NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
477387 | 2kzw | 17021 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1-169.287 66.250 -18.790 2 H2 MET 1 H2 MET 1-169.786 67.857 -18.994 3 H3 MET 1 H3 MET 1-170.899 66.593 -19.187 4 HA MET 1 HA MET 1-169.518 67.250 -16.654 5 HB2 MET 1 HB2 MET 1-172.314 67.889 -17.621 6 HB3 MET 1 HB3 MET 1-171.882 67.894 -15.922 7 HG2 MET 1 HG2 MET 1-171.856 70.131 -16.649 8 HG3 MET 1 HG3 MET 1-170.173 69.646 -16.464 9 HE1 MET 1 HE1 MET 1-170.263 72.225 -19.477 10 HE2 MET 1 HE2 MET 1-169.703 71.946 -17.826 11 HE3 MET 1 HE3 MET 1-171.419 72.211 -18.143 12 H ASN 2 H ASN 2-169.159 65.256 -15.807 13 HA ASN 2 HA ASN 2-171.523 63.594 -15.383 14 HB2 ASN 2 HB2 ASN 2-170.300 61.514 -15.860 15 HB3 ASN 2 HB3 ASN 2-170.405 62.536 -17.281 16 HD21 ASN 2 HD21 ASN 2-168.722 61.639 -18.341 17 HD22 ASN 2 HD22 ASN 2-167.072 61.772 -17.835 18 H ALA 3 H ALA 3-170.919 61.774 -13.751 19 HA ALA 3 HA ALA 3-169.283 62.995 -11.623 20 HB1 ALA 3 HB1 ALA 3-171.673 63.156 -11.135 21 HB2 ALA 3 HB2 ALA 3-170.850 62.089 -9.997 22 HB3 ALA 3 HB3 ALA 3-171.824 61.406 -11.300 23 H ARG 4 H ARG 4-167.737 61.768 -10.767 24 HA ARG 4 HA ARG 4-168.084 58.876 -10.734 25 HB2 ARG 4 HB2 ARG 4-165.741 58.442 -11.290 26 HB3 ARG 4 HB3 ARG 4-166.576 59.215 -12.621 27 HG2 ARG 4 HG2 ARG 4-165.004 60.926 -10.763 28 HG3 ARG 4 HG3 ARG 4-164.132 59.897 -11.894 29 HD2 ARG 4 HD2 ARG 4-165.454 60.926 -13.742 30 HD3 ARG 4 HD3 ARG 4-166.150 62.040 -12.564 31 HE ARG 4 HE ARG 4-163.413 62.255 -12.277 32 HH11 ARG 4 HH11 ARG 4-165.744 62.779 -14.836 33 HH12 ARG 4 HH12 ARG 4-164.780 63.971 -15.652 34 HH21 ARG 4 HH21 ARG 4-162.137 63.827 -13.345 35 HH22 ARG 4 HH22 ARG 4-162.729 64.566 -14.802 36 H ASP 5 H ASP 5-167.622 58.004 -8.798 37 HA ASP 5 HA ASP 5-166.214 59.726 -6.891 38 HB2 ASP 5 HB2 ASP 5-167.525 58.752 -5.071 39 HB3 ASP 5 HB3 ASP 5-168.561 59.517 -6.259 40 H ASN 6 H ASN 6-164.281 59.083 -6.557 41 HA ASN 6 HA ASN 6-163.731 56.313 -5.937 42 HB2 ASN 6 HB2 ASN 6-161.676 56.373 -7.492 43 HB3 ASN 6 HB3 ASN 6-163.245 56.091 -8.227 44 HD21 ASN 6 HD21 ASN 6-160.611 58.354 -7.853 45 HD22 ASN 6 HD22 ASN 6-161.082 59.407 -9.139 46 H LYS 7 H LYS 7-162.115 56.019 -4.539 47 HA LYS 7 HA LYS 7-160.438 58.330 -3.820 48 HB2 LYS 7 HB2 LYS 7-161.676 56.388 -1.855 49 HB3 LYS 7 HB3 LYS 7-160.576 57.695 -1.452 50 HG2 LYS 7 HG2 LYS 7-162.338 59.261 -2.419 51 HG3 LYS 7 HG3 LYS 7-163.425 57.872 -2.382 52 HD2 LYS 7 HD2 LYS 7-163.894 58.488 -0.287 53 HD3 LYS 7 HD3 LYS 7-162.305 57.849 0.133 54 HE2 LYS 7 HE2 LYS 7-162.980 60.713 -0.557 55 HE3 LYS 7 HE3 LYS 7-162.557 60.091 1.035 56 HZ1 LYS 7 HZ1 LYS 7-160.772 60.200 -1.340 57 HZ2 LYS 7 HZ2 LYS 7-160.352 59.531 0.157 58 HZ3 LYS 7 HZ3 LYS 7-160.672 61.190 0.031 59 H PHE 8 H PHE 8-158.328 57.871 -3.710 60 HA PHE 8 HA PHE 8-157.554 55.036 -3.696 61 HB2 PHE 8 HB2 PHE 8-156.542 57.241 -5.491 62 HB3 PHE 8 HB3 PHE 8-155.645 55.747 -5.240 63 HD1 PHE 8 HD2 PHE 8-156.607 53.596 -5.987 64 HD2 PHE 8 HD1 PHE 8-158.449 57.313 -6.917 65 HE1 PHE 8 HE2 PHE 8-157.930 52.498 -7.745 66 HE2 PHE 8 HE1 PHE 8-159.778 56.223 -8.675 67 HZ PHE 8 HZ PHE 8-159.517 53.813 -9.088 68 H ASN 9 H ASN 9-156.088 54.461 -2.324 69 HA ASN 9 HA ASN 9-153.890 56.064 -1.513 70 HB2 ASN 9 HB2 ASN 9-154.322 56.301 0.842 71 HB3 ASN 9 HB3 ASN 9-155.707 56.982 -0.014 72 HD21 ASN 9 HD21 ASN 9-157.616 55.570 -0.216 73 HD22 ASN 9 HD22 ASN 9-157.985 54.500 1.088 74 H THR 10 H THR 10-152.232 54.755 -1.005 75 HA THR 10 HA THR 10-152.828 51.899 -0.547 76 HB THR 10 HB THR 10-150.434 52.923 -2.088 77 HG1 THR 10 HG1 THR 10-153.020 52.830 -2.856 78 HG21 THR 10 HG21 THR 10-151.758 50.205 -1.966 79 HG22 THR 10 HG22 THR 10-150.252 50.650 -1.164 80 HG23 THR 10 HG23 THR 10-150.332 50.620 -2.925 81 H TRP 11 H TRP 11-151.937 51.086 1.250 82 HA TRP 11 HA TRP 11-149.907 52.732 2.602 83 HB2 TRP 11 HB2 TRP 11-152.100 52.522 3.775 84 HB3 TRP 11 HB3 TRP 11-151.839 50.784 3.884 85 HD1 TRP 11 HD1 TRP 11-150.658 49.983 6.043 86 HE1 TRP 11 HE1 TRP 11-149.281 51.109 7.911 87 HE3 TRP 11 HE3 TRP 11-150.328 54.677 4.068 88 HZ2 TRP 11 HZ2 TRP 11-148.201 53.665 8.459 89 HZ3 TRP 11 HZ3 TRP 11-149.109 56.397 5.314 90 HH2 TRP 11 HH2 TRP 11-148.068 55.907 7.465 91 H ASN 12 H ASN 12-147.975 51.923 2.257 92 HA ASN 12 HA ASN 12-147.517 49.101 2.968 93 HB2 ASN 12 HB2 ASN 12-147.044 49.439 0.570 94 HB3 ASN 12 HB3 ASN 12-145.945 50.751 0.965 95 HD21 ASN 12 HD21 ASN 12-144.142 49.904 0.145 96 HD22 ASN 12 HD22 ASN 12-143.371 48.464 0.725 97 H ASP 13 H ASP 13-146.269 48.842 4.685 98 HA ASP 13 HA ASP 13-144.344 50.873 5.475 99 HB2 ASP 13 HB2 ASP 13-146.448 51.652 6.473 100 HB3 ASP 13 HB3 ASP 13-146.696 50.078 7.218 101 H SER 14 H SER 14-142.564 49.862 6.101 102 HA SER 14 HA SER 14-142.795 47.217 7.382 103 HB2 SER 14 HB2 SER 14-140.573 48.187 5.554 104 HB3 SER 14 HB3 SER 14-140.650 46.612 6.344 105 HG SER 14 HG SER 14-142.810 47.394 4.754 106 H ARG 15 H ARG 15-141.863 47.028 9.328 107 HA ARG 15 HA ARG 15-139.850 48.992 10.141 108 HB2 ARG 15 HB2 ARG 15-141.000 49.302 12.324 109 HB3 ARG 15 HB3 ARG 15-141.880 49.967 10.960 110 HG2 ARG 15 HG2 ARG 15-143.321 47.936 10.984 111 HG3 ARG 15 HG3 ARG 15-142.490 47.426 12.456 112 HD2 ARG 15 HD2 ARG 15-144.519 48.530 13.086 113 HD3 ARG 15 HD3 ARG 15-143.164 49.578 13.501 114 HE ARG 15 HE ARG 15-144.421 50.071 10.916 115 HH11 ARG 15 HH11 ARG 15-144.203 51.024 14.308 116 HH12 ARG 15 HH12 ARG 15-144.943 52.569 14.036 117 HH21 ARG 15 HH21 ARG 15-145.360 52.086 10.579 118 HH22 ARG 15 HH22 ARG 15-145.596 53.175 11.914 119 H GLY 16 H GLY 16-138.306 48.257 11.450 120 HA2 GLY 16 HA2 GLY 16-138.434 46.012 13.131 121 HA3 GLY 16 HA3 GLY 16-137.786 45.508 11.575 122 H ASN 17 H ASN 17-136.633 45.875 14.367 123 HA ASN 17 HA ASN 17-134.208 47.278 13.480 124 HB2 ASN 17 HB2 ASN 17-135.530 47.521 16.201 125 HB3 ASN 17 HB3 ASN 17-133.866 47.991 15.896 126 HD21 ASN 17 HD21 ASN 17-133.429 49.834 14.787 127 HD22 ASN 17 HD22 ASN 17-134.632 51.017 14.403 128 H TYR 18 H TYR 18-132.858 45.649 13.164 129 HA TYR 18 HA TYR 18-132.793 43.490 15.170 130 HB2 TYR 18 HB2 TYR 18-132.339 43.213 12.188 131 HB3 TYR 18 HB3 TYR 18-132.282 41.909 13.371 132 HD1 TYR 18 HD2 TYR 18-134.476 41.637 14.815 133 HD2 TYR 18 HD1 TYR 18-134.314 43.580 11.033 134 HE1 TYR 18 HE2 TYR 18-136.892 41.297 14.546 135 HE2 TYR 18 HE1 TYR 18-136.737 43.247 10.756 136 HH TYR 18 HH TYR 18-138.757 42.391 13.311 137 H TRP 19 H TRP 19-130.850 42.718 15.836 138 HA TRP 19 HA TRP 19-128.393 43.573 14.606 139 HB2 TRP 19 HB2 TRP 19-127.471 44.682 16.601 140 HB3 TRP 19 HB3 TRP 19-128.875 45.536 15.980 141 HD1 TRP 19 HD1 TRP 19-131.226 45.118 17.434 142 HE1 TRP 19 HE1 TRP 19-131.498 44.882 19.980 143 HE3 TRP 19 HE3 TRP 19-126.414 43.900 18.653 144 HZ2 TRP 19 HZ2 TRP 19-129.885 44.274 22.211 145 HZ3 TRP 19 HZ3 TRP 19-125.860 43.513 21.016 146 HH2 TRP 19 HH2 TRP 19-127.561 43.697 22.758 147 H SER 20 H SER 20-126.561 42.489 15.422 148 HA SER 20 HA SER 20-127.156 40.227 17.204 149 HB2 SER 20 HB2 SER 20-125.418 38.969 15.860 150 HB3 SER 20 HB3 SER 20-126.912 39.321 14.994 151 HG SER 20 HG SER 20-124.667 41.030 14.846 152 H ASP 21 H ASP 21-125.252 39.447 18.418 153 HA ASP 21 HA ASP 21-123.205 41.541 18.718 154 HB2 ASP 21 HB2 ASP 21-124.810 41.623 20.581 155 HB3 ASP 21 HB3 ASP 21-124.453 39.944 20.956 156 H TYR 22 H TYR 22-121.211 40.911 18.627 157 HA TYR 22 HA TYR 22-120.520 38.162 18.190 158 HB2 TYR 22 HB2 TYR 22-119.291 39.832 16.939 159 HB3 TYR 22 HB3 TYR 22-118.811 40.655 18.417 160 HD1 TYR 22 HD2 TYR 22-118.410 37.412 16.608 161 HD2 TYR 22 HD1 TYR 22-116.760 40.125 19.444 162 HE1 TYR 22 HE2 TYR 22-116.362 36.058 16.711 163 HE2 TYR 22 HE1 TYR 22-114.712 38.774 19.550 164 HH TYR 22 HH TYR 22-113.953 36.409 17.299 165 H GLU 23 H GLU 23-120.309 36.769 19.740 166 HA GLU 23 HA GLU 23-119.150 37.643 22.303 167 HB2 GLU 23 HB2 GLU 23-120.991 35.279 21.844 168 HB3 GLU 23 HB3 GLU 23-120.354 35.822 23.390 169 HG2 GLU 23 HG2 GLU 23-121.579 37.952 23.093 170 HG3 GLU 23 HG3 GLU 23-122.289 37.290 21.622 171 H GLY 24 H GLY 24-117.044 37.187 22.066 172 HA2 GLY 24 HA2 GLY 24-116.303 34.399 21.581 173 HA3 GLY 24 HA3 GLY 24-115.594 35.620 20.533 174 H SER 25 H SER 25-115.595 34.203 23.690 175 HA SER 25 HA SER 25-113.059 35.568 24.250 176 HB2 SER 25 HB2 SER 25-115.273 35.210 26.298 177 HB3 SER 25 HB3 SER 25-113.678 35.891 26.609 178 HG SER 25 HG SER 25-114.770 37.196 24.555 179 H ASP 26 H ASP 26-111.692 33.902 24.090 180 HA ASP 26 HA ASP 26-112.102 31.630 25.882 181 HB2 ASP 26 HB2 ASP 26-112.953 30.942 23.645 182 HB3 ASP 26 HB3 ASP 26-111.373 31.298 22.959 183 H GLU 27 H GLU 27-110.232 30.795 26.724 184 HA GLU 27 HA GLU 27-107.700 32.051 25.885 185 HB2 GLU 27 HB2 GLU 27-108.559 31.385 28.706 186 HB3 GLU 27 HB3 GLU 27-106.998 32.046 28.241 187 HG2 GLU 27 HG2 GLU 27-107.977 34.118 27.595 188 HG3 GLU 27 HG3 GLU 27-109.606 33.451 27.734 189 H ASN 28 H ASN 28-106.059 30.723 25.524 190 HA ASN 28 HA ASN 28-105.910 28.150 26.884 191 HB2 ASN 28 HB2 ASN 28-107.042 27.699 24.694 192 HB3 ASN 28 HB3 ASN 28-105.608 28.314 23.871 193 HD21 ASN 28 HD21 ASN 28-106.853 25.828 25.971 194 HD22 ASN 28 HD22 ASN 28-105.588 24.683 25.701 195 H GLY 29 H GLY 29-104.052 28.292 27.899 196 HA2 GLY 29 HA2 GLY 29-101.792 29.662 26.582 197 HA3 GLY 29 HA3 GLY 29-102.001 29.523 28.323 198 H ASP 30 H ASP 30 -99.622 28.825 27.391 199 HA ASP 30 HA ASP 30 -99.571 25.956 27.844 200 HB2 ASP 30 HB2 ASP 30 -98.176 25.450 25.950 201 HB3 ASP 30 HB3 ASP 30 -99.601 26.282 25.347 202 H GLY 31 H GLY 31 -97.383 25.204 28.382 203 HA2 GLY 31 HA2 GLY 31 -95.102 26.706 28.580 204 HA3 GLY 31 HA3 GLY 31 -95.993 27.075 30.050 205 H ILE 32 H ILE 32 -93.443 25.669 29.574 206 HA ILE 32 HA ILE 32 -93.889 23.562 31.455 207 HB ILE 32 HB ILE 32 -94.361 22.256 29.489 208 HG12 ILE 32 HG12 ILE 32 -91.516 21.619 30.283 209 HG13 ILE 32 HG13 ILE 32 -92.911 21.271 31.297 210 HG21 ILE 32 HG21 ILE 32 -93.365 23.634 27.765 211 HG22 ILE 32 HG22 ILE 32 -92.777 21.976 27.629 212 HG23 ILE 32 HG23 ILE 32 -91.747 23.224 28.333 213 HD11 ILE 32 HD11 ILE 32 -92.176 19.297 30.080 214 HD12 ILE 32 HD12 ILE 32 -92.407 20.144 28.550 215 HD13 ILE 32 HD13 ILE 32 -93.795 19.785 29.577 216 H GLY 33 H GLY 33 -92.308 23.664 32.874 217 HA2 GLY 33 HA2 GLY 33 -89.714 24.815 32.075 218 HA3 GLY 33 HA3 GLY 33 -90.359 24.794 33.714 219 H ASP 34 H ASP 34 -88.209 23.364 31.649 220 HA ASP 34 HA ASP 34 -88.157 20.881 33.238 221 HB2 ASP 34 HB2 ASP 34 -88.749 20.493 30.864 222 HB3 ASP 34 HB3 ASP 34 -87.250 21.272 30.373 223 H SER 35 H SER 35 -86.365 20.501 34.363 224 HA SER 35 HA SER 35 -83.925 22.020 33.714 225 HB2 SER 35 HB2 SER 35 -84.855 21.019 36.425 226 HB3 SER 35 HB3 SER 35 -83.338 21.862 36.112 227 HG SER 35 HG SER 35 -84.667 23.643 35.324 228 H ALA 36 H ALA 36 -82.056 20.870 33.475 229 HA ALA 36 HA ALA 36 -82.100 18.012 34.135 230 HB1 ALA 36 HB1 ALA 36 -81.114 19.147 31.516 231 HB2 ALA 36 HB2 ALA 36 -82.585 18.202 31.750 232 HB3 ALA 36 HB3 ALA 36 -81.009 17.459 32.021 233 H TYR 37 H TYR 37 -80.431 17.457 35.322 234 HA TYR 37 HA TYR 37 -77.896 18.912 35.006 235 HB2 TYR 37 HB2 TYR 37 -79.038 19.698 37.052 236 HB3 TYR 37 HB3 TYR 37 -79.164 18.041 37.623 237 HD1 TYR 37 HD1 TYR 37 -76.783 20.763 36.866 238 HD2 TYR 37 HD2 TYR 37 -77.353 17.000 38.769 239 HE1 TYR 37 HE1 TYR 37 -74.605 21.000 37.984 240 HE2 TYR 37 HE2 TYR 37 -75.177 17.226 39.887 241 HH TYR 37 HH TYR 37 -73.006 18.464 39.458 242 H ALA 38 H ALA 38 -76.392 17.524 34.345 243 HA ALA 38 HA ALA 38 -76.612 14.711 35.128 244 HB1 ALA 38 HB1 ALA 38 -74.896 14.275 33.461 245 HB2 ALA 38 HB2 ALA 38 -74.757 16.004 33.138 246 HB3 ALA 38 HB3 ALA 38 -76.251 15.148 32.749 247 H VAL 39 H VAL 39 -75.037 13.699 36.304 248 HA VAL 39 HA VAL 39 -73.434 15.487 37.940 249 HB VAL 39 HB VAL 39 -73.712 12.490 38.259 250 HG11 VAL 39 HG11 VAL 39 -73.098 12.937 40.588 251 HG12 VAL 39 HG12 VAL 39 -72.938 14.654 40.215 252 HG13 VAL 39 HG13 VAL 39 -71.848 13.484 39.471 253 HG21 VAL 39 HG21 VAL 39 -75.404 14.650 39.526 254 HG22 VAL 39 HG22 VAL 39 -75.483 12.925 39.890 255 HG23 VAL 39 HG23 VAL 39 -75.937 13.511 38.288 256 H ASN 40 H ASN 40 -71.800 16.097 36.576 257 HA ASN 40 HA ASN 40 -69.919 13.991 35.760 258 HB2 ASN 40 HB2 ASN 40 -70.282 16.848 34.847 259 HB3 ASN 40 HB3 ASN 40 -68.810 15.947 34.500 260 HD21 ASN 40 HD21 ASN 40 -70.959 17.041 32.773 261 HD22 ASN 40 HD22 ASN 40 -71.492 15.706 31.808 262 HA PRO 41 HA PRO 41 -67.857 15.161 39.560 263 HB2 PRO 41 HB2 PRO 41 -65.803 13.243 38.670 264 HB3 PRO 41 HB3 PRO 41 -66.807 13.220 40.123 265 HG2 PRO 41 HG2 PRO 41 -67.220 11.492 38.118 266 HG3 PRO 41 HG3 PRO 41 -68.570 12.173 39.046 267 HD2 PRO 41 HD2 PRO 41 -67.537 12.968 36.345 268 HD3 PRO 41 HD3 PRO 41 -69.216 12.751 36.886 269 H GLU 42 H GLU 42 -65.319 14.288 37.205 270 HA GLU 42 HA GLU 42 -64.302 17.034 37.267 271 HB2 GLU 42 HB2 GLU 42 -62.721 14.558 37.993 272 HB3 GLU 42 HB3 GLU 42 -61.976 16.098 37.603 273 HG2 GLU 42 HG2 GLU 42 -62.982 17.137 39.531 274 HG3 GLU 42 HG3 GLU 42 -63.912 15.682 39.876 275 H ALA 43 H ALA 43 -62.112 16.888 35.804 276 HA ALA 43 HA ALA 43 -62.955 15.773 33.239 277 HB1 ALA 43 HB1 ALA 43 -61.119 17.095 32.294 278 HB2 ALA 43 HB2 ALA 43 -60.623 17.577 33.916 279 HB3 ALA 43 HB3 ALA 43 -62.182 18.100 33.278 280 H GLY 44 H GLY 44 -61.520 14.443 31.986 281 HA2 GLY 44 HA2 GLY 44 -60.078 12.549 33.659 282 HA3 GLY 44 HA3 GLY 44 -60.503 12.340 31.967 283 H SER 45 H SER 45 -58.384 14.205 34.104 284 HA SER 45 HA SER 45 -56.418 14.510 31.977 285 HB2 SER 45 HB2 SER 45 -56.923 16.401 33.531 286 HB3 SER 45 HB3 SER 45 -56.299 15.429 34.862 287 HG SER 45 HG SER 45 -54.341 15.919 34.286 288 H MET 46 H MET 46 -56.103 12.214 31.778 289 HA MET 46 HA MET 46 -54.351 11.063 33.841 290 HB2 MET 46 HB2 MET 46 -56.618 9.656 32.396 291 HB3 MET 46 HB3 MET 46 -55.437 8.851 33.421 292 HG2 MET 46 HG2 MET 46 -56.243 10.009 35.358 293 HG3 MET 46 HG3 MET 46 -57.293 11.020 34.371 294 HE1 MET 46 HE1 MET 46 -59.346 10.514 35.879 295 HE2 MET 46 HE2 MET 46 -58.327 9.535 36.933 296 HE3 MET 46 HE3 MET 46 -59.864 8.895 36.349 297 H ASP 47 H ASP 47 -52.458 10.877 32.927 298 HA ASP 47 HA ASP 47 -52.196 9.870 30.201 299 HB2 ASP 47 HB2 ASP 47 -52.369 12.287 29.935 300 HB3 ASP 47 HB3 ASP 47 -51.120 12.541 31.144 301 H TYR 48 H TYR 48 -50.664 8.401 30.152 302 HA TYR 48 HA TYR 48 -48.338 8.625 31.913 303 HB2 TYR 48 HB2 TYR 48 -49.698 7.165 33.188 304 HB3 TYR 48 HB3 TYR 48 -50.266 6.302 31.769 305 HD1 TYR 48 HD2 TYR 48 -46.971 7.015 33.434 306 HD2 TYR 48 HD1 TYR 48 -49.499 4.173 31.533 307 HE1 TYR 48 HE2 TYR 48 -45.261 5.283 33.760 308 HE2 TYR 48 HE1 TYR 48 -47.799 2.436 31.855 309 HH TYR 48 HH TYR 48 -45.061 2.892 33.864 310 H MET 49 H MET 49 -46.576 8.500 30.763 311 HA MET 49 HA MET 49 -46.332 6.499 28.664 312 HB2 MET 49 HB2 MET 49 -47.039 8.595 27.519 313 HB3 MET 49 HB3 MET 49 -45.630 9.407 28.191 314 HG2 MET 49 HG2 MET 49 -44.153 7.954 26.947 315 HG3 MET 49 HG3 MET 49 -45.529 7.034 26.340 316 HE1 MET 49 HE1 MET 49 -47.314 9.685 24.066 317 HE2 MET 49 HE2 MET 49 -47.623 9.416 25.782 318 HE3 MET 49 HE3 MET 49 -47.364 8.041 24.707 319 HA PRO 50 HA PRO 50 -42.482 6.468 31.027 320 HB2 PRO 50 HB2 PRO 50 -41.801 3.920 30.518 321 HB3 PRO 50 HB3 PRO 50 -43.073 4.337 31.671 322 HG2 PRO 50 HG2 PRO 50 -43.302 3.330 28.873 323 HG3 PRO 50 HG3 PRO 50 -44.298 2.957 30.289 324 HD2 PRO 50 HD2 PRO 50 -44.966 4.763 28.289 325 HD3 PRO 50 HD3 PRO 50 -45.675 4.725 29.913 326 H LEU 51 H LEU 51 -40.178 5.823 30.487 327 HA LEU 51 HA LEU 51 -39.557 6.308 27.644 328 HB2 LEU 51 HB2 LEU 51 -39.391 8.418 28.826 329 HB3 LEU 51 HB3 LEU 51 -38.397 7.688 30.068 330 HG LEU 51 HG LEU 51 -36.676 7.268 28.227 331 HD11 LEU 51 HD11 LEU 51 -38.389 9.292 26.799 332 HD12 LEU 51 HD12 LEU 51 -38.124 7.618 26.310 333 HD13 LEU 51 HD13 LEU 51 -36.780 8.761 26.303 334 HD21 LEU 51 HD21 LEU 51 -36.394 8.943 29.954 335 HD22 LEU 51 HD22 LEU 51 -37.359 10.090 29.026 336 HD23 LEU 51 HD23 LEU 51 -35.800 9.545 28.406 337 H MET 52 H MET 52 -38.254 4.772 26.869 338 HA MET 52 HA MET 52 -36.047 3.823 28.568 339 HB2 MET 52 HB2 MET 52 -37.887 2.188 26.869 340 HB3 MET 52 HB3 MET 52 -36.209 1.696 27.021 341 HG2 MET 52 HG2 MET 52 -36.457 1.560 29.433 342 HG3 MET 52 HG3 MET 52 -38.136 2.079 29.295 343 HE1 MET 52 HE1 MET 52 -37.421 -0.509 30.887 344 HE2 MET 52 HE2 MET 52 -38.604 -1.659 30.261 345 HE3 MET 52 HE3 MET 52 -39.083 0.006 30.591 346 H GLU 53 H GLU 53 -34.285 4.716 27.764 347 HA GLU 53 HA GLU 53 -33.964 4.788 24.845 348 HB2 GLU 53 HB2 GLU 53 -32.242 6.527 25.212 349 HB3 GLU 53 HB3 GLU 53 -33.822 7.017 25.804 350 HG2 GLU 53 HG2 GLU 53 -33.163 6.636 28.075 351 HG3 GLU 53 HG3 GLU 53 -31.647 5.900 27.561 352 H TYR 54 H TYR 54 -32.062 4.016 23.925 353 HA TYR 54 HA TYR 54 -30.436 2.335 25.716 354 HB2 TYR 54 HB2 TYR 54 -31.001 1.966 22.761 355 HB3 TYR 54 HB3 TYR 54 -29.924 0.955 23.717 356 HD1 TYR 54 HD1 TYR 54 -31.177 0.134 26.016 357 HD2 TYR 54 HD2 TYR 54 -33.042 1.025 22.304 358 HE1 TYR 54 HE1 TYR 54 -33.079 -1.287 26.643 359 HE2 TYR 54 HE2 TYR 54 -34.955 -0.393 22.917 360 HH TYR 54 HH TYR 54 -35.400 -2.341 24.471 361 H LEU 55 H LEU 55 -28.184 1.921 24.620 362 HA LEU 55 HA LEU 55 -27.059 4.583 24.230 363 HB2 LEU 55 HB2 LEU 55 -25.793 1.918 24.873 364 HB3 LEU 55 HB3 LEU 55 -24.842 3.319 24.437 365 HG LEU 55 HG LEU 55 -24.737 3.220 26.769 366 HD11 LEU 55 HD11 LEU 55 -25.916 5.193 27.586 367 HD12 LEU 55 HD12 LEU 55 -26.904 5.198 26.125 368 HD13 LEU 55 HD13 LEU 55 -25.164 5.464 26.014 369 HD21 LEU 55 HD21 LEU 55 -26.477 1.596 27.188 370 HD22 LEU 55 HD22 LEU 55 -27.717 2.806 26.856 371 HD23 LEU 55 HD23 LEU 55 -26.661 2.987 28.257 372 H HIS 56 H HIS 56 -25.176 4.733 22.667 373 HA HIS 56 HA HIS 56 -26.094 3.789 20.085 374 HB2 HIS 56 HB2 HIS 56 -23.768 5.577 20.850 375 HB3 HIS 56 HB3 HIS 56 -24.136 5.112 19.195 376 HD1 HIS 56 HD1 HIS 56 -24.275 8.017 20.762 377 HD2 HIS 56 HD2 HIS 56 -27.383 5.699 19.262 378 HE1 HIS 56 HE1 HIS 56 -26.185 9.609 20.396 379 HE2 HIS 56 HE2 HIS 56 -28.107 8.154 19.658 380 H SER 57 H SER 57 -25.600 1.836 19.435 381 HA SER 57 HA SER 57 -23.425 0.302 20.449 382 HB2 SER 57 HB2 SER 57 -25.037 -0.282 17.958 383 HB3 SER 57 HB3 SER 57 -24.217 -1.437 19.010 384 HG SER 57 HG SER 57 -26.631 -1.058 19.198 385 H SER 58 H SER 58 -21.398 0.711 19.926 386 HA SER 58 HA SER 58 -20.740 2.255 17.594 387 HB2 SER 58 HB2 SER 58 -18.391 2.014 18.576 388 HB3 SER 58 HB3 SER 58 -19.582 2.864 19.560 389 HG SER 58 HG SER 58 -18.846 0.123 19.832 390 HA PRO 59 HA PRO 59 -19.824 -1.477 15.278 391 HB2 PRO 59 HB2 PRO 59 -19.658 -0.357 12.848 392 HB3 PRO 59 HB3 PRO 59 -21.207 -0.613 13.658 393 HG2 PRO 59 HG2 PRO 59 -19.618 1.894 13.361 394 HG3 PRO 59 HG3 PRO 59 -21.374 1.664 13.304 395 HD2 PRO 59 HD2 PRO 59 -19.960 2.584 15.503 396 HD3 PRO 59 HD3 PRO 59 -21.579 1.861 15.560 397 H VAL 60 H VAL 60 -18.076 -2.347 14.176 398 HA VAL 60 HA VAL 60 -15.592 -0.833 14.478 399 HB VAL 60 HB VAL 60 -15.650 -2.924 15.726 400 HG11 VAL 60 HG11 VAL 60 -15.733 -5.108 14.696 401 HG12 VAL 60 HG12 VAL 60 -15.947 -4.377 13.106 402 HG13 VAL 60 HG13 VAL 60 -17.207 -4.204 14.329 403 HG21 VAL 60 HG21 VAL 60 -13.763 -3.041 13.393 404 HG22 VAL 60 HG22 VAL 60 -13.584 -3.936 14.903 405 HG23 VAL 60 HG23 VAL 60 -13.519 -2.173 14.907 406 H LEU 61 H LEU 61 -14.526 -0.151 12.779 407 HA LEU 61 HA LEU 61 -15.245 -1.225 10.150 408 HB2 LEU 61 HB2 LEU 61 -14.524 1.106 9.268 409 HB3 LEU 61 HB3 LEU 61 -16.126 0.884 9.907 410 HG LEU 61 HG LEU 61 -15.012 3.080 10.402 411 HD11 LEU 61 HD11 LEU 61 -15.897 1.488 12.788 412 HD12 LEU 61 HD12 LEU 61 -16.923 2.412 11.690 413 HD13 LEU 61 HD13 LEU 61 -15.757 3.245 12.719 414 HD21 LEU 61 HD21 LEU 61 -12.770 2.359 10.859 415 HD22 LEU 61 HD22 LEU 61 -13.323 1.447 12.262 416 HD23 LEU 61 HD23 LEU 61 -13.432 3.208 12.259 417 HA PRO 62 HA PRO 62 -11.025 -2.247 9.544 418 HB2 PRO 62 HB2 PRO 62 -10.517 -1.697 6.967 419 HB3 PRO 62 HB3 PRO 62 -11.521 -3.077 7.478 420 HG2 PRO 62 HG2 PRO 62 -12.351 -0.391 6.453 421 HG3 PRO 62 HG3 PRO 62 -13.037 -1.985 6.086 422 HD2 PRO 62 HD2 PRO 62 -14.176 -0.268 7.850 423 HD3 PRO 62 HD3 PRO 62 -14.289 -2.031 8.020 424 H THR 63 H THR 63 -8.925 -1.568 8.604 425 HA THR 63 HA THR 63 -8.521 1.281 8.291 426 HB THR 63 HB THR 63 -6.808 -0.244 10.266 427 HG1 THR 63 HG1 THR 63 -9.313 0.737 10.669 428 HG21 THR 63 HG21 THR 63 -5.810 1.672 9.244 429 HG22 THR 63 HG22 THR 63 -6.214 2.067 10.921 430 HG23 THR 63 HG23 THR 63 -7.232 2.644 9.597 431 H ALA 64 H ALA 64 -7.329 1.429 6.466 432 HA ALA 64 HA ALA 64 -5.636 -0.813 5.672 433 HB1 ALA 64 HB1 ALA 64 -5.438 0.307 3.546 434 HB2 ALA 64 HB2 ALA 64 -6.206 1.755 4.200 435 HB3 ALA 64 HB3 ALA 64 -7.138 0.267 4.021 436 H ARG 65 H ARG 65 -3.776 -0.820 6.714 437 HA ARG 65 HA ARG 65 -2.177 1.641 6.773 438 HB2 ARG 65 HB2 ARG 65 -2.636 -0.344 9.004 439 HB3 ARG 65 HB3 ARG 65 -1.199 0.667 8.959 440 HG2 ARG 65 HG2 ARG 65 -2.654 2.659 8.966 441 HG3 ARG 65 HG3 ARG 65 -4.052 1.591 9.112 442 HD2 ARG 65 HD2 ARG 65 -3.327 2.515 11.277 443 HD3 ARG 65 HD3 ARG 65 -3.250 0.754 11.226 444 HE ARG 65 HE ARG 65 -0.849 0.935 11.022 445 HH11 ARG 65 HH11 ARG 65 -2.520 3.881 12.004 446 HH12 ARG 65 HH12 ARG 65 -1.077 4.629 12.617 447 HH21 ARG 65 HH21 ARG 65 1.019 1.932 11.807 448 HH22 ARG 65 HH22 ARG 65 0.926 3.508 12.535 449 H PHE 66 H PHE 66 0.012 1.318 6.335 450 HA PHE 66 HA PHE 66 1.143 -1.310 6.375 451 HB2 PHE 66 HB2 PHE 66 1.781 -1.466 4.033 452 HB3 PHE 66 HB3 PHE 66 0.036 -1.371 4.153 453 HD1 PHE 66 HD2 PHE 66 -0.921 1.114 3.896 454 HD2 PHE 66 HD1 PHE 66 2.828 -0.251 2.426 455 HE1 PHE 66 HE2 PHE 66 -0.932 2.912 2.225 456 HE2 PHE 66 HE1 PHE 66 2.822 1.543 0.750 457 HZ PHE 66 HZ PHE 66 0.937 3.120 0.650 458 H THR 67 H THR 67 3.436 -1.299 6.064 459 HA THR 67 HA THR 67 4.610 1.393 6.072 460 HB THR 67 HB THR 67 5.073 0.244 8.187 461 HG1 THR 67 HG1 THR 67 7.583 0.038 7.075 462 HG21 THR 67 HG21 THR 67 4.970 -2.090 7.493 463 HG22 THR 67 HG22 THR 67 6.512 -1.749 8.279 464 HG23 THR 67 HG23 THR 67 6.429 -1.884 6.523 465 H SER 68 H SER 68 6.036 1.889 4.556 466 HA SER 68 HA SER 68 6.632 -0.024 2.463 467 HB2 SER 68 HB2 SER 68 7.797 1.987 1.444 468 HB3 SER 68 HB3 SER 68 6.074 2.198 1.735 469 HG SER 68 HG SER 68 8.187 3.558 2.770 470 H ASP 69 H ASP 69 8.781 -0.663 1.934 471 HA ASP 69 HA ASP 69 10.410 -1.237 4.171 472 HB2 ASP 69 HB2 ASP 69 10.226 -2.569 2.009 473 HB3 ASP 69 HB3 ASP 69 11.302 -1.369 1.296 474 H ILE 70 H ILE 70 11.187 0.778 1.313 475 HA ILE 70 HA ILE 70 12.639 2.548 3.134 476 HB ILE 70 HB ILE 70 13.589 3.627 1.058 477 HG12 ILE 70 HG12 ILE 70 13.640 1.688 -0.847 478 HG13 ILE 70 HG13 ILE 70 11.999 1.496 -0.246 479 HG21 ILE 70 HG21 ILE 70 14.277 0.745 1.572 480 HG22 ILE 70 HG22 ILE 70 14.924 2.158 2.408 481 HG23 ILE 70 HG23 ILE 70 15.290 1.895 0.703 482 HD11 ILE 70 HD11 ILE 70 12.063 2.978 -2.168 483 HD12 ILE 70 HD12 ILE 70 13.194 4.040 -1.328 484 HD13 ILE 70 HD13 ILE 70 11.549 3.848 -0.721 485 H THR 71 H THR 71 12.266 4.804 3.016 486 HA THR 71 HA THR 71 9.621 5.486 1.918 487 HB THR 71 HB THR 71 9.810 7.511 3.466 488 HG1 THR 71 HG1 THR 71 11.839 7.580 4.212 489 HG21 THR 71 HG21 THR 71 9.053 6.263 5.432 490 HG22 THR 71 HG22 THR 71 9.666 4.770 4.721 491 HG23 THR 71 HG23 THR 71 8.327 5.626 3.954 492 H GLU 72 H GLU 72 12.998 6.281 2.039 493 HA GLU 72 HA GLU 72 12.848 7.589 -0.493 494 HB2 GLU 72 HB2 GLU 72 12.400 9.436 1.171 495 HB3 GLU 72 HB3 GLU 72 14.020 9.167 1.798 496 HG2 GLU 72 HG2 GLU 72 14.941 9.653 -0.429 497 HG3 GLU 72 HG3 GLU 72 13.314 9.994 -1.010 498 H GLY 73 H GLY 73 14.865 7.693 -1.500 499 HA2 GLY 73 HA2 GLY 73 17.396 7.403 -0.858 500 HA3 GLY 73 HA3 GLY 73 16.813 5.791 -0.434 501 H PHE 74 H PHE 74 18.333 5.092 -2.178 502 HA PHE 74 HA PHE 74 17.603 5.673 -4.895 503 HB2 PHE 74 HB2 PHE 74 19.225 3.919 -5.501 504 HB3 PHE 74 HB3 PHE 74 19.923 5.020 -4.326 505 HD1 PHE 74 HD1 PHE 74 20.174 4.259 -1.936 506 HD2 PHE 74 HD2 PHE 74 19.026 1.589 -5.049 507 HE1 PHE 74 HE1 PHE 74 20.778 2.348 -0.517 508 HE2 PHE 74 HE2 PHE 74 19.624 -0.326 -3.628 509 HZ PHE 74 HZ PHE 74 20.501 0.053 -1.361 510 H ALA 75 H ALA 75 16.258 4.461 -6.247 511 HA ALA 75 HA ALA 75 14.363 2.667 -5.326 512 HB1 ALA 75 HB1 ALA 75 15.495 2.780 -8.116 513 HB2 ALA 75 HB2 ALA 75 14.229 3.835 -7.486 514 HB3 ALA 75 HB3 ALA 75 13.937 2.101 -7.643 515 HA PRO 76 HA PRO 76 17.007 -0.964 -4.904 516 HB2 PRO 76 HB2 PRO 76 15.083 -2.056 -3.090 517 HB3 PRO 76 HB3 PRO 76 16.625 -1.296 -2.699 518 HG2 PRO 76 HG2 PRO 76 14.171 -0.246 -2.038 519 HG3 PRO 76 HG3 PRO 76 15.650 0.715 -2.231 520 HD2 PRO 76 HD2 PRO 76 13.435 0.238 -4.206 521 HD3 PRO 76 HD3 PRO 76 14.261 1.760 -3.792 522 H LEU 77 H LEU 77 16.442 -3.422 -4.804 523 HA LEU 77 HA LEU 77 14.633 -3.913 -7.056 524 HB2 LEU 77 HB2 LEU 77 15.928 -6.026 -7.364 525 HB3 LEU 77 HB3 LEU 77 16.841 -4.556 -7.624 526 HG LEU 77 HG LEU 77 17.559 -4.998 -5.088 527 HD11 LEU 77 HD11 LEU 77 16.182 -6.981 -4.783 528 HD12 LEU 77 HD12 LEU 77 17.898 -7.381 -4.682 529 HD13 LEU 77 HD13 LEU 77 16.988 -7.763 -6.144 530 HD21 LEU 77 HD21 LEU 77 19.080 -4.746 -6.943 531 HD22 LEU 77 HD22 LEU 77 18.706 -6.374 -7.511 532 HD23 LEU 77 HD23 LEU 77 19.546 -6.145 -5.976 533 H SER 78 H SER 78 14.997 -4.507 -3.721 534 HA SER 78 HA SER 78 12.572 -6.148 -3.863 535 HB2 SER 78 HB2 SER 78 14.599 -7.542 -3.321 536 HB3 SER 78 HB3 SER 78 14.800 -6.586 -1.853 537 HG SER 78 HG SER 78 13.434 -8.723 -2.006 538 H VAL 79 H VAL 79 11.091 -4.744 -3.224 539 HA VAL 79 HA VAL 79 11.513 -3.351 -0.662 540 HB VAL 79 HB VAL 79 9.754 -2.365 -2.930 541 HG11 VAL 79 HG11 VAL 79 10.580 -1.019 -0.358 542 HG12 VAL 79 HG12 VAL 79 8.974 -1.643 -0.736 543 HG13 VAL 79 HG13 VAL 79 9.628 -0.279 -1.645 544 HG21 VAL 79 HG21 VAL 79 12.096 -2.206 -3.556 545 HG22 VAL 79 HG22 VAL 79 12.445 -1.345 -2.057 546 HG23 VAL 79 HG23 VAL 79 11.404 -0.608 -3.275 547 H ARG 80 H ARG 80 10.572 -4.868 0.603 548 HA ARG 80 HA ARG 80 8.006 -5.985 -0.124 549 HB2 ARG 80 HB2 ARG 80 8.263 -7.187 2.145 550 HB3 ARG 80 HB3 ARG 80 9.329 -7.644 0.831 551 HG2 ARG 80 HG2 ARG 80 10.291 -5.591 2.747 552 HG3 ARG 80 HG3 ARG 80 10.185 -7.262 3.297 553 HD2 ARG 80 HD2 ARG 80 12.003 -7.855 2.141 554 HD3 ARG 80 HD3 ARG 80 11.432 -7.048 0.679 555 HE ARG 80 HE ARG 80 12.271 -5.066 2.445 556 HH11 ARG 80 HH11 ARG 80 13.735 -7.763 0.757 557 HH12 ARG 80 HH12 ARG 80 15.256 -6.960 0.532 558 HH21 ARG 80 HH21 ARG 80 14.225 -4.006 2.159 559 HH22 ARG 80 HH22 ARG 80 15.529 -4.813 1.339 560 H PHE 81 H PHE 81 6.140 -5.271 0.478 561 HA PHE 81 HA PHE 81 6.009 -3.089 2.416 562 HB2 PHE 81 HB2 PHE 81 3.944 -4.103 0.440 563 HB3 PHE 81 HB3 PHE 81 3.727 -2.722 1.508 564 HD1 PHE 81 HD2 PHE 81 5.147 -0.690 1.184 565 HD2 PHE 81 HD1 PHE 81 5.090 -3.893 -1.623 566 HE1 PHE 81 HE2 PHE 81 6.123 0.790 -0.521 567 HE2 PHE 81 HE1 PHE 81 6.070 -2.416 -3.331 568 HZ PHE 81 HZ PHE 81 6.586 -0.074 -2.783 569 H LYS 82 H LYS 82 5.331 -3.464 4.393 570 HA LYS 82 HA LYS 82 4.025 -6.022 4.985 571 HB2 LYS 82 HB2 LYS 82 6.064 -5.495 6.276 572 HB3 LYS 82 HB3 LYS 82 5.337 -3.997 6.823 573 HG2 LYS 82 HG2 LYS 82 5.048 -5.346 8.656 574 HG3 LYS 82 HG3 LYS 82 3.509 -5.559 7.828 575 HD2 LYS 82 HD2 LYS 82 5.785 -7.442 7.331 576 HD3 LYS 82 HD3 LYS 82 4.761 -7.630 8.750 577 HE2 LYS 82 HE2 LYS 82 3.763 -7.575 5.900 578 HE3 LYS 82 HE3 LYS 82 4.053 -9.041 6.839 579 HZ1 LYS 82 HZ1 LYS 82 1.730 -8.465 6.909 580 HZ2 LYS 82 HZ2 LYS 82 2.078 -6.904 7.467 581 HZ3 LYS 82 HZ3 LYS 82 2.397 -8.246 8.452 582 H ASP 83 H ASP 83 1.857 -5.976 5.138 583 HA ASP 83 HA ASP 83 0.584 -3.389 5.518 584 HB2 ASP 83 HB2 ASP 83 -1.391 -4.293 4.634 585 HB3 ASP 83 HB3 ASP 83 -0.106 -5.012 3.671 586 H PHE 84 H PHE 84 -0.856 -2.934 7.050 587 HA PHE 84 HA PHE 84 -0.938 -4.686 9.419 588 HB2 PHE 84 HB2 PHE 84 -0.428 -1.702 9.309 589 HB3 PHE 84 HB3 PHE 84 -0.886 -2.546 10.780 590 HD1 PHE 84 HD2 PHE 84 0.632 -4.559 11.438 591 HD2 PHE 84 HD1 PHE 84 1.796 -1.414 8.820 592 HE1 PHE 84 HE2 PHE 84 2.995 -5.054 11.904 593 HE2 PHE 84 HE1 PHE 84 4.159 -1.906 9.281 594 HZ PHE 84 HZ PHE 84 4.761 -3.725 10.825 595 H SER 85 H SER 85 -2.754 -4.356 7.224 596 HA SER 85 HA SER 85 -5.006 -2.851 7.728 597 HB2 SER 85 HB2 SER 85 -5.088 -5.678 6.696 598 HB3 SER 85 HB3 SER 85 -6.165 -4.339 6.297 599 HG SER 85 HG SER 85 -3.696 -4.992 5.255 600 H GLU 86 H GLU 86 -6.313 -2.765 9.389 601 HA GLU 86 HA GLU 86 -6.582 -5.114 11.149 602 HB2 GLU 86 HB2 GLU 86 -5.530 -3.052 12.143 603 HB3 GLU 86 HB3 GLU 86 -7.007 -2.187 11.787 604 HG2 GLU 86 HG2 GLU 86 -6.889 -2.809 14.126 605 HG3 GLU 86 HG3 GLU 86 -8.237 -3.598 13.318 606 H ASN 87 H ASN 87 -8.644 -5.828 11.595 607 HA ASN 87 HA ASN 87 -10.912 -6.086 11.596 608 HB2 ASN 87 HB2 ASN 87 -10.982 -3.089 11.196 609 HB3 ASN 87 HB3 ASN 87 -12.313 -4.091 11.761 610 HD21 ASN 87 HD21 ASN 87 -10.651 -1.834 12.885 611 HD22 ASN 87 HD22 ASN 87 -10.222 -2.377 14.468 612 H ALA 88 H ALA 88 -9.555 -6.439 9.136 613 HA ALA 88 HA ALA 88 -11.411 -5.311 7.150 614 HB1 ALA 88 HB1 ALA 88 -9.618 -5.565 5.521 615 HB2 ALA 88 HB2 ALA 88 -8.577 -6.262 6.761 616 HB3 ALA 88 HB3 ALA 88 -9.088 -4.578 6.886 617 H THR 89 H THR 89 -12.353 -6.622 5.665 618 HA THR 89 HA THR 89 -12.431 -9.454 6.174 619 HB THR 89 HB THR 89 -13.665 -7.962 3.841 620 HG1 THR 89 HG1 THR 89 -15.188 -8.584 6.105 621 HG21 THR 89 HG21 THR 89 -13.663 -10.420 3.674 622 HG22 THR 89 HG22 THR 89 -15.293 -9.777 3.867 623 HG23 THR 89 HG23 THR 89 -14.473 -10.521 5.240 624 H SER 90 H SER 90 -11.382 -7.321 3.522 625 HA SER 90 HA SER 90 -9.305 -9.230 2.790 626 HB2 SER 90 HB2 SER 90 -11.317 -8.117 0.807 627 HB3 SER 90 HB3 SER 90 -9.863 -9.015 0.371 628 HG SER 90 HG SER 90 -11.116 -10.475 2.152 629 H ARG 91 H ARG 91 -7.461 -8.240 1.940 630 HA ARG 91 HA ARG 91 -7.639 -5.329 1.649 631 HB2 ARG 91 HB2 ARG 91 -5.381 -5.051 2.190 632 HB3 ARG 91 HB3 ARG 91 -5.965 -6.225 3.346 633 HG2 ARG 91 HG2 ARG 91 -4.376 -6.926 0.885 634 HG3 ARG 91 HG3 ARG 91 -3.665 -6.627 2.467 635 HD2 ARG 91 HD2 ARG 91 -5.029 -8.500 3.368 636 HD3 ARG 91 HD3 ARG 91 -5.602 -8.820 1.732 637 HE ARG 91 HE ARG 91 -2.916 -9.297 2.779 638 HH11 ARG 91 HH11 ARG 91 -5.127 -9.447 0.039 639 HH12 ARG 91 HH12 ARG 91 -4.137 -10.566 -0.846 640 HH21 ARG 91 HH21 ARG 91 -1.635 -10.749 1.596 641 HH22 ARG 91 HH22 ARG 91 -2.166 -11.306 0.038 642 H LEU 92 H LEU 92 -6.992 -4.336 -0.151 643 HA LEU 92 HA LEU 92 -6.870 -6.057 -2.531 644 HB2 LEU 92 HB2 LEU 92 -8.996 -4.793 -2.108 645 HB3 LEU 92 HB3 LEU 92 -8.083 -3.304 -2.185 646 HG LEU 92 HG LEU 92 -7.499 -3.920 -4.575 647 HD11 LEU 92 HD11 LEU 92 -8.020 -6.301 -4.466 648 HD12 LEU 92 HD12 LEU 92 -8.986 -5.494 -5.701 649 HD13 LEU 92 HD13 LEU 92 -9.714 -5.923 -4.153 650 HD21 LEU 92 HD21 LEU 92 -9.639 -3.151 -5.438 651 HD22 LEU 92 HD22 LEU 92 -9.176 -2.242 -3.998 652 HD23 LEU 92 HD23 LEU 92 -10.403 -3.506 -3.889 653 H TRP 93 H TRP 93 -4.909 -5.955 -3.422 654 HA TRP 93 HA TRP 93 -3.281 -3.569 -3.106 655 HB2 TRP 93 HB2 TRP 93 -2.672 -6.269 -4.335 656 HB3 TRP 93 HB3 TRP 93 -1.525 -4.938 -4.260 657 HD1 TRP 93 HD1 TRP 93 -2.702 -7.885 -2.331 658 HE1 TRP 93 HE1 TRP 93 -1.583 -7.933 -0.014 659 HE3 TRP 93 HE3 TRP 93 -0.784 -3.131 -2.237 660 HZ2 TRP 93 HZ2 TRP 93 -0.132 -6.185 1.653 661 HZ3 TRP 93 HZ3 TRP 93 0.452 -2.402 -0.233 662 HH2 TRP 93 HH2 TRP 93 0.769 -3.900 1.669 663 H MET 94 H MET 94 -3.520 -1.991 -4.503 664 HA MET 94 HA MET 94 -4.320 -2.637 -7.260 665 HB2 MET 94 HB2 MET 94 -4.851 -0.113 -5.680 666 HB3 MET 94 HB3 MET 94 -5.276 -0.351 -7.367 667 HG2 MET 94 HG2 MET 94 -6.759 -2.198 -6.707 668 HG3 MET 94 HG3 MET 94 -6.363 -1.883 -5.019 669 HE1 MET 94 HE1 MET 94 -7.054 0.597 -8.033 670 HE2 MET 94 HE2 MET 94 -8.755 0.968 -7.753 671 HE3 MET 94 HE3 MET 94 -8.273 -0.667 -8.205 672 H PHE 95 H PHE 95 -2.450 -2.727 -8.333 673 HA PHE 95 HA PHE 95 -0.582 -0.485 -8.083 674 HB2 PHE 95 HB2 PHE 95 -0.271 -3.197 -9.387 675 HB3 PHE 95 HB3 PHE 95 0.952 -1.933 -9.447 676 HD1 PHE 95 HD2 PHE 95 2.006 -1.159 -7.307 677 HD2 PHE 95 HD1 PHE 95 -0.477 -4.612 -7.506 678 HE1 PHE 95 HE2 PHE 95 2.910 -1.930 -5.152 679 HE2 PHE 95 HE1 PHE 95 0.422 -5.386 -5.351 680 HZ PHE 95 HZ PHE 95 2.117 -4.044 -4.172 681 H GLY 96 H GLY 96 -2.899 -1.931 -10.223 682 HA2 GLY 96 HA2 GLY 96 -4.023 -0.524 -11.807 683 HA3 GLY 96 HA3 GLY 96 -2.524 0.359 -12.033 684 H ASP 97 H ASP 97 -2.139 -3.013 -11.959 685 HA ASP 97 HA ASP 97 -2.121 -3.159 -14.904 686 HB2 ASP 97 HB2 ASP 97 0.055 -4.155 -13.044 687 HB3 ASP 97 HB3 ASP 97 -0.070 -4.622 -14.736 688 H GLY 98 H GLY 98 -3.634 -4.582 -15.430 689 HA2 GLY 98 HA2 GLY 98 -4.593 -6.660 -15.668 690 HA3 GLY 98 HA3 GLY 98 -3.357 -7.307 -14.601 691 H ASN 99 H ASN 99 -4.182 -8.279 -12.966 692 HA ASN 99 HA ASN 99 -6.862 -7.812 -12.003 693 HB2 ASN 99 HB2 ASN 99 -4.678 -9.751 -11.241 694 HB3 ASN 99 HB3 ASN 99 -6.196 -9.655 -10.354 695 HD21 ASN 99 HD21 ASN 99 -6.704 -11.777 -10.897 696 HD22 ASN 99 HD22 ASN 99 -7.241 -12.211 -12.486 697 H THR 100 H THR 100 -6.629 -8.358 -9.349 698 HA THR 100 HA THR 100 -5.155 -6.220 -8.040 699 HB THR 100 HB THR 100 -7.376 -5.471 -6.886 700 HG1 THR 100 HG1 THR 100 -8.276 -6.650 -9.302 701 HG21 THR 100 HG21 THR 100 -7.687 -3.672 -8.521 702 HG22 THR 100 HG22 THR 100 -6.695 -4.561 -9.678 703 HG23 THR 100 HG23 THR 100 -5.981 -3.962 -8.180 704 H SER 101 H SER 101 -5.348 -6.358 -5.719 705 HA SER 101 HA SER 101 -5.038 -7.381 -3.777 706 HB2 SER 101 HB2 SER 101 -6.668 -8.922 -2.844 707 HB3 SER 101 HB3 SER 101 -7.425 -7.541 -3.624 708 HG SER 101 HG SER 101 -8.551 -9.363 -4.192 709 H ASP 102 H ASP 102 -5.528 -9.964 -6.178 710 HA ASP 102 HA ASP 102 -3.616 -11.709 -4.966 711 HB2 ASP 102 HB2 ASP 102 -5.482 -12.507 -6.431 712 HB3 ASP 102 HB3 ASP 102 -4.720 -11.704 -7.795 713 H SER 103 H SER 103 -1.728 -10.684 -4.689 714 HA SER 103 HA SER 103 -0.358 -9.665 -7.069 715 HB2 SER 103 HB2 SER 103 -0.553 -8.099 -5.121 716 HB3 SER 103 HB3 SER 103 0.342 -9.261 -4.143 717 HG SER 103 HG SER 103 2.082 -8.369 -4.897 718 HA PRO 104 HA PRO 104 1.928 -13.480 -6.946 719 HB2 PRO 104 HB2 PRO 104 3.906 -12.817 -8.707 720 HB3 PRO 104 HB3 PRO 104 2.272 -13.283 -9.185 721 HG2 PRO 104 HG2 PRO 104 3.493 -10.571 -9.001 722 HG3 PRO 104 HG3 PRO 104 2.350 -11.213 -10.194 723 HD2 PRO 104 HD2 PRO 104 1.629 -9.578 -8.122 724 HD3 PRO 104 HD3 PRO 104 0.535 -10.753 -8.877 725 H SER 105 H SER 105 3.196 -10.464 -5.949 726 HA SER 105 HA SER 105 5.218 -11.747 -4.336 727 HB2 SER 105 HB2 SER 105 6.960 -10.082 -5.134 728 HB3 SER 105 HB3 SER 105 6.530 -11.343 -6.289 729 HG SER 105 HG SER 105 5.922 -9.838 -7.611 730 HA PRO 106 HA PRO 106 3.741 -8.426 -1.622 731 HB2 PRO 106 HB2 PRO 106 5.770 -9.396 0.252 732 HB3 PRO 106 HB3 PRO 106 4.014 -9.392 0.417 733 HG2 PRO 106 HG2 PRO 106 5.437 -11.670 0.090 734 HG3 PRO 106 HG3 PRO 106 3.785 -11.474 -0.520 735 HD2 PRO 106 HD2 PRO 106 6.381 -11.312 -1.996 736 HD3 PRO 106 HD3 PRO 106 4.846 -12.059 -2.491 737 H LEU 107 H LEU 107 7.070 -9.200 -2.331 738 HA LEU 107 HA LEU 107 7.930 -6.458 -1.872 739 HB2 LEU 107 HB2 LEU 107 10.200 -7.483 -2.538 740 HB3 LEU 107 HB3 LEU 107 9.523 -7.883 -0.974 741 HG LEU 107 HG LEU 107 8.583 -9.976 -2.351 742 HD11 LEU 107 HD11 LEU 107 9.513 -9.310 -4.489 743 HD12 LEU 107 HD12 LEU 107 10.272 -10.799 -3.917 744 HD13 LEU 107 HD13 LEU 107 11.132 -9.263 -3.789 745 HD21 LEU 107 HD21 LEU 107 10.506 -11.242 -1.525 746 HD22 LEU 107 HD22 LEU 107 9.918 -10.087 -0.329 747 HD23 LEU 107 HD23 LEU 107 11.378 -9.731 -1.253 748 H HIS 108 H HIS 108 8.628 -5.120 -3.523 749 HA HIS 108 HA HIS 108 8.119 -6.149 -6.234 750 HB2 HIS 108 HB2 HIS 108 7.004 -3.778 -4.881 751 HB3 HIS 108 HB3 HIS 108 7.572 -3.505 -6.525 752 HD1 HIS 108 HD1 HIS 108 5.777 -6.598 -5.206 753 HD2 HIS 108 HD2 HIS 108 5.259 -3.502 -7.933 754 HE1 HIS 108 HE1 HIS 108 3.671 -7.152 -6.456 755 HE2 HIS 108 HE2 HIS 108 3.510 -5.387 -8.245 756 H THR 109 H THR 109 9.449 -5.580 -7.838 757 HA THR 109 HA THR 109 11.993 -4.396 -7.068 758 HB THR 109 HB THR 109 11.249 -5.675 -9.716 759 HG1 THR 109 HG1 THR 109 12.473 -6.815 -7.398 760 HG21 THR 109 HG21 THR 109 13.932 -5.160 -8.413 761 HG22 THR 109 HG22 THR 109 13.263 -4.264 -9.776 762 HG23 THR 109 HG23 THR 109 13.674 -5.969 -9.961 763 H PHE 110 H PHE 110 12.235 -2.287 -7.318 764 HA PHE 110 HA PHE 110 10.825 -0.902 -9.452 765 HB2 PHE 110 HB2 PHE 110 12.600 0.136 -7.230 766 HB3 PHE 110 HB3 PHE 110 11.916 1.157 -8.491 767 HD1 PHE 110 HD1 PHE 110 9.311 0.976 -8.773 768 HD2 PHE 110 HD2 PHE 110 11.442 -0.107 -5.257 769 HE1 PHE 110 HE1 PHE 110 7.252 1.237 -7.451 770 HE2 PHE 110 HE2 PHE 110 9.388 0.152 -3.929 771 HZ PHE 110 HZ PHE 110 7.290 0.822 -5.024 772 H PHE 111 H PHE 111 11.658 -1.039 -11.376 773 HA PHE 111 HA PHE 111 14.479 -1.594 -11.768 774 HB2 PHE 111 HB2 PHE 111 12.187 -1.353 -13.729 775 HB3 PHE 111 HB3 PHE 111 13.836 -1.765 -14.176 776 HD1 PHE 111 HD1 PHE 111 14.826 -3.900 -13.319 777 HD2 PHE 111 HD2 PHE 111 10.691 -2.981 -12.941 778 HE1 PHE 111 HE1 PHE 111 14.335 -6.281 -12.956 779 HE2 PHE 111 HE2 PHE 111 10.193 -5.360 -12.570 780 HZ PHE 111 HZ PHE 111 12.015 -7.011 -12.580 781 H ASN 112 H ASN 112 12.319 1.055 -11.844 782 HA ASN 112 HA ASN 112 14.548 2.798 -12.531 783 HB2 ASN 112 HB2 ASN 112 13.192 4.241 -13.917 784 HB3 ASN 112 HB3 ASN 112 13.062 2.608 -14.544 785 HD21 ASN 112 HD21 ASN 112 11.089 1.496 -14.323 786 HD22 ASN 112 HD22 ASN 112 9.614 2.336 -13.988 787 H GLU 113 H GLU 113 14.096 5.056 -11.723 788 HA GLU 113 HA GLU 113 12.709 4.835 -9.151 789 HB2 GLU 113 HB2 GLU 113 14.056 6.736 -8.403 790 HB3 GLU 113 HB3 GLU 113 15.060 5.410 -8.960 791 HG2 GLU 113 HG2 GLU 113 14.396 7.658 -10.808 792 HG3 GLU 113 HG3 GLU 113 15.642 7.860 -9.582 793 H GLY 114 H GLY 114 11.985 7.097 -8.326 794 HA2 GLY 114 HA2 GLY 114 10.986 9.178 -9.638 795 HA3 GLY 114 HA3 GLY 114 9.874 7.913 -10.154 796 H GLU 115 H GLU 115 8.657 9.874 -8.859 797 HA GLU 115 HA GLU 115 8.504 9.047 -6.058 798 HB2 GLU 115 HB2 GLU 115 8.808 11.461 -6.564 799 HB3 GLU 115 HB3 GLU 115 7.257 11.462 -7.392 800 HG2 GLU 115 HG2 GLU 115 6.109 10.943 -5.341 801 HG3 GLU 115 HG3 GLU 115 7.639 10.767 -4.486 802 H TYR 116 H TYR 116 7.234 7.397 -5.810 803 HA TYR 116 HA TYR 116 4.840 7.043 -7.470 804 HB2 TYR 116 HB2 TYR 116 6.203 5.088 -5.590 805 HB3 TYR 116 HB3 TYR 116 4.885 4.719 -6.696 806 HD1 TYR 116 HD1 TYR 116 5.323 4.906 -9.181 807 HD2 TYR 116 HD2 TYR 116 8.442 4.951 -6.291 808 HE1 TYR 116 HE1 TYR 116 6.940 4.299 -10.927 809 HE2 TYR 116 HE2 TYR 116 10.072 4.352 -8.031 810 HH TYR 116 HH TYR 116 9.437 4.534 -11.301 811 H ILE 117 H ILE 117 2.857 6.333 -6.401 812 HA ILE 117 HA ILE 117 2.763 6.850 -3.511 813 HB ILE 117 HB ILE 117 0.507 7.644 -5.391 814 HG12 ILE 117 HG12 ILE 117 2.338 9.527 -3.886 815 HG13 ILE 117 HG13 ILE 117 2.610 9.086 -5.565 816 HG21 ILE 117 HG21 ILE 117 -0.240 7.017 -3.164 817 HG22 ILE 117 HG22 ILE 117 -0.394 8.761 -3.380 818 HG23 ILE 117 HG23 ILE 117 0.943 8.105 -2.434 819 HD11 ILE 117 HD11 ILE 117 1.512 11.239 -5.374 820 HD12 ILE 117 HD12 ILE 117 0.183 10.496 -4.484 821 HD13 ILE 117 HD13 ILE 117 0.464 10.066 -6.171 822 H VAL 118 H VAL 118 2.586 4.829 -2.759 823 HA VAL 118 HA VAL 118 0.899 2.857 -4.086 824 HB VAL 118 HB VAL 118 2.598 2.598 -1.581 825 HG11 VAL 118 HG11 VAL 118 0.773 0.979 -1.523 826 HG12 VAL 118 HG12 VAL 118 2.310 0.167 -1.821 827 HG13 VAL 118 HG13 VAL 118 1.183 0.438 -3.152 828 HG21 VAL 118 HG21 VAL 118 4.108 1.287 -2.990 829 HG22 VAL 118 HG22 VAL 118 3.936 2.945 -3.569 830 HG23 VAL 118 HG23 VAL 118 3.089 1.633 -4.390 831 H SER 119 H SER 119 -1.112 2.303 -3.432 832 HA SER 119 HA SER 119 -2.063 3.434 -0.896 833 HB2 SER 119 HB2 SER 119 -2.983 4.623 -2.897 834 HB3 SER 119 HB3 SER 119 -3.709 3.103 -3.417 835 HG SER 119 HG SER 119 -5.263 3.432 -2.053 836 H LEU 120 H LEU 120 -2.464 1.876 0.474 837 HA LEU 120 HA LEU 120 -3.447 -0.713 -0.443 838 HB2 LEU 120 HB2 LEU 120 -1.738 -0.688 1.325 839 HB3 LEU 120 HB3 LEU 120 -2.771 0.298 2.331 840 HG LEU 120 HG LEU 120 -4.273 -1.557 2.732 841 HD11 LEU 120 HD11 LEU 120 -3.919 -3.769 1.774 842 HD12 LEU 120 HD12 LEU 120 -2.563 -3.162 0.822 843 HD13 LEU 120 HD13 LEU 120 -4.200 -2.593 0.489 844 HD21 LEU 120 HD21 LEU 120 -1.410 -2.408 2.926 845 HD22 LEU 120 HD22 LEU 120 -2.764 -3.099 3.821 846 HD23 LEU 120 HD23 LEU 120 -2.295 -1.420 4.087 847 H ILE 121 H ILE 121 -5.517 -1.285 -0.304 848 HA ILE 121 HA ILE 121 -7.369 0.476 1.108 849 HB ILE 121 HB ILE 121 -7.665 1.220 -1.113 850 HG12 ILE 121 HG12 ILE 121 -9.793 -0.889 -0.669 851 HG13 ILE 121 HG13 ILE 121 -9.783 0.718 0.047 852 HG21 ILE 121 HG21 ILE 121 -6.416 -0.456 -2.305 853 HG22 ILE 121 HG22 ILE 121 -7.997 -0.238 -3.057 854 HG23 ILE 121 HG23 ILE 121 -7.689 -1.646 -2.038 855 HD11 ILE 121 HD11 ILE 121 -11.304 0.598 -1.830 856 HD12 ILE 121 HD12 ILE 121 -9.988 0.092 -2.889 857 HD13 ILE 121 HD13 ILE 121 -9.975 1.704 -2.175 858 H VAL 122 H VAL 122 -8.813 -0.584 2.304 859 HA VAL 122 HA VAL 122 -8.971 -3.502 1.964 860 HB VAL 122 HB VAL 122 -9.372 -3.695 4.411 861 HG11 VAL 122 HG11 VAL 122 -7.051 -3.349 5.113 862 HG12 VAL 122 HG12 VAL 122 -6.760 -2.395 3.658 863 HG13 VAL 122 HG13 VAL 122 -7.153 -4.110 3.524 864 HG21 VAL 122 HG21 VAL 122 -8.780 -1.837 5.892 865 HG22 VAL 122 HG22 VAL 122 -10.165 -1.441 4.874 866 HG23 VAL 122 HG23 VAL 122 -8.573 -0.786 4.488 867 H SER 123 H SER 123 -11.002 -4.450 2.739 868 HA SER 123 HA SER 123 -13.253 -2.584 2.629 869 HB2 SER 123 HB2 SER 123 -13.158 -5.179 1.066 870 HB3 SER 123 HB3 SER 123 -14.452 -3.979 1.068 871 HG SER 123 HG SER 123 -11.943 -3.028 0.402 872 H ASN 124 H ASN 124 -15.073 -3.290 3.699 873 HA ASN 124 HA ASN 124 -15.140 -5.832 5.066 874 HB2 ASN 124 HB2 ASN 124 -13.742 -4.450 6.581 875 HB3 ASN 124 HB3 ASN 124 -14.973 -3.205 6.599 876 HD21 ASN 124 HD21 ASN 124 -14.244 -6.499 7.590 877 HD22 ASN 124 HD22 ASN 124 -15.354 -6.539 8.919 878 H GLU 125 H GLU 125 -17.333 -5.772 6.458 879 HA GLU 125 HA GLU 125 -19.387 -5.195 4.553 880 HB2 GLU 125 HB2 GLU 125 -20.879 -6.193 6.255 881 HB3 GLU 125 HB3 GLU 125 -19.484 -7.206 5.922 882 HG2 GLU 125 HG2 GLU 125 -18.413 -6.434 7.974 883 HG3 GLU 125 HG3 GLU 125 -19.782 -5.376 8.302 884 H ASN 126 H ASN 126 -18.045 -3.512 7.273 885 HA ASN 126 HA ASN 126 -20.387 -1.838 7.707 886 HB2 ASN 126 HB2 ASN 126 -18.891 -2.624 9.600 887 HB3 ASN 126 HB3 ASN 126 -17.625 -1.580 8.956 888 HD21 ASN 126 HD21 ASN 126 -17.562 -0.362 10.830 889 HD22 ASN 126 HD22 ASN 126 -18.797 0.792 11.201 890 H ASP 127 H ASP 127 -16.962 -1.306 6.928 891 HA ASP 127 HA ASP 127 -17.678 0.897 5.143 892 HB2 ASP 127 HB2 ASP 127 -15.918 1.148 7.566 893 HB3 ASP 127 HB3 ASP 127 -15.713 2.212 6.181 894 H SER 128 H SER 128 -15.600 1.760 4.036 895 HA SER 128 HA SER 128 -13.548 -0.325 3.816 896 HB2 SER 128 HB2 SER 128 -13.354 0.314 1.380 897 HB3 SER 128 HB3 SER 128 -14.868 -0.486 1.801 898 HG SER 128 HG SER 128 -14.740 2.315 1.887 899 H ASP 129 H ASP 129 -11.511 0.412 4.004 900 HA ASP 129 HA ASP 129 -11.168 3.335 4.254 901 HB2 ASP 129 HB2 ASP 129 -11.103 2.045 6.422 902 HB3 ASP 129 HB3 ASP 129 -9.696 1.180 5.809 903 H SER 130 H SER 130 -9.426 4.224 3.133 904 HA SER 130 HA SER 130 -7.381 2.400 2.123 905 HB2 SER 130 HB2 SER 130 -7.449 3.608 -0.083 906 HB3 SER 130 HB3 SER 130 -8.869 2.619 0.246 907 HG SER 130 HG SER 130 -8.885 5.337 0.967 908 H ALA 131 H ALA 131 -5.350 3.236 2.110 909 HA ALA 131 HA ALA 131 -4.984 6.108 2.529 910 HB1 ALA 131 HB1 ALA 131 -3.817 4.019 4.364 911 HB2 ALA 131 HB2 ALA 131 -5.075 5.184 4.777 912 HB3 ALA 131 HB3 ALA 131 -3.449 5.745 4.394 913 H SER 132 H SER 132 -3.038 6.909 1.952 914 HA SER 132 HA SER 132 -1.455 5.129 0.234 915 HB2 SER 132 HB2 SER 132 -2.055 8.045 -0.295 916 HB3 SER 132 HB3 SER 132 -1.390 6.855 -1.400 917 HG SER 132 HG SER 132 -3.547 5.743 -0.935 918 H VAL 133 H VAL 133 0.786 5.585 0.105 919 HA VAL 133 HA VAL 133 1.762 7.835 1.700 920 HB VAL 133 HB VAL 133 2.009 5.603 2.940 921 HG11 VAL 133 HG11 VAL 133 2.721 4.170 1.160 922 HG12 VAL 133 HG12 VAL 133 3.971 4.236 2.405 923 HG13 VAL 133 HG13 VAL 133 4.166 5.145 0.904 924 HG21 VAL 133 HG21 VAL 133 4.483 7.261 2.469 925 HG22 VAL 133 HG22 VAL 133 4.224 6.168 3.829 926 HG23 VAL 133 HG23 VAL 133 3.206 7.594 3.637 927 H THR 134 H THR 134 3.742 8.741 0.955 928 HA THR 134 HA THR 134 4.047 8.448 -1.914 929 HB THR 134 HB THR 134 5.391 10.443 -0.078 930 HG1 THR 134 HG1 THR 134 3.183 10.722 0.174 931 HG21 THR 134 HG21 THR 134 6.356 10.299 -2.314 932 HG22 THR 134 HG22 THR 134 5.493 11.824 -2.104 933 HG23 THR 134 HG23 THR 134 4.758 10.511 -3.025 934 H ILE 135 H ILE 135 5.434 7.060 -2.657 935 HA ILE 135 HA ILE 135 7.751 6.173 -1.118 936 HB ILE 135 HB ILE 135 6.868 5.245 -3.871 937 HG12 ILE 135 HG12 ILE 135 5.033 4.845 -2.316 938 HG13 ILE 135 HG13 ILE 135 5.785 3.322 -2.766 939 HG21 ILE 135 HG21 ILE 135 8.675 3.939 -1.833 940 HG22 ILE 135 HG22 ILE 135 9.170 4.679 -3.355 941 HG23 ILE 135 HG23 ILE 135 8.177 3.222 -3.366 942 HD11 ILE 135 HD11 ILE 135 6.189 4.806 -0.181 943 HD12 ILE 135 HD12 ILE 135 6.959 3.281 -0.623 944 HD13 ILE 135 HD13 ILE 135 5.207 3.361 -0.419 945 H ARG 136 H ARG 136 9.607 7.309 -1.361 946 HA ARG 136 HA ARG 136 9.828 8.923 -3.794 947 HB2 ARG 136 HB2 ARG 136 10.958 9.396 -1.031 948 HB3 ARG 136 HB3 ARG 136 11.327 10.391 -2.435 949 HG2 ARG 136 HG2 ARG 136 9.066 11.120 -2.616 950 HG3 ARG 136 HG3 ARG 136 8.531 9.941 -1.421 951 HD2 ARG 136 HD2 ARG 136 8.658 12.213 -0.508 952 HD3 ARG 136 HD3 ARG 136 9.740 11.096 0.318 953 HE ARG 136 HE ARG 136 11.586 12.135 -0.774 954 HH11 ARG 136 HH11 ARG 136 8.540 13.801 -1.356 955 HH12 ARG 136 HH12 ARG 136 9.301 15.325 -1.685 956 HH21 ARG 136 HH21 ARG 136 12.569 14.114 -1.173 957 HH22 ARG 136 HH22 ARG 136 11.607 15.515 -1.552 958 H ALA 137 H ALA 137 10.918 7.686 -5.166 959 HA ALA 137 HA ALA 137 13.429 6.468 -4.256 960 HB1 ALA 137 HB1 ALA 137 11.893 4.920 -5.374 961 HB2 ALA 137 HB2 ALA 137 13.356 5.158 -6.329 962 HB3 ALA 137 HB3 ALA 137 11.859 5.967 -6.793 963 H LEU 138 H LEU 138 15.121 7.661 -4.569 964 HA LEU 138 HA LEU 138 14.910 10.113 -6.053 965 HB2 LEU 138 HB2 LEU 138 17.177 8.983 -4.422 966 HB3 LEU 138 HB3 LEU 138 17.144 10.593 -5.109 967 HG LEU 138 HG LEU 138 15.340 9.524 -2.938 968 HD11 LEU 138 HD11 LEU 138 16.451 11.215 -1.566 969 HD12 LEU 138 HD12 LEU 138 17.487 11.639 -2.930 970 HD13 LEU 138 HD13 LEU 138 17.596 10.036 -2.204 971 HD21 LEU 138 HD21 LEU 138 15.378 12.246 -4.238 972 HD22 LEU 138 HD22 LEU 138 14.397 11.771 -2.849 973 HD23 LEU 138 HD23 LEU 138 14.119 11.026 -4.425 974 H GLU 139 H GLU 139 16.019 10.758 -7.756 975 HA GLU 139 HA GLU 139 16.935 8.731 -9.557 976 HB2 GLU 139 HB2 GLU 139 15.597 11.045 -9.877 977 HB3 GLU 139 HB3 GLU 139 17.221 11.625 -10.189 978 HG2 GLU 139 HG2 GLU 139 16.100 9.257 -11.636 979 HG3 GLU 139 HG3 GLU 139 15.786 10.907 -12.170 980 H HIS 140 H HIS 140 18.990 8.291 -10.166 981 HA HIS 140 HA HIS 140 21.100 9.151 -8.438 982 HB2 HIS 140 HB2 HIS 140 22.577 7.753 -9.982 983 HB3 HIS 140 HB3 HIS 140 21.314 6.904 -9.113 984 HD1 HIS 140 HD1 HIS 140 21.956 8.277 -12.619 985 HD2 HIS 140 HD2 HIS 140 19.766 5.329 -10.680 986 HE1 HIS 140 HE1 HIS 140 20.904 6.908 -14.442 987 HE2 HIS 140 HE2 HIS 140 19.405 5.287 -13.241 988 H HIS 141 H HIS 141 22.552 10.699 -8.687 989 HA HIS 141 HA HIS 141 23.632 12.532 -9.431 990 HB2 HIS 141 HB2 HIS 141 24.506 10.825 -11.086 991 HB3 HIS 141 HB3 HIS 141 23.307 11.414 -12.225 992 HD1 HIS 141 HD1 HIS 141 24.090 13.170 -13.747 993 HD2 HIS 141 HD2 HIS 141 26.359 13.009 -10.262 994 HE1 HIS 141 HE1 HIS 141 25.943 14.835 -14.068 995 HE2 HIS 141 HE2 HIS 141 27.403 14.596 -12.040 996 H HIS 142 H HIS 142 20.929 12.826 -8.916 997 HA HIS 142 HA HIS 142 19.951 14.598 -11.039 998 HB2 HIS 142 HB2 HIS 142 18.559 12.729 -9.755 999 HB3 HIS 142 HB3 HIS 142 18.322 14.043 -8.605 1000 HD1 HIS 142 HD1 HIS 142 17.609 13.114 -12.187 1001 HD2 HIS 142 HD2 HIS 142 16.540 15.991 -9.388 1002 HE1 HIS 142 HE1 HIS 142 15.716 14.396 -13.226 1003 HE2 HIS 142 HE2 HIS 142 14.952 15.999 -11.432 1004 H HIS 143 H HIS 143 21.547 14.695 -8.050 1005 HA HIS 143 HA HIS 143 20.706 17.417 -7.447 1006 HB2 HIS 143 HB2 HIS 143 21.100 15.705 -5.621 1007 HB3 HIS 143 HB3 HIS 143 22.808 15.752 -6.040 1008 HD1 HIS 143 HD1 HIS 143 20.158 17.656 -4.266 1009 HD2 HIS 143 HD2 HIS 143 24.164 18.121 -5.277 1010 HE1 HIS 143 HE1 HIS 143 20.987 19.583 -2.880 1011 HE2 HIS 143 HE2 HIS 143 23.448 19.746 -3.392 1012 H HIS 144 H HIS 144 21.520 18.794 -8.898 1013 HA HIS 144 HA HIS 144 24.285 18.514 -9.784 1014 HB2 HIS 144 HB2 HIS 144 22.566 18.898 -11.501 1015 HB3 HIS 144 HB3 HIS 144 22.079 20.382 -10.696 1016 HD1 HIS 144 HD1 HIS 144 25.518 19.157 -11.817 1017 HD2 HIS 144 HD2 HIS 144 22.959 22.403 -12.239 1018 HE1 HIS 144 HE1 HIS 144 26.781 20.833 -13.201 1019 HE2 HIS 144 HE2 HIS 144 25.286 22.861 -13.268 1020 H HIS 145 H HIS 145 25.875 19.717 -9.030 1021 HA HIS 145 HA HIS 145 25.338 21.783 -7.072 1022 HB2 HIS 145 HB2 HIS 145 27.182 20.189 -6.666 1023 HB3 HIS 145 HB3 HIS 145 27.973 20.704 -8.147 1024 HD1 HIS 145 HD1 HIS 145 26.816 22.350 -4.901 1025 HD2 HIS 145 HD2 HIS 145 29.913 22.532 -7.667 1026 HE1 HIS 145 HE1 HIS 145 28.383 24.120 -4.042 1027 HE2 HIS 145 HE2 HIS 145 30.327 24.090 -5.639 Start of MODEL 2 1 H1 MET 1 H1 MET 1 -90.022 -58.100 148.185 2 H2 MET 1 H2 MET 1 -91.434 -57.268 148.625 3 H3 MET 1 H3 MET 1 -89.926 -56.503 148.737 4 HA MET 1 HA MET 1 -91.120 -57.468 146.214 5 HB2 MET 1 HB2 MET 1 -91.567 -55.073 145.713 6 HB3 MET 1 HB3 MET 1 -92.529 -55.694 147.042 7 HG2 MET 1 HG2 MET 1 -91.118 -54.566 148.640 8 HG3 MET 1 HG3 MET 1 -90.035 -54.034 147.355 9 HE1 MET 1 HE1 MET 1 -91.344 -52.109 149.558 10 HE2 MET 1 HE2 MET 1 -91.744 -50.719 148.549 11 HE3 MET 1 HE3 MET 1 -90.219 -51.574 148.311 12 H ASN 2 H ASN 2 -88.324 -57.616 147.464 13 HA ASN 2 HA ASN 2 -86.987 -56.260 145.225 14 HB2 ASN 2 HB2 ASN 2 -85.075 -55.756 146.511 15 HB3 ASN 2 HB3 ASN 2 -86.434 -55.298 147.519 16 HD21 ASN 2 HD21 ASN 2 -86.899 -56.553 149.374 17 HD22 ASN 2 HD22 ASN 2 -85.707 -57.599 150.067 18 H ALA 3 H ALA 3 -85.274 -57.321 144.231 19 HA ALA 3 HA ALA 3 -85.027 -60.195 144.843 20 HB1 ALA 3 HB1 ALA 3 -86.387 -59.887 142.837 21 HB2 ALA 3 HB2 ALA 3 -84.835 -60.629 142.441 22 HB3 ALA 3 HB3 ALA 3 -85.106 -58.917 142.111 23 H ARG 4 H ARG 4 -83.010 -61.141 144.080 24 HA ARG 4 HA ARG 4 -80.750 -59.247 144.072 25 HB2 ARG 4 HB2 ARG 4 -80.816 -62.228 144.669 26 HB3 ARG 4 HB3 ARG 4 -79.347 -61.281 144.569 27 HG2 ARG 4 HG2 ARG 4 -79.735 -61.527 146.853 28 HG3 ARG 4 HG3 ARG 4 -80.307 -59.899 146.498 29 HD2 ARG 4 HD2 ARG 4 -81.769 -61.324 148.015 30 HD3 ARG 4 HD3 ARG 4 -82.570 -60.554 146.646 31 HE ARG 4 HE ARG 4 -81.654 -63.327 146.368 32 HH11 ARG 4 HH11 ARG 4 -84.368 -61.133 146.823 33 HH12 ARG 4 HH12 ARG 4 -85.527 -62.216 146.110 34 HH21 ARG 4 HH21 ARG 4 -83.162 -64.741 145.425 35 HH22 ARG 4 HH22 ARG 4 -84.839 -64.291 145.336 36 H ASP 5 H ASP 5 -82.094 -59.245 141.815 37 HA ASP 5 HA ASP 5 -81.433 -61.487 140.084 38 HB2 ASP 5 HB2 ASP 5 -83.754 -60.798 140.154 39 HB3 ASP 5 HB3 ASP 5 -83.317 -59.140 139.771 40 H ASN 6 H ASN 6 -79.653 -61.424 138.975 41 HA ASN 6 HA ASN 6 -79.125 -59.212 137.225 42 HB2 ASN 6 HB2 ASN 6 -76.692 -59.055 137.885 43 HB3 ASN 6 HB3 ASN 6 -77.820 -58.382 139.039 44 HD21 ASN 6 HD21 ASN 6 -78.107 -59.425 141.048 45 HD22 ASN 6 HD22 ASN 6 -76.963 -60.586 141.638 46 H LYS 7 H LYS 7 -79.578 -60.586 135.556 47 HA LYS 7 HA LYS 7 -77.606 -62.733 135.177 48 HB2 LYS 7 HB2 LYS 7 -79.149 -64.029 133.880 49 HB3 LYS 7 HB3 LYS 7 -79.901 -63.638 135.410 50 HG2 LYS 7 HG2 LYS 7 -80.502 -62.064 132.923 51 HG3 LYS 7 HG3 LYS 7 -81.325 -63.576 133.288 52 HD2 LYS 7 HD2 LYS 7 -82.052 -62.606 135.447 53 HD3 LYS 7 HD3 LYS 7 -81.315 -61.074 134.973 54 HE2 LYS 7 HE2 LYS 7 -82.784 -61.070 132.964 55 HE3 LYS 7 HE3 LYS 7 -83.585 -62.503 133.602 56 HZ1 LYS 7 HZ1 LYS 7 -83.520 -59.798 134.813 57 HZ2 LYS 7 HZ2 LYS 7 -84.099 -61.163 135.620 58 HZ3 LYS 7 HZ3 LYS 7 -84.871 -60.625 134.212 59 H PHE 8 H PHE 8 -76.436 -62.799 133.370 60 HA PHE 8 HA PHE 8 -76.833 -60.540 131.540 61 HB2 PHE 8 HB2 PHE 8 -74.355 -60.429 131.293 62 HB3 PHE 8 HB3 PHE 8 -74.931 -60.012 132.895 63 HD1 PHE 8 HD2 PHE 8 -74.483 -61.508 134.798 64 HD2 PHE 8 HD1 PHE 8 -72.935 -62.338 130.921 65 HE1 PHE 8 HE2 PHE 8 -72.876 -63.086 135.780 66 HE2 PHE 8 HE1 PHE 8 -71.322 -63.913 131.900 67 HZ PHE 8 HZ PHE 8 -71.293 -64.292 134.332 68 H ASN 9 H ASN 9 -76.954 -60.921 129.487 69 HA ASN 9 HA ASN 9 -75.445 -63.141 128.365 70 HB2 ASN 9 HB2 ASN 9 -77.240 -63.786 126.832 71 HB3 ASN 9 HB3 ASN 9 -77.741 -64.003 128.496 72 HD21 ASN 9 HD21 ASN 9 -78.312 -62.369 125.522 73 HD22 ASN 9 HD22 ASN 9 -79.761 -61.553 125.987 74 H THR 10 H THR 10 -74.214 -62.484 126.760 75 HA THR 10 HA THR 10 -74.831 -59.856 125.609 76 HB THR 10 HB THR 10 -72.788 -59.648 126.826 77 HG1 THR 10 HG1 THR 10 -72.929 -58.839 124.552 78 HG21 THR 10 HG21 THR 10 -70.780 -61.001 126.382 79 HG22 THR 10 HG22 THR 10 -71.725 -62.040 125.312 80 HG23 THR 10 HG23 THR 10 -72.105 -61.965 127.033 81 H TRP 11 H TRP 11 -73.666 -63.095 124.917 82 HA TRP 11 HA TRP 11 -73.218 -64.251 123.037 83 HB2 TRP 11 HB2 TRP 11 -75.811 -62.945 122.178 84 HB3 TRP 11 HB3 TRP 11 -75.077 -64.349 121.404 85 HD1 TRP 11 HD1 TRP 11 -77.550 -63.507 123.963 86 HE1 TRP 11 HE1 TRP 11 -78.094 -65.537 125.452 87 HE3 TRP 11 HE3 TRP 11 -73.665 -66.559 122.632 88 HZ2 TRP 11 HZ2 TRP 11 -77.016 -68.085 125.994 89 HZ3 TRP 11 HZ3 TRP 11 -73.495 -68.773 123.688 90 HH2 TRP 11 HH2 TRP 11 -75.135 -69.519 125.332 91 H ASN 12 H ASN 12 -71.410 -62.653 122.928 92 HA ASN 12 HA ASN 12 -71.542 -60.707 120.832 93 HB2 ASN 12 HB2 ASN 12 -69.137 -60.289 121.348 94 HB3 ASN 12 HB3 ASN 12 -70.212 -60.090 122.716 95 HD21 ASN 12 HD21 ASN 12 -67.350 -60.498 122.619 96 HD22 ASN 12 HD22 ASN 12 -67.026 -61.903 123.579 97 H ASP 13 H ASP 13 -71.923 -61.627 118.980 98 HA ASP 13 HA ASP 13 -70.078 -63.682 117.986 99 HB2 ASP 13 HB2 ASP 13 -72.459 -64.342 118.136 100 HB3 ASP 13 HB3 ASP 13 -72.890 -63.000 117.084 101 H SER 14 H SER 14 -68.497 -62.224 117.372 102 HA SER 14 HA SER 14 -69.234 -60.247 115.338 103 HB2 SER 14 HB2 SER 14 -66.689 -60.442 116.970 104 HB3 SER 14 HB3 SER 14 -67.136 -59.127 115.883 105 HG SER 14 HG SER 14 -69.155 -59.258 117.453 106 H ARG 15 H ARG 15 -69.317 -61.530 113.547 107 HA ARG 15 HA ARG 15 -66.862 -62.962 112.828 108 HB2 ARG 15 HB2 ARG 15 -68.263 -64.186 111.183 109 HB3 ARG 15 HB3 ARG 15 -68.753 -64.438 112.848 110 HG2 ARG 15 HG2 ARG 15 -70.573 -62.784 112.504 111 HG3 ARG 15 HG3 ARG 15 -70.116 -62.699 110.801 112 HD2 ARG 15 HD2 ARG 15 -71.940 -64.237 110.990 113 HD3 ARG 15 HD3 ARG 15 -70.479 -65.170 110.667 114 HE ARG 15 HE ARG 15 -71.473 -64.860 113.431 115 HH11 ARG 15 HH11 ARG 15 -70.713 -66.984 110.703 116 HH12 ARG 15 HH12 ARG 15 -70.810 -68.431 111.660 117 HH21 ARG 15 HH21 ARG 15 -71.597 -66.748 114.657 118 HH22 ARG 15 HH22 ARG 15 -71.312 -68.297 113.907 119 H GLY 16 H GLY 16 -65.944 -62.720 110.809 120 HA2 GLY 16 HA2 GLY 16 -66.947 -60.801 108.910 121 HA3 GLY 16 HA3 GLY 16 -65.578 -60.209 109.842 122 H ASN 17 H ASN 17 -66.526 -61.848 107.133 123 HA ASN 17 HA ASN 17 -63.776 -62.613 106.560 124 HB2 ASN 17 HB2 ASN 17 -64.483 -64.751 105.510 125 HB3 ASN 17 HB3 ASN 17 -64.761 -64.722 107.239 126 HD21 ASN 17 HD21 ASN 17 -65.891 -66.349 105.077 127 HD22 ASN 17 HD22 ASN 17 -67.609 -66.196 105.228 128 H TYR 18 H TYR 18 -63.172 -61.539 104.835 129 HA TYR 18 HA TYR 18 -64.858 -61.356 102.503 130 HB2 TYR 18 HB2 TYR 18 -64.901 -58.892 102.392 131 HB3 TYR 18 HB3 TYR 18 -65.771 -59.487 103.797 132 HD1 TYR 18 HD2 TYR 18 -64.925 -59.071 106.048 133 HD2 TYR 18 HD1 TYR 18 -62.838 -57.648 102.630 134 HE1 TYR 18 HE2 TYR 18 -63.614 -57.569 107.488 135 HE2 TYR 18 HE1 TYR 18 -61.525 -56.127 104.057 136 HH TYR 18 HH TYR 18 -61.439 -56.403 107.436 137 H TRP 19 H TRP 19 -63.745 -60.614 100.637 138 HA TRP 19 HA TRP 19 -61.025 -59.727 100.797 139 HB2 TRP 19 HB2 TRP 19 -60.114 -61.592 99.368 140 HB3 TRP 19 HB3 TRP 19 -60.455 -62.018 101.035 141 HD1 TRP 19 HD1 TRP 19 -62.934 -63.363 101.346 142 HE1 TRP 19 HE1 TRP 19 -63.838 -65.285 99.871 143 HE3 TRP 19 HE3 TRP 19 -60.150 -62.533 97.144 144 HZ2 TRP 19 HZ2 TRP 19 -63.415 -66.297 97.262 145 HZ3 TRP 19 HZ3 TRP 19 -60.453 -64.022 95.212 146 HH2 TRP 19 HH2 TRP 19 -62.049 -65.865 95.271 147 H SER 20 H SER 20 -60.096 -59.362 98.572 148 HA SER 20 HA SER 20 -62.230 -58.655 96.693 149 HB2 SER 20 HB2 SER 20 -61.745 -56.767 98.310 150 HB3 SER 20 HB3 SER 20 -60.130 -56.681 97.610 151 HG SER 20 HG SER 20 -62.273 -56.641 95.833 152 H ASP 21 H ASP 21 -61.678 -58.726 94.597 153 HA ASP 21 HA ASP 21 -58.824 -58.958 93.897 154 HB2 ASP 21 HB2 ASP 21 -60.511 -60.979 93.498 155 HB3 ASP 21 HB3 ASP 21 -60.965 -60.036 92.083 156 H TYR 22 H TYR 22 -58.768 -58.339 91.280 157 HA TYR 22 HA TYR 22 -60.130 -55.728 91.158 158 HB2 TYR 22 HB2 TYR 22 -57.218 -56.267 90.569 159 HB3 TYR 22 HB3 TYR 22 -58.046 -54.770 90.155 160 HD1 TYR 22 HD1 TYR 22 -59.238 -53.552 92.126 161 HD2 TYR 22 HD2 TYR 22 -56.171 -56.457 92.629 162 HE1 TYR 22 HE1 TYR 22 -58.803 -52.689 94.381 163 HE2 TYR 22 HE2 TYR 22 -55.728 -55.600 94.889 164 HH TYR 22 HH TYR 22 -57.843 -53.527 96.512 165 H GLU 23 H GLU 23 -61.519 -55.884 89.581 166 HA GLU 23 HA GLU 23 -60.658 -57.009 86.997 167 HB2 GLU 23 HB2 GLU 23 -63.468 -56.406 87.969 168 HB3 GLU 23 HB3 GLU 23 -63.062 -57.007 86.372 169 HG2 GLU 23 HG2 GLU 23 -63.709 -58.933 87.390 170 HG3 GLU 23 HG3 GLU 23 -61.983 -58.973 87.716 171 H GLY 24 H GLY 24 -60.059 -55.600 85.500 172 HA2 GLY 24 HA2 GLY 24 -61.328 -53.604 84.311 173 HA3 GLY 24 HA3 GLY 24 -60.817 -52.790 85.782 174 H SER 25 H SER 25 -59.805 -54.234 82.796 175 HA SER 25 HA SER 25 -57.158 -53.020 83.170 176 HB2 SER 25 HB2 SER 25 -56.485 -54.749 81.340 177 HB3 SER 25 HB3 SER 25 -56.698 -55.307 83.000 178 HG SER 25 HG SER 25 -58.320 -55.725 80.741 179 H ASP 26 H ASP 26 -57.617 -51.037 82.364 180 HA ASP 26 HA ASP 26 -58.757 -50.791 79.680 181 HB2 ASP 26 HB2 ASP 26 -59.580 -49.290 81.480 182 HB3 ASP 26 HB3 ASP 26 -57.951 -48.656 81.673 183 H GLU 27 H GLU 27 -57.593 -50.144 77.930 184 HA GLU 27 HA GLU 27 -54.713 -50.384 78.198 185 HB2 GLU 27 HB2 GLU 27 -55.979 -51.668 76.467 186 HB3 GLU 27 HB3 GLU 27 -56.377 -50.150 75.680 187 HG2 GLU 27 HG2 GLU 27 -53.892 -49.748 75.477 188 HG3 GLU 27 HG3 GLU 27 -53.672 -51.426 75.975 189 H ASN 28 H ASN 28 -56.539 -48.293 75.969 190 HA ASN 28 HA ASN 28 -54.990 -45.956 76.766 191 HB2 ASN 28 HB2 ASN 28 -54.614 -47.452 74.190 192 HB3 ASN 28 HB3 ASN 28 -54.430 -45.704 74.205 193 HD21 ASN 28 HD21 ASN 28 -53.265 -45.477 76.787 194 HD22 ASN 28 HD22 ASN 28 -51.669 -46.145 76.690 195 H GLY 29 H GLY 29 -55.621 -44.017 75.470 196 HA2 GLY 29 HA2 GLY 29 -58.155 -44.245 74.020 197 HA3 GLY 29 HA3 GLY 29 -58.142 -43.217 75.449 198 H ASP 30 H ASP 30 -57.456 -43.417 72.131 199 HA ASP 30 HA ASP 30 -55.991 -40.864 72.247 200 HB2 ASP 30 HB2 ASP 30 -55.583 -43.261 70.501 201 HB3 ASP 30 HB3 ASP 30 -55.118 -41.667 69.916 202 H GLY 31 H GLY 31 -56.179 -39.494 70.365 203 HA2 GLY 31 HA2 GLY 31 -58.060 -39.699 68.343 204 HA3 GLY 31 HA3 GLY 31 -58.892 -38.982 69.719 205 H ILE 32 H ILE 32 -56.642 -38.507 67.177 206 HA ILE 32 HA ILE 32 -56.345 -35.711 68.011 207 HB ILE 32 HB ILE 32 -54.162 -36.674 67.792 208 HG12 ILE 32 HG12 ILE 32 -54.667 -35.038 65.293 209 HG13 ILE 32 HG13 ILE 32 -54.497 -34.363 66.906 210 HG21 ILE 32 HG21 ILE 32 -54.657 -38.611 66.436 211 HG22 ILE 32 HG22 ILE 32 -53.318 -37.701 65.735 212 HG23 ILE 32 HG23 ILE 32 -54.928 -37.587 65.025 213 HD11 ILE 32 HD11 ILE 32 -52.382 -35.850 65.360 214 HD12 ILE 32 HD12 ILE 32 -52.200 -35.242 67.006 215 HD13 ILE 32 HD13 ILE 32 -52.440 -34.114 65.671 216 H GLY 33 H GLY 33 -57.457 -34.268 66.986 217 HA2 GLY 33 HA2 GLY 33 -58.330 -34.803 64.217 218 HA3 GLY 33 HA3 GLY 33 -59.433 -34.153 65.425 219 H ASP 34 H ASP 34 -56.711 -33.503 63.377 220 HA ASP 34 HA ASP 34 -56.773 -30.674 64.156 221 HB2 ASP 34 HB2 ASP 34 -54.553 -30.465 63.197 222 HB3 ASP 34 HB3 ASP 34 -54.575 -31.794 64.344 223 H SER 35 H SER 35 -57.008 -29.069 62.648 224 HA SER 35 HA SER 35 -57.184 -29.749 59.829 225 HB2 SER 35 HB2 SER 35 -59.444 -28.341 61.292 226 HB3 SER 35 HB3 SER 35 -59.286 -28.419 59.537 227 HG SER 35 HG SER 35 -59.109 -30.870 60.742 228 H ALA 36 H ALA 36 -55.542 -28.537 59.172 229 HA ALA 36 HA ALA 36 -55.718 -25.653 59.733 230 HB1 ALA 36 HB1 ALA 36 -53.301 -25.497 59.458 231 HB2 ALA 36 HB2 ALA 36 -53.210 -27.229 59.142 232 HB3 ALA 36 HB3 ALA 36 -53.701 -26.650 60.733 233 H TYR 37 H TYR 37 -57.223 -25.608 57.956 234 HA TYR 37 HA TYR 37 -56.148 -26.181 55.314 235 HB2 TYR 37 HB2 TYR 37 -58.456 -26.851 55.795 236 HB3 TYR 37 HB3 TYR 37 -58.882 -25.188 56.165 237 HD1 TYR 37 HD1 TYR 37 -57.584 -27.314 53.381 238 HD2 TYR 37 HD2 TYR 37 -59.768 -23.838 54.492 239 HE1 TYR 37 HE1 TYR 37 -58.200 -26.950 51.027 240 HE2 TYR 37 HE2 TYR 37 -60.387 -23.465 52.149 241 HH TYR 37 HH TYR 37 -59.951 -25.797 49.731 242 H ALA 38 H ALA 38 -54.642 -24.704 54.834 243 HA ALA 38 HA ALA 38 -55.526 -21.900 54.716 244 HB1 ALA 38 HB1 ALA 38 -53.980 -22.176 56.593 245 HB2 ALA 38 HB2 ALA 38 -53.276 -21.175 55.322 246 HB3 ALA 38 HB3 ALA 38 -52.774 -22.857 55.500 247 H VAL 39 H VAL 39 -55.885 -21.677 52.592 248 HA VAL 39 HA VAL 39 -53.736 -22.534 50.779 249 HB VAL 39 HB VAL 39 -55.361 -22.493 48.931 250 HG11 VAL 39 HG11 VAL 39 -56.634 -24.486 49.604 251 HG12 VAL 39 HG12 VAL 39 -56.163 -24.198 51.280 252 HG13 VAL 39 HG13 VAL 39 -54.934 -24.574 50.071 253 HG21 VAL 39 HG21 VAL 39 -57.770 -22.368 49.388 254 HG22 VAL 39 HG22 VAL 39 -56.952 -20.852 49.770 255 HG23 VAL 39 HG23 VAL 39 -57.425 -21.949 51.069 256 H ASN 40 H ASN 40 -52.933 -21.155 49.241 257 HA ASN 40 HA ASN 40 -53.177 -18.325 49.916 258 HB2 ASN 40 HB2 ASN 40 -50.941 -19.511 49.695 259 HB3 ASN 40 HB3 ASN 40 -51.264 -19.670 47.978 260 HD21 ASN 40 HD21 ASN 40 -50.420 -17.509 50.563 261 HD22 ASN 40 HD22 ASN 40 -49.984 -16.161 49.568 262 HA PRO 41 HA PRO 41 -55.857 -17.652 46.404 263 HB2 PRO 41 HB2 PRO 41 -55.141 -14.819 46.505 264 HB3 PRO 41 HB3 PRO 41 -56.682 -15.606 46.862 265 HG2 PRO 41 HG2 PRO 41 -55.172 -14.503 48.802 266 HG3 PRO 41 HG3 PRO 41 -56.136 -15.966 49.083 267 HD2 PRO 41 HD2 PRO 41 -53.208 -15.717 48.490 268 HD3 PRO 41 HD3 PRO 41 -54.020 -16.701 49.729 269 H GLU 42 H GLU 42 -52.647 -17.667 46.081 270 HA GLU 42 HA GLU 42 -51.289 -17.995 44.332 271 HB2 GLU 42 HB2 GLU 42 -53.760 -17.736 42.612 272 HB3 GLU 42 HB3 GLU 42 -52.209 -18.385 42.098 273 HG2 GLU 42 HG2 GLU 42 -52.451 -20.311 43.417 274 HG3 GLU 42 HG3 GLU 42 -53.748 -19.597 44.371 275 H ALA 43 H ALA 43 -53.261 -16.039 42.229 276 HA ALA 43 HA ALA 43 -51.316 -13.854 42.445 277 HB1 ALA 43 HB1 ALA 43 -50.778 -15.190 40.462 278 HB2 ALA 43 HB2 ALA 43 -51.369 -13.591 40.009 279 HB3 ALA 43 HB3 ALA 43 -52.429 -14.995 39.874 280 H GLY 44 H GLY 44 -52.215 -11.937 42.739 281 HA2 GLY 44 HA2 GLY 44 -54.976 -11.492 41.792 282 HA3 GLY 44 HA3 GLY 44 -54.512 -11.040 43.428 283 H SER 45 H SER 45 -52.168 -10.699 40.961 284 HA SER 45 HA SER 45 -52.664 -7.808 40.773 285 HB2 SER 45 HB2 SER 45 -50.794 -8.514 42.404 286 HB3 SER 45 HB3 SER 45 -49.907 -9.018 40.967 287 HG SER 45 HG SER 45 -49.785 -6.932 40.279 288 H MET 46 H MET 46 -52.858 -7.221 38.715 289 HA MET 46 HA MET 46 -51.460 -8.808 36.672 290 HB2 MET 46 HB2 MET 46 -54.244 -7.647 36.406 291 HB3 MET 46 HB3 MET 46 -53.354 -8.454 35.125 292 HG2 MET 46 HG2 MET 46 -54.707 -10.149 35.838 293 HG3 MET 46 HG3 MET 46 -53.275 -10.437 36.828 294 HE1 MET 46 HE1 MET 46 -56.100 -11.736 37.612 295 HE2 MET 46 HE2 MET 46 -56.026 -11.462 39.352 296 HE3 MET 46 HE3 MET 46 -54.571 -11.934 38.470 297 H ASP 47 H ASP 47 -49.858 -7.187 37.074 298 HA ASP 47 HA ASP 47 -50.410 -4.592 35.824 299 HB2 ASP 47 HB2 ASP 47 -48.429 -3.775 37.115 300 HB3 ASP 47 HB3 ASP 47 -49.773 -4.293 38.120 301 H TYR 48 H TYR 48 -49.407 -4.058 34.002 302 HA TYR 48 HA TYR 48 -47.196 -5.774 33.073 303 HB2 TYR 48 HB2 TYR 48 -49.489 -4.901 31.299 304 HB3 TYR 48 HB3 TYR 48 -48.186 -6.004 30.889 305 HD1 TYR 48 HD1 TYR 48 -48.077 -8.217 32.312 306 HD2 TYR 48 HD2 TYR 48 -51.525 -5.744 32.007 307 HE1 TYR 48 HE1 TYR 48 -49.489 -10.106 33.009 308 HE2 TYR 48 HE2 TYR 48 -52.943 -7.626 32.699 309 HH TYR 48 HH TYR 48 -52.898 -10.046 32.753 310 H MET 49 H MET 49 -45.562 -4.721 32.058 311 HA MET 49 HA MET 49 -45.788 -1.807 31.859 312 HB2 MET 49 HB2 MET 49 -43.347 -3.595 31.781 313 HB3 MET 49 HB3 MET 49 -43.313 -1.840 31.691 314 HG2 MET 49 HG2 MET 49 -44.326 -3.460 34.016 315 HG3 MET 49 HG3 MET 49 -42.760 -2.660 33.919 316 HE1 MET 49 HE1 MET 49 -43.644 1.103 34.067 317 HE2 MET 49 HE2 MET 49 -43.237 0.102 32.672 318 HE3 MET 49 HE3 MET 49 -42.363 -0.104 34.191 319 HA PRO 50 HA PRO 50 -45.836 -1.766 27.362 320 HB2 PRO 50 HB2 PRO 50 -44.263 0.735 27.697 321 HB3 PRO 50 HB3 PRO 50 -45.770 0.464 26.815 322 HG2 PRO 50 HG2 PRO 50 -45.803 1.752 29.127 323 HG3 PRO 50 HG3 PRO 50 -47.067 0.568 28.742 324 HD2 PRO 50 HD2 PRO 50 -44.659 0.258 30.502 325 HD3 PRO 50 HD3 PRO 50 -46.331 -0.276 30.779 326 H LEU 51 H LEU 51 -44.535 -2.524 25.819 327 HA LEU 51 HA LEU 51 -41.747 -3.050 26.518 328 HB2 LEU 51 HB2 LEU 51 -43.406 -4.170 24.249 329 HB3 LEU 51 HB3 LEU 51 -41.808 -4.707 24.729 330 HG LEU 51 HG LEU 51 -44.265 -4.928 26.470 331 HD11 LEU 51 HD11 LEU 51 -44.508 -6.338 24.517 332 HD12 LEU 51 HD12 LEU 51 -44.173 -7.327 25.938 333 HD13 LEU 51 HD13 LEU 51 -42.895 -7.004 24.766 334 HD21 LEU 51 HD21 LEU 51 -41.509 -6.124 26.738 335 HD22 LEU 51 HD22 LEU 51 -42.879 -6.434 27.807 336 HD23 LEU 51 HD23 LEU 51 -42.173 -4.819 27.720 337 H MET 52 H MET 52 -40.508 -1.364 25.977 338 HA MET 52 HA MET 52 -40.422 -0.503 23.202 339 HB2 MET 52 HB2 MET 52 -40.369 1.928 23.973 340 HB3 MET 52 HB3 MET 52 -41.932 1.128 23.998 341 HG2 MET 52 HG2 MET 52 -41.626 0.749 26.443 342 HG3 MET 52 HG3 MET 52 -40.154 1.717 26.361 343 HE1 MET 52 HE1 MET 52 -40.937 3.489 28.143 344 HE2 MET 52 HE2 MET 52 -42.330 2.442 28.408 345 HE3 MET 52 HE3 MET 52 -42.561 4.177 28.175 346 H GLU 53 H GLU 53 -38.524 -1.935 23.637 347 HA GLU 53 HA GLU 53 -36.345 -0.596 25.070 348 HB2 GLU 53 HB2 GLU 53 -36.622 -3.446 24.123 349 HB3 GLU 53 HB3 GLU 53 -35.188 -2.792 24.901 350 HG2 GLU 53 HG2 GLU 53 -36.522 -2.303 26.908 351 HG3 GLU 53 HG3 GLU 53 -37.932 -3.010 26.123 352 H TYR 54 H TYR 54 -34.459 -0.050 24.108 353 HA TYR 54 HA TYR 54 -34.447 -0.213 21.178 354 HB2 TYR 54 HB2 TYR 54 -33.149 1.767 23.059 355 HB3 TYR 54 HB3 TYR 54 -32.817 1.711 21.330 356 HD1 TYR 54 HD1 TYR 54 -34.636 2.209 19.712 357 HD2 TYR 54 HD2 TYR 54 -35.142 2.783 23.898 358 HE1 TYR 54 HE1 TYR 54 -36.576 3.651 19.271 359 HE2 TYR 54 HE2 TYR 54 -37.089 4.226 23.468 360 HH TYR 54 HH TYR 54 -38.614 4.410 20.436 361 H LEU 55 H LEU 55 -33.246 -1.808 20.462 362 HA LEU 55 HA LEU 55 -30.964 -2.746 21.999 363 HB2 LEU 55 HB2 LEU 55 -32.233 -3.817 19.478 364 HB3 LEU 55 HB3 LEU 55 -30.893 -4.571 20.322 365 HG LEU 55 HG LEU 55 -33.664 -4.169 21.457 366 HD11 LEU 55 HD11 LEU 55 -32.290 -6.665 20.475 367 HD12 LEU 55 HD12 LEU 55 -33.631 -5.835 19.685 368 HD13 LEU 55 HD13 LEU 55 -33.868 -6.592 21.260 369 HD21 LEU 55 HD21 LEU 55 -31.255 -5.600 22.579 370 HD22 LEU 55 HD22 LEU 55 -32.876 -5.629 23.275 371 HD23 LEU 55 HD23 LEU 55 -31.975 -4.114 23.200 372 H HIS 56 H HIS 56 -29.069 -1.887 21.707 373 HA HIS 56 HA HIS 56 -28.489 -0.547 19.155 374 HB2 HIS 56 HB2 HIS 56 -27.487 -0.010 21.950 375 HB3 HIS 56 HB3 HIS 56 -26.761 0.715 20.520 376 HD1 HIS 56 HD1 HIS 56 -28.431 2.278 19.083 377 HD2 HIS 56 HD2 HIS 56 -29.637 1.320 22.943 378 HE1 HIS 56 HE1 HIS 56 -30.189 3.972 19.678 379 HE2 HIS 56 HE2 HIS 56 -30.741 3.504 22.095 380 H SER 57 H SER 57 -27.043 -1.390 17.898 381 HA SER 57 HA SER 57 -24.693 -2.673 19.057 382 HB2 SER 57 HB2 SER 57 -26.288 -4.481 18.439 383 HB3 SER 57 HB3 SER 57 -26.283 -3.884 16.777 384 HG SER 57 HG SER 57 -24.756 -5.686 17.537 385 H SER 58 H SER 58 -23.082 -1.450 18.375 386 HA SER 58 HA SER 58 -23.221 -0.206 15.732 387 HB2 SER 58 HB2 SER 58 -22.726 1.275 17.650 388 HB3 SER 58 HB3 SER 58 -21.310 0.297 18.034 389 HG SER 58 HG SER 58 -20.675 0.854 15.745 390 HA PRO 59 HA PRO 59 -20.061 -3.156 14.444 391 HB2 PRO 59 HB2 PRO 59 -20.030 -2.462 11.824 392 HB3 PRO 59 HB3 PRO 59 -21.271 -3.497 12.532 393 HG2 PRO 59 HG2 PRO 59 -21.431 -0.670 11.685 394 HG3 PRO 59 HG3 PRO 59 -22.707 -1.892 11.777 395 HD2 PRO 59 HD2 PRO 59 -22.204 0.180 13.625 396 HD3 PRO 59 HD3 PRO 59 -23.317 -1.186 13.831 397 H VAL 60 H VAL 60 -17.929 -2.953 13.219 398 HA VAL 60 HA VAL 60 -16.758 -0.321 13.834 399 HB VAL 60 HB VAL 60 -16.121 -2.074 15.457 400 HG11 VAL 60 HG11 VAL 60 -14.591 -3.863 14.844 401 HG12 VAL 60 HG12 VAL 60 -14.740 -3.406 13.145 402 HG13 VAL 60 HG13 VAL 60 -16.146 -4.014 14.019 403 HG21 VAL 60 HG21 VAL 60 -13.831 -1.035 13.797 404 HG22 VAL 60 HG22 VAL 60 -13.711 -1.657 15.444 405 HG23 VAL 60 HG23 VAL 60 -14.641 -0.195 15.121 406 H LEU 61 H LEU 61 -15.361 0.586 12.423 407 HA LEU 61 HA LEU 61 -15.350 -0.513 9.732 408 HB2 LEU 61 HB2 LEU 61 -14.293 1.806 9.198 409 HB3 LEU 61 HB3 LEU 61 -16.000 1.668 9.504 410 HG LEU 61 HG LEU 61 -14.815 3.716 10.415 411 HD11 LEU 61 HD11 LEU 61 -17.033 3.160 11.152 412 HD12 LEU 61 HD12 LEU 61 -16.081 3.787 12.497 413 HD13 LEU 61 HD13 LEU 61 -16.387 2.054 12.363 414 HD21 LEU 61 HD21 LEU 61 -13.718 3.525 12.588 415 HD22 LEU 61 HD22 LEU 61 -12.823 2.704 11.306 416 HD23 LEU 61 HD23 LEU 61 -13.785 1.765 12.449 417 HA PRO 62 HA PRO 62 -11.087 -1.676 9.855 418 HB2 PRO 62 HB2 PRO 62 -10.168 -1.233 7.367 419 HB3 PRO 62 HB3 PRO 62 -11.282 -2.564 7.758 420 HG2 PRO 62 HG2 PRO 62 -11.841 0.063 6.466 421 HG3 PRO 62 HG3 PRO 62 -12.575 -1.521 6.158 422 HD2 PRO 62 HD2 PRO 62 -13.749 0.475 7.653 423 HD3 PRO 62 HD3 PRO 62 -14.135 -1.246 7.794 424 H THR 63 H THR 63 -8.904 -1.085 8.991 425 HA THR 63 HA THR 63 -8.301 1.762 8.969 426 HB THR 63 HB THR 63 -7.001 -0.241 10.851 427 HG1 THR 63 HG1 THR 63 -9.109 0.702 11.469 428 HG21 THR 63 HG21 THR 63 -5.673 1.633 11.634 429 HG22 THR 63 HG22 THR 63 -6.462 2.692 10.463 430 HG23 THR 63 HG23 THR 63 -5.432 1.374 9.905 431 H ALA 64 H ALA 64 -7.259 1.892 7.033 432 HA ALA 64 HA ALA 64 -5.825 -0.376 5.975 433 HB1 ALA 64 HB1 ALA 64 -6.030 2.433 4.910 434 HB2 ALA 64 HB2 ALA 64 -7.140 1.113 4.540 435 HB3 ALA 64 HB3 ALA 64 -5.452 1.017 4.033 436 H ARG 65 H ARG 65 -3.877 -0.872 6.755 437 HA ARG 65 HA ARG 65 -1.944 1.282 7.112 438 HB2 ARG 65 HB2 ARG 65 -2.775 -0.699 9.196 439 HB3 ARG 65 HB3 ARG 65 -1.099 -0.169 9.144 440 HG2 ARG 65 HG2 ARG 65 -3.503 1.623 9.424 441 HG3 ARG 65 HG3 ARG 65 -2.416 1.138 10.728 442 HD2 ARG 65 HD2 ARG 65 -0.575 2.286 9.696 443 HD3 ARG 65 HD3 ARG 65 -1.531 2.621 8.256 444 HE ARG 65 HE ARG 65 -2.382 3.741 10.831 445 HH11 ARG 65 HH11 ARG 65 -1.094 4.238 7.592 446 HH12 ARG 65 HH12 ARG 65 -1.375 5.953 7.606 447 HH21 ARG 65 HH21 ARG 65 -2.736 6.001 10.846 448 HH22 ARG 65 HH22 ARG 65 -2.285 6.959 9.466 449 H PHE 66 H PHE 66 0.053 0.804 6.488 450 HA PHE 66 HA PHE 66 0.909 -1.881 5.983 451 HB2 PHE 66 HB2 PHE 66 1.197 -1.673 3.573 452 HB3 PHE 66 HB3 PHE 66 -0.494 -1.487 3.996 453 HD1 PHE 66 HD2 PHE 66 -1.272 1.054 4.264 454 HD2 PHE 66 HD1 PHE 66 2.120 -0.255 2.055 455 HE1 PHE 66 HE2 PHE 66 -1.362 3.102 2.919 456 HE2 PHE 66 HE1 PHE 66 2.027 1.793 0.702 457 HZ PHE 66 HZ PHE 66 0.282 3.472 1.135 458 H THR 67 H THR 67 3.163 -1.979 5.330 459 HA THR 67 HA THR 67 4.624 0.547 5.624 460 HB THR 67 HB THR 67 5.228 -1.956 7.231 461 HG1 THR 67 HG1 THR 67 3.721 0.275 7.716 462 HG21 THR 67 HG21 THR 67 6.955 -0.637 8.336 463 HG22 THR 67 HG22 THR 67 6.592 0.740 7.293 464 HG23 THR 67 HG23 THR 67 7.274 -0.734 6.603 465 H SER 68 H SER 68 6.167 0.752 4.181 466 HA SER 68 HA SER 68 7.038 -1.559 2.597 467 HB2 SER 68 HB2 SER 68 7.439 1.408 2.100 468 HB3 SER 68 HB3 SER 68 7.834 0.105 0.980 469 HG SER 68 HG SER 68 5.752 1.242 0.675 470 H ASP 69 H ASP 69 9.471 -1.187 1.831 471 HA ASP 69 HA ASP 69 11.139 -1.064 4.154 472 HB2 ASP 69 HB2 ASP 69 11.746 -1.320 1.215 473 HB3 ASP 69 HB3 ASP 69 13.031 -1.156 2.415 474 H ILE 70 H ILE 70 10.979 0.978 1.220 475 HA ILE 70 HA ILE 70 11.451 3.276 2.983 476 HB ILE 70 HB ILE 70 12.525 4.483 1.054 477 HG12 ILE 70 HG12 ILE 70 13.724 2.422 -0.382 478 HG13 ILE 70 HG13 ILE 70 12.032 1.944 -0.288 479 HG21 ILE 70 HG21 ILE 70 14.738 3.488 1.379 480 HG22 ILE 70 HG22 ILE 70 13.981 2.093 2.146 481 HG23 ILE 70 HG23 ILE 70 13.851 3.686 2.891 482 HD11 ILE 70 HD11 ILE 70 11.361 4.060 -1.274 483 HD12 ILE 70 HD12 ILE 70 12.522 3.227 -2.309 484 HD13 ILE 70 HD13 ILE 70 13.045 4.589 -1.319 485 H THR 71 H THR 71 10.054 4.937 2.809 486 HA THR 71 HA THR 71 8.142 4.941 0.599 487 HB THR 71 HB THR 71 7.114 6.869 1.865 488 HG1 THR 71 HG1 THR 71 8.027 6.549 4.257 489 HG21 THR 71 HG21 THR 71 6.165 5.474 3.656 490 HG22 THR 71 HG22 THR 71 7.426 4.272 3.380 491 HG23 THR 71 HG23 THR 71 6.235 4.605 2.121 492 H GLU 72 H GLU 72 11.124 6.155 1.418 493 HA GLU 72 HA GLU 72 11.311 7.878 -0.854 494 HB2 GLU 72 HB2 GLU 72 10.306 9.338 0.973 495 HB3 GLU 72 HB3 GLU 72 11.801 9.102 1.866 496 HG2 GLU 72 HG2 GLU 72 13.034 10.112 -0.046 497 HG3 GLU 72 HG3 GLU 72 11.481 10.465 -0.803 498 H GLY 73 H GLY 73 13.461 8.067 -1.463 499 HA2 GLY 73 HA2 GLY 73 15.841 7.977 -0.387 500 HA3 GLY 73 HA3 GLY 73 15.334 6.335 0.003 501 H PHE 74 H PHE 74 17.222 5.689 -1.400 502 HA PHE 74 HA PHE 74 16.767 6.128 -4.230 503 HB2 PHE 74 HB2 PHE 74 18.818 4.814 -4.608 504 HB3 PHE 74 HB3 PHE 74 19.091 6.148 -3.506 505 HD1 PHE 74 HD2 PHE 74 18.968 2.503 -3.856 506 HD2 PHE 74 HD1 PHE 74 19.697 5.742 -1.195 507 HE1 PHE 74 HE2 PHE 74 20.065 0.959 -2.290 508 HE2 PHE 74 HE1 PHE 74 20.808 4.203 0.371 509 HZ PHE 74 HZ PHE 74 20.989 1.809 -0.174 510 H ALA 75 H ALA 75 16.077 4.659 -5.665 511 HA ALA 75 HA ALA 75 14.285 2.684 -5.142 512 HB1 ALA 75 HB1 ALA 75 14.690 3.688 -7.350 513 HB2 ALA 75 HB2 ALA 75 14.614 1.926 -7.425 514 HB3 ALA 75 HB3 ALA 75 16.175 2.746 -7.486 515 HA PRO 76 HA PRO 76 17.018 -0.593 -3.677 516 HB2 PRO 76 HB2 PRO 76 15.292 -1.724 -1.982 517 HB3 PRO 76 HB3 PRO 76 16.052 -0.170 -1.621 518 HG2 PRO 76 HG2 PRO 76 13.274 -0.768 -2.462 519 HG3 PRO 76 HG3 PRO 76 13.890 0.563 -1.469 520 HD2 PRO 76 HD2 PRO 76 13.255 0.619 -4.246 521 HD3 PRO 76 HD3 PRO 76 13.996 1.912 -3.280 522 H LEU 77 H LEU 77 16.751 -3.013 -3.411 523 HA LEU 77 HA LEU 77 15.322 -4.001 -5.779 524 HB2 LEU 77 HB2 LEU 77 17.881 -4.142 -5.573 525 HB3 LEU 77 HB3 LEU 77 17.603 -5.368 -4.356 526 HG LEU 77 HG LEU 77 16.274 -5.809 -6.968 527 HD11 LEU 77 HD11 LEU 77 18.440 -4.944 -7.681 528 HD12 LEU 77 HD12 LEU 77 18.328 -6.679 -7.980 529 HD13 LEU 77 HD13 LEU 77 19.259 -6.079 -6.607 530 HD21 LEU 77 HD21 LEU 77 16.097 -7.443 -5.168 531 HD22 LEU 77 HD22 LEU 77 17.855 -7.573 -5.096 532 HD23 LEU 77 HD23 LEU 77 16.990 -8.112 -6.534 533 H SER 78 H SER 78 13.639 -5.158 -5.446 534 HA SER 78 HA SER 78 11.897 -6.231 -4.538 535 HB2 SER 78 HB2 SER 78 14.013 -7.675 -2.935 536 HB3 SER 78 HB3 SER 78 12.350 -8.209 -3.156 537 HG SER 78 HG SER 78 14.388 -8.768 -4.678 538 H VAL 79 H VAL 79 10.682 -4.822 -3.576 539 HA VAL 79 HA VAL 79 11.180 -4.127 -0.800 540 HB VAL 79 HB VAL 79 8.941 -2.856 -1.093 541 HG11 VAL 79 HG11 VAL 79 10.141 -0.935 -2.042 542 HG12 VAL 79 HG12 VAL 79 11.447 -2.015 -2.536 543 HG13 VAL 79 HG13 VAL 79 11.094 -1.782 -0.823 544 HG21 VAL 79 HG21 VAL 79 9.703 -3.253 -3.986 545 HG22 VAL 79 HG22 VAL 79 8.498 -2.108 -3.395 546 HG23 VAL 79 HG23 VAL 79 8.235 -3.842 -3.202 547 H ARG 80 H ARG 80 10.210 -4.969 0.876 548 HA ARG 80 HA ARG 80 8.333 -7.169 0.426 549 HB2 ARG 80 HB2 ARG 80 10.430 -7.365 1.894 550 HB3 ARG 80 HB3 ARG 80 9.581 -6.343 3.046 551 HG2 ARG 80 HG2 ARG 80 7.816 -7.997 3.243 552 HG3 ARG 80 HG3 ARG 80 8.624 -9.019 2.052 553 HD2 ARG 80 HD2 ARG 80 9.649 -8.233 4.778 554 HD3 ARG 80 HD3 ARG 80 9.102 -9.828 4.270 555 HE ARG 80 HE ARG 80 11.591 -8.511 3.391 556 HH11 ARG 80 HH11 ARG 80 9.649 -11.432 3.733 557 HH12 ARG 80 HH12 ARG 80 10.966 -12.502 3.389 558 HH21 ARG 80 HH21 ARG 80 13.324 -9.928 2.932 559 HH22 ARG 80 HH22 ARG 80 13.062 -11.645 2.924 560 H PHE 81 H PHE 81 6.357 -6.310 0.136 561 HA PHE 81 HA PHE 81 5.450 -4.060 1.651 562 HB2 PHE 81 HB2 PHE 81 3.256 -4.439 0.486 563 HB3 PHE 81 HB3 PHE 81 4.619 -4.207 -0.590 564 HD1 PHE 81 HD2 PHE 81 5.533 -6.171 -1.855 565 HD2 PHE 81 HD1 PHE 81 1.948 -6.411 0.432 566 HE1 PHE 81 HE2 PHE 81 4.890 -8.204 -3.080 567 HE2 PHE 81 HE1 PHE 81 1.299 -8.440 -0.794 568 HZ PHE 81 HZ PHE 81 2.771 -9.341 -2.551 569 H LYS 82 H LYS 82 4.553 -4.029 3.503 570 HA LYS 82 HA LYS 82 3.607 -6.541 4.732 571 HB2 LYS 82 HB2 LYS 82 4.736 -4.116 6.163 572 HB3 LYS 82 HB3 LYS 82 4.357 -5.678 6.869 573 HG2 LYS 82 HG2 LYS 82 6.180 -6.713 5.700 574 HG3 LYS 82 HG3 LYS 82 6.499 -5.225 4.808 575 HD2 LYS 82 HD2 LYS 82 6.962 -4.098 6.972 576 HD3 LYS 82 HD3 LYS 82 6.789 -5.660 7.775 577 HE2 LYS 82 HE2 LYS 82 9.123 -5.263 7.430 578 HE3 LYS 82 HE3 LYS 82 8.616 -6.532 6.317 579 HZ1 LYS 82 HZ1 LYS 82 8.999 -3.667 5.622 580 HZ2 LYS 82 HZ2 LYS 82 8.499 -4.869 4.545 581 HZ3 LYS 82 HZ3 LYS 82 10.054 -4.931 5.223 582 H ASP 83 H ASP 83 1.685 -6.345 6.034 583 HA ASP 83 HA ASP 83 0.478 -3.680 5.997 584 HB2 ASP 83 HB2 ASP 83 -1.642 -4.404 5.361 585 HB3 ASP 83 HB3 ASP 83 -0.570 -5.287 4.288 586 H PHE 84 H PHE 84 -0.599 -3.054 7.743 587 HA PHE 84 HA PHE 84 -0.738 -4.892 10.041 588 HB2 PHE 84 HB2 PHE 84 0.024 -1.955 10.039 589 HB3 PHE 84 HB3 PHE 84 -0.278 -2.902 11.491 590 HD1 PHE 84 HD2 PHE 84 1.185 -4.994 11.837 591 HD2 PHE 84 HD1 PHE 84 2.172 -1.857 9.139 592 HE1 PHE 84 HE2 PHE 84 3.533 -5.721 11.854 593 HE2 PHE 84 HE1 PHE 84 4.521 -2.586 9.148 594 HZ PHE 84 HZ PHE 84 5.203 -4.520 10.507 595 H SER 85 H SER 85 -2.575 -4.143 7.929 596 HA SER 85 HA SER 85 -4.550 -2.349 8.540 597 HB2 SER 85 HB2 SER 85 -4.944 -5.037 7.234 598 HB3 SER 85 HB3 SER 85 -5.977 -3.618 7.058 599 HG SER 85 HG SER 85 -3.521 -4.186 5.910 600 H GLU 86 H GLU 86 -6.261 -2.240 9.868 601 HA GLU 86 HA GLU 86 -6.647 -4.428 11.795 602 HB2 GLU 86 HB2 GLU 86 -5.840 -2.291 12.745 603 HB3 GLU 86 HB3 GLU 86 -7.169 -1.442 11.988 604 HG2 GLU 86 HG2 GLU 86 -7.561 -1.708 14.350 605 HG3 GLU 86 HG3 GLU 86 -8.738 -2.639 13.434 606 H ASN 87 H ASN 87 -8.699 -5.272 12.014 607 HA ASN 87 HA ASN 87 -10.925 -5.671 11.764 608 HB2 ASN 87 HB2 ASN 87 -10.993 -2.695 11.251 609 HB3 ASN 87 HB3 ASN 87 -12.439 -3.688 11.403 610 HD21 ASN 87 HD21 ASN 87 -11.066 -1.470 12.988 611 HD22 ASN 87 HD22 ASN 87 -11.109 -2.045 14.615 612 H ALA 88 H ALA 88 -9.324 -6.259 9.572 613 HA ALA 88 HA ALA 88 -10.937 -5.390 7.279 614 HB1 ALA 88 HB1 ALA 88 -8.117 -6.446 7.312 615 HB2 ALA 88 HB2 ALA 88 -8.582 -4.750 7.177 616 HB3 ALA 88 HB3 ALA 88 -9.002 -5.887 5.894 617 H THR 89 H THR 89 -11.999 -6.787 6.109 618 HA THR 89 HA THR 89 -12.045 -9.594 6.729 619 HB THR 89 HB THR 89 -13.320 -8.252 4.335 620 HG1 THR 89 HG1 THR 89 -14.837 -8.541 6.660 621 HG21 THR 89 HG21 THR 89 -15.011 -9.986 4.580 622 HG22 THR 89 HG22 THR 89 -14.209 -10.600 6.026 623 HG23 THR 89 HG23 THR 89 -13.414 -10.722 4.456 624 H SER 90 H SER 90 -10.999 -7.515 4.037 625 HA SER 90 HA SER 90 -9.060 -9.525 3.200 626 HB2 SER 90 HB2 SER 90 -11.083 -8.280 1.311 627 HB3 SER 90 HB3 SER 90 -9.731 -9.307 0.829 628 HG SER 90 HG SER 90 -11.155 -10.548 2.731 629 H ARG 91 H ARG 91 -7.390 -8.656 1.834 630 HA ARG 91 HA ARG 91 -7.095 -5.729 1.957 631 HB2 ARG 91 HB2 ARG 91 -5.037 -7.804 1.170 632 HB3 ARG 91 HB3 ARG 91 -4.760 -6.079 1.246 633 HG2 ARG 91 HG2 ARG 91 -3.826 -6.667 3.205 634 HG3 ARG 91 HG3 ARG 91 -5.488 -6.477 3.771 635 HD2 ARG 91 HD2 ARG 91 -5.835 -8.747 3.928 636 HD3 ARG 91 HD3 ARG 91 -4.622 -9.117 2.703 637 HE ARG 91 HE ARG 91 -3.431 -7.993 5.031 638 HH11 ARG 91 HH11 ARG 91 -4.848 -10.993 3.846 639 HH12 ARG 91 HH12 ARG 91 -3.805 -12.003 4.799 640 HH21 ARG 91 HH21 ARG 91 -2.069 -9.306 6.254 641 HH22 ARG 91 HH22 ARG 91 -2.235 -11.034 6.188 642 H LEU 92 H LEU 92 -6.552 -4.566 0.077 643 HA LEU 92 HA LEU 92 -6.464 -6.009 -2.461 644 HB2 LEU 92 HB2 LEU 92 -8.766 -4.774 -1.816 645 HB3 LEU 92 HB3 LEU 92 -7.887 -3.382 -2.406 646 HG LEU 92 HG LEU 92 -8.461 -5.880 -4.020 647 HD11 LEU 92 HD11 LEU 92 -10.044 -4.454 -5.235 648 HD12 LEU 92 HD12 LEU 92 -9.747 -3.157 -4.077 649 HD13 LEU 92 HD13 LEU 92 -10.493 -4.664 -3.542 650 HD21 LEU 92 HD21 LEU 92 -6.432 -4.743 -4.780 651 HD22 LEU 92 HD22 LEU 92 -7.321 -3.224 -4.894 652 HD23 LEU 92 HD23 LEU 92 -7.741 -4.574 -5.949 653 H TRP 93 H TRP 93 -4.467 -5.560 -3.131 654 HA TRP 93 HA TRP 93 -3.253 -3.013 -2.444 655 HB2 TRP 93 HB2 TRP 93 -2.144 -5.472 -3.813 656 HB3 TRP 93 HB3 TRP 93 -1.218 -3.999 -3.562 657 HD1 TRP 93 HD1 TRP 93 -2.377 -7.131 -1.778 658 HE1 TRP 93 HE1 TRP 93 -1.317 -7.211 0.569 659 HE3 TRP 93 HE3 TRP 93 -0.479 -2.382 -1.575 660 HZ2 TRP 93 HZ2 TRP 93 0.099 -5.483 2.287 661 HZ3 TRP 93 HZ3 TRP 93 0.711 -1.679 0.459 662 HH2 TRP 93 HH2 TRP 93 0.992 -3.196 2.349 663 H MET 94 H MET 94 -3.664 -1.377 -3.644 664 HA MET 94 HA MET 94 -4.209 -1.692 -6.507 665 HB2 MET 94 HB2 MET 94 -4.929 0.395 -4.469 666 HB3 MET 94 HB3 MET 94 -4.928 0.798 -6.176 667 HG2 MET 94 HG2 MET 94 -6.503 -1.503 -5.074 668 HG3 MET 94 HG3 MET 94 -7.142 0.140 -5.142 669 HE1 MET 94 HE1 MET 94 -9.060 -1.548 -8.102 670 HE2 MET 94 HE2 MET 94 -9.211 -0.517 -6.678 671 HE3 MET 94 HE3 MET 94 -8.702 -2.197 -6.500 672 H PHE 95 H PHE 95 -2.156 -1.768 -7.370 673 HA PHE 95 HA PHE 95 -0.281 0.362 -6.763 674 HB2 PHE 95 HB2 PHE 95 0.396 -2.048 -7.226 675 HB3 PHE 95 HB3 PHE 95 -0.014 -1.754 -8.910 676 HD1 PHE 95 HD1 PHE 95 2.095 -0.359 -6.165 677 HD2 PHE 95 HD2 PHE 95 1.636 -1.002 -10.349 678 HE1 PHE 95 HE1 PHE 95 4.352 0.545 -6.549 679 HE2 PHE 95 HE2 PHE 95 3.892 -0.100 -10.737 680 HZ PHE 95 HZ PHE 95 5.252 0.675 -8.837 681 H GLY 96 H GLY 96 -2.816 -0.272 -8.974 682 HA2 GLY 96 HA2 GLY 96 -3.814 1.202 -10.468 683 HA3 GLY 96 HA3 GLY 96 -2.451 2.293 -10.258 684 H ASP 97 H ASP 97 -1.655 -0.935 -10.975 685 HA ASP 97 HA ASP 97 -1.217 -0.281 -13.793 686 HB2 ASP 97 HB2 ASP 97 0.879 0.205 -12.573 687 HB3 ASP 97 HB3 ASP 97 0.914 -1.454 -11.989 688 H GLY 98 H GLY 98 -1.812 -1.829 -15.137 689 HA2 GLY 98 HA2 GLY 98 -2.278 -3.910 -16.005 690 HA3 GLY 98 HA3 GLY 98 -1.409 -4.614 -14.646 691 H ASN 99 H ASN 99 -2.691 -6.109 -13.838 692 HA ASN 99 HA ASN 99 -5.496 -5.481 -13.268 693 HB2 ASN 99 HB2 ASN 99 -4.024 -8.103 -12.850 694 HB3 ASN 99 HB3 ASN 99 -5.751 -7.837 -12.637 695 HD21 ASN 99 HD21 ASN 99 -3.219 -8.484 -14.826 696 HD22 ASN 99 HD22 ASN 99 -4.189 -8.654 -16.246 697 H THR 100 H THR 100 -6.281 -5.449 -11.170 698 HA THR 100 HA THR 100 -4.262 -5.715 -9.055 699 HB THR 100 HB THR 100 -6.048 -4.524 -7.617 700 HG1 THR 100 HG1 THR 100 -6.860 -3.395 -10.072 701 HG21 THR 100 HG21 THR 100 -3.903 -3.551 -8.289 702 HG22 THR 100 HG22 THR 100 -5.188 -2.342 -8.293 703 HG23 THR 100 HG23 THR 100 -4.618 -3.029 -9.815 704 H SER 101 H SER 101 -5.349 -6.405 -6.890 705 HA SER 101 HA SER 101 -5.890 -8.225 -5.671 706 HB2 SER 101 HB2 SER 101 -8.107 -8.519 -7.711 707 HB3 SER 101 HB3 SER 101 -8.014 -9.404 -6.191 708 HG SER 101 HG SER 101 -9.069 -7.037 -6.601 709 H ASP 102 H ASP 102 -3.859 -8.533 -7.581 710 HA ASP 102 HA ASP 102 -4.117 -11.131 -8.810 711 HB2 ASP 102 HB2 ASP 102 -1.960 -9.067 -8.663 712 HB3 ASP 102 HB3 ASP 102 -1.512 -10.719 -9.064 713 H SER 103 H SER 103 -2.203 -12.673 -8.456 714 HA SER 103 HA SER 103 -2.055 -13.500 -5.726 715 HB2 SER 103 HB2 SER 103 -0.359 -14.403 -8.073 716 HB3 SER 103 HB3 SER 103 -0.641 -15.284 -6.573 717 HG SER 103 HG SER 103 -2.586 -14.633 -8.547 718 HA PRO 104 HA PRO 104 1.225 -10.757 -4.477 719 HB2 PRO 104 HB2 PRO 104 1.834 -12.788 -2.414 720 HB3 PRO 104 HB3 PRO 104 1.373 -11.095 -2.222 721 HG2 PRO 104 HG2 PRO 104 -0.347 -13.049 -1.643 722 HG3 PRO 104 HG3 PRO 104 -0.898 -11.553 -2.423 723 HD2 PRO 104 HD2 PRO 104 -0.350 -14.235 -3.645 724 HD3 PRO 104 HD3 PRO 104 -1.711 -13.127 -3.935 725 H SER 105 H SER 105 2.728 -10.807 -5.994 726 HA SER 105 HA SER 105 4.762 -12.926 -5.923 727 HB2 SER 105 HB2 SER 105 3.801 -11.348 -8.327 728 HB3 SER 105 HB3 SER 105 5.036 -12.606 -8.347 729 HG SER 105 HG SER 105 2.251 -12.826 -8.038 730 HA PRO 106 HA PRO 106 7.531 -9.453 -5.243 731 HB2 PRO 106 HB2 PRO 106 9.796 -11.190 -5.676 732 HB3 PRO 106 HB3 PRO 106 9.154 -10.581 -4.150 733 HG2 PRO 106 HG2 PRO 106 9.066 -13.211 -4.888 734 HG3 PRO 106 HG3 PRO 106 7.908 -12.457 -3.778 735 HD2 PRO 106 HD2 PRO 106 7.622 -13.042 -6.706 736 HD3 PRO 106 HD3 PRO 106 6.448 -13.280 -5.390 737 H LEU 107 H LEU 107 6.535 -9.672 -7.917 738 HA LEU 107 HA LEU 107 8.860 -9.270 -9.642 739 HB2 LEU 107 HB2 LEU 107 5.947 -9.729 -10.127 740 HB3 LEU 107 HB3 LEU 107 6.872 -8.882 -11.350 741 HG LEU 107 HG LEU 107 8.458 -10.897 -11.315 742 HD11 LEU 107 HD11 LEU 107 7.696 -11.938 -9.254 743 HD12 LEU 107 HD12 LEU 107 7.470 -13.023 -10.625 744 HD13 LEU 107 HD13 LEU 107 6.089 -12.163 -9.947 745 HD21 LEU 107 HD21 LEU 107 6.951 -10.408 -13.147 746 HD22 LEU 107 HD22 LEU 107 5.633 -11.219 -12.301 747 HD23 LEU 107 HD23 LEU 107 7.028 -12.145 -12.855 748 H HIS 108 H HIS 108 7.665 -7.409 -7.467 749 HA HIS 108 HA HIS 108 7.785 -5.012 -9.150 750 HB2 HIS 108 HB2 HIS 108 6.169 -5.573 -6.702 751 HB3 HIS 108 HB3 HIS 108 6.763 -3.933 -6.944 752 HD1 HIS 108 HD1 HIS 108 4.053 -6.169 -7.910 753 HD2 HIS 108 HD2 HIS 108 5.924 -2.815 -9.510 754 HE1 HIS 108 HE1 HIS 108 2.489 -5.297 -9.681 755 HE2 HIS 108 HE2 HIS 108 3.770 -3.433 -10.799 756 H THR 109 H THR 109 9.920 -4.876 -9.204 757 HA THR 109 HA THR 109 11.284 -4.144 -6.702 758 HB THR 109 HB THR 109 12.361 -5.617 -9.123 759 HG1 THR 109 HG1 THR 109 11.568 -7.116 -7.785 760 HG21 THR 109 HG21 THR 109 14.540 -5.650 -8.018 761 HG22 THR 109 HG22 THR 109 13.916 -4.605 -6.740 762 HG23 THR 109 HG23 THR 109 14.044 -4.000 -8.394 763 H PHE 110 H PHE 110 12.510 -2.280 -6.785 764 HA PHE 110 HA PHE 110 11.671 -0.497 -8.918 765 HB2 PHE 110 HB2 PHE 110 13.028 0.112 -6.281 766 HB3 PHE 110 HB3 PHE 110 12.437 1.309 -7.423 767 HD1 PHE 110 HD1 PHE 110 9.814 -0.399 -8.019 768 HD2 PHE 110 HD2 PHE 110 11.710 1.020 -4.480 769 HE1 PHE 110 HE1 PHE 110 7.642 -0.373 -6.866 770 HE2 PHE 110 HE2 PHE 110 9.540 1.041 -3.326 771 HZ PHE 110 HZ PHE 110 7.503 0.343 -4.519 772 H PHE 111 H PHE 111 12.984 -1.101 -10.585 773 HA PHE 111 HA PHE 111 15.878 -0.957 -10.286 774 HB2 PHE 111 HB2 PHE 111 14.205 -1.506 -12.754 775 HB3 PHE 111 HB3 PHE 111 15.955 -1.599 -12.676 776 HD1 PHE 111 HD1 PHE 111 16.919 -3.316 -10.939 777 HD2 PHE 111 HD2 PHE 111 12.945 -3.395 -12.463 778 HE1 PHE 111 HE1 PHE 111 16.765 -5.717 -10.416 779 HE2 PHE 111 HE2 PHE 111 12.783 -5.790 -11.934 780 HZ PHE 111 HZ PHE 111 14.695 -6.955 -10.914 781 H ASN 112 H ASN 112 13.239 0.936 -11.503 782 HA ASN 112 HA ASN 112 15.112 2.881 -12.678 783 HB2 ASN 112 HB2 ASN 112 12.326 2.127 -13.597 784 HB3 ASN 112 HB3 ASN 112 13.208 3.523 -14.197 785 HD21 ASN 112 HD21 ASN 112 15.779 2.195 -14.264 786 HD22 ASN 112 HD22 ASN 112 15.722 1.075 -15.578 787 H GLU 113 H GLU 113 15.063 4.820 -11.777 788 HA GLU 113 HA GLU 113 13.582 5.262 -9.404 789 HB2 GLU 113 HB2 GLU 113 15.147 7.304 -10.995 790 HB3 GLU 113 HB3 GLU 113 14.641 7.458 -9.320 791 HG2 GLU 113 HG2 GLU 113 16.748 6.798 -8.932 792 HG3 GLU 113 HG3 GLU 113 16.053 5.188 -9.148 793 H GLY 114 H GLY 114 12.116 6.897 -8.881 794 HA2 GLY 114 HA2 GLY 114 10.879 8.826 -10.208 795 HA3 GLY 114 HA3 GLY 114 10.194 7.426 -11.013 796 H GLU 115 H GLU 115 8.222 8.538 -10.184 797 HA GLU 115 HA GLU 115 7.659 8.142 -7.355 798 HB2 GLU 115 HB2 GLU 115 7.004 10.240 -8.422 799 HB3 GLU 115 HB3 GLU 115 6.042 9.363 -9.601 800 HG2 GLU 115 HG2 GLU 115 4.649 8.520 -7.679 801 HG3 GLU 115 HG3 GLU 115 5.523 9.648 -6.645 802 H TYR 116 H TYR 116 6.780 6.342 -6.653 803 HA TYR 116 HA TYR 116 5.015 4.771 -8.432 804 HB2 TYR 116 HB2 TYR 116 6.129 3.666 -5.871 805 HB3 TYR 116 HB3 TYR 116 5.651 2.810 -7.329 806 HD1 TYR 116 HD1 TYR 116 7.215 2.765 -9.285 807 HD2 TYR 116 HD2 TYR 116 8.330 4.419 -5.536 808 HE1 TYR 116 HE1 TYR 116 9.582 2.609 -9.925 809 HE2 TYR 116 HE2 TYR 116 10.693 4.277 -6.163 810 HH TYR 116 HH TYR 116 11.710 3.563 -9.376 811 H ILE 117 H ILE 117 2.941 4.265 -7.621 812 HA ILE 117 HA ILE 117 2.350 5.475 -5.003 813 HB ILE 117 HB ILE 117 0.243 5.080 -7.135 814 HG12 ILE 117 HG12 ILE 117 1.673 7.672 -6.479 815 HG13 ILE 117 HG13 ILE 117 2.045 6.691 -7.890 816 HG21 ILE 117 HG21 ILE 117 -0.559 5.235 -4.849 817 HG22 ILE 117 HG22 ILE 117 -0.970 6.714 -5.721 818 HG23 ILE 117 HG23 ILE 117 0.384 6.704 -4.588 819 HD11 ILE 117 HD11 ILE 117 -0.605 7.999 -7.310 820 HD12 ILE 117 HD12 ILE 117 -0.223 7.027 -8.730 821 HD13 ILE 117 HD13 ILE 117 0.602 8.563 -8.464 822 H VAL 118 H VAL 118 2.247 3.958 -3.561 823 HA VAL 118 HA VAL 118 0.945 1.409 -4.211 824 HB VAL 118 HB VAL 118 2.607 2.079 -1.768 825 HG11 VAL 118 HG11 VAL 118 0.994 0.303 -1.348 826 HG12 VAL 118 HG12 VAL 118 2.635 -0.343 -1.383 827 HG13 VAL 118 HG13 VAL 118 1.568 -0.570 -2.769 828 HG21 VAL 118 HG21 VAL 118 3.372 0.531 -4.239 829 HG22 VAL 118 HG22 VAL 118 4.348 0.665 -2.775 830 HG23 VAL 118 HG23 VAL 118 4.010 2.099 -3.746 831 H SER 119 H SER 119 -1.148 1.424 -3.802 832 HA SER 119 HA SER 119 -2.101 2.786 -1.379 833 HB2 SER 119 HB2 SER 119 -3.026 3.639 -3.536 834 HB3 SER 119 HB3 SER 119 -3.684 2.035 -3.844 835 HG SER 119 HG SER 119 -5.293 3.256 -2.932 836 H LEU 120 H LEU 120 -3.104 1.657 0.114 837 HA LEU 120 HA LEU 120 -3.774 -1.167 -0.396 838 HB2 LEU 120 HB2 LEU 120 -1.856 -0.893 1.144 839 HB3 LEU 120 HB3 LEU 120 -2.810 0.147 2.167 840 HG LEU 120 HG LEU 120 -2.357 -2.273 2.931 841 HD11 LEU 120 HD11 LEU 120 -4.481 -2.450 4.048 842 HD12 LEU 120 HD12 LEU 120 -5.166 -1.230 2.975 843 HD13 LEU 120 HD13 LEU 120 -3.862 -0.801 4.082 844 HD21 LEU 120 HD21 LEU 120 -4.602 -2.823 0.992 845 HD22 LEU 120 HD22 LEU 120 -3.993 -3.942 2.214 846 HD23 LEU 120 HD23 LEU 120 -2.951 -3.436 0.884 847 H ILE 121 H ILE 121 -5.921 -1.430 -0.453 848 HA ILE 121 HA ILE 121 -7.517 0.239 1.342 849 HB ILE 121 HB ILE 121 -8.109 1.040 -0.818 850 HG12 ILE 121 HG12 ILE 121 -10.274 -0.952 -0.116 851 HG13 ILE 121 HG13 ILE 121 -9.967 0.507 0.816 852 HG21 ILE 121 HG21 ILE 121 -7.218 -0.702 -2.225 853 HG22 ILE 121 HG22 ILE 121 -8.898 -0.390 -2.658 854 HG23 ILE 121 HG23 ILE 121 -8.485 -1.815 -1.706 855 HD11 ILE 121 HD11 ILE 121 -10.491 1.862 -1.141 856 HD12 ILE 121 HD12 ILE 121 -11.828 0.799 -0.700 857 HD13 ILE 121 HD13 ILE 121 -10.796 0.395 -2.073 858 H VAL 122 H VAL 122 -8.635 -0.811 2.771 859 HA VAL 122 HA VAL 122 -9.022 -3.697 2.378 860 HB VAL 122 HB VAL 122 -9.104 -3.853 4.918 861 HG11 VAL 122 HG11 VAL 122 -7.264 -4.729 3.618 862 HG12 VAL 122 HG12 VAL 122 -6.655 -3.985 5.099 863 HG13 VAL 122 HG13 VAL 122 -6.514 -3.134 3.560 864 HG21 VAL 122 HG21 VAL 122 -7.873 -2.166 6.181 865 HG22 VAL 122 HG22 VAL 122 -9.297 -1.461 5.415 866 HG23 VAL 122 HG23 VAL 122 -7.697 -1.189 4.721 867 H SER 123 H SER 123 -10.920 -4.600 3.452 868 HA SER 123 HA SER 123 -13.107 -2.653 3.499 869 HB2 SER 123 HB2 SER 123 -13.209 -5.315 2.058 870 HB3 SER 123 HB3 SER 123 -14.476 -4.090 2.104 871 HG SER 123 HG SER 123 -11.931 -3.402 1.148 872 H ASN 124 H ASN 124 -14.795 -3.195 4.789 873 HA ASN 124 HA ASN 124 -14.758 -5.741 6.239 874 HB2 ASN 124 HB2 ASN 124 -13.780 -3.936 7.696 875 HB3 ASN 124 HB3 ASN 124 -15.255 -3.008 7.491 876 HD21 ASN 124 HD21 ASN 124 -13.845 -5.874 8.924 877 HD22 ASN 124 HD22 ASN 124 -15.073 -6.115 10.117 878 H GLU 125 H GLU 125 -17.142 -5.781 7.406 879 HA GLU 125 HA GLU 125 -18.994 -5.479 5.211 880 HB2 GLU 125 HB2 GLU 125 -20.572 -6.643 6.737 881 HB3 GLU 125 HB3 GLU 125 -19.073 -7.520 6.483 882 HG2 GLU 125 HG2 GLU 125 -18.268 -6.575 8.680 883 HG3 GLU 125 HG3 GLU 125 -19.906 -5.974 8.930 884 H ASN 126 H ASN 126 -17.998 -3.567 7.808 885 HA ASN 126 HA ASN 126 -20.445 -2.000 7.982 886 HB2 ASN 126 HB2 ASN 126 -19.074 -2.400 10.009 887 HB3 ASN 126 HB3 ASN 126 -17.722 -1.564 9.255 888 HD21 ASN 126 HD21 ASN 126 -17.613 -0.086 10.890 889 HD22 ASN 126 HD22 ASN 126 -18.774 1.172 11.098 890 H ASP 127 H ASP 127 -17.038 -1.409 7.123 891 HA ASP 127 HA ASP 127 -17.844 0.627 5.191 892 HB2 ASP 127 HB2 ASP 127 -17.679 1.689 7.479 893 HB3 ASP 127 HB3 ASP 127 -15.985 1.233 7.512 894 H SER 128 H SER 128 -15.796 1.468 4.010 895 HA SER 128 HA SER 128 -13.562 -0.441 4.186 896 HB2 SER 128 HB2 SER 128 -13.248 -0.107 1.698 897 HB3 SER 128 HB3 SER 128 -14.701 -1.007 2.138 898 HG SER 128 HG SER 128 -14.941 1.761 1.904 899 H ASP 129 H ASP 129 -11.497 0.459 3.913 900 HA ASP 129 HA ASP 129 -11.342 3.393 3.813 901 HB2 ASP 129 HB2 ASP 129 -11.498 2.699 6.191 902 HB3 ASP 129 HB3 ASP 129 -10.098 1.664 5.972 903 H SER 130 H SER 130 -9.452 4.184 2.888 904 HA SER 130 HA SER 130 -7.425 2.184 2.153 905 HB2 SER 130 HB2 SER 130 -7.111 3.297 -0.000 906 HB3 SER 130 HB3 SER 130 -8.782 2.749 0.177 907 HG SER 130 HG SER 130 -9.151 5.019 0.965 908 H ALA 131 H ALA 131 -5.327 2.861 2.002 909 HA ALA 131 HA ALA 131 -4.668 5.635 2.706 910 HB1 ALA 131 HB1 ALA 131 -3.304 3.181 3.831 911 HB2 ALA 131 HB2 ALA 131 -4.341 4.289 4.730 912 HB3 ALA 131 HB3 ALA 131 -2.797 4.851 4.089 913 H SER 132 H SER 132 -3.090 6.479 1.436 914 HA SER 132 HA SER 132 -1.642 4.639 -0.333 915 HB2 SER 132 HB2 SER 132 -3.603 5.614 -1.518 916 HB3 SER 132 HB3 SER 132 -2.966 7.226 -1.199 917 HG SER 132 HG SER 132 -2.418 5.670 -3.228 918 H VAL 133 H VAL 133 0.431 5.320 -0.924 919 HA VAL 133 HA VAL 133 1.367 7.806 0.288 920 HB VAL 133 HB VAL 133 1.841 6.020 1.925 921 HG11 VAL 133 HG11 VAL 133 3.542 4.796 -0.226 922 HG12 VAL 133 HG12 VAL 133 2.091 4.105 0.503 923 HG13 VAL 133 HG13 VAL 133 3.549 4.324 1.473 924 HG21 VAL 133 HG21 VAL 133 3.319 7.934 1.874 925 HG22 VAL 133 HG22 VAL 133 4.315 7.163 0.638 926 HG23 VAL 133 HG23 VAL 133 4.230 6.472 2.259 927 H THR 134 H THR 134 2.861 8.869 -0.852 928 HA THR 134 HA THR 134 3.576 7.999 -3.492 929 HB THR 134 HB THR 134 4.634 10.381 -1.944 930 HG1 THR 134 HG1 THR 134 2.327 10.265 -3.636 931 HG21 THR 134 HG21 THR 134 5.836 9.870 -4.017 932 HG22 THR 134 HG22 THR 134 4.926 11.378 -4.155 933 HG23 THR 134 HG23 THR 134 4.315 9.904 -4.906 934 H ILE 135 H ILE 135 5.164 6.574 -3.806 935 HA ILE 135 HA ILE 135 7.425 6.444 -1.946 936 HB ILE 135 HB ILE 135 7.097 4.720 -4.409 937 HG12 ILE 135 HG12 ILE 135 5.027 4.479 -3.071 938 HG13 ILE 135 HG13 ILE 135 5.983 3.003 -3.080 939 HG21 ILE 135 HG21 ILE 135 8.561 4.294 -1.801 940 HG22 ILE 135 HG22 ILE 135 9.284 4.677 -3.364 941 HG23 ILE 135 HG23 ILE 135 8.474 3.129 -3.123 942 HD11 ILE 135 HD11 ILE 135 5.026 3.439 -0.893 943 HD12 ILE 135 HD12 ILE 135 5.841 5.000 -0.831 944 HD13 ILE 135 HD13 ILE 135 6.789 3.512 -0.833 945 H ARG 136 H ARG 136 9.280 7.480 -2.412 946 HA ARG 136 HA ARG 136 9.541 8.555 -5.131 947 HB2 ARG 136 HB2 ARG 136 10.115 9.822 -2.469 948 HB3 ARG 136 HB3 ARG 136 10.871 10.411 -3.945 949 HG2 ARG 136 HG2 ARG 136 9.004 11.427 -4.633 950 HG3 ARG 136 HG3 ARG 136 7.980 10.069 -4.164 951 HD2 ARG 136 HD2 ARG 136 9.121 12.128 -2.277 952 HD3 ARG 136 HD3 ARG 136 7.470 12.120 -2.900 953 HE ARG 136 HE ARG 136 7.808 9.650 -1.757 954 HH11 ARG 136 HH11 ARG 136 7.992 12.959 -0.626 955 HH12 ARG 136 HH12 ARG 136 7.588 12.558 1.013 956 HH21 ARG 136 HH21 ARG 136 7.265 9.108 0.375 957 HH22 ARG 136 HH22 ARG 136 7.169 10.350 1.592 958 H ALA 137 H ALA 137 11.076 7.600 -6.171 959 HA ALA 137 HA ALA 137 13.440 6.635 -4.728 960 HB1 ALA 137 HB1 ALA 137 13.948 5.349 -6.716 961 HB2 ALA 137 HB2 ALA 137 12.564 6.059 -7.549 962 HB3 ALA 137 HB3 ALA 137 12.311 4.998 -6.161 963 H LEU 138 H LEU 138 15.098 7.857 -4.713 964 HA LEU 138 HA LEU 138 15.254 10.188 -6.417 965 HB2 LEU 138 HB2 LEU 138 16.999 9.277 -4.128 966 HB3 LEU 138 HB3 LEU 138 17.124 10.826 -4.939 967 HG LEU 138 HG LEU 138 14.761 9.870 -3.315 968 HD11 LEU 138 HD11 LEU 138 16.684 10.400 -1.936 969 HD12 LEU 138 HD12 LEU 138 15.431 11.630 -1.754 970 HD13 LEU 138 HD13 LEU 138 16.855 11.959 -2.743 971 HD21 LEU 138 HD21 LEU 138 13.902 12.140 -3.603 972 HD22 LEU 138 HD22 LEU 138 14.065 11.314 -5.153 973 HD23 LEU 138 HD23 LEU 138 15.256 12.521 -4.668 974 H GLU 139 H GLU 139 16.908 10.675 -7.775 975 HA GLU 139 HA GLU 139 17.826 8.372 -9.192 976 HB2 GLU 139 HB2 GLU 139 18.338 9.813 -10.977 977 HB3 GLU 139 HB3 GLU 139 16.902 10.501 -10.242 978 HG2 GLU 139 HG2 GLU 139 19.717 11.503 -9.799 979 HG3 GLU 139 HG3 GLU 139 18.579 12.181 -10.956 980 H HIS 140 H HIS 140 19.972 7.988 -9.883 981 HA HIS 140 HA HIS 140 22.014 8.686 -7.980 982 HB2 HIS 140 HB2 HIS 140 23.530 7.469 -9.743 983 HB3 HIS 140 HB3 HIS 140 22.440 6.535 -8.737 984 HD1 HIS 140 HD1 HIS 140 22.851 7.750 -12.296 985 HD2 HIS 140 HD2 HIS 140 20.541 5.073 -10.101 986 HE1 HIS 140 HE1 HIS 140 21.582 6.393 -13.993 987 HE2 HIS 140 HE2 HIS 140 20.024 4.959 -12.632 988 H HIS 141 H HIS 141 22.616 10.718 -7.972 989 HA HIS 141 HA HIS 141 22.808 12.124 -10.516 990 HB2 HIS 141 HB2 HIS 141 23.042 14.210 -9.081 991 HB3 HIS 141 HB3 HIS 141 21.491 13.398 -9.060 992 HD1 HIS 141 HD1 HIS 141 20.531 12.882 -6.837 993 HD2 HIS 141 HD2 HIS 141 24.598 13.756 -6.618 994 HE1 HIS 141 HE1 HIS 141 21.071 13.016 -4.377 995 HE2 HIS 141 HE2 HIS 141 23.564 13.344 -4.275 996 H HIS 142 H HIS 142 24.575 12.689 -11.446 997 HA HIS 142 HA HIS 142 27.102 12.709 -9.955 998 HB2 HIS 142 HB2 HIS 142 26.455 11.071 -12.388 999 HB3 HIS 142 HB3 HIS 142 28.085 11.699 -12.180 1000 HD1 HIS 142 HD1 HIS 142 29.540 10.635 -10.378 1001 HD2 HIS 142 HD2 HIS 142 25.708 9.040 -10.584 1002 HE1 HIS 142 HE1 HIS 142 29.600 8.555 -8.969 1003 HE2 HIS 142 HE2 HIS 142 27.221 7.718 -8.949 1004 H HIS 143 H HIS 143 28.664 14.151 -10.809 1005 HA HIS 143 HA HIS 143 27.526 16.280 -12.359 1006 HB2 HIS 143 HB2 HIS 143 29.603 17.479 -12.087 1007 HB3 HIS 143 HB3 HIS 143 29.129 16.789 -10.549 1008 HD1 HIS 143 HD1 HIS 143 31.878 16.858 -13.028 1009 HD2 HIS 143 HD2 HIS 143 30.859 14.695 -9.616 1010 HE1 HIS 143 HE1 HIS 143 33.996 15.709 -12.291 1011 HE2 HIS 143 HE2 HIS 143 33.378 14.429 -10.208 1012 H HIS 144 H HIS 144 27.312 16.286 -14.453 1013 HA HIS 144 HA HIS 144 28.997 14.443 -15.985 1014 HB2 HIS 144 HB2 HIS 144 27.148 14.020 -17.478 1015 HB3 HIS 144 HB3 HIS 144 26.603 13.776 -15.831 1016 HD1 HIS 144 HD1 HIS 144 25.871 15.644 -18.910 1017 HD2 HIS 144 HD2 HIS 144 24.751 15.806 -14.897 1018 HE1 HIS 144 HE1 HIS 144 23.819 17.105 -18.835 1019 HE2 HIS 144 HE2 HIS 144 23.124 17.154 -16.411 1020 H HIS 145 H HIS 145 29.883 15.046 -17.866 1021 HA HIS 145 HA HIS 145 30.128 17.919 -18.309 1022 HB2 HIS 145 HB2 HIS 145 32.125 16.382 -18.145 1023 HB3 HIS 145 HB3 HIS 145 31.611 15.648 -19.656 1024 HD1 HIS 145 HD1 HIS 145 32.270 16.809 -21.799 1025 HD2 HIS 145 HD2 HIS 145 33.051 19.088 -18.400 1026 HE1 HIS 145 HE1 HIS 145 33.640 18.768 -22.591 1027 HE2 HIS 145 HE2 HIS 145 34.084 20.150 -20.526 Start of MODEL 3 1 H1 MET 1 H1 MET 1 60.278 51.500 84.099 2 H2 MET 1 H2 MET 1 60.736 50.579 85.446 3 H3 MET 1 H3 MET 1 59.802 51.976 85.657 4 HA MET 1 HA MET 1 57.960 50.987 84.515 5 HB2 MET 1 HB2 MET 1 59.184 49.586 82.947 6 HB3 MET 1 HB3 MET 1 59.812 48.606 84.260 7 HG2 MET 1 HG2 MET 1 58.029 47.455 83.067 8 HG3 MET 1 HG3 MET 1 57.581 47.771 84.740 9 HE1 MET 1 HE1 MET 1 55.446 46.909 82.517 10 HE2 MET 1 HE2 MET 1 54.128 48.007 82.932 11 HE3 MET 1 HE3 MET 1 55.065 47.227 84.208 12 H ASN 2 H ASN 2 56.472 50.605 86.006 13 HA ASN 2 HA ASN 2 57.212 48.949 88.313 14 HB2 ASN 2 HB2 ASN 2 55.445 50.052 89.595 15 HB3 ASN 2 HB3 ASN 2 56.578 51.239 88.973 16 HD21 ASN 2 HD21 ASN 2 55.893 52.664 87.360 17 HD22 ASN 2 HD22 ASN 2 54.220 52.912 86.998 18 H ALA 3 H ALA 3 56.168 47.072 88.592 19 HA ALA 3 HA ALA 3 53.945 46.481 86.762 20 HB1 ALA 3 HB1 ALA 3 55.659 44.601 88.396 21 HB2 ALA 3 HB2 ALA 3 55.843 44.936 86.673 22 HB3 ALA 3 HB3 ALA 3 54.391 44.128 87.262 23 H ARG 4 H ARG 4 51.986 46.526 87.552 24 HA ARG 4 HA ARG 4 51.628 46.208 90.438 25 HB2 ARG 4 HB2 ARG 4 49.505 47.525 90.179 26 HB3 ARG 4 HB3 ARG 4 50.979 48.433 89.919 27 HG2 ARG 4 HG2 ARG 4 49.553 47.308 87.560 28 HG3 ARG 4 HG3 ARG 4 48.885 48.724 88.367 29 HD2 ARG 4 HD2 ARG 4 51.002 49.918 88.034 30 HD3 ARG 4 HD3 ARG 4 51.685 48.498 87.243 31 HE ARG 4 HE ARG 4 49.260 49.468 86.023 32 HH11 ARG 4 HH11 ARG 4 52.774 49.711 86.051 33 HH12 ARG 4 HH12 ARG 4 52.845 50.391 84.451 34 HH21 ARG 4 HH21 ARG 4 49.390 50.356 83.934 35 HH22 ARG 4 HH22 ARG 4 50.943 50.744 83.267 36 H ASP 5 H ASP 5 50.452 44.637 91.164 37 HA ASP 5 HA ASP 5 49.319 42.771 89.235 38 HB2 ASP 5 HB2 ASP 5 50.930 41.868 90.821 39 HB3 ASP 5 HB3 ASP 5 50.009 42.493 92.182 40 H ASN 6 H ASN 6 47.279 43.184 88.721 41 HA ASN 6 HA ASN 6 45.431 44.059 90.822 42 HB2 ASN 6 HB2 ASN 6 45.541 45.548 88.889 43 HB3 ASN 6 HB3 ASN 6 45.180 44.213 87.804 44 HD21 ASN 6 HD21 ASN 6 43.906 46.337 90.250 45 HD22 ASN 6 HD22 ASN 6 42.236 46.074 89.883 46 H LYS 7 H LYS 7 44.240 42.524 91.702 47 HA LYS 7 HA LYS 7 43.590 40.168 90.066 48 HB2 LYS 7 HB2 LYS 7 43.833 40.374 93.068 49 HB3 LYS 7 HB3 LYS 7 43.325 38.935 92.199 50 HG2 LYS 7 HG2 LYS 7 46.021 40.268 92.032 51 HG3 LYS 7 HG3 LYS 7 45.641 38.751 92.846 52 HD2 LYS 7 HD2 LYS 7 45.236 39.190 89.893 53 HD3 LYS 7 HD3 LYS 7 46.728 38.545 90.576 54 HE2 LYS 7 HE2 LYS 7 43.988 37.318 90.897 55 HE3 LYS 7 HE3 LYS 7 45.215 36.778 89.752 56 HZ1 LYS 7 HZ1 LYS 7 46.685 36.379 91.698 57 HZ2 LYS 7 HZ2 LYS 7 45.320 35.382 91.657 58 HZ3 LYS 7 HZ3 LYS 7 45.369 36.702 92.719 59 H PHE 8 H PHE 8 41.704 40.616 89.186 60 HA PHE 8 HA PHE 8 39.619 41.977 90.667 61 HB2 PHE 8 HB2 PHE 8 39.951 42.610 88.341 62 HB3 PHE 8 HB3 PHE 8 39.747 40.945 87.817 63 HD1 PHE 8 HD1 PHE 8 37.909 43.677 89.569 64 HD2 PHE 8 HD2 PHE 8 37.677 40.229 87.085 65 HE1 PHE 8 HE1 PHE 8 35.502 44.065 89.256 66 HE2 PHE 8 HE2 PHE 8 35.272 40.615 86.767 67 HZ PHE 8 HZ PHE 8 34.181 42.533 87.853 68 H ASN 9 H ASN 9 37.975 41.029 91.657 69 HA ASN 9 HA ASN 9 37.348 38.220 91.021 70 HB2 ASN 9 HB2 ASN 9 38.238 38.567 93.335 71 HB3 ASN 9 HB3 ASN 9 36.900 39.664 93.652 72 HD21 ASN 9 HD21 ASN 9 36.024 38.477 95.273 73 HD22 ASN 9 HD22 ASN 9 35.262 36.946 95.027 74 H THR 10 H THR 10 35.336 37.884 90.213 75 HA THR 10 HA THR 10 33.394 40.058 90.550 76 HB THR 10 HB THR 10 34.051 39.692 88.179 77 HG1 THR 10 HG1 THR 10 32.092 40.488 88.038 78 HG21 THR 10 HG21 THR 10 33.222 37.729 86.971 79 HG22 THR 10 HG22 THR 10 32.709 37.008 88.496 80 HG23 THR 10 HG23 THR 10 34.424 37.283 88.184 81 H TRP 11 H TRP 11 31.278 39.570 91.009 82 HA TRP 11 HA TRP 11 30.556 36.837 91.735 83 HB2 TRP 11 HB2 TRP 11 31.428 37.680 93.830 84 HB3 TRP 11 HB3 TRP 11 30.563 39.197 93.645 85 HD1 TRP 11 HD1 TRP 11 28.520 39.370 95.124 86 HE1 TRP 11 HE1 TRP 11 26.816 37.746 96.149 87 HE3 TRP 11 HE3 TRP 11 30.334 34.988 93.225 88 HZ2 TRP 11 HZ2 TRP 11 26.306 34.972 96.167 89 HZ3 TRP 11 HZ3 TRP 11 29.184 32.899 93.789 90 HH2 TRP 11 HH2 TRP 11 27.213 32.887 95.231 91 H ASN 12 H ASN 12 28.498 36.441 91.157 92 HA ASN 12 HA ASN 12 26.872 38.674 90.239 93 HB2 ASN 12 HB2 ASN 12 25.398 36.932 89.243 94 HB3 ASN 12 HB3 ASN 12 27.050 36.866 88.652 95 HD21 ASN 12 HD21 ASN 12 24.542 35.197 90.304 96 HD22 ASN 12 HD22 ASN 12 25.374 33.698 90.514 97 H ASP 13 H ASP 13 25.217 39.451 91.311 98 HA ASP 13 HA ASP 13 24.580 38.434 93.920 99 HB2 ASP 13 HB2 ASP 13 24.686 40.844 93.566 100 HB3 ASP 13 HB3 ASP 13 23.449 40.741 92.316 101 H SER 14 H SER 14 23.008 37.087 94.431 102 HA SER 14 HA SER 14 21.269 36.005 92.416 103 HB2 SER 14 HB2 SER 14 21.308 35.484 95.400 104 HB3 SER 14 HB3 SER 14 20.569 34.467 94.160 105 HG SER 14 HG SER 14 22.931 34.171 95.078 106 H ARG 15 H ARG 15 19.328 36.768 91.921 107 HA ARG 15 HA ARG 15 17.930 38.434 93.901 108 HB2 ARG 15 HB2 ARG 15 16.896 39.674 92.032 109 HB3 ARG 15 HB3 ARG 15 18.641 39.844 92.073 110 HG2 ARG 15 HG2 ARG 15 17.433 37.780 90.298 111 HG3 ARG 15 HG3 ARG 15 17.362 39.476 89.826 112 HD2 ARG 15 HD2 ARG 15 19.754 39.657 89.872 113 HD3 ARG 15 HD3 ARG 15 19.911 38.051 90.580 114 HE ARG 15 HE ARG 15 18.579 38.089 88.023 115 HH11 ARG 15 HH11 ARG 15 21.702 37.880 89.649 116 HH12 ARG 15 HH12 ARG 15 22.475 37.073 88.316 117 HH21 ARG 15 HH21 ARG 15 19.610 37.038 86.290 118 HH22 ARG 15 HH22 ARG 15 21.284 36.600 86.412 119 H GLY 16 H GLY 16 15.798 38.100 94.265 120 HA2 GLY 16 HA2 GLY 16 14.677 35.628 93.164 121 HA3 GLY 16 HA3 GLY 16 14.107 36.476 94.596 122 H ASN 17 H ASN 17 12.730 35.533 92.109 123 HA ASN 17 HA ASN 17 11.609 38.129 91.267 124 HB2 ASN 17 HB2 ASN 17 12.870 36.992 89.447 125 HB3 ASN 17 HB3 ASN 17 11.805 35.601 89.605 126 HD21 ASN 17 HD21 ASN 17 11.070 35.737 87.523 127 HD22 ASN 17 HD22 ASN 17 10.016 36.996 86.979 128 H TYR 18 H TYR 18 9.655 38.409 91.985 129 HA TYR 18 HA TYR 18 7.784 36.146 92.067 130 HB2 TYR 18 HB2 TYR 18 8.102 38.288 94.192 131 HB3 TYR 18 HB3 TYR 18 6.754 37.158 94.114 132 HD1 TYR 18 HD2 TYR 18 7.263 34.671 94.303 133 HD2 TYR 18 HD1 TYR 18 10.114 37.684 95.261 134 HE1 TYR 18 HE2 TYR 18 8.540 33.034 95.620 135 HE2 TYR 18 HE1 TYR 18 11.400 36.053 96.578 136 HH TYR 18 HH TYR 18 10.973 32.763 96.349 137 H TRP 19 H TRP 19 5.458 37.025 92.231 138 HA TRP 19 HA TRP 19 5.110 39.591 90.919 139 HB2 TRP 19 HB2 TRP 19 3.851 38.721 89.025 140 HB3 TRP 19 HB3 TRP 19 5.471 38.035 89.031 141 HD1 TRP 19 HD1 TRP 19 5.565 35.406 90.086 142 HE1 TRP 19 HE1 TRP 19 3.891 33.495 89.712 143 HE3 TRP 19 HE3 TRP 19 1.546 38.151 88.530 144 HZ2 TRP 19 HZ2 TRP 19 1.234 33.187 88.826 145 HZ3 TRP 19 HZ3 TRP 19 -0.518 36.963 87.925 146 HH2 TRP 19 HH2 TRP 19 -0.670 34.535 88.071 147 H SER 20 H SER 20 3.046 40.450 91.083 148 HA SER 20 HA SER 20 0.902 38.877 92.281 149 HB2 SER 20 HB2 SER 20 1.811 41.508 93.494 150 HB3 SER 20 HB3 SER 20 0.405 40.571 93.992 151 HG SER 20 HG SER 20 2.453 38.932 94.079 152 H ASP 21 H ASP 21 -0.455 39.086 90.599 153 HA ASP 21 HA ASP 21 -0.820 41.740 89.405 154 HB2 ASP 21 HB2 ASP 21 -0.316 39.662 87.989 155 HB3 ASP 21 HB3 ASP 21 -1.950 39.136 88.373 156 H TYR 22 H TYR 22 -2.875 42.635 89.168 157 HA TYR 22 HA TYR 22 -4.792 41.915 91.211 158 HB2 TYR 22 HB2 TYR 22 -4.144 44.303 90.633 159 HB3 TYR 22 HB3 TYR 22 -5.030 44.103 89.131 160 HD1 TYR 22 HD2 TYR 22 -5.419 44.078 92.821 161 HD2 TYR 22 HD1 TYR 22 -7.358 44.472 89.054 162 HE1 TYR 22 HE2 TYR 22 -7.477 44.769 93.963 163 HE2 TYR 22 HE1 TYR 22 -9.425 45.171 90.190 164 HH TYR 22 HH TYR 22 -9.499 45.996 93.514 165 H GLU 23 H GLU 23 -5.479 39.911 90.495 166 HA GLU 23 HA GLU 23 -6.953 39.836 87.959 167 HB2 GLU 23 HB2 GLU 23 -5.925 37.579 89.703 168 HB3 GLU 23 HB3 GLU 23 -6.812 37.371 88.198 169 HG2 GLU 23 HG2 GLU 23 -5.057 38.330 86.921 170 HG3 GLU 23 HG3 GLU 23 -4.216 38.870 88.372 171 H GLY 24 H GLY 24 -8.629 41.092 89.055 172 HA2 GLY 24 HA2 GLY 24 -10.669 39.378 90.191 173 HA3 GLY 24 HA3 GLY 24 -10.084 40.637 91.269 174 H SER 25 H SER 25 -11.913 39.922 88.422 175 HA SER 25 HA SER 25 -12.939 42.671 88.459 176 HB2 SER 25 HB2 SER 25 -11.357 42.340 86.547 177 HB3 SER 25 HB3 SER 25 -12.406 41.051 85.951 178 HG SER 25 HG SER 25 -13.015 43.802 86.249 179 H ASP 26 H ASP 26 -14.996 42.534 89.057 180 HA ASP 26 HA ASP 26 -16.554 40.196 88.176 181 HB2 ASP 26 HB2 ASP 26 -16.259 40.342 90.625 182 HB3 ASP 26 HB3 ASP 26 -16.988 41.948 90.610 183 H GLU 27 H GLU 27 -18.159 40.581 86.793 184 HA GLU 27 HA GLU 27 -19.638 43.079 86.859 185 HB2 GLU 27 HB2 GLU 27 -17.791 43.589 85.337 186 HB3 GLU 27 HB3 GLU 27 -18.158 42.161 84.380 187 HG2 GLU 27 HG2 GLU 27 -20.380 43.146 83.855 188 HG3 GLU 27 HG3 GLU 27 -19.888 44.612 84.708 189 H ASN 28 H ASN 28 -21.730 42.741 86.379 190 HA ASN 28 HA ASN 28 -22.445 40.348 84.817 191 HB2 ASN 28 HB2 ASN 28 -23.055 40.133 87.248 192 HB3 ASN 28 HB3 ASN 28 -24.121 41.522 87.053 193 HD21 ASN 28 HD21 ASN 28 -23.491 38.244 86.010 194 HD22 ASN 28 HD22 ASN 28 -25.108 37.891 85.512 195 H GLY 29 H GLY 29 -23.205 40.952 82.920 196 HA2 GLY 29 HA2 GLY 29 -24.592 43.555 82.736 197 HA3 GLY 29 HA3 GLY 29 -23.546 42.911 81.475 198 H ASP 30 H ASP 30 -26.662 43.394 82.272 199 HA ASP 30 HA ASP 30 -27.796 40.948 81.273 200 HB2 ASP 30 HB2 ASP 30 -29.958 42.094 81.504 201 HB3 ASP 30 HB3 ASP 30 -29.006 42.202 82.976 202 H GLY 31 H GLY 31 -28.904 40.654 79.359 203 HA2 GLY 31 HA2 GLY 31 -28.858 42.740 77.332 204 HA3 GLY 31 HA3 GLY 31 -27.903 41.303 76.992 205 H ILE 32 H ILE 32 -31.094 42.580 77.494 206 HA ILE 32 HA ILE 32 -32.440 40.088 77.070 207 HB ILE 32 HB ILE 32 -33.569 42.898 76.924 208 HG12 ILE 32 HG12 ILE 32 -33.618 40.952 79.244 209 HG13 ILE 32 HG13 ILE 32 -32.531 42.329 79.117 210 HG21 ILE 32 HG21 ILE 32 -35.758 41.845 77.279 211 HG22 ILE 32 HG22 ILE 32 -35.003 40.252 77.235 212 HG23 ILE 32 HG23 ILE 32 -35.000 41.268 75.793 213 HD11 ILE 32 HD11 ILE 32 -35.536 42.479 79.243 214 HD12 ILE 32 HD12 ILE 32 -34.428 43.849 79.155 215 HD13 ILE 32 HD13 ILE 32 -34.425 42.803 80.575 216 H GLY 33 H GLY 33 -32.388 39.106 75.179 217 HA2 GLY 33 HA2 GLY 33 -32.120 40.486 72.660 218 HA3 GLY 33 HA3 GLY 33 -32.367 38.758 72.893 219 H ASP 34 H ASP 34 -33.872 41.833 72.453 220 HA ASP 34 HA ASP 34 -36.562 40.786 72.810 221 HB2 ASP 34 HB2 ASP 34 -35.892 43.014 73.750 222 HB3 ASP 34 HB3 ASP 34 -35.672 43.594 72.103 223 H SER 35 H SER 35 -36.268 39.328 71.052 224 HA SER 35 HA SER 35 -37.358 40.370 68.584 225 HB2 SER 35 HB2 SER 35 -34.754 38.807 68.609 226 HB3 SER 35 HB3 SER 35 -35.700 39.158 67.166 227 HG SER 35 HG SER 35 -35.209 41.437 68.511 228 H ALA 36 H ALA 36 -38.502 38.808 67.459 229 HA ALA 36 HA ALA 36 -38.443 36.057 68.430 230 HB1 ALA 36 HB1 ALA 36 -40.264 37.125 69.675 231 HB2 ALA 36 HB2 ALA 36 -40.884 35.928 68.537 232 HB3 ALA 36 HB3 ALA 36 -40.998 37.647 68.156 233 H TYR 37 H TYR 37 -37.681 35.157 66.600 234 HA TYR 37 HA TYR 37 -38.705 36.009 64.023 235 HB2 TYR 37 HB2 TYR 37 -37.026 34.586 63.013 236 HB3 TYR 37 HB3 TYR 37 -36.273 35.542 64.277 237 HD1 TYR 37 HD2 TYR 37 -35.474 34.444 66.346 238 HD2 TYR 37 HD1 TYR 37 -37.158 32.178 63.164 239 HE1 TYR 37 HE2 TYR 37 -34.545 32.390 67.320 240 HE2 TYR 37 HE1 TYR 37 -36.229 30.124 64.128 241 HH TYR 37 HH TYR 37 -34.435 29.444 65.614 242 H ALA 38 H ALA 38 -39.497 34.482 62.469 243 HA ALA 38 HA ALA 38 -40.791 32.119 63.641 244 HB1 ALA 38 HB1 ALA 38 -42.040 34.040 61.676 245 HB2 ALA 38 HB2 ALA 38 -42.450 33.892 63.384 246 HB3 ALA 38 HB3 ALA 38 -42.771 32.553 62.283 247 H VAL 39 H VAL 39 -41.673 30.732 61.683 248 HA VAL 39 HA VAL 39 -39.729 30.697 59.503 249 HB VAL 39 HB VAL 39 -38.711 29.249 61.136 250 HG11 VAL 39 HG11 VAL 39 -39.798 27.250 62.047 251 HG12 VAL 39 HG12 VAL 39 -41.314 27.741 61.287 252 HG13 VAL 39 HG13 VAL 39 -40.597 28.741 62.550 253 HG21 VAL 39 HG21 VAL 39 -38.626 27.108 59.943 254 HG22 VAL 39 HG22 VAL 39 -38.505 28.490 58.855 255 HG23 VAL 39 HG23 VAL 39 -40.022 27.597 58.983 256 H ASN 40 H ASN 40 -40.575 30.089 57.584 257 HA ASN 40 HA ASN 40 -43.454 29.436 57.552 258 HB2 ASN 40 HB2 ASN 40 -41.789 30.818 55.422 259 HB3 ASN 40 HB3 ASN 40 -43.518 30.514 55.336 260 HD21 ASN 40 HD21 ASN 40 -44.924 31.828 56.479 261 HD22 ASN 40 HD22 ASN 40 -44.411 33.296 57.240 262 HA PRO 41 HA PRO 41 -42.033 25.664 55.414 263 HB2 PRO 41 HB2 PRO 41 -44.686 24.672 56.094 264 HB3 PRO 41 HB3 PRO 41 -43.114 24.041 56.589 265 HG2 PRO 41 HG2 PRO 41 -44.830 25.232 58.317 266 HG3 PRO 41 HG3 PRO 41 -43.067 25.315 58.509 267 HD2 PRO 41 HD2 PRO 41 -44.950 27.348 57.358 268 HD3 PRO 41 HD3 PRO 41 -43.588 27.585 58.477 269 H GLU 42 H GLU 42 -42.109 26.691 53.459 270 HA GLU 42 HA GLU 42 -44.537 27.629 52.253 271 HB2 GLU 42 HB2 GLU 42 -41.809 27.374 50.972 272 HB3 GLU 42 HB3 GLU 42 -43.143 28.385 50.439 273 HG2 GLU 42 HG2 GLU 42 -42.924 29.815 52.334 274 HG3 GLU 42 HG3 GLU 42 -41.740 28.735 53.077 275 H ALA 43 H ALA 43 -42.140 25.719 50.474 276 HA ALA 43 HA ALA 43 -43.772 23.479 49.884 277 HB1 ALA 43 HB1 ALA 43 -43.644 25.578 47.719 278 HB2 ALA 43 HB2 ALA 43 -45.088 25.138 48.632 279 HB3 ALA 43 HB3 ALA 43 -44.327 23.958 47.563 280 H GLY 44 H GLY 44 -42.868 22.184 48.100 281 HA2 GLY 44 HA2 GLY 44 -39.979 22.617 47.773 282 HA3 GLY 44 HA3 GLY 44 -40.829 21.099 47.515 283 H SER 45 H SER 45 -39.023 22.299 45.678 284 HA SER 45 HA SER 45 -40.642 23.491 43.587 285 HB2 SER 45 HB2 SER 45 -37.707 22.737 43.576 286 HB3 SER 45 HB3 SER 45 -38.536 23.701 42.351 287 HG SER 45 HG SER 45 -38.994 24.720 44.806 288 H MET 46 H MET 46 -40.899 22.630 41.514 289 HA MET 46 HA MET 46 -40.904 19.697 41.514 290 HB2 MET 46 HB2 MET 46 -42.909 19.770 40.130 291 HB3 MET 46 HB3 MET 46 -43.166 20.666 41.616 292 HG2 MET 46 HG2 MET 46 -42.462 21.969 38.999 293 HG3 MET 46 HG3 MET 46 -44.112 21.687 39.525 294 HE1 MET 46 HE1 MET 46 -45.196 22.875 41.684 295 HE2 MET 46 HE2 MET 46 -44.323 24.029 42.696 296 HE3 MET 46 HE3 MET 46 -43.857 22.327 42.695 297 H ASP 47 H ASP 47 -41.062 18.773 39.263 298 HA ASP 47 HA ASP 47 -40.185 18.283 37.249 299 HB2 ASP 47 HB2 ASP 47 -40.196 21.274 36.928 300 HB3 ASP 47 HB3 ASP 47 -39.646 20.199 35.655 301 H TYR 48 H TYR 48 -38.380 17.233 37.973 302 HA TYR 48 HA TYR 48 -35.900 18.687 37.372 303 HB2 TYR 48 HB2 TYR 48 -36.425 16.755 39.616 304 HB3 TYR 48 HB3 TYR 48 -34.796 16.996 38.990 305 HD1 TYR 48 HD1 TYR 48 -33.763 19.258 39.115 306 HD2 TYR 48 HD2 TYR 48 -37.441 18.374 41.062 307 HE1 TYR 48 HE1 TYR 48 -33.532 21.295 40.467 308 HE2 TYR 48 HE2 TYR 48 -37.217 20.410 42.420 309 HH TYR 48 HH TYR 48 -35.385 21.909 43.205 310 H MET 49 H MET 49 -35.001 17.961 35.646 311 HA MET 49 HA MET 49 -36.047 15.577 34.374 312 HB2 MET 49 HB2 MET 49 -34.073 17.641 33.375 313 HB3 MET 49 HB3 MET 49 -34.808 16.374 32.403 314 HG2 MET 49 HG2 MET 49 -36.998 17.349 32.753 315 HG3 MET 49 HG3 MET 49 -36.290 18.605 33.769 316 HE1 MET 49 HE1 MET 49 -38.175 19.326 31.371 317 HE2 MET 49 HE2 MET 49 -37.279 20.633 30.593 318 HE3 MET 49 HE3 MET 49 -37.360 20.542 32.353 319 HA PRO 50 HA PRO 50 -32.485 13.055 35.451 320 HB2 PRO 50 HB2 PRO 50 -32.992 10.984 33.755 321 HB3 PRO 50 HB3 PRO 50 -33.815 11.203 35.301 322 HG2 PRO 50 HG2 PRO 50 -34.757 11.838 32.542 323 HG3 PRO 50 HG3 PRO 50 -35.660 11.173 33.916 324 HD2 PRO 50 HD2 PRO 50 -35.789 13.787 33.154 325 HD3 PRO 50 HD3 PRO 50 -36.042 13.246 34.822 326 H LEU 51 H LEU 51 -30.487 13.285 34.780 327 HA LEU 51 HA LEU 51 -29.926 13.673 31.926 328 HB2 LEU 51 HB2 LEU 51 -28.519 14.509 34.431 329 HB3 LEU 51 HB3 LEU 51 -27.560 14.228 32.994 330 HG LEU 51 HG LEU 51 -29.055 15.931 31.821 331 HD11 LEU 51 HD11 LEU 51 -29.834 16.586 34.659 332 HD12 LEU 51 HD12 LEU 51 -30.909 15.957 33.408 333 HD13 LEU 51 HD13 LEU 51 -30.192 17.560 33.234 334 HD21 LEU 51 HD21 LEU 51 -27.821 17.827 32.770 335 HD22 LEU 51 HD22 LEU 51 -26.787 16.427 32.489 336 HD23 LEU 51 HD23 LEU 51 -27.327 16.811 34.123 337 H MET 52 H MET 52 -29.247 11.969 30.855 338 HA MET 52 HA MET 52 -27.334 10.115 31.913 339 HB2 MET 52 HB2 MET 52 -29.423 9.238 32.921 340 HB3 MET 52 HB3 MET 52 -30.135 9.115 31.318 341 HG2 MET 52 HG2 MET 52 -28.402 7.490 30.694 342 HG3 MET 52 HG3 MET 52 -27.749 7.582 32.331 343 HE1 MET 52 HE1 MET 52 -28.576 4.866 30.901 344 HE2 MET 52 HE2 MET 52 -29.392 4.035 32.227 345 HE3 MET 52 HE3 MET 52 -27.912 4.953 32.527 346 H GLU 53 H GLU 53 -26.086 9.481 30.268 347 HA GLU 53 HA GLU 53 -27.239 9.465 27.558 348 HB2 GLU 53 HB2 GLU 53 -24.330 9.446 28.409 349 HB3 GLU 53 HB3 GLU 53 -24.882 9.322 26.748 350 HG2 GLU 53 HG2 GLU 53 -24.269 11.539 26.950 351 HG3 GLU 53 HG3 GLU 53 -26.016 11.583 27.167 352 H TYR 54 H TYR 54 -27.514 7.595 26.521 353 HA TYR 54 HA TYR 54 -26.965 5.141 27.968 354 HB2 TYR 54 HB2 TYR 54 -28.407 5.649 25.354 355 HB3 TYR 54 HB3 TYR 54 -28.237 4.065 26.102 356 HD1 TYR 54 HD1 TYR 54 -29.381 3.582 28.244 357 HD2 TYR 54 HD2 TYR 54 -30.040 7.215 26.132 358 HE1 TYR 54 HE1 TYR 54 -31.413 3.978 29.565 359 HE2 TYR 54 HE2 TYR 54 -32.072 7.621 27.452 360 HH TYR 54 HH TYR 54 -33.712 6.330 28.744 361 H LEU 55 H LEU 55 -25.448 3.655 27.456 362 HA LEU 55 HA LEU 55 -23.320 4.461 25.737 363 HB2 LEU 55 HB2 LEU 55 -22.138 2.497 26.396 364 HB3 LEU 55 HB3 LEU 55 -22.904 3.170 27.815 365 HG LEU 55 HG LEU 55 -24.264 0.919 26.375 366 HD11 LEU 55 HD11 LEU 55 -21.973 0.617 28.314 367 HD12 LEU 55 HD12 LEU 55 -21.937 0.208 26.599 368 HD13 LEU 55 HD13 LEU 55 -22.986 -0.689 27.698 369 HD21 LEU 55 HD21 LEU 55 -25.404 2.031 28.237 370 HD22 LEU 55 HD22 LEU 55 -24.026 1.692 29.287 371 HD23 LEU 55 HD23 LEU 55 -24.995 0.364 28.644 372 H HIS 56 H HIS 56 -22.615 3.594 23.844 373 HA HIS 56 HA HIS 56 -24.809 2.415 22.284 374 HB2 HIS 56 HB2 HIS 56 -22.527 4.179 21.373 375 HB3 HIS 56 HB3 HIS 56 -23.731 3.465 20.309 376 HD1 HIS 56 HD1 HIS 56 -26.228 4.395 20.619 377 HD2 HIS 56 HD2 HIS 56 -23.230 6.532 22.546 378 HE1 HIS 56 HE1 HIS 56 -27.246 6.628 21.181 379 HE2 HIS 56 HE2 HIS 56 -25.357 7.963 22.185 380 H SER 57 H SER 57 -24.554 0.547 21.307 381 HA SER 57 HA SER 57 -21.942 -0.719 21.262 382 HB2 SER 57 HB2 SER 57 -24.601 -1.762 20.220 383 HB3 SER 57 HB3 SER 57 -23.116 -2.695 20.416 384 HG SER 57 HG SER 57 -23.337 -1.897 22.736 385 H SER 58 H SER 58 -20.900 0.730 19.882 386 HA SER 58 HA SER 58 -21.906 1.102 17.177 387 HB2 SER 58 HB2 SER 58 -19.381 2.159 18.487 388 HB3 SER 58 HB3 SER 58 -20.049 2.682 16.940 389 HG SER 58 HG SER 58 -20.744 3.409 19.479 390 HA PRO 59 HA PRO 59 -19.510 -2.430 15.804 391 HB2 PRO 59 HB2 PRO 59 -19.909 -2.047 13.129 392 HB3 PRO 59 HB3 PRO 59 -21.064 -2.840 14.201 393 HG2 PRO 59 HG2 PRO 59 -21.058 -0.041 13.166 394 HG3 PRO 59 HG3 PRO 59 -22.423 -1.142 13.417 395 HD2 PRO 59 HD2 PRO 59 -21.817 0.875 15.120 396 HD3 PRO 59 HD3 PRO 59 -22.582 -0.638 15.644 397 H VAL 60 H VAL 60 -17.484 -2.755 15.152 398 HA VAL 60 HA VAL 60 -15.852 -0.405 14.755 399 HB VAL 60 HB VAL 60 -15.164 -2.102 16.379 400 HG11 VAL 60 HG11 VAL 60 -16.034 -4.085 15.288 401 HG12 VAL 60 HG12 VAL 60 -14.333 -4.281 15.720 402 HG13 VAL 60 HG13 VAL 60 -14.790 -3.957 14.045 403 HG21 VAL 60 HG21 VAL 60 -13.449 -0.718 15.396 404 HG22 VAL 60 HG22 VAL 60 -13.244 -1.872 14.077 405 HG23 VAL 60 HG23 VAL 60 -12.827 -2.337 15.726 406 H LEU 61 H LEU 61 -14.665 0.064 12.972 407 HA LEU 61 HA LEU 61 -15.356 -1.407 10.537 408 HB2 LEU 61 HB2 LEU 61 -14.836 0.769 9.325 409 HB3 LEU 61 HB3 LEU 61 -16.330 0.674 10.204 410 HG LEU 61 HG LEU 61 -15.254 2.902 10.235 411 HD11 LEU 61 HD11 LEU 61 -15.520 1.637 12.941 412 HD12 LEU 61 HD12 LEU 61 -16.811 2.354 11.978 413 HD13 LEU 61 HD13 LEU 61 -15.514 3.370 12.611 414 HD21 LEU 61 HD21 LEU 61 -13.137 1.617 11.924 415 HD22 LEU 61 HD22 LEU 61 -13.328 3.349 11.641 416 HD23 LEU 61 HD23 LEU 61 -12.924 2.271 10.302 417 HA PRO 62 HA PRO 62 -11.108 -2.343 9.806 418 HB2 PRO 62 HB2 PRO 62 -10.629 -1.900 7.190 419 HB3 PRO 62 HB3 PRO 62 -11.683 -3.205 7.751 420 HG2 PRO 62 HG2 PRO 62 -12.427 -0.485 6.731 421 HG3 PRO 62 HG3 PRO 62 -13.129 -2.064 6.317 422 HD2 PRO 62 HD2 PRO 62 -14.286 -0.403 8.102 423 HD3 PRO 62 HD3 PRO 62 -14.364 -2.169 8.265 424 H THR 63 H THR 63 -8.971 -1.576 8.883 425 HA THR 63 HA THR 63 -8.805 1.286 8.542 426 HB THR 63 HB THR 63 -8.382 0.528 11.040 427 HG1 THR 63 HG1 THR 63 -8.028 2.644 10.018 428 HG21 THR 63 HG21 THR 63 -6.645 -1.158 10.620 429 HG22 THR 63 HG22 THR 63 -6.025 0.180 11.586 430 HG23 THR 63 HG23 THR 63 -5.627 0.075 9.872 431 H ALA 64 H ALA 64 -7.701 1.682 6.824 432 HA ALA 64 HA ALA 64 -6.083 -0.335 5.560 433 HB1 ALA 64 HB1 ALA 64 -7.500 1.159 4.237 434 HB2 ALA 64 HB2 ALA 64 -5.800 1.293 3.780 435 HB3 ALA 64 HB3 ALA 64 -6.545 2.537 4.785 436 H ARG 65 H ARG 65 -4.185 -0.755 6.340 437 HA ARG 65 HA ARG 65 -2.396 1.430 6.999 438 HB2 ARG 65 HB2 ARG 65 -3.647 0.764 9.089 439 HB3 ARG 65 HB3 ARG 65 -2.930 -0.834 8.939 440 HG2 ARG 65 HG2 ARG 65 -0.697 0.191 9.119 441 HG3 ARG 65 HG3 ARG 65 -1.464 1.760 9.364 442 HD2 ARG 65 HD2 ARG 65 -2.537 0.941 11.384 443 HD3 ARG 65 HD3 ARG 65 -1.848 -0.661 11.122 444 HE ARG 65 HE ARG 65 0.184 1.335 11.227 445 HH11 ARG 65 HH11 ARG 65 -1.922 -0.608 13.273 446 HH12 ARG 65 HH12 ARG 65 -0.873 -0.511 14.654 447 HH21 ARG 65 HH21 ARG 65 1.565 1.426 13.038 448 HH22 ARG 65 HH22 ARG 65 1.090 0.666 14.523 449 H PHE 66 H PHE 66 -0.404 0.990 6.345 450 HA PHE 66 HA PHE 66 0.645 -1.664 6.361 451 HB2 PHE 66 HB2 PHE 66 1.193 -1.854 4.012 452 HB3 PHE 66 HB3 PHE 66 -0.540 -1.634 4.163 453 HD1 PHE 66 HD2 PHE 66 -1.463 0.728 3.721 454 HD2 PHE 66 HD1 PHE 66 2.445 -0.523 2.602 455 HE1 PHE 66 HE2 PHE 66 -1.367 2.529 2.052 456 HE2 PHE 66 HE1 PHE 66 2.546 1.278 0.937 457 HZ PHE 66 HZ PHE 66 0.637 2.800 0.661 458 H THR 67 H THR 67 2.976 -1.645 5.904 459 HA THR 67 HA THR 67 4.097 1.052 6.004 460 HB THR 67 HB THR 67 4.112 0.210 8.304 461 HG1 THR 67 HG1 THR 67 5.874 1.397 8.208 462 HG21 THR 67 HG21 THR 67 5.482 -1.706 8.962 463 HG22 THR 67 HG22 THR 67 5.820 -2.053 7.266 464 HG23 THR 67 HG23 THR 67 4.174 -2.197 7.886 465 H SER 68 H SER 68 6.010 1.336 4.999 466 HA SER 68 HA SER 68 6.983 -0.899 3.361 467 HB2 SER 68 HB2 SER 68 7.688 0.906 1.737 468 HB3 SER 68 HB3 SER 68 5.944 0.719 1.913 469 HG SER 68 HG SER 68 7.400 2.903 2.280 470 H ASP 69 H ASP 69 9.240 -0.997 3.003 471 HA ASP 69 HA ASP 69 10.825 -0.347 5.256 472 HB2 ASP 69 HB2 ASP 69 11.296 -2.303 3.828 473 HB3 ASP 69 HB3 ASP 69 11.713 -1.228 2.497 474 H ILE 70 H ILE 70 10.869 0.929 1.917 475 HA ILE 70 HA ILE 70 12.075 3.351 3.048 476 HB ILE 70 HB ILE 70 12.827 3.979 0.795 477 HG12 ILE 70 HG12 ILE 70 12.200 1.204 -0.183 478 HG13 ILE 70 HG13 ILE 70 11.014 2.497 -0.331 479 HG21 ILE 70 HG21 ILE 70 13.793 1.269 1.693 480 HG22 ILE 70 HG22 ILE 70 14.385 2.838 2.241 481 HG23 ILE 70 HG23 ILE 70 14.638 2.335 0.571 482 HD11 ILE 70 HD11 ILE 70 13.782 2.470 -1.510 483 HD12 ILE 70 HD12 ILE 70 12.646 3.815 -1.603 484 HD13 ILE 70 HD13 ILE 70 12.258 2.278 -2.381 485 H THR 71 H THR 71 11.236 5.332 2.515 486 HA THR 71 HA THR 71 8.736 5.391 0.954 487 HB THR 71 HB THR 71 8.139 7.468 2.209 488 HG1 THR 71 HG1 THR 71 9.502 8.276 3.586 489 HG21 THR 71 HG21 THR 71 7.388 6.355 4.259 490 HG22 THR 71 HG22 THR 71 8.467 5.001 3.915 491 HG23 THR 71 HG23 THR 71 7.118 5.350 2.834 492 H GLU 72 H GLU 72 11.926 6.225 1.264 493 HA GLU 72 HA GLU 72 12.006 7.632 -1.204 494 HB2 GLU 72 HB2 GLU 72 11.613 9.457 0.524 495 HB3 GLU 72 HB3 GLU 72 13.174 9.031 1.212 496 HG2 GLU 72 HG2 GLU 72 14.243 9.556 -0.947 497 HG3 GLU 72 HG3 GLU 72 12.673 10.040 -1.588 498 H GLY 73 H GLY 73 13.915 7.239 -2.163 499 HA2 GLY 73 HA2 GLY 73 16.436 6.784 -1.345 500 HA3 GLY 73 HA3 GLY 73 15.646 5.260 -0.920 501 H PHE 74 H PHE 74 17.417 4.663 -2.683 502 HA PHE 74 HA PHE 74 16.732 5.334 -5.392 503 HB2 PHE 74 HB2 PHE 74 18.580 3.988 -6.074 504 HB3 PHE 74 HB3 PHE 74 19.091 4.747 -4.576 505 HD1 PHE 74 HD1 PHE 74 19.065 3.328 -2.448 506 HD2 PHE 74 HD2 PHE 74 18.579 1.662 -6.336 507 HE1 PHE 74 HE1 PHE 74 19.635 1.104 -1.570 508 HE2 PHE 74 HE2 PHE 74 19.147 -0.563 -5.459 509 HZ PHE 74 HZ PHE 74 19.672 -0.843 -3.073 510 H ALA 75 H ALA 75 15.586 4.162 -6.845 511 HA ALA 75 HA ALA 75 13.692 2.265 -6.277 512 HB1 ALA 75 HB1 ALA 75 15.189 2.614 -8.870 513 HB2 ALA 75 HB2 ALA 75 13.807 3.577 -8.349 514 HB3 ALA 75 HB3 ALA 75 13.609 1.852 -8.681 515 HA PRO 76 HA PRO 76 16.422 -1.309 -5.876 516 HB2 PRO 76 HB2 PRO 76 14.999 -2.437 -3.833 517 HB3 PRO 76 HB3 PRO 76 16.170 -1.139 -3.605 518 HG2 PRO 76 HG2 PRO 76 13.312 -1.050 -3.249 519 HG3 PRO 76 HG3 PRO 76 14.496 0.232 -2.954 520 HD2 PRO 76 HD2 PRO 76 12.768 -0.227 -5.317 521 HD3 PRO 76 HD3 PRO 76 13.505 1.281 -4.729 522 H LEU 77 H LEU 77 15.685 -3.787 -5.340 523 HA LEU 77 HA LEU 77 13.947 -4.498 -7.567 524 HB2 LEU 77 HB2 LEU 77 16.252 -5.498 -7.254 525 HB3 LEU 77 HB3 LEU 77 15.623 -6.320 -5.844 526 HG LEU 77 HG LEU 77 14.119 -6.781 -8.348 527 HD11 LEU 77 HD11 LEU 77 16.888 -7.899 -7.931 528 HD12 LEU 77 HD12 LEU 77 16.404 -6.770 -9.197 529 HD13 LEU 77 HD13 LEU 77 15.746 -8.407 -9.177 530 HD21 LEU 77 HD21 LEU 77 15.197 -8.613 -6.201 531 HD22 LEU 77 HD22 LEU 77 14.102 -9.078 -7.502 532 HD23 LEU 77 HD23 LEU 77 13.566 -7.944 -6.261 533 H SER 78 H SER 78 14.266 -5.010 -4.090 534 HA SER 78 HA SER 78 11.430 -5.715 -4.044 535 HB2 SER 78 HB2 SER 78 11.973 -7.425 -2.279 536 HB3 SER 78 HB3 SER 78 12.546 -7.824 -3.894 537 HG SER 78 HG SER 78 14.275 -6.434 -2.187 538 H VAL 79 H VAL 79 10.431 -4.236 -2.898 539 HA VAL 79 HA VAL 79 11.745 -3.044 -0.563 540 HB VAL 79 HB VAL 79 9.102 -2.248 -1.826 541 HG11 VAL 79 HG11 VAL 79 9.305 -0.191 -0.517 542 HG12 VAL 79 HG12 VAL 79 10.799 -0.792 0.204 543 HG13 VAL 79 HG13 VAL 79 9.271 -1.609 0.533 544 HG21 VAL 79 HG21 VAL 79 10.296 -0.328 -2.754 545 HG22 VAL 79 HG22 VAL 79 10.933 -1.852 -3.372 546 HG23 VAL 79 HG23 VAL 79 11.811 -0.969 -2.123 547 H ARG 80 H ARG 80 11.162 -3.571 1.424 548 HA ARG 80 HA ARG 80 9.460 -5.754 1.980 549 HB2 ARG 80 HB2 ARG 80 11.395 -5.150 3.348 550 HB3 ARG 80 HB3 ARG 80 10.634 -3.633 3.787 551 HG2 ARG 80 HG2 ARG 80 8.878 -4.873 4.970 552 HG3 ARG 80 HG3 ARG 80 9.685 -6.387 4.548 553 HD2 ARG 80 HD2 ARG 80 10.945 -4.149 6.133 554 HD3 ARG 80 HD3 ARG 80 10.224 -5.593 6.841 555 HE ARG 80 HE ARG 80 11.987 -6.765 5.314 556 HH11 ARG 80 HH11 ARG 80 12.480 -3.716 7.020 557 HH12 ARG 80 HH12 ARG 80 14.173 -3.997 7.289 558 HH21 ARG 80 HH21 ARG 80 14.228 -7.122 5.680 559 HH22 ARG 80 HH22 ARG 80 15.154 -5.931 6.543 560 H PHE 81 H PHE 81 7.378 -5.531 1.400 561 HA PHE 81 HA PHE 81 5.857 -3.263 2.479 562 HB2 PHE 81 HB2 PHE 81 5.200 -5.222 0.267 563 HB3 PHE 81 HB3 PHE 81 4.009 -4.133 0.961 564 HD1 PHE 81 HD2 PHE 81 4.793 -1.586 1.010 565 HD2 PHE 81 HD1 PHE 81 6.256 -4.567 -1.652 566 HE1 PHE 81 HE2 PHE 81 5.472 0.169 -0.575 567 HE2 PHE 81 HE1 PHE 81 6.936 -2.818 -3.242 568 HZ PHE 81 HZ PHE 81 6.544 -0.446 -2.704 569 H LYS 82 H LYS 82 4.640 -3.581 4.183 570 HA LYS 82 HA LYS 82 3.975 -6.352 4.913 571 HB2 LYS 82 HB2 LYS 82 5.786 -5.409 6.308 572 HB3 LYS 82 HB3 LYS 82 4.727 -4.088 6.768 573 HG2 LYS 82 HG2 LYS 82 4.815 -5.680 8.544 574 HG3 LYS 82 HG3 LYS 82 3.207 -5.715 7.824 575 HD2 LYS 82 HD2 LYS 82 3.875 -7.712 6.531 576 HD3 LYS 82 HD3 LYS 82 5.438 -7.687 7.357 577 HE2 LYS 82 HE2 LYS 82 4.266 -7.877 9.508 578 HE3 LYS 82 HE3 LYS 82 2.736 -7.991 8.640 579 HZ1 LYS 82 HZ1 LYS 82 5.009 -9.877 8.427 580 HZ2 LYS 82 HZ2 LYS 82 3.566 -9.985 7.549 581 HZ3 LYS 82 HZ3 LYS 82 3.548 -10.164 9.234 582 H ASP 83 H ASP 83 1.962 -6.777 5.348 583 HA ASP 83 HA ASP 83 -0.099 -4.777 5.158 584 HB2 ASP 83 HB2 ASP 83 -0.211 -7.738 5.793 585 HB3 ASP 83 HB3 ASP 83 -1.625 -6.712 5.620 586 H PHE 84 H PHE 84 -0.865 -3.660 6.798 587 HA PHE 84 HA PHE 84 -0.489 -4.658 9.547 588 HB2 PHE 84 HB2 PHE 84 0.239 -2.099 8.293 589 HB3 PHE 84 HB3 PHE 84 -0.668 -1.921 9.785 590 HD1 PHE 84 HD1 PHE 84 2.053 -4.260 8.714 591 HD2 PHE 84 HD2 PHE 84 0.712 -1.333 11.480 592 HE1 PHE 84 HE1 PHE 84 4.114 -4.551 10.021 593 HE2 PHE 84 HE2 PHE 84 2.770 -1.617 12.792 594 HZ PHE 84 HZ PHE 84 4.474 -3.231 12.063 595 H SER 85 H SER 85 -2.666 -4.356 7.291 596 HA SER 85 HA SER 85 -4.766 -2.762 8.095 597 HB2 SER 85 HB2 SER 85 -5.027 -5.471 6.787 598 HB3 SER 85 HB3 SER 85 -6.117 -4.091 6.627 599 HG SER 85 HG SER 85 -4.875 -3.908 4.871 600 H GLU 86 H GLU 86 -6.419 -2.891 9.495 601 HA GLU 86 HA GLU 86 -6.594 -5.267 11.220 602 HB2 GLU 86 HB2 GLU 86 -5.775 -2.662 11.939 603 HB3 GLU 86 HB3 GLU 86 -7.411 -2.825 12.550 604 HG2 GLU 86 HG2 GLU 86 -5.152 -4.722 13.132 605 HG3 GLU 86 HG3 GLU 86 -5.666 -3.409 14.188 606 H ASN 87 H ASN 87 -8.657 -5.845 11.837 607 HA ASN 87 HA ASN 87 -10.906 -6.135 11.800 608 HB2 ASN 87 HB2 ASN 87 -10.989 -3.129 11.468 609 HB3 ASN 87 HB3 ASN 87 -12.371 -4.137 11.871 610 HD21 ASN 87 HD21 ASN 87 -9.585 -2.542 13.027 611 HD22 ASN 87 HD22 ASN 87 -9.765 -2.949 14.694 612 H ALA 88 H ALA 88 -9.538 -6.424 9.277 613 HA ALA 88 HA ALA 88 -11.517 -5.367 7.368 614 HB1 ALA 88 HB1 ALA 88 -9.282 -4.444 7.061 615 HB2 ALA 88 HB2 ALA 88 -9.767 -5.429 5.680 616 HB3 ALA 88 HB3 ALA 88 -8.633 -6.074 6.867 617 H THR 89 H THR 89 -12.486 -6.641 5.975 618 HA THR 89 HA THR 89 -12.288 -9.519 6.329 619 HB THR 89 HB THR 89 -14.178 -8.024 4.499 620 HG1 THR 89 HG1 THR 89 -15.386 -8.694 6.776 621 HG21 THR 89 HG21 THR 89 -14.077 -10.463 4.216 622 HG22 THR 89 HG22 THR 89 -15.634 -9.955 4.865 623 HG23 THR 89 HG23 THR 89 -14.430 -10.676 5.933 624 H SER 90 H SER 90 -12.014 -7.062 3.771 625 HA SER 90 HA SER 90 -10.629 -9.016 2.059 626 HB2 SER 90 HB2 SER 90 -12.500 -6.803 1.157 627 HB3 SER 90 HB3 SER 90 -11.674 -7.958 0.112 628 HG SER 90 HG SER 90 -13.099 -9.445 0.601 629 H ARG 91 H ARG 91 -8.950 -8.124 0.722 630 HA ARG 91 HA ARG 91 -8.285 -5.308 1.181 631 HB2 ARG 91 HB2 ARG 91 -5.945 -5.775 1.545 632 HB3 ARG 91 HB3 ARG 91 -6.894 -6.667 2.721 633 HG2 ARG 91 HG2 ARG 91 -6.649 -8.671 1.179 634 HG3 ARG 91 HG3 ARG 91 -5.433 -7.725 0.319 635 HD2 ARG 91 HD2 ARG 91 -4.322 -9.130 1.919 636 HD3 ARG 91 HD3 ARG 91 -4.211 -7.455 2.465 637 HE ARG 91 HE ARG 91 -6.461 -8.903 3.544 638 HH11 ARG 91 HH11 ARG 91 -3.101 -8.022 4.045 639 HH12 ARG 91 HH12 ARG 91 -3.146 -8.370 5.752 640 HH21 ARG 91 HH21 ARG 91 -6.513 -9.340 5.764 641 HH22 ARG 91 HH22 ARG 91 -5.089 -9.108 6.728 642 H LEU 92 H LEU 92 -7.049 -4.312 -0.444 643 HA LEU 92 HA LEU 92 -6.609 -5.814 -2.911 644 HB2 LEU 92 HB2 LEU 92 -8.843 -4.791 -3.092 645 HB3 LEU 92 HB3 LEU 92 -8.156 -3.220 -2.732 646 HG LEU 92 HG LEU 92 -6.849 -3.351 -4.851 647 HD11 LEU 92 HD11 LEU 92 -8.520 -5.810 -5.354 648 HD12 LEU 92 HD12 LEU 92 -6.776 -5.782 -5.085 649 HD13 LEU 92 HD13 LEU 92 -7.461 -5.015 -6.520 650 HD21 LEU 92 HD21 LEU 92 -8.757 -2.946 -6.330 651 HD22 LEU 92 HD22 LEU 92 -8.960 -2.150 -4.769 652 HD23 LEU 92 HD23 LEU 92 -9.837 -3.640 -5.120 653 H TRP 93 H TRP 93 -4.576 -5.512 -3.439 654 HA TRP 93 HA TRP 93 -3.149 -3.128 -2.572 655 HB2 TRP 93 HB2 TRP 93 -2.326 -5.759 -3.762 656 HB3 TRP 93 HB3 TRP 93 -1.224 -4.391 -3.803 657 HD1 TRP 93 HD1 TRP 93 -2.165 -7.251 -1.679 658 HE1 TRP 93 HE1 TRP 93 -1.054 -7.038 0.644 659 HE3 TRP 93 HE3 TRP 93 -0.726 -2.341 -1.899 660 HZ2 TRP 93 HZ2 TRP 93 0.215 -5.048 2.180 661 HZ3 TRP 93 HZ3 TRP 93 0.426 -1.367 0.043 662 HH2 TRP 93 HH2 TRP 93 0.883 -2.692 2.037 663 H MET 94 H MET 94 -3.280 -1.416 -3.794 664 HA MET 94 HA MET 94 -3.414 -1.731 -6.716 665 HB2 MET 94 HB2 MET 94 -4.387 0.558 -4.986 666 HB3 MET 94 HB3 MET 94 -4.420 0.546 -6.744 667 HG2 MET 94 HG2 MET 94 -5.913 -1.409 -6.677 668 HG3 MET 94 HG3 MET 94 -5.921 -1.317 -4.918 669 HE1 MET 94 HE1 MET 94 -6.046 1.578 -7.628 670 HE2 MET 94 HE2 MET 94 -7.787 1.838 -7.731 671 HE3 MET 94 HE3 MET 94 -7.089 0.313 -8.279 672 H PHE 95 H PHE 95 -1.294 -1.794 -7.182 673 HA PHE 95 HA PHE 95 0.569 0.103 -6.059 674 HB2 PHE 95 HB2 PHE 95 0.924 -2.044 -8.163 675 HB3 PHE 95 HB3 PHE 95 2.230 -1.050 -7.531 676 HD1 PHE 95 HD2 PHE 95 2.688 -1.163 -5.022 677 HD2 PHE 95 HD1 PHE 95 0.317 -4.019 -7.101 678 HE1 PHE 95 HE2 PHE 95 3.029 -2.771 -3.191 679 HE2 PHE 95 HE1 PHE 95 0.651 -5.632 -5.276 680 HZ PHE 95 HZ PHE 95 2.007 -5.008 -3.317 681 H GLY 96 H GLY 96 -1.276 -0.254 -8.986 682 HA2 GLY 96 HA2 GLY 96 -1.711 1.530 -10.494 683 HA3 GLY 96 HA3 GLY 96 -0.196 2.281 -10.008 684 H ASP 97 H ASP 97 0.875 -0.617 -10.273 685 HA ASP 97 HA ASP 97 1.304 -0.541 -13.186 686 HB2 ASP 97 HB2 ASP 97 3.362 -1.054 -11.029 687 HB3 ASP 97 HB3 ASP 97 3.629 -1.374 -12.737 688 H GLY 98 H GLY 98 0.414 -2.271 -13.998 689 HA2 GLY 98 HA2 GLY 98 0.310 -4.561 -14.461 690 HA3 GLY 98 HA3 GLY 98 1.081 -4.893 -12.918 691 H ASN 99 H ASN 99 -0.540 -6.534 -12.732 692 HA ASN 99 HA ASN 99 -3.301 -5.830 -12.416 693 HB2 ASN 99 HB2 ASN 99 -3.620 -8.190 -11.764 694 HB3 ASN 99 HB3 ASN 99 -2.739 -8.026 -13.274 695 HD21 ASN 99 HD21 ASN 99 -2.665 -9.124 -10.033 696 HD22 ASN 99 HD22 ASN 99 -1.089 -9.843 -10.058 697 H THR 100 H THR 100 -4.557 -5.904 -10.568 698 HA THR 100 HA THR 100 -3.216 -5.084 -8.129 699 HB THR 100 HB THR 100 -5.701 -4.825 -7.381 700 HG1 THR 100 HG1 THR 100 -7.006 -5.612 -8.873 701 HG21 THR 100 HG21 THR 100 -5.856 -2.645 -8.496 702 HG22 THR 100 HG22 THR 100 -4.555 -3.118 -9.591 703 HG23 THR 100 HG23 THR 100 -4.234 -2.940 -7.866 704 H SER 101 H SER 101 -3.256 -6.117 -6.228 705 HA SER 101 HA SER 101 -3.109 -7.812 -4.788 706 HB2 SER 101 HB2 SER 101 -5.878 -8.218 -5.838 707 HB3 SER 101 HB3 SER 101 -5.210 -9.290 -4.609 708 HG SER 101 HG SER 101 -6.025 -7.755 -3.379 709 H ASP 102 H ASP 102 -1.400 -8.955 -5.421 710 HA ASP 102 HA ASP 102 -2.126 -11.639 -6.371 711 HB2 ASP 102 HB2 ASP 102 0.572 -10.296 -6.119 712 HB3 ASP 102 HB3 ASP 102 0.405 -12.034 -6.330 713 H SER 103 H SER 103 -0.444 -13.253 -4.992 714 HA SER 103 HA SER 103 -1.302 -13.181 -2.309 715 HB2 SER 103 HB2 SER 103 0.488 -14.936 -1.941 716 HB3 SER 103 HB3 SER 103 -0.673 -15.312 -3.209 717 HG SER 103 HG SER 103 0.860 -14.899 -4.744 718 HA PRO 104 HA PRO 104 0.981 -9.778 -0.774 719 HB2 PRO 104 HB2 PRO 104 0.895 -11.179 1.847 720 HB3 PRO 104 HB3 PRO 104 0.328 -9.566 1.411 721 HG2 PRO 104 HG2 PRO 104 -1.420 -11.516 1.793 722 HG3 PRO 104 HG3 PRO 104 -1.641 -10.379 0.447 723 HD2 PRO 104 HD2 PRO 104 -0.542 -13.167 0.411 724 HD3 PRO 104 HD3 PRO 104 -1.700 -12.405 -0.703 725 H SER 105 H SER 105 2.962 -9.449 -1.194 726 HA SER 105 HA SER 105 5.205 -10.489 0.197 727 HB2 SER 105 HB2 SER 105 4.412 -12.349 -1.521 728 HB3 SER 105 HB3 SER 105 5.106 -11.270 -2.726 729 HG SER 105 HG SER 105 6.529 -12.247 -0.463 730 HA PRO 106 HA PRO 106 6.861 -6.749 -2.080 731 HB2 PRO 106 HB2 PRO 106 9.371 -7.768 -2.809 732 HB3 PRO 106 HB3 PRO 106 9.016 -6.836 -1.352 733 HG2 PRO 106 HG2 PRO 106 9.330 -9.766 -1.700 734 HG3 PRO 106 HG3 PRO 106 9.720 -8.750 -0.302 735 HD2 PRO 106 HD2 PRO 106 7.556 -10.370 -0.369 736 HD3 PRO 106 HD3 PRO 106 7.572 -8.834 0.519 737 H LEU 107 H LEU 107 5.587 -6.762 -3.897 738 HA LEU 107 HA LEU 107 5.911 -8.898 -5.846 739 HB2 LEU 107 HB2 LEU 107 3.809 -6.750 -5.588 740 HB3 LEU 107 HB3 LEU 107 3.807 -8.002 -6.815 741 HG LEU 107 HG LEU 107 3.665 -8.541 -3.846 742 HD11 LEU 107 HD11 LEU 107 1.682 -7.340 -4.605 743 HD12 LEU 107 HD12 LEU 107 1.303 -9.018 -4.217 744 HD13 LEU 107 HD13 LEU 107 1.459 -8.516 -5.900 745 HD21 LEU 107 HD21 LEU 107 2.990 -10.788 -4.550 746 HD22 LEU 107 HD22 LEU 107 4.604 -10.383 -5.133 747 HD23 LEU 107 HD23 LEU 107 3.230 -10.332 -6.237 748 H HIS 108 H HIS 108 5.658 -5.326 -5.924 749 HA HIS 108 HA HIS 108 6.532 -5.440 -8.691 750 HB2 HIS 108 HB2 HIS 108 4.573 -4.001 -7.933 751 HB3 HIS 108 HB3 HIS 108 5.766 -2.917 -7.217 752 HD1 HIS 108 HD1 HIS 108 5.143 -4.521 -10.611 753 HD2 HIS 108 HD2 HIS 108 6.598 -0.992 -8.951 754 HE1 HIS 108 HE1 HIS 108 5.791 -3.069 -12.566 755 HE2 HIS 108 HE2 HIS 108 6.482 -0.876 -11.539 756 H THR 109 H THR 109 8.543 -5.457 -9.124 757 HA THR 109 HA THR 109 10.611 -4.210 -7.585 758 HB THR 109 HB THR 109 10.608 -5.309 -10.417 759 HG1 THR 109 HG1 THR 109 11.231 -6.464 -7.890 760 HG21 THR 109 HG21 THR 109 12.948 -4.716 -8.597 761 HG22 THR 109 HG22 THR 109 12.512 -3.805 -10.043 762 HG23 THR 109 HG23 THR 109 13.038 -5.483 -10.184 763 H PHE 110 H PHE 110 11.252 -2.125 -7.724 764 HA PHE 110 HA PHE 110 10.032 -0.435 -9.763 765 HB2 PHE 110 HB2 PHE 110 11.750 0.332 -7.388 766 HB3 PHE 110 HB3 PHE 110 10.918 1.454 -8.460 767 HD1 PHE 110 HD1 PHE 110 8.272 0.521 -8.745 768 HD2 PHE 110 HD2 PHE 110 10.774 0.275 -5.318 769 HE1 PHE 110 HE1 PHE 110 6.282 0.411 -7.303 770 HE2 PHE 110 HE2 PHE 110 8.788 0.164 -3.872 771 HZ PHE 110 HZ PHE 110 6.539 0.230 -4.867 772 H PHE 111 H PHE 111 11.034 -0.661 -11.611 773 HA PHE 111 HA PHE 111 13.819 -1.353 -11.817 774 HB2 PHE 111 HB2 PHE 111 12.020 -0.563 -14.117 775 HB3 PHE 111 HB3 PHE 111 13.430 -1.609 -14.157 776 HD1 PHE 111 HD1 PHE 111 13.258 -3.894 -13.068 777 HD2 PHE 111 HD2 PHE 111 9.882 -1.419 -13.818 778 HE1 PHE 111 HE1 PHE 111 11.782 -5.851 -12.881 779 HE2 PHE 111 HE2 PHE 111 8.401 -3.370 -13.622 780 HZ PHE 111 HZ PHE 111 9.350 -5.589 -13.152 781 H ASN 112 H ASN 112 11.866 1.506 -12.225 782 HA ASN 112 HA ASN 112 14.196 3.008 -13.229 783 HB2 ASN 112 HB2 ASN 112 11.274 3.557 -13.838 784 HB3 ASN 112 HB3 ASN 112 12.642 4.486 -14.435 785 HD21 ASN 112 HD21 ASN 112 10.710 1.678 -14.806 786 HD22 ASN 112 HD22 ASN 112 11.461 1.080 -16.247 787 H GLU 113 H GLU 113 14.253 5.255 -12.653 788 HA GLU 113 HA GLU 113 13.426 5.935 -10.004 789 HB2 GLU 113 HB2 GLU 113 15.425 6.929 -10.971 790 HB3 GLU 113 HB3 GLU 113 14.488 7.618 -12.286 791 HG2 GLU 113 HG2 GLU 113 13.308 9.052 -10.676 792 HG3 GLU 113 HG3 GLU 113 14.298 8.383 -9.379 793 H GLY 114 H GLY 114 11.625 6.958 -9.348 794 HA2 GLY 114 HA2 GLY 114 9.988 8.628 -10.887 795 HA3 GLY 114 HA3 GLY 114 9.335 6.994 -10.980 796 H GLU 115 H GLU 115 7.521 8.297 -9.890 797 HA GLU 115 HA GLU 115 7.922 7.970 -6.990 798 HB2 GLU 115 HB2 GLU 115 7.692 10.365 -7.762 799 HB3 GLU 115 HB3 GLU 115 6.044 9.973 -8.236 800 HG2 GLU 115 HG2 GLU 115 5.475 9.420 -5.947 801 HG3 GLU 115 HG3 GLU 115 7.145 9.691 -5.443 802 H TYR 116 H TYR 116 6.759 6.402 -6.219 803 HA TYR 116 HA TYR 116 4.466 5.419 -7.795 804 HB2 TYR 116 HB2 TYR 116 6.386 3.779 -6.111 805 HB3 TYR 116 HB3 TYR 116 5.092 3.158 -7.124 806 HD1 TYR 116 HD2 TYR 116 8.485 4.540 -7.071 807 HD2 TYR 116 HD1 TYR 116 5.367 3.031 -9.542 808 HE1 TYR 116 HE2 TYR 116 10.067 4.336 -8.937 809 HE2 TYR 116 HE1 TYR 116 6.945 2.819 -11.411 810 HH TYR 116 HH TYR 116 10.357 3.253 -10.994 811 H ILE 117 H ILE 117 2.752 6.124 -6.662 812 HA ILE 117 HA ILE 117 2.789 6.007 -3.760 813 HB ILE 117 HB ILE 117 0.521 6.933 -5.547 814 HG12 ILE 117 HG12 ILE 117 2.568 8.560 -4.006 815 HG13 ILE 117 HG13 ILE 117 2.597 8.309 -5.747 816 HG21 ILE 117 HG21 ILE 117 -0.235 6.206 -3.341 817 HG22 ILE 117 HG22 ILE 117 -0.335 7.963 -3.467 818 HG23 ILE 117 HG23 ILE 117 0.989 7.217 -2.567 819 HD11 ILE 117 HD11 ILE 117 0.443 9.734 -4.206 820 HD12 ILE 117 HD12 ILE 117 0.467 9.481 -5.950 821 HD13 ILE 117 HD13 ILE 117 1.698 10.489 -5.189 822 H VAL 118 H VAL 118 2.487 4.168 -2.883 823 HA VAL 118 HA VAL 118 0.969 2.054 -4.127 824 HB VAL 118 HB VAL 118 2.468 2.177 -1.485 825 HG11 VAL 118 HG11 VAL 118 1.271 -0.216 -2.884 826 HG12 VAL 118 HG12 VAL 118 0.736 0.487 -1.354 827 HG13 VAL 118 HG13 VAL 118 2.323 -0.269 -1.467 828 HG21 VAL 118 HG21 VAL 118 3.940 2.370 -3.405 829 HG22 VAL 118 HG22 VAL 118 3.224 0.928 -4.126 830 HG23 VAL 118 HG23 VAL 118 4.148 0.799 -2.628 831 H SER 119 H SER 119 -1.135 1.614 -3.678 832 HA SER 119 HA SER 119 -2.298 2.953 -1.334 833 HB2 SER 119 HB2 SER 119 -3.094 3.806 -3.575 834 HB3 SER 119 HB3 SER 119 -3.768 2.204 -3.868 835 HG SER 119 HG SER 119 -5.440 3.193 -2.968 836 H LEU 120 H LEU 120 -3.299 1.764 0.079 837 HA LEU 120 HA LEU 120 -4.031 -1.010 -0.583 838 HB2 LEU 120 HB2 LEU 120 -2.147 -0.837 1.035 839 HB3 LEU 120 HB3 LEU 120 -3.148 0.125 2.088 840 HG LEU 120 HG LEU 120 -2.723 -2.334 2.688 841 HD11 LEU 120 HD11 LEU 120 -4.286 -0.956 3.879 842 HD12 LEU 120 HD12 LEU 120 -4.915 -2.591 3.687 843 HD13 LEU 120 HD13 LEU 120 -5.530 -1.284 2.675 844 HD21 LEU 120 HD21 LEU 120 -4.859 -2.751 0.604 845 HD22 LEU 120 HD22 LEU 120 -4.323 -3.952 1.779 846 HD23 LEU 120 HD23 LEU 120 -3.204 -3.360 0.551 847 H ILE 121 H ILE 121 -6.143 -1.311 -0.590 848 HA ILE 121 HA ILE 121 -7.787 0.392 1.134 849 HB ILE 121 HB ILE 121 -8.293 1.163 -1.061 850 HG12 ILE 121 HG12 ILE 121 -10.482 -0.794 -0.327 851 HG13 ILE 121 HG13 ILE 121 -10.227 0.757 0.459 852 HG21 ILE 121 HG21 ILE 121 -9.021 -0.283 -2.906 853 HG22 ILE 121 HG22 ILE 121 -8.661 -1.700 -1.918 854 HG23 ILE 121 HG23 ILE 121 -7.363 -0.608 -2.401 855 HD11 ILE 121 HD11 ILE 121 -10.684 1.891 -1.661 856 HD12 ILE 121 HD12 ILE 121 -12.033 0.879 -1.146 857 HD13 ILE 121 HD13 ILE 121 -10.957 0.329 -2.430 858 H VAL 122 H VAL 122 -9.055 -0.636 2.495 859 HA VAL 122 HA VAL 122 -9.397 -3.535 2.125 860 HB VAL 122 HB VAL 122 -9.588 -3.649 4.676 861 HG11 VAL 122 HG11 VAL 122 -6.914 -3.016 3.429 862 HG12 VAL 122 HG12 VAL 122 -7.712 -4.590 3.439 863 HG13 VAL 122 HG13 VAL 122 -7.164 -3.868 4.952 864 HG21 VAL 122 HG21 VAL 122 -8.390 -1.968 5.949 865 HG22 VAL 122 HG22 VAL 122 -9.729 -1.224 5.070 866 HG23 VAL 122 HG23 VAL 122 -8.074 -1.051 4.477 867 H SER 123 H SER 123 -11.327 -4.427 3.169 868 HA SER 123 HA SER 123 -13.538 -2.513 3.267 869 HB2 SER 123 HB2 SER 123 -13.496 -4.985 1.515 870 HB3 SER 123 HB3 SER 123 -14.861 -3.887 1.730 871 HG SER 123 HG SER 123 -12.770 -2.416 1.070 872 H ASN 124 H ASN 124 -15.363 -3.276 4.308 873 HA ASN 124 HA ASN 124 -15.399 -5.869 5.594 874 HB2 ASN 124 HB2 ASN 124 -14.050 -4.447 7.146 875 HB3 ASN 124 HB3 ASN 124 -15.342 -3.264 7.182 876 HD21 ASN 124 HD21 ASN 124 -14.350 -6.454 8.217 877 HD22 ASN 124 HD22 ASN 124 -15.486 -6.597 9.513 878 H GLU 125 H GLU 125 -17.657 -5.771 7.007 879 HA GLU 125 HA GLU 125 -19.645 -5.040 5.040 880 HB2 GLU 125 HB2 GLU 125 -21.222 -6.156 6.603 881 HB3 GLU 125 HB3 GLU 125 -19.867 -7.178 6.149 882 HG2 GLU 125 HG2 GLU 125 -18.773 -6.577 8.307 883 HG3 GLU 125 HG3 GLU 125 -20.243 -5.710 8.751 884 H ASN 126 H ASN 126 -18.228 -3.537 7.721 885 HA ASN 126 HA ASN 126 -20.521 -1.856 8.359 886 HB2 ASN 126 HB2 ASN 126 -18.880 -2.763 10.091 887 HB3 ASN 126 HB3 ASN 126 -17.692 -1.646 9.428 888 HD21 ASN 126 HD21 ASN 126 -17.510 -0.557 11.351 889 HD22 ASN 126 HD22 ASN 126 -18.740 0.507 11.934 890 H ASP 127 H ASP 127 -17.138 -1.330 7.395 891 HA ASP 127 HA ASP 127 -17.937 0.865 5.631 892 HB2 ASP 127 HB2 ASP 127 -15.941 1.118 7.887 893 HB3 ASP 127 HB3 ASP 127 -15.931 2.201 6.503 894 H SER 128 H SER 128 -15.936 1.642 4.345 895 HA SER 128 HA SER 128 -13.725 -0.251 4.304 896 HB2 SER 128 HB2 SER 128 -13.773 -0.165 1.745 897 HB3 SER 128 HB3 SER 128 -15.004 -1.168 2.509 898 HG SER 128 HG SER 128 -15.371 1.502 1.582 899 H ASP 129 H ASP 129 -11.785 0.766 3.967 900 HA ASP 129 HA ASP 129 -11.830 3.577 3.165 901 HB2 ASP 129 HB2 ASP 129 -10.608 4.340 5.047 902 HB3 ASP 129 HB3 ASP 129 -11.967 3.424 5.675 903 H SER 130 H SER 130 -9.703 4.445 2.669 904 HA SER 130 HA SER 130 -7.745 2.396 1.903 905 HB2 SER 130 HB2 SER 130 -7.457 3.680 -0.278 906 HB3 SER 130 HB3 SER 130 -8.948 2.750 -0.126 907 HG SER 130 HG SER 130 -9.012 5.402 0.740 908 H ALA 131 H ALA 131 -5.613 3.050 1.877 909 HA ALA 131 HA ALA 131 -4.993 5.851 2.479 910 HB1 ALA 131 HB1 ALA 131 -5.024 4.686 4.648 911 HB2 ALA 131 HB2 ALA 131 -3.399 5.217 4.216 912 HB3 ALA 131 HB3 ALA 131 -3.850 3.523 4.032 913 H SER 132 H SER 132 -3.088 6.550 1.741 914 HA SER 132 HA SER 132 -1.704 4.732 -0.099 915 HB2 SER 132 HB2 SER 132 -2.494 7.621 -0.562 916 HB3 SER 132 HB3 SER 132 -1.607 6.601 -1.682 917 HG SER 132 HG SER 132 -3.659 5.185 -1.241 918 H VAL 133 H VAL 133 0.478 4.925 -0.200 919 HA VAL 133 HA VAL 133 1.779 7.003 1.439 920 HB VAL 133 HB VAL 133 2.558 4.070 1.243 921 HG11 VAL 133 HG11 VAL 133 4.587 5.391 1.152 922 HG12 VAL 133 HG12 VAL 133 4.450 4.601 2.725 923 HG13 VAL 133 HG13 VAL 133 4.076 6.318 2.564 924 HG21 VAL 133 HG21 VAL 133 0.823 4.461 2.871 925 HG22 VAL 133 HG22 VAL 133 1.754 5.773 3.599 926 HG23 VAL 133 HG23 VAL 133 2.340 4.112 3.701 927 H THR 134 H THR 134 3.212 8.172 0.355 928 HA THR 134 HA THR 134 3.749 7.631 -2.418 929 HB THR 134 HB THR 134 4.669 9.881 -0.608 930 HG1 THR 134 HG1 THR 134 2.348 9.689 -1.019 931 HG21 THR 134 HG21 THR 134 5.123 11.108 -2.680 932 HG22 THR 134 HG22 THR 134 4.725 9.665 -3.617 933 HG23 THR 134 HG23 THR 134 6.128 9.666 -2.546 934 H ILE 135 H ILE 135 5.296 6.276 -2.979 935 HA ILE 135 HA ILE 135 7.736 6.070 -1.357 936 HB ILE 135 HB ILE 135 7.000 4.313 -3.713 937 HG12 ILE 135 HG12 ILE 135 5.231 4.021 -2.067 938 HG13 ILE 135 HG13 ILE 135 6.254 2.591 -2.097 939 HG21 ILE 135 HG21 ILE 135 8.608 2.731 -2.739 940 HG22 ILE 135 HG22 ILE 135 8.965 3.892 -1.461 941 HG23 ILE 135 HG23 ILE 135 9.356 4.279 -3.137 942 HD11 ILE 135 HD11 ILE 135 6.303 4.776 -0.029 943 HD12 ILE 135 HD12 ILE 135 7.364 3.366 -0.054 944 HD13 ILE 135 HD13 ILE 135 5.625 3.158 0.163 945 H ARG 136 H ARG 136 9.391 7.282 -1.996 946 HA ARG 136 HA ARG 136 9.383 8.341 -4.718 947 HB2 ARG 136 HB2 ARG 136 10.850 9.187 -2.217 948 HB3 ARG 136 HB3 ARG 136 11.120 9.909 -3.797 949 HG2 ARG 136 HG2 ARG 136 8.757 10.607 -3.858 950 HG3 ARG 136 HG3 ARG 136 8.538 9.940 -2.239 951 HD2 ARG 136 HD2 ARG 136 8.903 12.378 -2.224 952 HD3 ARG 136 HD3 ARG 136 10.155 11.505 -1.340 953 HE ARG 136 HE ARG 136 11.104 11.800 -3.910 954 HH11 ARG 136 HH11 ARG 136 10.114 14.020 -1.368 955 HH12 ARG 136 HH12 ARG 136 11.252 15.244 -1.834 956 HH21 ARG 136 HH21 ARG 136 12.583 13.374 -4.499 957 HH22 ARG 136 HH22 ARG 136 12.667 14.872 -3.627 958 H ALA 137 H ALA 137 10.659 7.467 -6.159 959 HA ALA 137 HA ALA 137 12.900 5.794 -5.257 960 HB1 ALA 137 HB1 ALA 137 12.773 4.692 -7.418 961 HB2 ALA 137 HB2 ALA 137 11.489 5.790 -7.923 962 HB3 ALA 137 HB3 ALA 137 11.205 4.641 -6.612 963 H LEU 138 H LEU 138 14.869 6.268 -5.767 964 HA LEU 138 HA LEU 138 15.429 8.616 -7.442 965 HB2 LEU 138 HB2 LEU 138 17.023 7.321 -5.215 966 HB3 LEU 138 HB3 LEU 138 17.589 8.671 -6.179 967 HG LEU 138 HG LEU 138 15.107 8.804 -4.464 968 HD11 LEU 138 HD11 LEU 138 16.468 10.013 -2.834 969 HD12 LEU 138 HD12 LEU 138 17.911 9.699 -3.800 970 HD13 LEU 138 HD13 LEU 138 17.044 8.360 -3.047 971 HD21 LEU 138 HD21 LEU 138 15.413 11.218 -4.718 972 HD22 LEU 138 HD22 LEU 138 15.229 10.426 -6.285 973 HD23 LEU 138 HD23 LEU 138 16.825 10.933 -5.736 974 H GLU 139 H GLU 139 17.616 8.475 -8.527 975 HA GLU 139 HA GLU 139 18.009 5.767 -9.618 976 HB2 GLU 139 HB2 GLU 139 17.088 7.476 -11.196 977 HB3 GLU 139 HB3 GLU 139 18.557 8.414 -10.980 978 HG2 GLU 139 HG2 GLU 139 19.843 6.459 -11.851 979 HG3 GLU 139 HG3 GLU 139 18.300 5.692 -12.243 980 H HIS 140 H HIS 140 20.082 4.980 -9.808 981 HA HIS 140 HA HIS 140 22.184 6.295 -8.321 982 HB2 HIS 140 HB2 HIS 140 21.807 3.800 -8.311 983 HB3 HIS 140 HB3 HIS 140 22.328 3.760 -9.987 984 HD1 HIS 140 HD1 HIS 140 23.571 3.733 -6.545 985 HD2 HIS 140 HD2 HIS 140 25.141 4.353 -10.337 986 HE1 HIS 140 HE1 HIS 140 26.062 3.518 -6.285 987 HE2 HIS 140 HE2 HIS 140 27.002 3.970 -8.579 988 H HIS 141 H HIS 141 23.057 8.017 -9.264 989 HA HIS 141 HA HIS 141 24.235 7.762 -11.901 990 HB2 HIS 141 HB2 HIS 141 23.247 9.964 -12.660 991 HB3 HIS 141 HB3 HIS 141 22.147 8.599 -12.644 992 HD1 HIS 141 HD1 HIS 141 19.921 9.384 -12.037 993 HD2 HIS 141 HD2 HIS 141 22.850 11.401 -9.883 994 HE1 HIS 141 HE1 HIS 141 18.682 10.980 -10.530 995 HE2 HIS 141 HE2 HIS 141 20.471 12.232 -9.280 996 H HIS 142 H HIS 142 25.658 9.579 -12.450 997 HA HIS 142 HA HIS 142 26.933 10.595 -10.001 998 HB2 HIS 142 HB2 HIS 142 28.022 10.331 -12.820 999 HB3 HIS 142 HB3 HIS 142 28.913 10.996 -11.457 1000 HD1 HIS 142 HD1 HIS 142 28.494 7.986 -13.286 1001 HD2 HIS 142 HD2 HIS 142 29.134 8.912 -9.285 1002 HE1 HIS 142 HE1 HIS 142 29.377 5.877 -12.241 1003 HE2 HIS 142 HE2 HIS 142 29.893 6.501 -9.856 1004 H HIS 143 H HIS 143 27.726 12.736 -9.931 1005 HA HIS 143 HA HIS 143 26.485 14.608 -11.841 1006 HB2 HIS 143 HB2 HIS 143 25.725 14.785 -9.431 1007 HB3 HIS 143 HB3 HIS 143 27.377 15.202 -8.996 1008 HD1 HIS 143 HD1 HIS 143 28.117 17.603 -9.375 1009 HD2 HIS 143 HD2 HIS 143 24.322 16.786 -10.885 1010 HE1 HIS 143 HE1 HIS 143 27.136 19.840 -9.987 1011 HE2 HIS 143 HE2 HIS 143 24.816 19.336 -10.830 1012 H HIS 144 H HIS 144 28.049 14.901 -13.329 1013 HA HIS 144 HA HIS 144 30.844 14.981 -12.555 1014 HB2 HIS 144 HB2 HIS 144 29.920 13.830 -14.639 1015 HB3 HIS 144 HB3 HIS 144 29.707 15.438 -15.317 1016 HD1 HIS 144 HD1 HIS 144 31.738 16.573 -16.289 1017 HD2 HIS 144 HD2 HIS 144 32.659 13.047 -14.286 1018 HE1 HIS 144 HE1 HIS 144 34.134 16.080 -16.862 1019 HE2 HIS 144 HE2 HIS 144 34.617 13.860 -15.776 1020 H HIS 145 H HIS 145 31.853 16.759 -12.011 1021 HA HIS 145 HA HIS 145 30.764 19.356 -12.867 1022 HB2 HIS 145 HB2 HIS 145 31.028 18.795 -10.382 1023 HB3 HIS 145 HB3 HIS 145 32.765 18.868 -10.656 1024 HD1 HIS 145 HD1 HIS 145 33.648 20.999 -9.839 1025 HD2 HIS 145 HD2 HIS 145 29.875 21.468 -11.525 1026 HE1 HIS 145 HE1 HIS 145 33.112 23.448 -9.616 1027 HE2 HIS 145 HE2 HIS 145 30.764 23.679 -10.509 Start of MODEL 4 1 H1 MET 1 H1 MET 1-180.038 48.387 -51.277 2 H2 MET 1 H2 MET 1-179.087 49.724 -50.850 3 H3 MET 1 H3 MET 1-179.584 48.626 -49.661 4 HA MET 1 HA MET 1-178.268 46.889 -50.629 5 HB2 MET 1 HB2 MET 1-177.497 49.035 -52.619 6 HB3 MET 1 HB3 MET 1-176.619 47.524 -52.419 7 HG2 MET 1 HG2 MET 1-179.491 47.819 -53.256 8 HG3 MET 1 HG3 MET 1-178.133 47.410 -54.302 9 HE1 MET 1 HE1 MET 1-176.827 45.096 -54.213 10 HE2 MET 1 HE2 MET 1-177.112 43.868 -52.981 11 HE3 MET 1 HE3 MET 1-176.435 45.430 -52.526 12 H ASN 2 H ASN 2-177.252 46.830 -48.748 13 HA ASN 2 HA ASN 2-175.029 48.631 -48.261 14 HB2 ASN 2 HB2 ASN 2-175.954 48.980 -45.853 15 HB3 ASN 2 HB3 ASN 2-176.565 49.982 -47.160 16 HD21 ASN 2 HD21 ASN 2-177.310 47.358 -44.977 17 HD22 ASN 2 HD22 ASN 2-179.026 47.396 -45.218 18 H ALA 3 H ALA 3-173.694 47.982 -46.461 19 HA ALA 3 HA ALA 3-173.956 45.151 -45.713 20 HB1 ALA 3 HB1 ALA 3-171.622 44.731 -46.297 21 HB2 ALA 3 HB2 ALA 3-171.463 46.381 -46.898 22 HB3 ALA 3 HB3 ALA 3-172.541 45.246 -47.711 23 H ARG 4 H ARG 4-172.340 44.533 -44.008 24 HA ARG 4 HA ARG 4-171.376 46.822 -42.430 25 HB2 ARG 4 HB2 ARG 4-173.393 45.942 -41.315 26 HB3 ARG 4 HB3 ARG 4-172.688 44.333 -41.299 27 HG2 ARG 4 HG2 ARG 4-170.894 45.123 -39.823 28 HG3 ARG 4 HG3 ARG 4-171.598 46.740 -39.835 29 HD2 ARG 4 HD2 ARG 4-173.052 44.278 -38.867 30 HD3 ARG 4 HD3 ARG 4-172.134 45.356 -37.817 31 HE ARG 4 HE ARG 4-174.048 46.799 -39.347 32 HH11 ARG 4 HH11 ARG 4-173.812 44.690 -36.541 33 HH12 ARG 4 HH12 ARG 4-175.215 45.360 -35.764 34 HH21 ARG 4 HH21 ARG 4-175.882 47.675 -38.325 35 HH22 ARG 4 HH22 ARG 4-176.382 47.068 -36.779 36 H ASP 5 H ASP 5-169.290 46.684 -41.944 37 HA ASP 5 HA ASP 5-167.790 44.308 -42.641 38 HB2 ASP 5 HB2 ASP 5-166.829 46.883 -41.364 39 HB3 ASP 5 HB3 ASP 5-165.810 45.627 -42.057 40 H ASN 6 H ASN 6-166.651 42.995 -41.192 41 HA ASN 6 HA ASN 6-167.724 43.084 -38.474 42 HB2 ASN 6 HB2 ASN 6-167.879 40.947 -39.675 43 HB3 ASN 6 HB3 ASN 6-166.129 40.898 -39.845 44 HD21 ASN 6 HD21 ASN 6-168.762 40.799 -37.525 45 HD22 ASN 6 HD22 ASN 6-167.878 39.984 -36.281 46 H LYS 7 H LYS 7-166.650 44.173 -37.045 47 HA LYS 7 HA LYS 7-163.711 44.206 -37.142 48 HB2 LYS 7 HB2 LYS 7-165.597 46.199 -35.860 49 HB3 LYS 7 HB3 LYS 7-163.843 46.279 -35.803 50 HG2 LYS 7 HG2 LYS 7-163.782 46.531 -38.247 51 HG3 LYS 7 HG3 LYS 7-165.546 46.478 -38.280 52 HD2 LYS 7 HD2 LYS 7-163.936 48.518 -36.751 53 HD3 LYS 7 HD3 LYS 7-164.587 48.784 -38.368 54 HE2 LYS 7 HE2 LYS 7-166.843 48.501 -37.532 55 HE3 LYS 7 HE3 LYS 7-166.225 48.126 -35.923 56 HZ1 LYS 7 HZ1 LYS 7-166.955 50.422 -36.086 57 HZ2 LYS 7 HZ2 LYS 7-165.856 50.706 -37.346 58 HZ3 LYS 7 HZ3 LYS 7-165.291 50.334 -35.792 59 H PHE 8 H PHE 8-163.099 42.563 -35.909 60 HA PHE 8 HA PHE 8-163.955 42.618 -33.104 61 HB2 PHE 8 HB2 PHE 8-165.064 40.725 -34.287 62 HB3 PHE 8 HB3 PHE 8-163.481 40.101 -34.729 63 HD1 PHE 8 HD1 PHE 8-165.581 40.951 -31.784 64 HD2 PHE 8 HD2 PHE 8-162.364 38.624 -33.316 65 HE1 PHE 8 HE1 PHE 8-165.510 39.673 -29.683 66 HE2 PHE 8 HE2 PHE 8-162.289 37.348 -31.218 67 HZ PHE 8 HZ PHE 8-163.861 37.870 -29.401 68 H ASN 9 H ASN 9-162.257 42.967 -31.821 69 HA ASN 9 HA ASN 9-159.675 41.807 -32.575 70 HB2 ASN 9 HB2 ASN 9-158.480 43.811 -31.788 71 HB3 ASN 9 HB3 ASN 9-159.536 44.185 -33.139 72 HD21 ASN 9 HD21 ASN 9-158.866 44.748 -29.802 73 HD22 ASN 9 HD22 ASN 9-160.036 45.997 -29.563 74 H THR 10 H THR 10-158.500 40.948 -30.924 75 HA THR 10 HA THR 10-159.368 41.447 -28.179 76 HB THR 10 HB THR 10-158.846 38.651 -29.234 77 HG1 THR 10 HG1 THR 10-161.119 40.156 -29.150 78 HG21 THR 10 HG21 THR 10-159.639 37.923 -27.017 79 HG22 THR 10 HG22 THR 10-159.775 39.610 -26.518 80 HG23 THR 10 HG23 THR 10-158.193 38.926 -26.893 81 H TRP 11 H TRP 11-157.669 42.323 -27.292 82 HA TRP 11 HA TRP 11-154.999 41.544 -28.130 83 HB2 TRP 11 HB2 TRP 11-155.873 43.702 -26.186 84 HB3 TRP 11 HB3 TRP 11-154.234 43.452 -26.781 85 HD1 TRP 11 HD1 TRP 11-157.109 45.548 -27.401 86 HE1 TRP 11 HE1 TRP 11-157.041 46.613 -29.740 87 HE3 TRP 11 HE3 TRP 11-153.501 42.618 -29.517 88 HZ2 TRP 11 HZ2 TRP 11-155.652 46.248 -32.171 89 HZ3 TRP 11 HZ3 TRP 11-152.858 43.037 -31.851 90 HH2 TRP 11 HH2 TRP 11-153.913 44.815 -33.150 91 H ASN 12 H ASN 12-154.446 39.668 -27.295 92 HA ASN 12 HA ASN 12-155.171 39.044 -24.538 93 HB2 ASN 12 HB2 ASN 12-154.492 36.718 -25.152 94 HB3 ASN 12 HB3 ASN 12-155.825 37.356 -26.103 95 HD21 ASN 12 HD21 ASN 12-155.540 37.694 -28.291 96 HD22 ASN 12 HD22 ASN 12-154.151 37.138 -29.162 97 H ASP 13 H ASP 13-153.684 38.184 -23.060 98 HA ASP 13 HA ASP 13-150.850 38.367 -23.695 99 HB2 ASP 13 HB2 ASP 13-150.287 39.775 -21.827 100 HB3 ASP 13 HB3 ASP 13-151.523 40.608 -22.759 101 H SER 14 H SER 14-149.514 37.315 -22.068 102 HA SER 14 HA SER 14-150.966 35.546 -20.230 103 HB2 SER 14 HB2 SER 14-148.755 34.711 -22.128 104 HB3 SER 14 HB3 SER 14-149.356 33.714 -20.806 105 HG SER 14 HG SER 14-151.070 34.742 -22.802 106 H ARG 15 H ARG 15-149.966 35.199 -18.280 107 HA ARG 15 HA ARG 15-147.331 36.442 -17.891 108 HB2 ARG 15 HB2 ARG 15-148.080 37.307 -15.708 109 HB3 ARG 15 HB3 ARG 15-149.016 37.978 -17.032 110 HG2 ARG 15 HG2 ARG 15-150.807 36.333 -16.518 111 HG3 ARG 15 HG3 ARG 15-149.881 35.838 -15.100 112 HD2 ARG 15 HD2 ARG 15-149.967 38.164 -14.276 113 HD3 ARG 15 HD3 ARG 15-150.965 38.596 -15.663 114 HE ARG 15 HE ARG 15-152.269 36.506 -14.430 115 HH11 ARG 15 HH11 ARG 15-151.282 39.759 -13.522 116 HH12 ARG 15 HH12 ARG 15-152.532 39.939 -12.331 117 HH21 ARG 15 HH21 ARG 15-153.916 36.751 -12.882 118 HH22 ARG 15 HH22 ARG 15-154.040 38.225 -11.979 119 H GLY 16 H GLY 16-146.246 35.693 -15.861 120 HA2 GLY 16 HA2 GLY 16-147.111 33.163 -14.770 121 HA3 GLY 16 HA3 GLY 16-145.725 33.035 -15.843 122 H ASN 17 H ASN 17-146.182 32.689 -12.862 123 HA ASN 17 HA ASN 17-144.200 34.620 -11.857 124 HB2 ASN 17 HB2 ASN 17-146.033 32.731 -10.340 125 HB3 ASN 17 HB3 ASN 17-144.857 33.804 -9.591 126 HD21 ASN 17 HD21 ASN 17-145.237 36.036 -9.580 127 HD22 ASN 17 HD22 ASN 17-146.809 36.691 -9.894 128 H TYR 18 H TYR 18-142.178 34.025 -11.739 129 HA TYR 18 HA TYR 18-141.530 31.161 -11.707 130 HB2 TYR 18 HB2 TYR 18-140.119 33.547 -12.848 131 HB3 TYR 18 HB3 TYR 18-139.206 32.097 -12.438 132 HD1 TYR 18 HD1 TYR 18-141.959 33.396 -14.564 133 HD2 TYR 18 HD2 TYR 18-139.269 30.190 -13.799 134 HE1 TYR 18 HE1 TYR 18-142.601 32.359 -16.696 135 HE2 TYR 18 HE2 TYR 18-139.900 29.148 -15.935 136 HH TYR 18 HH TYR 18-141.713 30.782 -18.314 137 H TRP 19 H TRP 19-139.582 30.542 -10.547 138 HA TRP 19 HA TRP 19-139.240 32.035 -8.049 139 HB2 TRP 19 HB2 TRP 19-139.362 29.731 -6.897 140 HB3 TRP 19 HB3 TRP 19-140.874 30.462 -7.421 141 HD1 TRP 19 HD1 TRP 19-142.282 29.203 -9.226 142 HE1 TRP 19 HE1 TRP 19-142.122 26.886 -10.318 143 HE3 TRP 19 HE3 TRP 19-137.564 27.915 -7.728 144 HZ2 TRP 19 HZ2 TRP 19-140.264 24.792 -10.522 145 HZ3 TRP 19 HZ3 TRP 19-136.674 25.734 -8.426 146 HH2 TRP 19 HH2 TRP 19-137.995 24.209 -9.791 147 H SER 20 H SER 20-137.392 31.271 -6.754 148 HA SER 20 HA SER 20-135.477 29.481 -7.950 149 HB2 SER 20 HB2 SER 20-133.596 31.177 -7.845 150 HB3 SER 20 HB3 SER 20-134.751 31.429 -9.152 151 HG SER 20 HG SER 20-135.051 32.721 -6.664 152 H ASP 21 H ASP 21-134.721 28.318 -6.354 153 HA ASP 21 HA ASP 21-134.458 29.515 -3.675 154 HB2 ASP 21 HB2 ASP 21-135.005 27.242 -2.755 155 HB3 ASP 21 HB3 ASP 21-136.339 28.054 -3.561 156 H TYR 22 H TYR 22-133.032 27.961 -2.250 157 HA TYR 22 HA TYR 22-130.525 27.783 -3.804 158 HB2 TYR 22 HB2 TYR 22-130.847 28.584 -0.897 159 HB3 TYR 22 HB3 TYR 22-129.362 28.620 -1.842 160 HD1 TYR 22 HD1 TYR 22-129.255 30.251 -3.824 161 HD2 TYR 22 HD2 TYR 22-132.286 30.441 -0.842 162 HE1 TYR 22 HE1 TYR 22-129.776 32.555 -4.501 163 HE2 TYR 22 HE2 TYR 22-132.809 32.747 -1.510 164 HH TYR 22 HH TYR 22-131.654 34.646 -2.664 165 H GLU 23 H GLU 23-128.776 26.631 -2.246 166 HA GLU 23 HA GLU 23-129.988 24.047 -1.526 167 HB2 GLU 23 HB2 GLU 23-128.670 23.906 -3.574 168 HB3 GLU 23 HB3 GLU 23-127.282 24.618 -2.769 169 HG2 GLU 23 HG2 GLU 23-126.936 22.260 -3.011 170 HG3 GLU 23 HG3 GLU 23-127.155 22.630 -1.306 171 H GLY 24 H GLY 24-126.807 25.585 -0.965 172 HA2 GLY 24 HA2 GLY 24-126.286 26.279 1.370 173 HA3 GLY 24 HA3 GLY 24-127.017 24.758 1.866 174 H SER 25 H SER 25-124.229 25.859 2.197 175 HA SER 25 HA SER 25-122.797 23.481 1.347 176 HB2 SER 25 HB2 SER 25-122.778 25.221 -0.579 177 HB3 SER 25 HB3 SER 25-121.709 26.157 0.462 178 HG SER 25 HG SER 25-120.152 24.637 0.293 179 H ASP 26 H ASP 26-121.128 23.011 2.719 180 HA ASP 26 HA ASP 26-119.933 25.094 4.384 181 HB2 ASP 26 HB2 ASP 26-120.270 23.918 6.476 182 HB3 ASP 26 HB3 ASP 26-121.842 24.170 5.733 183 H GLU 27 H GLU 27-118.065 24.027 5.739 184 HA GLU 27 HA GLU 27-116.856 21.784 4.259 185 HB2 GLU 27 HB2 GLU 27-115.968 23.926 3.401 186 HB3 GLU 27 HB3 GLU 27-115.385 24.323 5.012 187 HG2 GLU 27 HG2 GLU 27-113.885 22.380 4.946 188 HG3 GLU 27 HG3 GLU 27-114.497 21.961 3.347 189 H ASN 28 H ASN 28-115.775 20.332 5.469 190 HA ASN 28 HA ASN 28-115.823 20.682 8.385 191 HB2 ASN 28 HB2 ASN 28-116.875 18.684 7.164 192 HB3 ASN 28 HB3 ASN 28-115.233 18.158 6.828 193 HD21 ASN 28 HD21 ASN 28-116.714 19.568 9.743 194 HD22 ASN 28 HD22 ASN 28-116.281 18.254 10.783 195 H GLY 29 H GLY 29-113.897 19.987 9.635 196 HA2 GLY 29 HA2 GLY 29-111.420 19.492 8.266 197 HA3 GLY 29 HA3 GLY 29-111.518 21.122 8.906 198 H ASP 30 H ASP 30-110.387 18.118 9.518 199 HA ASP 30 HA ASP 30-109.935 18.768 12.331 200 HB2 ASP 30 HB2 ASP 30-111.931 17.256 12.236 201 HB3 ASP 30 HB3 ASP 30-110.921 16.038 11.458 202 H GLY 31 H GLY 31-107.912 18.145 13.019 203 HA2 GLY 31 HA2 GLY 31-106.290 16.536 11.148 204 HA3 GLY 31 HA3 GLY 31-105.691 18.053 11.800 205 H ILE 32 H ILE 32-104.869 15.139 11.989 206 HA ILE 32 HA ILE 32-104.923 14.648 14.867 207 HB ILE 32 HB ILE 32-103.640 13.047 12.623 208 HG12 ILE 32 HG12 ILE 32-106.147 12.465 14.221 209 HG13 ILE 32 HG13 ILE 32-106.140 13.161 12.605 210 HG21 ILE 32 HG21 ILE 32-104.007 12.317 15.539 211 HG22 ILE 32 HG22 ILE 32-102.475 12.665 14.739 212 HG23 ILE 32 HG23 ILE 32-103.402 11.239 14.276 213 HD11 ILE 32 HD11 ILE 32-105.093 11.139 11.735 214 HD12 ILE 32 HD12 ILE 32-106.617 10.781 12.548 215 HD13 ILE 32 HD13 ILE 32-105.087 10.446 13.356 216 H GLY 33 H GLY 33-103.332 15.187 16.230 217 HA2 GLY 33 HA2 GLY 33-101.070 16.729 15.364 218 HA3 GLY 33 HA3 GLY 33-101.429 16.235 17.013 219 H ASP 34 H ASP 34 -99.359 15.872 14.477 220 HA ASP 34 HA ASP 34 -98.627 13.099 15.080 221 HB2 ASP 34 HB2 ASP 34 -99.041 13.822 12.713 222 HB3 ASP 34 HB3 ASP 34 -97.656 14.904 12.843 223 H SER 35 H SER 35 -96.928 12.675 16.338 224 HA SER 35 HA SER 35 -94.658 14.520 16.411 225 HB2 SER 35 HB2 SER 35 -96.119 13.538 18.881 226 HB3 SER 35 HB3 SER 35 -94.560 14.360 18.902 227 HG SER 35 HG SER 35 -96.347 15.784 17.458 228 H ALA 36 H ALA 36 -92.707 13.569 16.921 229 HA ALA 36 HA ALA 36 -92.668 10.670 17.410 230 HB1 ALA 36 HB1 ALA 36 -90.863 10.394 15.766 231 HB2 ALA 36 HB2 ALA 36 -90.994 12.099 15.331 232 HB3 ALA 36 HB3 ALA 36 -92.333 10.998 15.000 233 H TYR 37 H TYR 37 -90.324 9.994 17.967 234 HA TYR 37 HA TYR 37 -89.108 12.103 19.626 235 HB2 TYR 37 HB2 TYR 37 -88.500 10.420 21.287 236 HB3 TYR 37 HB3 TYR 37 -90.234 10.417 21.022 237 HD1 TYR 37 HD2 TYR 37 -91.307 8.498 19.886 238 HD2 TYR 37 HD1 TYR 37 -87.147 8.491 20.776 239 HE1 TYR 37 HE2 TYR 37 -91.238 6.067 19.545 240 HE2 TYR 37 HE1 TYR 37 -87.070 6.064 20.442 241 HH TYR 37 HH TYR 37 -88.604 4.160 20.516 242 H ALA 38 H ALA 38 -86.746 11.534 20.206 243 HA ALA 38 HA ALA 38 -85.410 10.109 18.021 244 HB1 ALA 38 HB1 ALA 38 -84.624 12.879 18.930 245 HB2 ALA 38 HB2 ALA 38 -85.391 12.471 17.396 246 HB3 ALA 38 HB3 ALA 38 -83.764 11.889 17.744 247 H VAL 39 H VAL 39 -82.895 10.102 18.593 248 HA VAL 39 HA VAL 39 -82.506 9.629 21.452 249 HB VAL 39 HB VAL 39 -83.315 7.498 20.363 250 HG11 VAL 39 HG11 VAL 39 -81.767 6.202 18.979 251 HG12 VAL 39 HG12 VAL 39 -80.677 7.588 18.914 252 HG13 VAL 39 HG13 VAL 39 -82.282 7.695 18.192 253 HG21 VAL 39 HG21 VAL 39 -81.640 6.031 21.385 254 HG22 VAL 39 HG22 VAL 39 -82.074 7.383 22.430 255 HG23 VAL 39 HG23 VAL 39 -80.547 7.408 21.549 256 H ASN 40 H ASN 40 -80.193 9.531 22.036 257 HA ASN 40 HA ASN 40 -78.427 10.682 19.970 258 HB2 ASN 40 HB2 ASN 40 -78.278 10.873 22.977 259 HB3 ASN 40 HB3 ASN 40 -76.982 11.394 21.904 260 HD21 ASN 40 HD21 ASN 40 -77.291 13.218 20.626 261 HD22 ASN 40 HD22 ASN 40 -78.551 14.365 20.943 262 HA PRO 41 HA PRO 41 -76.455 6.632 20.373 263 HB2 PRO 41 HB2 PRO 41 -75.459 7.009 17.700 264 HB3 PRO 41 HB3 PRO 41 -76.699 5.883 18.255 265 HG2 PRO 41 HG2 PRO 41 -77.186 8.030 16.608 266 HG3 PRO 41 HG3 PRO 41 -78.402 7.270 17.653 267 HD2 PRO 41 HD2 PRO 41 -76.796 9.756 18.102 268 HD3 PRO 41 HD3 PRO 41 -78.509 9.444 18.459 269 H GLU 42 H GLU 42 -74.946 7.243 21.785 270 HA GLU 42 HA GLU 42 -72.865 9.104 21.266 271 HB2 GLU 42 HB2 GLU 42 -73.239 7.081 23.471 272 HB3 GLU 42 HB3 GLU 42 -71.952 8.278 23.435 273 HG2 GLU 42 HG2 GLU 42 -74.870 8.988 23.354 274 HG3 GLU 42 HG3 GLU 42 -73.945 8.853 24.850 275 H ALA 43 H ALA 43 -70.592 8.681 21.525 276 HA ALA 43 HA ALA 43 -69.754 6.175 20.229 277 HB1 ALA 43 HB1 ALA 43 -67.730 7.398 19.600 278 HB2 ALA 43 HB2 ALA 43 -68.346 8.834 20.421 279 HB3 ALA 43 HB3 ALA 43 -69.182 8.200 19.003 280 H GLY 44 H GLY 44 -67.646 5.299 20.969 281 HA2 GLY 44 HA2 GLY 44 -67.444 5.551 23.902 282 HA3 GLY 44 HA3 GLY 44 -67.025 4.113 22.984 283 H SER 45 H SER 45 -65.317 5.212 24.855 284 HA SER 45 HA SER 45 -63.299 6.771 23.485 285 HB2 SER 45 HB2 SER 45 -63.310 5.511 26.241 286 HB3 SER 45 HB3 SER 45 -62.090 6.632 25.629 287 HG SER 45 HG SER 45 -63.845 8.141 25.303 288 H MET 46 H MET 46 -61.139 6.069 23.161 289 HA MET 46 HA MET 46 -60.837 3.147 22.858 290 HB2 MET 46 HB2 MET 46 -59.391 5.347 21.347 291 HB3 MET 46 HB3 MET 46 -59.221 3.617 21.077 292 HG2 MET 46 HG2 MET 46 -61.522 3.476 20.346 293 HG3 MET 46 HG3 MET 46 -61.749 5.193 20.676 294 HE1 MET 46 HE1 MET 46 -61.815 5.117 16.755 295 HE2 MET 46 HE2 MET 46 -62.668 5.616 18.216 296 HE3 MET 46 HE3 MET 46 -62.488 3.901 17.840 297 H ASP 47 H ASP 47 -59.228 2.170 23.948 298 HA ASP 47 HA ASP 47 -57.536 3.784 25.681 299 HB2 ASP 47 HB2 ASP 47 -58.764 1.667 26.423 300 HB3 ASP 47 HB3 ASP 47 -57.573 0.770 25.490 301 H TYR 48 H TYR 48 -55.388 4.090 25.407 302 HA TYR 48 HA TYR 48 -54.133 2.743 23.102 303 HB2 TYR 48 HB2 TYR 48 -53.655 5.568 24.091 304 HB3 TYR 48 HB3 TYR 48 -52.793 4.790 22.771 305 HD1 TYR 48 HD1 TYR 48 -54.115 4.143 20.694 306 HD2 TYR 48 HD2 TYR 48 -55.679 6.682 23.727 307 HE1 TYR 48 HE1 TYR 48 -55.807 4.973 19.121 308 HE2 TYR 48 HE2 TYR 48 -57.374 7.514 22.158 309 HH TYR 48 HH TYR 48 -57.728 7.716 19.791 310 H MET 49 H MET 49 -52.262 1.740 23.481 311 HA MET 49 HA MET 49 -50.894 2.251 26.044 312 HB2 MET 49 HB2 MET 49 -51.312 -0.315 24.525 313 HB3 MET 49 HB3 MET 49 -49.942 -0.141 25.616 314 HG2 MET 49 HG2 MET 49 -52.838 0.190 26.367 315 HG3 MET 49 HG3 MET 49 -51.835 -1.218 26.712 316 HE1 MET 49 HE1 MET 49 -52.268 0.355 30.269 317 HE2 MET 49 HE2 MET 49 -52.430 -1.103 29.289 318 HE3 MET 49 HE3 MET 49 -53.473 0.287 28.987 319 HA PRO 50 HA PRO 50 -47.557 3.796 23.637 320 HB2 PRO 50 HB2 PRO 50 -45.740 3.200 25.855 321 HB3 PRO 50 HB3 PRO 50 -46.260 4.760 25.216 322 HG2 PRO 50 HG2 PRO 50 -47.077 3.866 27.616 323 HG3 PRO 50 HG3 PRO 50 -48.125 4.845 26.569 324 HD2 PRO 50 HD2 PRO 50 -48.107 1.871 26.984 325 HD3 PRO 50 HD3 PRO 50 -49.490 2.987 26.909 326 H LEU 51 H LEU 51 -45.241 3.346 23.041 327 HA LEU 51 HA LEU 51 -44.825 0.458 22.670 328 HB2 LEU 51 HB2 LEU 51 -45.781 1.534 20.659 329 HB3 LEU 51 HB3 LEU 51 -44.440 2.657 20.628 330 HG LEU 51 HG LEU 51 -42.893 0.779 20.193 331 HD11 LEU 51 HD11 LEU 51 -45.409 -0.872 20.002 332 HD12 LEU 51 HD12 LEU 51 -44.156 -1.023 21.234 333 HD13 LEU 51 HD13 LEU 51 -43.787 -1.403 19.552 334 HD21 LEU 51 HD21 LEU 51 -43.596 0.390 17.886 335 HD22 LEU 51 HD22 LEU 51 -43.811 2.078 18.353 336 HD23 LEU 51 HD23 LEU 51 -45.204 0.999 18.275 337 H MET 52 H MET 52 -42.730 -0.261 22.734 338 HA MET 52 HA MET 52 -40.727 1.400 23.955 339 HB2 MET 52 HB2 MET 52 -40.634 -1.433 22.901 340 HB3 MET 52 HB3 MET 52 -39.288 -0.647 23.711 341 HG2 MET 52 HG2 MET 52 -40.598 -0.430 25.734 342 HG3 MET 52 HG3 MET 52 -41.991 -1.147 24.928 343 HE1 MET 52 HE1 MET 52 -38.084 -3.464 25.806 344 HE2 MET 52 HE2 MET 52 -38.329 -1.776 26.242 345 HE3 MET 52 HE3 MET 52 -38.214 -2.238 24.543 346 H GLU 53 H GLU 53 -38.792 2.066 23.068 347 HA GLU 53 HA GLU 53 -38.883 2.488 20.176 348 HB2 GLU 53 HB2 GLU 53 -37.160 3.821 22.287 349 HB3 GLU 53 HB3 GLU 53 -37.267 4.285 20.595 350 HG2 GLU 53 HG2 GLU 53 -39.610 4.889 20.893 351 HG3 GLU 53 HG3 GLU 53 -39.523 4.396 22.583 352 H TYR 54 H TYR 54 -36.512 2.699 19.231 353 HA TYR 54 HA TYR 54 -35.017 0.336 20.142 354 HB2 TYR 54 HB2 TYR 54 -35.485 1.199 17.266 355 HB3 TYR 54 HB3 TYR 54 -34.477 -0.154 17.773 356 HD1 TYR 54 HD1 TYR 54 -35.623 -2.053 19.068 357 HD2 TYR 54 HD2 TYR 54 -37.774 0.893 16.882 358 HE1 TYR 54 HE1 TYR 54 -37.586 -3.526 19.035 359 HE2 TYR 54 HE2 TYR 54 -39.747 -0.573 16.844 360 HH TYR 54 HH TYR 54 -40.020 -3.339 18.794 361 H LEU 55 H LEU 55 -32.744 0.336 19.138 362 HA LEU 55 HA LEU 55 -31.632 3.049 19.401 363 HB2 LEU 55 HB2 LEU 55 -30.423 0.427 20.329 364 HB3 LEU 55 HB3 LEU 55 -29.571 1.955 20.320 365 HG LEU 55 HG LEU 55 -31.597 2.709 21.871 366 HD11 LEU 55 HD11 LEU 55 -32.300 0.917 23.369 367 HD12 LEU 55 HD12 LEU 55 -31.448 -0.264 22.375 368 HD13 LEU 55 HD13 LEU 55 -32.836 0.608 21.719 369 HD21 LEU 55 HD21 LEU 55 -29.249 2.767 22.491 370 HD22 LEU 55 HD22 LEU 55 -29.279 1.033 22.813 371 HD23 LEU 55 HD23 LEU 55 -30.230 2.131 23.811 372 H HIS 56 H HIS 56 -29.454 3.287 18.374 373 HA HIS 56 HA HIS 56 -29.565 2.169 15.686 374 HB2 HIS 56 HB2 HIS 56 -27.958 4.408 16.912 375 HB3 HIS 56 HB3 HIS 56 -27.607 3.785 15.307 376 HD1 HIS 56 HD1 HIS 56 -29.519 6.328 16.943 377 HD2 HIS 56 HD2 HIS 56 -30.026 3.952 13.574 378 HE1 HIS 56 HE1 HIS 56 -31.238 7.515 15.545 379 HE2 HIS 56 HE2 HIS 56 -31.703 5.922 13.653 380 H SER 57 H SER 57 -27.908 1.066 14.690 381 HA SER 57 HA SER 57 -26.305 -0.614 16.412 382 HB2 SER 57 HB2 SER 57 -26.322 -0.559 13.386 383 HB3 SER 57 HB3 SER 57 -25.919 -1.909 14.447 384 HG SER 57 HG SER 57 -28.068 -2.051 15.057 385 H SER 58 H SER 58 -24.068 -0.774 16.400 386 HA SER 58 HA SER 58 -22.569 1.211 14.842 387 HB2 SER 58 HB2 SER 58 -22.046 0.534 17.754 388 HB3 SER 58 HB3 SER 58 -21.056 1.597 16.751 389 HG SER 58 HG SER 58 -23.728 2.222 16.769 390 HA PRO 59 HA PRO 59 -20.580 -2.865 14.202 391 HB2 PRO 59 HB2 PRO 59 -20.278 -2.289 11.428 392 HB3 PRO 59 HB3 PRO 59 -21.402 -3.422 12.180 393 HG2 PRO 59 HG2 PRO 59 -22.105 -1.089 10.856 394 HG3 PRO 59 HG3 PRO 59 -23.139 -1.988 11.979 395 HD2 PRO 59 HD2 PRO 59 -21.527 0.481 12.439 396 HD3 PRO 59 HD3 PRO 59 -23.103 0.013 13.119 397 H VAL 60 H VAL 60 -18.496 -3.401 13.048 398 HA VAL 60 HA VAL 60 -16.589 -1.312 13.722 399 HB VAL 60 HB VAL 60 -16.219 -3.500 14.712 400 HG11 VAL 60 HG11 VAL 60 -15.932 -4.561 11.911 401 HG12 VAL 60 HG12 VAL 60 -17.223 -4.939 13.052 402 HG13 VAL 60 HG13 VAL 60 -15.570 -5.455 13.391 403 HG21 VAL 60 HG21 VAL 60 -14.260 -2.163 14.290 404 HG22 VAL 60 HG22 VAL 60 -14.119 -2.831 12.664 405 HG23 VAL 60 HG23 VAL 60 -13.885 -3.872 14.068 406 H LEU 61 H LEU 61 -15.485 -0.158 12.246 407 HA LEU 61 HA LEU 61 -15.593 -1.032 9.462 408 HB2 LEU 61 HB2 LEU 61 -14.482 1.285 9.031 409 HB3 LEU 61 HB3 LEU 61 -16.198 1.165 9.280 410 HG LEU 61 HG LEU 61 -15.041 3.172 10.278 411 HD11 LEU 61 HD11 LEU 61 -17.254 2.573 11.008 412 HD12 LEU 61 HD12 LEU 61 -16.302 3.172 12.367 413 HD13 LEU 61 HD13 LEU 61 -16.589 1.441 12.183 414 HD21 LEU 61 HD21 LEU 61 -13.927 2.929 12.436 415 HD22 LEU 61 HD22 LEU 61 -13.036 2.145 11.131 416 HD23 LEU 61 HD23 LEU 61 -13.988 1.175 12.256 417 HA PRO 62 HA PRO 62 -11.330 -2.290 9.589 418 HB2 PRO 62 HB2 PRO 62 -10.410 -1.718 7.123 419 HB3 PRO 62 HB3 PRO 62 -11.474 -3.103 7.463 420 HG2 PRO 62 HG2 PRO 62 -12.136 -0.441 6.280 421 HG3 PRO 62 HG3 PRO 62 -12.787 -2.040 5.878 422 HD2 PRO 62 HD2 PRO 62 -14.108 -0.211 7.422 423 HD3 PRO 62 HD3 PRO 62 -14.339 -1.965 7.560 424 H THR 63 H THR 63 -9.097 -1.621 8.963 425 HA THR 63 HA THR 63 -8.634 1.216 8.601 426 HB THR 63 HB THR 63 -7.456 -0.375 10.913 427 HG1 THR 63 HG1 THR 63 -9.313 1.718 10.677 428 HG21 THR 63 HG21 THR 63 -6.146 1.656 11.397 429 HG22 THR 63 HG22 THR 63 -6.745 2.366 9.895 430 HG23 THR 63 HG23 THR 63 -5.722 0.931 9.842 431 H ALA 64 H ALA 64 -7.301 1.308 6.893 432 HA ALA 64 HA ALA 64 -5.642 -0.980 6.212 433 HB1 ALA 64 HB1 ALA 64 -6.830 0.215 4.441 434 HB2 ALA 64 HB2 ALA 64 -5.082 0.281 4.206 435 HB3 ALA 64 HB3 ALA 64 -5.941 1.685 4.841 436 H ARG 65 H ARG 65 -3.641 -1.189 6.801 437 HA ARG 65 HA ARG 65 -2.011 1.141 7.493 438 HB2 ARG 65 HB2 ARG 65 -2.698 -1.175 9.294 439 HB3 ARG 65 HB3 ARG 65 -1.150 -0.366 9.461 440 HG2 ARG 65 HG2 ARG 65 -3.823 0.994 9.684 441 HG3 ARG 65 HG3 ARG 65 -2.880 0.395 11.052 442 HD2 ARG 65 HD2 ARG 65 -1.009 1.860 10.314 443 HD3 ARG 65 HD3 ARG 65 -2.077 2.526 9.082 444 HE ARG 65 HE ARG 65 -3.270 2.737 11.641 445 HH11 ARG 65 HH11 ARG 65 -0.800 4.199 9.607 446 HH12 ARG 65 HH12 ARG 65 -0.807 5.705 10.473 447 HH21 ARG 65 HH21 ARG 65 -3.284 4.712 12.757 448 HH22 ARG 65 HH22 ARG 65 -2.225 5.994 12.258 449 H PHE 66 H PHE 66 0.062 0.913 6.824 450 HA PHE 66 HA PHE 66 1.323 -1.649 6.678 451 HB2 PHE 66 HB2 PHE 66 1.921 -1.648 4.320 452 HB3 PHE 66 HB3 PHE 66 0.176 -1.658 4.483 453 HD1 PHE 66 HD2 PHE 66 -1.045 0.582 4.156 454 HD2 PHE 66 HD1 PHE 66 2.982 -0.096 2.975 455 HE1 PHE 66 HE2 PHE 66 -1.186 2.477 2.603 456 HE2 PHE 66 HE1 PHE 66 2.844 1.795 1.417 457 HZ PHE 66 HZ PHE 66 0.755 3.083 1.228 458 H THR 67 H THR 67 3.608 -1.489 6.567 459 HA THR 67 HA THR 67 4.581 1.278 6.491 460 HB THR 67 HB THR 67 5.024 0.235 8.673 461 HG1 THR 67 HG1 THR 67 7.542 0.428 7.415 462 HG21 THR 67 HG21 THR 67 6.733 -1.737 7.148 463 HG22 THR 67 HG22 THR 67 5.243 -2.107 8.019 464 HG23 THR 67 HG23 THR 67 6.669 -1.567 8.904 465 H SER 68 H SER 68 6.408 1.743 5.282 466 HA SER 68 HA SER 68 6.704 -0.008 2.961 467 HB2 SER 68 HB2 SER 68 6.011 2.398 2.716 468 HB3 SER 68 HB3 SER 68 7.585 2.871 3.347 469 HG SER 68 HG SER 68 8.080 2.842 1.296 470 H ASP 69 H ASP 69 8.929 0.015 1.933 471 HA ASP 69 HA ASP 69 11.012 -0.793 3.690 472 HB2 ASP 69 HB2 ASP 69 10.640 -1.318 1.167 473 HB3 ASP 69 HB3 ASP 69 11.417 0.231 0.877 474 H ILE 70 H ILE 70 10.818 1.989 1.495 475 HA ILE 70 HA ILE 70 12.133 3.659 3.498 476 HB ILE 70 HB ILE 70 13.330 4.819 1.532 477 HG12 ILE 70 HG12 ILE 70 13.992 2.849 -0.173 478 HG13 ILE 70 HG13 ILE 70 12.340 2.358 0.176 479 HG21 ILE 70 HG21 ILE 70 14.206 2.081 2.422 480 HG22 ILE 70 HG22 ILE 70 14.529 3.613 3.234 481 HG23 ILE 70 HG23 ILE 70 15.244 3.283 1.656 482 HD11 ILE 70 HD11 ILE 70 13.193 5.028 -0.933 483 HD12 ILE 70 HD12 ILE 70 11.536 4.536 -0.587 484 HD13 ILE 70 HD13 ILE 70 12.456 3.703 -1.839 485 H THR 71 H THR 71 11.912 5.994 3.035 486 HA THR 71 HA THR 71 9.324 6.588 1.750 487 HB THR 71 HB THR 71 9.604 8.829 2.998 488 HG1 THR 71 HG1 THR 71 11.464 8.969 4.012 489 HG21 THR 71 HG21 THR 71 9.189 6.302 4.592 490 HG22 THR 71 HG22 THR 71 7.958 7.138 3.643 491 HG23 THR 71 HG23 THR 71 8.663 7.914 5.064 492 H GLU 72 H GLU 72 12.730 7.204 1.781 493 HA GLU 72 HA GLU 72 12.611 8.392 -0.848 494 HB2 GLU 72 HB2 GLU 72 12.470 10.338 0.714 495 HB3 GLU 72 HB3 GLU 72 14.006 9.849 1.412 496 HG2 GLU 72 HG2 GLU 72 15.046 10.146 -0.836 497 HG3 GLU 72 HG3 GLU 72 13.503 10.786 -1.406 498 H GLY 73 H GLY 73 14.235 7.570 -2.020 499 HA2 GLY 73 HA2 GLY 73 16.880 7.211 -1.366 500 HA3 GLY 73 HA3 GLY 73 16.088 5.729 -0.821 501 H PHE 74 H PHE 74 17.741 5.029 -2.607 502 HA PHE 74 HA PHE 74 16.963 5.549 -5.330 503 HB2 PHE 74 HB2 PHE 74 18.698 3.847 -5.904 504 HB3 PHE 74 HB3 PHE 74 19.312 5.129 -4.875 505 HD1 PHE 74 HD1 PHE 74 19.859 4.652 -2.504 506 HD2 PHE 74 HD2 PHE 74 18.655 1.561 -5.171 507 HE1 PHE 74 HE1 PHE 74 20.750 2.969 -0.954 508 HE2 PHE 74 HE2 PHE 74 19.538 -0.129 -3.618 509 HZ PHE 74 HZ PHE 74 20.587 0.577 -1.510 510 H ALA 75 H ALA 75 15.755 4.313 -6.682 511 HA ALA 75 HA ALA 75 13.785 2.586 -5.911 512 HB1 ALA 75 HB1 ALA 75 13.539 1.984 -8.253 513 HB2 ALA 75 HB2 ALA 75 15.165 2.575 -8.588 514 HB3 ALA 75 HB3 ALA 75 13.901 3.706 -8.103 515 HA PRO 76 HA PRO 76 16.205 -1.156 -5.186 516 HB2 PRO 76 HB2 PRO 76 14.218 -2.127 -3.428 517 HB3 PRO 76 HB3 PRO 76 15.679 -1.245 -2.987 518 HG2 PRO 76 HG2 PRO 76 13.059 -0.319 -2.674 519 HG3 PRO 76 HG3 PRO 76 14.526 0.673 -2.616 520 HD2 PRO 76 HD2 PRO 76 12.626 0.233 -4.885 521 HD3 PRO 76 HD3 PRO 76 13.481 1.715 -4.396 522 H LEU 77 H LEU 77 15.531 -3.567 -5.014 523 HA LEU 77 HA LEU 77 13.967 -4.195 -7.388 524 HB2 LEU 77 HB2 LEU 77 16.259 -5.208 -6.744 525 HB3 LEU 77 HB3 LEU 77 15.386 -6.133 -5.546 526 HG LEU 77 HG LEU 77 14.663 -6.332 -8.469 527 HD11 LEU 77 HD11 LEU 77 17.052 -6.749 -8.308 528 HD12 LEU 77 HD12 LEU 77 16.173 -8.247 -8.617 529 HD13 LEU 77 HD13 LEU 77 16.775 -7.896 -6.997 530 HD21 LEU 77 HD21 LEU 77 13.931 -8.575 -7.852 531 HD22 LEU 77 HD22 LEU 77 13.106 -7.361 -6.875 532 HD23 LEU 77 HD23 LEU 77 14.433 -8.296 -6.183 533 H SER 78 H SER 78 14.157 -5.814 -4.245 534 HA SER 78 HA SER 78 11.275 -6.258 -4.401 535 HB2 SER 78 HB2 SER 78 12.882 -8.207 -4.258 536 HB3 SER 78 HB3 SER 78 13.276 -7.666 -2.630 537 HG SER 78 HG SER 78 11.217 -8.103 -1.966 538 H VAL 79 H VAL 79 10.309 -4.615 -3.480 539 HA VAL 79 HA VAL 79 11.406 -3.244 -1.176 540 HB VAL 79 HB VAL 79 8.865 -2.738 -2.744 541 HG11 VAL 79 HG11 VAL 79 8.713 -1.764 -0.516 542 HG12 VAL 79 HG12 VAL 79 8.880 -0.504 -1.739 543 HG13 VAL 79 HG13 VAL 79 10.266 -0.960 -0.748 544 HG21 VAL 79 HG21 VAL 79 11.561 -1.407 -2.910 545 HG22 VAL 79 HG22 VAL 79 10.117 -0.928 -3.803 546 HG23 VAL 79 HG23 VAL 79 10.861 -2.498 -4.105 547 H ARG 80 H ARG 80 10.898 -3.698 0.847 548 HA ARG 80 HA ARG 80 9.137 -5.880 1.418 549 HB2 ARG 80 HB2 ARG 80 9.830 -5.489 3.793 550 HB3 ARG 80 HB3 ARG 80 11.170 -5.738 2.682 551 HG2 ARG 80 HG2 ARG 80 11.456 -3.274 2.582 552 HG3 ARG 80 HG3 ARG 80 10.216 -3.128 3.820 553 HD2 ARG 80 HD2 ARG 80 11.574 -4.277 5.406 554 HD3 ARG 80 HD3 ARG 80 12.771 -4.674 4.169 555 HE ARG 80 HE ARG 80 13.174 -2.238 3.990 556 HH11 ARG 80 HH11 ARG 80 11.763 -3.481 6.970 557 HH12 ARG 80 HH12 ARG 80 12.317 -2.142 7.930 558 HH21 ARG 80 HH21 ARG 80 13.846 -0.479 5.229 559 HH22 ARG 80 HH22 ARG 80 13.498 -0.423 6.928 560 H PHE 81 H PHE 81 7.121 -5.844 1.877 561 HA PHE 81 HA PHE 81 5.916 -3.541 3.231 562 HB2 PHE 81 HB2 PHE 81 4.891 -4.929 0.758 563 HB3 PHE 81 HB3 PHE 81 3.787 -4.135 1.873 564 HD1 PHE 81 HD2 PHE 81 4.475 -1.666 2.491 565 HD2 PHE 81 HD1 PHE 81 5.676 -3.728 -1.026 566 HE1 PHE 81 HE2 PHE 81 4.889 0.481 1.377 567 HE2 PHE 81 HE1 PHE 81 6.086 -1.578 -2.147 568 HZ PHE 81 HZ PHE 81 5.693 0.529 -0.943 569 H LYS 82 H LYS 82 4.254 -4.069 4.635 570 HA LYS 82 HA LYS 82 3.643 -6.915 4.879 571 HB2 LYS 82 HB2 LYS 82 3.653 -6.799 7.300 572 HB3 LYS 82 HB3 LYS 82 5.224 -6.326 6.680 573 HG2 LYS 82 HG2 LYS 82 4.614 -3.963 7.030 574 HG3 LYS 82 HG3 LYS 82 3.081 -4.490 7.727 575 HD2 LYS 82 HD2 LYS 82 4.583 -4.028 9.530 576 HD3 LYS 82 HD3 LYS 82 4.387 -5.778 9.426 577 HE2 LYS 82 HE2 LYS 82 6.509 -5.979 8.275 578 HE3 LYS 82 HE3 LYS 82 6.685 -4.226 8.240 579 HZ1 LYS 82 HZ1 LYS 82 8.005 -5.136 10.004 580 HZ2 LYS 82 HZ2 LYS 82 6.672 -5.953 10.654 581 HZ3 LYS 82 HZ3 LYS 82 6.720 -4.260 10.683 582 H ASP 83 H ASP 83 1.593 -7.418 5.522 583 HA ASP 83 HA ASP 83 -0.405 -5.346 5.149 584 HB2 ASP 83 HB2 ASP 83 -0.701 -8.306 5.778 585 HB3 ASP 83 HB3 ASP 83 -2.039 -7.204 5.454 586 H PHE 84 H PHE 84 -0.776 -4.044 6.826 587 HA PHE 84 HA PHE 84 -0.325 -5.129 9.544 588 HB2 PHE 84 HB2 PHE 84 1.373 -3.481 8.562 589 HB3 PHE 84 HB3 PHE 84 0.106 -2.270 8.612 590 HD1 PHE 84 HD1 PHE 84 1.792 -4.706 10.875 591 HD2 PHE 84 HD2 PHE 84 0.070 -0.853 10.392 592 HE1 PHE 84 HE1 PHE 84 2.476 -4.120 13.162 593 HE2 PHE 84 HE2 PHE 84 0.741 -0.257 12.679 594 HZ PHE 84 HZ PHE 84 1.944 -1.892 14.068 595 H SER 85 H SER 85 -2.561 -4.235 7.424 596 HA SER 85 HA SER 85 -4.384 -2.533 8.602 597 HB2 SER 85 HB2 SER 85 -4.940 -4.920 6.835 598 HB3 SER 85 HB3 SER 85 -6.015 -3.546 7.101 599 HG SER 85 HG SER 85 -4.463 -3.607 5.182 600 H GLU 86 H GLU 86 -6.095 -2.713 9.928 601 HA GLU 86 HA GLU 86 -6.402 -5.240 11.421 602 HB2 GLU 86 HB2 GLU 86 -5.468 -3.307 12.721 603 HB3 GLU 86 HB3 GLU 86 -6.949 -2.426 12.403 604 HG2 GLU 86 HG2 GLU 86 -8.171 -4.281 13.590 605 HG3 GLU 86 HG3 GLU 86 -6.588 -4.910 14.048 606 H ASN 87 H ASN 87 -8.480 -6.046 11.629 607 HA ASN 87 HA ASN 87 -10.732 -6.273 11.558 608 HB2 ASN 87 HB2 ASN 87 -10.648 -3.254 11.546 609 HB3 ASN 87 HB3 ASN 87 -12.147 -4.173 11.619 610 HD21 ASN 87 HD21 ASN 87 -10.573 -2.356 13.525 611 HD22 ASN 87 HD22 ASN 87 -10.545 -3.250 15.005 612 H ALA 88 H ALA 88 -9.268 -6.447 9.153 613 HA ALA 88 HA ALA 88 -11.063 -5.299 7.134 614 HB1 ALA 88 HB1 ALA 88 -8.686 -4.818 6.849 615 HB2 ALA 88 HB2 ALA 88 -9.312 -5.800 5.525 616 HB3 ALA 88 HB3 ALA 88 -8.346 -6.549 6.795 617 H THR 89 H THR 89 -12.285 -6.549 5.850 618 HA THR 89 HA THR 89 -12.256 -9.439 6.277 619 HB THR 89 HB THR 89 -14.305 -7.804 4.756 620 HG1 THR 89 HG1 THR 89 -15.398 -7.605 6.664 621 HG21 THR 89 HG21 THR 89 -14.472 -10.549 6.028 622 HG22 THR 89 HG22 THR 89 -14.379 -10.219 4.296 623 HG23 THR 89 HG23 THR 89 -15.788 -9.700 5.219 624 H SER 90 H SER 90 -11.819 -6.990 3.791 625 HA SER 90 HA SER 90 -10.604 -9.041 2.077 626 HB2 SER 90 HB2 SER 90 -12.304 -6.716 1.126 627 HB3 SER 90 HB3 SER 90 -11.507 -7.907 0.098 628 HG SER 90 HG SER 90 -12.847 -9.429 1.562 629 H ARG 91 H ARG 91 -8.709 -8.387 1.051 630 HA ARG 91 HA ARG 91 -7.833 -5.622 1.566 631 HB2 ARG 91 HB2 ARG 91 -5.500 -6.450 1.622 632 HB3 ARG 91 HB3 ARG 91 -6.481 -7.144 2.906 633 HG2 ARG 91 HG2 ARG 91 -6.686 -9.212 1.692 634 HG3 ARG 91 HG3 ARG 91 -5.842 -8.523 0.310 635 HD2 ARG 91 HD2 ARG 91 -3.828 -8.276 1.687 636 HD3 ARG 91 HD3 ARG 91 -4.676 -9.013 3.048 637 HE ARG 91 HE ARG 91 -4.978 -10.925 1.305 638 HH11 ARG 91 HH11 ARG 91 -2.078 -9.000 1.829 639 HH12 ARG 91 HH12 ARG 91 -1.015 -10.241 1.236 640 HH21 ARG 91 HH21 ARG 91 -3.612 -12.522 0.549 641 HH22 ARG 91 HH22 ARG 91 -1.890 -12.267 0.521 642 H LEU 92 H LEU 92 -6.569 -4.614 -0.042 643 HA LEU 92 HA LEU 92 -6.398 -5.900 -2.648 644 HB2 LEU 92 HB2 LEU 92 -8.639 -4.579 -2.227 645 HB3 LEU 92 HB3 LEU 92 -7.633 -3.168 -2.458 646 HG LEU 92 HG LEU 92 -7.850 -5.339 -4.545 647 HD11 LEU 92 HD11 LEU 92 -10.085 -4.485 -4.073 648 HD12 LEU 92 HD12 LEU 92 -9.515 -3.943 -5.652 649 HD13 LEU 92 HD13 LEU 92 -9.503 -2.833 -4.281 650 HD21 LEU 92 HD21 LEU 92 -5.954 -3.798 -4.775 651 HD22 LEU 92 HD22 LEU 92 -7.066 -2.429 -4.732 652 HD23 LEU 92 HD23 LEU 92 -7.137 -3.580 -6.066 653 H TRP 93 H TRP 93 -4.299 -5.635 -3.097 654 HA TRP 93 HA TRP 93 -2.914 -3.187 -2.337 655 HB2 TRP 93 HB2 TRP 93 -2.022 -5.808 -3.505 656 HB3 TRP 93 HB3 TRP 93 -0.972 -4.402 -3.550 657 HD1 TRP 93 HD1 TRP 93 -2.069 -7.203 -1.313 658 HE1 TRP 93 HE1 TRP 93 -0.854 -7.014 0.954 659 HE3 TRP 93 HE3 TRP 93 -0.146 -2.475 -1.787 660 HZ2 TRP 93 HZ2 TRP 93 0.669 -5.118 2.365 661 HZ3 TRP 93 HZ3 TRP 93 1.172 -1.551 0.077 662 HH2 TRP 93 HH2 TRP 93 1.568 -2.848 2.107 663 H MET 94 H MET 94 -3.069 -1.513 -3.612 664 HA MET 94 HA MET 94 -3.589 -1.836 -6.459 665 HB2 MET 94 HB2 MET 94 -3.660 0.499 -4.570 666 HB3 MET 94 HB3 MET 94 -3.600 0.762 -6.308 667 HG2 MET 94 HG2 MET 94 -5.697 -0.862 -4.897 668 HG3 MET 94 HG3 MET 94 -5.878 0.827 -5.362 669 HE1 MET 94 HE1 MET 94 -4.326 0.825 -8.195 670 HE2 MET 94 HE2 MET 94 -5.870 1.647 -7.954 671 HE3 MET 94 HE3 MET 94 -5.661 0.536 -9.308 672 H PHE 95 H PHE 95 -1.732 -2.448 -7.449 673 HA PHE 95 HA PHE 95 0.676 -0.860 -7.060 674 HB2 PHE 95 HB2 PHE 95 0.184 -3.204 -8.917 675 HB3 PHE 95 HB3 PHE 95 1.743 -2.472 -8.559 676 HD1 PHE 95 HD2 PHE 95 2.338 -2.426 -5.959 677 HD2 PHE 95 HD1 PHE 95 -0.388 -5.125 -7.809 678 HE1 PHE 95 HE2 PHE 95 2.641 -4.004 -4.098 679 HE2 PHE 95 HE1 PHE 95 -0.091 -6.702 -5.946 680 HZ PHE 95 HZ PHE 95 1.425 -6.145 -4.091 681 H GLY 96 H GLY 96 -1.988 -1.210 -9.243 682 HA2 GLY 96 HA2 GLY 96 -2.690 0.411 -10.786 683 HA3 GLY 96 HA3 GLY 96 -1.079 1.106 -10.752 684 H ASP 97 H ASP 97 -0.787 -2.175 -11.124 685 HA ASP 97 HA ASP 97 -0.767 -1.984 -14.048 686 HB2 ASP 97 HB2 ASP 97 1.552 -1.607 -13.097 687 HB3 ASP 97 HB3 ASP 97 1.500 -3.259 -12.499 688 H GLY 98 H GLY 98 -2.037 -3.505 -14.812 689 HA2 GLY 98 HA2 GLY 98 -2.626 -5.663 -15.381 690 HA3 GLY 98 HA3 GLY 98 -1.494 -6.256 -14.175 691 H ASN 99 H ASN 99 -2.609 -7.649 -13.021 692 HA ASN 99 HA ASN 99 -5.342 -7.044 -12.251 693 HB2 ASN 99 HB2 ASN 99 -5.437 -9.383 -11.404 694 HB3 ASN 99 HB3 ASN 99 -5.074 -9.257 -13.113 695 HD21 ASN 99 HD21 ASN 99 -4.645 -11.414 -11.185 696 HD22 ASN 99 HD22 ASN 99 -2.963 -11.802 -11.280 697 H THR 100 H THR 100 -5.717 -5.965 -10.543 698 HA THR 100 HA THR 100 -3.970 -6.056 -8.217 699 HB THR 100 HB THR 100 -5.682 -4.322 -7.368 700 HG1 THR 100 HG1 THR 100 -7.153 -3.597 -8.772 701 HG21 THR 100 HG21 THR 100 -4.617 -2.509 -8.612 702 HG22 THR 100 HG22 THR 100 -4.030 -3.662 -9.814 703 HG23 THR 100 HG23 THR 100 -3.434 -3.733 -8.155 704 H SER 101 H SER 101 -5.511 -5.863 -6.093 705 HA SER 101 HA SER 101 -6.632 -7.012 -4.513 706 HB2 SER 101 HB2 SER 101 -8.638 -6.551 -5.908 707 HB3 SER 101 HB3 SER 101 -8.369 -8.069 -6.757 708 HG SER 101 HG SER 101 -9.271 -9.095 -5.163 709 H ASP 102 H ASP 102 -7.074 -9.515 -6.997 710 HA ASP 102 HA ASP 102 -5.521 -11.397 -5.429 711 HB2 ASP 102 HB2 ASP 102 -7.652 -12.099 -6.532 712 HB3 ASP 102 HB3 ASP 102 -6.924 -11.760 -8.099 713 H SER 103 H SER 103 -3.433 -10.778 -5.546 714 HA SER 103 HA SER 103 -2.227 -10.720 -8.229 715 HB2 SER 103 HB2 SER 103 -1.237 -9.204 -5.797 716 HB3 SER 103 HB3 SER 103 -0.580 -9.124 -7.430 717 HG SER 103 HG SER 103 -2.656 -8.278 -8.081 718 HA PRO 104 HA PRO 104 -0.114 -14.129 -5.997 719 HB2 PRO 104 HB2 PRO 104 -0.395 -16.048 -7.818 720 HB3 PRO 104 HB3 PRO 104 -1.748 -15.566 -6.790 721 HG2 PRO 104 HG2 PRO 104 -1.214 -14.910 -9.652 722 HG3 PRO 104 HG3 PRO 104 -2.756 -15.240 -8.845 723 HD2 PRO 104 HD2 PRO 104 -1.712 -12.709 -9.440 724 HD3 PRO 104 HD3 PRO 104 -3.048 -13.050 -8.324 725 H SER 105 H SER 105 0.634 -12.233 -8.577 726 HA SER 105 HA SER 105 2.942 -13.774 -9.465 727 HB2 SER 105 HB2 SER 105 1.731 -11.237 -10.595 728 HB3 SER 105 HB3 SER 105 3.031 -12.184 -11.321 729 HG SER 105 HG SER 105 1.329 -13.970 -11.073 730 HA PRO 106 HA PRO 106 5.517 -10.899 -7.109 731 HB2 PRO 106 HB2 PRO 106 7.827 -12.315 -8.089 732 HB3 PRO 106 HB3 PRO 106 7.125 -12.354 -6.471 733 HG2 PRO 106 HG2 PRO 106 7.117 -14.484 -8.189 734 HG3 PRO 106 HG3 PRO 106 5.918 -14.242 -6.905 735 HD2 PRO 106 HD2 PRO 106 5.708 -13.647 -9.833 736 HD3 PRO 106 HD3 PRO 106 4.500 -14.369 -8.745 737 H LEU 107 H LEU 107 4.651 -9.563 -9.054 738 HA LEU 107 HA LEU 107 6.752 -8.908 -10.988 739 HB2 LEU 107 HB2 LEU 107 3.888 -7.948 -10.799 740 HB3 LEU 107 HB3 LEU 107 5.011 -7.568 -12.089 741 HG LEU 107 HG LEU 107 4.096 -10.370 -11.463 742 HD11 LEU 107 HD11 LEU 107 2.610 -10.125 -13.384 743 HD12 LEU 107 HD12 LEU 107 3.059 -8.423 -13.514 744 HD13 LEU 107 HD13 LEU 107 2.195 -9.002 -12.090 745 HD21 LEU 107 HD21 LEU 107 4.926 -10.856 -13.708 746 HD22 LEU 107 HD22 LEU 107 6.213 -10.227 -12.678 747 HD23 LEU 107 HD23 LEU 107 5.457 -9.185 -13.885 748 H HIS 108 H HIS 108 6.152 -8.100 -7.953 749 HA HIS 108 HA HIS 108 6.163 -5.215 -8.127 750 HB2 HIS 108 HB2 HIS 108 4.871 -6.331 -6.362 751 HB3 HIS 108 HB3 HIS 108 6.337 -7.064 -5.725 752 HD1 HIS 108 HD1 HIS 108 7.594 -5.772 -4.006 753 HD2 HIS 108 HD2 HIS 108 4.785 -3.442 -5.992 754 HE1 HIS 108 HE1 HIS 108 7.555 -3.576 -2.788 755 HE2 HIS 108 HE2 HIS 108 5.740 -2.247 -3.907 756 H THR 109 H THR 109 8.030 -4.786 -9.183 757 HA THR 109 HA THR 109 10.441 -4.696 -7.559 758 HB THR 109 HB THR 109 10.372 -5.964 -10.323 759 HG1 THR 109 HG1 THR 109 10.315 -6.973 -7.812 760 HG21 THR 109 HG21 THR 109 12.815 -6.223 -10.103 761 HG22 THR 109 HG22 THR 109 12.770 -5.306 -8.595 762 HG23 THR 109 HG23 THR 109 12.337 -4.524 -10.114 763 H PHE 110 H PHE 110 11.317 -2.685 -7.812 764 HA PHE 110 HA PHE 110 10.143 -0.989 -9.863 765 HB2 PHE 110 HB2 PHE 110 11.936 -0.304 -7.528 766 HB3 PHE 110 HB3 PHE 110 11.311 0.870 -8.678 767 HD1 PHE 110 HD1 PHE 110 8.503 -0.548 -8.850 768 HD2 PHE 110 HD2 PHE 110 10.946 0.776 -5.625 769 HE1 PHE 110 HE1 PHE 110 6.498 -0.247 -7.463 770 HE2 PHE 110 HE2 PHE 110 8.938 1.069 -4.232 771 HZ PHE 110 HZ PHE 110 6.712 0.557 -5.149 772 H PHE 111 H PHE 111 11.044 -1.364 -11.770 773 HA PHE 111 HA PHE 111 13.903 -1.727 -12.093 774 HB2 PHE 111 HB2 PHE 111 11.740 -1.480 -14.208 775 HB3 PHE 111 HB3 PHE 111 13.387 -2.030 -14.469 776 HD1 PHE 111 HD1 PHE 111 14.094 -4.240 -13.566 777 HD2 PHE 111 HD2 PHE 111 10.049 -2.933 -13.471 778 HE1 PHE 111 HE1 PHE 111 13.351 -6.562 -13.240 779 HE2 PHE 111 HE2 PHE 111 9.300 -5.248 -13.139 780 HZ PHE 111 HZ PHE 111 10.951 -7.065 -13.024 781 H ASN 112 H ASN 112 11.462 0.693 -12.498 782 HA ASN 112 HA ASN 112 13.466 2.610 -13.481 783 HB2 ASN 112 HB2 ASN 112 10.481 2.532 -14.010 784 HB3 ASN 112 HB3 ASN 112 11.536 3.864 -14.468 785 HD21 ASN 112 HD21 ASN 112 12.997 3.576 -16.150 786 HD22 ASN 112 HD22 ASN 112 12.870 2.260 -17.274 787 H GLU 113 H GLU 113 13.482 4.619 -12.549 788 HA GLU 113 HA GLU 113 12.557 4.682 -9.808 789 HB2 GLU 113 HB2 GLU 113 13.928 6.664 -9.581 790 HB3 GLU 113 HB3 GLU 113 14.839 5.423 -10.425 791 HG2 GLU 113 HG2 GLU 113 13.369 7.473 -12.007 792 HG3 GLU 113 HG3 GLU 113 14.884 7.918 -11.230 793 H GLY 114 H GLY 114 11.631 6.781 -8.955 794 HA2 GLY 114 HA2 GLY 114 10.568 8.876 -10.162 795 HA3 GLY 114 HA3 GLY 114 9.436 7.631 -10.676 796 H GLU 115 H GLU 115 7.995 9.178 -9.515 797 HA GLU 115 HA GLU 115 8.029 8.792 -6.622 798 HB2 GLU 115 HB2 GLU 115 7.728 11.076 -7.542 799 HB3 GLU 115 HB3 GLU 115 6.230 10.547 -8.297 800 HG2 GLU 115 HG2 GLU 115 5.257 10.095 -6.124 801 HG3 GLU 115 HG3 GLU 115 6.777 10.516 -5.335 802 H TYR 116 H TYR 116 7.015 7.114 -5.873 803 HA TYR 116 HA TYR 116 4.819 5.895 -7.401 804 HB2 TYR 116 HB2 TYR 116 6.107 4.681 -4.963 805 HB3 TYR 116 HB3 TYR 116 5.268 3.873 -6.279 806 HD1 TYR 116 HD1 TYR 116 6.451 3.819 -8.572 807 HD2 TYR 116 HD2 TYR 116 8.403 4.855 -4.938 808 HE1 TYR 116 HE1 TYR 116 8.629 3.306 -9.598 809 HE2 TYR 116 HE2 TYR 116 10.576 4.356 -5.953 810 HH TYR 116 HH TYR 116 10.930 3.703 -9.342 811 H ILE 117 H ILE 117 2.842 5.504 -6.409 812 HA ILE 117 HA ILE 117 2.570 6.492 -3.653 813 HB ILE 117 HB ILE 117 0.257 6.692 -5.607 814 HG12 ILE 117 HG12 ILE 117 2.062 9.002 -4.866 815 HG13 ILE 117 HG13 ILE 117 2.261 8.093 -6.358 816 HG21 ILE 117 HG21 ILE 117 -0.283 6.724 -3.236 817 HG22 ILE 117 HG22 ILE 117 -0.540 8.325 -3.929 818 HG23 ILE 117 HG23 ILE 117 0.897 8.008 -2.956 819 HD11 ILE 117 HD11 ILE 117 1.020 10.167 -6.706 820 HD12 ILE 117 HD12 ILE 117 -0.207 9.625 -5.560 821 HD13 ILE 117 HD13 ILE 117 0.035 8.750 -7.072 822 H VAL 118 H VAL 118 2.535 4.616 -2.590 823 HA VAL 118 HA VAL 118 1.246 2.278 -3.727 824 HB VAL 118 HB VAL 118 2.605 2.555 -1.031 825 HG11 VAL 118 HG11 VAL 118 1.093 0.636 -1.152 826 HG12 VAL 118 HG12 VAL 118 2.777 0.112 -1.091 827 HG13 VAL 118 HG13 VAL 118 1.900 0.084 -2.622 828 HG21 VAL 118 HG21 VAL 118 4.548 1.500 -2.083 829 HG22 VAL 118 HG22 VAL 118 4.162 3.046 -2.840 830 HG23 VAL 118 HG23 VAL 118 3.723 1.538 -3.643 831 H SER 119 H SER 119 -0.756 1.610 -3.264 832 HA SER 119 HA SER 119 -2.151 2.925 -1.043 833 HB2 SER 119 HB2 SER 119 -2.837 3.835 -3.249 834 HB3 SER 119 HB3 SER 119 -3.311 2.213 -3.750 835 HG SER 119 HG SER 119 -4.672 4.015 -2.260 836 H LEU 120 H LEU 120 -2.647 1.511 0.428 837 HA LEU 120 HA LEU 120 -3.557 -1.168 -0.390 838 HB2 LEU 120 HB2 LEU 120 -1.679 -1.246 1.160 839 HB3 LEU 120 HB3 LEU 120 -2.497 -0.171 2.268 840 HG LEU 120 HG LEU 120 -4.106 -1.909 2.840 841 HD11 LEU 120 HD11 LEU 120 -3.923 -4.176 1.966 842 HD12 LEU 120 HD12 LEU 120 -2.619 -3.672 0.891 843 HD13 LEU 120 HD13 LEU 120 -4.249 -3.036 0.659 844 HD21 LEU 120 HD21 LEU 120 -1.281 -2.932 2.895 845 HD22 LEU 120 HD22 LEU 120 -2.602 -3.468 3.933 846 HD23 LEU 120 HD23 LEU 120 -1.999 -1.814 4.056 847 H ILE 121 H ILE 121 -5.687 -1.441 -0.366 848 HA ILE 121 HA ILE 121 -7.258 0.256 1.432 849 HB ILE 121 HB ILE 121 -7.631 1.206 -0.733 850 HG12 ILE 121 HG12 ILE 121 -10.012 -0.562 -0.128 851 HG13 ILE 121 HG13 ILE 121 -9.602 0.886 0.781 852 HG21 ILE 121 HG21 ILE 121 -8.282 -1.556 -1.743 853 HG22 ILE 121 HG22 ILE 121 -6.873 -0.584 -2.164 854 HG23 ILE 121 HG23 ILE 121 -8.484 -0.060 -2.659 855 HD11 ILE 121 HD11 ILE 121 -9.919 2.230 -1.239 856 HD12 ILE 121 HD12 ILE 121 -11.371 1.328 -0.805 857 HD13 ILE 121 HD13 ILE 121 -10.350 0.773 -2.133 858 H VAL 122 H VAL 122 -8.623 -0.773 2.687 859 HA VAL 122 HA VAL 122 -9.139 -3.608 2.116 860 HB VAL 122 HB VAL 122 -9.246 -4.004 4.578 861 HG11 VAL 122 HG11 VAL 122 -6.807 -4.006 4.932 862 HG12 VAL 122 HG12 VAL 122 -6.617 -2.987 3.504 863 HG13 VAL 122 HG13 VAL 122 -7.261 -4.622 3.343 864 HG21 VAL 122 HG21 VAL 122 -9.637 -1.717 5.339 865 HG22 VAL 122 HG22 VAL 122 -8.030 -1.248 4.780 866 HG23 VAL 122 HG23 VAL 122 -8.202 -2.404 6.102 867 H SER 123 H SER 123 -11.202 -4.433 3.020 868 HA SER 123 HA SER 123 -13.235 -2.327 3.137 869 HB2 SER 123 HB2 SER 123 -13.276 -4.653 1.197 870 HB3 SER 123 HB3 SER 123 -14.594 -3.510 1.439 871 HG SER 123 HG SER 123 -12.374 -2.122 0.977 872 H ASN 124 H ASN 124 -15.194 -2.913 3.957 873 HA ASN 124 HA ASN 124 -15.717 -5.618 4.875 874 HB2 ASN 124 HB2 ASN 124 -14.561 -4.387 6.775 875 HB3 ASN 124 HB3 ASN 124 -15.876 -3.225 6.759 876 HD21 ASN 124 HD21 ASN 124 -16.377 -3.716 8.918 877 HD22 ASN 124 HD22 ASN 124 -17.183 -5.186 9.345 878 H GLU 125 H GLU 125 -18.164 -5.443 5.851 879 HA GLU 125 HA GLU 125 -19.780 -4.351 3.766 880 HB2 GLU 125 HB2 GLU 125 -21.657 -5.249 5.123 881 HB3 GLU 125 HB3 GLU 125 -20.402 -6.439 4.801 882 HG2 GLU 125 HG2 GLU 125 -19.502 -6.093 7.057 883 HG3 GLU 125 HG3 GLU 125 -20.760 -4.902 7.367 884 H ASN 126 H ASN 126 -18.499 -3.035 6.593 885 HA ASN 126 HA ASN 126 -20.699 -1.201 7.122 886 HB2 ASN 126 HB2 ASN 126 -19.367 -2.314 8.974 887 HB3 ASN 126 HB3 ASN 126 -17.988 -1.332 8.484 888 HD21 ASN 126 HD21 ASN 126 -17.903 -0.317 10.459 889 HD22 ASN 126 HD22 ASN 126 -19.065 0.859 10.951 890 H ASP 127 H ASP 127 -17.204 -0.999 6.413 891 HA ASP 127 HA ASP 127 -17.640 1.301 4.698 892 HB2 ASP 127 HB2 ASP 127 -17.235 1.905 7.286 893 HB3 ASP 127 HB3 ASP 127 -15.558 1.703 6.798 894 H SER 128 H SER 128 -15.426 2.034 3.791 895 HA SER 128 HA SER 128 -13.478 -0.170 3.765 896 HB2 SER 128 HB2 SER 128 -12.957 0.445 1.398 897 HB3 SER 128 HB3 SER 128 -14.598 -0.174 1.597 898 HG SER 128 HG SER 128 -14.213 2.581 1.821 899 H ASP 129 H ASP 129 -11.411 0.435 4.149 900 HA ASP 129 HA ASP 129 -10.919 3.326 4.474 901 HB2 ASP 129 HB2 ASP 129 -11.157 2.006 6.628 902 HB3 ASP 129 HB3 ASP 129 -9.702 1.127 6.163 903 H SER 130 H SER 130 -9.064 4.102 3.539 904 HA SER 130 HA SER 130 -7.176 2.114 2.493 905 HB2 SER 130 HB2 SER 130 -6.885 3.632 0.510 906 HB3 SER 130 HB3 SER 130 -8.460 2.848 0.603 907 HG SER 130 HG SER 130 -9.317 4.791 1.430 908 H ALA 131 H ALA 131 -5.051 2.604 2.597 909 HA ALA 131 HA ALA 131 -4.283 5.253 3.637 910 HB1 ALA 131 HB1 ALA 131 -2.396 4.190 4.780 911 HB2 ALA 131 HB2 ALA 131 -2.945 2.608 4.225 912 HB3 ALA 131 HB3 ALA 131 -3.930 3.538 5.354 913 H SER 132 H SER 132 -2.650 6.274 2.524 914 HA SER 132 HA SER 132 -1.240 4.765 0.470 915 HB2 SER 132 HB2 SER 132 -3.429 5.871 -0.402 916 HB3 SER 132 HB3 SER 132 -2.544 7.389 -0.244 917 HG SER 132 HG SER 132 -1.289 5.272 -1.563 918 H VAL 133 H VAL 133 0.798 5.584 0.021 919 HA VAL 133 HA VAL 133 1.602 8.033 1.396 920 HB VAL 133 HB VAL 133 1.993 6.153 2.976 921 HG11 VAL 133 HG11 VAL 133 2.433 4.348 1.453 922 HG12 VAL 133 HG12 VAL 133 3.788 4.541 2.570 923 HG13 VAL 133 HG13 VAL 133 3.914 5.127 0.909 924 HG21 VAL 133 HG21 VAL 133 4.311 6.668 3.553 925 HG22 VAL 133 HG22 VAL 133 3.395 8.121 3.150 926 HG23 VAL 133 HG23 VAL 133 4.529 7.440 1.983 927 H THR 134 H THR 134 3.385 9.068 0.499 928 HA THR 134 HA THR 134 3.929 8.427 -2.275 929 HB THR 134 HB THR 134 4.739 10.793 -0.565 930 HG1 THR 134 HG1 THR 134 2.945 11.073 -2.677 931 HG21 THR 134 HG21 THR 134 5.306 11.921 -2.656 932 HG22 THR 134 HG22 THR 134 4.942 10.444 -3.552 933 HG23 THR 134 HG23 THR 134 6.297 10.484 -2.423 934 H ILE 135 H ILE 135 5.610 7.325 -2.890 935 HA ILE 135 HA ILE 135 7.945 7.040 -1.109 936 HB ILE 135 HB ILE 135 7.340 5.295 -3.515 937 HG12 ILE 135 HG12 ILE 135 5.389 5.110 -2.059 938 HG13 ILE 135 HG13 ILE 135 6.325 3.620 -2.024 939 HG21 ILE 135 HG21 ILE 135 8.765 3.659 -2.365 940 HG22 ILE 135 HG22 ILE 135 9.023 4.805 -1.050 941 HG23 ILE 135 HG23 ILE 135 9.614 5.172 -2.672 942 HD11 ILE 135 HD11 ILE 135 5.500 4.192 0.180 943 HD12 ILE 135 HD12 ILE 135 6.310 5.756 0.098 944 HD13 ILE 135 HD13 ILE 135 7.264 4.273 0.140 945 H ARG 136 H ARG 136 9.791 8.043 -1.769 946 HA ARG 136 HA ARG 136 9.783 9.083 -4.519 947 HB2 ARG 136 HB2 ARG 136 11.268 10.158 -2.106 948 HB3 ARG 136 HB3 ARG 136 11.333 10.832 -3.729 949 HG2 ARG 136 HG2 ARG 136 9.696 12.188 -3.061 950 HG3 ARG 136 HG3 ARG 136 8.633 10.786 -3.196 951 HD2 ARG 136 HD2 ARG 136 8.302 11.755 -1.037 952 HD3 ARG 136 HD3 ARG 136 9.174 10.238 -0.821 953 HE ARG 136 HE ARG 136 11.017 12.372 -1.029 954 HH11 ARG 136 HH11 ARG 136 8.725 10.979 1.252 955 HH12 ARG 136 HH12 ARG 136 9.500 11.673 2.641 956 HH21 ARG 136 HH21 ARG 136 12.033 13.266 0.794 957 HH22 ARG 136 HH22 ARG 136 11.371 12.974 2.379 958 H ALA 137 H ALA 137 11.254 8.350 -5.888 959 HA ALA 137 HA ALA 137 13.504 6.807 -4.784 960 HB1 ALA 137 HB1 ALA 137 13.541 5.503 -6.817 961 HB2 ALA 137 HB2 ALA 137 12.221 6.461 -7.489 962 HB3 ALA 137 HB3 ALA 137 11.940 5.431 -6.083 963 H LEU 138 H LEU 138 15.487 7.323 -5.291 964 HA LEU 138 HA LEU 138 16.035 9.781 -6.649 965 HB2 LEU 138 HB2 LEU 138 17.885 7.690 -5.496 966 HB3 LEU 138 HB3 LEU 138 18.414 9.226 -6.153 967 HG LEU 138 HG LEU 138 16.672 8.836 -3.717 968 HD11 LEU 138 HD11 LEU 138 18.588 9.769 -2.517 969 HD12 LEU 138 HD12 LEU 138 19.511 9.807 -4.019 970 HD13 LEU 138 HD13 LEU 138 18.998 8.263 -3.335 971 HD21 LEU 138 HD21 LEU 138 17.707 11.379 -4.976 972 HD22 LEU 138 HD22 LEU 138 16.847 11.256 -3.441 973 HD23 LEU 138 HD23 LEU 138 16.026 10.840 -4.944 974 H GLU 139 H GLU 139 16.708 10.105 -8.599 975 HA GLU 139 HA GLU 139 16.405 7.958 -10.481 976 HB2 GLU 139 HB2 GLU 139 16.614 9.808 -12.161 977 HB3 GLU 139 HB3 GLU 139 15.293 9.983 -11.018 978 HG2 GLU 139 HG2 GLU 139 16.890 11.483 -9.705 979 HG3 GLU 139 HG3 GLU 139 17.865 11.499 -11.177 980 H HIS 140 H HIS 140 17.889 7.192 -11.925 981 HA HIS 140 HA HIS 140 20.666 7.851 -11.384 982 HB2 HIS 140 HB2 HIS 140 21.236 5.914 -12.860 983 HB3 HIS 140 HB3 HIS 140 20.321 5.486 -11.433 984 HD1 HIS 140 HD1 HIS 140 18.365 3.992 -11.796 985 HD2 HIS 140 HD2 HIS 140 19.561 5.904 -15.294 986 HE1 HIS 140 HE1 HIS 140 16.982 2.973 -13.642 987 HE2 HIS 140 HE2 HIS 140 17.552 4.314 -15.679 988 H HIS 141 H HIS 141 21.988 8.918 -12.742 989 HA HIS 141 HA HIS 141 20.792 9.745 -15.313 990 HB2 HIS 141 HB2 HIS 141 22.909 11.154 -13.652 991 HB3 HIS 141 HB3 HIS 141 22.370 11.679 -15.243 992 HD1 HIS 141 HD1 HIS 141 21.921 12.539 -11.898 993 HD2 HIS 141 HD2 HIS 141 19.262 11.985 -15.048 994 HE1 HIS 141 HE1 HIS 141 19.829 13.769 -11.237 995 HE2 HIS 141 HE2 HIS 141 18.173 13.245 -13.059 996 H HIS 142 H HIS 142 23.747 8.784 -13.697 997 HA HIS 142 HA HIS 142 25.117 8.129 -16.154 998 HB2 HIS 142 HB2 HIS 142 26.081 9.026 -13.890 999 HB3 HIS 142 HB3 HIS 142 25.984 7.347 -13.381 1000 HD1 HIS 142 HD1 HIS 142 27.772 9.583 -15.820 1001 HD2 HIS 142 HD2 HIS 142 27.970 5.698 -14.347 1002 HE1 HIS 142 HE1 HIS 142 29.972 8.667 -16.627 1003 HE2 HIS 142 HE2 HIS 142 30.022 6.279 -15.828 1004 H HIS 143 H HIS 143 25.540 6.034 -16.855 1005 HA HIS 143 HA HIS 143 23.634 4.060 -15.811 1006 HB2 HIS 143 HB2 HIS 143 24.872 4.285 -18.561 1007 HB3 HIS 143 HB3 HIS 143 23.827 2.968 -18.044 1008 HD1 HIS 143 HD1 HIS 143 21.303 3.448 -17.887 1009 HD2 HIS 143 HD2 HIS 143 23.571 6.732 -19.075 1010 HE1 HIS 143 HE1 HIS 143 19.641 5.187 -18.637 1011 HE2 HIS 143 HE2 HIS 143 21.024 7.183 -19.288 1012 H HIS 144 H HIS 144 24.249 1.824 -15.817 1013 HA HIS 144 HA HIS 144 26.939 1.568 -14.708 1014 HB2 HIS 144 HB2 HIS 144 24.508 -0.234 -14.582 1015 HB3 HIS 144 HB3 HIS 144 26.067 -0.667 -13.898 1016 HD1 HIS 144 HD1 HIS 144 25.930 -0.425 -11.438 1017 HD2 HIS 144 HD2 HIS 144 23.805 2.572 -13.380 1018 HE1 HIS 144 HE1 HIS 144 25.024 1.052 -9.614 1019 HE2 HIS 144 HE2 HIS 144 23.634 2.772 -10.808 1020 H HIS 145 H HIS 145 28.477 0.185 -15.465 1021 HA HIS 145 HA HIS 145 28.321 -0.501 -18.230 1022 HB2 HIS 145 HB2 HIS 145 30.644 -1.192 -18.062 1023 HB3 HIS 145 HB3 HIS 145 30.412 0.343 -17.241 1024 HD1 HIS 145 HD1 HIS 145 31.382 -3.211 -16.665 1025 HD2 HIS 145 HD2 HIS 145 30.836 0.260 -14.433 1026 HE1 HIS 145 HE1 HIS 145 32.437 -3.667 -14.427 1027 HE2 HIS 145 HE2 HIS 145 31.967 -1.621 -13.045 Start of MODEL 5 1 H1 MET 1 H1 MET 1 67.997 138.641 -11.356 2 H2 MET 1 H2 MET 1 67.120 137.191 -11.295 3 H3 MET 1 H3 MET 1 68.385 137.371 -12.404 4 HA MET 1 HA MET 1 69.991 137.493 -10.661 5 HB2 MET 1 HB2 MET 1 69.436 137.193 -8.346 6 HB3 MET 1 HB3 MET 1 68.466 138.518 -8.957 7 HG2 MET 1 HG2 MET 1 67.438 135.705 -8.631 8 HG3 MET 1 HG3 MET 1 67.302 136.948 -7.393 9 HE1 MET 1 HE1 MET 1 64.824 135.303 -8.487 10 HE2 MET 1 HE2 MET 1 63.620 136.575 -8.699 11 HE3 MET 1 HE3 MET 1 64.664 136.570 -7.275 12 H ASN 2 H ASN 2 70.967 135.580 -9.800 13 HA ASN 2 HA ASN 2 69.813 133.140 -10.902 14 HB2 ASN 2 HB2 ASN 2 72.555 133.834 -9.861 15 HB3 ASN 2 HB3 ASN 2 72.077 132.162 -10.124 16 HD21 ASN 2 HD21 ASN 2 73.614 131.846 -11.693 17 HD22 ASN 2 HD22 ASN 2 73.494 132.527 -13.278 18 H ALA 3 H ALA 3 68.307 132.357 -9.614 19 HA ALA 3 HA ALA 3 69.081 131.710 -6.848 20 HB1 ALA 3 HB1 ALA 3 66.344 132.620 -7.757 21 HB2 ALA 3 HB2 ALA 3 67.491 133.564 -6.807 22 HB3 ALA 3 HB3 ALA 3 66.774 132.104 -6.125 23 H ARG 4 H ARG 4 67.958 129.766 -6.011 24 HA ARG 4 HA ARG 4 67.958 127.806 -8.137 25 HB2 ARG 4 HB2 ARG 4 68.382 126.149 -6.558 26 HB3 ARG 4 HB3 ARG 4 69.240 127.542 -5.945 27 HG2 ARG 4 HG2 ARG 4 66.538 126.714 -4.924 28 HG3 ARG 4 HG3 ARG 4 68.041 126.076 -4.268 29 HD2 ARG 4 HD2 ARG 4 67.568 127.794 -2.807 30 HD3 ARG 4 HD3 ARG 4 68.657 128.585 -3.943 31 HE ARG 4 HE ARG 4 65.931 128.903 -4.726 32 HH11 ARG 4 HH11 ARG 4 68.339 130.164 -2.505 33 HH12 ARG 4 HH12 ARG 4 67.579 131.722 -2.384 34 HH21 ARG 4 HH21 ARG 4 64.974 130.946 -4.583 35 HH22 ARG 4 HH22 ARG 4 65.684 132.161 -3.565 36 H ASP 5 H ASP 5 66.415 126.297 -8.555 37 HA ASP 5 HA ASP 5 63.669 127.064 -7.864 38 HB2 ASP 5 HB2 ASP 5 64.067 126.949 -10.228 39 HB3 ASP 5 HB3 ASP 5 64.885 125.394 -10.084 40 H ASN 6 H ASN 6 62.345 125.718 -6.728 41 HA ASN 6 HA ASN 6 63.428 123.096 -5.939 42 HB2 ASN 6 HB2 ASN 6 62.024 125.107 -4.144 43 HB3 ASN 6 HB3 ASN 6 62.440 123.466 -3.677 44 HD21 ASN 6 HD21 ASN 6 64.546 122.964 -3.183 45 HD22 ASN 6 HD22 ASN 6 65.769 124.168 -2.959 46 H LYS 7 H LYS 7 62.088 121.493 -6.498 47 HA LYS 7 HA LYS 7 59.283 121.851 -5.785 48 HB2 LYS 7 HB2 LYS 7 58.366 120.836 -7.729 49 HB3 LYS 7 HB3 LYS 7 59.402 122.142 -8.263 50 HG2 LYS 7 HG2 LYS 7 60.612 119.444 -8.197 51 HG3 LYS 7 HG3 LYS 7 59.346 119.708 -9.389 52 HD2 LYS 7 HD2 LYS 7 61.722 121.535 -9.107 53 HD3 LYS 7 HD3 LYS 7 61.742 120.111 -10.145 54 HE2 LYS 7 HE2 LYS 7 61.133 121.744 -11.649 55 HE3 LYS 7 HE3 LYS 7 59.553 121.170 -11.124 56 HZ1 LYS 7 HZ1 LYS 7 60.965 123.587 -10.127 57 HZ2 LYS 7 HZ2 LYS 7 59.478 123.020 -9.542 58 HZ3 LYS 7 HZ3 LYS 7 59.602 123.564 -11.137 59 H PHE 8 H PHE 8 58.460 120.248 -4.659 60 HA PHE 8 HA PHE 8 59.357 117.549 -4.940 61 HB2 PHE 8 HB2 PHE 8 59.983 117.241 -2.532 62 HB3 PHE 8 HB3 PHE 8 61.125 118.207 -3.448 63 HD1 PHE 8 HD2 PHE 8 61.347 120.615 -3.010 64 HD2 PHE 8 HD1 PHE 8 58.743 118.170 -0.695 65 HE1 PHE 8 HE2 PHE 8 61.238 122.365 -1.288 66 HE2 PHE 8 HE1 PHE 8 58.638 119.912 1.030 67 HZ PHE 8 HZ PHE 8 59.883 122.011 0.735 68 H ASN 9 H ASN 9 57.883 116.097 -4.269 69 HA ASN 9 HA ASN 9 55.502 117.155 -2.934 70 HB2 ASN 9 HB2 ASN 9 54.182 115.450 -4.305 71 HB3 ASN 9 HB3 ASN 9 54.756 116.878 -5.152 72 HD21 ASN 9 HD21 ASN 9 54.616 115.880 -7.143 73 HD22 ASN 9 HD22 ASN 9 55.724 114.646 -7.651 74 H THR 10 H THR 10 54.280 115.623 -1.689 75 HA THR 10 HA THR 10 56.106 113.669 -0.483 76 HB THR 10 HB THR 10 53.577 114.784 0.755 77 HG1 THR 10 HG1 THR 10 56.007 115.961 0.305 78 HG21 THR 10 HG21 THR 10 54.456 112.735 1.786 79 HG22 THR 10 HG22 THR 10 54.665 114.124 2.855 80 HG23 THR 10 HG23 THR 10 56.039 113.494 1.946 81 H TRP 11 H TRP 11 55.829 111.741 -1.411 82 HA TRP 11 HA TRP 11 53.098 110.754 -1.851 83 HB2 TRP 11 HB2 TRP 11 55.743 109.758 -2.919 84 HB3 TRP 11 HB3 TRP 11 54.213 108.929 -3.159 85 HD1 TRP 11 HD1 TRP 11 56.409 110.758 -5.127 86 HE1 TRP 11 HE1 TRP 11 55.261 112.123 -6.974 87 HE3 TRP 11 HE3 TRP 11 51.626 110.824 -3.275 88 HZ2 TRP 11 HZ2 TRP 11 52.702 113.112 -7.563 89 HZ3 TRP 11 HZ3 TRP 11 49.894 112.010 -4.553 90 HH2 TRP 11 HH2 TRP 11 50.425 113.129 -6.652 91 H ASN 12 H ASN 12 52.454 108.748 -1.086 92 HA ASN 12 HA ASN 12 54.170 107.237 0.671 93 HB2 ASN 12 HB2 ASN 12 52.576 107.359 2.596 94 HB3 ASN 12 HB3 ASN 12 53.399 108.879 2.274 95 HD21 ASN 12 HD21 ASN 12 52.211 110.629 1.491 96 HD22 ASN 12 HD22 ASN 12 50.485 110.676 1.544 97 H ASP 13 H ASP 13 53.421 105.098 0.949 98 HA ASP 13 HA ASP 13 51.191 104.354 -0.766 99 HB2 ASP 13 HB2 ASP 13 51.847 102.063 -0.392 100 HB3 ASP 13 HB3 ASP 13 53.288 103.003 -0.746 101 H SER 14 H SER 14 49.275 103.340 -0.009 102 HA SER 14 HA SER 14 48.837 103.432 2.881 103 HB2 SER 14 HB2 SER 14 48.140 105.633 1.830 104 HB3 SER 14 HB3 SER 14 46.913 104.724 0.947 105 HG SER 14 HG SER 14 47.092 104.454 3.741 106 H ARG 15 H ARG 15 48.463 101.321 3.167 107 HA ARG 15 HA ARG 15 46.011 100.274 1.939 108 HB2 ARG 15 HB2 ARG 15 48.634 98.767 2.175 109 HB3 ARG 15 HB3 ARG 15 47.091 97.972 1.899 110 HG2 ARG 15 HG2 ARG 15 48.311 100.033 0.075 111 HG3 ARG 15 HG3 ARG 15 48.414 98.287 -0.153 112 HD2 ARG 15 HD2 ARG 15 46.226 98.100 -0.774 113 HD3 ARG 15 HD3 ARG 15 45.716 99.476 0.204 114 HE ARG 15 HE ARG 15 46.581 100.929 -1.511 115 HH11 ARG 15 HH11 ARG 15 46.315 97.549 -2.440 116 HH12 ARG 15 HH12 ARG 15 46.258 97.893 -4.142 117 HH21 ARG 15 HH21 ARG 15 46.464 101.376 -3.738 118 HH22 ARG 15 HH22 ARG 15 46.334 100.070 -4.876 119 H GLY 16 H GLY 16 44.688 99.281 3.350 120 HA2 GLY 16 HA2 GLY 16 45.735 98.629 6.040 121 HA3 GLY 16 HA3 GLY 16 44.179 99.415 5.806 122 H ASN 17 H ASN 17 44.371 97.025 7.207 123 HA ASN 17 HA ASN 17 43.750 94.890 5.338 124 HB2 ASN 17 HB2 ASN 17 43.796 93.375 7.185 125 HB3 ASN 17 HB3 ASN 17 45.147 94.477 7.387 126 HD21 ASN 17 HD21 ASN 17 42.182 93.317 8.695 127 HD22 ASN 17 HD22 ASN 17 42.251 94.186 10.186 128 H TYR 18 H TYR 18 41.819 93.744 5.256 129 HA TYR 18 HA TYR 18 39.471 94.795 6.597 130 HB2 TYR 18 HB2 TYR 18 38.263 94.942 4.347 131 HB3 TYR 18 HB3 TYR 18 39.382 96.240 4.733 132 HD1 TYR 18 HD1 TYR 18 38.892 93.228 2.639 133 HD2 TYR 18 HD2 TYR 18 41.291 96.652 3.397 134 HE1 TYR 18 HE1 TYR 18 40.048 92.885 0.504 135 HE2 TYR 18 HE2 TYR 18 42.465 96.317 1.268 136 HH TYR 18 HH TYR 18 42.948 94.363 -0.268 137 H TRP 19 H TRP 19 37.494 93.518 5.836 138 HA TRP 19 HA TRP 19 36.362 91.598 6.026 139 HB2 TRP 19 HB2 TRP 19 38.447 90.631 4.068 140 HB3 TRP 19 HB3 TRP 19 37.043 89.681 4.540 141 HD1 TRP 19 HD1 TRP 19 34.948 92.181 4.467 142 HE1 TRP 19 HE1 TRP 19 34.170 93.031 2.166 143 HE3 TRP 19 HE3 TRP 19 38.755 90.335 1.593 144 HZ2 TRP 19 HZ2 TRP 19 35.055 92.932 -0.510 145 HZ3 TRP 19 HZ3 TRP 19 38.709 90.753 -0.830 146 HH2 TRP 19 HH2 TRP 19 36.896 92.023 -1.854 147 H SER 20 H SER 20 37.101 91.704 8.244 148 HA SER 20 HA SER 20 38.631 89.289 8.962 149 HB2 SER 20 HB2 SER 20 38.537 91.936 10.437 150 HB3 SER 20 HB3 SER 20 39.427 90.505 10.958 151 HG SER 20 HG SER 20 40.187 90.956 8.492 152 H ASP 21 H ASP 21 35.690 90.178 8.619 153 HA ASP 21 HA ASP 21 34.566 89.772 11.249 154 HB2 ASP 21 HB2 ASP 21 32.396 90.108 10.163 155 HB3 ASP 21 HB3 ASP 21 33.516 91.382 9.702 156 H TYR 22 H TYR 22 32.702 88.178 11.423 157 HA TYR 22 HA TYR 22 33.464 85.650 10.142 158 HB2 TYR 22 HB2 TYR 22 32.866 84.460 12.191 159 HB3 TYR 22 HB3 TYR 22 34.069 85.685 12.547 160 HD1 TYR 22 HD1 TYR 22 33.217 87.892 13.618 161 HD2 TYR 22 HD2 TYR 22 30.891 84.338 13.416 162 HE1 TYR 22 HE1 TYR 22 31.785 88.730 15.428 163 HE2 TYR 22 HE2 TYR 22 29.450 85.170 15.216 164 HH TYR 22 HH TYR 22 29.541 86.755 17.069 165 H GLU 23 H GLU 23 31.528 84.014 10.528 166 HA GLU 23 HA GLU 23 29.133 85.304 9.456 167 HB2 GLU 23 HB2 GLU 23 30.128 83.432 8.214 168 HB3 GLU 23 HB3 GLU 23 29.910 82.385 9.607 169 HG2 GLU 23 HG2 GLU 23 27.475 82.722 9.430 170 HG3 GLU 23 HG3 GLU 23 27.738 83.683 7.975 171 H GLY 24 H GLY 24 29.669 82.497 11.611 172 HA2 GLY 24 HA2 GLY 24 28.925 82.160 13.784 173 HA3 GLY 24 HA3 GLY 24 28.150 83.736 13.747 174 H SER 25 H SER 25 27.866 80.442 12.444 175 HA SER 25 HA SER 25 24.950 80.730 12.660 176 HB2 SER 25 HB2 SER 25 26.464 79.388 10.407 177 HB3 SER 25 HB3 SER 25 24.723 79.261 10.646 178 HG SER 25 HG SER 25 25.821 81.820 10.583 179 H ASP 26 H ASP 26 24.417 79.514 14.332 180 HA ASP 26 HA ASP 26 25.382 76.734 14.420 181 HB2 ASP 26 HB2 ASP 26 25.135 76.765 16.848 182 HB3 ASP 26 HB3 ASP 26 26.235 78.036 16.342 183 H GLU 27 H GLU 27 23.797 75.128 15.001 184 HA GLU 27 HA GLU 27 21.017 75.972 14.952 185 HB2 GLU 27 HB2 GLU 27 20.544 74.437 12.989 186 HB3 GLU 27 HB3 GLU 27 21.354 75.952 12.624 187 HG2 GLU 27 HG2 GLU 27 23.478 74.816 12.408 188 HG3 GLU 27 HG3 GLU 27 22.747 73.291 12.907 189 H ASN 28 H ASN 28 19.831 74.790 16.226 190 HA ASN 28 HA ASN 28 20.360 71.909 16.505 191 HB2 ASN 28 HB2 ASN 28 19.952 73.906 18.725 192 HB3 ASN 28 HB3 ASN 28 19.503 72.222 18.940 193 HD21 ASN 28 HD21 ASN 28 21.747 71.187 17.372 194 HD22 ASN 28 HD22 ASN 28 23.146 71.411 18.358 195 H GLY 29 H GLY 29 18.558 70.633 16.573 196 HA2 GLY 29 HA2 GLY 29 15.949 71.632 17.173 197 HA3 GLY 29 HA3 GLY 29 16.168 71.438 15.440 198 H ASP 30 H ASP 30 16.945 69.362 14.694 199 HA ASP 30 HA ASP 30 17.090 67.135 14.509 200 HB2 ASP 30 HB2 ASP 30 17.412 67.193 17.513 201 HB3 ASP 30 HB3 ASP 30 17.736 65.798 16.487 202 H GLY 31 H GLY 31 15.619 66.441 17.590 203 HA2 GLY 31 HA2 GLY 31 13.279 65.394 16.126 204 HA3 GLY 31 HA3 GLY 31 13.965 64.657 17.567 205 H ILE 32 H ILE 32 11.272 65.851 16.787 206 HA ILE 32 HA ILE 32 10.968 67.619 19.136 207 HB ILE 32 HB ILE 32 9.289 67.694 16.607 208 HG12 ILE 32 HG12 ILE 32 11.552 68.580 16.170 209 HG13 ILE 32 HG13 ILE 32 10.325 69.833 16.065 210 HG21 ILE 32 HG21 ILE 32 9.265 69.519 19.005 211 HG22 ILE 32 HG22 ILE 32 8.023 68.349 18.560 212 HG23 ILE 32 HG23 ILE 32 8.323 69.749 17.531 213 HD11 ILE 32 HD11 ILE 32 10.978 70.638 18.288 214 HD12 ILE 32 HD12 ILE 32 12.326 70.661 17.150 215 HD13 ILE 32 HD13 ILE 32 12.220 69.386 18.365 216 H GLY 33 H GLY 33 10.018 66.435 20.700 217 HA2 GLY 33 HA2 GLY 33 7.769 65.847 21.450 218 HA3 GLY 33 HA3 GLY 33 7.553 64.995 19.934 219 H ASP 34 H ASP 34 7.233 64.101 22.693 220 HA ASP 34 HA ASP 34 8.543 61.549 22.425 221 HB2 ASP 34 HB2 ASP 34 10.273 62.858 23.641 222 HB3 ASP 34 HB3 ASP 34 9.090 63.268 24.878 223 H SER 35 H SER 35 6.800 60.265 22.657 224 HA SER 35 HA SER 35 5.342 60.314 25.161 225 HB2 SER 35 HB2 SER 35 3.115 60.121 23.975 226 HB3 SER 35 HB3 SER 35 3.851 61.706 23.921 227 HG SER 35 HG SER 35 2.964 60.469 21.901 228 H ALA 36 H ALA 36 4.404 58.332 25.698 229 HA ALA 36 HA ALA 36 4.478 56.229 23.717 230 HB1 ALA 36 HB1 ALA 36 5.749 54.675 25.101 231 HB2 ALA 36 HB2 ALA 36 5.946 55.914 26.340 232 HB3 ALA 36 HB3 ALA 36 6.707 56.114 24.760 233 H TYR 37 H TYR 37 2.679 55.065 23.822 234 HA TYR 37 HA TYR 37 1.658 54.086 26.314 235 HB2 TYR 37 HB2 TYR 37 0.606 56.397 26.081 236 HB3 TYR 37 HB3 TYR 37 -0.242 55.781 24.666 237 HD1 TYR 37 HD1 TYR 37 0.240 55.201 28.301 238 HD2 TYR 37 HD2 TYR 37 -2.274 54.642 24.923 239 HE1 TYR 37 HE1 TYR 37 -1.527 54.332 29.767 240 HE2 TYR 37 HE2 TYR 37 -4.051 53.768 26.375 241 HH TYR 37 HH TYR 37 -4.300 52.728 28.554 242 H ALA 38 H ALA 38 1.600 52.003 25.707 243 HA ALA 38 HA ALA 38 -0.018 51.224 23.404 244 HB1 ALA 38 HB1 ALA 38 2.247 51.475 22.505 245 HB2 ALA 38 HB2 ALA 38 1.707 49.796 22.468 246 HB3 ALA 38 HB3 ALA 38 2.842 50.331 23.707 247 H VAL 39 H VAL 39 -1.459 50.323 24.866 248 HA VAL 39 HA VAL 39 -0.849 47.662 25.713 249 HB VAL 39 HB VAL 39 0.150 48.700 27.635 250 HG11 VAL 39 HG11 VAL 39 -2.375 50.305 27.986 251 HG12 VAL 39 HG12 VAL 39 -0.793 50.919 27.509 252 HG13 VAL 39 HG13 VAL 39 -1.031 50.258 29.130 253 HG21 VAL 39 HG21 VAL 39 -1.242 47.876 29.495 254 HG22 VAL 39 HG22 VAL 39 -1.154 46.725 28.162 255 HG23 VAL 39 HG23 VAL 39 -2.601 47.707 28.383 256 H ASN 40 H ASN 40 -2.601 46.552 25.137 257 HA ASN 40 HA ASN 40 -5.119 47.206 26.316 258 HB2 ASN 40 HB2 ASN 40 -6.390 46.942 24.071 259 HB3 ASN 40 HB3 ASN 40 -5.694 48.503 24.469 260 HD21 ASN 40 HD21 ASN 40 -4.017 49.297 23.258 261 HD22 ASN 40 HD22 ASN 40 -3.532 48.601 21.749 262 HA PRO 41 HA PRO 41 -4.914 42.696 26.069 263 HB2 PRO 41 HB2 PRO 41 -5.750 42.666 28.819 264 HB3 PRO 41 HB3 PRO 41 -4.211 42.130 28.143 265 HG2 PRO 41 HG2 PRO 41 -4.507 44.307 29.796 266 HG3 PRO 41 HG3 PRO 41 -3.168 44.097 28.654 267 HD2 PRO 41 HD2 PRO 41 -5.661 45.728 28.382 268 HD3 PRO 41 HD3 PRO 41 -4.001 46.112 27.878 269 H GLU 42 H GLU 42 -6.726 42.668 24.772 270 HA GLU 42 HA GLU 42 -9.322 43.249 25.984 271 HB2 GLU 42 HB2 GLU 42 -8.671 42.657 23.090 272 HB3 GLU 42 HB3 GLU 42 -10.226 43.185 23.720 273 HG2 GLU 42 HG2 GLU 42 -8.963 45.249 24.570 274 HG3 GLU 42 HG3 GLU 42 -7.672 44.735 23.487 275 H ALA 43 H ALA 43 -11.116 41.693 24.938 276 HA ALA 43 HA ALA 43 -10.512 39.105 26.075 277 HB1 ALA 43 HB1 ALA 43 -12.654 40.217 26.567 278 HB2 ALA 43 HB2 ALA 43 -12.889 38.639 25.820 279 HB3 ALA 43 HB3 ALA 43 -13.101 40.106 24.863 280 H GLY 44 H GLY 44 -9.119 38.103 24.691 281 HA2 GLY 44 HA2 GLY 44 -10.383 36.845 22.393 282 HA3 GLY 44 HA3 GLY 44 -8.951 37.806 22.045 283 H SER 45 H SER 45 -9.471 35.966 24.978 284 HA SER 45 HA SER 45 -7.032 34.481 24.511 285 HB2 SER 45 HB2 SER 45 -7.492 33.576 26.831 286 HB3 SER 45 HB3 SER 45 -7.290 35.322 26.746 287 HG SER 45 HG SER 45 -9.808 34.000 26.742 288 H MET 46 H MET 46 -7.157 32.795 23.213 289 HA MET 46 HA MET 46 -9.647 31.353 22.913 290 HB2 MET 46 HB2 MET 46 -7.020 30.959 21.465 291 HB3 MET 46 HB3 MET 46 -8.564 30.240 21.025 292 HG2 MET 46 HG2 MET 46 -9.481 32.453 20.581 293 HG3 MET 46 HG3 MET 46 -7.949 33.188 21.051 294 HE1 MET 46 HE1 MET 46 -7.929 33.807 17.205 295 HE2 MET 46 HE2 MET 46 -7.693 34.524 18.799 296 HE3 MET 46 HE3 MET 46 -9.285 33.927 18.327 297 H ASP 47 H ASP 47 -9.782 30.425 24.915 298 HA ASP 47 HA ASP 47 -8.087 28.060 25.332 299 HB2 ASP 47 HB2 ASP 47 -7.368 29.773 26.925 300 HB3 ASP 47 HB3 ASP 47 -9.035 30.053 27.416 301 H TYR 48 H TYR 48 -9.259 26.267 25.484 302 HA TYR 48 HA TYR 48 -11.939 26.237 26.512 303 HB2 TYR 48 HB2 TYR 48 -12.905 25.275 24.375 304 HB3 TYR 48 HB3 TYR 48 -12.529 26.990 24.313 305 HD1 TYR 48 HD2 TYR 48 -11.571 23.651 23.102 306 HD2 TYR 48 HD1 TYR 48 -10.818 27.832 22.830 307 HE1 TYR 48 HE2 TYR 48 -10.239 23.277 21.075 308 HE2 TYR 48 HE1 TYR 48 -9.492 27.468 20.798 309 HH TYR 48 HH TYR 48 -8.192 25.630 19.781 310 H MET 49 H MET 49 -12.829 24.033 26.552 311 HA MET 49 HA MET 49 -10.817 21.920 26.243 312 HB2 MET 49 HB2 MET 49 -10.757 22.735 28.604 313 HB3 MET 49 HB3 MET 49 -12.454 22.310 28.762 314 HG2 MET 49 HG2 MET 49 -11.881 19.958 28.311 315 HG3 MET 49 HG3 MET 49 -10.179 20.408 28.230 316 HE1 MET 49 HE1 MET 49 -10.008 22.615 30.573 317 HE2 MET 49 HE2 MET 49 -8.799 21.354 30.322 318 HE3 MET 49 HE3 MET 49 -9.501 21.596 31.921 319 HA PRO 50 HA PRO 50 -14.582 19.979 24.610 320 HB2 PRO 50 HB2 PRO 50 -13.277 17.766 23.662 321 HB3 PRO 50 HB3 PRO 50 -13.460 19.273 22.763 322 HG2 PRO 50 HG2 PRO 50 -11.111 18.231 24.263 323 HG3 PRO 50 HG3 PRO 50 -11.162 19.169 22.762 324 HD2 PRO 50 HD2 PRO 50 -10.545 20.233 25.200 325 HD3 PRO 50 HD3 PRO 50 -11.263 21.164 23.872 326 H LEU 51 H LEU 51 -15.680 19.379 26.407 327 HA LEU 51 HA LEU 51 -14.849 16.864 27.689 328 HB2 LEU 51 HB2 LEU 51 -14.601 18.812 29.203 329 HB3 LEU 51 HB3 LEU 51 -16.296 19.192 28.985 330 HG LEU 51 HG LEU 51 -16.874 17.014 30.057 331 HD11 LEU 51 HD11 LEU 51 -14.808 15.811 29.577 332 HD12 LEU 51 HD12 LEU 51 -15.152 15.818 31.308 333 HD13 LEU 51 HD13 LEU 51 -13.919 16.894 30.648 334 HD21 LEU 51 HD21 LEU 51 -16.351 17.730 32.334 335 HD22 LEU 51 HD22 LEU 51 -16.864 19.094 31.341 336 HD23 LEU 51 HD23 LEU 51 -15.154 18.865 31.708 337 H MET 52 H MET 52 -16.063 15.677 26.209 338 HA MET 52 HA MET 52 -18.855 15.431 26.859 339 HB2 MET 52 HB2 MET 52 -19.719 15.679 24.589 340 HB3 MET 52 HB3 MET 52 -18.958 17.173 25.110 341 HG2 MET 52 HG2 MET 52 -17.068 16.797 23.727 342 HG3 MET 52 HG3 MET 52 -17.564 15.141 23.383 343 HE1 MET 52 HE1 MET 52 -18.064 16.624 19.859 344 HE2 MET 52 HE2 MET 52 -17.475 15.255 20.803 345 HE3 MET 52 HE3 MET 52 -16.721 16.840 20.981 346 H GLU 53 H GLU 53 -19.574 13.381 26.542 347 HA GLU 53 HA GLU 53 -18.027 11.644 24.766 348 HB2 GLU 53 HB2 GLU 53 -18.652 11.081 27.646 349 HB3 GLU 53 HB3 GLU 53 -18.490 9.757 26.497 350 HG2 GLU 53 HG2 GLU 53 -16.220 10.798 25.905 351 HG3 GLU 53 HG3 GLU 53 -16.423 11.742 27.380 352 H TYR 54 H TYR 54 -19.142 9.763 24.071 353 HA TYR 54 HA TYR 54 -22.062 9.906 24.270 354 HB2 TYR 54 HB2 TYR 54 -22.240 9.401 21.842 355 HB3 TYR 54 HB3 TYR 54 -21.479 10.955 22.138 356 HD1 TYR 54 HD1 TYR 54 -18.983 11.177 21.808 357 HD2 TYR 54 HD2 TYR 54 -21.112 7.683 20.659 358 HE1 TYR 54 HE1 TYR 54 -17.104 10.509 20.377 359 HE2 TYR 54 HE2 TYR 54 -19.240 7.005 19.230 360 HH TYR 54 HH TYR 54 -16.184 8.381 19.435 361 H LEU 55 H LEU 55 -23.082 7.907 24.341 362 HA LEU 55 HA LEU 55 -21.272 5.583 24.267 363 HB2 LEU 55 HB2 LEU 55 -23.313 6.228 26.395 364 HB3 LEU 55 HB3 LEU 55 -22.563 4.654 26.213 365 HG LEU 55 HG LEU 55 -21.061 7.214 26.806 366 HD11 LEU 55 HD11 LEU 55 -21.799 4.924 28.620 367 HD12 LEU 55 HD12 LEU 55 -22.488 6.547 28.673 368 HD13 LEU 55 HD13 LEU 55 -20.783 6.298 29.049 369 HD21 LEU 55 HD21 LEU 55 -19.185 5.712 27.296 370 HD22 LEU 55 HD22 LEU 55 -19.704 5.574 25.615 371 HD23 LEU 55 HD23 LEU 55 -20.159 4.335 26.784 372 H HIS 56 H HIS 56 -21.856 4.476 22.618 373 HA HIS 56 HA HIS 56 -24.338 3.068 22.647 374 HB2 HIS 56 HB2 HIS 56 -25.094 3.612 20.378 375 HB3 HIS 56 HB3 HIS 56 -25.103 5.051 21.375 376 HD1 HIS 56 HD1 HIS 56 -24.163 3.908 18.119 377 HD2 HIS 56 HD2 HIS 56 -22.664 6.721 20.785 378 HE1 HIS 56 HE1 HIS 56 -22.757 5.461 16.738 379 HE2 HIS 56 HE2 HIS 56 -22.026 7.262 18.331 380 H SER 57 H SER 57 -24.289 1.282 20.994 381 HA SER 57 HA SER 57 -21.578 0.309 20.743 382 HB2 SER 57 HB2 SER 57 -24.165 -0.960 19.811 383 HB3 SER 57 HB3 SER 57 -22.593 -1.758 19.899 384 HG SER 57 HG SER 57 -24.290 -0.913 21.987 385 H SER 58 H SER 58 -20.547 1.571 19.334 386 HA SER 58 HA SER 58 -21.595 2.295 16.772 387 HB2 SER 58 HB2 SER 58 -18.748 2.497 17.798 388 HB3 SER 58 HB3 SER 58 -19.452 3.383 16.446 389 HG SER 58 HG SER 58 -19.934 4.826 17.874 390 HA PRO 59 HA PRO 59 -20.168 -1.416 14.650 391 HB2 PRO 59 HB2 PRO 59 -20.463 -0.478 12.121 392 HB3 PRO 59 HB3 PRO 59 -21.788 -1.131 13.088 393 HG2 PRO 59 HG2 PRO 59 -21.059 1.721 12.560 394 HG3 PRO 59 HG3 PRO 59 -22.662 0.969 12.654 395 HD2 PRO 59 HD2 PRO 59 -21.593 2.413 14.687 396 HD3 PRO 59 HD3 PRO 59 -22.714 1.062 14.946 397 H VAL 60 H VAL 60 -18.229 -2.042 13.872 398 HA VAL 60 HA VAL 60 -16.240 0.079 13.927 399 HB VAL 60 HB VAL 60 -15.910 -1.578 15.613 400 HG11 VAL 60 HG11 VAL 60 -15.555 -3.922 15.216 401 HG12 VAL 60 HG12 VAL 60 -15.723 -3.683 13.476 402 HG13 VAL 60 HG13 VAL 60 -17.114 -3.430 14.534 403 HG21 VAL 60 HG21 VAL 60 -13.900 -0.648 14.686 404 HG22 VAL 60 HG22 VAL 60 -13.872 -1.879 13.423 405 HG23 VAL 60 HG23 VAL 60 -13.631 -2.338 15.109 406 H LEU 61 H LEU 61 -15.756 0.869 12.098 407 HA LEU 61 HA LEU 61 -15.696 -0.614 9.646 408 HB2 LEU 61 HB2 LEU 61 -14.660 1.596 8.753 409 HB3 LEU 61 HB3 LEU 61 -16.350 1.535 9.154 410 HG LEU 61 HG LEU 61 -15.162 3.673 9.703 411 HD11 LEU 61 HD11 LEU 61 -16.202 4.031 11.870 412 HD12 LEU 61 HD12 LEU 61 -16.457 2.293 12.025 413 HD13 LEU 61 HD13 LEU 61 -17.267 3.189 10.741 414 HD21 LEU 61 HD21 LEU 61 -13.050 2.865 10.512 415 HD22 LEU 61 HD22 LEU 61 -13.841 2.064 11.870 416 HD23 LEU 61 HD23 LEU 61 -13.849 3.824 11.760 417 HA PRO 62 HA PRO 62 -11.490 -1.919 9.722 418 HB2 PRO 62 HB2 PRO 62 -10.550 -1.505 7.227 419 HB3 PRO 62 HB3 PRO 62 -11.652 -2.836 7.647 420 HG2 PRO 62 HG2 PRO 62 -12.235 -0.233 6.311 421 HG3 PRO 62 HG3 PRO 62 -12.945 -1.832 6.018 422 HD2 PRO 62 HD2 PRO 62 -14.185 0.132 7.451 423 HD3 PRO 62 HD3 PRO 62 -14.474 -1.598 7.705 424 H THR 63 H THR 63 -9.264 -1.424 9.043 425 HA THR 63 HA THR 63 -8.606 1.378 8.692 426 HB THR 63 HB THR 63 -7.326 -0.305 10.871 427 HG1 THR 63 HG1 THR 63 -9.566 1.279 10.891 428 HG21 THR 63 HG21 THR 63 -5.873 1.347 9.824 429 HG22 THR 63 HG22 THR 63 -6.252 1.805 11.487 430 HG23 THR 63 HG23 THR 63 -7.068 2.601 10.140 431 H ALA 64 H ALA 64 -7.490 1.254 6.851 432 HA ALA 64 HA ALA 64 -5.867 -1.042 6.198 433 HB1 ALA 64 HB1 ALA 64 -5.328 0.183 4.157 434 HB2 ALA 64 HB2 ALA 64 -6.130 1.618 4.799 435 HB3 ALA 64 HB3 ALA 64 -7.069 0.167 4.440 436 H ARG 65 H ARG 65 -3.851 -1.289 6.805 437 HA ARG 65 HA ARG 65 -2.181 1.035 7.352 438 HB2 ARG 65 HB2 ARG 65 -3.292 0.341 9.510 439 HB3 ARG 65 HB3 ARG 65 -2.518 -1.226 9.352 440 HG2 ARG 65 HG2 ARG 65 -1.289 0.123 10.910 441 HG3 ARG 65 HG3 ARG 65 -0.317 -0.105 9.454 442 HD2 ARG 65 HD2 ARG 65 -0.997 2.107 8.659 443 HD3 ARG 65 HD3 ARG 65 -1.969 2.326 10.112 444 HE ARG 65 HE ARG 65 0.791 1.762 10.665 445 HH11 ARG 65 HH11 ARG 65 -1.505 4.310 9.916 446 HH12 ARG 65 HH12 ARG 65 -0.544 5.562 10.642 447 HH21 ARG 65 HH21 ARG 65 2.056 3.398 11.600 448 HH22 ARG 65 HH22 ARG 65 1.485 5.037 11.594 449 H PHE 66 H PHE 66 -0.136 0.680 6.648 450 HA PHE 66 HA PHE 66 0.984 -1.957 6.615 451 HB2 PHE 66 HB2 PHE 66 1.489 -2.089 4.239 452 HB3 PHE 66 HB3 PHE 66 -0.244 -1.996 4.470 453 HD1 PHE 66 HD2 PHE 66 -1.233 0.480 4.269 454 HD2 PHE 66 HD1 PHE 66 2.443 -0.850 2.592 455 HE1 PHE 66 HE2 PHE 66 -1.343 2.284 2.611 456 HE2 PHE 66 HE1 PHE 66 2.332 0.952 0.930 457 HZ PHE 66 HZ PHE 66 0.433 2.516 0.938 458 H THR 67 H THR 67 3.196 -1.966 6.451 459 HA THR 67 HA THR 67 4.450 0.689 6.590 460 HB THR 67 HB THR 67 6.401 -0.595 7.585 461 HG1 THR 67 HG1 THR 67 5.189 -2.656 6.799 462 HG21 THR 67 HG21 THR 67 5.418 -0.782 9.810 463 HG22 THR 67 HG22 THR 67 3.804 -0.680 9.110 464 HG23 THR 67 HG23 THR 67 4.898 0.701 9.006 465 H SER 68 H SER 68 5.706 1.296 4.967 466 HA SER 68 HA SER 68 6.836 -0.738 3.191 467 HB2 SER 68 HB2 SER 68 5.745 1.269 2.177 468 HB3 SER 68 HB3 SER 68 6.957 2.286 2.958 469 HG SER 68 HG SER 68 8.204 1.859 1.334 470 H ASP 69 H ASP 69 9.084 -0.998 3.010 471 HA ASP 69 HA ASP 69 10.537 -0.712 5.411 472 HB2 ASP 69 HB2 ASP 69 10.925 -2.512 3.755 473 HB3 ASP 69 HB3 ASP 69 11.592 -1.328 2.638 474 H ILE 70 H ILE 70 10.761 1.050 2.323 475 HA ILE 70 HA ILE 70 11.856 3.288 3.864 476 HB ILE 70 HB ILE 70 12.980 4.042 1.668 477 HG12 ILE 70 HG12 ILE 70 13.913 1.851 0.493 478 HG13 ILE 70 HG13 ILE 70 12.373 1.182 1.013 479 HG21 ILE 70 HG21 ILE 70 14.097 1.748 3.257 480 HG22 ILE 70 HG22 ILE 70 14.235 3.468 3.627 481 HG23 ILE 70 HG23 ILE 70 15.032 2.805 2.199 482 HD11 ILE 70 HD11 ILE 70 12.753 3.590 -0.757 483 HD12 ILE 70 HD12 ILE 70 11.204 2.931 -0.229 484 HD13 ILE 70 HD13 ILE 70 12.256 1.976 -1.273 485 H THR 71 H THR 71 11.318 5.380 3.106 486 HA THR 71 HA THR 71 8.927 5.456 1.397 487 HB THR 71 HB THR 71 8.726 7.833 2.481 488 HG1 THR 71 HG1 THR 71 9.462 7.372 4.834 489 HG21 THR 71 HG21 THR 71 7.066 6.065 2.734 490 HG22 THR 71 HG22 THR 71 7.325 6.892 4.271 491 HG23 THR 71 HG23 THR 71 8.043 5.304 3.992 492 H GLU 72 H GLU 72 12.187 6.338 1.735 493 HA GLU 72 HA GLU 72 12.199 7.530 -0.881 494 HB2 GLU 72 HB2 GLU 72 11.874 9.512 0.564 495 HB3 GLU 72 HB3 GLU 72 13.304 9.072 1.490 496 HG2 GLU 72 HG2 GLU 72 14.723 9.449 -0.425 497 HG3 GLU 72 HG3 GLU 72 13.322 9.718 -1.457 498 H GLY 73 H GLY 73 14.095 7.188 -1.911 499 HA2 GLY 73 HA2 GLY 73 16.631 6.814 -0.854 500 HA3 GLY 73 HA3 GLY 73 15.896 5.208 -0.950 501 H PHE 74 H PHE 74 17.935 5.263 -2.502 502 HA PHE 74 HA PHE 74 17.335 6.269 -5.143 503 HB2 PHE 74 HB2 PHE 74 19.337 4.818 -5.799 504 HB3 PHE 74 HB3 PHE 74 19.657 6.155 -4.709 505 HD1 PHE 74 HD2 PHE 74 19.422 2.487 -4.994 506 HD2 PHE 74 HD1 PHE 74 20.424 5.767 -2.473 507 HE1 PHE 74 HE2 PHE 74 20.522 0.947 -3.432 508 HE2 PHE 74 HE1 PHE 74 21.532 4.231 -0.913 509 HZ PHE 74 HZ PHE 74 21.580 1.816 -1.387 510 H ALA 75 H ALA 75 16.580 5.098 -6.881 511 HA ALA 75 HA ALA 75 14.581 3.269 -6.522 512 HB1 ALA 75 HB1 ALA 75 16.243 3.535 -9.018 513 HB2 ALA 75 HB2 ALA 75 14.901 4.584 -8.559 514 HB3 ALA 75 HB3 ALA 75 14.609 2.879 -8.907 515 HA PRO 76 HA PRO 76 17.080 -0.365 -5.767 516 HB2 PRO 76 HB2 PRO 76 15.239 -1.486 -4.059 517 HB3 PRO 76 HB3 PRO 76 16.420 -0.263 -3.591 518 HG2 PRO 76 HG2 PRO 76 13.566 -0.010 -3.725 519 HG3 PRO 76 HG3 PRO 76 14.751 1.210 -3.238 520 HD2 PRO 76 HD2 PRO 76 13.391 0.833 -5.836 521 HD3 PRO 76 HD3 PRO 76 14.110 2.300 -5.135 522 H LEU 77 H LEU 77 16.266 -2.815 -5.361 523 HA LEU 77 HA LEU 77 15.128 -3.583 -7.895 524 HB2 LEU 77 HB2 LEU 77 15.724 -5.893 -7.243 525 HB3 LEU 77 HB3 LEU 77 17.085 -4.799 -7.181 526 HG LEU 77 HG LEU 77 15.612 -5.425 -4.639 527 HD11 LEU 77 HD11 LEU 77 17.690 -7.199 -5.915 528 HD12 LEU 77 HD12 LEU 77 15.988 -7.598 -5.676 529 HD13 LEU 77 HD13 LEU 77 17.045 -7.371 -4.282 530 HD21 LEU 77 HD21 LEU 77 18.524 -4.897 -5.262 531 HD22 LEU 77 HD22 LEU 77 17.837 -5.135 -3.654 532 HD23 LEU 77 HD23 LEU 77 17.380 -3.723 -4.610 533 H SER 78 H SER 78 14.323 -4.101 -4.453 534 HA SER 78 HA SER 78 11.546 -4.494 -5.247 535 HB2 SER 78 HB2 SER 78 12.642 -6.760 -5.202 536 HB3 SER 78 HB3 SER 78 12.969 -6.512 -3.488 537 HG SER 78 HG SER 78 10.441 -6.672 -4.767 538 H VAL 79 H VAL 79 10.598 -2.958 -4.129 539 HA VAL 79 HA VAL 79 11.364 -2.443 -1.360 540 HB VAL 79 HB VAL 79 9.172 -1.125 -2.996 541 HG11 VAL 79 HG11 VAL 79 8.755 -0.943 -0.594 542 HG12 VAL 79 HG12 VAL 79 9.215 0.618 -1.272 543 HG13 VAL 79 HG13 VAL 79 10.389 -0.318 -0.348 544 HG21 VAL 79 HG21 VAL 79 10.719 0.756 -3.196 545 HG22 VAL 79 HG22 VAL 79 11.381 -0.704 -3.941 546 HG23 VAL 79 HG23 VAL 79 11.961 -0.172 -2.358 547 H ARG 80 H ARG 80 10.598 -3.682 0.162 548 HA ARG 80 HA ARG 80 8.252 -5.329 -0.363 549 HB2 ARG 80 HB2 ARG 80 10.292 -5.516 1.855 550 HB3 ARG 80 HB3 ARG 80 9.002 -6.670 1.546 551 HG2 ARG 80 HG2 ARG 80 10.005 -7.136 -0.666 552 HG3 ARG 80 HG3 ARG 80 11.339 -6.058 -0.252 553 HD2 ARG 80 HD2 ARG 80 12.082 -8.252 0.206 554 HD3 ARG 80 HD3 ARG 80 11.738 -7.504 1.762 555 HE ARG 80 HE ARG 80 9.441 -8.866 0.952 556 HH11 ARG 80 HH11 ARG 80 12.721 -9.624 1.971 557 HH12 ARG 80 HH12 ARG 80 12.307 -11.222 2.508 558 HH21 ARG 80 HH21 ARG 80 8.928 -10.968 1.643 559 HH22 ARG 80 HH22 ARG 80 10.163 -11.985 2.324 560 H PHE 81 H PHE 81 6.499 -5.402 0.868 561 HA PHE 81 HA PHE 81 6.147 -3.239 2.819 562 HB2 PHE 81 HB2 PHE 81 3.674 -3.434 2.176 563 HB3 PHE 81 HB3 PHE 81 4.743 -2.712 0.983 564 HD1 PHE 81 HD1 PHE 81 2.846 -5.774 1.840 565 HD2 PHE 81 HD2 PHE 81 5.042 -3.697 -1.157 566 HE1 PHE 81 HE1 PHE 81 2.070 -7.385 0.158 567 HE2 PHE 81 HE2 PHE 81 4.267 -5.309 -2.841 568 HZ PHE 81 HZ PHE 81 2.780 -7.155 -2.185 569 H LYS 82 H LYS 82 4.500 -3.667 4.472 570 HA LYS 82 HA LYS 82 4.089 -6.506 5.109 571 HB2 LYS 82 HB2 LYS 82 6.047 -5.543 6.409 572 HB3 LYS 82 HB3 LYS 82 4.911 -4.438 7.157 573 HG2 LYS 82 HG2 LYS 82 3.701 -6.272 8.152 574 HG3 LYS 82 HG3 LYS 82 4.731 -7.436 7.312 575 HD2 LYS 82 HD2 LYS 82 6.664 -6.649 8.531 576 HD3 LYS 82 HD3 LYS 82 5.688 -5.413 9.331 577 HE2 LYS 82 HE2 LYS 82 6.025 -7.305 10.816 578 HE3 LYS 82 HE3 LYS 82 4.326 -7.176 10.364 579 HZ1 LYS 82 HZ1 LYS 82 4.710 -8.926 8.701 580 HZ2 LYS 82 HZ2 LYS 82 5.023 -9.456 10.280 581 HZ3 LYS 82 HZ3 LYS 82 6.311 -9.083 9.243 582 H ASP 83 H ASP 83 2.017 -6.907 5.741 583 HA ASP 83 HA ASP 83 0.187 -4.647 5.620 584 HB2 ASP 83 HB2 ASP 83 -0.347 -6.545 4.226 585 HB3 ASP 83 HB3 ASP 83 -0.268 -7.643 5.595 586 H PHE 84 H PHE 84 -1.111 -3.964 7.211 587 HA PHE 84 HA PHE 84 -1.003 -5.302 9.838 588 HB2 PHE 84 HB2 PHE 84 -0.222 -2.460 9.233 589 HB3 PHE 84 HB3 PHE 84 -0.848 -2.905 10.811 590 HD1 PHE 84 HD2 PHE 84 0.372 -4.765 12.064 591 HD2 PHE 84 HD1 PHE 84 2.028 -2.648 8.770 592 HE1 PHE 84 HE2 PHE 84 2.627 -5.399 12.793 593 HE2 PHE 84 HE1 PHE 84 4.286 -3.280 9.501 594 HZ PHE 84 HZ PHE 84 4.584 -4.655 11.511 595 H SER 85 H SER 85 -2.964 -4.592 7.530 596 HA SER 85 HA SER 85 -4.903 -2.820 8.411 597 HB2 SER 85 HB2 SER 85 -5.247 -5.303 6.741 598 HB3 SER 85 HB3 SER 85 -6.429 -3.998 6.876 599 HG SER 85 HG SER 85 -3.993 -4.077 5.523 600 H GLU 86 H GLU 86 -6.525 -2.839 9.788 601 HA GLU 86 HA GLU 86 -6.958 -5.281 11.391 602 HB2 GLU 86 HB2 GLU 86 -5.663 -3.363 12.481 603 HB3 GLU 86 HB3 GLU 86 -7.150 -2.437 12.386 604 HG2 GLU 86 HG2 GLU 86 -8.251 -4.224 13.754 605 HG3 GLU 86 HG3 GLU 86 -6.659 -4.948 13.968 606 H ASN 87 H ASN 87 -9.068 -5.728 11.935 607 HA ASN 87 HA ASN 87 -11.322 -5.859 11.783 608 HB2 ASN 87 HB2 ASN 87 -11.274 -2.852 11.437 609 HB3 ASN 87 HB3 ASN 87 -12.692 -3.823 11.811 610 HD21 ASN 87 HD21 ASN 87 -10.021 -2.171 13.042 611 HD22 ASN 87 HD22 ASN 87 -10.190 -2.612 14.703 612 H ALA 88 H ALA 88 -9.850 -6.332 9.472 613 HA ALA 88 HA ALA 88 -11.560 -5.224 7.349 614 HB1 ALA 88 HB1 ALA 88 -9.194 -4.675 7.138 615 HB2 ALA 88 HB2 ALA 88 -9.726 -5.728 5.825 616 HB3 ALA 88 HB3 ALA 88 -8.788 -6.390 7.165 617 H THR 89 H THR 89 -12.710 -6.541 6.091 618 HA THR 89 HA THR 89 -12.855 -9.357 6.717 619 HB THR 89 HB THR 89 -14.230 -7.959 4.406 620 HG1 THR 89 HG1 THR 89 -14.466 -7.365 6.982 621 HG21 THR 89 HG21 THR 89 -15.950 -9.666 4.767 622 HG22 THR 89 HG22 THR 89 -15.028 -10.330 6.114 623 HG23 THR 89 HG23 THR 89 -14.383 -10.420 4.474 624 H SER 90 H SER 90 -12.064 -7.374 3.872 625 HA SER 90 HA SER 90 -10.207 -9.448 2.956 626 HB2 SER 90 HB2 SER 90 -12.132 -7.892 1.192 627 HB3 SER 90 HB3 SER 90 -10.903 -9.016 0.618 628 HG SER 90 HG SER 90 -13.225 -9.753 0.958 629 H ARG 91 H ARG 91 -8.367 -8.660 1.921 630 HA ARG 91 HA ARG 91 -8.029 -5.744 1.998 631 HB2 ARG 91 HB2 ARG 91 -5.620 -6.083 2.250 632 HB3 ARG 91 HB3 ARG 91 -6.495 -6.889 3.542 633 HG2 ARG 91 HG2 ARG 91 -6.180 -9.028 2.460 634 HG3 ARG 91 HG3 ARG 91 -5.385 -8.246 1.095 635 HD2 ARG 91 HD2 ARG 91 -3.702 -7.372 2.804 636 HD3 ARG 91 HD3 ARG 91 -4.412 -8.542 3.919 637 HE ARG 91 HE ARG 91 -3.673 -9.697 1.403 638 HH11 ARG 91 HH11 ARG 91 -2.462 -8.869 4.594 639 HH12 ARG 91 HH12 ARG 91 -1.124 -9.969 4.481 640 HH21 ARG 91 HH21 ARG 91 -1.931 -11.100 1.276 641 HH22 ARG 91 HH22 ARG 91 -0.813 -11.213 2.602 642 H LEU 92 H LEU 92 -7.018 -4.727 0.265 643 HA LEU 92 HA LEU 92 -6.856 -6.248 -2.242 644 HB2 LEU 92 HB2 LEU 92 -9.095 -4.982 -1.718 645 HB3 LEU 92 HB3 LEU 92 -8.169 -3.543 -2.071 646 HG LEU 92 HG LEU 92 -8.504 -5.790 -4.063 647 HD11 LEU 92 HD11 LEU 92 -10.168 -3.300 -3.713 648 HD12 LEU 92 HD12 LEU 92 -10.699 -4.961 -3.442 649 HD13 LEU 92 HD13 LEU 92 -10.269 -4.426 -5.067 650 HD21 LEU 92 HD21 LEU 92 -7.781 -2.881 -4.422 651 HD22 LEU 92 HD22 LEU 92 -7.967 -4.076 -5.705 652 HD23 LEU 92 HD23 LEU 92 -6.663 -4.242 -4.530 653 H TRP 93 H TRP 93 -4.849 -5.926 -2.965 654 HA TRP 93 HA TRP 93 -3.419 -3.494 -2.248 655 HB2 TRP 93 HB2 TRP 93 -2.523 -6.049 -3.581 656 HB3 TRP 93 HB3 TRP 93 -1.472 -4.659 -3.351 657 HD1 TRP 93 HD1 TRP 93 -2.838 -7.671 -1.575 658 HE1 TRP 93 HE1 TRP 93 -1.845 -7.799 0.794 659 HE3 TRP 93 HE3 TRP 93 -0.724 -3.020 -1.329 660 HZ2 TRP 93 HZ2 TRP 93 -0.414 -6.128 2.558 661 HZ3 TRP 93 HZ3 TRP 93 0.434 -2.362 0.740 662 HH2 TRP 93 HH2 TRP 93 0.584 -3.887 2.642 663 H MET 94 H MET 94 -3.325 -1.829 -3.508 664 HA MET 94 HA MET 94 -3.834 -2.145 -6.393 665 HB2 MET 94 HB2 MET 94 -4.208 0.270 -4.609 666 HB3 MET 94 HB3 MET 94 -4.405 0.285 -6.353 667 HG2 MET 94 HG2 MET 94 -6.225 -1.360 -6.124 668 HG3 MET 94 HG3 MET 94 -6.056 -1.261 -4.373 669 HE1 MET 94 HE1 MET 94 -7.058 0.640 -7.656 670 HE2 MET 94 HE2 MET 94 -5.748 1.645 -7.036 671 HE3 MET 94 HE3 MET 94 -7.402 2.258 -7.048 672 H PHE 95 H PHE 95 -1.844 -2.405 -7.260 673 HA PHE 95 HA PHE 95 0.321 -0.615 -6.465 674 HB2 PHE 95 HB2 PHE 95 0.350 -2.870 -8.493 675 HB3 PHE 95 HB3 PHE 95 1.754 -2.008 -7.873 676 HD1 PHE 95 HD2 PHE 95 2.002 -2.086 -5.237 677 HD2 PHE 95 HD1 PHE 95 -0.191 -4.895 -7.567 678 HE1 PHE 95 HE2 PHE 95 2.198 -3.739 -3.426 679 HE2 PHE 95 HE1 PHE 95 -0.000 -6.550 -5.758 680 HZ PHE 95 HZ PHE 95 1.196 -5.973 -3.687 681 H GLY 96 H GLY 96 -1.982 -1.090 -8.990 682 HA2 GLY 96 HA2 GLY 96 -2.537 0.443 -10.685 683 HA3 GLY 96 HA3 GLY 96 -0.970 1.216 -10.467 684 H ASP 97 H ASP 97 -0.392 -1.984 -10.508 685 HA ASP 97 HA ASP 97 0.269 -1.978 -13.378 686 HB2 ASP 97 HB2 ASP 97 1.893 -3.006 -11.029 687 HB3 ASP 97 HB3 ASP 97 2.278 -3.377 -12.710 688 H GLY 98 H GLY 98 -1.069 -3.321 -14.308 689 HA2 GLY 98 HA2 GLY 98 -1.977 -5.368 -14.909 690 HA3 GLY 98 HA3 GLY 98 -1.192 -6.092 -13.512 691 H ASN 99 H ASN 99 -3.270 -7.233 -13.360 692 HA ASN 99 HA ASN 99 -5.543 -5.730 -12.438 693 HB2 ASN 99 HB2 ASN 99 -6.698 -7.839 -12.178 694 HB3 ASN 99 HB3 ASN 99 -5.849 -7.834 -13.714 695 HD21 ASN 99 HD21 ASN 99 -6.200 -9.347 -10.654 696 HD22 ASN 99 HD22 ASN 99 -5.055 -10.619 -10.898 697 H THR 100 H THR 100 -6.380 -5.589 -10.414 698 HA THR 100 HA THR 100 -4.467 -5.835 -8.234 699 HB THR 100 HB THR 100 -6.200 -4.637 -6.903 700 HG1 THR 100 HG1 THR 100 -7.605 -4.436 -9.382 701 HG21 THR 100 HG21 THR 100 -5.503 -3.342 -9.539 702 HG22 THR 100 HG22 THR 100 -4.496 -3.363 -8.091 703 HG23 THR 100 HG23 THR 100 -6.032 -2.495 -8.084 704 H SER 101 H SER 101 -5.679 -6.408 -6.029 705 HA SER 101 HA SER 101 -6.373 -8.054 -4.628 706 HB2 SER 101 HB2 SER 101 -8.231 -8.858 -6.882 707 HB3 SER 101 HB3 SER 101 -8.392 -9.321 -5.191 708 HG SER 101 HG SER 101 -8.896 -6.867 -6.432 709 H ASP 102 H ASP 102 -4.135 -8.546 -6.453 710 HA ASP 102 HA ASP 102 -4.179 -11.485 -6.581 711 HB2 ASP 102 HB2 ASP 102 -4.517 -10.053 -8.818 712 HB3 ASP 102 HB3 ASP 102 -2.768 -9.923 -8.712 713 H SER 103 H SER 103 -1.785 -12.179 -7.112 714 HA SER 103 HA SER 103 -0.049 -11.352 -5.060 715 HB2 SER 103 HB2 SER 103 1.615 -12.738 -6.447 716 HB3 SER 103 HB3 SER 103 0.167 -13.564 -5.869 717 HG SER 103 HG SER 103 -0.444 -12.494 -8.207 718 HA PRO 104 HA PRO 104 2.188 -7.755 -6.465 719 HB2 PRO 104 HB2 PRO 104 4.689 -9.352 -6.151 720 HB3 PRO 104 HB3 PRO 104 4.284 -7.752 -5.518 721 HG2 PRO 104 HG2 PRO 104 4.237 -9.865 -3.914 722 HG3 PRO 104 HG3 PRO 104 2.990 -8.609 -3.795 723 HD2 PRO 104 HD2 PRO 104 2.818 -11.341 -4.979 724 HD3 PRO 104 HD3 PRO 104 1.596 -10.414 -4.086 725 H SER 105 H SER 105 3.353 -6.861 -8.205 726 HA SER 105 HA SER 105 2.716 -8.370 -10.579 727 HB2 SER 105 HB2 SER 105 3.833 -5.563 -10.488 728 HB3 SER 105 HB3 SER 105 2.750 -6.273 -11.685 729 HG SER 105 HG SER 105 1.122 -5.689 -10.506 730 HA PRO 106 HA PRO 106 6.993 -9.404 -11.456 731 HB2 PRO 106 HB2 PRO 106 6.151 -10.073 -14.153 732 HB3 PRO 106 HB3 PRO 106 6.699 -11.146 -12.866 733 HG2 PRO 106 HG2 PRO 106 4.141 -11.107 -13.767 734 HG3 PRO 106 HG3 PRO 106 4.581 -11.538 -12.106 735 HD2 PRO 106 HD2 PRO 106 3.511 -8.958 -13.174 736 HD3 PRO 106 HD3 PRO 106 3.105 -9.808 -11.666 737 H LEU 107 H LEU 107 8.671 -8.425 -12.387 738 HA LEU 107 HA LEU 107 9.967 -6.870 -13.358 739 HB2 LEU 107 HB2 LEU 107 7.719 -6.608 -15.356 740 HB3 LEU 107 HB3 LEU 107 9.302 -5.878 -15.534 741 HG LEU 107 HG LEU 107 8.797 -8.856 -15.372 742 HD11 LEU 107 HD11 LEU 107 9.275 -8.885 -17.762 743 HD12 LEU 107 HD12 LEU 107 9.403 -7.127 -17.765 744 HD13 LEU 107 HD13 LEU 107 7.856 -7.896 -17.411 745 HD21 LEU 107 HD21 LEU 107 11.293 -7.306 -16.074 746 HD22 LEU 107 HD22 LEU 107 11.118 -9.060 -16.111 747 HD23 LEU 107 HD23 LEU 107 11.021 -8.195 -14.576 748 H HIS 108 H HIS 108 7.987 -6.192 -11.284 749 HA HIS 108 HA HIS 108 7.612 -3.323 -11.729 750 HB2 HIS 108 HB2 HIS 108 5.773 -4.788 -10.735 751 HB3 HIS 108 HB3 HIS 108 6.768 -4.915 -9.291 752 HD1 HIS 108 HD1 HIS 108 5.870 -3.422 -7.552 753 HD2 HIS 108 HD2 HIS 108 5.594 -1.708 -11.328 754 HE1 HIS 108 HE1 HIS 108 4.845 -1.157 -7.194 755 HE2 HIS 108 HE2 HIS 108 4.537 -0.207 -9.496 756 H THR 109 H THR 109 10.171 -4.946 -11.179 757 HA THR 109 HA THR 109 11.448 -3.775 -8.957 758 HB THR 109 HB THR 109 12.543 -4.688 -11.647 759 HG1 THR 109 HG1 THR 109 12.453 -5.948 -9.084 760 HG21 THR 109 HG21 THR 109 14.021 -4.024 -9.087 761 HG22 THR 109 HG22 THR 109 14.174 -3.200 -10.643 762 HG23 THR 109 HG23 THR 109 14.729 -4.865 -10.473 763 H PHE 110 H PHE 110 12.506 -1.846 -8.757 764 HA PHE 110 HA PHE 110 11.508 0.234 -10.499 765 HB2 PHE 110 HB2 PHE 110 13.071 0.497 -7.915 766 HB3 PHE 110 HB3 PHE 110 12.181 1.775 -8.743 767 HD1 PHE 110 HD1 PHE 110 11.884 -1.261 -6.701 768 HD2 PHE 110 HD2 PHE 110 9.775 1.901 -8.610 769 HE1 PHE 110 HE1 PHE 110 9.858 -1.869 -5.459 770 HE2 PHE 110 HE2 PHE 110 7.747 1.301 -7.356 771 HZ PHE 110 HZ PHE 110 7.787 -0.589 -5.784 772 H PHE 111 H PHE 111 12.781 -0.371 -12.285 773 HA PHE 111 HA PHE 111 15.643 -0.130 -12.265 774 HB2 PHE 111 HB2 PHE 111 13.734 -0.120 -14.630 775 HB3 PHE 111 HB3 PHE 111 15.470 -0.339 -14.718 776 HD1 PHE 111 HD1 PHE 111 16.438 -2.453 -13.608 777 HD2 PHE 111 HD2 PHE 111 12.307 -1.930 -14.493 778 HE1 PHE 111 HE1 PHE 111 16.117 -4.893 -13.559 779 HE2 PHE 111 HE2 PHE 111 11.978 -4.366 -14.428 780 HZ PHE 111 HZ PHE 111 13.884 -5.851 -13.964 781 H ASN 112 H ASN 112 13.011 1.993 -12.451 782 HA ASN 112 HA ASN 112 14.592 4.132 -13.682 783 HB2 ASN 112 HB2 ASN 112 12.820 3.481 -15.197 784 HB3 ASN 112 HB3 ASN 112 11.633 3.492 -13.903 785 HD21 ASN 112 HD21 ASN 112 10.610 5.328 -13.402 786 HD22 ASN 112 HD22 ASN 112 10.874 6.846 -14.197 787 H GLU 113 H GLU 113 14.572 6.073 -12.652 788 HA GLU 113 HA GLU 113 13.646 6.105 -9.915 789 HB2 GLU 113 HB2 GLU 113 15.360 7.975 -11.549 790 HB3 GLU 113 HB3 GLU 113 14.851 8.358 -9.908 791 HG2 GLU 113 HG2 GLU 113 16.907 7.447 -9.530 792 HG3 GLU 113 HG3 GLU 113 15.875 6.036 -9.331 793 H GLY 114 H GLY 114 11.861 7.033 -9.233 794 HA2 GLY 114 HA2 GLY 114 10.763 9.434 -10.222 795 HA3 GLY 114 HA3 GLY 114 9.902 8.084 -10.947 796 H GLU 115 H GLU 115 8.017 8.946 -9.831 797 HA GLU 115 HA GLU 115 8.018 8.440 -6.929 798 HB2 GLU 115 HB2 GLU 115 7.457 10.752 -7.660 799 HB3 GLU 115 HB3 GLU 115 6.069 10.105 -8.526 800 HG2 GLU 115 HG2 GLU 115 5.206 9.229 -6.363 801 HG3 GLU 115 HG3 GLU 115 6.537 10.052 -5.550 802 H TYR 116 H TYR 116 7.240 6.528 -6.446 803 HA TYR 116 HA TYR 116 5.112 5.360 -8.122 804 HB2 TYR 116 HB2 TYR 116 7.200 3.988 -6.393 805 HB3 TYR 116 HB3 TYR 116 5.930 3.161 -7.291 806 HD1 TYR 116 HD1 TYR 116 6.046 2.960 -9.702 807 HD2 TYR 116 HD2 TYR 116 9.118 4.954 -7.538 808 HE1 TYR 116 HE1 TYR 116 7.492 2.880 -11.689 809 HE2 TYR 116 HE2 TYR 116 10.571 4.884 -9.513 810 HH TYR 116 HH TYR 116 10.849 3.669 -11.538 811 H ILE 117 H ILE 117 3.352 4.324 -7.006 812 HA ILE 117 HA ILE 117 3.135 5.130 -4.173 813 HB ILE 117 HB ILE 117 0.960 5.515 -6.266 814 HG12 ILE 117 HG12 ILE 117 2.503 7.601 -4.694 815 HG13 ILE 117 HG13 ILE 117 2.824 7.184 -6.371 816 HG21 ILE 117 HG21 ILE 117 0.023 4.890 -4.118 817 HG22 ILE 117 HG22 ILE 117 -0.294 6.593 -4.449 818 HG23 ILE 117 HG23 ILE 117 0.977 6.139 -3.314 819 HD11 ILE 117 HD11 ILE 117 1.547 9.228 -6.215 820 HD12 ILE 117 HD12 ILE 117 0.289 8.397 -5.300 821 HD13 ILE 117 HD13 ILE 117 0.589 7.963 -6.983 822 H VAL 118 H VAL 118 2.719 3.436 -2.935 823 HA VAL 118 HA VAL 118 1.282 1.121 -4.037 824 HB VAL 118 HB VAL 118 2.763 1.339 -1.398 825 HG11 VAL 118 HG11 VAL 118 1.628 -1.087 -2.787 826 HG12 VAL 118 HG12 VAL 118 1.009 -0.346 -1.311 827 HG13 VAL 118 HG13 VAL 118 2.598 -1.110 -1.314 828 HG21 VAL 118 HG21 VAL 118 4.317 1.490 -3.265 829 HG22 VAL 118 HG22 VAL 118 3.629 0.028 -3.972 830 HG23 VAL 118 HG23 VAL 118 4.491 -0.058 -2.436 831 H SER 119 H SER 119 -0.804 0.801 -3.520 832 HA SER 119 HA SER 119 -1.925 2.326 -1.262 833 HB2 SER 119 HB2 SER 119 -3.361 1.442 -3.776 834 HB3 SER 119 HB3 SER 119 -4.007 2.464 -2.498 835 HG SER 119 HG SER 119 -1.898 3.718 -3.137 836 H LEU 120 H LEU 120 -3.220 1.313 0.148 837 HA LEU 120 HA LEU 120 -3.934 -1.504 -0.315 838 HB2 LEU 120 HB2 LEU 120 -2.078 -1.469 1.249 839 HB3 LEU 120 HB3 LEU 120 -2.864 -0.250 2.222 840 HG LEU 120 HG LEU 120 -4.482 -1.859 3.042 841 HD11 LEU 120 HD11 LEU 120 -4.764 -3.218 0.997 842 HD12 LEU 120 HD12 LEU 120 -4.441 -4.209 2.421 843 HD13 LEU 120 HD13 LEU 120 -3.156 -3.899 1.253 844 HD21 LEU 120 HD21 LEU 120 -1.705 -2.962 3.080 845 HD22 LEU 120 HD22 LEU 120 -3.001 -3.352 4.212 846 HD23 LEU 120 HD23 LEU 120 -2.351 -1.713 4.144 847 H ILE 121 H ILE 121 -6.063 -1.693 -0.327 848 HA ILE 121 HA ILE 121 -7.634 0.108 1.372 849 HB ILE 121 HB ILE 121 -8.067 0.925 -0.815 850 HG12 ILE 121 HG12 ILE 121 -10.310 -0.954 -0.040 851 HG13 ILE 121 HG13 ILE 121 -10.075 0.678 0.554 852 HG21 ILE 121 HG21 ILE 121 -8.503 -1.910 -1.738 853 HG22 ILE 121 HG22 ILE 121 -7.143 -0.864 -2.145 854 HG23 ILE 121 HG23 ILE 121 -8.763 -0.464 -2.717 855 HD11 ILE 121 HD11 ILE 121 -10.734 -0.089 -2.279 856 HD12 ILE 121 HD12 ILE 121 -10.505 1.554 -1.678 857 HD13 ILE 121 HD13 ILE 121 -11.851 0.579 -1.087 858 H VAL 122 H VAL 122 -9.026 -0.872 2.681 859 HA VAL 122 HA VAL 122 -9.503 -3.745 2.269 860 HB VAL 122 HB VAL 122 -9.581 -3.999 4.763 861 HG11 VAL 122 HG11 VAL 122 -7.645 -4.726 3.509 862 HG12 VAL 122 HG12 VAL 122 -7.143 -4.035 5.053 863 HG13 VAL 122 HG13 VAL 122 -6.966 -3.098 3.568 864 HG21 VAL 122 HG21 VAL 122 -8.457 -2.339 6.157 865 HG22 VAL 122 HG22 VAL 122 -9.894 -1.659 5.390 866 HG23 VAL 122 HG23 VAL 122 -8.290 -1.272 4.764 867 H SER 123 H SER 123 -11.539 -4.528 3.276 868 HA SER 123 HA SER 123 -13.548 -2.390 3.322 869 HB2 SER 123 HB2 SER 123 -13.833 -4.966 1.752 870 HB3 SER 123 HB3 SER 123 -15.005 -3.652 1.845 871 HG SER 123 HG SER 123 -13.640 -2.346 0.702 872 H ASN 124 H ASN 124 -15.475 -2.877 4.396 873 HA ASN 124 HA ASN 124 -15.710 -5.445 5.786 874 HB2 ASN 124 HB2 ASN 124 -14.689 -3.426 7.219 875 HB3 ASN 124 HB3 ASN 124 -16.374 -2.949 7.314 876 HD21 ASN 124 HD21 ASN 124 -14.686 -3.664 9.487 877 HD22 ASN 124 HD22 ASN 124 -15.372 -5.059 10.242 878 H GLU 125 H GLU 125 -18.078 -4.859 7.144 879 HA GLU 125 HA GLU 125 -20.033 -4.736 5.035 880 HB2 GLU 125 HB2 GLU 125 -21.644 -5.038 6.917 881 HB3 GLU 125 HB3 GLU 125 -20.376 -6.254 6.898 882 HG2 GLU 125 HG2 GLU 125 -19.214 -5.109 8.695 883 HG3 GLU 125 HG3 GLU 125 -20.407 -3.813 8.669 884 H ASN 126 H ASN 126 -18.526 -2.471 7.080 885 HA ASN 126 HA ASN 126 -20.796 -0.649 7.204 886 HB2 ASN 126 HB2 ASN 126 -18.073 -0.577 8.521 887 HB3 ASN 126 HB3 ASN 126 -19.323 0.639 8.751 888 HD21 ASN 126 HD21 ASN 126 -17.981 -1.498 10.484 889 HD22 ASN 126 HD22 ASN 126 -19.316 -2.268 11.272 890 H ASP 127 H ASP 127 -17.371 -0.573 6.273 891 HA ASP 127 HA ASP 127 -17.843 1.271 4.131 892 HB2 ASP 127 HB2 ASP 127 -17.777 2.657 6.319 893 HB3 ASP 127 HB3 ASP 127 -16.065 2.263 6.381 894 H SER 128 H SER 128 -15.702 1.822 3.066 895 HA SER 128 HA SER 128 -13.684 -0.273 3.539 896 HB2 SER 128 HB2 SER 128 -14.213 1.276 0.981 897 HB3 SER 128 HB3 SER 128 -13.037 -0.023 1.191 898 HG SER 128 HG SER 128 -15.514 -0.282 0.435 899 H ASP 129 H ASP 129 -11.618 0.382 3.976 900 HA ASP 129 HA ASP 129 -11.193 3.290 4.198 901 HB2 ASP 129 HB2 ASP 129 -11.460 2.119 6.405 902 HB3 ASP 129 HB3 ASP 129 -10.061 1.129 6.007 903 H SER 130 H SER 130 -9.367 4.055 3.250 904 HA SER 130 HA SER 130 -7.515 2.046 2.165 905 HB2 SER 130 HB2 SER 130 -8.054 4.627 0.743 906 HB3 SER 130 HB3 SER 130 -7.527 3.079 0.092 907 HG SER 130 HG SER 130 -9.955 2.844 1.223 908 H ALA 131 H ALA 131 -5.409 2.440 2.402 909 HA ALA 131 HA ALA 131 -4.494 5.125 3.217 910 HB1 ALA 131 HB1 ALA 131 -2.733 4.066 4.549 911 HB2 ALA 131 HB2 ALA 131 -3.380 2.473 4.150 912 HB3 ALA 131 HB3 ALA 131 -4.329 3.594 5.128 913 H SER 132 H SER 132 -2.486 5.751 2.300 914 HA SER 132 HA SER 132 -1.288 3.996 0.321 915 HB2 SER 132 HB2 SER 132 -3.239 5.227 -0.757 916 HB3 SER 132 HB3 SER 132 -2.349 6.722 -0.473 917 HG SER 132 HG SER 132 -1.375 6.299 -2.260 918 H VAL 133 H VAL 133 0.880 4.512 -0.061 919 HA VAL 133 HA VAL 133 1.883 6.885 1.360 920 HB VAL 133 HB VAL 133 3.955 5.722 1.954 921 HG11 VAL 133 HG11 VAL 133 2.193 5.798 3.603 922 HG12 VAL 133 HG12 VAL 133 3.084 4.281 3.732 923 HG13 VAL 133 HG13 VAL 133 1.496 4.309 2.964 924 HG21 VAL 133 HG21 VAL 133 4.148 3.283 1.787 925 HG22 VAL 133 HG22 VAL 133 4.044 4.051 0.201 926 HG23 VAL 133 HG23 VAL 133 2.636 3.231 0.879 927 H THR 134 H THR 134 3.870 7.752 0.552 928 HA THR 134 HA THR 134 4.088 7.474 -2.343 929 HB THR 134 HB THR 134 5.406 9.541 -0.586 930 HG1 THR 134 HG1 THR 134 2.980 9.955 -1.997 931 HG21 THR 134 HG21 THR 134 4.670 9.553 -3.517 932 HG22 THR 134 HG22 THR 134 6.295 9.352 -2.862 933 HG23 THR 134 HG23 THR 134 5.438 10.878 -2.643 934 H ILE 135 H ILE 135 5.594 6.209 -3.111 935 HA ILE 135 HA ILE 135 8.018 5.612 -1.572 936 HB ILE 135 HB ILE 135 7.148 4.379 -4.205 937 HG12 ILE 135 HG12 ILE 135 5.424 3.868 -2.569 938 HG13 ILE 135 HG13 ILE 135 6.365 2.422 -2.898 939 HG21 ILE 135 HG21 ILE 135 9.162 3.455 -2.159 940 HG22 ILE 135 HG22 ILE 135 9.515 4.125 -3.752 941 HG23 ILE 135 HG23 ILE 135 8.700 2.566 -3.611 942 HD11 ILE 135 HD11 ILE 135 6.636 4.193 -0.478 943 HD12 ILE 135 HD12 ILE 135 7.571 2.732 -0.796 944 HD13 ILE 135 HD13 ILE 135 5.829 2.626 -0.538 945 H ARG 136 H ARG 136 9.603 7.009 -1.912 946 HA ARG 136 HA ARG 136 9.640 8.524 -4.418 947 HB2 ARG 136 HB2 ARG 136 10.932 9.071 -1.738 948 HB3 ARG 136 HB3 ARG 136 11.055 10.116 -3.147 949 HG2 ARG 136 HG2 ARG 136 8.758 10.657 -3.067 950 HG3 ARG 136 HG3 ARG 136 8.426 9.372 -1.906 951 HD2 ARG 136 HD2 ARG 136 8.446 11.607 -0.882 952 HD3 ARG 136 HD3 ARG 136 9.661 10.530 -0.199 953 HE ARG 136 HE ARG 136 11.323 11.739 -1.511 954 HH11 ARG 136 HH11 ARG 136 8.209 13.323 -1.087 955 HH12 ARG 136 HH12 ARG 136 8.858 14.919 -1.293 956 HH21 ARG 136 HH21 ARG 136 12.169 13.811 -1.734 957 HH22 ARG 136 HH22 ARG 136 11.122 15.199 -1.664 958 H ALA 137 H ALA 137 10.972 7.688 -5.894 959 HA ALA 137 HA ALA 137 13.468 6.448 -4.942 960 HB1 ALA 137 HB1 ALA 137 12.007 5.991 -7.551 961 HB2 ALA 137 HB2 ALA 137 12.004 4.903 -6.163 962 HB3 ALA 137 HB3 ALA 137 13.501 5.199 -7.046 963 H LEU 138 H LEU 138 15.053 7.852 -5.048 964 HA LEU 138 HA LEU 138 15.088 9.813 -7.204 965 HB2 LEU 138 HB2 LEU 138 16.952 10.860 -5.847 966 HB3 LEU 138 HB3 LEU 138 15.308 11.013 -5.276 967 HG LEU 138 HG LEU 138 15.868 9.028 -3.732 968 HD11 LEU 138 HD11 LEU 138 18.199 8.874 -3.049 969 HD12 LEU 138 HD12 LEU 138 18.669 9.990 -4.335 970 HD13 LEU 138 HD13 LEU 138 18.019 8.399 -4.738 971 HD21 LEU 138 HD21 LEU 138 15.421 11.305 -3.144 972 HD22 LEU 138 HD22 LEU 138 17.107 11.721 -3.437 973 HD23 LEU 138 HD23 LEU 138 16.685 10.625 -2.116 974 H GLU 139 H GLU 139 17.404 10.417 -7.865 975 HA GLU 139 HA GLU 139 18.545 7.912 -8.751 976 HB2 GLU 139 HB2 GLU 139 19.598 9.090 -10.547 977 HB3 GLU 139 HB3 GLU 139 17.929 9.616 -10.472 978 HG2 GLU 139 HG2 GLU 139 20.204 11.189 -9.279 979 HG3 GLU 139 HG3 GLU 139 19.664 11.399 -10.940 980 H HIS 140 H HIS 140 20.875 7.723 -8.950 981 HA HIS 140 HA HIS 140 22.224 8.500 -6.555 982 HB2 HIS 140 HB2 HIS 140 22.692 6.345 -7.720 983 HB3 HIS 140 HB3 HIS 140 23.354 7.241 -9.082 984 HD1 HIS 140 HD1 HIS 140 25.811 7.349 -9.045 985 HD2 HIS 140 HD2 HIS 140 24.221 7.088 -5.217 986 HE1 HIS 140 HE1 HIS 140 27.786 7.256 -7.500 987 HE2 HIS 140 HE2 HIS 140 26.799 6.916 -5.207 988 H HIS 141 H HIS 141 22.840 10.502 -6.256 989 HA HIS 141 HA HIS 141 23.990 11.986 -8.511 990 HB2 HIS 141 HB2 HIS 141 23.051 14.076 -7.596 991 HB3 HIS 141 HB3 HIS 141 21.792 12.930 -8.024 992 HD1 HIS 141 HD1 HIS 141 23.091 14.966 -5.261 993 HD2 HIS 141 HD2 HIS 141 20.458 11.784 -5.713 994 HE1 HIS 141 HE1 HIS 141 21.764 14.882 -3.131 995 HE2 HIS 141 HE2 HIS 141 20.167 12.958 -3.423 996 H HIS 142 H HIS 142 25.654 13.447 -8.030 997 HA HIS 142 HA HIS 142 27.213 12.619 -5.688 998 HB2 HIS 142 HB2 HIS 142 28.016 14.009 -8.247 999 HB3 HIS 142 HB3 HIS 142 29.111 13.792 -6.890 1000 HD1 HIS 142 HD1 HIS 142 30.316 11.596 -6.728 1001 HD2 HIS 142 HD2 HIS 142 27.265 11.553 -9.549 1002 HE1 HIS 142 HE1 HIS 142 30.587 9.432 -7.980 1003 HE2 HIS 142 HE2 HIS 142 28.678 9.383 -9.623 1004 H HIS 143 H HIS 143 28.200 14.137 -4.321 1005 HA HIS 143 HA HIS 143 27.555 16.953 -4.735 1006 HB2 HIS 143 HB2 HIS 143 26.930 17.299 -2.389 1007 HB3 HIS 143 HB3 HIS 143 25.834 16.184 -3.179 1008 HD1 HIS 143 HD1 HIS 143 28.028 16.561 -0.275 1009 HD2 HIS 143 HD2 HIS 143 26.188 13.435 -2.310 1010 HE1 HIS 143 HE1 HIS 143 28.091 14.597 1.291 1011 HE2 HIS 143 HE2 HIS 143 27.139 12.683 -0.023 1012 H HIS 144 H HIS 144 29.102 18.379 -3.990 1013 HA HIS 144 HA HIS 144 31.608 17.080 -3.155 1014 HB2 HIS 144 HB2 HIS 144 31.046 19.082 -5.263 1015 HB3 HIS 144 HB3 HIS 144 32.510 19.341 -4.319 1016 HD1 HIS 144 HD1 HIS 144 34.342 18.596 -5.788 1017 HD2 HIS 144 HD2 HIS 144 31.185 15.894 -5.786 1018 HE1 HIS 144 HE1 HIS 144 35.130 16.643 -7.158 1019 HE2 HIS 144 HE2 HIS 144 33.189 15.045 -7.188 1020 H HIS 145 H HIS 145 32.374 17.633 -1.290 1021 HA HIS 145 HA HIS 145 32.142 20.419 -0.424 1022 HB2 HIS 145 HB2 HIS 145 30.453 18.993 0.808 1023 HB3 HIS 145 HB3 HIS 145 31.799 18.084 1.485 1024 HD1 HIS 145 HD1 HIS 145 30.473 21.644 1.422 1025 HD2 HIS 145 HD2 HIS 145 32.810 19.143 3.786 1026 HE1 HIS 145 HE1 HIS 145 31.007 22.974 3.492 1027 HE2 HIS 145 HE2 HIS 145 32.561 21.509 4.816 Start of MODEL 6 1 H1 MET 1 H1 MET 1 -34.584 100.563 61.630 2 H2 MET 1 H2 MET 1 -33.886 99.194 62.344 3 H3 MET 1 H3 MET 1 -35.569 99.306 62.198 4 HA MET 1 HA MET 1 -35.415 99.225 59.810 5 HB2 MET 1 HB2 MET 1 -32.456 98.972 60.384 6 HB3 MET 1 HB3 MET 1 -33.179 98.545 58.841 7 HG2 MET 1 HG2 MET 1 -33.211 101.272 60.110 8 HG3 MET 1 HG3 MET 1 -32.181 100.757 58.777 9 HE1 MET 1 HE1 MET 1 -32.909 102.714 57.207 10 HE2 MET 1 HE2 MET 1 -33.898 103.376 58.510 11 HE3 MET 1 HE3 MET 1 -34.587 103.163 56.900 12 H ASN 2 H ASN 2 -36.193 97.310 59.212 13 HA ASN 2 HA ASN 2 -35.001 94.886 60.302 14 HB2 ASN 2 HB2 ASN 2 -37.172 93.912 60.905 15 HB3 ASN 2 HB3 ASN 2 -36.845 95.361 61.839 16 HD21 ASN 2 HD21 ASN 2 -38.114 97.196 61.502 17 HD22 ASN 2 HD22 ASN 2 -39.615 97.130 60.642 18 H ALA 3 H ALA 3 -35.105 93.126 59.011 19 HA ALA 3 HA ALA 3 -36.134 93.635 56.298 20 HB1 ALA 3 HB1 ALA 3 -33.952 91.745 57.193 21 HB2 ALA 3 HB2 ALA 3 -33.706 93.314 56.425 22 HB3 ALA 3 HB3 ALA 3 -34.479 92.006 55.529 23 H ARG 4 H ARG 4 -37.856 92.513 55.704 24 HA ARG 4 HA ARG 4 -38.764 90.266 57.287 25 HB2 ARG 4 HB2 ARG 4 -39.961 91.520 54.810 26 HB3 ARG 4 HB3 ARG 4 -40.727 90.280 55.792 27 HG2 ARG 4 HG2 ARG 4 -40.692 91.851 57.706 28 HG3 ARG 4 HG3 ARG 4 -40.067 93.097 56.624 29 HD2 ARG 4 HD2 ARG 4 -42.080 92.767 55.198 30 HD3 ARG 4 HD3 ARG 4 -42.709 91.666 56.425 31 HE ARG 4 HE ARG 4 -42.005 94.419 57.158 32 HH11 ARG 4 HH11 ARG 4 -44.463 91.930 56.779 33 HH12 ARG 4 HH12 ARG 4 -45.680 92.833 57.631 34 HH21 ARG 4 HH21 ARG 4 -43.576 95.580 58.282 35 HH22 ARG 4 HH22 ARG 4 -45.170 94.920 58.488 36 H ASP 5 H ASP 5 -37.439 88.580 56.982 37 HA ASP 5 HA ASP 5 -36.658 87.765 54.329 38 HB2 ASP 5 HB2 ASP 5 -35.150 87.497 56.321 39 HB3 ASP 5 HB3 ASP 5 -36.257 86.263 56.921 40 H ASN 6 H ASN 6 -38.353 87.159 53.173 41 HA ASN 6 HA ASN 6 -40.232 85.215 54.306 42 HB2 ASN 6 HB2 ASN 6 -41.115 87.354 53.306 43 HB3 ASN 6 HB3 ASN 6 -40.486 86.828 51.751 44 HD21 ASN 6 HD21 ASN 6 -42.036 84.810 54.203 45 HD22 ASN 6 HD22 ASN 6 -43.412 84.406 53.234 46 H LYS 7 H LYS 7 -39.251 83.275 54.039 47 HA LYS 7 HA LYS 7 -38.020 82.681 51.459 48 HB2 LYS 7 HB2 LYS 7 -36.989 80.778 52.526 49 HB3 LYS 7 HB3 LYS 7 -36.696 82.218 53.486 50 HG2 LYS 7 HG2 LYS 7 -38.420 81.524 55.072 51 HG3 LYS 7 HG3 LYS 7 -38.756 80.098 54.088 52 HD2 LYS 7 HD2 LYS 7 -36.124 80.727 55.433 53 HD3 LYS 7 HD3 LYS 7 -37.316 79.559 56.000 54 HE2 LYS 7 HE2 LYS 7 -35.851 79.419 53.357 55 HE3 LYS 7 HE3 LYS 7 -35.452 78.484 54.796 56 HZ1 LYS 7 HZ1 LYS 7 -37.651 77.454 54.671 57 HZ2 LYS 7 HZ2 LYS 7 -36.753 77.173 53.260 58 HZ3 LYS 7 HZ3 LYS 7 -37.990 78.325 53.259 59 H PHE 8 H PHE 8 -38.395 80.524 50.529 60 HA PHE 8 HA PHE 8 -41.203 79.707 50.880 61 HB2 PHE 8 HB2 PHE 8 -39.533 79.705 48.346 62 HB3 PHE 8 HB3 PHE 8 -41.177 79.084 48.477 63 HD1 PHE 8 HD2 PHE 8 -42.938 80.794 49.404 64 HD2 PHE 8 HD1 PHE 8 -39.218 81.890 47.652 65 HE1 PHE 8 HE2 PHE 8 -43.818 83.043 48.953 66 HE2 PHE 8 HE1 PHE 8 -40.094 84.143 47.203 67 HZ PHE 8 HZ PHE 8 -42.396 84.721 47.852 68 H ASN 9 H ASN 9 -41.646 77.447 50.387 69 HA ASN 9 HA ASN 9 -39.368 75.714 51.118 70 HB2 ASN 9 HB2 ASN 9 -42.309 75.338 51.764 71 HB3 ASN 9 HB3 ASN 9 -41.025 74.214 52.184 72 HD21 ASN 9 HD21 ASN 9 -42.916 75.648 53.883 73 HD22 ASN 9 HD22 ASN 9 -41.953 76.538 55.011 74 H THR 10 H THR 10 -39.203 73.690 50.093 75 HA THR 10 HA THR 10 -40.478 73.615 47.464 76 HB THR 10 HB THR 10 -38.298 71.771 48.486 77 HG1 THR 10 HG1 THR 10 -38.052 74.311 48.182 78 HG21 THR 10 HG21 THR 10 -37.851 71.409 46.110 79 HG22 THR 10 HG22 THR 10 -39.143 72.526 45.674 80 HG23 THR 10 HG23 THR 10 -39.526 71.002 46.477 81 H TRP 11 H TRP 11 -42.353 72.615 47.368 82 HA TRP 11 HA TRP 11 -42.760 70.178 48.961 83 HB2 TRP 11 HB2 TRP 11 -44.835 71.870 47.527 84 HB3 TRP 11 HB3 TRP 11 -45.152 70.516 48.607 85 HD1 TRP 11 HD1 TRP 11 -44.990 74.170 48.602 86 HE1 TRP 11 HE1 TRP 11 -44.892 75.104 50.996 87 HE3 TRP 11 HE3 TRP 11 -43.878 69.860 51.105 88 HZ2 TRP 11 HZ2 TRP 11 -44.394 74.139 53.604 89 HZ3 TRP 11 HZ3 TRP 11 -43.599 69.952 53.535 90 HH2 TRP 11 HH2 TRP 11 -43.853 72.044 54.763 91 H ASN 12 H ASN 12 -41.660 68.735 47.627 92 HA ASN 12 HA ASN 12 -42.526 68.547 44.830 93 HB2 ASN 12 HB2 ASN 12 -40.086 68.627 45.310 94 HB3 ASN 12 HB3 ASN 12 -40.233 67.133 46.224 95 HD21 ASN 12 HD21 ASN 12 -38.847 65.979 44.905 96 HD22 ASN 12 HD22 ASN 12 -39.251 65.530 43.285 97 H ASP 13 H ASP 13 -43.851 67.002 44.170 98 HA ASP 13 HA ASP 13 -44.338 64.719 45.962 99 HB2 ASP 13 HB2 ASP 13 -46.290 66.200 44.190 100 HB3 ASP 13 HB3 ASP 13 -46.650 64.651 44.951 101 H SER 14 H SER 14 -45.128 62.768 44.834 102 HA SER 14 HA SER 14 -43.619 62.410 42.342 103 HB2 SER 14 HB2 SER 14 -44.673 60.332 44.283 104 HB3 SER 14 HB3 SER 14 -43.657 60.013 42.876 105 HG SER 14 HG SER 14 -42.564 61.912 44.466 106 H ARG 15 H ARG 15 -44.523 61.240 40.605 107 HA ARG 15 HA ARG 15 -47.472 61.187 40.517 108 HB2 ARG 15 HB2 ARG 15 -45.471 61.272 38.240 109 HB3 ARG 15 HB3 ARG 15 -47.208 61.152 38.041 110 HG2 ARG 15 HG2 ARG 15 -45.822 63.471 39.363 111 HG3 ARG 15 HG3 ARG 15 -46.254 63.422 37.657 112 HD2 ARG 15 HD2 ARG 15 -48.002 64.613 38.644 113 HD3 ARG 15 HD3 ARG 15 -48.647 62.982 38.478 114 HE ARG 15 HE ARG 15 -47.417 63.501 41.028 115 HH11 ARG 15 HH11 ARG 15 -50.414 63.662 39.217 116 HH12 ARG 15 HH12 ARG 15 -51.418 63.666 40.633 117 HH21 ARG 15 HH21 ARG 15 -48.717 63.462 42.867 118 HH22 ARG 15 HH22 ARG 15 -50.446 63.537 42.718 119 H GLY 16 H GLY 16 -48.133 59.412 38.726 120 HA2 GLY 16 HA2 GLY 16 -47.102 57.202 37.924 121 HA3 GLY 16 HA3 GLY 16 -46.868 56.917 39.641 122 H ASN 17 H ASN 17 -49.293 57.424 37.139 123 HA ASN 17 HA ASN 17 -51.434 56.408 38.796 124 HB2 ASN 17 HB2 ASN 17 -51.239 57.233 35.909 125 HB3 ASN 17 HB3 ASN 17 -52.658 56.390 36.512 126 HD21 ASN 17 HD21 ASN 17 -54.004 58.100 36.113 127 HD22 ASN 17 HD22 ASN 17 -53.979 59.557 37.049 128 H TYR 18 H TYR 18 -51.979 54.347 39.032 129 HA TYR 18 HA TYR 18 -50.350 52.335 37.747 130 HB2 TYR 18 HB2 TYR 18 -51.221 50.786 39.354 131 HB3 TYR 18 HB3 TYR 18 -50.880 52.283 40.203 132 HD1 TYR 18 HD2 TYR 18 -52.792 53.751 40.904 133 HD2 TYR 18 HD1 TYR 18 -53.401 49.871 39.276 134 HE1 TYR 18 HE2 TYR 18 -55.083 53.738 41.798 135 HE2 TYR 18 HE1 TYR 18 -55.691 49.845 40.167 136 HH TYR 18 HH TYR 18 -56.955 50.954 42.004 137 H TRP 19 H TRP 19 -51.103 50.559 36.590 138 HA TRP 19 HA TRP 19 -53.854 50.744 35.556 139 HB2 TRP 19 HB2 TRP 19 -51.325 50.091 34.014 140 HB3 TRP 19 HB3 TRP 19 -52.938 49.776 33.394 141 HD1 TRP 19 HD1 TRP 19 -51.104 52.913 34.810 142 HE1 TRP 19 HE1 TRP 19 -51.657 54.911 33.282 143 HE3 TRP 19 HE3 TRP 19 -54.182 50.559 31.479 144 HZ2 TRP 19 HZ2 TRP 19 -53.177 55.413 30.964 145 HZ3 TRP 19 HZ3 TRP 19 -55.139 51.868 29.635 146 HH2 TRP 19 HH2 TRP 19 -54.647 54.245 29.383 147 H SER 20 H SER 20 -54.901 49.068 36.431 148 HA SER 20 HA SER 20 -53.727 46.400 36.265 149 HB2 SER 20 HB2 SER 20 -54.792 47.542 38.873 150 HB3 SER 20 HB3 SER 20 -54.283 45.873 38.617 151 HG SER 20 HG SER 20 -52.312 47.457 37.808 152 H ASP 21 H ASP 21 -55.233 45.571 34.912 153 HA ASP 21 HA ASP 21 -57.888 45.160 35.994 154 HB2 ASP 21 HB2 ASP 21 -58.101 47.267 34.697 155 HB3 ASP 21 HB3 ASP 21 -57.570 46.410 33.257 156 H TYR 22 H TYR 22 -58.556 43.181 35.572 157 HA TYR 22 HA TYR 22 -56.926 41.597 33.696 158 HB2 TYR 22 HB2 TYR 22 -58.175 40.837 36.336 159 HB3 TYR 22 HB3 TYR 22 -57.612 39.633 35.183 160 HD1 TYR 22 HD2 TYR 22 -56.513 42.466 37.308 161 HD2 TYR 22 HD1 TYR 22 -55.312 39.103 35.002 162 HE1 TYR 22 HE2 TYR 22 -54.238 42.677 38.198 163 HE2 TYR 22 HE1 TYR 22 -53.028 39.306 35.887 164 HH TYR 22 HH TYR 22 -52.267 41.364 38.530 165 H GLU 23 H GLU 23 -57.834 40.586 32.109 166 HA GLU 23 HA GLU 23 -60.769 40.514 31.940 167 HB2 GLU 23 HB2 GLU 23 -60.116 40.639 29.351 168 HB3 GLU 23 HB3 GLU 23 -60.396 42.069 30.326 169 HG2 GLU 23 HG2 GLU 23 -58.445 42.376 28.944 170 HG3 GLU 23 HG3 GLU 23 -57.977 42.326 30.634 171 H GLY 24 H GLY 24 -58.497 38.442 32.565 172 HA2 GLY 24 HA2 GLY 24 -58.859 36.565 30.360 173 HA3 GLY 24 HA3 GLY 24 -57.703 36.421 31.674 174 H SER 25 H SER 25 -61.231 36.814 31.645 175 HA SER 25 HA SER 25 -61.638 34.111 32.607 176 HB2 SER 25 HB2 SER 25 -62.488 36.542 34.205 177 HB3 SER 25 HB3 SER 25 -63.053 34.901 34.515 178 HG SER 25 HG SER 25 -60.322 35.108 34.371 179 H ASP 26 H ASP 26 -62.815 33.656 30.791 180 HA ASP 26 HA ASP 26 -65.445 34.902 30.597 181 HB2 ASP 26 HB2 ASP 26 -65.234 35.224 28.129 182 HB3 ASP 26 HB3 ASP 26 -64.227 36.305 29.082 183 H GLU 27 H GLU 27 -63.307 32.269 29.940 184 HA GLU 27 HA GLU 27 -65.391 30.740 28.606 185 HB2 GLU 27 HB2 GLU 27 -63.746 29.162 28.004 186 HB3 GLU 27 HB3 GLU 27 -62.982 30.726 27.820 187 HG2 GLU 27 HG2 GLU 27 -62.551 28.827 30.127 188 HG3 GLU 27 HG3 GLU 27 -61.469 29.035 28.758 189 H ASN 28 H ASN 28 -65.026 31.523 31.629 190 HA ASN 28 HA ASN 28 -65.122 28.986 32.971 191 HB2 ASN 28 HB2 ASN 28 -65.645 31.796 33.945 192 HB3 ASN 28 HB3 ASN 28 -65.714 30.372 34.977 193 HD21 ASN 28 HD21 ASN 28 -63.823 29.220 35.385 194 HD22 ASN 28 HD22 ASN 28 -62.269 29.927 35.163 195 H GLY 29 H GLY 29 -66.816 27.843 32.153 196 HA2 GLY 29 HA2 GLY 29 -69.000 27.045 32.344 197 HA3 GLY 29 HA3 GLY 29 -69.477 28.577 33.064 198 H ASP 30 H ASP 30 -71.337 28.181 31.579 199 HA ASP 30 HA ASP 30 -70.817 29.069 28.846 200 HB2 ASP 30 HB2 ASP 30 -73.118 28.586 28.355 201 HB3 ASP 30 HB3 ASP 30 -72.449 27.216 29.227 202 H GLY 31 H GLY 31 -71.383 30.379 31.847 203 HA2 GLY 31 HA2 GLY 31 -72.568 32.853 30.992 204 HA3 GLY 31 HA3 GLY 31 -71.791 32.546 32.543 205 H ILE 32 H ILE 32 -71.371 33.611 29.298 206 HA ILE 32 HA ILE 32 -68.526 33.538 29.186 207 HB ILE 32 HB ILE 32 -70.526 34.997 27.440 208 HG12 ILE 32 HG12 ILE 32 -70.911 32.592 27.384 209 HG13 ILE 32 HG13 ILE 32 -70.209 33.109 25.858 210 HG21 ILE 32 HG21 ILE 32 -67.625 34.397 26.900 211 HG22 ILE 32 HG22 ILE 32 -68.336 35.985 27.191 212 HG23 ILE 32 HG23 ILE 32 -68.765 35.079 25.739 213 HD11 ILE 32 HD11 ILE 32 -68.031 32.254 26.576 214 HD12 ILE 32 HD12 ILE 32 -69.264 30.992 26.588 215 HD13 ILE 32 HD13 ILE 32 -68.743 31.731 28.104 216 H GLY 33 H GLY 33 -67.394 34.737 30.522 217 HA2 GLY 33 HA2 GLY 33 -66.329 36.759 31.076 218 HA3 GLY 33 HA3 GLY 33 -67.719 37.636 30.467 219 H ASP 34 H ASP 34 -69.138 35.377 32.288 220 HA ASP 34 HA ASP 34 -69.732 37.257 34.367 221 HB2 ASP 34 HB2 ASP 34 -71.499 35.821 33.492 222 HB3 ASP 34 HB3 ASP 34 -70.611 34.383 33.977 223 H SER 35 H SER 35 -68.245 34.024 34.323 224 HA SER 35 HA SER 35 -67.592 34.354 37.145 225 HB2 SER 35 HB2 SER 35 -67.391 31.895 35.393 226 HB3 SER 35 HB3 SER 35 -67.210 31.952 37.148 227 HG SER 35 HG SER 35 -69.528 33.112 36.329 228 H ALA 36 H ALA 36 -65.513 33.782 37.954 229 HA ALA 36 HA ALA 36 -63.320 34.192 36.029 230 HB1 ALA 36 HB1 ALA 36 -63.588 36.127 37.502 231 HB2 ALA 36 HB2 ALA 36 -62.068 35.289 37.818 232 HB3 ALA 36 HB3 ALA 36 -63.436 35.077 38.910 233 H TYR 37 H TYR 37 -61.358 33.054 36.490 234 HA TYR 37 HA TYR 37 -61.873 30.460 37.637 235 HB2 TYR 37 HB2 TYR 37 -59.762 29.763 36.738 236 HB3 TYR 37 HB3 TYR 37 -60.557 30.735 35.516 237 HD1 TYR 37 HD2 TYR 37 -59.781 33.184 35.278 238 HD2 TYR 37 HD1 TYR 37 -57.585 30.233 37.417 239 HE1 TYR 37 HE2 TYR 37 -57.754 34.552 35.075 240 HE2 TYR 37 HE1 TYR 37 -55.552 31.594 37.219 241 HH TYR 37 HH TYR 37 -54.633 33.320 35.849 242 H ALA 38 H ALA 38 -60.872 29.534 39.399 243 HA ALA 38 HA ALA 38 -59.854 31.391 41.373 244 HB1 ALA 38 HB1 ALA 38 -60.241 28.412 41.589 245 HB2 ALA 38 HB2 ALA 38 -61.430 29.634 42.045 246 HB3 ALA 38 HB3 ALA 38 -59.894 29.529 42.909 247 H VAL 39 H VAL 39 -57.887 32.034 41.024 248 HA VAL 39 HA VAL 39 -55.873 30.500 39.737 249 HB VAL 39 HB VAL 39 -55.899 32.883 39.431 250 HG11 VAL 39 HG11 VAL 39 -55.411 33.210 42.384 251 HG12 VAL 39 HG12 VAL 39 -56.932 33.529 41.552 252 HG13 VAL 39 HG13 VAL 39 -55.505 34.504 41.187 253 HG21 VAL 39 HG21 VAL 39 -53.480 32.127 41.067 254 HG22 VAL 39 HG22 VAL 39 -53.597 33.509 39.978 255 HG23 VAL 39 HG23 VAL 39 -53.694 31.870 39.334 256 H ASN 40 H ASN 40 -54.575 29.026 40.565 257 HA ASN 40 HA ASN 40 -53.750 29.303 43.350 258 HB2 ASN 40 HB2 ASN 40 -53.862 26.830 43.669 259 HB3 ASN 40 HB3 ASN 40 -55.427 27.599 43.470 260 HD21 ASN 40 HD21 ASN 40 -53.264 25.227 42.327 261 HD22 ASN 40 HD22 ASN 40 -54.226 24.650 41.009 262 HA PRO 41 HA PRO 41 -49.831 28.746 41.144 263 HB2 PRO 41 HB2 PRO 41 -48.439 30.565 42.526 264 HB3 PRO 41 HB3 PRO 41 -49.545 31.029 41.227 265 HG2 PRO 41 HG2 PRO 41 -49.954 31.128 44.186 266 HG3 PRO 41 HG3 PRO 41 -50.420 32.308 42.949 267 HD2 PRO 41 HD2 PRO 41 -52.123 30.453 44.060 268 HD3 PRO 41 HD3 PRO 41 -52.361 31.219 42.480 269 H GLU 42 H GLU 42 -50.970 27.993 44.204 270 HA GLU 42 HA GLU 42 -48.445 27.144 45.349 271 HB2 GLU 42 HB2 GLU 42 -50.665 27.997 46.544 272 HB3 GLU 42 HB3 GLU 42 -51.106 26.300 46.415 273 HG2 GLU 42 HG2 GLU 42 -48.535 27.173 47.688 274 HG3 GLU 42 HG3 GLU 42 -50.042 27.107 48.593 275 H ALA 43 H ALA 43 -47.648 25.616 43.996 276 HA ALA 43 HA ALA 43 -48.514 22.949 44.367 277 HB1 ALA 43 HB1 ALA 43 -48.808 24.002 41.550 278 HB2 ALA 43 HB2 ALA 43 -50.150 23.639 42.637 279 HB3 ALA 43 HB3 ALA 43 -49.077 22.342 42.093 280 H GLY 44 H GLY 44 -46.605 21.987 44.624 281 HA2 GLY 44 HA2 GLY 44 -44.289 23.028 43.136 282 HA3 GLY 44 HA3 GLY 44 -44.208 22.152 44.658 283 H SER 45 H SER 45 -42.969 21.748 41.946 284 HA SER 45 HA SER 45 -44.047 19.169 41.140 285 HB2 SER 45 HB2 SER 45 -41.707 20.759 40.053 286 HB3 SER 45 HB3 SER 45 -42.347 19.273 39.352 287 HG SER 45 HG SER 45 -44.257 20.327 38.897 288 H MET 46 H MET 46 -43.266 17.266 41.750 289 HA MET 46 HA MET 46 -41.172 17.157 43.713 290 HB2 MET 46 HB2 MET 46 -41.690 14.772 43.868 291 HB3 MET 46 HB3 MET 46 -43.156 15.738 43.950 292 HG2 MET 46 HG2 MET 46 -43.680 15.196 41.649 293 HG3 MET 46 HG3 MET 46 -42.165 14.304 41.492 294 HE1 MET 46 HE1 MET 46 -44.861 12.963 40.652 295 HE2 MET 46 HE2 MET 46 -44.691 11.373 41.401 296 HE3 MET 46 HE3 MET 46 -43.304 12.146 40.632 297 H ASP 47 H ASP 47 -39.386 15.624 43.583 298 HA ASP 47 HA ASP 47 -37.993 15.914 41.056 299 HB2 ASP 47 HB2 ASP 47 -36.013 15.197 42.274 300 HB3 ASP 47 HB3 ASP 47 -36.845 16.446 43.188 301 H TYR 48 H TYR 48 -36.845 14.152 40.093 302 HA TYR 48 HA TYR 48 -37.946 11.488 40.570 303 HB2 TYR 48 HB2 TYR 48 -38.338 11.138 38.162 304 HB3 TYR 48 HB3 TYR 48 -39.332 12.438 38.787 305 HD1 TYR 48 HD1 TYR 48 -38.725 14.813 38.221 306 HD2 TYR 48 HD2 TYR 48 -36.813 11.489 36.376 307 HE1 TYR 48 HE1 TYR 48 -37.934 16.276 36.414 308 HE2 TYR 48 HE2 TYR 48 -36.015 12.944 34.568 309 HH TYR 48 HH TYR 48 -36.618 15.071 33.516 310 H MET 49 H MET 49 -36.708 9.903 38.964 311 HA MET 49 HA MET 49 -33.851 10.563 39.230 312 HB2 MET 49 HB2 MET 49 -35.373 7.994 39.413 313 HB3 MET 49 HB3 MET 49 -33.717 7.943 38.829 314 HG2 MET 49 HG2 MET 49 -33.686 7.480 41.152 315 HG3 MET 49 HG3 MET 49 -33.012 9.089 40.925 316 HE1 MET 49 HE1 MET 49 -36.069 6.983 42.173 317 HE2 MET 49 HE2 MET 49 -36.821 7.981 40.926 318 HE3 MET 49 HE3 MET 49 -37.225 8.239 42.623 319 HA PRO 50 HA PRO 50 -33.456 10.637 34.745 320 HB2 PRO 50 HB2 PRO 50 -30.802 9.826 34.669 321 HB3 PRO 50 HB3 PRO 50 -31.351 11.494 34.851 322 HG2 PRO 50 HG2 PRO 50 -30.439 9.557 36.926 323 HG3 PRO 50 HG3 PRO 50 -30.143 11.301 36.812 324 HD2 PRO 50 HD2 PRO 50 -31.950 10.289 38.517 325 HD3 PRO 50 HD3 PRO 50 -32.223 11.836 37.687 326 H LEU 51 H LEU 51 -33.818 9.163 33.209 327 HA LEU 51 HA LEU 51 -33.989 6.383 33.943 328 HB2 LEU 51 HB2 LEU 51 -34.709 7.924 31.460 329 HB3 LEU 51 HB3 LEU 51 -34.719 6.176 31.467 330 HG LEU 51 HG LEU 51 -36.390 6.333 33.395 331 HD11 LEU 51 HD11 LEU 51 -36.632 9.175 32.414 332 HD12 LEU 51 HD12 LEU 51 -36.025 8.679 33.994 333 HD13 LEU 51 HD13 LEU 51 -37.706 8.371 33.559 334 HD21 LEU 51 HD21 LEU 51 -37.147 7.362 30.667 335 HD22 LEU 51 HD22 LEU 51 -38.266 6.698 31.857 336 HD23 LEU 51 HD23 LEU 51 -37.016 5.672 31.153 337 H MET 52 H MET 52 -32.669 4.767 33.408 338 HA MET 52 HA MET 52 -30.152 5.394 32.150 339 HB2 MET 52 HB2 MET 52 -29.535 3.065 32.629 340 HB3 MET 52 HB3 MET 52 -30.142 3.880 34.058 341 HG2 MET 52 HG2 MET 52 -32.335 2.763 33.688 342 HG3 MET 52 HG3 MET 52 -31.597 1.861 32.366 343 HE1 MET 52 HE1 MET 52 -30.545 1.393 36.836 344 HE2 MET 52 HE2 MET 52 -31.915 2.318 36.224 345 HE3 MET 52 HE3 MET 52 -30.272 2.899 35.956 346 H GLU 53 H GLU 53 -29.472 4.831 30.145 347 HA GLU 53 HA GLU 53 -31.611 3.929 28.361 348 HB2 GLU 53 HB2 GLU 53 -30.365 5.131 26.568 349 HB3 GLU 53 HB3 GLU 53 -30.972 6.172 27.844 350 HG2 GLU 53 HG2 GLU 53 -28.786 6.397 28.793 351 HG3 GLU 53 HG3 GLU 53 -28.131 5.182 27.695 352 H TYR 54 H TYR 54 -31.266 2.403 26.846 353 HA TYR 54 HA TYR 54 -28.783 0.849 27.133 354 HB2 TYR 54 HB2 TYR 54 -31.564 -0.108 26.392 355 HB3 TYR 54 HB3 TYR 54 -30.131 -1.121 26.441 356 HD1 TYR 54 HD1 TYR 54 -29.131 -1.755 28.581 357 HD2 TYR 54 HD2 TYR 54 -32.681 0.584 28.417 358 HE1 TYR 54 HE1 TYR 54 -29.555 -2.234 30.953 359 HE2 TYR 54 HE2 TYR 54 -33.109 0.112 30.786 360 HH TYR 54 HH TYR 54 -32.546 -1.350 32.495 361 H LEU 55 H LEU 55 -27.766 0.137 25.269 362 HA LEU 55 HA LEU 55 -28.896 1.017 22.721 363 HB2 LEU 55 HB2 LEU 55 -26.926 2.079 21.984 364 HB3 LEU 55 HB3 LEU 55 -27.222 2.709 23.588 365 HG LEU 55 HG LEU 55 -25.236 0.484 23.105 366 HD11 LEU 55 HD11 LEU 55 -23.499 2.202 23.043 367 HD12 LEU 55 HD12 LEU 55 -24.743 3.453 23.055 368 HD13 LEU 55 HD13 LEU 55 -24.615 2.348 21.686 369 HD21 LEU 55 HD21 LEU 55 -25.930 0.847 25.434 370 HD22 LEU 55 HD22 LEU 55 -25.483 2.550 25.300 371 HD23 LEU 55 HD23 LEU 55 -24.243 1.301 25.184 372 H HIS 56 H HIS 56 -27.995 -0.077 20.865 373 HA HIS 56 HA HIS 56 -27.030 -2.753 21.513 374 HB2 HIS 56 HB2 HIS 56 -27.468 -3.364 19.202 375 HB3 HIS 56 HB3 HIS 56 -28.878 -2.545 19.850 376 HD1 HIS 56 HD1 HIS 56 -26.078 -2.097 17.357 377 HD2 HIS 56 HD2 HIS 56 -29.603 -0.209 18.510 378 HE1 HIS 56 HE1 HIS 56 -26.528 -0.368 15.590 379 HE2 HIS 56 HE2 HIS 56 -28.642 0.791 16.320 380 H SER 57 H SER 57 -25.176 -3.637 20.336 381 HA SER 57 HA SER 57 -22.996 -1.755 20.309 382 HB2 SER 57 HB2 SER 57 -22.876 -4.123 21.203 383 HB3 SER 57 HB3 SER 57 -22.927 -4.677 19.531 384 HG SER 57 HG SER 57 -21.016 -2.775 20.385 385 H SER 58 H SER 58 -22.383 -0.629 18.611 386 HA SER 58 HA SER 58 -23.220 -1.434 15.941 387 HB2 SER 58 HB2 SER 58 -22.097 0.806 15.350 388 HB3 SER 58 HB3 SER 58 -23.587 0.865 16.294 389 HG SER 58 HG SER 58 -20.910 1.199 17.199 390 HA PRO 59 HA PRO 59 -19.333 -3.553 15.386 391 HB2 PRO 59 HB2 PRO 59 -19.591 -4.020 12.703 392 HB3 PRO 59 HB3 PRO 59 -20.365 -4.984 13.963 393 HG2 PRO 59 HG2 PRO 59 -21.503 -2.794 12.280 394 HG3 PRO 59 HG3 PRO 59 -22.244 -4.325 12.779 395 HD2 PRO 59 HD2 PRO 59 -22.824 -1.971 13.970 396 HD3 PRO 59 HD3 PRO 59 -22.824 -3.511 14.855 397 H VAL 60 H VAL 60 -17.341 -3.399 14.008 398 HA VAL 60 HA VAL 60 -16.796 -0.523 13.801 399 HB VAL 60 HB VAL 60 -15.720 -1.579 15.692 400 HG11 VAL 60 HG11 VAL 60 -15.568 -3.854 14.921 401 HG12 VAL 60 HG12 VAL 60 -13.994 -3.279 15.473 402 HG13 VAL 60 HG13 VAL 60 -14.334 -3.398 13.745 403 HG21 VAL 60 HG21 VAL 60 -13.719 -0.834 13.567 404 HG22 VAL 60 HG22 VAL 60 -13.378 -0.958 15.292 405 HG23 VAL 60 HG23 VAL 60 -14.515 0.255 14.705 406 H LEU 61 H LEU 61 -15.809 0.352 12.139 407 HA LEU 61 HA LEU 61 -15.638 -1.074 9.667 408 HB2 LEU 61 HB2 LEU 61 -14.871 1.227 8.788 409 HB3 LEU 61 HB3 LEU 61 -16.520 1.016 9.297 410 HG LEU 61 HG LEU 61 -15.440 3.238 9.816 411 HD11 LEU 61 HD11 LEU 61 -16.591 1.718 12.132 412 HD12 LEU 61 HD12 LEU 61 -17.479 2.619 10.904 413 HD13 LEU 61 HD13 LEU 61 -16.430 3.472 12.037 414 HD21 LEU 61 HD21 LEU 61 -13.960 1.668 11.906 415 HD22 LEU 61 HD22 LEU 61 -14.077 3.427 11.839 416 HD23 LEU 61 HD23 LEU 61 -13.259 2.546 10.548 417 HA PRO 62 HA PRO 62 -11.299 -1.921 9.658 418 HB2 PRO 62 HB2 PRO 62 -10.633 -2.051 7.091 419 HB3 PRO 62 HB3 PRO 62 -11.823 -3.165 7.780 420 HG2 PRO 62 HG2 PRO 62 -12.258 -0.713 6.126 421 HG3 PRO 62 HG3 PRO 62 -13.086 -2.280 6.049 422 HD2 PRO 62 HD2 PRO 62 -14.067 -0.038 7.350 423 HD3 PRO 62 HD3 PRO 62 -14.558 -1.704 7.688 424 H THR 63 H THR 63 -9.283 -1.064 9.687 425 HA THR 63 HA THR 63 -8.973 1.637 8.597 426 HB THR 63 HB THR 63 -8.650 1.174 11.126 427 HG1 THR 63 HG1 THR 63 -7.362 2.814 9.396 428 HG21 THR 63 HG21 THR 63 -5.968 0.186 10.184 429 HG22 THR 63 HG22 THR 63 -7.213 -0.788 10.966 430 HG23 THR 63 HG23 THR 63 -6.432 0.526 11.852 431 H ALA 64 H ALA 64 -7.546 2.008 6.994 432 HA ALA 64 HA ALA 64 -5.961 -0.268 6.061 433 HB1 ALA 64 HB1 ALA 64 -5.701 0.959 3.988 434 HB2 ALA 64 HB2 ALA 64 -6.533 2.349 4.688 435 HB3 ALA 64 HB3 ALA 64 -7.406 0.837 4.426 436 H ARG 65 H ARG 65 -3.992 -0.415 6.750 437 HA ARG 65 HA ARG 65 -2.295 1.950 6.831 438 HB2 ARG 65 HB2 ARG 65 -2.848 0.132 9.154 439 HB3 ARG 65 HB3 ARG 65 -1.255 0.850 8.975 440 HG2 ARG 65 HG2 ARG 65 -2.271 3.078 9.010 441 HG3 ARG 65 HG3 ARG 65 -3.857 2.334 9.224 442 HD2 ARG 65 HD2 ARG 65 -3.170 1.379 11.323 443 HD3 ARG 65 HD3 ARG 65 -1.529 1.984 11.100 444 HE ARG 65 HE ARG 65 -2.636 4.267 11.142 445 HH11 ARG 65 HH11 ARG 65 -3.945 1.507 12.884 446 HH12 ARG 65 HH12 ARG 65 -4.684 2.481 14.119 447 HH21 ARG 65 HH21 ARG 65 -3.565 5.539 12.770 448 HH22 ARG 65 HH22 ARG 65 -4.457 4.790 14.056 449 H PHE 66 H PHE 66 -0.133 1.459 6.384 450 HA PHE 66 HA PHE 66 0.731 -1.259 6.228 451 HB2 PHE 66 HB2 PHE 66 1.243 -1.278 3.826 452 HB3 PHE 66 HB3 PHE 66 -0.478 -1.217 4.143 453 HD1 PHE 66 HD2 PHE 66 -1.574 1.154 3.996 454 HD2 PHE 66 HD1 PHE 66 2.173 0.114 2.281 455 HE1 PHE 66 HE2 PHE 66 -1.788 3.012 2.415 456 HE2 PHE 66 HE1 PHE 66 1.953 1.963 0.690 457 HZ PHE 66 HZ PHE 66 -0.029 3.413 0.759 458 H THR 67 H THR 67 2.943 -1.507 5.860 459 HA THR 67 HA THR 67 4.468 0.991 6.188 460 HB THR 67 HB THR 67 5.183 -1.766 7.247 461 HG1 THR 67 HG1 THR 67 3.964 0.487 8.471 462 HG21 THR 67 HG21 THR 67 7.136 -0.319 6.823 463 HG22 THR 67 HG22 THR 67 6.893 -0.601 8.546 464 HG23 THR 67 HG23 THR 67 6.409 0.936 7.832 465 H SER 68 H SER 68 5.972 1.359 4.636 466 HA SER 68 HA SER 68 6.530 -0.802 2.734 467 HB2 SER 68 HB2 SER 68 7.173 2.159 2.540 468 HB3 SER 68 HB3 SER 68 7.360 0.960 1.258 469 HG SER 68 HG SER 68 4.913 0.669 1.917 470 H ASP 69 H ASP 69 8.565 -1.593 2.411 471 HA ASP 69 HA ASP 69 10.372 -1.527 4.571 472 HB2 ASP 69 HB2 ASP 69 10.100 -3.390 2.864 473 HB3 ASP 69 HB3 ASP 69 11.060 -2.403 1.763 474 H ILE 70 H ILE 70 10.553 0.001 1.375 475 HA ILE 70 HA ILE 70 12.242 2.036 2.639 476 HB ILE 70 HB ILE 70 13.028 2.680 0.330 477 HG12 ILE 70 HG12 ILE 70 13.018 0.410 -1.151 478 HG13 ILE 70 HG13 ILE 70 11.434 0.296 -0.399 479 HG21 ILE 70 HG21 ILE 70 13.845 -0.026 1.359 480 HG22 ILE 70 HG22 ILE 70 14.498 1.539 1.852 481 HG23 ILE 70 HG23 ILE 70 14.760 0.948 0.209 482 HD11 ILE 70 HD11 ILE 70 11.304 1.363 -2.577 483 HD12 ILE 70 HD12 ILE 70 12.442 2.606 -2.053 484 HD13 ILE 70 HD13 ILE 70 10.851 2.492 -1.299 485 H THR 71 H THR 71 11.670 4.150 2.367 486 HA THR 71 HA THR 71 9.244 4.695 0.779 487 HB THR 71 HB THR 71 8.954 6.692 2.362 488 HG1 THR 71 HG1 THR 71 10.090 6.743 4.177 489 HG21 THR 71 HG21 THR 71 8.539 3.919 3.481 490 HG22 THR 71 HG22 THR 71 7.436 4.773 2.400 491 HG23 THR 71 HG23 THR 71 7.727 5.384 4.030 492 H GLU 72 H GLU 72 12.509 5.260 1.317 493 HA GLU 72 HA GLU 72 12.660 7.506 -0.502 494 HB2 GLU 72 HB2 GLU 72 12.255 8.427 1.828 495 HB3 GLU 72 HB3 GLU 72 13.781 7.697 2.307 496 HG2 GLU 72 HG2 GLU 72 14.904 9.090 0.559 497 HG3 GLU 72 HG3 GLU 72 13.360 9.915 0.309 498 H GLY 73 H GLY 73 14.936 7.876 -1.124 499 HA2 GLY 73 HA2 GLY 73 17.253 7.138 -1.083 500 HA3 GLY 73 HA3 GLY 73 16.669 5.549 -0.584 501 H PHE 74 H PHE 74 17.979 4.802 -2.486 502 HA PHE 74 HA PHE 74 16.930 5.541 -5.094 503 HB2 PHE 74 HB2 PHE 74 18.684 4.287 -6.065 504 HB3 PHE 74 HB3 PHE 74 19.404 5.008 -4.639 505 HD1 PHE 74 HD1 PHE 74 19.882 3.566 -2.645 506 HD2 PHE 74 HD2 PHE 74 18.547 1.934 -6.340 507 HE1 PHE 74 HE1 PHE 74 20.643 1.339 -1.940 508 HE2 PHE 74 HE2 PHE 74 19.301 -0.294 -5.633 509 HZ PHE 74 HZ PHE 74 20.349 -0.595 -3.434 510 H ALA 75 H ALA 75 15.637 4.248 -6.389 511 HA ALA 75 HA ALA 75 13.906 2.407 -5.199 512 HB1 ALA 75 HB1 ALA 75 13.399 3.736 -7.219 513 HB2 ALA 75 HB2 ALA 75 13.030 2.018 -7.402 514 HB3 ALA 75 HB3 ALA 75 14.483 2.691 -8.141 515 HA PRO 76 HA PRO 76 16.518 -1.251 -5.499 516 HB2 PRO 76 HB2 PRO 76 14.718 -2.556 -3.689 517 HB3 PRO 76 HB3 PRO 76 16.311 -1.888 -3.333 518 HG2 PRO 76 HG2 PRO 76 13.949 -0.897 -2.330 519 HG3 PRO 76 HG3 PRO 76 15.443 0.044 -2.494 520 HD2 PRO 76 HD2 PRO 76 13.056 -0.053 -4.305 521 HD3 PRO 76 HD3 PRO 76 14.009 1.351 -3.773 522 H LEU 77 H LEU 77 15.701 -3.738 -5.492 523 HA LEU 77 HA LEU 77 14.215 -3.930 -7.942 524 HB2 LEU 77 HB2 LEU 77 14.687 -6.530 -7.054 525 HB3 LEU 77 HB3 LEU 77 15.589 -5.647 -8.261 526 HG LEU 77 HG LEU 77 17.034 -4.809 -6.283 527 HD11 LEU 77 HD11 LEU 77 15.613 -5.534 -4.448 528 HD12 LEU 77 HD12 LEU 77 17.174 -6.354 -4.380 529 HD13 LEU 77 HD13 LEU 77 15.751 -7.209 -4.977 530 HD21 LEU 77 HD21 LEU 77 17.097 -7.700 -7.119 531 HD22 LEU 77 HD22 LEU 77 18.439 -6.794 -6.419 532 HD23 LEU 77 HD23 LEU 77 17.802 -6.345 -8.000 533 H SER 78 H SER 78 13.867 -5.901 -5.057 534 HA SER 78 HA SER 78 10.990 -5.987 -5.551 535 HB2 SER 78 HB2 SER 78 11.100 -7.988 -4.001 536 HB3 SER 78 HB3 SER 78 11.927 -8.169 -5.540 537 HG SER 78 HG SER 78 13.162 -7.452 -3.083 538 H VAL 79 H VAL 79 10.105 -4.297 -4.564 539 HA VAL 79 HA VAL 79 10.920 -3.514 -1.890 540 HB VAL 79 HB VAL 79 8.707 -2.376 -3.630 541 HG11 VAL 79 HG11 VAL 79 8.764 -0.436 -2.126 542 HG12 VAL 79 HG12 VAL 79 9.933 -1.267 -1.100 543 HG13 VAL 79 HG13 VAL 79 8.298 -1.905 -1.267 544 HG21 VAL 79 HG21 VAL 79 10.906 -2.069 -4.628 545 HG22 VAL 79 HG22 VAL 79 11.510 -1.379 -3.121 546 HG23 VAL 79 HG23 VAL 79 10.268 -0.532 -4.044 547 H ARG 80 H ARG 80 10.062 -4.220 -0.082 548 HA ARG 80 HA ARG 80 7.738 -5.965 -0.230 549 HB2 ARG 80 HB2 ARG 80 9.924 -5.602 1.784 550 HB3 ARG 80 HB3 ARG 80 8.425 -6.405 2.241 551 HG2 ARG 80 HG2 ARG 80 10.240 -7.236 -0.018 552 HG3 ARG 80 HG3 ARG 80 10.137 -8.006 1.568 553 HD2 ARG 80 HD2 ARG 80 7.913 -8.726 1.180 554 HD3 ARG 80 HD3 ARG 80 7.753 -7.691 -0.235 555 HE ARG 80 HE ARG 80 9.825 -9.603 -0.583 556 HH11 ARG 80 HH11 ARG 80 6.319 -9.286 -0.576 557 HH12 ARG 80 HH12 ARG 80 6.081 -10.558 -1.733 558 HH21 ARG 80 HH21 ARG 80 9.513 -11.270 -2.076 559 HH22 ARG 80 HH22 ARG 80 7.905 -11.705 -2.570 560 H PHE 81 H PHE 81 5.991 -5.835 1.113 561 HA PHE 81 HA PHE 81 5.533 -3.262 2.402 562 HB2 PHE 81 HB2 PHE 81 3.118 -3.475 1.407 563 HB3 PHE 81 HB3 PHE 81 4.411 -2.774 0.448 564 HD1 PHE 81 HD1 PHE 81 2.378 -5.837 0.944 565 HD2 PHE 81 HD2 PHE 81 5.055 -3.737 -1.607 566 HE1 PHE 81 HE1 PHE 81 1.881 -7.416 -0.867 567 HE2 PHE 81 HE2 PHE 81 4.565 -5.320 -3.425 568 HZ PHE 81 HZ PHE 81 2.973 -7.162 -3.054 569 H LYS 82 H LYS 82 4.648 -3.367 4.303 570 HA LYS 82 HA LYS 82 3.803 -5.966 5.349 571 HB2 LYS 82 HB2 LYS 82 5.516 -4.807 6.619 572 HB3 LYS 82 HB3 LYS 82 4.549 -3.346 6.679 573 HG2 LYS 82 HG2 LYS 82 4.529 -4.450 8.828 574 HG3 LYS 82 HG3 LYS 82 2.918 -4.494 8.119 575 HD2 LYS 82 HD2 LYS 82 3.361 -6.632 9.103 576 HD3 LYS 82 HD3 LYS 82 3.392 -6.820 7.349 577 HE2 LYS 82 HE2 LYS 82 5.850 -6.712 7.406 578 HE3 LYS 82 HE3 LYS 82 5.789 -6.564 9.160 579 HZ1 LYS 82 HZ1 LYS 82 6.233 -8.821 8.587 580 HZ2 LYS 82 HZ2 LYS 82 4.900 -8.887 7.547 581 HZ3 LYS 82 HZ3 LYS 82 4.663 -8.739 9.217 582 H ASP 83 H ASP 83 1.744 -6.421 5.719 583 HA ASP 83 HA ASP 83 -0.356 -4.476 5.409 584 HB2 ASP 83 HB2 ASP 83 -0.468 -7.329 6.438 585 HB3 ASP 83 HB3 ASP 83 -1.862 -6.333 6.057 586 H PHE 84 H PHE 84 -0.963 -3.109 6.982 587 HA PHE 84 HA PHE 84 -0.405 -3.891 9.785 588 HB2 PHE 84 HB2 PHE 84 0.930 -1.935 8.574 589 HB3 PHE 84 HB3 PHE 84 -0.512 -1.007 8.952 590 HD1 PHE 84 HD2 PHE 84 -1.106 -0.551 11.313 591 HD2 PHE 84 HD1 PHE 84 2.487 -2.577 10.256 592 HE1 PHE 84 HE2 PHE 84 -0.211 -0.126 13.560 593 HE2 PHE 84 HE1 PHE 84 3.386 -2.150 12.505 594 HZ PHE 84 HZ PHE 84 2.037 -0.923 14.159 595 H SER 85 H SER 85 -2.688 -3.414 7.543 596 HA SER 85 HA SER 85 -4.720 -1.899 8.649 597 HB2 SER 85 HB2 SER 85 -4.928 -4.325 6.869 598 HB3 SER 85 HB3 SER 85 -6.210 -3.142 7.154 599 HG SER 85 HG SER 85 -4.643 -2.927 5.248 600 H GLU 86 H GLU 86 -6.393 -2.236 9.949 601 HA GLU 86 HA GLU 86 -6.552 -4.775 11.429 602 HB2 GLU 86 HB2 GLU 86 -5.356 -2.953 12.679 603 HB3 GLU 86 HB3 GLU 86 -6.823 -1.996 12.589 604 HG2 GLU 86 HG2 GLU 86 -7.991 -3.784 13.850 605 HG3 GLU 86 HG3 GLU 86 -6.441 -4.602 14.044 606 H ASN 87 H ASN 87 -8.628 -5.231 12.249 607 HA ASN 87 HA ASN 87 -10.872 -5.506 12.219 608 HB2 ASN 87 HB2 ASN 87 -11.032 -2.559 11.544 609 HB3 ASN 87 HB3 ASN 87 -12.357 -3.558 12.116 610 HD21 ASN 87 HD21 ASN 87 -9.711 -1.625 12.982 611 HD22 ASN 87 HD22 ASN 87 -9.783 -1.858 14.692 612 H ALA 88 H ALA 88 -9.441 -6.082 9.826 613 HA ALA 88 HA ALA 88 -11.278 -5.175 7.716 614 HB1 ALA 88 HB1 ALA 88 -8.416 -6.072 7.448 615 HB2 ALA 88 HB2 ALA 88 -8.977 -4.400 7.426 616 HB3 ALA 88 HB3 ALA 88 -9.456 -5.510 6.139 617 H THR 89 H THR 89 -12.309 -6.600 6.498 618 HA THR 89 HA THR 89 -12.185 -9.425 7.163 619 HB THR 89 HB THR 89 -13.916 -8.108 5.058 620 HG1 THR 89 HG1 THR 89 -14.508 -8.438 7.835 621 HG21 THR 89 HG21 THR 89 -13.879 -10.568 5.053 622 HG22 THR 89 HG22 THR 89 -15.459 -9.946 5.531 623 HG23 THR 89 HG23 THR 89 -14.349 -10.576 6.751 624 H SER 90 H SER 90 -11.562 -7.252 4.455 625 HA SER 90 HA SER 90 -10.012 -9.340 3.088 626 HB2 SER 90 HB2 SER 90 -11.942 -7.434 1.726 627 HB3 SER 90 HB3 SER 90 -10.969 -8.673 0.937 628 HG SER 90 HG SER 90 -12.341 -9.870 2.851 629 H ARG 91 H ARG 91 -8.450 -8.407 1.541 630 HA ARG 91 HA ARG 91 -7.922 -5.539 1.902 631 HB2 ARG 91 HB2 ARG 91 -5.559 -5.895 2.150 632 HB3 ARG 91 HB3 ARG 91 -6.383 -6.876 3.350 633 HG2 ARG 91 HG2 ARG 91 -6.126 -8.810 1.709 634 HG3 ARG 91 HG3 ARG 91 -4.997 -7.768 0.841 635 HD2 ARG 91 HD2 ARG 91 -3.748 -9.168 2.328 636 HD3 ARG 91 HD3 ARG 91 -3.708 -7.517 2.945 637 HE ARG 91 HE ARG 91 -5.853 -8.724 4.188 638 HH11 ARG 91 HH11 ARG 91 -2.386 -9.217 4.084 639 HH12 ARG 91 HH12 ARG 91 -2.329 -10.016 5.622 640 HH21 ARG 91 HH21 ARG 91 -5.787 -9.774 6.188 641 HH22 ARG 91 HH22 ARG 91 -4.273 -10.328 6.825 642 H LEU 92 H LEU 92 -6.581 -4.622 0.182 643 HA LEU 92 HA LEU 92 -6.277 -6.137 -2.262 644 HB2 LEU 92 HB2 LEU 92 -8.648 -5.303 -2.253 645 HB3 LEU 92 HB3 LEU 92 -8.022 -3.668 -2.218 646 HG LEU 92 HG LEU 92 -6.897 -4.120 -4.411 647 HD11 LEU 92 HD11 LEU 92 -7.646 -6.039 -5.721 648 HD12 LEU 92 HD12 LEU 92 -8.558 -6.634 -4.333 649 HD13 LEU 92 HD13 LEU 92 -6.797 -6.552 -4.263 650 HD21 LEU 92 HD21 LEU 92 -8.940 -3.938 -5.731 651 HD22 LEU 92 HD22 LEU 92 -9.029 -2.937 -4.282 652 HD23 LEU 92 HD23 LEU 92 -9.890 -4.476 -4.346 653 H TRP 93 H TRP 93 -4.278 -5.664 -2.787 654 HA TRP 93 HA TRP 93 -3.118 -3.061 -2.192 655 HB2 TRP 93 HB2 TRP 93 -1.982 -5.649 -3.253 656 HB3 TRP 93 HB3 TRP 93 -1.045 -4.165 -3.224 657 HD1 TRP 93 HD1 TRP 93 -2.157 -7.025 -1.028 658 HE1 TRP 93 HE1 TRP 93 -1.066 -6.761 1.296 659 HE3 TRP 93 HE3 TRP 93 -0.368 -2.260 -1.496 660 HZ2 TRP 93 HZ2 TRP 93 0.316 -4.788 2.743 661 HZ3 TRP 93 HZ3 TRP 93 0.826 -1.263 0.404 662 HH2 TRP 93 HH2 TRP 93 1.157 -2.502 2.476 663 H MET 94 H MET 94 -3.094 -1.473 -3.642 664 HA MET 94 HA MET 94 -3.397 -2.202 -6.479 665 HB2 MET 94 HB2 MET 94 -4.768 0.068 -5.030 666 HB3 MET 94 HB3 MET 94 -4.751 -0.124 -6.775 667 HG2 MET 94 HG2 MET 94 -5.847 -2.356 -6.438 668 HG3 MET 94 HG3 MET 94 -6.039 -1.918 -4.741 669 HE1 MET 94 HE1 MET 94 -7.081 -1.189 -8.435 670 HE2 MET 94 HE2 MET 94 -6.308 0.333 -7.986 671 HE3 MET 94 HE3 MET 94 -8.047 0.277 -8.272 672 H PHE 95 H PHE 95 -1.648 -1.632 -7.549 673 HA PHE 95 HA PHE 95 -0.276 0.866 -6.939 674 HB2 PHE 95 HB2 PHE 95 1.029 -1.168 -7.572 675 HB3 PHE 95 HB3 PHE 95 0.253 -1.147 -9.150 676 HD1 PHE 95 HD1 PHE 95 2.364 0.937 -6.901 677 HD2 PHE 95 HD2 PHE 95 1.230 0.021 -10.902 678 HE1 PHE 95 HE1 PHE 95 4.129 2.429 -7.739 679 HE2 PHE 95 HE2 PHE 95 2.993 1.514 -11.745 680 HZ PHE 95 HZ PHE 95 4.444 2.716 -10.164 681 H GLY 96 H GLY 96 -2.395 -0.584 -9.294 682 HA2 GLY 96 HA2 GLY 96 -4.076 0.749 -10.405 683 HA3 GLY 96 HA3 GLY 96 -2.897 2.049 -10.517 684 H ASP 97 H ASP 97 -0.745 0.185 -11.268 685 HA ASP 97 HA ASP 97 -1.682 -0.777 -13.878 686 HB2 ASP 97 HB2 ASP 97 -0.109 1.005 -14.225 687 HB3 ASP 97 HB3 ASP 97 0.995 0.353 -13.023 688 H GLY 98 H GLY 98 -1.261 -2.856 -14.434 689 HA2 GLY 98 HA2 GLY 98 -0.153 -4.935 -14.312 690 HA3 GLY 98 HA3 GLY 98 0.490 -4.476 -12.738 691 H ASN 99 H ASN 99 -0.244 -5.886 -11.292 692 HA ASN 99 HA ASN 99 -3.082 -6.626 -11.429 693 HB2 ASN 99 HB2 ASN 99 -0.714 -8.256 -10.486 694 HB3 ASN 99 HB3 ASN 99 -2.384 -8.715 -10.173 695 HD21 ASN 99 HD21 ASN 99 -0.308 -10.077 -11.700 696 HD22 ASN 99 HD22 ASN 99 -0.951 -10.302 -13.287 697 H THR 100 H THR 100 -3.594 -7.667 -9.098 698 HA THR 100 HA THR 100 -3.133 -5.463 -7.198 699 HB THR 100 HB THR 100 -5.351 -6.242 -6.197 700 HG1 THR 100 HG1 THR 100 -5.681 -8.195 -7.192 701 HG21 THR 100 HG21 THR 100 -5.365 -5.081 -8.986 702 HG22 THR 100 HG22 THR 100 -5.155 -4.180 -7.483 703 HG23 THR 100 HG23 THR 100 -6.689 -4.983 -7.823 704 H SER 101 H SER 101 -4.142 -6.643 -4.905 705 HA SER 101 HA SER 101 -2.180 -8.346 -3.909 706 HB2 SER 101 HB2 SER 101 -3.825 -8.880 -2.085 707 HB3 SER 101 HB3 SER 101 -3.576 -7.160 -2.369 708 HG SER 101 HG SER 101 -5.715 -8.690 -3.434 709 H ASP 102 H ASP 102 -1.669 -10.301 -4.359 710 HA ASP 102 HA ASP 102 -3.564 -12.359 -5.073 711 HB2 ASP 102 HB2 ASP 102 -2.983 -10.831 -7.148 712 HB3 ASP 102 HB3 ASP 102 -1.457 -11.709 -7.125 713 H SER 103 H SER 103 -1.899 -14.287 -5.985 714 HA SER 103 HA SER 103 -0.235 -15.108 -3.917 715 HB2 SER 103 HB2 SER 103 -0.071 -15.810 -6.859 716 HB3 SER 103 HB3 SER 103 0.689 -16.717 -5.550 717 HG SER 103 HG SER 103 -2.078 -16.222 -5.445 718 HA PRO 104 HA PRO 104 2.927 -12.071 -4.080 719 HB2 PRO 104 HB2 PRO 104 4.903 -13.488 -2.741 720 HB3 PRO 104 HB3 PRO 104 3.617 -12.545 -1.989 721 HG2 PRO 104 HG2 PRO 104 3.797 -15.480 -2.434 722 HG3 PRO 104 HG3 PRO 104 3.095 -14.588 -1.075 723 HD2 PRO 104 HD2 PRO 104 1.573 -15.737 -2.967 724 HD3 PRO 104 HD3 PRO 104 1.108 -14.220 -2.166 725 H SER 105 H SER 105 3.522 -11.791 -6.086 726 HA SER 105 HA SER 105 5.944 -13.090 -7.052 727 HB2 SER 105 HB2 SER 105 3.466 -12.727 -8.779 728 HB3 SER 105 HB3 SER 105 5.004 -13.416 -9.293 729 HG SER 105 HG SER 105 3.074 -14.507 -7.531 730 HA PRO 106 HA PRO 106 6.623 -8.743 -8.077 731 HB2 PRO 106 HB2 PRO 106 8.450 -9.612 -10.208 732 HB3 PRO 106 HB3 PRO 106 8.796 -8.680 -8.751 733 HG2 PRO 106 HG2 PRO 106 9.636 -11.219 -9.054 734 HG3 PRO 106 HG3 PRO 106 9.165 -10.563 -7.475 735 HD2 PRO 106 HD2 PRO 106 7.609 -12.320 -9.336 736 HD3 PRO 106 HD3 PRO 106 7.752 -12.406 -7.566 737 H LEU 107 H LEU 107 4.816 -7.969 -9.037 738 HA LEU 107 HA LEU 107 3.931 -8.731 -11.646 739 HB2 LEU 107 HB2 LEU 107 3.194 -6.271 -10.039 740 HB3 LEU 107 HB3 LEU 107 2.390 -6.798 -11.497 741 HG LEU 107 HG LEU 107 0.906 -7.510 -9.915 742 HD11 LEU 107 HD11 LEU 107 2.755 -9.877 -10.073 743 HD12 LEU 107 HD12 LEU 107 1.477 -9.460 -11.216 744 HD13 LEU 107 HD13 LEU 107 1.068 -9.914 -9.561 745 HD21 LEU 107 HD21 LEU 107 3.166 -8.228 -8.063 746 HD22 LEU 107 HD22 LEU 107 1.445 -8.372 -7.700 747 HD23 LEU 107 HD23 LEU 107 2.160 -6.782 -7.975 748 H HIS 108 H HIS 108 5.665 -5.986 -10.290 749 HA HIS 108 HA HIS 108 7.262 -5.928 -12.676 750 HB2 HIS 108 HB2 HIS 108 7.114 -3.585 -13.135 751 HB3 HIS 108 HB3 HIS 108 5.481 -4.203 -13.119 752 HD1 HIS 108 HD1 HIS 108 7.315 -1.381 -12.109 753 HD2 HIS 108 HD2 HIS 108 4.273 -3.611 -10.350 754 HE1 HIS 108 HE1 HIS 108 6.274 0.127 -10.385 755 HE2 HIS 108 HE2 HIS 108 4.313 -1.159 -9.503 756 H THR 109 H THR 109 9.321 -5.713 -12.164 757 HA THR 109 HA THR 109 10.150 -5.149 -9.439 758 HB THR 109 HB THR 109 11.788 -5.686 -11.953 759 HG1 THR 109 HG1 THR 109 10.634 -7.384 -9.996 760 HG21 THR 109 HG21 THR 109 13.121 -4.650 -10.182 761 HG22 THR 109 HG22 THR 109 13.577 -6.343 -10.398 762 HG23 THR 109 HG23 THR 109 12.565 -5.860 -9.034 763 H PHE 110 H PHE 110 11.369 -3.254 -8.856 764 HA PHE 110 HA PHE 110 10.672 -0.972 -10.510 765 HB2 PHE 110 HB2 PHE 110 11.859 -1.145 -7.738 766 HB3 PHE 110 HB3 PHE 110 11.568 0.371 -8.579 767 HD1 PHE 110 HD1 PHE 110 9.959 -2.554 -7.011 768 HD2 PHE 110 HD2 PHE 110 9.382 1.290 -8.745 769 HE1 PHE 110 HE1 PHE 110 7.661 -2.508 -6.134 770 HE2 PHE 110 HE2 PHE 110 7.086 1.342 -7.866 771 HZ PHE 110 HZ PHE 110 6.222 -0.559 -6.563 772 H PHE 111 H PHE 111 12.014 -1.368 -12.235 773 HA PHE 111 HA PHE 111 14.887 -1.360 -11.962 774 HB2 PHE 111 HB2 PHE 111 13.127 -1.135 -14.418 775 HB3 PHE 111 HB3 PHE 111 14.874 -1.312 -14.445 776 HD1 PHE 111 HD1 PHE 111 15.750 -3.428 -13.084 777 HD2 PHE 111 HD2 PHE 111 11.856 -2.992 -14.738 778 HE1 PHE 111 HE1 PHE 111 15.500 -5.874 -13.132 779 HE2 PHE 111 HE2 PHE 111 11.596 -5.436 -14.783 780 HZ PHE 111 HZ PHE 111 13.419 -6.879 -13.981 781 H ASN 112 H ASN 112 12.417 0.953 -12.206 782 HA ASN 112 HA ASN 112 14.250 3.015 -13.222 783 HB2 ASN 112 HB2 ASN 112 11.223 3.138 -13.220 784 HB3 ASN 112 HB3 ASN 112 12.339 4.194 -14.072 785 HD21 ASN 112 HD21 ASN 112 13.288 3.472 -15.985 786 HD22 ASN 112 HD22 ASN 112 12.696 2.088 -16.838 787 H GLU 113 H GLU 113 14.347 4.965 -12.105 788 HA GLU 113 HA GLU 113 13.178 4.949 -9.420 789 HB2 GLU 113 HB2 GLU 113 15.328 6.717 -10.619 790 HB3 GLU 113 HB3 GLU 113 14.701 6.884 -8.987 791 HG2 GLU 113 HG2 GLU 113 16.540 5.658 -8.520 792 HG3 GLU 113 HG3 GLU 113 15.425 4.338 -8.843 793 H GLY 114 H GLY 114 12.125 6.861 -8.622 794 HA2 GLY 114 HA2 GLY 114 11.276 9.091 -9.870 795 HA3 GLY 114 HA3 GLY 114 10.259 7.859 -10.606 796 H GLU 115 H GLU 115 8.336 8.589 -9.725 797 HA GLU 115 HA GLU 115 8.169 8.414 -6.795 798 HB2 GLU 115 HB2 GLU 115 8.002 10.721 -7.730 799 HB3 GLU 115 HB3 GLU 115 6.549 10.223 -8.586 800 HG2 GLU 115 HG2 GLU 115 5.360 9.912 -6.563 801 HG3 GLU 115 HG3 GLU 115 6.831 10.052 -5.596 802 H TYR 116 H TYR 116 7.024 6.763 -6.163 803 HA TYR 116 HA TYR 116 4.903 5.692 -7.919 804 HB2 TYR 116 HB2 TYR 116 6.810 4.121 -6.154 805 HB3 TYR 116 HB3 TYR 116 5.539 3.439 -7.161 806 HD1 TYR 116 HD1 TYR 116 5.722 3.688 -9.656 807 HD2 TYR 116 HD2 TYR 116 8.953 4.568 -7.034 808 HE1 TYR 116 HE1 TYR 116 7.282 3.547 -11.543 809 HE2 TYR 116 HE2 TYR 116 10.528 4.430 -8.919 810 HH TYR 116 HH TYR 116 10.670 3.444 -11.123 811 H ILE 117 H ILE 117 2.967 5.727 -6.948 812 HA ILE 117 HA ILE 117 2.952 5.949 -4.024 813 HB ILE 117 HB ILE 117 0.796 6.800 -5.990 814 HG12 ILE 117 HG12 ILE 117 1.220 9.025 -4.680 815 HG13 ILE 117 HG13 ILE 117 2.753 8.286 -4.249 816 HG21 ILE 117 HG21 ILE 117 0.764 6.839 -2.970 817 HG22 ILE 117 HG22 ILE 117 -0.292 5.895 -4.029 818 HG23 ILE 117 HG23 ILE 117 -0.410 7.656 -4.001 819 HD11 ILE 117 HD11 ILE 117 1.790 8.886 -7.043 820 HD12 ILE 117 HD12 ILE 117 3.322 8.116 -6.624 821 HD13 ILE 117 HD13 ILE 117 3.008 9.780 -6.131 822 H VAL 118 H VAL 118 2.567 4.222 -2.954 823 HA VAL 118 HA VAL 118 1.180 1.950 -4.151 824 HB VAL 118 HB VAL 118 2.546 2.124 -1.447 825 HG11 VAL 118 HG11 VAL 118 2.582 -0.320 -1.528 826 HG12 VAL 118 HG12 VAL 118 1.717 -0.282 -3.064 827 HG13 VAL 118 HG13 VAL 118 0.931 0.301 -1.597 828 HG21 VAL 118 HG21 VAL 118 4.445 0.974 -2.467 829 HG22 VAL 118 HG22 VAL 118 4.162 2.538 -3.230 830 HG23 VAL 118 HG23 VAL 118 3.653 1.058 -4.042 831 H SER 119 H SER 119 -0.845 1.338 -3.556 832 HA SER 119 HA SER 119 -2.079 2.742 -1.279 833 HB2 SER 119 HB2 SER 119 -3.458 1.892 -3.839 834 HB3 SER 119 HB3 SER 119 -4.198 2.750 -2.486 835 HG SER 119 HG SER 119 -2.128 3.695 -4.187 836 H LEU 120 H LEU 120 -3.360 1.605 0.072 837 HA LEU 120 HA LEU 120 -3.921 -1.217 -0.519 838 HB2 LEU 120 HB2 LEU 120 -2.083 -1.258 1.057 839 HB3 LEU 120 HB3 LEU 120 -2.874 -0.085 2.085 840 HG LEU 120 HG LEU 120 -4.530 -1.739 2.779 841 HD11 LEU 120 HD11 LEU 120 -4.703 -3.015 0.680 842 HD12 LEU 120 HD12 LEU 120 -4.413 -4.066 2.068 843 HD13 LEU 120 HD13 LEU 120 -3.092 -3.678 0.964 844 HD21 LEU 120 HD21 LEU 120 -1.739 -2.837 2.907 845 HD22 LEU 120 HD22 LEU 120 -3.082 -3.273 3.965 846 HD23 LEU 120 HD23 LEU 120 -2.433 -1.633 3.993 847 H ILE 121 H ILE 121 -6.028 -1.423 -0.640 848 HA ILE 121 HA ILE 121 -7.695 0.204 1.140 849 HB ILE 121 HB ILE 121 -8.230 0.918 -1.068 850 HG12 ILE 121 HG12 ILE 121 -10.357 -1.096 -0.299 851 HG13 ILE 121 HG13 ILE 121 -10.142 0.466 0.476 852 HG21 ILE 121 HG21 ILE 121 -8.500 -1.971 -1.874 853 HG22 ILE 121 HG22 ILE 121 -7.247 -0.840 -2.387 854 HG23 ILE 121 HG23 ILE 121 -8.920 -0.587 -2.886 855 HD11 ILE 121 HD11 ILE 121 -10.635 1.574 -1.643 856 HD12 ILE 121 HD12 ILE 121 -11.952 0.527 -1.114 857 HD13 ILE 121 HD13 ILE 121 -10.869 -0.001 -2.402 858 H VAL 122 H VAL 122 -8.881 -0.844 2.545 859 HA VAL 122 HA VAL 122 -9.039 -3.767 2.273 860 HB VAL 122 HB VAL 122 -9.239 -3.846 4.776 861 HG11 VAL 122 HG11 VAL 122 -6.687 -2.735 3.617 862 HG12 VAL 122 HG12 VAL 122 -7.177 -4.430 3.650 863 HG13 VAL 122 HG13 VAL 122 -6.826 -3.584 5.156 864 HG21 VAL 122 HG21 VAL 122 -9.863 -1.519 5.194 865 HG22 VAL 122 HG22 VAL 122 -8.290 -0.984 4.606 866 HG23 VAL 122 HG23 VAL 122 -8.398 -1.950 6.078 867 H SER 123 H SER 123 -10.944 -4.782 3.153 868 HA SER 123 HA SER 123 -13.269 -3.004 2.922 869 HB2 SER 123 HB2 SER 123 -13.073 -5.779 1.727 870 HB3 SER 123 HB3 SER 123 -14.394 -4.623 1.544 871 HG SER 123 HG SER 123 -11.953 -3.620 0.809 872 H ASN 124 H ASN 124 -15.097 -3.668 4.037 873 HA ASN 124 HA ASN 124 -15.012 -6.013 5.762 874 HB2 ASN 124 HB2 ASN 124 -13.989 -4.107 7.049 875 HB3 ASN 124 HB3 ASN 124 -15.455 -3.186 6.799 876 HD21 ASN 124 HD21 ASN 124 -13.966 -5.777 8.550 877 HD22 ASN 124 HD22 ASN 124 -15.190 -5.931 9.754 878 H GLU 125 H GLU 125 -17.334 -6.037 6.908 879 HA GLU 125 HA GLU 125 -19.285 -5.911 4.816 880 HB2 GLU 125 HB2 GLU 125 -20.821 -6.691 6.662 881 HB3 GLU 125 HB3 GLU 125 -19.436 -7.728 6.345 882 HG2 GLU 125 HG2 GLU 125 -18.290 -6.848 8.288 883 HG3 GLU 125 HG3 GLU 125 -19.596 -5.700 8.568 884 H ASN 126 H ASN 126 -18.241 -3.784 7.306 885 HA ASN 126 HA ASN 126 -20.692 -2.228 7.413 886 HB2 ASN 126 HB2 ASN 126 -17.998 -1.843 8.745 887 HB3 ASN 126 HB3 ASN 126 -19.419 -0.850 9.045 888 HD21 ASN 126 HD21 ASN 126 -17.736 -2.785 10.665 889 HD22 ASN 126 HD22 ASN 126 -18.907 -3.808 11.418 890 H ASP 127 H ASP 127 -17.277 -1.632 6.624 891 HA ASP 127 HA ASP 127 -18.032 0.408 4.680 892 HB2 ASP 127 HB2 ASP 127 -17.792 1.352 7.108 893 HB3 ASP 127 HB3 ASP 127 -16.068 1.110 6.863 894 H SER 128 H SER 128 -15.883 1.275 3.634 895 HA SER 128 HA SER 128 -13.679 -0.644 3.863 896 HB2 SER 128 HB2 SER 128 -14.799 0.385 1.234 897 HB3 SER 128 HB3 SER 128 -13.369 -0.631 1.420 898 HG SER 128 HG SER 128 -15.810 -1.479 2.507 899 H ASP 129 H ASP 129 -11.655 0.274 3.722 900 HA ASP 129 HA ASP 129 -11.570 3.212 3.412 901 HB2 ASP 129 HB2 ASP 129 -11.653 2.690 5.811 902 HB3 ASP 129 HB3 ASP 129 -10.282 1.604 5.642 903 H SER 130 H SER 130 -9.768 4.015 2.430 904 HA SER 130 HA SER 130 -7.661 2.095 1.698 905 HB2 SER 130 HB2 SER 130 -9.166 2.664 -0.219 906 HB3 SER 130 HB3 SER 130 -8.718 4.358 -0.026 907 HG SER 130 HG SER 130 -7.287 3.712 -1.479 908 H ALA 131 H ALA 131 -5.570 2.873 1.688 909 HA ALA 131 HA ALA 131 -5.097 5.711 2.260 910 HB1 ALA 131 HB1 ALA 131 -3.775 3.468 3.802 911 HB2 ALA 131 HB2 ALA 131 -4.997 4.568 4.441 912 HB3 ALA 131 HB3 ALA 131 -3.422 5.192 3.953 913 H SER 132 H SER 132 -3.078 6.448 1.652 914 HA SER 132 HA SER 132 -1.608 4.697 -0.186 915 HB2 SER 132 HB2 SER 132 -2.480 7.538 -0.796 916 HB3 SER 132 HB3 SER 132 -1.587 6.461 -1.849 917 HG SER 132 HG SER 132 -3.359 5.246 -2.186 918 H VAL 133 H VAL 133 0.609 5.321 -0.505 919 HA VAL 133 HA VAL 133 1.533 7.620 1.031 920 HB VAL 133 HB VAL 133 1.877 5.580 2.464 921 HG11 VAL 133 HG11 VAL 133 3.867 4.796 0.351 922 HG12 VAL 133 HG12 VAL 133 2.400 3.924 0.799 923 HG13 VAL 133 HG13 VAL 133 3.729 4.064 1.951 924 HG21 VAL 133 HG21 VAL 133 4.363 7.053 1.612 925 HG22 VAL 133 HG22 VAL 133 4.186 6.121 3.099 926 HG23 VAL 133 HG23 VAL 133 3.202 7.562 2.837 927 H THR 134 H THR 134 3.173 8.722 0.109 928 HA THR 134 HA THR 134 3.757 8.098 -2.656 929 HB THR 134 HB THR 134 4.819 10.440 -1.080 930 HG1 THR 134 HG1 THR 134 2.665 10.673 -0.777 931 HG21 THR 134 HG21 THR 134 4.785 11.545 -3.253 932 HG22 THR 134 HG22 THR 134 4.104 10.092 -3.987 933 HG23 THR 134 HG23 THR 134 5.739 10.063 -3.324 934 H ILE 135 H ILE 135 5.332 6.668 -3.010 935 HA ILE 135 HA ILE 135 7.680 6.582 -1.273 936 HB ILE 135 HB ILE 135 7.029 4.835 -3.672 937 HG12 ILE 135 HG12 ILE 135 5.333 4.433 -2.013 938 HG13 ILE 135 HG13 ILE 135 6.453 3.078 -1.986 939 HG21 ILE 135 HG21 ILE 135 8.720 3.304 -2.793 940 HG22 ILE 135 HG22 ILE 135 9.082 4.442 -1.495 941 HG23 ILE 135 HG23 ILE 135 9.409 4.883 -3.172 942 HD11 ILE 135 HD11 ILE 135 5.779 3.717 0.252 943 HD12 ILE 135 HD12 ILE 135 6.378 5.354 -0.020 944 HD13 ILE 135 HD13 ILE 135 7.508 3.998 0.020 945 H ARG 136 H ARG 136 9.409 7.743 -1.752 946 HA ARG 136 HA ARG 136 9.569 8.862 -4.455 947 HB2 ARG 136 HB2 ARG 136 10.320 10.024 -1.780 948 HB3 ARG 136 HB3 ARG 136 10.908 10.697 -3.294 949 HG2 ARG 136 HG2 ARG 136 8.676 11.210 -4.007 950 HG3 ARG 136 HG3 ARG 136 7.991 10.362 -2.620 951 HD2 ARG 136 HD2 ARG 136 9.821 12.740 -2.365 952 HD3 ARG 136 HD3 ARG 136 8.065 12.878 -2.442 953 HE ARG 136 HE ARG 136 8.014 11.488 -0.393 954 HH11 ARG 136 HH11 ARG 136 11.025 13.143 -1.155 955 HH12 ARG 136 HH12 ARG 136 11.498 13.295 0.506 956 HH21 ARG 136 HH21 ARG 136 8.664 11.668 1.781 957 HH22 ARG 136 HH22 ARG 136 10.159 12.454 2.173 958 H ALA 137 H ALA 137 11.042 7.949 -5.599 959 HA ALA 137 HA ALA 137 13.427 6.815 -4.333 960 HB1 ALA 137 HB1 ALA 137 13.788 5.671 -6.463 961 HB2 ALA 137 HB2 ALA 137 12.368 6.471 -7.139 962 HB3 ALA 137 HB3 ALA 137 12.186 5.317 -5.817 963 H LEU 138 H LEU 138 15.379 7.646 -4.699 964 HA LEU 138 HA LEU 138 15.302 10.415 -5.500 965 HB2 LEU 138 HB2 LEU 138 17.494 8.754 -4.260 966 HB3 LEU 138 HB3 LEU 138 17.621 10.471 -4.589 967 HG LEU 138 HG LEU 138 15.647 9.194 -2.688 968 HD11 LEU 138 HD11 LEU 138 18.124 10.824 -2.156 969 HD12 LEU 138 HD12 LEU 138 17.929 9.099 -1.852 970 HD13 LEU 138 HD13 LEU 138 16.972 10.268 -0.942 971 HD21 LEU 138 HD21 LEU 138 14.767 11.221 -3.731 972 HD22 LEU 138 HD22 LEU 138 16.221 12.100 -3.259 973 HD23 LEU 138 HD23 LEU 138 15.125 11.482 -2.023 974 H GLU 139 H GLU 139 16.267 11.359 -7.127 975 HA GLU 139 HA GLU 139 17.347 9.712 -9.235 976 HB2 GLU 139 HB2 GLU 139 17.703 12.291 -10.113 977 HB3 GLU 139 HB3 GLU 139 16.325 11.273 -10.475 978 HG2 GLU 139 HG2 GLU 139 15.545 13.427 -9.833 979 HG3 GLU 139 HG3 GLU 139 15.125 12.286 -8.567 980 H HIS 140 H HIS 140 19.378 9.870 -10.095 981 HA HIS 140 HA HIS 140 21.450 10.443 -8.190 982 HB2 HIS 140 HB2 HIS 140 21.563 8.486 -9.746 983 HB3 HIS 140 HB3 HIS 140 21.716 9.606 -11.096 984 HD1 HIS 140 HD1 HIS 140 24.088 9.610 -11.861 985 HD2 HIS 140 HD2 HIS 140 23.793 9.316 -7.724 986 HE1 HIS 140 HE1 HIS 140 26.454 9.605 -11.013 987 HE2 HIS 140 HE2 HIS 140 26.256 9.281 -8.526 988 H HIS 141 H HIS 141 22.016 12.429 -7.824 989 HA HIS 141 HA HIS 141 22.010 14.324 -10.053 990 HB2 HIS 141 HB2 HIS 141 21.481 16.112 -8.465 991 HB3 HIS 141 HB3 HIS 141 20.258 14.869 -8.455 992 HD1 HIS 141 HD1 HIS 141 21.682 17.074 -6.224 993 HD2 HIS 141 HD2 HIS 141 21.087 12.964 -6.063 994 HE1 HIS 141 HE1 HIS 141 21.720 16.484 -3.784 995 HE2 HIS 141 HE2 HIS 141 21.487 13.987 -3.711 996 H HIS 142 H HIS 142 23.883 15.021 -10.690 997 HA HIS 142 HA HIS 142 26.222 14.654 -9.048 998 HB2 HIS 142 HB2 HIS 142 26.198 14.264 -11.531 999 HB3 HIS 142 HB3 HIS 142 26.005 15.996 -11.748 1000 HD1 HIS 142 HD1 HIS 142 28.525 13.485 -10.461 1001 HD2 HIS 142 HD2 HIS 142 28.317 17.445 -11.695 1002 HE1 HIS 142 HE1 HIS 142 30.909 14.282 -10.584 1003 HE2 HIS 142 HE2 HIS 142 30.769 16.632 -11.486 1004 H HIS 143 H HIS 143 24.700 17.437 -10.659 1005 HA HIS 143 HA HIS 143 25.025 19.001 -8.254 1006 HB2 HIS 143 HB2 HIS 143 27.168 19.290 -9.593 1007 HB3 HIS 143 HB3 HIS 143 26.194 20.071 -10.832 1008 HD1 HIS 143 HD1 HIS 143 25.970 22.535 -10.607 1009 HD2 HIS 143 HD2 HIS 143 26.955 20.722 -6.999 1010 HE1 HIS 143 HE1 HIS 143 26.301 24.418 -8.975 1011 HE2 HIS 143 HE2 HIS 143 26.857 23.302 -6.788 1012 H HIS 144 H HIS 144 23.224 20.049 -7.955 1013 HA HIS 144 HA HIS 144 21.206 20.327 -9.971 1014 HB2 HIS 144 HB2 HIS 144 20.684 19.948 -7.575 1015 HB3 HIS 144 HB3 HIS 144 21.402 21.497 -7.176 1016 HD1 HIS 144 HD1 HIS 144 19.999 23.604 -7.605 1017 HD2 HIS 144 HD2 HIS 144 18.097 20.058 -8.659 1018 HE1 HIS 144 HE1 HIS 144 17.586 24.213 -7.962 1019 HE2 HIS 144 HE2 HIS 144 16.431 22.039 -8.483 1020 H HIS 145 H HIS 145 21.367 21.803 -11.539 1021 HA HIS 145 HA HIS 145 21.860 24.577 -10.826 1022 HB2 HIS 145 HB2 HIS 145 24.100 23.535 -11.463 1023 HB3 HIS 145 HB3 HIS 145 23.448 23.345 -13.087 1024 HD1 HIS 145 HD1 HIS 145 24.632 25.051 -14.440 1025 HD2 HIS 145 HD2 HIS 145 23.352 26.580 -10.790 1026 HE1 HIS 145 HE1 HIS 145 25.212 27.499 -14.489 1027 HE2 HIS 145 HE2 HIS 145 24.471 28.395 -12.259 Start of MODEL 7 1 H1 MET 1 H1 MET 1 -70.411 75.492 153.290 2 H2 MET 1 H2 MET 1 -70.112 76.182 151.771 3 H3 MET 1 H3 MET 1 -69.650 77.004 153.178 4 HA MET 1 HA MET 1 -68.035 75.347 153.701 5 HB2 MET 1 HB2 MET 1 -69.054 74.038 151.176 6 HB3 MET 1 HB3 MET 1 -67.527 73.611 151.931 7 HG2 MET 1 HG2 MET 1 -68.764 73.014 153.984 8 HG3 MET 1 HG3 MET 1 -70.269 73.328 153.124 9 HE1 MET 1 HE1 MET 1 -71.173 70.893 153.656 10 HE2 MET 1 HE2 MET 1 -69.699 70.591 154.577 11 HE3 MET 1 HE3 MET 1 -70.239 69.428 153.366 12 H ASN 2 H ASN 2 -65.998 75.917 153.186 13 HA ASN 2 HA ASN 2 -65.709 77.725 150.879 14 HB2 ASN 2 HB2 ASN 2 -64.197 77.718 153.514 15 HB3 ASN 2 HB3 ASN 2 -63.830 78.776 152.156 16 HD21 ASN 2 HD21 ASN 2 -64.599 79.470 154.833 17 HD22 ASN 2 HD22 ASN 2 -66.046 80.409 154.701 18 H ALA 3 H ALA 3 -64.961 76.471 149.277 19 HA ALA 3 HA ALA 3 -62.226 75.540 149.503 20 HB1 ALA 3 HB1 ALA 3 -63.516 73.561 150.182 21 HB2 ALA 3 HB2 ALA 3 -62.673 73.302 148.655 22 HB3 ALA 3 HB3 ALA 3 -64.406 73.628 148.659 23 H ARG 4 H ARG 4 -61.550 76.948 147.953 24 HA ARG 4 HA ARG 4 -62.735 76.657 145.262 25 HB2 ARG 4 HB2 ARG 4 -61.039 78.940 146.310 26 HB3 ARG 4 HB3 ARG 4 -61.811 78.853 144.737 27 HG2 ARG 4 HG2 ARG 4 -63.989 79.036 145.733 28 HG3 ARG 4 HG3 ARG 4 -63.295 78.933 147.353 29 HD2 ARG 4 HD2 ARG 4 -61.962 81.007 146.752 30 HD3 ARG 4 HD3 ARG 4 -63.017 81.152 145.346 31 HE ARG 4 HE ARG 4 -64.510 80.885 147.757 32 HH11 ARG 4 HH11 ARG 4 -62.772 83.224 145.813 33 HH12 ARG 4 HH12 ARG 4 -63.577 84.586 146.528 34 HH21 ARG 4 HH21 ARG 4 -65.543 82.661 148.692 35 HH22 ARG 4 HH22 ARG 4 -65.136 84.266 148.168 36 H ASP 5 H ASP 5 -61.517 75.413 143.950 37 HA ASP 5 HA ASP 5 -58.596 75.613 144.196 38 HB2 ASP 5 HB2 ASP 5 -59.399 73.540 145.336 39 HB3 ASP 5 HB3 ASP 5 -60.070 73.000 143.800 40 H ASN 6 H ASN 6 -57.804 76.319 142.363 41 HA ASN 6 HA ASN 6 -59.126 75.610 139.823 42 HB2 ASN 6 HB2 ASN 6 -59.554 77.951 140.432 43 HB3 ASN 6 HB3 ASN 6 -57.832 78.239 140.622 44 HD21 ASN 6 HD21 ASN 6 -57.670 79.812 139.108 45 HD22 ASN 6 HD22 ASN 6 -57.913 79.550 137.413 46 H LYS 7 H LYS 7 -57.850 74.748 138.295 47 HA LYS 7 HA LYS 7 -55.053 75.455 138.092 48 HB2 LYS 7 HB2 LYS 7 -54.207 73.168 138.109 49 HB3 LYS 7 HB3 LYS 7 -54.975 73.538 139.643 50 HG2 LYS 7 HG2 LYS 7 -56.993 72.317 138.891 51 HG3 LYS 7 HG3 LYS 7 -56.145 71.881 137.408 52 HD2 LYS 7 HD2 LYS 7 -55.256 71.164 140.202 53 HD3 LYS 7 HD3 LYS 7 -56.099 70.077 139.099 54 HE2 LYS 7 HE2 LYS 7 -54.232 70.223 137.527 55 HE3 LYS 7 HE3 LYS 7 -53.401 71.341 138.606 56 HZ1 LYS 7 HZ1 LYS 7 -52.549 69.121 138.865 57 HZ2 LYS 7 HZ2 LYS 7 -54.093 68.524 139.215 58 HZ3 LYS 7 HZ3 LYS 7 -53.342 69.599 140.281 59 H PHE 8 H PHE 8 -54.151 74.935 136.053 60 HA PHE 8 HA PHE 8 -55.709 73.490 134.105 61 HB2 PHE 8 HB2 PHE 8 -55.620 75.317 132.397 62 HB3 PHE 8 HB3 PHE 8 -56.710 75.651 133.728 63 HD1 PHE 8 HD2 PHE 8 -56.224 77.452 135.301 64 HD2 PHE 8 HD1 PHE 8 -53.628 76.646 132.025 65 HE1 PHE 8 HE2 PHE 8 -55.153 79.640 135.612 66 HE2 PHE 8 HE1 PHE 8 -52.566 78.839 132.327 67 HZ PHE 8 HZ PHE 8 -53.324 80.334 134.122 68 H ASN 9 H ASN 9 -54.411 72.410 132.707 69 HA ASN 9 HA ASN 9 -51.770 73.456 132.134 70 HB2 ASN 9 HB2 ASN 9 -50.592 71.339 132.650 71 HB3 ASN 9 HB3 ASN 9 -51.240 72.122 134.079 72 HD21 ASN 9 HD21 ASN 9 -52.907 71.141 135.210 73 HD22 ASN 9 HD22 ASN 9 -53.345 69.479 134.967 74 H THR 10 H THR 10 -51.579 73.468 130.080 75 HA THR 10 HA THR 10 -51.963 71.049 128.557 76 HB THR 10 HB THR 10 -54.164 71.939 128.271 77 HG1 THR 10 HG1 THR 10 -52.959 71.232 126.323 78 HG21 THR 10 HG21 THR 10 -52.924 74.579 127.469 79 HG22 THR 10 HG22 THR 10 -53.833 74.261 128.945 80 HG23 THR 10 HG23 THR 10 -54.646 74.189 127.381 81 H TRP 11 H TRP 11 -50.282 70.790 127.262 82 HA TRP 11 HA TRP 11 -49.179 73.119 125.892 83 HB2 TRP 11 HB2 TRP 11 -47.719 72.766 127.876 84 HB3 TRP 11 HB3 TRP 11 -47.407 71.121 127.332 85 HD1 TRP 11 HD1 TRP 11 -45.210 70.871 126.058 86 HE1 TRP 11 HE1 TRP 11 -43.708 72.395 124.626 87 HE3 TRP 11 HE3 TRP 11 -48.044 75.135 126.153 88 HZ2 TRP 11 HZ2 TRP 11 -43.730 75.043 123.654 89 HZ3 TRP 11 HZ3 TRP 11 -47.230 77.112 124.942 90 HH2 TRP 11 HH2 TRP 11 -45.123 77.066 123.721 91 H ASN 12 H ASN 12 -49.400 72.663 123.823 92 HA ASN 12 HA ASN 12 -48.478 70.104 122.802 93 HB2 ASN 12 HB2 ASN 12 -50.492 69.771 121.419 94 HB3 ASN 12 HB3 ASN 12 -50.865 69.709 123.133 95 HD21 ASN 12 HD21 ASN 12 -52.099 71.367 124.056 96 HD22 ASN 12 HD22 ASN 12 -53.030 72.455 123.084 97 H ASP 13 H ASP 13 -47.784 70.141 120.693 98 HA ASP 13 HA ASP 13 -48.095 72.401 118.957 99 HB2 ASP 13 HB2 ASP 13 -46.302 73.183 120.578 100 HB3 ASP 13 HB3 ASP 13 -45.294 71.853 120.010 101 H SER 14 H SER 14 -47.232 71.935 116.829 102 HA SER 14 HA SER 14 -46.159 69.247 116.425 103 HB2 SER 14 HB2 SER 14 -48.651 69.096 116.243 104 HB3 SER 14 HB3 SER 14 -48.580 70.269 114.928 105 HG SER 14 HG SER 14 -47.125 67.840 114.877 106 H ARG 15 H ARG 15 -44.421 69.438 115.186 107 HA ARG 15 HA ARG 15 -44.613 70.855 112.678 108 HB2 ARG 15 HB2 ARG 15 -43.717 72.515 114.447 109 HB3 ARG 15 HB3 ARG 15 -42.258 71.535 114.443 110 HG2 ARG 15 HG2 ARG 15 -42.019 73.489 113.009 111 HG3 ARG 15 HG3 ARG 15 -41.937 71.996 112.072 112 HD2 ARG 15 HD2 ARG 15 -43.295 73.750 110.971 113 HD3 ARG 15 HD3 ARG 15 -44.217 72.289 111.316 114 HE ARG 15 HE ARG 15 -44.585 74.008 113.470 115 HH11 ARG 15 HH11 ARG 15 -45.356 74.023 110.043 116 HH12 ARG 15 HH12 ARG 15 -46.784 74.983 110.263 117 HH21 ARG 15 HH21 ARG 15 -46.446 75.248 113.718 118 HH22 ARG 15 HH22 ARG 15 -47.403 75.658 112.327 119 H GLY 16 H GLY 16 -43.805 69.507 111.195 120 HA2 GLY 16 HA2 GLY 16 -41.289 68.360 111.168 121 HA3 GLY 16 HA3 GLY 16 -42.342 67.170 111.919 122 H ASN 17 H ASN 17 -41.982 69.209 109.056 123 HA ASN 17 HA ASN 17 -43.210 67.070 107.441 124 HB2 ASN 17 HB2 ASN 17 -43.693 70.046 107.261 125 HB3 ASN 17 HB3 ASN 17 -44.029 68.966 105.915 126 HD21 ASN 17 HD21 ASN 17 -45.791 67.639 105.997 127 HD22 ASN 17 HD22 ASN 17 -46.990 67.726 107.240 128 H TYR 18 H TYR 18 -41.694 66.241 106.200 129 HA TYR 18 HA TYR 18 -39.784 68.039 104.875 130 HB2 TYR 18 HB2 TYR 18 -39.046 65.582 106.474 131 HB3 TYR 18 HB3 TYR 18 -37.967 66.326 105.303 132 HD1 TYR 18 HD2 TYR 18 -37.227 68.704 105.694 133 HD2 TYR 18 HD1 TYR 18 -39.228 66.415 108.659 134 HE1 TYR 18 HE2 TYR 18 -36.400 70.239 107.436 135 HE2 TYR 18 HE1 TYR 18 -38.421 67.937 110.400 136 HH TYR 18 HH TYR 18 -36.587 69.497 110.754 137 H TRP 19 H TRP 19 -38.788 67.201 103.003 138 HA TRP 19 HA TRP 19 -39.476 64.676 101.855 139 HB2 TRP 19 HB2 TRP 19 -40.719 65.566 99.897 140 HB3 TRP 19 HB3 TRP 19 -41.603 65.786 101.400 141 HD1 TRP 19 HD1 TRP 19 -41.681 68.364 102.369 142 HE1 TRP 19 HE1 TRP 19 -41.661 70.606 101.107 143 HE3 TRP 19 HE3 TRP 19 -39.825 66.750 97.898 144 HZ2 TRP 19 HZ2 TRP 19 -40.959 71.560 98.545 145 HZ3 TRP 19 HZ3 TRP 19 -39.506 68.384 96.090 146 HH2 TRP 19 HH2 TRP 19 -40.061 70.740 96.408 147 H SER 20 H SER 20 -38.281 64.317 99.847 148 HA SER 20 HA SER 20 -36.563 66.483 98.943 149 HB2 SER 20 HB2 SER 20 -35.417 63.878 99.987 150 HB3 SER 20 HB3 SER 20 -34.507 65.040 99.020 151 HG SER 20 HG SER 20 -35.809 66.115 101.197 152 H ASP 21 H ASP 21 -37.820 66.372 97.042 153 HA ASP 21 HA ASP 21 -37.490 63.904 95.468 154 HB2 ASP 21 HB2 ASP 21 -39.431 66.183 95.095 155 HB3 ASP 21 HB3 ASP 21 -39.245 64.868 93.948 156 H TYR 22 H TYR 22 -36.184 63.839 93.824 157 HA TYR 22 HA TYR 22 -35.223 66.299 92.555 158 HB2 TYR 22 HB2 TYR 22 -33.477 64.156 93.785 159 HB3 TYR 22 HB3 TYR 22 -32.877 65.331 92.626 160 HD1 TYR 22 HD1 TYR 22 -32.857 67.758 93.250 161 HD2 TYR 22 HD2 TYR 22 -33.746 64.708 96.080 162 HE1 TYR 22 HE1 TYR 22 -32.410 69.334 95.082 163 HE2 TYR 22 HE2 TYR 22 -33.306 66.278 97.917 164 HH TYR 22 HH TYR 22 -32.095 68.305 98.349 165 H GLU 23 H GLU 23 -35.442 66.106 90.444 166 HA GLU 23 HA GLU 23 -35.624 63.396 89.307 167 HB2 GLU 23 HB2 GLU 23 -36.985 65.948 88.415 168 HB3 GLU 23 HB3 GLU 23 -37.102 64.403 87.588 169 HG2 GLU 23 HG2 GLU 23 -38.042 64.925 90.402 170 HG3 GLU 23 HG3 GLU 23 -39.073 64.922 88.974 171 H GLY 24 H GLY 24 -34.007 62.850 88.070 172 HA2 GLY 24 HA2 GLY 24 -33.103 64.695 85.994 173 HA3 GLY 24 HA3 GLY 24 -31.877 64.054 87.082 174 H SER 25 H SER 25 -34.715 62.627 85.496 175 HA SER 25 HA SER 25 -33.088 60.302 84.823 176 HB2 SER 25 HB2 SER 25 -36.095 60.663 84.722 177 HB3 SER 25 HB3 SER 25 -35.217 59.147 84.517 178 HG SER 25 HG SER 25 -34.621 59.192 86.637 179 H ASP 26 H ASP 26 -31.968 61.060 83.054 180 HA ASP 26 HA ASP 26 -33.394 60.921 80.549 181 HB2 ASP 26 HB2 ASP 26 -33.552 63.327 81.131 182 HB3 ASP 26 HB3 ASP 26 -31.797 63.398 81.255 183 H GLU 27 H GLU 27 -32.232 59.464 79.516 184 HA GLU 27 HA GLU 27 -29.299 59.731 79.501 185 HB2 GLU 27 HB2 GLU 27 -30.946 57.195 79.602 186 HB3 GLU 27 HB3 GLU 27 -29.232 57.222 79.209 187 HG2 GLU 27 HG2 GLU 27 -28.718 58.134 81.411 188 HG3 GLU 27 HG3 GLU 27 -30.438 58.196 81.797 189 H ASN 28 H ASN 28 -28.323 59.628 77.545 190 HA ASN 28 HA ASN 28 -30.062 59.145 75.216 191 HB2 ASN 28 HB2 ASN 28 -27.617 60.887 75.526 192 HB3 ASN 28 HB3 ASN 28 -28.243 60.421 73.951 193 HD21 ASN 28 HD21 ASN 28 -31.043 60.550 74.863 194 HD22 ASN 28 HD22 ASN 28 -31.409 62.234 74.991 195 H GLY 29 H GLY 29 -29.305 57.906 73.522 196 HA2 GLY 29 HA2 GLY 29 -26.779 56.682 73.359 197 HA3 GLY 29 HA3 GLY 29 -27.872 55.597 74.211 198 H ASP 30 H ASP 30 -27.737 57.622 71.305 199 HA ASP 30 HA ASP 30 -29.164 55.499 69.850 200 HB2 ASP 30 HB2 ASP 30 -30.688 57.391 70.366 201 HB3 ASP 30 HB3 ASP 30 -29.606 58.473 69.502 202 H GLY 31 H GLY 31 -27.916 54.719 68.339 203 HA2 GLY 31 HA2 GLY 31 -26.790 56.117 66.246 204 HA3 GLY 31 HA3 GLY 31 -25.539 55.995 67.473 205 H ILE 32 H ILE 32 -26.942 54.526 64.840 206 HA ILE 32 HA ILE 32 -25.809 51.912 65.566 207 HB ILE 32 HB ILE 32 -27.163 50.836 63.896 208 HG12 ILE 32 HG12 ILE 32 -27.310 52.743 62.258 209 HG13 ILE 32 HG13 ILE 32 -28.807 51.862 62.492 210 HG21 ILE 32 HG21 ILE 32 -28.112 51.015 66.085 211 HG22 ILE 32 HG22 ILE 32 -29.391 51.116 64.875 212 HG23 ILE 32 HG23 ILE 32 -28.831 52.578 65.689 213 HD11 ILE 32 HD11 ILE 32 -29.227 54.224 62.280 214 HD12 ILE 32 HD12 ILE 32 -28.132 54.574 63.618 215 HD13 ILE 32 HD13 ILE 32 -29.629 53.688 63.912 216 H GLY 33 H GLY 33 -24.782 50.707 63.825 217 HA2 GLY 33 HA2 GLY 33 -23.810 52.245 61.536 218 HA3 GLY 33 HA3 GLY 33 -22.595 51.656 62.667 219 H ASP 34 H ASP 34 -25.535 50.401 61.157 220 HA ASP 34 HA ASP 34 -24.357 47.737 61.074 221 HB2 ASP 34 HB2 ASP 34 -26.640 46.961 60.644 222 HB3 ASP 34 HB3 ASP 34 -26.608 48.022 62.048 223 H SER 35 H SER 35 -24.530 50.320 58.985 224 HA SER 35 HA SER 35 -25.254 48.990 56.562 225 HB2 SER 35 HB2 SER 35 -23.793 51.610 56.992 226 HB3 SER 35 HB3 SER 35 -24.479 51.055 55.463 227 HG SER 35 HG SER 35 -25.953 51.475 57.855 228 H ALA 36 H ALA 36 -24.078 47.413 55.795 229 HA ALA 36 HA ALA 36 -21.228 47.894 55.256 230 HB1 ALA 36 HB1 ALA 36 -21.338 46.388 57.201 231 HB2 ALA 36 HB2 ALA 36 -20.685 45.566 55.783 232 HB3 ALA 36 HB3 ALA 36 -22.352 45.280 56.277 233 H TYR 37 H TYR 37 -21.230 48.063 53.098 234 HA TYR 37 HA TYR 37 -23.315 46.712 51.580 235 HB2 TYR 37 HB2 TYR 37 -21.443 48.959 50.807 236 HB3 TYR 37 HB3 TYR 37 -22.693 48.289 49.759 237 HD1 TYR 37 HD2 TYR 37 -25.099 48.532 50.416 238 HD2 TYR 37 HD1 TYR 37 -21.983 50.556 52.490 239 HE1 TYR 37 HE2 TYR 37 -26.753 50.048 51.411 240 HE2 TYR 37 HE1 TYR 37 -23.633 52.073 53.496 241 HH TYR 37 HH TYR 37 -26.915 51.449 53.490 242 H ALA 38 H ALA 38 -22.893 44.849 50.770 243 HA ALA 38 HA ALA 38 -20.187 44.231 49.793 244 HB1 ALA 38 HB1 ALA 38 -22.399 42.350 50.632 245 HB2 ALA 38 HB2 ALA 38 -20.981 42.769 51.593 246 HB3 ALA 38 HB3 ALA 38 -20.790 41.881 50.082 247 H VAL 39 H VAL 39 -19.932 44.102 47.654 248 HA VAL 39 HA VAL 39 -22.260 44.197 45.944 249 HB VAL 39 HB VAL 39 -20.652 44.395 44.048 250 HG11 VAL 39 HG11 VAL 39 -20.263 46.333 46.320 251 HG12 VAL 39 HG12 VAL 39 -21.553 46.369 45.117 252 HG13 VAL 39 HG13 VAL 39 -19.882 46.646 44.627 253 HG21 VAL 39 HG21 VAL 39 -18.550 44.418 46.215 254 HG22 VAL 39 HG22 VAL 39 -18.283 44.813 44.517 255 HG23 VAL 39 HG23 VAL 39 -18.753 43.175 44.980 256 H ASN 40 H ASN 40 -22.751 42.799 44.286 257 HA ASN 40 HA ASN 40 -21.590 40.097 44.491 258 HB2 ASN 40 HB2 ASN 40 -23.852 40.244 45.556 259 HB3 ASN 40 HB3 ASN 40 -24.513 40.790 44.024 260 HD21 ASN 40 HD21 ASN 40 -25.918 39.102 43.856 261 HD22 ASN 40 HD22 ASN 40 -25.419 37.478 43.531 262 HA PRO 41 HA PRO 41 -21.283 41.367 40.118 263 HB2 PRO 41 HB2 PRO 41 -18.717 40.117 39.980 264 HB3 PRO 41 HB3 PRO 41 -19.078 41.844 40.006 265 HG2 PRO 41 HG2 PRO 41 -17.770 40.485 42.024 266 HG3 PRO 41 HG3 PRO 41 -18.635 42.018 42.235 267 HD2 PRO 41 HD2 PRO 41 -19.552 39.229 42.833 268 HD3 PRO 41 HD3 PRO 41 -19.791 40.719 43.773 269 H GLU 42 H GLU 42 -22.939 39.801 39.676 270 HA GLU 42 HA GLU 42 -22.094 37.074 39.151 271 HB2 GLU 42 HB2 GLU 42 -24.766 38.437 38.902 272 HB3 GLU 42 HB3 GLU 42 -24.482 36.790 38.357 273 HG2 GLU 42 HG2 GLU 42 -23.797 36.191 40.652 274 HG3 GLU 42 HG3 GLU 42 -24.217 37.822 41.168 275 H ALA 43 H ALA 43 -22.927 36.099 37.058 276 HA ALA 43 HA ALA 43 -22.027 37.833 34.860 277 HB1 ALA 43 HB1 ALA 43 -21.531 34.887 35.235 278 HB2 ALA 43 HB2 ALA 43 -20.342 36.169 35.461 279 HB3 ALA 43 HB3 ALA 43 -21.007 35.851 33.857 280 H GLY 44 H GLY 44 -23.101 37.708 32.922 281 HA2 GLY 44 HA2 GLY 44 -25.582 36.142 32.864 282 HA3 GLY 44 HA3 GLY 44 -25.129 37.401 31.725 283 H SER 45 H SER 45 -22.786 35.069 32.596 284 HA SER 45 HA SER 45 -22.372 34.222 29.911 285 HB2 SER 45 HB2 SER 45 -20.575 34.551 31.620 286 HB3 SER 45 HB3 SER 45 -21.192 33.141 32.475 287 HG SER 45 HG SER 45 -19.825 32.132 31.236 288 H MET 46 H MET 46 -22.936 32.385 28.936 289 HA MET 46 HA MET 46 -24.865 30.678 30.327 290 HB2 MET 46 HB2 MET 46 -24.209 30.893 27.378 291 HB3 MET 46 HB3 MET 46 -25.485 29.906 28.074 292 HG2 MET 46 HG2 MET 46 -26.640 31.882 28.850 293 HG3 MET 46 HG3 MET 46 -25.337 32.906 28.244 294 HE1 MET 46 HE1 MET 46 -28.350 30.574 27.339 295 HE2 MET 46 HE2 MET 46 -27.009 29.713 26.579 296 HE3 MET 46 HE3 MET 46 -28.239 30.482 25.580 297 H ASP 47 H ASP 47 -23.921 29.004 31.324 298 HA ASP 47 HA ASP 47 -21.792 27.593 29.884 299 HB2 ASP 47 HB2 ASP 47 -20.900 26.818 31.960 300 HB3 ASP 47 HB3 ASP 47 -21.129 28.549 32.098 301 H TYR 48 H TYR 48 -22.186 25.691 29.100 302 HA TYR 48 HA TYR 48 -24.037 23.858 30.282 303 HB2 TYR 48 HB2 TYR 48 -25.482 23.675 28.194 304 HB3 TYR 48 HB3 TYR 48 -25.763 25.084 29.197 305 HD1 TYR 48 HD2 TYR 48 -24.398 23.908 25.981 306 HD2 TYR 48 HD1 TYR 48 -25.346 27.292 28.370 307 HE1 TYR 48 HE2 TYR 48 -24.127 25.360 24.020 308 HE2 TYR 48 HE1 TYR 48 -25.083 28.755 26.415 309 HH TYR 48 HH TYR 48 -24.884 27.551 23.234 310 H MET 49 H MET 49 -23.807 21.792 29.564 311 HA MET 49 HA MET 49 -22.334 21.223 27.140 312 HB2 MET 49 HB2 MET 49 -20.537 21.486 28.829 313 HB3 MET 49 HB3 MET 49 -21.307 20.254 29.820 314 HG2 MET 49 HG2 MET 49 -20.959 18.619 28.003 315 HG3 MET 49 HG3 MET 49 -20.117 19.864 27.082 316 HE1 MET 49 HE1 MET 49 -17.265 17.412 28.234 317 HE2 MET 49 HE2 MET 49 -18.072 18.148 26.849 318 HE3 MET 49 HE3 MET 49 -18.925 16.967 27.843 319 HA PRO 50 HA PRO 50 -25.656 18.107 27.797 320 HB2 PRO 50 HB2 PRO 50 -25.606 18.111 24.855 321 HB3 PRO 50 HB3 PRO 50 -26.966 18.367 25.949 322 HG2 PRO 50 HG2 PRO 50 -25.939 20.375 24.498 323 HG3 PRO 50 HG3 PRO 50 -26.556 20.631 26.143 324 HD2 PRO 50 HD2 PRO 50 -23.722 20.319 25.213 325 HD3 PRO 50 HD3 PRO 50 -24.400 21.482 26.373 326 H LEU 51 H LEU 51 -24.952 16.118 28.195 327 HA LEU 51 HA LEU 51 -22.479 15.186 27.028 328 HB2 LEU 51 HB2 LEU 51 -24.287 13.844 29.042 329 HB3 LEU 51 HB3 LEU 51 -22.666 13.332 28.614 330 HG LEU 51 HG LEU 51 -23.329 15.968 29.936 331 HD11 LEU 51 HD11 LEU 51 -22.395 14.960 31.956 332 HD12 LEU 51 HD12 LEU 51 -22.228 13.421 31.110 333 HD13 LEU 51 HD13 LEU 51 -23.830 14.097 31.403 334 HD21 LEU 51 HD21 LEU 51 -21.265 16.019 28.617 335 HD22 LEU 51 HD22 LEU 51 -20.684 14.588 29.467 336 HD23 LEU 51 HD23 LEU 51 -20.921 16.098 30.345 337 H MET 52 H MET 52 -22.507 14.301 25.106 338 HA MET 52 HA MET 52 -24.822 12.684 24.312 339 HB2 MET 52 HB2 MET 52 -22.679 14.030 22.648 340 HB3 MET 52 HB3 MET 52 -23.902 12.956 21.986 341 HG2 MET 52 HG2 MET 52 -24.448 15.543 23.429 342 HG3 MET 52 HG3 MET 52 -24.474 15.313 21.680 343 HE1 MET 52 HE1 MET 52 -26.264 13.773 20.414 344 HE2 MET 52 HE2 MET 52 -27.529 12.867 21.245 345 HE3 MET 52 HE3 MET 52 -25.839 12.405 21.446 346 H GLU 53 H GLU 53 -24.504 10.647 24.912 347 HA GLU 53 HA GLU 53 -21.884 9.442 24.445 348 HB2 GLU 53 HB2 GLU 53 -24.173 8.669 26.242 349 HB3 GLU 53 HB3 GLU 53 -22.855 7.561 25.879 350 HG2 GLU 53 HG2 GLU 53 -22.565 10.272 27.159 351 HG3 GLU 53 HG3 GLU 53 -22.531 8.725 28.008 352 H TYR 54 H TYR 54 -21.586 7.943 22.987 353 HA TYR 54 HA TYR 54 -23.896 7.212 21.331 354 HB2 TYR 54 HB2 TYR 54 -20.954 7.326 20.609 355 HB3 TYR 54 HB3 TYR 54 -22.263 6.924 19.505 356 HD1 TYR 54 HD1 TYR 54 -24.073 8.717 19.136 357 HD2 TYR 54 HD2 TYR 54 -20.286 9.539 20.880 358 HE1 TYR 54 HE1 TYR 54 -24.363 11.103 18.625 359 HE2 TYR 54 HE2 TYR 54 -20.561 11.926 20.371 360 HH TYR 54 HH TYR 54 -21.785 13.377 18.947 361 H LEU 55 H LEU 55 -23.418 5.112 20.055 362 HA LEU 55 HA LEU 55 -22.986 3.066 22.098 363 HB2 LEU 55 HB2 LEU 55 -24.432 3.117 19.471 364 HB3 LEU 55 HB3 LEU 55 -23.855 1.583 20.087 365 HG LEU 55 HG LEU 55 -26.147 1.808 20.688 366 HD11 LEU 55 HD11 LEU 55 -26.062 1.676 23.129 367 HD12 LEU 55 HD12 LEU 55 -24.424 2.332 23.095 368 HD13 LEU 55 HD13 LEU 55 -24.759 0.763 22.363 369 HD21 LEU 55 HD21 LEU 55 -26.436 4.197 20.501 370 HD22 LEU 55 HD22 LEU 55 -25.430 4.459 21.927 371 HD23 LEU 55 HD23 LEU 55 -26.989 3.647 22.084 372 H HIS 56 H HIS 56 -21.013 2.393 22.309 373 HA HIS 56 HA HIS 56 -19.152 2.159 20.118 374 HB2 HIS 56 HB2 HIS 56 -19.048 1.583 23.054 375 HB3 HIS 56 HB3 HIS 56 -17.836 0.868 22.002 376 HD1 HIS 56 HD1 HIS 56 -18.662 3.972 23.773 377 HD2 HIS 56 HD2 HIS 56 -16.219 2.822 20.610 378 HE1 HIS 56 HE1 HIS 56 -17.014 5.850 23.477 379 HE2 HIS 56 HE2 HIS 56 -15.449 5.058 21.670 380 H SER 57 H SER 57 -21.484 0.147 21.649 381 HA SER 57 HA SER 57 -20.505 -2.331 20.575 382 HB2 SER 57 HB2 SER 57 -22.792 -3.153 21.336 383 HB3 SER 57 HB3 SER 57 -21.742 -2.504 22.595 384 HG SER 57 HG SER 57 -23.604 -0.840 21.271 385 H SER 58 H SER 58 -20.246 -1.736 18.451 386 HA SER 58 HA SER 58 -22.566 -2.133 16.745 387 HB2 SER 58 HB2 SER 58 -20.675 0.226 16.387 388 HB3 SER 58 HB3 SER 58 -21.986 -0.215 15.299 389 HG SER 58 HG SER 58 -22.993 0.032 17.753 390 HA PRO 59 HA PRO 59 -19.283 -4.265 14.461 391 HB2 PRO 59 HB2 PRO 59 -19.986 -3.885 11.862 392 HB3 PRO 59 HB3 PRO 59 -20.739 -5.083 12.919 393 HG2 PRO 59 HG2 PRO 59 -21.705 -2.371 12.129 394 HG3 PRO 59 HG3 PRO 59 -22.624 -3.880 12.305 395 HD2 PRO 59 HD2 PRO 59 -22.628 -1.929 14.185 396 HD3 PRO 59 HD3 PRO 59 -22.801 -3.647 14.592 397 H VAL 60 H VAL 60 -17.327 -3.797 13.642 398 HA VAL 60 HA VAL 60 -16.686 -0.954 13.597 399 HB VAL 60 HB VAL 60 -15.554 -2.451 15.192 400 HG11 VAL 60 HG11 VAL 60 -13.914 -4.087 14.499 401 HG12 VAL 60 HG12 VAL 60 -14.276 -3.758 12.804 402 HG13 VAL 60 HG13 VAL 60 -15.507 -4.481 13.841 403 HG21 VAL 60 HG21 VAL 60 -13.232 -1.743 14.768 404 HG22 VAL 60 HG22 VAL 60 -14.402 -0.437 14.580 405 HG23 VAL 60 HG23 VAL 60 -13.714 -1.216 13.153 406 H LEU 61 H LEU 61 -15.845 0.106 11.904 407 HA LEU 61 HA LEU 61 -15.668 -1.208 9.364 408 HB2 LEU 61 HB2 LEU 61 -14.824 1.127 8.599 409 HB3 LEU 61 HB3 LEU 61 -16.501 0.889 8.986 410 HG LEU 61 HG LEU 61 -15.519 3.094 9.655 411 HD11 LEU 61 HD11 LEU 61 -17.573 2.344 10.660 412 HD12 LEU 61 HD12 LEU 61 -16.599 3.239 11.828 413 HD13 LEU 61 HD13 LEU 61 -16.677 1.476 11.903 414 HD21 LEU 61 HD21 LEU 61 -14.049 1.480 11.716 415 HD22 LEU 61 HD22 LEU 61 -14.211 3.239 11.718 416 HD23 LEU 61 HD23 LEU 61 -13.343 2.431 10.411 417 HA PRO 62 HA PRO 62 -11.456 -2.377 9.451 418 HB2 PRO 62 HB2 PRO 62 -10.494 -1.869 6.989 419 HB3 PRO 62 HB3 PRO 62 -11.607 -3.209 7.348 420 HG2 PRO 62 HG2 PRO 62 -12.185 -0.529 6.157 421 HG3 PRO 62 HG3 PRO 62 -12.851 -2.116 5.728 422 HD2 PRO 62 HD2 PRO 62 -14.201 -0.323 7.235 423 HD3 PRO 62 HD3 PRO 62 -14.385 -2.077 7.434 424 H THR 63 H THR 63 -9.172 -1.763 8.510 425 HA THR 63 HA THR 63 -8.573 1.057 8.879 426 HB THR 63 HB THR 63 -7.343 -1.117 10.619 427 HG1 THR 63 HG1 THR 63 -9.528 0.517 10.999 428 HG21 THR 63 HG21 THR 63 -6.256 0.760 11.751 429 HG22 THR 63 HG22 THR 63 -6.968 1.861 10.569 430 HG23 THR 63 HG23 THR 63 -5.799 0.647 10.050 431 H ALA 64 H ALA 64 -7.425 1.380 7.030 432 HA ALA 64 HA ALA 64 -5.622 -0.723 6.089 433 HB1 ALA 64 HB1 ALA 64 -7.138 0.296 4.469 434 HB2 ALA 64 HB2 ALA 64 -5.446 0.572 4.047 435 HB3 ALA 64 HB3 ALA 64 -6.400 1.867 4.775 436 H ARG 65 H ARG 65 -3.655 -0.687 6.874 437 HA ARG 65 HA ARG 65 -2.132 1.805 6.852 438 HB2 ARG 65 HB2 ARG 65 -2.350 -0.074 9.217 439 HB3 ARG 65 HB3 ARG 65 -1.024 1.062 9.029 440 HG2 ARG 65 HG2 ARG 65 -2.521 2.927 9.186 441 HG3 ARG 65 HG3 ARG 65 -3.922 1.859 9.145 442 HD2 ARG 65 HD2 ARG 65 -3.239 0.888 11.284 443 HD3 ARG 65 HD3 ARG 65 -1.838 1.961 11.321 444 HE ARG 65 HE ARG 65 -3.975 3.644 11.044 445 HH11 ARG 65 HH11 ARG 65 -3.101 1.192 13.372 446 HH12 ARG 65 HH12 ARG 65 -3.923 1.965 14.690 447 HH21 ARG 65 HH21 ARG 65 -5.088 4.641 12.735 448 HH22 ARG 65 HH22 ARG 65 -5.062 3.946 14.324 449 H PHE 66 H PHE 66 0.090 1.438 6.343 450 HA PHE 66 HA PHE 66 1.189 -1.195 6.369 451 HB2 PHE 66 HB2 PHE 66 1.704 -1.376 3.954 452 HB3 PHE 66 HB3 PHE 66 -0.007 -1.497 4.285 453 HD1 PHE 66 HD2 PHE 66 -1.177 1.029 4.157 454 HD2 PHE 66 HD1 PHE 66 2.237 -0.348 2.025 455 HE1 PHE 66 HE2 PHE 66 -1.632 2.664 2.385 456 HE2 PHE 66 HE1 PHE 66 1.773 1.276 0.252 457 HZ PHE 66 HZ PHE 66 -0.162 2.779 0.432 458 H THR 67 H THR 67 3.442 -1.270 5.885 459 HA THR 67 HA THR 67 4.715 1.363 5.615 460 HB THR 67 HB THR 67 4.905 0.443 7.974 461 HG1 THR 67 HG1 THR 67 6.460 1.914 7.265 462 HG21 THR 67 HG21 THR 67 6.550 -1.337 8.396 463 HG22 THR 67 HG22 THR 67 6.691 -1.611 6.660 464 HG23 THR 67 HG23 THR 67 5.165 -1.937 7.478 465 H SER 68 H SER 68 6.854 1.278 4.643 466 HA SER 68 HA SER 68 7.255 -1.089 2.951 467 HB2 SER 68 HB2 SER 68 8.160 0.503 1.222 468 HB3 SER 68 HB3 SER 68 6.431 0.645 1.523 469 HG SER 68 HG SER 68 8.300 2.525 1.714 470 H ASP 69 H ASP 69 9.519 -1.250 2.122 471 HA ASP 69 HA ASP 69 11.403 -1.243 4.223 472 HB2 ASP 69 HB2 ASP 69 11.421 -2.795 2.277 473 HB3 ASP 69 HB3 ASP 69 11.905 -1.457 1.246 474 H ILE 70 H ILE 70 11.289 0.671 1.230 475 HA ILE 70 HA ILE 70 12.484 2.861 2.748 476 HB ILE 70 HB ILE 70 13.311 3.755 0.497 477 HG12 ILE 70 HG12 ILE 70 13.970 1.551 -0.930 478 HG13 ILE 70 HG13 ILE 70 12.391 1.059 -0.332 479 HG21 ILE 70 HG21 ILE 70 14.581 1.303 1.680 480 HG22 ILE 70 HG22 ILE 70 14.831 2.978 2.175 481 HG23 ILE 70 HG23 ILE 70 15.381 2.433 0.590 482 HD11 ILE 70 HD11 ILE 70 11.406 3.067 -1.322 483 HD12 ILE 70 HD12 ILE 70 12.206 2.055 -2.525 484 HD13 ILE 70 HD13 ILE 70 12.988 3.529 -1.949 485 H THR 71 H THR 71 11.623 4.785 2.622 486 HA THR 71 HA THR 71 9.242 5.176 0.922 487 HB THR 71 HB THR 71 9.324 7.185 2.934 488 HG1 THR 71 HG1 THR 71 10.355 6.091 4.469 489 HG21 THR 71 HG21 THR 71 7.320 6.285 1.888 490 HG22 THR 71 HG22 THR 71 7.227 6.162 3.644 491 HG23 THR 71 HG23 THR 71 7.600 4.732 2.679 492 H GLU 72 H GLU 72 12.388 6.031 1.746 493 HA GLU 72 HA GLU 72 12.539 8.099 -0.269 494 HB2 GLU 72 HB2 GLU 72 12.067 9.280 1.912 495 HB3 GLU 72 HB3 GLU 72 13.539 8.572 2.563 496 HG2 GLU 72 HG2 GLU 72 13.977 10.839 1.892 497 HG3 GLU 72 HG3 GLU 72 14.823 9.742 0.803 498 H GLY 73 H GLY 73 14.559 8.058 -1.227 499 HA2 GLY 73 HA2 GLY 73 16.997 7.404 -0.730 500 HA3 GLY 73 HA3 GLY 73 16.283 5.833 -0.350 501 H PHE 74 H PHE 74 18.023 5.540 -2.219 502 HA PHE 74 HA PHE 74 17.100 6.321 -4.847 503 HB2 PHE 74 HB2 PHE 74 19.076 5.252 -5.724 504 HB3 PHE 74 HB3 PHE 74 19.536 6.194 -4.321 505 HD1 PHE 74 HD1 PHE 74 20.098 5.009 -2.185 506 HD2 PHE 74 HD2 PHE 74 19.453 2.920 -5.834 507 HE1 PHE 74 HE1 PHE 74 21.251 3.047 -1.266 508 HE2 PHE 74 HE2 PHE 74 20.598 0.948 -4.919 509 HZ PHE 74 HZ PHE 74 21.498 1.012 -2.629 510 H ALA 75 H ALA 75 16.345 4.946 -6.455 511 HA ALA 75 HA ALA 75 14.547 2.965 -5.868 512 HB1 ALA 75 HB1 ALA 75 14.644 4.155 -8.012 513 HB2 ALA 75 HB2 ALA 75 14.538 2.407 -8.231 514 HB3 ALA 75 HB3 ALA 75 16.082 3.229 -8.456 515 HA PRO 76 HA PRO 76 17.322 -0.529 -5.236 516 HB2 PRO 76 HB2 PRO 76 15.792 -1.827 -3.471 517 HB3 PRO 76 HB3 PRO 76 16.644 -0.348 -3.012 518 HG2 PRO 76 HG2 PRO 76 13.759 -0.783 -3.539 519 HG3 PRO 76 HG3 PRO 76 14.544 0.413 -2.495 520 HD2 PRO 76 HD2 PRO 76 13.568 0.774 -5.163 521 HD3 PRO 76 HD3 PRO 76 14.403 1.958 -4.140 522 H LEU 77 H LEU 77 16.299 -3.083 -4.895 523 HA LEU 77 HA LEU 77 14.892 -3.553 -7.377 524 HB2 LEU 77 HB2 LEU 77 15.206 -6.011 -6.692 525 HB3 LEU 77 HB3 LEU 77 16.601 -5.092 -7.207 526 HG LEU 77 HG LEU 77 16.276 -4.984 -4.317 527 HD11 LEU 77 HD11 LEU 77 15.235 -7.163 -4.628 528 HD12 LEU 77 HD12 LEU 77 16.821 -7.317 -3.871 529 HD13 LEU 77 HD13 LEU 77 16.620 -7.697 -5.583 530 HD21 LEU 77 HD21 LEU 77 18.319 -4.376 -5.510 531 HD22 LEU 77 HD22 LEU 77 18.467 -6.028 -6.112 532 HD23 LEU 77 HD23 LEU 77 18.610 -5.702 -4.384 533 H SER 78 H SER 78 14.382 -5.247 -4.317 534 HA SER 78 HA SER 78 11.501 -4.999 -4.844 535 HB2 SER 78 HB2 SER 78 12.962 -7.084 -3.212 536 HB3 SER 78 HB3 SER 78 11.232 -7.055 -3.546 537 HG SER 78 HG SER 78 12.568 -8.423 -4.951 538 H VAL 79 H VAL 79 10.374 -3.740 -3.604 539 HA VAL 79 HA VAL 79 11.443 -2.779 -1.073 540 HB VAL 79 HB VAL 79 8.875 -1.966 -2.475 541 HG11 VAL 79 HG11 VAL 79 8.859 -1.474 -0.078 542 HG12 VAL 79 HG12 VAL 79 8.942 0.006 -1.034 543 HG13 VAL 79 HG13 VAL 79 10.391 -0.616 -0.242 544 HG21 VAL 79 HG21 VAL 79 10.802 -1.435 -3.856 545 HG22 VAL 79 HG22 VAL 79 11.583 -0.640 -2.488 546 HG23 VAL 79 HG23 VAL 79 10.107 0.037 -3.177 547 H ARG 80 H ARG 80 10.896 -3.579 0.795 548 HA ARG 80 HA ARG 80 9.127 -5.812 1.029 549 HB2 ARG 80 HB2 ARG 80 10.679 -4.233 3.086 550 HB3 ARG 80 HB3 ARG 80 9.784 -5.705 3.445 551 HG2 ARG 80 HG2 ARG 80 11.241 -7.025 2.141 552 HG3 ARG 80 HG3 ARG 80 11.959 -5.605 1.379 553 HD2 ARG 80 HD2 ARG 80 12.977 -4.947 3.451 554 HD3 ARG 80 HD3 ARG 80 12.180 -6.261 4.314 555 HE ARG 80 HE ARG 80 13.561 -7.805 3.052 556 HH11 ARG 80 HH11 ARG 80 14.611 -4.430 2.961 557 HH12 ARG 80 HH12 ARG 80 16.263 -4.855 2.636 558 HH21 ARG 80 HH21 ARG 80 15.716 -8.312 2.642 559 HH22 ARG 80 HH22 ARG 80 16.884 -7.040 2.450 560 H PHE 81 H PHE 81 7.079 -5.895 1.800 561 HA PHE 81 HA PHE 81 5.933 -3.379 2.817 562 HB2 PHE 81 HB2 PHE 81 4.587 -5.397 0.996 563 HB3 PHE 81 HB3 PHE 81 3.771 -4.042 1.760 564 HD1 PHE 81 HD2 PHE 81 4.881 -1.686 1.273 565 HD2 PHE 81 HD1 PHE 81 5.327 -5.158 -1.149 566 HE1 PHE 81 HE2 PHE 81 5.453 -0.267 -0.652 567 HE2 PHE 81 HE1 PHE 81 5.899 -3.744 -3.078 568 HZ PHE 81 HZ PHE 81 5.963 -1.296 -2.832 569 H LYS 82 H LYS 82 5.231 -3.558 4.813 570 HA LYS 82 HA LYS 82 4.008 -6.104 5.649 571 HB2 LYS 82 HB2 LYS 82 5.306 -3.961 7.336 572 HB3 LYS 82 HB3 LYS 82 4.257 -5.195 8.014 573 HG2 LYS 82 HG2 LYS 82 5.865 -6.882 6.989 574 HG3 LYS 82 HG3 LYS 82 6.954 -5.514 6.755 575 HD2 LYS 82 HD2 LYS 82 5.750 -6.309 9.402 576 HD3 LYS 82 HD3 LYS 82 7.357 -6.781 8.854 577 HE2 LYS 82 HE2 LYS 82 6.460 -3.916 9.149 578 HE3 LYS 82 HE3 LYS 82 7.300 -4.811 10.417 579 HZ1 LYS 82 HZ1 LYS 82 8.819 -3.463 9.124 580 HZ2 LYS 82 HZ2 LYS 82 8.360 -4.252 7.694 581 HZ3 LYS 82 HZ3 LYS 82 9.167 -5.106 8.917 582 H ASP 83 H ASP 83 1.852 -6.009 5.617 583 HA ASP 83 HA ASP 83 0.588 -3.396 5.772 584 HB2 ASP 83 HB2 ASP 83 -1.394 -4.363 4.906 585 HB3 ASP 83 HB3 ASP 83 -0.072 -5.027 3.968 586 H PHE 84 H PHE 84 -0.916 -2.831 7.245 587 HA PHE 84 HA PHE 84 -0.928 -4.433 9.720 588 HB2 PHE 84 HB2 PHE 84 -0.798 -1.413 9.461 589 HB3 PHE 84 HB3 PHE 84 -0.936 -2.296 10.974 590 HD1 PHE 84 HD2 PHE 84 0.956 -4.060 11.406 591 HD2 PHE 84 HD1 PHE 84 1.272 -0.765 8.736 592 HE1 PHE 84 HE2 PHE 84 3.404 -4.182 11.556 593 HE2 PHE 84 HE1 PHE 84 3.719 -0.882 8.882 594 HZ PHE 84 HZ PHE 84 4.791 -2.591 10.290 595 H SER 85 H SER 85 -2.726 -4.266 7.416 596 HA SER 85 HA SER 85 -5.091 -2.922 7.927 597 HB2 SER 85 HB2 SER 85 -4.950 -5.680 6.734 598 HB3 SER 85 HB3 SER 85 -6.092 -4.381 6.360 599 HG SER 85 HG SER 85 -3.590 -4.858 5.358 600 H GLU 86 H GLU 86 -6.585 -3.110 9.414 601 HA GLU 86 HA GLU 86 -6.773 -5.561 11.029 602 HB2 GLU 86 HB2 GLU 86 -5.292 -3.711 12.006 603 HB3 GLU 86 HB3 GLU 86 -6.765 -2.781 12.200 604 HG2 GLU 86 HG2 GLU 86 -7.658 -4.507 13.675 605 HG3 GLU 86 HG3 GLU 86 -6.182 -5.450 13.466 606 H ASN 87 H ASN 87 -8.841 -5.878 11.947 607 HA ASN 87 HA ASN 87 -11.117 -5.853 12.105 608 HB2 ASN 87 HB2 ASN 87 -10.921 -2.891 11.508 609 HB3 ASN 87 HB3 ASN 87 -12.329 -3.725 12.154 610 HD21 ASN 87 HD21 ASN 87 -9.366 -2.221 12.855 611 HD22 ASN 87 HD22 ASN 87 -9.338 -2.501 14.558 612 H ALA 88 H ALA 88 -9.865 -6.437 9.601 613 HA ALA 88 HA ALA 88 -11.893 -5.525 7.663 614 HB1 ALA 88 HB1 ALA 88 -8.984 -6.121 7.143 615 HB2 ALA 88 HB2 ALA 88 -9.720 -4.518 7.185 616 HB3 ALA 88 HB3 ALA 88 -10.176 -5.668 5.925 617 H THR 89 H THR 89 -12.707 -7.036 6.247 618 HA THR 89 HA THR 89 -12.083 -9.814 6.923 619 HB THR 89 HB THR 89 -14.469 -9.078 7.154 620 HG1 THR 89 HG1 THR 89 -14.669 -11.151 6.879 621 HG21 THR 89 HG21 THR 89 -15.841 -8.839 5.142 622 HG22 THR 89 HG22 THR 89 -14.394 -8.922 4.138 623 HG23 THR 89 HG23 THR 89 -14.620 -7.566 5.242 624 H SER 90 H SER 90 -11.803 -7.452 4.405 625 HA SER 90 HA SER 90 -10.442 -9.422 2.730 626 HB2 SER 90 HB2 SER 90 -12.497 -7.463 1.655 627 HB3 SER 90 HB3 SER 90 -11.519 -8.565 0.694 628 HG SER 90 HG SER 90 -12.698 -10.075 2.468 629 H ARG 91 H ARG 91 -8.894 -8.466 1.305 630 HA ARG 91 HA ARG 91 -8.349 -5.622 1.779 631 HB2 ARG 91 HB2 ARG 91 -5.891 -6.164 1.610 632 HB3 ARG 91 HB3 ARG 91 -6.681 -6.716 3.075 633 HG2 ARG 91 HG2 ARG 91 -5.356 -8.510 2.549 634 HG3 ARG 91 HG3 ARG 91 -6.884 -8.973 1.799 635 HD2 ARG 91 HD2 ARG 91 -5.954 -7.933 -0.339 636 HD3 ARG 91 HD3 ARG 91 -4.389 -7.930 0.474 637 HE ARG 91 HE ARG 91 -4.605 -10.363 0.645 638 HH11 ARG 91 HH11 ARG 91 -6.711 -8.733 -1.645 639 HH12 ARG 91 HH12 ARG 91 -6.898 -10.128 -2.657 640 HH21 ARG 91 HH21 ARG 91 -4.855 -12.183 -0.690 641 HH22 ARG 91 HH22 ARG 91 -5.845 -12.081 -2.109 642 H LEU 92 H LEU 92 -6.977 -4.633 0.110 643 HA LEU 92 HA LEU 92 -7.050 -5.840 -2.542 644 HB2 LEU 92 HB2 LEU 92 -9.238 -4.529 -1.952 645 HB3 LEU 92 HB3 LEU 92 -8.242 -3.106 -2.120 646 HG LEU 92 HG LEU 92 -8.648 -5.101 -4.362 647 HD11 LEU 92 HD11 LEU 92 -10.153 -2.561 -3.753 648 HD12 LEU 92 HD12 LEU 92 -10.795 -4.205 -3.691 649 HD13 LEU 92 HD13 LEU 92 -10.291 -3.512 -5.232 650 HD21 LEU 92 HD21 LEU 92 -6.703 -3.625 -4.623 651 HD22 LEU 92 HD22 LEU 92 -7.740 -2.219 -4.378 652 HD23 LEU 92 HD23 LEU 92 -7.970 -3.249 -5.791 653 H TRP 93 H TRP 93 -4.991 -5.546 -3.184 654 HA TRP 93 HA TRP 93 -3.519 -3.206 -2.297 655 HB2 TRP 93 HB2 TRP 93 -2.747 -5.764 -3.643 656 HB3 TRP 93 HB3 TRP 93 -1.668 -4.378 -3.715 657 HD1 TRP 93 HD1 TRP 93 -2.688 -7.203 -1.484 658 HE1 TRP 93 HE1 TRP 93 -1.379 -7.058 0.732 659 HE3 TRP 93 HE3 TRP 93 -0.748 -2.495 -1.975 660 HZ2 TRP 93 HZ2 TRP 93 0.231 -5.194 2.101 661 HZ3 TRP 93 HZ3 TRP 93 0.664 -1.608 -0.166 662 HH2 TRP 93 HH2 TRP 93 1.141 -2.929 1.827 663 H MET 94 H MET 94 -3.392 -1.440 -3.423 664 HA MET 94 HA MET 94 -4.026 -1.519 -6.289 665 HB2 MET 94 HB2 MET 94 -4.058 0.730 -4.286 666 HB3 MET 94 HB3 MET 94 -4.168 1.004 -6.015 667 HG2 MET 94 HG2 MET 94 -6.070 -0.760 -4.532 668 HG3 MET 94 HG3 MET 94 -6.333 0.971 -4.737 669 HE1 MET 94 HE1 MET 94 -6.396 2.092 -7.269 670 HE2 MET 94 HE2 MET 94 -6.412 1.103 -8.734 671 HE3 MET 94 HE3 MET 94 -4.963 1.182 -7.732 672 H PHE 95 H PHE 95 -2.023 -2.253 -6.988 673 HA PHE 95 HA PHE 95 0.361 -0.748 -6.431 674 HB2 PHE 95 HB2 PHE 95 0.307 -3.220 -6.842 675 HB3 PHE 95 HB3 PHE 95 -0.138 -2.894 -8.514 676 HD1 PHE 95 HD1 PHE 95 2.504 -2.096 -6.011 677 HD2 PHE 95 HD2 PHE 95 1.522 -2.727 -10.102 678 HE1 PHE 95 HE1 PHE 95 4.881 -1.948 -6.604 679 HE2 PHE 95 HE2 PHE 95 3.901 -2.578 -10.697 680 HZ PHE 95 HZ PHE 95 5.581 -2.190 -8.950 681 H GLY 96 H GLY 96 -2.064 -0.933 -8.956 682 HA2 GLY 96 HA2 GLY 96 -2.595 0.870 -10.391 683 HA3 GLY 96 HA3 GLY 96 -0.971 1.500 -10.163 684 H ASP 97 H ASP 97 -0.705 -1.739 -10.740 685 HA ASP 97 HA ASP 97 -0.500 -1.369 -13.644 686 HB2 ASP 97 HB2 ASP 97 1.647 -2.454 -11.819 687 HB3 ASP 97 HB3 ASP 97 1.576 -2.938 -13.509 688 H GLY 98 H GLY 98 -1.928 -2.638 -14.503 689 HA2 GLY 98 HA2 GLY 98 -2.754 -4.653 -15.278 690 HA3 GLY 98 HA3 GLY 98 -1.682 -5.488 -14.168 691 H ASN 99 H ASN 99 -2.892 -6.819 -13.055 692 HA ASN 99 HA ASN 99 -5.613 -6.210 -12.357 693 HB2 ASN 99 HB2 ASN 99 -3.855 -8.593 -11.757 694 HB3 ASN 99 HB3 ASN 99 -5.501 -8.441 -11.153 695 HD21 ASN 99 HD21 ASN 99 -4.318 -10.383 -12.971 696 HD22 ASN 99 HD22 ASN 99 -5.287 -10.333 -14.403 697 H THR 100 H THR 100 -6.283 -5.214 -10.646 698 HA THR 100 HA THR 100 -4.506 -4.649 -8.441 699 HB THR 100 HB THR 100 -6.519 -3.455 -7.497 700 HG1 THR 100 HG1 THR 100 -8.148 -3.105 -9.301 701 HG21 THR 100 HG21 THR 100 -6.425 -1.622 -9.115 702 HG22 THR 100 HG22 THR 100 -5.667 -2.696 -10.295 703 HG23 THR 100 HG23 THR 100 -4.818 -2.280 -8.805 704 H SER 101 H SER 101 -5.529 -4.851 -6.181 705 HA SER 101 HA SER 101 -5.731 -6.242 -4.421 706 HB2 SER 101 HB2 SER 101 -8.106 -6.432 -5.439 707 HB3 SER 101 HB3 SER 101 -7.586 -8.012 -6.023 708 HG SER 101 HG SER 101 -7.912 -8.745 -4.096 709 H ASP 102 H ASP 102 -3.530 -6.488 -5.747 710 HA ASP 102 HA ASP 102 -3.021 -9.142 -6.716 711 HB2 ASP 102 HB2 ASP 102 -0.701 -8.273 -7.074 712 HB3 ASP 102 HB3 ASP 102 -1.948 -7.333 -7.871 713 H SER 103 H SER 103 -0.527 -9.738 -5.906 714 HA SER 103 HA SER 103 -1.008 -11.218 -3.588 715 HB2 SER 103 HB2 SER 103 1.646 -10.569 -4.879 716 HB3 SER 103 HB3 SER 103 1.332 -11.898 -3.762 717 HG SER 103 HG SER 103 -0.460 -12.093 -5.670 718 HA PRO 104 HA PRO 104 0.124 -8.231 -0.433 719 HB2 PRO 104 HB2 PRO 104 -0.439 -10.259 1.525 720 HB3 PRO 104 HB3 PRO 104 -1.415 -8.856 1.094 721 HG2 PRO 104 HG2 PRO 104 -2.157 -11.441 0.596 722 HG3 PRO 104 HG3 PRO 104 -2.725 -10.050 -0.342 723 HD2 PRO 104 HD2 PRO 104 -0.557 -12.011 -0.984 724 HD3 PRO 104 HD3 PRO 104 -1.802 -11.311 -2.047 725 H SER 105 H SER 105 2.305 -8.795 -1.424 726 HA SER 105 HA SER 105 4.067 -9.997 0.555 727 HB2 SER 105 HB2 SER 105 3.936 -10.892 -2.353 728 HB3 SER 105 HB3 SER 105 5.201 -11.362 -1.215 729 HG SER 105 HG SER 105 2.943 -11.910 -0.021 730 HA PRO 106 HA PRO 106 6.740 -6.647 -0.906 731 HB2 PRO 106 HB2 PRO 106 9.060 -8.272 -0.162 732 HB3 PRO 106 HB3 PRO 106 8.466 -6.768 0.543 733 HG2 PRO 106 HG2 PRO 106 8.309 -9.079 1.875 734 HG3 PRO 106 HG3 PRO 106 7.037 -7.845 1.989 735 HD2 PRO 106 HD2 PRO 106 7.111 -10.324 0.302 736 HD3 PRO 106 HD3 PRO 106 5.801 -9.725 1.345 737 H LEU 107 H LEU 107 6.184 -9.087 -2.768 738 HA LEU 107 HA LEU 107 8.637 -9.227 -4.325 739 HB2 LEU 107 HB2 LEU 107 6.697 -11.062 -3.736 740 HB3 LEU 107 HB3 LEU 107 6.172 -10.524 -5.315 741 HG LEU 107 HG LEU 107 8.939 -11.610 -4.764 742 HD11 LEU 107 HD11 LEU 107 7.276 -13.310 -4.293 743 HD12 LEU 107 HD12 LEU 107 8.136 -13.682 -5.789 744 HD13 LEU 107 HD13 LEU 107 6.505 -13.010 -5.851 745 HD21 LEU 107 HD21 LEU 107 8.786 -10.204 -6.764 746 HD22 LEU 107 HD22 LEU 107 7.439 -11.181 -7.349 747 HD23 LEU 107 HD23 LEU 107 9.043 -11.897 -7.186 748 H HIS 108 H HIS 108 8.293 -6.812 -4.587 749 HA HIS 108 HA HIS 108 7.080 -6.377 -7.212 750 HB2 HIS 108 HB2 HIS 108 6.616 -4.636 -4.778 751 HB3 HIS 108 HB3 HIS 108 6.432 -4.018 -6.412 752 HD1 HIS 108 HD1 HIS 108 4.641 -5.572 -7.902 753 HD2 HIS 108 HD2 HIS 108 4.305 -5.608 -3.751 754 HE1 HIS 108 HE1 HIS 108 2.308 -6.380 -7.424 755 HE2 HIS 108 HE2 HIS 108 2.066 -6.239 -4.929 756 H THR 109 H THR 109 8.804 -6.075 -8.397 757 HA THR 109 HA THR 109 11.142 -4.735 -7.245 758 HB THR 109 HB THR 109 10.967 -6.351 -9.803 759 HG1 THR 109 HG1 THR 109 11.547 -7.118 -7.122 760 HG21 THR 109 HG21 THR 109 13.333 -5.561 -8.094 761 HG22 THR 109 HG22 THR 109 12.919 -4.869 -9.662 762 HG23 THR 109 HG23 THR 109 13.394 -6.564 -9.549 763 H PHE 110 H PHE 110 11.730 -2.785 -7.879 764 HA PHE 110 HA PHE 110 10.384 -1.562 -10.194 765 HB2 PHE 110 HB2 PHE 110 11.694 -0.248 -7.791 766 HB3 PHE 110 HB3 PHE 110 10.932 0.608 -9.125 767 HD1 PHE 110 HD1 PHE 110 8.494 0.565 -9.402 768 HD2 PHE 110 HD2 PHE 110 10.384 -1.270 -6.058 769 HE1 PHE 110 HE1 PHE 110 6.339 0.482 -8.223 770 HE2 PHE 110 HE2 PHE 110 8.229 -1.351 -4.876 771 HZ PHE 110 HZ PHE 110 6.205 -0.472 -5.962 772 H PHE 111 H PHE 111 11.698 -1.924 -11.894 773 HA PHE 111 HA PHE 111 14.572 -1.634 -11.687 774 HB2 PHE 111 HB2 PHE 111 12.749 -2.219 -14.020 775 HB3 PHE 111 HB3 PHE 111 14.493 -2.061 -14.181 776 HD1 PHE 111 HD1 PHE 111 15.951 -3.656 -12.849 777 HD2 PHE 111 HD2 PHE 111 11.776 -4.249 -13.422 778 HE1 PHE 111 HE1 PHE 111 16.217 -6.038 -12.304 779 HE2 PHE 111 HE2 PHE 111 12.037 -6.632 -12.874 780 HZ PHE 111 HZ PHE 111 14.259 -7.525 -12.315 781 H ASN 112 H ASN 112 11.926 0.398 -12.307 782 HA ASN 112 HA ASN 112 13.660 2.408 -13.566 783 HB2 ASN 112 HB2 ASN 112 10.651 2.091 -13.572 784 HB3 ASN 112 HB3 ASN 112 11.465 3.552 -14.116 785 HD21 ASN 112 HD21 ASN 112 9.773 1.557 -15.516 786 HD22 ASN 112 HD22 ASN 112 10.718 1.055 -16.876 787 H GLU 113 H GLU 113 13.820 4.408 -12.670 788 HA GLU 113 HA GLU 113 13.028 4.692 -9.891 789 HB2 GLU 113 HB2 GLU 113 14.549 6.575 -9.804 790 HB3 GLU 113 HB3 GLU 113 15.351 5.228 -10.583 791 HG2 GLU 113 HG2 GLU 113 14.183 7.624 -12.000 792 HG3 GLU 113 HG3 GLU 113 15.886 7.395 -11.619 793 H GLY 114 H GLY 114 12.374 7.054 -9.266 794 HA2 GLY 114 HA2 GLY 114 11.135 8.980 -10.465 795 HA3 GLY 114 HA3 GLY 114 10.033 7.686 -10.923 796 H GLU 115 H GLU 115 8.230 8.024 -9.761 797 HA GLU 115 HA GLU 115 8.472 7.884 -6.862 798 HB2 GLU 115 HB2 GLU 115 8.238 10.330 -7.938 799 HB3 GLU 115 HB3 GLU 115 6.537 9.886 -7.896 800 HG2 GLU 115 HG2 GLU 115 6.529 9.674 -5.567 801 HG3 GLU 115 HG3 GLU 115 8.289 9.647 -5.479 802 H TYR 116 H TYR 116 7.144 6.378 -6.162 803 HA TYR 116 HA TYR 116 4.973 5.506 -7.966 804 HB2 TYR 116 HB2 TYR 116 6.879 3.821 -6.320 805 HB3 TYR 116 HB3 TYR 116 5.489 3.182 -7.190 806 HD1 TYR 116 HD1 TYR 116 5.439 3.209 -9.637 807 HD2 TYR 116 HD2 TYR 116 8.889 4.448 -7.482 808 HE1 TYR 116 HE1 TYR 116 6.764 3.084 -11.698 809 HE2 TYR 116 HE2 TYR 116 10.225 4.322 -9.538 810 HH TYR 116 HH TYR 116 10.187 3.280 -11.689 811 H ILE 117 H ILE 117 3.037 5.614 -7.092 812 HA ILE 117 HA ILE 117 2.850 5.903 -4.190 813 HB ILE 117 HB ILE 117 0.669 6.478 -6.211 814 HG12 ILE 117 HG12 ILE 117 2.582 8.426 -4.899 815 HG13 ILE 117 HG13 ILE 117 2.719 7.882 -6.565 816 HG21 ILE 117 HG21 ILE 117 -0.245 7.815 -4.340 817 HG22 ILE 117 HG22 ILE 117 1.055 7.217 -3.306 818 HG23 ILE 117 HG23 ILE 117 -0.143 6.096 -3.961 819 HD11 ILE 117 HD11 ILE 117 0.423 9.443 -5.405 820 HD12 ILE 117 HD12 ILE 117 0.561 8.900 -7.077 821 HD13 ILE 117 HD13 ILE 117 1.705 10.079 -6.436 822 H VAL 118 H VAL 118 2.619 4.053 -3.205 823 HA VAL 118 HA VAL 118 1.035 1.882 -4.335 824 HB VAL 118 HB VAL 118 2.629 1.939 -1.746 825 HG11 VAL 118 HG11 VAL 118 0.909 0.214 -1.710 826 HG12 VAL 118 HG12 VAL 118 2.511 -0.512 -1.848 827 HG13 VAL 118 HG13 VAL 118 1.472 -0.399 -3.269 828 HG21 VAL 118 HG21 VAL 118 4.342 0.663 -2.939 829 HG22 VAL 118 HG22 VAL 118 4.107 2.262 -3.649 830 HG23 VAL 118 HG23 VAL 118 3.425 0.838 -4.437 831 H SER 119 H SER 119 -0.991 1.421 -3.635 832 HA SER 119 HA SER 119 -1.942 2.808 -1.216 833 HB2 SER 119 HB2 SER 119 -3.577 2.120 -3.671 834 HB3 SER 119 HB3 SER 119 -4.145 2.973 -2.237 835 HG SER 119 HG SER 119 -3.183 4.063 -4.366 836 H LEU 120 H LEU 120 -3.379 1.740 0.102 837 HA LEU 120 HA LEU 120 -3.981 -1.076 -0.453 838 HB2 LEU 120 HB2 LEU 120 -2.053 -1.127 1.014 839 HB3 LEU 120 HB3 LEU 120 -2.782 0.035 2.092 840 HG LEU 120 HG LEU 120 -4.366 -1.631 2.902 841 HD11 LEU 120 HD11 LEU 120 -3.068 -3.554 0.968 842 HD12 LEU 120 HD12 LEU 120 -4.689 -2.884 0.796 843 HD13 LEU 120 HD13 LEU 120 -4.315 -3.945 2.156 844 HD21 LEU 120 HD21 LEU 120 -1.572 -2.716 2.782 845 HD22 LEU 120 HD22 LEU 120 -2.814 -3.149 3.956 846 HD23 LEU 120 HD23 LEU 120 -2.169 -1.509 3.920 847 H ILE 121 H ILE 121 -6.076 -1.330 -0.367 848 HA ILE 121 HA ILE 121 -7.612 0.292 1.521 849 HB ILE 121 HB ILE 121 -8.239 1.234 -0.551 850 HG12 ILE 121 HG12 ILE 121 -10.346 -0.863 0.029 851 HG13 ILE 121 HG13 ILE 121 -10.139 0.624 0.941 852 HG21 ILE 121 HG21 ILE 121 -8.516 -1.536 -1.697 853 HG22 ILE 121 HG22 ILE 121 -7.275 -0.344 -2.086 854 HG23 ILE 121 HG23 ILE 121 -8.957 -0.044 -2.528 855 HD11 ILE 121 HD11 ILE 121 -10.672 1.911 -1.065 856 HD12 ILE 121 HD12 ILE 121 -11.971 0.809 -0.611 857 HD13 ILE 121 HD13 ILE 121 -10.904 0.407 -1.956 858 H VAL 122 H VAL 122 -8.778 -0.833 2.885 859 HA VAL 122 HA VAL 122 -9.237 -3.665 2.273 860 HB VAL 122 HB VAL 122 -9.246 -4.085 4.748 861 HG11 VAL 122 HG11 VAL 122 -7.356 -4.695 3.371 862 HG12 VAL 122 HG12 VAL 122 -6.797 -4.112 4.938 863 HG13 VAL 122 HG13 VAL 122 -6.690 -3.069 3.519 864 HG21 VAL 122 HG21 VAL 122 -7.979 -1.350 4.874 865 HG22 VAL 122 HG22 VAL 122 -8.114 -2.495 6.210 866 HG23 VAL 122 HG23 VAL 122 -9.568 -1.783 5.509 867 H SER 123 H SER 123 -11.163 -4.557 3.431 868 HA SER 123 HA SER 123 -13.265 -2.552 3.625 869 HB2 SER 123 HB2 SER 123 -14.630 -3.931 1.990 870 HB3 SER 123 HB3 SER 123 -13.282 -3.036 1.287 871 HG SER 123 HG SER 123 -12.796 -4.931 0.505 872 H ASN 124 H ASN 124 -15.099 -3.219 4.619 873 HA ASN 124 HA ASN 124 -15.323 -5.980 5.533 874 HB2 ASN 124 HB2 ASN 124 -14.261 -4.421 7.332 875 HB3 ASN 124 HB3 ASN 124 -15.850 -3.682 7.437 876 HD21 ASN 124 HD21 ASN 124 -15.902 -4.337 9.643 877 HD22 ASN 124 HD22 ASN 124 -16.284 -5.976 10.062 878 H GLU 125 H GLU 125 -17.766 -5.693 6.858 879 HA GLU 125 HA GLU 125 -19.467 -5.215 4.594 880 HB2 GLU 125 HB2 GLU 125 -21.256 -6.017 6.269 881 HB3 GLU 125 HB3 GLU 125 -20.042 -7.152 5.704 882 HG2 GLU 125 HG2 GLU 125 -18.756 -6.595 7.818 883 HG3 GLU 125 HG3 GLU 125 -20.229 -5.800 8.374 884 H ASN 126 H ASN 126 -18.371 -3.204 6.994 885 HA ASN 126 HA ASN 126 -20.773 -1.544 7.049 886 HB2 ASN 126 HB2 ASN 126 -18.103 -1.128 8.419 887 HB3 ASN 126 HB3 ASN 126 -19.549 -0.153 8.661 888 HD21 ASN 126 HD21 ASN 126 -17.853 -2.969 9.535 889 HD22 ASN 126 HD22 ASN 126 -19.010 -3.602 10.645 890 H ASP 127 H ASP 127 -17.320 -1.182 6.263 891 HA ASP 127 HA ASP 127 -17.905 0.798 4.240 892 HB2 ASP 127 HB2 ASP 127 -17.919 1.971 6.512 893 HB3 ASP 127 HB3 ASP 127 -16.219 1.564 6.642 894 H SER 128 H SER 128 -15.736 1.589 3.292 895 HA SER 128 HA SER 128 -13.611 -0.410 3.663 896 HB2 SER 128 HB2 SER 128 -12.887 0.116 1.339 897 HB3 SER 128 HB3 SER 128 -14.506 -0.584 1.394 898 HG SER 128 HG SER 128 -13.927 2.198 1.233 899 H ASP 129 H ASP 129 -11.637 0.333 4.202 900 HA ASP 129 HA ASP 129 -11.326 3.261 4.429 901 HB2 ASP 129 HB2 ASP 129 -11.503 2.010 6.603 902 HB3 ASP 129 HB3 ASP 129 -10.053 1.115 6.162 903 H SER 130 H SER 130 -9.493 4.128 3.467 904 HA SER 130 HA SER 130 -7.524 2.214 2.429 905 HB2 SER 130 HB2 SER 130 -7.533 3.572 0.279 906 HB3 SER 130 HB3 SER 130 -8.937 2.545 0.567 907 HG SER 130 HG SER 130 -9.109 5.144 1.534 908 H ALA 131 H ALA 131 -5.482 2.814 2.505 909 HA ALA 131 HA ALA 131 -4.839 5.643 3.013 910 HB1 ALA 131 HB1 ALA 131 -4.428 4.334 5.037 911 HB2 ALA 131 HB2 ALA 131 -2.919 4.926 4.344 912 HB3 ALA 131 HB3 ALA 131 -3.388 3.238 4.130 913 H SER 132 H SER 132 -2.707 6.277 2.185 914 HA SER 132 HA SER 132 -1.671 4.602 0.033 915 HB2 SER 132 HB2 SER 132 -3.532 5.996 -0.904 916 HB3 SER 132 HB3 SER 132 -2.652 7.444 -0.416 917 HG SER 132 HG SER 132 -1.999 5.532 -2.391 918 H VAL 133 H VAL 133 0.495 5.137 -0.543 919 HA VAL 133 HA VAL 133 1.709 7.335 0.952 920 HB VAL 133 HB VAL 133 2.015 5.290 2.314 921 HG11 VAL 133 HG11 VAL 133 2.096 3.604 0.588 922 HG12 VAL 133 HG12 VAL 133 3.554 3.527 1.581 923 HG13 VAL 133 HG13 VAL 133 3.610 4.269 -0.019 924 HG21 VAL 133 HG21 VAL 133 4.450 5.503 2.640 925 HG22 VAL 133 HG22 VAL 133 3.635 7.063 2.514 926 HG23 VAL 133 HG23 VAL 133 4.543 6.428 1.142 927 H THR 134 H THR 134 3.223 8.423 -0.128 928 HA THR 134 HA THR 134 3.758 7.613 -2.871 929 HB THR 134 HB THR 134 4.562 10.197 -1.529 930 HG1 THR 134 HG1 THR 134 2.122 9.366 -1.835 931 HG21 THR 134 HG21 THR 134 4.545 11.066 -3.813 932 HG22 THR 134 HG22 THR 134 4.061 9.482 -4.419 933 HG23 THR 134 HG23 THR 134 5.646 9.695 -3.676 934 H ILE 135 H ILE 135 5.432 6.334 -3.154 935 HA ILE 135 HA ILE 135 7.706 6.355 -1.323 936 HB ILE 135 HB ILE 135 7.259 4.581 -3.742 937 HG12 ILE 135 HG12 ILE 135 5.372 4.256 -2.243 938 HG13 ILE 135 HG13 ILE 135 6.424 2.845 -2.187 939 HG21 ILE 135 HG21 ILE 135 8.822 3.045 -2.638 940 HG22 ILE 135 HG22 ILE 135 9.045 4.220 -1.341 941 HG23 ILE 135 HG23 ILE 135 9.557 4.612 -2.982 942 HD11 ILE 135 HD11 ILE 135 6.280 5.041 -0.134 943 HD12 ILE 135 HD12 ILE 135 7.354 3.643 -0.068 944 HD13 ILE 135 HD13 ILE 135 5.606 3.418 0.019 945 H ARG 136 H ARG 136 9.547 7.438 -1.809 946 HA ARG 136 HA ARG 136 9.671 8.591 -4.499 947 HB2 ARG 136 HB2 ARG 136 9.477 10.162 -2.559 948 HB3 ARG 136 HB3 ARG 136 11.039 9.581 -1.998 949 HG2 ARG 136 HG2 ARG 136 12.125 10.428 -3.961 950 HG3 ARG 136 HG3 ARG 136 10.574 10.860 -4.684 951 HD2 ARG 136 HD2 ARG 136 11.782 12.040 -2.189 952 HD3 ARG 136 HD3 ARG 136 11.692 12.814 -3.771 953 HE ARG 136 HE ARG 136 9.247 12.060 -2.311 954 HH11 ARG 136 HH11 ARG 136 11.195 14.474 -3.954 955 HH12 ARG 136 HH12 ARG 136 9.985 15.717 -3.806 956 HH21 ARG 136 HH21 ARG 136 7.681 13.690 -2.124 957 HH22 ARG 136 HH22 ARG 136 7.999 15.269 -2.773 958 H ALA 137 H ALA 137 11.129 7.872 -5.788 959 HA ALA 137 HA ALA 137 13.458 6.450 -4.717 960 HB1 ALA 137 HB1 ALA 137 13.646 5.410 -6.929 961 HB2 ALA 137 HB2 ALA 137 12.248 6.329 -7.488 962 HB3 ALA 137 HB3 ALA 137 12.058 5.110 -6.227 963 H LEU 138 H LEU 138 15.177 7.658 -4.602 964 HA LEU 138 HA LEU 138 15.426 10.213 -5.744 965 HB2 LEU 138 HB2 LEU 138 17.463 8.399 -4.460 966 HB3 LEU 138 HB3 LEU 138 17.815 10.042 -4.954 967 HG LEU 138 HG LEU 138 15.790 9.236 -2.845 968 HD11 LEU 138 HD11 LEU 138 18.497 10.536 -2.608 969 HD12 LEU 138 HD12 LEU 138 18.071 8.901 -2.099 970 HD13 LEU 138 HD13 LEU 138 17.351 10.293 -1.290 971 HD21 LEU 138 HD21 LEU 138 15.622 11.624 -2.396 972 HD22 LEU 138 HD22 LEU 138 15.120 11.257 -4.047 973 HD23 LEU 138 HD23 LEU 138 16.706 11.968 -3.744 974 H GLU 139 H GLU 139 16.286 10.948 -7.515 975 HA GLU 139 HA GLU 139 16.703 9.198 -9.707 976 HB2 GLU 139 HB2 GLU 139 17.255 11.325 -10.929 977 HB3 GLU 139 HB3 GLU 139 15.684 11.316 -10.141 978 HG2 GLU 139 HG2 GLU 139 16.501 12.699 -8.362 979 HG3 GLU 139 HG3 GLU 139 18.155 12.570 -8.957 980 H HIS 140 H HIS 140 18.532 8.798 -10.876 981 HA HIS 140 HA HIS 140 21.051 9.123 -9.455 982 HB2 HIS 140 HB2 HIS 140 21.974 7.495 -11.098 983 HB3 HIS 140 HB3 HIS 140 20.622 6.858 -10.191 984 HD1 HIS 140 HD1 HIS 140 21.929 7.029 -13.501 985 HD2 HIS 140 HD2 HIS 140 18.119 6.983 -11.864 986 HE1 HIS 140 HE1 HIS 140 20.405 6.336 -15.369 987 HE2 HIS 140 HE2 HIS 140 18.149 6.082 -14.287 988 H HIS 141 H HIS 141 22.494 10.597 -9.972 989 HA HIS 141 HA HIS 141 21.750 12.590 -11.876 990 HB2 HIS 141 HB2 HIS 141 22.768 13.153 -9.699 991 HB3 HIS 141 HB3 HIS 141 24.263 12.382 -10.201 992 HD1 HIS 141 HD1 HIS 141 22.079 15.351 -11.149 993 HD2 HIS 141 HD2 HIS 141 26.020 14.052 -11.453 994 HE1 HIS 141 HE1 HIS 141 23.356 17.287 -12.122 995 HE2 HIS 141 HE2 HIS 141 25.729 16.469 -12.333 996 H HIS 142 H HIS 142 24.006 9.905 -11.970 997 HA HIS 142 HA HIS 142 25.388 10.761 -14.313 998 HB2 HIS 142 HB2 HIS 142 26.265 9.003 -12.779 999 HB3 HIS 142 HB3 HIS 142 24.960 7.943 -13.277 1000 HD1 HIS 142 HD1 HIS 142 28.301 9.186 -14.304 1001 HD2 HIS 142 HD2 HIS 142 25.246 6.867 -15.906 1002 HE1 HIS 142 HE1 HIS 142 29.308 8.005 -16.283 1003 HE2 HIS 142 HE2 HIS 142 27.378 6.833 -17.371 1004 H HIS 143 H HIS 143 24.331 11.255 -16.044 1005 HA HIS 143 HA HIS 143 22.504 9.354 -17.301 1006 HB2 HIS 143 HB2 HIS 143 21.202 11.091 -15.900 1007 HB3 HIS 143 HB3 HIS 143 21.790 12.292 -17.040 1008 HD1 HIS 143 HD1 HIS 143 20.282 12.731 -18.950 1009 HD2 HIS 143 HD2 HIS 143 19.628 8.986 -17.278 1010 HE1 HIS 143 HE1 HIS 143 18.289 11.792 -20.164 1011 HE2 HIS 143 HE2 HIS 143 17.778 9.637 -18.966 1012 H HIS 144 H HIS 144 23.124 9.182 -19.419 1013 HA HIS 144 HA HIS 144 25.454 10.715 -20.109 1014 HB2 HIS 144 HB2 HIS 144 25.698 9.245 -22.064 1015 HB3 HIS 144 HB3 HIS 144 25.559 8.362 -20.559 1016 HD1 HIS 144 HD1 HIS 144 23.860 6.548 -20.469 1017 HD2 HIS 144 HD2 HIS 144 23.298 9.069 -23.731 1018 HE1 HIS 144 HE1 HIS 144 22.085 5.454 -21.872 1019 HE2 HIS 144 HE2 HIS 144 21.684 7.037 -23.780 1020 H HIS 145 H HIS 145 22.210 11.325 -20.749 1021 HA HIS 145 HA HIS 145 23.123 13.282 -22.745 1022 HB2 HIS 145 HB2 HIS 145 21.661 11.397 -23.717 1023 HB3 HIS 145 HB3 HIS 145 20.333 12.131 -22.818 1024 HD1 HIS 145 HD1 HIS 145 22.766 12.915 -25.606 1025 HD2 HIS 145 HD2 HIS 145 19.200 14.333 -24.005 1026 HE1 HIS 145 HE1 HIS 145 21.981 14.699 -27.189 1027 HE2 HIS 145 HE2 HIS 145 19.927 15.666 -26.105 Start of MODEL 8 1 H1 MET 1 H1 MET 1 -45.393 -50.172 4.863 2 H2 MET 1 H2 MET 1 -44.240 -50.541 6.053 3 H3 MET 1 H3 MET 1 -43.852 -49.481 4.792 4 HA MET 1 HA MET 1 -45.414 -47.887 5.548 5 HB2 MET 1 HB2 MET 1 -46.547 -48.222 7.739 6 HB3 MET 1 HB3 MET 1 -47.117 -49.295 6.474 7 HG2 MET 1 HG2 MET 1 -47.018 -50.682 8.302 8 HG3 MET 1 HG3 MET 1 -45.476 -51.011 7.519 9 HE1 MET 1 HE1 MET 1 -45.959 -51.934 10.453 10 HE2 MET 1 HE2 MET 1 -44.485 -51.391 11.254 11 HE3 MET 1 HE3 MET 1 -44.404 -52.094 9.634 12 H ASN 2 H ASN 2 -45.012 -46.422 7.414 13 HA ASN 2 HA ASN 2 -42.559 -46.926 8.904 14 HB2 ASN 2 HB2 ASN 2 -41.908 -45.968 6.647 15 HB3 ASN 2 HB3 ASN 2 -42.752 -44.499 7.103 16 HD21 ASN 2 HD21 ASN 2 -40.022 -44.801 6.405 17 HD22 ASN 2 HD22 ASN 2 -39.077 -44.285 7.766 18 H ALA 3 H ALA 3 -43.609 -46.650 10.818 19 HA ALA 3 HA ALA 3 -44.754 -43.985 11.290 20 HB1 ALA 3 HB1 ALA 3 -45.256 -46.515 12.860 21 HB2 ALA 3 HB2 ALA 3 -46.364 -45.788 11.699 22 HB3 ALA 3 HB3 ALA 3 -45.966 -44.932 13.189 23 H ARG 4 H ARG 4 -42.901 -42.911 11.718 24 HA ARG 4 HA ARG 4 -40.919 -43.954 13.545 25 HB2 ARG 4 HB2 ARG 4 -40.284 -42.641 11.536 26 HB3 ARG 4 HB3 ARG 4 -41.105 -41.243 12.207 27 HG2 ARG 4 HG2 ARG 4 -39.532 -41.120 14.019 28 HG3 ARG 4 HG3 ARG 4 -38.777 -42.629 13.514 29 HD2 ARG 4 HD2 ARG 4 -37.352 -40.929 12.734 30 HD3 ARG 4 HD3 ARG 4 -38.254 -41.473 11.322 31 HE ARG 4 HE ARG 4 -38.908 -39.008 12.818 32 HH11 ARG 4 HH11 ARG 4 -38.618 -40.772 9.783 33 HH12 ARG 4 HH12 ARG 4 -38.939 -39.372 8.806 34 HH21 ARG 4 HH21 ARG 4 -39.307 -37.177 11.514 35 HH22 ARG 4 HH22 ARG 4 -39.305 -37.340 9.783 36 H ASP 5 H ASP 5 -41.169 -43.833 15.619 37 HA ASP 5 HA ASP 5 -42.661 -41.596 16.813 38 HB2 ASP 5 HB2 ASP 5 -43.638 -43.858 17.157 39 HB3 ASP 5 HB3 ASP 5 -42.150 -44.370 17.939 40 H ASN 6 H ASN 6 -41.536 -40.220 18.108 41 HA ASN 6 HA ASN 6 -38.875 -41.098 19.007 42 HB2 ASN 6 HB2 ASN 6 -37.965 -38.937 18.667 43 HB3 ASN 6 HB3 ASN 6 -38.890 -39.285 17.220 44 HD21 ASN 6 HD21 ASN 6 -40.763 -38.118 16.803 45 HD22 ASN 6 HD22 ASN 6 -41.128 -36.640 17.629 46 H LYS 7 H LYS 7 -38.153 -40.376 21.020 47 HA LYS 7 HA LYS 7 -40.073 -39.014 22.771 48 HB2 LYS 7 HB2 LYS 7 -38.579 -41.568 23.432 49 HB3 LYS 7 HB3 LYS 7 -39.293 -40.529 24.655 50 HG2 LYS 7 HG2 LYS 7 -41.503 -40.902 23.720 51 HG3 LYS 7 HG3 LYS 7 -40.805 -41.897 22.439 52 HD2 LYS 7 HD2 LYS 7 -39.962 -43.463 24.139 53 HD3 LYS 7 HD3 LYS 7 -40.707 -42.475 25.398 54 HE2 LYS 7 HE2 LYS 7 -42.909 -42.878 24.360 55 HE3 LYS 7 HE3 LYS 7 -42.129 -43.922 23.170 56 HZ1 LYS 7 HZ1 LYS 7 -43.077 -45.224 24.955 57 HZ2 LYS 7 HZ2 LYS 7 -42.182 -44.363 26.107 58 HZ3 LYS 7 HZ3 LYS 7 -41.386 -45.351 24.986 59 H PHE 8 H PHE 8 -39.033 -37.946 24.580 60 HA PHE 8 HA PHE 8 -36.157 -37.543 24.318 61 HB2 PHE 8 HB2 PHE 8 -36.353 -35.107 24.236 62 HB3 PHE 8 HB3 PHE 8 -37.150 -35.834 22.850 63 HD1 PHE 8 HD2 PHE 8 -39.695 -36.003 22.901 64 HD2 PHE 8 HD1 PHE 8 -37.483 -33.624 25.645 65 HE1 PHE 8 HE2 PHE 8 -41.716 -34.703 23.399 66 HE2 PHE 8 HE1 PHE 8 -39.504 -32.319 26.142 67 HZ PHE 8 HZ PHE 8 -41.623 -32.857 25.020 68 H ASN 9 H ASN 9 -35.168 -36.510 26.124 69 HA ASN 9 HA ASN 9 -36.819 -36.475 28.573 70 HB2 ASN 9 HB2 ASN 9 -34.935 -38.146 28.538 71 HB3 ASN 9 HB3 ASN 9 -33.806 -36.806 28.377 72 HD21 ASN 9 HD21 ASN 9 -32.758 -37.155 30.289 73 HD22 ASN 9 HD22 ASN 9 -33.496 -36.921 31.839 74 H THR 10 H THR 10 -37.457 -34.428 28.814 75 HA THR 10 HA THR 10 -35.862 -32.257 27.782 76 HB THR 10 HB THR 10 -38.240 -32.208 27.313 77 HG1 THR 10 HG1 THR 10 -38.149 -30.128 29.154 78 HG21 THR 10 HG21 THR 10 -39.095 -33.411 29.264 79 HG22 THR 10 HG22 THR 10 -39.930 -31.871 29.057 80 HG23 THR 10 HG23 THR 10 -38.686 -32.038 30.296 81 H TRP 11 H TRP 11 -34.955 -30.593 28.904 82 HA TRP 11 HA TRP 11 -34.566 -31.056 31.775 83 HB2 TRP 11 HB2 TRP 11 -32.904 -29.686 29.675 84 HB3 TRP 11 HB3 TRP 11 -32.634 -29.385 31.391 85 HD1 TRP 11 HD1 TRP 11 -31.699 -31.755 28.693 86 HE1 TRP 11 HE1 TRP 11 -30.456 -33.785 29.685 87 HE3 TRP 11 HE3 TRP 11 -32.737 -30.988 33.630 88 HZ2 TRP 11 HZ2 TRP 11 -29.991 -34.910 32.242 89 HZ3 TRP 11 HZ3 TRP 11 -31.873 -32.576 35.280 90 HH2 TRP 11 HH2 TRP 11 -30.525 -34.497 34.608 91 H ASN 12 H ASN 12 -36.033 -30.040 32.879 92 HA ASN 12 HA ASN 12 -36.336 -27.152 32.458 93 HB2 ASN 12 HB2 ASN 12 -38.456 -29.183 33.152 94 HB3 ASN 12 HB3 ASN 12 -38.667 -27.470 33.475 95 HD21 ASN 12 HD21 ASN 12 -38.923 -26.044 31.765 96 HD22 ASN 12 HD22 ASN 12 -39.324 -26.584 30.167 97 H ASP 13 H ASP 13 -35.351 -26.150 34.046 98 HA ASP 13 HA ASP 13 -35.291 -27.393 36.703 99 HB2 ASP 13 HB2 ASP 13 -33.360 -26.046 37.195 100 HB3 ASP 13 HB3 ASP 13 -33.100 -26.862 35.663 101 H SER 14 H SER 14 -35.543 -26.056 38.569 102 HA SER 14 HA SER 14 -37.010 -23.563 38.134 103 HB2 SER 14 HB2 SER 14 -38.017 -25.879 39.809 104 HB3 SER 14 HB3 SER 14 -38.733 -24.268 39.795 105 HG SER 14 HG SER 14 -38.414 -25.287 37.283 106 H ARG 15 H ARG 15 -36.707 -22.024 39.713 107 HA ARG 15 HA ARG 15 -34.696 -22.718 41.740 108 HB2 ARG 15 HB2 ARG 15 -33.927 -20.459 41.734 109 HB3 ARG 15 HB3 ARG 15 -34.030 -20.980 40.065 110 HG2 ARG 15 HG2 ARG 15 -36.224 -19.381 41.343 111 HG3 ARG 15 HG3 ARG 15 -34.796 -18.614 40.655 112 HD2 ARG 15 HD2 ARG 15 -36.616 -20.475 39.134 113 HD3 ARG 15 HD3 ARG 15 -36.772 -18.720 39.129 114 HE ARG 15 HE ARG 15 -34.351 -18.817 38.270 115 HH11 ARG 15 HH11 ARG 15 -36.804 -21.226 37.507 116 HH12 ARG 15 HH12 ARG 15 -36.142 -21.567 35.938 117 HH21 ARG 15 HH21 ARG 15 -33.522 -19.248 36.229 118 HH22 ARG 15 HH22 ARG 15 -34.273 -20.446 35.220 119 H GLY 16 H GLY 16 -34.839 -21.688 43.840 120 HA2 GLY 16 HA2 GLY 16 -37.485 -20.689 44.601 121 HA3 GLY 16 HA3 GLY 16 -36.900 -22.146 45.397 122 H ASN 17 H ASN 17 -37.137 -18.908 45.728 123 HA ASN 17 HA ASN 17 -34.514 -18.542 47.014 124 HB2 ASN 17 HB2 ASN 17 -36.553 -16.493 46.076 125 HB3 ASN 17 HB3 ASN 17 -35.026 -16.110 46.853 126 HD21 ASN 17 HD21 ASN 17 -33.104 -16.400 45.723 127 HD22 ASN 17 HD22 ASN 17 -33.077 -16.596 44.001 128 H TYR 18 H TYR 18 -34.341 -18.035 49.132 129 HA TYR 18 HA TYR 18 -36.796 -17.441 50.636 130 HB2 TYR 18 HB2 TYR 18 -34.568 -19.336 51.373 131 HB3 TYR 18 HB3 TYR 18 -35.554 -18.572 52.616 132 HD1 TYR 18 HD2 TYR 18 -38.014 -18.983 52.647 133 HD2 TYR 18 HD1 TYR 18 -35.403 -21.172 50.107 134 HE1 TYR 18 HE2 TYR 18 -39.747 -20.707 52.366 135 HE2 TYR 18 HE1 TYR 18 -37.130 -22.894 49.807 136 HH TYR 18 HH TYR 18 -39.087 -23.740 50.898 137 H TRP 19 H TRP 19 -36.681 -15.394 51.146 138 HA TRP 19 HA TRP 19 -34.086 -14.236 51.878 139 HB2 TRP 19 HB2 TRP 19 -34.886 -12.102 51.012 140 HB3 TRP 19 HB3 TRP 19 -35.010 -13.345 49.776 141 HD1 TRP 19 HD1 TRP 19 -37.676 -14.422 49.583 142 HE1 TRP 19 HE1 TRP 19 -39.877 -13.086 49.578 143 HE3 TRP 19 HE3 TRP 19 -36.007 -10.081 51.730 144 HZ2 TRP 19 HZ2 TRP 19 -40.782 -10.530 50.363 145 HZ3 TRP 19 HZ3 TRP 19 -37.603 -8.240 52.053 146 HH2 TRP 19 HH2 TRP 19 -39.939 -8.462 51.385 147 H SER 20 H SER 20 -34.163 -12.445 53.435 148 HA SER 20 HA SER 20 -36.464 -12.520 55.226 149 HB2 SER 20 HB2 SER 20 -34.837 -14.311 55.965 150 HB3 SER 20 HB3 SER 20 -33.666 -13.024 56.269 151 HG SER 20 HG SER 20 -36.161 -13.472 57.533 152 H ASP 21 H ASP 21 -36.899 -10.562 56.028 153 HA ASP 21 HA ASP 21 -34.778 -8.595 56.394 154 HB2 ASP 21 HB2 ASP 21 -35.956 -8.408 54.057 155 HB3 ASP 21 HB3 ASP 21 -37.298 -7.748 54.978 156 H TYR 22 H TYR 22 -36.002 -6.519 57.451 157 HA TYR 22 HA TYR 22 -37.462 -7.597 59.717 158 HB2 TYR 22 HB2 TYR 22 -35.614 -5.813 59.785 159 HB3 TYR 22 HB3 TYR 22 -36.842 -4.701 59.204 160 HD1 TYR 22 HD2 TYR 22 -36.112 -7.079 61.959 161 HD2 TYR 22 HD1 TYR 22 -38.264 -3.617 60.740 162 HE1 TYR 22 HE2 TYR 22 -36.864 -6.740 64.273 163 HE2 TYR 22 HE1 TYR 22 -39.023 -3.274 63.053 164 HH TYR 22 HH TYR 22 -37.679 -4.893 65.702 165 H GLU 23 H GLU 23 -39.599 -7.473 60.042 166 HA GLU 23 HA GLU 23 -41.127 -6.533 57.748 167 HB2 GLU 23 HB2 GLU 23 -42.885 -7.996 58.377 168 HB3 GLU 23 HB3 GLU 23 -41.389 -8.889 58.537 169 HG2 GLU 23 HG2 GLU 23 -42.850 -7.640 60.852 170 HG3 GLU 23 HG3 GLU 23 -43.095 -9.300 60.315 171 H GLY 24 H GLY 24 -40.669 -5.767 61.094 172 HA2 GLY 24 HA2 GLY 24 -43.141 -4.420 61.563 173 HA3 GLY 24 HA3 GLY 24 -41.686 -4.296 62.536 174 H SER 25 H SER 25 -43.656 -2.835 60.171 175 HA SER 25 HA SER 25 -41.772 -0.588 59.920 176 HB2 SER 25 HB2 SER 25 -43.785 -1.468 57.829 177 HB3 SER 25 HB3 SER 25 -42.541 -0.230 57.655 178 HG SER 25 HG SER 25 -42.062 -3.005 58.092 179 H ASP 26 H ASP 26 -42.681 0.507 61.648 180 HA ASP 26 HA ASP 26 -45.501 1.191 61.620 181 HB2 ASP 26 HB2 ASP 26 -44.396 0.729 63.775 182 HB3 ASP 26 HB3 ASP 26 -43.275 2.053 63.487 183 H GLU 27 H GLU 27 -46.164 2.733 60.313 184 HA GLU 27 HA GLU 27 -44.721 5.243 60.100 185 HB2 GLU 27 HB2 GLU 27 -43.830 3.602 58.372 186 HB3 GLU 27 HB3 GLU 27 -45.413 3.662 57.616 187 HG2 GLU 27 HG2 GLU 27 -45.157 6.014 57.154 188 HG3 GLU 27 HG3 GLU 27 -43.635 6.061 58.040 189 H ASN 28 H ASN 28 -46.046 6.947 59.366 190 HA ASN 28 HA ASN 28 -48.897 6.516 59.535 191 HB2 ASN 28 HB2 ASN 28 -47.714 8.553 60.446 192 HB3 ASN 28 HB3 ASN 28 -47.430 9.048 58.779 193 HD21 ASN 28 HD21 ASN 28 -49.908 8.317 61.137 194 HD22 ASN 28 HD22 ASN 28 -51.152 9.274 60.408 195 H GLY 29 H GLY 29 -50.194 6.090 57.870 196 HA2 GLY 29 HA2 GLY 29 -49.047 5.749 55.238 197 HA3 GLY 29 HA3 GLY 29 -50.663 5.286 55.745 198 H ASP 30 H ASP 30 -50.056 6.463 53.295 199 HA ASP 30 HA ASP 30 -50.933 9.237 53.420 200 HB2 ASP 30 HB2 ASP 30 -49.147 8.574 51.826 201 HB3 ASP 30 HB3 ASP 30 -50.282 7.506 51.008 202 H GLY 31 H GLY 31 -52.996 9.525 53.768 203 HA2 GLY 31 HA2 GLY 31 -54.917 8.300 51.946 204 HA3 GLY 31 HA3 GLY 31 -55.181 8.074 53.672 205 H ILE 32 H ILE 32 -57.121 9.334 52.247 206 HA ILE 32 HA ILE 32 -56.620 12.180 52.303 207 HB ILE 32 HB ILE 32 -59.024 12.377 51.520 208 HG12 ILE 32 HG12 ILE 32 -58.783 9.407 50.968 209 HG13 ILE 32 HG13 ILE 32 -59.683 10.040 52.340 210 HG21 ILE 32 HG21 ILE 32 -57.132 12.570 50.041 211 HG22 ILE 32 HG22 ILE 32 -58.418 11.676 49.232 212 HG23 ILE 32 HG23 ILE 32 -57.025 10.816 49.888 213 HD11 ILE 32 HD11 ILE 32 -61.160 9.510 50.491 214 HD12 ILE 32 HD12 ILE 32 -60.256 10.602 49.439 215 HD13 ILE 32 HD13 ILE 32 -61.157 11.246 50.812 216 H GLY 33 H GLY 33 -56.569 13.141 54.172 217 HA2 GLY 33 HA2 GLY 33 -58.238 12.265 56.387 218 HA3 GLY 33 HA3 GLY 33 -56.979 13.491 56.443 219 H ASP 34 H ASP 34 -59.720 13.550 57.487 220 HA ASP 34 HA ASP 34 -61.157 15.408 55.807 221 HB2 ASP 34 HB2 ASP 34 -62.431 13.821 57.166 222 HB3 ASP 34 HB3 ASP 34 -61.701 14.468 58.635 223 H SER 35 H SER 35 -59.964 17.165 55.547 224 HA SER 35 HA SER 35 -59.979 19.100 57.694 225 HB2 SER 35 HB2 SER 35 -57.411 18.311 56.288 226 HB3 SER 35 HB3 SER 35 -57.597 19.766 57.258 227 HG SER 35 HG SER 35 -58.414 17.589 58.643 228 H ALA 36 H ALA 36 -60.136 21.177 56.921 229 HA ALA 36 HA ALA 36 -60.483 21.507 54.065 230 HB1 ALA 36 HB1 ALA 36 -60.675 23.542 56.292 231 HB2 ALA 36 HB2 ALA 36 -62.025 22.642 55.596 232 HB3 ALA 36 HB3 ALA 36 -61.134 23.800 54.607 233 H TYR 37 H TYR 37 -58.498 21.245 53.137 234 HA TYR 37 HA TYR 37 -56.145 22.461 54.235 235 HB2 TYR 37 HB2 TYR 37 -56.166 20.282 52.963 236 HB3 TYR 37 HB3 TYR 37 -56.463 21.205 51.496 237 HD1 TYR 37 HD1 TYR 37 -54.016 20.623 54.209 238 HD2 TYR 37 HD2 TYR 37 -54.662 22.295 50.347 239 HE1 TYR 37 HE1 TYR 37 -51.594 20.942 53.946 240 HE2 TYR 37 HE2 TYR 37 -52.241 22.615 50.079 241 HH TYR 37 HH TYR 37 -50.242 22.851 51.486 242 H ALA 38 H ALA 38 -55.904 24.576 54.144 243 HA ALA 38 HA ALA 38 -56.851 26.111 51.865 244 HB1 ALA 38 HB1 ALA 38 -57.138 27.032 54.112 245 HB2 ALA 38 HB2 ALA 38 -56.087 28.057 53.133 246 HB3 ALA 38 HB3 ALA 38 -55.393 26.993 54.356 247 H VAL 39 H VAL 39 -55.523 27.205 50.450 248 HA VAL 39 HA VAL 39 -52.931 25.963 50.052 249 HB VAL 39 HB VAL 39 -54.251 28.041 48.286 250 HG11 VAL 39 HG11 VAL 39 -52.114 25.988 47.713 251 HG12 VAL 39 HG12 VAL 39 -51.874 27.728 47.870 252 HG13 VAL 39 HG13 VAL 39 -52.826 27.088 46.530 253 HG21 VAL 39 HG21 VAL 39 -54.445 25.033 48.078 254 HG22 VAL 39 HG22 VAL 39 -55.106 26.200 46.930 255 HG23 VAL 39 HG23 VAL 39 -55.747 26.116 48.572 256 H ASN 40 H ASN 40 -51.700 26.789 51.675 257 HA ASN 40 HA ASN 40 -51.217 29.670 51.740 258 HB2 ASN 40 HB2 ASN 40 -51.562 28.532 53.906 259 HB3 ASN 40 HB3 ASN 40 -50.206 27.466 53.567 260 HD21 ASN 40 HD21 ASN 40 -48.146 28.187 53.891 261 HD22 ASN 40 HD22 ASN 40 -47.766 29.720 54.595 262 HA PRO 41 HA PRO 41 -47.861 28.935 48.949 263 HB2 PRO 41 HB2 PRO 41 -46.851 31.473 48.930 264 HB3 PRO 41 HB3 PRO 41 -48.256 30.952 47.999 265 HG2 PRO 41 HG2 PRO 41 -48.132 32.469 50.558 266 HG3 PRO 41 HG3 PRO 41 -49.267 32.634 49.208 267 HD2 PRO 41 HD2 PRO 41 -49.848 31.352 51.554 268 HD3 PRO 41 HD3 PRO 41 -50.636 30.984 50.006 269 H GLU 42 H GLU 42 -46.777 27.567 50.459 270 HA GLU 42 HA GLU 42 -44.168 28.751 51.020 271 HB2 GLU 42 HB2 GLU 42 -43.891 27.208 52.975 272 HB3 GLU 42 HB3 GLU 42 -45.025 28.525 53.232 273 HG2 GLU 42 HG2 GLU 42 -46.161 26.789 54.192 274 HG3 GLU 42 HG3 GLU 42 -46.797 26.714 52.553 275 H ALA 43 H ALA 43 -42.589 26.754 51.438 276 HA ALA 43 HA ALA 43 -43.198 24.668 49.462 277 HB1 ALA 43 HB1 ALA 43 -40.613 26.225 49.616 278 HB2 ALA 43 HB2 ALA 43 -41.832 26.376 48.351 279 HB3 ALA 43 HB3 ALA 43 -40.938 24.866 48.536 280 H GLY 44 H GLY 44 -43.166 22.816 50.580 281 HA2 GLY 44 HA2 GLY 44 -41.529 22.535 52.967 282 HA3 GLY 44 HA3 GLY 44 -42.703 21.377 52.363 283 H SER 45 H SER 45 -41.981 19.626 51.363 284 HA SER 45 HA SER 45 -39.130 19.547 50.685 285 HB2 SER 45 HB2 SER 45 -39.458 17.019 50.950 286 HB3 SER 45 HB3 SER 45 -39.516 17.997 52.416 287 HG SER 45 HG SER 45 -41.963 17.679 51.179 288 H MET 46 H MET 46 -38.451 18.893 48.705 289 HA MET 46 HA MET 46 -40.570 18.400 46.729 290 HB2 MET 46 HB2 MET 46 -39.113 19.469 45.050 291 HB3 MET 46 HB3 MET 46 -39.554 20.566 46.346 292 HG2 MET 46 HG2 MET 46 -37.351 21.079 46.099 293 HG3 MET 46 HG3 MET 46 -37.237 19.833 47.337 294 HE1 MET 46 HE1 MET 46 -34.728 20.769 45.578 295 HE2 MET 46 HE2 MET 46 -33.995 19.200 45.242 296 HE3 MET 46 HE3 MET 46 -34.668 19.539 46.840 297 H ASP 47 H ASP 47 -40.122 16.954 45.013 298 HA ASP 47 HA ASP 47 -38.005 14.999 45.636 299 HB2 ASP 47 HB2 ASP 47 -39.406 13.254 44.751 300 HB3 ASP 47 HB3 ASP 47 -40.349 14.158 45.926 301 H TYR 48 H TYR 48 -37.520 13.639 43.550 302 HA TYR 48 HA TYR 48 -37.298 15.371 41.212 303 HB2 TYR 48 HB2 TYR 48 -34.851 14.748 40.997 304 HB3 TYR 48 HB3 TYR 48 -35.231 15.854 42.309 305 HD1 TYR 48 HD1 TYR 48 -35.031 15.139 44.630 306 HD2 TYR 48 HD2 TYR 48 -34.056 12.497 41.445 307 HE1 TYR 48 HE1 TYR 48 -33.876 13.670 46.217 308 HE2 TYR 48 HE2 TYR 48 -32.902 11.012 43.026 309 HH TYR 48 HH TYR 48 -33.230 11.310 46.402 310 H MET 49 H MET 49 -36.455 14.191 39.300 311 HA MET 49 HA MET 49 -37.618 11.490 39.256 312 HB2 MET 49 HB2 MET 49 -37.005 13.327 36.926 313 HB3 MET 49 HB3 MET 49 -37.815 11.772 36.834 314 HG2 MET 49 HG2 MET 49 -39.638 12.726 38.243 315 HG3 MET 49 HG3 MET 49 -38.848 14.296 38.100 316 HE1 MET 49 HE1 MET 49 -38.460 15.512 35.715 317 HE2 MET 49 HE2 MET 49 -39.037 14.849 34.185 318 HE3 MET 49 HE3 MET 49 -37.735 14.042 35.063 319 HA PRO 50 HA PRO 50 -33.512 9.775 38.462 320 HB2 PRO 50 HB2 PRO 50 -34.409 7.368 37.481 321 HB3 PRO 50 HB3 PRO 50 -34.207 7.730 39.198 322 HG2 PRO 50 HG2 PRO 50 -36.682 7.745 37.530 323 HG3 PRO 50 HG3 PRO 50 -36.456 7.191 39.198 324 HD2 PRO 50 HD2 PRO 50 -37.594 9.562 38.604 325 HD3 PRO 50 HD3 PRO 50 -36.608 9.320 40.060 326 H LEU 51 H LEU 51 -32.491 10.632 36.771 327 HA LEU 51 HA LEU 51 -33.645 10.443 34.092 328 HB2 LEU 51 HB2 LEU 51 -32.784 12.626 34.934 329 HB3 LEU 51 HB3 LEU 51 -31.179 11.929 35.024 330 HG LEU 51 HG LEU 51 -31.232 11.577 32.564 331 HD11 LEU 51 HD11 LEU 51 -32.947 12.729 31.245 332 HD12 LEU 51 HD12 LEU 51 -33.810 13.135 32.728 333 HD13 LEU 51 HD13 LEU 51 -33.639 11.449 32.241 334 HD21 LEU 51 HD21 LEU 51 -30.924 13.922 31.982 335 HD22 LEU 51 HD22 LEU 51 -30.178 13.545 33.535 336 HD23 LEU 51 HD23 LEU 51 -31.718 14.402 33.482 337 H MET 52 H MET 52 -33.018 8.890 32.741 338 HA MET 52 HA MET 52 -30.781 7.184 33.588 339 HB2 MET 52 HB2 MET 52 -33.191 6.576 31.863 340 HB3 MET 52 HB3 MET 52 -31.918 5.427 32.257 341 HG2 MET 52 HG2 MET 52 -32.487 5.539 34.599 342 HG3 MET 52 HG3 MET 52 -33.676 6.798 34.276 343 HE1 MET 52 HE1 MET 52 -34.279 4.145 35.929 344 HE2 MET 52 HE2 MET 52 -35.855 3.688 35.277 345 HE3 MET 52 HE3 MET 52 -35.501 5.381 35.622 346 H GLU 53 H GLU 53 -29.184 6.606 32.236 347 HA GLU 53 HA GLU 53 -29.049 7.922 29.609 348 HB2 GLU 53 HB2 GLU 53 -26.902 6.908 31.477 349 HB3 GLU 53 HB3 GLU 53 -26.570 7.311 29.797 350 HG2 GLU 53 HG2 GLU 53 -27.312 9.601 30.185 351 HG3 GLU 53 HG3 GLU 53 -27.676 9.200 31.860 352 H TYR 54 H TYR 54 -27.853 6.657 27.905 353 HA TYR 54 HA TYR 54 -28.331 3.791 28.153 354 HB2 TYR 54 HB2 TYR 54 -29.512 3.705 25.980 355 HB3 TYR 54 HB3 TYR 54 -30.400 4.581 27.212 356 HD1 TYR 54 HD1 TYR 54 -30.785 6.982 26.993 357 HD2 TYR 54 HD2 TYR 54 -28.640 4.823 24.025 358 HE1 TYR 54 HE1 TYR 54 -31.092 8.843 25.423 359 HE2 TYR 54 HE2 TYR 54 -28.934 6.680 22.452 360 HH TYR 54 HH TYR 54 -30.514 8.541 22.110 361 H LEU 55 H LEU 55 -27.252 2.466 26.693 362 HA LEU 55 HA LEU 55 -25.130 3.774 25.130 363 HB2 LEU 55 HB2 LEU 55 -24.962 1.181 26.675 364 HB3 LEU 55 HB3 LEU 55 -23.716 1.791 25.608 365 HG LEU 55 HG LEU 55 -24.617 3.165 28.151 366 HD11 LEU 55 HD11 LEU 55 -23.509 1.036 28.615 367 HD12 LEU 55 HD12 LEU 55 -22.492 2.398 29.084 368 HD13 LEU 55 HD13 LEU 55 -22.152 1.514 27.595 369 HD21 LEU 55 HD21 LEU 55 -23.718 4.710 26.482 370 HD22 LEU 55 HD22 LEU 55 -22.280 3.703 26.315 371 HD23 LEU 55 HD23 LEU 55 -22.606 4.529 27.840 372 H HIS 56 H HIS 56 -24.674 2.899 23.138 373 HA HIS 56 HA HIS 56 -26.288 0.590 22.295 374 HB2 HIS 56 HB2 HIS 56 -25.735 3.137 20.778 375 HB3 HIS 56 HB3 HIS 56 -26.132 1.643 19.938 376 HD1 HIS 56 HD1 HIS 56 -28.578 0.835 20.050 377 HD2 HIS 56 HD2 HIS 56 -27.848 4.313 22.204 378 HE1 HIS 56 HE1 HIS 56 -30.843 1.718 20.696 379 HE2 HIS 56 HE2 HIS 56 -30.386 3.839 21.974 380 H SER 57 H SER 57 -25.295 -0.623 20.467 381 HA SER 57 HA SER 57 -22.379 -0.691 20.866 382 HB2 SER 57 HB2 SER 57 -24.213 -2.908 19.904 383 HB3 SER 57 HB3 SER 57 -22.494 -3.052 20.285 384 HG SER 57 HG SER 57 -22.945 -2.644 22.433 385 H SER 58 H SER 58 -21.348 0.304 19.284 386 HA SER 58 HA SER 58 -22.342 0.084 16.552 387 HB2 SER 58 HB2 SER 58 -20.544 1.725 16.012 388 HB3 SER 58 HB3 SER 58 -21.660 2.317 17.243 389 HG SER 58 HG SER 58 -20.124 1.847 18.819 390 HA PRO 59 HA PRO 59 -19.377 -3.141 15.686 391 HB2 PRO 59 HB2 PRO 59 -19.342 -3.016 12.975 392 HB3 PRO 59 HB3 PRO 59 -20.674 -3.727 13.890 393 HG2 PRO 59 HG2 PRO 59 -20.482 -1.056 12.587 394 HG3 PRO 59 HG3 PRO 59 -21.873 -2.145 12.722 395 HD2 PRO 59 HD2 PRO 59 -21.479 0.074 14.292 396 HD3 PRO 59 HD3 PRO 59 -22.465 -1.324 14.761 397 H VAL 60 H VAL 60 -17.272 -3.477 14.640 398 HA VAL 60 HA VAL 60 -15.702 -1.041 14.810 399 HB VAL 60 HB VAL 60 -15.057 -3.195 15.978 400 HG11 VAL 60 HG11 VAL 60 -15.446 -4.809 14.248 401 HG12 VAL 60 HG12 VAL 60 -13.744 -4.844 14.711 402 HG13 VAL 60 HG13 VAL 60 -14.238 -4.048 13.215 403 HG21 VAL 60 HG21 VAL 60 -13.527 -1.346 15.783 404 HG22 VAL 60 HG22 VAL 60 -13.010 -1.907 14.191 405 HG23 VAL 60 HG23 VAL 60 -12.664 -2.876 15.624 406 H LEU 61 H LEU 61 -14.527 -0.170 13.161 407 HA LEU 61 HA LEU 61 -15.125 -1.165 10.480 408 HB2 LEU 61 HB2 LEU 61 -14.324 1.167 9.731 409 HB3 LEU 61 HB3 LEU 61 -15.903 1.013 10.437 410 HG LEU 61 HG LEU 61 -14.698 3.106 11.015 411 HD11 LEU 61 HD11 LEU 61 -15.214 3.131 13.398 412 HD12 LEU 61 HD12 LEU 61 -15.372 1.375 13.372 413 HD13 LEU 61 HD13 LEU 61 -16.485 2.370 12.436 414 HD21 LEU 61 HD21 LEU 61 -12.442 2.339 11.186 415 HD22 LEU 61 HD22 LEU 61 -12.855 1.313 12.557 416 HD23 LEU 61 HD23 LEU 61 -12.935 3.068 12.717 417 HA PRO 62 HA PRO 62 -10.949 -2.362 9.888 418 HB2 PRO 62 HB2 PRO 62 -10.325 -1.608 7.362 419 HB3 PRO 62 HB3 PRO 62 -11.321 -3.029 7.748 420 HG2 PRO 62 HG2 PRO 62 -12.131 -0.356 6.747 421 HG3 PRO 62 HG3 PRO 62 -12.879 -1.939 6.468 422 HD2 PRO 62 HD2 PRO 62 -13.835 -0.036 8.220 423 HD3 PRO 62 HD3 PRO 62 -14.199 -1.766 8.312 424 H THR 63 H THR 63 -8.821 -1.667 8.872 425 HA THR 63 HA THR 63 -8.312 1.183 8.982 426 HB THR 63 HB THR 63 -6.647 -0.754 10.618 427 HG1 THR 63 HG1 THR 63 -8.970 0.588 11.243 428 HG21 THR 63 HG21 THR 63 -6.717 2.245 10.424 429 HG22 THR 63 HG22 THR 63 -5.485 1.190 9.742 430 HG23 THR 63 HG23 THR 63 -5.661 1.319 11.495 431 H ALA 64 H ALA 64 -7.569 1.356 6.899 432 HA ALA 64 HA ALA 64 -5.842 -0.686 5.791 433 HB1 ALA 64 HB1 ALA 64 -7.402 0.504 4.328 434 HB2 ALA 64 HB2 ALA 64 -5.731 0.738 3.814 435 HB3 ALA 64 HB3 ALA 64 -6.577 2.022 4.680 436 H ARG 65 H ARG 65 -3.812 -0.811 6.355 437 HA ARG 65 HA ARG 65 -2.229 1.612 6.750 438 HB2 ARG 65 HB2 ARG 65 -3.231 0.041 8.885 439 HB3 ARG 65 HB3 ARG 65 -1.536 -0.385 8.729 440 HG2 ARG 65 HG2 ARG 65 -1.730 1.356 10.345 441 HG3 ARG 65 HG3 ARG 65 -0.969 2.032 8.904 442 HD2 ARG 65 HD2 ARG 65 -2.930 3.171 8.272 443 HD3 ARG 65 HD3 ARG 65 -3.934 2.237 9.379 444 HE ARG 65 HE ARG 65 -2.059 3.637 10.898 445 HH11 ARG 65 HH11 ARG 65 -4.778 4.381 8.786 446 HH12 ARG 65 HH12 ARG 65 -5.238 5.799 9.675 447 HH21 ARG 65 HH21 ARG 65 -2.679 5.475 12.065 448 HH22 ARG 65 HH22 ARG 65 -4.031 6.428 11.537 449 H PHE 66 H PHE 66 -0.235 1.364 5.893 450 HA PHE 66 HA PHE 66 1.116 -1.153 5.944 451 HB2 PHE 66 HB2 PHE 66 1.500 -1.477 3.594 452 HB3 PHE 66 HB3 PHE 66 -0.232 -1.389 3.825 453 HD1 PHE 66 HD2 PHE 66 -1.294 0.983 3.406 454 HD2 PHE 66 HD1 PHE 66 2.472 -0.303 1.904 455 HE1 PHE 66 HE2 PHE 66 -1.422 2.674 1.635 456 HE2 PHE 66 HE1 PHE 66 2.339 1.383 0.130 457 HZ PHE 66 HZ PHE 66 0.390 2.870 -0.003 458 H THR 67 H THR 67 3.366 -0.944 5.437 459 HA THR 67 HA THR 67 4.343 1.679 4.707 460 HB THR 67 HB THR 67 4.092 1.740 7.224 461 HG1 THR 67 HG1 THR 67 6.832 1.952 6.607 462 HG21 THR 67 HG21 THR 67 5.782 0.621 8.596 463 HG22 THR 67 HG22 THR 67 6.372 -0.238 7.172 464 HG23 THR 67 HG23 THR 67 4.743 -0.548 7.779 465 H SER 68 H SER 68 6.619 1.682 4.252 466 HA SER 68 HA SER 68 7.783 -0.973 3.766 467 HB2 SER 68 HB2 SER 68 8.483 1.670 2.452 468 HB3 SER 68 HB3 SER 68 9.124 0.084 2.026 469 HG SER 68 HG SER 68 6.595 -0.248 1.875 470 H ASP 69 H ASP 69 10.332 -0.751 3.901 471 HA ASP 69 HA ASP 69 10.998 0.269 6.484 472 HB2 ASP 69 HB2 ASP 69 13.133 -0.680 6.198 473 HB3 ASP 69 HB3 ASP 69 12.040 -1.753 5.337 474 H ILE 70 H ILE 70 11.196 1.543 3.286 475 HA ILE 70 HA ILE 70 12.313 4.010 4.384 476 HB ILE 70 HB ILE 70 13.210 4.456 2.011 477 HG12 ILE 70 HG12 ILE 70 14.096 2.077 1.124 478 HG13 ILE 70 HG13 ILE 70 12.563 1.552 1.806 479 HG21 ILE 70 HG21 ILE 70 14.646 4.183 3.919 480 HG22 ILE 70 HG22 ILE 70 15.340 3.362 2.520 481 HG23 ILE 70 HG23 ILE 70 14.542 2.426 3.784 482 HD11 ILE 70 HD11 ILE 70 11.382 3.134 0.360 483 HD12 ILE 70 HD12 ILE 70 12.363 1.997 -0.567 484 HD13 ILE 70 HD13 ILE 70 12.924 3.652 -0.324 485 H THR 71 H THR 71 11.470 5.911 3.665 486 HA THR 71 HA THR 71 9.037 5.762 2.005 487 HB THR 71 HB THR 71 8.646 8.126 2.901 488 HG1 THR 71 HG1 THR 71 9.766 8.643 4.821 489 HG21 THR 71 HG21 THR 71 8.646 5.842 4.874 490 HG22 THR 71 HG22 THR 71 7.377 6.201 3.701 491 HG23 THR 71 HG23 THR 71 7.710 7.327 5.018 492 H GLU 72 H GLU 72 12.245 6.791 2.226 493 HA GLU 72 HA GLU 72 12.256 7.917 -0.424 494 HB2 GLU 72 HB2 GLU 72 11.759 9.862 1.030 495 HB3 GLU 72 HB3 GLU 72 13.216 9.528 1.956 496 HG2 GLU 72 HG2 GLU 72 14.550 9.893 -0.121 497 HG3 GLU 72 HG3 GLU 72 13.058 10.371 -0.937 498 H GLY 73 H GLY 73 14.188 7.606 -1.377 499 HA2 GLY 73 HA2 GLY 73 16.717 7.475 -0.457 500 HA3 GLY 73 HA3 GLY 73 16.085 5.872 -0.068 501 H PHE 74 H PHE 74 17.888 5.327 -1.703 502 HA PHE 74 HA PHE 74 17.069 5.859 -4.449 503 HB2 PHE 74 HB2 PHE 74 19.161 4.978 -5.165 504 HB3 PHE 74 HB3 PHE 74 19.520 5.942 -3.744 505 HD1 PHE 74 HD1 PHE 74 19.859 4.663 -1.524 506 HD2 PHE 74 HD2 PHE 74 19.877 2.796 -5.347 507 HE1 PHE 74 HE1 PHE 74 21.082 2.750 -0.584 508 HE2 PHE 74 HE2 PHE 74 21.095 0.881 -4.411 509 HZ PHE 74 HZ PHE 74 21.695 0.856 -2.026 510 H ALA 75 H ALA 75 16.324 4.277 -5.850 511 HA ALA 75 HA ALA 75 14.973 2.050 -4.555 512 HB1 ALA 75 HB1 ALA 75 14.878 3.041 -7.412 513 HB2 ALA 75 HB2 ALA 75 13.767 3.503 -6.123 514 HB3 ALA 75 HB3 ALA 75 13.805 1.836 -6.697 515 HA PRO 76 HA PRO 76 18.382 -0.472 -6.098 516 HB2 PRO 76 HB2 PRO 76 18.608 -2.028 -3.931 517 HB3 PRO 76 HB3 PRO 76 19.162 -0.355 -3.965 518 HG2 PRO 76 HG2 PRO 76 16.896 -1.528 -2.522 519 HG3 PRO 76 HG3 PRO 76 17.697 0.032 -2.275 520 HD2 PRO 76 HD2 PRO 76 15.249 -0.567 -3.740 521 HD3 PRO 76 HD3 PRO 76 15.912 1.012 -3.268 522 H LEU 77 H LEU 77 15.173 -1.559 -5.626 523 HA LEU 77 HA LEU 77 15.197 -4.060 -6.736 524 HB2 LEU 77 HB2 LEU 77 15.294 -5.626 -4.787 525 HB3 LEU 77 HB3 LEU 77 16.830 -4.884 -5.178 526 HG LEU 77 HG LEU 77 16.045 -3.196 -3.251 527 HD11 LEU 77 HD11 LEU 77 13.924 -4.374 -2.857 528 HD12 LEU 77 HD12 LEU 77 14.978 -4.356 -1.439 529 HD13 LEU 77 HD13 LEU 77 14.835 -5.821 -2.413 530 HD21 LEU 77 HD21 LEU 77 18.134 -4.421 -3.346 531 HD22 LEU 77 HD22 LEU 77 17.319 -5.883 -2.791 532 HD23 LEU 77 HD23 LEU 77 17.433 -4.478 -1.731 533 H SER 78 H SER 78 13.418 -5.536 -5.740 534 HA SER 78 HA SER 78 10.950 -4.203 -5.549 535 HB2 SER 78 HB2 SER 78 11.595 -6.956 -4.508 536 HB3 SER 78 HB3 SER 78 10.025 -6.360 -5.017 537 HG SER 78 HG SER 78 10.662 -6.441 -7.116 538 H VAL 79 H VAL 79 10.881 -2.673 -3.900 539 HA VAL 79 HA VAL 79 11.466 -3.298 -1.166 540 HB VAL 79 HB VAL 79 9.868 -0.959 -2.288 541 HG11 VAL 79 HG11 VAL 79 9.427 -1.325 0.085 542 HG12 VAL 79 HG12 VAL 79 10.369 0.150 -0.153 543 HG13 VAL 79 HG13 VAL 79 11.156 -1.324 0.415 544 HG21 VAL 79 HG21 VAL 79 12.788 -1.146 -1.524 545 HG22 VAL 79 HG22 VAL 79 11.954 0.327 -2.019 546 HG23 VAL 79 HG23 VAL 79 12.154 -1.002 -3.163 547 H ARG 80 H ARG 80 10.286 -4.576 0.041 548 HA ARG 80 HA ARG 80 7.704 -5.496 -0.815 549 HB2 ARG 80 HB2 ARG 80 9.337 -6.125 1.651 550 HB3 ARG 80 HB3 ARG 80 7.853 -6.953 1.203 551 HG2 ARG 80 HG2 ARG 80 8.906 -7.770 -0.836 552 HG3 ARG 80 HG3 ARG 80 10.389 -6.904 -0.427 553 HD2 ARG 80 HD2 ARG 80 10.593 -9.251 0.163 554 HD3 ARG 80 HD3 ARG 80 10.605 -8.242 1.605 555 HE ARG 80 HE ARG 80 7.987 -9.203 0.997 556 HH11 ARG 80 HH11 ARG 80 11.032 -10.171 2.467 557 HH12 ARG 80 HH12 ARG 80 10.290 -11.346 3.507 558 HH21 ARG 80 HH21 ARG 80 7.028 -10.730 2.381 559 HH22 ARG 80 HH22 ARG 80 8.025 -11.662 3.452 560 H PHE 81 H PHE 81 5.743 -5.128 0.080 561 HA PHE 81 HA PHE 81 5.618 -2.863 1.939 562 HB2 PHE 81 HB2 PHE 81 3.356 -3.963 0.252 563 HB3 PHE 81 HB3 PHE 81 3.436 -2.397 1.055 564 HD1 PHE 81 HD2 PHE 81 5.465 -0.882 0.285 565 HD2 PHE 81 HD1 PHE 81 3.800 -4.065 -2.002 566 HE1 PHE 81 HE2 PHE 81 6.413 0.093 -1.762 567 HE2 PHE 81 HE1 PHE 81 4.754 -3.096 -4.050 568 HZ PHE 81 HZ PHE 81 6.060 -1.017 -3.931 569 H LYS 82 H LYS 82 5.071 -3.258 3.965 570 HA LYS 82 HA LYS 82 3.867 -5.843 4.584 571 HB2 LYS 82 HB2 LYS 82 5.950 -5.335 5.777 572 HB3 LYS 82 HB3 LYS 82 5.241 -3.863 6.414 573 HG2 LYS 82 HG2 LYS 82 5.334 -5.738 8.042 574 HG3 LYS 82 HG3 LYS 82 3.713 -5.093 7.777 575 HD2 LYS 82 HD2 LYS 82 3.432 -6.984 6.071 576 HD3 LYS 82 HD3 LYS 82 4.886 -7.685 6.788 577 HE2 LYS 82 HE2 LYS 82 3.845 -8.161 8.764 578 HE3 LYS 82 HE3 LYS 82 2.690 -6.839 8.596 579 HZ1 LYS 82 HZ1 LYS 82 1.608 -8.122 6.817 580 HZ2 LYS 82 HZ2 LYS 82 1.558 -8.902 8.319 581 HZ3 LYS 82 HZ3 LYS 82 2.654 -9.420 7.135 582 H ASP 83 H ASP 83 1.853 -6.007 5.102 583 HA ASP 83 HA ASP 83 0.211 -3.639 5.292 584 HB2 ASP 83 HB2 ASP 83 -1.664 -5.127 4.996 585 HB3 ASP 83 HB3 ASP 83 -0.425 -5.544 3.823 586 H PHE 84 H PHE 84 -0.953 -3.027 6.989 587 HA PHE 84 HA PHE 84 -0.774 -4.579 9.499 588 HB2 PHE 84 HB2 PHE 84 -0.493 -1.580 9.160 589 HB3 PHE 84 HB3 PHE 84 -0.726 -2.376 10.712 590 HD1 PHE 84 HD2 PHE 84 1.019 -3.958 11.544 591 HD2 PHE 84 HD1 PHE 84 1.627 -1.446 8.162 592 HE1 PHE 84 HE2 PHE 84 3.445 -4.293 11.736 593 HE2 PHE 84 HE1 PHE 84 4.052 -1.783 8.351 594 HZ PHE 84 HZ PHE 84 4.962 -3.204 10.135 595 H SER 85 H SER 85 -2.686 -4.212 7.262 596 HA SER 85 HA SER 85 -4.917 -2.744 8.031 597 HB2 SER 85 HB2 SER 85 -4.695 -5.183 6.280 598 HB3 SER 85 HB3 SER 85 -6.090 -4.102 6.352 599 HG SER 85 HG SER 85 -4.426 -3.715 4.653 600 H GLU 86 H GLU 86 -6.300 -2.982 9.523 601 HA GLU 86 HA GLU 86 -6.556 -5.551 10.956 602 HB2 GLU 86 HB2 GLU 86 -5.417 -3.620 12.123 603 HB3 GLU 86 HB3 GLU 86 -6.928 -2.742 12.014 604 HG2 GLU 86 HG2 GLU 86 -8.004 -4.480 13.393 605 HG3 GLU 86 HG3 GLU 86 -6.450 -5.299 13.531 606 H ASN 87 H ASN 87 -8.673 -6.164 11.559 607 HA ASN 87 HA ASN 87 -10.939 -6.283 11.679 608 HB2 ASN 87 HB2 ASN 87 -10.789 -3.278 11.395 609 HB3 ASN 87 HB3 ASN 87 -12.220 -4.173 11.883 610 HD21 ASN 87 HD21 ASN 87 -10.312 -2.153 13.143 611 HD22 ASN 87 HD22 ASN 87 -9.973 -2.820 14.702 612 H ALA 88 H ALA 88 -9.835 -6.804 9.197 613 HA ALA 88 HA ALA 88 -11.742 -5.584 7.299 614 HB1 ALA 88 HB1 ALA 88 -8.949 -6.554 6.739 615 HB2 ALA 88 HB2 ALA 88 -9.437 -4.865 6.883 616 HB3 ALA 88 HB3 ALA 88 -10.060 -5.860 5.562 617 H THR 89 H THR 89 -12.777 -6.903 5.867 618 HA THR 89 HA THR 89 -12.696 -9.756 6.429 619 HB THR 89 HB THR 89 -14.919 -8.760 6.281 620 HG1 THR 89 HG1 THR 89 -14.106 -10.711 4.458 621 HG21 THR 89 HG21 THR 89 -14.512 -6.915 4.763 622 HG22 THR 89 HG22 THR 89 -15.828 -7.922 4.154 623 HG23 THR 89 HG23 THR 89 -14.219 -8.040 3.438 624 H SER 90 H SER 90 -11.765 -7.478 3.936 625 HA SER 90 HA SER 90 -10.263 -9.572 2.580 626 HB2 SER 90 HB2 SER 90 -12.139 -7.695 1.110 627 HB3 SER 90 HB3 SER 90 -11.067 -8.879 0.363 628 HG SER 90 HG SER 90 -12.322 -10.476 1.641 629 H ARG 91 H ARG 91 -8.430 -8.760 1.531 630 HA ARG 91 HA ARG 91 -8.045 -5.847 1.684 631 HB2 ARG 91 HB2 ARG 91 -5.621 -6.219 1.814 632 HB3 ARG 91 HB3 ARG 91 -6.450 -6.996 3.149 633 HG2 ARG 91 HG2 ARG 91 -6.214 -9.161 2.066 634 HG3 ARG 91 HG3 ARG 91 -5.444 -8.395 0.679 635 HD2 ARG 91 HD2 ARG 91 -3.650 -7.585 2.228 636 HD3 ARG 91 HD3 ARG 91 -4.387 -8.566 3.497 637 HE ARG 91 HE ARG 91 -3.857 -10.069 1.130 638 HH11 ARG 91 HH11 ARG 91 -2.314 -8.829 4.038 639 HH12 ARG 91 HH12 ARG 91 -1.087 -10.055 4.032 640 HH21 ARG 91 HH21 ARG 91 -2.261 -11.620 1.123 641 HH22 ARG 91 HH22 ARG 91 -1.049 -11.637 2.373 642 H LEU 92 H LEU 92 -7.444 -4.783 -0.109 643 HA LEU 92 HA LEU 92 -7.336 -6.327 -2.615 644 HB2 LEU 92 HB2 LEU 92 -9.427 -5.006 -2.241 645 HB3 LEU 92 HB3 LEU 92 -8.457 -3.555 -2.119 646 HG LEU 92 HG LEU 92 -7.739 -3.927 -4.503 647 HD11 LEU 92 HD11 LEU 92 -9.093 -5.422 -5.869 648 HD12 LEU 92 HD12 LEU 92 -9.920 -6.000 -4.421 649 HD13 LEU 92 HD13 LEU 92 -8.197 -6.311 -4.638 650 HD21 LEU 92 HD21 LEU 92 -9.849 -3.154 -5.467 651 HD22 LEU 92 HD22 LEU 92 -9.503 -2.341 -3.942 652 HD23 LEU 92 HD23 LEU 92 -10.698 -3.638 -3.998 653 H TRP 93 H TRP 93 -5.321 -6.238 -3.417 654 HA TRP 93 HA TRP 93 -3.583 -4.023 -2.711 655 HB2 TRP 93 HB2 TRP 93 -3.101 -6.624 -4.165 656 HB3 TRP 93 HB3 TRP 93 -1.876 -5.371 -4.041 657 HD1 TRP 93 HD1 TRP 93 -3.312 -8.285 -2.185 658 HE1 TRP 93 HE1 TRP 93 -2.131 -8.536 0.090 659 HE3 TRP 93 HE3 TRP 93 -0.831 -3.800 -2.038 660 HZ2 TRP 93 HZ2 TRP 93 -0.421 -7.026 1.749 661 HZ3 TRP 93 HZ3 TRP 93 0.554 -3.286 -0.064 662 HH2 TRP 93 HH2 TRP 93 0.750 -4.870 1.787 663 H MET 94 H MET 94 -2.967 -2.454 -4.027 664 HA MET 94 HA MET 94 -3.790 -2.605 -6.844 665 HB2 MET 94 HB2 MET 94 -3.993 -0.253 -4.970 666 HB3 MET 94 HB3 MET 94 -4.046 -0.081 -6.714 667 HG2 MET 94 HG2 MET 94 -6.047 -1.501 -6.774 668 HG3 MET 94 HG3 MET 94 -6.001 -1.607 -5.013 669 HE1 MET 94 HE1 MET 94 -8.591 -0.714 -5.101 670 HE2 MET 94 HE2 MET 94 -8.488 -0.530 -6.853 671 HE3 MET 94 HE3 MET 94 -9.045 0.815 -5.858 672 H PHE 95 H PHE 95 -1.824 -3.104 -7.708 673 HA PHE 95 HA PHE 95 0.410 -1.297 -7.421 674 HB2 PHE 95 HB2 PHE 95 -0.229 -3.261 -9.649 675 HB3 PHE 95 HB3 PHE 95 1.310 -2.448 -9.405 676 HD1 PHE 95 HD2 PHE 95 2.424 -2.890 -7.045 677 HD2 PHE 95 HD1 PHE 95 -0.486 -5.408 -8.864 678 HE1 PHE 95 HE2 PHE 95 3.184 -4.771 -5.652 679 HE2 PHE 95 HE1 PHE 95 0.274 -7.291 -7.473 680 HZ PHE 95 HZ PHE 95 2.109 -6.974 -5.865 681 H GLY 96 H GLY 96 -2.367 -1.757 -9.499 682 HA2 GLY 96 HA2 GLY 96 -3.654 0.243 -9.949 683 HA3 GLY 96 HA3 GLY 96 -2.146 1.067 -10.297 684 H ASP 97 H ASP 97 -1.075 -1.155 -11.942 685 HA ASP 97 HA ASP 97 -2.969 -1.094 -14.176 686 HB2 ASP 97 HB2 ASP 97 -0.725 -0.087 -14.542 687 HB3 ASP 97 HB3 ASP 97 0.015 -1.637 -14.173 688 H GLY 98 H GLY 98 -3.657 -2.947 -15.136 689 HA2 GLY 98 HA2 GLY 98 -3.466 -5.269 -15.671 690 HA3 GLY 98 HA3 GLY 98 -2.594 -5.510 -14.157 691 H ASN 99 H ASN 99 -3.758 -6.801 -12.936 692 HA ASN 99 HA ASN 99 -6.660 -6.403 -12.776 693 HB2 ASN 99 HB2 ASN 99 -6.791 -8.687 -11.849 694 HB3 ASN 99 HB3 ASN 99 -5.995 -8.677 -13.410 695 HD21 ASN 99 HD21 ASN 99 -3.785 -9.121 -13.524 696 HD22 ASN 99 HD22 ASN 99 -2.938 -9.891 -12.225 697 H THR 100 H THR 100 -7.021 -7.673 -10.270 698 HA THR 100 HA THR 100 -5.640 -6.002 -8.334 699 HB THR 100 HB THR 100 -8.013 -5.542 -7.274 700 HG1 THR 100 HG1 THR 100 -8.546 -6.154 -9.956 701 HG21 THR 100 HG21 THR 100 -6.985 -3.885 -9.574 702 HG22 THR 100 HG22 THR 100 -6.387 -3.817 -7.915 703 HG23 THR 100 HG23 THR 100 -8.045 -3.333 -8.281 704 H SER 101 H SER 101 -6.412 -6.546 -6.067 705 HA SER 101 HA SER 101 -6.599 -7.992 -4.346 706 HB2 SER 101 HB2 SER 101 -8.893 -8.416 -5.358 707 HB3 SER 101 HB3 SER 101 -8.197 -9.831 -6.151 708 HG SER 101 HG SER 101 -8.015 -10.830 -4.264 709 H ASP 102 H ASP 102 -4.356 -7.949 -5.586 710 HA ASP 102 HA ASP 102 -3.488 -10.346 -6.825 711 HB2 ASP 102 HB2 ASP 102 -1.879 -8.005 -5.771 712 HB3 ASP 102 HB3 ASP 102 -1.279 -9.247 -6.864 713 H SER 103 H SER 103 -1.594 -11.538 -6.153 714 HA SER 103 HA SER 103 -1.779 -12.553 -3.498 715 HB2 SER 103 HB2 SER 103 0.296 -12.979 -5.668 716 HB3 SER 103 HB3 SER 103 0.155 -13.950 -4.204 717 HG SER 103 HG SER 103 -2.227 -13.762 -5.484 718 HA PRO 104 HA PRO 104 1.227 -9.925 -1.417 719 HB2 PRO 104 HB2 PRO 104 2.420 -11.577 0.339 720 HB3 PRO 104 HB3 PRO 104 0.717 -11.131 0.484 721 HG2 PRO 104 HG2 PRO 104 1.922 -13.607 -0.717 722 HG3 PRO 104 HG3 PRO 104 0.592 -13.483 0.452 723 HD2 PRO 104 HD2 PRO 104 0.170 -13.833 -2.185 724 HD3 PRO 104 HD3 PRO 104 -0.936 -12.872 -1.179 725 H SER 105 H SER 105 2.224 -10.958 -3.962 726 HA SER 105 HA SER 105 5.008 -11.683 -3.475 727 HB2 SER 105 HB2 SER 105 3.621 -11.360 -6.147 728 HB3 SER 105 HB3 SER 105 5.041 -12.334 -5.763 729 HG SER 105 HG SER 105 3.788 -13.875 -4.912 730 HA PRO 106 HA PRO 106 6.051 -7.397 -4.410 731 HB2 PRO 106 HB2 PRO 106 8.826 -8.129 -4.718 732 HB3 PRO 106 HB3 PRO 106 8.061 -7.268 -3.382 733 HG2 PRO 106 HG2 PRO 106 9.093 -9.795 -3.171 734 HG3 PRO 106 HG3 PRO 106 7.790 -9.169 -2.146 735 HD2 PRO 106 HD2 PRO 106 7.625 -10.956 -4.541 736 HD3 PRO 106 HD3 PRO 106 6.711 -11.025 -3.016 737 H LEU 107 H LEU 107 4.902 -7.853 -6.486 738 HA LEU 107 HA LEU 107 6.430 -8.403 -8.856 739 HB2 LEU 107 HB2 LEU 107 3.967 -8.871 -8.529 740 HB3 LEU 107 HB3 LEU 107 3.686 -7.146 -8.593 741 HG LEU 107 HG LEU 107 5.075 -8.365 -10.938 742 HD11 LEU 107 HD11 LEU 107 2.971 -9.116 -11.900 743 HD12 LEU 107 HD12 LEU 107 2.125 -8.706 -10.408 744 HD13 LEU 107 HD13 LEU 107 3.325 -9.998 -10.414 745 HD21 LEU 107 HD21 LEU 107 2.853 -6.330 -10.664 746 HD22 LEU 107 HD22 LEU 107 3.667 -6.783 -12.161 747 HD23 LEU 107 HD23 LEU 107 4.566 -5.965 -10.883 748 H HIS 108 H HIS 108 5.500 -5.625 -7.006 749 HA HIS 108 HA HIS 108 6.251 -3.675 -8.991 750 HB2 HIS 108 HB2 HIS 108 4.505 -3.451 -7.072 751 HB3 HIS 108 HB3 HIS 108 5.897 -3.102 -6.058 752 HD1 HIS 108 HD1 HIS 108 6.862 -0.776 -6.188 753 HD2 HIS 108 HD2 HIS 108 3.974 -1.499 -9.083 754 HE1 HIS 108 HE1 HIS 108 6.357 1.465 -7.206 755 HE2 HIS 108 HE2 HIS 108 4.550 1.024 -8.904 756 H THR 109 H THR 109 8.358 -4.332 -9.457 757 HA THR 109 HA THR 109 10.388 -4.269 -7.402 758 HB THR 109 HB THR 109 10.702 -4.587 -10.401 759 HG1 THR 109 HG1 THR 109 9.780 -6.462 -10.021 760 HG21 THR 109 HG21 THR 109 12.562 -5.328 -8.134 761 HG22 THR 109 HG22 THR 109 12.793 -3.980 -9.249 762 HG23 THR 109 HG23 THR 109 12.852 -5.641 -9.845 763 H PHE 110 H PHE 110 11.468 -2.501 -6.859 764 HA PHE 110 HA PHE 110 11.219 -0.105 -8.487 765 HB2 PHE 110 HB2 PHE 110 12.460 -0.561 -5.768 766 HB3 PHE 110 HB3 PHE 110 12.462 0.988 -6.595 767 HD1 PHE 110 HD1 PHE 110 10.263 -1.569 -5.051 768 HD2 PHE 110 HD2 PHE 110 10.609 2.424 -6.483 769 HE1 PHE 110 HE1 PHE 110 8.123 -1.005 -3.987 770 HE2 PHE 110 HE2 PHE 110 8.466 2.990 -5.416 771 HZ PHE 110 HZ PHE 110 7.225 1.277 -4.164 772 H PHE 111 H PHE 111 12.446 -1.468 -10.130 773 HA PHE 111 HA PHE 111 15.335 -1.339 -9.806 774 HB2 PHE 111 HB2 PHE 111 15.444 -2.473 -11.985 775 HB3 PHE 111 HB3 PHE 111 14.398 -3.351 -10.885 776 HD1 PHE 111 HD1 PHE 111 11.957 -3.401 -11.274 777 HD2 PHE 111 HD2 PHE 111 14.595 -1.510 -14.023 778 HE1 PHE 111 HE1 PHE 111 10.191 -3.420 -12.979 779 HE2 PHE 111 HE2 PHE 111 12.826 -1.515 -15.730 780 HZ PHE 111 HZ PHE 111 10.623 -2.471 -15.206 781 H ASN 112 H ASN 112 12.700 0.350 -11.102 782 HA ASN 112 HA ASN 112 14.370 2.110 -12.734 783 HB2 ASN 112 HB2 ASN 112 12.182 0.912 -13.561 784 HB3 ASN 112 HB3 ASN 112 11.355 2.145 -12.621 785 HD21 ASN 112 HD21 ASN 112 11.283 1.642 -15.442 786 HD22 ASN 112 HD22 ASN 112 11.810 3.090 -16.223 787 H GLU 113 H GLU 113 14.692 4.165 -12.067 788 HA GLU 113 HA GLU 113 13.844 4.946 -9.438 789 HB2 GLU 113 HB2 GLU 113 16.109 5.400 -10.293 790 HB3 GLU 113 HB3 GLU 113 15.437 6.401 -11.564 791 HG2 GLU 113 HG2 GLU 113 14.750 7.185 -8.814 792 HG3 GLU 113 HG3 GLU 113 16.446 7.356 -9.272 793 H GLY 114 H GLY 114 12.244 6.299 -8.903 794 HA2 GLY 114 HA2 GLY 114 11.187 8.398 -10.344 795 HA3 GLY 114 HA3 GLY 114 10.245 6.988 -10.811 796 H GLU 115 H GLU 115 8.768 8.777 -9.770 797 HA GLU 115 HA GLU 115 8.508 8.319 -6.888 798 HB2 GLU 115 HB2 GLU 115 8.583 10.644 -7.713 799 HB3 GLU 115 HB3 GLU 115 7.166 10.333 -8.705 800 HG2 GLU 115 HG2 GLU 115 5.847 9.937 -6.690 801 HG3 GLU 115 HG3 GLU 115 7.276 10.246 -5.702 802 H TYR 116 H TYR 116 7.263 6.607 -6.392 803 HA TYR 116 HA TYR 116 5.033 5.926 -8.215 804 HB2 TYR 116 HB2 TYR 116 6.693 3.989 -6.577 805 HB3 TYR 116 HB3 TYR 116 5.405 3.568 -7.693 806 HD1 TYR 116 HD1 TYR 116 5.751 4.203 -10.168 807 HD2 TYR 116 HD2 TYR 116 8.884 4.089 -7.301 808 HE1 TYR 116 HE1 TYR 116 7.402 4.042 -11.983 809 HE2 TYR 116 HE2 TYR 116 10.539 3.931 -9.097 810 HH TYR 116 HH TYR 116 10.715 3.321 -11.361 811 H ILE 117 H ILE 117 3.063 5.600 -7.331 812 HA ILE 117 HA ILE 117 2.903 5.899 -4.407 813 HB ILE 117 HB ILE 117 0.671 6.504 -6.368 814 HG12 ILE 117 HG12 ILE 117 2.564 8.470 -5.051 815 HG13 ILE 117 HG13 ILE 117 2.671 7.975 -6.734 816 HG21 ILE 117 HG21 ILE 117 -0.079 6.041 -4.110 817 HG22 ILE 117 HG22 ILE 117 -0.242 7.764 -4.447 818 HG23 ILE 117 HG23 ILE 117 1.095 7.185 -3.453 819 HD11 ILE 117 HD11 ILE 117 1.603 10.148 -6.492 820 HD12 ILE 117 HD12 ILE 117 0.350 9.424 -5.482 821 HD13 ILE 117 HD13 ILE 117 0.495 8.957 -7.176 822 H VAL 118 H VAL 118 2.412 4.159 -3.337 823 HA VAL 118 HA VAL 118 1.248 1.817 -4.663 824 HB VAL 118 HB VAL 118 2.513 2.049 -1.922 825 HG11 VAL 118 HG11 VAL 118 1.064 0.112 -2.075 826 HG12 VAL 118 HG12 VAL 118 2.751 -0.405 -2.057 827 HG13 VAL 118 HG13 VAL 118 1.851 -0.387 -3.574 828 HG21 VAL 118 HG21 VAL 118 3.740 1.132 -4.511 829 HG22 VAL 118 HG22 VAL 118 4.509 1.050 -2.925 830 HG23 VAL 118 HG23 VAL 118 4.122 2.618 -3.640 831 H SER 119 H SER 119 -0.728 0.943 -4.027 832 HA SER 119 HA SER 119 -2.172 2.386 -1.896 833 HB2 SER 119 HB2 SER 119 -3.344 1.300 -4.471 834 HB3 SER 119 HB3 SER 119 -4.236 2.133 -3.194 835 HG SER 119 HG SER 119 -2.411 3.815 -3.706 836 H LEU 120 H LEU 120 -3.131 1.248 -0.382 837 HA LEU 120 HA LEU 120 -3.859 -1.556 -0.859 838 HB2 LEU 120 HB2 LEU 120 -1.855 -1.657 0.491 839 HB3 LEU 120 HB3 LEU 120 -2.479 -0.452 1.592 840 HG LEU 120 HG LEU 120 -4.127 -2.031 2.464 841 HD11 LEU 120 HD11 LEU 120 -2.944 -4.046 0.543 842 HD12 LEU 120 HD12 LEU 120 -4.550 -3.328 0.412 843 HD13 LEU 120 HD13 LEU 120 -4.161 -4.369 1.782 844 HD21 LEU 120 HD21 LEU 120 -2.621 -3.590 3.524 845 HD22 LEU 120 HD22 LEU 120 -1.920 -1.973 3.455 846 HD23 LEU 120 HD23 LEU 120 -1.376 -3.220 2.332 847 H ILE 121 H ILE 121 -5.950 -1.676 -0.745 848 HA ILE 121 HA ILE 121 -7.407 0.060 1.125 849 HB ILE 121 HB ILE 121 -7.880 0.917 -1.017 850 HG12 ILE 121 HG12 ILE 121 -9.939 0.325 0.491 851 HG13 ILE 121 HG13 ILE 121 -10.179 0.956 -1.126 852 HG21 ILE 121 HG21 ILE 121 -8.335 -1.856 -2.045 853 HG22 ILE 121 HG22 ILE 121 -7.003 -0.764 -2.425 854 HG23 ILE 121 HG23 ILE 121 -8.641 -0.379 -2.957 855 HD11 ILE 121 HD11 ILE 121 -10.661 -1.307 -1.927 856 HD12 ILE 121 HD12 ILE 121 -11.750 -0.818 -0.627 857 HD13 ILE 121 HD13 ILE 121 -10.421 -1.929 -0.295 858 H VAL 122 H VAL 122 -8.767 -0.933 2.489 859 HA VAL 122 HA VAL 122 -9.247 -3.801 2.041 860 HB VAL 122 HB VAL 122 -9.448 -4.051 4.532 861 HG11 VAL 122 HG11 VAL 122 -7.023 -4.126 4.903 862 HG12 VAL 122 HG12 VAL 122 -6.783 -3.184 3.429 863 HG13 VAL 122 HG13 VAL 122 -7.482 -4.802 3.342 864 HG21 VAL 122 HG21 VAL 122 -9.759 -1.706 5.140 865 HG22 VAL 122 HG22 VAL 122 -8.133 -1.335 4.567 866 HG23 VAL 122 HG23 VAL 122 -8.355 -2.391 5.963 867 H SER 123 H SER 123 -11.232 -4.629 3.097 868 HA SER 123 HA SER 123 -13.338 -2.600 3.019 869 HB2 SER 123 HB2 SER 123 -14.755 -4.285 1.816 870 HB3 SER 123 HB3 SER 123 -13.388 -3.690 0.874 871 HG SER 123 HG SER 123 -13.713 -6.016 0.831 872 H ASN 124 H ASN 124 -15.241 -3.146 4.102 873 HA ASN 124 HA ASN 124 -15.544 -5.508 5.698 874 HB2 ASN 124 HB2 ASN 124 -13.991 -4.101 7.104 875 HB3 ASN 124 HB3 ASN 124 -15.183 -2.818 7.075 876 HD21 ASN 124 HD21 ASN 124 -14.397 -5.969 8.340 877 HD22 ASN 124 HD22 ASN 124 -15.564 -5.963 9.610 878 H GLU 125 H GLU 125 -17.824 -5.169 6.939 879 HA GLU 125 HA GLU 125 -19.550 -4.041 4.899 880 HB2 GLU 125 HB2 GLU 125 -21.405 -5.076 6.101 881 HB3 GLU 125 HB3 GLU 125 -20.124 -6.234 5.802 882 HG2 GLU 125 HG2 GLU 125 -20.149 -4.859 8.434 883 HG3 GLU 125 HG3 GLU 125 -21.391 -6.066 8.126 884 H ASN 126 H ASN 126 -18.218 -3.015 7.851 885 HA ASN 126 HA ASN 126 -20.308 -1.131 8.555 886 HB2 ASN 126 HB2 ASN 126 -18.822 -2.279 10.241 887 HB3 ASN 126 HB3 ASN 126 -17.473 -1.326 9.629 888 HD21 ASN 126 HD21 ASN 126 -17.192 -0.443 11.656 889 HD22 ASN 126 HD22 ASN 126 -18.236 0.778 12.280 890 H ASP 127 H ASP 127 -16.994 -0.994 7.312 891 HA ASP 127 HA ASP 127 -17.599 1.262 5.627 892 HB2 ASP 127 HB2 ASP 127 -17.046 2.233 7.949 893 HB3 ASP 127 HB3 ASP 127 -15.399 1.697 7.657 894 H SER 128 H SER 128 -15.513 1.856 4.335 895 HA SER 128 HA SER 128 -13.570 -0.345 4.293 896 HB2 SER 128 HB2 SER 128 -14.838 0.951 1.854 897 HB3 SER 128 HB3 SER 128 -13.512 -0.215 1.815 898 HG SER 128 HG SER 128 -15.869 -0.886 3.183 899 H ASP 129 H ASP 129 -11.487 0.316 4.136 900 HA ASP 129 HA ASP 129 -11.067 3.238 4.023 901 HB2 ASP 129 HB2 ASP 129 -9.732 1.138 5.740 902 HB3 ASP 129 HB3 ASP 129 -9.055 2.748 5.510 903 H SER 130 H SER 130 -9.313 4.025 2.877 904 HA SER 130 HA SER 130 -7.591 2.033 1.590 905 HB2 SER 130 HB2 SER 130 -7.605 3.542 -0.458 906 HB3 SER 130 HB3 SER 130 -9.102 2.666 -0.149 907 HG SER 130 HG SER 130 -8.596 5.365 -0.134 908 H ALA 131 H ALA 131 -5.517 2.411 1.751 909 HA ALA 131 HA ALA 131 -4.624 5.110 2.526 910 HB1 ALA 131 HB1 ALA 131 -4.330 3.517 4.364 911 HB2 ALA 131 HB2 ALA 131 -2.781 4.084 3.741 912 HB3 ALA 131 HB3 ALA 131 -3.371 2.479 3.309 913 H SER 132 H SER 132 -2.787 5.880 1.549 914 HA SER 132 HA SER 132 -1.443 4.220 -0.414 915 HB2 SER 132 HB2 SER 132 -3.486 5.514 -1.425 916 HB3 SER 132 HB3 SER 132 -2.453 6.933 -1.259 917 HG SER 132 HG SER 132 -1.109 4.880 -2.403 918 H VAL 133 H VAL 133 0.708 4.967 -0.824 919 HA VAL 133 HA VAL 133 1.464 7.448 0.502 920 HB VAL 133 HB VAL 133 1.853 5.590 2.144 921 HG11 VAL 133 HG11 VAL 133 2.547 3.805 0.679 922 HG12 VAL 133 HG12 VAL 133 3.799 4.132 1.879 923 HG13 VAL 133 HG13 VAL 133 3.991 4.708 0.222 924 HG21 VAL 133 HG21 VAL 133 4.093 6.343 2.820 925 HG22 VAL 133 HG22 VAL 133 3.040 7.681 2.359 926 HG23 VAL 133 HG23 VAL 133 4.290 7.120 1.248 927 H THR 134 H THR 134 3.060 8.554 -0.453 928 HA THR 134 HA THR 134 3.844 7.720 -3.113 929 HB THR 134 HB THR 134 4.323 10.308 -1.618 930 HG1 THR 134 HG1 THR 134 2.049 9.527 -2.232 931 HG21 THR 134 HG21 THR 134 5.884 10.020 -3.453 932 HG22 THR 134 HG22 THR 134 4.702 11.273 -3.842 933 HG23 THR 134 HG23 THR 134 4.555 9.664 -4.551 934 H ILE 135 H ILE 135 5.646 6.657 -3.440 935 HA ILE 135 HA ILE 135 7.764 6.657 -1.435 936 HB ILE 135 HB ILE 135 7.643 5.043 -3.999 937 HG12 ILE 135 HG12 ILE 135 5.686 4.466 -2.658 938 HG13 ILE 135 HG13 ILE 135 6.840 3.140 -2.643 939 HG21 ILE 135 HG21 ILE 135 9.875 5.203 -3.050 940 HG22 ILE 135 HG22 ILE 135 9.255 3.559 -2.897 941 HG23 ILE 135 HG23 ILE 135 9.275 4.628 -1.494 942 HD11 ILE 135 HD11 ILE 135 7.555 3.789 -0.402 943 HD12 ILE 135 HD12 ILE 135 5.820 3.472 -0.465 944 HD13 ILE 135 HD13 ILE 135 6.411 5.133 -0.427 945 H ARG 136 H ARG 136 9.661 7.668 -1.699 946 HA ARG 136 HA ARG 136 9.972 9.290 -4.132 947 HB2 ARG 136 HB2 ARG 136 11.070 9.725 -1.344 948 HB3 ARG 136 HB3 ARG 136 11.321 10.798 -2.713 949 HG2 ARG 136 HG2 ARG 136 9.368 11.810 -2.407 950 HG3 ARG 136 HG3 ARG 136 8.508 10.279 -2.230 951 HD2 ARG 136 HD2 ARG 136 10.122 10.681 0.079 952 HD3 ARG 136 HD3 ARG 136 9.209 12.160 -0.220 953 HE ARG 136 HE ARG 136 7.508 9.918 -0.447 954 HH11 ARG 136 HH11 ARG 136 9.183 11.782 2.020 955 HH12 ARG 136 HH12 ARG 136 8.011 11.422 3.252 956 HH21 ARG 136 HH21 ARG 136 5.995 9.458 1.137 957 HH22 ARG 136 HH22 ARG 136 6.176 10.099 2.744 958 H ALA 137 H ALA 137 11.724 8.957 -5.396 959 HA ALA 137 HA ALA 137 13.820 7.173 -4.340 960 HB1 ALA 137 HB1 ALA 137 13.007 7.529 -7.221 961 HB2 ALA 137 HB2 ALA 137 12.555 6.172 -6.191 962 HB3 ALA 137 HB3 ALA 137 14.249 6.436 -6.609 963 H LEU 138 H LEU 138 15.973 7.679 -4.743 964 HA LEU 138 HA LEU 138 16.464 10.503 -5.120 965 HB2 LEU 138 HB2 LEU 138 18.309 8.225 -4.436 966 HB3 LEU 138 HB3 LEU 138 18.836 9.887 -4.625 967 HG LEU 138 HG LEU 138 16.830 8.937 -2.572 968 HD11 LEU 138 HD11 LEU 138 19.724 9.709 -2.249 969 HD12 LEU 138 HD12 LEU 138 19.054 8.084 -2.093 970 HD13 LEU 138 HD13 LEU 138 18.596 9.341 -0.943 971 HD21 LEU 138 HD21 LEU 138 18.174 11.612 -2.938 972 HD22 LEU 138 HD22 LEU 138 17.105 11.165 -1.609 973 HD23 LEU 138 HD23 LEU 138 16.477 11.250 -3.255 974 H GLU 139 H GLU 139 16.999 11.416 -6.892 975 HA GLU 139 HA GLU 139 17.481 9.782 -9.229 976 HB2 GLU 139 HB2 GLU 139 17.240 12.200 -10.294 977 HB3 GLU 139 HB3 GLU 139 15.859 11.219 -9.844 978 HG2 GLU 139 HG2 GLU 139 15.339 13.353 -9.070 979 HG3 GLU 139 HG3 GLU 139 15.872 12.485 -7.643 980 H HIS 140 H HIS 140 19.051 10.460 -10.859 981 HA HIS 140 HA HIS 140 21.558 11.093 -9.472 982 HB2 HIS 140 HB2 HIS 140 20.921 9.459 -11.907 983 HB3 HIS 140 HB3 HIS 140 22.556 10.052 -11.631 984 HD1 HIS 140 HD1 HIS 140 24.009 8.559 -10.242 985 HD2 HIS 140 HD2 HIS 140 19.961 7.773 -9.694 986 HE1 HIS 140 HE1 HIS 140 23.909 6.551 -8.725 987 HE2 HIS 140 HE2 HIS 140 21.447 6.131 -8.353 988 H HIS 141 H HIS 141 23.166 12.366 -10.560 989 HA HIS 141 HA HIS 141 21.987 14.296 -12.442 990 HB2 HIS 141 HB2 HIS 141 23.943 14.907 -10.195 991 HB3 HIS 141 HB3 HIS 141 23.390 16.063 -11.400 992 HD1 HIS 141 HD1 HIS 141 22.758 15.188 -8.046 993 HD2 HIS 141 HD2 HIS 141 20.303 16.070 -11.289 994 HE1 HIS 141 HE1 HIS 141 20.506 15.750 -7.059 995 HE2 HIS 141 HE2 HIS 141 19.001 15.992 -9.047 996 H HIS 142 H HIS 142 22.870 14.012 -14.334 997 HA HIS 142 HA HIS 142 25.463 12.776 -14.627 998 HB2 HIS 142 HB2 HIS 142 23.641 12.081 -16.097 999 HB3 HIS 142 HB3 HIS 142 23.439 13.725 -16.676 1000 HD1 HIS 142 HD1 HIS 142 24.799 14.428 -18.643 1001 HD2 HIS 142 HD2 HIS 142 26.065 10.806 -17.052 1002 HE1 HIS 142 HE1 HIS 142 26.538 13.568 -20.235 1003 HE2 HIS 142 HE2 HIS 142 27.236 11.330 -19.305 1004 H HIS 143 H HIS 143 27.295 13.759 -14.964 1005 HA HIS 143 HA HIS 143 27.299 16.533 -15.960 1006 HB2 HIS 143 HB2 HIS 143 29.515 15.200 -14.373 1007 HB3 HIS 143 HB3 HIS 143 29.420 16.887 -14.839 1008 HD1 HIS 143 HD1 HIS 143 27.122 18.103 -13.713 1009 HD2 HIS 143 HD2 HIS 143 28.769 14.784 -11.822 1010 HE1 HIS 143 HE1 HIS 143 26.209 18.145 -11.365 1011 HE2 HIS 143 HE2 HIS 143 27.093 16.049 -10.300 1012 H HIS 144 H HIS 144 28.933 17.025 -17.579 1013 HA HIS 144 HA HIS 144 29.465 14.749 -19.256 1014 HB2 HIS 144 HB2 HIS 144 30.468 16.352 -20.863 1015 HB3 HIS 144 HB3 HIS 144 28.816 16.737 -20.421 1016 HD1 HIS 144 HD1 HIS 144 28.413 19.127 -19.937 1017 HD2 HIS 144 HD2 HIS 144 32.403 18.096 -19.378 1018 HE1 HIS 144 HE1 HIS 144 29.606 21.285 -19.436 1019 HE2 HIS 144 HE2 HIS 144 32.040 20.666 -19.287 1020 H HIS 145 H HIS 145 31.344 13.803 -19.779 1021 HA HIS 145 HA HIS 145 33.523 14.148 -17.871 1022 HB2 HIS 145 HB2 HIS 145 32.629 11.876 -18.427 1023 HB3 HIS 145 HB3 HIS 145 33.187 12.091 -20.080 1024 HD1 HIS 145 HD1 HIS 145 34.520 11.649 -16.563 1025 HD2 HIS 145 HD2 HIS 145 35.826 11.453 -20.508 1026 HE1 HIS 145 HE1 HIS 145 36.842 10.689 -16.461 1027 HE2 HIS 145 HE2 HIS 145 37.648 10.649 -18.847 Start of MODEL 9 1 H1 MET 1 H1 MET 1 91.786 37.504 -46.327 2 H2 MET 1 H2 MET 1 92.237 38.979 -47.029 3 H3 MET 1 H3 MET 1 91.162 38.958 -45.723 4 HA MET 1 HA MET 1 93.986 38.082 -45.630 5 HB2 MET 1 HB2 MET 1 94.385 40.114 -44.272 6 HB3 MET 1 HB3 MET 1 93.917 40.472 -45.925 7 HG2 MET 1 HG2 MET 1 91.645 40.980 -45.165 8 HG3 MET 1 HG3 MET 1 92.127 40.631 -43.508 9 HE1 MET 1 HE1 MET 1 91.708 44.521 -43.456 10 HE2 MET 1 HE2 MET 1 91.209 42.984 -42.746 11 HE3 MET 1 HE3 MET 1 90.740 43.390 -44.400 12 H ASN 2 H ASN 2 90.865 38.176 -44.119 13 HA ASN 2 HA ASN 2 91.853 37.465 -41.498 14 HB2 ASN 2 HB2 ASN 2 89.789 38.803 -41.719 15 HB3 ASN 2 HB3 ASN 2 89.016 37.478 -42.578 16 HD21 ASN 2 HD21 ASN 2 87.386 37.244 -41.113 17 HD22 ASN 2 HD22 ASN 2 87.624 36.581 -39.528 18 H ALA 3 H ALA 3 92.794 35.580 -41.388 19 HA ALA 3 HA ALA 3 91.173 33.213 -41.779 20 HB1 ALA 3 HB1 ALA 3 92.345 33.417 -43.929 21 HB2 ALA 3 HB2 ALA 3 92.877 31.996 -43.029 22 HB3 ALA 3 HB3 ALA 3 93.890 33.440 -43.081 23 H ARG 4 H ARG 4 91.163 32.686 -39.697 24 HA ARG 4 HA ARG 4 93.761 32.022 -38.481 25 HB2 ARG 4 HB2 ARG 4 92.609 34.103 -37.493 26 HB3 ARG 4 HB3 ARG 4 91.374 33.004 -36.898 27 HG2 ARG 4 HG2 ARG 4 93.127 31.785 -35.641 28 HG3 ARG 4 HG3 ARG 4 94.296 32.996 -36.170 29 HD2 ARG 4 HD2 ARG 4 91.842 33.468 -34.478 30 HD3 ARG 4 HD3 ARG 4 93.519 33.526 -33.944 31 HE ARG 4 HE ARG 4 93.060 35.370 -36.056 32 HH11 ARG 4 HH11 ARG 4 92.553 34.958 -32.605 33 HH12 ARG 4 HH12 ARG 4 92.436 36.663 -32.295 34 HH21 ARG 4 HH21 ARG 4 92.908 37.592 -35.651 35 HH22 ARG 4 HH22 ARG 4 92.633 38.165 -34.033 36 H ASP 5 H ASP 5 93.813 29.867 -38.290 37 HA ASP 5 HA ASP 5 91.391 28.355 -38.581 38 HB2 ASP 5 HB2 ASP 5 92.840 26.396 -38.695 39 HB3 ASP 5 HB3 ASP 5 93.383 27.659 -39.783 40 H ASN 6 H ASN 6 90.340 27.157 -37.129 41 HA ASN 6 HA ASN 6 90.930 27.776 -34.326 42 HB2 ASN 6 HB2 ASN 6 88.706 28.381 -35.230 43 HB3 ASN 6 HB3 ASN 6 88.406 26.689 -35.605 44 HD21 ASN 6 HD21 ASN 6 86.646 26.483 -34.315 45 HD22 ASN 6 HD22 ASN 6 86.713 26.534 -32.584 46 H LYS 7 H LYS 7 91.732 26.296 -33.028 47 HA LYS 7 HA LYS 7 92.031 23.564 -33.920 48 HB2 LYS 7 HB2 LYS 7 93.175 25.223 -31.744 49 HB3 LYS 7 HB3 LYS 7 93.061 23.497 -31.442 50 HG2 LYS 7 HG2 LYS 7 95.230 23.985 -32.289 51 HG3 LYS 7 HG3 LYS 7 94.341 23.094 -33.523 52 HD2 LYS 7 HD2 LYS 7 93.850 25.223 -34.661 53 HD3 LYS 7 HD3 LYS 7 94.803 26.070 -33.440 54 HE2 LYS 7 HE2 LYS 7 95.872 23.890 -35.223 55 HE3 LYS 7 HE3 LYS 7 96.035 25.613 -35.550 56 HZ1 LYS 7 HZ1 LYS 7 98.009 24.677 -34.502 57 HZ2 LYS 7 HZ2 LYS 7 97.099 24.221 -33.153 58 HZ3 LYS 7 HZ3 LYS 7 97.299 25.863 -33.525 59 H PHE 8 H PHE 8 90.003 22.743 -33.920 60 HA PHE 8 HA PHE 8 88.696 22.404 -31.309 61 HB2 PHE 8 HB2 PHE 8 87.328 23.377 -33.163 62 HB3 PHE 8 HB3 PHE 8 87.581 21.906 -34.092 63 HD1 PHE 8 HD1 PHE 8 86.084 23.233 -30.980 64 HD2 PHE 8 HD2 PHE 8 86.192 20.041 -33.791 65 HE1 PHE 8 HE1 PHE 8 84.092 22.246 -29.932 66 HE2 PHE 8 HE2 PHE 8 84.204 19.047 -32.746 67 HZ PHE 8 HZ PHE 8 83.153 20.150 -30.815 68 H ASN 9 H ASN 9 89.250 20.615 -30.336 69 HA ASN 9 HA ASN 9 90.078 18.291 -31.918 70 HB2 ASN 9 HB2 ASN 9 91.024 17.472 -29.695 71 HB3 ASN 9 HB3 ASN 9 91.814 18.869 -30.413 72 HD21 ASN 9 HD21 ASN 9 89.758 17.748 -27.831 73 HD22 ASN 9 HD22 ASN 9 89.914 19.153 -26.834 74 H THR 10 H THR 10 89.538 16.134 -30.878 75 HA THR 10 HA THR 10 86.924 16.142 -29.553 76 HB THR 10 HB THR 10 87.575 14.352 -31.919 77 HG1 THR 10 HG1 THR 10 86.743 16.885 -31.878 78 HG21 THR 10 HG21 THR 10 85.197 13.759 -31.812 79 HG22 THR 10 HG22 THR 10 85.003 14.776 -30.384 80 HG23 THR 10 HG23 THR 10 86.026 13.339 -30.313 81 H TRP 11 H TRP 11 87.693 15.465 -27.640 82 HA TRP 11 HA TRP 11 88.956 12.802 -27.567 83 HB2 TRP 11 HB2 TRP 11 89.292 15.118 -25.648 84 HB3 TRP 11 HB3 TRP 11 89.857 13.484 -25.318 85 HD1 TRP 11 HD1 TRP 11 91.056 16.661 -26.644 86 HE1 TRP 11 HE1 TRP 11 93.256 16.366 -27.940 87 HE3 TRP 11 HE3 TRP 11 91.004 11.576 -27.187 88 HZ2 TRP 11 HZ2 TRP 11 94.771 14.253 -29.048 89 HZ3 TRP 11 HZ3 TRP 11 92.861 10.500 -28.378 90 HH2 TRP 11 HH2 TRP 11 94.702 11.809 -29.288 91 H ASN 12 H ASN 12 87.271 11.512 -27.286 92 HA ASN 12 HA ASN 12 85.521 12.086 -25.002 93 HB2 ASN 12 HB2 ASN 12 83.730 10.839 -26.079 94 HB3 ASN 12 HB3 ASN 12 84.274 12.135 -27.131 95 HD21 ASN 12 HD21 ASN 12 83.866 8.746 -26.739 96 HD22 ASN 12 HD22 ASN 12 84.403 8.279 -28.320 97 H ASP 13 H ASP 13 85.552 10.726 -23.394 98 HA ASP 13 HA ASP 13 86.811 8.091 -23.782 99 HB2 ASP 13 HB2 ASP 13 87.966 9.589 -22.159 100 HB3 ASP 13 HB3 ASP 13 86.486 9.681 -21.211 101 H SER 14 H SER 14 85.291 6.592 -24.050 102 HA SER 14 HA SER 14 82.769 6.929 -22.583 103 HB2 SER 14 HB2 SER 14 83.112 5.770 -25.360 104 HB3 SER 14 HB3 SER 14 81.590 5.994 -24.501 105 HG SER 14 HG SER 14 81.598 7.843 -25.509 106 H ARG 15 H ARG 15 83.301 5.574 -20.925 107 HA ARG 15 HA ARG 15 83.428 2.708 -21.596 108 HB2 ARG 15 HB2 ARG 15 84.108 4.202 -19.065 109 HB3 ARG 15 HB3 ARG 15 83.725 2.491 -19.020 110 HG2 ARG 15 HG2 ARG 15 85.992 2.412 -19.138 111 HG3 ARG 15 HG3 ARG 15 85.585 2.327 -20.848 112 HD2 ARG 15 HD2 ARG 15 86.058 4.685 -21.116 113 HD3 ARG 15 HD3 ARG 15 86.334 4.856 -19.383 114 HE ARG 15 HE ARG 15 88.045 3.196 -21.128 115 HH11 ARG 15 HH11 ARG 15 87.657 5.504 -18.498 116 HH12 ARG 15 HH12 ARG 15 89.360 5.620 -18.180 117 HH21 ARG 15 HH21 ARG 15 90.273 3.318 -20.687 118 HH22 ARG 15 HH22 ARG 15 90.855 4.370 -19.438 119 H GLY 16 H GLY 16 82.129 1.470 -19.633 120 HA2 GLY 16 HA2 GLY 16 79.718 2.745 -18.797 121 HA3 GLY 16 HA3 GLY 16 79.445 1.716 -20.196 122 H ASN 17 H ASN 17 79.337 1.798 -16.909 123 HA ASN 17 HA ASN 17 80.060 -1.000 -16.535 124 HB2 ASN 17 HB2 ASN 17 79.690 -0.664 -14.178 125 HB3 ASN 17 HB3 ASN 17 80.632 0.690 -14.774 126 HD21 ASN 17 HD21 ASN 17 77.650 -0.323 -13.350 127 HD22 ASN 17 HD22 ASN 17 76.995 1.254 -13.084 128 H TYR 18 H TYR 18 78.611 -2.602 -15.900 129 HA TYR 18 HA TYR 18 75.907 -2.228 -16.878 130 HB2 TYR 18 HB2 TYR 18 77.409 -4.658 -15.893 131 HB3 TYR 18 HB3 TYR 18 75.706 -4.702 -16.328 132 HD1 TYR 18 HD2 TYR 18 75.011 -4.423 -18.664 133 HD2 TYR 18 HD1 TYR 18 79.130 -4.526 -17.594 134 HE1 TYR 18 HE2 TYR 18 75.609 -4.809 -21.017 135 HE2 TYR 18 HE1 TYR 18 79.736 -4.914 -19.945 136 HH TYR 18 HH TYR 18 77.495 -4.536 -22.506 137 H TRP 19 H TRP 19 74.058 -2.423 -15.674 138 HA TRP 19 HA TRP 19 74.433 -2.027 -12.784 139 HB2 TRP 19 HB2 TRP 19 71.997 -1.356 -14.463 140 HB3 TRP 19 HB3 TRP 19 72.290 -0.893 -12.791 141 HD1 TRP 19 HD1 TRP 19 73.179 0.074 -16.372 142 HE1 TRP 19 HE1 TRP 19 74.373 2.351 -16.367 143 HE3 TRP 19 HE3 TRP 19 73.797 0.670 -11.321 144 HZ2 TRP 19 HZ2 TRP 19 75.426 4.162 -14.480 145 HZ3 TRP 19 HZ3 TRP 19 74.905 2.710 -10.509 146 HH2 TRP 19 HH2 TRP 19 75.700 4.416 -12.057 147 H SER 20 H SER 20 73.758 -3.569 -11.419 148 HA SER 20 HA SER 20 71.812 -5.549 -12.390 149 HB2 SER 20 HB2 SER 20 74.267 -6.165 -10.720 150 HB3 SER 20 HB3 SER 20 73.067 -7.330 -11.289 151 HG SER 20 HG SER 20 74.149 -5.778 -13.285 152 H ASP 21 H ASP 21 70.065 -5.363 -11.227 153 HA ASP 21 HA ASP 21 70.265 -5.121 -8.299 154 HB2 ASP 21 HB2 ASP 21 68.398 -3.574 -10.101 155 HB3 ASP 21 HB3 ASP 21 68.165 -3.703 -8.369 156 H TYR 22 H TYR 22 68.976 -6.505 -7.219 157 HA TYR 22 HA TYR 22 66.508 -7.495 -8.281 158 HB2 TYR 22 HB2 TYR 22 68.195 -8.930 -9.477 159 HB3 TYR 22 HB3 TYR 22 68.714 -9.536 -7.910 160 HD1 TYR 22 HD2 TYR 22 65.592 -9.120 -9.899 161 HD2 TYR 22 HD1 TYR 22 67.792 -11.502 -7.159 162 HE1 TYR 22 HE2 TYR 22 63.836 -10.833 -9.985 163 HE2 TYR 22 HE1 TYR 22 66.046 -13.214 -7.233 164 HH TYR 22 HH TYR 22 63.552 -13.193 -9.544 165 H GLU 23 H GLU 23 65.226 -7.614 -6.627 166 HA GLU 23 HA GLU 23 65.948 -9.108 -4.265 167 HB2 GLU 23 HB2 GLU 23 66.676 -6.786 -3.704 168 HB3 GLU 23 HB3 GLU 23 65.041 -6.222 -4.007 169 HG2 GLU 23 HG2 GLU 23 65.417 -6.435 -1.639 170 HG3 GLU 23 HG3 GLU 23 64.224 -7.612 -2.178 171 H GLY 24 H GLY 24 64.352 -10.538 -4.470 172 HA2 GLY 24 HA2 GLY 24 61.581 -9.528 -4.482 173 HA3 GLY 24 HA3 GLY 24 62.062 -10.832 -5.554 174 H SER 25 H SER 25 60.702 -10.106 -2.620 175 HA SER 25 HA SER 25 60.933 -12.880 -1.745 176 HB2 SER 25 HB2 SER 25 61.295 -12.097 0.637 177 HB3 SER 25 HB3 SER 25 62.672 -11.872 -0.442 178 HG SER 25 HG SER 25 61.946 -9.667 -0.698 179 H ASP 26 H ASP 26 59.248 -13.545 -0.303 180 HA ASP 26 HA ASP 26 56.902 -11.750 -0.245 181 HB2 ASP 26 HB2 ASP 26 56.934 -14.672 -1.045 182 HB3 ASP 26 HB3 ASP 26 55.464 -13.772 -0.693 183 H GLU 27 H GLU 27 55.879 -11.659 1.679 184 HA GLU 27 HA GLU 27 55.857 -13.962 3.438 185 HB2 GLU 27 HB2 GLU 27 57.740 -11.878 3.885 186 HB3 GLU 27 HB3 GLU 27 56.504 -11.735 5.128 187 HG2 GLU 27 HG2 GLU 27 58.156 -14.178 4.507 188 HG3 GLU 27 HG3 GLU 27 58.314 -13.131 5.918 189 H ASN 28 H ASN 28 53.628 -13.780 2.742 190 HA ASN 28 HA ASN 28 52.136 -12.003 4.560 191 HB2 ASN 28 HB2 ASN 28 51.618 -12.460 1.628 192 HB3 ASN 28 HB3 ASN 28 50.304 -12.047 2.719 193 HD21 ASN 28 HD21 ASN 28 51.840 -10.258 4.377 194 HD22 ASN 28 HD22 ASN 28 52.137 -8.839 3.434 195 H GLY 29 H GLY 29 50.256 -12.897 5.449 196 HA2 GLY 29 HA2 GLY 29 48.711 -14.959 4.898 197 HA3 GLY 29 HA3 GLY 29 50.185 -15.814 5.324 198 H ASP 30 H ASP 30 47.436 -14.119 6.479 199 HA ASP 30 HA ASP 30 48.163 -14.840 9.229 200 HB2 ASP 30 HB2 ASP 30 48.557 -12.412 8.992 201 HB3 ASP 30 HB3 ASP 30 46.917 -12.203 8.391 202 H GLY 31 H GLY 31 46.554 -15.847 10.299 203 HA2 GLY 31 HA2 GLY 31 44.241 -16.657 8.758 204 HA3 GLY 31 HA3 GLY 31 44.741 -17.292 10.314 205 H ILE 32 H ILE 32 42.092 -16.609 9.489 206 HA ILE 32 HA ILE 32 41.450 -14.499 11.414 207 HB ILE 32 HB ILE 32 41.558 -13.490 9.165 208 HG12 ILE 32 HG12 ILE 32 38.678 -13.630 10.056 209 HG13 ILE 32 HG13 ILE 32 39.912 -12.702 10.901 210 HG21 ILE 32 HG21 ILE 32 41.012 -15.377 7.772 211 HG22 ILE 32 HG22 ILE 32 39.894 -14.051 7.442 212 HG23 ILE 32 HG23 ILE 32 39.374 -15.426 8.419 213 HD11 ILE 32 HD11 ILE 32 39.059 -12.280 8.042 214 HD12 ILE 32 HD12 ILE 32 40.262 -11.333 8.920 215 HD13 ILE 32 HD13 ILE 32 38.572 -11.297 9.422 216 H GLY 33 H GLY 33 39.579 -14.801 12.577 217 HA2 GLY 33 HA2 GLY 33 37.295 -16.140 11.951 218 HA3 GLY 33 HA3 GLY 33 38.366 -17.418 12.497 219 H ASP 34 H ASP 34 36.395 -14.744 13.431 220 HA ASP 34 HA ASP 34 36.962 -15.356 16.262 221 HB2 ASP 34 HB2 ASP 34 36.447 -12.715 14.947 222 HB3 ASP 34 HB3 ASP 34 36.041 -12.948 16.643 223 H SER 35 H SER 35 35.339 -16.118 17.377 224 HA SER 35 HA SER 35 32.612 -15.215 16.899 225 HB2 SER 35 HB2 SER 35 33.366 -18.161 16.875 226 HB3 SER 35 HB3 SER 35 31.716 -17.547 16.975 227 HG SER 35 HG SER 35 33.034 -16.397 14.921 228 H ALA 36 H ALA 36 32.034 -14.472 18.849 229 HA ALA 36 HA ALA 36 32.391 -16.163 21.210 230 HB1 ALA 36 HB1 ALA 36 33.244 -14.306 22.559 231 HB2 ALA 36 HB2 ALA 36 33.255 -13.267 21.134 232 HB3 ALA 36 HB3 ALA 36 34.332 -14.660 21.216 233 H TYR 37 H TYR 37 30.432 -16.379 22.060 234 HA TYR 37 HA TYR 37 28.626 -14.138 22.305 235 HB2 TYR 37 HB2 TYR 37 26.793 -15.139 21.022 236 HB3 TYR 37 HB3 TYR 37 28.189 -14.875 19.989 237 HD1 TYR 37 HD2 TYR 37 29.635 -16.902 19.391 238 HD2 TYR 37 HD1 TYR 37 25.810 -17.261 21.217 239 HE1 TYR 37 HE2 TYR 37 29.518 -19.247 18.665 240 HE2 TYR 37 HE1 TYR 37 25.678 -19.602 20.493 241 HH TYR 37 HH TYR 37 28.360 -21.325 19.288 242 H ALA 38 H ALA 38 27.125 -14.394 23.896 243 HA ALA 38 HA ALA 38 26.213 -16.952 24.810 244 HB1 ALA 38 HB1 ALA 38 27.864 -15.344 26.769 245 HB2 ALA 38 HB2 ALA 38 28.353 -16.872 26.037 246 HB3 ALA 38 HB3 ALA 38 26.964 -16.822 27.122 247 H VAL 39 H VAL 39 24.206 -16.072 24.307 248 HA VAL 39 HA VAL 39 23.192 -14.277 26.405 249 HB VAL 39 HB VAL 39 21.383 -13.562 24.718 250 HG11 VAL 39 HG11 VAL 39 24.211 -12.578 24.380 251 HG12 VAL 39 HG12 VAL 39 23.046 -12.031 25.587 252 HG13 VAL 39 HG13 VAL 39 22.757 -11.716 23.876 253 HG21 VAL 39 HG21 VAL 39 23.495 -14.458 22.754 254 HG22 VAL 39 HG22 VAL 39 22.074 -13.487 22.365 255 HG23 VAL 39 HG23 VAL 39 21.883 -15.145 22.935 256 H ASN 40 H ASN 40 21.519 -14.986 27.501 257 HA ASN 40 HA ASN 40 20.203 -17.461 26.606 258 HB2 ASN 40 HB2 ASN 40 20.255 -16.156 29.337 259 HB3 ASN 40 HB3 ASN 40 19.396 -17.639 28.944 260 HD21 ASN 40 HD21 ASN 40 21.485 -17.164 30.886 261 HD22 ASN 40 HD22 ASN 40 22.792 -18.229 30.479 262 HA PRO 41 HA PRO 41 16.681 -14.665 25.905 263 HB2 PRO 41 HB2 PRO 41 15.551 -16.744 24.258 264 HB3 PRO 41 HB3 PRO 41 16.243 -15.201 23.752 265 HG2 PRO 41 HG2 PRO 41 17.372 -17.624 23.181 266 HG3 PRO 41 HG3 PRO 41 18.293 -16.117 23.322 267 HD2 PRO 41 HD2 PRO 41 17.918 -18.300 25.350 268 HD3 PRO 41 HD3 PRO 41 19.399 -17.419 24.901 269 H GLU 42 H GLU 42 16.744 -16.024 28.291 270 HA GLU 42 HA GLU 42 14.422 -17.759 28.524 271 HB2 GLU 42 HB2 GLU 42 16.343 -16.771 30.653 272 HB3 GLU 42 HB3 GLU 42 15.101 -17.995 30.875 273 HG2 GLU 42 HG2 GLU 42 16.234 -19.447 29.263 274 HG3 GLU 42 HG3 GLU 42 17.480 -18.223 29.043 275 H ALA 43 H ALA 43 15.496 -14.580 29.665 276 HA ALA 43 HA ALA 43 12.987 -13.987 30.948 277 HB1 ALA 43 HB1 ALA 43 15.068 -13.029 31.804 278 HB2 ALA 43 HB2 ALA 43 13.940 -11.761 31.322 279 HB3 ALA 43 HB3 ALA 43 15.306 -12.171 30.283 280 H GLY 44 H GLY 44 11.357 -12.698 30.193 281 HA2 GLY 44 HA2 GLY 44 10.680 -11.005 28.494 282 HA3 GLY 44 HA3 GLY 44 11.475 -12.044 27.315 283 H SER 45 H SER 45 9.171 -12.500 29.978 284 HA SER 45 HA SER 45 7.236 -13.590 28.061 285 HB2 SER 45 HB2 SER 45 7.806 -14.804 30.781 286 HB3 SER 45 HB3 SER 45 6.615 -15.369 29.610 287 HG SER 45 HG SER 45 8.980 -15.206 28.403 288 H MET 46 H MET 46 6.128 -11.674 28.113 289 HA MET 46 HA MET 46 4.849 -10.944 30.663 290 HB2 MET 46 HB2 MET 46 6.093 -9.054 28.650 291 HB3 MET 46 HB3 MET 46 5.045 -8.546 29.966 292 HG2 MET 46 HG2 MET 46 6.634 -9.365 31.591 293 HG3 MET 46 HG3 MET 46 7.670 -9.972 30.302 294 HE1 MET 46 HE1 MET 46 9.688 -6.939 31.766 295 HE2 MET 46 HE2 MET 46 9.717 -8.664 31.401 296 HE3 MET 46 HE3 MET 46 8.654 -8.049 32.667 297 H ASP 47 H ASP 47 2.812 -9.911 30.455 298 HA ASP 47 HA ASP 47 1.579 -10.051 27.788 299 HB2 ASP 47 HB2 ASP 47 0.923 -12.021 29.159 300 HB3 ASP 47 HB3 ASP 47 0.262 -10.930 30.374 301 H TYR 48 H TYR 48 0.472 -9.139 31.042 302 HA TYR 48 HA TYR 48 -0.278 -7.258 32.012 303 HB2 TYR 48 HB2 TYR 48 1.394 -5.871 29.909 304 HB3 TYR 48 HB3 TYR 48 0.595 -5.040 31.236 305 HD1 TYR 48 HD1 TYR 48 1.148 -6.080 33.636 306 HD2 TYR 48 HD2 TYR 48 3.602 -6.459 30.183 307 HE1 TYR 48 HE1 TYR 48 3.095 -6.507 35.077 308 HE2 TYR 48 HE2 TYR 48 5.551 -6.894 31.614 309 HH TYR 48 HH TYR 48 5.311 -7.654 34.889 310 H MET 49 H MET 49 -1.792 -8.407 29.604 311 HA MET 49 HA MET 49 -3.441 -6.026 29.074 312 HB2 MET 49 HB2 MET 49 -2.681 -7.103 27.026 313 HB3 MET 49 HB3 MET 49 -3.291 -8.654 27.580 314 HG2 MET 49 HG2 MET 49 -5.582 -7.730 27.540 315 HG3 MET 49 HG3 MET 49 -4.939 -6.227 26.891 316 HE1 MET 49 HE1 MET 49 -2.812 -7.031 24.799 317 HE2 MET 49 HE2 MET 49 -4.112 -5.892 24.449 318 HE3 MET 49 HE3 MET 49 -3.776 -7.217 23.334 319 HA PRO 50 HA PRO 50 -6.485 -8.123 31.707 320 HB2 PRO 50 HB2 PRO 50 -7.924 -5.611 31.663 321 HB3 PRO 50 HB3 PRO 50 -7.133 -6.394 33.031 322 HG2 PRO 50 HG2 PRO 50 -6.272 -4.056 31.884 323 HG3 PRO 50 HG3 PRO 50 -5.229 -5.167 32.786 324 HD2 PRO 50 HD2 PRO 50 -5.527 -4.815 29.837 325 HD3 PRO 50 HD3 PRO 50 -4.071 -5.161 30.793 326 H LEU 51 H LEU 51 -8.310 -9.125 30.979 327 HA LEU 51 HA LEU 51 -9.129 -8.534 28.252 328 HB2 LEU 51 HB2 LEU 51 -9.821 -10.812 30.098 329 HB3 LEU 51 HB3 LEU 51 -10.466 -10.642 28.478 330 HG LEU 51 HG LEU 51 -7.556 -11.036 29.205 331 HD11 LEU 51 HD11 LEU 51 -9.549 -12.830 27.824 332 HD12 LEU 51 HD12 LEU 51 -8.891 -13.051 29.445 333 HD13 LEU 51 HD13 LEU 51 -7.832 -13.177 28.040 334 HD21 LEU 51 HD21 LEU 51 -7.761 -9.588 27.246 335 HD22 LEU 51 HD22 LEU 51 -8.848 -10.752 26.487 336 HD23 LEU 51 HD23 LEU 51 -7.164 -11.184 26.786 337 H MET 52 H MET 52 -9.938 -6.903 30.673 338 HA MET 52 HA MET 52 -12.837 -6.909 30.335 339 HB2 MET 52 HB2 MET 52 -11.010 -5.226 32.072 340 HB3 MET 52 HB3 MET 52 -12.753 -5.023 31.989 341 HG2 MET 52 HG2 MET 52 -13.108 -7.216 32.901 342 HG3 MET 52 HG3 MET 52 -11.376 -7.550 32.859 343 HE1 MET 52 HE1 MET 52 -13.290 -4.379 35.630 344 HE2 MET 52 HE2 MET 52 -14.212 -5.350 34.481 345 HE3 MET 52 HE3 MET 52 -13.080 -4.130 33.897 346 H GLU 53 H GLU 53 -13.277 -6.126 28.341 347 HA GLU 53 HA GLU 53 -11.891 -3.723 27.427 348 HB2 GLU 53 HB2 GLU 53 -12.862 -4.237 25.221 349 HB3 GLU 53 HB3 GLU 53 -11.902 -5.569 25.842 350 HG2 GLU 53 HG2 GLU 53 -13.896 -6.784 26.456 351 HG3 GLU 53 HG3 GLU 53 -14.905 -5.417 25.986 352 H TYR 54 H TYR 54 -13.667 -2.495 25.845 353 HA TYR 54 HA TYR 54 -15.845 -1.833 27.689 354 HB2 TYR 54 HB2 TYR 54 -14.582 -0.139 25.501 355 HB3 TYR 54 HB3 TYR 54 -15.916 0.371 26.540 356 HD1 TYR 54 HD1 TYR 54 -15.450 0.144 29.122 357 HD2 TYR 54 HD2 TYR 54 -12.408 0.403 26.160 358 HE1 TYR 54 HE1 TYR 54 -13.841 0.812 30.848 359 HE2 TYR 54 HE2 TYR 54 -10.784 1.077 27.886 360 HH TYR 54 HH TYR 54 -11.413 0.774 31.218 361 H LEU 55 H LEU 55 -17.508 -2.995 27.185 362 HA LEU 55 HA LEU 55 -17.886 -4.131 24.612 363 HB2 LEU 55 HB2 LEU 55 -19.485 -4.200 27.149 364 HB3 LEU 55 HB3 LEU 55 -20.131 -4.871 25.669 365 HG LEU 55 HG LEU 55 -19.262 -6.692 26.876 366 HD11 LEU 55 HD11 LEU 55 -18.721 -6.780 24.525 367 HD12 LEU 55 HD12 LEU 55 -17.449 -7.543 25.481 368 HD13 LEU 55 HD13 LEU 55 -17.205 -5.926 24.822 369 HD21 LEU 55 HD21 LEU 55 -17.909 -5.524 28.507 370 HD22 LEU 55 HD22 LEU 55 -16.709 -5.146 27.271 371 HD23 LEU 55 HD23 LEU 55 -16.980 -6.821 27.753 372 H HIS 56 H HIS 56 -18.555 -3.072 22.966 373 HA HIS 56 HA HIS 56 -20.760 -1.162 23.289 374 HB2 HIS 56 HB2 HIS 56 -19.756 0.223 21.511 375 HB3 HIS 56 HB3 HIS 56 -18.689 0.090 22.900 376 HD1 HIS 56 HD1 HIS 56 -16.473 -1.328 22.531 377 HD2 HIS 56 HD2 HIS 56 -18.747 -0.732 19.096 378 HE1 HIS 56 HE1 HIS 56 -14.952 -1.897 20.608 379 HE2 HIS 56 HE2 HIS 56 -16.301 -1.369 18.542 380 H SER 57 H SER 57 -22.049 -0.877 21.317 381 HA SER 57 HA SER 57 -22.290 -3.365 19.816 382 HB2 SER 57 HB2 SER 57 -24.416 -2.240 18.964 383 HB3 SER 57 HB3 SER 57 -24.373 -2.631 20.681 384 HG SER 57 HG SER 57 -24.980 -0.609 20.798 385 H SER 58 H SER 58 -22.954 -2.968 17.435 386 HA SER 58 HA SER 58 -22.241 -2.604 15.347 387 HB2 SER 58 HB2 SER 58 -21.196 0.015 16.443 388 HB3 SER 58 HB3 SER 58 -21.036 -0.458 14.750 389 HG SER 58 HG SER 58 -22.967 0.336 14.538 390 HA PRO 59 HA PRO 59 -18.249 -4.627 15.585 391 HB2 PRO 59 HB2 PRO 59 -18.177 -5.227 12.907 392 HB3 PRO 59 HB3 PRO 59 -18.990 -6.207 14.129 393 HG2 PRO 59 HG2 PRO 59 -20.144 -4.201 12.235 394 HG3 PRO 59 HG3 PRO 59 -20.790 -5.775 12.736 395 HD2 PRO 59 HD2 PRO 59 -21.718 -3.466 13.752 396 HD3 PRO 59 HD3 PRO 59 -21.615 -4.950 14.721 397 H VAL 60 H VAL 60 -16.162 -4.354 14.550 398 HA VAL 60 HA VAL 60 -15.631 -1.554 14.308 399 HB VAL 60 HB VAL 60 -14.247 -3.027 15.679 400 HG11 VAL 60 HG11 VAL 60 -13.294 -4.255 13.108 401 HG12 VAL 60 HG12 VAL 60 -14.226 -5.046 14.379 402 HG13 VAL 60 HG13 VAL 60 -12.576 -4.511 14.699 403 HG21 VAL 60 HG21 VAL 60 -12.710 -1.710 13.457 404 HG22 VAL 60 HG22 VAL 60 -12.059 -2.188 15.026 405 HG23 VAL 60 HG23 VAL 60 -13.304 -0.944 14.932 406 H LEU 61 H LEU 61 -15.063 -0.394 12.637 407 HA LEU 61 HA LEU 61 -15.167 -1.423 9.959 408 HB2 LEU 61 HB2 LEU 61 -14.520 1.024 9.390 409 HB3 LEU 61 HB3 LEU 61 -16.111 0.685 10.001 410 HG LEU 61 HG LEU 61 -15.101 2.821 10.792 411 HD11 LEU 61 HD11 LEU 61 -15.763 2.626 13.135 412 HD12 LEU 61 HD12 LEU 61 -15.814 0.871 12.959 413 HD13 LEU 61 HD13 LEU 61 -16.920 1.880 12.027 414 HD21 LEU 61 HD21 LEU 61 -12.793 2.201 11.080 415 HD22 LEU 61 HD22 LEU 61 -13.225 1.076 12.368 416 HD23 LEU 61 HD23 LEU 61 -13.453 2.810 12.600 417 HA PRO 62 HA PRO 62 -10.995 -2.384 9.512 418 HB2 PRO 62 HB2 PRO 62 -10.302 -1.901 6.974 419 HB3 PRO 62 HB3 PRO 62 -11.594 -3.035 7.376 420 HG2 PRO 62 HG2 PRO 62 -11.768 -0.253 6.336 421 HG3 PRO 62 HG3 PRO 62 -12.802 -1.652 5.997 422 HD2 PRO 62 HD2 PRO 62 -13.362 0.410 7.807 423 HD3 PRO 62 HD3 PRO 62 -14.184 -1.156 7.715 424 H THR 63 H THR 63 -8.732 -1.796 8.757 425 HA THR 63 HA THR 63 -8.256 1.061 8.697 426 HB THR 63 HB THR 63 -7.962 0.310 11.095 427 HG1 THR 63 HG1 THR 63 -6.846 2.137 10.181 428 HG21 THR 63 HG21 THR 63 -6.989 -1.893 10.803 429 HG22 THR 63 HG22 THR 63 -5.919 -0.850 11.741 430 HG23 THR 63 HG23 THR 63 -5.564 -1.179 10.044 431 H ALA 64 H ALA 64 -7.029 1.510 7.031 432 HA ALA 64 HA ALA 64 -5.539 -0.624 5.742 433 HB1 ALA 64 HB1 ALA 64 -5.157 0.970 3.939 434 HB2 ALA 64 HB2 ALA 64 -5.909 2.244 4.897 435 HB3 ALA 64 HB3 ALA 64 -6.873 0.877 4.341 436 H ARG 65 H ARG 65 -3.761 -1.075 6.701 437 HA ARG 65 HA ARG 65 -1.919 1.089 7.402 438 HB2 ARG 65 HB2 ARG 65 -2.571 -1.405 8.975 439 HB3 ARG 65 HB3 ARG 65 -1.085 -0.503 9.217 440 HG2 ARG 65 HG2 ARG 65 -2.389 1.464 9.850 441 HG3 ARG 65 HG3 ARG 65 -3.877 0.541 9.630 442 HD2 ARG 65 HD2 ARG 65 -3.320 -0.935 11.409 443 HD3 ARG 65 HD3 ARG 65 -1.679 -0.297 11.503 444 HE ARG 65 HE ARG 65 -3.547 1.765 11.967 445 HH11 ARG 65 HH11 ARG 65 -2.318 -1.119 13.549 446 HH12 ARG 65 HH12 ARG 65 -2.428 -0.438 15.143 447 HH21 ARG 65 HH21 ARG 65 -3.724 2.641 14.042 448 HH22 ARG 65 HH22 ARG 65 -3.264 1.700 15.427 449 H PHE 66 H PHE 66 0.218 0.626 7.049 450 HA PHE 66 HA PHE 66 1.096 -1.938 6.165 451 HB2 PHE 66 HB2 PHE 66 2.081 -0.907 3.988 452 HB3 PHE 66 HB3 PHE 66 0.403 -1.427 3.993 453 HD1 PHE 66 HD1 PHE 66 2.540 1.604 4.363 454 HD2 PHE 66 HD2 PHE 66 -1.265 0.024 3.335 455 HE1 PHE 66 HE1 PHE 66 1.821 3.822 3.611 456 HE2 PHE 66 HE2 PHE 66 -1.990 2.240 2.580 457 HZ PHE 66 HZ PHE 66 -0.446 4.145 2.722 458 H THR 67 H THR 67 3.370 -2.102 6.112 459 HA THR 67 HA THR 67 4.755 0.298 7.083 460 HB THR 67 HB THR 67 4.810 -1.291 8.862 461 HG1 THR 67 HG1 THR 67 6.781 -0.597 9.045 462 HG21 THR 67 HG21 THR 67 5.876 -3.316 6.894 463 HG22 THR 67 HG22 THR 67 4.291 -3.342 7.671 464 HG23 THR 67 HG23 THR 67 5.751 -3.548 8.640 465 H SER 68 H SER 68 6.284 1.081 5.902 466 HA SER 68 HA SER 68 7.484 -0.572 3.784 467 HB2 SER 68 HB2 SER 68 7.755 1.568 2.489 468 HB3 SER 68 HB3 SER 68 6.071 1.105 2.730 469 HG SER 68 HG SER 68 7.262 2.781 4.623 470 H ASP 69 H ASP 69 9.664 -0.539 3.626 471 HA ASP 69 HA ASP 69 11.193 0.194 5.877 472 HB2 ASP 69 HB2 ASP 69 11.770 -1.639 4.300 473 HB3 ASP 69 HB3 ASP 69 12.153 -0.434 3.077 474 H ILE 70 H ILE 70 11.209 1.532 2.574 475 HA ILE 70 HA ILE 70 12.196 4.036 3.710 476 HB ILE 70 HB ILE 70 12.921 4.574 1.308 477 HG12 ILE 70 HG12 ILE 70 13.697 2.192 0.276 478 HG13 ILE 70 HG13 ILE 70 12.166 1.720 1.001 479 HG21 ILE 70 HG21 ILE 70 15.073 3.435 1.595 480 HG22 ILE 70 HG22 ILE 70 14.367 2.456 2.880 481 HG23 ILE 70 HG23 ILE 70 14.500 4.205 3.076 482 HD11 ILE 70 HD11 ILE 70 12.557 3.903 -1.035 483 HD12 ILE 70 HD12 ILE 70 11.023 3.445 -0.297 484 HD13 ILE 70 HD13 ILE 70 11.877 2.300 -1.331 485 H THR 71 H THR 71 11.241 5.897 3.288 486 HA THR 71 HA THR 71 8.864 5.886 1.547 487 HB THR 71 HB THR 71 8.433 8.152 2.732 488 HG1 THR 71 HG1 THR 71 9.892 6.919 4.827 489 HG21 THR 71 HG21 THR 71 7.021 6.187 3.020 490 HG22 THR 71 HG22 THR 71 7.232 7.037 4.552 491 HG23 THR 71 HG23 THR 71 8.138 5.558 4.233 492 H GLU 72 H GLU 72 12.030 7.036 2.110 493 HA GLU 72 HA GLU 72 12.211 8.074 -0.542 494 HB2 GLU 72 HB2 GLU 72 11.407 10.068 0.757 495 HB3 GLU 72 HB3 GLU 72 12.872 9.968 1.726 496 HG2 GLU 72 HG2 GLU 72 14.254 10.418 -0.214 497 HG3 GLU 72 HG3 GLU 72 12.848 10.348 -1.273 498 H GLY 73 H GLY 73 14.206 7.820 -1.298 499 HA2 GLY 73 HA2 GLY 73 16.639 7.764 0.029 500 HA3 GLY 73 HA3 GLY 73 15.991 6.124 0.118 501 H PHE 74 H PHE 74 18.086 5.860 -1.250 502 HA PHE 74 HA PHE 74 17.865 6.621 -4.020 503 HB2 PHE 74 HB2 PHE 74 19.831 5.233 -4.404 504 HB3 PHE 74 HB3 PHE 74 20.086 6.164 -2.938 505 HD1 PHE 74 HD1 PHE 74 19.988 5.014 -0.725 506 HD2 PHE 74 HD2 PHE 74 19.820 2.854 -4.389 507 HE1 PHE 74 HE1 PHE 74 20.554 2.948 0.468 508 HE2 PHE 74 HE2 PHE 74 20.382 0.779 -3.195 509 HZ PHE 74 HZ PHE 74 20.750 0.826 -0.764 510 H ALA 75 H ALA 75 17.104 5.377 -5.717 511 HA ALA 75 HA ALA 75 15.076 3.581 -5.540 512 HB1 ALA 75 HB1 ALA 75 15.511 2.958 -7.842 513 HB2 ALA 75 HB2 ALA 75 17.155 3.584 -7.717 514 HB3 ALA 75 HB3 ALA 75 15.781 4.688 -7.618 515 HA PRO 76 HA PRO 76 17.325 0.036 -3.946 516 HB2 PRO 76 HB2 PRO 76 14.925 -0.915 -2.753 517 HB3 PRO 76 HB3 PRO 76 16.222 -0.011 -1.971 518 HG2 PRO 76 HG2 PRO 76 13.646 0.929 -2.360 519 HG3 PRO 76 HG3 PRO 76 15.068 1.946 -2.065 520 HD2 PRO 76 HD2 PRO 76 13.745 1.247 -4.666 521 HD3 PRO 76 HD3 PRO 76 14.402 2.808 -4.117 522 H LEU 77 H LEU 77 17.043 -2.317 -4.024 523 HA LEU 77 HA LEU 77 15.888 -3.042 -6.575 524 HB2 LEU 77 HB2 LEU 77 17.019 -5.281 -6.133 525 HB3 LEU 77 HB3 LEU 77 18.048 -3.904 -6.435 526 HG LEU 77 HG LEU 77 17.517 -4.728 -3.595 527 HD11 LEU 77 HD11 LEU 77 19.531 -5.985 -5.451 528 HD12 LEU 77 HD12 LEU 77 18.116 -6.784 -4.762 529 HD13 LEU 77 HD13 LEU 77 19.426 -6.243 -3.710 530 HD21 LEU 77 HD21 LEU 77 19.797 -3.881 -3.276 531 HD22 LEU 77 HD22 LEU 77 18.767 -2.657 -4.018 532 HD23 LEU 77 HD23 LEU 77 19.922 -3.551 -5.007 533 H SER 78 H SER 78 15.830 -4.569 -3.314 534 HA SER 78 HA SER 78 13.024 -5.245 -3.903 535 HB2 SER 78 HB2 SER 78 14.562 -7.183 -3.480 536 HB3 SER 78 HB3 SER 78 14.819 -6.562 -1.848 537 HG SER 78 HG SER 78 13.195 -8.002 -1.655 538 H VAL 79 H VAL 79 11.904 -3.578 -3.177 539 HA VAL 79 HA VAL 79 12.495 -2.148 -0.757 540 HB VAL 79 HB VAL 79 10.022 -2.044 -2.516 541 HG11 VAL 79 HG11 VAL 79 9.524 0.099 -1.461 542 HG12 VAL 79 HG12 VAL 79 10.916 -0.085 -0.395 543 HG13 VAL 79 HG13 VAL 79 9.550 -1.193 -0.257 544 HG21 VAL 79 HG21 VAL 79 12.444 -0.256 -2.414 545 HG22 VAL 79 HG22 VAL 79 11.010 0.008 -3.408 546 HG23 VAL 79 HG23 VAL 79 12.039 -1.395 -3.699 547 H ARG 80 H ARG 80 11.928 -2.681 1.217 548 HA ARG 80 HA ARG 80 10.413 -5.062 1.726 549 HB2 ARG 80 HB2 ARG 80 11.357 -3.044 3.770 550 HB3 ARG 80 HB3 ARG 80 10.984 -4.741 4.032 551 HG2 ARG 80 HG2 ARG 80 13.295 -3.676 2.420 552 HG3 ARG 80 HG3 ARG 80 13.380 -4.329 4.055 553 HD2 ARG 80 HD2 ARG 80 12.713 -6.496 3.284 554 HD3 ARG 80 HD3 ARG 80 12.409 -5.877 1.663 555 HE ARG 80 HE ARG 80 14.977 -5.306 1.924 556 HH11 ARG 80 HH11 ARG 80 13.265 -8.233 2.812 557 HH12 ARG 80 HH12 ARG 80 14.609 -9.282 2.473 558 HH21 ARG 80 HH21 ARG 80 16.747 -6.668 1.480 559 HH22 ARG 80 HH22 ARG 80 16.585 -8.383 1.701 560 H PHE 81 H PHE 81 8.291 -5.055 1.586 561 HA PHE 81 HA PHE 81 6.779 -2.915 2.880 562 HB2 PHE 81 HB2 PHE 81 6.989 -2.425 0.407 563 HB3 PHE 81 HB3 PHE 81 6.090 -3.908 0.104 564 HD1 PHE 81 HD1 PHE 81 5.896 -0.563 1.644 565 HD2 PHE 81 HD2 PHE 81 3.734 -3.973 0.304 566 HE1 PHE 81 HE1 PHE 81 3.790 0.680 1.885 567 HE2 PHE 81 HE2 PHE 81 1.632 -2.733 0.545 568 HZ PHE 81 HZ PHE 81 1.658 -0.409 1.332 569 H LYS 82 H LYS 82 5.298 -3.728 4.162 570 HA LYS 82 HA LYS 82 4.175 -6.380 3.573 571 HB2 LYS 82 HB2 LYS 82 6.099 -6.339 5.313 572 HB3 LYS 82 HB3 LYS 82 4.950 -5.542 6.371 573 HG2 LYS 82 HG2 LYS 82 4.109 -8.090 5.113 574 HG3 LYS 82 HG3 LYS 82 5.332 -8.165 6.379 575 HD2 LYS 82 HD2 LYS 82 3.870 -7.184 7.970 576 HD3 LYS 82 HD3 LYS 82 2.721 -6.713 6.717 577 HE2 LYS 82 HE2 LYS 82 3.393 -9.556 7.460 578 HE3 LYS 82 HE3 LYS 82 1.979 -8.671 8.031 579 HZ1 LYS 82 HZ1 LYS 82 2.593 -9.273 5.185 580 HZ2 LYS 82 HZ2 LYS 82 1.215 -8.464 5.754 581 HZ3 LYS 82 HZ3 LYS 82 1.463 -10.095 6.140 582 H ASP 83 H ASP 83 1.978 -6.559 4.061 583 HA ASP 83 HA ASP 83 0.641 -4.030 4.511 584 HB2 ASP 83 HB2 ASP 83 -1.335 -5.023 3.715 585 HB3 ASP 83 HB3 ASP 83 -0.058 -5.677 2.707 586 H PHE 84 H PHE 84 -0.478 -3.457 6.254 587 HA PHE 84 HA PHE 84 -0.264 -5.271 8.579 588 HB2 PHE 84 HB2 PHE 84 1.343 -3.223 8.335 589 HB3 PHE 84 HB3 PHE 84 -0.066 -2.264 8.763 590 HD1 PHE 84 HD1 PHE 84 2.003 -5.105 9.957 591 HD2 PHE 84 HD2 PHE 84 -0.548 -1.864 10.988 592 HE1 PHE 84 HE1 PHE 84 2.502 -5.475 12.339 593 HE2 PHE 84 HE2 PHE 84 -0.058 -2.224 13.368 594 HZ PHE 84 HZ PHE 84 1.469 -4.030 14.046 595 H SER 85 H SER 85 -2.401 -4.516 6.583 596 HA SER 85 HA SER 85 -4.353 -2.908 7.802 597 HB2 SER 85 HB2 SER 85 -4.637 -5.014 5.657 598 HB3 SER 85 HB3 SER 85 -5.868 -3.817 6.070 599 HG SER 85 HG SER 85 -3.294 -2.886 5.520 600 H GLU 86 H GLU 86 -5.764 -3.224 9.298 601 HA GLU 86 HA GLU 86 -6.267 -5.960 10.284 602 HB2 GLU 86 HB2 GLU 86 -6.239 -3.446 11.951 603 HB3 GLU 86 HB3 GLU 86 -6.357 -5.104 12.522 604 HG2 GLU 86 HG2 GLU 86 -4.087 -5.525 11.762 605 HG3 GLU 86 HG3 GLU 86 -3.997 -3.873 11.164 606 H ASN 87 H ASN 87 -8.302 -6.074 11.572 607 HA ASN 87 HA ASN 87 -10.551 -5.888 11.873 608 HB2 ASN 87 HB2 ASN 87 -9.987 -2.977 11.232 609 HB3 ASN 87 HB3 ASN 87 -11.478 -3.579 11.946 610 HD21 ASN 87 HD21 ASN 87 -8.949 -1.894 12.745 611 HD22 ASN 87 HD22 ASN 87 -8.649 -2.433 14.359 612 H ALA 88 H ALA 88 -9.637 -6.670 9.272 613 HA ALA 88 HA ALA 88 -11.374 -5.179 7.427 614 HB1 ALA 88 HB1 ALA 88 -8.819 -6.664 6.833 615 HB2 ALA 88 HB2 ALA 88 -8.982 -4.913 6.983 616 HB3 ALA 88 HB3 ALA 88 -9.792 -5.766 5.667 617 H THR 89 H THR 89 -12.700 -6.222 6.110 618 HA THR 89 HA THR 89 -13.252 -9.021 6.544 619 HB THR 89 HB THR 89 -14.540 -7.009 4.672 620 HG1 THR 89 HG1 THR 89 -14.931 -7.669 7.393 621 HG21 THR 89 HG21 THR 89 -15.063 -9.322 4.056 622 HG22 THR 89 HG22 THR 89 -16.480 -8.513 4.728 623 HG23 THR 89 HG23 THR 89 -15.568 -9.659 5.712 624 H SER 90 H SER 90 -11.964 -6.913 4.007 625 HA SER 90 HA SER 90 -10.586 -9.167 2.809 626 HB2 SER 90 HB2 SER 90 -12.846 -9.021 1.671 627 HB3 SER 90 HB3 SER 90 -12.380 -7.420 1.108 628 HG SER 90 HG SER 90 -11.296 -9.932 0.416 629 H ARG 91 H ARG 91 -8.830 -8.494 1.486 630 HA ARG 91 HA ARG 91 -8.146 -5.640 1.668 631 HB2 ARG 91 HB2 ARG 91 -5.817 -6.302 1.188 632 HB3 ARG 91 HB3 ARG 91 -6.426 -7.094 2.635 633 HG2 ARG 91 HG2 ARG 91 -6.565 -9.168 1.587 634 HG3 ARG 91 HG3 ARG 91 -6.513 -8.462 -0.027 635 HD2 ARG 91 HD2 ARG 91 -4.414 -9.470 0.329 636 HD3 ARG 91 HD3 ARG 91 -4.172 -7.735 0.480 637 HE ARG 91 HE ARG 91 -3.829 -8.008 2.808 638 HH11 ARG 91 HH11 ARG 91 -4.456 -11.094 1.220 639 HH12 ARG 91 HH12 ARG 91 -3.563 -12.013 2.399 640 HH21 ARG 91 HH21 ARG 91 -2.676 -9.231 4.359 641 HH22 ARG 91 HH22 ARG 91 -2.581 -10.958 4.191 642 H LEU 92 H LEU 92 -7.388 -4.551 -0.222 643 HA LEU 92 HA LEU 92 -7.880 -5.937 -2.762 644 HB2 LEU 92 HB2 LEU 92 -9.820 -4.471 -1.957 645 HB3 LEU 92 HB3 LEU 92 -8.769 -3.101 -2.227 646 HG LEU 92 HG LEU 92 -9.350 -4.998 -4.487 647 HD11 LEU 92 HD11 LEU 92 -11.272 -3.612 -5.088 648 HD12 LEU 92 HD12 LEU 92 -11.089 -2.705 -3.586 649 HD13 LEU 92 HD13 LEU 92 -11.518 -4.416 -3.537 650 HD21 LEU 92 HD21 LEU 92 -7.639 -3.265 -4.809 651 HD22 LEU 92 HD22 LEU 92 -8.823 -2.026 -4.381 652 HD23 LEU 92 HD23 LEU 92 -9.047 -2.997 -5.838 653 H TRP 93 H TRP 93 -6.001 -5.965 -3.788 654 HA TRP 93 HA TRP 93 -4.140 -3.742 -3.485 655 HB2 TRP 93 HB2 TRP 93 -3.887 -6.519 -4.615 656 HB3 TRP 93 HB3 TRP 93 -2.658 -5.294 -4.914 657 HD1 TRP 93 HD1 TRP 93 -3.506 -7.949 -2.518 658 HE1 TRP 93 HE1 TRP 93 -2.088 -7.725 -0.381 659 HE3 TRP 93 HE3 TRP 93 -1.703 -3.217 -3.228 660 HZ2 TRP 93 HZ2 TRP 93 -0.436 -5.792 0.846 661 HZ3 TRP 93 HZ3 TRP 93 -0.218 -2.251 -1.524 662 HH2 TRP 93 HH2 TRP 93 0.400 -3.516 0.470 663 H MET 94 H MET 94 -4.349 -2.095 -4.839 664 HA MET 94 HA MET 94 -5.106 -2.713 -7.607 665 HB2 MET 94 HB2 MET 94 -5.938 -0.298 -7.689 666 HB3 MET 94 HB3 MET 94 -6.907 -1.465 -6.812 667 HG2 MET 94 HG2 MET 94 -6.001 -0.631 -4.705 668 HG3 MET 94 HG3 MET 94 -5.031 0.543 -5.590 669 HE1 MET 94 HE1 MET 94 -7.823 2.801 -7.213 670 HE2 MET 94 HE2 MET 94 -7.128 1.347 -7.932 671 HE3 MET 94 HE3 MET 94 -6.090 2.494 -7.083 672 H PHE 95 H PHE 95 -3.206 -2.926 -8.553 673 HA PHE 95 HA PHE 95 -1.218 -0.813 -8.433 674 HB2 PHE 95 HB2 PHE 95 -1.339 -3.316 -10.146 675 HB3 PHE 95 HB3 PHE 95 0.038 -2.228 -10.021 676 HD1 PHE 95 HD2 PHE 95 1.300 -2.080 -7.893 677 HD2 PHE 95 HD1 PHE 95 -1.749 -4.986 -8.511 678 HE1 PHE 95 HE2 PHE 95 2.157 -3.382 -5.990 679 HE2 PHE 95 HE1 PHE 95 -0.899 -6.287 -6.607 680 HZ PHE 95 HZ PHE 95 1.054 -5.487 -5.343 681 H GLY 96 H GLY 96 -3.676 -2.072 -10.594 682 HA2 GLY 96 HA2 GLY 96 -5.034 -0.431 -11.743 683 HA3 GLY 96 HA3 GLY 96 -3.556 0.452 -12.101 684 H ASP 97 H ASP 97 -2.051 -1.969 -12.917 685 HA ASP 97 HA ASP 97 -3.345 -2.630 -15.393 686 HB2 ASP 97 HB2 ASP 97 -1.290 -3.839 -15.913 687 HB3 ASP 97 HB3 ASP 97 -0.925 -2.224 -15.330 688 H GLY 98 H GLY 98 -3.963 -4.676 -16.068 689 HA2 GLY 98 HA2 GLY 98 -4.816 -6.799 -15.852 690 HA3 GLY 98 HA3 GLY 98 -3.962 -6.934 -14.320 691 H ASN 99 H ASN 99 -5.315 -7.476 -12.839 692 HA ASN 99 HA ASN 99 -7.652 -5.787 -12.446 693 HB2 ASN 99 HB2 ASN 99 -9.223 -7.513 -12.047 694 HB3 ASN 99 HB3 ASN 99 -8.441 -7.895 -13.563 695 HD21 ASN 99 HD21 ASN 99 -7.109 -9.689 -13.672 696 HD22 ASN 99 HD22 ASN 99 -7.117 -10.928 -12.465 697 H THR 100 H THR 100 -8.487 -5.781 -10.315 698 HA THR 100 HA THR 100 -6.321 -5.555 -8.482 699 HB THR 100 HB THR 100 -8.066 -4.715 -6.893 700 HG1 THR 100 HG1 THR 100 -9.777 -5.201 -9.137 701 HG21 THR 100 HG21 THR 100 -7.960 -3.499 -9.652 702 HG22 THR 100 HG22 THR 100 -6.890 -3.148 -8.290 703 HG23 THR 100 HG23 THR 100 -8.590 -2.683 -8.220 704 H SER 101 H SER 101 -6.252 -6.305 -6.346 705 HA SER 101 HA SER 101 -5.828 -7.959 -4.876 706 HB2 SER 101 HB2 SER 101 -8.610 -8.859 -5.644 707 HB3 SER 101 HB3 SER 101 -7.743 -9.322 -4.177 708 HG SER 101 HG SER 101 -9.266 -7.508 -3.998 709 H ASP 102 H ASP 102 -5.226 -8.532 -7.825 710 HA ASP 102 HA ASP 102 -4.959 -11.439 -7.543 711 HB2 ASP 102 HB2 ASP 102 -6.817 -10.923 -9.072 712 HB3 ASP 102 HB3 ASP 102 -5.729 -9.953 -10.058 713 H SER 103 H SER 103 -2.879 -11.503 -7.062 714 HA SER 103 HA SER 103 -1.021 -10.809 -9.206 715 HB2 SER 103 HB2 SER 103 -0.504 -10.158 -6.289 716 HB3 SER 103 HB3 SER 103 0.644 -9.951 -7.609 717 HG SER 103 HG SER 103 -1.591 -8.696 -8.278 718 HA PRO 104 HA PRO 104 -0.397 -15.218 -8.184 719 HB2 PRO 104 HB2 PRO 104 1.431 -14.944 -10.500 720 HB3 PRO 104 HB3 PRO 104 0.152 -16.125 -10.218 721 HG2 PRO 104 HG2 PRO 104 -0.182 -14.174 -11.991 722 HG3 PRO 104 HG3 PRO 104 -1.521 -14.682 -10.944 723 HD2 PRO 104 HD2 PRO 104 0.273 -12.300 -10.709 724 HD3 PRO 104 HD3 PRO 104 -1.484 -12.412 -10.457 725 H SER 105 H SER 105 2.279 -13.163 -9.330 726 HA SER 105 HA SER 105 3.603 -13.667 -6.781 727 HB2 SER 105 HB2 SER 105 5.830 -13.626 -8.012 728 HB3 SER 105 HB3 SER 105 4.858 -15.073 -8.270 729 HG SER 105 HG SER 105 4.831 -14.625 -10.312 730 HA PRO 106 HA PRO 106 3.620 -9.150 -7.248 731 HB2 PRO 106 HB2 PRO 106 3.964 -9.033 -4.371 732 HB3 PRO 106 HB3 PRO 106 2.567 -8.547 -5.331 733 HG2 PRO 106 HG2 PRO 106 2.572 -10.674 -3.612 734 HG3 PRO 106 HG3 PRO 106 1.507 -10.555 -5.025 735 HD2 PRO 106 HD2 PRO 106 4.080 -12.061 -4.703 736 HD3 PRO 106 HD3 PRO 106 2.580 -12.558 -5.513 737 H LEU 107 H LEU 107 5.772 -9.935 -8.205 738 HA LEU 107 HA LEU 107 8.102 -9.827 -6.541 739 HB2 LEU 107 HB2 LEU 107 7.983 -11.218 -8.583 740 HB3 LEU 107 HB3 LEU 107 7.843 -9.766 -9.554 741 HG LEU 107 HG LEU 107 10.112 -9.090 -8.807 742 HD11 LEU 107 HD11 LEU 107 10.202 -10.304 -6.693 743 HD12 LEU 107 HD12 LEU 107 11.558 -10.724 -7.737 744 HD13 LEU 107 HD13 LEU 107 10.203 -11.839 -7.567 745 HD21 LEU 107 HD21 LEU 107 9.763 -10.243 -10.919 746 HD22 LEU 107 HD22 LEU 107 9.934 -11.799 -10.107 747 HD23 LEU 107 HD23 LEU 107 11.305 -10.692 -10.192 748 H HIS 108 H HIS 108 9.086 -8.088 -5.876 749 HA HIS 108 HA HIS 108 8.426 -5.544 -7.163 750 HB2 HIS 108 HB2 HIS 108 8.786 -4.541 -4.832 751 HB3 HIS 108 HB3 HIS 108 7.306 -5.438 -5.114 752 HD1 HIS 108 HD1 HIS 108 7.008 -7.663 -3.790 753 HD2 HIS 108 HD2 HIS 108 10.530 -5.622 -2.937 754 HE1 HIS 108 HE1 HIS 108 7.925 -8.740 -1.703 755 HE2 HIS 108 HE2 HIS 108 10.098 -7.542 -1.257 756 H THR 109 H THR 109 10.097 -5.210 -8.423 757 HA THR 109 HA THR 109 12.640 -4.696 -7.074 758 HB THR 109 HB THR 109 12.514 -5.935 -9.839 759 HG1 THR 109 HG1 THR 109 12.590 -7.082 -7.282 760 HG21 THR 109 HG21 THR 109 14.919 -6.315 -9.467 761 HG22 THR 109 HG22 THR 109 14.800 -5.506 -7.903 762 HG23 THR 109 HG23 THR 109 14.516 -4.599 -9.389 763 H PHE 110 H PHE 110 12.841 -2.581 -7.154 764 HA PHE 110 HA PHE 110 11.711 -1.178 -9.453 765 HB2 PHE 110 HB2 PHE 110 12.406 -0.164 -6.698 766 HB3 PHE 110 HB3 PHE 110 11.833 0.857 -8.015 767 HD1 PHE 110 HD1 PHE 110 9.555 0.266 -9.053 768 HD2 PHE 110 HD2 PHE 110 10.887 -1.238 -5.310 769 HE1 PHE 110 HE1 PHE 110 7.229 -0.248 -8.432 770 HE2 PHE 110 HE2 PHE 110 8.569 -1.750 -4.681 771 HZ PHE 110 HZ PHE 110 6.737 -1.254 -6.240 772 H PHE 111 H PHE 111 13.480 -1.924 -10.661 773 HA PHE 111 HA PHE 111 16.130 -0.944 -10.203 774 HB2 PHE 111 HB2 PHE 111 16.430 -1.849 -12.637 775 HB3 PHE 111 HB3 PHE 111 16.174 -2.976 -11.313 776 HD1 PHE 111 HD2 PHE 111 14.384 -1.217 -14.069 777 HD2 PHE 111 HD1 PHE 111 14.438 -4.521 -11.393 778 HE1 PHE 111 HE2 PHE 111 12.464 -2.197 -15.247 779 HE2 PHE 111 HE1 PHE 111 12.517 -5.508 -12.569 780 HZ PHE 111 HZ PHE 111 11.526 -4.341 -14.497 781 H ASN 112 H ASN 112 13.354 0.426 -11.512 782 HA ASN 112 HA ASN 112 14.942 2.497 -12.862 783 HB2 ASN 112 HB2 ASN 112 12.162 1.479 -13.475 784 HB3 ASN 112 HB3 ASN 112 12.737 3.044 -14.044 785 HD21 ASN 112 HD21 ASN 112 11.957 0.662 -15.540 786 HD22 ASN 112 HD22 ASN 112 13.333 0.228 -16.497 787 H GLU 113 H GLU 113 14.757 4.504 -12.090 788 HA GLU 113 HA GLU 113 13.692 4.737 -9.436 789 HB2 GLU 113 HB2 GLU 113 14.794 6.941 -9.454 790 HB3 GLU 113 HB3 GLU 113 15.870 5.640 -9.943 791 HG2 GLU 113 HG2 GLU 113 15.542 6.256 -12.293 792 HG3 GLU 113 HG3 GLU 113 14.488 7.576 -11.795 793 H GLY 114 H GLY 114 12.691 6.902 -8.788 794 HA2 GLY 114 HA2 GLY 114 11.367 8.787 -9.822 795 HA3 GLY 114 HA3 GLY 114 10.494 7.507 -10.651 796 H GLU 115 H GLU 115 8.638 8.475 -9.664 797 HA GLU 115 HA GLU 115 8.338 7.927 -6.795 798 HB2 GLU 115 HB2 GLU 115 7.852 10.219 -7.623 799 HB3 GLU 115 HB3 GLU 115 6.566 9.557 -8.622 800 HG2 GLU 115 HG2 GLU 115 5.481 8.714 -6.525 801 HG3 GLU 115 HG3 GLU 115 6.713 9.584 -5.614 802 H TYR 116 H TYR 116 7.294 6.179 -6.214 803 HA TYR 116 HA TYR 116 5.285 5.008 -8.046 804 HB2 TYR 116 HB2 TYR 116 6.365 3.348 -5.826 805 HB3 TYR 116 HB3 TYR 116 5.937 2.886 -7.465 806 HD1 TYR 116 HD1 TYR 116 7.619 3.378 -9.332 807 HD2 TYR 116 HD2 TYR 116 8.562 3.751 -5.203 808 HE1 TYR 116 HE1 TYR 116 10.020 3.284 -9.876 809 HE2 TYR 116 HE2 TYR 116 10.953 3.658 -5.729 810 HH TYR 116 HH TYR 116 12.117 3.735 -9.033 811 H ILE 117 H ILE 117 3.247 4.579 -7.133 812 HA ILE 117 HA ILE 117 2.982 5.450 -4.333 813 HB ILE 117 HB ILE 117 0.906 5.975 -6.488 814 HG12 ILE 117 HG12 ILE 117 2.693 7.967 -5.060 815 HG13 ILE 117 HG13 ILE 117 2.979 7.383 -6.694 816 HG21 ILE 117 HG21 ILE 117 -0.090 5.632 -4.310 817 HG22 ILE 117 HG22 ILE 117 -0.160 7.344 -4.729 818 HG23 ILE 117 HG23 ILE 117 1.044 6.770 -3.574 819 HD11 ILE 117 HD11 ILE 117 0.569 8.938 -5.780 820 HD12 ILE 117 HD12 ILE 117 0.877 8.370 -7.422 821 HD13 ILE 117 HD13 ILE 117 1.936 9.578 -6.694 822 H VAL 118 H VAL 118 2.388 3.861 -3.068 823 HA VAL 118 HA VAL 118 0.924 1.566 -4.144 824 HB VAL 118 HB VAL 118 1.981 1.936 -1.329 825 HG11 VAL 118 HG11 VAL 118 1.783 -0.520 -1.198 826 HG12 VAL 118 HG12 VAL 118 1.032 -0.522 -2.794 827 HG13 VAL 118 HG13 VAL 118 0.231 0.282 -1.444 828 HG21 VAL 118 HG21 VAL 118 3.282 0.444 -3.602 829 HG22 VAL 118 HG22 VAL 118 3.857 0.524 -1.934 830 HG23 VAL 118 HG23 VAL 118 3.831 1.979 -2.932 831 H SER 119 H SER 119 -1.247 1.644 -4.091 832 HA SER 119 HA SER 119 -2.528 3.065 -1.861 833 HB2 SER 119 HB2 SER 119 -3.656 2.324 -4.578 834 HB3 SER 119 HB3 SER 119 -4.523 3.200 -3.311 835 HG SER 119 HG SER 119 -2.311 4.529 -3.617 836 H LEU 120 H LEU 120 -3.114 1.776 -0.300 837 HA LEU 120 HA LEU 120 -4.067 -0.931 -0.947 838 HB2 LEU 120 HB2 LEU 120 -2.013 -0.993 0.335 839 HB3 LEU 120 HB3 LEU 120 -2.669 0.106 1.523 840 HG LEU 120 HG LEU 120 -4.138 -1.607 2.398 841 HD11 LEU 120 HD11 LEU 120 -4.182 -3.882 1.527 842 HD12 LEU 120 HD12 LEU 120 -3.098 -3.419 0.216 843 HD13 LEU 120 HD13 LEU 120 -4.725 -2.741 0.294 844 HD21 LEU 120 HD21 LEU 120 -2.502 -3.216 3.186 845 HD22 LEU 120 HD22 LEU 120 -1.843 -1.578 3.198 846 HD23 LEU 120 HD23 LEU 120 -1.381 -2.707 1.923 847 H ILE 121 H ILE 121 -6.130 -1.154 -0.763 848 HA ILE 121 HA ILE 121 -7.592 0.468 1.194 849 HB ILE 121 HB ILE 121 -8.123 1.378 -0.944 850 HG12 ILE 121 HG12 ILE 121 -10.086 0.781 0.700 851 HG13 ILE 121 HG13 ILE 121 -10.421 1.453 -0.884 852 HG21 ILE 121 HG21 ILE 121 -7.361 -0.329 -2.407 853 HG22 ILE 121 HG22 ILE 121 -9.013 0.110 -2.839 854 HG23 ILE 121 HG23 ILE 121 -8.700 -1.384 -1.954 855 HD11 ILE 121 HD11 ILE 121 -10.665 -1.450 -0.101 856 HD12 ILE 121 HD12 ILE 121 -10.990 -0.788 -1.704 857 HD13 ILE 121 HD13 ILE 121 -11.987 -0.305 -0.333 858 H VAL 122 H VAL 122 -8.772 -0.651 2.588 859 HA VAL 122 HA VAL 122 -9.358 -3.460 1.940 860 HB VAL 122 HB VAL 122 -9.477 -3.829 4.457 861 HG11 VAL 122 HG11 VAL 122 -7.686 -4.715 3.091 862 HG12 VAL 122 HG12 VAL 122 -7.051 -4.158 4.639 863 HG13 VAL 122 HG13 VAL 122 -6.819 -3.180 3.190 864 HG21 VAL 122 HG21 VAL 122 -9.511 -1.509 5.206 865 HG22 VAL 122 HG22 VAL 122 -7.916 -1.240 4.501 866 HG23 VAL 122 HG23 VAL 122 -8.103 -2.351 5.858 867 H SER 123 H SER 123 -11.358 -4.324 2.904 868 HA SER 123 HA SER 123 -13.396 -2.210 2.953 869 HB2 SER 123 HB2 SER 123 -14.843 -3.811 1.701 870 HB3 SER 123 HB3 SER 123 -13.425 -3.291 0.791 871 HG SER 123 HG SER 123 -14.159 -5.768 1.467 872 H ASN 124 H ASN 124 -15.394 -2.871 4.021 873 HA ASN 124 HA ASN 124 -15.320 -5.176 5.782 874 HB2 ASN 124 HB2 ASN 124 -14.093 -3.304 6.953 875 HB3 ASN 124 HB3 ASN 124 -15.558 -2.350 6.870 876 HD21 ASN 124 HD21 ASN 124 -14.013 -5.103 8.339 877 HD22 ASN 124 HD22 ASN 124 -15.060 -5.197 9.709 878 H GLU 125 H GLU 125 -17.511 -4.808 7.230 879 HA GLU 125 HA GLU 125 -19.706 -4.630 5.400 880 HB2 GLU 125 HB2 GLU 125 -19.783 -6.282 7.093 881 HB3 GLU 125 HB3 GLU 125 -19.397 -5.128 8.354 882 HG2 GLU 125 HG2 GLU 125 -21.608 -4.098 8.043 883 HG3 GLU 125 HG3 GLU 125 -21.978 -5.323 6.826 884 H ASN 126 H ASN 126 -18.245 -2.579 7.840 885 HA ASN 126 HA ASN 126 -20.499 -0.752 7.907 886 HB2 ASN 126 HB2 ASN 126 -17.799 -0.593 9.276 887 HB3 ASN 126 HB3 ASN 126 -19.143 0.507 9.554 888 HD21 ASN 126 HD21 ASN 126 -17.752 -2.541 10.278 889 HD22 ASN 126 HD22 ASN 126 -18.932 -3.044 11.442 890 H ASP 127 H ASP 127 -17.035 -0.486 7.132 891 HA ASP 127 HA ASP 127 -17.638 1.581 5.155 892 HB2 ASP 127 HB2 ASP 127 -15.776 1.970 7.508 893 HB3 ASP 127 HB3 ASP 127 -15.650 2.928 6.042 894 H SER 128 H SER 128 -15.597 2.123 3.855 895 HA SER 128 HA SER 128 -13.607 -0.063 3.970 896 HB2 SER 128 HB2 SER 128 -14.440 1.664 1.615 897 HB3 SER 128 HB3 SER 128 -13.099 0.519 1.587 898 HG SER 128 HG SER 128 -15.669 -0.326 2.374 899 H ASP 129 H ASP 129 -11.488 0.537 4.167 900 HA ASP 129 HA ASP 129 -11.011 3.418 4.546 901 HB2 ASP 129 HB2 ASP 129 -11.103 1.958 6.659 902 HB3 ASP 129 HB3 ASP 129 -9.614 1.226 6.079 903 H SER 130 H SER 130 -9.360 4.229 3.376 904 HA SER 130 HA SER 130 -7.454 2.322 2.223 905 HB2 SER 130 HB2 SER 130 -7.468 3.757 0.148 906 HB3 SER 130 HB3 SER 130 -8.946 2.835 0.420 907 HG SER 130 HG SER 130 -9.971 4.678 1.094 908 H ALA 131 H ALA 131 -5.394 2.956 2.163 909 HA ALA 131 HA ALA 131 -4.720 5.742 2.788 910 HB1 ALA 131 HB1 ALA 131 -2.896 5.025 4.259 911 HB2 ALA 131 HB2 ALA 131 -3.388 3.341 4.062 912 HB3 ALA 131 HB3 ALA 131 -4.456 4.486 4.874 913 H SER 132 H SER 132 -2.777 6.450 1.852 914 HA SER 132 HA SER 132 -1.639 4.607 -0.129 915 HB2 SER 132 HB2 SER 132 -3.410 6.189 -1.065 916 HB3 SER 132 HB3 SER 132 -2.279 7.498 -0.730 917 HG SER 132 HG SER 132 -1.926 6.882 -2.806 918 H VAL 133 H VAL 133 0.544 4.948 -0.627 919 HA VAL 133 HA VAL 133 1.900 6.901 1.094 920 HB VAL 133 HB VAL 133 2.088 4.673 2.109 921 HG11 VAL 133 HG11 VAL 133 3.413 2.895 1.077 922 HG12 VAL 133 HG12 VAL 133 3.501 3.841 -0.410 923 HG13 VAL 133 HG13 VAL 133 1.942 3.255 0.169 924 HG21 VAL 133 HG21 VAL 133 4.703 5.712 1.031 925 HG22 VAL 133 HG22 VAL 133 4.529 4.586 2.378 926 HG23 VAL 133 HG23 VAL 133 3.890 6.225 2.510 927 H THR 134 H THR 134 3.504 8.033 0.194 928 HA THR 134 HA THR 134 3.999 7.684 -2.653 929 HB THR 134 HB THR 134 4.896 9.930 -0.835 930 HG1 THR 134 HG1 THR 134 2.433 9.312 -1.728 931 HG21 THR 134 HG21 THR 134 5.080 11.209 -2.933 932 HG22 THR 134 HG22 THR 134 4.647 9.758 -3.837 933 HG23 THR 134 HG23 THR 134 6.151 9.807 -2.918 934 H ILE 135 H ILE 135 5.533 6.290 -3.101 935 HA ILE 135 HA ILE 135 7.874 5.984 -1.375 936 HB ILE 135 HB ILE 135 7.317 4.468 -3.943 937 HG12 ILE 135 HG12 ILE 135 5.379 4.127 -2.464 938 HG13 ILE 135 HG13 ILE 135 6.321 2.654 -2.626 939 HG21 ILE 135 HG21 ILE 135 9.001 3.780 -1.532 940 HG22 ILE 135 HG22 ILE 135 9.593 4.313 -3.106 941 HG23 ILE 135 HG23 ILE 135 8.772 2.761 -2.955 942 HD11 ILE 135 HD11 ILE 135 5.524 2.979 -0.352 943 HD12 ILE 135 HD12 ILE 135 6.370 4.524 -0.264 944 HD13 ILE 135 HD13 ILE 135 7.288 3.024 -0.419 945 H ARG 136 H ARG 136 9.507 7.326 -1.742 946 HA ARG 136 HA ARG 136 9.751 8.496 -4.425 947 HB2 ARG 136 HB2 ARG 136 10.603 9.562 -1.725 948 HB3 ARG 136 HB3 ARG 136 10.958 10.344 -3.260 949 HG2 ARG 136 HG2 ARG 136 8.733 10.911 -3.629 950 HG3 ARG 136 HG3 ARG 136 8.138 9.709 -2.482 951 HD2 ARG 136 HD2 ARG 136 9.719 12.167 -1.744 952 HD3 ARG 136 HD3 ARG 136 7.964 12.030 -1.644 953 HE ARG 136 HE ARG 136 9.269 9.937 -0.213 954 HH11 ARG 136 HH11 ARG 136 8.310 13.308 0.034 955 HH12 ARG 136 HH12 ARG 136 8.333 13.312 1.772 956 HH21 ARG 136 HH21 ARG 136 9.277 9.946 2.063 957 HH22 ARG 136 HH22 ARG 136 8.868 11.393 2.923 958 H ALA 137 H ALA 137 11.406 7.860 -5.593 959 HA ALA 137 HA ALA 137 13.772 6.850 -4.172 960 HB1 ALA 137 HB1 ALA 137 12.573 5.016 -5.246 961 HB2 ALA 137 HB2 ALA 137 14.149 5.288 -5.993 962 HB3 ALA 137 HB3 ALA 137 12.682 5.853 -6.794 963 H LEU 138 H LEU 138 15.248 8.289 -4.325 964 HA LEU 138 HA LEU 138 15.529 9.902 -6.724 965 HB2 LEU 138 HB2 LEU 138 17.238 11.130 -5.287 966 HB3 LEU 138 HB3 LEU 138 15.532 11.349 -4.970 967 HG LEU 138 HG LEU 138 15.907 9.515 -3.146 968 HD11 LEU 138 HD11 LEU 138 18.213 8.942 -3.722 969 HD12 LEU 138 HD12 LEU 138 18.112 9.644 -2.106 970 HD13 LEU 138 HD13 LEU 138 18.700 10.617 -3.457 971 HD21 LEU 138 HD21 LEU 138 16.352 11.305 -1.605 972 HD22 LEU 138 HD22 LEU 138 15.251 11.820 -2.891 973 HD23 LEU 138 HD23 LEU 138 16.946 12.298 -2.936 974 H GLU 139 H GLU 139 18.031 10.509 -6.993 975 HA GLU 139 HA GLU 139 19.211 7.962 -7.624 976 HB2 GLU 139 HB2 GLU 139 19.151 10.457 -8.916 977 HB3 GLU 139 HB3 GLU 139 20.825 10.193 -8.453 978 HG2 GLU 139 HG2 GLU 139 19.133 8.286 -10.043 979 HG3 GLU 139 HG3 GLU 139 20.339 9.379 -10.710 980 H HIS 140 H HIS 140 21.187 7.270 -6.990 981 HA HIS 140 HA HIS 140 22.122 8.232 -4.442 982 HB2 HIS 140 HB2 HIS 140 23.555 6.302 -4.410 983 HB3 HIS 140 HB3 HIS 140 22.003 5.785 -5.030 984 HD1 HIS 140 HD1 HIS 140 21.996 5.622 -7.824 985 HD2 HIS 140 HD2 HIS 140 25.660 5.438 -5.860 986 HE1 HIS 140 HE1 HIS 140 23.589 4.594 -9.473 987 HE2 HIS 140 HE2 HIS 140 25.769 4.387 -8.235 988 H HIS 141 H HIS 141 24.201 9.083 -4.000 989 HA HIS 141 HA HIS 141 25.568 10.192 -6.363 990 HB2 HIS 141 HB2 HIS 141 24.897 11.682 -3.810 991 HB3 HIS 141 HB3 HIS 141 25.938 12.305 -5.085 992 HD1 HIS 141 HD1 HIS 141 22.536 12.380 -3.972 993 HD2 HIS 141 HD2 HIS 141 24.428 12.463 -7.671 994 HE1 HIS 141 HE1 HIS 141 20.822 13.270 -5.584 995 HE2 HIS 141 HE2 HIS 141 21.931 13.132 -7.841 996 H HIS 142 H HIS 142 27.485 9.262 -6.420 997 HA HIS 142 HA HIS 142 28.952 8.579 -4.031 998 HB2 HIS 142 HB2 HIS 142 29.113 7.230 -6.127 999 HB3 HIS 142 HB3 HIS 142 29.881 8.599 -6.923 1000 HD1 HIS 142 HD1 HIS 142 32.371 8.867 -6.618 1001 HD2 HIS 142 HD2 HIS 142 30.742 5.990 -4.091 1002 HE1 HIS 142 HE1 HIS 142 34.338 7.735 -5.525 1003 HE2 HIS 142 HE2 HIS 142 33.329 5.859 -4.173 1004 H HIS 143 H HIS 143 30.087 9.957 -2.910 1005 HA HIS 143 HA HIS 143 30.897 12.496 -4.142 1006 HB2 HIS 143 HB2 HIS 143 30.634 11.712 -1.229 1007 HB3 HIS 143 HB3 HIS 143 31.220 13.272 -1.787 1008 HD1 HIS 143 HD1 HIS 143 28.238 11.695 -0.644 1009 HD2 HIS 143 HD2 HIS 143 29.114 14.605 -3.486 1010 HE1 HIS 143 HE1 HIS 143 26.061 12.885 -1.076 1011 HE2 HIS 143 HE2 HIS 143 26.587 14.555 -2.893 1012 H HIS 144 H HIS 144 32.987 13.317 -3.818 1013 HA HIS 144 HA HIS 144 34.989 11.598 -2.586 1014 HB2 HIS 144 HB2 HIS 144 34.894 10.866 -4.973 1015 HB3 HIS 144 HB3 HIS 144 35.307 12.499 -5.466 1016 HD1 HIS 144 HD1 HIS 144 36.817 9.787 -3.250 1017 HD2 HIS 144 HD2 HIS 144 37.958 12.847 -5.828 1018 HE1 HIS 144 HE1 HIS 144 39.332 9.685 -3.345 1019 HE2 HIS 144 HE2 HIS 144 39.998 11.489 -4.980 1020 H HIS 145 H HIS 145 36.251 12.809 -1.396 1021 HA HIS 145 HA HIS 145 36.299 15.704 -1.886 1022 HB2 HIS 145 HB2 HIS 145 35.522 14.713 0.354 1023 HB3 HIS 145 HB3 HIS 145 37.205 14.287 0.637 1024 HD1 HIS 145 HD1 HIS 145 38.737 16.122 1.468 1025 HD2 HIS 145 HD2 HIS 145 34.990 17.520 0.334 1026 HE1 HIS 145 HE1 HIS 145 38.634 18.504 2.267 1027 HE2 HIS 145 HE2 HIS 145 36.453 19.385 1.379 Start of MODEL 10 1 H1 MET 1 H1 MET 1-108.110 81.898 22.859 2 H2 MET 1 H2 MET 1-106.828 82.911 23.297 3 H3 MET 1 H3 MET 1-108.012 83.462 22.214 4 HA MET 1 HA MET 1-108.373 84.436 24.364 5 HB2 MET 1 HB2 MET 1-110.330 83.852 22.969 6 HB3 MET 1 HB3 MET 1-110.396 82.269 23.731 7 HG2 MET 1 HG2 MET 1-110.772 83.423 25.914 8 HG3 MET 1 HG3 MET 1-110.908 84.937 25.021 9 HE1 MET 1 HE1 MET 1-113.821 81.380 24.566 10 HE2 MET 1 HE2 MET 1-112.474 81.411 25.704 11 HE3 MET 1 HE3 MET 1-112.161 81.334 23.970 12 H ASN 2 H ASN 2-108.567 80.886 24.457 13 HA ASN 2 HA ASN 2-108.381 80.797 27.325 14 HB2 ASN 2 HB2 ASN 2-109.632 79.067 26.085 15 HB3 ASN 2 HB3 ASN 2-108.158 78.579 25.263 16 HD21 ASN 2 HD21 ASN 2-106.699 77.269 26.317 17 HD22 ASN 2 HD22 ASN 2-107.021 76.538 27.848 18 H ALA 3 H ALA 3-106.541 81.525 28.139 19 HA ALA 3 HA ALA 3-104.035 80.325 27.185 20 HB1 ALA 3 HB1 ALA 3-102.876 82.195 28.275 21 HB2 ALA 3 HB2 ALA 3-104.428 82.856 28.791 22 HB3 ALA 3 HB3 ALA 3-104.034 82.770 27.074 23 H ARG 4 H ARG 4-104.775 78.408 28.337 24 HA ARG 4 HA ARG 4-104.363 78.567 31.246 25 HB2 ARG 4 HB2 ARG 4-106.744 77.378 29.832 26 HB3 ARG 4 HB3 ARG 4-106.290 76.901 31.459 27 HG2 ARG 4 HG2 ARG 4-106.997 79.692 30.599 28 HG3 ARG 4 HG3 ARG 4-108.084 78.567 31.412 29 HD2 ARG 4 HD2 ARG 4-105.559 79.807 32.500 30 HD3 ARG 4 HD3 ARG 4-107.208 80.077 33.053 31 HE ARG 4 HE ARG 4-105.477 77.856 33.712 32 HH11 ARG 4 HH11 ARG 4-108.781 79.056 33.718 33 HH12 ARG 4 HH12 ARG 4-109.325 77.902 34.891 34 HH21 ARG 4 HH21 ARG 4-106.200 76.356 35.257 35 HH22 ARG 4 HH22 ARG 4-107.855 76.383 35.769 36 H ASP 5 H ASP 5-103.234 76.901 32.089 37 HA ASP 5 HA ASP 5-103.428 74.294 30.858 38 HB2 ASP 5 HB2 ASP 5-101.034 73.868 30.738 39 HB3 ASP 5 HB3 ASP 5-101.447 75.236 29.721 40 H ASN 6 H ASN 6-103.794 72.885 32.337 41 HA ASN 6 HA ASN 6-103.143 73.453 35.142 42 HB2 ASN 6 HB2 ASN 6-105.487 72.865 34.615 43 HB3 ASN 6 HB3 ASN 6-104.957 71.359 33.885 44 HD21 ASN 6 HD21 ASN 6-106.063 70.026 35.202 45 HD22 ASN 6 HD22 ASN 6-105.739 69.847 36.891 46 H LYS 7 H LYS 7-101.557 72.337 36.162 47 HA LYS 7 HA LYS 7-100.614 69.851 34.974 48 HB2 LYS 7 HB2 LYS 7 -98.342 70.475 34.816 49 HB3 LYS 7 HB3 LYS 7 -99.234 71.785 34.069 50 HG2 LYS 7 HG2 LYS 7 -98.780 72.328 36.863 51 HG3 LYS 7 HG3 LYS 7 -97.266 71.953 36.045 52 HD2 LYS 7 HD2 LYS 7 -97.427 74.244 35.769 53 HD3 LYS 7 HD3 LYS 7 -98.109 73.639 34.260 54 HE2 LYS 7 HE2 LYS 7-100.351 73.949 35.122 55 HE3 LYS 7 HE3 LYS 7 -99.703 74.475 36.674 56 HZ1 LYS 7 HZ1 LYS 7 -98.685 76.359 35.549 57 HZ2 LYS 7 HZ2 LYS 7-100.365 76.349 35.338 58 HZ3 LYS 7 HZ3 LYS 7 -99.351 75.854 34.074 59 H PHE 8 H PHE 8 -99.336 68.574 36.350 60 HA PHE 8 HA PHE 8 -99.413 69.285 39.208 61 HB2 PHE 8 HB2 PHE 8 -99.923 66.623 37.862 62 HB3 PHE 8 HB3 PHE 8 -99.476 66.736 39.558 63 HD1 PHE 8 HD1 PHE 8-102.076 67.636 37.090 64 HD2 PHE 8 HD2 PHE 8-101.051 67.320 41.205 65 HE1 PHE 8 HE1 PHE 8-104.434 67.957 37.697 66 HE2 PHE 8 HE2 PHE 8-103.409 67.644 41.819 67 HZ PHE 8 HZ PHE 8-105.105 67.963 40.064 68 H ASN 9 H ASN 9 -97.390 70.088 37.607 69 HA ASN 9 HA ASN 9 -95.248 68.315 37.191 70 HB2 ASN 9 HB2 ASN 9 -95.553 70.516 36.059 71 HB3 ASN 9 HB3 ASN 9 -95.135 71.312 37.571 72 HD21 ASN 9 HD21 ASN 9 -93.433 72.335 36.486 73 HD22 ASN 9 HD22 ASN 9 -91.956 71.501 36.149 74 H THR 10 H THR 10 -93.938 67.407 38.551 75 HA THR 10 HA THR 10 -94.312 68.100 41.353 76 HB THR 10 HB THR 10 -94.969 65.879 40.782 77 HG1 THR 10 HG1 THR 10 -93.039 64.739 42.005 78 HG21 THR 10 HG21 THR 10 -93.443 64.186 39.882 79 HG22 THR 10 HG22 THR 10 -92.179 65.407 39.724 80 HG23 THR 10 HG23 THR 10 -93.650 65.533 38.761 81 H TRP 11 H TRP 11 -91.723 67.784 38.982 82 HA TRP 11 HA TRP 11 -89.481 67.990 39.018 83 HB2 TRP 11 HB2 TRP 11 -90.245 70.013 41.098 84 HB3 TRP 11 HB3 TRP 11 -88.559 69.740 40.680 85 HD1 TRP 11 HD1 TRP 11 -90.969 72.173 39.995 86 HE1 TRP 11 HE1 TRP 11 -90.701 73.266 37.681 87 HE3 TRP 11 HE3 TRP 11 -88.002 68.647 37.760 88 HZ2 TRP 11 HZ2 TRP 11 -89.428 72.698 35.233 89 HZ3 TRP 11 HZ3 TRP 11 -87.311 69.000 35.425 90 HH2 TRP 11 HH2 TRP 11 -88.012 70.984 34.193 91 H ASN 12 H ASN 12 -90.449 65.794 40.487 92 HA ASN 12 HA ASN 12 -88.437 65.566 42.616 93 HB2 ASN 12 HB2 ASN 12 -90.954 65.652 43.253 94 HB3 ASN 12 HB3 ASN 12 -91.025 64.020 42.606 95 HD21 ASN 12 HD21 ASN 12 -91.571 63.190 44.598 96 HD22 ASN 12 HD22 ASN 12 -90.422 63.048 45.881 97 H ASP 13 H ASP 13 -87.950 65.058 39.950 98 HA ASP 13 HA ASP 13 -88.029 62.184 39.564 99 HB2 ASP 13 HB2 ASP 13 -87.289 62.695 37.266 100 HB3 ASP 13 HB3 ASP 13 -88.771 63.537 37.691 101 H SER 14 H SER 14 -86.123 63.779 41.425 102 HA SER 14 HA SER 14 -83.574 62.838 40.357 103 HB2 SER 14 HB2 SER 14 -84.210 64.376 42.888 104 HB3 SER 14 HB3 SER 14 -82.590 63.894 42.387 105 HG SER 14 HG SER 14 -84.322 65.492 40.799 106 H ARG 15 H ARG 15 -83.579 60.648 40.502 107 HA ARG 15 HA ARG 15 -82.960 59.731 43.155 108 HB2 ARG 15 HB2 ARG 15 -84.294 57.758 43.219 109 HB3 ARG 15 HB3 ARG 15 -85.362 59.103 42.919 110 HG2 ARG 15 HG2 ARG 15 -84.444 57.393 40.649 111 HG3 ARG 15 HG3 ARG 15 -85.718 56.827 41.723 112 HD2 ARG 15 HD2 ARG 15 -86.981 57.829 40.124 113 HD3 ARG 15 HD3 ARG 15 -86.734 59.204 41.196 114 HE ARG 15 HE ARG 15 -85.213 60.114 39.645 115 HH11 ARG 15 HH11 ARG 15 -86.632 57.120 38.469 116 HH12 ARG 15 HH12 ARG 15 -86.223 57.435 36.812 117 HH21 ARG 15 HH21 ARG 15 -84.676 60.517 37.475 118 HH22 ARG 15 HH22 ARG 15 -85.107 59.364 36.249 119 H GLY 16 H GLY 16 -80.972 59.100 42.988 120 HA2 GLY 16 HA2 GLY 16 -80.158 57.347 40.806 121 HA3 GLY 16 HA3 GLY 16 -79.432 58.943 40.822 122 H ASN 17 H ASN 17 -79.868 56.035 42.797 123 HA ASN 17 HA ASN 17 -77.225 56.576 43.948 124 HB2 ASN 17 HB2 ASN 17 -77.742 55.048 45.753 125 HB3 ASN 17 HB3 ASN 17 -79.039 56.222 45.622 126 HD21 ASN 17 HD21 ASN 17 -81.057 55.550 44.844 127 HD22 ASN 17 HD22 ASN 17 -81.513 53.878 44.851 128 H TYR 18 H TYR 18 -75.607 55.021 43.812 129 HA TYR 18 HA TYR 18 -76.137 52.653 42.204 130 HB2 TYR 18 HB2 TYR 18 -74.376 53.140 40.578 131 HB3 TYR 18 HB3 TYR 18 -75.622 54.370 40.524 132 HD1 TYR 18 HD2 TYR 18 -75.152 56.647 41.351 133 HD2 TYR 18 HD1 TYR 18 -72.109 53.670 41.216 134 HE1 TYR 18 HE2 TYR 18 -73.436 58.394 41.580 135 HE2 TYR 18 HE1 TYR 18 -70.397 55.413 41.429 136 HH TYR 18 HH TYR 18 -70.162 57.827 40.975 137 H TRP 19 H TRP 19 -74.533 51.070 42.312 138 HA TRP 19 HA TRP 19 -72.281 51.654 44.095 139 HB2 TRP 19 HB2 TRP 19 -73.913 50.207 45.278 140 HB3 TRP 19 HB3 TRP 19 -73.802 49.031 43.971 141 HD1 TRP 19 HD1 TRP 19 -70.859 50.843 45.705 142 HE1 TRP 19 HE1 TRP 19 -69.297 49.048 46.703 143 HE3 TRP 19 HE3 TRP 19 -73.623 46.672 44.654 144 HZ2 TRP 19 HZ2 TRP 19 -69.253 46.243 47.016 145 HZ3 TRP 19 HZ3 TRP 19 -72.756 44.475 45.340 146 HH2 TRP 19 HH2 TRP 19 -70.617 44.266 46.494 147 H SER 20 H SER 20 -70.771 51.957 42.585 148 HA SER 20 HA SER 20 -70.064 49.698 40.877 149 HB2 SER 20 HB2 SER 20 -70.509 52.504 39.810 150 HB3 SER 20 HB3 SER 20 -69.776 51.183 38.900 151 HG SER 20 HG SER 20 -71.997 50.193 39.782 152 H ASP 21 H ASP 21 -68.082 49.310 41.657 153 HA ASP 21 HA ASP 21 -66.208 51.558 41.913 154 HB2 ASP 21 HB2 ASP 21 -65.825 48.657 42.671 155 HB3 ASP 21 HB3 ASP 21 -64.652 49.934 42.928 156 H TYR 22 H TYR 22 -64.976 52.004 40.247 157 HA TYR 22 HA TYR 22 -64.625 49.992 38.189 158 HB2 TYR 22 HB2 TYR 22 -63.524 51.879 36.868 159 HB3 TYR 22 HB3 TYR 22 -65.249 51.991 37.144 160 HD1 TYR 22 HD1 TYR 22 -66.124 53.679 38.787 161 HD2 TYR 22 HD2 TYR 22 -62.022 53.562 37.645 162 HE1 TYR 22 HE1 TYR 22 -65.841 55.984 39.589 163 HE2 TYR 22 HE2 TYR 22 -61.730 55.864 38.457 164 HH TYR 22 HH TYR 22 -63.125 57.871 38.864 165 H GLU 23 H GLU 23 -63.087 48.658 38.339 166 HA GLU 23 HA GLU 23 -60.696 49.348 39.885 167 HB2 GLU 23 HB2 GLU 23 -60.512 46.679 39.690 168 HB3 GLU 23 HB3 GLU 23 -61.396 47.492 40.967 169 HG2 GLU 23 HG2 GLU 23 -62.677 45.640 40.134 170 HG3 GLU 23 HG3 GLU 23 -63.489 47.141 39.719 171 H GLY 24 H GLY 24 -61.246 49.838 36.945 172 HA2 GLY 24 HA2 GLY 24 -59.389 48.270 35.462 173 HA3 GLY 24 HA3 GLY 24 -60.077 49.811 34.969 174 H SER 25 H SER 25 -57.286 48.565 35.018 175 HA SER 25 HA SER 25 -55.818 50.264 36.828 176 HB2 SER 25 HB2 SER 25 -53.812 49.195 35.698 177 HB3 SER 25 HB3 SER 25 -54.912 48.073 36.496 178 HG SER 25 HG SER 25 -55.228 47.151 34.648 179 H ASP 26 H ASP 26 -54.532 51.983 36.337 180 HA ASP 26 HA ASP 26 -54.451 52.844 33.537 181 HB2 ASP 26 HB2 ASP 26 -54.734 55.167 34.133 182 HB3 ASP 26 HB3 ASP 26 -56.089 54.261 34.780 183 H GLU 27 H GLU 27 -52.521 53.218 32.799 184 HA GLU 27 HA GLU 27 -50.278 53.613 34.662 185 HB2 GLU 27 HB2 GLU 27 -50.306 51.717 32.302 186 HB3 GLU 27 HB3 GLU 27 -48.898 52.087 33.287 187 HG2 GLU 27 HG2 GLU 27 -49.838 50.991 35.177 188 HG3 GLU 27 HG3 GLU 27 -51.404 50.834 34.378 189 H ASN 28 H ASN 28 -49.506 55.560 34.146 190 HA ASN 28 HA ASN 28 -49.417 56.313 31.306 191 HB2 ASN 28 HB2 ASN 28 -49.617 58.035 33.781 192 HB3 ASN 28 HB3 ASN 28 -49.237 58.685 32.193 193 HD21 ASN 28 HD21 ASN 28 -51.017 56.961 30.726 194 HD22 ASN 28 HD22 ASN 28 -52.621 57.502 31.082 195 H GLY 29 H GLY 29 -47.474 55.586 30.676 196 HA2 GLY 29 HA2 GLY 29 -45.228 55.948 30.234 197 HA3 GLY 29 HA3 GLY 29 -45.184 57.095 31.560 198 H ASP 30 H ASP 30 -43.069 55.548 31.251 199 HA ASP 30 HA ASP 30 -43.147 54.019 33.727 200 HB2 ASP 30 HB2 ASP 30 -41.995 52.097 32.840 201 HB3 ASP 30 HB3 ASP 30 -43.421 52.356 31.849 202 H GLY 31 H GLY 31 -40.773 53.422 34.322 203 HA2 GLY 31 HA2 GLY 31 -38.665 54.964 33.209 204 HA3 GLY 31 HA3 GLY 31 -39.285 55.731 34.668 205 H ILE 32 H ILE 32 -38.364 52.489 33.524 206 HA ILE 32 HA ILE 32 -37.446 51.835 36.216 207 HB ILE 32 HB ILE 32 -37.420 49.994 33.810 208 HG12 ILE 32 HG12 ILE 32 -39.731 50.746 34.188 209 HG13 ILE 32 HG13 ILE 32 -39.542 49.049 34.602 210 HG21 ILE 32 HG21 ILE 32 -37.384 48.201 35.484 211 HG22 ILE 32 HG22 ILE 32 -37.348 49.407 36.770 212 HG23 ILE 32 HG23 ILE 32 -35.995 49.276 35.646 213 HD11 ILE 32 HD11 ILE 32 -39.505 49.640 36.981 214 HD12 ILE 32 HD12 ILE 32 -40.979 50.200 36.190 215 HD13 ILE 32 HD13 ILE 32 -39.688 51.344 36.556 216 H GLY 33 H GLY 33 -35.677 53.231 36.292 217 HA2 GLY 33 HA2 GLY 33 -33.419 52.663 34.520 218 HA3 GLY 33 HA3 GLY 33 -33.515 53.972 35.698 219 H ASP 34 H ASP 34 -34.379 52.476 37.893 220 HA ASP 34 HA ASP 34 -32.009 51.232 38.845 221 HB2 ASP 34 HB2 ASP 34 -33.559 52.359 40.385 222 HB3 ASP 34 HB3 ASP 34 -34.829 51.211 39.970 223 H SER 35 H SER 35 -31.317 49.326 38.339 224 HA SER 35 HA SER 35 -33.251 47.276 37.496 225 HB2 SER 35 HB2 SER 35 -30.316 47.556 36.804 226 HB3 SER 35 HB3 SER 35 -31.378 46.265 36.245 227 HG SER 35 HG SER 35 -31.664 49.047 35.703 228 H ALA 36 H ALA 36 -33.552 45.661 38.848 229 HA ALA 36 HA ALA 36 -31.671 45.263 41.037 230 HB1 ALA 36 HB1 ALA 36 -34.374 44.006 40.560 231 HB2 ALA 36 HB2 ALA 36 -34.057 45.408 41.582 232 HB3 ALA 36 HB3 ALA 36 -33.390 43.834 42.015 233 H TYR 37 H TYR 37 -30.071 43.938 40.732 234 HA TYR 37 HA TYR 37 -30.098 41.876 38.751 235 HB2 TYR 37 HB2 TYR 37 -27.820 41.314 39.645 236 HB3 TYR 37 HB3 TYR 37 -27.998 42.977 39.117 237 HD1 TYR 37 HD2 TYR 37 -28.062 44.804 40.790 238 HD2 TYR 37 HD1 TYR 37 -27.325 40.771 41.936 239 HE1 TYR 37 HE2 TYR 37 -27.198 45.582 42.951 240 HE2 TYR 37 HE1 TYR 37 -26.455 41.545 44.101 241 HH TYR 37 HH TYR 37 -25.493 43.550 45.085 242 H ALA 38 H ALA 38 -30.148 39.676 39.036 243 HA ALA 38 HA ALA 38 -31.722 38.829 41.295 244 HB1 ALA 38 HB1 ALA 38 -30.739 37.276 38.915 245 HB2 ALA 38 HB2 ALA 38 -32.295 38.097 39.043 246 HB3 ALA 38 HB3 ALA 38 -31.932 36.724 40.090 247 H VAL 39 H VAL 39 -31.176 37.389 42.855 248 HA VAL 39 HA VAL 39 -28.337 36.966 43.316 249 HB VAL 39 HB VAL 39 -29.849 37.790 45.124 250 HG11 VAL 39 HG11 VAL 39 -31.069 35.044 45.027 251 HG12 VAL 39 HG12 VAL 39 -31.863 36.572 44.653 252 HG13 VAL 39 HG13 VAL 39 -31.336 36.235 46.303 253 HG21 VAL 39 HG21 VAL 39 -29.020 36.363 46.923 254 HG22 VAL 39 HG22 VAL 39 -27.760 36.742 45.750 255 HG23 VAL 39 HG23 VAL 39 -28.526 35.153 45.739 256 H ASN 40 H ASN 40 -27.385 34.872 43.554 257 HA ASN 40 HA ASN 40 -28.727 32.783 42.037 258 HB2 ASN 40 HB2 ASN 40 -25.942 32.791 43.255 259 HB3 ASN 40 HB3 ASN 40 -26.584 31.572 42.162 260 HD21 ASN 40 HD21 ASN 40 -25.054 34.581 42.452 261 HD22 ASN 40 HD22 ASN 40 -24.936 34.955 40.770 262 HA PRO 41 HA PRO 41 -29.851 30.311 45.650 263 HB2 PRO 41 HB2 PRO 41 -29.081 27.902 44.119 264 HB3 PRO 41 HB3 PRO 41 -30.647 28.353 44.795 265 HG2 PRO 41 HG2 PRO 41 -30.212 28.411 42.164 266 HG3 PRO 41 HG3 PRO 41 -31.218 29.641 42.955 267 HD2 PRO 41 HD2 PRO 41 -28.362 29.815 42.061 268 HD3 PRO 41 HD3 PRO 41 -29.670 31.001 41.875 269 H GLU 42 H GLU 42 -26.723 30.179 44.206 270 HA GLU 42 HA GLU 42 -24.642 29.660 44.876 271 HB2 GLU 42 HB2 GLU 42 -26.000 30.134 47.455 272 HB3 GLU 42 HB3 GLU 42 -24.498 29.228 47.546 273 HG2 GLU 42 HG2 GLU 42 -23.998 31.523 47.893 274 HG3 GLU 42 HG3 GLU 42 -23.385 31.074 46.311 275 H ALA 43 H ALA 43 -26.678 27.502 44.342 276 HA ALA 43 HA ALA 43 -24.991 25.251 44.992 277 HB1 ALA 43 HB1 ALA 43 -26.412 25.370 46.993 278 HB2 ALA 43 HB2 ALA 43 -26.778 23.933 46.037 279 HB3 ALA 43 HB3 ALA 43 -27.851 25.331 45.974 280 H GLY 44 H GLY 44 -24.872 24.125 43.156 281 HA2 GLY 44 HA2 GLY 44 -27.228 24.069 41.383 282 HA3 GLY 44 HA3 GLY 44 -25.615 24.380 40.755 283 H SER 45 H SER 45 -27.747 21.985 42.152 284 HA SER 45 HA SER 45 -25.855 19.830 41.795 285 HB2 SER 45 HB2 SER 45 -27.921 18.427 42.443 286 HB3 SER 45 HB3 SER 45 -27.251 19.513 43.662 287 HG SER 45 HG SER 45 -28.951 20.829 43.463 288 H MET 46 H MET 46 -25.369 19.463 39.741 289 HA MET 46 HA MET 46 -27.575 19.027 37.831 290 HB2 MET 46 HB2 MET 46 -24.816 20.167 37.306 291 HB3 MET 46 HB3 MET 46 -25.969 19.737 36.050 292 HG2 MET 46 HG2 MET 46 -27.533 21.388 36.909 293 HG3 MET 46 HG3 MET 46 -26.398 21.804 38.188 294 HE1 MET 46 HE1 MET 46 -26.734 24.323 37.443 295 HE2 MET 46 HE2 MET 46 -27.751 23.890 36.068 296 HE3 MET 46 HE3 MET 46 -26.352 24.939 35.835 297 H ASP 47 H ASP 47 -27.763 16.868 37.742 298 HA ASP 47 HA ASP 47 -25.381 15.201 37.686 299 HB2 ASP 47 HB2 ASP 47 -26.887 13.305 37.902 300 HB3 ASP 47 HB3 ASP 47 -27.277 14.517 39.115 301 H TYR 48 H TYR 48 -25.303 13.408 36.063 302 HA TYR 48 HA TYR 48 -26.418 14.128 33.466 303 HB2 TYR 48 HB2 TYR 48 -24.361 15.377 33.442 304 HB3 TYR 48 HB3 TYR 48 -23.452 14.021 34.088 305 HD1 TYR 48 HD2 TYR 48 -25.571 14.834 31.105 306 HD2 TYR 48 HD1 TYR 48 -22.144 12.831 32.627 307 HE1 TYR 48 HE2 TYR 48 -24.984 14.114 28.830 308 HE2 TYR 48 HE1 TYR 48 -21.548 12.107 30.361 309 HH TYR 48 HH TYR 48 -22.663 11.717 28.203 310 H MET 49 H MET 49 -27.079 12.390 32.420 311 HA MET 49 HA MET 49 -25.453 10.023 32.303 312 HB2 MET 49 HB2 MET 49 -27.014 8.420 33.118 313 HB3 MET 49 HB3 MET 49 -26.910 9.657 34.357 314 HG2 MET 49 HG2 MET 49 -29.024 10.579 33.697 315 HG3 MET 49 HG3 MET 49 -29.107 9.503 32.303 316 HE1 MET 49 HE1 MET 49 -31.341 8.315 32.699 317 HE2 MET 49 HE2 MET 49 -31.631 9.558 33.918 318 HE3 MET 49 HE3 MET 49 -31.937 7.861 34.296 319 HA PRO 50 HA PRO 50 -27.634 9.751 28.279 320 HB2 PRO 50 HB2 PRO 50 -26.833 6.903 28.474 321 HB3 PRO 50 HB3 PRO 50 -26.549 8.063 27.173 322 HG2 PRO 50 HG2 PRO 50 -24.562 7.284 28.762 323 HG3 PRO 50 HG3 PRO 50 -24.681 8.964 28.204 324 HD2 PRO 50 HD2 PRO 50 -25.416 7.793 30.865 325 HD3 PRO 50 HD3 PRO 50 -24.584 9.321 30.497 326 H LEU 51 H LEU 51 -29.682 8.936 27.701 327 HA LEU 51 HA LEU 51 -31.065 7.581 29.918 328 HB2 LEU 51 HB2 LEU 51 -33.082 8.901 29.227 329 HB3 LEU 51 HB3 LEU 51 -31.775 9.818 29.948 330 HG LEU 51 HG LEU 51 -31.165 10.153 27.340 331 HD11 LEU 51 HD11 LEU 51 -33.087 8.894 26.525 332 HD12 LEU 51 HD12 LEU 51 -33.205 10.596 26.074 333 HD13 LEU 51 HD13 LEU 51 -34.174 9.967 27.407 334 HD21 LEU 51 HD21 LEU 51 -32.230 12.340 27.521 335 HD22 LEU 51 HD22 LEU 51 -31.402 11.901 29.016 336 HD23 LEU 51 HD23 LEU 51 -33.158 11.778 28.912 337 H MET 52 H MET 52 -30.171 7.093 26.763 338 HA MET 52 HA MET 52 -32.192 5.028 26.419 339 HB2 MET 52 HB2 MET 52 -33.022 7.187 25.343 340 HB3 MET 52 HB3 MET 52 -31.703 7.029 24.200 341 HG2 MET 52 HG2 MET 52 -33.700 4.831 24.566 342 HG3 MET 52 HG3 MET 52 -34.055 6.216 23.548 343 HE1 MET 52 HE1 MET 52 -31.132 6.782 22.293 344 HE2 MET 52 HE2 MET 52 -32.617 6.822 21.344 345 HE3 MET 52 HE3 MET 52 -31.238 5.862 20.795 346 H GLU 53 H GLU 53 -30.612 3.517 26.638 347 HA GLU 53 HA GLU 53 -29.647 2.552 24.174 348 HB2 GLU 53 HB2 GLU 53 -27.794 4.267 24.941 349 HB3 GLU 53 HB3 GLU 53 -27.358 2.976 26.057 350 HG2 GLU 53 HG2 GLU 53 -27.191 1.444 24.090 351 HG3 GLU 53 HG3 GLU 53 -27.397 2.853 23.047 352 H TYR 54 H TYR 54 -28.725 0.388 24.459 353 HA TYR 54 HA TYR 54 -29.033 -0.757 27.137 354 HB2 TYR 54 HB2 TYR 54 -30.275 -1.757 24.566 355 HB3 TYR 54 HB3 TYR 54 -30.028 -2.816 25.949 356 HD1 TYR 54 HD1 TYR 54 -31.057 -2.044 28.186 357 HD2 TYR 54 HD2 TYR 54 -32.247 -0.502 24.403 358 HE1 TYR 54 HE1 TYR 54 -33.174 -1.293 29.168 359 HE2 TYR 54 HE2 TYR 54 -34.374 0.257 25.383 360 HH TYR 54 HH TYR 54 -35.826 -0.362 27.337 361 H LEU 55 H LEU 55 -26.730 0.077 25.550 362 HA LEU 55 HA LEU 55 -24.706 -0.491 24.793 363 HB2 LEU 55 HB2 LEU 55 -24.378 -1.509 26.947 364 HB3 LEU 55 HB3 LEU 55 -25.203 -2.970 26.445 365 HG LEU 55 HG LEU 55 -23.372 -3.424 24.837 366 HD11 LEU 55 HD11 LEU 55 -22.029 -1.064 26.137 367 HD12 LEU 55 HD12 LEU 55 -22.584 -1.156 24.466 368 HD13 LEU 55 HD13 LEU 55 -21.267 -2.193 25.017 369 HD21 LEU 55 HD21 LEU 55 -22.495 -3.052 27.694 370 HD22 LEU 55 HD22 LEU 55 -21.699 -4.077 26.499 371 HD23 LEU 55 HD23 LEU 55 -23.338 -4.454 27.035 372 H HIS 56 H HIS 56 -25.143 -0.503 22.678 373 HA HIS 56 HA HIS 56 -25.540 -3.144 21.461 374 HB2 HIS 56 HB2 HIS 56 -26.211 -1.989 19.381 375 HB3 HIS 56 HB3 HIS 56 -27.250 -1.559 20.720 376 HD1 HIS 56 HD1 HIS 56 -25.054 -0.127 18.138 377 HD2 HIS 56 HD2 HIS 56 -26.909 1.157 21.628 378 HE1 HIS 56 HE1 HIS 56 -24.949 2.383 18.072 379 HE2 HIS 56 HE2 HIS 56 -26.045 3.148 20.202 380 H SER 57 H SER 57 -23.810 -4.094 20.683 381 HA SER 57 HA SER 57 -21.304 -2.754 20.487 382 HB2 SER 57 HB2 SER 57 -22.142 -5.513 19.536 383 HB3 SER 57 HB3 SER 57 -20.479 -4.922 19.622 384 HG SER 57 HG SER 57 -20.520 -5.006 21.770 385 H SER 58 H SER 58 -20.999 -1.298 19.000 386 HA SER 58 HA SER 58 -22.212 -1.309 16.428 387 HB2 SER 58 HB2 SER 58 -20.555 0.563 16.001 388 HB3 SER 58 HB3 SER 58 -21.629 0.805 17.380 389 HG SER 58 HG SER 58 -19.420 -0.485 18.192 390 HA PRO 59 HA PRO 59 -19.454 -4.314 14.605 391 HB2 PRO 59 HB2 PRO 59 -20.115 -3.794 11.981 392 HB3 PRO 59 HB3 PRO 59 -21.014 -4.870 13.051 393 HG2 PRO 59 HG2 PRO 59 -21.586 -2.037 12.304 394 HG3 PRO 59 HG3 PRO 59 -22.711 -3.384 12.540 395 HD2 PRO 59 HD2 PRO 59 -22.357 -1.467 14.396 396 HD3 PRO 59 HD3 PRO 59 -22.714 -3.156 14.835 397 H VAL 60 H VAL 60 -17.450 -4.279 13.843 398 HA VAL 60 HA VAL 60 -16.244 -1.674 13.943 399 HB VAL 60 HB VAL 60 -15.332 -3.530 15.240 400 HG11 VAL 60 HG11 VAL 60 -14.119 -5.378 14.250 401 HG12 VAL 60 HG12 VAL 60 -14.528 -4.807 12.634 402 HG13 VAL 60 HG13 VAL 60 -15.802 -5.380 13.711 403 HG21 VAL 60 HG21 VAL 60 -13.847 -1.723 14.685 404 HG22 VAL 60 HG22 VAL 60 -13.420 -2.499 13.158 405 HG23 VAL 60 HG23 VAL 60 -12.961 -3.247 14.689 406 H LEU 61 H LEU 61 -15.615 -0.476 12.332 407 HA LEU 61 HA LEU 61 -15.642 -1.429 9.614 408 HB2 LEU 61 HB2 LEU 61 -14.849 1.001 9.150 409 HB3 LEU 61 HB3 LEU 61 -16.502 0.712 9.601 410 HG LEU 61 HG LEU 61 -15.440 2.797 10.524 411 HD11 LEU 61 HD11 LEU 61 -16.544 0.863 12.543 412 HD12 LEU 61 HD12 LEU 61 -17.460 1.956 11.506 413 HD13 LEU 61 HD13 LEU 61 -16.408 2.609 12.761 414 HD21 LEU 61 HD21 LEU 61 -13.922 0.894 12.288 415 HD22 LEU 61 HD22 LEU 61 -14.032 2.642 12.510 416 HD23 LEU 61 HD23 LEU 61 -13.240 1.980 11.079 417 HA PRO 62 HA PRO 62 -11.386 -2.382 9.486 418 HB2 PRO 62 HB2 PRO 62 -10.485 -1.705 7.053 419 HB3 PRO 62 HB3 PRO 62 -11.616 -3.052 7.320 420 HG2 PRO 62 HG2 PRO 62 -12.114 -0.350 6.205 421 HG3 PRO 62 HG3 PRO 62 -12.952 -1.876 5.881 422 HD2 PRO 62 HD2 PRO 62 -13.845 0.187 7.554 423 HD3 PRO 62 HD3 PRO 62 -14.494 -1.461 7.485 424 H THR 63 H THR 63 -9.163 -1.739 8.820 425 HA THR 63 HA THR 63 -8.606 1.101 8.767 426 HB THR 63 HB THR 63 -7.307 -0.762 10.784 427 HG1 THR 63 HG1 THR 63 -9.448 0.067 11.351 428 HG21 THR 63 HG21 THR 63 -6.894 2.163 10.254 429 HG22 THR 63 HG22 THR 63 -5.783 0.861 9.829 430 HG23 THR 63 HG23 THR 63 -6.116 1.219 11.527 431 H ALA 64 H ALA 64 -7.330 1.319 7.025 432 HA ALA 64 HA ALA 64 -5.676 -0.931 6.175 433 HB1 ALA 64 HB1 ALA 64 -5.296 0.335 4.146 434 HB2 ALA 64 HB2 ALA 64 -6.128 1.728 4.837 435 HB3 ALA 64 HB3 ALA 64 -7.022 0.246 4.496 436 H ARG 65 H ARG 65 -3.752 -1.097 7.098 437 HA ARG 65 HA ARG 65 -2.062 1.294 7.222 438 HB2 ARG 65 HB2 ARG 65 -2.409 -0.727 9.453 439 HB3 ARG 65 HB3 ARG 65 -1.048 0.380 9.363 440 HG2 ARG 65 HG2 ARG 65 -2.706 2.262 9.395 441 HG3 ARG 65 HG3 ARG 65 -3.953 1.060 9.722 442 HD2 ARG 65 HD2 ARG 65 -2.631 0.359 11.731 443 HD3 ARG 65 HD3 ARG 65 -1.569 1.735 11.433 444 HE ARG 65 HE ARG 65 -4.447 2.154 11.821 445 HH11 ARG 65 HH11 ARG 65 -1.147 2.739 12.866 446 HH12 ARG 65 HH12 ARG 65 -1.618 3.916 14.053 447 HH21 ARG 65 HH21 ARG 65 -5.049 3.696 13.367 448 HH22 ARG 65 HH22 ARG 65 -3.822 4.445 14.347 449 H PHE 66 H PHE 66 0.201 0.802 7.091 450 HA PHE 66 HA PHE 66 1.080 -1.877 6.598 451 HB2 PHE 66 HB2 PHE 66 1.954 -1.359 4.283 452 HB3 PHE 66 HB3 PHE 66 0.211 -1.544 4.387 453 HD1 PHE 66 HD1 PHE 66 2.945 0.914 3.995 454 HD2 PHE 66 HD2 PHE 66 -1.243 0.225 3.799 455 HE1 PHE 66 HE1 PHE 66 2.641 3.062 2.856 456 HE2 PHE 66 HE2 PHE 66 -1.551 2.376 2.666 457 HZ PHE 66 HZ PHE 66 0.395 3.796 2.192 458 H THR 67 H THR 67 3.471 -1.902 6.093 459 HA THR 67 HA THR 67 4.743 0.663 6.682 460 HB THR 67 HB THR 67 4.665 -0.830 8.755 461 HG1 THR 67 HG1 THR 67 6.218 0.467 9.263 462 HG21 THR 67 HG21 THR 67 5.260 -2.977 7.749 463 HG22 THR 67 HG22 THR 67 6.450 -2.509 8.964 464 HG23 THR 67 HG23 THR 67 6.822 -2.320 7.251 465 H SER 68 H SER 68 6.532 1.099 5.581 466 HA SER 68 HA SER 68 7.649 -0.965 3.807 467 HB2 SER 68 HB2 SER 68 8.412 1.002 2.411 468 HB3 SER 68 HB3 SER 68 6.664 0.788 2.473 469 HG SER 68 HG SER 68 8.032 2.953 3.083 470 H ASP 69 H ASP 69 9.930 -1.077 3.689 471 HA ASP 69 HA ASP 69 11.383 -0.475 6.024 472 HB2 ASP 69 HB2 ASP 69 12.021 -2.257 4.417 473 HB3 ASP 69 HB3 ASP 69 12.467 -1.020 3.249 474 H ILE 70 H ILE 70 11.501 1.044 2.812 475 HA ILE 70 HA ILE 70 12.639 3.420 4.081 476 HB ILE 70 HB ILE 70 13.427 4.020 1.731 477 HG12 ILE 70 HG12 ILE 70 13.974 1.686 0.500 478 HG13 ILE 70 HG13 ILE 70 12.438 1.249 1.235 479 HG21 ILE 70 HG21 ILE 70 14.620 1.655 3.154 480 HG22 ILE 70 HG22 ILE 70 14.944 3.363 3.466 481 HG23 ILE 70 HG23 ILE 70 15.441 2.635 1.938 482 HD11 ILE 70 HD11 ILE 70 11.360 3.125 0.089 483 HD12 ILE 70 HD12 ILE 70 12.131 2.015 -1.046 484 HD13 ILE 70 HD13 ILE 70 12.901 3.553 -0.654 485 H THR 71 H THR 71 11.953 5.458 3.412 486 HA THR 71 HA THR 71 9.495 5.551 1.783 487 HB THR 71 HB THR 71 8.963 7.693 3.070 488 HG1 THR 71 HG1 THR 71 10.469 8.283 4.412 489 HG21 THR 71 HG21 THR 71 7.935 6.534 4.960 490 HG22 THR 71 HG22 THR 71 8.919 5.110 4.629 491 HG23 THR 71 HG23 THR 71 7.708 5.630 3.457 492 H GLU 72 H GLU 72 12.692 6.191 1.945 493 HA GLU 72 HA GLU 72 12.633 8.351 -0.006 494 HB2 GLU 72 HB2 GLU 72 12.790 9.251 2.416 495 HB3 GLU 72 HB3 GLU 72 14.389 8.524 2.451 496 HG2 GLU 72 HG2 GLU 72 14.672 10.811 1.947 497 HG3 GLU 72 HG3 GLU 72 14.958 9.918 0.452 498 H GLY 73 H GLY 73 14.546 8.388 -1.268 499 HA2 GLY 73 HA2 GLY 73 16.990 7.736 -1.190 500 HA3 GLY 73 HA3 GLY 73 16.385 6.122 -0.815 501 H PHE 74 H PHE 74 17.862 5.953 -2.818 502 HA PHE 74 HA PHE 74 16.495 6.509 -5.329 503 HB2 PHE 74 HB2 PHE 74 18.489 5.346 -6.345 504 HB3 PHE 74 HB3 PHE 74 18.867 6.806 -5.450 505 HD1 PHE 74 HD2 PHE 74 19.217 3.147 -5.543 506 HD2 PHE 74 HD1 PHE 74 20.143 6.700 -3.382 507 HE1 PHE 74 HE2 PHE 74 20.899 1.916 -4.238 508 HE2 PHE 74 HE1 PHE 74 21.828 5.474 -2.083 509 HZ PHE 74 HZ PHE 74 22.206 3.078 -2.505 510 H ALA 75 H ALA 75 15.847 4.828 -6.762 511 HA ALA 75 HA ALA 75 14.339 2.766 -5.752 512 HB1 ALA 75 HB1 ALA 75 14.126 3.709 -8.017 513 HB2 ALA 75 HB2 ALA 75 14.170 1.944 -8.018 514 HB3 ALA 75 HB3 ALA 75 15.600 2.860 -8.494 515 HA PRO 76 HA PRO 76 17.743 -0.045 -4.842 516 HB2 PRO 76 HB2 PRO 76 16.625 -1.071 -2.601 517 HB3 PRO 76 HB3 PRO 76 17.373 0.526 -2.653 518 HG2 PRO 76 HG2 PRO 76 14.564 -0.169 -2.351 519 HG3 PRO 76 HG3 PRO 76 15.347 1.407 -2.155 520 HD2 PRO 76 HD2 PRO 76 13.880 0.332 -4.464 521 HD3 PRO 76 HD3 PRO 76 14.335 2.009 -4.094 522 H LEU 77 H LEU 77 15.226 -0.758 -6.508 523 HA LEU 77 HA LEU 77 14.364 -2.508 -7.604 524 HB2 LEU 77 HB2 LEU 77 16.604 -3.443 -7.772 525 HB3 LEU 77 HB3 LEU 77 16.447 -4.170 -6.186 526 HG LEU 77 HG LEU 77 14.426 -5.419 -7.209 527 HD11 LEU 77 HD11 LEU 77 14.619 -5.840 -9.610 528 HD12 LEU 77 HD12 LEU 77 15.907 -4.639 -9.713 529 HD13 LEU 77 HD13 LEU 77 14.274 -4.145 -9.263 530 HD21 LEU 77 HD21 LEU 77 16.451 -6.505 -6.485 531 HD22 LEU 77 HD22 LEU 77 17.267 -6.056 -7.985 532 HD23 LEU 77 HD23 LEU 77 15.918 -7.194 -8.019 533 H SER 78 H SER 78 15.151 -4.198 -4.557 534 HA SER 78 HA SER 78 12.279 -4.758 -4.328 535 HB2 SER 78 HB2 SER 78 13.050 -6.848 -3.150 536 HB3 SER 78 HB3 SER 78 13.480 -6.765 -4.853 537 HG SER 78 HG SER 78 15.192 -6.133 -2.661 538 H VAL 79 H VAL 79 11.269 -4.220 -2.528 539 HA VAL 79 HA VAL 79 12.857 -3.480 -0.144 540 HB VAL 79 HB VAL 79 10.377 -2.056 -1.191 541 HG11 VAL 79 HG11 VAL 79 11.931 -1.478 1.333 542 HG12 VAL 79 HG12 VAL 79 10.301 -2.146 1.256 543 HG13 VAL 79 HG13 VAL 79 10.608 -0.505 0.688 544 HG21 VAL 79 HG21 VAL 79 12.393 -1.417 -2.365 545 HG22 VAL 79 HG22 VAL 79 13.211 -1.105 -0.834 546 HG23 VAL 79 HG23 VAL 79 11.851 -0.099 -1.328 547 H ARG 80 H ARG 80 12.252 -4.440 1.726 548 HA ARG 80 HA ARG 80 10.191 -6.381 1.849 549 HB2 ARG 80 HB2 ARG 80 10.644 -6.399 4.303 550 HB3 ARG 80 HB3 ARG 80 12.090 -6.592 3.325 551 HG2 ARG 80 HG2 ARG 80 12.598 -4.189 3.692 552 HG3 ARG 80 HG3 ARG 80 11.193 -4.092 4.750 553 HD2 ARG 80 HD2 ARG 80 13.167 -4.337 6.079 554 HD3 ARG 80 HD3 ARG 80 12.209 -5.812 6.197 555 HE ARG 80 HE ARG 80 13.804 -6.899 4.781 556 HH11 ARG 80 HH11 ARG 80 14.812 -3.686 5.819 557 HH12 ARG 80 HH12 ARG 80 16.505 -4.033 5.627 558 HH21 ARG 80 HH21 ARG 80 16.013 -7.317 4.495 559 HH22 ARG 80 HH22 ARG 80 17.185 -6.095 4.873 560 H PHE 81 H PHE 81 8.110 -6.193 2.172 561 HA PHE 81 HA PHE 81 7.020 -3.713 3.285 562 HB2 PHE 81 HB2 PHE 81 7.115 -3.653 0.741 563 HB3 PHE 81 HB3 PHE 81 5.956 -4.977 0.750 564 HD1 PHE 81 HD1 PHE 81 6.483 -1.441 1.555 565 HD2 PHE 81 HD2 PHE 81 3.646 -4.595 1.250 566 HE1 PHE 81 HE1 PHE 81 4.651 0.192 1.712 567 HE2 PHE 81 HE2 PHE 81 1.818 -2.967 1.405 568 HZ PHE 81 HZ PHE 81 2.322 -0.578 1.636 569 H LYS 82 H LYS 82 5.536 -4.126 4.773 570 HA LYS 82 HA LYS 82 4.060 -6.661 4.622 571 HB2 LYS 82 HB2 LYS 82 5.387 -5.429 7.007 572 HB3 LYS 82 HB3 LYS 82 4.000 -6.489 7.204 573 HG2 LYS 82 HG2 LYS 82 5.322 -8.179 5.821 574 HG3 LYS 82 HG3 LYS 82 6.716 -7.137 6.112 575 HD2 LYS 82 HD2 LYS 82 6.675 -8.886 7.778 576 HD3 LYS 82 HD3 LYS 82 6.303 -7.343 8.548 577 HE2 LYS 82 HE2 LYS 82 3.906 -7.884 8.446 578 HE3 LYS 82 HE3 LYS 82 4.295 -9.438 7.712 579 HZ1 LYS 82 HZ1 LYS 82 5.202 -8.561 10.394 580 HZ2 LYS 82 HZ2 LYS 82 5.438 -10.089 9.697 581 HZ3 LYS 82 HZ3 LYS 82 3.878 -9.577 10.107 582 H ASP 83 H ASP 83 2.026 -6.723 5.470 583 HA ASP 83 HA ASP 83 0.554 -4.220 5.395 584 HB2 ASP 83 HB2 ASP 83 -0.344 -5.981 4.060 585 HB3 ASP 83 HB3 ASP 83 -0.224 -7.137 5.374 586 H PHE 84 H PHE 84 -0.657 -3.407 7.093 587 HA PHE 84 HA PHE 84 -0.485 -4.816 9.679 588 HB2 PHE 84 HB2 PHE 84 0.283 -1.994 9.038 589 HB3 PHE 84 HB3 PHE 84 -0.465 -2.319 10.595 590 HD1 PHE 84 HD1 PHE 84 2.372 -3.377 8.424 591 HD2 PHE 84 HD2 PHE 84 0.817 -3.041 12.368 592 HE1 PHE 84 HE1 PHE 84 4.548 -4.044 9.342 593 HE2 PHE 84 HE2 PHE 84 2.994 -3.712 13.285 594 HZ PHE 84 HZ PHE 84 4.863 -4.217 11.771 595 H SER 85 H SER 85 -2.538 -4.267 7.438 596 HA SER 85 HA SER 85 -4.599 -2.668 8.539 597 HB2 SER 85 HB2 SER 85 -4.734 -4.855 6.451 598 HB3 SER 85 HB3 SER 85 -6.019 -3.697 6.797 599 HG SER 85 HG SER 85 -3.648 -3.369 5.415 600 H GLU 86 H GLU 86 -6.525 -3.229 9.511 601 HA GLU 86 HA GLU 86 -6.753 -5.926 10.629 602 HB2 GLU 86 HB2 GLU 86 -5.445 -4.484 12.220 603 HB3 GLU 86 HB3 GLU 86 -6.824 -3.410 12.307 604 HG2 GLU 86 HG2 GLU 86 -6.697 -4.857 14.254 605 HG3 GLU 86 HG3 GLU 86 -8.160 -5.161 13.322 606 H ASN 87 H ASN 87 -8.841 -6.495 11.198 607 HA ASN 87 HA ASN 87 -11.084 -6.523 11.415 608 HB2 ASN 87 HB2 ASN 87 -10.750 -3.529 11.590 609 HB3 ASN 87 HB3 ASN 87 -12.268 -4.370 11.896 610 HD21 ASN 87 HD21 ASN 87 -10.241 -2.797 13.542 611 HD22 ASN 87 HD22 ASN 87 -10.012 -3.780 14.943 612 H ALA 88 H ALA 88 -10.060 -6.815 8.917 613 HA ALA 88 HA ALA 88 -11.959 -5.391 7.185 614 HB1 ALA 88 HB1 ALA 88 -9.333 -6.666 6.470 615 HB2 ALA 88 HB2 ALA 88 -9.618 -4.936 6.664 616 HB3 ALA 88 HB3 ALA 88 -10.410 -5.825 5.359 617 H THR 89 H THR 89 -13.286 -6.513 5.898 618 HA THR 89 HA THR 89 -13.602 -9.355 6.209 619 HB THR 89 HB THR 89 -14.932 -7.514 4.203 620 HG1 THR 89 HG1 THR 89 -16.469 -8.101 6.348 621 HG21 THR 89 HG21 THR 89 -15.263 -9.897 3.744 622 HG22 THR 89 HG22 THR 89 -16.767 -9.149 4.284 623 HG23 THR 89 HG23 THR 89 -15.829 -10.145 5.397 624 H SER 90 H SER 90 -12.698 -7.109 3.616 625 HA SER 90 HA SER 90 -11.218 -9.247 2.252 626 HB2 SER 90 HB2 SER 90 -13.086 -7.250 0.942 627 HB3 SER 90 HB3 SER 90 -12.064 -8.399 0.081 628 HG SER 90 HG SER 90 -14.440 -8.880 0.658 629 H ARG 91 H ARG 91 -9.597 -8.345 0.716 630 HA ARG 91 HA ARG 91 -8.917 -5.541 1.304 631 HB2 ARG 91 HB2 ARG 91 -6.546 -6.077 1.181 632 HB3 ARG 91 HB3 ARG 91 -7.330 -6.971 2.471 633 HG2 ARG 91 HG2 ARG 91 -7.301 -8.989 1.151 634 HG3 ARG 91 HG3 ARG 91 -6.661 -8.111 -0.240 635 HD2 ARG 91 HD2 ARG 91 -4.921 -9.365 0.979 636 HD3 ARG 91 HD3 ARG 91 -4.626 -7.627 0.955 637 HE ARG 91 HE ARG 91 -5.745 -9.069 3.271 638 HH11 ARG 91 HH11 ARG 91 -3.717 -6.541 1.920 639 HH12 ARG 91 HH12 ARG 91 -3.238 -5.926 3.472 640 HH21 ARG 91 HH21 ARG 91 -5.137 -8.246 5.287 641 HH22 ARG 91 HH22 ARG 91 -4.019 -6.919 5.385 642 H LEU 92 H LEU 92 -7.580 -4.491 -0.286 643 HA LEU 92 HA LEU 92 -7.575 -5.652 -2.951 644 HB2 LEU 92 HB2 LEU 92 -9.664 -4.266 -2.621 645 HB3 LEU 92 HB3 LEU 92 -8.624 -2.876 -2.385 646 HG LEU 92 HG LEU 92 -7.723 -3.236 -4.687 647 HD11 LEU 92 HD11 LEU 92 -9.981 -5.227 -4.863 648 HD12 LEU 92 HD12 LEU 92 -8.259 -5.607 -4.899 649 HD13 LEU 92 HD13 LEU 92 -8.982 -4.670 -6.207 650 HD21 LEU 92 HD21 LEU 92 -10.702 -2.830 -4.468 651 HD22 LEU 92 HD22 LEU 92 -9.679 -2.320 -5.812 652 HD23 LEU 92 HD23 LEU 92 -9.470 -1.594 -4.219 653 H TRP 93 H TRP 93 -5.488 -5.589 -3.471 654 HA TRP 93 HA TRP 93 -3.797 -3.407 -2.536 655 HB2 TRP 93 HB2 TRP 93 -3.236 -5.963 -4.030 656 HB3 TRP 93 HB3 TRP 93 -2.017 -4.720 -3.829 657 HD1 TRP 93 HD1 TRP 93 -3.442 -7.717 -2.159 658 HE1 TRP 93 HE1 TRP 93 -2.306 -8.060 0.126 659 HE3 TRP 93 HE3 TRP 93 -1.161 -3.161 -1.710 660 HZ2 TRP 93 HZ2 TRP 93 -0.702 -6.556 1.923 661 HZ3 TRP 93 HZ3 TRP 93 0.151 -2.691 0.314 662 HH2 TRP 93 HH2 TRP 93 0.371 -4.355 2.089 663 H MET 94 H MET 94 -3.828 -1.608 -3.669 664 HA MET 94 HA MET 94 -4.246 -1.769 -6.570 665 HB2 MET 94 HB2 MET 94 -4.612 0.537 -4.647 666 HB3 MET 94 HB3 MET 94 -4.740 0.688 -6.395 667 HG2 MET 94 HG2 MET 94 -6.598 -0.883 -6.408 668 HG3 MET 94 HG3 MET 94 -6.463 -1.071 -4.661 669 HE1 MET 94 HE1 MET 94 -7.377 1.366 -7.611 670 HE2 MET 94 HE2 MET 94 -6.105 2.264 -6.777 671 HE3 MET 94 HE3 MET 94 -7.759 2.858 -6.741 672 H PHE 95 H PHE 95 -2.448 -1.857 -7.642 673 HA PHE 95 HA PHE 95 0.012 -0.761 -6.546 674 HB2 PHE 95 HB2 PHE 95 -0.371 -2.302 -9.124 675 HB3 PHE 95 HB3 PHE 95 1.140 -2.027 -8.267 676 HD1 PHE 95 HD2 PHE 95 1.324 -3.038 -5.893 677 HD2 PHE 95 HD1 PHE 95 -1.582 -4.239 -8.761 678 HE1 PHE 95 HE2 PHE 95 1.016 -5.161 -4.688 679 HE2 PHE 95 HE1 PHE 95 -1.899 -6.361 -7.561 680 HZ PHE 95 HZ PHE 95 -0.598 -6.823 -5.522 681 H GLY 96 H GLY 96 -2.372 0.019 -8.877 682 HA2 GLY 96 HA2 GLY 96 -2.527 2.043 -10.093 683 HA3 GLY 96 HA3 GLY 96 -0.783 2.245 -9.950 684 H ASP 97 H ASP 97 -0.722 -0.742 -10.642 685 HA ASP 97 HA ASP 97 -1.087 -0.542 -13.530 686 HB2 ASP 97 HB2 ASP 97 1.290 0.077 -12.964 687 HB3 ASP 97 HB3 ASP 97 1.491 -1.532 -12.274 688 H GLY 98 H GLY 98 -1.903 -2.378 -14.385 689 HA2 GLY 98 HA2 GLY 98 -2.165 -4.663 -14.735 690 HA3 GLY 98 HA3 GLY 98 -1.251 -4.966 -13.266 691 H ASN 99 H ASN 99 -2.776 -6.587 -12.774 692 HA ASN 99 HA ASN 99 -5.483 -5.756 -12.127 693 HB2 ASN 99 HB2 ASN 99 -4.162 -8.470 -11.943 694 HB3 ASN 99 HB3 ASN 99 -5.837 -8.153 -11.513 695 HD21 ASN 99 HD21 ASN 99 -7.309 -7.604 -13.159 696 HD22 ASN 99 HD22 ASN 99 -6.986 -7.982 -14.814 697 H THR 100 H THR 100 -6.361 -5.661 -10.157 698 HA THR 100 HA THR 100 -4.541 -5.023 -8.018 699 HB THR 100 HB THR 100 -6.672 -4.439 -6.775 700 HG1 THR 100 HG1 THR 100 -7.731 -5.501 -9.138 701 HG21 THR 100 HG21 THR 100 -7.083 -2.421 -8.081 702 HG22 THR 100 HG22 THR 100 -6.241 -3.130 -9.461 703 HG23 THR 100 HG23 THR 100 -5.357 -2.768 -7.976 704 H SER 101 H SER 101 -4.350 -5.947 -6.054 705 HA SER 101 HA SER 101 -4.064 -7.572 -4.522 706 HB2 SER 101 HB2 SER 101 -6.722 -8.615 -5.510 707 HB3 SER 101 HB3 SER 101 -5.905 -9.143 -4.040 708 HG SER 101 HG SER 101 -7.580 -7.381 -3.955 709 H ASP 102 H ASP 102 -3.574 -8.151 -7.621 710 HA ASP 102 HA ASP 102 -2.971 -11.000 -7.266 711 HB2 ASP 102 HB2 ASP 102 -5.005 -10.799 -8.608 712 HB3 ASP 102 HB3 ASP 102 -4.212 -9.663 -9.693 713 H SER 103 H SER 103 -0.890 -11.303 -7.438 714 HA SER 103 HA SER 103 0.551 -9.995 -9.620 715 HB2 SER 103 HB2 SER 103 1.584 -10.258 -6.781 716 HB3 SER 103 HB3 SER 103 2.563 -9.762 -8.161 717 HG SER 103 HG SER 103 0.319 -8.288 -8.050 718 HA PRO 104 HA PRO 104 1.570 -14.466 -9.971 719 HB2 PRO 104 HB2 PRO 104 1.650 -13.868 -12.822 720 HB3 PRO 104 HB3 PRO 104 0.659 -15.049 -11.965 721 HG2 PRO 104 HG2 PRO 104 -0.383 -12.827 -13.113 722 HG3 PRO 104 HG3 PRO 104 -1.074 -13.575 -11.662 723 HD2 PRO 104 HD2 PRO 104 0.690 -11.167 -11.898 724 HD3 PRO 104 HD3 PRO 104 -0.733 -11.428 -10.865 725 H SER 105 H SER 105 2.714 -11.693 -11.792 726 HA SER 105 HA SER 105 5.505 -12.546 -11.471 727 HB2 SER 105 HB2 SER 105 4.379 -10.304 -13.182 728 HB3 SER 105 HB3 SER 105 6.022 -10.951 -13.220 729 HG SER 105 HG SER 105 3.864 -11.780 -14.555 730 HA PRO 106 HA PRO 106 6.044 -9.221 -8.419 731 HB2 PRO 106 HB2 PRO 106 8.622 -8.606 -9.730 732 HB3 PRO 106 HB3 PRO 106 8.296 -9.075 -8.061 733 HG2 PRO 106 HG2 PRO 106 9.453 -10.784 -9.750 734 HG3 PRO 106 HG3 PRO 106 8.259 -11.341 -8.562 735 HD2 PRO 106 HD2 PRO 106 7.907 -10.808 -11.488 736 HD3 PRO 106 HD3 PRO 106 7.300 -12.163 -10.509 737 H LEU 107 H LEU 107 4.531 -7.724 -9.058 738 HA LEU 107 HA LEU 107 4.853 -6.229 -11.505 739 HB2 LEU 107 HB2 LEU 107 2.675 -6.176 -9.416 740 HB3 LEU 107 HB3 LEU 107 2.648 -5.232 -10.891 741 HG LEU 107 HG LEU 107 2.608 -8.247 -10.718 742 HD11 LEU 107 HD11 LEU 107 0.491 -6.246 -11.478 743 HD12 LEU 107 HD12 LEU 107 0.529 -7.225 -10.011 744 HD13 LEU 107 HD13 LEU 107 0.333 -8.000 -11.584 745 HD21 LEU 107 HD21 LEU 107 2.428 -6.439 -13.133 746 HD22 LEU 107 HD22 LEU 107 2.225 -8.191 -13.132 747 HD23 LEU 107 HD23 LEU 107 3.789 -7.484 -12.725 748 H HIS 108 H HIS 108 4.414 -5.305 -8.067 749 HA HIS 108 HA HIS 108 5.269 -2.606 -8.774 750 HB2 HIS 108 HB2 HIS 108 3.239 -3.267 -7.229 751 HB3 HIS 108 HB3 HIS 108 4.481 -3.358 -5.982 752 HD1 HIS 108 HD1 HIS 108 5.039 -1.209 -4.852 753 HD2 HIS 108 HD2 HIS 108 3.159 -0.628 -8.513 754 HE1 HIS 108 HE1 HIS 108 4.666 1.274 -5.039 755 HE2 HIS 108 HE2 HIS 108 3.362 1.576 -7.171 756 H THR 109 H THR 109 7.336 -3.826 -9.238 757 HA THR 109 HA THR 109 9.128 -3.683 -6.893 758 HB THR 109 HB THR 109 9.692 -5.193 -9.466 759 HG1 THR 109 HG1 THR 109 7.771 -5.808 -7.927 760 HG21 THR 109 HG21 THR 109 10.806 -5.494 -6.667 761 HG22 THR 109 HG22 THR 109 11.626 -4.701 -8.012 762 HG23 THR 109 HG23 THR 109 11.287 -6.431 -8.084 763 H PHE 110 H PHE 110 11.142 -2.557 -7.308 764 HA PHE 110 HA PHE 110 10.583 -0.355 -9.146 765 HB2 PHE 110 HB2 PHE 110 12.648 -0.365 -6.943 766 HB3 PHE 110 HB3 PHE 110 11.902 1.026 -7.725 767 HD1 PHE 110 HD1 PHE 110 9.112 0.731 -7.574 768 HD2 PHE 110 HD2 PHE 110 12.007 -0.602 -4.755 769 HE1 PHE 110 HE1 PHE 110 7.403 0.775 -5.807 770 HE2 PHE 110 HE2 PHE 110 10.301 -0.552 -2.989 771 HZ PHE 110 HZ PHE 110 7.998 0.136 -3.513 772 H PHE 111 H PHE 111 11.252 -1.488 -10.998 773 HA PHE 111 HA PHE 111 13.979 -2.408 -11.287 774 HB2 PHE 111 HB2 PHE 111 11.772 -2.111 -13.344 775 HB3 PHE 111 HB3 PHE 111 13.314 -2.908 -13.615 776 HD1 PHE 111 HD1 PHE 111 13.839 -4.962 -12.147 777 HD2 PHE 111 HD2 PHE 111 9.940 -3.320 -12.606 778 HE1 PHE 111 HE1 PHE 111 12.857 -7.110 -11.451 779 HE2 PHE 111 HE2 PHE 111 8.954 -5.460 -11.905 780 HZ PHE 111 HZ PHE 111 10.413 -7.358 -11.331 781 H ASN 112 H ASN 112 12.055 0.344 -12.141 782 HA ASN 112 HA ASN 112 14.384 1.706 -13.310 783 HB2 ASN 112 HB2 ASN 112 11.609 1.461 -14.462 784 HB3 ASN 112 HB3 ASN 112 12.608 2.862 -14.826 785 HD21 ASN 112 HD21 ASN 112 11.571 0.659 -16.521 786 HD22 ASN 112 HD22 ASN 112 12.974 0.008 -17.304 787 H GLU 113 H GLU 113 14.074 4.082 -13.297 788 HA GLU 113 HA GLU 113 13.207 4.933 -10.709 789 HB2 GLU 113 HB2 GLU 113 14.439 6.353 -13.061 790 HB3 GLU 113 HB3 GLU 113 13.780 7.273 -11.716 791 HG2 GLU 113 HG2 GLU 113 16.090 7.061 -11.319 792 HG3 GLU 113 HG3 GLU 113 15.294 5.956 -10.205 793 H GLY 114 H GLY 114 11.772 6.699 -10.287 794 HA2 GLY 114 HA2 GLY 114 10.025 8.042 -11.783 795 HA3 GLY 114 HA3 GLY 114 9.323 6.428 -11.827 796 H GLU 115 H GLU 115 7.577 7.841 -10.798 797 HA GLU 115 HA GLU 115 7.978 7.824 -7.894 798 HB2 GLU 115 HB2 GLU 115 7.525 10.058 -8.987 799 HB3 GLU 115 HB3 GLU 115 5.922 9.447 -9.387 800 HG2 GLU 115 HG2 GLU 115 5.299 9.298 -7.126 801 HG3 GLU 115 HG3 GLU 115 6.962 9.479 -6.571 802 H TYR 116 H TYR 116 7.007 6.257 -6.912 803 HA TYR 116 HA TYR 116 4.948 4.718 -8.330 804 HB2 TYR 116 HB2 TYR 116 6.297 3.699 -5.862 805 HB3 TYR 116 HB3 TYR 116 5.748 2.816 -7.279 806 HD1 TYR 116 HD1 TYR 116 7.187 2.721 -9.306 807 HD2 TYR 116 HD2 TYR 116 8.490 4.592 -5.717 808 HE1 TYR 116 HE1 TYR 116 9.516 2.630 -10.099 809 HE2 TYR 116 HE2 TYR 116 10.810 4.509 -6.498 810 HH TYR 116 HH TYR 116 11.619 3.603 -9.747 811 H ILE 117 H ILE 117 3.070 4.041 -7.203 812 HA ILE 117 HA ILE 117 2.665 5.328 -4.587 813 HB ILE 117 HB ILE 117 0.545 5.063 -6.748 814 HG12 ILE 117 HG12 ILE 117 1.780 7.586 -5.617 815 HG13 ILE 117 HG13 ILE 117 2.278 6.855 -7.136 816 HG21 ILE 117 HG21 ILE 117 0.411 6.279 -3.984 817 HG22 ILE 117 HG22 ILE 117 -0.406 4.811 -4.525 818 HG23 ILE 117 HG23 ILE 117 -0.862 6.375 -5.202 819 HD11 ILE 117 HD11 ILE 117 -0.459 7.938 -6.513 820 HD12 ILE 117 HD12 ILE 117 0.042 7.212 -8.041 821 HD13 ILE 117 HD13 ILE 117 0.775 8.721 -7.499 822 H VAL 118 H VAL 118 2.430 3.834 -3.062 823 HA VAL 118 HA VAL 118 1.168 1.271 -3.702 824 HB VAL 118 HB VAL 118 2.310 2.194 -1.047 825 HG11 VAL 118 HG11 VAL 118 0.544 0.520 -0.786 826 HG12 VAL 118 HG12 VAL 118 2.122 -0.147 -0.362 827 HG13 VAL 118 HG13 VAL 118 1.384 -0.544 -1.914 828 HG21 VAL 118 HG21 VAL 118 4.073 1.912 -2.691 829 HG22 VAL 118 HG22 VAL 118 3.464 0.303 -3.086 830 HG23 VAL 118 HG23 VAL 118 4.136 0.624 -1.486 831 H SER 119 H SER 119 -0.970 1.111 -3.544 832 HA SER 119 HA SER 119 -2.334 2.747 -1.523 833 HB2 SER 119 HB2 SER 119 -2.949 3.408 -3.817 834 HB3 SER 119 HB3 SER 119 -3.445 1.752 -4.161 835 HG SER 119 HG SER 119 -4.968 3.599 -3.273 836 H LEU 120 H LEU 120 -3.157 1.650 0.053 837 HA LEU 120 HA LEU 120 -3.949 -1.147 -0.384 838 HB2 LEU 120 HB2 LEU 120 -1.959 -1.073 0.983 839 HB3 LEU 120 HB3 LEU 120 -2.663 0.130 2.034 840 HG LEU 120 HG LEU 120 -4.125 -1.497 3.046 841 HD11 LEU 120 HD11 LEU 120 -4.187 -3.836 2.376 842 HD12 LEU 120 HD12 LEU 120 -3.064 -3.510 1.055 843 HD13 LEU 120 HD13 LEU 120 -4.685 -2.814 1.026 844 HD21 LEU 120 HD21 LEU 120 -2.490 -3.009 3.982 845 HD22 LEU 120 HD22 LEU 120 -1.832 -1.379 3.824 846 HD23 LEU 120 HD23 LEU 120 -1.375 -2.633 2.669 847 H ILE 121 H ILE 121 -6.028 -1.421 -0.201 848 HA ILE 121 HA ILE 121 -7.525 0.249 1.656 849 HB ILE 121 HB ILE 121 -7.875 1.306 -0.465 850 HG12 ILE 121 HG12 ILE 121 -9.903 0.804 1.126 851 HG13 ILE 121 HG13 ILE 121 -10.161 1.571 -0.430 852 HG21 ILE 121 HG21 ILE 121 -7.237 -0.381 -2.002 853 HG22 ILE 121 HG22 ILE 121 -8.851 0.190 -2.430 854 HG23 ILE 121 HG23 ILE 121 -8.651 -1.357 -1.603 855 HD11 ILE 121 HD11 ILE 121 -10.911 -0.563 -1.350 856 HD12 ILE 121 HD12 ILE 121 -11.867 -0.086 0.053 857 HD13 ILE 121 HD13 ILE 121 -10.632 -1.336 0.210 858 H VAL 122 H VAL 122 -8.754 -0.890 2.936 859 HA VAL 122 HA VAL 122 -9.376 -3.655 2.166 860 HB VAL 122 HB VAL 122 -9.548 -4.098 4.671 861 HG11 VAL 122 HG11 VAL 122 -6.861 -3.376 3.501 862 HG12 VAL 122 HG12 VAL 122 -7.696 -4.923 3.341 863 HG13 VAL 122 HG13 VAL 122 -7.116 -4.391 4.920 864 HG21 VAL 122 HG21 VAL 122 -8.241 -2.631 6.137 865 HG22 VAL 122 HG22 VAL 122 -9.634 -1.793 5.452 866 HG23 VAL 122 HG23 VAL 122 -8.019 -1.500 4.804 867 H SER 123 H SER 123 -11.462 -4.478 2.849 868 HA SER 123 HA SER 123 -13.442 -2.302 3.023 869 HB2 SER 123 HB2 SER 123 -13.641 -4.804 1.315 870 HB3 SER 123 HB3 SER 123 -14.860 -3.536 1.443 871 HG SER 123 HG SER 123 -12.451 -2.487 0.823 872 H ASN 124 H ASN 124 -15.416 -2.848 4.022 873 HA ASN 124 HA ASN 124 -15.653 -5.410 5.400 874 HB2 ASN 124 HB2 ASN 124 -14.378 -3.722 6.863 875 HB3 ASN 124 HB3 ASN 124 -15.844 -2.757 6.870 876 HD21 ASN 124 HD21 ASN 124 -14.324 -5.661 8.016 877 HD22 ASN 124 HD22 ASN 124 -15.474 -6.015 9.256 878 H GLU 125 H GLU 125 -17.973 -5.154 6.681 879 HA GLU 125 HA GLU 125 -19.919 -4.504 4.676 880 HB2 GLU 125 HB2 GLU 125 -21.556 -5.208 6.417 881 HB3 GLU 125 HB3 GLU 125 -20.323 -6.409 6.073 882 HG2 GLU 125 HG2 GLU 125 -19.134 -5.803 8.105 883 HG3 GLU 125 HG3 GLU 125 -20.317 -4.539 8.439 884 H ASN 126 H ASN 126 -18.389 -2.727 7.155 885 HA ASN 126 HA ASN 126 -20.593 -0.852 7.539 886 HB2 ASN 126 HB2 ASN 126 -17.819 -1.004 8.729 887 HB3 ASN 126 HB3 ASN 126 -18.918 0.337 9.023 888 HD21 ASN 126 HD21 ASN 126 -18.194 -2.974 9.674 889 HD22 ASN 126 HD22 ASN 126 -19.348 -3.177 10.943 890 H ASP 127 H ASP 127 -17.187 -0.723 6.566 891 HA ASP 127 HA ASP 127 -17.719 1.382 4.645 892 HB2 ASP 127 HB2 ASP 127 -15.955 1.788 7.075 893 HB3 ASP 127 HB3 ASP 127 -15.829 2.780 5.631 894 H SER 128 H SER 128 -15.561 2.035 3.611 895 HA SER 128 HA SER 128 -13.603 -0.162 3.726 896 HB2 SER 128 HB2 SER 128 -13.067 0.489 1.300 897 HB3 SER 128 HB3 SER 128 -14.586 -0.369 1.568 898 HG SER 128 HG SER 128 -15.197 2.146 1.828 899 H ASP 129 H ASP 129 -11.546 0.452 4.132 900 HA ASP 129 HA ASP 129 -11.097 3.353 4.466 901 HB2 ASP 129 HB2 ASP 129 -11.389 1.997 6.587 902 HB3 ASP 129 HB3 ASP 129 -9.920 1.121 6.149 903 H SER 130 H SER 130 -9.272 4.164 3.518 904 HA SER 130 HA SER 130 -7.311 2.213 2.533 905 HB2 SER 130 HB2 SER 130 -7.052 3.612 0.485 906 HB3 SER 130 HB3 SER 130 -8.646 2.876 0.625 907 HG SER 130 HG SER 130 -9.530 4.800 1.022 908 H ALA 131 H ALA 131 -5.230 2.778 2.513 909 HA ALA 131 HA ALA 131 -4.468 5.539 3.168 910 HB1 ALA 131 HB1 ALA 131 -2.556 4.705 4.461 911 HB2 ALA 131 HB2 ALA 131 -3.118 3.048 4.234 912 HB3 ALA 131 HB3 ALA 131 -4.083 4.186 5.175 913 H SER 132 H SER 132 -2.834 6.314 1.890 914 HA SER 132 HA SER 132 -1.513 4.464 0.059 915 HB2 SER 132 HB2 SER 132 -3.622 5.355 -1.020 916 HB3 SER 132 HB3 SER 132 -2.925 6.971 -0.906 917 HG SER 132 HG SER 132 -1.506 4.876 -2.149 918 H VAL 133 H VAL 133 0.545 5.176 -0.601 919 HA VAL 133 HA VAL 133 1.389 7.782 0.443 920 HB VAL 133 HB VAL 133 3.595 6.841 1.122 921 HG11 VAL 133 HG11 VAL 133 1.239 5.758 2.654 922 HG12 VAL 133 HG12 VAL 133 1.930 7.373 2.804 923 HG13 VAL 133 HG13 VAL 133 2.877 5.963 3.279 924 HG21 VAL 133 HG21 VAL 133 3.557 4.762 -0.128 925 HG22 VAL 133 HG22 VAL 133 2.215 4.173 0.855 926 HG23 VAL 133 HG23 VAL 133 3.795 4.447 1.592 927 H THR 134 H THR 134 3.255 8.640 -0.529 928 HA THR 134 HA THR 134 3.636 7.785 -3.282 929 HB THR 134 HB THR 134 4.587 10.262 -1.828 930 HG1 THR 134 HG1 THR 134 2.227 9.906 -2.274 931 HG21 THR 134 HG21 THR 134 5.033 11.178 -4.058 932 HG22 THR 134 HG22 THR 134 4.599 9.625 -4.776 933 HG23 THR 134 HG23 THR 134 6.016 9.749 -3.735 934 H ILE 135 H ILE 135 5.163 6.352 -3.628 935 HA ILE 135 HA ILE 135 7.499 6.154 -1.888 936 HB ILE 135 HB ILE 135 6.909 4.491 -4.357 937 HG12 ILE 135 HG12 ILE 135 5.033 4.234 -2.804 938 HG13 ILE 135 HG13 ILE 135 5.983 2.759 -2.898 939 HG21 ILE 135 HG21 ILE 135 8.414 2.850 -3.337 940 HG22 ILE 135 HG22 ILE 135 8.692 3.942 -1.979 941 HG23 ILE 135 HG23 ILE 135 9.222 4.396 -3.600 942 HD11 ILE 135 HD11 ILE 135 6.081 4.783 -0.671 943 HD12 ILE 135 HD12 ILE 135 7.028 3.296 -0.755 944 HD13 ILE 135 HD13 ILE 135 5.269 3.217 -0.624 945 H ARG 136 H ARG 136 9.449 6.980 -2.463 946 HA ARG 136 HA ARG 136 9.453 8.427 -5.013 947 HB2 ARG 136 HB2 ARG 136 9.196 9.839 -2.965 948 HB3 ARG 136 HB3 ARG 136 10.767 9.267 -2.426 949 HG2 ARG 136 HG2 ARG 136 11.780 10.244 -4.451 950 HG3 ARG 136 HG3 ARG 136 10.199 10.892 -4.897 951 HD2 ARG 136 HD2 ARG 136 10.136 12.147 -2.795 952 HD3 ARG 136 HD3 ARG 136 11.722 11.509 -2.372 953 HE ARG 136 HE ARG 136 11.587 12.945 -4.884 954 HH11 ARG 136 HH11 ARG 136 12.380 13.056 -1.477 955 HH12 ARG 136 HH12 ARG 136 13.211 14.576 -1.595 956 HH21 ARG 136 HH21 ARG 136 12.686 14.916 -5.041 957 HH22 ARG 136 HH22 ARG 136 13.398 15.628 -3.625 958 H ALA 137 H ALA 137 10.957 7.823 -6.364 959 HA ALA 137 HA ALA 137 13.458 6.692 -5.338 960 HB1 ALA 137 HB1 ALA 137 12.426 5.438 -7.174 961 HB2 ALA 137 HB2 ALA 137 13.969 6.135 -7.671 962 HB3 ALA 137 HB3 ALA 137 12.455 6.882 -8.184 963 H LEU 138 H LEU 138 15.290 7.873 -5.407 964 HA LEU 138 HA LEU 138 15.000 10.685 -5.927 965 HB2 LEU 138 HB2 LEU 138 17.339 9.059 -4.949 966 HB3 LEU 138 HB3 LEU 138 17.420 10.789 -5.212 967 HG LEU 138 HG LEU 138 15.737 9.331 -3.167 968 HD11 LEU 138 HD11 LEU 138 17.072 10.620 -1.581 969 HD12 LEU 138 HD12 LEU 138 17.989 11.316 -2.919 970 HD13 LEU 138 HD13 LEU 138 18.081 9.585 -2.592 971 HD21 LEU 138 HD21 LEU 138 15.790 12.285 -3.801 972 HD22 LEU 138 HD22 LEU 138 14.956 11.527 -2.445 973 HD23 LEU 138 HD23 LEU 138 14.440 11.186 -4.097 974 H GLU 139 H GLU 139 16.090 11.920 -7.352 975 HA GLU 139 HA GLU 139 16.705 10.678 -9.864 976 HB2 GLU 139 HB2 GLU 139 15.470 12.804 -9.754 977 HB3 GLU 139 HB3 GLU 139 16.849 13.568 -8.984 978 HG2 GLU 139 HG2 GLU 139 18.166 13.340 -10.973 979 HG3 GLU 139 HG3 GLU 139 16.897 12.399 -11.756 980 H HIS 140 H HIS 140 18.464 9.546 -9.811 981 HA HIS 140 HA HIS 140 20.803 10.096 -8.348 982 HB2 HIS 140 HB2 HIS 140 21.830 8.251 -9.680 983 HB3 HIS 140 HB3 HIS 140 20.299 7.812 -8.950 984 HD1 HIS 140 HD1 HIS 140 22.060 7.988 -12.169 985 HD2 HIS 140 HD2 HIS 140 18.146 7.577 -10.837 986 HE1 HIS 140 HE1 HIS 140 20.750 7.168 -14.155 987 HE2 HIS 140 HE2 HIS 140 18.462 6.679 -13.244 988 H HIS 141 H HIS 141 22.814 10.743 -8.968 989 HA HIS 141 HA HIS 141 22.661 12.979 -10.797 990 HB2 HIS 141 HB2 HIS 141 24.768 12.116 -8.812 991 HB3 HIS 141 HB3 HIS 141 24.938 13.524 -9.850 992 HD1 HIS 141 HD1 HIS 141 24.198 15.648 -8.826 993 HD2 HIS 141 HD2 HIS 141 22.327 12.374 -7.089 994 HE1 HIS 141 HE1 HIS 141 22.829 16.580 -6.937 995 HE2 HIS 141 HE2 HIS 141 21.875 14.557 -5.777 996 H HIS 142 H HIS 142 23.212 12.844 -12.805 997 HA HIS 142 HA HIS 142 25.510 11.180 -13.504 998 HB2 HIS 142 HB2 HIS 142 24.404 10.683 -15.735 999 HB3 HIS 142 HB3 HIS 142 23.741 9.861 -14.332 1000 HD1 HIS 142 HD1 HIS 142 22.899 12.380 -16.975 1001 HD2 HIS 142 HD2 HIS 142 21.066 10.524 -13.735 1002 HE1 HIS 142 HE1 HIS 142 20.446 12.870 -17.209 1003 HE2 HIS 142 HE2 HIS 142 19.347 11.728 -15.263 1004 H HIS 143 H HIS 143 26.640 13.154 -13.192 1005 HA HIS 143 HA HIS 143 26.381 15.199 -15.229 1006 HB2 HIS 143 HB2 HIS 143 27.211 15.715 -12.915 1007 HB3 HIS 143 HB3 HIS 143 28.625 14.719 -13.226 1008 HD1 HIS 143 HD1 HIS 143 26.968 17.849 -14.632 1009 HD2 HIS 143 HD2 HIS 143 30.720 16.104 -14.244 1010 HE1 HIS 143 HE1 HIS 143 28.604 19.554 -15.494 1011 HE2 HIS 143 HE2 HIS 143 30.871 18.558 -15.050 1012 H HIS 144 H HIS 144 27.251 15.066 -17.173 1013 HA HIS 144 HA HIS 144 28.490 12.638 -17.987 1014 HB2 HIS 144 HB2 HIS 144 26.855 14.009 -19.353 1015 HB3 HIS 144 HB3 HIS 144 28.170 15.137 -19.655 1016 HD1 HIS 144 HD1 HIS 144 29.759 14.572 -21.517 1017 HD2 HIS 144 HD2 HIS 144 27.264 11.402 -20.519 1018 HE1 HIS 144 HE1 HIS 144 30.169 12.817 -23.262 1019 HE2 HIS 144 HE2 HIS 144 28.714 10.868 -22.598 1020 H HIS 145 H HIS 145 29.649 16.032 -18.325 1021 HA HIS 145 HA HIS 145 32.281 15.294 -17.432 1022 HB2 HIS 145 HB2 HIS 145 32.174 14.480 -19.846 1023 HB3 HIS 145 HB3 HIS 145 32.033 16.167 -20.319 1024 HD1 HIS 145 HD1 HIS 145 34.173 17.233 -20.902 1025 HD2 HIS 145 HD2 HIS 145 34.691 14.062 -18.263 1026 HE1 HIS 145 HE1 HIS 145 36.658 17.002 -20.601 1027 HE2 HIS 145 HE2 HIS 145 36.959 14.999 -19.110 Start of MODEL 11 1 H1 MET 1 H1 MET 1 31.537 11.729 144.105 2 H2 MET 1 H2 MET 1 30.099 11.077 143.493 3 H3 MET 1 H3 MET 1 30.070 12.549 144.331 4 HA MET 1 HA MET 1 31.360 13.603 142.616 5 HB2 MET 1 HB2 MET 1 31.243 10.857 141.358 6 HB3 MET 1 HB3 MET 1 31.606 12.308 140.433 7 HG2 MET 1 HG2 MET 1 33.674 11.311 140.934 8 HG3 MET 1 HG3 MET 1 33.530 12.692 142.010 9 HE1 MET 1 HE1 MET 1 33.062 8.287 143.314 10 HE2 MET 1 HE2 MET 1 33.500 8.798 141.682 11 HE3 MET 1 HE3 MET 1 31.874 9.104 142.298 12 H ASN 2 H ASN 2 29.762 14.985 142.205 13 HA ASN 2 HA ASN 2 27.331 13.979 140.863 14 HB2 ASN 2 HB2 ASN 2 26.899 14.701 143.202 15 HB3 ASN 2 HB3 ASN 2 27.539 16.293 142.819 16 HD21 ASN 2 HD21 ASN 2 25.634 17.314 143.365 17 HD22 ASN 2 HD22 ASN 2 24.222 17.234 142.362 18 H ALA 3 H ALA 3 26.733 14.974 139.022 19 HA ALA 3 HA ALA 3 28.491 17.102 138.014 20 HB1 ALA 3 HB1 ALA 3 26.697 15.202 136.511 21 HB2 ALA 3 HB2 ALA 3 28.440 15.028 136.718 22 HB3 ALA 3 HB3 ALA 3 27.793 16.383 135.791 23 H ARG 4 H ARG 4 27.673 18.920 137.022 24 HA ARG 4 HA ARG 4 24.931 19.666 137.687 25 HB2 ARG 4 HB2 ARG 4 27.241 21.210 136.499 26 HB3 ARG 4 HB3 ARG 4 25.614 21.860 136.533 27 HG2 ARG 4 HG2 ARG 4 26.693 22.826 138.359 28 HG3 ARG 4 HG3 ARG 4 25.704 21.546 139.057 29 HD2 ARG 4 HD2 ARG 4 27.980 21.689 140.023 30 HD3 ARG 4 HD3 ARG 4 27.626 20.124 139.293 31 HE ARG 4 HE ARG 4 28.887 21.795 137.398 32 HH11 ARG 4 HH11 ARG 4 29.659 20.068 140.354 33 HH12 ARG 4 HH12 ARG 4 31.281 19.686 139.856 34 HH21 ARG 4 HH21 ARG 4 31.024 21.329 136.761 35 HH22 ARG 4 HH22 ARG 4 32.075 20.445 137.827 36 H ASP 5 H ASP 5 23.362 19.131 136.290 37 HA ASP 5 HA ASP 5 24.024 19.231 133.440 38 HB2 ASP 5 HB2 ASP 5 22.696 17.295 132.968 39 HB3 ASP 5 HB3 ASP 5 23.867 16.880 134.209 40 H ASN 6 H ASN 6 22.835 20.401 132.232 41 HA ASN 6 HA ASN 6 20.050 20.952 132.789 42 HB2 ASN 6 HB2 ASN 6 21.560 22.666 134.062 43 HB3 ASN 6 HB3 ASN 6 21.870 23.335 132.466 44 HD21 ASN 6 HD21 ASN 6 20.556 24.499 134.779 45 HD22 ASN 6 HD22 ASN 6 18.982 24.980 134.250 46 H LYS 7 H LYS 7 19.059 20.860 130.903 47 HA LYS 7 HA LYS 7 20.574 20.699 128.458 48 HB2 LYS 7 HB2 LYS 7 17.569 20.701 128.721 49 HB3 LYS 7 HB3 LYS 7 18.532 20.010 127.426 50 HG2 LYS 7 HG2 LYS 7 18.496 18.983 130.258 51 HG3 LYS 7 HG3 LYS 7 17.517 18.335 128.946 52 HD2 LYS 7 HD2 LYS 7 20.523 18.471 128.847 53 HD3 LYS 7 HD3 LYS 7 19.646 17.077 129.474 54 HE2 LYS 7 HE2 LYS 7 18.517 16.831 127.298 55 HE3 LYS 7 HE3 LYS 7 19.435 18.203 126.679 56 HZ1 LYS 7 HZ1 LYS 7 21.478 16.960 127.074 57 HZ2 LYS 7 HZ2 LYS 7 20.452 16.121 126.023 58 HZ3 LYS 7 HZ3 LYS 7 20.585 15.639 127.643 59 H PHE 8 H PHE 8 20.715 22.194 126.871 60 HA PHE 8 HA PHE 8 19.579 24.827 127.362 61 HB2 PHE 8 HB2 PHE 8 21.475 23.821 125.227 62 HB3 PHE 8 HB3 PHE 8 20.885 25.473 125.308 63 HD1 PHE 8 HD1 PHE 8 23.101 22.994 126.827 64 HD2 PHE 8 HD2 PHE 8 21.688 27.007 126.986 65 HE1 PHE 8 HE1 PHE 8 24.977 23.592 128.302 66 HE2 PHE 8 HE2 PHE 8 23.562 27.609 128.463 67 HZ PHE 8 HZ PHE 8 25.208 25.901 129.120 68 H ASN 9 H ASN 9 17.463 24.824 126.922 69 HA ASN 9 HA ASN 9 16.470 23.466 124.547 70 HB2 ASN 9 HB2 ASN 9 15.026 24.773 126.860 71 HB3 ASN 9 HB3 ASN 9 14.199 24.112 125.460 72 HD21 ASN 9 HD21 ASN 9 13.080 22.593 126.638 73 HD22 ASN 9 HD22 ASN 9 13.844 21.218 127.361 74 H THR 10 H THR 10 17.415 24.839 123.033 75 HA THR 10 HA THR 10 15.885 27.295 122.553 76 HB THR 10 HB THR 10 18.881 27.083 122.108 77 HG1 THR 10 HG1 THR 10 17.612 27.511 124.368 78 HG21 THR 10 HG21 THR 10 17.002 29.446 121.898 79 HG22 THR 10 HG22 THR 10 17.756 28.602 120.545 80 HG23 THR 10 HG23 THR 10 18.754 29.503 121.689 81 H TRP 11 H TRP 11 14.759 26.785 120.780 82 HA TRP 11 HA TRP 11 16.080 25.183 118.698 83 HB2 TRP 11 HB2 TRP 11 13.115 25.694 118.912 84 HB3 TRP 11 HB3 TRP 11 13.927 24.470 117.952 85 HD1 TRP 11 HD1 TRP 11 11.777 24.552 120.699 86 HE1 TRP 11 HE1 TRP 11 12.144 22.647 122.386 87 HE3 TRP 11 HE3 TRP 11 16.454 23.064 119.251 88 HZ2 TRP 11 HZ2 TRP 11 14.142 20.774 123.020 89 HZ3 TRP 11 HZ3 TRP 11 17.516 21.206 120.454 90 HH2 TRP 11 HH2 TRP 11 16.383 20.087 122.301 91 H ASN 12 H ASN 12 15.432 25.717 116.442 92 HA ASN 12 HA ASN 12 15.194 28.636 116.114 93 HB2 ASN 12 HB2 ASN 12 17.272 27.415 115.220 94 HB3 ASN 12 HB3 ASN 12 16.207 26.699 114.027 95 HD21 ASN 12 HD21 ASN 12 15.397 27.957 112.354 96 HD22 ASN 12 HD22 ASN 12 15.987 29.552 112.021 97 H ASP 13 H ASP 13 13.271 29.299 115.489 98 HA ASP 13 HA ASP 13 11.545 27.481 113.952 99 HB2 ASP 13 HB2 ASP 13 10.888 29.990 115.511 100 HB3 ASP 13 HB3 ASP 13 9.723 29.158 114.492 101 H SER 14 H SER 14 11.275 27.785 111.862 102 HA SER 14 HA SER 14 11.630 30.443 110.705 103 HB2 SER 14 HB2 SER 14 13.071 29.442 108.889 104 HB3 SER 14 HB3 SER 14 13.833 29.507 110.480 105 HG SER 14 HG SER 14 12.550 27.236 109.341 106 H ARG 15 H ARG 15 10.025 30.898 109.384 107 HA ARG 15 HA ARG 15 9.030 28.916 107.517 108 HB2 ARG 15 HB2 ARG 15 6.663 29.336 108.044 109 HB3 ARG 15 HB3 ARG 15 7.510 28.583 109.382 110 HG2 ARG 15 HG2 ARG 15 7.605 30.708 110.555 111 HG3 ARG 15 HG3 ARG 15 6.846 31.518 109.184 112 HD2 ARG 15 HD2 ARG 15 4.883 29.993 109.484 113 HD3 ARG 15 HD3 ARG 15 5.633 29.418 110.973 114 HE ARG 15 HE ARG 15 5.485 31.764 111.777 115 HH11 ARG 15 HH11 ARG 15 3.347 30.684 109.197 116 HH12 ARG 15 HH12 ARG 15 2.125 31.870 109.542 117 HH21 ARG 15 HH21 ARG 15 3.892 33.343 112.213 118 HH22 ARG 15 HH22 ARG 15 2.446 33.390 111.255 119 H GLY 16 H GLY 16 7.784 29.836 105.787 120 HA2 GLY 16 HA2 GLY 16 7.705 32.723 105.519 121 HA3 GLY 16 HA3 GLY 16 8.874 31.922 104.482 122 H ASN 17 H ASN 17 5.619 32.786 104.912 123 HA ASN 17 HA ASN 17 4.802 31.093 102.640 124 HB2 ASN 17 HB2 ASN 17 3.137 32.057 104.978 125 HB3 ASN 17 HB3 ASN 17 2.468 31.277 103.557 126 HD21 ASN 17 HD21 ASN 17 2.958 29.100 103.167 127 HD22 ASN 17 HD22 ASN 17 3.450 28.044 104.453 128 H TYR 18 H TYR 18 3.893 32.038 100.913 129 HA TYR 18 HA TYR 18 3.130 34.856 101.110 130 HB2 TYR 18 HB2 TYR 18 5.095 33.690 99.151 131 HB3 TYR 18 HB3 TYR 18 4.212 35.173 98.799 132 HD1 TYR 18 HD2 TYR 18 4.338 36.989 100.718 133 HD2 TYR 18 HD1 TYR 18 7.163 33.859 100.181 134 HE1 TYR 18 HE2 TYR 18 5.992 38.289 101.986 135 HE2 TYR 18 HE1 TYR 18 8.836 35.148 101.446 136 HH TYR 18 HH TYR 18 8.042 37.849 103.334 137 H TRP 19 H TRP 19 1.595 35.575 99.702 138 HA TRP 19 HA TRP 19 0.103 33.485 98.260 139 HB2 TRP 19 HB2 TRP 19 -0.953 36.160 99.212 140 HB3 TRP 19 HB3 TRP 19 -1.890 34.805 98.595 141 HD1 TRP 19 HD1 TRP 19 -0.386 36.192 101.769 142 HE1 TRP 19 HE1 TRP 19 -1.013 34.683 103.760 143 HE3 TRP 19 HE3 TRP 19 -2.374 32.238 99.195 144 HZ2 TRP 19 HZ2 TRP 19 -2.193 32.157 104.176 145 HZ3 TRP 19 HZ3 TRP 19 -3.231 30.318 100.471 146 HH2 TRP 19 HH2 TRP 19 -3.142 30.280 102.908 147 H SER 20 H SER 20 1.178 33.620 96.300 148 HA SER 20 HA SER 20 0.856 36.157 94.885 149 HB2 SER 20 HB2 SER 20 3.169 35.770 93.868 150 HB3 SER 20 HB3 SER 20 3.123 36.319 95.539 151 HG SER 20 HG SER 20 3.061 33.647 95.516 152 H ASP 21 H ASP 21 -0.668 35.553 93.517 153 HA ASP 21 HA ASP 21 0.123 33.596 91.478 154 HB2 ASP 21 HB2 ASP 21 -2.232 32.958 91.164 155 HB3 ASP 21 HB3 ASP 21 -1.677 32.569 92.785 156 H TYR 22 H TYR 22 -0.313 34.213 89.347 157 HA TYR 22 HA TYR 22 -0.739 37.117 89.175 158 HB2 TYR 22 HB2 TYR 22 1.292 35.459 87.673 159 HB3 TYR 22 HB3 TYR 22 1.001 37.179 87.421 160 HD1 TYR 22 HD1 TYR 22 1.408 38.771 89.362 161 HD2 TYR 22 HD2 TYR 22 2.745 34.727 89.400 162 HE1 TYR 22 HE1 TYR 22 2.977 39.314 91.176 163 HE2 TYR 22 HE2 TYR 22 4.322 35.266 91.210 164 HH TYR 22 HH TYR 22 5.487 37.221 92.141 165 H GLU 23 H GLU 23 -2.919 36.329 88.870 166 HA GLU 23 HA GLU 23 -4.760 36.597 87.630 167 HB2 GLU 23 HB2 GLU 23 -2.854 37.805 85.625 168 HB3 GLU 23 HB3 GLU 23 -4.590 38.049 85.668 169 HG2 GLU 23 HG2 GLU 23 -2.549 39.015 87.662 170 HG3 GLU 23 HG3 GLU 23 -3.550 39.983 86.583 171 H GLY 24 H GLY 24 -4.569 36.663 84.583 172 HA2 GLY 24 HA2 GLY 24 -3.938 34.632 83.115 173 HA3 GLY 24 HA3 GLY 24 -4.954 33.764 84.258 174 H SER 25 H SER 25 -5.069 36.603 82.083 175 HA SER 25 HA SER 25 -7.607 35.599 81.028 176 HB2 SER 25 HB2 SER 25 -7.168 38.453 81.942 177 HB3 SER 25 HB3 SER 25 -8.523 37.936 80.940 178 HG SER 25 HG SER 25 -7.994 36.645 83.392 179 H ASP 26 H ASP 26 -6.700 34.967 79.139 180 HA ASP 26 HA ASP 26 -5.509 37.084 77.461 181 HB2 ASP 26 HB2 ASP 26 -4.978 34.103 77.450 182 HB3 ASP 26 HB3 ASP 26 -4.451 35.177 76.161 183 H GLU 27 H GLU 27 -7.302 37.820 76.410 184 HA GLU 27 HA GLU 27 -8.934 35.812 75.043 185 HB2 GLU 27 HB2 GLU 27 -10.651 37.529 74.752 186 HB3 GLU 27 HB3 GLU 27 -10.229 37.338 76.439 187 HG2 GLU 27 HG2 GLU 27 -9.079 39.541 74.764 188 HG3 GLU 27 HG3 GLU 27 -10.651 39.689 75.545 189 H ASN 28 H ASN 28 -8.620 35.423 73.018 190 HA ASN 28 HA ASN 28 -7.692 37.487 71.170 191 HB2 ASN 28 HB2 ASN 28 -5.675 36.273 72.184 192 HB3 ASN 28 HB3 ASN 28 -6.260 34.825 71.374 193 HD21 ASN 28 HD21 ASN 28 -6.256 38.164 70.165 194 HD22 ASN 28 HD22 ASN 28 -5.219 37.847 68.817 195 H GLY 29 H GLY 29 -9.141 37.377 69.567 196 HA2 GLY 29 HA2 GLY 29 -9.608 35.096 68.018 197 HA3 GLY 29 HA3 GLY 29 -10.906 35.214 69.194 198 H ASP 30 H ASP 30 -12.642 35.937 68.221 199 HA ASP 30 HA ASP 30 -14.144 37.184 67.077 200 HB2 ASP 30 HB2 ASP 30 -12.528 39.055 68.251 201 HB3 ASP 30 HB3 ASP 30 -12.398 39.509 66.558 202 H GLY 31 H GLY 31 -12.329 35.424 65.657 203 HA2 GLY 31 HA2 GLY 31 -11.474 36.746 63.229 204 HA3 GLY 31 HA3 GLY 31 -11.311 35.037 63.608 205 H ILE 32 H ILE 32 -12.494 36.901 61.364 206 HA ILE 32 HA ILE 32 -15.119 35.650 61.081 207 HB ILE 32 HB ILE 32 -15.408 37.120 59.103 208 HG12 ILE 32 HG12 ILE 32 -12.822 38.467 59.902 209 HG13 ILE 32 HG13 ILE 32 -12.894 37.257 58.627 210 HG21 ILE 32 HG21 ILE 32 -15.565 39.237 60.349 211 HG22 ILE 32 HG22 ILE 32 -14.577 38.542 61.635 212 HG23 ILE 32 HG23 ILE 32 -16.169 37.868 61.283 213 HD11 ILE 32 HD11 ILE 32 -14.452 38.663 57.385 214 HD12 ILE 32 HD12 ILE 32 -12.933 39.496 57.710 215 HD13 ILE 32 HD13 ILE 32 -14.369 39.877 58.660 216 H GLY 33 H GLY 33 -15.693 34.314 59.327 217 HA2 GLY 33 HA2 GLY 33 -13.704 33.542 57.385 218 HA3 GLY 33 HA3 GLY 33 -13.980 32.325 58.621 219 H ASP 34 H ASP 34 -14.507 31.203 56.499 220 HA ASP 34 HA ASP 34 -17.169 31.798 55.492 221 HB2 ASP 34 HB2 ASP 34 -16.613 30.005 53.789 222 HB3 ASP 34 HB3 ASP 34 -15.605 31.444 53.748 223 H SER 35 H SER 35 -17.591 31.096 57.915 224 HA SER 35 HA SER 35 -18.035 28.253 58.218 225 HB2 SER 35 HB2 SER 35 -18.882 30.536 60.028 226 HB3 SER 35 HB3 SER 35 -18.865 28.823 60.443 227 HG SER 35 HG SER 35 -16.471 29.148 59.722 228 H ALA 36 H ALA 36 -19.548 27.625 56.730 229 HA ALA 36 HA ALA 36 -22.164 28.955 56.842 230 HB1 ALA 36 HB1 ALA 36 -22.651 27.871 54.719 231 HB2 ALA 36 HB2 ALA 36 -21.085 27.058 54.764 232 HB3 ALA 36 HB3 ALA 36 -21.166 28.815 54.617 233 H TYR 37 H TYR 37 -23.569 28.064 58.127 234 HA TYR 37 HA TYR 37 -23.539 25.136 58.461 235 HB2 TYR 37 HB2 TYR 37 -22.723 26.432 60.467 236 HB3 TYR 37 HB3 TYR 37 -24.326 27.142 60.578 237 HD1 TYR 37 HD1 TYR 37 -22.455 23.965 60.789 238 HD2 TYR 37 HD2 TYR 37 -26.125 25.965 61.603 239 HE1 TYR 37 HE1 TYR 37 -23.188 22.059 62.161 240 HE2 TYR 37 HE2 TYR 37 -26.862 24.064 62.975 241 HH TYR 37 HH TYR 37 -26.354 21.585 63.101 242 H ALA 38 H ALA 38 -25.170 24.357 57.424 243 HA ALA 38 HA ALA 38 -27.226 23.815 56.732 244 HB1 ALA 38 HB1 ALA 38 -28.353 25.767 58.715 245 HB2 ALA 38 HB2 ALA 38 -27.933 24.091 59.073 246 HB3 ALA 38 HB3 ALA 38 -29.209 24.452 57.912 247 H VAL 39 H VAL 39 -27.704 27.238 57.360 248 HA VAL 39 HA VAL 39 -28.979 27.669 54.848 249 HB VAL 39 HB VAL 39 -29.773 28.982 56.667 250 HG11 VAL 39 HG11 VAL 39 -26.989 30.087 57.016 251 HG12 VAL 39 HG12 VAL 39 -27.836 28.997 58.113 252 HG13 VAL 39 HG13 VAL 39 -28.429 30.640 57.875 253 HG21 VAL 39 HG21 VAL 39 -29.844 30.133 54.542 254 HG22 VAL 39 HG22 VAL 39 -28.227 30.783 54.811 255 HG23 VAL 39 HG23 VAL 39 -29.562 31.283 55.849 256 H ASN 40 H ASN 40 -28.060 27.864 52.996 257 HA ASN 40 HA ASN 40 -25.710 29.501 52.599 258 HB2 ASN 40 HB2 ASN 40 -24.788 27.206 53.088 259 HB3 ASN 40 HB3 ASN 40 -25.663 26.603 51.687 260 HD21 ASN 40 HD21 ASN 40 -23.034 28.584 52.792 261 HD22 ASN 40 HD22 ASN 40 -22.221 28.724 51.270 262 HA PRO 41 HA PRO 41 -28.287 29.790 48.875 263 HB2 PRO 41 HB2 PRO 41 -28.579 32.444 48.886 264 HB3 PRO 41 HB3 PRO 41 -29.447 31.428 50.040 265 HG2 PRO 41 HG2 PRO 41 -27.187 33.271 50.495 266 HG3 PRO 41 HG3 PRO 41 -28.385 32.651 51.642 267 HD2 PRO 41 HD2 PRO 41 -25.693 31.685 51.124 268 HD3 PRO 41 HD3 PRO 41 -26.828 31.181 52.394 269 H GLU 42 H GLU 42 -25.306 29.588 48.885 270 HA GLU 42 HA GLU 42 -24.359 31.843 47.335 271 HB2 GLU 42 HB2 GLU 42 -22.991 29.478 48.571 272 HB3 GLU 42 HB3 GLU 42 -22.146 30.566 47.476 273 HG2 GLU 42 HG2 GLU 42 -22.787 32.448 48.998 274 HG3 GLU 42 HG3 GLU 42 -23.402 31.232 50.125 275 H ALA 43 H ALA 43 -22.506 31.026 45.696 276 HA ALA 43 HA ALA 43 -24.111 30.119 43.464 277 HB1 ALA 43 HB1 ALA 43 -22.711 32.114 43.261 278 HB2 ALA 43 HB2 ALA 43 -22.235 30.875 42.098 279 HB3 ALA 43 HB3 ALA 43 -21.272 31.139 43.553 280 H GLY 44 H GLY 44 -23.719 28.346 42.177 281 HA2 GLY 44 HA2 GLY 44 -21.372 26.750 42.321 282 HA3 GLY 44 HA3 GLY 44 -22.680 26.000 43.225 283 H SER 45 H SER 45 -22.627 24.250 41.750 284 HA SER 45 HA SER 45 -23.482 24.784 39.012 285 HB2 SER 45 HB2 SER 45 -22.685 22.219 40.409 286 HB3 SER 45 HB3 SER 45 -23.150 22.329 38.710 287 HG SER 45 HG SER 45 -21.398 23.902 38.512 288 H MET 46 H MET 46 -25.412 24.138 38.153 289 HA MET 46 HA MET 46 -27.561 23.497 39.996 290 HB2 MET 46 HB2 MET 46 -29.067 23.831 38.156 291 HB3 MET 46 HB3 MET 46 -27.874 25.120 38.082 292 HG2 MET 46 HG2 MET 46 -26.699 23.953 36.307 293 HG3 MET 46 HG3 MET 46 -27.843 22.617 36.407 294 HE1 MET 46 HE1 MET 46 -28.841 24.153 32.992 295 HE2 MET 46 HE2 MET 46 -28.495 22.668 33.881 296 HE3 MET 46 HE3 MET 46 -27.234 23.883 33.667 297 H ASP 47 H ASP 47 -29.045 21.659 39.509 298 HA ASP 47 HA ASP 47 -27.521 19.329 38.605 299 HB2 ASP 47 HB2 ASP 47 -28.598 19.191 40.827 300 HB3 ASP 47 HB3 ASP 47 -30.165 19.421 40.070 301 H TYR 48 H TYR 48 -27.706 18.805 36.591 302 HA TYR 48 HA TYR 48 -30.281 19.198 35.214 303 HB2 TYR 48 HB2 TYR 48 -28.510 20.804 34.480 304 HB3 TYR 48 HB3 TYR 48 -27.503 19.442 34.019 305 HD1 TYR 48 HD2 TYR 48 -30.737 21.114 33.268 306 HD2 TYR 48 HD1 TYR 48 -27.681 18.508 31.859 307 HE1 TYR 48 HE2 TYR 48 -31.745 21.149 31.024 308 HE2 TYR 48 HE1 TYR 48 -28.677 18.544 29.611 309 HH TYR 48 HH TYR 48 -30.972 18.945 28.607 310 H MET 49 H MET 49 -31.148 17.246 34.928 311 HA MET 49 HA MET 49 -29.420 15.099 33.962 312 HB2 MET 49 HB2 MET 49 -30.765 13.495 35.427 313 HB3 MET 49 HB3 MET 49 -29.542 14.476 36.209 314 HG2 MET 49 HG2 MET 49 -31.221 15.942 37.111 315 HG3 MET 49 HG3 MET 49 -32.484 15.115 36.200 316 HE1 MET 49 HE1 MET 49 -30.092 13.045 39.575 317 HE2 MET 49 HE2 MET 49 -29.815 14.724 39.104 318 HE3 MET 49 HE3 MET 49 -29.434 13.418 37.980 319 HA PRO 50 HA PRO 50 -33.038 14.614 31.323 320 HB2 PRO 50 HB2 PRO 50 -31.479 14.295 29.032 321 HB3 PRO 50 HB3 PRO 50 -32.247 15.795 29.550 322 HG2 PRO 50 HG2 PRO 50 -29.462 15.215 29.432 323 HG3 PRO 50 HG3 PRO 50 -30.233 16.693 30.024 324 HD2 PRO 50 HD2 PRO 50 -29.137 14.406 31.533 325 HD3 PRO 50 HD3 PRO 50 -29.390 16.086 32.046 326 H LEU 51 H LEU 51 -33.557 12.567 32.120 327 HA LEU 51 HA LEU 51 -31.872 10.311 31.443 328 HB2 LEU 51 HB2 LEU 51 -34.391 10.591 33.044 329 HB3 LEU 51 HB3 LEU 51 -33.901 9.013 32.465 330 HG LEU 51 HG LEU 51 -31.655 9.514 33.655 331 HD11 LEU 51 HD11 LEU 51 -33.437 11.464 35.105 332 HD12 LEU 51 HD12 LEU 51 -32.036 11.879 34.116 333 HD13 LEU 51 HD13 LEU 51 -31.824 10.960 35.606 334 HD21 LEU 51 HD21 LEU 51 -32.530 8.621 35.749 335 HD22 LEU 51 HD22 LEU 51 -33.228 7.802 34.351 336 HD23 LEU 51 HD23 LEU 51 -34.171 9.008 35.228 337 H MET 52 H MET 52 -31.948 10.607 29.224 338 HA MET 52 HA MET 52 -34.007 9.131 27.864 339 HB2 MET 52 HB2 MET 52 -34.943 11.439 27.909 340 HB3 MET 52 HB3 MET 52 -33.487 12.026 27.125 341 HG2 MET 52 HG2 MET 52 -34.000 10.739 25.141 342 HG3 MET 52 HG3 MET 52 -35.427 10.062 25.924 343 HE1 MET 52 HE1 MET 52 -37.001 12.442 23.260 344 HE2 MET 52 HE2 MET 52 -36.947 10.802 23.904 345 HE3 MET 52 HE3 MET 52 -35.539 11.475 23.078 346 H GLU 53 H GLU 53 -32.634 7.731 26.992 347 HA GLU 53 HA GLU 53 -30.282 8.769 25.573 348 HB2 GLU 53 HB2 GLU 53 -29.004 6.799 26.338 349 HB3 GLU 53 HB3 GLU 53 -29.512 7.821 27.674 350 HG2 GLU 53 HG2 GLU 53 -31.253 6.284 28.271 351 HG3 GLU 53 HG3 GLU 53 -30.961 5.320 26.828 352 H TYR 54 H TYR 54 -29.552 7.578 23.811 353 HA TYR 54 HA TYR 54 -31.223 5.314 22.971 354 HB2 TYR 54 HB2 TYR 54 -30.100 7.490 21.186 355 HB3 TYR 54 HB3 TYR 54 -30.763 5.974 20.588 356 HD1 TYR 54 HD1 TYR 54 -33.183 5.503 20.824 357 HD2 TYR 54 HD2 TYR 54 -31.525 9.267 21.907 358 HE1 TYR 54 HE1 TYR 54 -35.433 6.496 20.790 359 HE2 TYR 54 HE2 TYR 54 -33.769 10.271 21.878 360 HH TYR 54 HH TYR 54 -36.611 8.420 21.801 361 H LEU 55 H LEU 55 -30.053 3.541 23.017 362 HA LEU 55 HA LEU 55 -27.177 3.741 22.428 363 HB2 LEU 55 HB2 LEU 55 -27.902 3.290 24.874 364 HB3 LEU 55 HB3 LEU 55 -28.366 1.702 24.303 365 HG LEU 55 HG LEU 55 -25.553 2.673 23.861 366 HD11 LEU 55 HD11 LEU 55 -26.590 1.382 26.381 367 HD12 LEU 55 HD12 LEU 55 -26.052 3.054 26.230 368 HD13 LEU 55 HD13 LEU 55 -24.903 1.737 26.006 369 HD21 LEU 55 HD21 LEU 55 -26.720 -0.070 24.362 370 HD22 LEU 55 HD22 LEU 55 -25.031 0.301 24.015 371 HD23 LEU 55 HD23 LEU 55 -26.265 0.580 22.786 372 H HIS 56 H HIS 56 -26.771 2.808 20.574 373 HA HIS 56 HA HIS 56 -27.854 0.139 20.070 374 HB2 HIS 56 HB2 HIS 56 -29.100 1.995 18.752 375 HB3 HIS 56 HB3 HIS 56 -27.608 2.150 17.830 376 HD1 HIS 56 HD1 HIS 56 -27.516 0.753 15.799 377 HD2 HIS 56 HD2 HIS 56 -30.100 -0.834 18.651 378 HE1 HIS 56 HE1 HIS 56 -28.570 -1.263 14.714 379 HE2 HIS 56 HE2 HIS 56 -30.011 -2.297 16.503 380 H SER 57 H SER 57 -26.373 -1.231 19.226 381 HA SER 57 HA SER 57 -23.638 -0.444 19.432 382 HB2 SER 57 HB2 SER 57 -23.301 -2.924 18.763 383 HB3 SER 57 HB3 SER 57 -24.083 -2.567 20.303 384 HG SER 57 HG SER 57 -25.316 -4.107 19.284 385 H SER 58 H SER 58 -23.105 0.935 17.824 386 HA SER 58 HA SER 58 -23.535 0.321 15.050 387 HB2 SER 58 HB2 SER 58 -22.088 2.359 14.696 388 HB3 SER 58 HB3 SER 58 -23.523 2.646 15.680 389 HG SER 58 HG SER 58 -22.130 3.467 17.026 390 HA PRO 59 HA PRO 59 -19.949 -2.220 14.639 391 HB2 PRO 59 HB2 PRO 59 -19.743 -2.279 11.934 392 HB3 PRO 59 HB3 PRO 59 -20.960 -3.184 12.838 393 HG2 PRO 59 HG2 PRO 59 -21.227 -0.643 11.312 394 HG3 PRO 59 HG3 PRO 59 -22.384 -1.971 11.497 395 HD2 PRO 59 HD2 PRO 59 -22.502 0.416 12.862 396 HD3 PRO 59 HD3 PRO 59 -23.251 -1.095 13.405 397 H VAL 60 H VAL 60 -17.788 -2.254 13.848 398 HA VAL 60 HA VAL 60 -16.623 0.415 13.748 399 HB VAL 60 HB VAL 60 -15.762 -1.204 15.405 400 HG11 VAL 60 HG11 VAL 60 -16.077 -3.272 14.233 401 HG12 VAL 60 HG12 VAL 60 -14.383 -3.110 14.703 402 HG13 VAL 60 HG13 VAL 60 -14.873 -2.814 13.031 403 HG21 VAL 60 HG21 VAL 60 -13.726 -0.455 13.313 404 HG22 VAL 60 HG22 VAL 60 -13.362 -0.954 14.965 405 HG23 VAL 60 HG23 VAL 60 -14.257 0.537 14.674 406 H LEU 61 H LEU 61 -15.511 1.200 12.013 407 HA LEU 61 HA LEU 61 -15.621 -0.367 9.566 408 HB2 LEU 61 HB2 LEU 61 -14.831 1.758 8.432 409 HB3 LEU 61 HB3 LEU 61 -16.432 1.769 9.106 410 HG LEU 61 HG LEU 61 -15.226 3.924 9.264 411 HD11 LEU 61 HD11 LEU 61 -17.041 3.544 10.778 412 HD12 LEU 61 HD12 LEU 61 -15.763 4.460 11.579 413 HD13 LEU 61 HD13 LEU 61 -15.966 2.739 11.920 414 HD21 LEU 61 HD21 LEU 61 -12.985 3.167 9.645 415 HD22 LEU 61 HD22 LEU 61 -13.446 2.509 11.214 416 HD23 LEU 61 HD23 LEU 61 -13.494 4.254 10.939 417 HA PRO 62 HA PRO 62 -11.468 -1.590 9.747 418 HB2 PRO 62 HB2 PRO 62 -10.464 -1.436 7.241 419 HB3 PRO 62 HB3 PRO 62 -11.630 -2.673 7.757 420 HG2 PRO 62 HG2 PRO 62 -12.035 -0.282 6.071 421 HG3 PRO 62 HG3 PRO 62 -12.941 -1.803 6.110 422 HD2 PRO 62 HD2 PRO 62 -13.729 0.637 7.248 423 HD3 PRO 62 HD3 PRO 62 -14.466 -0.947 7.534 424 H THR 63 H THR 63 -9.208 -1.251 9.016 425 HA THR 63 HA THR 63 -8.462 1.524 8.524 426 HB THR 63 HB THR 63 -7.244 -0.225 10.681 427 HG1 THR 63 HG1 THR 63 -9.266 1.550 10.710 428 HG21 THR 63 HG21 THR 63 -5.586 1.122 9.500 429 HG22 THR 63 HG22 THR 63 -5.812 1.688 11.159 430 HG23 THR 63 HG23 THR 63 -6.539 2.570 9.813 431 H ALA 64 H ALA 64 -7.462 1.370 6.614 432 HA ALA 64 HA ALA 64 -5.861 -0.950 5.956 433 HB1 ALA 64 HB1 ALA 64 -7.164 0.195 4.217 434 HB2 ALA 64 HB2 ALA 64 -5.436 0.178 3.848 435 HB3 ALA 64 HB3 ALA 64 -6.194 1.648 4.464 436 H ARG 65 H ARG 65 -3.835 -1.168 6.508 437 HA ARG 65 HA ARG 65 -2.135 1.176 6.761 438 HB2 ARG 65 HB2 ARG 65 -3.014 0.688 9.054 439 HB3 ARG 65 HB3 ARG 65 -2.328 -0.928 8.941 440 HG2 ARG 65 HG2 ARG 65 -0.084 0.154 8.627 441 HG3 ARG 65 HG3 ARG 65 -0.849 1.694 9.007 442 HD2 ARG 65 HD2 ARG 65 -1.348 1.012 11.214 443 HD3 ARG 65 HD3 ARG 65 -0.984 -0.676 10.852 444 HE ARG 65 HE ARG 65 1.225 1.164 10.509 445 HH11 ARG 65 HH11 ARG 65 -0.401 -1.038 12.729 446 HH12 ARG 65 HH12 ARG 65 1.014 -1.290 13.700 447 HH21 ARG 65 HH21 ARG 65 3.080 0.791 11.750 448 HH22 ARG 65 HH22 ARG 65 3.005 -0.257 13.135 449 H PHE 66 H PHE 66 -0.075 0.769 6.126 450 HA PHE 66 HA PHE 66 1.019 -1.866 6.082 451 HB2 PHE 66 HB2 PHE 66 1.500 -1.992 3.684 452 HB3 PHE 66 HB3 PHE 66 -0.231 -1.957 3.948 453 HD1 PHE 66 HD2 PHE 66 -1.294 0.490 3.783 454 HD2 PHE 66 HD1 PHE 66 2.373 -0.735 2.012 455 HE1 PHE 66 HE2 PHE 66 -1.496 2.290 2.132 456 HE2 PHE 66 HE1 PHE 66 2.167 1.066 0.353 457 HZ PHE 66 HZ PHE 66 0.231 2.574 0.412 458 H THR 67 H THR 67 3.307 -1.796 5.283 459 HA THR 67 HA THR 67 4.382 0.914 5.156 460 HB THR 67 HB THR 67 4.680 -0.002 7.501 461 HG1 THR 67 HG1 THR 67 7.095 0.525 6.073 462 HG21 THR 67 HG21 THR 67 6.517 -1.595 7.884 463 HG22 THR 67 HG22 THR 67 6.653 -1.853 6.145 464 HG23 THR 67 HG23 THR 67 5.187 -2.341 6.997 465 H SER 68 H SER 68 6.161 1.158 3.895 466 HA SER 68 HA SER 68 7.089 -1.160 2.360 467 HB2 SER 68 HB2 SER 68 8.238 0.578 0.965 468 HB3 SER 68 HB3 SER 68 6.485 0.782 1.017 469 HG SER 68 HG SER 68 8.279 2.584 1.595 470 H ASP 69 H ASP 69 9.557 -1.173 2.048 471 HA ASP 69 HA ASP 69 10.923 -1.089 4.521 472 HB2 ASP 69 HB2 ASP 69 11.600 -2.484 2.524 473 HB3 ASP 69 HB3 ASP 69 12.209 -1.006 1.778 474 H ILE 70 H ILE 70 11.384 0.989 1.649 475 HA ILE 70 HA ILE 70 11.990 3.194 3.487 476 HB ILE 70 HB ILE 70 13.280 4.229 1.541 477 HG12 ILE 70 HG12 ILE 70 14.376 2.053 0.282 478 HG13 ILE 70 HG13 ILE 70 12.685 1.583 0.381 479 HG21 ILE 70 HG21 ILE 70 14.367 1.780 2.907 480 HG22 ILE 70 HG22 ILE 70 14.372 3.431 3.529 481 HG23 ILE 70 HG23 ILE 70 15.336 3.019 2.111 482 HD11 ILE 70 HD11 ILE 70 13.721 4.129 -0.853 483 HD12 ILE 70 HD12 ILE 70 12.037 3.610 -0.796 484 HD13 ILE 70 HD13 ILE 70 13.213 2.686 -1.732 485 H THR 71 H THR 71 10.854 5.028 3.305 486 HA THR 71 HA THR 71 8.871 5.276 1.196 487 HB THR 71 HB THR 71 8.563 7.555 2.563 488 HG1 THR 71 HG1 THR 71 8.959 6.239 4.855 489 HG21 THR 71 HG21 THR 71 6.847 5.861 2.228 490 HG22 THR 71 HG22 THR 71 6.864 6.409 3.904 491 HG23 THR 71 HG23 THR 71 7.579 4.853 3.479 492 H GLU 72 H GLU 72 12.041 6.245 1.831 493 HA GLU 72 HA GLU 72 12.138 7.776 -0.600 494 HB2 GLU 72 HB2 GLU 72 11.630 9.467 1.222 495 HB3 GLU 72 HB3 GLU 72 13.177 9.040 1.946 496 HG2 GLU 72 HG2 GLU 72 14.305 9.716 -0.147 497 HG3 GLU 72 HG3 GLU 72 12.748 10.230 -0.791 498 H GLY 73 H GLY 73 14.148 7.637 -1.526 499 HA2 GLY 73 HA2 GLY 73 16.625 7.394 -0.522 500 HA3 GLY 73 HA3 GLY 73 16.010 5.755 -0.341 501 H PHE 74 H PHE 74 17.975 5.513 -1.822 502 HA PHE 74 HA PHE 74 17.542 6.133 -4.593 503 HB2 PHE 74 HB2 PHE 74 19.568 4.686 -4.958 504 HB3 PHE 74 HB3 PHE 74 19.839 6.013 -3.841 505 HD1 PHE 74 HD1 PHE 74 20.209 5.579 -1.464 506 HD2 PHE 74 HD2 PHE 74 19.657 2.382 -4.222 507 HE1 PHE 74 HE1 PHE 74 21.096 3.996 0.193 508 HE2 PHE 74 HE2 PHE 74 20.536 0.798 -2.564 509 HZ PHE 74 HZ PHE 74 21.256 1.603 -0.355 510 H ALA 75 H ALA 75 16.698 4.875 -6.117 511 HA ALA 75 HA ALA 75 14.731 3.069 -5.741 512 HB1 ALA 75 HB1 ALA 75 15.210 4.245 -7.832 513 HB2 ALA 75 HB2 ALA 75 14.906 2.528 -8.092 514 HB3 ALA 75 HB3 ALA 75 16.557 3.147 -8.131 515 HA PRO 76 HA PRO 76 16.935 -0.801 -4.901 516 HB2 PRO 76 HB2 PRO 76 14.935 -1.751 -3.237 517 HB3 PRO 76 HB3 PRO 76 16.338 -0.820 -2.710 518 HG2 PRO 76 HG2 PRO 76 13.593 -0.029 -2.678 519 HG3 PRO 76 HG3 PRO 76 15.004 0.925 -2.196 520 HD2 PRO 76 HD2 PRO 76 13.469 0.970 -4.729 521 HD3 PRO 76 HD3 PRO 76 14.463 2.241 -3.985 522 H LEU 77 H LEU 77 16.448 -3.041 -5.385 523 HA LEU 77 HA LEU 77 14.825 -3.183 -7.776 524 HB2 LEU 77 HB2 LEU 77 17.166 -4.181 -7.396 525 HB3 LEU 77 HB3 LEU 77 16.366 -5.435 -6.484 526 HG LEU 77 HG LEU 77 17.016 -5.943 -8.891 527 HD11 LEU 77 HD11 LEU 77 15.042 -7.283 -9.339 528 HD12 LEU 77 HD12 LEU 77 14.153 -6.405 -8.094 529 HD13 LEU 77 HD13 LEU 77 15.540 -7.402 -7.652 530 HD21 LEU 77 HD21 LEU 77 15.416 -5.275 -10.623 531 HD22 LEU 77 HD22 LEU 77 16.276 -3.898 -9.934 532 HD23 LEU 77 HD23 LEU 77 14.610 -4.224 -9.457 533 H SER 78 H SER 78 14.923 -4.813 -4.629 534 HA SER 78 HA SER 78 12.092 -5.524 -5.023 535 HB2 SER 78 HB2 SER 78 13.578 -7.495 -4.800 536 HB3 SER 78 HB3 SER 78 14.108 -6.903 -3.229 537 HG SER 78 HG SER 78 12.372 -8.523 -3.237 538 H VAL 79 H VAL 79 10.934 -3.988 -4.092 539 HA VAL 79 HA VAL 79 11.789 -2.786 -1.572 540 HB VAL 79 HB VAL 79 9.354 -2.093 -3.234 541 HG11 VAL 79 HG11 VAL 79 9.163 -1.378 -0.910 542 HG12 VAL 79 HG12 VAL 79 9.379 0.012 -1.974 543 HG13 VAL 79 HG13 VAL 79 10.734 -0.581 -1.014 544 HG21 VAL 79 HG21 VAL 79 12.074 -0.794 -3.185 545 HG22 VAL 79 HG22 VAL 79 10.660 -0.192 -4.052 546 HG23 VAL 79 HG23 VAL 79 11.390 -1.729 -4.514 547 H ARG 80 H ARG 80 11.110 -3.508 0.293 548 HA ARG 80 HA ARG 80 9.453 -5.798 0.496 549 HB2 ARG 80 HB2 ARG 80 10.603 -3.970 2.598 550 HB3 ARG 80 HB3 ARG 80 9.741 -5.459 2.963 551 HG2 ARG 80 HG2 ARG 80 11.420 -6.760 1.814 552 HG3 ARG 80 HG3 ARG 80 12.252 -5.289 1.304 553 HD2 ARG 80 HD2 ARG 80 13.370 -6.306 3.218 554 HD3 ARG 80 HD3 ARG 80 12.705 -4.731 3.634 555 HE ARG 80 HE ARG 80 11.268 -7.210 4.324 556 HH11 ARG 80 HH11 ARG 80 12.699 -4.128 5.287 557 HH12 ARG 80 HH12 ARG 80 12.153 -4.257 6.936 558 HH21 ARG 80 HH21 ARG 80 10.566 -7.367 6.491 559 HH22 ARG 80 HH22 ARG 80 10.944 -6.100 7.619 560 H PHE 81 H PHE 81 7.461 -6.099 1.247 561 HA PHE 81 HA PHE 81 5.849 -3.746 1.909 562 HB2 PHE 81 HB2 PHE 81 3.922 -4.768 0.688 563 HB3 PHE 81 HB3 PHE 81 5.235 -4.260 -0.359 564 HD1 PHE 81 HD2 PHE 81 6.748 -6.016 -1.354 565 HD2 PHE 81 HD1 PHE 81 3.161 -7.000 0.719 566 HE1 PHE 81 HE2 PHE 81 6.753 -8.238 -2.405 567 HE2 PHE 81 HE1 PHE 81 3.165 -9.221 -0.332 568 HZ PHE 81 HZ PHE 81 4.960 -9.842 -1.895 569 H LYS 82 H LYS 82 4.650 -3.917 3.656 570 HA LYS 82 HA LYS 82 4.076 -6.564 4.782 571 HB2 LYS 82 HB2 LYS 82 6.069 -5.803 5.932 572 HB3 LYS 82 HB3 LYS 82 5.339 -4.239 6.247 573 HG2 LYS 82 HG2 LYS 82 5.313 -5.486 8.265 574 HG3 LYS 82 HG3 LYS 82 3.658 -5.384 7.676 575 HD2 LYS 82 HD2 LYS 82 3.831 -7.666 6.786 576 HD3 LYS 82 HD3 LYS 82 5.495 -7.765 7.373 577 HE2 LYS 82 HE2 LYS 82 4.670 -7.384 9.668 578 HE3 LYS 82 HE3 LYS 82 3.020 -7.390 9.053 579 HZ1 LYS 82 HZ1 LYS 82 4.910 -9.671 8.832 580 HZ2 LYS 82 HZ2 LYS 82 3.273 -9.665 8.386 581 HZ3 LYS 82 HZ3 LYS 82 3.706 -9.526 10.013 582 H ASP 83 H ASP 83 1.989 -6.732 5.123 583 HA ASP 83 HA ASP 83 0.278 -4.402 5.129 584 HB2 ASP 83 HB2 ASP 83 -0.451 -6.252 3.782 585 HB3 ASP 83 HB3 ASP 83 -0.256 -7.379 5.113 586 H PHE 84 H PHE 84 -0.951 -3.685 6.803 587 HA PHE 84 HA PHE 84 -0.598 -4.965 9.444 588 HB2 PHE 84 HB2 PHE 84 0.039 -2.122 8.697 589 HB3 PHE 84 HB3 PHE 84 -0.456 -2.527 10.329 590 HD1 PHE 84 HD2 PHE 84 0.925 -4.653 11.281 591 HD2 PHE 84 HD1 PHE 84 2.256 -1.865 8.360 592 HE1 PHE 84 HE2 PHE 84 3.255 -5.147 11.878 593 HE2 PHE 84 HE1 PHE 84 4.590 -2.349 8.959 594 HZ PHE 84 HZ PHE 84 5.089 -3.992 10.720 595 H SER 85 H SER 85 -2.766 -4.251 7.265 596 HA SER 85 HA SER 85 -4.640 -2.538 8.351 597 HB2 SER 85 HB2 SER 85 -5.086 -4.979 6.635 598 HB3 SER 85 HB3 SER 85 -6.267 -3.694 6.896 599 HG SER 85 HG SER 85 -3.924 -3.693 5.379 600 H GLU 86 H GLU 86 -6.319 -2.640 9.708 601 HA GLU 86 HA GLU 86 -6.719 -5.117 11.247 602 HB2 GLU 86 HB2 GLU 86 -5.368 -3.398 12.496 603 HB3 GLU 86 HB3 GLU 86 -6.719 -2.297 12.348 604 HG2 GLU 86 HG2 GLU 86 -6.580 -3.336 14.565 605 HG3 GLU 86 HG3 GLU 86 -8.090 -3.705 13.741 606 H ASN 87 H ASN 87 -8.841 -5.480 11.936 607 HA ASN 87 HA ASN 87 -11.108 -5.420 12.015 608 HB2 ASN 87 HB2 ASN 87 -10.659 -2.469 11.548 609 HB3 ASN 87 HB3 ASN 87 -12.247 -3.168 11.850 610 HD21 ASN 87 HD21 ASN 87 -10.182 -1.376 13.314 611 HD22 ASN 87 HD22 ASN 87 -10.237 -1.984 14.929 612 H ALA 88 H ALA 88 -9.864 -6.190 9.649 613 HA ALA 88 HA ALA 88 -11.730 -5.203 7.595 614 HB1 ALA 88 HB1 ALA 88 -9.415 -4.543 7.159 615 HB2 ALA 88 HB2 ALA 88 -10.003 -5.680 5.944 616 HB3 ALA 88 HB3 ALA 88 -8.926 -6.237 7.223 617 H THR 89 H THR 89 -12.802 -6.636 6.383 618 HA THR 89 HA THR 89 -12.746 -9.444 7.091 619 HB THR 89 HB THR 89 -14.344 -8.156 4.866 620 HG1 THR 89 HG1 THR 89 -16.001 -7.857 6.427 621 HG21 THR 89 HG21 THR 89 -14.308 -10.614 4.906 622 HG22 THR 89 HG22 THR 89 -15.912 -9.983 5.285 623 HG23 THR 89 HG23 THR 89 -14.877 -10.590 6.578 624 H SER 90 H SER 90 -12.211 -7.420 4.206 625 HA SER 90 HA SER 90 -10.418 -9.489 3.140 626 HB2 SER 90 HB2 SER 90 -12.402 -7.808 1.583 627 HB3 SER 90 HB3 SER 90 -11.224 -8.912 0.866 628 HG SER 90 HG SER 90 -12.561 -10.261 2.711 629 H ARG 91 H ARG 91 -8.625 -8.725 1.981 630 HA ARG 91 HA ARG 91 -8.179 -5.819 2.095 631 HB2 ARG 91 HB2 ARG 91 -5.754 -6.285 2.099 632 HB3 ARG 91 HB3 ARG 91 -6.564 -6.974 3.499 633 HG2 ARG 91 HG2 ARG 91 -6.522 -9.174 2.435 634 HG3 ARG 91 HG3 ARG 91 -5.699 -8.477 1.038 635 HD2 ARG 91 HD2 ARG 91 -3.804 -7.879 2.400 636 HD3 ARG 91 HD3 ARG 91 -4.642 -8.418 3.856 637 HE ARG 91 HE ARG 91 -4.340 -10.452 1.833 638 HH11 ARG 91 HH11 ARG 91 -2.905 -8.980 4.694 639 HH12 ARG 91 HH12 ARG 91 -1.910 -10.367 5.042 640 HH21 ARG 91 HH21 ARG 91 -3.015 -12.250 2.311 641 HH22 ARG 91 HH22 ARG 91 -1.966 -12.196 3.694 642 H LEU 92 H LEU 92 -7.021 -4.866 0.339 643 HA LEU 92 HA LEU 92 -7.110 -6.292 -2.208 644 HB2 LEU 92 HB2 LEU 92 -9.311 -4.928 -1.398 645 HB3 LEU 92 HB3 LEU 92 -8.418 -3.628 -2.151 646 HG LEU 92 HG LEU 92 -10.101 -4.671 -3.630 647 HD11 LEU 92 HD11 LEU 92 -7.252 -5.006 -4.553 648 HD12 LEU 92 HD12 LEU 92 -8.224 -3.536 -4.651 649 HD13 LEU 92 HD13 LEU 92 -8.674 -4.956 -5.597 650 HD21 LEU 92 HD21 LEU 92 -9.680 -6.899 -4.540 651 HD22 LEU 92 HD22 LEU 92 -9.976 -6.933 -2.801 652 HD23 LEU 92 HD23 LEU 92 -8.331 -7.093 -3.418 653 H TRP 93 H TRP 93 -5.198 -5.850 -3.109 654 HA TRP 93 HA TRP 93 -3.828 -3.370 -2.459 655 HB2 TRP 93 HB2 TRP 93 -3.018 -5.907 -3.848 656 HB3 TRP 93 HB3 TRP 93 -2.016 -4.463 -3.943 657 HD1 TRP 93 HD1 TRP 93 -2.875 -7.334 -1.650 658 HE1 TRP 93 HE1 TRP 93 -1.399 -7.204 0.464 659 HE3 TRP 93 HE3 TRP 93 -0.937 -2.638 -2.293 660 HZ2 TRP 93 HZ2 TRP 93 0.317 -5.345 1.704 661 HZ3 TRP 93 HZ3 TRP 93 0.613 -1.764 -0.594 662 HH2 TRP 93 HH2 TRP 93 1.224 -3.089 1.361 663 H MET 94 H MET 94 -4.151 -1.635 -3.635 664 HA MET 94 HA MET 94 -4.762 -1.942 -6.497 665 HB2 MET 94 HB2 MET 94 -5.477 0.267 -4.577 666 HB3 MET 94 HB3 MET 94 -5.611 0.447 -6.316 667 HG2 MET 94 HG2 MET 94 -7.183 -1.450 -6.359 668 HG3 MET 94 HG3 MET 94 -7.089 -1.537 -4.601 669 HE1 MET 94 HE1 MET 94 -9.770 -1.371 -4.565 670 HE2 MET 94 HE2 MET 94 -9.802 -1.219 -6.322 671 HE3 MET 94 HE3 MET 94 -10.673 -0.058 -5.320 672 H PHE 95 H PHE 95 -2.573 -2.172 -7.035 673 HA PHE 95 HA PHE 95 -0.882 0.158 -6.590 674 HB2 PHE 95 HB2 PHE 95 0.838 -1.389 -7.836 675 HB3 PHE 95 HB3 PHE 95 0.458 -1.647 -6.142 676 HD1 PHE 95 HD2 PHE 95 -0.884 -3.569 -5.451 677 HD2 PHE 95 HD1 PHE 95 0.212 -2.995 -9.525 678 HE1 PHE 95 HE2 PHE 95 -1.444 -5.912 -5.928 679 HE2 PHE 95 HE1 PHE 95 -0.346 -5.341 -10.000 680 HZ PHE 95 HZ PHE 95 -1.174 -6.800 -8.201 681 H GLY 96 H GLY 96 -2.862 -1.184 -9.010 682 HA2 GLY 96 HA2 GLY 96 -3.645 -0.095 -10.891 683 HA3 GLY 96 HA3 GLY 96 -2.468 1.172 -10.607 684 H ASP 97 H ASP 97 -1.147 -1.995 -10.800 685 HA ASP 97 HA ASP 97 -0.436 -1.530 -13.614 686 HB2 ASP 97 HB2 ASP 97 1.470 -0.916 -12.105 687 HB3 ASP 97 HB3 ASP 97 1.475 -2.572 -11.501 688 H GLY 98 H GLY 98 -1.597 -3.032 -14.611 689 HA2 GLY 98 HA2 GLY 98 -1.952 -5.178 -15.429 690 HA3 GLY 98 HA3 GLY 98 -0.992 -5.813 -14.102 691 H ASN 99 H ASN 99 -2.125 -7.155 -13.006 692 HA ASN 99 HA ASN 99 -5.005 -7.003 -12.857 693 HB2 ASN 99 HB2 ASN 99 -3.023 -9.023 -11.783 694 HB3 ASN 99 HB3 ASN 99 -4.766 -9.163 -11.583 695 HD21 ASN 99 HD21 ASN 99 -2.839 -10.875 -12.984 696 HD22 ASN 99 HD22 ASN 99 -3.428 -11.012 -14.610 697 H THR 100 H THR 100 -6.162 -6.202 -11.251 698 HA THR 100 HA THR 100 -5.000 -6.143 -8.539 699 HB THR 100 HB THR 100 -6.729 -4.314 -8.077 700 HG1 THR 100 HG1 THR 100 -7.815 -3.472 -9.690 701 HG21 THR 100 HG21 THR 100 -4.458 -3.685 -9.973 702 HG22 THR 100 HG22 THR 100 -4.355 -3.800 -8.216 703 HG23 THR 100 HG23 THR 100 -5.298 -2.511 -8.964 704 H SER 101 H SER 101 -6.671 -6.418 -6.811 705 HA SER 101 HA SER 101 -8.297 -7.592 -5.755 706 HB2 SER 101 HB2 SER 101 -9.699 -7.648 -8.440 707 HB3 SER 101 HB3 SER 101 -10.408 -8.207 -6.926 708 HG SER 101 HG SER 101 -9.369 -5.600 -7.115 709 H ASP 102 H ASP 102 -6.035 -8.825 -7.176 710 HA ASP 102 HA ASP 102 -6.999 -11.590 -7.411 711 HB2 ASP 102 HB2 ASP 102 -4.987 -12.060 -8.678 712 HB3 ASP 102 HB3 ASP 102 -5.781 -10.657 -9.379 713 H SER 103 H SER 103 -4.795 -13.025 -6.851 714 HA SER 103 HA SER 103 -4.444 -13.248 -4.143 715 HB2 SER 103 HB2 SER 103 -2.242 -14.368 -4.795 716 HB3 SER 103 HB3 SER 103 -3.700 -15.003 -5.554 717 HG SER 103 HG SER 103 -2.332 -12.936 -6.861 718 HA PRO 104 HA PRO 104 -2.228 -9.505 -3.234 719 HB2 PRO 104 HB2 PRO 104 -1.962 -10.390 -0.486 720 HB3 PRO 104 HB3 PRO 104 -3.002 -9.129 -1.153 721 HG2 PRO 104 HG2 PRO 104 -3.964 -11.467 -0.154 722 HG3 PRO 104 HG3 PRO 104 -4.771 -10.566 -1.451 723 HD2 PRO 104 HD2 PRO 104 -2.973 -12.961 -1.639 724 HD3 PRO 104 HD3 PRO 104 -4.501 -12.634 -2.490 725 H SER 105 H SER 105 -0.387 -10.311 -4.490 726 HA SER 105 HA SER 105 1.943 -10.331 -2.723 727 HB2 SER 105 HB2 SER 105 1.605 -12.153 -5.125 728 HB3 SER 105 HB3 SER 105 3.116 -11.921 -4.246 729 HG SER 105 HG SER 105 1.051 -12.537 -2.584 730 HA PRO 106 HA PRO 106 2.366 -7.228 -6.135 731 HB2 PRO 106 HB2 PRO 106 2.523 -5.045 -4.351 732 HB3 PRO 106 HB3 PRO 106 1.149 -5.494 -5.359 733 HG2 PRO 106 HG2 PRO 106 1.251 -5.573 -2.568 734 HG3 PRO 106 HG3 PRO 106 0.018 -6.318 -3.595 735 HD2 PRO 106 HD2 PRO 106 2.373 -7.546 -2.258 736 HD3 PRO 106 HD3 PRO 106 0.778 -8.246 -2.613 737 H LEU 107 H LEU 107 4.444 -8.046 -6.490 738 HA LEU 107 HA LEU 107 6.650 -7.402 -4.782 739 HB2 LEU 107 HB2 LEU 107 6.685 -9.405 -6.153 740 HB3 LEU 107 HB3 LEU 107 6.517 -8.452 -7.612 741 HG LEU 107 HG LEU 107 8.768 -7.443 -7.107 742 HD11 LEU 107 HD11 LEU 107 8.853 -7.928 -4.715 743 HD12 LEU 107 HD12 LEU 107 10.233 -8.629 -5.562 744 HD13 LEU 107 HD13 LEU 107 8.890 -9.658 -5.063 745 HD21 LEU 107 HD21 LEU 107 8.464 -9.202 -8.752 746 HD22 LEU 107 HD22 LEU 107 8.618 -10.426 -7.492 747 HD23 LEU 107 HD23 LEU 107 9.996 -9.402 -7.901 748 H HIS 108 H HIS 108 7.460 -5.447 -4.593 749 HA HIS 108 HA HIS 108 6.872 -3.444 -6.623 750 HB2 HIS 108 HB2 HIS 108 8.242 -3.073 -3.946 751 HB3 HIS 108 HB3 HIS 108 7.661 -1.797 -5.003 752 HD1 HIS 108 HD1 HIS 108 4.899 -2.013 -5.451 753 HD2 HIS 108 HD2 HIS 108 6.513 -3.664 -1.985 754 HE1 HIS 108 HE1 HIS 108 2.953 -2.348 -3.881 755 HE2 HIS 108 HE2 HIS 108 3.932 -3.493 -1.869 756 H THR 109 H THR 109 8.249 -3.044 -8.184 757 HA THR 109 HA THR 109 11.096 -3.576 -7.691 758 HB THR 109 HB THR 109 9.658 -3.932 -10.330 759 HG1 THR 109 HG1 THR 109 10.059 -5.624 -8.169 760 HG21 THR 109 HG21 THR 109 12.448 -4.647 -9.429 761 HG22 THR 109 HG22 THR 109 12.008 -3.414 -10.613 762 HG23 THR 109 HG23 THR 109 11.729 -5.120 -10.967 763 H PHE 110 H PHE 110 11.831 -1.593 -7.312 764 HA PHE 110 HA PHE 110 11.173 0.556 -9.191 765 HB2 PHE 110 HB2 PHE 110 12.553 0.634 -6.495 766 HB3 PHE 110 HB3 PHE 110 12.417 2.023 -7.552 767 HD1 PHE 110 HD1 PHE 110 9.718 -0.470 -6.803 768 HD2 PHE 110 HD2 PHE 110 11.201 3.479 -6.235 769 HE1 PHE 110 HE1 PHE 110 7.630 0.146 -5.667 770 HE2 PHE 110 HE2 PHE 110 9.109 4.098 -5.108 771 HZ PHE 110 HZ PHE 110 7.323 2.432 -4.819 772 H PHE 111 H PHE 111 12.400 -0.540 -10.838 773 HA PHE 111 HA PHE 111 15.250 -0.812 -10.500 774 HB2 PHE 111 HB2 PHE 111 15.235 -1.536 -12.890 775 HB3 PHE 111 HB3 PHE 111 14.181 -2.479 -11.851 776 HD1 PHE 111 HD1 PHE 111 11.761 -2.373 -12.107 777 HD2 PHE 111 HD2 PHE 111 14.338 -0.125 -14.644 778 HE1 PHE 111 HE1 PHE 111 9.901 -2.014 -13.672 779 HE2 PHE 111 HE2 PHE 111 12.478 0.243 -16.208 780 HZ PHE 111 HZ PHE 111 10.258 -0.700 -15.723 781 H ASN 112 H ASN 112 13.183 1.679 -11.284 782 HA ASN 112 HA ASN 112 15.397 3.304 -12.284 783 HB2 ASN 112 HB2 ASN 112 13.936 4.385 -13.909 784 HB3 ASN 112 HB3 ASN 112 13.969 2.655 -14.205 785 HD21 ASN 112 HD21 ASN 112 12.039 5.375 -13.459 786 HD22 ASN 112 HD22 ASN 112 10.514 4.559 -13.384 787 H GLU 113 H GLU 113 14.942 5.655 -12.041 788 HA GLU 113 HA GLU 113 13.889 6.179 -9.416 789 HB2 GLU 113 HB2 GLU 113 14.808 8.236 -11.418 790 HB3 GLU 113 HB3 GLU 113 14.677 8.421 -9.676 791 HG2 GLU 113 HG2 GLU 113 16.864 8.019 -9.659 792 HG3 GLU 113 HG3 GLU 113 16.400 6.330 -9.895 793 H GLY 114 H GLY 114 12.303 7.649 -8.899 794 HA2 GLY 114 HA2 GLY 114 10.529 9.056 -10.355 795 HA3 GLY 114 HA3 GLY 114 9.970 7.403 -10.592 796 H GLU 115 H GLU 115 8.120 8.722 -9.463 797 HA GLU 115 HA GLU 115 8.394 8.128 -6.597 798 HB2 GLU 115 HB2 GLU 115 8.436 10.597 -7.237 799 HB3 GLU 115 HB3 GLU 115 6.750 10.407 -7.692 800 HG2 GLU 115 HG2 GLU 115 6.178 9.791 -5.424 801 HG3 GLU 115 HG3 GLU 115 7.871 9.869 -4.952 802 H TYR 116 H TYR 116 7.284 6.332 -6.362 803 HA TYR 116 HA TYR 116 4.903 5.859 -8.015 804 HB2 TYR 116 HB2 TYR 116 6.750 3.964 -6.555 805 HB3 TYR 116 HB3 TYR 116 5.270 3.455 -7.352 806 HD1 TYR 116 HD2 TYR 116 8.675 4.799 -7.913 807 HD2 TYR 116 HD1 TYR 116 5.185 3.146 -9.699 808 HE1 TYR 116 HE2 TYR 116 9.911 4.478 -10.015 809 HE2 TYR 116 HE1 TYR 116 6.410 2.815 -11.800 810 HH TYR 116 HH TYR 116 9.763 3.016 -12.040 811 H ILE 117 H ILE 117 2.957 5.625 -7.101 812 HA ILE 117 HA ILE 117 2.831 5.888 -4.184 813 HB ILE 117 HB ILE 117 0.520 6.350 -6.076 814 HG12 ILE 117 HG12 ILE 117 2.416 8.437 -4.977 815 HG13 ILE 117 HG13 ILE 117 2.495 7.822 -6.622 816 HG21 ILE 117 HG21 ILE 117 -0.316 7.706 -4.195 817 HG22 ILE 117 HG22 ILE 117 1.107 7.260 -3.253 818 HG23 ILE 117 HG23 ILE 117 -0.059 6.024 -3.731 819 HD11 ILE 117 HD11 ILE 117 0.170 9.312 -5.414 820 HD12 ILE 117 HD12 ILE 117 0.269 8.713 -7.071 821 HD13 ILE 117 HD13 ILE 117 1.369 9.978 -6.524 822 H VAL 118 H VAL 118 2.583 4.069 -3.156 823 HA VAL 118 HA VAL 118 1.201 1.790 -4.353 824 HB VAL 118 HB VAL 118 2.603 1.964 -1.668 825 HG11 VAL 118 HG11 VAL 118 1.014 0.121 -1.800 826 HG12 VAL 118 HG12 VAL 118 2.672 -0.482 -1.776 827 HG13 VAL 118 HG13 VAL 118 1.773 -0.439 -3.293 828 HG21 VAL 118 HG21 VAL 118 4.195 2.418 -3.457 829 HG22 VAL 118 HG22 VAL 118 3.695 0.946 -4.290 830 HG23 VAL 118 HG23 VAL 118 4.504 0.844 -2.726 831 H SER 119 H SER 119 -0.858 1.188 -3.754 832 HA SER 119 HA SER 119 -2.020 2.555 -1.424 833 HB2 SER 119 HB2 SER 119 -2.832 3.534 -3.563 834 HB3 SER 119 HB3 SER 119 -3.460 1.952 -4.019 835 HG SER 119 HG SER 119 -5.025 3.380 -3.050 836 H LEU 120 H LEU 120 -3.310 1.443 -0.126 837 HA LEU 120 HA LEU 120 -4.073 -1.317 -0.777 838 HB2 LEU 120 HB2 LEU 120 -2.123 -1.527 0.620 839 HB3 LEU 120 HB3 LEU 120 -2.725 -0.338 1.746 840 HG LEU 120 HG LEU 120 -4.387 -1.929 2.596 841 HD11 LEU 120 HD11 LEU 120 -3.229 -3.892 0.609 842 HD12 LEU 120 HD12 LEU 120 -4.838 -3.175 0.511 843 HD13 LEU 120 HD13 LEU 120 -4.431 -4.248 1.851 844 HD21 LEU 120 HD21 LEU 120 -1.642 -3.115 2.382 845 HD22 LEU 120 HD22 LEU 120 -2.869 -3.528 3.583 846 HD23 LEU 120 HD23 LEU 120 -2.170 -1.908 3.555 847 H ILE 121 H ILE 121 -6.158 -1.643 -0.460 848 HA ILE 121 HA ILE 121 -7.627 0.131 1.356 849 HB ILE 121 HB ILE 121 -8.187 0.891 -0.863 850 HG12 ILE 121 HG12 ILE 121 -10.459 -0.858 0.117 851 HG13 ILE 121 HG13 ILE 121 -10.051 0.719 0.779 852 HG21 ILE 121 HG21 ILE 121 -7.492 -0.993 -2.182 853 HG22 ILE 121 HG22 ILE 121 -9.159 -0.581 -2.582 854 HG23 ILE 121 HG23 ILE 121 -8.818 -1.972 -1.553 855 HD11 ILE 121 HD11 ILE 121 -11.956 0.820 -0.739 856 HD12 ILE 121 HD12 ILE 121 -10.954 0.190 -2.046 857 HD13 ILE 121 HD13 ILE 121 -10.597 1.767 -1.343 858 H VAL 122 H VAL 122 -9.026 -0.885 2.711 859 HA VAL 122 HA VAL 122 -9.420 -3.761 2.276 860 HB VAL 122 HB VAL 122 -9.562 -4.012 4.776 861 HG11 VAL 122 HG11 VAL 122 -7.615 -4.746 3.518 862 HG12 VAL 122 HG12 VAL 122 -7.136 -4.095 5.086 863 HG13 VAL 122 HG13 VAL 122 -6.918 -3.128 3.627 864 HG21 VAL 122 HG21 VAL 122 -9.873 -1.663 5.372 865 HG22 VAL 122 HG22 VAL 122 -8.259 -1.289 4.764 866 HG23 VAL 122 HG23 VAL 122 -8.452 -2.339 6.167 867 H SER 123 H SER 123 -11.374 -4.625 3.400 868 HA SER 123 HA SER 123 -13.511 -2.632 3.461 869 HB2 SER 123 HB2 SER 123 -14.932 -4.313 2.202 870 HB3 SER 123 HB3 SER 123 -13.665 -3.534 1.255 871 HG SER 123 HG SER 123 -13.785 -5.844 0.972 872 H ASN 124 H ASN 124 -15.020 -2.963 4.946 873 HA ASN 124 HA ASN 124 -15.034 -5.478 6.488 874 HB2 ASN 124 HB2 ASN 124 -14.132 -3.487 7.751 875 HB3 ASN 124 HB3 ASN 124 -15.645 -2.655 7.462 876 HD21 ASN 124 HD21 ASN 124 -14.066 -5.210 9.233 877 HD22 ASN 124 HD22 ASN 124 -15.299 -5.410 10.426 878 H GLU 125 H GLU 125 -17.428 -5.444 7.662 879 HA GLU 125 HA GLU 125 -19.383 -5.504 5.570 880 HB2 GLU 125 HB2 GLU 125 -19.318 -7.027 7.566 881 HB3 GLU 125 HB3 GLU 125 -19.754 -5.658 8.576 882 HG2 GLU 125 HG2 GLU 125 -21.758 -6.729 8.273 883 HG3 GLU 125 HG3 GLU 125 -21.822 -5.467 7.053 884 H ASN 126 H ASN 126 -18.324 -3.234 7.916 885 HA ASN 126 HA ASN 126 -20.649 -1.539 7.934 886 HB2 ASN 126 HB2 ASN 126 -19.131 -1.838 9.893 887 HB3 ASN 126 HB3 ASN 126 -17.859 -1.022 8.994 888 HD21 ASN 126 HD21 ASN 126 -17.718 0.485 10.616 889 HD22 ASN 126 HD22 ASN 126 -18.873 1.745 10.815 890 H ASP 127 H ASP 127 -17.300 -1.204 6.715 891 HA ASP 127 HA ASP 127 -18.096 0.637 4.635 892 HB2 ASP 127 HB2 ASP 127 -18.002 1.936 6.867 893 HB3 ASP 127 HB3 ASP 127 -16.264 1.710 6.783 894 H SER 128 H SER 128 -15.961 1.550 3.563 895 HA SER 128 HA SER 128 -13.788 -0.414 3.864 896 HB2 SER 128 HB2 SER 128 -13.268 0.192 1.418 897 HB3 SER 128 HB3 SER 128 -14.663 -0.844 1.719 898 HG SER 128 HG SER 128 -14.582 1.870 0.958 899 H ASP 129 H ASP 129 -11.700 0.342 3.930 900 HA ASP 129 HA ASP 129 -11.347 3.266 4.092 901 HB2 ASP 129 HB2 ASP 129 -11.497 2.173 6.355 902 HB3 ASP 129 HB3 ASP 129 -10.080 1.225 5.934 903 H SER 130 H SER 130 -9.484 4.035 3.105 904 HA SER 130 HA SER 130 -7.525 2.036 2.235 905 HB2 SER 130 HB2 SER 130 -9.025 2.686 0.346 906 HB3 SER 130 HB3 SER 130 -8.495 4.356 0.548 907 HG SER 130 HG SER 130 -6.534 2.379 0.250 908 H ALA 131 H ALA 131 -5.459 2.576 2.405 909 HA ALA 131 HA ALA 131 -4.741 5.377 2.929 910 HB1 ALA 131 HB1 ALA 131 -4.506 4.106 5.012 911 HB2 ALA 131 HB2 ALA 131 -2.938 4.629 4.397 912 HB3 ALA 131 HB3 ALA 131 -3.453 2.953 4.190 913 H SER 132 H SER 132 -2.865 6.073 1.930 914 HA SER 132 HA SER 132 -1.531 4.188 0.131 915 HB2 SER 132 HB2 SER 132 -3.437 5.475 -1.003 916 HB3 SER 132 HB3 SER 132 -2.456 6.922 -0.775 917 HG SER 132 HG SER 132 -1.271 4.689 -1.972 918 H VAL 133 H VAL 133 0.638 4.831 -0.423 919 HA VAL 133 HA VAL 133 1.629 7.188 0.985 920 HB VAL 133 HB VAL 133 1.984 5.272 2.501 921 HG11 VAL 133 HG11 VAL 133 2.271 3.459 0.935 922 HG12 VAL 133 HG12 VAL 133 3.669 3.570 2.007 923 HG13 VAL 133 HG13 VAL 133 3.775 4.169 0.351 924 HG21 VAL 133 HG21 VAL 133 4.353 5.663 2.963 925 HG22 VAL 133 HG22 VAL 133 3.477 7.159 2.637 926 HG23 VAL 133 HG23 VAL 133 4.518 6.457 1.397 927 H THR 134 H THR 134 3.187 8.284 -0.041 928 HA THR 134 HA THR 134 3.699 7.497 -2.804 929 HB THR 134 HB THR 134 4.325 10.168 -1.534 930 HG1 THR 134 HG1 THR 134 1.958 9.153 -1.523 931 HG21 THR 134 HG21 THR 134 3.930 10.994 -3.813 932 HG22 THR 134 HG22 THR 134 3.609 9.344 -4.347 933 HG23 THR 134 HG23 THR 134 5.217 9.790 -3.773 934 H ILE 135 H ILE 135 5.546 6.498 -3.232 935 HA ILE 135 HA ILE 135 7.732 6.624 -1.280 936 HB ILE 135 HB ILE 135 7.450 4.685 -3.587 937 HG12 ILE 135 HG12 ILE 135 5.462 4.487 -2.160 938 HG13 ILE 135 HG13 ILE 135 6.492 3.063 -2.018 939 HG21 ILE 135 HG21 ILE 135 8.948 3.262 -2.266 940 HG22 ILE 135 HG22 ILE 135 9.056 4.522 -1.035 941 HG23 ILE 135 HG23 ILE 135 9.689 4.815 -2.657 942 HD11 ILE 135 HD11 ILE 135 6.325 5.328 -0.040 943 HD12 ILE 135 HD12 ILE 135 7.349 3.899 0.109 944 HD13 ILE 135 HD13 ILE 135 5.594 3.732 0.135 945 H ARG 136 H ARG 136 9.720 7.412 -1.779 946 HA ARG 136 HA ARG 136 10.033 8.584 -4.444 947 HB2 ARG 136 HB2 ARG 136 11.219 9.259 -1.768 948 HB3 ARG 136 HB3 ARG 136 11.961 9.817 -3.260 949 HG2 ARG 136 HG2 ARG 136 9.898 10.986 -3.844 950 HG3 ARG 136 HG3 ARG 136 9.162 10.424 -2.338 951 HD2 ARG 136 HD2 ARG 136 10.680 11.675 -1.023 952 HD3 ARG 136 HD3 ARG 136 11.716 12.008 -2.409 953 HE ARG 136 HE ARG 136 9.212 13.096 -2.959 954 HH11 ARG 136 HH11 ARG 136 11.761 13.557 -0.578 955 HH12 ARG 136 HH12 ARG 136 11.509 15.274 -0.449 956 HH21 ARG 136 HH21 ARG 136 8.885 15.359 -2.792 957 HH22 ARG 136 HH22 ARG 136 9.868 16.298 -1.714 958 H ALA 137 H ALA 137 11.277 7.586 -5.785 959 HA ALA 137 HA ALA 137 13.717 6.268 -4.789 960 HB1 ALA 137 HB1 ALA 137 12.241 5.799 -7.385 961 HB2 ALA 137 HB2 ALA 137 12.240 4.715 -5.994 962 HB3 ALA 137 HB3 ALA 137 13.733 4.999 -6.890 963 H LEU 138 H LEU 138 15.392 7.630 -5.033 964 HA LEU 138 HA LEU 138 15.153 9.602 -7.173 965 HB2 LEU 138 HB2 LEU 138 16.534 11.082 -5.625 966 HB3 LEU 138 HB3 LEU 138 14.807 10.922 -5.402 967 HG LEU 138 HG LEU 138 15.412 9.160 -3.614 968 HD11 LEU 138 HD11 LEU 138 18.023 10.672 -3.755 969 HD12 LEU 138 HD12 LEU 138 17.806 8.962 -4.129 970 HD13 LEU 138 HD13 LEU 138 17.541 9.545 -2.486 971 HD21 LEU 138 HD21 LEU 138 16.009 12.068 -3.289 972 HD22 LEU 138 HD22 LEU 138 15.535 10.953 -2.000 973 HD23 LEU 138 HD23 LEU 138 14.411 11.331 -3.311 974 H GLU 139 H GLU 139 17.206 10.788 -7.593 975 HA GLU 139 HA GLU 139 19.359 8.849 -7.855 976 HB2 GLU 139 HB2 GLU 139 18.666 9.685 -9.996 977 HB3 GLU 139 HB3 GLU 139 18.696 11.341 -9.422 978 HG2 GLU 139 HG2 GLU 139 20.553 10.888 -10.914 979 HG3 GLU 139 HG3 GLU 139 21.115 11.293 -9.298 980 H HIS 140 H HIS 140 20.438 8.966 -6.037 981 HA HIS 140 HA HIS 140 21.754 11.524 -5.427 982 HB2 HIS 140 HB2 HIS 140 20.102 10.569 -3.679 983 HB3 HIS 140 HB3 HIS 140 21.320 9.331 -3.405 984 HD1 HIS 140 HD1 HIS 140 20.634 12.967 -2.867 985 HD2 HIS 140 HD2 HIS 140 23.579 10.166 -1.969 986 HE1 HIS 140 HE1 HIS 140 22.103 14.060 -1.133 987 HE2 HIS 140 HE2 HIS 140 23.900 12.366 -0.627 988 H HIS 141 H HIS 141 23.783 11.392 -6.176 989 HA HIS 141 HA HIS 141 25.256 8.899 -5.690 990 HB2 HIS 141 HB2 HIS 141 26.447 9.165 -7.849 991 HB3 HIS 141 HB3 HIS 141 24.732 8.850 -8.048 992 HD1 HIS 141 HD1 HIS 141 23.370 10.558 -9.308 993 HD2 HIS 141 HD2 HIS 141 27.280 11.799 -8.605 994 HE1 HIS 141 HE1 HIS 141 23.683 12.649 -10.690 995 HE2 HIS 141 HE2 HIS 141 25.996 13.460 -10.131 996 H HIS 142 H HIS 142 27.466 9.075 -5.320 997 HA HIS 142 HA HIS 142 28.305 11.703 -4.331 998 HB2 HIS 142 HB2 HIS 142 28.503 9.514 -2.982 999 HB3 HIS 142 HB3 HIS 142 29.806 9.092 -4.077 1000 HD1 HIS 142 HD1 HIS 142 29.274 10.532 -0.873 1001 HD2 HIS 142 HD2 HIS 142 31.906 11.290 -4.007 1002 HE1 HIS 142 HE1 HIS 142 31.209 11.783 0.147 1003 HE2 HIS 142 HE2 HIS 142 32.873 12.043 -1.731 1004 H HIS 143 H HIS 143 29.564 12.953 -5.553 1005 HA HIS 143 HA HIS 143 30.902 11.699 -7.847 1006 HB2 HIS 143 HB2 HIS 143 30.763 13.883 -8.993 1007 HB3 HIS 143 HB3 HIS 143 29.184 13.240 -8.578 1008 HD1 HIS 143 HD1 HIS 143 27.637 14.832 -7.453 1009 HD2 HIS 143 HD2 HIS 143 31.605 16.070 -7.170 1010 HE1 HIS 143 HE1 HIS 143 27.556 17.119 -6.414 1011 HE2 HIS 143 HE2 HIS 143 29.967 17.787 -6.106 1012 H HIS 144 H HIS 144 32.868 12.757 -8.625 1013 HA HIS 144 HA HIS 144 34.671 13.412 -6.448 1014 HB2 HIS 144 HB2 HIS 144 35.336 11.837 -8.249 1015 HB3 HIS 144 HB3 HIS 144 35.173 13.131 -9.424 1016 HD1 HIS 144 HD1 HIS 144 37.208 14.458 -9.893 1017 HD2 HIS 144 HD2 HIS 144 37.513 12.313 -6.339 1018 HE1 HIS 144 HE1 HIS 144 39.568 14.807 -9.092 1019 HE2 HIS 144 HE2 HIS 144 39.795 13.313 -7.073 1020 H HIS 145 H HIS 145 35.443 15.423 -5.998 1021 HA HIS 145 HA HIS 145 34.129 17.662 -7.247 1022 HB2 HIS 145 HB2 HIS 145 35.142 19.049 -5.552 1023 HB3 HIS 145 HB3 HIS 145 34.495 17.608 -4.801 1024 HD1 HIS 145 HD1 HIS 145 36.208 15.981 -3.681 1025 HD2 HIS 145 HD2 HIS 145 37.912 19.405 -5.338 1026 HE1 HIS 145 HE1 HIS 145 38.539 16.109 -2.734 1027 HE2 HIS 145 HE2 HIS 145 39.485 18.282 -3.605 Start of MODEL 12 1 H1 MET 1 H1 MET 1 7.113 93.351 115.299 2 H2 MET 1 H2 MET 1 8.044 93.996 116.560 3 H3 MET 1 H3 MET 1 8.625 92.678 115.666 4 HA MET 1 HA MET 1 8.144 95.406 114.617 5 HB2 MET 1 HB2 MET 1 10.720 93.930 115.205 6 HB3 MET 1 HB3 MET 1 10.629 95.436 114.302 7 HG2 MET 1 HG2 MET 1 9.691 96.550 116.250 8 HG3 MET 1 HG3 MET 1 9.766 95.040 117.154 9 HE1 MET 1 HE1 MET 1 11.017 97.606 118.392 10 HE2 MET 1 HE2 MET 1 12.561 96.969 118.958 11 HE3 MET 1 HE3 MET 1 11.094 95.996 119.107 12 H ASN 2 H ASN 2 8.157 95.640 112.484 13 HA ASN 2 HA ASN 2 8.970 93.432 110.742 14 HB2 ASN 2 HB2 ASN 2 6.554 93.099 111.262 15 HB3 ASN 2 HB3 ASN 2 6.215 94.704 110.635 16 HD21 ASN 2 HD21 ASN 2 4.837 93.997 109.056 17 HD22 ASN 2 HD22 ASN 2 5.357 93.108 107.666 18 H ALA 3 H ALA 3 9.720 94.136 108.776 19 HA ALA 3 HA ALA 3 10.144 96.950 108.377 20 HB1 ALA 3 HB1 ALA 3 11.826 95.287 107.711 21 HB2 ALA 3 HB2 ALA 3 11.308 96.276 106.344 22 HB3 ALA 3 HB3 ALA 3 10.696 94.632 106.526 23 H ARG 4 H ARG 4 8.285 98.005 108.060 24 HA ARG 4 HA ARG 4 6.237 96.928 106.306 25 HB2 ARG 4 HB2 ARG 4 5.654 97.798 108.548 26 HB3 ARG 4 HB3 ARG 4 6.232 99.387 108.073 27 HG2 ARG 4 HG2 ARG 4 4.482 99.478 106.347 28 HG3 ARG 4 HG3 ARG 4 3.884 97.912 106.905 29 HD2 ARG 4 HD2 ARG 4 3.438 98.839 109.104 30 HD3 ARG 4 HD3 ARG 4 4.107 100.390 108.607 31 HE ARG 4 HE ARG 4 1.961 99.592 106.913 32 HH11 ARG 4 HH11 ARG 4 2.666 101.024 110.048 33 HH12 ARG 4 HH12 ARG 4 1.137 101.837 110.168 34 HH21 ARG 4 HH21 ARG 4 -0.051 100.678 107.074 35 HH22 ARG 4 HH22 ARG 4 -0.408 101.636 108.476 36 H ASP 5 H ASP 5 6.816 97.241 104.232 37 HA ASP 5 HA ASP 5 6.967 100.010 103.308 38 HB2 ASP 5 HB2 ASP 5 8.785 99.543 101.788 39 HB3 ASP 5 HB3 ASP 5 9.288 99.079 103.406 40 H ASN 6 H ASN 6 6.513 100.167 100.940 41 HA ASN 6 HA ASN 6 4.507 98.174 100.158 42 HB2 ASN 6 HB2 ASN 6 5.006 101.016 99.322 43 HB3 ASN 6 HB3 ASN 6 4.071 99.943 98.291 44 HD21 ASN 6 HD21 ASN 6 2.262 101.237 98.532 45 HD22 ASN 6 HD22 ASN 6 1.314 101.238 99.982 46 H LYS 7 H LYS 7 5.887 96.537 99.494 47 HA LYS 7 HA LYS 7 7.996 96.988 97.609 48 HB2 LYS 7 HB2 LYS 7 7.254 94.959 99.389 49 HB3 LYS 7 HB3 LYS 7 7.140 94.235 97.793 50 HG2 LYS 7 HG2 LYS 7 9.574 95.673 98.819 51 HG3 LYS 7 HG3 LYS 7 9.329 93.932 98.925 52 HD2 LYS 7 HD2 LYS 7 9.198 93.798 96.485 53 HD3 LYS 7 HD3 LYS 7 9.434 95.544 96.374 54 HE2 LYS 7 HE2 LYS 7 11.625 95.324 97.409 55 HE3 LYS 7 HE3 LYS 7 11.383 93.587 97.579 56 HZ1 LYS 7 HZ1 LYS 7 11.296 93.397 95.176 57 HZ2 LYS 7 HZ2 LYS 7 12.755 94.106 95.665 58 HZ3 LYS 7 HZ3 LYS 7 11.524 95.067 95.008 59 H PHE 8 H PHE 8 4.800 95.452 97.473 60 HA PHE 8 HA PHE 8 5.000 94.872 94.695 61 HB2 PHE 8 HB2 PHE 8 2.596 94.204 94.879 62 HB3 PHE 8 HB3 PHE 8 3.645 93.406 96.033 63 HD1 PHE 8 HD2 PHE 8 3.551 94.075 98.455 64 HD2 PHE 8 HD1 PHE 8 0.765 95.531 95.579 65 HE1 PHE 8 HE2 PHE 8 2.016 94.712 100.268 66 HE2 PHE 8 HE1 PHE 8 -0.770 96.166 97.390 67 HZ PHE 8 HZ PHE 8 -0.147 95.759 99.734 68 H ASN 9 H ASN 9 4.790 96.174 93.089 69 HA ASN 9 HA ASN 9 2.844 98.338 93.149 70 HB2 ASN 9 HB2 ASN 9 5.112 99.252 93.863 71 HB3 ASN 9 HB3 ASN 9 5.695 98.812 92.264 72 HD21 ASN 9 HD21 ASN 9 6.193 100.957 91.801 73 HD22 ASN 9 HD22 ASN 9 4.970 102.123 91.432 74 H THR 10 H THR 10 2.022 98.788 91.121 75 HA THR 10 HA THR 10 1.136 98.219 89.141 76 HB THR 10 HB THR 10 3.891 97.226 88.412 77 HG1 THR 10 HG1 THR 10 2.913 99.761 88.876 78 HG21 THR 10 HG21 THR 10 2.114 96.635 86.787 79 HG22 THR 10 HG22 THR 10 3.265 97.792 86.117 80 HG23 THR 10 HG23 THR 10 1.683 98.343 86.668 81 H TRP 11 H TRP 11 -0.058 96.710 90.438 82 HA TRP 11 HA TRP 11 0.703 93.894 90.127 83 HB2 TRP 11 HB2 TRP 11 0.323 94.745 92.429 84 HB3 TRP 11 HB3 TRP 11 -1.327 95.161 91.983 85 HD1 TRP 11 HD1 TRP 11 -3.050 93.408 92.684 86 HE1 TRP 11 HE1 TRP 11 -3.032 90.880 93.185 87 HE3 TRP 11 HE3 TRP 11 1.839 92.400 91.582 88 HZ2 TRP 11 HZ2 TRP 11 -1.186 88.746 93.111 89 HZ3 TRP 11 HZ3 TRP 11 2.645 90.095 91.819 90 HH2 TRP 11 HH2 TRP 11 1.166 88.307 92.569 91 H ASN 12 H ASN 12 -0.245 92.805 88.591 92 HA ASN 12 HA ASN 12 -2.643 93.797 87.294 93 HB2 ASN 12 HB2 ASN 12 -0.635 92.867 86.056 94 HB3 ASN 12 HB3 ASN 12 -1.082 91.286 86.669 95 HD21 ASN 12 HD21 ASN 12 -3.286 93.812 85.537 96 HD22 ASN 12 HD22 ASN 12 -3.885 92.910 84.184 97 H ASP 13 H ASP 13 -4.558 92.519 87.041 98 HA ASP 13 HA ASP 13 -5.152 91.262 89.567 99 HB2 ASP 13 HB2 ASP 13 -7.560 91.476 88.795 100 HB3 ASP 13 HB3 ASP 13 -6.669 92.969 89.041 101 H SER 14 H SER 14 -7.082 90.223 86.793 102 HA SER 14 HA SER 14 -5.987 87.528 87.004 103 HB2 SER 14 HB2 SER 14 -8.815 88.229 87.797 104 HB3 SER 14 HB3 SER 14 -8.268 86.585 87.485 105 HG SER 14 HG SER 14 -8.255 87.374 89.749 106 H ARG 15 H ARG 15 -7.175 85.979 85.571 107 HA ARG 15 HA ARG 15 -8.183 87.321 83.151 108 HB2 ARG 15 HB2 ARG 15 -5.966 86.237 82.846 109 HB3 ARG 15 HB3 ARG 15 -6.656 84.711 83.365 110 HG2 ARG 15 HG2 ARG 15 -6.344 84.904 80.914 111 HG3 ARG 15 HG3 ARG 15 -8.004 84.567 81.394 112 HD2 ARG 15 HD2 ARG 15 -7.853 86.230 79.584 113 HD3 ARG 15 HD3 ARG 15 -8.620 86.872 81.031 114 HE ARG 15 HE ARG 15 -5.813 87.446 80.954 115 HH11 ARG 15 HH11 ARG 15 -8.913 88.466 79.654 116 HH12 ARG 15 HH12 ARG 15 -8.448 90.132 79.495 117 HH21 ARG 15 HH21 ARG 15 -5.191 89.655 80.704 118 HH22 ARG 15 HH22 ARG 15 -6.334 90.791 80.058 119 H GLY 16 H GLY 16 -10.107 86.669 82.370 120 HA2 GLY 16 HA2 GLY 16 -11.923 85.361 84.091 121 HA3 GLY 16 HA3 GLY 16 -12.243 85.847 82.441 122 H ASN 17 H ASN 17 -12.426 83.350 84.372 123 HA ASN 17 HA ASN 17 -11.488 81.365 82.430 124 HB2 ASN 17 HB2 ASN 17 -12.217 81.008 85.353 125 HB3 ASN 17 HB3 ASN 17 -11.720 79.711 84.277 126 HD21 ASN 17 HD21 ASN 17 -10.519 80.635 86.738 127 HD22 ASN 17 HD22 ASN 17 -8.885 81.068 86.358 128 H TYR 18 H TYR 18 -13.094 81.214 80.990 129 HA TYR 18 HA TYR 18 -15.672 80.280 81.996 130 HB2 TYR 18 HB2 TYR 18 -16.676 81.524 79.939 131 HB3 TYR 18 HB3 TYR 18 -16.345 82.407 81.416 132 HD1 TYR 18 HD1 TYR 18 -15.173 81.798 77.969 133 HD2 TYR 18 HD2 TYR 18 -14.777 84.186 81.461 134 HE1 TYR 18 HE1 TYR 18 -13.865 83.444 76.688 135 HE2 TYR 18 HE2 TYR 18 -13.465 85.837 80.197 136 HH TYR 18 HH TYR 18 -12.070 85.920 78.180 137 H TRP 19 H TRP 19 -16.452 78.537 81.060 138 HA TRP 19 HA TRP 19 -15.077 77.515 78.666 139 HB2 TRP 19 HB2 TRP 19 -15.891 76.019 81.168 140 HB3 TRP 19 HB3 TRP 19 -15.485 75.204 79.665 141 HD1 TRP 19 HD1 TRP 19 -13.705 77.844 81.943 142 HE1 TRP 19 HE1 TRP 19 -11.226 77.164 82.139 143 HE3 TRP 19 HE3 TRP 19 -13.760 73.677 78.963 144 HZ2 TRP 19 HZ2 TRP 19 -9.529 75.140 81.164 145 HZ3 TRP 19 HZ3 TRP 19 -11.663 72.428 78.656 146 HH2 TRP 19 HH2 TRP 19 -9.592 73.145 79.733 147 H SER 20 H SER 20 -16.399 75.677 77.653 148 HA SER 20 HA SER 20 -19.262 76.348 77.754 149 HB2 SER 20 HB2 SER 20 -17.611 75.724 75.290 150 HB3 SER 20 HB3 SER 20 -19.355 75.977 75.308 151 HG SER 20 HG SER 20 -18.235 78.036 76.537 152 H ASP 21 H ASP 21 -20.718 74.650 77.497 153 HA ASP 21 HA ASP 21 -19.595 71.993 77.881 154 HB2 ASP 21 HB2 ASP 21 -21.833 71.257 78.429 155 HB3 ASP 21 HB3 ASP 21 -21.455 72.710 79.336 156 H TYR 22 H TYR 22 -20.842 70.176 76.681 157 HA TYR 22 HA TYR 22 -20.568 70.905 73.844 158 HB2 TYR 22 HB2 TYR 22 -19.802 68.349 75.271 159 HB3 TYR 22 HB3 TYR 22 -19.771 68.545 73.523 160 HD1 TYR 22 HD1 TYR 22 -18.081 69.923 72.457 161 HD2 TYR 22 HD2 TYR 22 -18.120 69.419 76.680 162 HE1 TYR 22 HE1 TYR 22 -15.802 70.831 72.579 163 HE2 TYR 22 HE2 TYR 22 -15.839 70.332 76.816 164 HH TYR 22 HH TYR 22 -14.345 71.931 74.198 165 H GLU 23 H GLU 23 -22.185 70.580 72.539 166 HA GLU 23 HA GLU 23 -24.620 69.357 73.301 167 HB2 GLU 23 HB2 GLU 23 -23.500 70.192 70.632 168 HB3 GLU 23 HB3 GLU 23 -25.070 69.422 70.776 169 HG2 GLU 23 HG2 GLU 23 -24.288 71.992 72.130 170 HG3 GLU 23 HG3 GLU 23 -25.182 71.889 70.614 171 H GLY 24 H GLY 24 -25.156 67.317 73.361 172 HA2 GLY 24 HA2 GLY 24 -23.407 65.270 72.270 173 HA3 GLY 24 HA3 GLY 24 -24.823 65.005 73.273 174 H SER 25 H SER 25 -24.637 63.309 71.314 175 HA SER 25 HA SER 25 -26.498 64.292 69.255 176 HB2 SER 25 HB2 SER 25 -24.302 62.230 68.957 177 HB3 SER 25 HB3 SER 25 -25.501 62.607 67.717 178 HG SER 25 HG SER 25 -23.419 64.235 68.732 179 H ASP 26 H ASP 26 -27.796 62.437 68.279 180 HA ASP 26 HA ASP 26 -28.289 60.263 70.159 181 HB2 ASP 26 HB2 ASP 26 -29.819 62.049 70.871 182 HB3 ASP 26 HB3 ASP 26 -30.449 62.170 69.232 183 H GLU 27 H GLU 27 -28.210 58.476 69.033 184 HA GLU 27 HA GLU 27 -29.761 58.270 66.580 185 HB2 GLU 27 HB2 GLU 27 -27.948 56.989 65.443 186 HB3 GLU 27 HB3 GLU 27 -27.574 58.689 65.677 187 HG2 GLU 27 HG2 GLU 27 -26.022 58.223 67.378 188 HG3 GLU 27 HG3 GLU 27 -26.594 56.570 67.566 189 H ASN 28 H ASN 28 -30.758 56.364 66.299 190 HA ASN 28 HA ASN 28 -29.852 53.908 67.478 191 HB2 ASN 28 HB2 ASN 28 -31.214 55.194 69.324 192 HB3 ASN 28 HB3 ASN 28 -32.612 54.704 68.364 193 HD21 ASN 28 HD21 ASN 28 -29.973 53.663 70.326 194 HD22 ASN 28 HD22 ASN 28 -30.502 52.038 70.564 195 H GLY 29 H GLY 29 -30.344 52.361 66.009 196 HA2 GLY 29 HA2 GLY 29 -32.875 52.396 64.619 197 HA3 GLY 29 HA3 GLY 29 -31.507 52.808 63.600 198 H ASP 30 H ASP 30 -33.465 50.376 64.537 199 HA ASP 30 HA ASP 30 -31.543 48.223 64.179 200 HB2 ASP 30 HB2 ASP 30 -33.487 47.943 65.694 201 HB3 ASP 30 HB3 ASP 30 -34.571 48.168 64.328 202 H GLY 31 H GLY 31 -31.198 47.121 62.293 203 HA2 GLY 31 HA2 GLY 31 -32.564 48.204 59.912 204 HA3 GLY 31 HA3 GLY 31 -30.921 47.584 59.921 205 H ILE 32 H ILE 32 -34.304 46.774 59.863 206 HA ILE 32 HA ILE 32 -33.915 43.936 59.687 207 HB ILE 32 HB ILE 32 -36.274 45.728 59.093 208 HG12 ILE 32 HG12 ILE 32 -35.745 45.395 61.456 209 HG13 ILE 32 HG13 ILE 32 -37.277 44.641 61.044 210 HG21 ILE 32 HG21 ILE 32 -37.680 43.726 58.819 211 HG22 ILE 32 HG22 ILE 32 -36.230 42.722 58.836 212 HG23 ILE 32 HG23 ILE 32 -36.480 43.888 57.535 213 HD11 ILE 32 HD11 ILE 32 -36.001 43.236 62.548 214 HD12 ILE 32 HD12 ILE 32 -34.646 43.224 61.418 215 HD13 ILE 32 HD13 ILE 32 -36.171 42.455 60.975 216 H GLY 33 H GLY 33 -32.861 43.074 58.080 217 HA2 GLY 33 HA2 GLY 33 -33.665 43.319 55.375 218 HA3 GLY 33 HA3 GLY 33 -32.199 44.254 55.654 219 H ASP 34 H ASP 34 -33.563 41.062 56.362 220 HA ASP 34 HA ASP 34 -30.888 39.895 56.291 221 HB2 ASP 34 HB2 ASP 34 -32.405 39.294 58.157 222 HB3 ASP 34 HB3 ASP 34 -33.557 38.643 57.000 223 H SER 35 H SER 35 -33.959 38.539 55.167 224 HA SER 35 HA SER 35 -34.780 37.814 53.210 225 HB2 SER 35 HB2 SER 35 -32.619 39.467 51.895 226 HB3 SER 35 HB3 SER 35 -34.031 38.779 51.090 227 HG SER 35 HG SER 35 -33.820 41.045 52.566 228 H ALA 36 H ALA 36 -34.709 35.778 52.783 229 HA ALA 36 HA ALA 36 -32.189 34.600 51.808 230 HB1 ALA 36 HB1 ALA 36 -34.307 33.242 53.476 231 HB2 ALA 36 HB2 ALA 36 -32.717 33.753 54.044 232 HB3 ALA 36 HB3 ALA 36 -32.853 32.482 52.828 233 H TYR 37 H TYR 37 -32.342 34.058 49.752 234 HA TYR 37 HA TYR 37 -34.950 33.260 48.648 235 HB2 TYR 37 HB2 TYR 37 -33.465 35.095 47.551 236 HB3 TYR 37 HB3 TYR 37 -32.447 33.760 47.035 237 HD1 TYR 37 HD2 TYR 37 -33.579 31.905 45.621 238 HD2 TYR 37 HD1 TYR 37 -35.292 35.742 46.264 239 HE1 TYR 37 HE2 TYR 37 -35.002 31.588 43.648 240 HE2 TYR 37 HE1 TYR 37 -36.719 35.441 44.283 241 HH TYR 37 HH TYR 37 -37.113 32.413 42.744 242 H ALA 38 H ALA 38 -35.275 31.162 48.839 243 HA ALA 38 HA ALA 38 -33.040 29.347 49.122 244 HB1 ALA 38 HB1 ALA 38 -36.000 28.826 49.261 245 HB2 ALA 38 HB2 ALA 38 -34.944 29.180 50.628 246 HB3 ALA 38 HB3 ALA 38 -34.726 27.691 49.708 247 H VAL 39 H VAL 39 -32.154 28.330 47.540 248 HA VAL 39 HA VAL 39 -33.748 27.466 45.218 249 HB VAL 39 HB VAL 39 -30.842 28.377 45.125 250 HG11 VAL 39 HG11 VAL 39 -31.040 28.227 42.699 251 HG12 VAL 39 HG12 VAL 39 -32.689 27.623 42.861 252 HG13 VAL 39 HG13 VAL 39 -31.336 26.661 43.457 253 HG21 VAL 39 HG21 VAL 39 -32.352 30.275 45.453 254 HG22 VAL 39 HG22 VAL 39 -33.268 29.785 44.027 255 HG23 VAL 39 HG23 VAL 39 -31.591 30.306 43.861 256 H ASN 40 H ASN 40 -33.348 25.350 44.564 257 HA ASN 40 HA ASN 40 -31.530 23.746 46.220 258 HB2 ASN 40 HB2 ASN 40 -33.552 22.843 44.142 259 HB3 ASN 40 HB3 ASN 40 -32.605 21.784 45.182 260 HD21 ASN 40 HD21 ASN 40 -35.303 23.940 44.961 261 HD22 ASN 40 HD22 ASN 40 -35.996 23.564 46.503 262 HA PRO 41 HA PRO 41 -28.918 24.278 42.541 263 HB2 PRO 41 HB2 PRO 41 -26.594 23.963 44.189 264 HB3 PRO 41 HB3 PRO 41 -27.227 25.448 43.477 265 HG2 PRO 41 HG2 PRO 41 -27.169 24.929 46.176 266 HG3 PRO 41 HG3 PRO 41 -28.287 26.063 45.396 267 HD2 PRO 41 HD2 PRO 41 -28.756 23.220 46.244 268 HD3 PRO 41 HD3 PRO 41 -29.819 24.637 46.421 269 H GLU 42 H GLU 42 -29.611 22.286 41.772 270 HA GLU 42 HA GLU 42 -28.130 19.895 42.576 271 HB2 GLU 42 HB2 GLU 42 -30.464 20.259 40.686 272 HB3 GLU 42 HB3 GLU 42 -29.720 18.716 41.075 273 HG2 GLU 42 HG2 GLU 42 -30.420 18.919 43.384 274 HG3 GLU 42 HG3 GLU 42 -31.076 20.524 43.064 275 H ALA 43 H ALA 43 -27.197 18.528 40.905 276 HA ALA 43 HA ALA 43 -25.855 20.005 38.819 277 HB1 ALA 43 HB1 ALA 43 -24.655 18.242 40.012 278 HB2 ALA 43 HB2 ALA 43 -24.788 17.846 38.297 279 HB3 ALA 43 HB3 ALA 43 -25.837 17.051 39.469 280 H GLY 44 H GLY 44 -26.904 20.510 37.027 281 HA2 GLY 44 HA2 GLY 44 -29.353 19.327 36.213 282 HA3 GLY 44 HA3 GLY 44 -28.414 20.495 35.298 283 H SER 45 H SER 45 -29.428 17.302 35.560 284 HA SER 45 HA SER 45 -27.250 16.205 33.952 285 HB2 SER 45 HB2 SER 45 -29.583 14.779 35.252 286 HB3 SER 45 HB3 SER 45 -28.147 14.035 34.548 287 HG SER 45 HG SER 45 -28.092 15.857 36.726 288 H MET 46 H MET 46 -27.487 15.457 31.928 289 HA MET 46 HA MET 46 -30.009 15.934 30.535 290 HB2 MET 46 HB2 MET 46 -28.758 15.723 28.489 291 HB3 MET 46 HB3 MET 46 -27.833 16.745 29.572 292 HG2 MET 46 HG2 MET 46 -27.289 13.812 29.176 293 HG3 MET 46 HG3 MET 46 -26.522 15.076 28.234 294 HE1 MET 46 HE1 MET 46 -24.316 13.761 28.972 295 HE2 MET 46 HE2 MET 46 -25.142 12.714 30.131 296 HE3 MET 46 HE3 MET 46 -23.741 13.654 30.639 297 H ASP 47 H ASP 47 -29.605 13.777 32.471 298 HA ASP 47 HA ASP 47 -29.105 11.255 31.348 299 HB2 ASP 47 HB2 ASP 47 -29.049 11.969 33.803 300 HB3 ASP 47 HB3 ASP 47 -30.805 11.844 33.785 301 H TYR 48 H TYR 48 -30.297 9.988 30.146 302 HA TYR 48 HA TYR 48 -32.935 10.871 29.345 303 HB2 TYR 48 HB2 TYR 48 -31.233 8.555 28.385 304 HB3 TYR 48 HB3 TYR 48 -32.746 9.064 27.646 305 HD1 TYR 48 HD1 TYR 48 -32.808 11.577 26.887 306 HD2 TYR 48 HD2 TYR 48 -29.245 9.349 27.527 307 HE1 TYR 48 HE1 TYR 48 -31.580 13.145 25.444 308 HE2 TYR 48 HE2 TYR 48 -28.005 10.908 26.092 309 HH TYR 48 HH TYR 48 -28.490 12.476 24.239 310 H MET 49 H MET 49 -31.519 8.377 31.276 311 HA MET 49 HA MET 49 -32.217 6.527 32.352 312 HB2 MET 49 HB2 MET 49 -33.602 8.221 33.548 313 HB3 MET 49 HB3 MET 49 -34.921 7.890 32.436 314 HG2 MET 49 HG2 MET 49 -34.998 5.575 33.217 315 HG3 MET 49 HG3 MET 49 -33.690 5.919 34.345 316 HE1 MET 49 HE1 MET 49 -36.389 4.609 35.318 317 HE2 MET 49 HE2 MET 49 -36.700 5.552 36.776 318 HE3 MET 49 HE3 MET 49 -35.057 5.040 36.390 319 HA PRO 50 HA PRO 50 -33.741 4.457 28.562 320 HB2 PRO 50 HB2 PRO 50 -31.973 2.318 29.570 321 HB3 PRO 50 HB3 PRO 50 -32.024 3.080 27.978 322 HG2 PRO 50 HG2 PRO 50 -30.026 3.596 29.665 323 HG3 PRO 50 HG3 PRO 50 -30.712 4.879 28.646 324 HD2 PRO 50 HD2 PRO 50 -31.243 4.278 31.538 325 HD3 PRO 50 HD3 PRO 50 -30.924 5.844 30.756 326 H LEU 51 H LEU 51 -35.727 3.830 28.879 327 HA LEU 51 HA LEU 51 -36.380 1.983 31.048 328 HB2 LEU 51 HB2 LEU 51 -38.198 3.504 29.175 329 HB3 LEU 51 HB3 LEU 51 -38.719 2.513 30.523 330 HG LEU 51 HG LEU 51 -37.048 5.019 30.798 331 HD11 LEU 51 HD11 LEU 51 -40.002 4.595 31.249 332 HD12 LEU 51 HD12 LEU 51 -39.277 5.534 29.944 333 HD13 LEU 51 HD13 LEU 51 -39.102 6.069 31.616 334 HD21 LEU 51 HD21 LEU 51 -37.637 4.852 33.170 335 HD22 LEU 51 HD22 LEU 51 -36.734 3.437 32.631 336 HD23 LEU 51 HD23 LEU 51 -38.481 3.334 32.856 337 H MET 52 H MET 52 -35.504 0.121 30.223 338 HA MET 52 HA MET 52 -35.354 -1.837 29.108 339 HB2 MET 52 HB2 MET 52 -38.129 -1.136 28.134 340 HB3 MET 52 HB3 MET 52 -37.358 -2.703 27.932 341 HG2 MET 52 HG2 MET 52 -37.320 -3.060 30.302 342 HG3 MET 52 HG3 MET 52 -37.899 -1.423 30.602 343 HE1 MET 52 HE1 MET 52 -41.574 -1.563 29.323 344 HE2 MET 52 HE2 MET 52 -40.162 -1.038 28.405 345 HE3 MET 52 HE3 MET 52 -40.330 -0.583 30.102 346 H GLU 53 H GLU 53 -34.226 0.458 27.933 347 HA GLU 53 HA GLU 53 -34.659 0.167 25.052 348 HB2 GLU 53 HB2 GLU 53 -33.222 2.280 26.676 349 HB3 GLU 53 HB3 GLU 53 -33.266 2.256 24.919 350 HG2 GLU 53 HG2 GLU 53 -35.666 2.515 24.926 351 HG3 GLU 53 HG3 GLU 53 -35.703 2.397 26.682 352 H TYR 54 H TYR 54 -33.168 -0.661 23.735 353 HA TYR 54 HA TYR 54 -31.001 -2.118 24.997 354 HB2 TYR 54 HB2 TYR 54 -32.060 -2.138 22.156 355 HB3 TYR 54 HB3 TYR 54 -30.750 -3.161 22.730 356 HD1 TYR 54 HD2 TYR 54 -34.374 -2.448 23.141 357 HD2 TYR 54 HD1 TYR 54 -31.203 -5.198 23.825 358 HE1 TYR 54 HE2 TYR 54 -36.010 -4.162 23.791 359 HE2 TYR 54 HE1 TYR 54 -32.831 -6.925 24.466 360 HH TYR 54 HH TYR 54 -35.143 -7.074 25.327 361 H LEU 55 H LEU 55 -28.867 -1.736 24.741 362 HA LEU 55 HA LEU 55 -28.045 0.689 23.371 363 HB2 LEU 55 HB2 LEU 55 -26.495 -1.311 25.023 364 HB3 LEU 55 HB3 LEU 55 -25.744 0.044 24.205 365 HG LEU 55 HG LEU 55 -27.459 1.468 25.587 366 HD11 LEU 55 HD11 LEU 55 -27.956 0.530 27.778 367 HD12 LEU 55 HD12 LEU 55 -27.260 -1.013 27.284 368 HD13 LEU 55 HD13 LEU 55 -28.718 -0.412 26.496 369 HD21 LEU 55 HD21 LEU 55 -25.036 1.592 25.785 370 HD22 LEU 55 HD22 LEU 55 -25.043 0.185 26.849 371 HD23 LEU 55 HD23 LEU 55 -25.811 1.686 27.367 372 H HIS 56 H HIS 56 -26.963 0.781 21.476 373 HA HIS 56 HA HIS 56 -27.003 -1.738 19.989 374 HB2 HIS 56 HB2 HIS 56 -27.184 1.119 19.030 375 HB3 HIS 56 HB3 HIS 56 -27.038 -0.262 17.948 376 HD1 HIS 56 HD1 HIS 56 -29.080 -2.002 18.012 377 HD2 HIS 56 HD2 HIS 56 -29.710 1.630 19.948 378 HE1 HIS 56 HE1 HIS 56 -31.559 -1.890 18.455 379 HE2 HIS 56 HE2 HIS 56 -31.913 0.291 19.671 380 H SER 57 H SER 57 -25.199 -2.721 19.911 381 HA SER 57 HA SER 57 -22.635 -1.585 20.262 382 HB2 SER 57 HB2 SER 57 -23.264 -4.261 19.000 383 HB3 SER 57 HB3 SER 57 -21.811 -3.804 19.888 384 HG SER 57 HG SER 57 -23.240 -3.519 21.744 385 H SER 58 H SER 58 -21.587 -0.377 18.835 386 HA SER 58 HA SER 58 -22.328 -0.393 16.055 387 HB2 SER 58 HB2 SER 58 -20.531 1.387 15.888 388 HB3 SER 58 HB3 SER 58 -21.857 1.755 16.991 389 HG SER 58 HG SER 58 -19.205 1.477 17.502 390 HA PRO 59 HA PRO 59 -19.265 -3.444 14.902 391 HB2 PRO 59 HB2 PRO 59 -19.395 -2.956 12.193 392 HB3 PRO 59 HB3 PRO 59 -20.465 -4.048 13.074 393 HG2 PRO 59 HG2 PRO 59 -20.954 -1.274 12.120 394 HG3 PRO 59 HG3 PRO 59 -22.084 -2.630 12.261 395 HD2 PRO 59 HD2 PRO 59 -21.992 -0.542 14.012 396 HD3 PRO 59 HD3 PRO 59 -22.552 -2.167 14.451 397 H VAL 60 H VAL 60 -17.136 -3.436 14.248 398 HA VAL 60 HA VAL 60 -15.929 -0.797 14.350 399 HB VAL 60 HB VAL 60 -15.156 -2.557 15.884 400 HG11 VAL 60 HG11 VAL 60 -13.804 -4.424 15.133 401 HG12 VAL 60 HG12 VAL 60 -14.104 -3.977 13.453 402 HG13 VAL 60 HG13 VAL 60 -15.441 -4.507 14.474 403 HG21 VAL 60 HG21 VAL 60 -13.638 -0.759 15.352 404 HG22 VAL 60 HG22 VAL 60 -13.029 -1.652 13.956 405 HG23 VAL 60 HG23 VAL 60 -12.753 -2.267 15.587 406 H LEU 61 H LEU 61 -14.836 0.157 12.727 407 HA LEU 61 HA LEU 61 -15.135 -1.034 10.102 408 HB2 LEU 61 HB2 LEU 61 -14.074 1.219 9.332 409 HB3 LEU 61 HB3 LEU 61 -15.746 1.136 9.801 410 HG LEU 61 HG LEU 61 -14.470 3.203 10.454 411 HD11 LEU 61 HD11 LEU 61 -15.801 1.703 12.685 412 HD12 LEU 61 HD12 LEU 61 -16.593 2.694 11.460 413 HD13 LEU 61 HD13 LEU 61 -15.506 3.441 12.630 414 HD21 LEU 61 HD21 LEU 61 -13.208 1.385 12.476 415 HD22 LEU 61 HD22 LEU 61 -13.135 3.150 12.488 416 HD23 LEU 61 HD23 LEU 61 -12.395 2.243 11.168 417 HA PRO 62 HA PRO 62 -10.996 -2.455 9.663 418 HB2 PRO 62 HB2 PRO 62 -10.538 -2.186 7.030 419 HB3 PRO 62 HB3 PRO 62 -11.660 -3.396 7.666 420 HG2 PRO 62 HG2 PRO 62 -12.255 -0.690 6.528 421 HG3 PRO 62 HG3 PRO 62 -13.045 -2.244 6.187 422 HD2 PRO 62 HD2 PRO 62 -14.117 -0.472 7.901 423 HD3 PRO 62 HD3 PRO 62 -14.244 -2.220 8.159 424 H THR 63 H THR 63 -8.913 -1.808 9.446 425 HA THR 63 HA THR 63 -8.503 1.001 8.738 426 HB THR 63 HB THR 63 -8.234 0.396 11.218 427 HG1 THR 63 HG1 THR 63 -7.135 2.194 9.874 428 HG21 THR 63 HG21 THR 63 -7.024 -1.709 10.986 429 HG22 THR 63 HG22 THR 63 -6.116 -0.536 11.943 430 HG23 THR 63 HG23 THR 63 -5.660 -0.850 10.267 431 H ALA 64 H ALA 64 -7.270 1.323 7.029 432 HA ALA 64 HA ALA 64 -5.557 -0.852 6.120 433 HB1 ALA 64 HB1 ALA 64 -5.261 0.459 4.087 434 HB2 ALA 64 HB2 ALA 64 -6.194 1.779 4.796 435 HB3 ALA 64 HB3 ALA 64 -6.972 0.234 4.448 436 H ARG 65 H ARG 65 -3.641 -0.926 6.941 437 HA ARG 65 HA ARG 65 -2.089 1.529 7.274 438 HB2 ARG 65 HB2 ARG 65 -2.179 -0.739 9.294 439 HB3 ARG 65 HB3 ARG 65 -1.131 0.666 9.376 440 HG2 ARG 65 HG2 ARG 65 -3.141 2.095 9.601 441 HG3 ARG 65 HG3 ARG 65 -4.129 0.635 9.646 442 HD2 ARG 65 HD2 ARG 65 -1.920 1.309 11.582 443 HD3 ARG 65 HD3 ARG 65 -3.640 1.535 11.887 444 HE ARG 65 HE ARG 65 -3.323 -1.123 11.204 445 HH11 ARG 65 HH11 ARG 65 -2.077 0.975 13.745 446 HH12 ARG 65 HH12 ARG 65 -2.015 -0.299 14.924 447 HH21 ARG 65 HH21 ARG 65 -3.236 -2.771 12.741 448 HH22 ARG 65 HH22 ARG 65 -2.689 -2.434 14.355 449 H PHE 66 H PHE 66 0.027 1.255 6.570 450 HA PHE 66 HA PHE 66 1.204 -1.353 6.596 451 HB2 PHE 66 HB2 PHE 66 1.764 -1.556 4.251 452 HB3 PHE 66 HB3 PHE 66 0.023 -1.468 4.427 453 HD1 PHE 66 HD2 PHE 66 -1.126 0.730 3.855 454 HD2 PHE 66 HD1 PHE 66 2.918 -0.115 2.839 455 HE1 PHE 66 HE2 PHE 66 -1.191 2.486 2.140 456 HE2 PHE 66 HE1 PHE 66 2.851 1.636 1.117 457 HZ PHE 66 HZ PHE 66 0.795 2.937 0.769 458 H THR 67 H THR 67 3.453 -1.339 6.341 459 HA THR 67 HA THR 67 4.643 1.342 6.368 460 HB THR 67 HB THR 67 4.860 -0.047 8.499 461 HG1 THR 67 HG1 THR 67 6.274 1.700 7.971 462 HG21 THR 67 HG21 THR 67 5.314 -2.249 7.528 463 HG22 THR 67 HG22 THR 67 6.643 -1.737 8.569 464 HG23 THR 67 HG23 THR 67 6.810 -1.637 6.817 465 H SER 68 H SER 68 6.652 1.568 5.280 466 HA SER 68 HA SER 68 7.121 -0.453 3.182 467 HB2 SER 68 HB2 SER 68 6.190 1.723 2.344 468 HB3 SER 68 HB3 SER 68 7.603 2.543 3.005 469 HG SER 68 HG SER 68 8.471 2.118 1.138 470 H ASP 69 H ASP 69 9.403 -0.632 2.510 471 HA ASP 69 HA ASP 69 11.192 -0.715 4.720 472 HB2 ASP 69 HB2 ASP 69 11.342 -2.262 2.759 473 HB3 ASP 69 HB3 ASP 69 11.848 -0.903 1.759 474 H ILE 70 H ILE 70 11.345 1.168 1.703 475 HA ILE 70 HA ILE 70 12.345 3.419 3.289 476 HB ILE 70 HB ILE 70 13.332 4.292 1.102 477 HG12 ILE 70 HG12 ILE 70 14.093 2.053 -0.249 478 HG13 ILE 70 HG13 ILE 70 12.454 1.610 0.202 479 HG21 ILE 70 HG21 ILE 70 14.519 1.832 2.359 480 HG22 ILE 70 HG22 ILE 70 14.721 3.500 2.899 481 HG23 ILE 70 HG23 ILE 70 15.390 2.985 1.350 482 HD11 ILE 70 HD11 ILE 70 11.607 3.614 -0.902 483 HD12 ILE 70 HD12 ILE 70 12.529 2.601 -2.015 484 HD13 ILE 70 HD13 ILE 70 13.252 4.067 -1.349 485 H THR 71 H THR 71 11.206 5.246 3.252 486 HA THR 71 HA THR 71 8.943 5.496 1.441 487 HB THR 71 HB THR 71 8.713 7.766 2.671 488 HG1 THR 71 HG1 THR 71 9.711 7.151 4.953 489 HG21 THR 71 HG21 THR 71 7.555 6.704 4.546 490 HG22 THR 71 HG22 THR 71 8.349 5.175 4.169 491 HG23 THR 71 HG23 THR 71 7.209 5.884 3.023 492 H GLU 72 H GLU 72 12.185 6.445 1.778 493 HA GLU 72 HA GLU 72 12.140 7.856 -0.737 494 HB2 GLU 72 HB2 GLU 72 11.795 9.581 1.085 495 HB3 GLU 72 HB3 GLU 72 13.387 9.146 1.694 496 HG2 GLU 72 HG2 GLU 72 14.360 9.784 -0.485 497 HG3 GLU 72 HG3 GLU 72 12.761 10.297 -1.018 498 H GLY 73 H GLY 73 13.987 7.481 -1.832 499 HA2 GLY 73 HA2 GLY 73 16.546 7.145 -1.200 500 HA3 GLY 73 HA3 GLY 73 15.880 5.610 -0.648 501 H PHE 74 H PHE 74 17.479 4.886 -2.376 502 HA PHE 74 HA PHE 74 16.624 5.328 -5.097 503 HB2 PHE 74 HB2 PHE 74 18.483 3.759 -5.697 504 HB3 PHE 74 HB3 PHE 74 19.010 5.135 -4.743 505 HD1 PHE 74 HD1 PHE 74 19.633 4.803 -2.348 506 HD2 PHE 74 HD2 PHE 74 18.784 1.534 -4.939 507 HE1 PHE 74 HE1 PHE 74 20.764 3.275 -0.791 508 HE2 PHE 74 HE2 PHE 74 19.907 0.000 -3.379 509 HZ PHE 74 HZ PHE 74 20.897 0.871 -1.301 510 H ALA 75 H ALA 75 15.422 4.021 -6.318 511 HA ALA 75 HA ALA 75 13.568 2.260 -5.425 512 HB1 ALA 75 HB1 ALA 75 14.854 2.177 -8.146 513 HB2 ALA 75 HB2 ALA 75 13.590 3.305 -7.649 514 HB3 ALA 75 HB3 ALA 75 13.251 1.574 -7.727 515 HA PRO 76 HA PRO 76 16.126 -1.338 -4.579 516 HB2 PRO 76 HB2 PRO 76 14.401 -2.494 -2.820 517 HB3 PRO 76 HB3 PRO 76 15.489 -1.170 -2.401 518 HG2 PRO 76 HG2 PRO 76 12.581 -1.159 -2.706 519 HG3 PRO 76 HG3 PRO 76 13.631 0.030 -1.921 520 HD2 PRO 76 HD2 PRO 76 12.430 0.136 -4.547 521 HD3 PRO 76 HD3 PRO 76 13.397 1.375 -3.721 522 H LEU 77 H LEU 77 15.753 -3.758 -4.466 523 HA LEU 77 HA LEU 77 14.266 -4.545 -6.835 524 HB2 LEU 77 HB2 LEU 77 15.574 -6.458 -6.931 525 HB3 LEU 77 HB3 LEU 77 16.676 -5.267 -6.286 526 HG LEU 77 HG LEU 77 15.233 -7.271 -4.544 527 HD11 LEU 77 HD11 LEU 77 17.995 -7.472 -5.725 528 HD12 LEU 77 HD12 LEU 77 16.593 -8.421 -6.218 529 HD13 LEU 77 HD13 LEU 77 17.251 -8.601 -4.591 530 HD21 LEU 77 HD21 LEU 77 17.688 -5.577 -4.073 531 HD22 LEU 77 HD22 LEU 77 17.054 -6.795 -2.967 532 HD23 LEU 77 HD23 LEU 77 16.102 -5.355 -3.330 533 H SER 78 H SER 78 13.928 -4.586 -3.471 534 HA SER 78 HA SER 78 11.348 -5.856 -3.736 535 HB2 SER 78 HB2 SER 78 11.848 -7.259 -1.650 536 HB3 SER 78 HB3 SER 78 12.565 -7.807 -3.163 537 HG SER 78 HG SER 78 14.348 -7.771 -2.035 538 H VAL 79 H VAL 79 10.158 -4.192 -3.097 539 HA VAL 79 HA VAL 79 10.899 -2.529 -0.874 540 HB VAL 79 HB VAL 79 8.249 -2.704 -2.361 541 HG11 VAL 79 HG11 VAL 79 7.967 -1.740 -0.125 542 HG12 VAL 79 HG12 VAL 79 7.762 -0.517 -1.378 543 HG13 VAL 79 HG13 VAL 79 9.262 -0.588 -0.453 544 HG21 VAL 79 HG21 VAL 79 9.007 -0.680 -3.493 545 HG22 VAL 79 HG22 VAL 79 10.100 -2.034 -3.788 546 HG23 VAL 79 HG23 VAL 79 10.545 -0.775 -2.635 547 H ARG 80 H ARG 80 10.789 -3.218 1.129 548 HA ARG 80 HA ARG 80 9.263 -5.550 1.843 549 HB2 ARG 80 HB2 ARG 80 10.962 -3.683 3.511 550 HB3 ARG 80 HB3 ARG 80 10.218 -5.154 4.117 551 HG2 ARG 80 HG2 ARG 80 12.201 -5.088 1.856 552 HG3 ARG 80 HG3 ARG 80 12.638 -5.344 3.547 553 HD2 ARG 80 HD2 ARG 80 10.786 -7.069 1.907 554 HD3 ARG 80 HD3 ARG 80 12.447 -7.461 2.347 555 HE ARG 80 HE ARG 80 10.707 -6.931 4.593 556 HH11 ARG 80 HH11 ARG 80 11.923 -9.420 2.425 557 HH12 ARG 80 HH12 ARG 80 11.630 -10.715 3.549 558 HH21 ARG 80 HH21 ARG 80 10.304 -8.613 6.047 559 HH22 ARG 80 HH22 ARG 80 10.692 -10.252 5.620 560 H PHE 81 H PHE 81 7.132 -5.019 1.634 561 HA PHE 81 HA PHE 81 6.152 -2.877 3.359 562 HB2 PHE 81 HB2 PHE 81 4.071 -2.907 2.030 563 HB3 PHE 81 HB3 PHE 81 5.480 -2.567 1.041 564 HD1 PHE 81 HD2 PHE 81 6.324 -4.303 -0.531 565 HD2 PHE 81 HD1 PHE 81 2.690 -4.790 1.622 566 HE1 PHE 81 HE2 PHE 81 5.643 -6.074 -2.091 567 HE2 PHE 81 HE1 PHE 81 2.002 -6.559 0.063 568 HZ PHE 81 HZ PHE 81 3.479 -7.205 -1.795 569 H LYS 82 H LYS 82 5.113 -3.338 5.132 570 HA LYS 82 HA LYS 82 3.885 -5.994 5.367 571 HB2 LYS 82 HB2 LYS 82 5.539 -4.491 7.346 572 HB3 LYS 82 HB3 LYS 82 4.217 -5.485 7.944 573 HG2 LYS 82 HG2 LYS 82 6.463 -6.457 6.184 574 HG3 LYS 82 HG3 LYS 82 6.354 -6.692 7.931 575 HD2 LYS 82 HD2 LYS 82 4.399 -8.033 7.709 576 HD3 LYS 82 HD3 LYS 82 4.233 -7.621 6.005 577 HE2 LYS 82 HE2 LYS 82 6.418 -8.783 5.610 578 HE3 LYS 82 HE3 LYS 82 6.353 -9.330 7.288 579 HZ1 LYS 82 HZ1 LYS 82 4.267 -10.444 6.818 580 HZ2 LYS 82 HZ2 LYS 82 5.464 -10.993 5.753 581 HZ3 LYS 82 HZ3 LYS 82 4.294 -9.892 5.218 582 H ASP 83 H ASP 83 1.811 -6.003 5.649 583 HA ASP 83 HA ASP 83 0.498 -3.437 5.998 584 HB2 ASP 83 HB2 ASP 83 -1.301 -4.258 4.849 585 HB3 ASP 83 HB3 ASP 83 -0.031 -5.247 4.149 586 H PHE 84 H PHE 84 -1.036 -3.043 7.533 587 HA PHE 84 HA PHE 84 -0.995 -4.866 9.856 588 HB2 PHE 84 HB2 PHE 84 -0.832 -1.836 9.946 589 HB3 PHE 84 HB3 PHE 84 -0.908 -2.899 11.343 590 HD1 PHE 84 HD2 PHE 84 1.030 -4.724 11.413 591 HD2 PHE 84 HD1 PHE 84 1.203 -1.035 9.294 592 HE1 PHE 84 HE2 PHE 84 3.486 -4.821 11.447 593 HE2 PHE 84 HE1 PHE 84 3.660 -1.129 9.328 594 HZ PHE 84 HZ PHE 84 4.804 -3.022 10.406 595 H SER 85 H SER 85 -2.862 -4.424 7.623 596 HA SER 85 HA SER 85 -5.117 -2.992 8.356 597 HB2 SER 85 HB2 SER 85 -5.134 -5.578 6.814 598 HB3 SER 85 HB3 SER 85 -6.283 -4.243 6.696 599 HG SER 85 HG SER 85 -3.762 -4.524 5.595 600 H GLU 86 H GLU 86 -6.386 -3.162 9.969 601 HA GLU 86 HA GLU 86 -6.766 -5.739 11.329 602 HB2 GLU 86 HB2 GLU 86 -5.331 -4.113 12.579 603 HB3 GLU 86 HB3 GLU 86 -6.652 -2.963 12.536 604 HG2 GLU 86 HG2 GLU 86 -8.012 -4.531 13.865 605 HG3 GLU 86 HG3 GLU 86 -6.631 -5.619 13.953 606 H ASN 87 H ASN 87 -8.856 -6.086 12.065 607 HA ASN 87 HA ASN 87 -11.133 -6.081 12.129 608 HB2 ASN 87 HB2 ASN 87 -10.928 -3.100 11.639 609 HB3 ASN 87 HB3 ASN 87 -12.323 -3.959 12.283 610 HD21 ASN 87 HD21 ASN 87 -10.085 -1.922 13.182 611 HD22 ASN 87 HD22 ASN 87 -9.752 -2.428 14.800 612 H ALA 88 H ALA 88 -9.609 -6.369 9.632 613 HA ALA 88 HA ALA 88 -11.528 -5.398 7.618 614 HB1 ALA 88 HB1 ALA 88 -9.316 -4.415 7.343 615 HB2 ALA 88 HB2 ALA 88 -9.660 -5.530 6.018 616 HB3 ALA 88 HB3 ALA 88 -8.588 -6.022 7.329 617 H THR 89 H THR 89 -12.306 -6.828 6.128 618 HA THR 89 HA THR 89 -11.814 -9.640 6.730 619 HB THR 89 HB THR 89 -13.822 -9.874 5.060 620 HG1 THR 89 HG1 THR 89 -15.174 -8.040 5.094 621 HG21 THR 89 HG21 THR 89 -13.912 -10.488 7.421 622 HG22 THR 89 HG22 THR 89 -15.388 -9.643 6.954 623 HG23 THR 89 HG23 THR 89 -14.138 -8.795 7.865 624 H SER 90 H SER 90 -11.849 -7.398 3.955 625 HA SER 90 HA SER 90 -10.158 -9.308 2.510 626 HB2 SER 90 HB2 SER 90 -11.388 -8.382 0.414 627 HB3 SER 90 HB3 SER 90 -12.188 -9.607 1.397 628 HG SER 90 HG SER 90 -13.724 -8.232 1.746 629 H ARG 91 H ARG 91 -8.834 -8.313 0.799 630 HA ARG 91 HA ARG 91 -8.411 -5.429 1.070 631 HB2 ARG 91 HB2 ARG 91 -6.040 -5.631 1.455 632 HB3 ARG 91 HB3 ARG 91 -6.901 -6.514 2.703 633 HG2 ARG 91 HG2 ARG 91 -6.467 -8.575 1.190 634 HG3 ARG 91 HG3 ARG 91 -5.223 -7.553 0.464 635 HD2 ARG 91 HD2 ARG 91 -4.201 -8.843 2.207 636 HD3 ARG 91 HD3 ARG 91 -4.307 -7.166 2.751 637 HE ARG 91 HE ARG 91 -6.601 -8.565 3.601 638 HH11 ARG 91 HH11 ARG 91 -3.159 -8.498 4.293 639 HH12 ARG 91 HH12 ARG 91 -3.363 -8.937 5.956 640 HH21 ARG 91 HH21 ARG 91 -6.855 -9.172 5.762 641 HH22 ARG 91 HH22 ARG 91 -5.466 -9.338 6.784 642 H LEU 92 H LEU 92 -7.056 -4.511 -0.584 643 HA LEU 92 HA LEU 92 -6.760 -6.068 -3.048 644 HB2 LEU 92 HB2 LEU 92 -9.035 -4.716 -2.705 645 HB3 LEU 92 HB3 LEU 92 -8.034 -3.364 -3.177 646 HG LEU 92 HG LEU 92 -8.220 -5.799 -4.932 647 HD11 LEU 92 HD11 LEU 92 -10.116 -3.454 -4.904 648 HD12 LEU 92 HD12 LEU 92 -10.510 -5.110 -4.439 649 HD13 LEU 92 HD13 LEU 92 -10.073 -4.743 -6.108 650 HD21 LEU 92 HD21 LEU 92 -7.776 -2.874 -5.544 651 HD22 LEU 92 HD22 LEU 92 -7.745 -4.208 -6.699 652 HD23 LEU 92 HD23 LEU 92 -6.510 -4.100 -5.445 653 H TRP 93 H TRP 93 -4.727 -5.652 -3.762 654 HA TRP 93 HA TRP 93 -3.428 -3.171 -2.982 655 HB2 TRP 93 HB2 TRP 93 -2.419 -5.665 -4.343 656 HB3 TRP 93 HB3 TRP 93 -1.437 -4.212 -4.193 657 HD1 TRP 93 HD1 TRP 93 -2.410 -7.293 -2.344 658 HE1 TRP 93 HE1 TRP 93 -1.392 -7.260 0.018 659 HE3 TRP 93 HE3 TRP 93 -0.914 -2.402 -2.179 660 HZ2 TRP 93 HZ2 TRP 93 -0.159 -5.386 1.747 661 HZ3 TRP 93 HZ3 TRP 93 0.176 -1.570 -0.135 662 HH2 TRP 93 HH2 TRP 93 0.543 -3.032 1.784 663 H MET 94 H MET 94 -3.760 -1.452 -4.169 664 HA MET 94 HA MET 94 -4.188 -1.783 -7.046 665 HB2 MET 94 HB2 MET 94 -4.727 0.563 -5.225 666 HB3 MET 94 HB3 MET 94 -4.855 0.653 -6.973 667 HG2 MET 94 HG2 MET 94 -6.540 -1.136 -6.919 668 HG3 MET 94 HG3 MET 94 -6.456 -1.130 -5.159 669 HE1 MET 94 HE1 MET 94 -9.127 -0.809 -5.135 670 HE2 MET 94 HE2 MET 94 -9.116 -0.798 -6.899 671 HE3 MET 94 HE3 MET 94 -9.947 0.482 -6.013 672 H PHE 95 H PHE 95 -2.230 -2.046 -7.885 673 HA PHE 95 HA PHE 95 -0.114 -0.145 -7.308 674 HB2 PHE 95 HB2 PHE 95 0.384 -2.565 -7.497 675 HB3 PHE 95 HB3 PHE 95 -0.185 -2.545 -9.162 676 HD1 PHE 95 HD1 PHE 95 2.231 -0.648 -7.034 677 HD2 PHE 95 HD2 PHE 95 1.432 -2.516 -10.772 678 HE1 PHE 95 HE1 PHE 95 4.497 -0.085 -7.796 679 HE2 PHE 95 HE2 PHE 95 3.700 -1.956 -11.540 680 HZ PHE 95 HZ PHE 95 5.234 -0.737 -10.053 681 H GLY 96 H GLY 96 -2.424 -0.965 -9.808 682 HA2 GLY 96 HA2 GLY 96 -3.259 0.645 -11.338 683 HA3 GLY 96 HA3 GLY 96 -1.745 1.521 -11.201 684 H ASP 97 H ASP 97 -1.024 -1.698 -11.569 685 HA ASP 97 HA ASP 97 -0.842 -1.431 -14.484 686 HB2 ASP 97 HB2 ASP 97 1.353 -0.820 -13.510 687 HB3 ASP 97 HB3 ASP 97 1.429 -2.392 -12.729 688 H GLY 98 H GLY 98 -1.684 -3.085 -15.483 689 HA2 GLY 98 HA2 GLY 98 -2.207 -5.252 -16.041 690 HA3 GLY 98 HA3 GLY 98 -1.222 -5.793 -14.686 691 H ASN 99 H ASN 99 -2.491 -7.173 -13.682 692 HA ASN 99 HA ASN 99 -5.255 -6.525 -13.104 693 HB2 ASN 99 HB2 ASN 99 -4.617 -8.764 -13.988 694 HB3 ASN 99 HB3 ASN 99 -3.678 -9.042 -12.533 695 HD21 ASN 99 HD21 ASN 99 -4.686 -9.517 -10.651 696 HD22 ASN 99 HD22 ASN 99 -6.356 -9.893 -10.560 697 H THR 100 H THR 100 -5.802 -5.602 -11.267 698 HA THR 100 HA THR 100 -3.853 -5.251 -9.166 699 HB THR 100 HB THR 100 -5.707 -3.908 -8.063 700 HG1 THR 100 HG1 THR 100 -7.119 -4.987 -10.106 701 HG21 THR 100 HG21 THR 100 -5.428 -2.005 -9.594 702 HG22 THR 100 HG22 THR 100 -4.778 -3.087 -10.824 703 HG23 THR 100 HG23 THR 100 -3.902 -2.839 -9.312 704 H SER 101 H SER 101 -4.907 -5.303 -6.861 705 HA SER 101 HA SER 101 -4.999 -6.595 -5.073 706 HB2 SER 101 HB2 SER 101 -6.756 -8.189 -4.712 707 HB3 SER 101 HB3 SER 101 -7.405 -6.821 -5.601 708 HG SER 101 HG SER 101 -8.218 -8.751 -6.424 709 H ASP 102 H ASP 102 -5.282 -9.177 -7.545 710 HA ASP 102 HA ASP 102 -2.951 -10.440 -6.289 711 HB2 ASP 102 HB2 ASP 102 -5.002 -11.827 -6.505 712 HB3 ASP 102 HB3 ASP 102 -4.951 -11.605 -8.252 713 H SER 103 H SER 103 -1.202 -9.521 -7.119 714 HA SER 103 HA SER 103 -0.926 -9.408 -10.036 715 HB2 SER 103 HB2 SER 103 0.732 -8.041 -7.893 716 HB3 SER 103 HB3 SER 103 0.934 -7.843 -9.633 717 HG SER 103 HG SER 103 -1.505 -7.248 -9.377 718 HA PRO 104 HA PRO 104 1.648 -13.021 -9.157 719 HB2 PRO 104 HB2 PRO 104 1.628 -14.076 -11.635 720 HB3 PRO 104 HB3 PRO 104 0.247 -14.198 -10.542 721 HG2 PRO 104 HG2 PRO 104 0.655 -12.417 -12.894 722 HG3 PRO 104 HG3 PRO 104 -0.829 -13.181 -12.296 723 HD2 PRO 104 HD2 PRO 104 -0.089 -10.530 -11.868 724 HD3 PRO 104 HD3 PRO 104 -1.304 -11.425 -10.940 725 H SER 105 H SER 105 2.296 -10.419 -11.286 726 HA SER 105 HA SER 105 4.896 -11.328 -12.150 727 HB2 SER 105 HB2 SER 105 3.610 -8.602 -12.468 728 HB3 SER 105 HB3 SER 105 4.888 -9.307 -13.461 729 HG SER 105 HG SER 105 3.203 -9.813 -14.665 730 HA PRO 106 HA PRO 106 7.136 -9.122 -8.877 731 HB2 PRO 106 HB2 PRO 106 9.217 -8.300 -10.768 732 HB3 PRO 106 HB3 PRO 106 9.319 -9.433 -9.416 733 HG2 PRO 106 HG2 PRO 106 9.441 -10.261 -11.979 734 HG3 PRO 106 HG3 PRO 106 8.688 -11.235 -10.703 735 HD2 PRO 106 HD2 PRO 106 7.378 -9.485 -12.763 736 HD3 PRO 106 HD3 PRO 106 6.931 -11.121 -12.227 737 H LEU 107 H LEU 107 5.201 -7.564 -9.344 738 HA LEU 107 HA LEU 107 6.085 -4.966 -10.362 739 HB2 LEU 107 HB2 LEU 107 3.340 -5.883 -9.472 740 HB3 LEU 107 HB3 LEU 107 3.712 -4.346 -10.229 741 HG LEU 107 HG LEU 107 3.994 -7.055 -11.536 742 HD11 LEU 107 HD11 LEU 107 2.118 -6.339 -12.920 743 HD12 LEU 107 HD12 LEU 107 1.976 -4.862 -11.964 744 HD13 LEU 107 HD13 LEU 107 1.675 -6.432 -11.216 745 HD21 LEU 107 HD21 LEU 107 4.381 -4.288 -12.685 746 HD22 LEU 107 HD22 LEU 107 4.408 -5.799 -13.593 747 HD23 LEU 107 HD23 LEU 107 5.651 -5.478 -12.383 748 H HIS 108 H HIS 108 6.302 -6.566 -7.589 749 HA HIS 108 HA HIS 108 5.903 -4.324 -5.778 750 HB2 HIS 108 HB2 HIS 108 6.695 -5.860 -4.022 751 HB3 HIS 108 HB3 HIS 108 5.396 -6.586 -4.948 752 HD1 HIS 108 HD1 HIS 108 8.714 -7.277 -3.691 753 HD2 HIS 108 HD2 HIS 108 6.416 -8.594 -6.903 754 HE1 HIS 108 HE1 HIS 108 9.826 -9.389 -4.492 755 HE2 HIS 108 HE2 HIS 108 8.295 -10.282 -6.289 756 H THR 109 H THR 109 8.026 -5.042 -8.053 757 HA THR 109 HA THR 109 10.412 -4.046 -6.666 758 HB THR 109 HB THR 109 10.191 -5.461 -9.342 759 HG1 THR 109 HG1 THR 109 11.412 -6.698 -7.156 760 HG21 THR 109 HG21 THR 109 12.614 -5.721 -9.174 761 HG22 THR 109 HG22 THR 109 12.614 -4.844 -7.643 762 HG23 THR 109 HG23 THR 109 12.168 -4.013 -9.135 763 H PHE 110 H PHE 110 11.009 -1.986 -7.134 764 HA PHE 110 HA PHE 110 9.879 -0.739 -9.523 765 HB2 PHE 110 HB2 PHE 110 11.340 0.524 -7.186 766 HB3 PHE 110 HB3 PHE 110 10.701 1.404 -8.573 767 HD1 PHE 110 HD1 PHE 110 8.094 0.553 -9.047 768 HD2 PHE 110 HD2 PHE 110 10.087 0.801 -5.297 769 HE1 PHE 110 HE1 PHE 110 5.924 0.724 -7.907 770 HE2 PHE 110 HE2 PHE 110 7.918 0.973 -4.155 771 HZ PHE 110 HZ PHE 110 5.838 0.921 -5.451 772 H PHE 111 H PHE 111 10.990 -1.057 -11.253 773 HA PHE 111 HA PHE 111 13.846 -1.552 -11.201 774 HB2 PHE 111 HB2 PHE 111 11.886 -1.456 -13.509 775 HB3 PHE 111 HB3 PHE 111 13.572 -1.931 -13.641 776 HD1 PHE 111 HD1 PHE 111 14.331 -3.978 -12.341 777 HD2 PHE 111 HD2 PHE 111 10.238 -3.023 -13.006 778 HE1 PHE 111 HE1 PHE 111 13.718 -6.318 -11.907 779 HE2 PHE 111 HE2 PHE 111 9.617 -5.362 -12.564 780 HZ PHE 111 HZ PHE 111 11.358 -7.014 -12.018 781 H ASN 112 H ASN 112 11.671 1.035 -11.897 782 HA ASN 112 HA ASN 112 13.801 2.572 -13.216 783 HB2 ASN 112 HB2 ASN 112 10.791 2.893 -13.380 784 HB3 ASN 112 HB3 ASN 112 11.950 3.967 -14.145 785 HD21 ASN 112 HD21 ASN 112 13.058 3.288 -15.956 786 HD22 ASN 112 HD22 ASN 112 12.607 1.880 -16.855 787 H GLU 113 H GLU 113 14.026 4.785 -12.688 788 HA GLU 113 HA GLU 113 13.468 5.453 -9.929 789 HB2 GLU 113 HB2 GLU 113 15.637 5.928 -11.104 790 HB3 GLU 113 HB3 GLU 113 14.782 7.092 -12.099 791 HG2 GLU 113 HG2 GLU 113 14.108 8.059 -9.722 792 HG3 GLU 113 HG3 GLU 113 15.620 7.270 -9.273 793 H GLY 114 H GLY 114 11.898 6.825 -9.235 794 HA2 GLY 114 HA2 GLY 114 10.792 8.995 -10.519 795 HA3 GLY 114 HA3 GLY 114 9.819 7.630 -11.046 796 H GLU 115 H GLU 115 8.276 9.240 -9.885 797 HA GLU 115 HA GLU 115 8.202 8.711 -7.004 798 HB2 GLU 115 HB2 GLU 115 7.953 11.047 -7.866 799 HB3 GLU 115 HB3 GLU 115 6.453 10.556 -8.638 800 HG2 GLU 115 HG2 GLU 115 5.483 10.041 -6.462 801 HG3 GLU 115 HG3 GLU 115 6.998 10.479 -5.674 802 H TYR 116 H TYR 116 7.005 7.080 -6.304 803 HA TYR 116 HA TYR 116 4.866 6.074 -8.061 804 HB2 TYR 116 HB2 TYR 116 6.713 4.518 -6.235 805 HB3 TYR 116 HB3 TYR 116 5.368 3.821 -7.140 806 HD1 TYR 116 HD1 TYR 116 5.398 4.219 -9.702 807 HD2 TYR 116 HD2 TYR 116 8.830 4.577 -7.216 808 HE1 TYR 116 HE1 TYR 116 6.841 3.952 -11.668 809 HE2 TYR 116 HE2 TYR 116 10.285 4.310 -9.182 810 HH TYR 116 HH TYR 116 9.218 4.661 -12.290 811 H ILE 117 H ILE 117 3.067 5.057 -7.030 812 HA ILE 117 HA ILE 117 2.645 5.980 -4.268 813 HB ILE 117 HB ILE 117 0.543 6.085 -6.458 814 HG12 ILE 117 HG12 ILE 117 1.861 8.425 -5.056 815 HG13 ILE 117 HG13 ILE 117 2.392 7.830 -6.622 816 HG21 ILE 117 HG21 ILE 117 0.508 6.961 -3.572 817 HG22 ILE 117 HG22 ILE 117 -0.419 5.642 -4.290 818 HG23 ILE 117 HG23 ILE 117 -0.762 7.312 -4.746 819 HD11 ILE 117 HD11 ILE 117 0.955 9.780 -6.834 820 HD12 ILE 117 HD12 ILE 117 -0.341 8.925 -5.999 821 HD13 ILE 117 HD13 ILE 117 0.216 8.359 -7.574 822 H VAL 118 H VAL 118 2.398 4.263 -3.017 823 HA VAL 118 HA VAL 118 1.116 1.838 -4.080 824 HB VAL 118 HB VAL 118 2.630 2.188 -1.473 825 HG11 VAL 118 HG11 VAL 118 0.992 0.381 -1.363 826 HG12 VAL 118 HG12 VAL 118 2.638 -0.254 -1.360 827 HG13 VAL 118 HG13 VAL 118 1.668 -0.327 -2.831 828 HG21 VAL 118 HG21 VAL 118 4.126 2.435 -3.370 829 HG22 VAL 118 HG22 VAL 118 3.526 0.926 -4.059 830 HG23 VAL 118 HG23 VAL 118 4.427 0.907 -2.543 831 H SER 119 H SER 119 -0.947 1.393 -3.537 832 HA SER 119 HA SER 119 -2.026 2.682 -1.130 833 HB2 SER 119 HB2 SER 119 -2.845 3.779 -3.210 834 HB3 SER 119 HB3 SER 119 -3.560 2.244 -3.697 835 HG SER 119 HG SER 119 -4.172 3.434 -1.205 836 H LEU 120 H LEU 120 -2.757 1.383 0.302 837 HA LEU 120 HA LEU 120 -3.636 -1.337 -0.377 838 HB2 LEU 120 HB2 LEU 120 -1.884 -1.267 1.283 839 HB3 LEU 120 HB3 LEU 120 -2.731 -0.052 2.203 840 HG LEU 120 HG LEU 120 -4.327 -1.691 3.021 841 HD11 LEU 120 HD11 LEU 120 -4.527 -3.066 0.968 842 HD12 LEU 120 HD12 LEU 120 -4.231 -4.038 2.410 843 HD13 LEU 120 HD13 LEU 120 -2.917 -3.717 1.278 844 HD21 LEU 120 HD21 LEU 120 -1.524 -2.738 3.119 845 HD22 LEU 120 HD22 LEU 120 -2.831 -3.140 4.233 846 HD23 LEU 120 HD23 LEU 120 -2.212 -1.489 4.157 847 H ILE 121 H ILE 121 -5.779 -1.496 -0.645 848 HA ILE 121 HA ILE 121 -7.468 0.192 1.052 849 HB ILE 121 HB ILE 121 -7.692 0.963 -1.222 850 HG12 ILE 121 HG12 ILE 121 -9.783 0.715 0.293 851 HG13 ILE 121 HG13 ILE 121 -9.994 1.131 -1.394 852 HG21 ILE 121 HG21 ILE 121 -8.386 -1.841 -2.035 853 HG22 ILE 121 HG22 ILE 121 -6.970 -0.898 -2.503 854 HG23 ILE 121 HG23 ILE 121 -8.573 -0.415 -3.057 855 HD11 ILE 121 HD11 ILE 121 -11.674 -0.446 -0.636 856 HD12 ILE 121 HD12 ILE 121 -10.415 -1.601 -0.198 857 HD13 ILE 121 HD13 ILE 121 -10.659 -1.160 -1.889 858 H VAL 122 H VAL 122 -8.605 -0.864 2.460 859 HA VAL 122 HA VAL 122 -9.111 -3.718 1.990 860 HB VAL 122 HB VAL 122 -9.336 -3.967 4.462 861 HG11 VAL 122 HG11 VAL 122 -6.926 -3.878 4.940 862 HG12 VAL 122 HG12 VAL 122 -6.687 -2.930 3.471 863 HG13 VAL 122 HG13 VAL 122 -7.277 -4.590 3.366 864 HG21 VAL 122 HG21 VAL 122 -8.422 -2.249 5.944 865 HG22 VAL 122 HG22 VAL 122 -9.830 -1.649 5.064 866 HG23 VAL 122 HG23 VAL 122 -8.205 -1.169 4.567 867 H SER 123 H SER 123 -11.141 -4.557 2.631 868 HA SER 123 HA SER 123 -13.232 -2.526 2.830 869 HB2 SER 123 HB2 SER 123 -14.577 -3.997 1.217 870 HB3 SER 123 HB3 SER 123 -13.306 -2.996 0.525 871 HG SER 123 HG SER 123 -13.114 -5.765 1.155 872 H ASN 124 H ASN 124 -15.148 -3.208 3.713 873 HA ASN 124 HA ASN 124 -15.462 -5.789 4.948 874 HB2 ASN 124 HB2 ASN 124 -13.906 -4.545 6.494 875 HB3 ASN 124 HB3 ASN 124 -15.091 -3.264 6.614 876 HD21 ASN 124 HD21 ASN 124 -14.275 -6.513 7.530 877 HD22 ASN 124 HD22 ASN 124 -15.420 -6.650 8.814 878 H GLU 125 H GLU 125 -17.749 -5.561 6.262 879 HA GLU 125 HA GLU 125 -19.476 -4.257 4.336 880 HB2 GLU 125 HB2 GLU 125 -21.343 -5.327 5.566 881 HB3 GLU 125 HB3 GLU 125 -20.149 -6.461 4.967 882 HG2 GLU 125 HG2 GLU 125 -19.875 -5.526 7.771 883 HG3 GLU 125 HG3 GLU 125 -21.189 -6.644 7.390 884 H ASN 126 H ASN 126 -18.011 -3.289 7.171 885 HA ASN 126 HA ASN 126 -20.148 -1.496 7.994 886 HB2 ASN 126 HB2 ASN 126 -18.510 -2.597 9.616 887 HB3 ASN 126 HB3 ASN 126 -17.291 -1.496 8.980 888 HD21 ASN 126 HD21 ASN 126 -17.006 -0.477 10.897 889 HD22 ASN 126 HD22 ASN 126 -18.181 0.568 11.607 890 H ASP 127 H ASP 127 -16.793 -1.194 6.878 891 HA ASP 127 HA ASP 127 -17.423 1.156 5.285 892 HB2 ASP 127 HB2 ASP 127 -16.934 1.986 7.601 893 HB3 ASP 127 HB3 ASP 127 -15.365 1.206 7.521 894 H SER 128 H SER 128 -15.525 1.741 3.903 895 HA SER 128 HA SER 128 -13.457 -0.339 3.813 896 HB2 SER 128 HB2 SER 128 -13.251 0.300 1.327 897 HB3 SER 128 HB3 SER 128 -14.649 -0.669 1.798 898 HG SER 128 HG SER 128 -15.939 1.143 1.688 899 H ASP 129 H ASP 129 -11.379 0.354 3.908 900 HA ASP 129 HA ASP 129 -10.965 3.268 4.103 901 HB2 ASP 129 HB2 ASP 129 -11.109 2.071 6.319 902 HB3 ASP 129 HB3 ASP 129 -9.687 1.149 5.851 903 H SER 130 H SER 130 -8.974 4.048 3.294 904 HA SER 130 HA SER 130 -7.170 2.049 2.161 905 HB2 SER 130 HB2 SER 130 -7.010 3.521 0.084 906 HB3 SER 130 HB3 SER 130 -8.487 2.572 0.267 907 HG SER 130 HG SER 130 -9.473 4.481 1.139 908 H ALA 131 H ALA 131 -5.120 2.447 2.465 909 HA ALA 131 HA ALA 131 -4.260 5.137 3.318 910 HB1 ALA 131 HB1 ALA 131 -2.323 4.051 4.327 911 HB2 ALA 131 HB2 ALA 131 -2.887 2.483 3.749 912 HB3 ALA 131 HB3 ALA 131 -3.819 3.365 4.960 913 H SER 132 H SER 132 -2.348 5.996 2.396 914 HA SER 132 HA SER 132 -1.173 4.661 0.118 915 HB2 SER 132 HB2 SER 132 -3.179 5.730 -0.833 916 HB3 SER 132 HB3 SER 132 -2.681 7.278 -0.156 917 HG SER 132 HG SER 132 -2.104 7.103 -2.338 918 H VAL 133 H VAL 133 0.915 5.348 -0.212 919 HA VAL 133 HA VAL 133 1.757 7.778 1.159 920 HB VAL 133 HB VAL 133 2.203 5.854 2.689 921 HG11 VAL 133 HG11 VAL 133 4.099 4.360 2.226 922 HG12 VAL 133 HG12 VAL 133 4.132 4.961 0.569 923 HG13 VAL 133 HG13 VAL 133 2.718 4.091 1.164 924 HG21 VAL 133 HG21 VAL 133 4.497 6.484 3.260 925 HG22 VAL 133 HG22 VAL 133 3.493 7.889 2.902 926 HG23 VAL 133 HG23 VAL 133 4.651 7.305 1.706 927 H THR 134 H THR 134 3.389 8.873 0.204 928 HA THR 134 HA THR 134 3.891 8.288 -2.564 929 HB THR 134 HB THR 134 4.954 10.536 -0.837 930 HG1 THR 134 HG1 THR 134 2.457 10.037 -1.683 931 HG21 THR 134 HG21 THR 134 5.260 11.721 -2.970 932 HG22 THR 134 HG22 THR 134 4.716 10.286 -3.840 933 HG23 THR 134 HG23 THR 134 6.214 10.239 -2.913 934 H ILE 135 H ILE 135 5.362 6.915 -3.136 935 HA ILE 135 HA ILE 135 7.746 6.405 -1.528 936 HB ILE 135 HB ILE 135 6.959 5.128 -4.164 937 HG12 ILE 135 HG12 ILE 135 5.151 4.695 -2.598 938 HG13 ILE 135 HG13 ILE 135 6.064 3.222 -2.875 939 HG21 ILE 135 HG21 ILE 135 8.432 3.295 -3.466 940 HG22 ILE 135 HG22 ILE 135 8.854 4.201 -2.012 941 HG23 ILE 135 HG23 ILE 135 9.291 4.830 -3.602 942 HD11 ILE 135 HD11 ILE 135 5.422 3.450 -0.552 943 HD12 ILE 135 HD12 ILE 135 6.268 4.992 -0.452 944 HD13 ILE 135 HD13 ILE 135 7.179 3.504 -0.722 945 H ARG 136 H ARG 136 9.516 7.636 -1.919 946 HA ARG 136 HA ARG 136 9.712 8.887 -4.560 947 HB2 ARG 136 HB2 ARG 136 9.738 10.425 -2.596 948 HB3 ARG 136 HB3 ARG 136 11.197 9.624 -2.023 949 HG2 ARG 136 HG2 ARG 136 12.397 10.338 -4.007 950 HG3 ARG 136 HG3 ARG 136 10.939 11.096 -4.643 951 HD2 ARG 136 HD2 ARG 136 10.913 12.567 -2.633 952 HD3 ARG 136 HD3 ARG 136 12.462 11.872 -2.164 953 HE ARG 136 HE ARG 136 12.317 13.053 -4.820 954 HH11 ARG 136 HH11 ARG 136 13.334 13.443 -1.465 955 HH12 ARG 136 HH12 ARG 136 14.389 14.778 -1.826 956 HH21 ARG 136 HH21 ARG 136 13.682 14.792 -5.271 957 HH22 ARG 136 HH22 ARG 136 14.583 15.547 -3.994 958 H ALA 137 H ALA 137 10.771 7.590 -5.875 959 HA ALA 137 HA ALA 137 13.178 6.220 -4.909 960 HB1 ALA 137 HB1 ALA 137 13.105 4.970 -7.017 961 HB2 ALA 137 HB2 ALA 137 11.695 5.898 -7.524 962 HB3 ALA 137 HB3 ALA 137 11.583 4.812 -6.137 963 H LEU 138 H LEU 138 14.991 7.319 -5.148 964 HA LEU 138 HA LEU 138 14.977 9.501 -7.083 965 HB2 LEU 138 HB2 LEU 138 16.507 10.684 -5.508 966 HB3 LEU 138 HB3 LEU 138 14.812 10.587 -5.107 967 HG LEU 138 HG LEU 138 15.424 8.714 -3.506 968 HD11 LEU 138 HD11 LEU 138 17.675 8.179 -4.348 969 HD12 LEU 138 HD12 LEU 138 17.723 8.704 -2.665 970 HD13 LEU 138 HD13 LEU 138 18.208 9.812 -3.948 971 HD21 LEU 138 HD21 LEU 138 16.543 11.456 -3.138 972 HD22 LEU 138 HD22 LEU 138 16.058 10.349 -1.848 973 HD23 LEU 138 HD23 LEU 138 14.854 10.998 -2.970 974 H GLU 139 H GLU 139 17.250 10.470 -7.229 975 HA GLU 139 HA GLU 139 18.914 8.439 -8.380 976 HB2 GLU 139 HB2 GLU 139 20.303 10.576 -8.984 977 HB3 GLU 139 HB3 GLU 139 18.804 10.219 -9.836 978 HG2 GLU 139 HG2 GLU 139 17.608 11.819 -8.498 979 HG3 GLU 139 HG3 GLU 139 19.025 12.099 -7.490 980 H HIS 140 H HIS 140 20.520 7.512 -7.426 981 HA HIS 140 HA HIS 140 21.554 8.426 -4.914 982 HB2 HIS 140 HB2 HIS 140 21.320 6.051 -5.231 983 HB3 HIS 140 HB3 HIS 140 22.269 6.096 -6.707 984 HD1 HIS 140 HD1 HIS 140 22.716 6.568 -2.961 985 HD2 HIS 140 HD2 HIS 140 24.902 5.571 -6.358 986 HE1 HIS 140 HE1 HIS 140 25.012 5.929 -2.131 987 HE2 HIS 140 HE2 HIS 140 26.259 5.164 -4.189 988 H HIS 141 H HIS 141 23.041 9.905 -4.705 989 HA HIS 141 HA HIS 141 24.956 10.358 -6.880 990 HB2 HIS 141 HB2 HIS 141 23.809 12.146 -4.774 991 HB3 HIS 141 HB3 HIS 141 25.389 12.519 -5.451 992 HD1 HIS 141 HD1 HIS 141 25.381 13.861 -7.538 993 HD2 HIS 141 HD2 HIS 141 21.708 12.044 -6.842 994 HE1 HIS 141 HE1 HIS 141 23.835 14.793 -9.285 995 HE2 HIS 141 HE2 HIS 141 21.568 13.812 -8.734 996 H HIS 142 H HIS 142 27.064 10.050 -6.575 997 HA HIS 142 HA HIS 142 27.978 9.399 -3.870 998 HB2 HIS 142 HB2 HIS 142 28.466 7.737 -5.663 999 HB3 HIS 142 HB3 HIS 142 29.401 8.957 -6.513 1000 HD1 HIS 142 HD1 HIS 142 31.832 8.982 -6.011 1001 HD2 HIS 142 HD2 HIS 142 29.636 7.096 -3.020 1002 HE1 HIS 142 HE1 HIS 142 33.530 8.082 -4.381 1003 HE2 HIS 142 HE2 HIS 142 32.173 7.127 -2.489 1004 H HIS 143 H HIS 143 27.994 11.486 -3.110 1005 HA HIS 143 HA HIS 143 30.162 13.193 -4.139 1006 HB2 HIS 143 HB2 HIS 143 27.954 14.214 -4.592 1007 HB3 HIS 143 HB3 HIS 143 27.544 14.093 -2.888 1008 HD1 HIS 143 HD1 HIS 143 27.986 16.145 -1.555 1009 HD2 HIS 143 HD2 HIS 143 30.289 16.019 -5.023 1010 HE1 HIS 143 HE1 HIS 143 29.242 18.331 -1.613 1011 HE2 HIS 143 HE2 HIS 143 30.700 18.200 -3.667 1012 H HIS 144 H HIS 144 31.617 13.875 -2.680 1013 HA HIS 144 HA HIS 144 31.574 12.627 -0.083 1014 HB2 HIS 144 HB2 HIS 144 33.640 12.726 -1.456 1015 HB3 HIS 144 HB3 HIS 144 33.624 14.476 -1.321 1016 HD1 HIS 144 HD1 HIS 144 35.095 15.365 0.445 1017 HD2 HIS 144 HD2 HIS 144 33.844 11.483 1.283 1018 HE1 HIS 144 HE1 HIS 144 36.275 14.716 2.573 1019 HE2 HIS 144 HE2 HIS 144 35.638 12.313 2.965 1020 H HIS 145 H HIS 145 30.955 13.516 1.754 1021 HA HIS 145 HA HIS 145 30.272 16.380 1.796 1022 HB2 HIS 145 HB2 HIS 145 28.551 14.521 2.318 1023 HB3 HIS 145 HB3 HIS 145 29.424 14.308 3.829 1024 HD1 HIS 145 HD1 HIS 145 29.013 16.017 5.684 1025 HD2 HIS 145 HD2 HIS 145 27.136 16.971 2.083 1026 HE1 HIS 145 HE1 HIS 145 27.430 17.909 6.218 1027 HE2 HIS 145 HE2 HIS 145 26.268 18.440 4.044 Start of MODEL 13 1 H1 MET 1 H1 MET 1 -83.515-100.027 6.036 2 H2 MET 1 H2 MET 1 -82.126-100.989 6.151 3 H3 MET 1 H3 MET 1 -82.001 -99.304 6.260 4 HA MET 1 HA MET 1 -83.453-101.027 8.171 5 HB2 MET 1 HB2 MET 1 -81.587-100.500 9.739 6 HB3 MET 1 HB3 MET 1 -81.115-101.511 8.387 7 HG2 MET 1 HG2 MET 1 -80.236 -99.421 7.280 8 HG3 MET 1 HG3 MET 1 -80.505 -98.600 8.816 9 HE1 MET 1 HE1 MET 1 -79.199-102.214 7.902 10 HE2 MET 1 HE2 MET 1 -77.459-101.984 8.070 11 HE3 MET 1 HE3 MET 1 -78.343-101.129 6.805 12 H ASN 2 H ASN 2 -84.865 -99.999 9.384 13 HA ASN 2 HA ASN 2 -84.675 -97.070 9.622 14 HB2 ASN 2 HB2 ASN 2 -87.226 -98.595 9.023 15 HB3 ASN 2 HB3 ASN 2 -87.117 -96.873 9.335 16 HD21 ASN 2 HD21 ASN 2 -85.935 -95.572 7.789 17 HD22 ASN 2 HD22 ASN 2 -85.906 -96.056 6.124 18 H ALA 3 H ALA 3 -84.546 -96.555 11.668 19 HA ALA 3 HA ALA 3 -86.006 -98.182 13.641 20 HB1 ALA 3 HB1 ALA 3 -84.239 -97.725 15.253 21 HB2 ALA 3 HB2 ALA 3 -83.371 -96.768 14.051 22 HB3 ALA 3 HB3 ALA 3 -83.580 -98.503 13.811 23 H ARG 4 H ARG 4 -87.799 -96.990 13.936 24 HA ARG 4 HA ARG 4 -87.429 -94.180 14.693 25 HB2 ARG 4 HB2 ARG 4 -90.083 -94.256 14.392 26 HB3 ARG 4 HB3 ARG 4 -88.983 -93.891 13.079 27 HG2 ARG 4 HG2 ARG 4 -90.481 -95.375 12.139 28 HG3 ARG 4 HG3 ARG 4 -89.112 -96.401 12.546 29 HD2 ARG 4 HD2 ARG 4 -90.261 -97.217 14.512 30 HD3 ARG 4 HD3 ARG 4 -91.599 -96.100 14.228 31 HE ARG 4 HE ARG 4 -91.754 -97.408 11.994 32 HH11 ARG 4 HH11 ARG 4 -90.979 -98.820 15.130 33 HH12 ARG 4 HH12 ARG 4 -91.595-100.388 14.715 34 HH21 ARG 4 HH21 ARG 4 -92.579 -99.460 11.465 35 HH22 ARG 4 HH22 ARG 4 -92.520-100.745 12.636 36 H ASP 5 H ASP 5 -87.737 -93.540 16.679 37 HA ASP 5 HA ASP 5 -88.927 -95.440 18.574 38 HB2 ASP 5 HB2 ASP 5 -86.667 -94.705 19.169 39 HB3 ASP 5 HB3 ASP 5 -87.176 -93.022 19.097 40 H ASN 6 H ASN 6 -90.965 -95.156 18.873 41 HA ASN 6 HA ASN 6 -92.097 -92.443 18.948 42 HB2 ASN 6 HB2 ASN 6 -92.986 -94.205 17.301 43 HB3 ASN 6 HB3 ASN 6 -93.631 -95.038 18.707 44 HD21 ASN 6 HD21 ASN 6 -94.897 -93.780 16.364 45 HD22 ASN 6 HD22 ASN 6 -96.083 -92.693 17.013 46 H LYS 7 H LYS 7 -92.360 -91.690 20.923 47 HA LYS 7 HA LYS 7 -92.279 -93.483 23.187 48 HB2 LYS 7 HB2 LYS 7 -90.998 -91.313 23.060 49 HB3 LYS 7 HB3 LYS 7 -92.534 -90.477 23.225 50 HG2 LYS 7 HG2 LYS 7 -91.398 -90.602 25.358 51 HG3 LYS 7 HG3 LYS 7 -92.886 -91.549 25.395 52 HD2 LYS 7 HD2 LYS 7 -91.636 -93.600 25.106 53 HD3 LYS 7 HD3 LYS 7 -90.134 -92.693 24.916 54 HE2 LYS 7 HE2 LYS 7 -91.840 -92.695 27.405 55 HE3 LYS 7 HE3 LYS 7 -90.401 -93.688 27.171 56 HZ1 LYS 7 HZ1 LYS 7 -89.871 -91.688 28.410 57 HZ2 LYS 7 HZ2 LYS 7 -90.485 -90.713 27.171 58 HZ3 LYS 7 HZ3 LYS 7 -89.100 -91.650 26.901 59 H PHE 8 H PHE 8 -94.062 -94.488 23.671 60 HA PHE 8 HA PHE 8 -96.640 -93.151 23.464 61 HB2 PHE 8 HB2 PHE 8 -95.907 -96.019 24.096 62 HB3 PHE 8 HB3 PHE 8 -97.556 -95.410 24.036 63 HD1 PHE 8 HD2 PHE 8 -98.353 -94.389 21.820 64 HD2 PHE 8 HD1 PHE 8 -94.874 -96.816 22.164 65 HE1 PHE 8 HE2 PHE 8 -98.439 -94.850 19.404 66 HE2 PHE 8 HE1 PHE 8 -94.958 -97.279 19.750 67 HZ PHE 8 HZ PHE 8 -96.740 -96.295 18.368 68 H ASN 9 H ASN 9 -98.170 -93.397 25.237 69 HA ASN 9 HA ASN 9 -98.936 -93.080 27.316 70 HB2 ASN 9 HB2 ASN 9 -97.818 -95.178 27.939 71 HB3 ASN 9 HB3 ASN 9 -96.340 -94.295 28.287 72 HD21 ASN 9 HD21 ASN 9 -96.231 -94.903 30.402 73 HD22 ASN 9 HD22 ASN 9 -97.345 -94.358 31.606 74 H THR 10 H THR 10 -99.143 -90.967 27.379 75 HA THR 10 HA THR 10 -97.029 -89.514 28.811 76 HB THR 10 HB THR 10 -97.401 -88.579 26.535 77 HG1 THR 10 HG1 THR 10 -96.810 -86.853 27.556 78 HG21 THR 10 HG21 THR 10 -99.466 -87.323 26.049 79 HG22 THR 10 HG22 THR 10-100.185 -87.964 27.526 80 HG23 THR 10 HG23 THR 10 -99.761 -89.055 26.207 81 H TRP 11 H TRP 11 -97.805 -87.993 30.431 82 HA TRP 11 HA TRP 11-100.125 -89.135 31.799 83 HB2 TRP 11 HB2 TRP 11 -97.975 -87.268 32.841 84 HB3 TRP 11 HB3 TRP 11 -99.221 -88.054 33.809 85 HD1 TRP 11 HD1 TRP 11 -95.734 -88.516 32.698 86 HE1 TRP 11 HE1 TRP 11 -94.925 -90.918 33.174 87 HE3 TRP 11 HE3 TRP 11-100.233 -90.690 33.742 88 HZ2 TRP 11 HZ2 TRP 11 -96.052 -93.398 33.884 89 HZ3 TRP 11 HZ3 TRP 11-100.286 -93.075 34.300 90 HH2 TRP 11 HH2 TRP 11 -98.239 -94.408 34.375 91 H ASN 12 H ASN 12-102.003 -88.139 31.690 92 HA ASN 12 HA ASN 12-102.179 -85.457 30.632 93 HB2 ASN 12 HB2 ASN 12-103.776 -87.062 29.797 94 HB3 ASN 12 HB3 ASN 12-104.301 -87.463 31.426 95 HD21 ASN 12 HD21 ASN 12-104.367 -85.036 28.909 96 HD22 ASN 12 HD22 ASN 12-105.742 -84.173 29.507 97 H ASP 13 H ASP 13-101.856 -83.826 31.898 98 HA ASP 13 HA ASP 13-103.412 -83.628 34.364 99 HB2 ASP 13 HB2 ASP 13-101.602 -82.443 35.489 100 HB3 ASP 13 HB3 ASP 13-101.064 -84.046 35.013 101 H SER 14 H SER 14-104.110 -81.495 34.858 102 HA SER 14 HA SER 14-103.723 -79.528 32.702 103 HB2 SER 14 HB2 SER 14-106.359 -80.104 34.080 104 HB3 SER 14 HB3 SER 14-106.083 -78.932 32.792 105 HG SER 14 HG SER 14-106.933 -81.228 32.347 106 H ARG 15 H ARG 15-102.526 -78.022 33.705 107 HA ARG 15 HA ARG 15-103.278 -77.234 36.415 108 HB2 ARG 15 HB2 ARG 15-101.136 -75.996 36.468 109 HB3 ARG 15 HB3 ARG 15-100.937 -77.715 36.190 110 HG2 ARG 15 HG2 ARG 15-100.501 -77.318 33.841 111 HG3 ARG 15 HG3 ARG 15-100.809 -75.592 34.054 112 HD2 ARG 15 HD2 ARG 15 -98.599 -77.186 35.350 113 HD3 ARG 15 HD3 ARG 15 -98.415 -76.057 34.010 114 HE ARG 15 HE ARG 15 -99.296 -75.235 36.715 115 HH11 ARG 15 HH11 ARG 15 -97.414 -74.659 33.786 116 HH12 ARG 15 HH12 ARG 15 -96.761 -73.154 34.360 117 HH21 ARG 15 HH21 ARG 15 -98.398 -73.279 37.470 118 HH22 ARG 15 HH22 ARG 15 -97.316 -72.377 36.456 119 H GLY 16 H GLY 16-104.149 -75.331 36.922 120 HA2 GLY 16 HA2 GLY 16-104.837 -73.584 34.640 121 HA3 GLY 16 HA3 GLY 16-105.857 -73.834 36.050 122 H ASN 17 H ASN 17-103.946 -71.665 34.598 123 HA ASN 17 HA ASN 17-103.230 -70.417 37.162 124 HB2 ASN 17 HB2 ASN 17-101.374 -69.259 35.986 125 HB3 ASN 17 HB3 ASN 17-101.185 -71.002 36.034 126 HD21 ASN 17 HD21 ASN 17-101.630 -68.217 34.025 127 HD22 ASN 17 HD22 ASN 17-101.432 -69.022 32.507 128 H TYR 18 H TYR 18-103.817 -68.379 37.527 129 HA TYR 18 HA TYR 18-105.085 -66.859 35.380 130 HB2 TYR 18 HB2 TYR 18-107.020 -66.315 36.879 131 HB3 TYR 18 HB3 TYR 18-106.963 -67.984 36.347 132 HD1 TYR 18 HD2 TYR 18-106.493 -69.788 37.964 133 HD2 TYR 18 HD1 TYR 18-106.785 -65.730 39.216 134 HE1 TYR 18 HE2 TYR 18-106.753 -70.530 40.296 135 HE2 TYR 18 HE1 TYR 18-107.057 -66.461 41.544 136 HH TYR 18 HH TYR 18-106.402 -69.621 42.580 137 H TRP 19 H TRP 19-102.564 -66.512 36.555 138 HA TRP 19 HA TRP 19-102.616 -64.472 38.567 139 HB2 TRP 19 HB2 TRP 19-100.346 -65.278 36.736 140 HB3 TRP 19 HB3 TRP 19-100.203 -64.277 38.173 141 HD1 TRP 19 HD1 TRP 19-101.448 -65.839 40.441 142 HE1 TRP 19 HE1 TRP 19-100.630 -68.184 41.145 143 HE3 TRP 19 HE3 TRP 19 -99.122 -67.231 36.100 144 HZ2 TRP 19 HZ2 TRP 19 -99.195 -70.328 40.005 145 HZ3 TRP 19 HZ3 TRP 19 -98.047 -69.440 35.998 146 HH2 TRP 19 HH2 TRP 19 -98.082 -70.954 37.909 147 H SER 20 H SER 20-103.789 -62.748 37.889 148 HA SER 20 HA SER 20-102.698 -61.231 35.625 149 HB2 SER 20 HB2 SER 20-105.458 -61.106 36.871 150 HB3 SER 20 HB3 SER 20-104.885 -60.052 35.575 151 HG SER 20 HG SER 20-104.554 -61.978 34.313 152 H ASP 21 H ASP 21-101.354 -59.732 36.256 153 HA ASP 21 HA ASP 21-101.609 -58.608 38.962 154 HB2 ASP 21 HB2 ASP 21 -99.515 -59.860 38.191 155 HB3 ASP 21 HB3 ASP 21 -99.185 -58.480 37.161 156 H TYR 22 H TYR 22-101.485 -56.369 39.284 157 HA TYR 22 HA TYR 22-102.699 -54.941 37.055 158 HB2 TYR 22 HB2 TYR 22-102.619 -54.412 40.008 159 HB3 TYR 22 HB3 TYR 22-103.168 -53.184 38.870 160 HD1 TYR 22 HD1 TYR 22-104.800 -54.524 36.966 161 HD2 TYR 22 HD2 TYR 22-104.406 -55.328 41.123 162 HE1 TYR 22 HE1 TYR 22-107.061 -55.488 36.985 163 HE2 TYR 22 HE2 TYR 22-106.662 -56.300 41.153 164 HH TYR 22 HH TYR 22-108.772 -56.100 39.812 165 H GLU 23 H GLU 23 -99.594 -55.260 37.865 166 HA GLU 23 HA GLU 23 -98.896 -52.496 37.376 167 HB2 GLU 23 HB2 GLU 23 -96.537 -53.352 37.204 168 HB3 GLU 23 HB3 GLU 23 -97.314 -53.622 38.750 169 HG2 GLU 23 HG2 GLU 23 -96.247 -55.612 38.441 170 HG3 GLU 23 HG3 GLU 23 -97.827 -55.982 37.766 171 H GLY 24 H GLY 24 -98.169 -51.650 35.473 172 HA2 GLY 24 HA2 GLY 24 -98.634 -53.331 33.086 173 HA3 GLY 24 HA3 GLY 24 -98.896 -51.592 33.136 174 H SER 25 H SER 25 -97.155 -50.201 33.134 175 HA SER 25 HA SER 25 -94.477 -51.304 32.754 176 HB2 SER 25 HB2 SER 25 -95.823 -49.435 30.774 177 HB3 SER 25 HB3 SER 25 -94.111 -49.858 30.747 178 HG SER 25 HG SER 25 -96.340 -51.577 30.351 179 H ASP 26 H ASP 26 -93.243 -50.243 34.204 180 HA ASP 26 HA ASP 26 -93.934 -47.466 34.809 181 HB2 ASP 26 HB2 ASP 26 -92.603 -47.644 36.805 182 HB3 ASP 26 HB3 ASP 26 -93.696 -49.017 36.744 183 H GLU 27 H GLU 27 -92.720 -45.810 34.184 184 HA GLU 27 HA GLU 27 -90.497 -46.418 32.435 185 HB2 GLU 27 HB2 GLU 27 -90.582 -43.888 31.988 186 HB3 GLU 27 HB3 GLU 27 -91.892 -44.888 31.392 187 HG2 GLU 27 HG2 GLU 27 -92.925 -42.972 32.225 188 HG3 GLU 27 HG3 GLU 27 -93.174 -44.187 33.468 189 H ASN 28 H ASN 28 -88.461 -45.428 32.540 190 HA ASN 28 HA ASN 28 -87.682 -44.793 35.307 191 HB2 ASN 28 HB2 ASN 28 -86.002 -45.985 33.085 192 HB3 ASN 28 HB3 ASN 28 -85.401 -45.552 34.678 193 HD21 ASN 28 HD21 ASN 28 -87.802 -46.514 36.063 194 HD22 ASN 28 HD22 ASN 28 -87.712 -48.243 36.014 195 H GLY 29 H GLY 29 -87.520 -42.697 35.550 196 HA2 GLY 29 HA2 GLY 29 -86.369 -41.066 33.390 197 HA3 GLY 29 HA3 GLY 29 -87.280 -40.455 34.767 198 H ASP 30 H ASP 30 -84.791 -39.400 34.002 199 HA ASP 30 HA ASP 30 -82.601 -40.528 35.369 200 HB2 ASP 30 HB2 ASP 30 -81.443 -38.430 34.932 201 HB3 ASP 30 HB3 ASP 30 -82.317 -38.956 33.502 202 H GLY 31 H GLY 31 -81.642 -40.073 37.306 203 HA2 GLY 31 HA2 GLY 31 -83.407 -38.704 39.228 204 HA3 GLY 31 HA3 GLY 31 -82.673 -40.262 39.576 205 H ILE 32 H ILE 32 -80.922 -40.268 40.709 206 HA ILE 32 HA ILE 32 -79.086 -39.673 41.887 207 HB ILE 32 HB ILE 32 -78.779 -37.265 40.057 208 HG12 ILE 32 HG12 ILE 32 -78.801 -39.356 38.742 209 HG13 ILE 32 HG13 ILE 32 -77.218 -38.590 38.716 210 HG21 ILE 32 HG21 ILE 32 -77.412 -37.059 42.065 211 HG22 ILE 32 HG22 ILE 32 -76.405 -37.320 40.639 212 HG23 ILE 32 HG23 ILE 32 -76.705 -38.648 41.760 213 HD11 ILE 32 HD11 ILE 32 -76.430 -40.214 40.385 214 HD12 ILE 32 HD12 ILE 32 -77.010 -40.994 38.912 215 HD13 ILE 32 HD13 ILE 32 -78.015 -40.985 40.362 216 H GLY 33 H GLY 33 -81.928 -38.150 41.910 217 HA2 GLY 33 HA2 GLY 33 -82.869 -36.914 43.712 218 HA3 GLY 33 HA3 GLY 33 -81.265 -36.302 44.087 219 H ASP 34 H ASP 34 -80.325 -35.353 41.847 220 HA ASP 34 HA ASP 34 -82.236 -33.843 40.314 221 HB2 ASP 34 HB2 ASP 34 -81.272 -31.659 40.739 222 HB3 ASP 34 HB3 ASP 34 -81.779 -32.360 42.269 223 H SER 35 H SER 35 -81.067 -32.667 38.516 224 HA SER 35 HA SER 35 -79.194 -34.507 37.345 225 HB2 SER 35 HB2 SER 35 -80.197 -31.884 36.219 226 HB3 SER 35 HB3 SER 35 -79.458 -33.212 35.324 227 HG SER 35 HG SER 35 -81.266 -34.493 35.798 228 H ALA 36 H ALA 36 -77.068 -34.382 37.473 229 HA ALA 36 HA ALA 36 -75.806 -31.971 38.483 230 HB1 ALA 36 HB1 ALA 36 -73.796 -33.359 38.693 231 HB2 ALA 36 HB2 ALA 36 -74.640 -34.699 37.916 232 HB3 ALA 36 HB3 ALA 36 -75.181 -34.107 39.487 233 H TYR 37 H TYR 37 -74.642 -30.595 37.278 234 HA TYR 37 HA TYR 37 -74.150 -31.342 34.469 235 HB2 TYR 37 HB2 TYR 37 -74.479 -28.558 35.608 236 HB3 TYR 37 HB3 TYR 37 -74.242 -28.961 33.917 237 HD1 TYR 37 HD2 TYR 37 -76.096 -30.423 32.813 238 HD2 TYR 37 HD1 TYR 37 -76.606 -28.293 36.462 239 HE1 TYR 37 HE2 TYR 37 -78.537 -30.478 32.503 240 HE2 TYR 37 HE1 TYR 37 -79.042 -28.340 36.157 241 HH TYR 37 HH TYR 37 -80.581 -30.299 33.850 242 H ALA 38 H ALA 38 -72.293 -30.111 33.475 243 HA ALA 38 HA ALA 38 -70.049 -29.936 35.362 244 HB1 ALA 38 HB1 ALA 38 -68.607 -30.113 33.400 245 HB2 ALA 38 HB2 ALA 38 -70.029 -30.155 32.357 246 HB3 ALA 38 HB3 ALA 38 -69.729 -31.469 33.496 247 H VAL 39 H VAL 39 -68.945 -28.077 35.660 248 HA VAL 39 HA VAL 39 -70.010 -25.681 34.301 249 HB VAL 39 HB VAL 39 -68.883 -25.843 37.111 250 HG11 VAL 39 HG11 VAL 39 -68.543 -23.654 36.079 251 HG12 VAL 39 HG12 VAL 39 -69.722 -23.570 37.388 252 HG13 VAL 39 HG13 VAL 39 -70.267 -23.555 35.711 253 HG21 VAL 39 HG21 VAL 39 -71.161 -25.509 37.905 254 HG22 VAL 39 HG22 VAL 39 -71.032 -26.993 36.955 255 HG23 VAL 39 HG23 VAL 39 -71.754 -25.551 36.242 256 H ASN 40 H ASN 40 -68.610 -24.557 33.141 257 HA ASN 40 HA ASN 40 -65.741 -25.063 33.440 258 HB2 ASN 40 HB2 ASN 40 -66.690 -25.169 31.158 259 HB3 ASN 40 HB3 ASN 40 -67.261 -23.514 31.321 260 HD21 ASN 40 HD21 ASN 40 -64.456 -25.553 30.969 261 HD22 ASN 40 HD22 ASN 40 -63.365 -24.305 30.474 262 HA PRO 41 HA PRO 41 -65.648 -21.156 35.745 263 HB2 PRO 41 HB2 PRO 41 -62.823 -21.892 36.132 264 HB3 PRO 41 HB3 PRO 41 -64.074 -21.577 37.339 265 HG2 PRO 41 HG2 PRO 41 -63.146 -24.051 36.918 266 HG3 PRO 41 HG3 PRO 41 -64.857 -23.755 37.282 267 HD2 PRO 41 HD2 PRO 41 -63.551 -24.246 34.619 268 HD3 PRO 41 HD3 PRO 41 -65.039 -24.957 35.287 269 H GLU 42 H GLU 42 -62.599 -22.026 34.074 270 HA GLU 42 HA GLU 42 -62.637 -19.355 32.821 271 HB2 GLU 42 HB2 GLU 42 -60.260 -20.831 33.966 272 HB3 GLU 42 HB3 GLU 42 -60.154 -19.342 33.043 273 HG2 GLU 42 HG2 GLU 42 -61.563 -19.664 35.689 274 HG3 GLU 42 HG3 GLU 42 -59.958 -18.973 35.464 275 H ALA 43 H ALA 43 -61.164 -19.184 30.926 276 HA ALA 43 HA ALA 43 -61.726 -21.352 29.098 277 HB1 ALA 43 HB1 ALA 43 -60.360 -18.712 28.609 278 HB2 ALA 43 HB2 ALA 43 -62.088 -19.022 28.440 279 HB3 ALA 43 HB3 ALA 43 -60.940 -19.835 27.375 280 H GLY 44 H GLY 44 -58.797 -19.686 30.271 281 HA2 GLY 44 HA2 GLY 44 -57.101 -21.675 30.691 282 HA3 GLY 44 HA3 GLY 44 -57.133 -21.667 28.935 283 H SER 45 H SER 45 -56.258 -19.918 27.799 284 HA SER 45 HA SER 45 -54.412 -18.267 29.396 285 HB2 SER 45 HB2 SER 45 -53.180 -19.914 28.124 286 HB3 SER 45 HB3 SER 45 -54.076 -19.514 26.663 287 HG SER 45 HG SER 45 -52.842 -17.836 26.329 288 H MET 46 H MET 46 -54.249 -16.101 28.958 289 HA MET 46 HA MET 46 -56.278 -14.869 27.314 290 HB2 MET 46 HB2 MET 46 -55.381 -12.737 28.086 291 HB3 MET 46 HB3 MET 46 -55.592 -13.831 29.443 292 HG2 MET 46 HG2 MET 46 -53.216 -14.280 29.504 293 HG3 MET 46 HG3 MET 46 -52.966 -13.292 28.066 294 HE1 MET 46 HE1 MET 46 -55.309 -12.574 31.201 295 HE2 MET 46 HE2 MET 46 -54.208 -11.621 32.198 296 HE3 MET 46 HE3 MET 46 -53.865 -13.322 31.881 297 H ASP 47 H ASP 47 -53.045 -15.880 26.951 298 HA ASP 47 HA ASP 47 -51.539 -15.921 25.298 299 HB2 ASP 47 HB2 ASP 47 -53.968 -15.260 23.663 300 HB3 ASP 47 HB3 ASP 47 -52.372 -15.333 22.921 301 H TYR 48 H TYR 48 -50.151 -14.487 26.004 302 HA TYR 48 HA TYR 48 -50.417 -11.738 25.033 303 HB2 TYR 48 HB2 TYR 48 -48.859 -11.138 26.922 304 HB3 TYR 48 HB3 TYR 48 -50.462 -11.660 27.404 305 HD1 TYR 48 HD2 TYR 48 -46.886 -12.501 27.422 306 HD2 TYR 48 HD1 TYR 48 -50.774 -13.737 28.637 307 HE1 TYR 48 HE2 TYR 48 -45.885 -14.113 28.984 308 HE2 TYR 48 HE1 TYR 48 -49.777 -15.345 30.204 309 HH TYR 48 HH TYR 48 -47.624 -16.594 30.448 310 H MET 49 H MET 49 -48.510 -10.665 24.332 311 HA MET 49 HA MET 49 -46.512 -12.532 23.223 312 HB2 MET 49 HB2 MET 49 -47.368 -9.808 22.205 313 HB3 MET 49 HB3 MET 49 -46.112 -10.805 21.491 314 HG2 MET 49 HG2 MET 49 -47.768 -12.521 20.974 315 HG3 MET 49 HG3 MET 49 -49.028 -11.517 21.690 316 HE1 MET 49 HE1 MET 49 -49.836 -9.182 20.645 317 HE2 MET 49 HE2 MET 49 -49.083 -8.441 19.235 318 HE3 MET 49 HE3 MET 49 -48.175 -8.599 20.740 319 HA PRO 50 HA PRO 50 -43.252 -10.392 25.539 320 HB2 PRO 50 HB2 PRO 50 -41.633 -11.002 23.121 321 HB3 PRO 50 HB3 PRO 50 -41.307 -11.374 24.818 322 HG2 PRO 50 HG2 PRO 50 -42.064 -13.286 23.135 323 HG3 PRO 50 HG3 PRO 50 -42.668 -13.248 24.804 324 HD2 PRO 50 HD2 PRO 50 -44.037 -12.421 22.272 325 HD3 PRO 50 HD3 PRO 50 -44.690 -13.299 23.671 326 H LEU 51 H LEU 51 -42.174 -8.435 25.463 327 HA LEU 51 HA LEU 51 -43.331 -6.473 23.734 328 HB2 LEU 51 HB2 LEU 51 -41.124 -6.228 25.782 329 HB3 LEU 51 HB3 LEU 51 -41.948 -4.885 25.014 330 HG LEU 51 HG LEU 51 -43.283 -6.917 26.808 331 HD11 LEU 51 HD11 LEU 51 -43.354 -5.115 28.463 332 HD12 LEU 51 HD12 LEU 51 -42.406 -4.090 27.384 333 HD13 LEU 51 HD13 LEU 51 -41.697 -5.559 28.054 334 HD21 LEU 51 HD21 LEU 51 -44.285 -4.317 25.646 335 HD22 LEU 51 HD22 LEU 51 -45.151 -5.327 26.804 336 HD23 LEU 51 HD23 LEU 51 -44.810 -5.936 25.185 337 H MET 52 H MET 52 -42.552 -5.654 21.904 338 HA MET 52 HA MET 52 -40.030 -6.688 20.882 339 HB2 MET 52 HB2 MET 52 -42.133 -4.988 19.516 340 HB3 MET 52 HB3 MET 52 -40.696 -5.630 18.738 341 HG2 MET 52 HG2 MET 52 -42.273 -7.135 18.064 342 HG3 MET 52 HG3 MET 52 -41.652 -7.931 19.504 343 HE1 MET 52 HE1 MET 52 -43.939 -9.453 19.344 344 HE2 MET 52 HE2 MET 52 -44.502 -8.479 17.981 345 HE3 MET 52 HE3 MET 52 -45.554 -8.740 19.371 346 H GLU 53 H GLU 53 -38.228 -5.528 20.525 347 HA GLU 53 HA GLU 53 -38.290 -2.644 21.114 348 HB2 GLU 53 HB2 GLU 53 -36.038 -2.911 22.154 349 HB3 GLU 53 HB3 GLU 53 -37.329 -3.712 23.036 350 HG2 GLU 53 HG2 GLU 53 -36.646 -5.857 21.995 351 HG3 GLU 53 HG3 GLU 53 -35.293 -5.020 21.237 352 H TYR 54 H TYR 54 -36.508 -1.403 20.163 353 HA TYR 54 HA TYR 54 -35.696 -2.524 17.610 354 HB2 TYR 54 HB2 TYR 54 -34.919 -0.305 16.992 355 HB3 TYR 54 HB3 TYR 54 -36.564 -0.230 17.582 356 HD1 TYR 54 HD1 TYR 54 -36.901 0.628 20.004 357 HD2 TYR 54 HD2 TYR 54 -33.279 1.122 17.834 358 HE1 TYR 54 HE1 TYR 54 -36.272 2.485 21.486 359 HE2 TYR 54 HE2 TYR 54 -32.638 2.974 19.315 360 HH TYR 54 HH TYR 54 -33.705 4.612 20.793 361 H LEU 55 H LEU 55 -33.786 -3.313 17.172 362 HA LEU 55 HA LEU 55 -31.983 -3.644 19.413 363 HB2 LEU 55 HB2 LEU 55 -32.868 -5.506 17.895 364 HB3 LEU 55 HB3 LEU 55 -31.752 -4.904 16.691 365 HG LEU 55 HG LEU 55 -30.584 -5.572 19.344 366 HD11 LEU 55 HD11 LEU 55 -32.148 -7.414 19.021 367 HD12 LEU 55 HD12 LEU 55 -30.485 -7.958 18.794 368 HD13 LEU 55 HD13 LEU 55 -31.520 -7.676 17.394 369 HD21 LEU 55 HD21 LEU 55 -29.189 -4.776 17.482 370 HD22 LEU 55 HD22 LEU 55 -29.732 -6.138 16.500 371 HD23 LEU 55 HD23 LEU 55 -28.770 -6.424 17.950 372 H HIS 56 H HIS 56 -30.060 -2.748 19.609 373 HA HIS 56 HA HIS 56 -29.203 -0.776 17.656 374 HB2 HIS 56 HB2 HIS 56 -27.830 -1.602 20.225 375 HB3 HIS 56 HB3 HIS 56 -27.476 -0.176 19.265 376 HD1 HIS 56 HD1 HIS 56 -29.550 1.632 19.180 377 HD2 HIS 56 HD2 HIS 56 -29.562 -1.186 22.249 378 HE1 HIS 56 HE1 HIS 56 -31.106 2.549 20.941 379 HE2 HIS 56 HE2 HIS 56 -31.214 0.760 22.713 380 H SER 57 H SER 57 -28.477 -1.891 15.872 381 HA SER 57 HA SER 57 -26.435 -3.931 16.203 382 HB2 SER 57 HB2 SER 57 -27.603 -2.757 13.662 383 HB3 SER 57 HB3 SER 57 -26.566 -4.179 13.772 384 HG SER 57 HG SER 57 -28.351 -5.246 14.007 385 H SER 58 H SER 58 -24.484 -3.200 16.684 386 HA SER 58 HA SER 58 -23.532 -0.753 15.360 387 HB2 SER 58 HB2 SER 58 -22.556 -2.021 17.932 388 HB3 SER 58 HB3 SER 58 -21.995 -0.494 17.248 389 HG SER 58 HG SER 58 -24.214 0.233 17.440 390 HA PRO 59 HA PRO 59 -20.832 -3.928 13.507 391 HB2 PRO 59 HB2 PRO 59 -20.808 -2.996 11.009 392 HB3 PRO 59 HB3 PRO 59 -22.202 -3.869 11.657 393 HG2 PRO 59 HG2 PRO 59 -21.842 -0.946 11.203 394 HG3 PRO 59 HG3 PRO 59 -23.297 -1.941 11.027 395 HD2 PRO 59 HD2 PRO 59 -22.657 -0.325 13.224 396 HD3 PRO 59 HD3 PRO 59 -23.899 -1.590 13.180 397 H VAL 60 H VAL 60 -18.702 -3.803 12.432 398 HA VAL 60 HA VAL 60 -17.346 -1.286 13.130 399 HB VAL 60 HB VAL 60 -16.888 -2.951 14.819 400 HG11 VAL 60 HG11 VAL 60 -15.725 -5.020 14.393 401 HG12 VAL 60 HG12 VAL 60 -15.717 -4.685 12.661 402 HG13 VAL 60 HG13 VAL 60 -17.245 -4.968 13.496 403 HG21 VAL 60 HG21 VAL 60 -15.120 -1.378 14.332 404 HG22 VAL 60 HG22 VAL 60 -14.474 -2.451 13.089 405 HG23 VAL 60 HG23 VAL 60 -14.444 -2.944 14.781 406 H LEU 61 H LEU 61 -16.253 -0.335 11.633 407 HA LEU 61 HA LEU 61 -15.934 -1.541 9.027 408 HB2 LEU 61 HB2 LEU 61 -15.074 0.825 8.439 409 HB3 LEU 61 HB3 LEU 61 -16.768 0.595 8.759 410 HG LEU 61 HG LEU 61 -15.756 2.743 9.596 411 HD11 LEU 61 HD11 LEU 61 -16.918 2.760 11.752 412 HD12 LEU 61 HD12 LEU 61 -17.101 1.008 11.648 413 HD13 LEU 61 HD13 LEU 61 -17.879 2.048 10.455 414 HD21 LEU 61 HD21 LEU 61 -14.450 0.975 11.646 415 HD22 LEU 61 HD22 LEU 61 -14.554 2.735 11.724 416 HD23 LEU 61 HD23 LEU 61 -13.637 1.962 10.431 417 HA PRO 62 HA PRO 62 -11.608 -2.384 9.444 418 HB2 PRO 62 HB2 PRO 62 -10.523 -2.009 7.032 419 HB3 PRO 62 HB3 PRO 62 -11.778 -3.227 7.290 420 HG2 PRO 62 HG2 PRO 62 -12.001 -0.499 6.096 421 HG3 PRO 62 HG3 PRO 62 -12.770 -2.014 5.591 422 HD2 PRO 62 HD2 PRO 62 -13.990 -0.053 7.115 423 HD3 PRO 62 HD3 PRO 62 -14.503 -1.744 7.040 424 H THR 63 H THR 63 -9.309 -1.615 8.964 425 HA THR 63 HA THR 63 -8.983 1.253 8.798 426 HB THR 63 HB THR 63 -9.185 0.429 11.308 427 HG1 THR 63 HG1 THR 63 -8.521 2.543 10.540 428 HG21 THR 63 HG21 THR 63 -6.267 -0.184 10.787 429 HG22 THR 63 HG22 THR 63 -7.507 -1.364 11.230 430 HG23 THR 63 HG23 THR 63 -7.047 -0.093 12.365 431 H ALA 64 H ALA 64 -7.126 1.735 7.660 432 HA ALA 64 HA ALA 64 -5.584 -0.611 6.788 433 HB1 ALA 64 HB1 ALA 64 -6.705 0.695 5.044 434 HB2 ALA 64 HB2 ALA 64 -4.951 0.670 4.849 435 HB3 ALA 64 HB3 ALA 64 -5.746 2.103 5.503 436 H ARG 65 H ARG 65 -3.664 -0.932 7.553 437 HA ARG 65 HA ARG 65 -1.919 1.293 8.269 438 HB2 ARG 65 HB2 ARG 65 -2.889 -0.839 10.166 439 HB3 ARG 65 HB3 ARG 65 -1.303 -0.106 10.388 440 HG2 ARG 65 HG2 ARG 65 -2.265 2.064 10.646 441 HG3 ARG 65 HG3 ARG 65 -3.858 1.466 10.197 442 HD2 ARG 65 HD2 ARG 65 -4.002 0.182 12.226 443 HD3 ARG 65 HD3 ARG 65 -2.333 0.589 12.644 444 HE ARG 65 HE ARG 65 -3.266 3.004 12.557 445 HH11 ARG 65 HH11 ARG 65 -5.029 0.221 13.826 446 HH12 ARG 65 HH12 ARG 65 -5.986 1.193 14.901 447 HH21 ARG 65 HH21 ARG 65 -4.508 4.233 13.961 448 HH22 ARG 65 HH22 ARG 65 -5.672 3.471 15.002 449 H PHE 66 H PHE 66 0.250 0.840 7.910 450 HA PHE 66 HA PHE 66 1.155 -1.853 7.490 451 HB2 PHE 66 HB2 PHE 66 1.844 -1.632 5.167 452 HB3 PHE 66 HB3 PHE 66 0.108 -1.419 5.298 453 HD1 PHE 66 HD2 PHE 66 -0.807 0.969 5.192 454 HD2 PHE 66 HD1 PHE 66 3.182 -0.042 4.091 455 HE1 PHE 66 HE2 PHE 66 -0.634 3.051 3.897 456 HE2 PHE 66 HE1 PHE 66 3.350 2.037 2.794 457 HZ PHE 66 HZ PHE 66 1.444 3.585 2.698 458 H THR 67 H THR 67 3.473 -1.951 6.923 459 HA THR 67 HA THR 67 4.881 0.543 7.576 460 HB THR 67 HB THR 67 5.363 -1.122 9.291 461 HG1 THR 67 HG1 THR 67 7.141 0.231 8.258 462 HG21 THR 67 HG21 THR 67 6.537 -3.218 8.777 463 HG22 THR 67 HG22 THR 67 6.324 -2.913 7.053 464 HG23 THR 67 HG23 THR 67 4.917 -3.185 8.085 465 H SER 68 H SER 68 6.187 1.366 6.100 466 HA SER 68 HA SER 68 6.793 -0.208 3.704 467 HB2 SER 68 HB2 SER 68 7.405 2.063 2.750 468 HB3 SER 68 HB3 SER 68 5.703 1.880 3.180 469 HG SER 68 HG SER 68 5.999 3.141 4.950 470 H ASP 69 H ASP 69 8.975 -0.332 2.975 471 HA ASP 69 HA ASP 69 10.981 -0.233 5.014 472 HB2 ASP 69 HB2 ASP 69 11.048 -1.932 3.229 473 HB3 ASP 69 HB3 ASP 69 11.261 -0.665 2.026 474 H ILE 70 H ILE 70 10.364 1.577 2.034 475 HA ILE 70 HA ILE 70 11.986 3.761 3.115 476 HB ILE 70 HB ILE 70 12.313 4.390 0.601 477 HG12 ILE 70 HG12 ILE 70 12.803 2.148 -0.670 478 HG13 ILE 70 HG13 ILE 70 11.614 1.479 0.434 479 HG21 ILE 70 HG21 ILE 70 13.891 2.206 1.932 480 HG22 ILE 70 HG22 ILE 70 14.123 3.946 2.114 481 HG23 ILE 70 HG23 ILE 70 14.437 3.171 0.561 482 HD11 ILE 70 HD11 ILE 70 10.597 2.049 -1.680 483 HD12 ILE 70 HD12 ILE 70 11.150 3.717 -1.523 484 HD13 ILE 70 HD13 ILE 70 9.952 3.073 -0.397 485 H THR 71 H THR 71 11.357 5.849 2.677 486 HA THR 71 HA THR 71 8.685 6.214 1.508 487 HB THR 71 HB THR 71 8.955 8.573 2.492 488 HG1 THR 71 HG1 THR 71 10.623 8.959 3.772 489 HG21 THR 71 HG21 THR 71 8.776 6.208 4.363 490 HG22 THR 71 HG22 THR 71 7.442 6.936 3.466 491 HG23 THR 71 HG23 THR 71 8.252 7.850 4.737 492 H GLU 72 H GLU 72 12.072 6.934 1.287 493 HA GLU 72 HA GLU 72 11.859 7.953 -1.388 494 HB2 GLU 72 HB2 GLU 72 11.488 9.989 0.047 495 HB3 GLU 72 HB3 GLU 72 13.082 9.732 0.741 496 HG2 GLU 72 HG2 GLU 72 14.058 9.958 -1.535 497 HG3 GLU 72 HG3 GLU 72 12.455 10.357 -2.147 498 H GLY 73 H GLY 73 13.760 7.639 -2.484 499 HA2 GLY 73 HA2 GLY 73 16.339 7.538 -1.470 500 HA3 GLY 73 HA3 GLY 73 15.720 5.887 -1.393 501 H PHE 74 H PHE 74 17.161 5.133 -2.989 502 HA PHE 74 HA PHE 74 17.021 6.225 -5.646 503 HB2 PHE 74 HB2 PHE 74 18.481 4.176 -6.180 504 HB3 PHE 74 HB3 PHE 74 19.151 5.374 -5.091 505 HD1 PHE 74 HD1 PHE 74 19.489 4.852 -2.724 506 HD2 PHE 74 HD2 PHE 74 17.963 1.927 -5.413 507 HE1 PHE 74 HE1 PHE 74 20.006 3.088 -1.095 508 HE2 PHE 74 HE2 PHE 74 18.472 0.159 -3.780 509 HZ PHE 74 HZ PHE 74 19.493 0.739 -1.618 510 H ALA 75 H ALA 75 17.113 3.128 -6.493 511 HA ALA 75 HA ALA 75 14.207 2.984 -6.860 512 HB1 ALA 75 HB1 ALA 75 15.293 3.439 -9.014 513 HB2 ALA 75 HB2 ALA 75 14.596 1.817 -8.984 514 HB3 ALA 75 HB3 ALA 75 16.335 2.036 -8.784 515 HA PRO 76 HA PRO 76 15.580 -0.485 -4.320 516 HB2 PRO 76 HB2 PRO 76 12.941 -0.629 -3.189 517 HB3 PRO 76 HB3 PRO 76 14.412 0.013 -2.457 518 HG2 PRO 76 HG2 PRO 76 12.250 1.550 -3.144 519 HG3 PRO 76 HG3 PRO 76 13.909 2.163 -3.032 520 HD2 PRO 76 HD2 PRO 76 12.360 1.326 -5.460 521 HD3 PRO 76 HD3 PRO 76 13.419 2.740 -5.229 522 H LEU 77 H LEU 77 15.341 -2.697 -4.335 523 HA LEU 77 HA LEU 77 13.857 -3.655 -6.644 524 HB2 LEU 77 HB2 LEU 77 16.359 -4.108 -6.054 525 HB3 LEU 77 HB3 LEU 77 15.715 -5.323 -4.973 526 HG LEU 77 HG LEU 77 14.792 -5.450 -7.793 527 HD11 LEU 77 HD11 LEU 77 16.834 -6.601 -8.494 528 HD12 LEU 77 HD12 LEU 77 17.582 -6.221 -6.944 529 HD13 LEU 77 HD13 LEU 77 17.163 -4.923 -8.061 530 HD21 LEU 77 HD21 LEU 77 15.060 -7.847 -7.386 531 HD22 LEU 77 HD22 LEU 77 14.057 -7.095 -6.145 532 HD23 LEU 77 HD23 LEU 77 15.738 -7.504 -5.794 533 H SER 78 H SER 78 14.507 -5.526 -3.674 534 HA SER 78 HA SER 78 11.661 -6.204 -3.656 535 HB2 SER 78 HB2 SER 78 13.362 -8.039 -3.611 536 HB3 SER 78 HB3 SER 78 13.898 -7.453 -2.037 537 HG SER 78 HG SER 78 11.229 -8.257 -2.614 538 H VAL 79 H VAL 79 10.609 -4.606 -2.696 539 HA VAL 79 HA VAL 79 11.671 -3.345 -0.281 540 HB VAL 79 HB VAL 79 9.063 -2.598 -1.590 541 HG11 VAL 79 HG11 VAL 79 9.592 -0.380 -0.725 542 HG12 VAL 79 HG12 VAL 79 11.125 -0.984 -0.097 543 HG13 VAL 79 HG13 VAL 79 9.604 -1.586 0.562 544 HG21 VAL 79 HG21 VAL 79 10.700 -2.661 -3.402 545 HG22 VAL 79 HG22 VAL 79 11.776 -1.618 -2.471 546 HG23 VAL 79 HG23 VAL 79 10.218 -1.006 -3.029 547 H ARG 80 H ARG 80 10.939 -3.861 1.710 548 HA ARG 80 HA ARG 80 8.914 -5.889 1.953 549 HB2 ARG 80 HB2 ARG 80 9.455 -5.826 4.386 550 HB3 ARG 80 HB3 ARG 80 10.833 -6.158 3.350 551 HG2 ARG 80 HG2 ARG 80 11.632 -3.896 3.623 552 HG3 ARG 80 HG3 ARG 80 10.201 -3.478 4.565 553 HD2 ARG 80 HD2 ARG 80 11.990 -3.857 6.085 554 HD3 ARG 80 HD3 ARG 80 10.870 -5.209 6.217 555 HE ARG 80 HE ARG 80 12.459 -6.555 4.993 556 HH11 ARG 80 HH11 ARG 80 13.654 -3.419 5.999 557 HH12 ARG 80 HH12 ARG 80 15.312 -3.920 6.097 558 HH21 ARG 80 HH21 ARG 80 14.652 -7.241 5.080 559 HH22 ARG 80 HH22 ARG 80 15.883 -6.119 5.576 560 H PHE 81 H PHE 81 6.879 -5.493 1.993 561 HA PHE 81 HA PHE 81 5.895 -3.217 3.586 562 HB2 PHE 81 HB2 PHE 81 4.474 -4.515 1.245 563 HB3 PHE 81 HB3 PHE 81 3.905 -3.142 2.179 564 HD1 PHE 81 HD2 PHE 81 5.425 -1.020 2.110 565 HD2 PHE 81 HD1 PHE 81 5.571 -4.183 -0.737 566 HE1 PHE 81 HE2 PHE 81 6.464 0.498 0.476 567 HE2 PHE 81 HE1 PHE 81 6.608 -2.669 -2.374 568 HZ PHE 81 HZ PHE 81 7.054 -0.327 -1.768 569 H LYS 82 H LYS 82 4.847 -3.874 5.343 570 HA LYS 82 HA LYS 82 3.628 -6.550 5.295 571 HB2 LYS 82 HB2 LYS 82 5.094 -5.144 7.506 572 HB3 LYS 82 HB3 LYS 82 3.896 -6.374 7.875 573 HG2 LYS 82 HG2 LYS 82 6.302 -6.808 6.115 574 HG3 LYS 82 HG3 LYS 82 6.214 -7.230 7.829 575 HD2 LYS 82 HD2 LYS 82 4.271 -8.689 7.316 576 HD3 LYS 82 HD3 LYS 82 4.494 -8.327 5.606 577 HE2 LYS 82 HE2 LYS 82 6.578 -9.613 7.365 578 HE3 LYS 82 HE3 LYS 82 5.471 -10.499 6.321 579 HZ1 LYS 82 HZ1 LYS 82 6.419 -9.255 4.419 580 HZ2 LYS 82 HZ2 LYS 82 7.547 -10.239 5.207 581 HZ3 LYS 82 HZ3 LYS 82 7.562 -8.568 5.468 582 H ASP 83 H ASP 83 1.583 -6.726 5.702 583 HA ASP 83 HA ASP 83 -0.020 -4.349 6.033 584 HB2 ASP 83 HB2 ASP 83 -0.755 -6.068 4.468 585 HB3 ASP 83 HB3 ASP 83 -0.734 -7.283 5.732 586 H PHE 84 H PHE 84 -0.982 -3.678 7.831 587 HA PHE 84 HA PHE 84 -1.134 -5.482 10.151 588 HB2 PHE 84 HB2 PHE 84 -0.141 -2.617 10.171 589 HB3 PHE 84 HB3 PHE 84 -0.640 -3.477 11.622 590 HD1 PHE 84 HD2 PHE 84 0.530 -5.899 11.823 591 HD2 PHE 84 HD1 PHE 84 2.103 -2.535 9.745 592 HE1 PHE 84 HE2 PHE 84 2.795 -6.835 12.029 593 HE2 PHE 84 HE1 PHE 84 4.368 -3.468 9.950 594 HZ PHE 84 HZ PHE 84 4.717 -5.619 11.092 595 H SER 85 H SER 85 -2.873 -4.371 7.968 596 HA SER 85 HA SER 85 -4.703 -2.518 9.032 597 HB2 SER 85 HB2 SER 85 -5.074 -4.536 6.814 598 HB3 SER 85 HB3 SER 85 -6.066 -3.104 7.094 599 HG SER 85 HG SER 85 -3.713 -3.327 5.796 600 H GLU 86 H GLU 86 -6.325 -2.753 10.387 601 HA GLU 86 HA GLU 86 -6.947 -5.453 11.350 602 HB2 GLU 86 HB2 GLU 86 -7.494 -2.783 12.651 603 HB3 GLU 86 HB3 GLU 86 -7.725 -4.366 13.374 604 HG2 GLU 86 HG2 GLU 86 -5.348 -4.754 13.400 605 HG3 GLU 86 HG3 GLU 86 -5.066 -3.246 12.529 606 H ASN 87 H ASN 87 -9.085 -6.015 11.757 607 HA ASN 87 HA ASN 87 -11.300 -6.280 11.372 608 HB2 ASN 87 HB2 ASN 87 -11.301 -3.268 11.091 609 HB3 ASN 87 HB3 ASN 87 -12.751 -4.260 11.161 610 HD21 ASN 87 HD21 ASN 87 -10.194 -2.809 12.950 611 HD22 ASN 87 HD22 ASN 87 -10.749 -3.248 14.523 612 H ALA 88 H ALA 88 -9.419 -6.440 9.165 613 HA ALA 88 HA ALA 88 -10.959 -5.422 6.895 614 HB1 ALA 88 HB1 ALA 88 -8.952 -5.847 5.579 615 HB2 ALA 88 HB2 ALA 88 -8.167 -6.552 6.993 616 HB3 ALA 88 HB3 ALA 88 -8.586 -4.839 6.981 617 H THR 89 H THR 89 -11.988 -6.700 5.543 618 HA THR 89 HA THR 89 -11.987 -9.575 5.918 619 HB THR 89 HB THR 89 -13.480 -7.920 3.858 620 HG1 THR 89 HG1 THR 89 -13.904 -8.357 6.580 621 HG21 THR 89 HG21 THR 89 -14.075 -10.657 5.003 622 HG22 THR 89 HG22 THR 89 -13.421 -10.344 3.394 623 HG23 THR 89 HG23 THR 89 -15.046 -9.794 3.808 624 H SER 90 H SER 90 -11.329 -7.254 3.299 625 HA SER 90 HA SER 90 -9.461 -9.191 2.118 626 HB2 SER 90 HB2 SER 90 -11.339 -7.341 0.620 627 HB3 SER 90 HB3 SER 90 -10.165 -8.433 -0.114 628 HG SER 90 HG SER 90 -12.508 -9.109 0.136 629 H ARG 91 H ARG 91 -7.575 -8.293 1.246 630 HA ARG 91 HA ARG 91 -7.266 -5.396 1.618 631 HB2 ARG 91 HB2 ARG 91 -4.789 -5.836 1.644 632 HB3 ARG 91 HB3 ARG 91 -5.674 -6.447 3.032 633 HG2 ARG 91 HG2 ARG 91 -5.688 -8.689 1.866 634 HG3 ARG 91 HG3 ARG 91 -4.528 -7.995 0.731 635 HD2 ARG 91 HD2 ARG 91 -3.487 -9.270 2.596 636 HD3 ARG 91 HD3 ARG 91 -2.952 -7.596 2.480 637 HE ARG 91 HE ARG 91 -3.932 -7.143 4.512 638 HH11 ARG 91 HH11 ARG 91 -4.998 -10.339 3.456 639 HH12 ARG 91 HH12 ARG 91 -5.673 -10.751 5.006 640 HH21 ARG 91 HH21 ARG 91 -4.792 -7.697 6.526 641 HH22 ARG 91 HH22 ARG 91 -5.548 -9.246 6.752 642 H LEU 92 H LEU 92 -6.498 -4.156 -0.021 643 HA LEU 92 HA LEU 92 -6.457 -5.457 -2.659 644 HB2 LEU 92 HB2 LEU 92 -8.586 -4.197 -1.992 645 HB3 LEU 92 HB3 LEU 92 -7.615 -2.741 -2.038 646 HG LEU 92 HG LEU 92 -7.083 -3.435 -4.472 647 HD11 LEU 92 HD11 LEU 92 -8.876 -4.732 -5.529 648 HD12 LEU 92 HD12 LEU 92 -9.564 -5.057 -3.937 649 HD13 LEU 92 HD13 LEU 92 -7.970 -5.684 -4.353 650 HD21 LEU 92 HD21 LEU 92 -9.095 -2.299 -5.263 651 HD22 LEU 92 HD22 LEU 92 -8.424 -1.492 -3.845 652 HD23 LEU 92 HD23 LEU 92 -9.847 -2.521 -3.683 653 H TRP 93 H TRP 93 -4.366 -5.283 -3.264 654 HA TRP 93 HA TRP 93 -2.927 -2.813 -2.732 655 HB2 TRP 93 HB2 TRP 93 -2.111 -5.429 -4.011 656 HB3 TRP 93 HB3 TRP 93 -1.064 -4.015 -4.012 657 HD1 TRP 93 HD1 TRP 93 -1.866 -7.009 -2.009 658 HE1 TRP 93 HE1 TRP 93 -0.707 -6.896 0.293 659 HE3 TRP 93 HE3 TRP 93 -0.512 -2.073 -2.026 660 HZ2 TRP 93 HZ2 TRP 93 0.572 -4.954 1.898 661 HZ3 TRP 93 HZ3 TRP 93 0.667 -1.172 -0.068 662 HH2 TRP 93 HH2 TRP 93 1.196 -2.580 1.852 663 H MET 94 H MET 94 -3.352 -1.172 -4.012 664 HA MET 94 HA MET 94 -3.522 -1.735 -6.875 665 HB2 MET 94 HB2 MET 94 -4.941 0.294 -7.135 666 HB3 MET 94 HB3 MET 94 -5.706 -1.017 -6.260 667 HG2 MET 94 HG2 MET 94 -5.466 0.128 -4.189 668 HG3 MET 94 HG3 MET 94 -4.448 1.369 -4.928 669 HE1 MET 94 HE1 MET 94 -7.598 3.524 -4.251 670 HE2 MET 94 HE2 MET 94 -5.835 3.458 -4.209 671 HE3 MET 94 HE3 MET 94 -6.782 2.361 -3.204 672 H PHE 95 H PHE 95 -1.842 -1.158 -7.863 673 HA PHE 95 HA PHE 95 -0.309 1.177 -6.983 674 HB2 PHE 95 HB2 PHE 95 0.450 -0.954 -9.000 675 HB3 PHE 95 HB3 PHE 95 1.502 0.305 -8.370 676 HD1 PHE 95 HD2 PHE 95 2.140 0.245 -5.927 677 HD2 PHE 95 HD1 PHE 95 0.187 -3.004 -7.872 678 HE1 PHE 95 HE2 PHE 95 2.858 -1.268 -4.121 679 HE2 PHE 95 HE1 PHE 95 0.902 -4.517 -6.071 680 HZ PHE 95 HZ PHE 95 2.240 -3.651 -4.193 681 H GLY 96 H GLY 96 -2.688 0.322 -9.159 682 HA2 GLY 96 HA2 GLY 96 -3.754 1.761 -10.679 683 HA3 GLY 96 HA3 GLY 96 -2.305 2.751 -10.724 684 H ASP 97 H ASP 97 -1.362 -0.356 -11.034 685 HA ASP 97 HA ASP 97 -1.417 -0.286 -13.960 686 HB2 ASP 97 HB2 ASP 97 0.722 0.727 -13.145 687 HB3 ASP 97 HB3 ASP 97 1.083 -0.780 -12.314 688 H GLY 98 H GLY 98 -2.436 -2.083 -14.532 689 HA2 GLY 98 HA2 GLY 98 -2.589 -4.414 -14.812 690 HA3 GLY 98 HA3 GLY 98 -1.591 -4.631 -13.383 691 H ASN 99 H ASN 99 -2.801 -5.931 -12.196 692 HA ASN 99 HA ASN 99 -5.654 -5.451 -11.868 693 HB2 ASN 99 HB2 ASN 99 -3.869 -7.719 -11.013 694 HB3 ASN 99 HB3 ASN 99 -5.499 -7.553 -10.375 695 HD21 ASN 99 HD21 ASN 99 -4.402 -9.683 -11.939 696 HD22 ASN 99 HD22 ASN 99 -5.348 -9.782 -13.391 697 H THR 100 H THR 100 -6.696 -5.249 -9.887 698 HA THR 100 HA THR 100 -5.132 -4.173 -7.662 699 HB THR 100 HB THR 100 -7.437 -3.828 -6.640 700 HG1 THR 100 HG1 THR 100 -8.529 -5.358 -8.014 701 HG21 THR 100 HG21 THR 100 -6.247 -2.000 -7.683 702 HG22 THR 100 HG22 THR 100 -7.965 -1.897 -8.076 703 HG23 THR 100 HG23 THR 100 -6.818 -2.500 -9.275 704 H SER 101 H SER 101 -4.976 -5.146 -5.694 705 HA SER 101 HA SER 101 -4.720 -6.769 -4.158 706 HB2 SER 101 HB2 SER 101 -7.131 -7.177 -4.181 707 HB3 SER 101 HB3 SER 101 -6.960 -8.250 -5.569 708 HG SER 101 HG SER 101 -6.037 -9.767 -4.308 709 H ASP 102 H ASP 102 -5.305 -8.448 -7.248 710 HA ASP 102 HA ASP 102 -2.969 -10.150 -6.936 711 HB2 ASP 102 HB2 ASP 102 -5.053 -11.033 -7.918 712 HB3 ASP 102 HB3 ASP 102 -4.988 -9.816 -9.181 713 H SER 103 H SER 103 -1.178 -10.091 -8.474 714 HA SER 103 HA SER 103 -1.162 -7.885 -10.363 715 HB2 SER 103 HB2 SER 103 1.223 -7.303 -9.735 716 HB3 SER 103 HB3 SER 103 0.014 -6.849 -8.534 717 HG SER 103 HG SER 103 1.268 -9.349 -8.333 718 HA PRO 104 HA PRO 104 0.246 -11.541 -12.682 719 HB2 PRO 104 HB2 PRO 104 0.072 -9.610 -14.918 720 HB3 PRO 104 HB3 PRO 104 -0.675 -11.201 -14.747 721 HG2 PRO 104 HG2 PRO 104 -2.139 -8.975 -14.566 722 HG3 PRO 104 HG3 PRO 104 -2.470 -10.377 -13.531 723 HD2 PRO 104 HD2 PRO 104 -1.023 -7.835 -12.873 724 HD3 PRO 104 HD3 PRO 104 -2.216 -8.730 -11.907 725 H SER 105 H SER 105 1.364 -8.237 -13.472 726 HA SER 105 HA SER 105 4.126 -9.187 -13.183 727 HB2 SER 105 HB2 SER 105 3.133 -6.439 -14.017 728 HB3 SER 105 HB3 SER 105 4.802 -7.007 -14.068 729 HG SER 105 HG SER 105 2.662 -7.578 -15.768 730 HA PRO 106 HA PRO 106 3.227 -7.899 -8.913 731 HB2 PRO 106 HB2 PRO 106 5.932 -9.001 -8.448 732 HB3 PRO 106 HB3 PRO 106 4.400 -9.415 -7.670 733 HG2 PRO 106 HG2 PRO 106 5.531 -11.088 -9.403 734 HG3 PRO 106 HG3 PRO 106 3.771 -10.850 -9.394 735 HD2 PRO 106 HD2 PRO 106 5.831 -9.653 -11.220 736 HD3 PRO 106 HD3 PRO 106 4.265 -10.387 -11.630 737 H LEU 107 H LEU 107 3.368 -5.837 -8.518 738 HA LEU 107 HA LEU 107 5.781 -4.341 -9.212 739 HB2 LEU 107 HB2 LEU 107 3.025 -3.392 -8.436 740 HB3 LEU 107 HB3 LEU 107 4.351 -2.362 -8.941 741 HG LEU 107 HG LEU 107 3.082 -4.482 -10.669 742 HD11 LEU 107 HD11 LEU 107 1.538 -2.674 -10.199 743 HD12 LEU 107 HD12 LEU 107 2.091 -2.611 -11.874 744 HD13 LEU 107 HD13 LEU 107 2.756 -1.493 -10.681 745 HD21 LEU 107 HD21 LEU 107 5.422 -4.042 -11.228 746 HD22 LEU 107 HD22 LEU 107 5.079 -2.313 -11.322 747 HD23 LEU 107 HD23 LEU 107 4.340 -3.424 -12.477 748 H HIS 108 H HIS 108 5.858 -6.021 -6.987 749 HA HIS 108 HA HIS 108 6.067 -4.183 -4.703 750 HB2 HIS 108 HB2 HIS 108 6.562 -7.184 -4.755 751 HB3 HIS 108 HB3 HIS 108 6.394 -6.168 -3.329 752 HD1 HIS 108 HD1 HIS 108 4.015 -5.775 -2.451 753 HD2 HIS 108 HD2 HIS 108 4.104 -7.708 -6.139 754 HE1 HIS 108 HE1 HIS 108 1.646 -6.494 -2.905 755 HE2 HIS 108 HE2 HIS 108 1.721 -7.689 -5.124 756 H THR 109 H THR 109 7.688 -5.113 -7.317 757 HA THR 109 HA THR 109 10.330 -4.540 -6.192 758 HB THR 109 HB THR 109 9.658 -6.421 -8.477 759 HG1 THR 109 HG1 THR 109 10.166 -6.743 -5.778 760 HG21 THR 109 HG21 THR 109 12.073 -6.909 -8.544 761 HG22 THR 109 HG22 THR 109 12.357 -5.639 -7.351 762 HG23 THR 109 HG23 THR 109 11.733 -5.226 -8.949 763 H PHE 110 H PHE 110 11.045 -2.631 -6.935 764 HA PHE 110 HA PHE 110 9.818 -1.543 -9.361 765 HB2 PHE 110 HB2 PHE 110 11.587 -0.097 -7.371 766 HB3 PHE 110 HB3 PHE 110 10.648 0.626 -8.671 767 HD1 PHE 110 HD2 PHE 110 8.016 -0.362 -8.486 768 HD2 PHE 110 HD1 PHE 110 10.745 0.419 -5.312 769 HE1 PHE 110 HE2 PHE 110 6.126 -0.079 -6.935 770 HE2 PHE 110 HE1 PHE 110 8.859 0.698 -3.759 771 HZ PHE 110 HZ PHE 110 6.547 0.450 -4.567 772 H PHE 111 H PHE 111 10.804 -2.078 -11.123 773 HA PHE 111 HA PHE 111 13.526 -2.963 -11.181 774 HB2 PHE 111 HB2 PHE 111 11.620 -2.514 -13.494 775 HB3 PHE 111 HB3 PHE 111 13.125 -3.421 -13.552 776 HD1 PHE 111 HD1 PHE 111 13.304 -5.554 -12.199 777 HD2 PHE 111 HD2 PHE 111 9.612 -3.536 -12.852 778 HE1 PHE 111 HE1 PHE 111 12.077 -7.609 -11.619 779 HE2 PHE 111 HE2 PHE 111 8.383 -5.582 -12.268 780 HZ PHE 111 HZ PHE 111 9.615 -7.623 -11.650 781 H ASN 112 H ASN 112 11.977 0.045 -11.730 782 HA ASN 112 HA ASN 112 14.504 1.242 -12.565 783 HB2 ASN 112 HB2 ASN 112 11.959 1.329 -14.124 784 HB3 ASN 112 HB3 ASN 112 12.956 2.781 -14.081 785 HD21 ASN 112 HD21 ASN 112 12.313 0.967 -16.300 786 HD22 ASN 112 HD22 ASN 112 13.835 0.418 -16.915 787 H GLU 113 H GLU 113 14.087 3.757 -12.688 788 HA GLU 113 HA GLU 113 13.230 4.517 -10.022 789 HB2 GLU 113 HB2 GLU 113 14.513 6.179 -12.210 790 HB3 GLU 113 HB3 GLU 113 14.280 6.678 -10.541 791 HG2 GLU 113 HG2 GLU 113 16.394 5.998 -10.299 792 HG3 GLU 113 HG3 GLU 113 15.667 4.399 -10.172 793 H GLY 114 H GLY 114 12.144 6.832 -9.918 794 HA2 GLY 114 HA2 GLY 114 10.674 8.211 -11.545 795 HA3 GLY 114 HA3 GLY 114 9.769 6.708 -11.651 796 H GLU 115 H GLU 115 7.884 7.284 -10.710 797 HA GLU 115 HA GLU 115 7.976 7.960 -7.865 798 HB2 GLU 115 HB2 GLU 115 7.680 10.059 -9.224 799 HB3 GLU 115 HB3 GLU 115 6.170 9.389 -9.824 800 HG2 GLU 115 HG2 GLU 115 5.254 9.357 -7.575 801 HG3 GLU 115 HG3 GLU 115 6.785 9.931 -6.921 802 H TYR 116 H TYR 116 6.860 6.443 -6.857 803 HA TYR 116 HA TYR 116 4.674 5.089 -8.304 804 HB2 TYR 116 HB2 TYR 116 6.575 3.917 -6.249 805 HB3 TYR 116 HB3 TYR 116 5.268 3.048 -7.044 806 HD1 TYR 116 HD1 TYR 116 5.438 2.488 -9.445 807 HD2 TYR 116 HD2 TYR 116 8.674 4.299 -7.352 808 HE1 TYR 116 HE1 TYR 116 6.965 1.860 -11.266 809 HE2 TYR 116 HE2 TYR 116 10.206 3.678 -9.170 810 HH TYR 116 HH TYR 116 10.399 2.180 -10.983 811 H ILE 117 H ILE 117 2.917 4.322 -6.985 812 HA ILE 117 HA ILE 117 2.761 5.596 -4.334 813 HB ILE 117 HB ILE 117 0.487 5.282 -6.313 814 HG12 ILE 117 HG12 ILE 117 2.063 7.169 -6.740 815 HG13 ILE 117 HG13 ILE 117 0.415 7.687 -6.412 816 HG21 ILE 117 HG21 ILE 117 -0.907 6.448 -4.639 817 HG22 ILE 117 HG22 ILE 117 0.418 6.319 -3.479 818 HG23 ILE 117 HG23 ILE 117 -0.360 4.861 -4.096 819 HD11 ILE 117 HD11 ILE 117 1.087 8.284 -4.126 820 HD12 ILE 117 HD12 ILE 117 2.027 9.147 -5.345 821 HD13 ILE 117 HD13 ILE 117 2.736 7.774 -4.494 822 H VAL 118 H VAL 118 2.801 4.116 -2.829 823 HA VAL 118 HA VAL 118 1.608 1.492 -3.281 824 HB VAL 118 HB VAL 118 3.222 2.594 -0.962 825 HG11 VAL 118 HG11 VAL 118 2.092 -0.187 -1.282 826 HG12 VAL 118 HG12 VAL 118 1.591 1.003 -0.080 827 HG13 VAL 118 HG13 VAL 118 3.221 0.327 -0.028 828 HG21 VAL 118 HG21 VAL 118 4.868 0.923 -1.682 829 HG22 VAL 118 HG22 VAL 118 4.520 2.106 -2.946 830 HG23 VAL 118 HG23 VAL 118 3.816 0.490 -3.031 831 H SER 119 H SER 119 -0.509 1.392 -3.033 832 HA SER 119 HA SER 119 -1.717 2.900 -0.823 833 HB2 SER 119 HB2 SER 119 -2.383 3.788 -3.042 834 HB3 SER 119 HB3 SER 119 -3.019 2.199 -3.468 835 HG SER 119 HG SER 119 -4.544 2.404 -1.836 836 H LEU 120 H LEU 120 -2.186 1.588 0.723 837 HA LEU 120 HA LEU 120 -3.237 -1.083 0.125 838 HB2 LEU 120 HB2 LEU 120 -1.337 -1.005 1.674 839 HB3 LEU 120 HB3 LEU 120 -2.204 0.107 2.708 840 HG LEU 120 HG LEU 120 -3.752 -1.627 3.390 841 HD11 LEU 120 HD11 LEU 120 -3.570 -3.927 2.588 842 HD12 LEU 120 HD12 LEU 120 -2.305 -3.447 1.457 843 HD13 LEU 120 HD13 LEU 120 -3.948 -2.834 1.255 844 HD21 LEU 120 HD21 LEU 120 -0.919 -2.631 3.406 845 HD22 LEU 120 HD22 LEU 120 -2.212 -3.145 4.490 846 HD23 LEU 120 HD23 LEU 120 -1.619 -1.485 4.548 847 H ILE 121 H ILE 121 -5.348 -1.098 -0.088 848 HA ILE 121 HA ILE 121 -6.923 0.478 1.802 849 HB ILE 121 HB ILE 121 -7.314 1.623 -0.240 850 HG12 ILE 121 HG12 ILE 121 -9.636 -0.303 -0.044 851 HG13 ILE 121 HG13 ILE 121 -9.334 0.957 1.144 852 HG21 ILE 121 HG21 ILE 121 -7.746 -1.038 -1.584 853 HG22 ILE 121 HG22 ILE 121 -6.394 0.070 -1.828 854 HG23 ILE 121 HG23 ILE 121 -8.018 0.537 -2.332 855 HD11 ILE 121 HD11 ILE 121 -9.602 2.650 -0.597 856 HD12 ILE 121 HD12 ILE 121 -11.033 1.633 -0.434 857 HD13 ILE 121 HD13 ILE 121 -9.920 1.379 -1.779 858 H VAL 122 H VAL 122 -8.288 -0.674 2.952 859 HA VAL 122 HA VAL 122 -8.583 -3.485 2.173 860 HB VAL 122 HB VAL 122 -8.920 -3.961 4.628 861 HG11 VAL 122 HG11 VAL 122 -6.502 -3.950 5.103 862 HG12 VAL 122 HG12 VAL 122 -6.250 -2.889 3.716 863 HG13 VAL 122 HG13 VAL 122 -6.866 -4.524 3.476 864 HG21 VAL 122 HG21 VAL 122 -7.756 -1.189 4.938 865 HG22 VAL 122 HG22 VAL 122 -7.975 -2.366 6.234 866 HG23 VAL 122 HG23 VAL 122 -9.380 -1.693 5.408 867 H SER 123 H SER 123 -10.544 -4.523 2.706 868 HA SER 123 HA SER 123 -12.785 -2.635 2.564 869 HB2 SER 123 HB2 SER 123 -12.553 -5.215 0.995 870 HB3 SER 123 HB3 SER 123 -13.794 -3.963 0.835 871 HG SER 123 HG SER 123 -11.449 -4.148 -0.417 872 H ASN 124 H ASN 124 -14.771 -3.464 3.322 873 HA ASN 124 HA ASN 124 -14.778 -5.962 4.819 874 HB2 ASN 124 HB2 ASN 124 -13.945 -4.138 6.347 875 HB3 ASN 124 HB3 ASN 124 -15.428 -3.255 6.044 876 HD21 ASN 124 HD21 ASN 124 -14.028 -6.055 7.583 877 HD22 ASN 124 HD22 ASN 124 -15.319 -6.325 8.699 878 H GLU 125 H GLU 125 -17.187 -6.139 5.743 879 HA GLU 125 HA GLU 125 -18.981 -5.874 3.532 880 HB2 GLU 125 HB2 GLU 125 -20.634 -6.854 5.160 881 HB3 GLU 125 HB3 GLU 125 -19.176 -7.806 4.926 882 HG2 GLU 125 HG2 GLU 125 -18.268 -6.806 7.027 883 HG3 GLU 125 HG3 GLU 125 -19.834 -6.038 7.274 884 H ASN 126 H ASN 126 -18.054 -3.768 5.966 885 HA ASN 126 HA ASN 126 -20.596 -2.314 6.027 886 HB2 ASN 126 HB2 ASN 126 -18.111 -2.168 7.735 887 HB3 ASN 126 HB3 ASN 126 -19.454 -1.035 7.886 888 HD21 ASN 126 HD21 ASN 126 -18.236 -3.277 9.575 889 HD22 ASN 126 HD22 ASN 126 -19.619 -4.192 10.076 890 H ASP 127 H ASP 127 -17.111 -1.674 5.637 891 HA ASP 127 HA ASP 127 -17.605 0.493 3.796 892 HB2 ASP 127 HB2 ASP 127 -17.944 1.402 6.174 893 HB3 ASP 127 HB3 ASP 127 -16.227 1.128 6.416 894 H SER 128 H SER 128 -15.333 1.588 3.340 895 HA SER 128 HA SER 128 -13.190 -0.405 3.651 896 HB2 SER 128 HB2 SER 128 -12.349 0.395 1.378 897 HB3 SER 128 HB3 SER 128 -13.808 -0.594 1.355 898 HG SER 128 HG SER 128 -14.848 1.653 1.493 899 H ASP 129 H ASP 129 -11.075 0.446 3.899 900 HA ASP 129 HA ASP 129 -10.869 3.360 4.298 901 HB2 ASP 129 HB2 ASP 129 -11.289 2.152 6.496 902 HB3 ASP 129 HB3 ASP 129 -9.741 1.348 6.259 903 H SER 130 H SER 130 -8.885 4.223 3.684 904 HA SER 130 HA SER 130 -6.860 2.286 2.794 905 HB2 SER 130 HB2 SER 130 -6.420 3.808 0.853 906 HB3 SER 130 HB3 SER 130 -8.005 3.033 0.817 907 HG SER 130 HG SER 130 -8.013 5.436 2.130 908 H ALA 131 H ALA 131 -4.764 2.796 3.025 909 HA ALA 131 HA ALA 131 -4.013 5.510 3.870 910 HB1 ALA 131 HB1 ALA 131 -2.844 2.951 4.977 911 HB2 ALA 131 HB2 ALA 131 -3.903 4.058 5.849 912 HB3 ALA 131 HB3 ALA 131 -2.295 4.585 5.351 913 H SER 132 H SER 132 -2.176 6.289 2.841 914 HA SER 132 HA SER 132 -0.901 4.489 0.908 915 HB2 SER 132 HB2 SER 132 -2.864 5.655 -0.151 916 HB3 SER 132 HB3 SER 132 -2.056 7.189 0.165 917 HG SER 132 HG SER 132 -0.948 5.070 -1.369 918 H VAL 133 H VAL 133 1.120 5.243 0.094 919 HA VAL 133 HA VAL 133 2.194 7.672 1.295 920 HB VAL 133 HB VAL 133 2.902 5.819 2.776 921 HG11 VAL 133 HG11 VAL 133 4.328 4.728 0.362 922 HG12 VAL 133 HG12 VAL 133 2.998 3.973 1.241 923 HG13 VAL 133 HG13 VAL 133 4.567 4.179 2.021 924 HG21 VAL 133 HG21 VAL 133 5.297 6.328 2.830 925 HG22 VAL 133 HG22 VAL 133 4.314 7.777 2.614 926 HG23 VAL 133 HG23 VAL 133 5.168 7.076 1.238 927 H THR 134 H THR 134 3.446 8.823 -0.051 928 HA THR 134 HA THR 134 3.694 8.011 -2.795 929 HB THR 134 HB THR 134 4.793 10.489 -1.445 930 HG1 THR 134 HG1 THR 134 2.861 11.456 -2.000 931 HG21 THR 134 HG21 THR 134 5.794 10.067 -3.632 932 HG22 THR 134 HG22 THR 134 4.715 11.460 -3.700 933 HG23 THR 134 HG23 THR 134 4.192 9.905 -4.351 934 H ILE 135 H ILE 135 5.296 6.960 -3.642 935 HA ILE 135 HA ILE 135 7.781 6.575 -2.130 936 HB ILE 135 HB ILE 135 6.796 5.075 -4.576 937 HG12 ILE 135 HG12 ILE 135 5.209 4.716 -2.774 938 HG13 ILE 135 HG13 ILE 135 6.146 3.251 -3.047 939 HG21 ILE 135 HG21 ILE 135 8.983 4.383 -2.617 940 HG22 ILE 135 HG22 ILE 135 9.192 4.885 -4.294 941 HG23 ILE 135 HG23 ILE 135 8.415 3.345 -3.926 942 HD11 ILE 135 HD11 ILE 135 6.605 5.224 -0.818 943 HD12 ILE 135 HD12 ILE 135 7.503 3.728 -1.083 944 HD13 ILE 135 HD13 ILE 135 5.787 3.669 -0.675 945 H ARG 136 H ARG 136 9.625 7.530 -2.811 946 HA ARG 136 HA ARG 136 9.670 8.613 -5.543 947 HB2 ARG 136 HB2 ARG 136 10.863 9.623 -2.991 948 HB3 ARG 136 HB3 ARG 136 11.595 10.044 -4.531 949 HG2 ARG 136 HG2 ARG 136 9.463 11.029 -5.254 950 HG3 ARG 136 HG3 ARG 136 8.771 10.638 -3.674 951 HD2 ARG 136 HD2 ARG 136 10.317 12.074 -2.564 952 HD3 ARG 136 HD3 ARG 136 11.239 12.316 -4.043 953 HE ARG 136 HE ARG 136 8.601 13.218 -4.449 954 HH11 ARG 136 HH11 ARG 136 11.426 14.042 -2.530 955 HH12 ARG 136 HH12 ARG 136 11.143 15.759 -2.613 956 HH21 ARG 136 HH21 ARG 136 8.219 15.484 -4.541 957 HH22 ARG 136 HH22 ARG 136 9.307 16.570 -3.729 958 H ALA 137 H ALA 137 10.924 7.613 -6.879 959 HA ALA 137 HA ALA 137 13.296 6.183 -5.857 960 HB1 ALA 137 HB1 ALA 137 13.162 4.791 -7.857 961 HB2 ALA 137 HB2 ALA 137 11.748 5.694 -8.410 962 HB3 ALA 137 HB3 ALA 137 11.652 4.713 -6.946 963 H LEU 138 H LEU 138 15.029 7.379 -6.114 964 HA LEU 138 HA LEU 138 15.059 9.495 -8.109 965 HB2 LEU 138 HB2 LEU 138 16.987 8.851 -5.872 966 HB3 LEU 138 HB3 LEU 138 17.153 10.211 -6.965 967 HG LEU 138 HG LEU 138 14.845 9.793 -5.059 968 HD11 LEU 138 HD11 LEU 138 17.202 11.663 -4.909 969 HD12 LEU 138 HD12 LEU 138 16.903 10.268 -3.871 970 HD13 LEU 138 HD13 LEU 138 15.819 11.658 -3.813 971 HD21 LEU 138 HD21 LEU 138 14.258 12.098 -5.626 972 HD22 LEU 138 HD22 LEU 138 14.188 11.044 -7.038 973 HD23 LEU 138 HD23 LEU 138 15.556 12.137 -6.821 974 H GLU 139 H GLU 139 16.611 9.757 -9.648 975 HA GLU 139 HA GLU 139 17.201 7.351 -11.019 976 HB2 GLU 139 HB2 GLU 139 17.983 10.207 -11.627 977 HB3 GLU 139 HB3 GLU 139 18.202 8.853 -12.724 978 HG2 GLU 139 HG2 GLU 139 15.832 8.546 -12.915 979 HG3 GLU 139 HG3 GLU 139 15.534 9.772 -11.678 980 H HIS 140 H HIS 140 19.019 6.249 -11.299 981 HA HIS 140 HA HIS 140 21.493 7.405 -10.262 982 HB2 HIS 140 HB2 HIS 140 22.517 5.146 -10.646 983 HB3 HIS 140 HB3 HIS 140 21.268 5.194 -9.421 984 HD1 HIS 140 HD1 HIS 140 22.100 3.715 -12.742 985 HD2 HIS 140 HD2 HIS 140 18.988 3.654 -9.977 986 HE1 HIS 140 HE1 HIS 140 20.634 1.774 -13.405 987 HE2 HIS 140 HE2 HIS 140 18.662 1.890 -11.847 988 H HIS 141 H HIS 141 22.457 8.663 -11.609 989 HA HIS 141 HA HIS 141 22.124 8.194 -14.479 990 HB2 HIS 141 HB2 HIS 141 21.344 10.370 -13.558 991 HB3 HIS 141 HB3 HIS 141 22.989 10.719 -13.050 992 HD1 HIS 141 HD1 HIS 141 24.211 12.186 -14.631 993 HD2 HIS 141 HD2 HIS 141 21.279 9.935 -16.554 994 HE1 HIS 141 HE1 HIS 141 24.293 12.892 -17.052 995 HE2 HIS 141 HE2 HIS 141 22.477 11.553 -18.188 996 H HIS 142 H HIS 142 23.718 7.258 -15.466 997 HA HIS 142 HA HIS 142 26.440 7.516 -14.491 998 HB2 HIS 142 HB2 HIS 142 25.746 5.310 -15.267 999 HB3 HIS 142 HB3 HIS 142 25.293 5.970 -16.829 1000 HD1 HIS 142 HD1 HIS 142 28.486 5.730 -14.737 1001 HD2 HIS 142 HD2 HIS 142 27.205 5.605 -18.694 1002 HE1 HIS 142 HE1 HIS 142 30.556 5.301 -16.108 1003 HE2 HIS 142 HE2 HIS 142 29.768 5.259 -18.501 1004 H HIS 143 H HIS 143 27.643 9.172 -15.060 1005 HA HIS 143 HA HIS 143 27.249 10.424 -17.684 1006 HB2 HIS 143 HB2 HIS 143 27.496 11.853 -15.591 1007 HB3 HIS 143 HB3 HIS 143 29.154 11.279 -15.488 1008 HD1 HIS 143 HD1 HIS 143 30.870 12.493 -16.849 1009 HD2 HIS 143 HD2 HIS 143 26.970 13.471 -17.937 1010 HE1 HIS 143 HE1 HIS 143 31.078 14.401 -18.484 1011 HE2 HIS 143 HE2 HIS 143 28.727 14.831 -19.287 1012 H HIS 144 H HIS 144 28.660 10.078 -19.311 1013 HA HIS 144 HA HIS 144 30.453 7.851 -18.949 1014 HB2 HIS 144 HB2 HIS 144 30.513 7.640 -21.301 1015 HB3 HIS 144 HB3 HIS 144 28.879 8.139 -20.930 1016 HD1 HIS 144 HD1 HIS 144 30.803 8.506 -23.603 1017 HD2 HIS 144 HD2 HIS 144 29.319 11.420 -21.029 1018 HE1 HIS 144 HE1 HIS 144 30.794 10.641 -24.933 1019 HE2 HIS 144 HE2 HIS 144 29.734 12.355 -23.414 1020 H HIS 145 H HIS 145 32.629 7.901 -20.134 1021 HA HIS 145 HA HIS 145 34.185 10.089 -19.034 1022 HB2 HIS 145 HB2 HIS 145 34.916 7.697 -18.883 1023 HB3 HIS 145 HB3 HIS 145 35.094 7.670 -20.629 1024 HD1 HIS 145 HD1 HIS 145 36.486 9.730 -17.720 1025 HD2 HIS 145 HD2 HIS 145 37.641 8.137 -21.393 1026 HE1 HIS 145 HE1 HIS 145 38.935 10.284 -17.960 1027 HE2 HIS 145 HE2 HIS 145 39.618 9.330 -20.201 Start of MODEL 14 1 H1 MET 1 H1 MET 1 85.890 -2.821 44.158 2 H2 MET 1 H2 MET 1 85.252 -1.259 43.991 3 H3 MET 1 H3 MET 1 86.823 -1.591 43.456 4 HA MET 1 HA MET 1 85.985 -3.067 41.757 5 HB2 MET 1 HB2 MET 1 83.250 -2.137 42.679 6 HB3 MET 1 HB3 MET 1 83.574 -3.143 41.278 7 HG2 MET 1 HG2 MET 1 82.836 -4.656 42.851 8 HG3 MET 1 HG3 MET 1 84.587 -4.794 42.976 9 HE1 MET 1 HE1 MET 1 81.292 -3.459 44.642 10 HE2 MET 1 HE2 MET 1 82.192 -1.967 44.369 11 HE3 MET 1 HE3 MET 1 81.925 -2.543 46.013 12 H ASN 2 H ASN 2 86.173 -2.079 39.803 13 HA ASN 2 HA ASN 2 85.634 0.785 39.678 14 HB2 ASN 2 HB2 ASN 2 87.759 -0.133 38.728 15 HB3 ASN 2 HB3 ASN 2 86.808 -1.005 37.532 16 HD21 ASN 2 HD21 ASN 2 87.709 0.045 35.798 17 HD22 ASN 2 HD22 ASN 2 87.386 1.705 35.430 18 H ALA 3 H ALA 3 83.464 0.903 39.719 19 HA ALA 3 HA ALA 3 81.974 -0.380 37.536 20 HB1 ALA 3 HB1 ALA 3 80.943 0.711 40.154 21 HB2 ALA 3 HB2 ALA 3 81.226 -0.991 39.793 22 HB3 ALA 3 HB3 ALA 3 79.982 -0.099 38.916 23 H ARG 4 H ARG 4 81.634 0.919 35.904 24 HA ARG 4 HA ARG 4 80.815 3.673 36.253 25 HB2 ARG 4 HB2 ARG 4 83.411 3.468 36.343 26 HB3 ARG 4 HB3 ARG 4 83.292 3.145 34.623 27 HG2 ARG 4 HG2 ARG 4 83.815 5.453 34.970 28 HG3 ARG 4 HG3 ARG 4 82.179 5.326 34.324 29 HD2 ARG 4 HD2 ARG 4 82.449 6.983 36.180 30 HD3 ARG 4 HD3 ARG 4 81.219 5.753 36.464 31 HE ARG 4 HE ARG 4 82.805 4.649 37.959 32 HH11 ARG 4 HH11 ARG 4 83.568 7.978 37.085 33 HH12 ARG 4 HH12 ARG 4 84.482 8.283 38.526 34 HH21 ARG 4 HH21 ARG 4 84.013 5.048 39.859 35 HH22 ARG 4 HH22 ARG 4 84.739 6.608 40.113 36 H ASP 5 H ASP 5 79.554 4.306 34.555 37 HA ASP 5 HA ASP 5 79.176 2.477 32.340 38 HB2 ASP 5 HB2 ASP 5 77.338 3.928 31.654 39 HB3 ASP 5 HB3 ASP 5 77.197 3.521 33.357 40 H ASN 6 H ASN 6 79.084 3.390 30.087 41 HA ASN 6 HA ASN 6 81.430 5.127 29.730 42 HB2 ASN 6 HB2 ASN 6 80.688 2.696 28.085 43 HB3 ASN 6 HB3 ASN 6 82.021 3.787 27.731 44 HD21 ASN 6 HD21 ASN 6 80.873 1.200 29.704 45 HD22 ASN 6 HD22 ASN 6 82.365 0.874 30.525 46 H LYS 7 H LYS 7 81.276 6.770 28.420 47 HA LYS 7 HA LYS 7 80.769 8.158 26.735 48 HB2 LYS 7 HB2 LYS 7 79.375 5.740 25.699 49 HB3 LYS 7 HB3 LYS 7 78.974 7.293 24.982 50 HG2 LYS 7 HG2 LYS 7 80.680 6.255 23.661 51 HG3 LYS 7 HG3 LYS 7 81.381 7.641 24.491 52 HD2 LYS 7 HD2 LYS 7 82.349 6.125 26.176 53 HD3 LYS 7 HD3 LYS 7 81.666 4.747 25.314 54 HE2 LYS 7 HE2 LYS 7 83.009 5.299 23.354 55 HE3 LYS 7 HE3 LYS 7 83.671 6.700 24.196 56 HZ1 LYS 7 HZ1 LYS 7 83.992 3.886 25.087 57 HZ2 LYS 7 HZ2 LYS 7 84.699 5.255 25.792 58 HZ3 LYS 7 HZ3 LYS 7 85.158 4.771 24.233 59 H PHE 8 H PHE 8 79.778 9.927 27.070 60 HA PHE 8 HA PHE 8 77.157 9.938 28.373 61 HB2 PHE 8 HB2 PHE 8 79.231 12.104 27.969 62 HB3 PHE 8 HB3 PHE 8 77.654 12.392 28.690 63 HD1 PHE 8 HD2 PHE 8 77.103 11.460 30.884 64 HD2 PHE 8 HD1 PHE 8 80.985 11.019 29.198 65 HE1 PHE 8 HE2 PHE 8 77.992 10.859 33.095 66 HE2 PHE 8 HE1 PHE 8 81.878 10.417 31.410 67 HZ PHE 8 HZ PHE 8 80.383 10.339 33.360 68 H ASN 9 H ASN 9 75.361 10.530 27.386 69 HA ASN 9 HA ASN 9 75.413 11.189 24.567 70 HB2 ASN 9 HB2 ASN 9 73.088 10.746 26.458 71 HB3 ASN 9 HB3 ASN 9 72.933 11.009 24.726 72 HD21 ASN 9 HD21 ASN 9 73.487 9.376 23.306 73 HD22 ASN 9 HD22 ASN 9 73.769 7.747 23.820 74 H THR 10 H THR 10 75.528 13.205 23.870 75 HA THR 10 HA THR 10 74.994 15.362 25.798 76 HB THR 10 HB THR 10 76.722 15.552 23.329 77 HG1 THR 10 HG1 THR 10 77.301 14.544 25.926 78 HG21 THR 10 HG21 THR 10 77.797 17.368 24.571 79 HG22 THR 10 HG22 THR 10 76.709 17.092 25.931 80 HG23 THR 10 HG23 THR 10 76.067 17.672 24.394 81 H TRP 11 H TRP 11 73.543 16.924 25.355 82 HA TRP 11 HA TRP 11 71.806 16.779 23.093 83 HB2 TRP 11 HB2 TRP 11 72.121 19.028 25.101 84 HB3 TRP 11 HB3 TRP 11 70.760 18.791 24.011 85 HD1 TRP 11 HD1 TRP 11 71.757 18.155 27.468 86 HE1 TRP 11 HE1 TRP 11 70.206 16.431 28.588 87 HE3 TRP 11 HE3 TRP 11 69.444 16.323 23.289 88 HZ2 TRP 11 HZ2 TRP 11 68.259 14.542 27.789 89 HZ3 TRP 11 HZ3 TRP 11 67.762 14.558 23.556 90 HH2 TRP 11 HH2 TRP 11 67.180 13.685 25.759 91 H ASN 12 H ASN 12 71.871 17.882 21.206 92 HA ASN 12 HA ASN 12 74.265 19.548 20.808 93 HB2 ASN 12 HB2 ASN 12 74.359 17.353 19.684 94 HB3 ASN 12 HB3 ASN 12 72.894 17.749 18.797 95 HD21 ASN 12 HD21 ASN 12 76.275 18.510 19.232 96 HD22 ASN 12 HD22 ASN 12 76.497 19.284 17.699 97 H ASP 13 H ASP 13 71.128 19.060 19.074 98 HA ASP 13 HA ASP 13 71.203 21.968 18.554 99 HB2 ASP 13 HB2 ASP 13 71.813 20.370 16.636 100 HB3 ASP 13 HB3 ASP 13 70.112 19.930 16.615 101 H SER 14 H SER 14 69.513 23.032 19.309 102 HA SER 14 HA SER 14 66.868 21.743 19.270 103 HB2 SER 14 HB2 SER 14 67.966 23.515 21.470 104 HB3 SER 14 HB3 SER 14 66.303 22.926 21.380 105 HG SER 14 HG SER 14 67.559 20.755 21.215 106 H ARG 15 H ARG 15 65.490 22.817 18.028 107 HA ARG 15 HA ARG 15 65.668 25.757 17.804 108 HB2 ARG 15 HB2 ARG 15 65.249 23.842 15.484 109 HB3 ARG 15 HB3 ARG 15 65.133 25.593 15.384 110 HG2 ARG 15 HG2 ARG 15 67.479 25.807 15.922 111 HG3 ARG 15 HG3 ARG 15 67.615 24.061 16.120 112 HD2 ARG 15 HD2 ARG 15 66.745 23.978 13.675 113 HD3 ARG 15 HD3 ARG 15 67.267 25.664 13.618 114 HE ARG 15 HE ARG 15 69.214 23.772 14.642 115 HH11 ARG 15 HH11 ARG 15 68.141 25.618 11.836 116 HH12 ARG 15 HH12 ARG 15 69.588 25.291 10.937 117 HH21 ARG 15 HH21 ARG 15 71.088 23.376 13.478 118 HH22 ARG 15 HH22 ARG 15 71.264 24.006 11.861 119 H GLY 16 H GLY 16 63.674 26.811 17.656 120 HA2 GLY 16 HA2 GLY 16 61.250 25.610 16.906 121 HA3 GLY 16 HA3 GLY 16 61.400 25.455 18.646 122 H ASN 17 H ASN 17 61.145 27.744 15.975 123 HA ASN 17 HA ASN 17 60.117 29.681 17.925 124 HB2 ASN 17 HB2 ASN 17 60.716 31.521 16.414 125 HB3 ASN 17 HB3 ASN 17 62.121 30.606 16.921 126 HD21 ASN 17 HD21 ASN 17 61.669 32.414 14.652 127 HD22 ASN 17 HD22 ASN 17 62.096 31.512 13.239 128 H TYR 18 H TYR 18 58.033 29.751 17.920 129 HA TYR 18 HA TYR 18 56.584 29.211 15.409 130 HB2 TYR 18 HB2 TYR 18 55.670 28.498 18.210 131 HB3 TYR 18 HB3 TYR 18 54.847 28.101 16.706 132 HD1 TYR 18 HD2 TYR 18 56.009 26.517 15.089 133 HD2 TYR 18 HD1 TYR 18 57.310 27.073 19.100 134 HE1 TYR 18 HE2 TYR 18 57.261 24.397 14.977 135 HE2 TYR 18 HE1 TYR 18 58.565 24.963 18.997 136 HH TYR 18 HH TYR 18 59.168 23.315 16.084 137 H TRP 19 H TRP 19 54.340 30.150 15.406 138 HA TRP 19 HA TRP 19 54.455 32.809 16.660 139 HB2 TRP 19 HB2 TRP 19 53.668 32.251 13.786 140 HB3 TRP 19 HB3 TRP 19 53.746 33.833 14.559 141 HD1 TRP 19 HD1 TRP 19 55.837 31.374 12.672 142 HE1 TRP 19 HE1 TRP 19 58.285 32.166 12.566 143 HE3 TRP 19 HE3 TRP 19 55.612 35.168 16.107 144 HZ2 TRP 19 HZ2 TRP 19 59.902 34.128 13.787 145 HZ3 TRP 19 HZ3 TRP 19 57.662 36.443 16.584 146 HH2 TRP 19 HH2 TRP 19 59.759 35.929 15.446 147 H SER 20 H SER 20 52.858 32.804 18.056 148 HA SER 20 HA SER 20 50.306 31.562 17.342 149 HB2 SER 20 HB2 SER 20 51.217 32.579 20.049 150 HB3 SER 20 HB3 SER 20 49.792 31.593 19.717 151 HG SER 20 HG SER 20 52.522 30.876 19.601 152 H ASP 21 H ASP 21 48.948 32.873 16.388 153 HA ASP 21 HA ASP 21 48.950 35.729 16.920 154 HB2 ASP 21 HB2 ASP 21 47.322 35.782 15.010 155 HB3 ASP 21 HB3 ASP 21 48.908 35.146 14.600 156 H TYR 22 H TYR 22 46.786 36.828 17.105 157 HA TYR 22 HA TYR 22 44.866 35.220 18.624 158 HB2 TYR 22 HB2 TYR 22 44.757 36.755 20.457 159 HB3 TYR 22 HB3 TYR 22 46.454 36.377 20.215 160 HD1 TYR 22 HD1 TYR 22 47.927 38.112 19.076 161 HD2 TYR 22 HD2 TYR 22 43.965 38.973 20.363 162 HE1 TYR 22 HE1 TYR 22 48.419 40.518 18.963 163 HE2 TYR 22 HE2 TYR 22 44.442 41.382 20.245 164 HH TYR 22 HH TYR 22 47.189 42.647 18.688 165 H GLU 23 H GLU 23 42.771 35.773 18.372 166 HA GLU 23 HA GLU 23 42.105 38.469 17.450 167 HB2 GLU 23 HB2 GLU 23 41.196 35.921 16.167 168 HB3 GLU 23 HB3 GLU 23 40.061 37.258 16.278 169 HG2 GLU 23 HG2 GLU 23 42.763 37.342 14.944 170 HG3 GLU 23 HG3 GLU 23 41.207 37.238 14.122 171 H GLY 24 H GLY 24 41.133 39.310 19.129 172 HA2 GLY 24 HA2 GLY 24 39.769 37.598 21.045 173 HA3 GLY 24 HA3 GLY 24 40.178 39.290 21.262 174 H SER 25 H SER 25 38.062 37.132 19.478 175 HA SER 25 HA SER 25 36.101 39.233 19.062 176 HB2 SER 25 HB2 SER 25 35.966 36.302 18.300 177 HB3 SER 25 HB3 SER 25 34.953 37.604 17.682 178 HG SER 25 HG SER 25 36.454 37.455 16.156 179 H ASP 26 H ASP 26 35.037 39.711 20.902 180 HA ASP 26 HA ASP 26 33.756 37.564 22.415 181 HB2 ASP 26 HB2 ASP 26 35.944 37.872 23.485 182 HB3 ASP 26 HB3 ASP 26 35.643 39.596 23.634 183 H GLU 27 H GLU 27 31.703 38.101 22.690 184 HA GLU 27 HA GLU 27 31.078 40.829 23.494 185 HB2 GLU 27 HB2 GLU 27 29.159 41.025 22.073 186 HB3 GLU 27 HB3 GLU 27 30.552 40.673 21.070 187 HG2 GLU 27 HG2 GLU 27 28.600 38.549 21.916 188 HG3 GLU 27 HG3 GLU 27 28.352 39.545 20.487 189 H ASN 28 H ASN 28 29.171 41.035 24.739 190 HA ASN 28 HA ASN 28 28.325 38.502 25.981 191 HB2 ASN 28 HB2 ASN 28 28.436 41.320 27.064 192 HB3 ASN 28 HB3 ASN 28 27.530 40.045 27.870 193 HD21 ASN 28 HD21 ASN 28 29.393 37.935 27.284 194 HD22 ASN 28 HD22 ASN 28 30.799 38.220 28.247 195 H GLY 29 H GLY 29 26.437 37.787 25.328 196 HA2 GLY 29 HA2 GLY 29 24.569 39.610 24.032 197 HA3 GLY 29 HA3 GLY 29 24.504 37.854 24.008 198 H ASP 30 H ASP 30 22.672 40.228 24.805 199 HA ASP 30 HA ASP 30 21.907 39.459 27.494 200 HB2 ASP 30 HB2 ASP 30 20.204 41.225 27.290 201 HB3 ASP 30 HB3 ASP 30 21.813 41.817 26.910 202 H GLY 31 H GLY 31 19.516 39.095 27.905 203 HA2 GLY 31 HA2 GLY 31 18.350 37.381 25.810 204 HA3 GLY 31 HA3 GLY 31 18.456 36.837 27.477 205 H ILE 32 H ILE 32 16.290 36.603 27.749 206 HA ILE 32 HA ILE 32 14.673 39.058 27.676 207 HB ILE 32 HB ILE 32 14.004 37.199 26.103 208 HG12 ILE 32 HG12 ILE 32 11.898 37.784 28.196 209 HG13 ILE 32 HG13 ILE 32 12.392 38.923 26.952 210 HG21 ILE 32 HG21 ILE 32 14.555 35.275 27.446 211 HG22 ILE 32 HG22 ILE 32 12.845 35.233 27.019 212 HG23 ILE 32 HG23 ILE 32 13.336 35.717 28.643 213 HD11 ILE 32 HD11 ILE 32 11.595 37.409 25.223 214 HD12 ILE 32 HD12 ILE 32 10.313 37.783 26.375 215 HD13 ILE 32 HD13 ILE 32 11.140 36.227 26.451 216 H GLY 33 H GLY 33 13.062 39.254 29.462 217 HA2 GLY 33 HA2 GLY 33 13.988 38.398 32.025 218 HA3 GLY 33 HA3 GLY 33 12.454 39.180 31.686 219 H ASP 34 H ASP 34 12.528 37.204 33.566 220 HA ASP 34 HA ASP 34 12.185 34.586 32.490 221 HB2 ASP 34 HB2 ASP 34 13.012 35.124 34.811 222 HB3 ASP 34 HB3 ASP 34 11.358 35.545 35.237 223 H SER 35 H SER 35 9.885 37.015 33.742 224 HA SER 35 HA SER 35 7.787 35.641 32.224 225 HB2 SER 35 HB2 SER 35 7.419 36.723 35.034 226 HB3 SER 35 HB3 SER 35 6.158 36.019 34.027 227 HG SER 35 HG SER 35 8.302 34.365 34.228 228 H ALA 36 H ALA 36 6.923 36.948 30.801 229 HA ALA 36 HA ALA 36 6.669 39.817 31.435 230 HB1 ALA 36 HB1 ALA 36 6.687 40.235 29.016 231 HB2 ALA 36 HB2 ALA 36 6.906 38.509 28.723 232 HB3 ALA 36 HB3 ALA 36 8.164 39.432 29.545 233 H TYR 37 H TYR 37 4.679 40.687 31.396 234 HA TYR 37 HA TYR 37 2.441 38.829 31.129 235 HB2 TYR 37 HB2 TYR 37 2.499 41.673 32.164 236 HB3 TYR 37 HB3 TYR 37 1.119 40.586 32.228 237 HD1 TYR 37 HD2 TYR 37 1.197 38.593 33.731 238 HD2 TYR 37 HD1 TYR 37 4.226 41.581 33.792 239 HE1 TYR 37 HE2 TYR 37 1.934 37.789 35.928 240 HE2 TYR 37 HE1 TYR 37 4.975 40.784 35.998 241 HH TYR 37 HH TYR 37 3.879 37.809 37.348 242 H ALA 38 H ALA 38 0.972 38.907 29.544 243 HA ALA 38 HA ALA 38 1.210 41.050 27.547 244 HB1 ALA 38 HB1 ALA 38 -0.040 38.318 27.283 245 HB2 ALA 38 HB2 ALA 38 1.562 38.783 26.711 246 HB3 ALA 38 HB3 ALA 38 0.125 39.513 25.995 247 H VAL 39 H VAL 39 -0.682 41.989 26.652 248 HA VAL 39 HA VAL 39 -2.794 42.471 28.526 249 HB VAL 39 HB VAL 39 -2.509 43.322 25.624 250 HG11 VAL 39 HG11 VAL 39 -4.869 43.340 26.297 251 HG12 VAL 39 HG12 VAL 39 -4.249 44.973 26.049 252 HG13 VAL 39 HG13 VAL 39 -4.463 44.350 27.686 253 HG21 VAL 39 HG21 VAL 39 -2.032 44.856 28.175 254 HG22 VAL 39 HG22 VAL 39 -1.906 45.503 26.538 255 HG23 VAL 39 HG23 VAL 39 -0.790 44.249 27.079 256 H ASN 40 H ASN 40 -2.444 40.679 25.519 257 HA ASN 40 HA ASN 40 -3.622 39.123 24.419 258 HB2 ASN 40 HB2 ASN 40 -5.430 38.964 26.850 259 HB3 ASN 40 HB3 ASN 40 -5.520 37.901 25.451 260 HD21 ASN 40 HD21 ASN 40 -3.856 38.661 28.354 261 HD22 ASN 40 HD22 ASN 40 -2.757 37.323 28.343 262 HA PRO 41 HA PRO 41 -6.177 41.954 22.210 263 HB2 PRO 41 HB2 PRO 41 -6.851 39.632 20.514 264 HB3 PRO 41 HB3 PRO 41 -6.058 41.149 20.083 265 HG2 PRO 41 HG2 PRO 41 -4.681 38.865 20.201 266 HG3 PRO 41 HG3 PRO 41 -3.965 40.395 20.740 267 HD2 PRO 41 HD2 PRO 41 -5.144 38.177 22.372 268 HD3 PRO 41 HD3 PRO 41 -3.655 39.108 22.646 269 H GLU 42 H GLU 42 -7.468 38.792 23.089 270 HA GLU 42 HA GLU 42 -10.019 40.072 23.676 271 HB2 GLU 42 HB2 GLU 42 -10.916 37.603 22.942 272 HB3 GLU 42 HB3 GLU 42 -10.986 39.030 21.928 273 HG2 GLU 42 HG2 GLU 42 -10.179 37.272 20.586 274 HG3 GLU 42 HG3 GLU 42 -8.806 38.317 20.919 275 H ALA 43 H ALA 43 -11.344 38.871 25.201 276 HA ALA 43 HA ALA 43 -9.764 37.914 27.382 277 HB1 ALA 43 HB1 ALA 43 -11.777 39.262 27.744 278 HB2 ALA 43 HB2 ALA 43 -11.898 37.698 28.555 279 HB3 ALA 43 HB3 ALA 43 -12.759 37.980 27.041 280 H GLY 44 H GLY 44 -9.659 35.884 28.261 281 HA2 GLY 44 HA2 GLY 44 -10.153 33.642 26.517 282 HA3 GLY 44 HA3 GLY 44 -9.446 33.582 28.127 283 H SER 45 H SER 45 -12.307 33.359 26.253 284 HA SER 45 HA SER 45 -14.141 33.354 28.446 285 HB2 SER 45 HB2 SER 45 -15.735 32.482 26.636 286 HB3 SER 45 HB3 SER 45 -15.035 34.081 26.389 287 HG SER 45 HG SER 45 -14.726 33.091 24.482 288 H MET 46 H MET 46 -15.162 31.644 29.407 289 HA MET 46 HA MET 46 -13.474 29.396 29.781 290 HB2 MET 46 HB2 MET 46 -15.283 28.649 31.377 291 HB3 MET 46 HB3 MET 46 -14.538 30.202 31.709 292 HG2 MET 46 HG2 MET 46 -16.506 31.285 30.613 293 HG3 MET 46 HG3 MET 46 -17.253 29.691 30.528 294 HE1 MET 46 HE1 MET 46 -15.009 31.300 33.334 295 HE2 MET 46 HE2 MET 46 -16.240 31.905 34.445 296 HE3 MET 46 HE3 MET 46 -16.075 32.616 32.840 297 H ASP 47 H ASP 47 -13.338 27.681 28.648 298 HA ASP 47 HA ASP 47 -15.215 26.979 26.604 299 HB2 ASP 47 HB2 ASP 47 -12.762 26.728 26.347 300 HB3 ASP 47 HB3 ASP 47 -12.767 25.500 27.604 301 H TYR 48 H TYR 48 -16.959 25.760 26.853 302 HA TYR 48 HA TYR 48 -16.867 23.394 28.512 303 HB2 TYR 48 HB2 TYR 48 -17.627 25.260 30.034 304 HB3 TYR 48 HB3 TYR 48 -19.037 25.449 28.998 305 HD1 TYR 48 HD2 TYR 48 -17.245 22.894 31.025 306 HD2 TYR 48 HD1 TYR 48 -20.980 24.216 29.473 307 HE1 TYR 48 HE2 TYR 48 -18.397 21.150 32.320 308 HE2 TYR 48 HE1 TYR 48 -22.142 22.476 30.767 309 HH TYR 48 HH TYR 48 -21.543 20.203 31.765 310 H MET 49 H MET 49 -17.674 21.831 27.294 311 HA MET 49 HA MET 49 -20.022 22.455 25.635 312 HB2 MET 49 HB2 MET 49 -19.407 20.729 24.060 313 HB3 MET 49 HB3 MET 49 -18.046 21.815 24.251 314 HG2 MET 49 HG2 MET 49 -18.228 19.197 25.712 315 HG3 MET 49 HG3 MET 49 -17.558 19.332 24.091 316 HE1 MET 49 HE1 MET 49 -15.975 22.088 24.145 317 HE2 MET 49 HE2 MET 49 -15.324 20.586 23.490 318 HE3 MET 49 HE3 MET 49 -14.381 21.530 24.645 319 HA PRO 50 HA PRO 50 -22.138 19.467 28.202 320 HB2 PRO 50 HB2 PRO 50 -24.252 18.911 26.605 321 HB3 PRO 50 HB3 PRO 50 -24.100 20.425 27.502 322 HG2 PRO 50 HG2 PRO 50 -23.511 19.864 24.623 323 HG3 PRO 50 HG3 PRO 50 -24.343 21.255 25.345 324 HD2 PRO 50 HD2 PRO 50 -21.742 21.342 24.577 325 HD3 PRO 50 HD3 PRO 50 -22.376 22.285 25.940 326 H LEU 51 H LEU 51 -22.585 17.207 28.335 327 HA LEU 51 HA LEU 51 -21.296 15.646 26.194 328 HB2 LEU 51 HB2 LEU 51 -21.159 15.266 29.181 329 HB3 LEU 51 HB3 LEU 51 -20.773 13.974 28.071 330 HG LEU 51 HG LEU 51 -18.699 14.796 28.650 331 HD11 LEU 51 HD11 LEU 51 -17.752 15.967 26.737 332 HD12 LEU 51 HD12 LEU 51 -19.379 16.333 26.162 333 HD13 LEU 51 HD13 LEU 51 -18.831 14.659 26.252 334 HD21 LEU 51 HD21 LEU 51 -19.382 16.724 29.929 335 HD22 LEU 51 HD22 LEU 51 -19.739 17.614 28.447 336 HD23 LEU 51 HD23 LEU 51 -18.079 17.152 28.821 337 H MET 52 H MET 52 -23.005 14.868 25.081 338 HA MET 52 HA MET 52 -24.851 13.110 26.561 339 HB2 MET 52 HB2 MET 52 -25.949 15.156 25.596 340 HB3 MET 52 HB3 MET 52 -25.492 14.583 23.999 341 HG2 MET 52 HG2 MET 52 -26.859 12.609 24.284 342 HG3 MET 52 HG3 MET 52 -27.261 13.100 25.928 343 HE1 MET 52 HE1 MET 52 -30.658 13.568 24.076 344 HE2 MET 52 HE2 MET 52 -29.835 12.841 25.457 345 HE3 MET 52 HE3 MET 52 -29.459 12.298 23.822 346 H GLU 53 H GLU 53 -24.936 11.049 25.893 347 HA GLU 53 HA GLU 53 -23.449 10.345 23.451 348 HB2 GLU 53 HB2 GLU 53 -23.405 8.898 26.110 349 HB3 GLU 53 HB3 GLU 53 -22.643 8.317 24.634 350 HG2 GLU 53 HG2 GLU 53 -21.151 10.236 24.617 351 HG3 GLU 53 HG3 GLU 53 -21.948 10.888 26.046 352 H TYR 54 H TYR 54 -24.396 8.951 22.091 353 HA TYR 54 HA TYR 54 -26.905 7.660 22.932 354 HB2 TYR 54 HB2 TYR 54 -25.865 8.174 20.132 355 HB3 TYR 54 HB3 TYR 54 -27.408 7.432 20.535 356 HD1 TYR 54 HD1 TYR 54 -29.204 8.816 21.592 357 HD2 TYR 54 HD2 TYR 54 -25.596 10.537 20.130 358 HE1 TYR 54 HE1 TYR 54 -30.272 11.032 21.573 359 HE2 TYR 54 HE2 TYR 54 -26.655 12.750 20.109 360 HH TYR 54 HH TYR 54 -28.917 13.709 19.987 361 H LEU 55 H LEU 55 -26.895 5.502 23.209 362 HA LEU 55 HA LEU 55 -24.432 4.117 22.424 363 HB2 LEU 55 HB2 LEU 55 -24.839 4.215 24.823 364 HB3 LEU 55 HB3 LEU 55 -26.402 3.456 24.609 365 HG LEU 55 HG LEU 55 -25.328 1.373 23.902 366 HD11 LEU 55 HD11 LEU 55 -22.720 2.805 24.404 367 HD12 LEU 55 HD12 LEU 55 -23.342 2.307 22.831 368 HD13 LEU 55 HD13 LEU 55 -22.907 1.090 24.031 369 HD21 LEU 55 HD21 LEU 55 -24.154 2.462 26.454 370 HD22 LEU 55 HD22 LEU 55 -24.330 0.758 26.031 371 HD23 LEU 55 HD23 LEU 55 -25.761 1.759 26.278 372 H HIS 56 H HIS 56 -24.473 2.738 20.894 373 HA HIS 56 HA HIS 56 -26.680 0.852 20.571 374 HB2 HIS 56 HB2 HIS 56 -26.844 2.842 18.907 375 HB3 HIS 56 HB3 HIS 56 -25.397 2.171 18.168 376 HD1 HIS 56 HD1 HIS 56 -29.051 1.463 18.682 377 HD2 HIS 56 HD2 HIS 56 -25.804 -0.043 16.552 378 HE1 HIS 56 HE1 HIS 56 -30.010 -0.225 17.073 379 HE2 HIS 56 HE2 HIS 56 -28.014 -1.249 15.933 380 H SER 57 H SER 57 -25.927 -1.187 19.769 381 HA SER 57 HA SER 57 -23.092 -1.648 20.025 382 HB2 SER 57 HB2 SER 57 -24.952 -3.309 20.639 383 HB3 SER 57 HB3 SER 57 -25.107 -3.604 18.907 384 HG SER 57 HG SER 57 -22.832 -4.047 20.552 385 H SER 58 H SER 58 -21.836 -0.841 18.473 386 HA SER 58 HA SER 58 -22.800 -0.875 15.697 387 HB2 SER 58 HB2 SER 58 -20.754 0.941 16.995 388 HB3 SER 58 HB3 SER 58 -21.345 1.061 15.337 389 HG SER 58 HG SER 58 -23.435 1.461 16.188 390 HA PRO 59 HA PRO 59 -19.444 -3.704 14.932 391 HB2 PRO 59 HB2 PRO 59 -19.729 -3.904 12.245 392 HB3 PRO 59 HB3 PRO 59 -20.798 -4.713 13.393 393 HG2 PRO 59 HG2 PRO 59 -21.256 -2.248 11.791 394 HG3 PRO 59 HG3 PRO 59 -22.402 -3.515 12.257 395 HD2 PRO 59 HD2 PRO 59 -22.186 -1.049 13.485 396 HD3 PRO 59 HD3 PRO 59 -22.899 -2.494 14.223 397 H VAL 60 H VAL 60 -17.339 -3.668 14.097 398 HA VAL 60 HA VAL 60 -16.369 -0.947 13.931 399 HB VAL 60 HB VAL 60 -15.422 -2.472 15.579 400 HG11 VAL 60 HG11 VAL 60 -13.917 -4.276 15.000 401 HG12 VAL 60 HG12 VAL 60 -14.237 -4.018 13.285 402 HG13 VAL 60 HG13 VAL 60 -15.530 -4.571 14.349 403 HG21 VAL 60 HG21 VAL 60 -13.437 -1.536 13.525 404 HG22 VAL 60 HG22 VAL 60 -13.054 -1.993 15.185 405 HG23 VAL 60 HG23 VAL 60 -14.095 -0.604 14.871 406 H LEU 61 H LEU 61 -15.557 0.039 12.258 407 HA LEU 61 HA LEU 61 -15.488 -1.303 9.702 408 HB2 LEU 61 HB2 LEU 61 -15.017 1.040 8.799 409 HB3 LEU 61 HB3 LEU 61 -16.594 0.714 9.454 410 HG LEU 61 HG LEU 61 -15.738 3.002 9.878 411 HD11 LEU 61 HD11 LEU 61 -17.478 2.161 11.289 412 HD12 LEU 61 HD12 LEU 61 -16.371 3.168 12.222 413 HD13 LEU 61 HD13 LEU 61 -16.295 1.409 12.359 414 HD21 LEU 61 HD21 LEU 61 -14.083 3.410 11.608 415 HD22 LEU 61 HD22 LEU 61 -13.398 2.561 10.222 416 HD23 LEU 61 HD23 LEU 61 -13.760 1.678 11.705 417 HA PRO 62 HA PRO 62 -11.190 -2.007 9.510 418 HB2 PRO 62 HB2 PRO 62 -10.500 -1.661 6.938 419 HB3 PRO 62 HB3 PRO 62 -11.589 -2.957 7.447 420 HG2 PRO 62 HG2 PRO 62 -12.245 -0.283 6.270 421 HG3 PRO 62 HG3 PRO 62 -12.897 -1.880 5.846 422 HD2 PRO 62 HD2 PRO 62 -14.214 -0.153 7.463 423 HD3 PRO 62 HD3 PRO 62 -14.337 -1.911 7.639 424 H THR 63 H THR 63 -9.008 -1.228 8.727 425 HA THR 63 HA THR 63 -8.819 1.619 8.339 426 HB THR 63 HB THR 63 -8.798 1.187 10.847 427 HG1 THR 63 HG1 THR 63 -7.705 2.992 9.544 428 HG21 THR 63 HG21 THR 63 -7.435 -0.796 10.975 429 HG22 THR 63 HG22 THR 63 -6.711 0.526 11.890 430 HG23 THR 63 HG23 THR 63 -6.057 0.084 10.311 431 H ALA 64 H ALA 64 -7.407 2.019 6.839 432 HA ALA 64 HA ALA 64 -5.721 -0.133 5.879 433 HB1 ALA 64 HB1 ALA 64 -7.022 1.194 4.291 434 HB2 ALA 64 HB2 ALA 64 -5.289 1.317 3.979 435 HB3 ALA 64 HB3 ALA 64 -6.137 2.640 4.780 436 H ARG 65 H ARG 65 -3.955 -0.439 6.949 437 HA ARG 65 HA ARG 65 -2.190 1.828 7.479 438 HB2 ARG 65 HB2 ARG 65 -2.852 -0.452 9.356 439 HB3 ARG 65 HB3 ARG 65 -1.452 0.588 9.565 440 HG2 ARG 65 HG2 ARG 65 -2.862 2.504 9.908 441 HG3 ARG 65 HG3 ARG 65 -4.300 1.560 9.522 442 HD2 ARG 65 HD2 ARG 65 -4.086 1.843 11.923 443 HD3 ARG 65 HD3 ARG 65 -3.903 0.149 11.478 444 HE ARG 65 HE ARG 65 -1.361 1.387 11.625 445 HH11 ARG 65 HH11 ARG 65 -3.965 0.278 13.718 446 HH12 ARG 65 HH12 ARG 65 -2.915 -0.049 15.060 447 HH21 ARG 65 HH21 ARG 65 0.011 0.964 13.395 448 HH22 ARG 65 HH22 ARG 65 -0.657 0.364 14.882 449 H PHE 66 H PHE 66 -0.200 1.469 6.702 450 HA PHE 66 HA PHE 66 0.887 -1.154 6.489 451 HB2 PHE 66 HB2 PHE 66 1.202 -1.225 4.067 452 HB3 PHE 66 HB3 PHE 66 -0.505 -1.191 4.458 453 HD1 PHE 66 HD2 PHE 66 -1.535 1.305 4.449 454 HD2 PHE 66 HD1 PHE 66 1.925 0.032 2.325 455 HE1 PHE 66 HE2 PHE 66 -1.842 3.142 2.850 456 HE2 PHE 66 HE1 PHE 66 1.614 1.866 0.718 457 HZ PHE 66 HZ PHE 66 -0.275 3.421 0.982 458 H THR 67 H THR 67 3.092 -1.161 5.896 459 HA THR 67 HA THR 67 4.323 1.457 5.533 460 HB THR 67 HB THR 67 4.629 0.995 7.902 461 HG1 THR 67 HG1 THR 67 7.146 0.480 7.559 462 HG21 THR 67 HG21 THR 67 5.900 -0.947 8.720 463 HG22 THR 67 HG22 THR 67 5.905 -1.625 7.092 464 HG23 THR 67 HG23 THR 67 4.383 -1.427 7.962 465 H SER 68 H SER 68 5.805 1.474 3.987 466 HA SER 68 HA SER 68 6.402 -0.974 2.557 467 HB2 SER 68 HB2 SER 68 7.661 0.650 1.053 468 HB3 SER 68 HB3 SER 68 5.928 0.941 1.191 469 HG SER 68 HG SER 68 7.910 2.614 1.727 470 H ASP 69 H ASP 69 8.772 -1.406 2.010 471 HA ASP 69 HA ASP 69 10.237 -1.587 4.436 472 HB2 ASP 69 HB2 ASP 69 10.313 -3.140 2.321 473 HB3 ASP 69 HB3 ASP 69 11.546 -2.007 1.764 474 H ILE 70 H ILE 70 11.031 0.167 1.392 475 HA ILE 70 HA ILE 70 12.173 2.243 3.112 476 HB ILE 70 HB ILE 70 13.058 3.280 0.981 477 HG12 ILE 70 HG12 ILE 70 13.462 1.119 -0.676 478 HG13 ILE 70 HG13 ILE 70 11.787 0.905 -0.190 479 HG21 ILE 70 HG21 ILE 70 14.105 0.585 1.797 480 HG22 ILE 70 HG22 ILE 70 14.506 2.143 2.521 481 HG23 ILE 70 HG23 ILE 70 15.000 1.783 0.865 482 HD11 ILE 70 HD11 ILE 70 11.958 2.146 -2.271 483 HD12 ILE 70 HD12 ILE 70 12.955 3.366 -1.479 484 HD13 ILE 70 HD13 ILE 70 11.272 3.155 -0.996 485 H THR 71 H THR 71 11.248 4.181 3.290 486 HA THR 71 HA THR 71 8.687 4.616 1.947 487 HB THR 71 HB THR 71 8.641 6.668 3.490 488 HG1 THR 71 HG1 THR 71 10.224 6.923 4.903 489 HG21 THR 71 HG21 THR 71 7.965 5.355 5.448 490 HG22 THR 71 HG22 THR 71 8.734 3.926 4.757 491 HG23 THR 71 HG23 THR 71 7.339 4.650 3.956 492 H GLU 72 H GLU 72 11.946 5.673 2.069 493 HA GLU 72 HA GLU 72 11.720 7.338 -0.249 494 HB2 GLU 72 HB2 GLU 72 11.092 8.848 1.685 495 HB3 GLU 72 HB3 GLU 72 12.697 8.574 2.339 496 HG2 GLU 72 HG2 GLU 72 13.649 9.545 0.239 497 HG3 GLU 72 HG3 GLU 72 12.003 9.944 -0.253 498 H GLY 73 H GLY 73 13.709 7.460 -1.246 499 HA2 GLY 73 HA2 GLY 73 16.238 7.306 -0.548 500 HA3 GLY 73 HA3 GLY 73 15.742 5.662 -0.153 501 H PHE 74 H PHE 74 17.129 4.821 -1.795 502 HA PHE 74 HA PHE 74 16.469 5.546 -4.531 503 HB2 PHE 74 HB2 PHE 74 18.399 4.064 -5.125 504 HB3 PHE 74 HB3 PHE 74 18.829 5.426 -4.103 505 HD1 PHE 74 HD1 PHE 74 19.396 5.044 -1.716 506 HD2 PHE 74 HD2 PHE 74 18.703 1.813 -4.401 507 HE1 PHE 74 HE1 PHE 74 20.518 3.512 -0.158 508 HE2 PHE 74 HE2 PHE 74 19.817 0.278 -2.839 509 HZ PHE 74 HZ PHE 74 20.723 1.125 -0.716 510 H ALA 75 H ALA 75 15.651 4.098 -6.033 511 HA ALA 75 HA ALA 75 14.305 1.738 -5.085 512 HB1 ALA 75 HB1 ALA 75 14.674 2.770 -7.895 513 HB2 ALA 75 HB2 ALA 75 13.339 3.187 -6.821 514 HB3 ALA 75 HB3 ALA 75 13.532 1.526 -7.388 515 HA PRO 76 HA PRO 76 18.019 -0.629 -6.159 516 HB2 PRO 76 HB2 PRO 76 17.823 -2.442 -4.158 517 HB3 PRO 76 HB3 PRO 76 18.492 -0.825 -3.947 518 HG2 PRO 76 HG2 PRO 76 15.981 -1.930 -2.942 519 HG3 PRO 76 HG3 PRO 76 16.820 -0.447 -2.463 520 HD2 PRO 76 HD2 PRO 76 14.556 -0.773 -4.255 521 HD3 PRO 76 HD3 PRO 76 15.260 0.724 -3.610 522 H LEU 77 H LEU 77 14.763 -1.763 -6.052 523 HA LEU 77 HA LEU 77 14.668 -3.942 -7.590 524 HB2 LEU 77 HB2 LEU 77 14.887 -5.926 -6.017 525 HB3 LEU 77 HB3 LEU 77 16.375 -5.204 -6.579 526 HG LEU 77 HG LEU 77 15.964 -3.935 -4.161 527 HD11 LEU 77 HD11 LEU 77 15.540 -5.717 -2.547 528 HD12 LEU 77 HD12 LEU 77 15.168 -6.825 -3.868 529 HD13 LEU 77 HD13 LEU 77 14.137 -5.423 -3.573 530 HD21 LEU 77 HD21 LEU 77 17.800 -5.353 -3.383 531 HD22 LEU 77 HD22 LEU 77 18.070 -4.761 -5.022 532 HD23 LEU 77 HD23 LEU 77 17.548 -6.426 -4.762 533 H SER 78 H SER 78 13.164 -5.811 -6.338 534 HA SER 78 HA SER 78 10.640 -4.640 -6.051 535 HB2 SER 78 HB2 SER 78 11.343 -7.079 -6.623 536 HB3 SER 78 HB3 SER 78 11.281 -7.331 -4.880 537 HG SER 78 HG SER 78 9.241 -6.901 -6.700 538 H VAL 79 H VAL 79 9.649 -3.678 -4.444 539 HA VAL 79 HA VAL 79 10.986 -3.443 -1.882 540 HB VAL 79 HB VAL 79 8.548 -2.020 -2.989 541 HG11 VAL 79 HG11 VAL 79 8.717 -0.492 -1.100 542 HG12 VAL 79 HG12 VAL 79 10.046 -1.436 -0.427 543 HG13 VAL 79 HG13 VAL 79 8.429 -2.134 -0.528 544 HG21 VAL 79 HG21 VAL 79 10.057 -0.099 -3.126 545 HG22 VAL 79 HG22 VAL 79 10.636 -1.452 -4.097 546 HG23 VAL 79 HG23 VAL 79 11.384 -1.102 -2.538 547 H ARG 80 H ARG 80 10.529 -4.569 -0.186 548 HA ARG 80 HA ARG 80 8.395 -6.485 -0.153 549 HB2 ARG 80 HB2 ARG 80 10.735 -6.897 0.644 550 HB3 ARG 80 HB3 ARG 80 10.434 -5.797 1.974 551 HG2 ARG 80 HG2 ARG 80 8.492 -7.969 1.755 552 HG3 ARG 80 HG3 ARG 80 10.147 -8.494 2.060 553 HD2 ARG 80 HD2 ARG 80 8.464 -6.622 3.708 554 HD3 ARG 80 HD3 ARG 80 9.097 -8.199 4.168 555 HE ARG 80 HE ARG 80 10.563 -5.672 4.075 556 HH11 ARG 80 HH11 ARG 80 10.759 -9.177 4.526 557 HH12 ARG 80 HH12 ARG 80 12.273 -9.089 5.372 558 HH21 ARG 80 HH21 ARG 80 12.532 -5.586 5.145 559 HH22 ARG 80 HH22 ARG 80 13.292 -7.047 5.709 560 H PHE 81 H PHE 81 6.437 -5.914 0.341 561 HA PHE 81 HA PHE 81 5.900 -3.540 1.922 562 HB2 PHE 81 HB2 PHE 81 3.568 -3.829 1.141 563 HB3 PHE 81 HB3 PHE 81 4.714 -3.765 -0.190 564 HD1 PHE 81 HD2 PHE 81 5.330 -5.909 -1.365 565 HD2 PHE 81 HD1 PHE 81 2.158 -5.690 1.455 566 HE1 PHE 81 HE2 PHE 81 4.415 -8.014 -2.228 567 HE2 PHE 81 HE1 PHE 81 1.245 -7.797 0.597 568 HZ PHE 81 HZ PHE 81 2.373 -8.962 -1.248 569 H LYS 82 H LYS 82 4.656 -3.479 3.769 570 HA LYS 82 HA LYS 82 3.962 -6.027 5.056 571 HB2 LYS 82 HB2 LYS 82 5.633 -3.809 6.281 572 HB3 LYS 82 HB3 LYS 82 4.940 -5.136 7.200 573 HG2 LYS 82 HG2 LYS 82 6.359 -6.709 6.235 574 HG3 LYS 82 HG3 LYS 82 6.762 -5.654 4.883 575 HD2 LYS 82 HD2 LYS 82 7.559 -5.126 7.740 576 HD3 LYS 82 HD3 LYS 82 8.588 -5.941 6.563 577 HE2 LYS 82 HE2 LYS 82 8.385 -3.900 5.111 578 HE3 LYS 82 HE3 LYS 82 7.557 -3.107 6.449 579 HZ1 LYS 82 HZ1 LYS 82 10.380 -3.921 6.239 580 HZ2 LYS 82 HZ2 LYS 82 9.657 -3.802 7.761 581 HZ3 LYS 82 HZ3 LYS 82 9.724 -2.443 6.752 582 H ASP 83 H ASP 83 1.819 -5.852 5.501 583 HA ASP 83 HA ASP 83 0.739 -3.165 5.909 584 HB2 ASP 83 HB2 ASP 83 -1.410 -3.963 5.327 585 HB3 ASP 83 HB3 ASP 83 -0.296 -4.644 4.154 586 H PHE 84 H PHE 84 -0.464 -2.576 7.600 587 HA PHE 84 HA PHE 84 -0.417 -4.305 9.989 588 HB2 PHE 84 HB2 PHE 84 0.546 -1.627 9.508 589 HB3 PHE 84 HB3 PHE 84 -0.721 -1.596 10.727 590 HD1 PHE 84 HD1 PHE 84 2.475 -3.301 9.869 591 HD2 PHE 84 HD2 PHE 84 -0.234 -2.104 12.927 592 HE1 PHE 84 HE1 PHE 84 4.095 -4.009 11.582 593 HE2 PHE 84 HE2 PHE 84 1.382 -2.811 14.642 594 HZ PHE 84 HZ PHE 84 3.548 -3.765 13.970 595 H SER 85 H SER 85 -2.388 -3.906 7.781 596 HA SER 85 HA SER 85 -4.577 -2.314 8.378 597 HB2 SER 85 HB2 SER 85 -4.756 -5.023 7.057 598 HB3 SER 85 HB3 SER 85 -5.766 -3.603 6.772 599 HG SER 85 HG SER 85 -3.243 -4.218 5.810 600 H GLU 86 H GLU 86 -6.229 -2.415 9.738 601 HA GLU 86 HA GLU 86 -6.492 -4.801 11.439 602 HB2 GLU 86 HB2 GLU 86 -5.228 -2.897 12.482 603 HB3 GLU 86 HB3 GLU 86 -6.669 -1.915 12.318 604 HG2 GLU 86 HG2 GLU 86 -7.862 -3.467 13.823 605 HG3 GLU 86 HG3 GLU 86 -6.368 -4.390 14.000 606 H ASN 87 H ASN 87 -8.589 -5.171 12.217 607 HA ASN 87 HA ASN 87 -10.853 -5.252 12.305 608 HB2 ASN 87 HB2 ASN 87 -10.666 -2.324 11.559 609 HB3 ASN 87 HB3 ASN 87 -12.095 -3.122 12.205 610 HD21 ASN 87 HD21 ASN 87 -10.081 -0.978 13.120 611 HD22 ASN 87 HD22 ASN 87 -9.738 -1.417 14.754 612 H ALA 88 H ALA 88 -9.574 -5.991 9.861 613 HA ALA 88 HA ALA 88 -11.591 -5.254 7.843 614 HB1 ALA 88 HB1 ALA 88 -9.492 -4.088 7.396 615 HB2 ALA 88 HB2 ALA 88 -9.827 -5.290 6.150 616 HB3 ALA 88 HB3 ALA 88 -8.631 -5.627 7.401 617 H THR 89 H THR 89 -12.148 -6.850 6.359 618 HA THR 89 HA THR 89 -11.251 -9.553 7.079 619 HB THR 89 HB THR 89 -13.622 -9.311 7.485 620 HG1 THR 89 HG1 THR 89 -12.730 -10.973 5.430 621 HG21 THR 89 HG21 THR 89 -13.913 -8.545 4.579 622 HG22 THR 89 HG22 THR 89 -14.135 -7.472 5.963 623 HG23 THR 89 HG23 THR 89 -15.232 -8.831 5.714 624 H SER 90 H SER 90 -11.224 -7.195 4.596 625 HA SER 90 HA SER 90 -10.051 -9.134 2.734 626 HB2 SER 90 HB2 SER 90 -11.974 -6.938 1.928 627 HB3 SER 90 HB3 SER 90 -11.236 -8.128 0.863 628 HG SER 90 HG SER 90 -13.485 -8.321 2.345 629 H ARG 91 H ARG 91 -8.379 -8.263 1.421 630 HA ARG 91 HA ARG 91 -7.892 -5.381 1.649 631 HB2 ARG 91 HB2 ARG 91 -5.448 -5.747 1.781 632 HB3 ARG 91 HB3 ARG 91 -6.303 -6.328 3.199 633 HG2 ARG 91 HG2 ARG 91 -6.093 -8.605 2.434 634 HG3 ARG 91 HG3 ARG 91 -5.345 -8.062 0.932 635 HD2 ARG 91 HD2 ARG 91 -3.673 -8.884 2.496 636 HD3 ARG 91 HD3 ARG 91 -3.457 -7.168 2.183 637 HE ARG 91 HE ARG 91 -3.813 -6.752 4.400 638 HH11 ARG 91 HH11 ARG 91 -5.069 -9.980 3.752 639 HH12 ARG 91 HH12 ARG 91 -5.240 -10.376 5.437 640 HH21 ARG 91 HH21 ARG 91 -4.012 -7.306 6.594 641 HH22 ARG 91 HH22 ARG 91 -4.628 -8.869 7.040 642 H LEU 92 H LEU 92 -6.939 -4.407 -0.086 643 HA LEU 92 HA LEU 92 -6.459 -6.004 -2.496 644 HB2 LEU 92 HB2 LEU 92 -8.664 -5.143 -2.796 645 HB3 LEU 92 HB3 LEU 92 -8.217 -3.569 -2.178 646 HG LEU 92 HG LEU 92 -6.854 -3.201 -4.238 647 HD11 LEU 92 HD11 LEU 92 -6.440 -5.520 -4.871 648 HD12 LEU 92 HD12 LEU 92 -7.219 -4.628 -6.177 649 HD13 LEU 92 HD13 LEU 92 -8.160 -5.745 -5.189 650 HD21 LEU 92 HD21 LEU 92 -9.098 -2.316 -4.053 651 HD22 LEU 92 HD22 LEU 92 -9.767 -3.836 -4.647 652 HD23 LEU 92 HD23 LEU 92 -8.775 -2.836 -5.709 653 H TRP 93 H TRP 93 -4.414 -5.697 -2.985 654 HA TRP 93 HA TRP 93 -3.060 -3.245 -2.221 655 HB2 TRP 93 HB2 TRP 93 -2.141 -5.918 -3.213 656 HB3 TRP 93 HB3 TRP 93 -1.071 -4.527 -3.295 657 HD1 TRP 93 HD1 TRP 93 -2.182 -7.211 -0.974 658 HE1 TRP 93 HE1 TRP 93 -1.118 -6.835 1.344 659 HE3 TRP 93 HE3 TRP 93 -0.530 -2.405 -1.600 660 HZ2 TRP 93 HZ2 TRP 93 0.163 -4.746 2.740 661 HZ3 TRP 93 HZ3 TRP 93 0.599 -1.295 0.281 662 HH2 TRP 93 HH2 TRP 93 0.936 -2.443 2.404 663 H MET 94 H MET 94 -3.063 -1.623 -3.511 664 HA MET 94 HA MET 94 -3.332 -2.064 -6.397 665 HB2 MET 94 HB2 MET 94 -3.946 0.357 -4.699 666 HB3 MET 94 HB3 MET 94 -4.032 0.335 -6.455 667 HG2 MET 94 HG2 MET 94 -5.629 -1.452 -4.651 668 HG3 MET 94 HG3 MET 94 -6.216 0.067 -5.324 669 HE1 MET 94 HE1 MET 94 -4.823 -0.112 -8.262 670 HE2 MET 94 HE2 MET 94 -6.475 0.455 -8.012 671 HE3 MET 94 HE3 MET 94 -6.144 -0.813 -9.194 672 H PHE 95 H PHE 95 -1.310 -2.322 -7.089 673 HA PHE 95 HA PHE 95 0.818 -0.498 -6.439 674 HB2 PHE 95 HB2 PHE 95 1.113 -2.932 -7.081 675 HB3 PHE 95 HB3 PHE 95 0.667 -2.488 -8.721 676 HD1 PHE 95 HD1 PHE 95 3.148 -1.692 -6.054 677 HD2 PHE 95 HD2 PHE 95 2.318 -1.863 -10.228 678 HE1 PHE 95 HE1 PHE 95 5.509 -1.202 -6.544 679 HE2 PHE 95 HE2 PHE 95 4.677 -1.370 -10.720 680 HZ PHE 95 HZ PHE 95 6.276 -1.042 -8.877 681 H GLY 96 H GLY 96 -1.716 -0.760 -8.772 682 HA2 GLY 96 HA2 GLY 96 -2.562 1.068 -10.016 683 HA3 GLY 96 HA3 GLY 96 -0.975 1.821 -9.941 684 H ASP 97 H ASP 97 -0.733 -1.435 -10.664 685 HA ASP 97 HA ASP 97 -0.584 -0.895 -13.540 686 HB2 ASP 97 HB2 ASP 97 1.698 -0.686 -12.498 687 HB3 ASP 97 HB3 ASP 97 1.573 -2.370 -12.008 688 H GLY 98 H GLY 98 -1.583 -2.389 -14.706 689 HA2 GLY 98 HA2 GLY 98 -2.342 -4.419 -15.470 690 HA3 GLY 98 HA3 GLY 98 -1.252 -5.178 -14.322 691 H ASN 99 H ASN 99 -2.729 -6.814 -13.863 692 HA ASN 99 HA ASN 99 -5.176 -6.100 -12.460 693 HB2 ASN 99 HB2 ASN 99 -3.924 -8.761 -13.170 694 HB3 ASN 99 HB3 ASN 99 -5.368 -8.613 -12.171 695 HD21 ASN 99 HD21 ASN 99 -4.055 -8.340 -15.371 696 HD22 ASN 99 HD22 ASN 99 -5.568 -8.213 -16.200 697 H THR 100 H THR 100 -5.174 -5.668 -10.404 698 HA THR 100 HA THR 100 -2.758 -5.932 -8.884 699 HB THR 100 HB THR 100 -4.184 -4.706 -7.136 700 HG1 THR 100 HG1 THR 100 -6.057 -3.732 -7.998 701 HG21 THR 100 HG21 THR 100 -3.669 -3.457 -9.836 702 HG22 THR 100 HG22 THR 100 -2.487 -3.639 -8.540 703 HG23 THR 100 HG23 THR 100 -3.884 -2.583 -8.317 704 H SER 101 H SER 101 -3.802 -6.042 -6.274 705 HA SER 101 HA SER 101 -3.981 -7.479 -4.555 706 HB2 SER 101 HB2 SER 101 -5.549 -9.130 -6.521 707 HB3 SER 101 HB3 SER 101 -5.206 -9.695 -4.885 708 HG SER 101 HG SER 101 -7.017 -8.655 -4.515 709 H ASP 102 H ASP 102 -3.587 -9.814 -7.205 710 HA ASP 102 HA ASP 102 -0.914 -10.443 -6.206 711 HB2 ASP 102 HB2 ASP 102 -2.565 -12.027 -5.172 712 HB3 ASP 102 HB3 ASP 102 -3.015 -12.549 -6.790 713 H SER 103 H SER 103 0.483 -10.607 -7.789 714 HA SER 103 HA SER 103 -0.490 -11.017 -10.536 715 HB2 SER 103 HB2 SER 103 2.050 -9.627 -9.629 716 HB3 SER 103 HB3 SER 103 1.425 -9.703 -11.275 717 HG SER 103 HG SER 103 -0.448 -8.545 -10.453 718 HA PRO 104 HA PRO 104 1.855 -14.891 -10.713 719 HB2 PRO 104 HB2 PRO 104 2.581 -13.987 -13.458 720 HB3 PRO 104 HB3 PRO 104 1.886 -15.522 -12.925 721 HG2 PRO 104 HG2 PRO 104 0.339 -13.744 -14.131 722 HG3 PRO 104 HG3 PRO 104 -0.259 -14.631 -12.715 723 HD2 PRO 104 HD2 PRO 104 0.752 -11.818 -12.895 724 HD3 PRO 104 HD3 PRO 104 -0.643 -12.459 -12.000 725 H SER 105 H SER 105 3.518 -12.283 -12.520 726 HA SER 105 HA SER 105 6.056 -12.953 -11.288 727 HB2 SER 105 HB2 SER 105 5.310 -10.614 -13.072 728 HB3 SER 105 HB3 SER 105 6.947 -11.143 -12.678 729 HG SER 105 HG SER 105 5.723 -13.255 -13.633 730 HA PRO 106 HA PRO 106 5.397 -10.335 -7.709 731 HB2 PRO 106 HB2 PRO 106 8.318 -9.809 -7.817 732 HB3 PRO 106 HB3 PRO 106 7.342 -10.480 -6.505 733 HG2 PRO 106 HG2 PRO 106 8.938 -12.067 -7.915 734 HG3 PRO 106 HG3 PRO 106 7.320 -12.613 -7.434 735 HD2 PRO 106 HD2 PRO 106 8.247 -11.574 -10.091 736 HD3 PRO 106 HD3 PRO 106 7.211 -12.973 -9.730 737 H LEU 107 H LEU 107 4.303 -8.560 -8.395 738 HA LEU 107 HA LEU 107 5.687 -6.545 -9.991 739 HB2 LEU 107 HB2 LEU 107 3.532 -7.533 -10.763 740 HB3 LEU 107 HB3 LEU 107 2.742 -6.811 -9.376 741 HG LEU 107 HG LEU 107 3.386 -4.562 -10.245 742 HD11 LEU 107 HD11 LEU 107 4.234 -6.118 -12.684 743 HD12 LEU 107 HD12 LEU 107 5.309 -5.248 -11.588 744 HD13 LEU 107 HD13 LEU 107 4.127 -4.363 -12.553 745 HD21 LEU 107 HD21 LEU 107 1.693 -4.522 -11.984 746 HD22 LEU 107 HD22 LEU 107 1.177 -5.541 -10.639 747 HD23 LEU 107 HD23 LEU 107 1.776 -6.277 -12.126 748 H HIS 108 H HIS 108 6.764 -6.273 -7.749 749 HA HIS 108 HA HIS 108 5.572 -3.861 -6.557 750 HB2 HIS 108 HB2 HIS 108 6.973 -6.023 -4.941 751 HB3 HIS 108 HB3 HIS 108 6.268 -4.538 -4.312 752 HD1 HIS 108 HD1 HIS 108 5.468 -8.022 -5.181 753 HD2 HIS 108 HD2 HIS 108 3.374 -4.515 -4.366 754 HE1 HIS 108 HE1 HIS 108 3.053 -8.708 -4.958 755 HE2 HIS 108 HE2 HIS 108 1.858 -6.613 -4.224 756 H THR 109 H THR 109 7.701 -4.883 -8.489 757 HA THR 109 HA THR 109 10.226 -4.241 -7.316 758 HB THR 109 HB THR 109 9.574 -4.729 -10.237 759 HG1 THR 109 HG1 THR 109 10.087 -6.922 -9.741 760 HG21 THR 109 HG21 THR 109 11.810 -3.794 -9.859 761 HG22 THR 109 HG22 THR 109 11.918 -5.481 -10.367 762 HG23 THR 109 HG23 THR 109 12.145 -5.054 -8.669 763 H PHE 110 H PHE 110 10.908 -2.253 -7.042 764 HA PHE 110 HA PHE 110 10.078 -0.148 -8.870 765 HB2 PHE 110 HB2 PHE 110 11.819 -0.098 -6.394 766 HB3 PHE 110 HB3 PHE 110 11.555 1.303 -7.412 767 HD1 PHE 110 HD1 PHE 110 8.596 -0.745 -7.072 768 HD2 PHE 110 HD2 PHE 110 10.902 2.311 -5.208 769 HE1 PHE 110 HE1 PHE 110 6.666 -0.143 -5.681 770 HE2 PHE 110 HE2 PHE 110 8.969 2.912 -3.817 771 HZ PHE 110 HZ PHE 110 6.851 1.684 -4.048 772 H PHE 111 H PHE 111 10.990 -0.948 -10.738 773 HA PHE 111 HA PHE 111 13.844 -1.483 -10.819 774 HB2 PHE 111 HB2 PHE 111 13.378 -2.137 -13.213 775 HB3 PHE 111 HB3 PHE 111 12.557 -3.103 -12.000 776 HD1 PHE 111 HD1 PHE 111 10.114 -2.873 -11.682 777 HD2 PHE 111 HD2 PHE 111 12.160 -0.822 -14.799 778 HE1 PHE 111 HE1 PHE 111 7.974 -2.490 -12.830 779 HE2 PHE 111 HE2 PHE 111 10.021 -0.432 -15.946 780 HZ PHE 111 HZ PHE 111 7.925 -1.264 -14.962 781 H ASN 112 H ASN 112 11.572 0.933 -11.697 782 HA ASN 112 HA ASN 112 13.703 2.500 -12.950 783 HB2 ASN 112 HB2 ASN 112 10.702 2.718 -13.088 784 HB3 ASN 112 HB3 ASN 112 11.731 4.081 -13.509 785 HD21 ASN 112 HD21 ASN 112 13.813 2.319 -14.615 786 HD22 ASN 112 HD22 ASN 112 13.201 1.785 -16.140 787 H GLU 113 H GLU 113 14.100 4.561 -12.268 788 HA GLU 113 HA GLU 113 13.588 5.184 -9.502 789 HB2 GLU 113 HB2 GLU 113 15.708 5.554 -10.897 790 HB3 GLU 113 HB3 GLU 113 14.863 6.910 -11.620 791 HG2 GLU 113 HG2 GLU 113 14.734 8.025 -9.494 792 HG3 GLU 113 HG3 GLU 113 15.420 6.617 -8.678 793 H GLY 114 H GLY 114 12.354 7.036 -8.794 794 HA2 GLY 114 HA2 GLY 114 11.230 9.082 -9.991 795 HA3 GLY 114 HA3 GLY 114 10.271 7.804 -10.713 796 H GLU 115 H GLU 115 8.351 7.684 -9.827 797 HA GLU 115 HA GLU 115 8.043 8.104 -6.946 798 HB2 GLU 115 HB2 GLU 115 7.727 10.277 -8.092 799 HB3 GLU 115 HB3 GLU 115 6.474 9.556 -9.090 800 HG2 GLU 115 HG2 GLU 115 5.903 9.138 -6.302 801 HG3 GLU 115 HG3 GLU 115 6.179 10.849 -6.639 802 H TYR 116 H TYR 116 6.882 6.500 -6.146 803 HA TYR 116 HA TYR 116 4.795 5.254 -7.825 804 HB2 TYR 116 HB2 TYR 116 6.608 3.875 -5.827 805 HB3 TYR 116 HB3 TYR 116 5.251 3.117 -6.636 806 HD1 TYR 116 HD2 TYR 116 8.611 4.588 -7.193 807 HD2 TYR 116 HD1 TYR 116 5.509 2.135 -8.763 808 HE1 TYR 116 HE2 TYR 116 10.124 3.824 -8.965 809 HE2 TYR 116 HE1 TYR 116 7.024 1.353 -10.540 810 HH TYR 116 HH TYR 116 10.428 2.123 -10.495 811 H ILE 117 H ILE 117 2.851 5.697 -6.946 812 HA ILE 117 HA ILE 117 2.681 6.038 -4.048 813 HB ILE 117 HB ILE 117 0.497 6.459 -6.112 814 HG12 ILE 117 HG12 ILE 117 2.106 8.517 -4.579 815 HG13 ILE 117 HG13 ILE 117 2.460 8.037 -6.233 816 HG21 ILE 117 HG21 ILE 117 -0.688 7.594 -4.265 817 HG22 ILE 117 HG22 ILE 117 0.607 7.126 -3.160 818 HG23 ILE 117 HG23 ILE 117 -0.400 5.889 -3.914 819 HD11 ILE 117 HD11 ILE 117 1.228 10.135 -6.137 820 HD12 ILE 117 HD12 ILE 117 -0.093 9.325 -5.295 821 HD13 ILE 117 HD13 ILE 117 0.300 8.879 -6.955 822 H VAL 118 H VAL 118 2.488 4.266 -2.933 823 HA VAL 118 HA VAL 118 1.167 1.920 -4.027 824 HB VAL 118 HB VAL 118 2.463 2.268 -1.306 825 HG11 VAL 118 HG11 VAL 118 0.874 0.424 -1.348 826 HG12 VAL 118 HG12 VAL 118 2.527 -0.187 -1.259 827 HG13 VAL 118 HG13 VAL 118 1.652 -0.233 -2.789 828 HG21 VAL 118 HG21 VAL 118 4.382 1.062 -2.244 829 HG22 VAL 118 HG22 VAL 118 4.104 2.593 -3.075 830 HG23 VAL 118 HG23 VAL 118 3.610 1.077 -3.829 831 H SER 119 H SER 119 -0.897 1.445 -3.644 832 HA SER 119 HA SER 119 -2.279 2.927 -1.517 833 HB2 SER 119 HB2 SER 119 -3.032 3.539 -3.796 834 HB3 SER 119 HB3 SER 119 -3.413 1.849 -4.111 835 HG SER 119 HG SER 119 -5.312 2.497 -3.423 836 H LEU 120 H LEU 120 -3.274 1.808 -0.002 837 HA LEU 120 HA LEU 120 -3.865 -1.041 -0.443 838 HB2 LEU 120 HB2 LEU 120 -1.939 -0.752 1.094 839 HB3 LEU 120 HB3 LEU 120 -2.909 0.268 2.121 840 HG LEU 120 HG LEU 120 -2.431 -2.170 2.837 841 HD11 LEU 120 HD11 LEU 120 -4.544 -2.356 3.982 842 HD12 LEU 120 HD12 LEU 120 -5.234 -1.116 2.933 843 HD13 LEU 120 HD13 LEU 120 -3.917 -0.709 4.035 844 HD21 LEU 120 HD21 LEU 120 -4.093 -3.816 2.119 845 HD22 LEU 120 HD22 LEU 120 -3.056 -3.301 0.788 846 HD23 LEU 120 HD23 LEU 120 -4.701 -2.673 0.917 847 H ILE 121 H ILE 121 -5.965 -1.376 -0.411 848 HA ILE 121 HA ILE 121 -7.590 0.290 1.357 849 HB ILE 121 HB ILE 121 -8.150 1.086 -0.789 850 HG12 ILE 121 HG12 ILE 121 -10.079 0.315 0.839 851 HG13 ILE 121 HG13 ILE 121 -10.440 0.986 -0.741 852 HG21 ILE 121 HG21 ILE 121 -8.910 -0.318 -2.670 853 HG22 ILE 121 HG22 ILE 121 -8.418 -1.744 -1.753 854 HG23 ILE 121 HG23 ILE 121 -7.219 -0.539 -2.226 855 HD11 ILE 121 HD11 ILE 121 -10.838 -1.267 -1.607 856 HD12 ILE 121 HD12 ILE 121 -11.866 -0.914 -0.217 857 HD13 ILE 121 HD13 ILE 121 -10.449 -1.948 -0.026 858 H VAL 122 H VAL 122 -8.544 -0.780 2.849 859 HA VAL 122 HA VAL 122 -9.024 -3.655 2.462 860 HB VAL 122 HB VAL 122 -9.098 -3.761 5.006 861 HG11 VAL 122 HG11 VAL 122 -7.239 -4.646 3.730 862 HG12 VAL 122 HG12 VAL 122 -6.656 -3.883 5.211 863 HG13 VAL 122 HG13 VAL 122 -6.498 -3.049 3.664 864 HG21 VAL 122 HG21 VAL 122 -7.687 -1.108 4.759 865 HG22 VAL 122 HG22 VAL 122 -7.902 -2.043 6.240 866 HG23 VAL 122 HG23 VAL 122 -9.305 -1.353 5.423 867 H SER 123 H SER 123 -10.954 -4.493 3.592 868 HA SER 123 HA SER 123 -13.037 -2.508 3.932 869 HB2 SER 123 HB2 SER 123 -14.534 -3.766 2.333 870 HB3 SER 123 HB3 SER 123 -13.218 -2.869 1.580 871 HG SER 123 HG SER 123 -13.719 -5.245 1.028 872 H ASN 124 H ASN 124 -14.905 -3.270 4.857 873 HA ASN 124 HA ASN 124 -14.851 -5.971 6.024 874 HB2 ASN 124 HB2 ASN 124 -14.439 -3.868 7.579 875 HB3 ASN 124 HB3 ASN 124 -16.168 -3.618 7.377 876 HD21 ASN 124 HD21 ASN 124 -13.700 -5.591 8.795 877 HD22 ASN 124 HD22 ASN 124 -14.741 -6.497 9.841 878 H GLU 125 H GLU 125 -17.492 -6.060 6.913 879 HA GLU 125 HA GLU 125 -19.061 -5.826 4.498 880 HB2 GLU 125 HB2 GLU 125 -20.906 -6.727 5.879 881 HB3 GLU 125 HB3 GLU 125 -19.449 -7.706 5.972 882 HG2 GLU 125 HG2 GLU 125 -18.915 -6.682 8.143 883 HG3 GLU 125 HG3 GLU 125 -20.407 -5.747 8.054 884 H ASN 126 H ASN 126 -18.155 -3.667 6.821 885 HA ASN 126 HA ASN 126 -20.647 -2.140 6.901 886 HB2 ASN 126 HB2 ASN 126 -18.029 -1.622 8.341 887 HB3 ASN 126 HB3 ASN 126 -19.576 -0.850 8.666 888 HD21 ASN 126 HD21 ASN 126 -17.690 -2.538 10.260 889 HD22 ASN 126 HD22 ASN 126 -18.683 -3.782 10.935 890 H ASP 127 H ASP 127 -17.191 -1.617 6.256 891 HA ASP 127 HA ASP 127 -17.777 0.661 4.537 892 HB2 ASP 127 HB2 ASP 127 -17.730 1.508 6.884 893 HB3 ASP 127 HB3 ASP 127 -16.111 0.859 7.067 894 H SER 128 H SER 128 -15.821 1.402 3.374 895 HA SER 128 HA SER 128 -13.557 -0.485 3.504 896 HB2 SER 128 HB2 SER 128 -14.477 1.119 1.100 897 HB3 SER 128 HB3 SER 128 -13.123 -0.011 1.146 898 HG SER 128 HG SER 128 -15.610 -0.974 1.946 899 H ASP 129 H ASP 129 -11.632 0.389 3.951 900 HA ASP 129 HA ASP 129 -11.423 3.332 3.989 901 HB2 ASP 129 HB2 ASP 129 -11.569 2.228 6.265 902 HB3 ASP 129 HB3 ASP 129 -10.051 1.420 5.895 903 H SER 130 H SER 130 -9.761 4.156 2.838 904 HA SER 130 HA SER 130 -7.617 2.314 2.027 905 HB2 SER 130 HB2 SER 130 -7.504 3.649 -0.112 906 HB3 SER 130 HB3 SER 130 -8.963 2.677 0.080 907 HG SER 130 HG SER 130 -10.073 4.560 0.709 908 H ALA 131 H ALA 131 -5.573 3.131 1.832 909 HA ALA 131 HA ALA 131 -5.083 5.960 2.309 910 HB1 ALA 131 HB1 ALA 131 -3.740 3.799 3.947 911 HB2 ALA 131 HB2 ALA 131 -4.927 4.956 4.552 912 HB3 ALA 131 HB3 ALA 131 -3.354 5.520 3.986 913 H SER 132 H SER 132 -3.142 6.674 1.541 914 HA SER 132 HA SER 132 -1.640 4.806 -0.134 915 HB2 SER 132 HB2 SER 132 -2.874 7.415 -1.046 916 HB3 SER 132 HB3 SER 132 -1.759 6.449 -1.985 917 HG SER 132 HG SER 132 -3.669 4.822 -1.209 918 H VAL 133 H VAL 133 0.493 5.495 -0.596 919 HA VAL 133 HA VAL 133 1.366 7.950 0.686 920 HB VAL 133 HB VAL 133 1.689 6.268 2.423 921 HG11 VAL 133 HG11 VAL 133 1.908 4.256 1.093 922 HG12 VAL 133 HG12 VAL 133 3.273 4.426 2.198 923 HG13 VAL 133 HG13 VAL 133 3.470 4.805 0.487 924 HG21 VAL 133 HG21 VAL 133 4.089 6.592 2.865 925 HG22 VAL 133 HG22 VAL 133 3.277 8.076 2.368 926 HG23 VAL 133 HG23 VAL 133 4.290 7.197 1.221 927 H THR 134 H THR 134 2.770 9.032 -0.473 928 HA THR 134 HA THR 134 3.630 8.024 -3.031 929 HB THR 134 HB THR 134 4.255 10.673 -1.693 930 HG1 THR 134 HG1 THR 134 2.041 10.541 -1.924 931 HG21 THR 134 HG21 THR 134 5.725 10.133 -3.593 932 HG22 THR 134 HG22 THR 134 4.653 11.489 -3.951 933 HG23 THR 134 HG23 THR 134 4.304 9.889 -4.608 934 H ILE 135 H ILE 135 5.288 6.673 -3.080 935 HA ILE 135 HA ILE 135 7.461 6.870 -1.143 936 HB ILE 135 HB ILE 135 7.125 4.838 -3.373 937 HG12 ILE 135 HG12 ILE 135 5.188 4.677 -1.903 938 HG13 ILE 135 HG13 ILE 135 6.243 3.292 -1.652 939 HG21 ILE 135 HG21 ILE 135 9.400 4.970 -2.519 940 HG22 ILE 135 HG22 ILE 135 8.647 3.445 -2.052 941 HG23 ILE 135 HG23 ILE 135 8.810 4.744 -0.869 942 HD11 ILE 135 HD11 ILE 135 5.342 4.129 0.442 943 HD12 ILE 135 HD12 ILE 135 6.055 5.713 0.130 944 HD13 ILE 135 HD13 ILE 135 7.098 4.311 0.391 945 H ARG 136 H ARG 136 9.486 7.565 -1.648 946 HA ARG 136 HA ARG 136 9.748 8.788 -4.299 947 HB2 ARG 136 HB2 ARG 136 11.165 9.465 -1.713 948 HB3 ARG 136 HB3 ARG 136 11.425 10.269 -3.256 949 HG2 ARG 136 HG2 ARG 136 9.137 11.088 -3.241 950 HG3 ARG 136 HG3 ARG 136 8.827 10.235 -1.727 951 HD2 ARG 136 HD2 ARG 136 9.246 12.542 -1.230 952 HD3 ARG 136 HD3 ARG 136 10.615 11.589 -0.662 953 HE ARG 136 HE ARG 136 11.021 12.620 -3.304 954 HH11 ARG 136 HH11 ARG 136 11.287 13.424 0.111 955 HH12 ARG 136 HH12 ARG 136 12.408 14.720 -0.162 956 HH21 ARG 136 HH21 ARG 136 12.504 14.291 -3.646 957 HH22 ARG 136 HH22 ARG 136 13.105 15.213 -2.299 958 H ALA 137 H ALA 137 11.018 7.783 -5.640 959 HA ALA 137 HA ALA 137 13.327 6.277 -4.596 960 HB1 ALA 137 HB1 ALA 137 11.708 4.886 -5.803 961 HB2 ALA 137 HB2 ALA 137 13.240 4.983 -6.672 962 HB3 ALA 137 HB3 ALA 137 11.857 5.935 -7.213 963 H LEU 138 H LEU 138 15.136 7.409 -4.803 964 HA LEU 138 HA LEU 138 15.346 9.328 -7.002 965 HB2 LEU 138 HB2 LEU 138 16.631 10.770 -5.349 966 HB3 LEU 138 HB3 LEU 138 14.883 10.773 -5.333 967 HG LEU 138 HG LEU 138 15.094 9.087 -3.387 968 HD11 LEU 138 HD11 LEU 138 17.859 10.308 -3.315 969 HD12 LEU 138 HD12 LEU 138 17.490 8.602 -3.574 970 HD13 LEU 138 HD13 LEU 138 17.112 9.362 -2.026 971 HD21 LEU 138 HD21 LEU 138 15.211 10.958 -1.878 972 HD22 LEU 138 HD22 LEU 138 14.311 11.369 -3.343 973 HD23 LEU 138 HD23 LEU 138 15.969 11.927 -3.143 974 H GLU 139 H GLU 139 17.689 10.300 -6.994 975 HA GLU 139 HA GLU 139 19.405 8.013 -7.321 976 HB2 GLU 139 HB2 GLU 139 19.181 9.716 -9.117 977 HB3 GLU 139 HB3 GLU 139 19.919 10.894 -8.048 978 HG2 GLU 139 HG2 GLU 139 21.544 8.493 -8.387 979 HG3 GLU 139 HG3 GLU 139 21.222 9.344 -9.898 980 H HIS 140 H HIS 140 20.829 7.375 -5.915 981 HA HIS 140 HA HIS 140 21.539 9.165 -3.714 982 HB2 HIS 140 HB2 HIS 140 22.203 7.219 -2.439 983 HB3 HIS 140 HB3 HIS 140 20.606 6.947 -3.089 984 HD1 HIS 140 HD1 HIS 140 23.261 5.001 -2.265 985 HD2 HIS 140 HD2 HIS 140 21.261 5.463 -5.884 986 HE1 HIS 140 HE1 HIS 140 23.669 2.872 -3.545 987 HE2 HIS 140 HE2 HIS 140 22.479 3.177 -5.741 988 H HIS 141 H HIS 141 23.551 9.860 -3.337 989 HA HIS 141 HA HIS 141 25.732 8.712 -4.891 990 HB2 HIS 141 HB2 HIS 141 26.614 11.066 -5.344 991 HB3 HIS 141 HB3 HIS 141 25.266 10.514 -6.311 992 HD1 HIS 141 HD1 HIS 141 22.866 11.546 -5.575 993 HD2 HIS 141 HD2 HIS 141 26.279 13.497 -4.208 994 HE1 HIS 141 HE1 HIS 141 22.087 13.838 -4.849 995 HE2 HIS 141 HE2 HIS 141 24.201 15.052 -4.173 996 H HIS 142 H HIS 142 26.447 7.725 -3.100 997 HA HIS 142 HA HIS 142 27.971 9.456 -1.280 998 HB2 HIS 142 HB2 HIS 142 26.251 7.114 -0.407 999 HB3 HIS 142 HB3 HIS 142 27.462 7.873 0.610 1000 HD1 HIS 142 HD1 HIS 142 26.920 10.405 1.338 1001 HD2 HIS 142 HD2 HIS 142 23.776 8.248 -0.338 1002 HE1 HIS 142 HE1 HIS 142 24.824 11.647 1.979 1003 HE2 HIS 142 HE2 HIS 142 22.931 10.322 0.973 1004 H HIS 143 H HIS 143 30.012 8.948 -1.965 1005 HA HIS 143 HA HIS 143 30.822 6.246 -1.228 1006 HB2 HIS 143 HB2 HIS 143 32.219 5.847 -3.131 1007 HB3 HIS 143 HB3 HIS 143 30.642 6.276 -3.743 1008 HD1 HIS 143 HD1 HIS 143 30.510 8.881 -4.653 1009 HD2 HIS 143 HD2 HIS 143 34.271 7.130 -4.306 1010 HE1 HIS 143 HE1 HIS 143 32.045 10.288 -6.077 1011 HE2 HIS 143 HE2 HIS 143 34.327 9.264 -5.784 1012 H HIS 144 H HIS 144 32.365 6.321 0.238 1013 HA HIS 144 HA HIS 144 34.274 8.548 0.192 1014 HB2 HIS 144 HB2 HIS 144 32.558 7.758 2.538 1015 HB3 HIS 144 HB3 HIS 144 34.132 8.497 2.790 1016 HD1 HIS 144 HD1 HIS 144 34.328 10.999 2.426 1017 HD2 HIS 144 HD2 HIS 144 30.597 9.462 1.415 1018 HE1 HIS 144 HE1 HIS 144 32.850 13.003 2.045 1019 HE2 HIS 144 HE2 HIS 144 30.649 12.048 1.264 1020 H HIS 145 H HIS 145 33.701 5.938 2.538 1021 HA HIS 145 HA HIS 145 35.925 4.373 1.592 1022 HB2 HIS 145 HB2 HIS 145 37.045 6.129 2.960 1023 HB3 HIS 145 HB3 HIS 145 36.059 5.671 4.338 1024 HD1 HIS 145 HD1 HIS 145 38.778 4.219 2.110 1025 HD2 HIS 145 HD2 HIS 145 37.124 3.698 5.897 1026 HE1 HIS 145 HE1 HIS 145 40.281 2.577 3.285 1027 HE2 HIS 145 HE2 HIS 145 39.399 2.472 5.650 Start of MODEL 15 1 H1 MET 1 H1 MET 1-150.063 69.122 96.757 2 H2 MET 1 H2 MET 1-150.332 67.652 95.956 3 H3 MET 1 H3 MET 1-150.809 69.108 95.237 4 HA MET 1 HA MET 1-148.569 69.812 94.973 5 HB2 MET 1 HB2 MET 1-147.914 67.200 96.360 6 HB3 MET 1 HB3 MET 1-146.732 68.145 95.470 7 HG2 MET 1 HG2 MET 1-146.396 68.690 97.715 8 HG3 MET 1 HG3 MET 1-147.288 70.052 97.044 9 HE1 MET 1 HE1 MET 1-148.692 70.001 100.654 10 HE2 MET 1 HE2 MET 1-147.983 70.977 99.368 11 HE3 MET 1 HE3 MET 1-147.030 69.707 100.138 12 H ASN 2 H ASN 2-148.389 69.714 92.842 13 HA ASN 2 HA ASN 2-148.792 67.100 91.528 14 HB2 ASN 2 HB2 ASN 2-149.221 69.892 90.424 15 HB3 ASN 2 HB3 ASN 2-149.335 68.423 89.465 16 HD21 ASN 2 HD21 ASN 2-151.315 70.489 90.055 17 HD22 ASN 2 HD22 ASN 2-152.666 69.671 90.763 18 H ALA 3 H ALA 3-146.586 66.638 92.075 19 HA ALA 3 HA ALA 3-144.647 68.049 90.368 20 HB1 ALA 3 HB1 ALA 3-144.284 68.534 92.727 21 HB2 ALA 3 HB2 ALA 3-142.945 67.601 92.057 22 HB3 ALA 3 HB3 ALA 3-144.154 66.810 93.071 23 H ARG 4 H ARG 4-142.652 66.677 89.976 24 HA ARG 4 HA ARG 4-143.238 63.831 89.744 25 HB2 ARG 4 HB2 ARG 4-142.435 63.774 87.398 26 HB3 ARG 4 HB3 ARG 4-143.933 64.668 87.579 27 HG2 ARG 4 HG2 ARG 4-141.357 66.162 87.594 28 HG3 ARG 4 HG3 ARG 4-141.982 65.542 86.065 29 HD2 ARG 4 HD2 ARG 4-143.939 66.845 86.216 30 HD3 ARG 4 HD3 ARG 4-143.678 67.188 87.926 31 HE ARG 4 HE ARG 4-141.719 68.537 87.178 32 HH11 ARG 4 HH11 ARG 4-144.352 67.932 84.896 33 HH12 ARG 4 HH12 ARG 4-144.072 69.403 84.016 34 HH21 ARG 4 HH21 ARG 4-141.395 70.465 86.032 35 HH22 ARG 4 HH22 ARG 4-142.397 70.829 84.661 36 H ASP 5 H ASP 5-141.516 62.536 89.975 37 HA ASP 5 HA ASP 5-138.915 63.815 90.384 38 HB2 ASP 5 HB2 ASP 5-139.779 62.200 92.119 39 HB3 ASP 5 HB3 ASP 5-139.667 60.927 90.904 40 H ASN 6 H ASN 6-137.402 63.713 88.893 41 HA ASN 6 HA ASN 6-138.112 62.447 86.374 42 HB2 ASN 6 HB2 ASN 6-137.440 64.859 86.497 43 HB3 ASN 6 HB3 ASN 6-135.839 64.343 87.002 44 HD21 ASN 6 HD21 ASN 6-137.787 62.719 84.547 45 HD22 ASN 6 HD22 ASN 6-136.738 63.100 83.227 46 H LYS 7 H LYS 7-137.439 60.456 86.036 47 HA LYS 7 HA LYS 7-134.699 59.724 86.814 48 HB2 LYS 7 HB2 LYS 7-135.416 57.359 86.626 49 HB3 LYS 7 HB3 LYS 7-136.341 58.236 87.828 50 HG2 LYS 7 HG2 LYS 7-138.031 57.093 86.846 51 HG3 LYS 7 HG3 LYS 7-138.030 58.507 85.794 52 HD2 LYS 7 HD2 LYS 7-136.622 57.279 84.181 53 HD3 LYS 7 HD3 LYS 7-136.661 55.872 85.242 54 HE2 LYS 7 HE2 LYS 7-139.093 57.138 83.976 55 HE3 LYS 7 HE3 LYS 7-138.257 55.715 83.354 56 HZ1 LYS 7 HZ1 LYS 7-140.119 54.997 84.636 57 HZ2 LYS 7 HZ2 LYS 7-139.669 55.964 85.954 58 HZ3 LYS 7 HZ3 LYS 7-138.718 54.629 85.519 59 H PHE 8 H PHE 8-133.574 58.274 85.216 60 HA PHE 8 HA PHE 8-134.491 58.598 82.463 61 HB2 PHE 8 HB2 PHE 8-132.275 59.383 81.693 62 HB3 PHE 8 HB3 PHE 8-133.070 60.536 82.750 63 HD1 PHE 8 HD1 PHE 8-130.240 58.247 82.373 64 HD2 PHE 8 HD2 PHE 8-132.152 61.055 84.932 65 HE1 PHE 8 HE1 PHE 8-128.197 58.400 83.727 66 HE2 PHE 8 HE2 PHE 8-130.114 61.208 86.293 67 HZ PHE 8 HZ PHE 8-128.129 59.880 85.689 68 H ASN 9 H ASN 9-133.127 57.350 80.927 69 HA ASN 9 HA ASN 9-131.958 54.956 82.177 70 HB2 ASN 9 HB2 ASN 9-133.641 55.248 79.693 71 HB3 ASN 9 HB3 ASN 9-132.528 53.896 79.874 72 HD21 ASN 9 HD21 ASN 9-132.965 52.297 81.306 73 HD22 ASN 9 HD22 ASN 9-134.497 52.123 82.096 74 H THR 10 H THR 10-129.951 54.338 81.485 75 HA THR 10 HA THR 10-128.772 55.803 79.239 76 HB THR 10 HB THR 10-128.095 56.974 81.316 77 HG1 THR 10 HG1 THR 10-126.643 56.974 79.563 78 HG21 THR 10 HG21 THR 10-126.545 55.916 82.895 79 HG22 THR 10 HG22 THR 10-126.732 54.380 82.049 80 HG23 THR 10 HG23 THR 10-128.109 55.099 82.886 81 H TRP 11 H TRP 11-127.056 54.726 78.191 82 HA TRP 11 HA TRP 11-126.395 52.020 79.006 83 HB2 TRP 11 HB2 TRP 11-128.501 51.854 77.633 84 HB3 TRP 11 HB3 TRP 11-127.610 52.535 76.277 85 HD1 TRP 11 HD1 TRP 11-126.916 50.694 74.639 86 HE1 TRP 11 HE1 TRP 11-126.177 48.235 74.813 87 HE3 TRP 11 HE3 TRP 11-127.164 50.112 79.726 88 HZ2 TRP 11 HZ2 TRP 11-125.747 46.319 76.825 89 HZ3 TRP 11 HZ3 TRP 11-126.561 47.928 80.686 90 HH2 TRP 11 HH2 TRP 11-125.868 46.077 79.263 91 H ASN 12 H ASN 12-124.473 51.301 78.161 92 HA ASN 12 HA ASN 12-122.953 53.209 76.522 93 HB2 ASN 12 HB2 ASN 12-120.918 52.408 77.656 94 HB3 ASN 12 HB3 ASN 12-122.064 53.070 78.812 95 HD21 ASN 12 HD21 ASN 12-120.328 50.294 77.775 96 HD22 ASN 12 HD22 ASN 12-120.859 49.221 79.028 97 H ASP 13 H ASP 13-121.249 52.199 75.196 98 HA ASP 13 HA ASP 13-122.212 49.683 74.045 99 HB2 ASP 13 HB2 ASP 13-120.471 51.893 72.997 100 HB3 ASP 13 HB3 ASP 13-120.465 50.310 72.229 101 H SER 14 H SER 14-120.414 48.255 73.131 102 HA SER 14 HA SER 14-118.237 48.020 75.102 103 HB2 SER 14 HB2 SER 14-119.684 45.794 73.643 104 HB3 SER 14 HB3 SER 14-118.324 45.582 74.748 105 HG SER 14 HG SER 14-119.741 46.712 76.322 106 H ARG 15 H ARG 15-116.442 48.671 74.160 107 HA ARG 15 HA ARG 15-115.699 47.566 71.547 108 HB2 ARG 15 HB2 ARG 15-116.601 49.887 71.239 109 HB3 ARG 15 HB3 ARG 15-115.360 50.473 72.332 110 HG2 ARG 15 HG2 ARG 15-114.689 50.920 70.084 111 HG3 ARG 15 HG3 ARG 15-113.639 49.671 70.748 112 HD2 ARG 15 HD2 ARG 15-114.311 49.193 68.431 113 HD3 ARG 15 HD3 ARG 15-114.865 47.960 69.561 114 HE ARG 15 HE ARG 15-117.085 49.148 69.457 115 HH11 ARG 15 HH11 ARG 15-114.817 49.343 66.765 116 HH12 ARG 15 HH12 ARG 15-116.064 49.573 65.576 117 HH21 ARG 15 HH21 ARG 15-118.699 49.456 67.892 118 HH22 ARG 15 HH22 ARG 15-118.266 49.614 66.219 119 H GLY 16 H GLY 16-113.633 46.838 71.540 120 HA2 GLY 16 HA2 GLY 16-111.851 47.702 73.727 121 HA3 GLY 16 HA3 GLY 16-112.024 46.004 73.306 122 H ASN 17 H ASN 17-109.915 48.377 73.057 123 HA ASN 17 HA ASN 17-108.959 47.400 70.452 124 HB2 ASN 17 HB2 ASN 17-108.933 50.205 71.532 125 HB3 ASN 17 HB3 ASN 17-107.702 49.689 70.386 126 HD21 ASN 17 HD21 ASN 17-111.042 50.467 70.852 127 HD22 ASN 17 HD22 ASN 17-111.481 50.468 69.176 128 H TYR 18 H TYR 18-106.894 46.746 70.330 129 HA TYR 18 HA TYR 18-105.036 47.175 72.520 130 HB2 TYR 18 HB2 TYR 18-104.667 44.810 72.951 131 HB3 TYR 18 HB3 TYR 18-106.367 45.173 73.190 132 HD1 TYR 18 HD2 TYR 18-108.034 44.425 71.483 133 HD2 TYR 18 HD1 TYR 18-103.947 43.216 71.315 134 HE1 TYR 18 HE2 TYR 18-108.644 42.605 69.956 135 HE2 TYR 18 HE1 TYR 18-104.562 41.379 69.788 136 HH TYR 18 HH TYR 18-107.579 41.214 68.240 137 H TRP 19 H TRP 19-102.967 45.751 71.937 138 HA TRP 19 HA TRP 19-102.603 45.462 69.063 139 HB2 TRP 19 HB2 TRP 19-100.327 46.566 69.252 140 HB3 TRP 19 HB3 TRP 19-101.705 47.656 69.358 141 HD1 TRP 19 HD1 TRP 19 -99.176 45.911 71.708 142 HE1 TRP 19 HE1 TRP 19 -98.805 47.436 73.749 143 HE3 TRP 19 HE3 TRP 19-102.597 49.546 70.636 144 HZ2 TRP 19 HZ2 TRP 19 -99.830 49.852 74.772 145 HZ3 TRP 19 HZ3 TRP 19-102.848 51.425 72.200 146 HH2 TRP 19 HH2 TRP 19-101.494 51.574 74.226 147 H SER 20 H SER 20-100.465 44.315 68.622 148 HA SER 20 HA SER 20 -99.550 42.654 70.860 149 HB2 SER 20 HB2 SER 20-100.416 41.565 68.165 150 HB3 SER 20 HB3 SER 20 -99.561 40.634 69.395 151 HG SER 20 HG SER 20-101.763 41.919 70.375 152 H ASP 21 H ASP 21 -97.516 43.345 71.015 153 HA ASP 21 HA ASP 21 -95.758 43.119 68.706 154 HB2 ASP 21 HB2 ASP 21 -96.521 45.453 68.701 155 HB3 ASP 21 HB3 ASP 21 -95.998 45.636 70.372 156 H TYR 22 H TYR 22 -93.708 42.486 69.251 157 HA TYR 22 HA TYR 22 -92.983 42.430 72.101 158 HB2 TYR 22 HB2 TYR 22 -92.728 40.117 70.157 159 HB3 TYR 22 HB3 TYR 22 -91.975 40.159 71.745 160 HD1 TYR 22 HD1 TYR 22 -93.345 39.922 73.771 161 HD2 TYR 22 HD2 TYR 22 -95.099 39.751 69.901 162 HE1 TYR 22 HE1 TYR 22 -95.403 38.995 74.746 163 HE2 TYR 22 HE2 TYR 22 -97.155 38.829 70.866 164 HH TYR 22 HH TYR 22 -97.913 37.657 72.825 165 H GLU 23 H GLU 23 -91.304 43.761 72.204 166 HA GLU 23 HA GLU 23 -89.489 44.057 69.960 167 HB2 GLU 23 HB2 GLU 23 -89.433 45.454 72.639 168 HB3 GLU 23 HB3 GLU 23 -88.503 45.897 71.213 169 HG2 GLU 23 HG2 GLU 23 -90.675 46.275 70.025 170 HG3 GLU 23 HG3 GLU 23 -91.483 46.055 71.575 171 H GLY 24 H GLY 24 -87.868 42.733 69.704 172 HA2 GLY 24 HA2 GLY 24 -86.349 41.867 72.087 173 HA3 GLY 24 HA3 GLY 24 -86.513 40.891 70.630 174 H SER 25 H SER 25 -84.651 43.203 72.243 175 HA SER 25 HA SER 25 -83.426 44.312 69.870 176 HB2 SER 25 HB2 SER 25 -82.647 44.654 72.775 177 HB3 SER 25 HB3 SER 25 -82.118 45.654 71.422 178 HG SER 25 HG SER 25 -83.809 46.698 72.436 179 H ASP 26 H ASP 26 -81.746 43.512 68.860 180 HA ASP 26 HA ASP 26 -80.399 41.148 69.799 181 HB2 ASP 26 HB2 ASP 26 -80.961 41.415 67.420 182 HB3 ASP 26 HB3 ASP 26 -79.946 42.854 67.333 183 H GLU 27 H GLU 27 -78.485 41.028 70.779 184 HA GLU 27 HA GLU 27 -77.151 43.450 71.622 185 HB2 GLU 27 HB2 GLU 27 -77.520 41.528 73.152 186 HB3 GLU 27 HB3 GLU 27 -76.451 40.552 72.155 187 HG2 GLU 27 HG2 GLU 27 -74.599 42.069 72.668 188 HG3 GLU 27 HG3 GLU 27 -75.681 43.038 73.671 189 H ASN 28 H ASN 28 -75.665 44.389 70.417 190 HA ASN 28 HA ASN 28 -74.509 42.945 68.176 191 HB2 ASN 28 HB2 ASN 28 -74.634 45.860 68.909 192 HB3 ASN 28 HB3 ASN 28 -73.512 45.295 67.681 193 HD21 ASN 28 HD21 ASN 28 -76.723 43.953 68.216 194 HD22 ASN 28 HD22 ASN 28 -77.391 44.505 66.721 195 H GLY 29 H GLY 29 -72.907 41.661 68.884 196 HA2 GLY 29 HA2 GLY 29 -70.750 42.806 70.490 197 HA3 GLY 29 HA3 GLY 29 -70.913 41.116 70.022 198 H ASP 30 H ASP 30 -68.936 43.581 69.635 199 HA ASP 30 HA ASP 30 -68.546 43.222 66.745 200 HB2 ASP 30 HB2 ASP 30 -69.024 45.532 67.484 201 HB3 ASP 30 HB3 ASP 30 -67.610 45.482 68.529 202 H GLY 31 H GLY 31 -66.693 42.381 65.986 203 HA2 GLY 31 HA2 GLY 31 -64.478 41.983 67.894 204 HA3 GLY 31 HA3 GLY 31 -64.896 40.807 66.657 205 H ILE 32 H ILE 32 -62.340 41.678 66.781 206 HA ILE 32 HA ILE 32 -62.130 43.181 64.285 207 HB ILE 32 HB ILE 32 -61.729 44.865 65.982 208 HG12 ILE 32 HG12 ILE 32 -59.055 44.052 64.816 209 HG13 ILE 32 HG13 ILE 32 -60.323 44.860 63.907 210 HG21 ILE 32 HG21 ILE 32 -61.143 43.480 67.868 211 HG22 ILE 32 HG22 ILE 32 -59.902 44.708 67.614 212 HG23 ILE 32 HG23 ILE 32 -59.613 43.041 67.110 213 HD11 ILE 32 HD11 ILE 32 -60.146 46.796 65.392 214 HD12 ILE 32 HD12 ILE 32 -58.612 46.429 64.604 215 HD13 ILE 32 HD13 ILE 32 -58.864 45.983 66.292 216 H GLY 33 H GLY 33 -60.700 42.341 62.881 217 HA2 GLY 33 HA2 GLY 33 -59.019 40.113 63.790 218 HA3 GLY 33 HA3 GLY 33 -59.460 40.456 62.122 219 H ASP 34 H ASP 34 -57.508 41.545 64.834 220 HA ASP 34 HA ASP 34 -56.067 43.528 63.379 221 HB2 ASP 34 HB2 ASP 34 -56.348 43.657 65.819 222 HB3 ASP 34 HB3 ASP 34 -55.422 42.174 66.016 223 H SER 35 H SER 35 -54.105 43.431 62.398 224 HA SER 35 HA SER 35 -53.293 40.730 61.631 225 HB2 SER 35 HB2 SER 35 -52.599 43.365 60.326 226 HB3 SER 35 HB3 SER 35 -52.357 41.749 59.654 227 HG SER 35 HG SER 35 -54.808 41.643 60.067 228 H ALA 36 H ALA 36 -51.296 39.969 61.852 229 HA ALA 36 HA ALA 36 -49.182 41.725 62.907 230 HB1 ALA 36 HB1 ALA 36 -49.949 40.193 64.661 231 HB2 ALA 36 HB2 ALA 36 -48.306 39.801 64.153 232 HB3 ALA 36 HB3 ALA 36 -49.661 38.820 63.595 233 H TYR 37 H TYR 37 -47.115 41.406 61.968 234 HA TYR 37 HA TYR 37 -47.264 40.180 59.357 235 HB2 TYR 37 HB2 TYR 37 -45.286 41.300 58.782 236 HB3 TYR 37 HB3 TYR 37 -46.132 42.417 59.832 237 HD1 TYR 37 HD2 TYR 37 -45.287 42.723 62.214 238 HD2 TYR 37 HD1 TYR 37 -43.109 40.541 59.278 239 HE1 TYR 37 HE2 TYR 37 -43.241 42.955 63.557 240 HE2 TYR 37 HE1 TYR 37 -41.066 40.773 60.612 241 HH TYR 37 HH TYR 37 -40.156 42.275 62.332 242 H ALA 38 H ALA 38 -46.244 38.405 58.635 243 HA ALA 38 HA ALA 38 -44.737 36.825 60.602 244 HB1 ALA 38 HB1 ALA 38 -46.973 35.790 58.865 245 HB2 ALA 38 HB2 ALA 38 -47.059 36.060 60.606 246 HB3 ALA 38 HB3 ALA 38 -45.976 34.827 59.956 247 H VAL 39 H VAL 39 -43.153 35.488 59.753 248 HA VAL 39 HA VAL 39 -42.177 36.249 57.148 249 HB VAL 39 HB VAL 39 -40.622 36.030 59.033 250 HG11 VAL 39 HG11 VAL 39 -41.646 34.242 60.288 251 HG12 VAL 39 HG12 VAL 39 -39.965 33.847 59.924 252 HG13 VAL 39 HG13 VAL 39 -41.268 33.089 59.007 253 HG21 VAL 39 HG21 VAL 39 -40.085 34.043 56.836 254 HG22 VAL 39 HG22 VAL 39 -38.878 34.664 57.962 255 HG23 VAL 39 HG23 VAL 39 -39.682 35.761 56.839 256 H ASN 40 H ASN 40 -42.157 35.035 55.304 257 HA ASN 40 HA ASN 40 -43.648 32.512 55.403 258 HB2 ASN 40 HB2 ASN 40 -43.966 32.995 52.859 259 HB3 ASN 40 HB3 ASN 40 -44.966 33.826 54.039 260 HD21 ASN 40 HD21 ASN 40 -42.513 34.163 51.616 261 HD22 ASN 40 HD22 ASN 40 -42.486 35.893 51.608 262 HA PRO 41 HA PRO 41 -39.710 30.792 54.187 263 HB2 PRO 41 HB2 PRO 41 -40.227 28.287 55.125 264 HB3 PRO 41 HB3 PRO 41 -39.673 29.616 56.144 265 HG2 PRO 41 HG2 PRO 41 -42.323 28.362 55.984 266 HG3 PRO 41 HG3 PRO 41 -41.608 29.316 57.289 267 HD2 PRO 41 HD2 PRO 41 -43.506 30.160 55.333 268 HD3 PRO 41 HD3 PRO 41 -42.744 31.133 56.603 269 H GLU 42 H GLU 42 -40.195 31.019 51.984 270 HA GLU 42 HA GLU 42 -41.563 28.752 50.713 271 HB2 GLU 42 HB2 GLU 42 -41.627 30.292 48.710 272 HB3 GLU 42 HB3 GLU 42 -42.669 30.705 50.067 273 HG2 GLU 42 HG2 GLU 42 -40.978 32.357 50.807 274 HG3 GLU 42 HG3 GLU 42 -40.026 31.976 49.374 275 H ALA 43 H ALA 43 -40.786 28.144 48.547 276 HA ALA 43 HA ALA 43 -37.947 28.468 48.057 277 HB1 ALA 43 HB1 ALA 43 -39.124 25.778 48.724 278 HB2 ALA 43 HB2 ALA 43 -38.025 26.703 49.744 279 HB3 ALA 43 HB3 ALA 43 -37.469 26.077 48.189 280 H GLY 44 H GLY 44 -38.010 28.975 45.960 281 HA2 GLY 44 HA2 GLY 44 -39.800 27.449 44.177 282 HA3 GLY 44 HA3 GLY 44 -39.103 29.023 43.811 283 H SER 45 H SER 45 -38.359 25.596 44.220 284 HA SER 45 HA SER 45 -36.178 25.772 42.317 285 HB2 SER 45 HB2 SER 45 -35.171 26.437 44.489 286 HB3 SER 45 HB3 SER 45 -35.705 24.910 45.182 287 HG SER 45 HG SER 45 -34.052 24.974 42.888 288 H MET 46 H MET 46 -35.395 23.671 41.684 289 HA MET 46 HA MET 46 -36.722 21.308 42.723 290 HB2 MET 46 HB2 MET 46 -37.400 20.524 40.470 291 HB3 MET 46 HB3 MET 46 -38.286 21.952 40.986 292 HG2 MET 46 HG2 MET 46 -36.819 23.345 39.602 293 HG3 MET 46 HG3 MET 46 -35.970 21.898 39.065 294 HE1 MET 46 HE1 MET 46 -39.330 23.927 38.956 295 HE2 MET 46 HE2 MET 46 -39.852 22.402 39.673 296 HE3 MET 46 HE3 MET 46 -40.382 22.840 38.049 297 H ASP 47 H ASP 47 -35.790 19.305 41.663 298 HA ASP 47 HA ASP 47 -33.004 19.771 40.831 299 HB2 ASP 47 HB2 ASP 47 -34.024 17.586 42.664 300 HB3 ASP 47 HB3 ASP 47 -32.388 17.657 42.015 301 H TYR 48 H TYR 48 -32.139 17.450 40.009 302 HA TYR 48 HA TYR 48 -34.119 16.443 38.077 303 HB2 TYR 48 HB2 TYR 48 -32.598 18.256 37.140 304 HB3 TYR 48 HB3 TYR 48 -31.263 17.137 37.365 305 HD1 TYR 48 HD2 TYR 48 -34.484 17.590 35.586 306 HD2 TYR 48 HD1 TYR 48 -30.779 15.507 35.744 307 HE1 TYR 48 HE2 TYR 48 -34.933 16.633 33.366 308 HE2 TYR 48 HE1 TYR 48 -31.216 14.549 33.528 309 HH TYR 48 HH TYR 48 -33.191 14.038 32.114 310 H MET 49 H MET 49 -34.306 14.335 38.417 311 HA MET 49 HA MET 49 -32.388 12.752 39.779 312 HB2 MET 49 HB2 MET 49 -34.889 12.057 38.246 313 HB3 MET 49 HB3 MET 49 -33.883 10.827 39.004 314 HG2 MET 49 HG2 MET 49 -34.198 11.960 41.172 315 HG3 MET 49 HG3 MET 49 -35.290 13.100 40.388 316 HE1 MET 49 HE1 MET 49 -37.711 12.492 39.520 317 HE2 MET 49 HE2 MET 49 -38.311 10.838 39.392 318 HE3 MET 49 HE3 MET 49 -36.959 11.365 38.389 319 HA PRO 50 HA PRO 50 -29.498 11.584 36.647 320 HB2 PRO 50 HB2 PRO 50 -29.469 8.888 37.869 321 HB3 PRO 50 HB3 PRO 50 -28.146 10.034 37.636 322 HG2 PRO 50 HG2 PRO 50 -29.180 9.592 40.054 323 HG3 PRO 50 HG3 PRO 50 -28.657 11.214 39.563 324 HD2 PRO 50 HD2 PRO 50 -31.416 10.074 39.727 325 HD3 PRO 50 HD3 PRO 50 -30.836 11.695 40.166 326 H LEU 51 H LEU 51 -29.745 10.962 34.623 327 HA LEU 51 HA LEU 51 -31.999 9.342 33.823 328 HB2 LEU 51 HB2 LEU 51 -29.795 10.629 32.213 329 HB3 LEU 51 HB3 LEU 51 -31.188 9.815 31.535 330 HG LEU 51 HG LEU 51 -31.303 12.315 33.223 331 HD11 LEU 51 HD11 LEU 51 -31.849 13.438 31.121 332 HD12 LEU 51 HD12 LEU 51 -31.609 11.925 30.245 333 HD13 LEU 51 HD13 LEU 51 -30.247 12.704 31.053 334 HD21 LEU 51 HD21 LEU 51 -33.633 12.402 32.475 335 HD22 LEU 51 HD22 LEU 51 -33.309 10.942 33.409 336 HD23 LEU 51 HD23 LEU 51 -33.425 10.856 31.652 337 H MET 52 H MET 52 -31.924 7.388 32.744 338 HA MET 52 HA MET 52 -29.411 5.891 33.046 339 HB2 MET 52 HB2 MET 52 -32.253 4.849 32.875 340 HB3 MET 52 HB3 MET 52 -30.814 3.853 33.044 341 HG2 MET 52 HG2 MET 52 -31.790 5.880 35.044 342 HG3 MET 52 HG3 MET 52 -32.002 4.134 35.160 343 HE1 MET 52 HE1 MET 52 -29.361 4.977 37.962 344 HE2 MET 52 HE2 MET 52 -30.938 4.261 37.625 345 HE3 MET 52 HE3 MET 52 -30.699 5.999 37.437 346 H GLU 53 H GLU 53 -28.406 6.270 31.140 347 HA GLU 53 HA GLU 53 -29.915 5.930 28.665 348 HB2 GLU 53 HB2 GLU 53 -27.985 7.020 27.559 349 HB3 GLU 53 HB3 GLU 53 -28.742 8.029 28.780 350 HG2 GLU 53 HG2 GLU 53 -26.963 7.538 30.340 351 HG3 GLU 53 HG3 GLU 53 -26.225 6.430 29.185 352 H TYR 54 H TYR 54 -28.656 4.925 26.841 353 HA TYR 54 HA TYR 54 -27.386 2.492 27.902 354 HB2 TYR 54 HB2 TYR 54 -28.911 2.686 25.293 355 HB3 TYR 54 HB3 TYR 54 -28.395 1.228 26.131 356 HD1 TYR 54 HD1 TYR 54 -29.579 0.522 28.218 357 HD2 TYR 54 HD2 TYR 54 -30.947 3.777 25.847 358 HE1 TYR 54 HE1 TYR 54 -31.764 0.417 29.339 359 HE2 TYR 54 HE2 TYR 54 -33.132 3.678 26.958 360 HH TYR 54 HH TYR 54 -34.500 2.173 28.179 361 H LEU 55 H LEU 55 -25.546 1.733 26.898 362 HA LEU 55 HA LEU 55 -23.919 3.753 25.748 363 HB2 LEU 55 HB2 LEU 55 -22.111 2.188 25.802 364 HB3 LEU 55 HB3 LEU 55 -23.014 2.059 27.292 365 HG LEU 55 HG LEU 55 -23.461 0.103 25.042 366 HD11 LEU 55 HD11 LEU 55 -21.381 -0.070 27.214 367 HD12 LEU 55 HD12 LEU 55 -21.070 0.133 25.490 368 HD13 LEU 55 HD13 LEU 55 -21.802 -1.358 26.083 369 HD21 LEU 55 HD21 LEU 55 -25.079 0.101 26.901 370 HD22 LEU 55 HD22 LEU 55 -23.757 -0.148 28.042 371 HD23 LEU 55 HD23 LEU 55 -24.138 -1.391 26.850 372 H HIS 56 H HIS 56 -23.179 4.069 23.749 373 HA HIS 56 HA HIS 56 -24.740 3.021 21.581 374 HB2 HIS 56 HB2 HIS 56 -22.492 5.018 21.775 375 HB3 HIS 56 HB3 HIS 56 -23.024 4.427 20.210 376 HD1 HIS 56 HD1 HIS 56 -24.277 6.309 19.211 377 HD2 HIS 56 HD2 HIS 56 -25.317 5.701 23.188 378 HE1 HIS 56 HE1 HIS 56 -26.136 7.933 19.676 379 HE2 HIS 56 HE2 HIS 56 -26.895 7.382 22.012 380 H SER 57 H SER 57 -24.376 1.223 20.558 381 HA SER 57 HA SER 57 -21.757 -0.040 20.662 382 HB2 SER 57 HB2 SER 57 -23.865 -1.355 21.077 383 HB3 SER 57 HB3 SER 57 -24.315 -1.076 19.396 384 HG SER 57 HG SER 57 -21.792 -2.052 19.610 385 H SER 58 H SER 58 -20.521 1.206 19.359 386 HA SER 58 HA SER 58 -21.343 1.979 16.714 387 HB2 SER 58 HB2 SER 58 -18.943 2.837 16.622 388 HB3 SER 58 HB3 SER 58 -19.972 3.547 17.865 389 HG SER 58 HG SER 58 -17.958 2.978 18.735 390 HA PRO 59 HA PRO 59 -19.721 -1.747 14.827 391 HB2 PRO 59 HB2 PRO 59 -20.025 -1.021 12.236 392 HB3 PRO 59 HB3 PRO 59 -21.363 -1.578 13.248 393 HG2 PRO 59 HG2 PRO 59 -20.614 1.195 12.453 394 HG3 PRO 59 HG3 PRO 59 -22.223 0.477 12.646 395 HD2 PRO 59 HD2 PRO 59 -21.026 2.105 14.506 396 HD3 PRO 59 HD3 PRO 59 -22.273 0.904 14.885 397 H VAL 60 H VAL 60 -17.856 -2.392 13.798 398 HA VAL 60 HA VAL 60 -15.797 -0.345 13.916 399 HB VAL 60 HB VAL 60 -15.504 -2.380 15.256 400 HG11 VAL 60 HG11 VAL 60 -15.254 -3.861 12.648 401 HG12 VAL 60 HG12 VAL 60 -16.589 -3.998 13.790 402 HG13 VAL 60 HG13 VAL 60 -14.969 -4.526 14.259 403 HG21 VAL 60 HG21 VAL 60 -13.186 -2.856 14.608 404 HG22 VAL 60 HG22 VAL 60 -13.564 -1.133 14.613 405 HG23 VAL 60 HG23 VAL 60 -13.462 -2.010 13.085 406 H LEU 61 H LEU 61 -14.887 0.494 12.218 407 HA LEU 61 HA LEU 61 -15.239 -0.772 9.612 408 HB2 LEU 61 HB2 LEU 61 -14.355 1.460 8.703 409 HB3 LEU 61 HB3 LEU 61 -15.989 1.402 9.290 410 HG LEU 61 HG LEU 61 -14.776 3.529 9.744 411 HD11 LEU 61 HD11 LEU 61 -15.675 2.084 12.216 412 HD12 LEU 61 HD12 LEU 61 -16.692 2.989 11.095 413 HD13 LEU 61 HD13 LEU 61 -15.473 3.829 12.054 414 HD21 LEU 61 HD21 LEU 61 -13.156 3.671 11.550 415 HD22 LEU 61 HD22 LEU 61 -12.558 2.707 10.198 416 HD23 LEU 61 HD23 LEU 61 -13.134 1.910 11.664 417 HA PRO 62 HA PRO 62 -10.971 -1.911 9.560 418 HB2 PRO 62 HB2 PRO 62 -10.268 -1.798 6.966 419 HB3 PRO 62 HB3 PRO 62 -11.400 -3.010 7.583 420 HG2 PRO 62 HG2 PRO 62 -11.971 -0.448 6.149 421 HG3 PRO 62 HG3 PRO 62 -12.704 -2.048 5.923 422 HD2 PRO 62 HD2 PRO 62 -13.884 -0.067 7.372 423 HD3 PRO 62 HD3 PRO 62 -14.125 -1.793 7.700 424 H THR 63 H THR 63 -8.891 -1.160 9.507 425 HA THR 63 HA THR 63 -8.514 1.550 8.467 426 HB THR 63 HB THR 63 -8.273 1.255 10.989 427 HG1 THR 63 HG1 THR 63 -7.238 2.945 9.600 428 HG21 THR 63 HG21 THR 63 -7.075 -0.839 11.096 429 HG22 THR 63 HG22 THR 63 -6.145 0.456 11.855 430 HG23 THR 63 HG23 THR 63 -5.703 -0.121 10.245 431 H ALA 64 H ALA 64 -7.286 1.675 6.715 432 HA ALA 64 HA ALA 64 -5.688 -0.631 5.947 433 HB1 ALA 64 HB1 ALA 64 -6.131 1.972 4.506 434 HB2 ALA 64 HB2 ALA 64 -7.042 0.485 4.242 435 HB3 ALA 64 HB3 ALA 64 -5.321 0.547 3.850 436 H ARG 65 H ARG 65 -3.737 -0.823 6.668 437 HA ARG 65 HA ARG 65 -2.006 1.517 6.784 438 HB2 ARG 65 HB2 ARG 65 -2.323 -0.425 9.103 439 HB3 ARG 65 HB3 ARG 65 -1.077 0.808 8.984 440 HG2 ARG 65 HG2 ARG 65 -2.815 2.544 9.003 441 HG3 ARG 65 HG3 ARG 65 -4.043 1.292 9.174 442 HD2 ARG 65 HD2 ARG 65 -2.848 0.583 11.276 443 HD3 ARG 65 HD3 ARG 65 -1.892 2.060 11.126 444 HE ARG 65 HE ARG 65 -4.628 2.695 10.955 445 HH11 ARG 65 HH11 ARG 65 -2.231 1.741 13.335 446 HH12 ARG 65 HH12 ARG 65 -3.145 2.351 14.679 447 HH21 ARG 65 HH21 ARG 65 -5.815 3.489 12.698 448 HH22 ARG 65 HH22 ARG 65 -5.194 3.349 14.310 449 H PHE 66 H PHE 66 0.226 0.933 6.698 450 HA PHE 66 HA PHE 66 0.955 -1.840 6.667 451 HB2 PHE 66 HB2 PHE 66 2.157 -1.730 4.482 452 HB3 PHE 66 HB3 PHE 66 0.410 -1.692 4.329 453 HD1 PHE 66 HD1 PHE 66 3.512 0.221 3.935 454 HD2 PHE 66 HD2 PHE 66 -0.711 0.239 3.430 455 HE1 PHE 66 HE1 PHE 66 3.695 2.180 2.465 456 HE2 PHE 66 HE2 PHE 66 -0.534 2.201 1.968 457 HZ PHE 66 HZ PHE 66 1.670 3.168 1.481 458 H THR 67 H THR 67 3.265 -2.135 6.761 459 HA THR 67 HA THR 67 4.619 0.256 7.768 460 HB THR 67 HB THR 67 4.396 -1.609 9.393 461 HG1 THR 67 HG1 THR 67 7.139 -1.526 8.822 462 HG21 THR 67 HG21 THR 67 5.728 -3.652 9.144 463 HG22 THR 67 HG22 THR 67 6.192 -3.151 7.516 464 HG23 THR 67 HG23 THR 67 4.506 -3.525 7.878 465 H SER 68 H SER 68 6.657 0.793 7.002 466 HA SER 68 HA SER 68 7.461 -0.575 4.528 467 HB2 SER 68 HB2 SER 68 8.179 1.711 3.731 468 HB3 SER 68 HB3 SER 68 6.435 1.518 3.910 469 HG SER 68 HG SER 68 6.433 2.838 5.610 470 H ASP 69 H ASP 69 9.693 -0.731 4.157 471 HA ASP 69 HA ASP 69 11.424 -0.364 6.424 472 HB2 ASP 69 HB2 ASP 69 11.749 -2.219 4.803 473 HB3 ASP 69 HB3 ASP 69 12.141 -1.036 3.554 474 H ILE 70 H ILE 70 10.936 1.144 3.278 475 HA ILE 70 HA ILE 70 12.045 3.624 4.329 476 HB ILE 70 HB ILE 70 12.887 4.079 1.904 477 HG12 ILE 70 HG12 ILE 70 13.999 1.816 1.081 478 HG13 ILE 70 HG13 ILE 70 12.619 1.092 1.894 479 HG21 ILE 70 HG21 ILE 70 14.403 2.304 3.800 480 HG22 ILE 70 HG22 ILE 70 14.339 4.067 3.814 481 HG23 ILE 70 HG23 ILE 70 15.117 3.222 2.476 482 HD11 ILE 70 HD11 ILE 70 12.191 1.355 -0.471 483 HD12 ILE 70 HD12 ILE 70 12.501 3.088 -0.362 484 HD13 ILE 70 HD13 ILE 70 11.108 2.386 0.464 485 H THR 71 H THR 71 11.192 5.513 3.439 486 HA THR 71 HA THR 71 8.711 5.181 1.879 487 HB THR 71 HB THR 71 8.215 7.550 2.696 488 HG1 THR 71 HG1 THR 71 9.814 8.465 3.734 489 HG21 THR 71 HG21 THR 71 7.103 5.591 3.676 490 HG22 THR 71 HG22 THR 71 7.425 6.825 4.893 491 HG23 THR 71 HG23 THR 71 8.448 5.392 4.802 492 H GLU 72 H GLU 72 11.897 6.279 1.868 493 HA GLU 72 HA GLU 72 11.740 7.347 -0.797 494 HB2 GLU 72 HB2 GLU 72 11.213 9.275 0.808 495 HB3 GLU 72 HB3 GLU 72 12.857 9.109 1.400 496 HG2 GLU 72 HG2 GLU 72 13.670 9.531 -0.912 497 HG3 GLU 72 HG3 GLU 72 12.002 9.844 -1.390 498 H GLY 73 H GLY 73 13.979 7.688 -1.622 499 HA2 GLY 73 HA2 GLY 73 16.393 7.456 -0.544 500 HA3 GLY 73 HA3 GLY 73 15.831 5.787 -0.409 501 H PHE 74 H PHE 74 17.883 5.700 -1.864 502 HA PHE 74 HA PHE 74 17.409 6.397 -4.618 503 HB2 PHE 74 HB2 PHE 74 19.522 4.907 -4.951 504 HB3 PHE 74 HB3 PHE 74 19.683 6.484 -4.201 505 HD1 PHE 74 HD2 PHE 74 19.525 2.837 -3.467 506 HD2 PHE 74 HD1 PHE 74 20.597 6.710 -2.072 507 HE1 PHE 74 HE2 PHE 74 20.678 1.824 -1.548 508 HE2 PHE 74 HE1 PHE 74 21.756 5.704 -0.158 509 HZ PHE 74 HZ PHE 74 21.795 3.259 0.109 510 H ALA 75 H ALA 75 16.805 5.136 -6.240 511 HA ALA 75 HA ALA 75 14.820 3.345 -5.991 512 HB1 ALA 75 HB1 ALA 75 15.108 2.812 -8.324 513 HB2 ALA 75 HB2 ALA 75 16.773 3.394 -8.277 514 HB3 ALA 75 HB3 ALA 75 15.435 4.521 -8.043 515 HA PRO 76 HA PRO 76 17.033 -0.428 -4.857 516 HB2 PRO 76 HB2 PRO 76 15.165 -1.268 -3.084 517 HB3 PRO 76 HB3 PRO 76 16.333 -0.001 -2.709 518 HG2 PRO 76 HG2 PRO 76 13.450 0.215 -3.089 519 HG3 PRO 76 HG3 PRO 76 14.582 1.409 -2.439 520 HD2 PRO 76 HD2 PRO 76 13.482 1.178 -5.141 521 HD3 PRO 76 HD3 PRO 76 14.329 2.542 -4.383 522 H LEU 77 H LEU 77 15.934 -2.765 -4.330 523 HA LEU 77 HA LEU 77 14.577 -3.611 -6.733 524 HB2 LEU 77 HB2 LEU 77 15.623 -5.038 -4.296 525 HB3 LEU 77 HB3 LEU 77 14.665 -5.870 -5.500 526 HG LEU 77 HG LEU 77 17.327 -4.537 -6.022 527 HD11 LEU 77 HD11 LEU 77 17.531 -6.514 -4.616 528 HD12 LEU 77 HD12 LEU 77 18.134 -6.843 -6.243 529 HD13 LEU 77 HD13 LEU 77 16.545 -7.435 -5.752 530 HD21 LEU 77 HD21 LEU 77 15.900 -4.528 -7.992 531 HD22 LEU 77 HD22 LEU 77 15.544 -6.241 -7.766 532 HD23 LEU 77 HD23 LEU 77 17.183 -5.726 -8.175 533 H SER 78 H SER 78 13.155 -5.762 -5.427 534 HA SER 78 HA SER 78 10.641 -4.562 -4.887 535 HB2 SER 78 HB2 SER 78 10.949 -6.770 -5.974 536 HB3 SER 78 HB3 SER 78 11.584 -7.407 -4.460 537 HG SER 78 HG SER 78 8.961 -6.756 -5.173 538 H VAL 79 H VAL 79 10.851 -3.222 -3.110 539 HA VAL 79 HA VAL 79 11.763 -4.045 -0.545 540 HB VAL 79 HB VAL 79 9.760 -1.833 -1.107 541 HG11 VAL 79 HG11 VAL 79 10.668 -0.787 0.918 542 HG12 VAL 79 HG12 VAL 79 11.719 -2.183 1.163 543 HG13 VAL 79 HG13 VAL 79 9.968 -2.371 1.256 544 HG21 VAL 79 HG21 VAL 79 11.691 -1.487 -2.531 545 HG22 VAL 79 HG22 VAL 79 12.773 -1.674 -1.151 546 HG23 VAL 79 HG23 VAL 79 11.673 -0.298 -1.230 547 H ARG 80 H ARG 80 10.734 -5.075 1.081 548 HA ARG 80 HA ARG 80 8.174 -6.257 0.406 549 HB2 ARG 80 HB2 ARG 80 10.234 -7.503 1.365 550 HB3 ARG 80 HB3 ARG 80 9.721 -6.842 2.911 551 HG2 ARG 80 HG2 ARG 80 8.892 -9.118 2.580 552 HG3 ARG 80 HG3 ARG 80 7.565 -7.960 2.703 553 HD2 ARG 80 HD2 ARG 80 7.212 -9.629 0.921 554 HD3 ARG 80 HD3 ARG 80 7.278 -7.983 0.297 555 HE ARG 80 HE ARG 80 9.553 -9.869 0.139 556 HH11 ARG 80 HH11 ARG 80 7.496 -7.404 -1.322 557 HH12 ARG 80 HH12 ARG 80 8.449 -7.313 -2.774 558 HH21 ARG 80 HH21 ARG 80 10.775 -9.737 -1.760 559 HH22 ARG 80 HH22 ARG 80 10.294 -8.649 -3.025 560 H PHE 81 H PHE 81 6.654 -4.798 0.667 561 HA PHE 81 HA PHE 81 6.360 -3.349 3.160 562 HB2 PHE 81 HB2 PHE 81 4.692 -3.473 0.640 563 HB3 PHE 81 HB3 PHE 81 4.176 -2.600 2.075 564 HD1 PHE 81 HD1 PHE 81 6.809 -2.740 -0.533 565 HD2 PHE 81 HD2 PHE 81 4.938 -0.431 2.507 566 HE1 PHE 81 HE1 PHE 81 8.006 -0.744 -1.321 567 HE2 PHE 81 HE2 PHE 81 6.139 1.569 1.727 568 HZ PHE 81 HZ PHE 81 7.674 1.413 -0.190 569 H LYS 82 H LYS 82 5.392 -4.158 4.833 570 HA LYS 82 HA LYS 82 3.677 -6.511 4.527 571 HB2 LYS 82 HB2 LYS 82 5.442 -6.948 6.073 572 HB3 LYS 82 HB3 LYS 82 5.249 -5.390 6.852 573 HG2 LYS 82 HG2 LYS 82 4.492 -7.213 8.273 574 HG3 LYS 82 HG3 LYS 82 3.168 -6.125 7.866 575 HD2 LYS 82 HD2 LYS 82 2.494 -7.749 6.080 576 HD3 LYS 82 HD3 LYS 82 3.717 -8.859 6.710 577 HE2 LYS 82 HE2 LYS 82 2.567 -9.223 8.667 578 HE3 LYS 82 HE3 LYS 82 1.721 -7.679 8.579 579 HZ1 LYS 82 HZ1 LYS 82 0.190 -9.433 8.143 580 HZ2 LYS 82 HZ2 LYS 82 1.189 -10.096 6.948 581 HZ3 LYS 82 HZ3 LYS 82 0.444 -8.592 6.689 582 H ASP 83 H ASP 83 1.553 -6.382 4.904 583 HA ASP 83 HA ASP 83 0.365 -3.807 5.264 584 HB2 ASP 83 HB2 ASP 83 -1.771 -4.933 4.959 585 HB3 ASP 83 HB3 ASP 83 -0.636 -5.418 3.709 586 H PHE 84 H PHE 84 -0.551 -2.955 7.014 587 HA PHE 84 HA PHE 84 -0.299 -4.476 9.531 588 HB2 PHE 84 HB2 PHE 84 0.930 -2.049 8.715 589 HB3 PHE 84 HB3 PHE 84 -0.250 -1.644 9.958 590 HD1 PHE 84 HD1 PHE 84 2.439 -4.119 9.274 591 HD2 PHE 84 HD2 PHE 84 0.399 -1.737 12.142 592 HE1 PHE 84 HE1 PHE 84 4.040 -4.832 10.999 593 HE2 PHE 84 HE2 PHE 84 1.993 -2.445 13.875 594 HZ PHE 84 HZ PHE 84 3.818 -3.992 13.299 595 H SER 85 H SER 85 -2.488 -3.898 7.531 596 HA SER 85 HA SER 85 -4.443 -2.232 8.546 597 HB2 SER 85 HB2 SER 85 -4.753 -4.762 6.931 598 HB3 SER 85 HB3 SER 85 -5.989 -3.517 7.136 599 HG SER 85 HG SER 85 -4.239 -3.559 5.278 600 H GLU 86 H GLU 86 -5.921 -2.325 10.033 601 HA GLU 86 HA GLU 86 -6.240 -4.802 11.581 602 HB2 GLU 86 HB2 GLU 86 -5.081 -2.928 12.798 603 HB3 GLU 86 HB3 GLU 86 -6.503 -1.942 12.536 604 HG2 GLU 86 HG2 GLU 86 -6.449 -2.769 14.795 605 HG3 GLU 86 HG3 GLU 86 -7.811 -3.459 13.917 606 H ASN 87 H ASN 87 -8.365 -5.256 12.224 607 HA ASN 87 HA ASN 87 -10.623 -5.382 12.237 608 HB2 ASN 87 HB2 ASN 87 -10.407 -2.417 11.704 609 HB3 ASN 87 HB3 ASN 87 -11.891 -3.251 12.164 610 HD21 ASN 87 HD21 ASN 87 -10.005 -1.210 13.435 611 HD22 ASN 87 HD22 ASN 87 -9.800 -1.811 15.050 612 H ALA 88 H ALA 88 -9.284 -5.998 9.807 613 HA ALA 88 HA ALA 88 -11.210 -5.087 7.767 614 HB1 ALA 88 HB1 ALA 88 -8.353 -5.977 7.393 615 HB2 ALA 88 HB2 ALA 88 -8.932 -4.312 7.324 616 HB3 ALA 88 HB3 ALA 88 -9.455 -5.482 6.109 617 H THR 89 H THR 89 -12.227 -6.600 6.535 618 HA THR 89 HA THR 89 -12.134 -9.333 7.465 619 HB THR 89 HB THR 89 -13.786 -8.166 5.206 620 HG1 THR 89 HG1 THR 89 -13.960 -7.974 7.943 621 HG21 THR 89 HG21 THR 89 -13.667 -10.622 5.166 622 HG22 THR 89 HG22 THR 89 -15.277 -10.071 5.639 623 HG23 THR 89 HG23 THR 89 -14.154 -10.678 6.857 624 H SER 90 H SER 90 -11.663 -7.687 4.326 625 HA SER 90 HA SER 90 -9.638 -9.701 3.691 626 HB2 SER 90 HB2 SER 90 -10.483 -9.653 1.293 627 HB3 SER 90 HB3 SER 90 -11.511 -10.494 2.450 628 HG SER 90 HG SER 90 -12.041 -8.304 0.927 629 H ARG 91 H ARG 91 -8.078 -9.014 2.144 630 HA ARG 91 HA ARG 91 -7.830 -6.087 1.949 631 HB2 ARG 91 HB2 ARG 91 -5.375 -6.471 1.782 632 HB3 ARG 91 HB3 ARG 91 -6.049 -7.019 3.309 633 HG2 ARG 91 HG2 ARG 91 -6.047 -9.322 2.476 634 HG3 ARG 91 HG3 ARG 91 -5.338 -8.771 0.962 635 HD2 ARG 91 HD2 ARG 91 -3.356 -8.009 2.158 636 HD3 ARG 91 HD3 ARG 91 -4.078 -8.517 3.689 637 HE ARG 91 HE ARG 91 -3.856 -10.574 1.654 638 HH11 ARG 91 HH11 ARG 91 -2.281 -9.083 4.415 639 HH12 ARG 91 HH12 ARG 91 -1.434 -10.533 4.851 640 HH21 ARG 91 HH21 ARG 91 -2.721 -12.456 2.227 641 HH22 ARG 91 HH22 ARG 91 -1.678 -12.435 3.611 642 H LEU 92 H LEU 92 -7.194 -5.191 -0.018 643 HA LEU 92 HA LEU 92 -7.235 -7.012 -2.327 644 HB2 LEU 92 HB2 LEU 92 -9.345 -5.567 -1.855 645 HB3 LEU 92 HB3 LEU 92 -8.366 -4.215 -2.377 646 HG LEU 92 HG LEU 92 -8.712 -6.583 -4.200 647 HD11 LEU 92 HD11 LEU 92 -10.646 -4.292 -3.883 648 HD12 LEU 92 HD12 LEU 92 -10.958 -5.971 -3.441 649 HD13 LEU 92 HD13 LEU 92 -10.704 -5.536 -5.132 650 HD21 LEU 92 HD21 LEU 92 -8.493 -4.885 -5.935 651 HD22 LEU 92 HD22 LEU 92 -7.114 -4.824 -4.835 652 HD23 LEU 92 HD23 LEU 92 -8.399 -3.620 -4.710 653 H TRP 93 H TRP 93 -5.525 -6.742 -3.685 654 HA TRP 93 HA TRP 93 -3.800 -4.435 -3.181 655 HB2 TRP 93 HB2 TRP 93 -3.267 -7.132 -4.416 656 HB3 TRP 93 HB3 TRP 93 -2.147 -5.787 -4.609 657 HD1 TRP 93 HD1 TRP 93 -3.099 -8.507 -2.208 658 HE1 TRP 93 HE1 TRP 93 -1.639 -8.341 -0.090 659 HE3 TRP 93 HE3 TRP 93 -1.022 -3.898 -3.011 660 HZ2 TRP 93 HZ2 TRP 93 0.135 -6.483 1.101 661 HZ3 TRP 93 HZ3 TRP 93 0.541 -2.999 -1.336 662 HH2 TRP 93 HH2 TRP 93 1.106 -4.264 0.678 663 H MET 94 H MET 94 -4.193 -2.773 -4.446 664 HA MET 94 HA MET 94 -4.613 -3.361 -7.281 665 HB2 MET 94 HB2 MET 94 -5.827 -1.212 -7.506 666 HB3 MET 94 HB3 MET 94 -6.644 -2.373 -6.477 667 HG2 MET 94 HG2 MET 94 -5.910 -1.177 -4.510 668 HG3 MET 94 HG3 MET 94 -5.016 -0.043 -5.517 669 HE1 MET 94 HE1 MET 94 -7.890 1.847 -7.395 670 HE2 MET 94 HE2 MET 94 -6.948 0.461 -7.948 671 HE3 MET 94 HE3 MET 94 -6.154 1.779 -7.087 672 H PHE 95 H PHE 95 -2.842 -3.138 -8.293 673 HA PHE 95 HA PHE 95 -0.831 -1.214 -7.493 674 HB2 PHE 95 HB2 PHE 95 -0.896 -3.342 -9.644 675 HB3 PHE 95 HB3 PHE 95 0.465 -2.252 -9.411 676 HD1 PHE 95 HD1 PHE 95 -1.485 -4.980 -7.847 677 HD2 PHE 95 HD2 PHE 95 2.045 -2.611 -7.691 678 HE1 PHE 95 HE1 PHE 95 -0.539 -6.509 -6.172 679 HE2 PHE 95 HE2 PHE 95 2.995 -4.137 -6.017 680 HZ PHE 95 HZ PHE 95 1.703 -6.091 -5.255 681 H GLY 96 H GLY 96 -3.247 -1.599 -9.961 682 HA2 GLY 96 HA2 GLY 96 -4.063 0.077 -11.385 683 HA3 GLY 96 HA3 GLY 96 -2.633 1.041 -11.037 684 H ASP 97 H ASP 97 -2.060 -2.211 -11.734 685 HA ASP 97 HA ASP 97 -1.366 -1.618 -14.522 686 HB2 ASP 97 HB2 ASP 97 0.255 -3.078 -12.432 687 HB3 ASP 97 HB3 ASP 97 0.529 -3.340 -14.151 688 H GLY 98 H GLY 98 -2.955 -2.606 -15.562 689 HA2 GLY 98 HA2 GLY 98 -3.969 -4.424 -16.578 690 HA3 GLY 98 HA3 GLY 98 -3.070 -5.488 -15.504 691 H ASN 99 H ASN 99 -4.907 -6.742 -15.128 692 HA ASN 99 HA ASN 99 -7.213 -5.554 -13.832 693 HB2 ASN 99 HB2 ASN 99 -6.495 -8.417 -14.494 694 HB3 ASN 99 HB3 ASN 99 -7.977 -7.955 -13.663 695 HD21 ASN 99 HD21 ASN 99 -9.586 -6.845 -14.821 696 HD22 ASN 99 HD22 ASN 99 -9.594 -6.800 -16.551 697 H THR 100 H THR 100 -7.473 -5.327 -11.734 698 HA THR 100 HA THR 100 -5.373 -6.236 -9.933 699 HB THR 100 HB THR 100 -6.746 -4.783 -8.283 700 HG1 THR 100 HG1 THR 100 -8.596 -4.268 -9.278 701 HG21 THR 100 HG21 THR 100 -5.598 -2.810 -8.993 702 HG22 THR 100 HG22 THR 100 -5.470 -3.422 -10.649 703 HG23 THR 100 HG23 THR 100 -4.565 -4.200 -9.348 704 H SER 101 H SER 101 -6.281 -6.700 -7.595 705 HA SER 101 HA SER 101 -6.924 -8.423 -6.279 706 HB2 SER 101 HB2 SER 101 -9.146 -7.223 -6.739 707 HB3 SER 101 HB3 SER 101 -9.492 -8.525 -7.877 708 HG SER 101 HG SER 101 -9.220 -10.008 -6.116 709 H ASP 102 H ASP 102 -5.323 -9.077 -8.423 710 HA ASP 102 HA ASP 102 -6.326 -11.569 -9.576 711 HB2 ASP 102 HB2 ASP 102 -4.406 -11.423 -11.076 712 HB3 ASP 102 HB3 ASP 102 -5.280 -9.898 -11.072 713 H SER 103 H SER 103 -4.176 -13.139 -9.885 714 HA SER 103 HA SER 103 -3.713 -14.420 -7.477 715 HB2 SER 103 HB2 SER 103 -1.913 -14.403 -9.911 716 HB3 SER 103 HB3 SER 103 -1.909 -15.622 -8.641 717 HG SER 103 HG SER 103 -4.378 -15.518 -9.419 718 HA PRO 104 HA PRO 104 -1.350 -11.497 -5.227 719 HB2 PRO 104 HB2 PRO 104 -0.158 -13.227 -3.420 720 HB3 PRO 104 HB3 PRO 104 -1.779 -12.551 -3.276 721 HG2 PRO 104 HG2 PRO 104 -0.928 -15.220 -4.290 722 HG3 PRO 104 HG3 PRO 104 -2.328 -14.798 -3.290 723 HD2 PRO 104 HD2 PRO 104 -2.595 -15.302 -5.904 724 HD3 PRO 104 HD3 PRO 104 -3.563 -14.047 -5.102 725 H SER 105 H SER 105 0.154 -10.678 -6.465 726 HA SER 105 HA SER 105 2.703 -12.093 -6.752 727 HB2 SER 105 HB2 SER 105 1.644 -9.719 -8.320 728 HB3 SER 105 HB3 SER 105 3.142 -10.588 -8.632 729 HG SER 105 HG SER 105 0.584 -11.807 -8.691 730 HA PRO 106 HA PRO 106 4.515 -8.920 -4.089 731 HB2 PRO 106 HB2 PRO 106 7.013 -9.408 -5.563 732 HB3 PRO 106 HB3 PRO 106 6.677 -9.624 -3.844 733 HG2 PRO 106 HG2 PRO 106 7.041 -11.710 -5.514 734 HG3 PRO 106 HG3 PRO 106 5.939 -11.787 -4.127 735 HD2 PRO 106 HD2 PRO 106 5.322 -11.414 -7.027 736 HD3 PRO 106 HD3 PRO 106 4.448 -12.355 -5.797 737 H LEU 107 H LEU 107 5.206 -6.773 -4.363 738 HA LEU 107 HA LEU 107 4.609 -5.514 -6.819 739 HB2 LEU 107 HB2 LEU 107 5.638 -3.485 -5.755 740 HB3 LEU 107 HB3 LEU 107 4.335 -4.227 -4.855 741 HG LEU 107 HG LEU 107 6.477 -5.414 -3.688 742 HD11 LEU 107 HD11 LEU 107 8.164 -3.701 -3.261 743 HD12 LEU 107 HD12 LEU 107 7.354 -2.617 -4.393 744 HD13 LEU 107 HD13 LEU 107 8.087 -4.112 -4.975 745 HD21 LEU 107 HD21 LEU 107 5.234 -2.768 -2.960 746 HD22 LEU 107 HD22 LEU 107 6.113 -3.835 -1.864 747 HD23 LEU 107 HD23 LEU 107 4.586 -4.363 -2.573 748 H HIS 108 H HIS 108 5.923 -4.662 -8.400 749 HA HIS 108 HA HIS 108 8.368 -6.087 -8.782 750 HB2 HIS 108 HB2 HIS 108 8.551 -4.844 -10.931 751 HB3 HIS 108 HB3 HIS 108 7.036 -5.708 -10.737 752 HD1 HIS 108 HD1 HIS 108 4.880 -4.311 -10.681 753 HD2 HIS 108 HD2 HIS 108 8.352 -2.038 -11.020 754 HE1 HIS 108 HE1 HIS 108 4.116 -1.999 -11.320 755 HE2 HIS 108 HE2 HIS 108 6.239 -0.732 -11.781 756 H THR 109 H THR 109 10.381 -5.124 -9.321 757 HA THR 109 HA THR 109 11.496 -3.519 -7.364 758 HB THR 109 HB THR 109 12.377 -4.274 -10.156 759 HG1 THR 109 HG1 THR 109 12.149 -5.802 -8.259 760 HG21 THR 109 HG21 THR 109 14.075 -2.920 -8.059 761 HG22 THR 109 HG22 THR 109 13.615 -2.250 -9.625 762 HG23 THR 109 HG23 THR 109 14.677 -3.657 -9.545 763 H PHE 110 H PHE 110 11.873 -1.376 -7.131 764 HA PHE 110 HA PHE 110 10.698 0.485 -9.014 765 HB2 PHE 110 HB2 PHE 110 12.403 1.126 -6.590 766 HB3 PHE 110 HB3 PHE 110 11.309 2.211 -7.439 767 HD1 PHE 110 HD1 PHE 110 8.809 1.657 -7.362 768 HD2 PHE 110 HD2 PHE 110 11.668 -0.112 -4.759 769 HE1 PHE 110 HE1 PHE 110 7.007 1.048 -5.802 770 HE2 PHE 110 HE2 PHE 110 9.870 -0.724 -3.197 771 HZ PHE 110 HZ PHE 110 7.537 -0.144 -3.717 772 H PHE 111 H PHE 111 12.008 -0.187 -10.821 773 HA PHE 111 HA PHE 111 14.877 -0.106 -10.569 774 HB2 PHE 111 HB2 PHE 111 14.812 -0.865 -13.010 775 HB3 PHE 111 HB3 PHE 111 14.176 -1.968 -11.803 776 HD1 PHE 111 HD2 PHE 111 13.225 0.406 -14.482 777 HD2 PHE 111 HD1 PHE 111 11.942 -2.719 -11.899 778 HE1 PHE 111 HE2 PHE 111 11.135 0.214 -15.754 779 HE2 PHE 111 HE1 PHE 111 9.854 -2.921 -13.175 780 HZ PHE 111 HZ PHE 111 9.443 -1.446 -15.100 781 H ASN 112 H ASN 112 12.479 2.043 -11.546 782 HA ASN 112 HA ASN 112 14.496 3.724 -12.856 783 HB2 ASN 112 HB2 ASN 112 11.476 3.839 -12.972 784 HB3 ASN 112 HB3 ASN 112 12.522 5.104 -13.609 785 HD21 ASN 112 HD21 ASN 112 14.536 3.232 -14.588 786 HD22 ASN 112 HD22 ASN 112 13.846 2.478 -15.986 787 H GLU 113 H GLU 113 14.894 5.750 -12.056 788 HA GLU 113 HA GLU 113 13.962 6.328 -9.409 789 HB2 GLU 113 HB2 GLU 113 15.799 7.800 -11.279 790 HB3 GLU 113 HB3 GLU 113 15.236 8.521 -9.776 791 HG2 GLU 113 HG2 GLU 113 17.112 7.608 -8.965 792 HG3 GLU 113 HG3 GLU 113 16.091 6.176 -8.839 793 H GLY 114 H GLY 114 11.975 6.713 -9.332 794 HA2 GLY 114 HA2 GLY 114 10.901 9.122 -10.563 795 HA3 GLY 114 HA3 GLY 114 10.106 7.614 -11.009 796 H GLU 115 H GLU 115 8.234 8.653 -10.002 797 HA GLU 115 HA GLU 115 8.338 8.295 -7.091 798 HB2 GLU 115 HB2 GLU 115 8.006 10.658 -8.000 799 HB3 GLU 115 HB3 GLU 115 6.412 10.120 -8.519 800 HG2 GLU 115 HG2 GLU 115 5.751 9.670 -6.278 801 HG3 GLU 115 HG3 GLU 115 7.396 9.918 -5.686 802 H TYR 116 H TYR 116 7.542 6.383 -6.738 803 HA TYR 116 HA TYR 116 5.306 5.340 -8.311 804 HB2 TYR 116 HB2 TYR 116 7.230 4.044 -6.362 805 HB3 TYR 116 HB3 TYR 116 5.856 3.203 -7.062 806 HD1 TYR 116 HD2 TYR 116 9.071 4.889 -7.936 807 HD2 TYR 116 HD1 TYR 116 6.030 2.175 -9.163 808 HE1 TYR 116 HE2 TYR 116 10.480 4.176 -9.822 809 HE2 TYR 116 HE1 TYR 116 7.433 1.447 -11.046 810 HH TYR 116 HH TYR 116 9.286 2.210 -12.383 811 H ILE 117 H ILE 117 3.583 4.182 -7.037 812 HA ILE 117 HA ILE 117 3.155 5.448 -4.416 813 HB ILE 117 HB ILE 117 0.999 5.136 -6.541 814 HG12 ILE 117 HG12 ILE 117 0.913 7.748 -5.953 815 HG13 ILE 117 HG13 ILE 117 2.621 7.471 -5.645 816 HG21 ILE 117 HG21 ILE 117 0.083 4.761 -4.343 817 HG22 ILE 117 HG22 ILE 117 -0.444 6.331 -4.949 818 HG23 ILE 117 HG23 ILE 117 0.838 6.238 -3.742 819 HD11 ILE 117 HD11 ILE 117 2.256 8.290 -7.891 820 HD12 ILE 117 HD12 ILE 117 1.180 6.934 -8.236 821 HD13 ILE 117 HD13 ILE 117 2.894 6.647 -7.927 822 H VAL 118 H VAL 118 2.919 3.976 -2.881 823 HA VAL 118 HA VAL 118 1.827 1.332 -3.542 824 HB VAL 118 HB VAL 118 3.230 2.299 -1.028 825 HG11 VAL 118 HG11 VAL 118 1.566 0.627 -0.429 826 HG12 VAL 118 HG12 VAL 118 3.189 -0.052 -0.293 827 HG13 VAL 118 HG13 VAL 118 2.176 -0.456 -1.681 828 HG21 VAL 118 HG21 VAL 118 4.090 0.365 -3.178 829 HG22 VAL 118 HG22 VAL 118 4.993 0.731 -1.706 830 HG23 VAL 118 HG23 VAL 118 4.730 1.989 -2.915 831 H SER 119 H SER 119 -0.288 1.087 -3.321 832 HA SER 119 HA SER 119 -1.687 2.683 -1.288 833 HB2 SER 119 HB2 SER 119 -2.666 1.809 -4.012 834 HB3 SER 119 HB3 SER 119 -3.684 2.557 -2.781 835 HG SER 119 HG SER 119 -2.348 3.821 -4.566 836 H LEU 120 H LEU 120 -2.889 1.700 0.119 837 HA LEU 120 HA LEU 120 -3.302 -1.221 -0.089 838 HB2 LEU 120 HB2 LEU 120 -1.894 0.035 1.820 839 HB3 LEU 120 HB3 LEU 120 -3.486 0.287 2.490 840 HG LEU 120 HG LEU 120 -2.320 -1.621 3.505 841 HD11 LEU 120 HD11 LEU 120 -4.734 -2.436 1.916 842 HD12 LEU 120 HD12 LEU 120 -4.731 -1.660 3.501 843 HD13 LEU 120 HD13 LEU 120 -4.078 -3.288 3.314 844 HD21 LEU 120 HD21 LEU 120 -1.001 -2.335 1.618 845 HD22 LEU 120 HD22 LEU 120 -2.459 -2.832 0.758 846 HD23 LEU 120 HD23 LEU 120 -1.973 -3.672 2.232 847 H ILE 121 H ILE 121 -5.415 -1.836 -0.263 848 HA ILE 121 HA ILE 121 -7.421 -0.080 0.936 849 HB ILE 121 HB ILE 121 -7.677 0.402 -1.376 850 HG12 ILE 121 HG12 ILE 121 -9.917 -0.655 -1.961 851 HG13 ILE 121 HG13 ILE 121 -9.770 -1.561 -0.462 852 HG21 ILE 121 HG21 ILE 121 -7.711 -2.548 -1.946 853 HG22 ILE 121 HG22 ILE 121 -6.438 -1.403 -2.368 854 HG23 ILE 121 HG23 ILE 121 -8.026 -1.273 -3.124 855 HD11 ILE 121 HD11 ILE 121 -9.705 0.533 0.789 856 HD12 ILE 121 HD12 ILE 121 -11.174 0.383 -0.174 857 HD13 ILE 121 HD13 ILE 121 -9.867 1.434 -0.719 858 H VAL 122 H VAL 122 -8.506 -1.081 2.439 859 HA VAL 122 HA VAL 122 -8.909 -3.989 2.200 860 HB VAL 122 HB VAL 122 -9.220 -3.985 4.725 861 HG11 VAL 122 HG11 VAL 122 -6.495 -3.392 3.593 862 HG12 VAL 122 HG12 VAL 122 -7.287 -4.968 3.664 863 HG13 VAL 122 HG13 VAL 122 -6.812 -4.151 5.154 864 HG21 VAL 122 HG21 VAL 122 -9.428 -1.583 5.077 865 HG22 VAL 122 HG22 VAL 122 -7.781 -1.342 4.493 866 HG23 VAL 122 HG23 VAL 122 -8.064 -2.233 5.988 867 H SER 123 H SER 123 -10.897 -4.794 3.200 868 HA SER 123 HA SER 123 -13.046 -2.824 2.963 869 HB2 SER 123 HB2 SER 123 -14.320 -4.594 1.668 870 HB3 SER 123 HB3 SER 123 -12.978 -3.837 0.813 871 HG SER 123 HG SER 123 -12.966 -6.370 2.108 872 H ASN 124 H ASN 124 -14.899 -3.231 4.051 873 HA ASN 124 HA ASN 124 -15.377 -5.691 5.488 874 HB2 ASN 124 HB2 ASN 124 -13.962 -3.987 6.958 875 HB3 ASN 124 HB3 ASN 124 -15.490 -3.138 7.089 876 HD21 ASN 124 HD21 ASN 124 -13.798 -4.447 9.114 877 HD22 ASN 124 HD22 ASN 124 -14.835 -5.572 9.925 878 H GLU 125 H GLU 125 -17.683 -5.241 6.641 879 HA GLU 125 HA GLU 125 -19.384 -4.403 4.454 880 HB2 GLU 125 HB2 GLU 125 -21.216 -5.254 5.878 881 HB3 GLU 125 HB3 GLU 125 -19.935 -6.435 5.653 882 HG2 GLU 125 HG2 GLU 125 -19.161 -6.177 7.857 883 HG3 GLU 125 HG3 GLU 125 -20.052 -4.674 8.081 884 H ASN 126 H ASN 126 -18.089 -2.864 7.186 885 HA ASN 126 HA ASN 126 -20.347 -1.080 7.603 886 HB2 ASN 126 HB2 ASN 126 -18.966 -1.917 9.521 887 HB3 ASN 126 HB3 ASN 126 -17.600 -1.014 8.880 888 HD21 ASN 126 HD21 ASN 126 -17.445 0.161 10.768 889 HD22 ASN 126 HD22 ASN 126 -18.562 1.419 11.172 890 H ASP 127 H ASP 127 -17.022 -0.975 6.457 891 HA ASP 127 HA ASP 127 -17.555 1.079 4.546 892 HB2 ASP 127 HB2 ASP 127 -17.311 2.385 6.708 893 HB3 ASP 127 HB3 ASP 127 -15.666 1.779 6.827 894 H SER 128 H SER 128 -15.445 1.549 3.313 895 HA SER 128 HA SER 128 -13.385 -0.497 3.817 896 HB2 SER 128 HB2 SER 128 -14.263 0.589 1.120 897 HB3 SER 128 HB3 SER 128 -12.959 -0.569 1.387 898 HG SER 128 HG SER 128 -15.569 -1.067 2.313 899 H ASP 129 H ASP 129 -11.358 0.288 4.061 900 HA ASP 129 HA ASP 129 -11.106 3.216 3.863 901 HB2 ASP 129 HB2 ASP 129 -11.112 2.244 6.159 902 HB3 ASP 129 HB3 ASP 129 -9.663 1.338 5.744 903 H SER 130 H SER 130 -9.337 4.076 2.796 904 HA SER 130 HA SER 130 -7.396 2.130 1.763 905 HB2 SER 130 HB2 SER 130 -7.204 3.610 -0.239 906 HB3 SER 130 HB3 SER 130 -8.792 2.866 -0.059 907 HG SER 130 HG SER 130 -8.011 5.535 0.242 908 H ALA 131 H ALA 131 -5.317 2.580 1.937 909 HA ALA 131 HA ALA 131 -4.466 5.238 2.927 910 HB1 ALA 131 HB1 ALA 131 -3.961 3.443 4.520 911 HB2 ALA 131 HB2 ALA 131 -2.482 4.120 3.836 912 HB3 ALA 131 HB3 ALA 131 -3.091 2.567 3.262 913 H SER 132 H SER 132 -2.513 6.084 1.960 914 HA SER 132 HA SER 132 -1.353 4.609 -0.232 915 HB2 SER 132 HB2 SER 132 -3.278 5.865 -1.231 916 HB3 SER 132 HB3 SER 132 -2.558 7.367 -0.658 917 HG SER 132 HG SER 132 -1.648 5.601 -2.657 918 H VAL 133 H VAL 133 0.772 5.052 -0.401 919 HA VAL 133 HA VAL 133 1.819 7.474 0.887 920 HB VAL 133 HB VAL 133 2.959 4.676 1.240 921 HG11 VAL 133 HG11 VAL 133 4.171 7.303 2.109 922 HG12 VAL 133 HG12 VAL 133 4.803 6.218 0.868 923 HG13 VAL 133 HG13 VAL 133 4.763 5.701 2.554 924 HG21 VAL 133 HG21 VAL 133 1.956 6.681 3.254 925 HG22 VAL 133 HG22 VAL 133 2.707 5.131 3.634 926 HG23 VAL 133 HG23 VAL 133 1.164 5.176 2.782 927 H THR 134 H THR 134 3.127 8.550 -0.408 928 HA THR 134 HA THR 134 3.674 7.453 -3.030 929 HB THR 134 HB THR 134 4.561 10.189 -2.205 930 HG1 THR 134 HG1 THR 134 2.573 10.643 -1.622 931 HG21 THR 134 HG21 THR 134 3.826 10.714 -4.476 932 HG22 THR 134 HG22 THR 134 3.257 9.056 -4.675 933 HG23 THR 134 HG23 THR 134 4.980 9.381 -4.474 934 H ILE 135 H ILE 135 5.421 6.319 -3.330 935 HA ILE 135 HA ILE 135 7.683 6.502 -1.493 936 HB ILE 135 HB ILE 135 7.240 4.512 -3.741 937 HG12 ILE 135 HG12 ILE 135 5.376 4.348 -2.178 938 HG13 ILE 135 HG13 ILE 135 6.415 2.939 -2.032 939 HG21 ILE 135 HG21 ILE 135 8.828 3.091 -2.527 940 HG22 ILE 135 HG22 ILE 135 9.049 4.363 -1.326 941 HG23 ILE 135 HG23 ILE 135 9.556 4.629 -2.993 942 HD11 ILE 135 HD11 ILE 135 5.633 3.693 0.132 943 HD12 ILE 135 HD12 ILE 135 6.339 5.286 -0.145 944 HD13 ILE 135 HD13 ILE 135 7.384 3.871 0.011 945 H ARG 136 H ARG 136 9.506 7.526 -2.039 946 HA ARG 136 HA ARG 136 9.615 8.557 -4.780 947 HB2 ARG 136 HB2 ARG 136 10.524 9.742 -2.163 948 HB3 ARG 136 HB3 ARG 136 11.011 10.397 -3.723 949 HG2 ARG 136 HG2 ARG 136 8.812 10.988 -4.286 950 HG3 ARG 136 HG3 ARG 136 8.128 10.002 -2.996 951 HD2 ARG 136 HD2 ARG 136 8.073 12.451 -2.567 952 HD3 ARG 136 HD3 ARG 136 8.901 11.515 -1.329 953 HE ARG 136 HE ARG 136 10.835 12.626 -1.799 954 HH11 ARG 136 HH11 ARG 136 8.673 13.155 -4.548 955 HH12 ARG 136 HH12 ARG 136 9.622 14.471 -5.178 956 HH21 ARG 136 HH21 ARG 136 12.036 14.367 -2.650 957 HH22 ARG 136 HH22 ARG 136 11.515 15.139 -4.117 958 H ALA 137 H ALA 137 11.057 7.665 -6.000 959 HA ALA 137 HA ALA 137 13.474 6.518 -4.786 960 HB1 ALA 137 HB1 ALA 137 13.707 5.213 -6.848 961 HB2 ALA 137 HB2 ALA 137 12.257 5.976 -7.501 962 HB3 ALA 137 HB3 ALA 137 12.140 4.923 -6.090 963 H LEU 138 H LEU 138 15.141 7.822 -4.864 964 HA LEU 138 HA LEU 138 15.304 9.752 -7.052 965 HB2 LEU 138 HB2 LEU 138 16.707 11.101 -5.435 966 HB3 LEU 138 HB3 LEU 138 14.973 11.076 -5.226 967 HG LEU 138 HG LEU 138 15.434 9.254 -3.445 968 HD11 LEU 138 HD11 LEU 138 17.821 8.905 -3.943 969 HD12 LEU 138 HD12 LEU 138 17.562 9.460 -2.289 970 HD13 LEU 138 HD13 LEU 138 18.144 10.586 -3.516 971 HD21 LEU 138 HD21 LEU 138 16.211 12.118 -3.084 972 HD22 LEU 138 HD22 LEU 138 15.646 11.024 -1.815 973 HD23 LEU 138 HD23 LEU 138 14.571 11.485 -3.140 974 H GLU 139 H GLU 139 17.622 10.635 -7.243 975 HA GLU 139 HA GLU 139 19.497 8.385 -7.120 976 HB2 GLU 139 HB2 GLU 139 19.081 9.183 -9.424 977 HB3 GLU 139 HB3 GLU 139 19.562 10.804 -8.944 978 HG2 GLU 139 HG2 GLU 139 21.813 9.804 -8.330 979 HG3 GLU 139 HG3 GLU 139 21.281 8.351 -9.178 980 H HIS 140 H HIS 140 20.519 8.640 -5.193 981 HA HIS 140 HA HIS 140 21.511 11.264 -4.459 982 HB2 HIS 140 HB2 HIS 140 20.832 9.640 -2.672 983 HB3 HIS 140 HB3 HIS 140 22.164 8.594 -3.155 984 HD1 HIS 140 HD1 HIS 140 21.589 12.094 -1.806 985 HD2 HIS 140 HD2 HIS 140 24.559 9.185 -1.928 986 HE1 HIS 140 HE1 HIS 140 23.486 13.006 -0.427 987 HE2 HIS 140 HE2 HIS 140 25.345 11.345 -0.718 988 H HIS 141 H HIS 141 22.973 12.012 -5.714 989 HA HIS 141 HA HIS 141 24.983 10.209 -6.839 990 HB2 HIS 141 HB2 HIS 141 25.356 12.119 -8.501 991 HB3 HIS 141 HB3 HIS 141 23.852 11.228 -8.640 992 HD1 HIS 141 HD1 HIS 141 21.837 12.623 -8.880 993 HD2 HIS 141 HD2 HIS 141 24.918 14.709 -7.029 994 HE1 HIS 141 HE1 HIS 141 20.979 14.967 -8.578 995 HE2 HIS 141 HE2 HIS 141 22.771 16.146 -7.256 996 H HIS 142 H HIS 142 27.085 11.285 -7.310 997 HA HIS 142 HA HIS 142 28.334 12.130 -4.959 998 HB2 HIS 142 HB2 HIS 142 30.314 12.636 -6.477 999 HB3 HIS 142 HB3 HIS 142 29.697 10.996 -6.521 1000 HD1 HIS 142 HD1 HIS 142 30.161 14.028 -8.635 1001 HD2 HIS 142 HD2 HIS 142 28.528 10.225 -8.967 1002 HE1 HIS 142 HE1 HIS 142 29.824 13.652 -11.097 1003 HE2 HIS 142 HE2 HIS 142 28.690 11.406 -11.267 1004 H HIS 143 H HIS 143 28.147 13.957 -3.959 1005 HA HIS 143 HA HIS 143 27.393 16.378 -5.387 1006 HB2 HIS 143 HB2 HIS 143 26.160 15.782 -3.345 1007 HB3 HIS 143 HB3 HIS 143 27.652 15.797 -2.420 1008 HD1 HIS 143 HD1 HIS 143 27.984 17.848 -1.121 1009 HD2 HIS 143 HD2 HIS 143 25.638 18.527 -4.495 1010 HE1 HIS 143 HE1 HIS 143 27.297 20.271 -0.995 1011 HE2 HIS 143 HE2 HIS 143 25.848 20.656 -3.015 1012 H HIS 144 H HIS 144 29.075 17.249 -6.374 1013 HA HIS 144 HA HIS 144 31.634 17.484 -4.961 1014 HB2 HIS 144 HB2 HIS 144 31.373 16.587 -7.392 1015 HB3 HIS 144 HB3 HIS 144 31.131 18.269 -7.833 1016 HD1 HIS 144 HD1 HIS 144 33.724 15.796 -6.999 1017 HD2 HIS 144 HD2 HIS 144 33.455 19.909 -7.504 1018 HE1 HIS 144 HE1 HIS 144 36.098 16.604 -7.223 1019 HE2 HIS 144 HE2 HIS 144 35.899 19.072 -7.694 1020 H HIS 145 H HIS 145 32.521 19.431 -4.451 1021 HA HIS 145 HA HIS 145 30.902 21.753 -4.226 1022 HB2 HIS 145 HB2 HIS 145 32.731 21.312 -2.664 1023 HB3 HIS 145 HB3 HIS 145 33.909 21.381 -3.968 1024 HD1 HIS 145 HD1 HIS 145 35.125 23.516 -4.061 1025 HD2 HIS 145 HD2 HIS 145 31.314 23.987 -2.467 1026 HE1 HIS 145 HE1 HIS 145 34.952 25.950 -3.441 1027 HE2 HIS 145 HE2 HIS 145 32.709 26.166 -2.309 Start of MODEL 16 1 H1 MET 1 H1 MET 1 -92.186 -27.821 43.442 2 H2 MET 1 H2 MET 1 -92.730 -29.411 43.213 3 H3 MET 1 H3 MET 1 -93.716 -28.285 44.005 4 HA MET 1 HA MET 1 -94.461 -28.678 41.749 5 HB2 MET 1 HB2 MET 1 -94.668 -26.350 41.088 6 HB3 MET 1 HB3 MET 1 -94.840 -26.493 42.830 7 HG2 MET 1 HG2 MET 1 -92.530 -25.729 43.113 8 HG3 MET 1 HG3 MET 1 -92.375 -25.576 41.365 9 HE1 MET 1 HE1 MET 1 -95.429 -24.696 43.710 10 HE2 MET 1 HE2 MET 1 -95.151 -22.976 43.984 11 HE3 MET 1 HE3 MET 1 -94.017 -24.163 44.627 12 H ASN 2 H ASN 2 -91.180 -28.821 42.015 13 HA ASN 2 HA ASN 2 -90.557 -27.966 39.305 14 HB2 ASN 2 HB2 ASN 2 -88.846 -28.936 41.589 15 HB3 ASN 2 HB3 ASN 2 -88.203 -28.734 39.967 16 HD21 ASN 2 HD21 ASN 2 -86.756 -27.198 40.751 17 HD22 ASN 2 HD22 ASN 2 -87.251 -25.580 41.115 18 H ALA 3 H ALA 3 -91.705 -29.472 38.087 19 HA ALA 3 HA ALA 3 -90.857 -32.261 38.226 20 HB1 ALA 3 HB1 ALA 3 -92.868 -30.926 36.407 21 HB2 ALA 3 HB2 ALA 3 -93.239 -31.794 37.897 22 HB3 ALA 3 HB3 ALA 3 -92.561 -32.659 36.516 23 H ARG 4 H ARG 4 -88.883 -32.515 37.431 24 HA ARG 4 HA ARG 4 -88.109 -30.995 35.053 25 HB2 ARG 4 HB2 ARG 4 -85.777 -31.569 35.667 26 HB3 ARG 4 HB3 ARG 4 -86.617 -30.645 36.894 27 HG2 ARG 4 HG2 ARG 4 -85.447 -32.183 38.145 28 HG3 ARG 4 HG3 ARG 4 -87.024 -32.958 38.007 29 HD2 ARG 4 HD2 ARG 4 -86.224 -34.449 36.315 30 HD3 ARG 4 HD3 ARG 4 -84.718 -33.554 36.155 31 HE ARG 4 HE ARG 4 -84.743 -34.399 38.754 32 HH11 ARG 4 HH11 ARG 4 -85.089 -36.050 35.672 33 HH12 ARG 4 HH12 ARG 4 -84.222 -37.465 36.177 34 HH21 ARG 4 HH21 ARG 4 -83.612 -36.272 39.431 35 HH22 ARG 4 HH22 ARG 4 -83.404 -37.596 38.318 36 H ASP 5 H ASP 5 -86.743 -32.049 33.435 37 HA ASP 5 HA ASP 5 -87.074 -34.964 33.272 38 HB2 ASP 5 HB2 ASP 5 -88.750 -33.632 31.793 39 HB3 ASP 5 HB3 ASP 5 -87.346 -33.232 30.810 40 H ASN 6 H ASN 6 -85.054 -35.699 33.372 41 HA ASN 6 HA ASN 6 -82.928 -34.148 32.068 42 HB2 ASN 6 HB2 ASN 6 -82.669 -34.633 34.509 43 HB3 ASN 6 HB3 ASN 6 -82.632 -36.351 34.126 44 HD21 ASN 6 HD21 ASN 6 -80.576 -36.698 34.859 45 HD22 ASN 6 HD22 ASN 6 -79.168 -36.047 34.094 46 H LYS 7 H LYS 7 -83.070 -34.835 29.995 47 HA LYS 7 HA LYS 7 -82.109 -37.507 29.445 48 HB2 LYS 7 HB2 LYS 7 -84.650 -37.616 29.527 49 HB3 LYS 7 HB3 LYS 7 -84.656 -36.568 28.117 50 HG2 LYS 7 HG2 LYS 7 -84.924 -38.840 27.412 51 HG3 LYS 7 HG3 LYS 7 -83.337 -38.263 26.898 52 HD2 LYS 7 HD2 LYS 7 -82.312 -39.393 28.817 53 HD3 LYS 7 HD3 LYS 7 -83.902 -39.959 29.328 54 HE2 LYS 7 HE2 LYS 7 -82.565 -40.647 26.710 55 HE3 LYS 7 HE3 LYS 7 -82.637 -41.698 28.125 56 HZ1 LYS 7 HZ1 LYS 7 -84.357 -42.302 26.561 57 HZ2 LYS 7 HZ2 LYS 7 -84.956 -40.718 26.541 58 HZ3 LYS 7 HZ3 LYS 7 -85.078 -41.645 27.949 59 H PHE 8 H PHE 8 -80.465 -37.168 28.155 60 HA PHE 8 HA PHE 8 -80.874 -35.757 25.658 61 HB2 PHE 8 HB2 PHE 8 -79.997 -33.959 27.104 62 HB3 PHE 8 HB3 PHE 8 -78.620 -34.964 27.537 63 HD1 PHE 8 HD1 PHE 8 -80.268 -33.312 24.636 64 HD2 PHE 8 HD2 PHE 8 -76.666 -34.906 26.257 65 HE1 PHE 8 HE1 PHE 8 -79.010 -32.426 22.714 66 HE2 PHE 8 HE2 PHE 8 -75.407 -34.020 24.341 67 HZ PHE 8 HZ PHE 8 -76.578 -32.781 22.567 68 H ASN 9 H ASN 9 -79.820 -36.749 24.036 69 HA ASN 9 HA ASN 9 -77.500 -38.412 24.677 70 HB2 ASN 9 HB2 ASN 9 -78.234 -40.198 23.196 71 HB3 ASN 9 HB3 ASN 9 -79.446 -39.930 24.435 72 HD21 ASN 9 HD21 ASN 9 -78.715 -39.787 21.058 73 HD22 ASN 9 HD22 ASN 9 -80.315 -39.428 20.509 74 H THR 10 H THR 10 -75.990 -38.620 22.970 75 HA THR 10 HA THR 10 -76.602 -37.344 20.456 76 HB THR 10 HB THR 10 -75.651 -35.469 21.590 77 HG1 THR 10 HG1 THR 10 -73.472 -36.423 20.059 78 HG21 THR 10 HG21 THR 10 -73.257 -37.172 22.294 79 HG22 THR 10 HG22 THR 10 -74.463 -36.552 23.421 80 HG23 THR 10 HG23 THR 10 -73.397 -35.435 22.568 81 H TRP 11 H TRP 11 -76.227 -38.792 18.984 82 HA TRP 11 HA TRP 11 -73.899 -40.574 19.299 83 HB2 TRP 11 HB2 TRP 11 -76.604 -41.366 18.193 84 HB3 TRP 11 HB3 TRP 11 -75.177 -42.392 18.224 85 HD1 TRP 11 HD1 TRP 11 -78.211 -41.737 20.115 86 HE1 TRP 11 HE1 TRP 11 -78.079 -42.699 22.496 87 HE3 TRP 11 HE3 TRP 11 -73.184 -42.638 20.341 88 HZ2 TRP 11 HZ2 TRP 11 -76.102 -43.701 24.243 89 HZ3 TRP 11 HZ3 TRP 11 -72.254 -43.594 22.400 90 HH2 TRP 11 HH2 TRP 11 -73.681 -44.117 24.314 91 H ASN 12 H ASN 12 -72.772 -39.070 18.020 92 HA ASN 12 HA ASN 12 -73.343 -39.378 15.146 93 HB2 ASN 12 HB2 ASN 12 -73.349 -37.021 15.960 94 HB3 ASN 12 HB3 ASN 12 -71.691 -37.226 16.505 95 HD21 ASN 12 HD21 ASN 12 -73.001 -38.497 13.471 96 HD22 ASN 12 HD22 ASN 12 -72.063 -37.466 12.448 97 H ASP 13 H ASP 13 -72.300 -41.182 14.649 98 HA ASP 13 HA ASP 13 -69.623 -41.662 15.756 99 HB2 ASP 13 HB2 ASP 13 -71.329 -43.371 16.257 100 HB3 ASP 13 HB3 ASP 13 -71.606 -43.601 14.536 101 H SER 14 H SER 14 -67.898 -41.744 14.482 102 HA SER 14 HA SER 14 -68.320 -41.576 11.575 103 HB2 SER 14 HB2 SER 14 -67.577 -39.425 12.805 104 HB3 SER 14 HB3 SER 14 -66.035 -40.249 13.032 105 HG SER 14 HG SER 14 -66.996 -38.989 10.845 106 H ARG 15 H ARG 15 -66.234 -42.093 10.400 107 HA ARG 15 HA ARG 15 -65.099 -44.542 11.553 108 HB2 ARG 15 HB2 ARG 15 -64.664 -45.171 9.157 109 HB3 ARG 15 HB3 ARG 15 -66.369 -44.996 9.559 110 HG2 ARG 15 HG2 ARG 15 -66.305 -42.712 8.606 111 HG3 ARG 15 HG3 ARG 15 -64.641 -43.006 8.108 112 HD2 ARG 15 HD2 ARG 15 -65.969 -43.412 6.211 113 HD3 ARG 15 HD3 ARG 15 -65.510 -44.996 6.829 114 HE ARG 15 HE ARG 15 -67.754 -45.223 7.714 115 HH11 ARG 15 HH11 ARG 15 -67.267 -42.550 5.468 116 HH12 ARG 15 HH12 ARG 15 -68.931 -42.492 4.979 117 HH21 ARG 15 HH21 ARG 15 -69.959 -45.116 7.082 118 HH22 ARG 15 HH22 ARG 15 -70.457 -43.948 5.893 119 H GLY 16 H GLY 16 -62.832 -45.020 10.273 120 HA2 GLY 16 HA2 GLY 16 -61.246 -42.581 10.092 121 HA3 GLY 16 HA3 GLY 16 -60.861 -43.640 11.439 122 H ASN 17 H ASN 17 -60.154 -42.877 8.281 123 HA ASN 17 HA ASN 17 -58.949 -45.515 7.789 124 HB2 ASN 17 HB2 ASN 17 -58.754 -44.936 5.454 125 HB3 ASN 17 HB3 ASN 17 -60.400 -44.613 5.962 126 HD21 ASN 17 HD21 ASN 17 -61.135 -42.493 6.029 127 HD22 ASN 17 HD22 ASN 17 -60.274 -41.187 5.289 128 H TYR 18 H TYR 18 -56.735 -45.580 6.990 129 HA TYR 18 HA TYR 18 -55.126 -43.218 7.500 130 HB2 TYR 18 HB2 TYR 18 -53.506 -44.562 8.890 131 HB3 TYR 18 HB3 TYR 18 -55.028 -44.185 9.673 132 HD1 TYR 18 HD1 TYR 18 -53.033 -46.883 8.120 133 HD2 TYR 18 HD2 TYR 18 -56.505 -45.918 10.384 134 HE1 TYR 18 HE1 TYR 18 -53.324 -49.261 8.680 135 HE2 TYR 18 HE2 TYR 18 -56.814 -48.288 10.945 136 HH TYR 18 HH TYR 18 -56.203 -50.498 10.004 137 H TRP 19 H TRP 19 -53.078 -43.247 6.580 138 HA TRP 19 HA TRP 19 -52.222 -45.559 5.053 139 HB2 TRP 19 HB2 TRP 19 -53.691 -44.186 3.509 140 HB3 TRP 19 HB3 TRP 19 -52.527 -42.876 3.677 141 HD1 TRP 19 HD1 TRP 19 -52.142 -46.657 2.847 142 HE1 TRP 19 HE1 TRP 19 -50.595 -46.860 0.791 143 HE3 TRP 19 HE3 TRP 19 -51.286 -41.691 1.988 144 HZ2 TRP 19 HZ2 TRP 19 -49.208 -45.136 -0.956 145 HZ3 TRP 19 HZ3 TRP 19 -49.841 -41.053 0.103 146 HH2 TRP 19 HH2 TRP 19 -48.825 -42.740 -1.337 147 H SER 20 H SER 20 -50.098 -45.779 5.319 148 HA SER 20 HA SER 20 -48.812 -43.775 6.974 149 HB2 SER 20 HB2 SER 20 -47.887 -46.560 6.244 150 HB3 SER 20 HB3 SER 20 -47.205 -45.527 7.501 151 HG SER 20 HG SER 20 -49.011 -45.782 8.721 152 H ASP 21 H ASP 21 -46.565 -43.249 6.711 153 HA ASP 21 HA ASP 21 -45.892 -42.757 3.897 154 HB2 ASP 21 HB2 ASP 21 -46.112 -40.889 5.660 155 HB3 ASP 21 HB3 ASP 21 -44.599 -41.492 6.313 156 H TYR 22 H TYR 22 -43.826 -43.269 3.104 157 HA TYR 22 HA TYR 22 -42.210 -45.015 4.822 158 HB2 TYR 22 HB2 TYR 22 -43.740 -46.356 3.358 159 HB3 TYR 22 HB3 TYR 22 -42.901 -45.693 1.959 160 HD1 TYR 22 HD2 TYR 22 -42.316 -47.647 5.081 161 HD2 TYR 22 HD1 TYR 22 -40.969 -46.746 1.145 162 HE1 TYR 22 HE2 TYR 22 -40.631 -49.431 5.251 163 HE2 TYR 22 HE1 TYR 22 -39.283 -48.525 1.309 164 HH TYR 22 HH TYR 22 -39.341 -50.904 3.664 165 H GLU 23 H GLU 23 -40.545 -43.677 5.086 166 HA GLU 23 HA GLU 23 -38.682 -43.659 2.872 167 HB2 GLU 23 HB2 GLU 23 -40.015 -41.342 3.126 168 HB3 GLU 23 HB3 GLU 23 -38.799 -41.077 4.362 169 HG2 GLU 23 HG2 GLU 23 -38.201 -41.737 1.486 170 HG3 GLU 23 HG3 GLU 23 -38.234 -40.111 2.151 171 H GLY 24 H GLY 24 -37.243 -44.915 3.811 172 HA2 GLY 24 HA2 GLY 24 -36.237 -44.137 6.481 173 HA3 GLY 24 HA3 GLY 24 -36.287 -45.801 5.909 174 H SER 25 H SER 25 -34.605 -42.816 5.863 175 HA SER 25 HA SER 25 -32.690 -43.836 3.907 176 HB2 SER 25 HB2 SER 25 -31.875 -41.387 3.977 177 HB3 SER 25 HB3 SER 25 -33.415 -41.729 3.187 178 HG SER 25 HG SER 25 -34.455 -40.685 4.709 179 H ASP 26 H ASP 26 -30.395 -43.058 4.285 180 HA ASP 26 HA ASP 26 -29.608 -43.879 6.997 181 HB2 ASP 26 HB2 ASP 26 -28.794 -45.104 4.907 182 HB3 ASP 26 HB3 ASP 26 -27.872 -43.654 4.527 183 H GLU 27 H GLU 27 -28.546 -42.492 8.341 184 HA GLU 27 HA GLU 27 -27.581 -39.953 7.232 185 HB2 GLU 27 HB2 GLU 27 -28.470 -38.753 9.205 186 HB3 GLU 27 HB3 GLU 27 -29.728 -39.448 8.197 187 HG2 GLU 27 HG2 GLU 27 -30.097 -41.220 9.759 188 HG3 GLU 27 HG3 GLU 27 -28.694 -40.738 10.709 189 H ASN 28 H ASN 28 -26.097 -38.792 8.514 190 HA ASN 28 HA ASN 28 -24.643 -40.139 10.653 191 HB2 ASN 28 HB2 ASN 28 -23.590 -39.712 7.886 192 HB3 ASN 28 HB3 ASN 28 -22.495 -39.396 9.223 193 HD21 ASN 28 HD21 ASN 28 -23.447 -41.459 10.960 194 HD22 ASN 28 HD22 ASN 28 -22.949 -42.964 10.269 195 H GLY 29 H GLY 29 -22.430 -38.412 10.758 196 HA2 GLY 29 HA2 GLY 29 -21.974 -36.026 10.262 197 HA3 GLY 29 HA3 GLY 29 -23.634 -35.709 10.725 198 H ASP 30 H ASP 30 -21.043 -34.668 11.711 199 HA ASP 30 HA ASP 30 -21.742 -34.889 14.536 200 HB2 ASP 30 HB2 ASP 30 -19.467 -35.132 15.292 201 HB3 ASP 30 HB3 ASP 30 -19.796 -36.424 14.148 202 H GLY 31 H GLY 31 -21.304 -32.998 15.755 203 HA2 GLY 31 HA2 GLY 31 -20.796 -30.630 14.049 204 HA3 GLY 31 HA3 GLY 31 -21.882 -30.635 15.431 205 H ILE 32 H ILE 32 -19.225 -29.233 14.575 206 HA ILE 32 HA ILE 32 -17.698 -29.801 17.033 207 HB ILE 32 HB ILE 32 -16.648 -28.303 14.617 208 HG12 ILE 32 HG12 ILE 32 -16.127 -31.218 15.238 209 HG13 ILE 32 HG13 ILE 32 -17.354 -30.694 14.092 210 HG21 ILE 32 HG21 ILE 32 -14.455 -28.879 15.580 211 HG22 ILE 32 HG22 ILE 32 -15.266 -29.660 16.938 212 HG23 ILE 32 HG23 ILE 32 -15.433 -27.921 16.693 213 HD11 ILE 32 HD11 ILE 32 -15.640 -29.641 12.722 214 HD12 ILE 32 HD12 ILE 32 -15.293 -31.352 12.975 215 HD13 ILE 32 HD13 ILE 32 -14.404 -30.128 13.882 216 H GLY 33 H GLY 33 -17.705 -28.314 18.592 217 HA2 GLY 33 HA2 GLY 33 -18.922 -25.706 18.077 218 HA3 GLY 33 HA3 GLY 33 -18.600 -26.409 19.655 219 H ASP 34 H ASP 34 -17.986 -23.744 18.544 220 HA ASP 34 HA ASP 34 -15.077 -23.714 18.399 221 HB2 ASP 34 HB2 ASP 34 -17.211 -21.663 17.938 222 HB3 ASP 34 HB3 ASP 34 -15.564 -21.135 18.279 223 H SER 35 H SER 35 -14.153 -24.024 20.325 224 HA SER 35 HA SER 35 -15.145 -22.611 22.677 225 HB2 SER 35 HB2 SER 35 -12.853 -24.583 22.434 226 HB3 SER 35 HB3 SER 35 -13.577 -23.996 23.934 227 HG SER 35 HG SER 35 -15.532 -24.966 22.420 228 H ALA 36 H ALA 36 -14.589 -20.501 22.437 229 HA ALA 36 HA ALA 36 -11.735 -19.865 22.500 230 HB1 ALA 36 HB1 ALA 36 -12.001 -18.076 20.859 231 HB2 ALA 36 HB2 ALA 36 -13.682 -18.546 20.611 232 HB3 ALA 36 HB3 ALA 36 -12.382 -19.648 20.156 233 H TYR 37 H TYR 37 -11.242 -17.925 23.532 234 HA TYR 37 HA TYR 37 -13.467 -16.580 24.914 235 HB2 TYR 37 HB2 TYR 37 -10.803 -17.359 26.135 236 HB3 TYR 37 HB3 TYR 37 -12.045 -16.407 26.938 237 HD1 TYR 37 HD2 TYR 37 -14.368 -17.569 27.205 238 HD2 TYR 37 HD1 TYR 37 -10.744 -19.653 26.414 239 HE1 TYR 37 HE2 TYR 37 -15.381 -19.640 28.060 240 HE2 TYR 37 HE1 TYR 37 -11.742 -21.731 27.269 241 HH TYR 37 HH TYR 37 -15.072 -22.093 27.800 242 H ALA 38 H ALA 38 -13.277 -14.393 25.159 243 HA ALA 38 HA ALA 38 -11.135 -13.080 23.674 244 HB1 ALA 38 HB1 ALA 38 -13.633 -11.919 24.910 245 HB2 ALA 38 HB2 ALA 38 -13.438 -12.386 23.221 246 HB3 ALA 38 HB3 ALA 38 -12.487 -11.056 23.884 247 H VAL 39 H VAL 39 -9.354 -12.513 24.740 248 HA VAL 39 HA VAL 39 -9.433 -12.181 27.623 249 HB VAL 39 HB VAL 39 -6.979 -12.016 27.523 250 HG11 VAL 39 HG11 VAL 39 -7.979 -14.197 27.766 251 HG12 VAL 39 HG12 VAL 39 -6.531 -14.313 26.763 252 HG13 VAL 39 HG13 VAL 39 -8.129 -14.357 26.016 253 HG21 VAL 39 HG21 VAL 39 -6.681 -10.939 25.365 254 HG22 VAL 39 HG22 VAL 39 -7.308 -12.365 24.540 255 HG23 VAL 39 HG23 VAL 39 -5.779 -12.454 25.417 256 H ASN 40 H ASN 40 -8.737 -10.338 28.723 257 HA ASN 40 HA ASN 40 -9.327 -7.866 27.340 258 HB2 ASN 40 HB2 ASN 40 -9.187 -6.837 29.604 259 HB3 ASN 40 HB3 ASN 40 -10.355 -8.142 29.502 260 HD21 ASN 40 HD21 ASN 40 -7.483 -6.986 30.980 261 HD22 ASN 40 HD22 ASN 40 -7.241 -8.305 32.074 262 HA PRO 41 HA PRO 41 -5.108 -6.780 26.507 263 HB2 PRO 41 HB2 PRO 41 -5.941 -3.960 26.728 264 HB3 PRO 41 HB3 PRO 41 -5.299 -4.837 25.337 265 HG2 PRO 41 HG2 PRO 41 -7.866 -4.089 25.460 266 HG3 PRO 41 HG3 PRO 41 -7.372 -5.612 24.697 267 HD2 PRO 41 HD2 PRO 41 -8.566 -5.142 27.402 268 HD3 PRO 41 HD3 PRO 41 -8.912 -6.427 26.226 269 H GLU 42 H GLU 42 -6.752 -4.856 28.984 270 HA GLU 42 HA GLU 42 -4.404 -5.055 30.693 271 HB2 GLU 42 HB2 GLU 42 -4.709 -2.629 31.328 272 HB3 GLU 42 HB3 GLU 42 -4.034 -2.915 29.728 273 HG2 GLU 42 HG2 GLU 42 -6.293 -2.555 28.764 274 HG3 GLU 42 HG3 GLU 42 -6.874 -2.148 30.379 275 H ALA 43 H ALA 43 -4.854 -4.541 32.917 276 HA ALA 43 HA ALA 43 -7.527 -5.439 33.677 277 HB1 ALA 43 HB1 ALA 43 -6.503 -5.794 35.887 278 HB2 ALA 43 HB2 ALA 43 -4.985 -5.140 35.267 279 HB3 ALA 43 HB3 ALA 43 -5.636 -6.641 34.605 280 H GLY 44 H GLY 44 -8.915 -3.787 33.754 281 HA2 GLY 44 HA2 GLY 44 -8.387 -1.638 35.647 282 HA3 GLY 44 HA3 GLY 44 -8.703 -1.164 33.984 283 H SER 45 H SER 45 -10.099 -1.303 36.840 284 HA SER 45 HA SER 45 -12.653 -2.430 36.003 285 HB2 SER 45 HB2 SER 45 -13.214 -1.994 38.471 286 HB3 SER 45 HB3 SER 45 -11.997 -3.221 38.126 287 HG SER 45 HG SER 45 -11.631 -0.581 39.090 288 H MET 46 H MET 46 -12.258 -0.279 34.527 289 HA MET 46 HA MET 46 -14.126 1.711 35.627 290 HB2 MET 46 HB2 MET 46 -11.662 2.406 34.003 291 HB3 MET 46 HB3 MET 46 -12.891 3.534 34.543 292 HG2 MET 46 HG2 MET 46 -12.259 3.151 36.855 293 HG3 MET 46 HG3 MET 46 -11.060 1.964 36.341 294 HE1 MET 46 HE1 MET 46 -9.927 3.387 33.668 295 HE2 MET 46 HE2 MET 46 -8.905 2.590 34.862 296 HE3 MET 46 HE3 MET 46 -8.529 4.230 34.332 297 H ASP 47 H ASP 47 -15.852 1.830 34.338 298 HA ASP 47 HA ASP 47 -15.488 2.010 31.459 299 HB2 ASP 47 HB2 ASP 47 -15.847 -0.432 31.861 300 HB3 ASP 47 HB3 ASP 47 -17.378 -0.050 32.637 301 H TYR 48 H TYR 48 -16.584 3.774 30.885 302 HA TYR 48 HA TYR 48 -19.256 4.163 32.021 303 HB2 TYR 48 HB2 TYR 48 -17.688 5.747 33.136 304 HB3 TYR 48 HB3 TYR 48 -17.284 6.421 31.561 305 HD1 TYR 48 HD2 TYR 48 -20.235 5.789 33.763 306 HD2 TYR 48 HD1 TYR 48 -18.484 8.272 30.785 307 HE1 TYR 48 HE2 TYR 48 -22.127 7.351 33.963 308 HE2 TYR 48 HE1 TYR 48 -20.368 9.839 30.972 309 HH TYR 48 HH TYR 48 -22.681 9.873 31.691 310 H MET 49 H MET 49 -20.450 3.640 30.327 311 HA MET 49 HA MET 49 -20.037 5.175 27.845 312 HB2 MET 49 HB2 MET 49 -21.223 2.422 28.230 313 HB3 MET 49 HB3 MET 49 -21.423 3.349 26.752 314 HG2 MET 49 HG2 MET 49 -18.919 3.415 26.582 315 HG3 MET 49 HG3 MET 49 -18.879 2.258 27.913 316 HE1 MET 49 HE1 MET 49 -19.867 2.890 24.172 317 HE2 MET 49 HE2 MET 49 -21.436 2.533 24.892 318 HE3 MET 49 HE3 MET 49 -20.709 1.398 23.754 319 HA PRO 50 HA PRO 50 -24.062 6.839 29.066 320 HB2 PRO 50 HB2 PRO 50 -23.797 8.630 26.798 321 HB3 PRO 50 HB3 PRO 50 -23.762 9.019 28.517 322 HG2 PRO 50 HG2 PRO 50 -21.583 9.209 26.894 323 HG3 PRO 50 HG3 PRO 50 -21.477 8.880 28.632 324 HD2 PRO 50 HD2 PRO 50 -21.296 6.976 26.327 325 HD3 PRO 50 HD3 PRO 50 -20.334 7.031 27.821 326 H LEU 51 H LEU 51 -25.537 5.324 28.511 327 HA LEU 51 HA LEU 51 -26.532 5.408 25.787 328 HB2 LEU 51 HB2 LEU 51 -26.860 2.759 26.205 329 HB3 LEU 51 HB3 LEU 51 -25.557 3.463 25.277 330 HG LEU 51 HG LEU 51 -24.324 3.445 27.627 331 HD11 LEU 51 HD11 LEU 51 -24.875 1.445 28.919 332 HD12 LEU 51 HD12 LEU 51 -26.295 1.183 27.908 333 HD13 LEU 51 HD13 LEU 51 -26.195 2.614 28.935 334 HD21 LEU 51 HD21 LEU 51 -23.362 1.283 27.015 335 HD22 LEU 51 HD22 LEU 51 -23.550 2.340 25.617 336 HD23 LEU 51 HD23 LEU 51 -24.689 1.020 25.883 337 H MET 52 H MET 52 -28.380 6.331 26.159 338 HA MET 52 HA MET 52 -30.143 5.634 28.319 339 HB2 MET 52 HB2 MET 52 -30.094 7.900 27.345 340 HB3 MET 52 HB3 MET 52 -30.635 7.254 25.805 341 HG2 MET 52 HG2 MET 52 -32.748 6.565 26.870 342 HG3 MET 52 HG3 MET 52 -32.201 7.293 28.380 343 HE1 MET 52 HE1 MET 52 -34.968 8.000 26.906 344 HE2 MET 52 HE2 MET 52 -35.000 9.746 27.141 345 HE3 MET 52 HE3 MET 52 -34.460 8.689 28.449 346 H GLU 53 H GLU 53 -30.079 5.109 24.848 347 HA GLU 53 HA GLU 53 -32.082 2.986 25.121 348 HB2 GLU 53 HB2 GLU 53 -31.090 4.371 22.618 349 HB3 GLU 53 HB3 GLU 53 -32.359 3.156 22.691 350 HG2 GLU 53 HG2 GLU 53 -33.714 4.679 24.078 351 HG3 GLU 53 HG3 GLU 53 -32.451 5.897 23.932 352 H TYR 54 H TYR 54 -31.641 0.943 24.130 353 HA TYR 54 HA TYR 54 -28.856 0.253 24.506 354 HB2 TYR 54 HB2 TYR 54 -31.280 -1.497 24.059 355 HB3 TYR 54 HB3 TYR 54 -29.654 -2.094 24.382 356 HD1 TYR 54 HD1 TYR 54 -28.543 -1.345 26.571 357 HD2 TYR 54 HD2 TYR 54 -32.716 -0.988 25.828 358 HE1 TYR 54 HE1 TYR 54 -28.949 -1.180 28.990 359 HE2 TYR 54 HE2 TYR 54 -33.139 -0.817 28.244 360 HH TYR 54 HH TYR 54 -30.682 -0.268 30.515 361 H LEU 55 H LEU 55 -27.450 -0.232 23.036 362 HA LEU 55 HA LEU 55 -27.938 0.335 20.296 363 HB2 LEU 55 HB2 LEU 55 -25.559 -0.710 21.804 364 HB3 LEU 55 HB3 LEU 55 -25.550 -0.647 20.059 365 HG LEU 55 HG LEU 55 -25.928 1.842 20.227 366 HD11 LEU 55 HD11 LEU 55 -26.808 1.961 22.502 367 HD12 LEU 55 HD12 LEU 55 -25.366 2.958 22.309 368 HD13 LEU 55 HD13 LEU 55 -25.258 1.402 23.134 369 HD21 LEU 55 HD21 LEU 55 -23.593 2.314 20.795 370 HD22 LEU 55 HD22 LEU 55 -23.757 0.904 19.748 371 HD23 LEU 55 HD23 LEU 55 -23.441 0.691 21.470 372 H HIS 56 H HIS 56 -28.243 -0.957 18.595 373 HA HIS 56 HA HIS 56 -29.021 -3.700 19.050 374 HB2 HIS 56 HB2 HIS 56 -30.292 -2.193 17.535 375 HB3 HIS 56 HB3 HIS 56 -28.888 -2.071 16.490 376 HD1 HIS 56 HD1 HIS 56 -28.321 -4.167 15.018 377 HD2 HIS 56 HD2 HIS 56 -31.847 -4.463 17.203 378 HE1 HIS 56 HE1 HIS 56 -29.601 -6.071 13.977 379 HE2 HIS 56 HE2 HIS 56 -31.676 -6.314 15.393 380 H SER 57 H SER 57 -26.513 -1.971 17.226 381 HA SER 57 HA SER 57 -24.864 -4.390 17.216 382 HB2 SER 57 HB2 SER 57 -25.455 -2.724 14.763 383 HB3 SER 57 HB3 SER 57 -24.288 -4.038 14.832 384 HG SER 57 HG SER 57 -26.151 -4.867 13.983 385 H SER 58 H SER 58 -22.729 -3.984 17.551 386 HA SER 58 HA SER 58 -21.762 -1.307 16.880 387 HB2 SER 58 HB2 SER 58 -20.238 -1.443 18.926 388 HB3 SER 58 HB3 SER 58 -21.945 -1.138 19.235 389 HG SER 58 HG SER 58 -22.138 -3.039 20.177 390 HA PRO 59 HA PRO 59 -18.839 -4.449 15.193 391 HB2 PRO 59 HB2 PRO 59 -19.294 -3.885 12.507 392 HB3 PRO 59 HB3 PRO 59 -19.970 -5.244 13.406 393 HG2 PRO 59 HG2 PRO 59 -21.356 -2.993 12.335 394 HG3 PRO 59 HG3 PRO 59 -22.021 -4.329 13.285 395 HD2 PRO 59 HD2 PRO 59 -21.317 -1.594 14.131 396 HD3 PRO 59 HD3 PRO 59 -22.422 -2.758 14.886 397 H VAL 60 H VAL 60 -16.861 -4.055 13.978 398 HA VAL 60 HA VAL 60 -16.171 -1.213 14.162 399 HB VAL 60 HB VAL 60 -14.978 -2.725 15.691 400 HG11 VAL 60 HG11 VAL 60 -13.269 -4.253 14.917 401 HG12 VAL 60 HG12 VAL 60 -13.734 -3.941 13.243 402 HG13 VAL 60 HG13 VAL 60 -14.870 -4.727 14.343 403 HG21 VAL 60 HG21 VAL 60 -12.700 -1.920 15.244 404 HG22 VAL 60 HG22 VAL 60 -13.922 -0.657 15.104 405 HG23 VAL 60 HG23 VAL 60 -13.224 -1.375 13.651 406 H LEU 61 H LEU 61 -15.407 -0.108 12.509 407 HA LEU 61 HA LEU 61 -15.449 -1.244 9.869 408 HB2 LEU 61 HB2 LEU 61 -14.776 1.153 9.198 409 HB3 LEU 61 HB3 LEU 61 -16.374 0.871 9.819 410 HG LEU 61 HG LEU 61 -15.336 3.034 10.493 411 HD11 LEU 61 HD11 LEU 61 -17.171 2.198 11.781 412 HD12 LEU 61 HD12 LEU 61 -16.002 2.996 12.834 413 HD13 LEU 61 HD13 LEU 61 -16.080 1.234 12.775 414 HD21 LEU 61 HD21 LEU 61 -13.700 3.107 12.300 415 HD22 LEU 61 HD22 LEU 61 -13.042 2.390 10.829 416 HD23 LEU 61 HD23 LEU 61 -13.501 1.358 12.184 417 HA PRO 62 HA PRO 62 -11.202 -2.141 9.570 418 HB2 PRO 62 HB2 PRO 62 -10.420 -1.525 7.065 419 HB3 PRO 62 HB3 PRO 62 -11.503 -2.880 7.426 420 HG2 PRO 62 HG2 PRO 62 -12.115 -0.229 6.254 421 HG3 PRO 62 HG3 PRO 62 -12.927 -1.784 6.014 422 HD2 PRO 62 HD2 PRO 62 -13.820 0.300 7.662 423 HD3 PRO 62 HD3 PRO 62 -14.404 -1.369 7.681 424 H THR 63 H THR 63 -8.995 -1.451 8.887 425 HA THR 63 HA THR 63 -8.522 1.411 8.987 426 HB THR 63 HB THR 63 -7.321 -0.531 10.994 427 HG1 THR 63 HG1 THR 63 -9.556 1.059 11.069 428 HG21 THR 63 HG21 THR 63 -6.947 2.433 10.624 429 HG22 THR 63 HG22 THR 63 -5.740 1.174 10.361 430 HG23 THR 63 HG23 THR 63 -6.335 1.500 11.991 431 H ALA 64 H ALA 64 -7.404 1.615 7.154 432 HA ALA 64 HA ALA 64 -5.758 -0.516 6.136 433 HB1 ALA 64 HB1 ALA 64 -7.093 0.893 4.634 434 HB2 ALA 64 HB2 ALA 64 -5.375 0.938 4.234 435 HB3 ALA 64 HB3 ALA 64 -6.116 2.288 5.091 436 H ARG 65 H ARG 65 -3.855 -0.883 6.936 437 HA ARG 65 HA ARG 65 -2.030 1.329 7.498 438 HB2 ARG 65 HB2 ARG 65 -2.828 -0.855 9.419 439 HB3 ARG 65 HB3 ARG 65 -1.284 -0.033 9.559 440 HG2 ARG 65 HG2 ARG 65 -4.020 1.206 9.791 441 HG3 ARG 65 HG3 ARG 65 -2.870 0.922 11.096 442 HD2 ARG 65 HD2 ARG 65 -2.575 2.834 8.784 443 HD3 ARG 65 HD3 ARG 65 -2.798 3.247 10.483 444 HE ARG 65 HE ARG 65 -0.494 1.733 10.384 445 HH11 ARG 65 HH11 ARG 65 -1.589 4.764 8.981 446 HH12 ARG 65 HH12 ARG 65 0.011 5.425 8.844 447 HH21 ARG 65 HH21 ARG 65 1.619 2.591 10.162 448 HH22 ARG 65 HH22 ARG 65 1.837 4.179 9.500 449 H PHE 66 H PHE 66 -0.057 0.919 6.725 450 HA PHE 66 HA PHE 66 1.039 -1.724 6.657 451 HB2 PHE 66 HB2 PHE 66 1.482 -1.852 4.258 452 HB3 PHE 66 HB3 PHE 66 -0.246 -1.760 4.528 453 HD1 PHE 66 HD2 PHE 66 -1.343 0.569 4.233 454 HD2 PHE 66 HD1 PHE 66 2.510 -0.447 2.746 455 HE1 PHE 66 HE2 PHE 66 -1.488 2.403 2.613 456 HE2 PHE 66 HE1 PHE 66 2.364 1.387 1.116 457 HZ PHE 66 HZ PHE 66 0.362 2.813 1.051 458 H THR 67 H THR 67 3.381 -1.639 5.927 459 HA THR 67 HA THR 67 4.380 1.079 5.699 460 HB THR 67 HB THR 67 4.534 0.506 8.134 461 HG1 THR 67 HG1 THR 67 7.040 0.888 6.824 462 HG21 THR 67 HG21 THR 67 6.364 -0.957 8.882 463 HG22 THR 67 HG22 THR 67 6.621 -1.478 7.216 464 HG23 THR 67 HG23 THR 67 5.106 -1.857 8.036 465 H SER 68 H SER 68 6.027 1.351 4.454 466 HA SER 68 HA SER 68 7.392 -0.941 3.247 467 HB2 SER 68 HB2 SER 68 6.490 0.811 1.731 468 HB3 SER 68 HB3 SER 68 7.445 2.024 2.576 469 HG SER 68 HG SER 68 8.764 1.558 0.979 470 H ASP 69 H ASP 69 9.787 -0.855 3.225 471 HA ASP 69 HA ASP 69 10.824 -0.086 5.780 472 HB2 ASP 69 HB2 ASP 69 12.175 -1.239 3.339 473 HB3 ASP 69 HB3 ASP 69 13.019 -0.915 4.851 474 H ILE 70 H ILE 70 10.841 1.341 2.604 475 HA ILE 70 HA ILE 70 12.181 3.669 3.772 476 HB ILE 70 HB ILE 70 12.997 4.205 1.378 477 HG12 ILE 70 HG12 ILE 70 13.754 1.792 0.417 478 HG13 ILE 70 HG13 ILE 70 12.182 1.370 1.084 479 HG21 ILE 70 HG21 ILE 70 14.495 3.829 3.211 480 HG22 ILE 70 HG22 ILE 70 15.108 3.012 1.774 481 HG23 ILE 70 HG23 ILE 70 14.317 2.081 3.045 482 HD11 ILE 70 HD11 ILE 70 12.028 1.929 -1.273 483 HD12 ILE 70 HD12 ILE 70 12.711 3.523 -0.954 484 HD13 ILE 70 HD13 ILE 70 11.134 3.090 -0.292 485 H THR 71 H THR 71 11.442 5.668 3.233 486 HA THR 71 HA THR 71 8.973 5.769 1.622 487 HB THR 71 HB THR 71 8.683 8.054 2.742 488 HG1 THR 71 HG1 THR 71 9.766 8.255 4.770 489 HG21 THR 71 HG21 THR 71 8.518 5.597 4.489 490 HG22 THR 71 HG22 THR 71 7.305 6.109 3.315 491 HG23 THR 71 HG23 THR 71 7.639 7.105 4.731 492 H GLU 72 H GLU 72 12.229 6.683 1.857 493 HA GLU 72 HA GLU 72 12.160 8.170 -0.617 494 HB2 GLU 72 HB2 GLU 72 11.773 9.853 1.228 495 HB3 GLU 72 HB3 GLU 72 13.349 9.420 1.874 496 HG2 GLU 72 HG2 GLU 72 14.329 10.091 -0.343 497 HG3 GLU 72 HG3 GLU 72 12.747 10.738 -0.768 498 H GLY 73 H GLY 73 14.213 8.203 -1.607 499 HA2 GLY 73 HA2 GLY 73 16.707 7.840 -0.914 500 HA3 GLY 73 HA3 GLY 73 16.095 6.233 -0.534 501 H PHE 74 H PHE 74 17.840 5.807 -2.248 502 HA PHE 74 HA PHE 74 16.897 6.268 -4.959 503 HB2 PHE 74 HB2 PHE 74 19.033 5.174 -5.649 504 HB3 PHE 74 HB3 PHE 74 19.283 6.575 -4.624 505 HD1 PHE 74 HD2 PHE 74 19.588 2.935 -4.879 506 HD2 PHE 74 HD1 PHE 74 20.239 6.339 -2.406 507 HE1 PHE 74 HE2 PHE 74 21.063 1.600 -3.437 508 HE2 PHE 74 HE1 PHE 74 21.723 5.007 -0.966 509 HZ PHE 74 HZ PHE 74 22.129 2.634 -1.480 510 H ALA 75 H ALA 75 16.270 4.547 -6.353 511 HA ALA 75 HA ALA 75 14.947 2.367 -5.045 512 HB1 ALA 75 HB1 ALA 75 14.154 1.751 -7.255 513 HB2 ALA 75 HB2 ALA 75 15.312 2.857 -7.995 514 HB3 ALA 75 HB3 ALA 75 13.998 3.492 -7.007 515 HA PRO 76 HA PRO 76 18.578 -0.227 -5.592 516 HB2 PRO 76 HB2 PRO 76 18.380 -1.493 -3.226 517 HB3 PRO 76 HB3 PRO 76 18.938 0.173 -3.384 518 HG2 PRO 76 HG2 PRO 76 16.448 -0.832 -2.228 519 HG3 PRO 76 HG3 PRO 76 17.167 0.782 -2.101 520 HD2 PRO 76 HD2 PRO 76 15.063 -0.176 -3.897 521 HD3 PRO 76 HD3 PRO 76 15.551 1.495 -3.537 522 H LEU 77 H LEU 77 15.334 -1.394 -5.452 523 HA LEU 77 HA LEU 77 15.617 -3.991 -6.380 524 HB2 LEU 77 HB2 LEU 77 16.955 -4.086 -4.114 525 HB3 LEU 77 HB3 LEU 77 15.366 -4.104 -3.381 526 HG LEU 77 HG LEU 77 15.188 -6.121 -5.250 527 HD11 LEU 77 HD11 LEU 77 17.930 -6.211 -4.007 528 HD12 LEU 77 HD12 LEU 77 17.568 -6.001 -5.721 529 HD13 LEU 77 HD13 LEU 77 17.160 -7.514 -4.912 530 HD21 LEU 77 HD21 LEU 77 15.915 -6.258 -2.329 531 HD22 LEU 77 HD22 LEU 77 15.351 -7.621 -3.296 532 HD23 LEU 77 HD23 LEU 77 14.292 -6.237 -3.023 533 H SER 78 H SER 78 13.643 -5.317 -5.890 534 HA SER 78 HA SER 78 11.203 -3.943 -5.550 535 HB2 SER 78 HB2 SER 78 11.776 -6.871 -5.043 536 HB3 SER 78 HB3 SER 78 10.219 -6.154 -5.438 537 HG SER 78 HG SER 78 10.890 -6.816 -7.365 538 H VAL 79 H VAL 79 10.998 -2.776 -3.709 539 HA VAL 79 HA VAL 79 11.778 -3.694 -1.118 540 HB VAL 79 HB VAL 79 9.936 -1.386 -1.819 541 HG11 VAL 79 HG11 VAL 79 9.805 -2.032 0.542 542 HG12 VAL 79 HG12 VAL 79 10.578 -0.458 0.347 543 HG13 VAL 79 HG13 VAL 79 11.558 -1.887 0.679 544 HG21 VAL 79 HG21 VAL 79 12.083 -1.164 -2.954 545 HG22 VAL 79 HG22 VAL 79 12.930 -1.408 -1.423 546 HG23 VAL 79 HG23 VAL 79 11.936 0.030 -1.658 547 H ARG 80 H ARG 80 10.677 -4.834 0.318 548 HA ARG 80 HA ARG 80 8.287 -6.182 -0.450 549 HB2 ARG 80 HB2 ARG 80 8.430 -7.135 1.912 550 HB3 ARG 80 HB3 ARG 80 9.789 -7.457 0.849 551 HG2 ARG 80 HG2 ARG 80 11.144 -5.860 1.942 552 HG3 ARG 80 HG3 ARG 80 9.772 -5.198 2.825 553 HD2 ARG 80 HD2 ARG 80 10.762 -8.018 3.161 554 HD3 ARG 80 HD3 ARG 80 11.322 -6.665 4.144 555 HE ARG 80 HE ARG 80 8.614 -7.817 4.149 556 HH11 ARG 80 HH11 ARG 80 10.971 -5.591 5.544 557 HH12 ARG 80 HH12 ARG 80 10.050 -5.333 6.992 558 HH21 ARG 80 HH21 ARG 80 7.406 -7.458 6.040 559 HH22 ARG 80 HH22 ARG 80 8.021 -6.408 7.279 560 H PHE 81 H PHE 81 6.239 -5.919 0.127 561 HA PHE 81 HA PHE 81 5.585 -3.627 1.860 562 HB2 PHE 81 HB2 PHE 81 3.761 -4.956 -0.159 563 HB3 PHE 81 HB3 PHE 81 3.492 -3.431 0.672 564 HD1 PHE 81 HD2 PHE 81 5.501 -1.672 0.237 565 HD2 PHE 81 HD1 PHE 81 4.353 -4.853 -2.350 566 HE1 PHE 81 HE2 PHE 81 6.512 -0.489 -1.666 567 HE2 PHE 81 HE1 PHE 81 5.366 -3.675 -4.257 568 HZ PHE 81 HZ PHE 81 6.447 -1.491 -3.913 569 H LYS 82 H LYS 82 4.804 -4.172 3.817 570 HA LYS 82 HA LYS 82 3.377 -6.735 4.007 571 HB2 LYS 82 HB2 LYS 82 5.492 -6.618 5.370 572 HB3 LYS 82 HB3 LYS 82 4.742 -5.335 6.311 573 HG2 LYS 82 HG2 LYS 82 2.994 -6.819 7.042 574 HG3 LYS 82 HG3 LYS 82 3.599 -8.102 5.998 575 HD2 LYS 82 HD2 LYS 82 5.675 -8.177 7.306 576 HD3 LYS 82 HD3 LYS 82 5.051 -6.899 8.354 577 HE2 LYS 82 HE2 LYS 82 3.177 -8.338 8.990 578 HE3 LYS 82 HE3 LYS 82 3.806 -9.617 7.957 579 HZ1 LYS 82 HZ1 LYS 82 5.184 -8.480 10.333 580 HZ2 LYS 82 HZ2 LYS 82 5.782 -9.714 9.336 581 HZ3 LYS 82 HZ3 LYS 82 4.391 -9.976 10.266 582 H ASP 83 H ASP 83 1.366 -6.731 4.631 583 HA ASP 83 HA ASP 83 0.103 -4.148 5.096 584 HB2 ASP 83 HB2 ASP 83 -0.682 -5.769 3.290 585 HB3 ASP 83 HB3 ASP 83 -1.243 -6.809 4.591 586 H PHE 84 H PHE 84 -0.689 -3.576 6.990 587 HA PHE 84 HA PHE 84 -0.706 -5.551 9.190 588 HB2 PHE 84 HB2 PHE 84 0.004 -2.612 9.215 589 HB3 PHE 84 HB3 PHE 84 -0.241 -3.564 10.669 590 HD1 PHE 84 HD2 PHE 84 1.339 -5.388 11.216 591 HD2 PHE 84 HD1 PHE 84 2.025 -2.677 8.014 592 HE1 PHE 84 HE2 PHE 84 3.713 -6.022 11.190 593 HE2 PHE 84 HE1 PHE 84 4.397 -3.307 7.986 594 HZ PHE 84 HZ PHE 84 5.242 -4.982 9.571 595 H SER 85 H SER 85 -2.758 -4.333 7.236 596 HA SER 85 HA SER 85 -4.500 -2.659 8.570 597 HB2 SER 85 HB2 SER 85 -4.969 -4.622 6.354 598 HB3 SER 85 HB3 SER 85 -6.210 -3.505 6.932 599 HG SER 85 HG SER 85 -3.869 -3.009 5.501 600 H GLU 86 H GLU 86 -6.082 -2.852 9.949 601 HA GLU 86 HA GLU 86 -6.575 -5.510 11.123 602 HB2 GLU 86 HB2 GLU 86 -5.119 -3.870 12.417 603 HB3 GLU 86 HB3 GLU 86 -6.558 -2.881 12.589 604 HG2 GLU 86 HG2 GLU 86 -7.670 -4.692 13.801 605 HG3 GLU 86 HG3 GLU 86 -6.242 -5.707 13.601 606 H ASN 87 H ASN 87 -8.678 -5.842 11.990 607 HA ASN 87 HA ASN 87 -10.921 -5.645 12.302 608 HB2 ASN 87 HB2 ASN 87 -10.401 -2.700 11.828 609 HB3 ASN 87 HB3 ASN 87 -11.924 -3.366 12.410 610 HD21 ASN 87 HD21 ASN 87 -9.682 -1.599 13.518 611 HD22 ASN 87 HD22 ASN 87 -9.392 -2.249 15.088 612 H ALA 88 H ALA 88 -9.839 -6.262 9.741 613 HA ALA 88 HA ALA 88 -11.728 -4.987 7.882 614 HB1 ALA 88 HB1 ALA 88 -10.076 -5.409 6.122 615 HB2 ALA 88 HB2 ALA 88 -8.985 -6.111 7.319 616 HB3 ALA 88 HB3 ALA 88 -9.413 -4.401 7.408 617 H THR 89 H THR 89 -12.858 -6.225 6.500 618 HA THR 89 HA THR 89 -13.121 -9.041 6.987 619 HB THR 89 HB THR 89 -14.387 -7.209 4.926 620 HG1 THR 89 HG1 THR 89 -15.222 -8.187 7.462 621 HG21 THR 89 HG21 THR 89 -14.420 -9.529 4.128 622 HG22 THR 89 HG22 THR 89 -16.039 -8.978 4.558 623 HG23 THR 89 HG23 THR 89 -15.151 -10.045 5.648 624 H SER 90 H SER 90 -12.170 -7.043 4.180 625 HA SER 90 HA SER 90 -10.445 -9.222 3.248 626 HB2 SER 90 HB2 SER 90 -11.188 -8.692 0.902 627 HB3 SER 90 HB3 SER 90 -12.438 -9.419 1.909 628 HG SER 90 HG SER 90 -12.393 -6.994 0.686 629 H ARG 91 H ARG 91 -8.819 -8.449 1.640 630 HA ARG 91 HA ARG 91 -8.274 -5.572 1.805 631 HB2 ARG 91 HB2 ARG 91 -5.879 -6.008 2.212 632 HB3 ARG 91 HB3 ARG 91 -6.893 -6.556 3.535 633 HG2 ARG 91 HG2 ARG 91 -6.744 -8.860 2.381 634 HG3 ARG 91 HG3 ARG 91 -5.362 -8.160 1.535 635 HD2 ARG 91 HD2 ARG 91 -4.555 -9.304 3.485 636 HD3 ARG 91 HD3 ARG 91 -4.382 -7.566 3.737 637 HE ARG 91 HE ARG 91 -6.684 -9.039 4.850 638 HH11 ARG 91 HH11 ARG 91 -3.953 -6.857 5.290 639 HH12 ARG 91 HH12 ARG 91 -4.270 -6.622 6.983 640 HH21 ARG 91 HH21 ARG 91 -7.127 -8.680 7.057 641 HH22 ARG 91 HH22 ARG 91 -6.080 -7.647 7.984 642 H LEU 92 H LEU 92 -6.651 -4.848 0.183 643 HA LEU 92 HA LEU 92 -6.345 -6.438 -2.203 644 HB2 LEU 92 HB2 LEU 92 -8.803 -5.557 -2.000 645 HB3 LEU 92 HB3 LEU 92 -8.108 -4.012 -2.425 646 HG LEU 92 HG LEU 92 -7.702 -6.394 -4.214 647 HD11 LEU 92 HD11 LEU 92 -10.099 -6.248 -3.793 648 HD12 LEU 92 HD12 LEU 92 -9.718 -5.716 -5.431 649 HD13 LEU 92 HD13 LEU 92 -10.072 -4.527 -4.178 650 HD21 LEU 92 HD21 LEU 92 -6.404 -4.338 -4.646 651 HD22 LEU 92 HD22 LEU 92 -7.912 -3.429 -4.760 652 HD23 LEU 92 HD23 LEU 92 -7.550 -4.691 -5.939 653 H TRP 93 H TRP 93 -4.484 -5.755 -3.097 654 HA TRP 93 HA TRP 93 -3.503 -3.062 -2.533 655 HB2 TRP 93 HB2 TRP 93 -2.203 -5.420 -3.909 656 HB3 TRP 93 HB3 TRP 93 -1.431 -3.854 -3.703 657 HD1 TRP 93 HD1 TRP 93 -2.316 -7.028 -1.813 658 HE1 TRP 93 HE1 TRP 93 -1.146 -6.996 0.479 659 HE3 TRP 93 HE3 TRP 93 -0.580 -2.214 -1.836 660 HZ2 TRP 93 HZ2 TRP 93 0.313 -5.186 2.060 661 HZ3 TRP 93 HZ3 TRP 93 0.692 -1.419 0.113 662 HH2 TRP 93 HH2 TRP 93 1.126 -2.874 2.020 663 H MET 94 H MET 94 -3.918 -1.458 -3.868 664 HA MET 94 HA MET 94 -4.518 -2.051 -6.679 665 HB2 MET 94 HB2 MET 94 -5.118 0.363 -4.973 666 HB3 MET 94 HB3 MET 94 -5.278 0.385 -6.722 667 HG2 MET 94 HG2 MET 94 -6.893 -1.473 -6.561 668 HG3 MET 94 HG3 MET 94 -6.777 -1.383 -4.805 669 HE1 MET 94 HE1 MET 94 -9.456 -1.120 -4.701 670 HE2 MET 94 HE2 MET 94 -9.518 -1.197 -6.462 671 HE3 MET 94 HE3 MET 94 -10.338 0.109 -5.607 672 H PHE 95 H PHE 95 -2.523 -2.297 -7.546 673 HA PHE 95 HA PHE 95 -0.449 -0.342 -7.086 674 HB2 PHE 95 HB2 PHE 95 -0.584 -2.712 -8.960 675 HB3 PHE 95 HB3 PHE 95 0.837 -1.703 -8.731 676 HD1 PHE 95 HD2 PHE 95 1.532 -1.461 -6.140 677 HD2 PHE 95 HD1 PHE 95 -0.652 -4.693 -7.845 678 HE1 PHE 95 HE2 PHE 95 2.266 -2.923 -4.300 679 HE2 PHE 95 HE1 PHE 95 0.081 -6.159 -6.013 680 HZ PHE 95 HZ PHE 95 1.541 -5.278 -4.238 681 H GLY 96 H GLY 96 -2.979 -0.831 -9.372 682 HA2 GLY 96 HA2 GLY 96 -3.668 0.519 -11.135 683 HA3 GLY 96 HA3 GLY 96 -2.239 1.511 -10.895 684 H ASP 97 H ASP 97 -1.386 -1.689 -11.065 685 HA ASP 97 HA ASP 97 -0.695 -1.493 -13.906 686 HB2 ASP 97 HB2 ASP 97 1.092 -1.882 -11.545 687 HB3 ASP 97 HB3 ASP 97 1.472 -2.783 -13.010 688 H GLY 98 H GLY 98 -1.886 -3.051 -14.797 689 HA2 GLY 98 HA2 GLY 98 -2.273 -5.234 -15.465 690 HA3 GLY 98 HA3 GLY 98 -1.217 -5.782 -14.171 691 H ASN 99 H ASN 99 -2.297 -7.171 -12.974 692 HA ASN 99 HA ASN 99 -5.154 -6.978 -12.572 693 HB2 ASN 99 HB2 ASN 99 -3.102 -8.886 -11.439 694 HB3 ASN 99 HB3 ASN 99 -4.822 -8.980 -11.108 695 HD21 ASN 99 HD21 ASN 99 -2.967 -10.853 -12.334 696 HD22 ASN 99 HD22 ASN 99 -3.633 -11.250 -13.881 697 H THR 100 H THR 100 -6.125 -5.985 -10.929 698 HA THR 100 HA THR 100 -4.687 -5.559 -8.420 699 HB THR 100 HB THR 100 -6.828 -4.537 -7.623 700 HG1 THR 100 HG1 THR 100 -7.674 -4.947 -10.325 701 HG21 THR 100 HG21 THR 100 -5.766 -3.418 -10.216 702 HG22 THR 100 HG22 THR 100 -5.117 -3.111 -8.605 703 HG23 THR 100 HG23 THR 100 -6.725 -2.525 -9.035 704 H SER 101 H SER 101 -5.994 -6.272 -6.383 705 HA SER 101 HA SER 101 -6.714 -7.935 -5.032 706 HB2 SER 101 HB2 SER 101 -8.826 -7.712 -6.326 707 HB3 SER 101 HB3 SER 101 -8.248 -8.937 -7.453 708 HG SER 101 HG SER 101 -8.351 -10.463 -5.837 709 H ASP 102 H ASP 102 -4.260 -8.201 -5.876 710 HA ASP 102 HA ASP 102 -3.743 -10.863 -6.924 711 HB2 ASP 102 HB2 ASP 102 -1.390 -10.164 -6.903 712 HB3 ASP 102 HB3 ASP 102 -2.389 -8.959 -7.707 713 H SER 103 H SER 103 -1.745 -11.943 -5.703 714 HA SER 103 HA SER 103 -2.369 -12.051 -2.852 715 HB2 SER 103 HB2 SER 103 -0.538 -13.779 -4.535 716 HB3 SER 103 HB3 SER 103 -0.929 -14.055 -2.829 717 HG SER 103 HG SER 103 -3.096 -13.784 -4.518 718 HA PRO 104 HA PRO 104 0.279 -8.564 -2.136 719 HB2 PRO 104 HB2 PRO 104 0.939 -10.144 0.309 720 HB3 PRO 104 HB3 PRO 104 0.527 -8.434 0.146 721 HG2 PRO 104 HG2 PRO 104 -1.301 -10.260 0.949 722 HG3 PRO 104 HG3 PRO 104 -1.724 -8.841 -0.019 723 HD2 PRO 104 HD2 PRO 104 -1.703 -11.662 -0.777 724 HD3 PRO 104 HD3 PRO 104 -2.492 -10.285 -1.571 725 H SER 105 H SER 105 1.898 -8.711 -3.633 726 HA SER 105 HA SER 105 4.464 -9.719 -2.619 727 HB2 SER 105 HB2 SER 105 3.413 -10.134 -5.439 728 HB3 SER 105 HB3 SER 105 5.032 -10.558 -4.889 729 HG SER 105 HG SER 105 2.616 -11.620 -3.823 730 HA PRO 106 HA PRO 106 5.892 -5.817 -4.445 731 HB2 PRO 106 HB2 PRO 106 8.574 -6.806 -4.825 732 HB3 PRO 106 HB3 PRO 106 7.983 -5.702 -3.583 733 HG2 PRO 106 HG2 PRO 106 8.869 -8.246 -3.084 734 HG3 PRO 106 HG3 PRO 106 7.723 -7.371 -2.053 735 HD2 PRO 106 HD2 PRO 106 7.192 -9.472 -4.124 736 HD3 PRO 106 HD3 PRO 106 6.429 -9.241 -2.535 737 H LEU 107 H LEU 107 4.525 -7.125 -6.263 738 HA LEU 107 HA LEU 107 5.940 -7.841 -8.642 739 HB2 LEU 107 HB2 LEU 107 3.068 -6.950 -8.279 740 HB3 LEU 107 HB3 LEU 107 3.726 -7.669 -9.734 741 HG LEU 107 HG LEU 107 3.518 -9.058 -7.062 742 HD11 LEU 107 HD11 LEU 107 1.863 -9.364 -9.559 743 HD12 LEU 107 HD12 LEU 107 1.333 -8.637 -8.042 744 HD13 LEU 107 HD13 LEU 107 1.737 -10.354 -8.105 745 HD21 LEU 107 HD21 LEU 107 4.311 -10.097 -9.784 746 HD22 LEU 107 HD22 LEU 107 4.069 -11.079 -8.339 747 HD23 LEU 107 HD23 LEU 107 5.376 -9.897 -8.390 748 H HIS 108 H HIS 108 4.677 -4.895 -7.271 749 HA HIS 108 HA HIS 108 5.421 -3.275 -9.543 750 HB2 HIS 108 HB2 HIS 108 3.655 -2.864 -7.537 751 HB3 HIS 108 HB3 HIS 108 5.057 -2.050 -6.855 752 HD1 HIS 108 HD1 HIS 108 2.177 -1.249 -8.648 753 HD2 HIS 108 HD2 HIS 108 6.174 -0.237 -9.103 754 HE1 HIS 108 HE1 HIS 108 2.179 0.856 -10.017 755 HE2 HIS 108 HE2 HIS 108 4.617 1.355 -10.429 756 H THR 109 H THR 109 7.527 -3.393 -9.965 757 HA THR 109 HA THR 109 9.488 -3.647 -7.829 758 HB THR 109 HB THR 109 9.890 -3.688 -10.839 759 HG1 THR 109 HG1 THR 109 8.702 -5.467 -9.238 760 HG21 THR 109 HG21 THR 109 11.960 -4.935 -10.303 761 HG22 THR 109 HG22 THR 109 11.658 -4.666 -8.583 762 HG23 THR 109 HG23 THR 109 11.980 -3.297 -9.648 763 H PHE 110 H PHE 110 11.034 -2.177 -7.349 764 HA PHE 110 HA PHE 110 10.868 0.481 -8.517 765 HB2 PHE 110 HB2 PHE 110 12.588 -0.559 -6.237 766 HB3 PHE 110 HB3 PHE 110 12.435 1.126 -6.720 767 HD1 PHE 110 HD2 PHE 110 10.558 -1.745 -5.293 768 HD2 PHE 110 HD1 PHE 110 10.674 2.461 -5.920 769 HE1 PHE 110 HE2 PHE 110 8.658 -1.468 -3.763 770 HE2 PHE 110 HE1 PHE 110 8.773 2.737 -4.389 771 HZ PHE 110 HZ PHE 110 7.763 0.774 -3.308 772 H PHE 111 H PHE 111 11.557 -0.389 -10.587 773 HA PHE 111 HA PHE 111 14.327 -1.282 -10.824 774 HB2 PHE 111 HB2 PHE 111 13.711 -1.764 -13.204 775 HB3 PHE 111 HB3 PHE 111 12.731 -2.631 -12.034 776 HD1 PHE 111 HD1 PHE 111 10.360 -1.987 -11.692 777 HD2 PHE 111 HD2 PHE 111 12.739 -0.195 -14.729 778 HE1 PHE 111 HE1 PHE 111 8.324 -1.164 -12.796 779 HE2 PHE 111 HE2 PHE 111 10.705 0.635 -15.835 780 HZ PHE 111 HZ PHE 111 8.496 0.155 -14.867 781 H ASN 112 H ASN 112 12.271 1.379 -11.554 782 HA ASN 112 HA ASN 112 14.494 2.882 -12.764 783 HB2 ASN 112 HB2 ASN 112 12.511 2.504 -14.245 784 HB3 ASN 112 HB3 ASN 112 11.497 3.293 -13.050 785 HD21 ASN 112 HD21 ASN 112 13.985 3.739 -15.438 786 HD22 ASN 112 HD22 ASN 112 13.792 5.446 -15.606 787 H GLU 113 H GLU 113 14.711 5.106 -11.960 788 HA GLU 113 HA GLU 113 13.629 5.320 -9.264 789 HB2 GLU 113 HB2 GLU 113 15.813 6.911 -10.611 790 HB3 GLU 113 HB3 GLU 113 15.296 7.109 -8.933 791 HG2 GLU 113 HG2 GLU 113 15.847 4.768 -8.496 792 HG3 GLU 113 HG3 GLU 113 16.389 4.594 -10.158 793 H GLY 114 H GLY 114 11.690 5.885 -9.437 794 HA2 GLY 114 HA2 GLY 114 11.058 8.591 -10.405 795 HA3 GLY 114 HA3 GLY 114 10.121 7.251 -11.047 796 H GLU 115 H GLU 115 8.142 7.646 -10.205 797 HA GLU 115 HA GLU 115 7.980 7.919 -7.277 798 HB2 GLU 115 HB2 GLU 115 7.357 9.944 -8.726 799 HB3 GLU 115 HB3 GLU 115 5.940 9.008 -9.194 800 HG2 GLU 115 HG2 GLU 115 5.224 8.880 -6.876 801 HG3 GLU 115 HG3 GLU 115 6.674 9.739 -6.360 802 H TYR 116 H TYR 116 7.208 6.148 -6.423 803 HA TYR 116 HA TYR 116 5.229 4.570 -7.927 804 HB2 TYR 116 HB2 TYR 116 7.314 3.643 -5.937 805 HB3 TYR 116 HB3 TYR 116 6.075 2.610 -6.637 806 HD1 TYR 116 HD1 TYR 116 6.145 2.102 -9.067 807 HD2 TYR 116 HD2 TYR 116 9.326 4.144 -7.134 808 HE1 TYR 116 HE1 TYR 116 7.631 1.520 -10.925 809 HE2 TYR 116 HE2 TYR 116 10.828 3.566 -8.997 810 HH TYR 116 HH TYR 116 9.765 2.477 -11.941 811 H ILE 117 H ILE 117 3.300 5.074 -7.088 812 HA ILE 117 HA ILE 117 3.078 5.543 -4.214 813 HB ILE 117 HB ILE 117 0.891 5.847 -6.305 814 HG12 ILE 117 HG12 ILE 117 1.265 8.356 -5.472 815 HG13 ILE 117 HG13 ILE 117 2.899 7.763 -5.197 816 HG21 ILE 117 HG21 ILE 117 -0.302 7.069 -4.519 817 HG22 ILE 117 HG22 ILE 117 0.984 6.635 -3.388 818 HG23 ILE 117 HG23 ILE 117 -0.023 5.375 -4.108 819 HD11 ILE 117 HD11 ILE 117 3.078 7.145 -7.544 820 HD12 ILE 117 HD12 ILE 117 2.677 8.853 -7.364 821 HD13 ILE 117 HD13 ILE 117 1.426 7.698 -7.826 822 H VAL 118 H VAL 118 2.570 3.974 -2.907 823 HA VAL 118 HA VAL 118 1.435 1.506 -3.994 824 HB VAL 118 HB VAL 118 2.656 1.985 -1.260 825 HG11 VAL 118 HG11 VAL 118 1.990 -0.585 -2.692 826 HG12 VAL 118 HG12 VAL 118 1.125 0.086 -1.307 827 HG13 VAL 118 HG13 VAL 118 2.795 -0.452 -1.128 828 HG21 VAL 118 HG21 VAL 118 4.322 2.318 -3.006 829 HG22 VAL 118 HG22 VAL 118 3.902 0.761 -3.720 830 HG23 VAL 118 HG23 VAL 118 4.637 0.828 -2.117 831 H SER 119 H SER 119 -0.674 1.124 -3.732 832 HA SER 119 HA SER 119 -2.081 2.610 -1.631 833 HB2 SER 119 HB2 SER 119 -2.672 3.326 -3.939 834 HB3 SER 119 HB3 SER 119 -3.194 1.681 -4.284 835 HG SER 119 HG SER 119 -4.343 3.578 -2.539 836 H LEU 120 H LEU 120 -3.160 1.538 -0.202 837 HA LEU 120 HA LEU 120 -3.858 -1.291 -0.638 838 HB2 LEU 120 HB2 LEU 120 -2.036 -0.919 1.040 839 HB3 LEU 120 HB3 LEU 120 -3.121 0.085 1.965 840 HG LEU 120 HG LEU 120 -2.689 -2.271 2.831 841 HD11 LEU 120 HD11 LEU 120 -4.959 -2.625 3.571 842 HD12 LEU 120 HD12 LEU 120 -5.541 -1.465 2.376 843 HD13 LEU 120 HD13 LEU 120 -4.489 -0.929 3.687 844 HD21 LEU 120 HD21 LEU 120 -4.535 -3.015 0.565 845 HD22 LEU 120 HD22 LEU 120 -4.035 -4.072 1.887 846 HD23 LEU 120 HD23 LEU 120 -2.842 -3.482 0.729 847 H ILE 121 H ILE 121 -5.988 -1.681 -0.543 848 HA ILE 121 HA ILE 121 -7.653 0.162 1.013 849 HB ILE 121 HB ILE 121 -8.180 0.668 -1.272 850 HG12 ILE 121 HG12 ILE 121 -10.307 -1.113 -0.075 851 HG13 ILE 121 HG13 ILE 121 -10.076 0.589 0.261 852 HG21 ILE 121 HG21 ILE 121 -8.600 -2.283 -1.732 853 HG22 ILE 121 HG22 ILE 121 -7.300 -1.288 -2.386 854 HG23 ILE 121 HG23 ILE 121 -8.965 -1.005 -2.894 855 HD11 ILE 121 HD11 ILE 121 -10.680 1.128 -2.035 856 HD12 ILE 121 HD12 ILE 121 -11.955 0.225 -1.218 857 HD13 ILE 121 HD13 ILE 121 -10.905 -0.587 -2.379 858 H VAL 122 H VAL 122 -8.812 -0.770 2.551 859 HA VAL 122 HA VAL 122 -9.272 -3.666 2.353 860 HB VAL 122 HB VAL 122 -9.560 -3.596 4.906 861 HG11 VAL 122 HG11 VAL 122 -7.742 -4.739 3.795 862 HG12 VAL 122 HG12 VAL 122 -7.156 -3.933 5.250 863 HG13 VAL 122 HG13 VAL 122 -6.842 -3.228 3.663 864 HG21 VAL 122 HG21 VAL 122 -9.552 -1.177 5.222 865 HG22 VAL 122 HG22 VAL 122 -7.919 -1.085 4.562 866 HG23 VAL 122 HG23 VAL 122 -8.207 -1.926 6.085 867 H SER 123 H SER 123 -11.258 -4.470 3.108 868 HA SER 123 HA SER 123 -13.382 -2.446 3.030 869 HB2 SER 123 HB2 SER 123 -13.406 -5.109 1.584 870 HB3 SER 123 HB3 SER 123 -14.695 -3.904 1.575 871 HG SER 123 HG SER 123 -12.122 -3.133 0.789 872 H ASN 124 H ASN 124 -15.264 -2.985 4.102 873 HA ASN 124 HA ASN 124 -15.405 -5.409 5.727 874 HB2 ASN 124 HB2 ASN 124 -14.238 -3.548 7.040 875 HB3 ASN 124 HB3 ASN 124 -15.712 -2.617 6.889 876 HD21 ASN 124 HD21 ASN 124 -14.165 -5.310 8.444 877 HD22 ASN 124 HD22 ASN 124 -15.356 -5.540 9.676 878 H GLU 125 H GLU 125 -17.804 -5.182 6.888 879 HA GLU 125 HA GLU 125 -19.592 -4.581 4.691 880 HB2 GLU 125 HB2 GLU 125 -21.358 -5.487 6.188 881 HB3 GLU 125 HB3 GLU 125 -20.033 -6.601 5.896 882 HG2 GLU 125 HG2 GLU 125 -19.100 -6.081 8.097 883 HG3 GLU 125 HG3 GLU 125 -20.411 -4.931 8.375 884 H ASN 126 H ASN 126 -18.339 -2.871 7.313 885 HA ASN 126 HA ASN 126 -20.605 -1.045 7.552 886 HB2 ASN 126 HB2 ASN 126 -17.864 -1.030 8.842 887 HB3 ASN 126 HB3 ASN 126 -19.116 0.161 9.168 888 HD21 ASN 126 HD21 ASN 126 -17.708 -1.858 10.823 889 HD22 ASN 126 HD22 ASN 126 -18.966 -2.746 11.601 890 H ASP 127 H ASP 127 -17.153 -0.768 6.785 891 HA ASP 127 HA ASP 127 -17.702 1.422 4.932 892 HB2 ASP 127 HB2 ASP 127 -15.825 1.632 7.302 893 HB3 ASP 127 HB3 ASP 127 -15.794 2.741 5.941 894 H SER 128 H SER 128 -15.605 2.076 3.795 895 HA SER 128 HA SER 128 -13.630 -0.091 3.797 896 HB2 SER 128 HB2 SER 128 -13.234 0.553 1.351 897 HB3 SER 128 HB3 SER 128 -14.713 -0.339 1.702 898 HG SER 128 HG SER 128 -14.361 2.278 0.851 899 H ASP 129 H ASP 129 -11.557 0.522 3.994 900 HA ASP 129 HA ASP 129 -11.057 3.408 4.347 901 HB2 ASP 129 HB2 ASP 129 -11.237 1.890 6.461 902 HB3 ASP 129 HB3 ASP 129 -9.678 1.257 5.950 903 H SER 130 H SER 130 -9.232 4.170 3.306 904 HA SER 130 HA SER 130 -7.459 2.146 2.136 905 HB2 SER 130 HB2 SER 130 -8.374 4.564 0.584 906 HB3 SER 130 HB3 SER 130 -7.583 3.106 -0.014 907 HG SER 130 HG SER 130 -9.707 2.188 1.057 908 H ALA 131 H ALA 131 -5.359 2.648 2.019 909 HA ALA 131 HA ALA 131 -4.473 5.359 2.726 910 HB1 ALA 131 HB1 ALA 131 -4.265 3.944 4.744 911 HB2 ALA 131 HB2 ALA 131 -2.695 4.463 4.129 912 HB3 ALA 131 HB3 ALA 131 -3.261 2.820 3.829 913 H SER 132 H SER 132 -3.001 6.148 1.539 914 HA SER 132 HA SER 132 -1.459 4.389 -0.227 915 HB2 SER 132 HB2 SER 132 -2.761 7.038 -0.921 916 HB3 SER 132 HB3 SER 132 -1.695 6.126 -1.966 917 HG SER 132 HG SER 132 -4.312 5.539 -1.161 918 H VAL 133 H VAL 133 0.671 5.065 -0.601 919 HA VAL 133 HA VAL 133 1.496 7.564 0.623 920 HB VAL 133 HB VAL 133 1.817 5.906 2.410 921 HG11 VAL 133 HG11 VAL 133 3.705 4.528 0.519 922 HG12 VAL 133 HG12 VAL 133 2.175 3.897 1.132 923 HG13 VAL 133 HG13 VAL 133 3.525 4.164 2.236 924 HG21 VAL 133 HG21 VAL 133 4.411 6.950 1.280 925 HG22 VAL 133 HG22 VAL 133 4.166 6.383 2.933 926 HG23 VAL 133 HG23 VAL 133 3.308 7.812 2.354 927 H THR 134 H THR 134 3.007 8.592 -0.462 928 HA THR 134 HA THR 134 3.827 7.598 -3.035 929 HB THR 134 HB THR 134 4.476 10.200 -1.623 930 HG1 THR 134 HG1 THR 134 2.224 9.272 -2.896 931 HG21 THR 134 HG21 THR 134 4.672 9.458 -4.545 932 HG22 THR 134 HG22 THR 134 6.025 9.751 -3.453 933 HG23 THR 134 HG23 THR 134 4.932 11.070 -3.877 934 H ILE 135 H ILE 135 5.452 6.154 -3.065 935 HA ILE 135 HA ILE 135 7.683 6.420 -1.205 936 HB ILE 135 HB ILE 135 7.370 4.323 -3.367 937 HG12 ILE 135 HG12 ILE 135 5.412 4.198 -1.888 938 HG13 ILE 135 HG13 ILE 135 6.466 2.808 -1.653 939 HG21 ILE 135 HG21 ILE 135 9.003 4.353 -0.830 940 HG22 ILE 135 HG22 ILE 135 9.620 4.576 -2.468 941 HG23 ILE 135 HG23 ILE 135 8.921 3.027 -1.992 942 HD11 ILE 135 HD11 ILE 135 6.307 5.215 0.149 943 HD12 ILE 135 HD12 ILE 135 7.323 3.794 0.401 944 HD13 ILE 135 HD13 ILE 135 5.566 3.644 0.450 945 H ARG 136 H ARG 136 9.538 7.319 -1.748 946 HA ARG 136 HA ARG 136 9.616 8.570 -4.388 947 HB2 ARG 136 HB2 ARG 136 11.066 9.301 -1.832 948 HB3 ARG 136 HB3 ARG 136 11.089 10.222 -3.331 949 HG2 ARG 136 HG2 ARG 136 8.957 11.013 -3.039 950 HG3 ARG 136 HG3 ARG 136 8.470 9.641 -2.041 951 HD2 ARG 136 HD2 ARG 136 9.976 10.496 -0.254 952 HD3 ARG 136 HD3 ARG 136 10.260 11.930 -1.241 953 HE ARG 136 HE ARG 136 7.996 12.566 -0.915 954 HH11 ARG 136 HH11 ARG 136 8.907 9.713 0.949 955 HH12 ARG 136 HH12 ARG 136 7.607 9.891 2.091 956 HH21 ARG 136 HH21 ARG 136 6.291 12.791 0.596 957 HH22 ARG 136 HH22 ARG 136 6.131 11.639 1.889 958 H ALA 137 H ALA 137 10.929 7.693 -5.798 959 HA ALA 137 HA ALA 137 13.442 6.504 -4.836 960 HB1 ALA 137 HB1 ALA 137 11.918 5.911 -7.379 961 HB2 ALA 137 HB2 ALA 137 12.029 4.857 -5.970 962 HB3 ALA 137 HB3 ALA 137 13.470 5.205 -6.929 963 H LEU 138 H LEU 138 15.043 7.898 -5.111 964 HA LEU 138 HA LEU 138 14.797 9.799 -7.309 965 HB2 LEU 138 HB2 LEU 138 16.002 11.418 -5.771 966 HB3 LEU 138 HB3 LEU 138 14.284 11.166 -5.603 967 HG LEU 138 HG LEU 138 14.812 9.633 -3.656 968 HD11 LEU 138 HD11 LEU 138 17.207 9.246 -4.077 969 HD12 LEU 138 HD12 LEU 138 16.939 10.005 -2.507 970 HD13 LEU 138 HD13 LEU 138 17.516 10.970 -3.866 971 HD21 LEU 138 HD21 LEU 138 15.608 12.505 -3.568 972 HD22 LEU 138 HD22 LEU 138 15.011 11.543 -2.209 973 HD23 LEU 138 HD23 LEU 138 13.960 11.891 -3.587 974 H GLU 139 H GLU 139 16.826 11.047 -7.628 975 HA GLU 139 HA GLU 139 19.027 9.300 -8.047 976 HB2 GLU 139 HB2 GLU 139 20.160 11.493 -8.756 977 HB3 GLU 139 HB3 GLU 139 18.770 10.978 -9.704 978 HG2 GLU 139 HG2 GLU 139 17.361 12.597 -8.686 979 HG3 GLU 139 HG3 GLU 139 18.546 12.938 -7.430 980 H HIS 140 H HIS 140 20.645 8.871 -6.674 981 HA HIS 140 HA HIS 140 21.069 10.476 -4.326 982 HB2 HIS 140 HB2 HIS 140 21.695 8.047 -4.398 983 HB3 HIS 140 HB3 HIS 140 22.944 8.430 -5.581 984 HD1 HIS 140 HD1 HIS 140 25.133 9.361 -4.705 985 HD2 HIS 140 HD2 HIS 140 22.202 9.023 -1.764 986 HE1 HIS 140 HE1 HIS 140 26.292 9.893 -2.527 987 HE2 HIS 140 HE2 HIS 140 24.484 9.790 -0.767 988 H HIS 141 H HIS 141 22.153 12.301 -4.254 989 HA HIS 141 HA HIS 141 22.973 13.483 -6.731 990 HB2 HIS 141 HB2 HIS 141 22.902 14.543 -3.906 991 HB3 HIS 141 HB3 HIS 141 23.508 15.493 -5.258 992 HD1 HIS 141 HD1 HIS 141 21.793 17.049 -6.105 993 HD2 HIS 141 HD2 HIS 141 20.088 13.554 -4.644 994 HE1 HIS 141 HE1 HIS 141 19.313 17.327 -6.423 995 HE2 HIS 141 HE2 HIS 141 18.302 15.319 -5.270 996 H HIS 142 H HIS 142 24.743 12.810 -7.594 997 HA HIS 142 HA HIS 142 27.138 12.370 -6.003 998 HB2 HIS 142 HB2 HIS 142 28.123 11.428 -8.053 999 HB3 HIS 142 HB3 HIS 142 26.602 10.654 -7.646 1000 HD1 HIS 142 HD1 HIS 142 28.372 12.288 -10.383 1001 HD2 HIS 142 HD2 HIS 142 24.409 11.475 -9.407 1002 HE1 HIS 142 HE1 HIS 142 27.071 12.596 -12.516 1003 HE2 HIS 142 HE2 HIS 142 24.659 12.300 -11.851 1004 H HIS 143 H HIS 143 29.199 13.334 -6.636 1005 HA HIS 143 HA HIS 143 28.749 16.096 -7.567 1006 HB2 HIS 143 HB2 HIS 143 30.516 15.208 -5.275 1007 HB3 HIS 143 HB3 HIS 143 30.391 16.855 -5.874 1008 HD1 HIS 143 HD1 HIS 143 28.324 18.215 -5.155 1009 HD2 HIS 143 HD2 HIS 143 28.333 14.306 -3.727 1010 HE1 HIS 143 HE1 HIS 143 26.488 18.113 -3.432 1011 HE2 HIS 143 HE2 HIS 143 26.391 15.701 -2.721 1012 H HIS 144 H HIS 144 30.270 17.013 -8.861 1013 HA HIS 144 HA HIS 144 32.066 15.191 -10.186 1014 HB2 HIS 144 HB2 HIS 144 30.784 16.822 -11.490 1015 HB3 HIS 144 HB3 HIS 144 31.564 18.144 -10.637 1016 HD1 HIS 144 HD1 HIS 144 32.332 15.424 -13.151 1017 HD2 HIS 144 HD2 HIS 144 33.983 18.952 -11.681 1018 HE1 HIS 144 HE1 HIS 144 34.342 15.893 -14.602 1019 HE2 HIS 144 HE2 HIS 144 35.445 17.907 -13.552 1020 H HIS 145 H HIS 145 34.021 14.774 -9.522 1021 HA HIS 145 HA HIS 145 35.659 16.980 -8.456 1022 HB2 HIS 145 HB2 HIS 145 35.204 15.201 -6.751 1023 HB3 HIS 145 HB3 HIS 145 35.959 14.026 -7.816 1024 HD1 HIS 145 HD1 HIS 145 36.847 17.109 -5.791 1025 HD2 HIS 145 HD2 HIS 145 38.679 13.804 -7.539 1026 HE1 HIS 145 HE1 HIS 145 39.236 17.157 -4.995 1027 HE2 HIS 145 HE2 HIS 145 40.363 15.240 -6.192 Start of MODEL 17 1 H1 MET 1 H1 MET 1 108.493 -11.095 110.559 2 H2 MET 1 H2 MET 1 109.978 -11.794 110.975 3 H3 MET 1 H3 MET 1 108.818 -12.704 110.135 4 HA MET 1 HA MET 1 110.244 -10.324 109.108 5 HB2 MET 1 HB2 MET 1 110.434 -13.239 108.318 6 HB3 MET 1 HB3 MET 1 111.270 -11.912 107.526 7 HG2 MET 1 HG2 MET 1 111.682 -12.849 110.355 8 HG3 MET 1 HG3 MET 1 112.763 -13.125 108.987 9 HE1 MET 1 HE1 MET 1 113.598 -11.854 111.837 10 HE2 MET 1 HE2 MET 1 114.709 -10.595 111.296 11 HE3 MET 1 HE3 MET 1 114.740 -12.188 110.536 12 H ASN 2 H ASN 2 109.724 -9.707 107.037 13 HA ASN 2 HA ASN 2 108.600 -9.378 105.115 14 HB2 ASN 2 HB2 ASN 2 107.424 -12.144 105.491 15 HB3 ASN 2 HB3 ASN 2 107.382 -11.198 104.011 16 HD21 ASN 2 HD21 ASN 2 108.490 -13.846 104.580 17 HD22 ASN 2 HD22 ASN 2 110.155 -13.771 104.099 18 H ALA 3 H ALA 3 107.391 -7.673 105.966 19 HA ALA 3 HA ALA 3 104.555 -8.361 106.417 20 HB1 ALA 3 HB1 ALA 3 105.955 -5.768 107.078 21 HB2 ALA 3 HB2 ALA 3 105.533 -7.032 108.236 22 HB3 ALA 3 HB3 ALA 3 104.262 -6.147 107.391 23 H ARG 4 H ARG 4 103.664 -8.481 104.477 24 HA ARG 4 HA ARG 4 104.562 -6.641 102.364 25 HB2 ARG 4 HB2 ARG 4 103.220 -9.344 102.280 26 HB3 ARG 4 HB3 ARG 4 103.410 -8.338 100.849 27 HG2 ARG 4 HG2 ARG 4 105.709 -9.231 102.577 28 HG3 ARG 4 HG3 ARG 4 105.157 -10.095 101.138 29 HD2 ARG 4 HD2 ARG 4 105.723 -8.299 99.719 30 HD3 ARG 4 HD3 ARG 4 105.903 -7.185 101.072 31 HE ARG 4 HE ARG 4 107.806 -9.072 101.534 32 HH11 ARG 4 HH11 ARG 4 107.075 -7.071 98.730 33 HH12 ARG 4 HH12 ARG 4 108.737 -6.937 98.249 34 HH21 ARG 4 HH21 ARG 4 109.976 -8.857 100.903 35 HH22 ARG 4 HH22 ARG 4 110.377 -7.943 99.481 36 H ASP 5 H ASP 5 102.380 -6.293 104.539 37 HA ASP 5 HA ASP 5 99.974 -5.851 103.003 38 HB2 ASP 5 HB2 ASP 5 100.723 -5.084 105.837 39 HB3 ASP 5 HB3 ASP 5 99.138 -4.794 105.126 40 H ASN 6 H ASN 6 99.443 -4.068 101.944 41 HA ASN 6 HA ASN 6 101.327 -1.815 102.048 42 HB2 ASN 6 HB2 ASN 6 99.295 -2.528 99.909 43 HB3 ASN 6 HB3 ASN 6 100.426 -1.177 99.842 44 HD21 ASN 6 HD21 ASN 6 99.998 -4.571 99.491 45 HD22 ASN 6 HD22 ASN 6 101.583 -4.918 98.879 46 H LYS 7 H LYS 7 100.699 0.234 102.471 47 HA LYS 7 HA LYS 7 97.973 0.570 103.479 48 HB2 LYS 7 HB2 LYS 7 100.435 2.298 103.821 49 HB3 LYS 7 HB3 LYS 7 98.856 2.688 104.481 50 HG2 LYS 7 HG2 LYS 7 100.413 0.204 105.194 51 HG3 LYS 7 HG3 LYS 7 100.477 1.706 106.112 52 HD2 LYS 7 HD2 LYS 7 98.868 0.619 107.313 53 HD3 LYS 7 HD3 LYS 7 97.833 1.378 106.105 54 HE2 LYS 7 HE2 LYS 7 98.006 -0.742 104.770 55 HE3 LYS 7 HE3 LYS 7 98.839 -1.467 106.147 56 HZ1 LYS 7 HZ1 LYS 7 96.089 -0.353 106.161 57 HZ2 LYS 7 HZ2 LYS 7 96.880 -1.019 107.503 58 HZ3 LYS 7 HZ3 LYS 7 96.498 -1.998 106.172 59 H PHE 8 H PHE 8 96.801 0.808 101.656 60 HA PHE 8 HA PHE 8 97.303 3.244 100.096 61 HB2 PHE 8 HB2 PHE 8 96.419 2.104 98.088 62 HB3 PHE 8 HB3 PHE 8 97.875 1.331 98.691 63 HD1 PHE 8 HD2 PHE 8 97.739 -0.887 99.774 64 HD2 PHE 8 HD1 PHE 8 94.323 0.948 98.021 65 HE1 PHE 8 HE2 PHE 8 96.576 -3.049 99.779 66 HE2 PHE 8 HE1 PHE 8 93.156 -1.212 98.022 67 HZ PHE 8 HZ PHE 8 94.282 -3.215 98.904 68 H ASN 9 H ASN 9 95.495 4.403 99.416 69 HA ASN 9 HA ASN 9 92.823 3.498 99.937 70 HB2 ASN 9 HB2 ASN 9 93.564 4.219 102.233 71 HB3 ASN 9 HB3 ASN 9 93.818 5.839 101.604 72 HD21 ASN 9 HD21 ASN 9 92.050 7.119 101.108 73 HD22 ASN 9 HD22 ASN 9 90.450 6.739 101.644 74 H THR 10 H THR 10 92.006 4.123 98.020 75 HA THR 10 HA THR 10 91.926 6.970 97.502 76 HB THR 10 HB THR 10 93.827 6.388 96.167 77 HG1 THR 10 HG1 THR 10 92.148 6.446 94.029 78 HG21 THR 10 HG21 THR 10 93.789 4.750 94.359 79 HG22 THR 10 HG22 THR 10 92.158 4.265 94.820 80 HG23 THR 10 HG23 THR 10 93.505 3.980 95.922 81 H TRP 11 H TRP 11 89.913 7.501 97.369 82 HA TRP 11 HA TRP 11 87.980 5.711 96.029 83 HB2 TRP 11 HB2 TRP 11 87.520 7.215 98.630 84 HB3 TRP 11 HB3 TRP 11 86.312 6.280 97.762 85 HD1 TRP 11 HD1 TRP 11 88.747 5.969 100.500 86 HE1 TRP 11 HE1 TRP 11 89.083 3.500 101.149 87 HE3 TRP 11 HE3 TRP 11 86.504 3.763 96.472 88 HZ2 TRP 11 HZ2 TRP 11 88.486 0.956 100.080 89 HZ3 TRP 11 HZ3 TRP 11 86.440 1.316 96.356 90 HH2 TRP 11 HH2 TRP 11 87.409 -0.063 98.122 91 H ASN 12 H ASN 12 87.062 6.780 94.383 92 HA ASN 12 HA ASN 12 86.533 9.667 94.676 93 HB2 ASN 12 HB2 ASN 12 87.606 8.321 92.178 94 HB3 ASN 12 HB3 ASN 12 87.098 10.002 92.281 95 HD21 ASN 12 HD21 ASN 12 88.408 11.480 93.326 96 HD22 ASN 12 HD22 ASN 12 90.053 11.135 93.733 97 H ASP 13 H ASP 13 84.600 10.385 93.879 98 HA ASP 13 HA ASP 13 82.986 8.644 92.177 99 HB2 ASP 13 HB2 ASP 13 82.445 8.067 94.599 100 HB3 ASP 13 HB3 ASP 13 81.851 9.716 94.779 101 H SER 14 H SER 14 81.963 9.827 90.690 102 HA SER 14 HA SER 14 81.239 12.602 91.286 103 HB2 SER 14 HB2 SER 14 83.459 12.581 90.082 104 HB3 SER 14 HB3 SER 14 82.647 11.790 88.730 105 HG SER 14 HG SER 14 82.385 13.797 88.131 106 H ARG 15 H ARG 15 79.146 12.761 90.918 107 HA ARG 15 HA ARG 15 78.064 11.613 88.472 108 HB2 ARG 15 HB2 ARG 15 77.611 9.922 90.196 109 HB3 ARG 15 HB3 ARG 15 76.846 11.136 91.208 110 HG2 ARG 15 HG2 ARG 15 75.196 9.728 90.106 111 HG3 ARG 15 HG3 ARG 15 75.057 11.404 89.574 112 HD2 ARG 15 HD2 ARG 15 76.441 10.760 87.571 113 HD3 ARG 15 HD3 ARG 15 76.271 9.081 88.084 114 HE ARG 15 HE ARG 15 73.722 9.910 88.004 115 HH11 ARG 15 HH11 ARG 15 76.315 10.128 85.629 116 HH12 ARG 15 HH12 ARG 15 75.233 10.156 84.276 117 HH21 ARG 15 HH21 ARG 15 72.337 9.937 86.220 118 HH22 ARG 15 HH22 ARG 15 72.978 10.037 84.614 119 H GLY 16 H GLY 16 77.197 13.234 87.406 120 HA2 GLY 16 HA2 GLY 16 75.185 14.907 88.586 121 HA3 GLY 16 HA3 GLY 16 76.679 15.777 88.276 122 H ASN 17 H ASN 17 74.000 14.077 86.850 123 HA ASN 17 HA ASN 17 74.453 15.624 84.411 124 HB2 ASN 17 HB2 ASN 17 75.208 13.330 83.912 125 HB3 ASN 17 HB3 ASN 17 73.660 12.697 84.459 126 HD21 ASN 17 HD21 ASN 17 75.235 14.630 81.984 127 HD22 ASN 17 HD22 ASN 17 74.009 14.415 80.782 128 H TYR 18 H TYR 18 72.887 17.022 84.491 129 HA TYR 18 HA TYR 18 70.158 16.101 85.131 130 HB2 TYR 18 HB2 TYR 18 71.313 18.818 85.828 131 HB3 TYR 18 HB3 TYR 18 69.720 18.208 86.255 132 HD1 TYR 18 HD2 TYR 18 69.690 16.053 87.735 133 HD2 TYR 18 HD1 TYR 18 73.061 18.620 87.339 134 HE1 TYR 18 HE2 TYR 18 70.598 15.175 89.847 135 HE2 TYR 18 HE1 TYR 18 73.980 17.744 89.446 136 HH TYR 18 HH TYR 18 72.808 14.935 90.928 137 H TRP 19 H TRP 19 68.630 16.670 83.699 138 HA TRP 19 HA TRP 19 69.247 18.613 81.620 139 HB2 TRP 19 HB2 TRP 19 68.630 16.939 79.835 140 HB3 TRP 19 HB3 TRP 19 70.174 16.656 80.624 141 HD1 TRP 19 HD1 TRP 19 70.233 14.562 82.421 142 HE1 TRP 19 HE1 TRP 19 68.922 12.353 82.404 143 HE3 TRP 19 HE3 TRP 19 66.473 15.865 79.208 144 HZ2 TRP 19 HZ2 TRP 19 66.613 11.296 81.189 145 HZ3 TRP 19 HZ3 TRP 19 64.758 14.190 78.670 146 HH2 TRP 19 HH2 TRP 19 64.826 11.954 79.639 147 H SER 20 H SER 20 67.446 19.445 80.544 148 HA SER 20 HA SER 20 64.802 18.501 81.378 149 HB2 SER 20 HB2 SER 20 65.759 21.365 81.665 150 HB3 SER 20 HB3 SER 20 64.092 20.833 81.889 151 HG SER 20 HG SER 20 65.646 19.275 83.373 152 H ASP 21 H ASP 21 63.329 18.576 79.791 153 HA ASP 21 HA ASP 21 63.859 20.240 77.414 154 HB2 ASP 21 HB2 ASP 21 62.850 17.377 77.414 155 HB3 ASP 21 HB3 ASP 21 62.861 18.432 76.005 156 H TYR 22 H TYR 22 61.888 20.647 76.114 157 HA TYR 22 HA TYR 22 59.419 20.491 77.677 158 HB2 TYR 22 HB2 TYR 22 58.841 22.814 76.864 159 HB3 TYR 22 HB3 TYR 22 60.123 22.724 78.051 160 HD1 TYR 22 HD1 TYR 22 62.493 23.158 77.354 161 HD2 TYR 22 HD2 TYR 22 59.217 23.725 74.692 162 HE1 TYR 22 HE1 TYR 22 63.912 24.535 75.902 163 HE2 TYR 22 HE2 TYR 22 60.639 25.096 73.236 164 HH TYR 22 HH TYR 22 62.671 26.485 73.450 165 H GLU 23 H GLU 23 57.916 19.473 76.679 166 HA GLU 23 HA GLU 23 57.774 19.563 73.736 167 HB2 GLU 23 HB2 GLU 23 57.227 17.178 75.522 168 HB3 GLU 23 HB3 GLU 23 57.008 17.215 73.784 169 HG2 GLU 23 HG2 GLU 23 59.667 17.556 75.165 170 HG3 GLU 23 HG3 GLU 23 59.056 16.026 74.540 171 H GLY 24 H GLY 24 55.887 20.268 73.000 172 HA2 GLY 24 HA2 GLY 24 53.391 19.318 73.721 173 HA3 GLY 24 HA3 GLY 24 53.651 20.727 74.731 174 H SER 25 H SER 25 52.472 19.632 71.812 175 HA SER 25 HA SER 25 52.151 22.389 70.868 176 HB2 SER 25 HB2 SER 25 53.082 20.106 69.099 177 HB3 SER 25 HB3 SER 25 52.563 21.686 68.511 178 HG SER 25 HG SER 25 54.455 21.793 70.502 179 H ASP 26 H ASP 26 50.154 22.825 69.978 180 HA ASP 26 HA ASP 26 48.502 20.571 69.136 181 HB2 ASP 26 HB2 ASP 26 46.549 21.261 70.327 182 HB3 ASP 26 HB3 ASP 26 47.849 21.168 71.502 183 H GLU 27 H GLU 27 47.316 20.950 67.366 184 HA GLU 27 HA GLU 27 47.226 23.719 66.351 185 HB2 GLU 27 HB2 GLU 27 47.207 21.107 64.817 186 HB3 GLU 27 HB3 GLU 27 46.799 22.651 64.087 187 HG2 GLU 27 HG2 GLU 27 49.015 22.275 63.479 188 HG3 GLU 27 HG3 GLU 27 49.122 23.416 64.814 189 H ASN 28 H ASN 28 45.310 24.555 66.888 190 HA ASN 28 HA ASN 28 42.962 22.828 67.018 191 HB2 ASN 28 HB2 ASN 28 43.524 24.547 68.799 192 HB3 ASN 28 HB3 ASN 28 43.082 25.783 67.622 193 HD21 ASN 28 HD21 ASN 28 41.936 23.080 69.499 194 HD22 ASN 28 HD22 ASN 28 40.259 23.489 69.421 195 H GLY 29 H GLY 29 41.385 22.783 65.568 196 HA2 GLY 29 HA2 GLY 29 40.783 24.955 63.799 197 HA3 GLY 29 HA3 GLY 29 41.631 23.654 62.974 198 H ASP 30 H ASP 30 38.816 24.737 62.846 199 HA ASP 30 HA ASP 30 37.491 22.159 62.687 200 HB2 ASP 30 HB2 ASP 30 37.024 22.879 65.006 201 HB3 ASP 30 HB3 ASP 30 36.391 24.404 64.406 202 H GLY 31 H GLY 31 36.138 22.100 60.983 203 HA2 GLY 31 HA2 GLY 31 35.689 24.629 59.539 204 HA3 GLY 31 HA3 GLY 31 35.759 23.041 58.794 205 H ILE 32 H ILE 32 33.731 25.444 59.492 206 HA ILE 32 HA ILE 32 31.443 23.726 60.176 207 HB ILE 32 HB ILE 32 31.530 26.775 60.161 208 HG12 ILE 32 HG12 ILE 32 31.200 26.221 62.765 209 HG13 ILE 32 HG13 ILE 32 32.143 24.806 62.317 210 HG21 ILE 32 HG21 ILE 32 29.459 24.873 61.257 211 HG22 ILE 32 HG22 ILE 32 29.290 25.885 59.821 212 HG23 ILE 32 HG23 ILE 32 29.430 26.629 61.414 213 HD11 ILE 32 HD11 ILE 32 33.549 26.585 63.191 214 HD12 ILE 32 HD12 ILE 32 32.984 27.676 61.925 215 HD13 ILE 32 HD13 ILE 32 33.929 26.246 61.504 216 H GLY 33 H GLY 33 30.149 23.088 58.568 217 HA2 GLY 33 HA2 GLY 33 29.902 24.804 56.178 218 HA3 GLY 33 HA3 GLY 33 30.133 23.069 56.025 219 H ASP 34 H ASP 34 27.909 24.987 55.274 220 HA ASP 34 HA ASP 34 25.695 23.838 56.857 221 HB2 ASP 34 HB2 ASP 34 25.840 26.326 55.138 222 HB3 ASP 34 HB3 ASP 34 24.323 25.668 55.749 223 H SER 35 H SER 35 24.307 22.460 55.959 224 HA SER 35 HA SER 35 24.014 22.394 53.029 225 HB2 SER 35 HB2 SER 35 24.212 19.976 54.851 226 HB3 SER 35 HB3 SER 35 23.797 19.917 53.139 227 HG SER 35 HG SER 35 26.012 21.320 53.324 228 H ALA 36 H ALA 36 22.033 23.126 52.700 229 HA ALA 36 HA ALA 36 19.782 21.897 54.101 230 HB1 ALA 36 HB1 ALA 36 18.737 24.059 54.565 231 HB2 ALA 36 HB2 ALA 36 20.160 24.890 53.932 232 HB3 ALA 36 HB3 ALA 36 20.285 23.911 55.395 233 H TYR 37 H TYR 37 17.755 22.219 52.998 234 HA TYR 37 HA TYR 37 17.935 23.210 50.265 235 HB2 TYR 37 HB2 TYR 37 16.900 21.136 49.349 236 HB3 TYR 37 HB3 TYR 37 18.532 20.906 49.938 237 HD1 TYR 37 HD1 TYR 37 14.991 20.084 50.471 238 HD2 TYR 37 HD2 TYR 37 18.969 19.487 51.856 239 HE1 TYR 37 HE1 TYR 37 14.234 18.175 51.812 240 HE2 TYR 37 HE2 TYR 37 18.218 17.577 53.202 241 HH TYR 37 HH TYR 37 15.165 16.134 52.795 242 H ALA 38 H ALA 38 15.965 23.705 49.295 243 HA ALA 38 HA ALA 38 13.624 23.614 51.084 244 HB1 ALA 38 HB1 ALA 38 12.834 25.667 50.018 245 HB2 ALA 38 HB2 ALA 38 14.286 25.711 49.018 246 HB3 ALA 38 HB3 ALA 38 14.413 25.905 50.768 247 H VAL 39 H VAL 39 12.729 21.756 50.335 248 HA VAL 39 HA VAL 39 11.978 21.687 47.483 249 HB VAL 39 HB VAL 39 12.644 19.318 49.270 250 HG11 VAL 39 HG11 VAL 39 11.811 19.327 46.370 251 HG12 VAL 39 HG12 VAL 39 10.847 18.738 47.724 252 HG13 VAL 39 HG13 VAL 39 12.345 17.915 47.284 253 HG21 VAL 39 HG21 VAL 39 14.633 20.501 48.528 254 HG22 VAL 39 HG22 VAL 39 14.080 20.406 46.856 255 HG23 VAL 39 HG23 VAL 39 14.508 18.931 47.724 256 H ASN 40 H ASN 40 9.855 21.797 47.162 257 HA ASN 40 HA ASN 40 8.050 20.812 49.276 258 HB2 ASN 40 HB2 ASN 40 7.747 23.129 47.373 259 HB3 ASN 40 HB3 ASN 40 6.333 22.359 48.083 260 HD21 ASN 40 HD21 ASN 40 7.406 25.069 48.392 261 HD22 ASN 40 HD22 ASN 40 7.636 25.284 50.092 262 HA PRO 41 HA PRO 41 6.833 18.159 45.783 263 HB2 PRO 41 HB2 PRO 41 6.811 15.850 47.388 264 HB3 PRO 41 HB3 PRO 41 8.067 16.320 46.246 265 HG2 PRO 41 HG2 PRO 41 8.306 16.174 49.053 266 HG3 PRO 41 HG3 PRO 41 9.477 16.867 47.922 267 HD2 PRO 41 HD2 PRO 41 7.457 18.222 49.626 268 HD3 PRO 41 HD3 PRO 41 9.036 18.806 49.057 269 H GLU 42 H GLU 42 4.849 19.187 45.852 270 HA GLU 42 HA GLU 42 2.885 18.186 47.798 271 HB2 GLU 42 HB2 GLU 42 1.657 20.289 47.384 272 HB3 GLU 42 HB3 GLU 42 3.273 20.574 48.009 273 HG2 GLU 42 HG2 GLU 42 3.999 20.967 45.624 274 HG3 GLU 42 HG3 GLU 42 2.287 20.949 45.199 275 H ALA 43 H ALA 43 0.566 18.989 46.455 276 HA ALA 43 HA ALA 43 0.220 16.873 44.576 277 HB1 ALA 43 HB1 ALA 43 -2.073 17.695 44.388 278 HB2 ALA 43 HB2 ALA 43 -1.633 19.156 45.276 279 HB3 ALA 43 HB3 ALA 43 -1.576 17.583 46.075 280 H GLY 44 H GLY 44 -0.498 17.090 42.375 281 HA2 GLY 44 HA2 GLY 44 1.031 19.109 40.945 282 HA3 GLY 44 HA3 GLY 44 0.224 17.713 40.246 283 H SER 45 H SER 45 -0.597 19.065 38.582 284 HA SER 45 HA SER 45 -2.470 21.136 39.447 285 HB2 SER 45 HB2 SER 45 -1.304 20.627 36.701 286 HB3 SER 45 HB3 SER 45 -2.349 21.980 37.135 287 HG SER 45 HG SER 45 0.032 21.507 38.578 288 H MET 46 H MET 46 -2.676 19.266 36.404 289 HA MET 46 HA MET 46 -5.293 18.278 37.321 290 HB2 MET 46 HB2 MET 46 -4.696 19.602 34.673 291 HB3 MET 46 HB3 MET 46 -6.143 18.648 34.964 292 HG2 MET 46 HG2 MET 46 -6.771 20.183 36.774 293 HG3 MET 46 HG3 MET 46 -5.344 21.155 36.426 294 HE1 MET 46 HE1 MET 46 -6.808 23.358 36.130 295 HE2 MET 46 HE2 MET 46 -8.202 22.385 36.600 296 HE3 MET 46 HE3 MET 46 -8.283 23.406 35.164 297 H ASP 47 H ASP 47 -5.656 16.236 37.019 298 HA ASP 47 HA ASP 47 -4.033 14.705 35.072 299 HB2 ASP 47 HB2 ASP 47 -5.063 13.848 37.800 300 HB3 ASP 47 HB3 ASP 47 -4.370 12.739 36.627 301 H TYR 48 H TYR 48 -5.279 13.827 33.493 302 HA TYR 48 HA TYR 48 -8.116 13.343 34.134 303 HB2 TYR 48 HB2 TYR 48 -6.970 14.692 31.698 304 HB3 TYR 48 HB3 TYR 48 -8.564 13.945 31.679 305 HD1 TYR 48 HD1 TYR 48 -10.315 14.773 33.282 306 HD2 TYR 48 HD2 TYR 48 -6.643 16.825 32.641 307 HE1 TYR 48 HE1 TYR 48 -11.285 16.807 34.260 308 HE2 TYR 48 HE2 TYR 48 -7.605 18.860 33.621 309 HH TYR 48 HH TYR 48 -9.854 19.833 33.925 310 H MET 49 H MET 49 -9.223 11.811 32.893 311 HA MET 49 HA MET 49 -7.601 9.834 31.485 312 HB2 MET 49 HB2 MET 49 -8.581 7.982 32.728 313 HB3 MET 49 HB3 MET 49 -7.757 9.073 33.822 314 HG2 MET 49 HG2 MET 49 -10.745 9.079 33.418 315 HG3 MET 49 HG3 MET 49 -9.929 8.115 34.639 316 HE1 MET 49 HE1 MET 49 -11.694 10.988 36.672 317 HE2 MET 49 HE2 MET 49 -11.539 9.242 36.467 318 HE3 MET 49 HE3 MET 49 -12.288 10.223 35.199 319 HA PRO 50 HA PRO 50 -11.102 10.236 28.747 320 HB2 PRO 50 HB2 PRO 50 -10.420 8.300 26.962 321 HB3 PRO 50 HB3 PRO 50 -9.670 9.898 27.000 322 HG2 PRO 50 HG2 PRO 50 -8.655 7.299 28.051 323 HG3 PRO 50 HG3 PRO 50 -7.769 8.612 27.256 324 HD2 PRO 50 HD2 PRO 50 -7.768 8.195 29.958 325 HD3 PRO 50 HD3 PRO 50 -7.514 9.778 29.197 326 H LEU 51 H LEU 51 -12.944 9.577 29.742 327 HA LEU 51 HA LEU 51 -13.467 6.696 29.972 328 HB2 LEU 51 HB2 LEU 51 -13.896 8.057 31.981 329 HB3 LEU 51 HB3 LEU 51 -15.007 9.060 31.070 330 HG LEU 51 HG LEU 51 -16.372 6.940 30.682 331 HD11 LEU 51 HD11 LEU 51 -14.657 5.944 32.947 332 HD12 LEU 51 HD12 LEU 51 -14.676 5.318 31.300 333 HD13 LEU 51 HD13 LEU 51 -16.106 5.155 32.320 334 HD21 LEU 51 HD21 LEU 51 -17.499 7.133 32.831 335 HD22 LEU 51 HD22 LEU 51 -17.064 8.718 32.193 336 HD23 LEU 51 HD23 LEU 51 -16.110 7.999 33.489 337 H MET 52 H MET 52 -14.198 5.908 28.137 338 HA MET 52 HA MET 52 -16.335 7.377 26.751 339 HB2 MET 52 HB2 MET 52 -14.261 7.168 25.397 340 HB3 MET 52 HB3 MET 52 -14.375 5.419 25.529 341 HG2 MET 52 HG2 MET 52 -16.563 5.520 24.368 342 HG3 MET 52 HG3 MET 52 -16.329 7.252 24.152 343 HE1 MET 52 HE1 MET 52 -13.711 3.997 22.179 344 HE2 MET 52 HE2 MET 52 -15.102 3.667 23.211 345 HE3 MET 52 HE3 MET 52 -13.630 4.347 23.907 346 H GLU 53 H GLU 53 -18.187 6.516 27.251 347 HA GLU 53 HA GLU 53 -18.378 3.651 27.814 348 HB2 GLU 53 HB2 GLU 53 -20.383 5.873 28.275 349 HB3 GLU 53 HB3 GLU 53 -20.634 4.180 28.681 350 HG2 GLU 53 HG2 GLU 53 -18.826 4.264 30.286 351 HG3 GLU 53 HG3 GLU 53 -18.490 5.939 29.848 352 H TYR 54 H TYR 54 -19.320 2.313 26.444 353 HA TYR 54 HA TYR 54 -20.300 3.383 23.943 354 HB2 TYR 54 HB2 TYR 54 -20.282 0.984 23.188 355 HB3 TYR 54 HB3 TYR 54 -18.721 1.597 23.699 356 HD1 TYR 54 HD1 TYR 54 -17.728 0.819 25.841 357 HD2 TYR 54 HD2 TYR 54 -21.333 -0.847 24.311 358 HE1 TYR 54 HE1 TYR 54 -17.472 -1.100 27.348 359 HE2 TYR 54 HE2 TYR 54 -21.091 -2.765 25.821 360 HH TYR 54 HH TYR 54 -18.889 -2.796 28.419 361 H LEU 55 H LEU 55 -22.328 3.642 23.453 362 HA LEU 55 HA LEU 55 -24.352 2.630 25.306 363 HB2 LEU 55 HB2 LEU 55 -24.646 4.695 23.117 364 HB3 LEU 55 HB3 LEU 55 -25.828 4.313 24.352 365 HG LEU 55 HG LEU 55 -23.122 5.552 24.882 366 HD11 LEU 55 HD11 LEU 55 -25.860 6.802 24.832 367 HD12 LEU 55 HD12 LEU 55 -24.568 7.073 23.662 368 HD13 LEU 55 HD13 LEU 55 -24.370 7.600 25.333 369 HD21 LEU 55 HD21 LEU 55 -25.484 5.120 26.710 370 HD22 LEU 55 HD22 LEU 55 -23.998 5.974 27.126 371 HD23 LEU 55 HD23 LEU 55 -23.954 4.246 26.771 372 H HIS 56 H HIS 56 -23.930 3.090 21.796 373 HA HIS 56 HA HIS 56 -25.081 0.423 21.364 374 HB2 HIS 56 HB2 HIS 56 -25.856 2.899 19.797 375 HB3 HIS 56 HB3 HIS 56 -26.238 1.260 19.296 376 HD1 HIS 56 HD1 HIS 56 -27.939 -0.057 20.881 377 HD2 HIS 56 HD2 HIS 56 -27.619 4.037 21.551 378 HE1 HIS 56 HE1 HIS 56 -29.961 0.569 22.239 379 HE2 HIS 56 HE2 HIS 56 -29.719 3.023 22.698 380 H SER 57 H SER 57 -23.221 -0.569 20.777 381 HA SER 57 HA SER 57 -21.470 0.738 18.835 382 HB2 SER 57 HB2 SER 57 -21.057 -1.869 20.327 383 HB3 SER 57 HB3 SER 57 -19.857 -1.015 19.359 384 HG SER 57 HG SER 57 -20.265 -0.725 21.892 385 H SER 58 H SER 58 -21.743 0.354 16.770 386 HA SER 58 HA SER 58 -23.164 -1.981 15.798 387 HB2 SER 58 HB2 SER 58 -22.824 -0.891 13.573 388 HB3 SER 58 HB3 SER 58 -23.592 0.181 14.743 389 HG SER 58 HG SER 58 -20.863 0.367 14.788 390 HA PRO 59 HA PRO 59 -19.515 -4.435 14.621 391 HB2 PRO 59 HB2 PRO 59 -19.692 -4.640 11.847 392 HB3 PRO 59 HB3 PRO 59 -20.454 -5.722 13.016 393 HG2 PRO 59 HG2 PRO 59 -21.610 -3.414 11.528 394 HG3 PRO 59 HG3 PRO 59 -22.355 -4.970 11.939 395 HD2 PRO 59 HD2 PRO 59 -22.950 -2.733 13.284 396 HD3 PRO 59 HD3 PRO 59 -22.848 -4.305 14.110 397 H VAL 60 H VAL 60 -17.432 -4.267 13.759 398 HA VAL 60 HA VAL 60 -16.626 -1.515 13.837 399 HB VAL 60 HB VAL 60 -15.557 -3.317 15.195 400 HG11 VAL 60 HG11 VAL 60 -13.867 -4.774 14.218 401 HG12 VAL 60 HG12 VAL 60 -14.305 -4.207 12.608 402 HG13 VAL 60 HG13 VAL 60 -15.473 -5.113 13.569 403 HG21 VAL 60 HG21 VAL 60 -13.685 -1.778 13.412 404 HG22 VAL 60 HG22 VAL 60 -13.257 -2.536 14.946 405 HG23 VAL 60 HG23 VAL 60 -14.419 -1.211 14.913 406 H LEU 61 H LEU 61 -15.737 -0.313 12.273 407 HA LEU 61 HA LEU 61 -15.579 -1.380 9.580 408 HB2 LEU 61 HB2 LEU 61 -14.904 1.084 9.043 409 HB3 LEU 61 HB3 LEU 61 -16.566 0.694 9.369 410 HG LEU 61 HG LEU 61 -15.740 2.895 10.251 411 HD11 LEU 61 HD11 LEU 61 -17.775 1.962 11.100 412 HD12 LEU 61 HD12 LEU 61 -16.889 2.748 12.407 413 HD13 LEU 61 HD13 LEU 61 -16.884 0.989 12.268 414 HD21 LEU 61 HD21 LEU 61 -14.498 2.953 12.347 415 HD22 LEU 61 HD22 LEU 61 -13.543 2.270 11.031 416 HD23 LEU 61 HD23 LEU 61 -14.254 1.208 12.247 417 HA PRO 62 HA PRO 62 -11.380 -2.212 9.776 418 HB2 PRO 62 HB2 PRO 62 -10.347 -1.757 7.359 419 HB3 PRO 62 HB3 PRO 62 -11.557 -3.024 7.652 420 HG2 PRO 62 HG2 PRO 62 -11.853 -0.397 6.326 421 HG3 PRO 62 HG3 PRO 62 -12.777 -1.890 6.086 422 HD2 PRO 62 HD2 PRO 62 -13.560 0.361 7.598 423 HD3 PRO 62 HD3 PRO 62 -14.356 -1.219 7.543 424 H THR 63 H THR 63 -9.123 -1.662 8.945 425 HA THR 63 HA THR 63 -8.446 1.159 9.063 426 HB THR 63 HB THR 63 -7.077 -0.879 10.848 427 HG1 THR 63 HG1 THR 63 -9.429 0.389 11.252 428 HG21 THR 63 HG21 THR 63 -5.698 0.973 10.220 429 HG22 THR 63 HG22 THR 63 -6.182 1.176 11.909 430 HG23 THR 63 HG23 THR 63 -6.976 2.111 10.641 431 H ALA 64 H ALA 64 -7.418 1.249 7.084 432 HA ALA 64 HA ALA 64 -5.711 -0.966 6.271 433 HB1 ALA 64 HB1 ALA 64 -7.096 0.154 4.592 434 HB2 ALA 64 HB2 ALA 64 -5.374 0.263 4.217 435 HB3 ALA 64 HB3 ALA 64 -6.222 1.657 4.887 436 H ARG 65 H ARG 65 -3.789 -1.099 7.054 437 HA ARG 65 HA ARG 65 -2.140 1.310 7.289 438 HB2 ARG 65 HB2 ARG 65 -2.445 -0.847 9.404 439 HB3 ARG 65 HB3 ARG 65 -1.137 0.325 9.397 440 HG2 ARG 65 HG2 ARG 65 -4.069 0.964 9.641 441 HG3 ARG 65 HG3 ARG 65 -2.918 0.903 10.975 442 HD2 ARG 65 HD2 ARG 65 -1.663 2.754 9.970 443 HD3 ARG 65 HD3 ARG 65 -2.797 2.793 8.619 444 HE ARG 65 HE ARG 65 -3.453 3.497 11.412 445 HH11 ARG 65 HH11 ARG 65 -4.158 3.711 7.965 446 HH12 ARG 65 HH12 ARG 65 -5.397 4.910 8.177 447 HH21 ARG 65 HH21 ARG 65 -5.079 5.042 11.664 448 HH22 ARG 65 HH22 ARG 65 -5.914 5.665 10.277 449 H PHE 66 H PHE 66 0.028 0.922 6.822 450 HA PHE 66 HA PHE 66 1.020 -1.749 6.593 451 HB2 PHE 66 HB2 PHE 66 1.622 -1.723 4.236 452 HB3 PHE 66 HB3 PHE 66 -0.113 -1.569 4.402 453 HD1 PHE 66 HD2 PHE 66 -1.156 0.708 4.033 454 HD2 PHE 66 HD1 PHE 66 2.875 -0.192 3.007 455 HE1 PHE 66 HE2 PHE 66 -1.125 2.617 2.487 456 HE2 PHE 66 HE1 PHE 66 2.908 1.710 1.458 457 HZ PHE 66 HZ PHE 66 0.904 3.115 1.198 458 H THR 67 H THR 67 3.295 -1.829 6.481 459 HA THR 67 HA THR 67 4.541 0.813 6.657 460 HB THR 67 HB THR 67 4.928 -0.346 8.716 461 HG1 THR 67 HG1 THR 67 7.173 -0.270 8.741 462 HG21 THR 67 HG21 THR 67 6.138 -2.487 8.846 463 HG22 THR 67 HG22 THR 67 6.045 -2.629 7.089 464 HG23 THR 67 HG23 THR 67 4.569 -2.645 8.055 465 H SER 68 H SER 68 5.877 1.424 5.191 466 HA SER 68 HA SER 68 6.640 -0.400 3.045 467 HB2 SER 68 HB2 SER 68 5.593 1.799 2.483 468 HB3 SER 68 HB3 SER 68 6.938 2.619 3.277 469 HG SER 68 HG SER 68 7.931 2.468 1.440 470 H ASP 69 H ASP 69 8.809 -0.789 2.548 471 HA ASP 69 HA ASP 69 10.678 -0.724 4.676 472 HB2 ASP 69 HB2 ASP 69 10.736 -2.394 2.847 473 HB3 ASP 69 HB3 ASP 69 11.213 -1.123 1.722 474 H ILE 70 H ILE 70 10.725 1.045 1.565 475 HA ILE 70 HA ILE 70 11.941 3.270 3.024 476 HB ILE 70 HB ILE 70 12.878 4.064 0.806 477 HG12 ILE 70 HG12 ILE 70 13.387 1.799 -0.612 478 HG13 ILE 70 HG13 ILE 70 11.742 1.479 -0.084 479 HG21 ILE 70 HG21 ILE 70 14.837 2.596 0.921 480 HG22 ILE 70 HG22 ILE 70 13.934 1.496 1.962 481 HG23 ILE 70 HG23 ILE 70 14.297 3.133 2.512 482 HD11 ILE 70 HD11 ILE 70 12.663 3.889 -1.640 483 HD12 ILE 70 HD12 ILE 70 11.010 3.568 -1.113 484 HD13 ILE 70 HD13 ILE 70 11.785 2.501 -2.285 485 H THR 71 H THR 71 10.929 5.131 3.049 486 HA THR 71 HA THR 71 8.464 5.473 1.559 487 HB THR 71 HB THR 71 8.578 7.779 2.744 488 HG1 THR 71 HG1 THR 71 9.979 7.855 4.495 489 HG21 THR 71 HG21 THR 71 7.041 5.995 3.412 490 HG22 THR 71 HG22 THR 71 7.690 6.838 4.819 491 HG23 THR 71 HG23 THR 71 8.316 5.249 4.379 492 H GLU 72 H GLU 72 11.746 6.527 1.616 493 HA GLU 72 HA GLU 72 11.713 7.507 -1.052 494 HB2 GLU 72 HB2 GLU 72 10.821 9.457 0.352 495 HB3 GLU 72 HB3 GLU 72 12.410 9.521 1.095 496 HG2 GLU 72 HG2 GLU 72 13.440 10.036 -1.013 497 HG3 GLU 72 HG3 GLU 72 11.905 9.810 -1.855 498 H GLY 73 H GLY 73 13.873 7.843 -1.787 499 HA2 GLY 73 HA2 GLY 73 16.295 7.867 -0.752 500 HA3 GLY 73 HA3 GLY 73 15.796 6.253 -0.249 501 H PHE 74 H PHE 74 17.734 5.676 -1.669 502 HA PHE 74 HA PHE 74 17.284 5.967 -4.499 503 HB2 PHE 74 HB2 PHE 74 19.338 4.813 -4.869 504 HB3 PHE 74 HB3 PHE 74 19.604 5.861 -3.491 505 HD1 PHE 74 HD1 PHE 74 19.776 4.855 -1.209 506 HD2 PHE 74 HD2 PHE 74 19.605 2.474 -4.731 507 HE1 PHE 74 HE1 PHE 74 20.663 2.940 0.045 508 HE2 PHE 74 HE2 PHE 74 20.485 0.555 -3.480 509 HZ PHE 74 HZ PHE 74 21.018 0.786 -1.092 510 H ALA 75 H ALA 75 16.348 4.630 -5.848 511 HA ALA 75 HA ALA 75 14.482 2.764 -5.149 512 HB1 ALA 75 HB1 ALA 75 15.987 2.904 -7.761 513 HB2 ALA 75 HB2 ALA 75 14.554 3.841 -7.329 514 HB3 ALA 75 HB3 ALA 75 14.446 2.087 -7.495 515 HA PRO 76 HA PRO 76 16.891 -1.021 -4.646 516 HB2 PRO 76 HB2 PRO 76 14.858 -2.073 -2.991 517 HB3 PRO 76 HB3 PRO 76 16.380 -1.363 -2.452 518 HG2 PRO 76 HG2 PRO 76 13.819 -0.325 -1.998 519 HG3 PRO 76 HG3 PRO 76 15.351 0.537 -1.782 520 HD2 PRO 76 HD2 PRO 76 13.431 0.627 -4.067 521 HD3 PRO 76 HD3 PRO 76 14.446 1.919 -3.384 522 H LEU 77 H LEU 77 16.033 -3.362 -4.948 523 HA LEU 77 HA LEU 77 14.082 -3.283 -7.109 524 HB2 LEU 77 HB2 LEU 77 14.756 -5.659 -7.517 525 HB3 LEU 77 HB3 LEU 77 16.012 -4.467 -7.781 526 HG LEU 77 HG LEU 77 16.234 -5.409 -5.094 527 HD11 LEU 77 HD11 LEU 77 16.079 -7.584 -7.174 528 HD12 LEU 77 HD12 LEU 77 15.008 -7.375 -5.787 529 HD13 LEU 77 HD13 LEU 77 16.708 -7.774 -5.538 530 HD21 LEU 77 HD21 LEU 77 18.447 -6.072 -5.864 531 HD22 LEU 77 HD22 LEU 77 18.025 -4.468 -6.461 532 HD23 LEU 77 HD23 LEU 77 17.940 -5.861 -7.541 533 H SER 78 H SER 78 14.590 -4.697 -3.922 534 HA SER 78 HA SER 78 11.755 -5.460 -3.977 535 HB2 SER 78 HB2 SER 78 13.948 -6.547 -2.196 536 HB3 SER 78 HB3 SER 78 12.271 -7.079 -2.237 537 HG SER 78 HG SER 78 13.216 -7.170 -4.711 538 H VAL 79 H VAL 79 10.853 -3.574 -3.316 539 HA VAL 79 HA VAL 79 11.610 -2.487 -0.719 540 HB VAL 79 HB VAL 79 9.174 -1.728 -2.358 541 HG11 VAL 79 HG11 VAL 79 10.667 -0.236 -0.199 542 HG12 VAL 79 HG12 VAL 79 9.118 -1.058 -0.001 543 HG13 VAL 79 HG13 VAL 79 9.246 0.344 -1.066 544 HG21 VAL 79 HG21 VAL 79 10.464 0.173 -3.200 545 HG22 VAL 79 HG22 VAL 79 11.158 -1.365 -3.720 546 HG23 VAL 79 HG23 VAL 79 11.906 -0.457 -2.405 547 H ARG 80 H ARG 80 10.834 -3.305 1.077 548 HA ARG 80 HA ARG 80 9.132 -5.614 1.002 549 HB2 ARG 80 HB2 ARG 80 10.216 -4.144 3.413 550 HB3 ARG 80 HB3 ARG 80 9.615 -5.796 3.374 551 HG2 ARG 80 HG2 ARG 80 11.487 -6.479 2.001 552 HG3 ARG 80 HG3 ARG 80 12.051 -4.808 1.905 553 HD2 ARG 80 HD2 ARG 80 12.200 -4.853 4.430 554 HD3 ARG 80 HD3 ARG 80 11.958 -6.597 4.325 555 HE ARG 80 HE ARG 80 14.012 -6.392 2.725 556 HH11 ARG 80 HH11 ARG 80 13.513 -4.593 5.702 557 HH12 ARG 80 HH12 ARG 80 15.208 -4.414 6.027 558 HH21 ARG 80 HH21 ARG 80 16.242 -6.173 3.178 559 HH22 ARG 80 HH22 ARG 80 16.747 -5.324 4.607 560 H PHE 81 H PHE 81 7.028 -5.322 0.709 561 HA PHE 81 HA PHE 81 5.647 -3.319 2.364 562 HB2 PHE 81 HB2 PHE 81 4.845 -4.548 -0.280 563 HB3 PHE 81 HB3 PHE 81 3.742 -3.615 0.725 564 HD1 PHE 81 HD2 PHE 81 4.424 -1.212 1.292 565 HD2 PHE 81 HD1 PHE 81 6.207 -3.498 -1.812 566 HE1 PHE 81 HE2 PHE 81 5.214 0.853 0.223 567 HE2 PHE 81 HE1 PHE 81 6.997 -1.439 -2.885 568 HZ PHE 81 HZ PHE 81 6.500 0.740 -1.870 569 H LYS 82 H LYS 82 4.437 -4.048 3.942 570 HA LYS 82 HA LYS 82 3.109 -6.631 3.599 571 HB2 LYS 82 HB2 LYS 82 3.490 -7.233 5.940 572 HB3 LYS 82 HB3 LYS 82 5.011 -7.070 5.078 573 HG2 LYS 82 HG2 LYS 82 5.473 -4.983 6.132 574 HG3 LYS 82 HG3 LYS 82 3.848 -4.905 6.813 575 HD2 LYS 82 HD2 LYS 82 5.872 -7.038 7.486 576 HD3 LYS 82 HD3 LYS 82 5.594 -5.590 8.451 577 HE2 LYS 82 HE2 LYS 82 3.299 -6.256 8.850 578 HE3 LYS 82 HE3 LYS 82 3.500 -7.665 7.810 579 HZ1 LYS 82 HZ1 LYS 82 4.974 -7.174 10.345 580 HZ2 LYS 82 HZ2 LYS 82 5.129 -8.539 9.348 581 HZ3 LYS 82 HZ3 LYS 82 3.669 -8.240 10.150 582 H ASP 83 H ASP 83 1.146 -6.847 4.786 583 HA ASP 83 HA ASP 83 -0.168 -4.306 5.195 584 HB2 ASP 83 HB2 ASP 83 -2.241 -5.507 5.301 585 HB3 ASP 83 HB3 ASP 83 -1.322 -6.139 3.946 586 H PHE 84 H PHE 84 -0.698 -3.457 7.026 587 HA PHE 84 HA PHE 84 -0.243 -4.962 9.521 588 HB2 PHE 84 HB2 PHE 84 1.295 -2.914 8.752 589 HB3 PHE 84 HB3 PHE 84 -0.026 -1.980 9.445 590 HD1 PHE 84 HD1 PHE 84 1.997 -4.991 10.341 591 HD2 PHE 84 HD2 PHE 84 0.262 -1.321 11.612 592 HE1 PHE 84 HE1 PHE 84 2.949 -5.320 12.585 593 HE2 PHE 84 HE2 PHE 84 1.212 -1.644 13.855 594 HZ PHE 84 HZ PHE 84 2.555 -3.642 14.346 595 H SER 85 H SER 85 -2.471 -4.220 7.576 596 HA SER 85 HA SER 85 -4.390 -2.575 8.684 597 HB2 SER 85 HB2 SER 85 -4.732 -5.010 6.933 598 HB3 SER 85 HB3 SER 85 -5.935 -3.742 7.189 599 HG SER 85 HG SER 85 -4.478 -3.585 5.278 600 H GLU 86 H GLU 86 -6.067 -2.790 9.993 601 HA GLU 86 HA GLU 86 -6.331 -5.293 11.518 602 HB2 GLU 86 HB2 GLU 86 -6.511 -2.456 12.554 603 HB3 GLU 86 HB3 GLU 86 -6.875 -3.893 13.495 604 HG2 GLU 86 HG2 GLU 86 -4.579 -4.618 13.373 605 HG3 GLU 86 HG3 GLU 86 -4.187 -3.298 12.275 606 H ASN 87 H ASN 87 -8.443 -5.858 12.092 607 HA ASN 87 HA ASN 87 -10.711 -6.002 12.066 608 HB2 ASN 87 HB2 ASN 87 -10.693 -2.990 11.727 609 HB3 ASN 87 HB3 ASN 87 -12.082 -3.964 12.179 610 HD21 ASN 87 HD21 ASN 87 -9.322 -2.311 13.270 611 HD22 ASN 87 HD22 ASN 87 -9.435 -2.729 14.944 612 H ALA 88 H ALA 88 -9.344 -6.398 9.590 613 HA ALA 88 HA ALA 88 -11.133 -5.171 7.599 614 HB1 ALA 88 HB1 ALA 88 -8.765 -4.649 7.311 615 HB2 ALA 88 HB2 ALA 88 -9.377 -5.617 5.969 616 HB3 ALA 88 HB3 ALA 88 -8.393 -6.371 7.223 617 H THR 89 H THR 89 -12.351 -6.385 6.301 618 HA THR 89 HA THR 89 -12.532 -9.233 6.770 619 HB THR 89 HB THR 89 -14.024 -7.699 4.630 620 HG1 THR 89 HG1 THR 89 -14.449 -7.770 7.444 621 HG21 THR 89 HG21 THR 89 -14.265 -10.150 4.628 622 HG22 THR 89 HG22 THR 89 -15.779 -9.354 5.057 623 HG23 THR 89 HG23 THR 89 -14.791 -10.097 6.313 624 H SER 90 H SER 90 -11.781 -7.061 4.043 625 HA SER 90 HA SER 90 -10.183 -9.214 2.813 626 HB2 SER 90 HB2 SER 90 -11.860 -7.175 1.316 627 HB3 SER 90 HB3 SER 90 -10.913 -8.478 0.601 628 HG SER 90 HG SER 90 -12.302 -9.961 1.726 629 H ARG 91 H ARG 91 -8.466 -8.348 1.366 630 HA ARG 91 HA ARG 91 -7.867 -5.490 1.700 631 HB2 ARG 91 HB2 ARG 91 -5.444 -6.001 1.989 632 HB3 ARG 91 HB3 ARG 91 -6.433 -6.533 3.337 633 HG2 ARG 91 HG2 ARG 91 -6.132 -8.770 2.845 634 HG3 ARG 91 HG3 ARG 91 -5.733 -8.447 1.156 635 HD2 ARG 91 HD2 ARG 91 -3.614 -7.429 1.872 636 HD3 ARG 91 HD3 ARG 91 -4.007 -7.803 3.550 637 HE ARG 91 HE ARG 91 -3.513 -10.027 3.162 638 HH11 ARG 91 HH11 ARG 91 -3.504 -8.334 0.072 639 HH12 ARG 91 HH12 ARG 91 -2.619 -9.579 -0.745 640 HH21 ARG 91 HH21 ARG 91 -2.394 -11.663 2.062 641 HH22 ARG 91 HH22 ARG 91 -1.982 -11.457 0.385 642 H LEU 92 H LEU 92 -6.626 -4.564 0.043 643 HA LEU 92 HA LEU 92 -6.224 -6.162 -2.393 644 HB2 LEU 92 HB2 LEU 92 -7.698 -3.558 -2.081 645 HB3 LEU 92 HB3 LEU 92 -6.968 -4.009 -3.608 646 HG LEU 92 HG LEU 92 -8.997 -5.746 -2.231 647 HD11 LEU 92 HD11 LEU 92 -10.644 -4.754 -3.781 648 HD12 LEU 92 HD12 LEU 92 -9.438 -3.559 -4.260 649 HD13 LEU 92 HD13 LEU 92 -10.040 -3.591 -2.602 650 HD21 LEU 92 HD21 LEU 92 -9.293 -6.631 -4.489 651 HD22 LEU 92 HD22 LEU 92 -7.636 -6.822 -3.919 652 HD23 LEU 92 HD23 LEU 92 -8.030 -5.545 -5.070 653 H TRP 93 H TRP 93 -4.175 -5.965 -3.034 654 HA TRP 93 HA TRP 93 -2.641 -3.603 -2.308 655 HB2 TRP 93 HB2 TRP 93 -1.948 -6.269 -3.486 656 HB3 TRP 93 HB3 TRP 93 -0.834 -4.920 -3.673 657 HD1 TRP 93 HD1 TRP 93 -1.561 -7.693 -1.407 658 HE1 TRP 93 HE1 TRP 93 -0.349 -7.399 0.845 659 HE3 TRP 93 HE3 TRP 93 -0.230 -2.764 -1.829 660 HZ2 TRP 93 HZ2 TRP 93 0.980 -5.355 2.258 661 HZ3 TRP 93 HZ3 TRP 93 1.010 -1.720 0.025 662 HH2 TRP 93 HH2 TRP 93 1.600 -2.989 2.023 663 H MET 94 H MET 94 -2.670 -1.913 -3.531 664 HA MET 94 HA MET 94 -3.198 -2.179 -6.403 665 HB2 MET 94 HB2 MET 94 -3.084 0.328 -4.710 666 HB3 MET 94 HB3 MET 94 -3.582 0.227 -6.392 667 HG2 MET 94 HG2 MET 94 -5.487 -1.168 -5.717 668 HG3 MET 94 HG3 MET 94 -5.006 -0.970 -4.032 669 HE1 MET 94 HE1 MET 94 -6.379 2.518 -6.737 670 HE2 MET 94 HE2 MET 94 -6.353 0.835 -7.264 671 HE3 MET 94 HE3 MET 94 -4.840 1.686 -6.950 672 H PHE 95 H PHE 95 -1.457 -2.403 -7.604 673 HA PHE 95 HA PHE 95 1.141 -1.503 -6.701 674 HB2 PHE 95 HB2 PHE 95 0.704 -3.757 -7.739 675 HB3 PHE 95 HB3 PHE 95 0.373 -2.939 -9.256 676 HD1 PHE 95 HD1 PHE 95 3.019 -3.336 -6.680 677 HD2 PHE 95 HD2 PHE 95 2.097 -2.584 -10.759 678 HE1 PHE 95 HE1 PHE 95 5.407 -3.467 -7.236 679 HE2 PHE 95 HE2 PHE 95 4.487 -2.713 -11.323 680 HZ PHE 95 HZ PHE 95 6.145 -3.157 -9.558 681 H GLY 96 H GLY 96 -1.324 -0.616 -8.977 682 HA2 GLY 96 HA2 GLY 96 -1.531 1.542 -9.934 683 HA3 GLY 96 HA3 GLY 96 0.203 1.760 -9.766 684 H ASP 97 H ASP 97 -0.156 -1.243 -10.885 685 HA ASP 97 HA ASP 97 -0.190 -0.497 -13.710 686 HB2 ASP 97 HB2 ASP 97 2.196 -0.617 -13.023 687 HB3 ASP 97 HB3 ASP 97 1.940 -2.266 -12.470 688 H GLY 98 H GLY 98 -1.745 -1.637 -14.606 689 HA2 GLY 98 HA2 GLY 98 -2.754 -3.590 -15.395 690 HA3 GLY 98 HA3 GLY 98 -1.874 -4.509 -14.185 691 H ASN 99 H ASN 99 -3.465 -5.629 -13.321 692 HA ASN 99 HA ASN 99 -5.898 -4.252 -12.446 693 HB2 ASN 99 HB2 ASN 99 -6.951 -6.437 -12.230 694 HB3 ASN 99 HB3 ASN 99 -6.237 -6.270 -13.823 695 HD21 ASN 99 HD21 ASN 99 -4.467 -7.544 -14.374 696 HD22 ASN 99 HD22 ASN 99 -4.004 -8.927 -13.442 697 H THR 100 H THR 100 -6.750 -4.466 -10.376 698 HA THR 100 HA THR 100 -4.863 -5.038 -8.233 699 HB THR 100 HB THR 100 -6.807 -4.356 -6.766 700 HG1 THR 100 HG1 THR 100 -8.240 -4.773 -8.852 701 HG21 THR 100 HG21 THR 100 -5.907 -2.411 -8.888 702 HG22 THR 100 HG22 THR 100 -5.075 -2.767 -7.372 703 HG23 THR 100 HG23 THR 100 -6.651 -1.974 -7.352 704 H SER 101 H SER 101 -5.767 -6.408 -6.336 705 HA SER 101 HA SER 101 -6.098 -8.524 -5.592 706 HB2 SER 101 HB2 SER 101 -8.499 -7.859 -6.258 707 HB3 SER 101 HB3 SER 101 -8.253 -8.880 -7.677 708 HG SER 101 HG SER 101 -8.088 -10.653 -6.404 709 H ASP 102 H ASP 102 -4.047 -8.187 -7.346 710 HA ASP 102 HA ASP 102 -4.007 -10.337 -9.272 711 HB2 ASP 102 HB2 ASP 102 -2.718 -8.024 -9.320 712 HB3 ASP 102 HB3 ASP 102 -1.526 -8.903 -8.374 713 H SER 103 H SER 103 -1.562 -11.501 -8.939 714 HA SER 103 HA SER 103 -1.939 -13.615 -7.225 715 HB2 SER 103 HB2 SER 103 0.775 -12.566 -8.065 716 HB3 SER 103 HB3 SER 103 0.305 -14.241 -7.769 717 HG SER 103 HG SER 103 -0.202 -12.595 -9.973 718 HA PRO 104 HA PRO 104 -0.803 -11.913 -3.227 719 HB2 PRO 104 HB2 PRO 104 -0.809 -14.240 -1.823 720 HB3 PRO 104 HB3 PRO 104 -2.277 -13.383 -2.303 721 HG2 PRO 104 HG2 PRO 104 -1.013 -15.798 -3.503 722 HG3 PRO 104 HG3 PRO 104 -2.727 -15.395 -3.315 723 HD2 PRO 104 HD2 PRO 104 -1.303 -15.146 -5.659 724 HD3 PRO 104 HD3 PRO 104 -2.787 -14.251 -5.276 725 H SER 105 H SER 105 1.349 -12.828 -5.178 726 HA SER 105 HA SER 105 3.482 -13.688 -3.411 727 HB2 SER 105 HB2 SER 105 4.830 -13.380 -5.559 728 HB3 SER 105 HB3 SER 105 3.549 -14.587 -5.637 729 HG SER 105 HG SER 105 3.597 -13.179 -7.463 730 HA PRO 106 HA PRO 106 4.941 -9.434 -2.774 731 HB2 PRO 106 HB2 PRO 106 7.724 -10.329 -2.817 732 HB3 PRO 106 HB3 PRO 106 6.771 -9.719 -1.460 733 HG2 PRO 106 HG2 PRO 106 7.551 -12.309 -1.635 734 HG3 PRO 106 HG3 PRO 106 6.036 -11.816 -0.859 735 HD2 PRO 106 HD2 PRO 106 6.478 -12.926 -3.606 736 HD3 PRO 106 HD3 PRO 106 5.216 -13.326 -2.421 737 H LEU 107 H LEU 107 4.242 -8.977 -4.981 738 HA LEU 107 HA LEU 107 6.246 -9.189 -7.081 739 HB2 LEU 107 HB2 LEU 107 4.257 -8.401 -8.520 740 HB3 LEU 107 HB3 LEU 107 4.245 -10.022 -7.867 741 HG LEU 107 HG LEU 107 2.739 -9.071 -6.002 742 HD11 LEU 107 HD11 LEU 107 3.073 -6.690 -6.424 743 HD12 LEU 107 HD12 LEU 107 1.376 -7.136 -6.617 744 HD13 LEU 107 HD13 LEU 107 2.386 -6.872 -8.039 745 HD21 LEU 107 HD21 LEU 107 0.755 -9.348 -7.402 746 HD22 LEU 107 HD22 LEU 107 1.973 -10.583 -7.723 747 HD23 LEU 107 HD23 LEU 107 1.765 -9.237 -8.845 748 H HIS 108 H HIS 108 6.268 -7.101 -4.880 749 HA HIS 108 HA HIS 108 5.909 -4.655 -6.415 750 HB2 HIS 108 HB2 HIS 108 6.671 -5.006 -3.506 751 HB3 HIS 108 HB3 HIS 108 6.339 -3.473 -4.295 752 HD1 HIS 108 HD1 HIS 108 4.737 -6.162 -2.437 753 HD2 HIS 108 HD2 HIS 108 3.530 -3.239 -5.138 754 HE1 HIS 108 HE1 HIS 108 2.237 -6.005 -2.200 755 HE2 HIS 108 HE2 HIS 108 1.518 -4.347 -3.943 756 H THR 109 H THR 109 7.626 -5.426 -7.842 757 HA THR 109 HA THR 109 10.329 -4.937 -6.801 758 HB THR 109 HB THR 109 9.566 -6.467 -9.302 759 HG1 THR 109 HG1 THR 109 10.092 -7.339 -6.650 760 HG21 THR 109 HG21 THR 109 11.823 -5.562 -9.369 761 HG22 THR 109 HG22 THR 109 11.887 -7.313 -9.152 762 HG23 THR 109 HG23 THR 109 12.164 -6.240 -7.778 763 H PHE 110 H PHE 110 11.104 -3.038 -7.321 764 HA PHE 110 HA PHE 110 10.058 -1.690 -9.705 765 HB2 PHE 110 HB2 PHE 110 11.367 -0.471 -7.259 766 HB3 PHE 110 HB3 PHE 110 10.680 0.416 -8.615 767 HD1 PHE 110 HD1 PHE 110 8.177 0.162 -9.058 768 HD2 PHE 110 HD2 PHE 110 10.034 -1.088 -5.441 769 HE1 PHE 110 HE1 PHE 110 5.991 0.174 -7.935 770 HE2 PHE 110 HE2 PHE 110 7.849 -1.077 -4.313 771 HZ PHE 110 HZ PHE 110 5.825 -0.445 -5.556 772 H PHE 111 H PHE 111 11.372 -2.268 -11.308 773 HA PHE 111 HA PHE 111 14.257 -2.279 -11.028 774 HB2 PHE 111 HB2 PHE 111 12.533 -2.572 -13.508 775 HB3 PHE 111 HB3 PHE 111 14.271 -2.801 -13.455 776 HD1 PHE 111 HD1 PHE 111 15.194 -4.731 -12.114 777 HD2 PHE 111 HD2 PHE 111 11.056 -4.309 -13.012 778 HE1 PHE 111 HE1 PHE 111 14.858 -7.132 -11.688 779 HE2 PHE 111 HE2 PHE 111 10.713 -6.705 -12.580 780 HZ PHE 111 HZ PHE 111 12.616 -8.120 -11.920 781 H ASN 112 H ASN 112 11.799 -0.065 -11.851 782 HA ASN 112 HA ASN 112 13.734 1.805 -13.051 783 HB2 ASN 112 HB2 ASN 112 11.728 1.074 -14.432 784 HB3 ASN 112 HB3 ASN 112 10.713 1.888 -13.256 785 HD21 ASN 112 HD21 ASN 112 13.843 3.051 -14.400 786 HD22 ASN 112 HD22 ASN 112 13.205 4.434 -15.224 787 H GLU 113 H GLU 113 13.895 3.857 -12.176 788 HA GLU 113 HA GLU 113 12.687 4.302 -9.573 789 HB2 GLU 113 HB2 GLU 113 14.086 6.345 -9.542 790 HB3 GLU 113 HB3 GLU 113 15.018 4.878 -9.801 791 HG2 GLU 113 HG2 GLU 113 15.261 5.374 -12.136 792 HG3 GLU 113 HG3 GLU 113 14.159 6.745 -12.003 793 H GLY 114 H GLY 114 11.921 6.697 -9.234 794 HA2 GLY 114 HA2 GLY 114 10.810 8.499 -10.684 795 HA3 GLY 114 HA3 GLY 114 9.856 7.151 -11.293 796 H GLU 115 H GLU 115 8.005 8.385 -10.500 797 HA GLU 115 HA GLU 115 7.705 8.320 -7.577 798 HB2 GLU 115 HB2 GLU 115 7.318 10.482 -8.784 799 HB3 GLU 115 HB3 GLU 115 5.996 9.714 -9.651 800 HG2 GLU 115 HG2 GLU 115 4.915 9.281 -7.432 801 HG3 GLU 115 HG3 GLU 115 6.177 10.284 -6.706 802 H TYR 116 H TYR 116 6.648 6.644 -6.786 803 HA TYR 116 HA TYR 116 4.511 5.395 -8.397 804 HB2 TYR 116 HB2 TYR 116 6.385 4.097 -6.396 805 HB3 TYR 116 HB3 TYR 116 4.998 3.297 -7.121 806 HD1 TYR 116 HD1 TYR 116 5.021 2.698 -9.504 807 HD2 TYR 116 HD2 TYR 116 8.431 4.402 -7.615 808 HE1 TYR 116 HE1 TYR 116 6.427 1.949 -11.376 809 HE2 TYR 116 HE2 TYR 116 9.846 3.665 -9.482 810 HH TYR 116 HH TYR 116 9.843 2.003 -11.239 811 H ILE 117 H ILE 117 2.562 5.035 -7.346 812 HA ILE 117 HA ILE 117 2.500 5.932 -4.538 813 HB ILE 117 HB ILE 117 0.120 5.979 -6.421 814 HG12 ILE 117 HG12 ILE 117 1.711 8.342 -5.403 815 HG13 ILE 117 HG13 ILE 117 1.973 7.626 -6.987 816 HG21 ILE 117 HG21 ILE 117 -0.472 5.716 -4.072 817 HG22 ILE 117 HG22 ILE 117 -0.881 7.345 -4.616 818 HG23 ILE 117 HG23 ILE 117 0.563 7.078 -3.636 819 HD11 ILE 117 HD11 ILE 117 -0.597 8.871 -6.030 820 HD12 ILE 117 HD12 ILE 117 -0.309 8.179 -7.628 821 HD13 ILE 117 HD13 ILE 117 0.578 9.615 -7.116 822 H VAL 118 H VAL 118 2.280 4.393 -3.155 823 HA VAL 118 HA VAL 118 1.180 1.816 -3.990 824 HB VAL 118 HB VAL 118 2.765 2.539 -1.517 825 HG11 VAL 118 HG11 VAL 118 1.307 0.639 -1.086 826 HG12 VAL 118 HG12 VAL 118 2.990 0.115 -1.178 827 HG13 VAL 118 HG13 VAL 118 1.903 -0.170 -2.538 828 HG21 VAL 118 HG21 VAL 118 4.095 2.712 -3.535 829 HG22 VAL 118 HG22 VAL 118 3.589 1.096 -4.030 830 HG23 VAL 118 HG23 VAL 118 4.589 1.306 -2.591 831 H SER 119 H SER 119 -0.775 1.239 -3.413 832 HA SER 119 HA SER 119 -2.022 2.601 -1.135 833 HB2 SER 119 HB2 SER 119 -2.946 3.484 -3.201 834 HB3 SER 119 HB3 SER 119 -3.267 1.852 -3.785 835 HG SER 119 HG SER 119 -4.963 1.698 -2.508 836 H LEU 120 H LEU 120 -2.616 1.274 0.398 837 HA LEU 120 HA LEU 120 -3.501 -1.432 -0.340 838 HB2 LEU 120 HB2 LEU 120 -1.597 -1.498 1.188 839 HB3 LEU 120 HB3 LEU 120 -2.415 -0.419 2.296 840 HG LEU 120 HG LEU 120 -4.061 -2.167 2.820 841 HD11 LEU 120 HD11 LEU 120 -3.767 -4.448 2.009 842 HD12 LEU 120 HD12 LEU 120 -2.440 -3.921 0.971 843 HD13 LEU 120 HD13 LEU 120 -4.080 -3.344 0.668 844 HD21 LEU 120 HD21 LEU 120 -1.217 -3.106 3.016 845 HD22 LEU 120 HD22 LEU 120 -2.572 -3.673 3.992 846 HD23 LEU 120 HD23 LEU 120 -2.027 -2.001 4.125 847 H ILE 121 H ILE 121 -5.621 -1.584 -0.387 848 HA ILE 121 HA ILE 121 -7.178 0.132 1.407 849 HB ILE 121 HB ILE 121 -7.643 1.005 -0.758 850 HG12 ILE 121 HG12 ILE 121 -9.894 -0.923 -0.121 851 HG13 ILE 121 HG13 ILE 121 -9.616 0.602 0.704 852 HG21 ILE 121 HG21 ILE 121 -8.068 -1.813 -1.745 853 HG22 ILE 121 HG22 ILE 121 -6.733 -0.735 -2.157 854 HG23 ILE 121 HG23 ILE 121 -8.372 -0.347 -2.679 855 HD11 ILE 121 HD11 ILE 121 -10.024 1.800 -1.384 856 HD12 ILE 121 HD12 ILE 121 -11.396 0.797 -0.912 857 HD13 ILE 121 HD13 ILE 121 -10.315 0.263 -2.199 858 H VAL 122 H VAL 122 -8.537 -0.886 2.717 859 HA VAL 122 HA VAL 122 -8.865 -3.768 2.282 860 HB VAL 122 HB VAL 122 -9.161 -4.014 4.735 861 HG11 VAL 122 HG11 VAL 122 -6.552 -2.798 3.848 862 HG12 VAL 122 HG12 VAL 122 -7.020 -4.494 3.716 863 HG13 VAL 122 HG13 VAL 122 -6.785 -3.765 5.305 864 HG21 VAL 122 HG21 VAL 122 -8.443 -2.241 6.242 865 HG22 VAL 122 HG22 VAL 122 -9.827 -1.720 5.278 866 HG23 VAL 122 HG23 VAL 122 -8.205 -1.156 4.871 867 H SER 123 H SER 123 -10.880 -4.686 3.031 868 HA SER 123 HA SER 123 -13.059 -2.768 2.556 869 HB2 SER 123 HB2 SER 123 -13.014 -5.624 1.569 870 HB3 SER 123 HB3 SER 123 -14.133 -4.332 1.125 871 HG SER 123 HG SER 123 -11.619 -3.548 0.633 872 H ASN 124 H ASN 124 -15.001 -3.178 3.617 873 HA ASN 124 HA ASN 124 -15.330 -5.452 5.349 874 HB2 ASN 124 HB2 ASN 124 -13.929 -4.111 6.794 875 HB3 ASN 124 HB3 ASN 124 -14.828 -2.659 6.415 876 HD21 ASN 124 HD21 ASN 124 -14.818 -5.638 8.226 877 HD22 ASN 124 HD22 ASN 124 -16.041 -5.171 9.353 878 H GLU 125 H GLU 125 -17.572 -5.162 6.501 879 HA GLU 125 HA GLU 125 -19.441 -4.724 4.409 880 HB2 GLU 125 HB2 GLU 125 -21.099 -5.373 6.203 881 HB3 GLU 125 HB3 GLU 125 -19.832 -6.544 5.866 882 HG2 GLU 125 HG2 GLU 125 -18.610 -5.762 7.857 883 HG3 GLU 125 HG3 GLU 125 -19.919 -4.628 8.192 884 H ASN 126 H ASN 126 -18.318 -2.715 7.016 885 HA ASN 126 HA ASN 126 -20.710 -1.035 6.955 886 HB2 ASN 126 HB2 ASN 126 -18.218 -0.777 8.661 887 HB3 ASN 126 HB3 ASN 126 -19.681 0.190 8.820 888 HD21 ASN 126 HD21 ASN 126 -18.127 -2.790 9.533 889 HD22 ASN 126 HD22 ASN 126 -19.401 -3.460 10.498 890 H ASP 127 H ASP 127 -17.215 -0.843 6.391 891 HA ASP 127 HA ASP 127 -17.597 1.292 4.484 892 HB2 ASP 127 HB2 ASP 127 -17.443 2.324 6.859 893 HB3 ASP 127 HB3 ASP 127 -15.759 1.815 6.826 894 H SER 128 H SER 128 -15.599 1.712 3.286 895 HA SER 128 HA SER 128 -13.548 -0.368 3.651 896 HB2 SER 128 HB2 SER 128 -12.907 0.482 1.261 897 HB3 SER 128 HB3 SER 128 -14.271 -0.618 1.452 898 HG SER 128 HG SER 128 -14.425 1.546 0.196 899 H ASP 129 H ASP 129 -11.555 0.235 4.197 900 HA ASP 129 HA ASP 129 -11.067 3.138 4.470 901 HB2 ASP 129 HB2 ASP 129 -11.330 1.760 6.604 902 HB3 ASP 129 HB3 ASP 129 -9.822 0.957 6.163 903 H SER 130 H SER 130 -9.103 3.928 3.654 904 HA SER 130 HA SER 130 -7.224 1.925 2.646 905 HB2 SER 130 HB2 SER 130 -7.011 3.348 0.553 906 HB3 SER 130 HB3 SER 130 -8.494 2.408 0.718 907 HG SER 130 HG SER 130 -8.776 4.851 1.856 908 H ALA 131 H ALA 131 -5.114 2.526 2.501 909 HA ALA 131 HA ALA 131 -4.395 5.258 3.343 910 HB1 ALA 131 HB1 ALA 131 -2.943 2.720 4.105 911 HB2 ALA 131 HB2 ALA 131 -3.936 3.702 5.183 912 HB3 ALA 131 HB3 ALA 131 -2.445 4.363 4.511 913 H SER 132 H SER 132 -2.574 6.133 2.274 914 HA SER 132 HA SER 132 -1.463 4.579 0.068 915 HB2 SER 132 HB2 SER 132 -3.615 5.816 -0.629 916 HB3 SER 132 HB3 SER 132 -2.679 7.299 -0.442 917 HG SER 132 HG SER 132 -2.771 6.222 -2.595 918 H VAL 133 H VAL 133 0.612 5.226 -0.465 919 HA VAL 133 HA VAL 133 1.645 7.667 0.831 920 HB VAL 133 HB VAL 133 3.244 5.090 0.637 921 HG11 VAL 133 HG11 VAL 133 4.813 6.222 2.147 922 HG12 VAL 133 HG12 VAL 133 3.827 7.683 2.060 923 HG13 VAL 133 HG13 VAL 133 4.628 7.070 0.612 924 HG21 VAL 133 HG21 VAL 133 3.067 4.960 3.092 925 HG22 VAL 133 HG22 VAL 133 1.533 4.702 2.263 926 HG23 VAL 133 HG23 VAL 133 1.864 6.250 3.046 927 H THR 134 H THR 134 2.686 8.961 -0.558 928 HA THR 134 HA THR 134 3.314 8.102 -3.229 929 HB THR 134 HB THR 134 4.062 10.704 -1.878 930 HG1 THR 134 HG1 THR 134 2.083 11.430 -3.003 931 HG21 THR 134 HG21 THR 134 5.232 10.257 -3.996 932 HG22 THR 134 HG22 THR 134 4.097 11.599 -4.156 933 HG23 THR 134 HG23 THR 134 3.679 10.009 -4.797 934 H ILE 135 H ILE 135 5.007 6.880 -3.558 935 HA ILE 135 HA ILE 135 7.370 7.023 -1.826 936 HB ILE 135 HB ILE 135 6.764 5.038 -4.042 937 HG12 ILE 135 HG12 ILE 135 5.015 4.886 -2.323 938 HG13 ILE 135 HG13 ILE 135 6.026 3.449 -2.341 939 HG21 ILE 135 HG21 ILE 135 9.118 5.146 -3.480 940 HG22 ILE 135 HG22 ILE 135 8.432 3.614 -2.942 941 HG23 ILE 135 HG23 ILE 135 8.747 4.897 -1.773 942 HD11 ILE 135 HD11 ILE 135 5.472 4.105 -0.080 943 HD12 ILE 135 HD12 ILE 135 6.181 5.696 -0.346 944 HD13 ILE 135 HD13 ILE 135 7.210 4.261 -0.356 945 H ARG 136 H ARG 136 9.053 8.269 -2.532 946 HA ARG 136 HA ARG 136 9.228 8.714 -5.426 947 HB2 ARG 136 HB2 ARG 136 8.945 10.781 -4.052 948 HB3 ARG 136 HB3 ARG 136 10.459 10.412 -3.238 949 HG2 ARG 136 HG2 ARG 136 11.697 10.672 -5.276 950 HG3 ARG 136 HG3 ARG 136 10.214 10.825 -6.215 951 HD2 ARG 136 HD2 ARG 136 11.236 12.992 -5.906 952 HD3 ARG 136 HD3 ARG 136 9.707 12.921 -5.036 953 HE ARG 136 HE ARG 136 11.190 12.436 -3.011 954 HH11 ARG 136 HH11 ARG 136 12.257 14.434 -5.712 955 HH12 ARG 136 HH12 ARG 136 13.278 15.429 -4.723 956 HH21 ARG 136 HH21 ARG 136 12.521 13.767 -1.731 957 HH22 ARG 136 HH22 ARG 136 13.417 15.058 -2.479 958 H ALA 137 H ALA 137 10.567 7.390 -6.325 959 HA ALA 137 HA ALA 137 12.849 6.375 -4.798 960 HB1 ALA 137 HB1 ALA 137 11.661 5.376 -7.392 961 HB2 ALA 137 HB2 ALA 137 11.381 4.683 -5.794 962 HB3 ALA 137 HB3 ALA 137 12.994 4.629 -6.509 963 H LEU 138 H LEU 138 14.596 7.507 -5.028 964 HA LEU 138 HA LEU 138 15.205 8.767 -7.597 965 HB2 LEU 138 HB2 LEU 138 16.718 10.247 -6.205 966 HB3 LEU 138 HB3 LEU 138 14.992 10.525 -6.135 967 HG LEU 138 HG LEU 138 15.262 8.911 -3.999 968 HD11 LEU 138 HD11 LEU 138 17.836 10.486 -4.143 969 HD12 LEU 138 HD12 LEU 138 17.695 8.730 -4.195 970 HD13 LEU 138 HD13 LEU 138 17.237 9.606 -2.735 971 HD21 LEU 138 HD21 LEU 138 15.131 10.963 -2.734 972 HD22 LEU 138 HD22 LEU 138 14.170 11.058 -4.215 973 HD23 LEU 138 HD23 LEU 138 15.736 11.859 -4.130 974 H GLU 139 H GLU 139 17.784 9.242 -7.496 975 HA GLU 139 HA GLU 139 19.015 6.672 -6.784 976 HB2 GLU 139 HB2 GLU 139 18.713 6.945 -9.243 977 HB3 GLU 139 HB3 GLU 139 19.686 8.402 -9.182 978 HG2 GLU 139 HG2 GLU 139 21.070 6.121 -8.041 979 HG3 GLU 139 HG3 GLU 139 20.565 5.836 -9.707 980 H HIS 140 H HIS 140 20.320 7.018 -5.085 981 HA HIS 140 HA HIS 140 21.574 9.503 -4.503 982 HB2 HIS 140 HB2 HIS 140 21.210 7.726 -2.763 983 HB3 HIS 140 HB3 HIS 140 22.438 6.743 -3.549 984 HD1 HIS 140 HD1 HIS 140 22.120 10.106 -1.811 985 HD2 HIS 140 HD2 HIS 140 24.976 7.213 -2.664 986 HE1 HIS 140 HE1 HIS 140 24.218 10.868 -0.660 987 HE2 HIS 140 HE2 HIS 140 25.976 9.207 -1.348 988 H HIS 141 H HIS 141 23.169 10.410 -5.573 989 HA HIS 141 HA HIS 141 23.930 9.247 -8.016 990 HB2 HIS 141 HB2 HIS 141 23.683 11.766 -7.302 991 HB3 HIS 141 HB3 HIS 141 25.400 11.631 -6.912 992 HD1 HIS 141 HD1 HIS 141 27.029 11.661 -8.853 993 HD2 HIS 141 HD2 HIS 141 23.060 11.402 -10.052 994 HE1 HIS 141 HE1 HIS 141 27.048 11.985 -11.343 995 HE2 HIS 141 HE2 HIS 141 24.631 12.054 -12.014 996 H HIS 142 H HIS 142 25.599 8.236 -8.693 997 HA HIS 142 HA HIS 142 27.202 6.810 -6.850 998 HB2 HIS 142 HB2 HIS 142 26.300 6.369 -9.376 999 HB3 HIS 142 HB3 HIS 142 27.965 6.817 -9.722 1000 HD1 HIS 142 HD1 HIS 142 29.686 5.029 -9.439 1001 HD2 HIS 142 HD2 HIS 142 26.070 4.083 -7.614 1002 HE1 HIS 142 HE1 HIS 142 29.889 2.625 -8.733 1003 HE2 HIS 142 HE2 HIS 142 27.643 2.022 -7.779 1004 H HIS 143 H HIS 143 29.053 7.368 -5.973 1005 HA HIS 143 HA HIS 143 30.607 9.563 -7.097 1006 HB2 HIS 143 HB2 HIS 143 31.929 9.494 -4.996 1007 HB3 HIS 143 HB3 HIS 143 30.213 9.743 -4.706 1008 HD1 HIS 143 HD1 HIS 143 32.939 7.165 -4.274 1009 HD2 HIS 143 HD2 HIS 143 28.995 7.828 -3.116 1010 HE1 HIS 143 HE1 HIS 143 32.441 5.434 -2.520 1011 HE2 HIS 143 HE2 HIS 143 30.035 5.775 -1.915 1012 H HIS 144 H HIS 144 32.986 9.359 -7.196 1013 HA HIS 144 HA HIS 144 33.625 6.942 -8.635 1014 HB2 HIS 144 HB2 HIS 144 35.664 8.037 -9.321 1015 HB3 HIS 144 HB3 HIS 144 34.326 9.144 -9.516 1016 HD1 HIS 144 HD1 HIS 144 37.617 8.811 -7.944 1017 HD2 HIS 144 HD2 HIS 144 34.303 11.301 -7.567 1018 HE1 HIS 144 HE1 HIS 144 38.432 10.850 -6.716 1019 HE2 HIS 144 HE2 HIS 144 36.383 12.228 -6.307 1020 H HIS 145 H HIS 145 35.608 5.726 -8.279 1021 HA HIS 145 HA HIS 145 36.016 5.132 -5.466 1022 HB2 HIS 145 HB2 HIS 145 35.737 3.318 -7.174 1023 HB3 HIS 145 HB3 HIS 145 37.250 3.818 -7.912 1024 HD1 HIS 145 HD1 HIS 145 39.415 2.990 -6.843 1025 HD2 HIS 145 HD2 HIS 145 36.012 2.007 -4.656 1026 HE1 HIS 145 HE1 HIS 145 40.182 1.365 -5.088 1027 HE2 HIS 145 HE2 HIS 145 38.125 0.764 -3.785 Start of MODEL 18 1 H1 MET 1 H1 MET 1-107.145 128.768 13.151 2 H2 MET 1 H2 MET 1-106.702 127.130 13.179 3 H3 MET 1 H3 MET 1-106.092 128.150 11.977 4 HA MET 1 HA MET 1-104.820 129.387 13.549 5 HB2 MET 1 HB2 MET 1-106.073 127.523 15.579 6 HB3 MET 1 HB3 MET 1-104.691 128.553 15.918 7 HG2 MET 1 HG2 MET 1-106.051 130.530 15.464 8 HG3 MET 1 HG3 MET 1-107.437 129.494 15.125 9 HE1 MET 1 HE1 MET 1-107.447 131.898 17.236 10 HE2 MET 1 HE2 MET 1-108.273 131.183 18.621 11 HE3 MET 1 HE3 MET 1-108.878 130.897 16.988 12 H ASN 2 H ASN 2-102.869 128.801 12.944 13 HA ASN 2 HA ASN 2-102.003 126.054 13.497 14 HB2 ASN 2 HB2 ASN 2-100.704 125.987 11.426 15 HB3 ASN 2 HB3 ASN 2-102.410 126.205 11.082 16 HD21 ASN 2 HD21 ASN 2-103.112 128.110 10.138 17 HD22 ASN 2 HD22 ASN 2-102.019 129.284 9.475 18 H ALA 3 H ALA 3 -99.775 125.793 13.907 19 HA ALA 3 HA ALA 3 -98.455 128.273 14.803 20 HB1 ALA 3 HB1 ALA 3 -99.181 126.861 16.682 21 HB2 ALA 3 HB2 ALA 3 -97.422 126.970 16.595 22 HB3 ALA 3 HB3 ALA 3 -98.246 125.518 16.026 23 H ARG 4 H ARG 4 -96.559 128.715 13.858 24 HA ARG 4 HA ARG 4 -95.304 126.658 12.227 25 HB2 ARG 4 HB2 ARG 4 -93.870 128.430 11.345 26 HB3 ARG 4 HB3 ARG 4 -95.560 128.882 11.220 27 HG2 ARG 4 HG2 ARG 4 -95.376 130.448 12.977 28 HG3 ARG 4 HG3 ARG 4 -93.805 129.819 13.471 29 HD2 ARG 4 HD2 ARG 4 -93.479 131.891 12.312 30 HD3 ARG 4 HD3 ARG 4 -92.873 130.576 11.312 31 HE ARG 4 HE ARG 4 -95.373 130.909 10.362 32 HH11 ARG 4 HH11 ARG 4 -92.820 133.239 11.034 33 HH12 ARG 4 HH12 ARG 4 -93.265 134.289 9.722 34 HH21 ARG 4 HH21 ARG 4 -95.969 132.306 8.657 35 HH22 ARG 4 HH22 ARG 4 -95.072 133.767 8.388 36 H ASP 5 H ASP 5 -93.404 125.678 12.674 37 HA ASP 5 HA ASP 5 -91.768 126.764 14.834 38 HB2 ASP 5 HB2 ASP 5 -91.447 124.650 15.927 39 HB3 ASP 5 HB3 ASP 5 -93.174 124.949 15.817 40 H ASN 6 H ASN 6 -89.643 126.547 14.592 41 HA ASN 6 HA ASN 6 -88.416 124.753 12.734 42 HB2 ASN 6 HB2 ASN 6 -89.235 126.660 11.248 43 HB3 ASN 6 HB3 ASN 6 -88.126 127.707 12.128 44 HD21 ASN 6 HD21 ASN 6 -86.960 128.158 10.278 45 HD22 ASN 6 HD22 ASN 6 -85.894 127.007 9.547 46 H LYS 7 H LYS 7 -87.012 124.079 14.282 47 HA LYS 7 HA LYS 7 -85.301 126.167 15.444 48 HB2 LYS 7 HB2 LYS 7 -86.723 124.990 17.128 49 HB3 LYS 7 HB3 LYS 7 -85.915 123.488 16.710 50 HG2 LYS 7 HG2 LYS 7 -85.045 124.525 18.776 51 HG3 LYS 7 HG3 LYS 7 -83.810 124.328 17.529 52 HD2 LYS 7 HD2 LYS 7 -84.029 126.683 16.923 53 HD3 LYS 7 HD3 LYS 7 -85.309 126.885 18.119 54 HE2 LYS 7 HE2 LYS 7 -82.532 125.978 18.839 55 HE3 LYS 7 HE3 LYS 7 -82.998 127.677 18.791 56 HZ1 LYS 7 HZ1 LYS 7 -84.647 127.272 20.475 57 HZ2 LYS 7 HZ2 LYS 7 -83.153 126.698 21.027 58 HZ3 LYS 7 HZ3 LYS 7 -84.323 125.611 20.471 59 H PHE 8 H PHE 8 -83.871 126.158 13.806 60 HA PHE 8 HA PHE 8 -82.419 123.704 13.208 61 HB2 PHE 8 HB2 PHE 8 -83.133 125.248 11.364 62 HB3 PHE 8 HB3 PHE 8 -82.072 126.479 12.032 63 HD1 PHE 8 HD1 PHE 8 -82.171 123.183 10.390 64 HD2 PHE 8 HD2 PHE 8 -79.746 126.468 11.580 65 HE1 PHE 8 HE1 PHE 8 -80.323 122.313 9.018 66 HE2 PHE 8 HE2 PHE 8 -77.895 125.600 10.217 67 HZ PHE 8 HZ PHE 8 -78.181 123.521 8.937 68 H ASN 9 H ASN 9 -81.109 123.246 14.870 69 HA ASN 9 HA ASN 9 -79.254 125.299 15.860 70 HB2 ASN 9 HB2 ASN 9 -80.477 124.008 17.570 71 HB3 ASN 9 HB3 ASN 9 -79.896 122.507 16.875 72 HD21 ASN 9 HD21 ASN 9 -79.016 125.346 18.716 73 HD22 ASN 9 HD22 ASN 9 -77.556 124.699 19.381 74 H THR 10 H THR 10 -76.971 124.894 15.753 75 HA THR 10 HA THR 10 -76.115 123.248 13.555 76 HB THR 10 HB THR 10 -74.349 124.672 15.566 77 HG1 THR 10 HG1 THR 10 -74.701 126.499 14.494 78 HG21 THR 10 HG21 THR 10 -73.859 123.845 12.696 79 HG22 THR 10 HG22 THR 10 -73.188 123.050 14.122 80 HG23 THR 10 HG23 THR 10 -72.720 124.706 13.731 81 H TRP 11 H TRP 11 -76.860 121.210 14.321 82 HA TRP 11 HA TRP 11 -75.295 120.092 16.520 83 HB2 TRP 11 HB2 TRP 11 -77.682 119.771 16.807 84 HB3 TRP 11 HB3 TRP 11 -77.822 119.079 15.195 85 HD1 TRP 11 HD1 TRP 11 -78.312 116.585 15.450 86 HE1 TRP 11 HE1 TRP 11 -77.409 114.647 16.879 87 HE3 TRP 11 HE3 TRP 11 -75.030 119.188 18.405 88 HZ2 TRP 11 HZ2 TRP 11 -75.558 114.265 18.968 89 HZ3 TRP 11 HZ3 TRP 11 -73.732 117.951 20.086 90 HH2 TRP 11 HH2 TRP 11 -73.992 115.542 20.361 91 H ASN 12 H ASN 12 -73.440 119.505 15.744 92 HA ASN 12 HA ASN 12 -73.401 117.384 13.744 93 HB2 ASN 12 HB2 ASN 12 -72.822 119.766 12.791 94 HB3 ASN 12 HB3 ASN 12 -71.300 119.542 13.644 95 HD21 ASN 12 HD21 ASN 12 -73.322 118.448 11.046 96 HD22 ASN 12 HD22 ASN 12 -72.115 117.519 10.226 97 H ASP 13 H ASP 13 -71.442 116.036 14.007 98 HA ASP 13 HA ASP 13 -70.792 115.960 16.834 99 HB2 ASP 13 HB2 ASP 13 -70.124 113.711 16.539 100 HB3 ASP 13 HB3 ASP 13 -71.567 113.915 15.556 101 H SER 14 H SER 14 -68.695 115.652 17.630 102 HA SER 14 HA SER 14 -66.573 116.821 15.960 103 HB2 SER 14 HB2 SER 14 -66.809 116.700 18.985 104 HB3 SER 14 HB3 SER 14 -65.458 117.404 18.097 105 HG SER 14 HG SER 14 -68.131 118.319 18.291 106 H ARG 15 H ARG 15 -65.587 115.131 15.012 107 HA ARG 15 HA ARG 15 -65.012 112.783 16.642 108 HB2 ARG 15 HB2 ARG 15 -64.241 111.814 14.374 109 HB3 ARG 15 HB3 ARG 15 -65.952 111.998 14.698 110 HG2 ARG 15 HG2 ARG 15 -65.904 112.787 12.585 111 HG3 ARG 15 HG3 ARG 15 -65.569 114.293 13.431 112 HD2 ARG 15 HD2 ARG 15 -63.296 112.562 12.567 113 HD3 ARG 15 HD3 ARG 15 -64.124 113.558 11.374 114 HE ARG 15 HE ARG 15 -63.604 115.375 13.228 115 HH11 ARG 15 HH11 ARG 15 -61.491 112.861 11.957 116 HH12 ARG 15 HH12 ARG 15 -60.049 113.794 12.206 117 HH21 ARG 15 HH21 ARG 15 -61.699 116.561 13.583 118 HH22 ARG 15 HH22 ARG 15 -60.163 115.879 13.137 119 H GLY 16 H GLY 16 -62.816 111.673 15.889 120 HA2 GLY 16 HA2 GLY 16 -60.669 113.646 15.685 121 HA3 GLY 16 HA3 GLY 16 -60.703 112.642 17.128 122 H ASN 17 H ASN 17 -58.616 112.731 15.146 123 HA ASN 17 HA ASN 17 -58.947 110.278 13.610 124 HB2 ASN 17 HB2 ASN 17 -56.900 110.848 12.449 125 HB3 ASN 17 HB3 ASN 17 -57.968 112.240 12.464 126 HD21 ASN 17 HD21 ASN 17 -55.043 111.971 12.114 127 HD22 ASN 17 HD22 ASN 17 -54.348 113.036 13.291 128 H TYR 18 H TYR 18 -57.428 108.586 13.627 129 HA TYR 18 HA TYR 18 -55.533 108.440 15.821 130 HB2 TYR 18 HB2 TYR 18 -56.345 106.249 16.581 131 HB3 TYR 18 HB3 TYR 18 -57.576 107.481 16.795 132 HD1 TYR 18 HD2 TYR 18 -59.625 107.431 15.449 133 HD2 TYR 18 HD1 TYR 18 -56.651 104.419 15.008 134 HE1 TYR 18 HE2 TYR 18 -61.246 106.004 14.276 135 HE2 TYR 18 HE1 TYR 18 -58.272 102.985 13.853 136 HH TYR 18 HH TYR 18 -60.749 102.718 13.739 137 H TRP 19 H TRP 19 -53.922 106.771 15.482 138 HA TRP 19 HA TRP 19 -54.078 105.296 12.982 139 HB2 TRP 19 HB2 TRP 19 -52.918 107.461 12.449 140 HB3 TRP 19 HB3 TRP 19 -51.661 107.017 13.600 141 HD1 TRP 19 HD1 TRP 19 -53.333 105.071 10.687 142 HE1 TRP 19 HE1 TRP 19 -51.458 104.029 9.250 143 HE3 TRP 19 HE3 TRP 19 -49.270 106.851 13.233 144 HZ2 TRP 19 HZ2 TRP 19 -48.635 103.978 9.207 145 HZ3 TRP 19 HZ3 TRP 19 -47.022 106.261 12.427 146 HH2 TRP 19 HH2 TRP 19 -46.712 104.856 10.458 147 H SER 20 H SER 20 -54.131 103.377 14.002 148 HA SER 20 HA SER 20 -51.707 102.608 15.472 149 HB2 SER 20 HB2 SER 20 -54.528 101.815 16.248 150 HB3 SER 20 HB3 SER 20 -53.046 101.292 17.049 151 HG SER 20 HG SER 20 -52.703 103.706 17.282 152 H ASP 21 H ASP 21 -50.739 101.286 14.076 153 HA ASP 21 HA ASP 21 -52.269 99.305 12.579 154 HB2 ASP 21 HB2 ASP 21 -50.484 100.553 11.423 155 HB3 ASP 21 HB3 ASP 21 -49.307 99.947 12.577 156 H TYR 22 H TYR 22 -52.075 97.089 12.885 157 HA TYR 22 HA TYR 22 -51.452 96.366 15.611 158 HB2 TYR 22 HB2 TYR 22 -53.544 95.595 14.527 159 HB3 TYR 22 HB3 TYR 22 -52.585 94.660 13.385 160 HD1 TYR 22 HD2 TYR 22 -53.084 95.052 17.071 161 HD2 TYR 22 HD1 TYR 22 -52.175 92.417 13.853 162 HE1 TYR 22 HE2 TYR 22 -53.081 93.153 18.632 163 HE2 TYR 22 HE1 TYR 22 -52.170 90.514 15.410 164 HH TYR 22 HH TYR 22 -53.406 90.708 18.560 165 H GLU 23 H GLU 23 -49.632 95.522 16.261 166 HA GLU 23 HA GLU 23 -47.897 94.162 14.315 167 HB2 GLU 23 HB2 GLU 23 -46.983 96.222 15.433 168 HB3 GLU 23 HB3 GLU 23 -47.098 95.379 16.969 169 HG2 GLU 23 HG2 GLU 23 -45.528 93.673 16.117 170 HG3 GLU 23 HG3 GLU 23 -45.374 94.598 14.624 171 H GLY 24 H GLY 24 -48.017 92.031 14.459 172 HA2 GLY 24 HA2 GLY 24 -48.121 90.791 17.133 173 HA3 GLY 24 HA3 GLY 24 -49.260 90.282 15.891 174 H SER 25 H SER 25 -46.031 90.096 17.078 175 HA SER 25 HA SER 25 -45.305 88.265 14.885 176 HB2 SER 25 HB2 SER 25 -43.402 89.864 16.619 177 HB3 SER 25 HB3 SER 25 -42.982 88.876 15.222 178 HG SER 25 HG SER 25 -44.150 91.406 15.346 179 H ASP 26 H ASP 26 -45.905 86.328 15.717 180 HA ASP 26 HA ASP 26 -44.235 85.279 17.842 181 HB2 ASP 26 HB2 ASP 26 -46.078 84.284 19.089 182 HB3 ASP 26 HB3 ASP 26 -46.240 86.034 19.055 183 H GLU 27 H GLU 27 -43.745 83.150 17.590 184 HA GLU 27 HA GLU 27 -45.234 81.600 15.610 185 HB2 GLU 27 HB2 GLU 27 -43.389 82.735 14.380 186 HB3 GLU 27 HB3 GLU 27 -42.232 81.963 15.453 187 HG2 GLU 27 HG2 GLU 27 -42.311 80.777 13.362 188 HG3 GLU 27 HG3 GLU 27 -42.959 79.762 14.644 189 H ASN 28 H ASN 28 -45.665 79.697 16.417 190 HA ASN 28 HA ASN 28 -43.655 78.143 17.814 191 HB2 ASN 28 HB2 ASN 28 -44.899 79.470 19.605 192 HB3 ASN 28 HB3 ASN 28 -46.347 78.585 19.145 193 HD21 ASN 28 HD21 ASN 28 -43.004 77.423 19.438 194 HD22 ASN 28 HD22 ASN 28 -43.350 76.253 20.666 195 H GLY 29 H GLY 29 -43.883 75.996 17.321 196 HA2 GLY 29 HA2 GLY 29 -46.487 75.051 16.350 197 HA3 GLY 29 HA3 GLY 29 -45.094 74.890 15.290 198 H ASP 30 H ASP 30 -46.916 73.403 17.667 199 HA ASP 30 HA ASP 30 -44.728 71.574 18.376 200 HB2 ASP 30 HB2 ASP 30 -46.172 70.817 20.238 201 HB3 ASP 30 HB3 ASP 30 -45.791 72.527 20.338 202 H GLY 31 H GLY 31 -45.018 69.335 18.231 203 HA2 GLY 31 HA2 GLY 31 -47.340 68.037 17.349 204 HA3 GLY 31 HA3 GLY 31 -46.378 68.442 15.936 205 H ILE 32 H ILE 32 -46.319 66.705 19.024 206 HA ILE 32 HA ILE 32 -44.235 64.939 17.908 207 HB ILE 32 HB ILE 32 -45.080 65.204 20.813 208 HG12 ILE 32 HG12 ILE 32 -42.489 66.126 19.550 209 HG13 ILE 32 HG13 ILE 32 -43.859 67.195 19.817 210 HG21 ILE 32 HG21 ILE 32 -43.087 63.842 21.288 211 HG22 ILE 32 HG22 ILE 32 -42.795 63.674 19.557 212 HG23 ILE 32 HG23 ILE 32 -44.245 62.975 20.278 213 HD11 ILE 32 HD11 ILE 32 -42.333 65.722 21.955 214 HD12 ILE 32 HD12 ILE 32 -43.696 66.809 22.220 215 HD13 ILE 32 HD13 ILE 32 -42.185 67.435 21.560 216 H GLY 33 H GLY 33 -45.120 63.253 16.914 217 HA2 GLY 33 HA2 GLY 33 -47.279 61.777 18.265 218 HA3 GLY 33 HA3 GLY 33 -47.487 62.259 16.587 219 H ASP 34 H ASP 34 -45.910 60.105 18.781 220 HA ASP 34 HA ASP 34 -44.456 58.785 16.608 221 HB2 ASP 34 HB2 ASP 34 -43.221 57.601 18.354 222 HB3 ASP 34 HB3 ASP 34 -43.158 59.335 18.632 223 H SER 35 H SER 35 -44.627 56.554 16.232 224 HA SER 35 HA SER 35 -46.745 55.059 17.571 225 HB2 SER 35 HB2 SER 35 -46.642 55.455 14.565 226 HB3 SER 35 HB3 SER 35 -47.682 54.291 15.386 227 HG SER 35 HG SER 35 -47.905 56.810 16.413 228 H ALA 36 H ALA 36 -46.531 52.800 17.395 229 HA ALA 36 HA ALA 36 -44.261 51.719 15.913 230 HB1 ALA 36 HB1 ALA 36 -43.405 50.499 17.856 231 HB2 ALA 36 HB2 ALA 36 -44.601 51.289 18.884 232 HB3 ALA 36 HB3 ALA 36 -43.330 52.241 18.115 233 H TYR 37 H TYR 37 -44.328 49.325 15.826 234 HA TYR 37 HA TYR 37 -47.072 48.298 16.171 235 HB2 TYR 37 HB2 TYR 37 -45.101 47.680 13.956 236 HB3 TYR 37 HB3 TYR 37 -46.620 46.828 14.195 237 HD1 TYR 37 HD2 TYR 37 -48.774 48.013 13.829 238 HD2 TYR 37 HD1 TYR 37 -45.036 49.836 12.919 239 HE1 TYR 37 HE2 TYR 37 -49.931 49.690 12.454 240 HE2 TYR 37 HE1 TYR 37 -46.187 51.517 11.546 241 HH TYR 37 HH TYR 37 -48.245 51.846 10.375 242 H ALA 38 H ALA 38 -47.025 45.772 16.064 243 HA ALA 38 HA ALA 38 -45.164 44.914 18.146 244 HB1 ALA 38 HB1 ALA 38 -47.610 43.541 17.038 245 HB2 ALA 38 HB2 ALA 38 -47.547 44.515 18.507 246 HB3 ALA 38 HB3 ALA 38 -46.652 42.997 18.417 247 H VAL 39 H VAL 39 -43.897 43.063 17.998 248 HA VAL 39 HA VAL 39 -43.428 42.113 15.254 249 HB VAL 39 HB VAL 39 -41.585 43.509 16.115 250 HG11 VAL 39 HG11 VAL 39 -40.108 42.721 17.892 251 HG12 VAL 39 HG12 VAL 39 -41.213 41.386 18.221 252 HG13 VAL 39 HG13 VAL 39 -41.735 43.049 18.490 253 HG21 VAL 39 HG21 VAL 39 -40.872 40.612 15.703 254 HG22 VAL 39 HG22 VAL 39 -39.735 41.957 15.624 255 HG23 VAL 39 HG23 VAL 39 -41.057 41.851 14.462 256 H ASN 40 H ASN 40 -43.198 39.931 14.912 257 HA ASN 40 HA ASN 40 -43.869 38.193 17.194 258 HB2 ASN 40 HB2 ASN 40 -44.645 38.022 14.281 259 HB3 ASN 40 HB3 ASN 40 -44.777 36.645 15.361 260 HD21 ASN 40 HD21 ASN 40 -46.398 36.559 16.836 261 HD22 ASN 40 HD22 ASN 40 -47.679 37.726 16.924 262 HA PRO 41 HA PRO 41 -39.845 36.300 16.219 263 HB2 PRO 41 HB2 PRO 41 -39.973 34.542 18.334 264 HB3 PRO 41 HB3 PRO 41 -39.315 36.176 18.438 265 HG2 PRO 41 HG2 PRO 41 -41.983 35.145 19.275 266 HG3 PRO 41 HG3 PRO 41 -40.962 36.377 20.038 267 HD2 PRO 41 HD2 PRO 41 -43.151 36.972 18.540 268 HD3 PRO 41 HD3 PRO 41 -41.749 38.047 18.674 269 H GLU 42 H GLU 42 -42.835 34.611 17.097 270 HA GLU 42 HA GLU 42 -42.075 32.383 15.319 271 HB2 GLU 42 HB2 GLU 42 -44.081 32.377 17.586 272 HB3 GLU 42 HB3 GLU 42 -43.631 30.992 16.605 273 HG2 GLU 42 HG2 GLU 42 -41.821 32.486 18.489 274 HG3 GLU 42 HG3 GLU 42 -42.598 30.939 18.818 275 H ALA 43 H ALA 43 -44.407 31.218 14.796 276 HA ALA 43 HA ALA 43 -45.980 33.246 13.379 277 HB1 ALA 43 HB1 ALA 43 -46.844 31.359 12.077 278 HB2 ALA 43 HB2 ALA 43 -45.943 30.236 13.096 279 HB3 ALA 43 HB3 ALA 43 -45.081 31.378 12.065 280 H GLY 44 H GLY 44 -46.274 33.153 16.136 281 HA2 GLY 44 HA2 GLY 44 -48.415 33.382 17.309 282 HA3 GLY 44 HA3 GLY 44 -48.892 31.857 16.569 283 H SER 45 H SER 45 -49.202 30.703 18.450 284 HA SER 45 HA SER 45 -46.894 30.304 20.185 285 HB2 SER 45 HB2 SER 45 -49.654 29.044 20.273 286 HB3 SER 45 HB3 SER 45 -48.399 28.858 21.502 287 HG SER 45 HG SER 45 -49.073 31.475 20.838 288 H MET 46 H MET 46 -45.491 28.683 19.902 289 HA MET 46 HA MET 46 -46.168 26.651 17.877 290 HB2 MET 46 HB2 MET 46 -43.481 27.920 18.448 291 HB3 MET 46 HB3 MET 46 -43.749 26.601 17.316 292 HG2 MET 46 HG2 MET 46 -44.926 29.362 17.103 293 HG3 MET 46 HG3 MET 46 -43.541 28.765 16.198 294 HE1 MET 46 HE1 MET 46 -43.703 26.871 14.319 295 HE2 MET 46 HE2 MET 46 -45.195 26.010 13.941 296 HE3 MET 46 HE3 MET 46 -44.427 25.793 15.514 297 H ASP 47 H ASP 47 -46.121 24.628 18.510 298 HA ASP 47 HA ASP 47 -44.474 23.907 20.841 299 HB2 ASP 47 HB2 ASP 47 -46.031 22.136 21.382 300 HB3 ASP 47 HB3 ASP 47 -46.916 23.650 21.276 301 H TYR 48 H TYR 48 -43.870 21.496 20.759 302 HA TYR 48 HA TYR 48 -43.158 20.789 17.999 303 HB2 TYR 48 HB2 TYR 48 -40.976 19.959 18.809 304 HB3 TYR 48 HB3 TYR 48 -41.165 21.684 19.076 305 HD1 TYR 48 HD1 TYR 48 -41.323 22.576 21.351 306 HD2 TYR 48 HD2 TYR 48 -40.860 18.401 20.675 307 HE1 TYR 48 HE1 TYR 48 -40.695 22.267 23.705 308 HE2 TYR 48 HE2 TYR 48 -40.240 18.086 23.026 309 HH TYR 48 HH TYR 48 -39.330 19.376 24.869 310 H MET 49 H MET 49 -42.700 18.498 17.664 311 HA MET 49 HA MET 49 -44.270 16.814 19.503 312 HB2 MET 49 HB2 MET 49 -43.645 16.433 16.563 313 HB3 MET 49 HB3 MET 49 -44.479 15.250 17.562 314 HG2 MET 49 HG2 MET 49 -46.286 16.842 17.952 315 HG3 MET 49 HG3 MET 49 -45.447 18.039 16.966 316 HE1 MET 49 HE1 MET 49 -47.231 14.106 15.306 317 HE2 MET 49 HE2 MET 49 -47.377 14.612 16.990 318 HE3 MET 49 HE3 MET 49 -45.806 14.141 16.344 319 HA PRO 50 HA PRO 50 -40.322 15.005 20.588 320 HB2 PRO 50 HB2 PRO 50 -41.907 12.889 21.871 321 HB3 PRO 50 HB3 PRO 50 -40.788 14.049 22.594 322 HG2 PRO 50 HG2 PRO 50 -43.441 14.220 22.973 323 HG3 PRO 50 HG3 PRO 50 -42.416 15.660 22.854 324 HD2 PRO 50 HD2 PRO 50 -44.182 14.418 20.778 325 HD3 PRO 50 HD3 PRO 50 -43.963 16.133 21.187 326 H LEU 51 H LEU 51 -39.045 13.305 19.961 327 HA LEU 51 HA LEU 51 -40.188 11.683 17.792 328 HB2 LEU 51 HB2 LEU 51 -38.488 13.346 17.161 329 HB3 LEU 51 HB3 LEU 51 -37.347 12.598 18.257 330 HG LEU 51 HG LEU 51 -37.424 10.535 16.864 331 HD11 LEU 51 HD11 LEU 51 -39.060 12.245 14.994 332 HD12 LEU 51 HD12 LEU 51 -39.628 10.822 15.869 333 HD13 LEU 51 HD13 LEU 51 -38.391 10.655 14.623 334 HD21 LEU 51 HD21 LEU 51 -36.664 13.083 15.445 335 HD22 LEU 51 HD22 LEU 51 -36.117 11.466 15.004 336 HD23 LEU 51 HD23 LEU 51 -35.652 12.160 16.557 337 H MET 52 H MET 52 -40.001 9.538 17.781 338 HA MET 52 HA MET 52 -39.173 8.102 20.107 339 HB2 MET 52 HB2 MET 52 -40.017 7.204 17.352 340 HB3 MET 52 HB3 MET 52 -39.579 6.078 18.627 341 HG2 MET 52 HG2 MET 52 -41.399 6.886 20.003 342 HG3 MET 52 HG3 MET 52 -41.821 8.082 18.776 343 HE1 MET 52 HE1 MET 52 -43.940 6.072 19.986 344 HE2 MET 52 HE2 MET 52 -44.785 5.522 18.539 345 HE3 MET 52 HE3 MET 52 -44.346 7.223 18.714 346 H GLU 53 H GLU 53 -37.554 6.449 20.182 347 HA GLU 53 HA GLU 53 -35.328 6.830 18.309 348 HB2 GLU 53 HB2 GLU 53 -33.741 6.775 20.181 349 HB3 GLU 53 HB3 GLU 53 -34.844 8.132 20.328 350 HG2 GLU 53 HG2 GLU 53 -36.195 6.649 21.902 351 HG3 GLU 53 HG3 GLU 53 -34.789 5.590 21.923 352 H TYR 54 H TYR 54 -33.984 5.028 18.010 353 HA TYR 54 HA TYR 54 -34.943 2.527 19.225 354 HB2 TYR 54 HB2 TYR 54 -33.957 1.353 17.239 355 HB3 TYR 54 HB3 TYR 54 -35.337 2.368 16.872 356 HD1 TYR 54 HD2 TYR 54 -31.692 1.980 16.464 357 HD2 TYR 54 HD1 TYR 54 -35.117 4.277 15.419 358 HE1 TYR 54 HE2 TYR 54 -30.421 3.042 14.649 359 HE2 TYR 54 HE1 TYR 54 -33.858 5.336 13.595 360 HH TYR 54 HH TYR 54 -30.987 4.155 12.417 361 H LEU 55 H LEU 55 -33.072 0.812 19.181 362 HA LEU 55 HA LEU 55 -30.826 2.038 20.564 363 HB2 LEU 55 HB2 LEU 55 -31.682 -0.827 20.184 364 HB3 LEU 55 HB3 LEU 55 -30.109 -0.419 20.828 365 HG LEU 55 HG LEU 55 -31.398 -0.906 22.704 366 HD11 LEU 55 HD11 LEU 55 -30.150 1.135 23.014 367 HD12 LEU 55 HD12 LEU 55 -31.657 1.182 23.929 368 HD13 LEU 55 HD13 LEU 55 -31.514 2.083 22.420 369 HD21 LEU 55 HD21 LEU 55 -33.589 -0.972 21.668 370 HD22 LEU 55 HD22 LEU 55 -33.627 0.790 21.599 371 HD23 LEU 55 HD23 LEU 55 -33.628 -0.032 23.159 372 H HIS 56 H HIS 56 -28.796 2.213 19.792 373 HA HIS 56 HA HIS 56 -28.387 1.558 16.990 374 HB2 HIS 56 HB2 HIS 56 -26.338 2.880 17.125 375 HB3 HIS 56 HB3 HIS 56 -27.700 3.790 17.746 376 HD1 HIS 56 HD1 HIS 56 -27.522 4.670 20.116 377 HD2 HIS 56 HD2 HIS 56 -24.412 2.099 19.099 378 HE1 HIS 56 HE1 HIS 56 -25.808 4.909 21.955 379 HE2 HIS 56 HE2 HIS 56 -24.066 3.172 21.428 380 H SER 57 H SER 57 -26.849 0.155 16.194 381 HA SER 57 HA SER 57 -25.732 -1.724 18.122 382 HB2 SER 57 HB2 SER 57 -25.190 -3.047 15.991 383 HB3 SER 57 HB3 SER 57 -26.898 -2.849 16.384 384 HG SER 57 HG SER 57 -26.547 -2.405 14.201 385 H SER 58 H SER 58 -24.761 0.224 15.345 386 HA SER 58 HA SER 58 -22.854 1.151 14.621 387 HB2 SER 58 HB2 SER 58 -22.065 1.135 17.543 388 HB3 SER 58 HB3 SER 58 -21.302 2.093 16.274 389 HG SER 58 HG SER 58 -23.928 2.517 16.161 390 HA PRO 59 HA PRO 59 -20.477 -2.757 14.411 391 HB2 PRO 59 HB2 PRO 59 -20.356 -2.803 11.676 392 HB3 PRO 59 HB3 PRO 59 -21.613 -3.580 12.637 393 HG2 PRO 59 HG2 PRO 59 -21.733 -1.138 11.008 394 HG3 PRO 59 HG3 PRO 59 -23.037 -2.220 11.519 395 HD2 PRO 59 HD2 PRO 59 -22.413 0.304 12.592 396 HD3 PRO 59 HD3 PRO 59 -23.545 -0.887 13.255 397 H VAL 60 H VAL 60 -18.402 -3.207 13.155 398 HA VAL 60 HA VAL 60 -16.793 -0.787 13.500 399 HB VAL 60 HB VAL 60 -16.322 -2.707 14.995 400 HG11 VAL 60 HG11 VAL 60 -15.371 -4.108 12.513 401 HG12 VAL 60 HG12 VAL 60 -16.752 -4.557 13.512 402 HG13 VAL 60 HG13 VAL 60 -15.117 -4.662 14.170 403 HG21 VAL 60 HG21 VAL 60 -14.598 -1.073 14.622 404 HG22 VAL 60 HG22 VAL 60 -14.059 -1.923 13.173 405 HG23 VAL 60 HG23 VAL 60 -13.881 -2.679 14.757 406 H LEU 61 H LEU 61 -15.588 0.047 11.963 407 HA LEU 61 HA LEU 61 -15.625 -1.194 9.325 408 HB2 LEU 61 HB2 LEU 61 -14.701 1.129 8.609 409 HB3 LEU 61 HB3 LEU 61 -16.396 0.937 8.951 410 HG LEU 61 HG LEU 61 -15.371 3.103 9.686 411 HD11 LEU 61 HD11 LEU 61 -16.490 3.229 11.844 412 HD12 LEU 61 HD12 LEU 61 -16.634 1.472 11.872 413 HD13 LEU 61 HD13 LEU 61 -17.472 2.405 10.632 414 HD21 LEU 61 HD21 LEU 61 -14.105 3.183 11.767 415 HD22 LEU 61 HD22 LEU 61 -13.232 2.339 10.487 416 HD23 LEU 61 HD23 LEU 61 -14.016 1.422 11.773 417 HA PRO 62 HA PRO 62 -11.347 -2.252 9.497 418 HB2 PRO 62 HB2 PRO 62 -10.330 -1.618 7.076 419 HB3 PRO 62 HB3 PRO 62 -11.360 -3.037 7.365 420 HG2 PRO 62 HG2 PRO 62 -12.051 -0.400 6.164 421 HG3 PRO 62 HG3 PRO 62 -12.656 -2.015 5.752 422 HD2 PRO 62 HD2 PRO 62 -14.061 -0.203 7.241 423 HD3 PRO 62 HD3 PRO 62 -14.269 -1.956 7.370 424 H THR 63 H THR 63 -9.104 -1.542 8.731 425 HA THR 63 HA THR 63 -8.613 1.308 8.964 426 HB THR 63 HB THR 63 -7.232 -0.686 10.783 427 HG1 THR 63 HG1 THR 63 -9.626 0.593 11.080 428 HG21 THR 63 HG21 THR 63 -5.947 1.285 10.143 429 HG22 THR 63 HG22 THR 63 -6.360 1.316 11.859 430 HG23 THR 63 HG23 THR 63 -7.252 2.321 10.715 431 H ALA 64 H ALA 64 -7.441 1.602 7.136 432 HA ALA 64 HA ALA 64 -5.580 -0.451 6.266 433 HB1 ALA 64 HB1 ALA 64 -5.230 0.948 4.316 434 HB2 ALA 64 HB2 ALA 64 -6.196 2.231 5.047 435 HB3 ALA 64 HB3 ALA 64 -6.953 0.700 4.603 436 H ARG 65 H ARG 65 -3.762 -0.546 7.300 437 HA ARG 65 HA ARG 65 -2.210 1.892 7.748 438 HB2 ARG 65 HB2 ARG 65 -3.270 1.170 9.891 439 HB3 ARG 65 HB3 ARG 65 -2.517 -0.406 9.713 440 HG2 ARG 65 HG2 ARG 65 -0.325 0.565 9.968 441 HG3 ARG 65 HG3 ARG 65 -1.016 2.190 10.007 442 HD2 ARG 65 HD2 ARG 65 -2.179 1.694 12.059 443 HD3 ARG 65 HD3 ARG 65 -1.646 0.013 11.998 444 HE ARG 65 HE ARG 65 0.634 0.835 12.363 445 HH11 ARG 65 HH11 ARG 65 -1.970 3.114 13.057 446 HH12 ARG 65 HH12 ARG 65 -1.063 3.973 14.266 447 HH21 ARG 65 HH21 ARG 65 1.815 1.944 13.940 448 HH22 ARG 65 HH22 ARG 65 1.108 3.297 14.769 449 H PHE 66 H PHE 66 0.025 1.571 7.343 450 HA PHE 66 HA PHE 66 1.044 -1.036 6.762 451 HB2 PHE 66 HB2 PHE 66 1.561 -0.619 4.361 452 HB3 PHE 66 HB3 PHE 66 -0.134 -0.875 4.710 453 HD1 PHE 66 HD1 PHE 66 0.542 2.478 5.615 454 HD2 PHE 66 HD2 PHE 66 0.065 -0.044 2.227 455 HE1 PHE 66 HE1 PHE 66 -0.038 4.425 4.237 456 HE2 PHE 66 HE2 PHE 66 -0.512 1.897 0.856 457 HZ PHE 66 HZ PHE 66 -0.564 4.132 1.863 458 H THR 67 H THR 67 3.285 -1.020 5.931 459 HA THR 67 HA THR 67 4.634 1.546 6.051 460 HB THR 67 HB THR 67 4.686 0.381 8.380 461 HG1 THR 67 HG1 THR 67 6.243 2.051 7.246 462 HG21 THR 67 HG21 THR 67 6.565 -1.156 8.729 463 HG22 THR 67 HG22 THR 67 6.849 -1.214 6.991 464 HG23 THR 67 HG23 THR 67 5.355 -1.870 7.663 465 H SER 68 H SER 68 6.635 1.554 4.946 466 HA SER 68 HA SER 68 7.121 -0.816 3.267 467 HB2 SER 68 HB2 SER 68 8.046 0.803 1.584 468 HB3 SER 68 HB3 SER 68 6.321 0.986 1.878 469 HG SER 68 HG SER 68 8.172 2.836 2.053 470 H ASP 69 H ASP 69 9.364 -1.093 2.589 471 HA ASP 69 HA ASP 69 11.195 -0.963 4.735 472 HB2 ASP 69 HB2 ASP 69 11.358 -2.748 3.153 473 HB3 ASP 69 HB3 ASP 69 11.491 -1.635 1.802 474 H ILE 70 H ILE 70 11.275 0.710 1.551 475 HA ILE 70 HA ILE 70 12.744 2.843 2.917 476 HB ILE 70 HB ILE 70 13.530 3.607 0.673 477 HG12 ILE 70 HG12 ILE 70 13.578 1.437 -0.942 478 HG13 ILE 70 HG13 ILE 70 11.988 1.242 -0.220 479 HG21 ILE 70 HG21 ILE 70 14.367 0.853 1.540 480 HG22 ILE 70 HG22 ILE 70 14.993 2.392 2.138 481 HG23 ILE 70 HG23 ILE 70 15.284 1.910 0.465 482 HD11 ILE 70 HD11 ILE 70 11.360 3.465 -1.004 483 HD12 ILE 70 HD12 ILE 70 11.876 2.434 -2.338 484 HD13 ILE 70 HD13 ILE 70 12.962 3.673 -1.709 485 H THR 71 H THR 71 12.246 4.938 2.580 486 HA THR 71 HA THR 71 9.766 5.575 1.133 487 HB THR 71 HB THR 71 9.511 7.429 2.954 488 HG1 THR 71 HG1 THR 71 10.758 5.443 4.559 489 HG21 THR 71 HG21 THR 71 7.873 5.670 2.600 490 HG22 THR 71 HG22 THR 71 8.110 5.954 4.325 491 HG23 THR 71 HG23 THR 71 8.848 4.550 3.553 492 H GLU 72 H GLU 72 13.006 6.125 1.867 493 HA GLU 72 HA GLU 72 13.169 8.386 0.069 494 HB2 GLU 72 HB2 GLU 72 12.927 9.372 2.357 495 HB3 GLU 72 HB3 GLU 72 14.387 8.515 2.839 496 HG2 GLU 72 HG2 GLU 72 15.643 9.752 1.100 497 HG3 GLU 72 HG3 GLU 72 14.176 10.652 0.723 498 H GLY 73 H GLY 73 14.760 8.020 -1.259 499 HA2 GLY 73 HA2 GLY 73 17.308 7.401 -1.111 500 HA3 GLY 73 HA3 GLY 73 16.610 5.828 -0.721 501 H PHE 74 H PHE 74 17.978 5.562 -2.864 502 HA PHE 74 HA PHE 74 16.436 6.299 -5.220 503 HB2 PHE 74 HB2 PHE 74 18.226 5.419 -6.541 504 HB3 PHE 74 HB3 PHE 74 18.983 6.295 -5.221 505 HD1 PHE 74 HD1 PHE 74 19.797 4.883 -3.206 506 HD2 PHE 74 HD2 PHE 74 18.832 3.239 -7.012 507 HE1 PHE 74 HE1 PHE 74 21.142 2.896 -2.689 508 HE2 PHE 74 HE2 PHE 74 20.173 1.245 -6.493 509 HZ PHE 74 HZ PHE 74 21.328 1.075 -4.328 510 H ALA 75 H ALA 75 15.504 4.700 -6.604 511 HA ALA 75 HA ALA 75 13.994 2.739 -5.375 512 HB1 ALA 75 HB1 ALA 75 13.328 2.063 -7.581 513 HB2 ALA 75 HB2 ALA 75 14.758 2.817 -8.285 514 HB3 ALA 75 HB3 ALA 75 13.511 3.820 -7.545 515 HA PRO 76 HA PRO 76 17.029 -0.612 -5.264 516 HB2 PRO 76 HB2 PRO 76 15.660 -1.840 -3.139 517 HB3 PRO 76 HB3 PRO 76 17.044 -0.758 -2.997 518 HG2 PRO 76 HG2 PRO 76 14.419 -0.256 -2.115 519 HG3 PRO 76 HG3 PRO 76 15.742 0.917 -2.221 520 HD2 PRO 76 HD2 PRO 76 13.480 0.433 -4.098 521 HD3 PRO 76 HD3 PRO 76 14.336 1.945 -3.719 522 H LEU 77 H LEU 77 16.382 -3.165 -4.775 523 HA LEU 77 HA LEU 77 14.549 -3.767 -6.945 524 HB2 LEU 77 HB2 LEU 77 16.802 -4.874 -6.665 525 HB3 LEU 77 HB3 LEU 77 16.159 -5.686 -5.252 526 HG LEU 77 HG LEU 77 14.408 -6.704 -6.756 527 HD11 LEU 77 HD11 LEU 77 16.197 -5.575 -8.905 528 HD12 LEU 77 HD12 LEU 77 14.521 -5.123 -8.589 529 HD13 LEU 77 HD13 LEU 77 14.904 -6.747 -9.162 530 HD21 LEU 77 HD21 LEU 77 16.390 -7.931 -5.998 531 HD22 LEU 77 HD22 LEU 77 17.287 -7.336 -7.397 532 HD23 LEU 77 HD23 LEU 77 15.907 -8.410 -7.626 533 H SER 78 H SER 78 14.965 -5.485 -3.862 534 HA SER 78 HA SER 78 12.080 -5.878 -3.747 535 HB2 SER 78 HB2 SER 78 13.592 -7.809 -3.424 536 HB3 SER 78 HB3 SER 78 14.278 -7.027 -2.003 537 HG SER 78 HG SER 78 12.103 -8.557 -2.170 538 H VAL 79 H VAL 79 11.139 -4.025 -3.018 539 HA VAL 79 HA VAL 79 12.070 -2.819 -0.528 540 HB VAL 79 HB VAL 79 9.679 -2.045 -2.227 541 HG11 VAL 79 HG11 VAL 79 9.496 -1.238 0.066 542 HG12 VAL 79 HG12 VAL 79 9.795 0.101 -1.042 543 HG13 VAL 79 HG13 VAL 79 11.106 -0.523 -0.041 544 HG21 VAL 79 HG21 VAL 79 11.729 -1.824 -3.506 545 HG22 VAL 79 HG22 VAL 79 12.460 -0.882 -2.205 546 HG23 VAL 79 HG23 VAL 79 11.080 -0.236 -3.094 547 H ARG 80 H ARG 80 11.620 -4.199 1.096 548 HA ARG 80 HA ARG 80 9.496 -6.036 1.159 549 HB2 ARG 80 HB2 ARG 80 11.001 -5.019 3.575 550 HB3 ARG 80 HB3 ARG 80 10.215 -6.580 3.378 551 HG2 ARG 80 HG2 ARG 80 11.860 -7.090 1.563 552 HG3 ARG 80 HG3 ARG 80 12.702 -5.601 1.997 553 HD2 ARG 80 HD2 ARG 80 13.825 -7.336 3.131 554 HD3 ARG 80 HD3 ARG 80 12.841 -6.519 4.346 555 HE ARG 80 HE ARG 80 11.183 -8.426 3.833 556 HH11 ARG 80 HH11 ARG 80 14.691 -8.763 3.838 557 HH12 ARG 80 HH12 ARG 80 14.649 -10.454 4.234 558 HH21 ARG 80 HH21 ARG 80 11.131 -10.643 4.330 559 HH22 ARG 80 HH22 ARG 80 12.614 -11.527 4.523 560 H PHE 81 H PHE 81 7.432 -5.816 1.641 561 HA PHE 81 HA PHE 81 6.602 -3.286 2.889 562 HB2 PHE 81 HB2 PHE 81 6.138 -3.724 0.364 563 HB3 PHE 81 HB3 PHE 81 4.881 -4.809 0.953 564 HD1 PHE 81 HD1 PHE 81 6.012 -1.337 0.774 565 HD2 PHE 81 HD2 PHE 81 2.880 -3.952 1.971 566 HE1 PHE 81 HE1 PHE 81 4.521 0.591 1.074 567 HE2 PHE 81 HE2 PHE 81 1.388 -2.025 2.272 568 HZ PHE 81 HZ PHE 81 2.211 0.244 1.826 569 H LYS 82 H LYS 82 5.250 -3.373 4.566 570 HA LYS 82 HA LYS 82 3.984 -5.952 5.208 571 HB2 LYS 82 HB2 LYS 82 5.358 -4.000 7.049 572 HB3 LYS 82 HB3 LYS 82 4.170 -5.145 7.650 573 HG2 LYS 82 HG2 LYS 82 6.721 -5.868 6.223 574 HG3 LYS 82 HG3 LYS 82 6.473 -5.913 7.967 575 HD2 LYS 82 HD2 LYS 82 4.762 -7.498 6.059 576 HD3 LYS 82 HD3 LYS 82 6.281 -8.121 6.693 577 HE2 LYS 82 HE2 LYS 82 4.677 -9.015 8.131 578 HE3 LYS 82 HE3 LYS 82 5.293 -7.623 9.012 579 HZ1 LYS 82 HZ1 LYS 82 3.349 -6.372 8.385 580 HZ2 LYS 82 HZ2 LYS 82 2.864 -7.823 9.111 581 HZ3 LYS 82 HZ3 LYS 82 2.775 -7.646 7.426 582 H ASP 83 H ASP 83 1.847 -5.889 5.428 583 HA ASP 83 HA ASP 83 0.580 -3.273 5.749 584 HB2 ASP 83 HB2 ASP 83 -1.406 -4.123 4.853 585 HB3 ASP 83 HB3 ASP 83 -0.153 -4.884 3.886 586 H PHE 84 H PHE 84 -0.902 -2.858 7.332 587 HA PHE 84 HA PHE 84 -0.857 -4.660 9.673 588 HB2 PHE 84 HB2 PHE 84 -0.507 -1.648 9.621 589 HB3 PHE 84 HB3 PHE 84 -0.835 -2.561 11.084 590 HD1 PHE 84 HD1 PHE 84 1.659 -1.752 8.534 591 HD2 PHE 84 HD2 PHE 84 0.874 -3.898 12.121 592 HE1 PHE 84 HE1 PHE 84 4.069 -2.069 8.867 593 HE2 PHE 84 HE2 PHE 84 3.289 -4.222 12.456 594 HZ PHE 84 HZ PHE 84 4.888 -3.307 10.828 595 H SER 85 H SER 85 -2.750 -4.216 7.476 596 HA SER 85 HA SER 85 -4.981 -2.727 8.070 597 HB2 SER 85 HB2 SER 85 -5.108 -5.497 6.901 598 HB3 SER 85 HB3 SER 85 -6.143 -4.111 6.547 599 HG SER 85 HG SER 85 -3.626 -4.751 5.578 600 H GLU 86 H GLU 86 -6.558 -2.792 9.548 601 HA GLU 86 HA GLU 86 -6.783 -5.204 11.220 602 HB2 GLU 86 HB2 GLU 86 -5.697 -3.163 12.300 603 HB3 GLU 86 HB3 GLU 86 -7.248 -2.362 12.123 604 HG2 GLU 86 HG2 GLU 86 -6.931 -3.231 14.374 605 HG3 GLU 86 HG3 GLU 86 -8.296 -4.002 13.567 606 H ASN 87 H ASN 87 -8.867 -5.853 11.750 607 HA ASN 87 HA ASN 87 -11.138 -6.014 11.815 608 HB2 ASN 87 HB2 ASN 87 -11.019 -3.018 11.408 609 HB3 ASN 87 HB3 ASN 87 -12.478 -3.907 11.834 610 HD21 ASN 87 HD21 ASN 87 -10.680 -1.833 13.165 611 HD22 ASN 87 HD22 ASN 87 -10.436 -2.457 14.761 612 H ALA 88 H ALA 88 -9.796 -6.438 9.329 613 HA ALA 88 HA ALA 88 -11.857 -5.619 7.396 614 HB1 ALA 88 HB1 ALA 88 -10.113 -5.403 5.699 615 HB2 ALA 88 HB2 ALA 88 -8.889 -5.783 6.909 616 HB3 ALA 88 HB3 ALA 88 -9.835 -4.301 7.049 617 H THR 89 H THR 89 -12.321 -7.050 5.760 618 HA THR 89 HA THR 89 -11.822 -9.839 6.348 619 HB THR 89 HB THR 89 -13.405 -8.629 4.063 620 HG1 THR 89 HG1 THR 89 -13.888 -8.567 6.693 621 HG21 THR 89 HG21 THR 89 -14.555 -10.770 3.999 622 HG22 THR 89 HG22 THR 89 -13.602 -11.358 5.360 623 HG23 THR 89 HG23 THR 89 -12.819 -11.031 3.811 624 H SER 90 H SER 90 -11.372 -7.658 3.538 625 HA SER 90 HA SER 90 -9.232 -9.450 2.618 626 HB2 SER 90 HB2 SER 90 -11.307 -8.052 0.914 627 HB3 SER 90 HB3 SER 90 -9.946 -8.991 0.295 628 HG SER 90 HG SER 90 -10.895 -10.746 1.679 629 H ARG 91 H ARG 91 -7.505 -8.516 1.568 630 HA ARG 91 HA ARG 91 -7.320 -5.587 1.723 631 HB2 ARG 91 HB2 ARG 91 -4.853 -5.912 1.571 632 HB3 ARG 91 HB3 ARG 91 -5.555 -6.664 2.996 633 HG2 ARG 91 HG2 ARG 91 -5.430 -8.841 1.947 634 HG3 ARG 91 HG3 ARG 91 -4.828 -8.115 0.459 635 HD2 ARG 91 HD2 ARG 91 -2.974 -9.038 1.621 636 HD3 ARG 91 HD3 ARG 91 -2.866 -7.285 1.734 637 HE ARG 91 HE ARG 91 -3.298 -7.418 4.023 638 HH11 ARG 91 HH11 ARG 91 -3.496 -10.625 2.574 639 HH12 ARG 91 HH12 ARG 91 -3.220 -11.450 4.077 640 HH21 ARG 91 HH21 ARG 91 -2.914 -8.501 5.970 641 HH22 ARG 91 HH22 ARG 91 -2.899 -10.237 6.012 642 H LEU 92 H LEU 92 -6.943 -4.408 -0.084 643 HA LEU 92 HA LEU 92 -6.979 -5.874 -2.636 644 HB2 LEU 92 HB2 LEU 92 -9.042 -4.522 -1.923 645 HB3 LEU 92 HB3 LEU 92 -8.058 -3.094 -2.128 646 HG LEU 92 HG LEU 92 -8.489 -5.002 -4.418 647 HD11 LEU 92 HD11 LEU 92 -10.274 -2.713 -3.608 648 HD12 LEU 92 HD12 LEU 92 -10.691 -4.425 -3.546 649 HD13 LEU 92 HD13 LEU 92 -10.398 -3.645 -5.101 650 HD21 LEU 92 HD21 LEU 92 -7.977 -2.027 -4.327 651 HD22 LEU 92 HD22 LEU 92 -8.139 -3.017 -5.779 652 HD23 LEU 92 HD23 LEU 92 -6.771 -3.262 -4.692 653 H TRP 93 H TRP 93 -5.012 -5.779 -3.495 654 HA TRP 93 HA TRP 93 -3.317 -3.486 -2.972 655 HB2 TRP 93 HB2 TRP 93 -2.797 -6.150 -4.289 656 HB3 TRP 93 HB3 TRP 93 -1.606 -4.856 -4.259 657 HD1 TRP 93 HD1 TRP 93 -2.341 -7.888 -2.481 658 HE1 TRP 93 HE1 TRP 93 -1.340 -7.886 -0.109 659 HE3 TRP 93 HE3 TRP 93 -1.414 -2.875 -1.988 660 HZ2 TRP 93 HZ2 TRP 93 -0.317 -6.003 1.742 661 HZ3 TRP 93 HZ3 TRP 93 -0.432 -2.061 0.114 662 HH2 TRP 93 HH2 TRP 93 0.100 -3.595 1.937 663 H MET 94 H MET 94 -3.401 -1.800 -4.237 664 HA MET 94 HA MET 94 -3.481 -2.265 -7.127 665 HB2 MET 94 HB2 MET 94 -4.620 -0.027 -7.373 666 HB3 MET 94 HB3 MET 94 -5.607 -1.330 -6.744 667 HG2 MET 94 HG2 MET 94 -5.415 -0.422 -4.508 668 HG3 MET 94 HG3 MET 94 -4.358 0.862 -5.101 669 HE1 MET 94 HE1 MET 94 -5.912 2.793 -4.114 670 HE2 MET 94 HE2 MET 94 -6.941 1.547 -3.409 671 HE3 MET 94 HE3 MET 94 -7.658 2.853 -4.356 672 H PHE 95 H PHE 95 -1.759 -1.647 -8.111 673 HA PHE 95 HA PHE 95 0.022 0.309 -6.774 674 HB2 PHE 95 HB2 PHE 95 0.801 -2.131 -8.385 675 HB3 PHE 95 HB3 PHE 95 1.931 -0.949 -7.742 676 HD1 PHE 95 HD2 PHE 95 1.658 -0.564 -5.104 677 HD2 PHE 95 HD1 PHE 95 0.522 -4.076 -7.223 678 HE1 PHE 95 HE2 PHE 95 1.838 -1.874 -3.030 679 HE2 PHE 95 HE1 PHE 95 0.702 -5.387 -5.150 680 HZ PHE 95 HZ PHE 95 1.360 -4.285 -3.052 681 H GLY 96 H GLY 96 -1.991 0.470 -9.190 682 HA2 GLY 96 HA2 GLY 96 -1.997 1.625 -11.225 683 HA3 GLY 96 HA3 GLY 96 -0.262 1.904 -11.032 684 H ASP 97 H ASP 97 -2.586 -0.678 -11.655 685 HA ASP 97 HA ASP 97 -0.511 -2.203 -13.028 686 HB2 ASP 97 HB2 ASP 97 -0.864 -2.707 -10.415 687 HB3 ASP 97 HB3 ASP 97 -2.164 -3.710 -11.049 688 H GLY 98 H GLY 98 -1.916 -4.548 -13.411 689 HA2 GLY 98 HA2 GLY 98 -4.139 -3.860 -15.114 690 HA3 GLY 98 HA3 GLY 98 -3.569 -5.481 -14.750 691 H ASN 99 H ASN 99 -5.147 -6.630 -13.884 692 HA ASN 99 HA ASN 99 -7.423 -5.671 -12.552 693 HB2 ASN 99 HB2 ASN 99 -6.119 -8.398 -12.339 694 HB3 ASN 99 HB3 ASN 99 -7.715 -8.001 -11.709 695 HD21 ASN 99 HD21 ASN 99 -5.835 -8.713 -14.512 696 HD22 ASN 99 HD22 ASN 99 -7.159 -8.813 -15.626 697 H THR 100 H THR 100 -7.738 -4.871 -10.596 698 HA THR 100 HA THR 100 -5.609 -4.836 -8.622 699 HB THR 100 HB THR 100 -7.289 -3.554 -7.258 700 HG1 THR 100 HG1 THR 100 -9.092 -4.599 -8.624 701 HG21 THR 100 HG21 THR 100 -7.240 -1.539 -8.642 702 HG22 THR 100 HG22 THR 100 -6.790 -2.512 -10.045 703 HG23 THR 100 HG23 THR 100 -5.693 -2.383 -8.668 704 H SER 101 H SER 101 -6.199 -5.374 -6.294 705 HA SER 101 HA SER 101 -6.463 -7.005 -4.750 706 HB2 SER 101 HB2 SER 101 -8.893 -6.192 -5.233 707 HB3 SER 101 HB3 SER 101 -9.082 -7.752 -6.034 708 HG SER 101 HG SER 101 -9.045 -8.739 -4.151 709 H ASP 102 H ASP 102 -4.996 -7.737 -7.049 710 HA ASP 102 HA ASP 102 -5.843 -10.288 -8.037 711 HB2 ASP 102 HB2 ASP 102 -4.440 -8.521 -9.265 712 HB3 ASP 102 HB3 ASP 102 -3.089 -9.060 -8.279 713 H SER 103 H SER 103 -4.420 -12.220 -7.876 714 HA SER 103 HA SER 103 -3.955 -13.185 -5.345 715 HB2 SER 103 HB2 SER 103 -2.432 -14.855 -6.571 716 HB3 SER 103 HB3 SER 103 -4.103 -14.731 -7.136 717 HG SER 103 HG SER 103 -2.600 -12.934 -8.441 718 HA PRO 104 HA PRO 104 -0.712 -10.425 -4.137 719 HB2 PRO 104 HB2 PRO 104 -0.535 -12.190 -1.758 720 HB3 PRO 104 HB3 PRO 104 -0.836 -10.451 -1.859 721 HG2 PRO 104 HG2 PRO 104 -2.830 -12.093 -1.281 722 HG3 PRO 104 HG3 PRO 104 -3.089 -10.737 -2.396 723 HD2 PRO 104 HD2 PRO 104 -2.614 -13.635 -3.031 724 HD3 PRO 104 HD3 PRO 104 -3.840 -12.525 -3.695 725 H SER 105 H SER 105 0.968 -10.665 -5.355 726 HA SER 105 HA SER 105 2.946 -12.741 -4.749 727 HB2 SER 105 HB2 SER 105 3.716 -11.997 -7.155 728 HB3 SER 105 HB3 SER 105 2.334 -13.084 -6.987 729 HG SER 105 HG SER 105 0.951 -11.357 -7.307 730 HA PRO 106 HA PRO 106 5.739 -9.315 -3.712 731 HB2 PRO 106 HB2 PRO 106 7.879 -10.319 -5.467 732 HB3 PRO 106 HB3 PRO 106 7.861 -10.132 -3.712 733 HG2 PRO 106 HG2 PRO 106 7.784 -12.552 -4.865 734 HG3 PRO 106 HG3 PRO 106 6.904 -12.201 -3.368 735 HD2 PRO 106 HD2 PRO 106 5.867 -12.349 -6.180 736 HD3 PRO 106 HD3 PRO 106 5.154 -12.996 -4.685 737 H LEU 107 H LEU 107 4.332 -7.896 -4.948 738 HA LEU 107 HA LEU 107 5.443 -6.952 -7.502 739 HB2 LEU 107 HB2 LEU 107 2.788 -6.374 -6.172 740 HB3 LEU 107 HB3 LEU 107 3.292 -5.734 -7.722 741 HG LEU 107 HG LEU 107 2.836 -8.657 -7.107 742 HD11 LEU 107 HD11 LEU 107 1.186 -6.706 -8.705 743 HD12 LEU 107 HD12 LEU 107 0.765 -7.367 -7.126 744 HD13 LEU 107 HD13 LEU 107 0.869 -8.431 -8.529 745 HD21 LEU 107 HD21 LEU 107 3.455 -7.271 -9.718 746 HD22 LEU 107 HD22 LEU 107 3.059 -8.979 -9.521 747 HD23 LEU 107 HD23 LEU 107 4.544 -8.333 -8.822 748 H HIS 108 H HIS 108 6.420 -6.504 -4.732 749 HA HIS 108 HA HIS 108 6.236 -3.599 -4.450 750 HB2 HIS 108 HB2 HIS 108 7.385 -4.003 -2.250 751 HB3 HIS 108 HB3 HIS 108 5.827 -4.798 -2.393 752 HD1 HIS 108 HD1 HIS 108 9.533 -5.649 -2.571 753 HD2 HIS 108 HD2 HIS 108 5.874 -7.482 -1.845 754 HE1 HIS 108 HE1 HIS 108 10.084 -7.983 -1.824 755 HE2 HIS 108 HE2 HIS 108 7.870 -9.008 -1.198 756 H THR 109 H THR 109 7.811 -5.342 -6.413 757 HA THR 109 HA THR 109 10.552 -4.522 -5.851 758 HB THR 109 HB THR 109 9.490 -6.295 -8.065 759 HG1 THR 109 HG1 THR 109 10.743 -7.790 -6.374 760 HG21 THR 109 HG21 THR 109 12.282 -5.924 -6.973 761 HG22 THR 109 HG22 THR 109 11.695 -5.349 -8.534 762 HG23 THR 109 HG23 THR 109 11.807 -7.081 -8.217 763 H PHE 110 H PHE 110 11.213 -2.634 -6.661 764 HA PHE 110 HA PHE 110 9.725 -1.504 -8.922 765 HB2 PHE 110 HB2 PHE 110 11.493 -0.099 -6.905 766 HB3 PHE 110 HB3 PHE 110 10.578 0.684 -8.190 767 HD1 PHE 110 HD1 PHE 110 7.984 -0.731 -8.002 768 HD2 PHE 110 HD2 PHE 110 10.567 0.720 -4.947 769 HE1 PHE 110 HE1 PHE 110 6.059 -0.506 -6.489 770 HE2 PHE 110 HE2 PHE 110 8.645 0.941 -3.429 771 HZ PHE 110 HZ PHE 110 6.390 0.326 -4.197 772 H PHE 111 H PHE 111 10.624 -1.748 -10.813 773 HA PHE 111 HA PHE 111 13.466 -2.327 -11.018 774 HB2 PHE 111 HB2 PHE 111 11.280 -2.349 -13.110 775 HB3 PHE 111 HB3 PHE 111 12.941 -2.855 -13.385 776 HD1 PHE 111 HD1 PHE 111 13.788 -4.929 -12.392 777 HD2 PHE 111 HD2 PHE 111 9.721 -3.751 -11.945 778 HE1 PHE 111 HE1 PHE 111 13.201 -7.219 -11.704 779 HE2 PHE 111 HE2 PHE 111 9.131 -6.035 -11.254 780 HZ PHE 111 HZ PHE 111 10.871 -7.773 -11.134 781 H ASN 112 H ASN 112 11.314 0.300 -11.594 782 HA ASN 112 HA ASN 112 13.377 1.726 -13.138 783 HB2 ASN 112 HB2 ASN 112 10.378 2.129 -13.064 784 HB3 ASN 112 HB3 ASN 112 11.498 3.201 -13.897 785 HD21 ASN 112 HD21 ASN 112 9.286 1.505 -14.875 786 HD22 ASN 112 HD22 ASN 112 9.984 0.512 -16.109 787 H GLU 113 H GLU 113 13.728 3.947 -12.684 788 HA GLU 113 HA GLU 113 13.273 4.699 -9.901 789 HB2 GLU 113 HB2 GLU 113 15.522 4.839 -11.108 790 HB3 GLU 113 HB3 GLU 113 14.850 6.176 -12.022 791 HG2 GLU 113 HG2 GLU 113 14.634 7.504 -10.033 792 HG3 GLU 113 HG3 GLU 113 15.103 6.140 -9.019 793 H GLY 114 H GLY 114 12.440 6.850 -9.395 794 HA2 GLY 114 HA2 GLY 114 11.399 8.849 -10.681 795 HA3 GLY 114 HA3 GLY 114 10.298 7.602 -11.249 796 H GLU 115 H GLU 115 8.471 7.435 -10.166 797 HA GLU 115 HA GLU 115 8.427 7.810 -7.281 798 HB2 GLU 115 HB2 GLU 115 7.980 10.038 -8.332 799 HB3 GLU 115 HB3 GLU 115 6.568 9.335 -9.109 800 HG2 GLU 115 HG2 GLU 115 6.136 8.680 -6.495 801 HG3 GLU 115 HG3 GLU 115 6.953 10.242 -6.353 802 H TYR 116 H TYR 116 7.000 6.476 -6.329 803 HA TYR 116 HA TYR 116 4.968 5.165 -8.019 804 HB2 TYR 116 HB2 TYR 116 6.663 3.921 -5.837 805 HB3 TYR 116 HB3 TYR 116 5.260 3.139 -6.557 806 HD1 TYR 116 HD1 TYR 116 5.334 2.289 -8.821 807 HD2 TYR 116 HD2 TYR 116 8.744 4.147 -7.083 808 HE1 TYR 116 HE1 TYR 116 6.739 1.376 -10.616 809 HE2 TYR 116 HE2 TYR 116 10.156 3.239 -8.876 810 HH TYR 116 HH TYR 116 10.216 1.624 -10.503 811 H ILE 117 H ILE 117 3.006 4.617 -6.970 812 HA ILE 117 HA ILE 117 2.679 5.724 -4.266 813 HB ILE 117 HB ILE 117 0.496 5.834 -6.370 814 HG12 ILE 117 HG12 ILE 117 2.074 8.180 -5.278 815 HG13 ILE 117 HG13 ILE 117 2.431 7.422 -6.824 816 HG21 ILE 117 HG21 ILE 117 0.724 6.963 -3.579 817 HG22 ILE 117 HG22 ILE 117 -0.335 5.654 -4.108 818 HG23 ILE 117 HG23 ILE 117 -0.601 7.296 -4.696 819 HD11 ILE 117 HD11 ILE 117 1.113 9.449 -7.097 820 HD12 ILE 117 HD12 ILE 117 -0.158 8.766 -6.082 821 HD13 ILE 117 HD13 ILE 117 0.216 8.030 -7.640 822 H VAL 118 H VAL 118 2.419 4.062 -2.972 823 HA VAL 118 HA VAL 118 1.009 1.662 -3.869 824 HB VAL 118 HB VAL 118 2.487 2.186 -1.271 825 HG11 VAL 118 HG11 VAL 118 2.294 -0.214 -0.862 826 HG12 VAL 118 HG12 VAL 118 1.347 -0.397 -2.339 827 HG13 VAL 118 HG13 VAL 118 0.700 0.534 -0.987 828 HG21 VAL 118 HG21 VAL 118 3.989 2.085 -3.196 829 HG22 VAL 118 HG22 VAL 118 3.293 0.533 -3.664 830 HG23 VAL 118 HG23 VAL 118 4.194 0.676 -2.154 831 H SER 119 H SER 119 -1.085 1.386 -3.436 832 HA SER 119 HA SER 119 -2.221 2.874 -1.172 833 HB2 SER 119 HB2 SER 119 -3.491 2.329 -3.857 834 HB3 SER 119 HB3 SER 119 -4.336 3.024 -2.475 835 HG SER 119 HG SER 119 -2.871 4.282 -4.283 836 H LEU 120 H LEU 120 -2.827 1.632 0.361 837 HA LEU 120 HA LEU 120 -3.755 -1.102 -0.160 838 HB2 LEU 120 HB2 LEU 120 -1.966 -0.988 1.443 839 HB3 LEU 120 HB3 LEU 120 -2.764 0.288 2.328 840 HG LEU 120 HG LEU 120 -4.439 -1.308 3.157 841 HD11 LEU 120 HD11 LEU 120 -4.486 -2.852 1.243 842 HD12 LEU 120 HD12 LEU 120 -4.207 -3.697 2.766 843 HD13 LEU 120 HD13 LEU 120 -2.863 -3.403 1.661 844 HD21 LEU 120 HD21 LEU 120 -2.966 -2.584 4.587 845 HD22 LEU 120 HD22 LEU 120 -2.409 -0.919 4.403 846 HD23 LEU 120 HD23 LEU 120 -1.608 -2.221 3.522 847 H ILE 121 H ILE 121 -5.846 -1.300 -0.352 848 HA ILE 121 HA ILE 121 -7.584 0.355 1.324 849 HB ILE 121 HB ILE 121 -8.139 1.168 -0.790 850 HG12 ILE 121 HG12 ILE 121 -10.031 -1.171 -0.468 851 HG13 ILE 121 HG13 ILE 121 -10.138 0.333 0.432 852 HG21 ILE 121 HG21 ILE 121 -7.938 -1.613 -1.921 853 HG22 ILE 121 HG22 ILE 121 -6.782 -0.297 -2.133 854 HG23 ILE 121 HG23 ILE 121 -8.401 -0.168 -2.822 855 HD11 ILE 121 HD11 ILE 121 -10.546 1.539 -1.652 856 HD12 ILE 121 HD12 ILE 121 -11.744 0.278 -1.369 857 HD13 ILE 121 HD13 ILE 121 -10.454 0.020 -2.543 858 H VAL 122 H VAL 122 -8.849 -0.758 2.645 859 HA VAL 122 HA VAL 122 -9.030 -3.648 2.182 860 HB VAL 122 HB VAL 122 -9.120 -3.911 4.716 861 HG11 VAL 122 HG11 VAL 122 -6.563 -3.052 3.376 862 HG12 VAL 122 HG12 VAL 122 -7.265 -4.671 3.368 863 HG13 VAL 122 HG13 VAL 122 -6.667 -3.976 4.875 864 HG21 VAL 122 HG21 VAL 122 -7.827 -1.183 4.608 865 HG22 VAL 122 HG22 VAL 122 -7.892 -2.231 6.024 866 HG23 VAL 122 HG23 VAL 122 -9.381 -1.571 5.349 867 H SER 123 H SER 123 -10.906 -4.692 2.999 868 HA SER 123 HA SER 123 -13.183 -2.849 3.059 869 HB2 SER 123 HB2 SER 123 -14.334 -4.484 1.497 870 HB3 SER 123 HB3 SER 123 -13.028 -3.539 0.783 871 HG SER 123 HG SER 123 -13.064 -5.892 0.352 872 H ASN 124 H ASN 124 -14.842 -3.408 4.291 873 HA ASN 124 HA ASN 124 -15.029 -6.132 5.350 874 HB2 ASN 124 HB2 ASN 124 -13.986 -4.444 7.017 875 HB3 ASN 124 HB3 ASN 124 -15.568 -3.681 7.052 876 HD21 ASN 124 HD21 ASN 124 -15.692 -4.130 9.289 877 HD22 ASN 124 HD22 ASN 124 -16.084 -5.716 9.856 878 H GLU 125 H GLU 125 -17.468 -6.175 6.448 879 HA GLU 125 HA GLU 125 -19.159 -5.523 4.204 880 HB2 GLU 125 HB2 GLU 125 -20.847 -6.833 5.199 881 HB3 GLU 125 HB3 GLU 125 -19.340 -7.658 5.531 882 HG2 GLU 125 HG2 GLU 125 -20.848 -5.950 7.506 883 HG3 GLU 125 HG3 GLU 125 -20.923 -7.703 7.412 884 H ASN 126 H ASN 126 -18.165 -3.796 6.822 885 HA ASN 126 HA ASN 126 -20.590 -2.230 7.151 886 HB2 ASN 126 HB2 ASN 126 -19.049 -2.854 9.078 887 HB3 ASN 126 HB3 ASN 126 -17.881 -1.726 8.396 888 HD21 ASN 126 HD21 ASN 126 -17.930 -0.418 10.183 889 HD22 ASN 126 HD22 ASN 126 -19.286 0.572 10.597 890 H ASP 127 H ASP 127 -17.176 -1.630 6.238 891 HA ASP 127 HA ASP 127 -17.913 0.304 4.240 892 HB2 ASP 127 HB2 ASP 127 -17.999 1.462 6.595 893 HB3 ASP 127 HB3 ASP 127 -16.244 1.409 6.491 894 H SER 128 H SER 128 -15.726 1.434 3.430 895 HA SER 128 HA SER 128 -13.500 -0.471 3.737 896 HB2 SER 128 HB2 SER 128 -12.781 0.140 1.421 897 HB3 SER 128 HB3 SER 128 -14.329 -0.704 1.479 898 HG SER 128 HG SER 128 -14.823 1.911 1.654 899 H ASP 129 H ASP 129 -11.494 0.345 4.127 900 HA ASP 129 HA ASP 129 -11.267 3.274 4.392 901 HB2 ASP 129 HB2 ASP 129 -11.411 2.057 6.599 902 HB3 ASP 129 HB3 ASP 129 -9.934 1.207 6.167 903 H SER 130 H SER 130 -9.485 4.156 3.369 904 HA SER 130 HA SER 130 -7.511 2.251 2.307 905 HB2 SER 130 HB2 SER 130 -8.416 4.580 0.650 906 HB3 SER 130 HB3 SER 130 -7.698 3.054 0.138 907 HG SER 130 HG SER 130 -10.041 2.636 1.404 908 H ALA 131 H ALA 131 -5.462 2.882 2.388 909 HA ALA 131 HA ALA 131 -4.852 5.695 3.037 910 HB1 ALA 131 HB1 ALA 131 -3.422 3.245 4.071 911 HB2 ALA 131 HB2 ALA 131 -4.477 4.304 5.008 912 HB3 ALA 131 HB3 ALA 131 -2.951 4.918 4.371 913 H SER 132 H SER 132 -2.830 6.472 2.207 914 HA SER 132 HA SER 132 -1.708 4.852 0.035 915 HB2 SER 132 HB2 SER 132 -3.493 6.426 -0.804 916 HB3 SER 132 HB3 SER 132 -2.486 7.766 -0.265 917 HG SER 132 HG SER 132 -1.921 5.837 -2.258 918 H VAL 133 H VAL 133 0.458 5.361 -0.504 919 HA VAL 133 HA VAL 133 1.781 7.412 1.084 920 HB VAL 133 HB VAL 133 1.984 5.317 2.401 921 HG11 VAL 133 HG11 VAL 133 2.004 3.640 0.675 922 HG12 VAL 133 HG12 VAL 133 3.466 3.507 1.651 923 HG13 VAL 133 HG13 VAL 133 3.538 4.251 0.053 924 HG21 VAL 133 HG21 VAL 133 4.583 6.356 1.288 925 HG22 VAL 133 HG22 VAL 133 4.409 5.415 2.772 926 HG23 VAL 133 HG23 VAL 133 3.677 7.015 2.651 927 H THR 134 H THR 134 3.354 8.459 0.011 928 HA THR 134 HA THR 134 3.799 7.737 -2.771 929 HB THR 134 HB THR 134 4.849 10.161 -1.287 930 HG1 THR 134 HG1 THR 134 2.519 10.009 -1.238 931 HG21 THR 134 HG21 THR 134 4.936 11.161 -3.535 932 HG22 THR 134 HG22 THR 134 4.378 9.637 -4.229 933 HG23 THR 134 HG23 THR 134 5.949 9.722 -3.429 934 H ILE 135 H ILE 135 5.437 6.574 -3.368 935 HA ILE 135 HA ILE 135 7.725 6.173 -1.585 936 HB ILE 135 HB ILE 135 7.113 4.744 -4.191 937 HG12 ILE 135 HG12 ILE 135 5.253 4.327 -2.684 938 HG13 ILE 135 HG13 ILE 135 6.233 2.876 -2.822 939 HG21 ILE 135 HG21 ILE 135 9.426 4.557 -3.516 940 HG22 ILE 135 HG22 ILE 135 8.612 3.004 -3.329 941 HG23 ILE 135 HG23 ILE 135 8.942 4.002 -1.912 942 HD11 ILE 135 HD11 ILE 135 6.282 4.811 -0.516 943 HD12 ILE 135 HD12 ILE 135 7.218 3.319 -0.642 944 HD13 ILE 135 HD13 ILE 135 5.456 3.253 -0.545 945 H ARG 136 H ARG 136 9.703 7.053 -2.040 946 HA ARG 136 HA ARG 136 9.845 8.681 -4.476 947 HB2 ARG 136 HB2 ARG 136 11.068 9.053 -1.753 948 HB3 ARG 136 HB3 ARG 136 11.774 9.819 -3.164 949 HG2 ARG 136 HG2 ARG 136 10.435 11.464 -2.235 950 HG3 ARG 136 HG3 ARG 136 9.454 10.827 -3.551 951 HD2 ARG 136 HD2 ARG 136 8.095 9.587 -2.038 952 HD3 ARG 136 HD3 ARG 136 9.192 9.908 -0.697 953 HE ARG 136 HE ARG 136 8.110 12.297 -1.856 954 HH11 ARG 136 HH11 ARG 136 7.419 9.710 0.421 955 HH12 ARG 136 HH12 ARG 136 6.405 10.694 1.432 956 HH21 ARG 136 HH21 ARG 136 6.756 13.572 -0.558 957 HH22 ARG 136 HH22 ARG 136 6.016 12.898 0.863 958 H ALA 137 H ALA 137 11.331 8.249 -5.930 959 HA ALA 137 HA ALA 137 13.659 6.642 -5.117 960 HB1 ALA 137 HB1 ALA 137 12.276 5.457 -6.754 961 HB2 ALA 137 HB2 ALA 137 13.843 5.899 -7.434 962 HB3 ALA 137 HB3 ALA 137 12.404 6.828 -7.856 963 H LEU 138 H LEU 138 15.405 7.839 -4.978 964 HA LEU 138 HA LEU 138 15.120 10.631 -5.603 965 HB2 LEU 138 HB2 LEU 138 17.383 9.163 -4.259 966 HB3 LEU 138 HB3 LEU 138 17.290 10.903 -4.433 967 HG LEU 138 HG LEU 138 15.485 9.135 -2.784 968 HD11 LEU 138 HD11 LEU 138 17.629 9.616 -1.774 969 HD12 LEU 138 HD12 LEU 138 16.338 10.472 -0.929 970 HD13 LEU 138 HD13 LEU 138 17.391 11.343 -2.045 971 HD21 LEU 138 HD21 LEU 138 14.345 11.191 -2.082 972 HD22 LEU 138 HD22 LEU 138 14.114 10.860 -3.800 973 HD23 LEU 138 HD23 LEU 138 15.259 12.101 -3.287 974 H GLU 139 H GLU 139 16.365 11.899 -6.794 975 HA GLU 139 HA GLU 139 17.089 10.834 -9.318 976 HB2 GLU 139 HB2 GLU 139 16.006 13.031 -9.009 977 HB3 GLU 139 HB3 GLU 139 17.446 13.618 -8.190 978 HG2 GLU 139 HG2 GLU 139 18.734 13.265 -10.273 979 HG3 GLU 139 HG3 GLU 139 17.245 12.768 -11.077 980 H HIS 140 H HIS 140 18.965 10.111 -9.977 981 HA HIS 140 HA HIS 140 21.422 10.673 -8.555 982 HB2 HIS 140 HB2 HIS 140 20.793 9.102 -11.063 983 HB3 HIS 140 HB3 HIS 140 22.437 9.362 -10.499 984 HD1 HIS 140 HD1 HIS 140 19.383 7.333 -9.842 985 HD2 HIS 140 HD2 HIS 140 23.099 8.014 -8.101 986 HE1 HIS 140 HE1 HIS 140 19.691 5.494 -8.161 987 HE2 HIS 140 HE2 HIS 140 21.848 6.048 -6.978 988 H HIS 141 H HIS 141 22.995 12.079 -9.233 989 HA HIS 141 HA HIS 141 22.027 14.370 -10.524 990 HB2 HIS 141 HB2 HIS 141 24.283 15.324 -10.288 991 HB3 HIS 141 HB3 HIS 141 23.706 14.599 -8.802 992 HD1 HIS 141 HD1 HIS 141 26.528 14.593 -11.133 993 HD2 HIS 141 HD2 HIS 141 25.054 12.097 -8.144 994 HE1 HIS 141 HE1 HIS 141 28.408 13.022 -10.575 995 HE2 HIS 141 HE2 HIS 141 27.548 11.616 -8.659 996 H HIS 142 H HIS 142 24.305 11.911 -11.734 997 HA HIS 142 HA HIS 142 24.940 11.248 -13.795 998 HB2 HIS 142 HB2 HIS 142 22.515 11.470 -14.388 999 HB3 HIS 142 HB3 HIS 142 22.845 13.091 -14.982 1000 HD1 HIS 142 HD1 HIS 142 23.263 13.186 -17.442 1001 HD2 HIS 142 HD2 HIS 142 24.188 9.452 -15.852 1002 HE1 HIS 142 HE1 HIS 142 23.973 11.771 -19.400 1003 HE2 HIS 142 HE2 HIS 142 24.724 9.589 -18.386 1004 H HIS 143 H HIS 143 24.856 14.630 -13.160 1005 HA HIS 143 HA HIS 143 26.470 15.509 -15.341 1006 HB2 HIS 143 HB2 HIS 143 24.756 16.843 -14.060 1007 HB3 HIS 143 HB3 HIS 143 25.860 16.863 -12.698 1008 HD1 HIS 143 HD1 HIS 143 25.063 18.583 -15.859 1009 HD2 HIS 143 HD2 HIS 143 28.142 18.527 -13.057 1010 HE1 HIS 143 HE1 HIS 143 26.392 20.685 -16.267 1011 HE2 HIS 143 HE2 HIS 143 28.335 20.545 -14.669 1012 H HIS 144 H HIS 144 28.403 14.481 -15.440 1013 HA HIS 144 HA HIS 144 30.381 15.172 -13.398 1014 HB2 HIS 144 HB2 HIS 144 29.495 12.827 -12.920 1015 HB3 HIS 144 HB3 HIS 144 30.133 12.341 -14.477 1016 HD1 HIS 144 HD1 HIS 144 30.925 11.779 -11.201 1017 HD2 HIS 144 HD2 HIS 144 33.193 13.306 -14.340 1018 HE1 HIS 144 HE1 HIS 144 33.328 11.368 -10.567 1019 HE2 HIS 144 HE2 HIS 144 34.686 12.409 -12.423 1020 H HIS 145 H HIS 145 30.856 16.709 -15.127 1021 HA HIS 145 HA HIS 145 33.026 15.718 -16.734 1022 HB2 HIS 145 HB2 HIS 145 30.479 16.351 -18.029 1023 HB3 HIS 145 HB3 HIS 145 31.821 17.275 -18.682 1024 HD1 HIS 145 HD1 HIS 145 34.031 15.549 -19.188 1025 HD2 HIS 145 HD2 HIS 145 30.161 14.013 -19.325 1026 HE1 HIS 145 HE1 HIS 145 34.188 13.417 -20.515 1027 HE2 HIS 145 HE2 HIS 145 31.889 12.405 -20.390 Start of MODEL 19 1 H1 MET 1 H1 MET 1 23.343 -40.550 75.273 2 H2 MET 1 H2 MET 1 24.369 -39.635 76.261 3 H3 MET 1 H3 MET 1 22.694 -39.581 76.501 4 HA MET 1 HA MET 1 22.644 -41.857 77.176 5 HB2 MET 1 HB2 MET 1 24.713 -43.142 77.443 6 HB3 MET 1 HB3 MET 1 24.458 -42.684 75.768 7 HG2 MET 1 HG2 MET 1 26.107 -40.889 76.009 8 HG3 MET 1 HG3 MET 1 26.357 -41.348 77.692 9 HE1 MET 1 HE1 MET 1 25.855 -43.634 74.495 10 HE2 MET 1 HE2 MET 1 27.533 -43.961 74.063 11 HE3 MET 1 HE3 MET 1 26.890 -42.323 73.931 12 H ASN 2 H ASN 2 23.640 -38.917 78.090 13 HA ASN 2 HA ASN 2 24.394 -39.765 80.798 14 HB2 ASN 2 HB2 ASN 2 24.732 -37.082 79.434 15 HB3 ASN 2 HB3 ASN 2 25.017 -37.337 81.149 16 HD21 ASN 2 HD21 ASN 2 27.147 -36.866 81.149 17 HD22 ASN 2 HD22 ASN 2 28.351 -37.819 80.343 18 H ALA 3 H ALA 3 22.340 -40.357 81.416 19 HA ALA 3 HA ALA 3 20.508 -38.100 81.869 20 HB1 ALA 3 HB1 ALA 3 18.637 -39.665 81.754 21 HB2 ALA 3 HB2 ALA 3 19.754 -40.987 81.413 22 HB3 ALA 3 HB3 ALA 3 19.562 -39.674 80.251 23 H ARG 4 H ARG 4 20.856 -37.526 83.883 24 HA ARG 4 HA ARG 4 21.466 -39.294 86.038 25 HB2 ARG 4 HB2 ARG 4 20.445 -36.456 86.000 26 HB3 ARG 4 HB3 ARG 4 20.884 -37.310 87.467 27 HG2 ARG 4 HG2 ARG 4 23.192 -37.466 86.698 28 HG3 ARG 4 HG3 ARG 4 22.748 -36.638 85.199 29 HD2 ARG 4 HD2 ARG 4 22.119 -34.666 86.404 30 HD3 ARG 4 HD3 ARG 4 22.334 -35.479 87.948 31 HE ARG 4 HE ARG 4 24.798 -35.637 86.887 32 HH11 ARG 4 HH11 ARG 4 22.579 -32.917 87.117 33 HH12 ARG 4 HH12 ARG 4 23.833 -31.741 87.351 34 HH21 ARG 4 HH21 ARG 4 26.451 -34.091 87.233 35 HH22 ARG 4 HH22 ARG 4 26.036 -32.416 87.416 36 H ASP 5 H ASP 5 20.132 -40.255 87.514 37 HA ASP 5 HA ASP 5 17.368 -40.542 86.817 38 HB2 ASP 5 HB2 ASP 5 18.696 -42.398 87.826 39 HB3 ASP 5 HB3 ASP 5 18.786 -41.481 89.325 40 H ASN 6 H ASN 6 15.852 -39.137 87.285 41 HA ASN 6 HA ASN 6 16.022 -37.632 89.794 42 HB2 ASN 6 HB2 ASN 6 15.491 -36.499 87.050 43 HB3 ASN 6 HB3 ASN 6 14.985 -35.667 88.515 44 HD21 ASN 6 HD21 ASN 6 17.518 -36.257 86.345 45 HD22 ASN 6 HD22 ASN 6 18.777 -35.458 87.224 46 H LYS 7 H LYS 7 14.280 -37.688 90.968 47 HA LYS 7 HA LYS 7 11.674 -37.843 89.674 48 HB2 LYS 7 HB2 LYS 7 12.263 -40.157 90.383 49 HB3 LYS 7 HB3 LYS 7 12.436 -39.583 92.036 50 HG2 LYS 7 HG2 LYS 7 10.068 -38.955 92.064 51 HG3 LYS 7 HG3 LYS 7 9.895 -39.548 90.410 52 HD2 LYS 7 HD2 LYS 7 10.513 -41.790 91.145 53 HD3 LYS 7 HD3 LYS 7 10.715 -41.200 92.796 54 HE2 LYS 7 HE2 LYS 7 8.565 -42.272 92.593 55 HE3 LYS 7 HE3 LYS 7 8.337 -40.538 92.814 56 HZ1 LYS 7 HZ1 LYS 7 8.046 -40.345 90.388 57 HZ2 LYS 7 HZ2 LYS 7 6.868 -41.321 91.109 58 HZ3 LYS 7 HZ3 LYS 7 8.146 -42.033 90.250 59 H PHE 8 H PHE 8 11.406 -35.694 90.122 60 HA PHE 8 HA PHE 8 11.145 -35.017 92.972 61 HB2 PHE 8 HB2 PHE 8 12.892 -33.683 91.898 62 HB3 PHE 8 HB3 PHE 8 11.764 -33.169 90.651 63 HD1 PHE 8 HD1 PHE 8 12.060 -33.169 94.378 64 HD2 PHE 8 HD2 PHE 8 10.794 -31.100 90.880 65 HE1 PHE 8 HE1 PHE 8 11.414 -31.237 95.755 66 HE2 PHE 8 HE2 PHE 8 10.150 -29.168 92.253 67 HZ PHE 8 HZ PHE 8 10.458 -29.235 94.692 68 H ASN 9 H ASN 9 9.178 -34.887 93.628 69 HA ASN 9 HA ASN 9 7.069 -33.917 91.817 70 HB2 ASN 9 HB2 ASN 9 6.951 -36.003 94.003 71 HB3 ASN 9 HB3 ASN 9 5.507 -35.239 93.352 72 HD21 ASN 9 HD21 ASN 9 4.804 -35.770 91.321 73 HD22 ASN 9 HD22 ASN 9 5.447 -37.093 90.411 74 H THR 10 H THR 10 5.451 -32.547 92.779 75 HA THR 10 HA THR 10 6.441 -31.255 95.228 76 HB THR 10 HB THR 10 6.886 -29.866 93.236 77 HG1 THR 10 HG1 THR 10 6.591 -28.266 94.558 78 HG21 THR 10 HG21 THR 10 5.021 -28.774 92.034 79 HG22 THR 10 HG22 THR 10 3.881 -29.809 92.893 80 HG23 THR 10 HG23 THR 10 5.050 -30.522 91.782 81 H TRP 11 H TRP 11 4.865 -30.298 96.616 82 HA TRP 11 HA TRP 11 2.169 -31.483 96.356 83 HB2 TRP 11 HB2 TRP 11 3.918 -31.085 98.784 84 HB3 TRP 11 HB3 TRP 11 2.181 -31.317 98.923 85 HD1 TRP 11 HD1 TRP 11 5.352 -33.235 98.748 86 HE1 TRP 11 HE1 TRP 11 4.856 -35.752 98.519 87 HE3 TRP 11 HE3 TRP 11 0.398 -32.964 97.587 88 HZ2 TRP 11 HZ2 TRP 11 2.634 -37.402 97.920 89 HZ3 TRP 11 HZ3 TRP 11 -0.835 -35.034 97.195 90 HH2 TRP 11 HH2 TRP 11 0.249 -37.217 97.359 91 H ASN 12 H ASN 12 0.895 -29.855 95.679 92 HA ASN 12 HA ASN 12 0.553 -27.648 97.536 93 HB2 ASN 12 HB2 ASN 12 0.374 -25.938 95.826 94 HB3 ASN 12 HB3 ASN 12 1.961 -26.681 95.754 95 HD21 ASN 12 HD21 ASN 12 0.174 -25.197 93.819 96 HD22 ASN 12 HD22 ASN 12 0.155 -26.185 92.398 97 H ASP 13 H ASP 13 -1.535 -26.912 97.732 98 HA ASP 13 HA ASP 13 -3.565 -28.273 96.086 99 HB2 ASP 13 HB2 ASP 13 -5.006 -28.492 98.045 100 HB3 ASP 13 HB3 ASP 13 -3.477 -29.308 98.318 101 H SER 14 H SER 14 -5.795 -27.144 96.505 102 HA SER 14 HA SER 14 -5.465 -24.240 96.671 103 HB2 SER 14 HB2 SER 14 -6.899 -25.661 94.408 104 HB3 SER 14 HB3 SER 14 -6.842 -23.909 94.655 105 HG SER 14 HG SER 14 -4.356 -24.616 94.668 106 H ARG 15 H ARG 15 -7.080 -23.231 97.705 107 HA ARG 15 HA ARG 15 -9.751 -24.323 97.765 108 HB2 ARG 15 HB2 ARG 15 -9.959 -24.221 100.226 109 HB3 ARG 15 HB3 ARG 15 -8.818 -25.450 99.710 110 HG2 ARG 15 HG2 ARG 15 -6.959 -24.064 100.346 111 HG3 ARG 15 HG3 ARG 15 -8.042 -22.717 100.706 112 HD2 ARG 15 HD2 ARG 15 -9.126 -24.128 102.440 113 HD3 ARG 15 HD3 ARG 15 -7.907 -25.367 102.138 114 HE ARG 15 HE ARG 15 -6.237 -23.785 102.933 115 HH11 ARG 15 HH11 ARG 15 -9.587 -22.956 103.629 116 HH12 ARG 15 HH12 ARG 15 -9.189 -21.994 105.021 117 HH21 ARG 15 HH21 ARG 15 -5.719 -22.499 104.737 118 HH22 ARG 15 HH22 ARG 15 -6.982 -21.723 105.643 119 H GLY 16 H GLY 16 -11.333 -22.750 98.477 120 HA2 GLY 16 HA2 GLY 16 -11.177 -20.308 99.493 121 HA3 GLY 16 HA3 GLY 16 -10.397 -20.033 97.943 122 H ASN 17 H ASN 17 -13.356 -20.403 99.611 123 HA ASN 17 HA ASN 17 -14.801 -19.990 97.074 124 HB2 ASN 17 HB2 ASN 17 -15.141 -22.272 98.160 125 HB3 ASN 17 HB3 ASN 17 -15.967 -21.423 99.459 126 HD21 ASN 17 HD21 ASN 17 -17.859 -22.594 98.961 127 HD22 ASN 17 HD22 ASN 17 -18.848 -22.166 97.605 128 H TYR 18 H TYR 18 -15.330 -17.945 97.051 129 HA TYR 18 HA TYR 18 -15.800 -16.547 99.601 130 HB2 TYR 18 HB2 TYR 18 -14.882 -15.379 96.958 131 HB3 TYR 18 HB3 TYR 18 -14.935 -14.555 98.511 132 HD1 TYR 18 HD2 TYR 18 -13.385 -15.409 100.365 133 HD2 TYR 18 HD1 TYR 18 -12.953 -16.551 96.290 134 HE1 TYR 18 HE2 TYR 18 -11.063 -16.091 100.807 135 HE2 TYR 18 HE1 TYR 18 -10.631 -17.233 96.721 136 HH TYR 18 HH TYR 18 -8.834 -16.733 98.351 137 H TRP 19 H TRP 19 -17.036 -14.327 99.047 138 HA TRP 19 HA TRP 19 -19.459 -15.043 97.517 139 HB2 TRP 19 HB2 TRP 19 -19.155 -13.271 99.948 140 HB3 TRP 19 HB3 TRP 19 -20.615 -13.331 98.975 141 HD1 TRP 19 HD1 TRP 19 -18.527 -15.534 101.351 142 HE1 TRP 19 HE1 TRP 19 -20.073 -17.330 102.352 143 HE3 TRP 19 HE3 TRP 19 -22.753 -14.579 98.632 144 HZ2 TRP 19 HZ2 TRP 19 -22.731 -18.217 102.040 145 HZ3 TRP 19 HZ3 TRP 19 -24.755 -15.945 99.051 146 HH2 TRP 19 HH2 TRP 19 -24.743 -17.726 100.720 147 H SER 20 H SER 20 -20.536 -13.330 96.377 148 HA SER 20 HA SER 20 -19.214 -10.765 96.065 149 HB2 SER 20 HB2 SER 20 -19.162 -10.984 93.557 150 HB3 SER 20 HB3 SER 20 -18.018 -12.038 94.392 151 HG SER 20 HG SER 20 -19.954 -12.698 92.684 152 H ASP 21 H ASP 21 -21.664 -11.341 97.239 153 HA ASP 21 HA ASP 21 -23.733 -11.047 95.205 154 HB2 ASP 21 HB2 ASP 21 -25.308 -11.695 96.956 155 HB3 ASP 21 HB3 ASP 21 -23.987 -12.848 96.858 156 H TYR 22 H TYR 22 -25.775 -9.896 96.528 157 HA TYR 22 HA TYR 22 -26.824 -8.004 97.131 158 HB2 TYR 22 HB2 TYR 22 -25.184 -7.861 99.021 159 HB3 TYR 22 HB3 TYR 22 -24.164 -6.850 98.006 160 HD1 TYR 22 HD2 TYR 22 -27.618 -7.011 99.413 161 HD2 TYR 22 HD1 TYR 22 -24.420 -4.538 98.089 162 HE1 TYR 22 HE2 TYR 22 -28.836 -5.026 100.203 163 HE2 TYR 22 HE1 TYR 22 -25.627 -2.548 98.880 164 HH TYR 22 HH TYR 22 -28.390 -2.731 100.889 165 H GLU 23 H GLU 23 -27.652 -7.177 95.417 166 HA GLU 23 HA GLU 23 -25.939 -5.603 93.637 167 HB2 GLU 23 HB2 GLU 23 -27.419 -6.446 91.753 168 HB3 GLU 23 HB3 GLU 23 -26.290 -7.597 92.443 169 HG2 GLU 23 HG2 GLU 23 -28.182 -8.520 93.803 170 HG3 GLU 23 HG3 GLU 23 -29.263 -7.460 92.903 171 H GLY 24 H GLY 24 -26.535 -3.616 93.306 172 HA2 GLY 24 HA2 GLY 24 -29.379 -2.882 93.361 173 HA3 GLY 24 HA3 GLY 24 -28.260 -2.013 94.399 174 H SER 25 H SER 25 -29.896 -1.707 91.663 175 HA SER 25 HA SER 25 -27.880 0.038 90.422 176 HB2 SER 25 HB2 SER 25 -29.648 -1.928 88.937 177 HB3 SER 25 HB3 SER 25 -28.601 -0.733 88.173 178 HG SER 25 HG SER 25 -26.822 -1.780 89.225 179 H ASP 26 H ASP 26 -28.750 1.988 90.835 180 HA ASP 26 HA ASP 26 -31.433 2.548 89.805 181 HB2 ASP 26 HB2 ASP 26 -30.501 3.072 92.623 182 HB3 ASP 26 HB3 ASP 26 -31.738 4.081 91.887 183 H GLU 27 H GLU 27 -31.008 3.995 88.238 184 HA GLU 27 HA GLU 27 -30.037 6.572 89.126 185 HB2 GLU 27 HB2 GLU 27 -28.693 6.826 86.939 186 HB3 GLU 27 HB3 GLU 27 -27.961 5.973 88.285 187 HG2 GLU 27 HG2 GLU 27 -27.388 4.741 86.390 188 HG3 GLU 27 HG3 GLU 27 -28.689 3.829 87.132 189 H ASN 28 H ASN 28 -30.846 8.327 87.940 190 HA ASN 28 HA ASN 28 -32.515 7.860 85.630 191 HB2 ASN 28 HB2 ASN 28 -33.974 7.281 87.629 192 HB3 ASN 28 HB3 ASN 28 -33.836 8.964 88.123 193 HD21 ASN 28 HD21 ASN 28 -34.128 7.858 84.778 194 HD22 ASN 28 HD22 ASN 28 -35.690 8.552 84.511 195 H GLY 29 H GLY 29 -32.277 9.538 84.329 196 HA2 GLY 29 HA2 GLY 29 -32.452 12.247 85.218 197 HA3 GLY 29 HA3 GLY 29 -30.798 11.805 84.815 198 H ASP 30 H ASP 30 -33.087 13.511 83.622 199 HA ASP 30 HA ASP 30 -33.162 12.386 80.917 200 HB2 ASP 30 HB2 ASP 30 -34.680 14.672 82.192 201 HB3 ASP 30 HB3 ASP 30 -34.799 14.265 80.485 202 H GLY 31 H GLY 31 -32.661 13.759 79.063 203 HA2 GLY 31 HA2 GLY 31 -31.260 16.211 79.374 204 HA3 GLY 31 HA3 GLY 31 -30.126 14.879 79.268 205 H ILE 32 H ILE 32 -33.118 15.870 77.568 206 HA ILE 32 HA ILE 32 -31.537 15.775 75.089 207 HB ILE 32 HB ILE 32 -33.781 15.619 73.877 208 HG12 ILE 32 HG12 ILE 32 -34.711 14.469 76.519 209 HG13 ILE 32 HG13 ILE 32 -35.170 16.061 75.927 210 HG21 ILE 32 HG21 ILE 32 -32.168 13.835 73.869 211 HG22 ILE 32 HG22 ILE 32 -33.791 13.164 74.025 212 HG23 ILE 32 HG23 ILE 32 -32.738 13.263 75.437 213 HD11 ILE 32 HD11 ILE 32 -35.784 13.434 74.588 214 HD12 ILE 32 HD12 ILE 32 -36.250 15.028 73.992 215 HD13 ILE 32 HD13 ILE 32 -36.916 14.424 75.511 216 H GLY 33 H GLY 33 -31.695 17.461 73.654 217 HA2 GLY 33 HA2 GLY 33 -33.512 19.641 74.013 218 HA3 GLY 33 HA3 GLY 33 -31.917 20.022 74.648 219 H ASP 34 H ASP 34 -32.867 18.129 71.806 220 HA ASP 34 HA ASP 34 -31.174 19.854 70.164 221 HB2 ASP 34 HB2 ASP 34 -30.761 17.465 69.920 222 HB3 ASP 34 HB3 ASP 34 -32.456 17.176 69.547 223 H SER 35 H SER 35 -32.033 21.447 69.110 224 HA SER 35 HA SER 35 -34.825 21.249 68.204 225 HB2 SER 35 HB2 SER 35 -33.383 23.775 69.066 226 HB3 SER 35 HB3 SER 35 -35.079 23.636 68.591 227 HG SER 35 HG SER 35 -34.269 21.965 70.648 228 H ALA 36 H ALA 36 -34.588 20.750 66.112 229 HA ALA 36 HA ALA 36 -33.219 22.694 64.413 230 HB1 ALA 36 HB1 ALA 36 -31.609 20.866 64.725 231 HB2 ALA 36 HB2 ALA 36 -32.174 20.954 63.057 232 HB3 ALA 36 HB3 ALA 36 -32.807 19.711 64.138 233 H TYR 37 H TYR 37 -34.349 23.166 62.595 234 HA TYR 37 HA TYR 37 -36.747 21.548 62.092 235 HB2 TYR 37 HB2 TYR 37 -37.819 23.774 61.344 236 HB3 TYR 37 HB3 TYR 37 -37.674 23.456 63.060 237 HD1 TYR 37 HD2 TYR 37 -36.030 24.727 64.421 238 HD2 TYR 37 HD1 TYR 37 -36.655 25.616 60.304 239 HE1 TYR 37 HE2 TYR 37 -34.909 26.891 64.725 240 HE2 TYR 37 HE1 TYR 37 -35.539 27.784 60.602 241 HH TYR 37 HH TYR 37 -33.708 28.548 63.359 242 H ALA 38 H ALA 38 -36.394 20.460 60.335 243 HA ALA 38 HA ALA 38 -36.057 21.835 57.815 244 HB1 ALA 38 HB1 ALA 38 -33.708 21.508 58.473 245 HB2 ALA 38 HB2 ALA 38 -34.128 20.535 57.063 246 HB3 ALA 38 HB3 ALA 38 -34.002 19.778 58.651 247 H VAL 39 H VAL 39 -36.757 20.544 56.047 248 HA VAL 39 HA VAL 39 -37.945 17.979 56.833 249 HB VAL 39 HB VAL 39 -39.303 18.072 54.783 250 HG11 VAL 39 HG11 VAL 39 -40.823 19.849 55.443 251 HG12 VAL 39 HG12 VAL 39 -39.564 20.573 56.441 252 HG13 VAL 39 HG13 VAL 39 -40.211 18.985 56.854 253 HG21 VAL 39 HG21 VAL 39 -39.446 20.111 53.438 254 HG22 VAL 39 HG22 VAL 39 -37.842 19.385 53.340 255 HG23 VAL 39 HG23 VAL 39 -38.105 20.809 54.349 256 H ASN 40 H ASN 40 -37.566 16.113 55.613 257 HA ASN 40 HA ASN 40 -35.374 16.316 53.678 258 HB2 ASN 40 HB2 ASN 40 -34.933 13.835 54.284 259 HB3 ASN 40 HB3 ASN 40 -34.343 15.098 55.347 260 HD21 ASN 40 HD21 ASN 40 -34.199 13.774 57.086 261 HD22 ASN 40 HD22 ASN 40 -35.571 13.142 57.927 262 HA PRO 41 HA PRO 41 -38.886 14.890 51.181 263 HB2 PRO 41 HB2 PRO 41 -37.483 16.238 48.999 264 HB3 PRO 41 HB3 PRO 41 -39.089 16.558 49.660 265 HG2 PRO 41 HG2 PRO 41 -37.029 18.268 49.998 266 HG3 PRO 41 HG3 PRO 41 -38.292 18.050 51.225 267 HD2 PRO 41 HD2 PRO 41 -35.537 16.869 51.114 268 HD3 PRO 41 HD3 PRO 41 -36.388 17.607 52.489 269 H GLU 42 H GLU 42 -35.779 15.195 49.439 270 HA GLU 42 HA GLU 42 -35.753 12.283 49.071 271 HB2 GLU 42 HB2 GLU 42 -35.277 14.339 46.906 272 HB3 GLU 42 HB3 GLU 42 -34.943 12.619 46.745 273 HG2 GLU 42 HG2 GLU 42 -37.290 12.098 46.965 274 HG3 GLU 42 HG3 GLU 42 -37.670 13.782 47.307 275 H ALA 43 H ALA 43 -33.580 11.594 48.149 276 HA ALA 43 HA ALA 43 -31.398 13.250 49.228 277 HB1 ALA 43 HB1 ALA 43 -31.743 10.275 49.554 278 HB2 ALA 43 HB2 ALA 43 -31.918 11.489 50.819 279 HB3 ALA 43 HB3 ALA 43 -30.340 11.205 50.084 280 H GLY 44 H GLY 44 -32.643 12.271 46.492 281 HA2 GLY 44 HA2 GLY 44 -30.028 11.674 45.263 282 HA3 GLY 44 HA3 GLY 44 -31.505 10.872 44.743 283 H SER 45 H SER 45 -30.303 14.178 45.294 284 HA SER 45 HA SER 45 -31.968 15.161 43.120 285 HB2 SER 45 HB2 SER 45 -31.032 17.410 43.946 286 HB3 SER 45 HB3 SER 45 -32.101 16.528 45.038 287 HG SER 45 HG SER 45 -30.525 16.647 46.407 288 H MET 46 H MET 46 -28.721 14.230 43.694 289 HA MET 46 HA MET 46 -27.964 15.367 41.103 290 HB2 MET 46 HB2 MET 46 -25.626 15.645 42.013 291 HB3 MET 46 HB3 MET 46 -26.822 16.754 42.661 292 HG2 MET 46 HG2 MET 46 -26.992 15.335 44.673 293 HG3 MET 46 HG3 MET 46 -25.731 14.297 44.016 294 HE1 MET 46 HE1 MET 46 -24.258 14.541 46.161 295 HE2 MET 46 HE2 MET 46 -25.520 15.532 46.896 296 HE3 MET 46 HE3 MET 46 -23.844 16.086 46.909 297 H ASP 47 H ASP 47 -27.987 13.695 39.830 298 HA ASP 47 HA ASP 47 -26.137 11.508 40.450 299 HB2 ASP 47 HB2 ASP 47 -27.571 9.922 39.274 300 HB3 ASP 47 HB3 ASP 47 -28.465 10.658 40.593 301 H TYR 48 H TYR 48 -24.605 11.195 38.930 302 HA TYR 48 HA TYR 48 -25.006 12.293 36.242 303 HB2 TYR 48 HB2 TYR 48 -22.564 12.935 37.920 304 HB3 TYR 48 HB3 TYR 48 -22.770 13.342 36.226 305 HD1 TYR 48 HD1 TYR 48 -24.564 15.012 35.587 306 HD2 TYR 48 HD2 TYR 48 -23.405 14.319 39.622 307 HE1 TYR 48 HE1 TYR 48 -25.578 17.154 36.240 308 HE2 TYR 48 HE2 TYR 48 -24.416 16.455 40.285 309 HH TYR 48 HH TYR 48 -26.545 18.164 38.353 310 H MET 49 H MET 49 -25.223 10.036 35.744 311 HA MET 49 HA MET 49 -22.588 8.739 35.448 312 HB2 MET 49 HB2 MET 49 -25.257 7.412 35.977 313 HB3 MET 49 HB3 MET 49 -23.824 6.543 35.455 314 HG2 MET 49 HG2 MET 49 -22.662 7.267 37.491 315 HG3 MET 49 HG3 MET 49 -24.133 8.085 38.017 316 HE1 MET 49 HE1 MET 49 -23.885 4.960 40.394 317 HE2 MET 49 HE2 MET 49 -24.082 6.712 40.329 318 HE3 MET 49 HE3 MET 49 -22.580 5.973 39.774 319 HA PRO 50 HA PRO 50 -23.629 9.224 31.122 320 HB2 PRO 50 HB2 PRO 50 -21.611 7.658 30.118 321 HB3 PRO 50 HB3 PRO 50 -21.419 9.346 30.601 322 HG2 PRO 50 HG2 PRO 50 -20.718 6.854 32.084 323 HG3 PRO 50 HG3 PRO 50 -19.838 8.390 31.991 324 HD2 PRO 50 HD2 PRO 50 -21.339 7.693 34.135 325 HD3 PRO 50 HD3 PRO 50 -21.139 9.377 33.617 326 H LEU 51 H LEU 51 -24.400 8.035 29.380 327 HA LEU 51 HA LEU 51 -25.999 5.780 30.068 328 HB2 LEU 51 HB2 LEU 51 -26.579 7.655 28.486 329 HB3 LEU 51 HB3 LEU 51 -25.447 6.966 27.342 330 HG LEU 51 HG LEU 51 -26.839 4.929 27.197 331 HD11 LEU 51 HD11 LEU 51 -27.830 4.976 29.419 332 HD12 LEU 51 HD12 LEU 51 -29.086 4.941 28.182 333 HD13 LEU 51 HD13 LEU 51 -28.709 6.450 29.014 334 HD21 LEU 51 HD21 LEU 51 -28.671 5.951 25.968 335 HD22 LEU 51 HD22 LEU 51 -27.149 6.783 25.645 336 HD23 LEU 51 HD23 LEU 51 -28.333 7.503 26.736 337 H MET 52 H MET 52 -23.511 6.191 27.548 338 HA MET 52 HA MET 52 -21.657 5.066 27.007 339 HB2 MET 52 HB2 MET 52 -22.254 3.462 29.463 340 HB3 MET 52 HB3 MET 52 -20.885 3.098 28.420 341 HG2 MET 52 HG2 MET 52 -21.396 5.654 29.920 342 HG3 MET 52 HG3 MET 52 -20.162 4.445 30.267 343 HE1 MET 52 HE1 MET 52 -18.034 3.990 28.645 344 HE2 MET 52 HE2 MET 52 -17.798 4.839 27.116 345 HE3 MET 52 HE3 MET 52 -19.150 3.724 27.307 346 H GLU 53 H GLU 53 -24.468 3.003 27.443 347 HA GLU 53 HA GLU 53 -23.295 0.818 25.962 348 HB2 GLU 53 HB2 GLU 53 -26.126 1.190 26.941 349 HB3 GLU 53 HB3 GLU 53 -25.450 -0.295 26.287 350 HG2 GLU 53 HG2 GLU 53 -23.848 -0.368 28.164 351 HG3 GLU 53 HG3 GLU 53 -24.607 1.076 28.834 352 H TYR 54 H TYR 54 -25.093 3.608 25.168 353 HA TYR 54 HA TYR 54 -26.089 2.462 22.687 354 HB2 TYR 54 HB2 TYR 54 -26.539 5.099 24.061 355 HB3 TYR 54 HB3 TYR 54 -26.993 4.871 22.377 356 HD1 TYR 54 HD2 TYR 54 -27.390 2.979 25.595 357 HD2 TYR 54 HD1 TYR 54 -29.221 4.416 22.037 358 HE1 TYR 54 HE2 TYR 54 -29.514 1.993 26.305 359 HE2 TYR 54 HE1 TYR 54 -31.362 3.427 22.739 360 HH TYR 54 HH TYR 54 -31.833 2.165 25.934 361 H LEU 55 H LEU 55 -24.122 2.023 21.737 362 HA LEU 55 HA LEU 55 -22.370 4.288 21.108 363 HB2 LEU 55 HB2 LEU 55 -21.552 2.080 22.138 364 HB3 LEU 55 HB3 LEU 55 -21.849 1.367 20.565 365 HG LEU 55 HG LEU 55 -20.221 2.984 19.579 366 HD11 LEU 55 HD11 LEU 55 -20.357 4.737 21.261 367 HD12 LEU 55 HD12 LEU 55 -18.697 4.165 21.092 368 HD13 LEU 55 HD13 LEU 55 -19.672 3.651 22.469 369 HD21 LEU 55 HD21 LEU 55 -19.546 0.719 20.150 370 HD22 LEU 55 HD22 LEU 55 -19.184 1.227 21.799 371 HD23 LEU 55 HD23 LEU 55 -18.232 1.855 20.454 372 H HIS 56 H HIS 56 -22.173 5.035 19.080 373 HA HIS 56 HA HIS 56 -24.231 4.333 17.206 374 HB2 HIS 56 HB2 HIS 56 -21.894 6.202 16.732 375 HB3 HIS 56 HB3 HIS 56 -23.400 6.145 15.830 376 HD1 HIS 56 HD1 HIS 56 -21.769 7.928 18.471 377 HD2 HIS 56 HD2 HIS 56 -25.705 6.902 17.584 378 HE1 HIS 56 HE1 HIS 56 -23.197 9.464 19.864 379 HE2 HIS 56 HE2 HIS 56 -25.580 8.840 19.303 380 H SER 57 H SER 57 -20.694 4.196 17.193 381 HA SER 57 HA SER 57 -20.809 2.282 14.997 382 HB2 SER 57 HB2 SER 57 -18.378 3.486 16.348 383 HB3 SER 57 HB3 SER 57 -18.406 2.574 14.839 384 HG SER 57 HG SER 57 -18.518 4.546 14.052 385 H SER 58 H SER 58 -21.967 0.871 16.562 386 HA SER 58 HA SER 58 -20.555 -0.301 18.719 387 HB2 SER 58 HB2 SER 58 -22.525 -2.049 18.450 388 HB3 SER 58 HB3 SER 58 -22.801 -0.439 19.111 389 HG SER 58 HG SER 58 -23.995 -1.524 17.058 390 HA PRO 59 HA PRO 59 -18.927 -3.549 15.820 391 HB2 PRO 59 HB2 PRO 59 -19.396 -3.306 13.095 392 HB3 PRO 59 HB3 PRO 59 -20.159 -4.473 14.173 393 HG2 PRO 59 HG2 PRO 59 -21.374 -2.267 12.827 394 HG3 PRO 59 HG3 PRO 59 -22.133 -3.417 13.934 395 HD2 PRO 59 HD2 PRO 59 -21.235 -0.665 14.432 396 HD3 PRO 59 HD3 PRO 59 -22.380 -1.661 15.345 397 H VAL 60 H VAL 60 -16.901 -3.452 14.570 398 HA VAL 60 HA VAL 60 -16.006 -0.667 14.584 399 HB VAL 60 HB VAL 60 -14.893 -2.137 16.165 400 HG11 VAL 60 HG11 VAL 60 -13.372 -3.893 15.509 401 HG12 VAL 60 HG12 VAL 60 -13.799 -3.661 13.814 402 HG13 VAL 60 HG13 VAL 60 -15.012 -4.248 14.956 403 HG21 VAL 60 HG21 VAL 60 -13.676 -0.230 15.368 404 HG22 VAL 60 HG22 VAL 60 -13.082 -1.141 13.979 405 HG23 VAL 60 HG23 VAL 60 -12.565 -1.582 15.607 406 H LEU 61 H LEU 61 -15.375 0.368 12.911 407 HA LEU 61 HA LEU 61 -15.454 -0.816 10.310 408 HB2 LEU 61 HB2 LEU 61 -14.770 1.564 9.572 409 HB3 LEU 61 HB3 LEU 61 -16.372 1.287 10.192 410 HG LEU 61 HG LEU 61 -15.350 3.462 10.831 411 HD11 LEU 61 HD11 LEU 61 -17.178 2.641 12.131 412 HD12 LEU 61 HD12 LEU 61 -16.010 3.444 13.181 413 HD13 LEU 61 HD13 LEU 61 -16.088 1.682 13.131 414 HD21 LEU 61 HD21 LEU 61 -13.050 2.834 11.167 415 HD22 LEU 61 HD22 LEU 61 -13.498 1.820 12.540 416 HD23 LEU 61 HD23 LEU 61 -13.704 3.570 12.631 417 HA PRO 62 HA PRO 62 -11.254 -1.866 9.884 418 HB2 PRO 62 HB2 PRO 62 -10.768 -1.699 7.262 419 HB3 PRO 62 HB3 PRO 62 -11.950 -2.845 7.910 420 HG2 PRO 62 HG2 PRO 62 -12.411 -0.156 6.669 421 HG3 PRO 62 HG3 PRO 62 -13.261 -1.686 6.369 422 HD2 PRO 62 HD2 PRO 62 -14.233 0.242 8.027 423 HD3 PRO 62 HD3 PRO 62 -14.556 -1.486 8.253 424 H THR 63 H THR 63 -9.131 -1.307 9.331 425 HA THR 63 HA THR 63 -8.696 1.381 8.277 426 HB THR 63 HB THR 63 -8.184 1.050 10.847 427 HG1 THR 63 HG1 THR 63 -7.565 2.856 9.381 428 HG21 THR 63 HG21 THR 63 -6.778 -0.922 10.716 429 HG22 THR 63 HG22 THR 63 -5.844 0.454 11.306 430 HG23 THR 63 HG23 THR 63 -5.657 -0.090 9.636 431 H ALA 64 H ALA 64 -7.284 1.450 6.606 432 HA ALA 64 HA ALA 64 -5.905 -1.037 5.890 433 HB1 ALA 64 HB1 ALA 64 -7.154 0.092 4.105 434 HB2 ALA 64 HB2 ALA 64 -5.425 0.058 3.760 435 HB3 ALA 64 HB3 ALA 64 -6.180 1.542 4.344 436 H ARG 65 H ARG 65 -3.779 -1.252 6.216 437 HA ARG 65 HA ARG 65 -2.153 1.091 6.759 438 HB2 ARG 65 HB2 ARG 65 -3.358 -0.110 8.885 439 HB3 ARG 65 HB3 ARG 65 -1.868 -1.038 8.790 440 HG2 ARG 65 HG2 ARG 65 -1.656 0.832 10.330 441 HG3 ARG 65 HG3 ARG 65 -0.569 1.026 8.949 442 HD2 ARG 65 HD2 ARG 65 -2.072 2.587 7.916 443 HD3 ARG 65 HD3 ARG 65 -3.301 2.279 9.138 444 HE ARG 65 HE ARG 65 -0.725 3.575 9.768 445 HH11 ARG 65 HH11 ARG 65 -4.235 3.380 9.981 446 HH12 ARG 65 HH12 ARG 65 -4.377 4.740 11.051 447 HH21 ARG 65 HH21 ARG 65 -0.913 5.365 11.168 448 HH22 ARG 65 HH22 ARG 65 -2.480 5.864 11.729 449 H PHE 66 H PHE 66 -0.045 0.771 6.298 450 HA PHE 66 HA PHE 66 1.113 -1.836 6.208 451 HB2 PHE 66 HB2 PHE 66 1.836 -1.763 3.847 452 HB3 PHE 66 HB3 PHE 66 0.086 -1.850 3.975 453 HD1 PHE 66 HD2 PHE 66 -1.275 0.185 3.486 454 HD2 PHE 66 HD1 PHE 66 2.914 0.037 2.765 455 HE1 PHE 66 HE2 PHE 66 -1.466 2.125 1.994 456 HE2 PHE 66 HE1 PHE 66 2.723 1.974 1.266 457 HZ PHE 66 HZ PHE 66 0.531 3.021 0.882 458 H THR 67 H THR 67 3.426 -1.718 6.086 459 HA THR 67 HA THR 67 4.455 1.030 6.210 460 HB THR 67 HB THR 67 4.998 -0.353 8.214 461 HG1 THR 67 HG1 THR 67 7.185 0.460 6.569 462 HG21 THR 67 HG21 THR 67 6.663 -1.988 6.293 463 HG22 THR 67 HG22 THR 67 5.239 -2.553 7.167 464 HG23 THR 67 HG23 THR 67 6.699 -2.114 8.053 465 H SER 68 H SER 68 6.078 1.655 4.890 466 HA SER 68 HA SER 68 6.635 0.002 2.563 467 HB2 SER 68 HB2 SER 68 7.595 2.804 3.211 468 HB3 SER 68 HB3 SER 68 7.622 2.010 1.634 469 HG SER 68 HG SER 68 5.145 1.870 2.416 470 H ASP 69 H ASP 69 8.812 -0.494 1.930 471 HA ASP 69 HA ASP 69 10.566 -1.059 4.140 472 HB2 ASP 69 HB2 ASP 69 10.286 -2.539 2.098 473 HB3 ASP 69 HB3 ASP 69 11.179 -1.326 1.190 474 H ILE 70 H ILE 70 11.208 0.653 1.056 475 HA ILE 70 HA ILE 70 12.422 2.769 2.671 476 HB ILE 70 HB ILE 70 13.611 3.540 0.604 477 HG12 ILE 70 HG12 ILE 70 13.906 1.307 -0.963 478 HG13 ILE 70 HG13 ILE 70 12.189 1.257 -0.589 479 HG21 ILE 70 HG21 ILE 70 15.370 1.833 0.682 480 HG22 ILE 70 HG22 ILE 70 14.279 0.778 1.580 481 HG23 ILE 70 HG23 ILE 70 14.801 2.309 2.283 482 HD11 ILE 70 HD11 ILE 70 13.657 3.560 -1.860 483 HD12 ILE 70 HD12 ILE 70 11.939 3.527 -1.469 484 HD13 ILE 70 HD13 ILE 70 12.587 2.419 -2.678 485 H THR 71 H THR 71 11.899 4.837 2.329 486 HA THR 71 HA THR 71 9.603 5.378 0.567 487 HB THR 71 HB THR 71 9.668 7.283 2.704 488 HG1 THR 71 HG1 THR 71 10.423 5.969 4.239 489 HG21 THR 71 HG21 THR 71 7.709 6.684 1.382 490 HG22 THR 71 HG22 THR 71 7.405 6.454 3.104 491 HG23 THR 71 HG23 THR 71 7.736 5.060 2.073 492 H GLU 72 H GLU 72 12.749 6.048 1.534 493 HA GLU 72 HA GLU 72 12.935 8.394 -0.174 494 HB2 GLU 72 HB2 GLU 72 12.604 8.968 2.369 495 HB3 GLU 72 HB3 GLU 72 14.268 8.428 2.519 496 HG2 GLU 72 HG2 GLU 72 14.276 10.801 2.302 497 HG3 GLU 72 HG3 GLU 72 14.900 10.109 0.809 498 H GLY 73 H GLY 73 15.162 8.819 -0.785 499 HA2 GLY 73 HA2 GLY 73 17.454 8.277 -0.936 500 HA3 GLY 73 HA3 GLY 73 17.119 6.742 -0.145 501 H PHE 74 H PHE 74 18.493 5.968 -1.985 502 HA PHE 74 HA PHE 74 17.387 6.235 -4.643 503 HB2 PHE 74 HB2 PHE 74 19.374 4.949 -5.384 504 HB3 PHE 74 HB3 PHE 74 19.811 6.365 -4.442 505 HD1 PHE 74 HD1 PHE 74 20.732 6.104 -2.164 506 HD2 PHE 74 HD2 PHE 74 19.893 2.734 -4.631 507 HE1 PHE 74 HE1 PHE 74 22.146 4.698 -0.726 508 HE2 PHE 74 HE2 PHE 74 21.301 1.326 -3.190 509 HZ PHE 74 HZ PHE 74 22.426 2.309 -1.237 510 H ALA 75 H ALA 75 16.488 4.587 -5.844 511 HA ALA 75 HA ALA 75 15.194 2.487 -4.391 512 HB1 ALA 75 HB1 ALA 75 15.294 2.999 -7.365 513 HB2 ALA 75 HB2 ALA 75 14.097 3.654 -6.247 514 HB3 ALA 75 HB3 ALA 75 14.180 1.913 -6.536 515 HA PRO 76 HA PRO 76 18.695 -0.203 -5.217 516 HB2 PRO 76 HB2 PRO 76 18.417 -1.620 -2.879 517 HB3 PRO 76 HB3 PRO 76 19.248 -0.074 -3.034 518 HG2 PRO 76 HG2 PRO 76 16.808 -0.640 -1.628 519 HG3 PRO 76 HG3 PRO 76 17.655 0.908 -1.765 520 HD2 PRO 76 HD2 PRO 76 15.329 -0.110 -3.282 521 HD3 PRO 76 HD3 PRO 76 15.836 1.566 -2.980 522 H LEU 77 H LEU 77 15.428 -1.320 -4.766 523 HA LEU 77 HA LEU 77 15.520 -3.714 -6.096 524 HB2 LEU 77 HB2 LEU 77 15.756 -5.481 -4.499 525 HB3 LEU 77 HB3 LEU 77 17.170 -4.461 -4.366 526 HG LEU 77 HG LEU 77 15.078 -3.745 -2.446 527 HD11 LEU 77 HD11 LEU 77 16.354 -6.473 -2.275 528 HD12 LEU 77 HD12 LEU 77 14.646 -6.154 -2.580 529 HD13 LEU 77 HD13 LEU 77 15.364 -5.706 -1.031 530 HD21 LEU 77 HD21 LEU 77 17.376 -2.916 -2.336 531 HD22 LEU 77 HD22 LEU 77 17.965 -4.570 -2.152 532 HD23 LEU 77 HD23 LEU 77 16.960 -3.847 -0.895 533 H SER 78 H SER 78 13.816 -5.347 -5.105 534 HA SER 78 HA SER 78 11.266 -4.319 -5.055 535 HB2 SER 78 HB2 SER 78 12.161 -6.795 -3.561 536 HB3 SER 78 HB3 SER 78 10.549 -6.466 -4.197 537 HG SER 78 HG SER 78 11.197 -7.317 -5.992 538 H VAL 79 H VAL 79 10.313 -2.975 -3.708 539 HA VAL 79 HA VAL 79 11.077 -2.617 -0.986 540 HB VAL 79 HB VAL 79 8.781 -1.551 -2.639 541 HG11 VAL 79 HG11 VAL 79 7.920 -1.790 -0.340 542 HG12 VAL 79 HG12 VAL 79 8.130 -0.098 -0.794 543 HG13 VAL 79 HG13 VAL 79 9.306 -0.880 0.262 544 HG21 VAL 79 HG21 VAL 79 11.165 -0.263 -1.327 545 HG22 VAL 79 HG22 VAL 79 9.938 0.576 -2.276 546 HG23 VAL 79 HG23 VAL 79 10.982 -0.621 -3.045 547 H ARG 80 H ARG 80 10.745 -4.052 0.487 548 HA ARG 80 HA ARG 80 8.734 -6.051 0.467 549 HB2 ARG 80 HB2 ARG 80 10.654 -5.048 2.558 550 HB3 ARG 80 HB3 ARG 80 9.384 -6.178 2.993 551 HG2 ARG 80 HG2 ARG 80 11.252 -7.515 2.640 552 HG3 ARG 80 HG3 ARG 80 10.323 -7.676 1.155 553 HD2 ARG 80 HD2 ARG 80 12.722 -7.440 0.722 554 HD3 ARG 80 HD3 ARG 80 11.797 -6.110 0.028 555 HE ARG 80 HE ARG 80 12.510 -4.846 2.107 556 HH11 ARG 80 HH11 ARG 80 14.483 -7.483 0.869 557 HH12 ARG 80 HH12 ARG 80 15.974 -6.750 1.370 558 HH21 ARG 80 HH21 ARG 80 14.458 -3.897 2.748 559 HH22 ARG 80 HH22 ARG 80 15.966 -4.707 2.427 560 H PHE 81 H PHE 81 6.681 -5.805 0.857 561 HA PHE 81 HA PHE 81 5.803 -3.498 2.424 562 HB2 PHE 81 HB2 PHE 81 3.561 -3.893 1.369 563 HB3 PHE 81 HB3 PHE 81 4.829 -3.462 0.235 564 HD1 PHE 81 HD2 PHE 81 5.677 -5.115 -1.369 565 HD2 PHE 81 HD1 PHE 81 2.499 -6.049 1.300 566 HE1 PHE 81 HE2 PHE 81 5.105 -7.078 -2.737 567 HE2 PHE 81 HE1 PHE 81 1.922 -8.007 -0.063 568 HZ PHE 81 HZ PHE 81 3.225 -8.526 -2.083 569 H LYS 82 H LYS 82 4.678 -3.726 4.256 570 HA LYS 82 HA LYS 82 3.856 -6.440 5.047 571 HB2 LYS 82 HB2 LYS 82 5.237 -4.321 6.674 572 HB3 LYS 82 HB3 LYS 82 4.260 -5.559 7.445 573 HG2 LYS 82 HG2 LYS 82 6.590 -6.141 5.637 574 HG3 LYS 82 HG3 LYS 82 6.700 -6.032 7.396 575 HD2 LYS 82 HD2 LYS 82 5.127 -7.866 7.633 576 HD3 LYS 82 HD3 LYS 82 4.919 -7.943 5.883 577 HE2 LYS 82 HE2 LYS 82 7.214 -8.607 5.597 578 HE3 LYS 82 HE3 LYS 82 7.531 -8.385 7.318 579 HZ1 LYS 82 HZ1 LYS 82 5.631 -10.366 6.179 580 HZ2 LYS 82 HZ2 LYS 82 6.022 -10.178 7.814 581 HZ3 LYS 82 HZ3 LYS 82 7.196 -10.722 6.719 582 H ASP 83 H ASP 83 1.716 -6.538 5.192 583 HA ASP 83 HA ASP 83 0.243 -4.056 5.420 584 HB2 ASP 83 HB2 ASP 83 -1.706 -5.250 4.744 585 HB3 ASP 83 HB3 ASP 83 -0.391 -5.766 3.703 586 H PHE 84 H PHE 84 -0.928 -3.422 7.054 587 HA PHE 84 HA PHE 84 -0.758 -5.000 9.546 588 HB2 PHE 84 HB2 PHE 84 -0.050 -2.090 9.121 589 HB3 PHE 84 HB3 PHE 84 -0.360 -2.772 10.710 590 HD1 PHE 84 HD2 PHE 84 1.044 -5.409 10.391 591 HD2 PHE 84 HD1 PHE 84 2.164 -1.463 9.261 592 HE1 PHE 84 HE2 PHE 84 3.415 -6.033 10.576 593 HE2 PHE 84 HE1 PHE 84 4.531 -2.083 9.450 594 HZ PHE 84 HZ PHE 84 5.161 -4.366 10.109 595 H SER 85 H SER 85 -2.776 -4.066 7.418 596 HA SER 85 HA SER 85 -4.700 -2.395 8.425 597 HB2 SER 85 HB2 SER 85 -5.133 -4.871 6.754 598 HB3 SER 85 HB3 SER 85 -6.218 -3.485 6.872 599 HG SER 85 HG SER 85 -4.394 -3.754 5.114 600 H GLU 86 H GLU 86 -6.081 -2.437 10.041 601 HA GLU 86 HA GLU 86 -6.515 -4.971 11.456 602 HB2 GLU 86 HB2 GLU 86 -6.644 -2.140 12.525 603 HB3 GLU 86 HB3 GLU 86 -6.977 -3.590 13.456 604 HG2 GLU 86 HG2 GLU 86 -4.329 -2.915 12.203 605 HG3 GLU 86 HG3 GLU 86 -4.752 -2.624 13.890 606 H ASN 87 H ASN 87 -8.598 -5.318 12.292 607 HA ASN 87 HA ASN 87 -10.867 -5.382 12.397 608 HB2 ASN 87 HB2 ASN 87 -10.652 -2.446 11.700 609 HB3 ASN 87 HB3 ASN 87 -12.088 -3.237 12.339 610 HD21 ASN 87 HD21 ASN 87 -10.023 -1.131 13.258 611 HD22 ASN 87 HD22 ASN 87 -9.713 -1.577 14.896 612 H ALA 88 H ALA 88 -9.589 -6.027 9.859 613 HA ALA 88 HA ALA 88 -11.534 -4.999 7.897 614 HB1 ALA 88 HB1 ALA 88 -8.650 -5.755 7.444 615 HB2 ALA 88 HB2 ALA 88 -9.285 -4.113 7.534 616 HB3 ALA 88 HB3 ALA 88 -9.773 -5.175 6.212 617 H THR 89 H THR 89 -12.255 -6.403 6.306 618 HA THR 89 HA THR 89 -12.178 -9.214 7.041 619 HB THR 89 HB THR 89 -13.809 -7.911 4.850 620 HG1 THR 89 HG1 THR 89 -14.105 -7.959 7.655 621 HG21 THR 89 HG21 THR 89 -15.331 -9.796 5.210 622 HG22 THR 89 HG22 THR 89 -14.278 -10.422 6.476 623 HG23 THR 89 HG23 THR 89 -13.718 -10.386 4.805 624 H SER 90 H SER 90 -11.683 -7.246 4.090 625 HA SER 90 HA SER 90 -9.883 -9.344 3.087 626 HB2 SER 90 HB2 SER 90 -12.026 -7.929 1.476 627 HB3 SER 90 HB3 SER 90 -10.826 -9.041 0.817 628 HG SER 90 HG SER 90 -12.555 -10.307 1.186 629 H ARG 91 H ARG 91 -8.390 -8.606 1.434 630 HA ARG 91 HA ARG 91 -7.878 -5.715 1.560 631 HB2 ARG 91 HB2 ARG 91 -5.464 -6.186 1.437 632 HB3 ARG 91 HB3 ARG 91 -6.191 -6.854 2.889 633 HG2 ARG 91 HG2 ARG 91 -6.185 -9.067 1.904 634 HG3 ARG 91 HG3 ARG 91 -5.537 -8.419 0.398 635 HD2 ARG 91 HD2 ARG 91 -3.530 -7.668 1.649 636 HD3 ARG 91 HD3 ARG 91 -4.180 -8.452 3.090 637 HE ARG 91 HE ARG 91 -3.873 -10.101 0.711 638 HH11 ARG 91 HH11 ARG 91 -2.586 -9.208 3.874 639 HH12 ARG 91 HH12 ARG 91 -1.582 -10.622 3.978 640 HH21 ARG 91 HH21 ARG 91 -2.549 -11.933 0.881 641 HH22 ARG 91 HH22 ARG 91 -1.551 -12.151 2.290 642 H LEU 92 H LEU 92 -6.891 -4.772 -0.250 643 HA LEU 92 HA LEU 92 -6.962 -6.293 -2.758 644 HB2 LEU 92 HB2 LEU 92 -9.134 -5.085 -2.352 645 HB3 LEU 92 HB3 LEU 92 -8.242 -3.581 -2.323 646 HG LEU 92 HG LEU 92 -7.550 -4.080 -4.711 647 HD11 LEU 92 HD11 LEU 92 -9.728 -6.143 -4.443 648 HD12 LEU 92 HD12 LEU 92 -8.017 -6.465 -4.726 649 HD13 LEU 92 HD13 LEU 92 -8.973 -5.633 -5.953 650 HD21 LEU 92 HD21 LEU 92 -9.679 -3.314 -5.628 651 HD22 LEU 92 HD22 LEU 92 -9.281 -2.457 -4.138 652 HD23 LEU 92 HD23 LEU 92 -10.487 -3.745 -4.121 653 H TRP 93 H TRP 93 -4.867 -6.123 -3.412 654 HA TRP 93 HA TRP 93 -3.450 -3.612 -3.028 655 HB2 TRP 93 HB2 TRP 93 -2.608 -6.296 -4.126 656 HB3 TRP 93 HB3 TRP 93 -1.574 -4.878 -4.230 657 HD1 TRP 93 HD1 TRP 93 -2.486 -7.673 -1.932 658 HE1 TRP 93 HE1 TRP 93 -1.276 -7.385 0.325 659 HE3 TRP 93 HE3 TRP 93 -0.825 -2.867 -2.493 660 HZ2 TRP 93 HZ2 TRP 93 0.146 -5.386 1.695 661 HZ3 TRP 93 HZ3 TRP 93 0.455 -1.848 -0.658 662 HH2 TRP 93 HH2 TRP 93 0.929 -3.081 1.391 663 H MET 94 H MET 94 -3.707 -2.049 -4.412 664 HA MET 94 HA MET 94 -4.661 -2.693 -7.112 665 HB2 MET 94 HB2 MET 94 -4.832 -0.104 -5.562 666 HB3 MET 94 HB3 MET 94 -5.421 -0.332 -7.199 667 HG2 MET 94 HG2 MET 94 -6.971 -2.058 -6.358 668 HG3 MET 94 HG3 MET 94 -6.429 -1.701 -4.720 669 HE1 MET 94 HE1 MET 94 -7.280 0.646 -7.833 670 HE2 MET 94 HE2 MET 94 -8.931 1.098 -7.405 671 HE3 MET 94 HE3 MET 94 -8.542 -0.584 -7.772 672 H PHE 95 H PHE 95 -2.944 -2.906 -8.429 673 HA PHE 95 HA PHE 95 -0.792 -0.981 -8.422 674 HB2 PHE 95 HB2 PHE 95 -1.462 -3.238 -10.334 675 HB3 PHE 95 HB3 PHE 95 0.021 -2.291 -10.371 676 HD1 PHE 95 HD2 PHE 95 1.605 -2.443 -8.457 677 HD2 PHE 95 HD1 PHE 95 -1.709 -5.076 -8.877 678 HE1 PHE 95 HE2 PHE 95 2.657 -4.009 -6.884 679 HE2 PHE 95 HE1 PHE 95 -0.665 -6.647 -7.301 680 HZ PHE 95 HZ PHE 95 1.521 -6.116 -6.300 681 H GLY 96 H GLY 96 -3.536 -1.863 -10.434 682 HA2 GLY 96 HA2 GLY 96 -4.958 -0.120 -11.291 683 HA3 GLY 96 HA3 GLY 96 -3.518 0.836 -11.608 684 H ASP 97 H ASP 97 -2.003 -1.373 -12.858 685 HA ASP 97 HA ASP 97 -3.607 -1.871 -15.233 686 HB2 ASP 97 HB2 ASP 97 -1.534 -2.586 -16.285 687 HB3 ASP 97 HB3 ASP 97 -1.284 -1.033 -15.505 688 H GLY 98 H GLY 98 -3.700 -4.012 -16.167 689 HA2 GLY 98 HA2 GLY 98 -3.981 -6.301 -16.097 690 HA3 GLY 98 HA3 GLY 98 -3.020 -6.324 -14.623 691 H ASN 99 H ASN 99 -4.114 -7.327 -13.146 692 HA ASN 99 HA ASN 99 -6.861 -6.437 -12.595 693 HB2 ASN 99 HB2 ASN 99 -5.693 -9.203 -12.436 694 HB3 ASN 99 HB3 ASN 99 -7.064 -8.753 -11.427 695 HD21 ASN 99 HD21 ASN 99 -6.837 -10.687 -13.663 696 HD22 ASN 99 HD22 ASN 99 -8.071 -10.224 -14.783 697 H THR 100 H THR 100 -7.326 -5.824 -10.547 698 HA THR 100 HA THR 100 -5.160 -5.563 -8.679 699 HB THR 100 HB THR 100 -6.857 -4.553 -7.154 700 HG1 THR 100 HG1 THR 100 -8.727 -4.395 -9.189 701 HG21 THR 100 HG21 THR 100 -7.241 -2.555 -8.529 702 HG22 THR 100 HG22 THR 100 -6.791 -3.462 -9.973 703 HG23 THR 100 HG23 THR 100 -5.593 -3.153 -8.714 704 H SER 101 H SER 101 -5.323 -6.225 -6.452 705 HA SER 101 HA SER 101 -4.842 -7.869 -5.027 706 HB2 SER 101 HB2 SER 101 -6.554 -9.419 -4.319 707 HB3 SER 101 HB3 SER 101 -7.233 -7.817 -4.560 708 HG SER 101 HG SER 101 -7.878 -8.701 -6.721 709 H ASP 102 H ASP 102 -5.877 -9.345 -8.103 710 HA ASP 102 HA ASP 102 -4.141 -11.639 -7.675 711 HB2 ASP 102 HB2 ASP 102 -6.359 -11.881 -8.781 712 HB3 ASP 102 HB3 ASP 102 -5.806 -10.817 -10.066 713 H SER 103 H SER 103 -2.058 -11.627 -8.237 714 HA SER 103 HA SER 103 -1.179 -9.627 -10.212 715 HB2 SER 103 HB2 SER 103 0.481 -10.814 -7.976 716 HB3 SER 103 HB3 SER 103 0.950 -9.508 -9.057 717 HG SER 103 HG SER 103 -1.239 -8.651 -8.041 718 HA PRO 104 HA PRO 104 -0.256 -13.558 -12.433 719 HB2 PRO 104 HB2 PRO 104 -0.117 -11.645 -14.686 720 HB3 PRO 104 HB3 PRO 104 -1.031 -13.151 -14.542 721 HG2 PRO 104 HG2 PRO 104 -2.286 -10.802 -14.452 722 HG3 PRO 104 HG3 PRO 104 -2.778 -12.132 -13.385 723 HD2 PRO 104 HD2 PRO 104 -1.064 -9.748 -12.767 724 HD3 PRO 104 HD3 PRO 104 -2.412 -10.432 -11.830 725 H SER 105 H SER 105 1.245 -10.386 -12.940 726 HA SER 105 HA SER 105 3.878 -11.553 -13.360 727 HB2 SER 105 HB2 SER 105 4.462 -9.052 -13.581 728 HB3 SER 105 HB3 SER 105 3.365 -9.711 -14.796 729 HG SER 105 HG SER 105 2.590 -7.728 -13.972 730 HA PRO 106 HA PRO 106 5.242 -10.686 -9.086 731 HB2 PRO 106 HB2 PRO 106 7.621 -9.261 -10.092 732 HB3 PRO 106 HB3 PRO 106 7.521 -10.709 -9.088 733 HG2 PRO 106 HG2 PRO 106 8.308 -10.823 -11.647 734 HG3 PRO 106 HG3 PRO 106 7.353 -12.119 -10.903 735 HD2 PRO 106 HD2 PRO 106 6.467 -9.929 -12.742 736 HD3 PRO 106 HD3 PRO 106 5.989 -11.637 -12.714 737 H LEU 107 H LEU 107 6.011 -8.824 -7.663 738 HA LEU 107 HA LEU 107 4.498 -6.466 -8.179 739 HB2 LEU 107 HB2 LEU 107 5.400 -5.596 -6.112 740 HB3 LEU 107 HB3 LEU 107 4.973 -7.274 -5.878 741 HG LEU 107 HG LEU 107 7.656 -7.417 -6.512 742 HD11 LEU 107 HD11 LEU 107 8.760 -5.797 -5.036 743 HD12 LEU 107 HD12 LEU 107 7.212 -4.998 -4.763 744 HD13 LEU 107 HD13 LEU 107 7.928 -5.008 -6.376 745 HD21 LEU 107 HD21 LEU 107 7.957 -7.918 -4.139 746 HD22 LEU 107 HD22 LEU 107 6.510 -8.688 -4.789 747 HD23 LEU 107 HD23 LEU 107 6.365 -7.239 -3.794 748 H HIS 108 H HIS 108 5.191 -4.412 -8.765 749 HA HIS 108 HA HIS 108 7.287 -4.343 -10.648 750 HB2 HIS 108 HB2 HIS 108 6.857 -1.909 -10.823 751 HB3 HIS 108 HB3 HIS 108 5.409 -2.873 -10.983 752 HD1 HIS 108 HD1 HIS 108 6.929 -0.159 -8.991 753 HD2 HIS 108 HD2 HIS 108 3.553 -2.578 -8.826 754 HE1 HIS 108 HE1 HIS 108 5.385 0.954 -7.343 755 HE2 HIS 108 HE2 HIS 108 3.274 -0.440 -7.384 756 H THR 109 H THR 109 9.334 -4.329 -10.319 757 HA THR 109 HA THR 109 10.376 -3.887 -7.664 758 HB THR 109 HB THR 109 11.952 -4.623 -10.145 759 HG1 THR 109 HG1 THR 109 9.943 -5.976 -9.228 760 HG21 THR 109 HG21 THR 109 12.382 -5.210 -7.208 761 HG22 THR 109 HG22 THR 109 13.282 -4.037 -8.169 762 HG23 THR 109 HG23 THR 109 13.415 -5.759 -8.528 763 H PHE 110 H PHE 110 11.980 -2.405 -7.119 764 HA PHE 110 HA PHE 110 11.630 0.099 -8.552 765 HB2 PHE 110 HB2 PHE 110 12.683 -0.541 -5.783 766 HB3 PHE 110 HB3 PHE 110 12.694 1.078 -6.463 767 HD1 PHE 110 HD2 PHE 110 10.035 -1.597 -6.391 768 HD2 PHE 110 HD1 PHE 110 11.176 2.367 -5.342 769 HE1 PHE 110 HE2 PHE 110 7.782 -1.193 -5.500 770 HE2 PHE 110 HE1 PHE 110 8.922 2.767 -4.443 771 HZ PHE 110 HZ PHE 110 7.224 0.989 -4.520 772 H PHE 111 H PHE 111 13.001 -0.707 -10.277 773 HA PHE 111 HA PHE 111 15.875 -0.698 -9.764 774 HB2 PHE 111 HB2 PHE 111 14.262 -1.229 -12.257 775 HB3 PHE 111 HB3 PHE 111 16.014 -1.119 -12.263 776 HD1 PHE 111 HD1 PHE 111 17.099 -2.671 -10.302 777 HD2 PHE 111 HD2 PHE 111 13.399 -3.321 -12.295 778 HE1 PHE 111 HE1 PHE 111 17.267 -5.077 -9.819 779 HE2 PHE 111 HE2 PHE 111 13.555 -5.726 -11.809 780 HZ PHE 111 HZ PHE 111 15.493 -6.608 -10.571 781 H ASN 112 H ASN 112 13.394 1.410 -10.848 782 HA ASN 112 HA ASN 112 15.406 3.300 -11.861 783 HB2 ASN 112 HB2 ASN 112 13.768 2.324 -13.584 784 HB3 ASN 112 HB3 ASN 112 12.516 3.239 -12.754 785 HD21 ASN 112 HD21 ASN 112 15.432 3.452 -14.674 786 HD22 ASN 112 HD22 ASN 112 15.202 5.085 -15.200 787 H GLU 113 H GLU 113 14.945 5.531 -11.444 788 HA GLU 113 HA GLU 113 13.736 5.826 -8.818 789 HB2 GLU 113 HB2 GLU 113 15.530 7.701 -10.363 790 HB3 GLU 113 HB3 GLU 113 15.015 7.913 -8.696 791 HG2 GLU 113 HG2 GLU 113 16.943 6.912 -8.171 792 HG3 GLU 113 HG3 GLU 113 16.106 5.425 -8.612 793 H GLY 114 H GLY 114 12.853 8.160 -8.434 794 HA2 GLY 114 HA2 GLY 114 11.584 9.937 -9.685 795 HA3 GLY 114 HA3 GLY 114 10.788 8.595 -10.500 796 H GLU 115 H GLU 115 8.829 8.187 -9.741 797 HA GLU 115 HA GLU 115 8.356 8.363 -6.861 798 HB2 GLU 115 HB2 GLU 115 7.625 10.487 -7.930 799 HB3 GLU 115 HB3 GLU 115 6.518 9.564 -8.939 800 HG2 GLU 115 HG2 GLU 115 5.450 8.734 -6.798 801 HG3 GLU 115 HG3 GLU 115 6.429 9.931 -5.949 802 H TYR 116 H TYR 116 7.213 6.710 -6.116 803 HA TYR 116 HA TYR 116 5.547 5.164 -7.987 804 HB2 TYR 116 HB2 TYR 116 7.301 4.147 -5.746 805 HB3 TYR 116 HB3 TYR 116 6.079 3.166 -6.544 806 HD1 TYR 116 HD1 TYR 116 6.372 2.507 -8.894 807 HD2 TYR 116 HD2 TYR 116 9.418 4.606 -6.800 808 HE1 TYR 116 HE1 TYR 116 8.003 1.817 -10.591 809 HE2 TYR 116 HE2 TYR 116 11.063 3.921 -8.496 810 HH TYR 116 HH TYR 116 10.200 2.619 -11.478 811 H ILE 117 H ILE 117 3.634 4.264 -7.077 812 HA ILE 117 HA ILE 117 2.924 5.350 -4.425 813 HB ILE 117 HB ILE 117 0.960 5.013 -6.720 814 HG12 ILE 117 HG12 ILE 117 2.059 7.597 -5.578 815 HG13 ILE 117 HG13 ILE 117 2.602 6.882 -7.090 816 HG21 ILE 117 HG21 ILE 117 0.680 6.246 -3.976 817 HG22 ILE 117 HG22 ILE 117 -0.070 4.751 -4.543 818 HG23 ILE 117 HG23 ILE 117 -0.548 6.300 -5.241 819 HD11 ILE 117 HD11 ILE 117 0.369 7.151 -8.027 820 HD12 ILE 117 HD12 ILE 117 1.016 8.693 -7.461 821 HD13 ILE 117 HD13 ILE 117 -0.193 7.837 -6.502 822 H VAL 118 H VAL 118 2.468 3.807 -2.982 823 HA VAL 118 HA VAL 118 1.690 1.133 -3.935 824 HB VAL 118 HB VAL 118 2.603 1.933 -1.151 825 HG11 VAL 118 HG11 VAL 118 2.865 -0.463 -0.763 826 HG12 VAL 118 HG12 VAL 118 2.242 -0.800 -2.377 827 HG13 VAL 118 HG13 VAL 118 1.194 -0.065 -1.165 828 HG21 VAL 118 HG21 VAL 118 4.152 0.560 -3.347 829 HG22 VAL 118 HG22 VAL 118 4.716 0.816 -1.695 830 HG23 VAL 118 HG23 VAL 118 4.422 2.199 -2.750 831 H SER 119 H SER 119 -0.390 0.513 -3.756 832 HA SER 119 HA SER 119 -2.150 2.143 -2.046 833 HB2 SER 119 HB2 SER 119 -2.491 2.608 -4.431 834 HB3 SER 119 HB3 SER 119 -2.788 0.899 -4.732 835 HG SER 119 HG SER 119 -4.711 2.186 -4.511 836 H LEU 120 H LEU 120 -2.895 1.065 -0.393 837 HA LEU 120 HA LEU 120 -3.848 -1.698 -0.770 838 HB2 LEU 120 HB2 LEU 120 -1.888 -1.704 0.679 839 HB3 LEU 120 HB3 LEU 120 -2.595 -0.469 1.693 840 HG LEU 120 HG LEU 120 -4.217 -2.032 2.589 841 HD11 LEU 120 HD11 LEU 120 -3.058 -4.074 0.681 842 HD12 LEU 120 HD12 LEU 120 -4.650 -3.327 0.531 843 HD13 LEU 120 HD13 LEU 120 -4.292 -4.371 1.908 844 HD21 LEU 120 HD21 LEU 120 -1.482 -3.261 2.465 845 HD22 LEU 120 HD22 LEU 120 -2.733 -3.616 3.657 846 HD23 LEU 120 HD23 LEU 120 -2.013 -2.007 3.586 847 H ILE 121 H ILE 121 -5.963 -1.716 -0.760 848 HA ILE 121 HA ILE 121 -7.403 0.062 1.090 849 HB ILE 121 HB ILE 121 -7.940 0.916 -1.045 850 HG12 ILE 121 HG12 ILE 121 -10.147 -0.987 -0.234 851 HG13 ILE 121 HG13 ILE 121 -9.936 0.666 0.307 852 HG21 ILE 121 HG21 ILE 121 -7.017 -0.823 -2.420 853 HG22 ILE 121 HG22 ILE 121 -8.649 -0.434 -2.959 854 HG23 ILE 121 HG23 ILE 121 -8.357 -1.899 -2.020 855 HD11 ILE 121 HD11 ILE 121 -11.729 0.508 -1.301 856 HD12 ILE 121 HD12 ILE 121 -10.638 -0.212 -2.485 857 HD13 ILE 121 HD13 ILE 121 -10.398 1.456 -1.965 858 H VAL 122 H VAL 122 -8.891 -0.884 2.402 859 HA VAL 122 HA VAL 122 -9.272 -3.785 2.079 860 HB VAL 122 HB VAL 122 -9.575 -3.935 4.532 861 HG11 VAL 122 HG11 VAL 122 -6.927 -2.807 3.636 862 HG12 VAL 122 HG12 VAL 122 -7.435 -4.494 3.548 863 HG13 VAL 122 HG13 VAL 122 -7.202 -3.723 5.117 864 HG21 VAL 122 HG21 VAL 122 -8.609 -1.074 4.559 865 HG22 VAL 122 HG22 VAL 122 -8.822 -2.106 5.973 866 HG23 VAL 122 HG23 VAL 122 -10.222 -1.634 5.010 867 H SER 123 H SER 123 -11.284 -4.633 3.070 868 HA SER 123 HA SER 123 -13.488 -2.714 2.883 869 HB2 SER 123 HB2 SER 123 -14.762 -4.486 1.602 870 HB3 SER 123 HB3 SER 123 -13.441 -3.720 0.720 871 HG SER 123 HG SER 123 -12.277 -5.538 0.832 872 H ASN 124 H ASN 124 -15.276 -3.184 4.106 873 HA ASN 124 HA ASN 124 -15.487 -5.608 5.678 874 HB2 ASN 124 HB2 ASN 124 -13.971 -4.287 7.060 875 HB3 ASN 124 HB3 ASN 124 -14.977 -2.866 6.887 876 HD21 ASN 124 HD21 ASN 124 -14.654 -5.984 8.431 877 HD22 ASN 124 HD22 ASN 124 -15.764 -5.668 9.720 878 H GLU 125 H GLU 125 -17.684 -5.349 7.037 879 HA GLU 125 HA GLU 125 -19.646 -4.686 5.050 880 HB2 GLU 125 HB2 GLU 125 -21.258 -5.632 6.657 881 HB3 GLU 125 HB3 GLU 125 -19.890 -6.704 6.390 882 HG2 GLU 125 HG2 GLU 125 -18.893 -5.857 8.514 883 HG3 GLU 125 HG3 GLU 125 -20.367 -4.933 8.785 884 H ASN 126 H ASN 126 -18.262 -3.002 7.670 885 HA ASN 126 HA ASN 126 -20.550 -1.241 8.087 886 HB2 ASN 126 HB2 ASN 126 -17.786 -1.192 9.329 887 HB3 ASN 126 HB3 ASN 126 -19.160 -0.211 9.830 888 HD21 ASN 126 HD21 ASN 126 -17.478 -2.366 11.130 889 HD22 ASN 126 HD22 ASN 126 -18.638 -3.468 11.780 890 H ASP 127 H ASP 127 -17.152 -0.992 7.070 891 HA ASP 127 HA ASP 127 -17.788 1.269 5.364 892 HB2 ASP 127 HB2 ASP 127 -17.324 2.128 7.728 893 HB3 ASP 127 HB3 ASP 127 -15.676 1.559 7.520 894 H SER 128 H SER 128 -15.745 1.972 4.163 895 HA SER 128 HA SER 128 -13.810 -0.235 3.917 896 HB2 SER 128 HB2 SER 128 -14.544 1.715 1.720 897 HB3 SER 128 HB3 SER 128 -13.567 0.253 1.577 898 HG SER 128 HG SER 128 -16.355 0.496 1.978 899 H ASP 129 H ASP 129 -11.613 0.396 3.798 900 HA ASP 129 HA ASP 129 -11.098 3.249 4.255 901 HB2 ASP 129 HB2 ASP 129 -11.125 1.847 6.404 902 HB3 ASP 129 HB3 ASP 129 -9.662 1.083 5.790 903 H SER 130 H SER 130 -9.346 4.034 3.190 904 HA SER 130 HA SER 130 -7.690 2.068 1.764 905 HB2 SER 130 HB2 SER 130 -8.470 4.741 0.619 906 HB3 SER 130 HB3 SER 130 -7.837 3.328 -0.222 907 HG SER 130 HG SER 130 -10.015 2.477 0.853 908 H ALA 131 H ALA 131 -5.548 2.376 1.914 909 HA ALA 131 HA ALA 131 -4.559 5.008 2.789 910 HB1 ALA 131 HB1 ALA 131 -3.461 2.334 3.651 911 HB2 ALA 131 HB2 ALA 131 -4.404 3.434 4.657 912 HB3 ALA 131 HB3 ALA 131 -2.808 3.915 4.081 913 H SER 132 H SER 132 -2.839 5.788 1.711 914 HA SER 132 HA SER 132 -1.292 4.087 -0.053 915 HB2 SER 132 HB2 SER 132 -3.388 4.871 -1.296 916 HB3 SER 132 HB3 SER 132 -2.722 6.501 -1.188 917 HG SER 132 HG SER 132 -1.287 4.319 -2.280 918 H VAL 133 H VAL 133 0.695 5.176 -0.768 919 HA VAL 133 HA VAL 133 1.263 7.697 0.564 920 HB VAL 133 HB VAL 133 1.745 5.915 2.236 921 HG11 VAL 133 HG11 VAL 133 2.458 4.114 0.816 922 HG12 VAL 133 HG12 VAL 133 3.735 4.503 1.969 923 HG13 VAL 133 HG13 VAL 133 3.866 5.037 0.293 924 HG21 VAL 133 HG21 VAL 133 3.966 6.698 2.900 925 HG22 VAL 133 HG22 VAL 133 2.918 8.028 2.406 926 HG23 VAL 133 HG23 VAL 133 4.175 7.442 1.314 927 H THR 134 H THR 134 2.926 8.865 -0.320 928 HA THR 134 HA THR 134 3.834 8.183 -2.962 929 HB THR 134 HB THR 134 4.627 10.509 -1.190 930 HG1 THR 134 HG1 THR 134 2.796 10.729 -3.317 931 HG21 THR 134 HG21 THR 134 6.166 10.128 -3.080 932 HG22 THR 134 HG22 THR 134 5.259 11.630 -3.263 933 HG23 THR 134 HG23 THR 134 4.798 10.202 -4.190 934 H ILE 135 H ILE 135 5.414 6.752 -3.209 935 HA ILE 135 HA ILE 135 7.659 6.631 -1.340 936 HB ILE 135 HB ILE 135 7.354 5.028 -3.892 937 HG12 ILE 135 HG12 ILE 135 5.354 4.598 -2.527 938 HG13 ILE 135 HG13 ILE 135 6.399 3.186 -2.576 939 HG21 ILE 135 HG21 ILE 135 9.582 5.042 -2.926 940 HG22 ILE 135 HG22 ILE 135 8.853 3.442 -2.764 941 HG23 ILE 135 HG23 ILE 135 8.932 4.521 -1.370 942 HD11 ILE 135 HD11 ILE 135 5.457 3.526 -0.367 943 HD12 ILE 135 HD12 ILE 135 6.176 5.136 -0.295 944 HD13 ILE 135 HD13 ILE 135 7.212 3.708 -0.338 945 H ARG 136 H ARG 136 9.509 7.742 -1.750 946 HA ARG 136 HA ARG 136 9.745 8.891 -4.433 947 HB2 ARG 136 HB2 ARG 136 10.625 10.027 -1.782 948 HB3 ARG 136 HB3 ARG 136 11.126 10.687 -3.335 949 HG2 ARG 136 HG2 ARG 136 8.736 11.023 -3.902 950 HG3 ARG 136 HG3 ARG 136 8.318 10.500 -2.271 951 HD2 ARG 136 HD2 ARG 136 10.048 12.859 -2.985 952 HD3 ARG 136 HD3 ARG 136 8.366 12.937 -2.469 953 HE ARG 136 HE ARG 136 10.390 11.751 -0.690 954 HH11 ARG 136 HH11 ARG 136 7.982 14.245 -1.321 955 HH12 ARG 136 HH12 ARG 136 8.086 14.908 0.280 956 HH21 ARG 136 HH21 ARG 136 10.519 12.636 1.394 957 HH22 ARG 136 HH22 ARG 136 9.524 14.001 1.823 958 H ALA 137 H ALA 137 11.171 7.971 -5.577 959 HA ALA 137 HA ALA 137 13.493 6.710 -4.329 960 HB1 ALA 137 HB1 ALA 137 12.189 5.305 -5.854 961 HB2 ALA 137 HB2 ALA 137 13.803 5.604 -6.497 962 HB3 ALA 137 HB3 ALA 137 12.420 6.485 -7.146 963 H LEU 138 H LEU 138 15.154 7.978 -4.146 964 HA LEU 138 HA LEU 138 15.447 10.349 -5.781 965 HB2 LEU 138 HB2 LEU 138 17.238 9.281 -3.591 966 HB3 LEU 138 HB3 LEU 138 17.347 10.866 -4.332 967 HG LEU 138 HG LEU 138 15.104 9.852 -2.583 968 HD11 LEU 138 HD11 LEU 138 17.178 11.995 -2.153 969 HD12 LEU 138 HD12 LEU 138 17.133 10.415 -1.370 970 HD13 LEU 138 HD13 LEU 138 15.861 11.594 -1.050 971 HD21 LEU 138 HD21 LEU 138 15.422 12.541 -3.912 972 HD22 LEU 138 HD22 LEU 138 14.159 12.089 -2.763 973 HD23 LEU 138 HD23 LEU 138 14.238 11.307 -4.346 974 H GLU 139 H GLU 139 17.225 10.795 -7.067 975 HA GLU 139 HA GLU 139 17.934 8.526 -8.651 976 HB2 GLU 139 HB2 GLU 139 18.908 11.372 -8.911 977 HB3 GLU 139 HB3 GLU 139 18.983 10.124 -10.143 978 HG2 GLU 139 HG2 GLU 139 16.602 10.130 -10.382 979 HG3 GLU 139 HG3 GLU 139 16.429 11.228 -9.013 980 H HIS 140 H HIS 140 19.908 7.549 -8.917 981 HA HIS 140 HA HIS 140 22.151 8.365 -7.300 982 HB2 HIS 140 HB2 HIS 140 23.451 6.672 -8.452 983 HB3 HIS 140 HB3 HIS 140 21.897 5.975 -8.063 984 HD1 HIS 140 HD1 HIS 140 20.228 5.659 -10.170 985 HD2 HIS 140 HD2 HIS 140 24.200 6.548 -11.056 986 HE1 HIS 140 HE1 HIS 140 20.548 5.001 -12.582 987 HE2 HIS 140 HE2 HIS 140 22.991 5.382 -13.036 988 H HIS 141 H HIS 141 23.589 9.938 -7.812 989 HA HIS 141 HA HIS 141 22.452 11.798 -9.655 990 HB2 HIS 141 HB2 HIS 141 23.579 12.199 -7.317 991 HB3 HIS 141 HB3 HIS 141 25.049 12.346 -8.275 992 HD1 HIS 141 HD1 HIS 141 21.509 13.765 -8.511 993 HD2 HIS 141 HD2 HIS 141 25.489 14.925 -8.937 994 HE1 HIS 141 HE1 HIS 141 21.440 16.196 -9.170 995 HE2 HIS 141 HE2 HIS 141 23.854 16.877 -9.443 996 H HIS 142 H HIS 142 22.942 12.255 -11.606 997 HA HIS 142 HA HIS 142 24.684 10.746 -13.210 998 HB2 HIS 142 HB2 HIS 142 22.554 12.164 -13.784 999 HB3 HIS 142 HB3 HIS 142 23.697 13.477 -14.012 1000 HD1 HIS 142 HD1 HIS 142 21.849 11.361 -15.969 1001 HD2 HIS 142 HD2 HIS 142 25.916 12.250 -15.932 1002 HE1 HIS 142 HE1 HIS 142 22.690 10.783 -18.273 1003 HE2 HIS 142 HE2 HIS 142 25.131 11.401 -18.257 1004 H HIS 143 H HIS 143 25.127 13.864 -11.611 1005 HA HIS 143 HA HIS 143 27.561 14.484 -12.963 1006 HB2 HIS 143 HB2 HIS 143 26.049 16.186 -11.894 1007 HB3 HIS 143 HB3 HIS 143 26.607 15.614 -10.331 1008 HD1 HIS 143 HD1 HIS 143 27.714 17.560 -13.330 1009 HD2 HIS 143 HD2 HIS 143 29.159 16.487 -9.576 1010 HE1 HIS 143 HE1 HIS 143 29.766 18.971 -12.969 1011 HE2 HIS 143 HE2 HIS 143 30.704 18.215 -10.748 1012 H HIS 144 H HIS 144 29.336 13.487 -12.746 1013 HA HIS 144 HA HIS 144 30.271 12.638 -10.109 1014 HB2 HIS 144 HB2 HIS 144 31.352 10.622 -11.248 1015 HB3 HIS 144 HB3 HIS 144 29.612 10.541 -11.037 1016 HD1 HIS 144 HD1 HIS 144 28.283 9.970 -13.057 1017 HD2 HIS 144 HD2 HIS 144 32.116 11.258 -14.033 1018 HE1 HIS 144 HE1 HIS 144 28.497 9.637 -15.541 1019 HE2 HIS 144 HE2 HIS 144 30.872 10.283 -16.084 1020 H HIS 145 H HIS 145 32.564 12.686 -9.867 1021 HA HIS 145 HA HIS 145 34.233 13.706 -11.978 1022 HB2 HIS 145 HB2 HIS 145 32.953 15.750 -11.133 1023 HB3 HIS 145 HB3 HIS 145 33.780 15.536 -9.593 1024 HD1 HIS 145 HD1 HIS 145 35.334 17.455 -9.497 1025 HD2 HIS 145 HD2 HIS 145 35.420 15.569 -13.204 1026 HE1 HIS 145 HE1 HIS 145 37.169 18.595 -10.793 1027 HE2 HIS 145 HE2 HIS 145 37.308 17.329 -12.970 Start of MODEL 20 1 H1 MET 1 H1 MET 1 -32.167 53.224 103.151 2 H2 MET 1 H2 MET 1 -30.908 53.193 102.021 3 H3 MET 1 H3 MET 1 -32.137 52.029 101.953 4 HA MET 1 HA MET 1 -32.477 54.931 101.521 5 HB2 MET 1 HB2 MET 1 -32.124 52.613 99.660 6 HB3 MET 1 HB3 MET 1 -33.155 53.952 99.171 7 HG2 MET 1 HG2 MET 1 -30.962 54.285 98.286 8 HG3 MET 1 HG3 MET 1 -31.265 55.495 99.528 9 HE1 MET 1 HE1 MET 1 -27.451 55.007 99.935 10 HE2 MET 1 HE2 MET 1 -28.771 56.177 99.888 11 HE3 MET 1 HE3 MET 1 -28.434 55.169 98.480 12 H ASN 2 H ASN 2 -34.504 55.669 101.406 13 HA ASN 2 HA ASN 2 -36.739 53.762 101.502 14 HB2 ASN 2 HB2 ASN 2 -36.207 56.013 103.434 15 HB3 ASN 2 HB3 ASN 2 -37.832 55.400 103.161 16 HD21 ASN 2 HD21 ASN 2 -38.358 53.336 103.837 17 HD22 ASN 2 HD22 ASN 2 -37.401 52.487 105.002 18 H ALA 3 H ALA 3 -38.740 54.599 100.783 19 HA ALA 3 HA ALA 3 -38.461 56.904 98.987 20 HB1 ALA 3 HB1 ALA 3 -40.460 56.039 97.878 21 HB2 ALA 3 HB2 ALA 3 -40.582 54.759 99.084 22 HB3 ALA 3 HB3 ALA 3 -39.207 54.801 97.979 23 H ARG 4 H ARG 4 -39.228 58.797 99.674 24 HA ARG 4 HA ARG 4 -41.023 58.892 101.960 25 HB2 ARG 4 HB2 ARG 4 -39.583 61.058 100.428 26 HB3 ARG 4 HB3 ARG 4 -40.693 61.380 101.749 27 HG2 ARG 4 HG2 ARG 4 -39.237 60.062 103.247 28 HG3 ARG 4 HG3 ARG 4 -38.110 59.855 101.903 29 HD2 ARG 4 HD2 ARG 4 -37.859 62.290 101.746 30 HD3 ARG 4 HD3 ARG 4 -38.971 62.483 103.098 31 HE ARG 4 HE ARG 4 -36.802 60.812 103.823 32 HH11 ARG 4 HH11 ARG 4 -37.637 64.188 103.299 33 HH12 ARG 4 HH12 ARG 4 -36.364 64.781 104.318 34 HH21 ARG 4 HH21 ARG 4 -35.126 61.602 105.144 35 HH22 ARG 4 HH22 ARG 4 -34.947 63.318 105.357 36 H ASP 5 H ASP 5 -43.099 58.681 101.587 37 HA ASP 5 HA ASP 5 -44.375 59.655 99.182 38 HB2 ASP 5 HB2 ASP 5 -45.566 58.516 101.724 39 HB3 ASP 5 HB3 ASP 5 -46.475 58.902 100.266 40 H ASN 6 H ASN 6 -45.900 61.352 99.101 41 HA ASN 6 HA ASN 6 -45.200 63.511 100.918 42 HB2 ASN 6 HB2 ASN 6 -46.954 63.573 98.448 43 HB3 ASN 6 HB3 ASN 6 -46.421 64.975 99.364 44 HD21 ASN 6 HD21 ASN 6 -44.262 65.604 99.250 45 HD22 ASN 6 HD22 ASN 6 -43.223 65.067 97.977 46 H LYS 7 H LYS 7 -48.350 62.611 99.526 47 HA LYS 7 HA LYS 7 -49.479 62.432 102.202 48 HB2 LYS 7 HB2 LYS 7 -51.442 63.834 101.600 49 HB3 LYS 7 HB3 LYS 7 -49.948 64.745 101.680 50 HG2 LYS 7 HG2 LYS 7 -50.886 63.752 99.032 51 HG3 LYS 7 HG3 LYS 7 -51.695 65.137 99.764 52 HD2 LYS 7 HD2 LYS 7 -49.520 66.280 99.945 53 HD3 LYS 7 HD3 LYS 7 -48.744 64.905 99.160 54 HE2 LYS 7 HE2 LYS 7 -49.096 66.634 97.528 55 HE3 LYS 7 HE3 LYS 7 -50.184 65.292 97.177 56 HZ1 LYS 7 HZ1 LYS 7 -51.996 66.497 98.148 57 HZ2 LYS 7 HZ2 LYS 7 -51.248 67.499 97.006 58 HZ3 LYS 7 HZ3 LYS 7 -50.971 67.744 98.658 59 H PHE 8 H PHE 8 -51.241 61.057 102.350 60 HA PHE 8 HA PHE 8 -51.449 59.198 100.130 61 HB2 PHE 8 HB2 PHE 8 -51.175 58.332 102.429 62 HB3 PHE 8 HB3 PHE 8 -52.700 59.083 102.892 63 HD1 PHE 8 HD1 PHE 8 -51.315 56.685 100.399 64 HD2 PHE 8 HD2 PHE 8 -54.627 57.802 102.824 65 HE1 PHE 8 HE1 PHE 8 -52.509 54.657 99.694 66 HE2 PHE 8 HE2 PHE 8 -55.827 55.772 102.126 67 HZ PHE 8 HZ PHE 8 -54.767 54.200 100.560 68 H ASN 9 H ASN 9 -52.744 59.823 98.554 69 HA ASN 9 HA ASN 9 -55.569 60.005 99.113 70 HB2 ASN 9 HB2 ASN 9 -54.720 62.395 99.223 71 HB3 ASN 9 HB3 ASN 9 -54.288 62.244 97.526 72 HD21 ASN 9 HD21 ASN 9 -56.903 62.372 99.808 73 HD22 ASN 9 HD22 ASN 9 -58.153 62.706 98.656 74 H THR 10 H THR 10 -56.326 58.512 97.828 75 HA THR 10 HA THR 10 -55.626 58.625 95.003 76 HB THR 10 HB THR 10 -54.298 56.797 95.670 77 HG1 THR 10 HG1 THR 10 -55.312 56.135 93.855 78 HG21 THR 10 HG21 THR 10 -55.096 54.866 96.965 79 HG22 THR 10 HG22 THR 10 -56.641 55.682 97.212 80 HG23 THR 10 HG23 THR 10 -55.164 56.366 97.896 81 H TRP 11 H TRP 11 -57.420 59.573 94.368 82 HA TRP 11 HA TRP 11 -59.940 58.102 94.746 83 HB2 TRP 11 HB2 TRP 11 -60.028 60.043 96.202 84 HB3 TRP 11 HB3 TRP 11 -59.526 61.100 94.892 85 HD1 TRP 11 HD1 TRP 11 -61.444 62.426 93.875 86 HE1 TRP 11 HE1 TRP 11 -63.982 62.121 93.608 87 HE3 TRP 11 HE3 TRP 11 -61.937 57.803 95.997 88 HZ2 TRP 11 HZ2 TRP 11 -65.940 60.180 94.211 89 HZ3 TRP 11 HZ3 TRP 11 -64.168 56.796 96.110 90 HH2 TRP 11 HH2 TRP 11 -66.129 57.957 95.240 91 H ASN 12 H ASN 12 -60.671 57.437 92.889 92 HA ASN 12 HA ASN 12 -60.449 59.143 90.513 93 HB2 ASN 12 HB2 ASN 12 -58.701 57.386 90.356 94 HB3 ASN 12 HB3 ASN 12 -59.933 56.147 90.555 95 HD21 ASN 12 HD21 ASN 12 -58.580 58.528 88.415 96 HD22 ASN 12 HD22 ASN 12 -59.341 57.955 86.968 97 H ASP 13 H ASP 13 -62.437 59.546 89.803 98 HA ASP 13 HA ASP 13 -64.389 57.375 89.725 99 HB2 ASP 13 HB2 ASP 13 -64.846 58.656 91.806 100 HB3 ASP 13 HB3 ASP 13 -65.066 60.114 90.841 101 H SER 14 H SER 14 -65.136 57.218 87.763 102 HA SER 14 HA SER 14 -64.786 59.458 85.906 103 HB2 SER 14 HB2 SER 14 -63.742 57.164 85.470 104 HB3 SER 14 HB3 SER 14 -65.386 56.589 85.202 105 HG SER 14 HG SER 14 -64.049 58.645 83.769 106 H ARG 15 H ARG 15 -66.480 60.335 84.833 107 HA ARG 15 HA ARG 15 -69.151 59.339 85.534 108 HB2 ARG 15 HB2 ARG 15 -68.471 61.965 84.181 109 HB3 ARG 15 HB3 ARG 15 -69.994 61.517 84.935 110 HG2 ARG 15 HG2 ARG 15 -68.912 61.512 87.125 111 HG3 ARG 15 HG3 ARG 15 -67.383 61.961 86.366 112 HD2 ARG 15 HD2 ARG 15 -69.924 63.585 86.415 113 HD3 ARG 15 HD3 ARG 15 -68.440 63.921 87.303 114 HE ARG 15 HE ARG 15 -68.452 63.896 84.356 115 HH11 ARG 15 HH11 ARG 15 -67.874 65.601 87.372 116 HH12 ARG 15 HH12 ARG 15 -67.158 66.975 86.594 117 HH21 ARG 15 HH21 ARG 15 -67.523 65.713 83.348 118 HH22 ARG 15 HH22 ARG 15 -66.948 67.035 84.319 119 H GLY 16 H GLY 16 -70.824 59.749 83.702 120 HA2 GLY 16 HA2 GLY 16 -71.010 59.994 81.236 121 HA3 GLY 16 HA3 GLY 16 -69.643 58.895 81.128 122 H ASN 17 H ASN 17 -72.924 59.147 80.925 123 HA ASN 17 HA ASN 17 -73.221 56.243 81.235 124 HB2 ASN 17 HB2 ASN 17 -75.574 56.590 81.923 125 HB3 ASN 17 HB3 ASN 17 -74.436 57.276 83.066 126 HD21 ASN 17 HD21 ASN 17 -75.762 58.720 83.982 127 HD22 ASN 17 HD22 ASN 17 -76.460 60.072 83.155 128 H TYR 18 H TYR 18 -75.352 55.529 80.004 129 HA TYR 18 HA TYR 18 -75.821 57.089 77.614 130 HB2 TYR 18 HB2 TYR 18 -75.441 55.136 76.084 131 HB3 TYR 18 HB3 TYR 18 -73.980 55.788 76.797 132 HD1 TYR 18 HD1 TYR 18 -76.241 52.903 76.678 133 HD2 TYR 18 HD2 TYR 18 -72.665 54.468 78.372 134 HE1 TYR 18 HE1 TYR 18 -75.601 50.645 77.399 135 HE2 TYR 18 HE2 TYR 18 -72.023 52.215 79.106 136 HH TYR 18 HH TYR 18 -73.062 50.077 79.611 137 H TRP 19 H TRP 19 -77.901 57.058 77.103 138 HA TRP 19 HA TRP 19 -79.561 54.873 78.200 139 HB2 TRP 19 HB2 TRP 19 -80.378 57.741 77.659 140 HB3 TRP 19 HB3 TRP 19 -81.432 56.473 78.276 141 HD1 TRP 19 HD1 TRP 19 -79.389 55.295 80.475 142 HE1 TRP 19 HE1 TRP 19 -78.931 56.662 82.609 143 HE3 TRP 19 HE3 TRP 19 -80.832 59.902 78.803 144 HZ2 TRP 19 HZ2 TRP 19 -79.177 59.334 83.469 145 HZ3 TRP 19 HZ3 TRP 19 -80.698 61.810 80.349 146 HH2 TRP 19 HH2 TRP 19 -79.889 61.530 82.630 147 H SER 20 H SER 20 -81.015 53.882 76.867 148 HA SER 20 HA SER 20 -81.006 54.621 74.032 149 HB2 SER 20 HB2 SER 20 -79.126 53.039 74.422 150 HB3 SER 20 HB3 SER 20 -80.266 51.876 75.096 151 HG SER 20 HG SER 20 -80.488 52.920 72.466 152 H ASP 21 H ASP 21 -82.806 53.880 72.874 153 HA ASP 21 HA ASP 21 -84.860 52.409 74.386 154 HB2 ASP 21 HB2 ASP 21 -85.146 55.050 74.034 155 HB3 ASP 21 HB3 ASP 21 -85.713 54.541 72.445 156 H TYR 22 H TYR 22 -86.699 51.861 72.582 157 HA TYR 22 HA TYR 22 -85.348 50.914 70.177 158 HB2 TYR 22 HB2 TYR 22 -86.491 48.692 70.429 159 HB3 TYR 22 HB3 TYR 22 -85.227 49.001 71.598 160 HD1 TYR 22 HD1 TYR 22 -85.873 49.560 73.973 161 HD2 TYR 22 HD2 TYR 22 -88.708 48.198 71.112 162 HE1 TYR 22 HE1 TYR 22 -87.409 48.961 75.790 163 HE2 TYR 22 HE2 TYR 22 -90.255 47.606 72.922 164 HH TYR 22 HH TYR 22 -90.185 47.057 75.298 165 H GLU 23 H GLU 23 -86.413 51.493 68.425 166 HA GLU 23 HA GLU 23 -89.336 51.554 68.523 167 HB2 GLU 23 HB2 GLU 23 -89.423 53.691 67.275 168 HB3 GLU 23 HB3 GLU 23 -88.711 53.861 68.862 169 HG2 GLU 23 HG2 GLU 23 -87.046 53.657 66.371 170 HG3 GLU 23 HG3 GLU 23 -87.687 55.186 66.960 171 H GLY 24 H GLY 24 -88.198 49.428 67.559 172 HA2 GLY 24 HA2 GLY 24 -87.901 49.730 64.652 173 HA3 GLY 24 HA3 GLY 24 -87.358 48.349 65.595 174 H SER 25 H SER 25 -89.501 49.193 63.347 175 HA SER 25 HA SER 25 -91.296 47.016 64.036 176 HB2 SER 25 HB2 SER 25 -92.315 49.045 65.091 177 HB3 SER 25 HB3 SER 25 -92.416 49.789 63.495 178 HG SER 25 HG SER 25 -94.305 48.857 63.500 179 H ASP 26 H ASP 26 -90.236 46.090 62.206 180 HA ASP 26 HA ASP 26 -91.763 46.611 59.810 181 HB2 ASP 26 HB2 ASP 26 -89.913 46.732 58.283 182 HB3 ASP 26 HB3 ASP 26 -89.679 47.974 59.502 183 H GLU 27 H GLU 27 -91.833 44.828 58.401 184 HA GLU 27 HA GLU 27 -91.355 42.304 59.836 185 HB2 GLU 27 HB2 GLU 27 -93.307 42.947 57.606 186 HB3 GLU 27 HB3 GLU 27 -93.164 41.393 58.419 187 HG2 GLU 27 HG2 GLU 27 -93.888 42.364 60.512 188 HG3 GLU 27 HG3 GLU 27 -93.892 43.973 59.799 189 H ASN 28 H ASN 28 -90.287 40.599 58.882 190 HA ASN 28 HA ASN 28 -88.902 41.239 56.352 191 HB2 ASN 28 HB2 ASN 28 -87.886 39.963 58.860 192 HB3 ASN 28 HB3 ASN 28 -87.177 39.503 57.321 193 HD21 ASN 28 HD21 ASN 28 -88.354 42.739 58.090 194 HD22 ASN 28 HD22 ASN 28 -86.798 43.486 58.090 195 H GLY 29 H GLY 29 -88.852 39.804 54.758 196 HA2 GLY 29 HA2 GLY 29 -90.349 37.302 55.113 197 HA3 GLY 29 HA3 GLY 29 -89.950 38.057 53.573 198 H ASP 30 H ASP 30 -89.204 35.919 52.925 199 HA ASP 30 HA ASP 30 -86.430 35.446 53.787 200 HB2 ASP 30 HB2 ASP 30 -87.971 33.846 54.954 201 HB3 ASP 30 HB3 ASP 30 -88.481 33.250 53.379 202 H GLY 31 H GLY 31 -85.070 35.200 52.130 203 HA2 GLY 31 HA2 GLY 31 -86.042 35.524 49.448 204 HA3 GLY 31 HA3 GLY 31 -84.362 35.399 49.945 205 H ILE 32 H ILE 32 -86.624 33.994 48.099 206 HA ILE 32 HA ILE 32 -85.908 31.222 48.678 207 HB ILE 32 HB ILE 32 -87.613 30.745 46.783 208 HG12 ILE 32 HG12 ILE 32 -89.452 32.610 46.859 209 HG13 ILE 32 HG13 ILE 32 -88.116 33.670 47.286 210 HG21 ILE 32 HG21 ILE 32 -89.479 30.891 48.363 211 HG22 ILE 32 HG22 ILE 32 -88.499 31.915 49.412 212 HG23 ILE 32 HG23 ILE 32 -88.017 30.245 49.110 213 HD11 ILE 32 HD11 ILE 32 -88.353 32.052 44.758 214 HD12 ILE 32 HD12 ILE 32 -86.999 33.096 45.191 215 HD13 ILE 32 HD13 ILE 32 -88.598 33.792 44.922 216 H GLY 33 H GLY 33 -85.674 29.792 46.630 217 HA2 GLY 33 HA2 GLY 33 -84.872 30.368 44.170 218 HA3 GLY 33 HA3 GLY 33 -83.460 30.887 45.077 219 H ASP 34 H ASP 34 -83.616 28.806 43.083 220 HA ASP 34 HA ASP 34 -82.490 26.640 44.694 221 HB2 ASP 34 HB2 ASP 34 -84.830 25.986 44.224 222 HB3 ASP 34 HB3 ASP 34 -84.521 26.163 42.501 223 H SER 35 H SER 35 -80.467 26.599 44.032 224 HA SER 35 HA SER 35 -79.953 26.416 41.139 225 HB2 SER 35 HB2 SER 35 -78.115 27.645 43.214 226 HB3 SER 35 HB3 SER 35 -77.792 27.511 41.481 227 HG SER 35 HG SER 35 -79.812 28.801 41.252 228 H ALA 36 H ALA 36 -79.719 24.275 40.875 229 HA ALA 36 HA ALA 36 -77.915 22.835 42.709 230 HB1 ALA 36 HB1 ALA 36 -79.133 20.796 42.160 231 HB2 ALA 36 HB2 ALA 36 -80.196 21.705 41.085 232 HB3 ALA 36 HB3 ALA 36 -80.217 22.019 42.821 233 H TYR 37 H TYR 37 -76.263 21.675 41.887 234 HA TYR 37 HA TYR 37 -76.015 21.241 39.045 235 HB2 TYR 37 HB2 TYR 37 -73.823 22.372 38.846 236 HB3 TYR 37 HB3 TYR 37 -75.123 23.499 39.189 237 HD1 TYR 37 HD2 TYR 37 -75.343 24.362 41.601 238 HD2 TYR 37 HD1 TYR 37 -71.898 22.299 40.186 239 HE1 TYR 37 HE2 TYR 37 -74.038 25.278 43.465 240 HE2 TYR 37 HE1 TYR 37 -70.585 23.215 42.050 241 HH TYR 37 HH TYR 37 -72.005 24.709 44.735 242 H ALA 38 H ALA 38 -74.930 19.457 38.588 243 HA ALA 38 HA ALA 38 -73.452 18.148 40.784 244 HB1 ALA 38 HB1 ALA 38 -74.936 16.843 38.496 245 HB2 ALA 38 HB2 ALA 38 -75.491 16.935 40.170 246 HB3 ALA 38 HB3 ALA 38 -74.047 16.005 39.769 247 H VAL 39 H VAL 39 -71.337 17.974 40.472 248 HA VAL 39 HA VAL 39 -70.281 18.307 37.779 249 HB VAL 39 HB VAL 39 -68.008 18.338 38.902 250 HG11 VAL 39 HG11 VAL 39 -70.041 20.411 39.727 251 HG12 VAL 39 HG12 VAL 39 -69.161 20.358 38.197 252 HG13 VAL 39 HG13 VAL 39 -68.291 20.634 39.706 253 HG21 VAL 39 HG21 VAL 39 -69.669 18.530 41.418 254 HG22 VAL 39 HG22 VAL 39 -67.934 18.828 41.304 255 HG23 VAL 39 HG23 VAL 39 -68.576 17.212 40.997 256 H ASN 40 H ASN 40 -70.091 16.669 36.569 257 HA ASN 40 HA ASN 40 -69.760 13.986 37.722 258 HB2 ASN 40 HB2 ASN 40 -70.666 14.807 34.944 259 HB3 ASN 40 HB3 ASN 40 -70.634 13.166 35.577 260 HD21 ASN 40 HD21 ASN 40 -72.821 14.830 34.518 261 HD22 ASN 40 HD22 ASN 40 -74.025 14.858 35.763 262 HA PRO 41 HA PRO 41 -65.724 13.823 35.723 263 HB2 PRO 41 HB2 PRO 41 -65.858 10.906 35.925 264 HB3 PRO 41 HB3 PRO 41 -64.766 12.022 36.742 265 HG2 PRO 41 HG2 PRO 41 -66.718 10.637 38.032 266 HG3 PRO 41 HG3 PRO 41 -66.126 12.218 38.573 267 HD2 PRO 41 HD2 PRO 41 -68.610 11.537 37.055 268 HD3 PRO 41 HD3 PRO 41 -68.380 12.725 38.358 269 H GLU 42 H GLU 42 -66.542 14.478 33.758 270 HA GLU 42 HA GLU 42 -68.266 13.057 32.078 271 HB2 GLU 42 HB2 GLU 42 -67.831 15.526 32.073 272 HB3 GLU 42 HB3 GLU 42 -66.290 15.204 31.283 273 HG2 GLU 42 HG2 GLU 42 -67.889 15.892 29.642 274 HG3 GLU 42 HG3 GLU 42 -67.521 14.186 29.400 275 H ALA 43 H ALA 43 -64.735 13.476 31.833 276 HA ALA 43 HA ALA 43 -64.687 11.270 29.897 277 HB1 ALA 43 HB1 ALA 43 -62.492 12.072 29.235 278 HB2 ALA 43 HB2 ALA 43 -62.563 13.321 30.479 279 HB3 ALA 43 HB3 ALA 43 -63.683 13.367 29.117 280 H GLY 44 H GLY 44 -63.311 12.445 32.912 281 HA2 GLY 44 HA2 GLY 44 -62.354 11.179 34.621 282 HA3 GLY 44 HA3 GLY 44 -62.462 9.759 33.583 283 H SER 45 H SER 45 -60.288 9.174 34.049 284 HA SER 45 HA SER 45 -58.423 10.430 32.241 285 HB2 SER 45 HB2 SER 45 -58.254 11.706 34.446 286 HB3 SER 45 HB3 SER 45 -57.617 10.218 35.140 287 HG SER 45 HG SER 45 -55.829 11.210 34.503 288 H MET 46 H MET 46 -56.750 9.086 31.663 289 HA MET 46 HA MET 46 -56.400 6.563 33.091 290 HB2 MET 46 HB2 MET 46 -56.329 5.300 30.965 291 HB3 MET 46 HB3 MET 46 -57.915 5.992 31.267 292 HG2 MET 46 HG2 MET 46 -57.525 7.735 29.670 293 HG3 MET 46 HG3 MET 46 -55.855 7.211 29.444 294 HE1 MET 46 HE1 MET 46 -57.549 7.655 26.910 295 HE2 MET 46 HE2 MET 46 -57.282 6.166 26.000 296 HE3 MET 46 HE3 MET 46 -55.943 6.926 26.860 297 H ASP 47 H ASP 47 -54.279 5.774 32.993 298 HA ASP 47 HA ASP 47 -52.389 7.255 31.369 299 HB2 ASP 47 HB2 ASP 47 -50.881 7.735 33.255 300 HB3 ASP 47 HB3 ASP 47 -52.405 8.597 33.371 301 H TYR 48 H TYR 48 -51.650 5.674 30.214 302 HA TYR 48 HA TYR 48 -50.138 3.567 31.612 303 HB2 TYR 48 HB2 TYR 48 -51.794 3.165 29.099 304 HB3 TYR 48 HB3 TYR 48 -50.692 1.977 29.777 305 HD1 TYR 48 HD1 TYR 48 -51.211 1.101 32.135 306 HD2 TYR 48 HD2 TYR 48 -54.027 3.236 29.764 307 HE1 TYR 48 HE1 TYR 48 -53.040 0.179 33.488 308 HE2 TYR 48 HE2 TYR 48 -55.866 2.319 31.115 309 HH TYR 48 HH TYR 48 -55.349 0.737 34.084 310 H MET 49 H MET 49 -48.084 4.107 31.237 311 HA MET 49 HA MET 49 -47.356 5.071 28.547 312 HB2 MET 49 HB2 MET 49 -47.414 6.881 30.259 313 HB3 MET 49 HB3 MET 49 -46.200 6.011 31.178 314 HG2 MET 49 HG2 MET 49 -44.640 6.252 29.283 315 HG3 MET 49 HG3 MET 49 -45.859 7.206 28.437 316 HE1 MET 49 HE1 MET 49 -44.146 9.216 28.144 317 HE2 MET 49 HE2 MET 49 -42.904 8.269 28.966 318 HE3 MET 49 HE3 MET 49 -43.234 9.924 29.477 319 HA PRO 50 HA PRO 50 -44.338 1.707 29.208 320 HB2 PRO 50 HB2 PRO 50 -44.637 1.048 26.428 321 HB3 PRO 50 HB3 PRO 50 -45.146 0.106 27.831 322 HG2 PRO 50 HG2 PRO 50 -46.873 1.265 26.031 323 HG3 PRO 50 HG3 PRO 50 -47.297 0.846 27.700 324 HD2 PRO 50 HD2 PRO 50 -46.522 3.502 26.545 325 HD3 PRO 50 HD3 PRO 50 -47.778 3.115 27.744 326 H LEU 51 H LEU 51 -42.268 2.322 29.114 327 HA LEU 51 HA LEU 51 -41.428 4.196 27.040 328 HB2 LEU 51 HB2 LEU 51 -40.191 3.320 29.634 329 HB3 LEU 51 HB3 LEU 51 -39.201 4.067 28.402 330 HG LEU 51 HG LEU 51 -39.757 5.780 29.908 331 HD11 LEU 51 HD11 LEU 51 -41.126 7.338 28.606 332 HD12 LEU 51 HD12 LEU 51 -41.623 6.004 27.565 333 HD13 LEU 51 HD13 LEU 51 -39.931 6.494 27.619 334 HD21 LEU 51 HD21 LEU 51 -42.638 4.923 29.733 335 HD22 LEU 51 HD22 LEU 51 -42.030 6.325 30.614 336 HD23 LEU 51 HD23 LEU 51 -41.560 4.698 31.111 337 H MET 52 H MET 52 -41.086 3.161 25.197 338 HA MET 52 HA MET 52 -39.395 0.756 25.250 339 HB2 MET 52 HB2 MET 52 -41.324 1.680 23.101 340 HB3 MET 52 HB3 MET 52 -40.367 0.204 23.056 341 HG2 MET 52 HG2 MET 52 -41.551 -0.627 25.021 342 HG3 MET 52 HG3 MET 52 -42.494 0.858 25.079 343 HE1 MET 52 HE1 MET 52 -44.400 1.477 23.381 344 HE2 MET 52 HE2 MET 52 -44.738 0.570 21.906 345 HE3 MET 52 HE3 MET 52 -43.214 1.446 22.075 346 H GLU 53 H GLU 53 -37.420 1.697 25.227 347 HA GLU 53 HA GLU 53 -36.851 3.708 23.168 348 HB2 GLU 53 HB2 GLU 53 -35.373 3.072 25.730 349 HB3 GLU 53 HB3 GLU 53 -34.901 4.303 24.565 350 HG2 GLU 53 HG2 GLU 53 -36.964 5.531 24.990 351 HG3 GLU 53 HG3 GLU 53 -37.490 4.268 26.105 352 H TYR 54 H TYR 54 -34.791 3.576 22.066 353 HA TYR 54 HA TYR 54 -34.080 0.786 21.537 354 HB2 TYR 54 HB2 TYR 54 -33.347 3.258 19.938 355 HB3 TYR 54 HB3 TYR 54 -33.086 1.588 19.454 356 HD1 TYR 54 HD1 TYR 54 -35.200 0.138 19.091 357 HD2 TYR 54 HD2 TYR 54 -35.257 4.383 19.312 358 HE1 TYR 54 HE1 TYR 54 -37.349 0.165 17.900 359 HE2 TYR 54 HE2 TYR 54 -37.413 4.427 18.133 360 HH TYR 54 HH TYR 54 -39.334 1.706 17.707 361 H LEU 55 H LEU 55 -31.907 0.155 21.337 362 HA LEU 55 HA LEU 55 -29.978 1.807 22.805 363 HB2 LEU 55 HB2 LEU 55 -29.879 -1.100 21.986 364 HB3 LEU 55 HB3 LEU 55 -28.577 -0.257 22.797 365 HG LEU 55 HG LEU 55 -31.323 -0.739 23.961 366 HD11 LEU 55 HD11 LEU 55 -30.174 -2.320 25.434 367 HD12 LEU 55 HD12 LEU 55 -28.677 -2.064 24.536 368 HD13 LEU 55 HD13 LEU 55 -30.068 -2.804 23.741 369 HD21 LEU 55 HD21 LEU 55 -30.347 0.050 26.047 370 HD22 LEU 55 HD22 LEU 55 -30.276 1.302 24.806 371 HD23 LEU 55 HD23 LEU 55 -28.825 0.388 25.222 372 H HIS 56 H HIS 56 -27.970 2.299 21.887 373 HA HIS 56 HA HIS 56 -27.974 2.329 18.962 374 HB2 HIS 56 HB2 HIS 56 -27.540 4.438 20.300 375 HB3 HIS 56 HB3 HIS 56 -26.031 3.722 20.836 376 HD1 HIS 56 HD1 HIS 56 -27.610 5.480 17.990 377 HD2 HIS 56 HD2 HIS 56 -24.024 3.533 18.795 378 HE1 HIS 56 HE1 HIS 56 -26.031 6.186 16.162 379 HE2 HIS 56 HE2 HIS 56 -23.883 4.966 16.635 380 H SER 57 H SER 57 -27.041 0.711 17.961 381 HA SER 57 HA SER 57 -24.553 -0.389 19.077 382 HB2 SER 57 HB2 SER 57 -26.406 -1.997 19.359 383 HB3 SER 57 HB3 SER 57 -26.719 -1.946 17.624 384 HG SER 57 HG SER 57 -25.194 -3.623 18.762 385 H SER 58 H SER 58 -22.876 -0.383 17.728 386 HA SER 58 HA SER 58 -23.353 0.043 14.865 387 HB2 SER 58 HB2 SER 58 -22.985 2.250 15.981 388 HB3 SER 58 HB3 SER 58 -21.431 1.665 16.566 389 HG SER 58 HG SER 58 -21.606 1.293 13.905 390 HA PRO 59 HA PRO 59 -19.934 -2.895 14.790 391 HB2 PRO 59 HB2 PRO 59 -19.805 -2.713 11.938 392 HB3 PRO 59 HB3 PRO 59 -20.501 -4.010 12.910 393 HG2 PRO 59 HG2 PRO 59 -21.912 -2.267 11.280 394 HG3 PRO 59 HG3 PRO 59 -22.606 -3.264 12.567 395 HD2 PRO 59 HD2 PRO 59 -21.948 -0.366 12.553 396 HD3 PRO 59 HD3 PRO 59 -23.227 -1.233 13.427 397 H VAL 60 H VAL 60 -17.766 -2.952 13.538 398 HA VAL 60 HA VAL 60 -16.712 -0.210 13.530 399 HB VAL 60 HB VAL 60 -15.771 -1.846 15.193 400 HG11 VAL 60 HG11 VAL 60 -14.137 -3.504 14.452 401 HG12 VAL 60 HG12 VAL 60 -14.578 -3.173 12.776 402 HG13 VAL 60 HG13 VAL 60 -15.768 -3.863 13.880 403 HG21 VAL 60 HG21 VAL 60 -13.426 -1.229 14.850 404 HG22 VAL 60 HG22 VAL 60 -14.523 0.132 14.621 405 HG23 VAL 60 HG23 VAL 60 -13.818 -0.680 13.221 406 H LEU 61 H LEU 61 -15.544 0.544 11.801 407 HA LEU 61 HA LEU 61 -15.615 -1.031 9.360 408 HB2 LEU 61 HB2 LEU 61 -14.781 1.121 8.266 409 HB3 LEU 61 HB3 LEU 61 -16.425 1.079 8.824 410 HG LEU 61 HG LEU 61 -15.285 3.273 9.079 411 HD11 LEU 61 HD11 LEU 61 -16.190 2.058 11.666 412 HD12 LEU 61 HD12 LEU 61 -17.208 2.797 10.430 413 HD13 LEU 61 HD13 LEU 61 -16.049 3.783 11.327 414 HD21 LEU 61 HD21 LEU 61 -13.047 2.592 9.659 415 HD22 LEU 61 HD22 LEU 61 -13.619 1.920 11.185 416 HD23 LEU 61 HD23 LEU 61 -13.710 3.659 10.901 417 HA PRO 62 HA PRO 62 -11.252 -1.893 9.621 418 HB2 PRO 62 HB2 PRO 62 -10.232 -1.592 7.151 419 HB3 PRO 62 HB3 PRO 62 -11.266 -2.967 7.604 420 HG2 PRO 62 HG2 PRO 62 -11.950 -0.501 6.066 421 HG3 PRO 62 HG3 PRO 62 -12.526 -2.162 5.841 422 HD2 PRO 62 HD2 PRO 62 -13.971 -0.193 7.091 423 HD3 PRO 62 HD3 PRO 62 -14.181 -1.928 7.399 424 H THR 63 H THR 63 -9.044 -1.192 8.953 425 HA THR 63 HA THR 63 -8.722 1.648 8.454 426 HB THR 63 HB THR 63 -7.490 0.166 10.804 427 HG1 THR 63 HG1 THR 63 -9.099 2.524 10.612 428 HG21 THR 63 HG21 THR 63 -5.794 1.502 9.700 429 HG22 THR 63 HG22 THR 63 -6.249 2.234 11.246 430 HG23 THR 63 HG23 THR 63 -6.859 2.903 9.729 431 H ALA 64 H ALA 64 -7.452 1.786 6.759 432 HA ALA 64 HA ALA 64 -5.851 -0.437 5.868 433 HB1 ALA 64 HB1 ALA 64 -5.379 0.950 3.940 434 HB2 ALA 64 HB2 ALA 64 -6.092 2.349 4.744 435 HB3 ALA 64 HB3 ALA 64 -7.107 0.977 4.298 436 H ARG 65 H ARG 65 -4.046 -0.809 6.947 437 HA ARG 65 HA ARG 65 -2.190 1.428 7.286 438 HB2 ARG 65 HB2 ARG 65 -2.825 -0.739 9.295 439 HB3 ARG 65 HB3 ARG 65 -1.312 0.155 9.339 440 HG2 ARG 65 HG2 ARG 65 -4.077 1.307 9.600 441 HG3 ARG 65 HG3 ARG 65 -2.904 1.091 10.900 442 HD2 ARG 65 HD2 ARG 65 -1.402 2.686 9.831 443 HD3 ARG 65 HD3 ARG 65 -2.517 2.842 8.474 444 HE ARG 65 HE ARG 65 -3.049 3.783 11.221 445 HH11 ARG 65 HH11 ARG 65 -3.742 3.899 7.761 446 HH12 ARG 65 HH12 ARG 65 -4.712 5.332 7.889 447 HH21 ARG 65 HH21 ARG 65 -4.336 5.648 11.364 448 HH22 ARG 65 HH22 ARG 65 -5.051 6.320 9.930 449 H PHE 66 H PHE 66 -0.233 1.065 6.578 450 HA PHE 66 HA PHE 66 0.840 -1.555 6.223 451 HB2 PHE 66 HB2 PHE 66 1.088 -1.530 3.815 452 HB3 PHE 66 HB3 PHE 66 -0.614 -1.355 4.195 453 HD1 PHE 66 HD2 PHE 66 -1.376 1.241 4.347 454 HD2 PHE 66 HD1 PHE 66 1.917 -0.273 2.122 455 HE1 PHE 66 HE2 PHE 66 -1.483 3.194 2.868 456 HE2 PHE 66 HE1 PHE 66 1.812 1.677 0.639 457 HZ PHE 66 HZ PHE 66 0.105 3.410 1.015 458 H THR 67 H THR 67 3.052 -1.485 6.106 459 HA THR 67 HA THR 67 4.197 1.159 5.607 460 HB THR 67 HB THR 67 4.451 0.828 7.963 461 HG1 THR 67 HG1 THR 67 6.702 0.979 8.116 462 HG21 THR 67 HG21 THR 67 5.774 -1.812 7.344 463 HG22 THR 67 HG22 THR 67 4.206 -1.585 8.119 464 HG23 THR 67 HG23 THR 67 5.677 -1.058 8.935 465 H SER 68 H SER 68 5.829 1.297 4.276 466 HA SER 68 HA SER 68 6.653 -1.059 2.769 467 HB2 SER 68 HB2 SER 68 7.415 1.844 2.337 468 HB3 SER 68 HB3 SER 68 7.578 0.520 1.185 469 HG SER 68 HG SER 68 5.057 0.556 1.867 470 H ASP 69 H ASP 69 8.971 -1.422 2.398 471 HA ASP 69 HA ASP 69 10.559 -1.274 4.727 472 HB2 ASP 69 HB2 ASP 69 10.904 -2.976 2.952 473 HB3 ASP 69 HB3 ASP 69 11.474 -1.704 1.870 474 H ILE 70 H ILE 70 11.035 0.405 1.607 475 HA ILE 70 HA ILE 70 11.953 2.715 3.154 476 HB ILE 70 HB ILE 70 13.239 3.446 1.117 477 HG12 ILE 70 HG12 ILE 70 13.921 1.061 -0.116 478 HG13 ILE 70 HG13 ILE 70 12.173 0.938 0.044 479 HG21 ILE 70 HG21 ILE 70 14.366 2.542 3.044 480 HG22 ILE 70 HG22 ILE 70 15.163 2.004 1.565 481 HG23 ILE 70 HG23 ILE 70 14.115 0.898 2.452 482 HD11 ILE 70 HD11 ILE 70 13.661 3.202 -1.277 483 HD12 ILE 70 HD12 ILE 70 11.910 3.057 -1.130 484 HD13 ILE 70 HD13 ILE 70 12.811 1.893 -2.104 485 H THR 71 H THR 71 10.899 4.531 2.939 486 HA THR 71 HA THR 71 8.916 4.794 0.786 487 HB THR 71 HB THR 71 8.098 6.739 2.212 488 HG1 THR 71 HG1 THR 71 8.825 6.840 4.317 489 HG21 THR 71 HG21 THR 71 6.940 4.579 2.158 490 HG22 THR 71 HG22 THR 71 6.878 5.291 3.770 491 HG23 THR 71 HG23 THR 71 8.001 3.973 3.432 492 H GLU 72 H GLU 72 12.003 5.657 1.621 493 HA GLU 72 HA GLU 72 12.171 7.577 -0.535 494 HB2 GLU 72 HB2 GLU 72 11.749 8.926 1.565 495 HB3 GLU 72 HB3 GLU 72 13.245 8.273 2.215 496 HG2 GLU 72 HG2 GLU 72 14.414 9.271 0.218 497 HG3 GLU 72 HG3 GLU 72 12.902 10.103 -0.149 498 H GLY 73 H GLY 73 14.171 7.453 -1.517 499 HA2 GLY 73 HA2 GLY 73 16.651 6.917 -0.833 500 HA3 GLY 73 HA3 GLY 73 15.950 5.321 -0.547 501 H PHE 74 H PHE 74 17.805 5.107 -2.330 502 HA PHE 74 HA PHE 74 17.037 5.909 -4.992 503 HB2 PHE 74 HB2 PHE 74 18.995 4.661 -5.763 504 HB3 PHE 74 HB3 PHE 74 19.413 5.703 -4.418 505 HD1 PHE 74 HD1 PHE 74 19.965 4.718 -2.219 506 HD2 PHE 74 HD2 PHE 74 19.206 2.272 -5.618 507 HE1 PHE 74 HE1 PHE 74 21.035 2.818 -1.090 508 HE2 PHE 74 HE2 PHE 74 20.267 0.365 -4.489 509 HZ PHE 74 HZ PHE 74 21.185 0.638 -2.220 510 H ALA 75 H ALA 75 16.328 4.609 -6.668 511 HA ALA 75 HA ALA 75 14.391 2.748 -6.363 512 HB1 ALA 75 HB1 ALA 75 14.935 3.876 -8.481 513 HB2 ALA 75 HB2 ALA 75 14.667 2.143 -8.680 514 HB3 ALA 75 HB3 ALA 75 16.309 2.787 -8.688 515 HA PRO 76 HA PRO 76 16.798 -0.725 -4.928 516 HB2 PRO 76 HB2 PRO 76 14.822 -1.912 -3.561 517 HB3 PRO 76 HB3 PRO 76 15.583 -0.423 -2.997 518 HG2 PRO 76 HG2 PRO 76 12.915 -0.845 -4.200 519 HG3 PRO 76 HG3 PRO 76 13.454 0.409 -3.074 520 HD2 PRO 76 HD2 PRO 76 13.159 0.616 -5.901 521 HD3 PRO 76 HD3 PRO 76 13.804 1.834 -4.785 522 H LEU 77 H LEU 77 16.547 -3.150 -4.916 523 HA LEU 77 HA LEU 77 15.587 -4.052 -7.471 524 HB2 LEU 77 HB2 LEU 77 16.432 -6.313 -6.588 525 HB3 LEU 77 HB3 LEU 77 17.598 -5.057 -6.938 526 HG LEU 77 HG LEU 77 17.425 -4.570 -4.362 527 HD11 LEU 77 HD11 LEU 77 17.053 -6.567 -3.021 528 HD12 LEU 77 HD12 LEU 77 16.560 -7.453 -4.465 529 HD13 LEU 77 HD13 LEU 77 15.589 -6.099 -3.885 530 HD21 LEU 77 HD21 LEU 77 19.259 -6.133 -3.980 531 HD22 LEU 77 HD22 LEU 77 19.424 -5.304 -5.527 532 HD23 LEU 77 HD23 LEU 77 18.856 -6.972 -5.479 533 H SER 78 H SER 78 14.400 -4.065 -4.224 534 HA SER 78 HA SER 78 11.761 -4.562 -5.089 535 HB2 SER 78 HB2 SER 78 11.302 -6.627 -3.747 536 HB3 SER 78 HB3 SER 78 12.334 -6.914 -5.145 537 HG SER 78 HG SER 78 13.736 -7.683 -3.824 538 H VAL 79 H VAL 79 10.261 -3.980 -3.533 539 HA VAL 79 HA VAL 79 11.329 -3.154 -0.911 540 HB VAL 79 HB VAL 79 8.771 -2.158 -2.237 541 HG11 VAL 79 HG11 VAL 79 10.199 -1.183 0.241 542 HG12 VAL 79 HG12 VAL 79 8.692 -2.100 0.211 543 HG13 VAL 79 HG13 VAL 79 8.749 -0.474 -0.471 544 HG21 VAL 79 HG21 VAL 79 9.940 -0.032 -2.543 545 HG22 VAL 79 HG22 VAL 79 10.702 -1.334 -3.454 546 HG23 VAL 79 HG23 VAL 79 11.429 -0.767 -1.950 547 H ARG 80 H ARG 80 10.750 -4.449 0.732 548 HA ARG 80 HA ARG 80 8.652 -6.386 0.419 549 HB2 ARG 80 HB2 ARG 80 9.190 -7.039 2.758 550 HB3 ARG 80 HB3 ARG 80 10.597 -7.031 1.706 551 HG2 ARG 80 HG2 ARG 80 11.259 -4.859 2.631 552 HG3 ARG 80 HG3 ARG 80 9.851 -4.894 3.686 553 HD2 ARG 80 HD2 ARG 80 10.734 -6.984 4.696 554 HD3 ARG 80 HD3 ARG 80 12.192 -6.787 3.721 555 HE ARG 80 HE ARG 80 11.982 -4.410 4.992 556 HH11 ARG 80 HH11 ARG 80 12.138 -7.734 6.130 557 HH12 ARG 80 HH12 ARG 80 12.697 -7.285 7.711 558 HH21 ARG 80 HH21 ARG 80 12.705 -3.835 7.037 559 HH22 ARG 80 HH22 ARG 80 13.013 -5.059 8.229 560 H PHE 81 H PHE 81 6.618 -6.273 1.017 561 HA PHE 81 HA PHE 81 5.711 -3.889 2.493 562 HB2 PHE 81 HB2 PHE 81 4.250 -5.494 0.380 563 HB3 PHE 81 HB3 PHE 81 3.524 -4.203 1.325 564 HD1 PHE 81 HD2 PHE 81 4.656 -1.881 1.157 565 HD2 PHE 81 HD1 PHE 81 5.245 -5.025 -1.647 566 HE1 PHE 81 HE2 PHE 81 5.388 -0.243 -0.523 567 HE2 PHE 81 HE1 PHE 81 5.980 -3.390 -3.331 568 HZ PHE 81 HZ PHE 81 6.052 -0.997 -2.770 569 H LYS 82 H LYS 82 3.953 -4.165 3.947 570 HA LYS 82 HA LYS 82 3.115 -6.890 4.520 571 HB2 LYS 82 HB2 LYS 82 3.323 -6.460 6.996 572 HB3 LYS 82 HB3 LYS 82 4.849 -6.679 6.146 573 HG2 LYS 82 HG2 LYS 82 5.296 -4.330 6.226 574 HG3 LYS 82 HG3 LYS 82 3.679 -3.997 6.850 575 HD2 LYS 82 HD2 LYS 82 5.753 -5.658 8.275 576 HD3 LYS 82 HD3 LYS 82 5.454 -3.947 8.593 577 HE2 LYS 82 HE2 LYS 82 3.144 -4.472 9.225 578 HE3 LYS 82 HE3 LYS 82 3.438 -6.179 8.894 579 HZ1 LYS 82 HZ1 LYS 82 5.224 -6.057 10.611 580 HZ2 LYS 82 HZ2 LYS 82 3.650 -5.869 11.202 581 HZ3 LYS 82 HZ3 LYS 82 4.652 -4.514 11.023 582 H ASP 83 H ASP 83 1.042 -7.068 5.189 583 HA ASP 83 HA ASP 83 -0.535 -4.641 5.262 584 HB2 ASP 83 HB2 ASP 83 -2.504 -6.156 5.476 585 HB3 ASP 83 HB3 ASP 83 -1.555 -6.452 4.031 586 H PHE 84 H PHE 84 -0.938 -3.597 6.975 587 HA PHE 84 HA PHE 84 -0.532 -4.861 9.602 588 HB2 PHE 84 HB2 PHE 84 1.267 -3.265 8.874 589 HB3 PHE 84 HB3 PHE 84 0.059 -1.992 8.779 590 HD1 PHE 84 HD1 PHE 84 0.816 -4.610 11.322 591 HD2 PHE 84 HD2 PHE 84 0.404 -0.475 10.427 592 HE1 PHE 84 HE1 PHE 84 1.147 -4.068 13.707 593 HE2 PHE 84 HE2 PHE 84 0.740 0.084 12.807 594 HZ PHE 84 HZ PHE 84 1.108 -1.719 14.450 595 H SER 85 H SER 85 -2.748 -4.048 7.587 596 HA SER 85 HA SER 85 -4.549 -2.237 8.605 597 HB2 SER 85 HB2 SER 85 -5.190 -4.787 7.122 598 HB3 SER 85 HB3 SER 85 -6.156 -3.310 7.165 599 HG SER 85 HG SER 85 -4.829 -3.482 5.283 600 H GLU 86 H GLU 86 -6.252 -2.296 9.989 601 HA GLU 86 HA GLU 86 -6.573 -4.736 11.603 602 HB2 GLU 86 HB2 GLU 86 -6.855 -1.887 12.565 603 HB3 GLU 86 HB3 GLU 86 -7.052 -3.339 13.534 604 HG2 GLU 86 HG2 GLU 86 -4.662 -3.888 13.084 605 HG3 GLU 86 HG3 GLU 86 -4.502 -2.325 12.293 606 H ASN 87 H ASN 87 -8.619 -5.344 12.134 607 HA ASN 87 HA ASN 87 -10.865 -5.586 12.106 608 HB2 ASN 87 HB2 ASN 87 -10.840 -2.579 11.871 609 HB3 ASN 87 HB3 ASN 87 -12.313 -3.529 12.061 610 HD21 ASN 87 HD21 ASN 87 -9.540 -2.231 13.620 611 HD22 ASN 87 HD22 ASN 87 -9.949 -2.734 15.222 612 H ALA 88 H ALA 88 -9.440 -5.913 9.700 613 HA ALA 88 HA ALA 88 -11.454 -5.157 7.689 614 HB1 ALA 88 HB1 ALA 88 -8.557 -5.881 7.287 615 HB2 ALA 88 HB2 ALA 88 -9.250 -4.263 7.155 616 HB3 ALA 88 HB3 ALA 88 -9.710 -5.523 6.005 617 H THR 89 H THR 89 -12.365 -6.745 6.465 618 HA THR 89 HA THR 89 -11.896 -9.483 7.326 619 HB THR 89 HB THR 89 -13.827 -9.930 5.661 620 HG1 THR 89 HG1 THR 89 -15.163 -8.024 5.418 621 HG21 THR 89 HG21 THR 89 -14.060 -10.087 8.085 622 HG22 THR 89 HG22 THR 89 -15.490 -9.329 7.379 623 HG23 THR 89 HG23 THR 89 -14.274 -8.340 8.191 624 H SER 90 H SER 90 -11.476 -7.439 4.486 625 HA SER 90 HA SER 90 -9.724 -9.505 3.375 626 HB2 SER 90 HB2 SER 90 -11.808 -7.967 1.805 627 HB3 SER 90 HB3 SER 90 -10.559 -8.982 1.090 628 HG SER 90 HG SER 90 -12.631 -9.821 2.849 629 H ARG 91 H ARG 91 -7.966 -8.725 2.194 630 HA ARG 91 HA ARG 91 -7.608 -5.806 2.253 631 HB2 ARG 91 HB2 ARG 91 -5.159 -6.228 2.138 632 HB3 ARG 91 HB3 ARG 91 -5.898 -6.856 3.596 633 HG2 ARG 91 HG2 ARG 91 -4.485 -8.560 3.069 634 HG3 ARG 91 HG3 ARG 91 -5.943 -9.094 2.239 635 HD2 ARG 91 HD2 ARG 91 -5.077 -8.182 0.130 636 HD3 ARG 91 HD3 ARG 91 -3.619 -7.640 0.956 637 HE ARG 91 HE ARG 91 -3.754 -10.340 1.454 638 HH11 ARG 91 HH11 ARG 91 -3.701 -8.401 -1.484 639 HH12 ARG 91 HH12 ARG 91 -2.825 -9.589 -2.395 640 HH21 ARG 91 HH21 ARG 91 -2.629 -11.901 0.213 641 HH22 ARG 91 HH22 ARG 91 -2.241 -11.552 -1.440 642 H LEU 92 H LEU 92 -6.299 -4.913 0.461 643 HA LEU 92 HA LEU 92 -6.251 -6.417 -2.020 644 HB2 LEU 92 HB2 LEU 92 -8.533 -5.224 -1.719 645 HB3 LEU 92 HB3 LEU 92 -7.643 -3.738 -1.937 646 HG LEU 92 HG LEU 92 -7.612 -5.899 -4.035 647 HD11 LEU 92 HD11 LEU 92 -9.596 -3.652 -3.738 648 HD12 LEU 92 HD12 LEU 92 -9.939 -5.374 -3.561 649 HD13 LEU 92 HD13 LEU 92 -9.450 -4.727 -5.128 650 HD21 LEU 92 HD21 LEU 92 -5.952 -4.088 -4.261 651 HD22 LEU 92 HD22 LEU 92 -7.261 -2.904 -4.220 652 HD23 LEU 92 HD23 LEU 92 -7.156 -4.057 -5.551 653 H TRP 93 H TRP 93 -4.172 -6.087 -2.653 654 HA TRP 93 HA TRP 93 -2.903 -3.535 -2.004 655 HB2 TRP 93 HB2 TRP 93 -1.810 -6.095 -3.189 656 HB3 TRP 93 HB3 TRP 93 -0.878 -4.611 -3.128 657 HD1 TRP 93 HD1 TRP 93 -1.822 -7.595 -1.087 658 HE1 TRP 93 HE1 TRP 93 -0.708 -7.453 1.226 659 HE3 TRP 93 HE3 TRP 93 -0.214 -2.737 -1.263 660 HZ2 TRP 93 HZ2 TRP 93 0.635 -5.525 2.784 661 HZ3 TRP 93 HZ3 TRP 93 0.979 -1.828 0.687 662 HH2 TRP 93 HH2 TRP 93 1.392 -3.195 2.665 663 H MET 94 H MET 94 -3.349 -1.963 -3.383 664 HA MET 94 HA MET 94 -3.593 -2.641 -6.219 665 HB2 MET 94 HB2 MET 94 -5.478 -1.400 -5.027 666 HB3 MET 94 HB3 MET 94 -4.389 -0.022 -4.940 667 HG2 MET 94 HG2 MET 94 -4.241 0.060 -7.342 668 HG3 MET 94 HG3 MET 94 -5.232 -1.391 -7.480 669 HE1 MET 94 HE1 MET 94 -6.787 2.737 -6.084 670 HE2 MET 94 HE2 MET 94 -5.150 2.444 -6.671 671 HE3 MET 94 HE3 MET 94 -5.660 1.788 -5.115 672 H PHE 95 H PHE 95 -1.524 -2.760 -6.770 673 HA PHE 95 HA PHE 95 0.463 -0.868 -5.963 674 HB2 PHE 95 HB2 PHE 95 0.696 -3.383 -6.590 675 HB3 PHE 95 HB3 PHE 95 0.734 -2.807 -8.252 676 HD1 PHE 95 HD1 PHE 95 2.503 -2.956 -5.070 677 HD2 PHE 95 HD2 PHE 95 2.637 -1.548 -9.084 678 HE1 PHE 95 HE1 PHE 95 4.912 -2.531 -4.838 679 HE2 PHE 95 HE2 PHE 95 5.043 -1.119 -8.854 680 HZ PHE 95 HZ PHE 95 6.182 -1.614 -6.731 681 H GLY 96 H GLY 96 -1.623 -1.325 -8.731 682 HA2 GLY 96 HA2 GLY 96 -2.120 0.449 -10.262 683 HA3 GLY 96 HA3 GLY 96 -0.512 1.099 -9.972 684 H ASP 97 H ASP 97 -0.087 -2.115 -10.197 685 HA ASP 97 HA ASP 97 0.667 -1.932 -13.024 686 HB2 ASP 97 HB2 ASP 97 2.414 -2.523 -11.293 687 HB3 ASP 97 HB3 ASP 97 1.524 -4.011 -10.984 688 H GLY 98 H GLY 98 -1.095 -2.468 -14.164 689 HA2 GLY 98 HA2 GLY 98 -2.683 -3.794 -15.167 690 HA3 GLY 98 HA3 GLY 98 -1.941 -5.167 -14.365 691 H ASN 99 H ASN 99 -4.072 -6.048 -14.061 692 HA ASN 99 HA ASN 99 -5.762 -4.746 -12.096 693 HB2 ASN 99 HB2 ASN 99 -5.971 -7.283 -13.679 694 HB3 ASN 99 HB3 ASN 99 -6.896 -7.133 -12.187 695 HD21 ASN 99 HD21 ASN 99 -6.510 -5.999 -15.438 696 HD22 ASN 99 HD22 ASN 99 -7.988 -5.107 -15.515 697 H THR 100 H THR 100 -5.500 -4.858 -10.058 698 HA THR 100 HA THR 100 -3.499 -6.669 -8.923 699 HB THR 100 HB THR 100 -3.635 -5.172 -6.955 700 HG1 THR 100 HG1 THR 100 -5.389 -3.639 -8.619 701 HG21 THR 100 HG21 THR 100 -1.987 -4.754 -8.709 702 HG22 THR 100 HG22 THR 100 -2.559 -3.242 -8.004 703 HG23 THR 100 HG23 THR 100 -3.158 -3.762 -9.580 704 H SER 101 H SER 101 -4.423 -6.703 -6.244 705 HA SER 101 HA SER 101 -5.482 -8.153 -4.872 706 HB2 SER 101 HB2 SER 101 -7.419 -6.619 -5.518 707 HB3 SER 101 HB3 SER 101 -7.918 -7.875 -6.649 708 HG SER 101 HG SER 101 -8.996 -8.504 -4.930 709 H ASP 102 H ASP 102 -3.915 -9.268 -6.882 710 HA ASP 102 HA ASP 102 -5.338 -11.627 -7.850 711 HB2 ASP 102 HB2 ASP 102 -3.272 -12.086 -9.114 712 HB3 ASP 102 HB3 ASP 102 -3.871 -10.462 -9.425 713 H SER 103 H SER 103 -3.619 -13.650 -7.775 714 HA SER 103 HA SER 103 -3.546 -14.597 -5.137 715 HB2 SER 103 HB2 SER 103 -1.890 -15.510 -7.510 716 HB3 SER 103 HB3 SER 103 -2.211 -16.445 -6.050 717 HG SER 103 HG SER 103 -4.428 -16.407 -6.602 718 HA PRO 104 HA PRO 104 -0.154 -12.405 -3.290 719 HB2 PRO 104 HB2 PRO 104 0.674 -14.434 -1.550 720 HB3 PRO 104 HB3 PRO 104 -0.552 -13.214 -1.221 721 HG2 PRO 104 HG2 PRO 104 -0.879 -16.037 -2.099 722 HG3 PRO 104 HG3 PRO 104 -1.891 -15.075 -1.010 723 HD2 PRO 104 HD2 PRO 104 -2.642 -15.595 -3.528 724 HD3 PRO 104 HD3 PRO 104 -3.012 -14.036 -2.749 725 H SER 105 H SER 105 1.516 -12.041 -4.496 726 HA SER 105 HA SER 105 3.590 -14.054 -4.930 727 HB2 SER 105 HB2 SER 105 2.283 -12.476 -7.180 728 HB3 SER 105 HB3 SER 105 3.667 -13.552 -7.353 729 HG SER 105 HG SER 105 1.077 -14.328 -6.471 730 HA PRO 106 HA PRO 106 6.226 -10.289 -4.789 731 HB2 PRO 106 HB2 PRO 106 7.782 -11.438 -7.031 732 HB3 PRO 106 HB3 PRO 106 8.329 -10.938 -5.429 733 HG2 PRO 106 HG2 PRO 106 8.166 -13.523 -6.090 734 HG3 PRO 106 HG3 PRO 106 7.759 -12.960 -4.458 735 HD2 PRO 106 HD2 PRO 106 5.941 -13.704 -6.716 736 HD3 PRO 106 HD3 PRO 106 5.789 -14.066 -4.983 737 H LEU 107 H LEU 107 5.306 -8.527 -5.623 738 HA LEU 107 HA LEU 107 4.149 -8.480 -8.251 739 HB2 LEU 107 HB2 LEU 107 4.424 -6.302 -6.168 740 HB3 LEU 107 HB3 LEU 107 3.594 -6.094 -7.695 741 HG LEU 107 HG LEU 107 2.245 -8.230 -6.755 742 HD11 LEU 107 HD11 LEU 107 1.785 -7.909 -4.373 743 HD12 LEU 107 HD12 LEU 107 3.045 -6.677 -4.299 744 HD13 LEU 107 HD13 LEU 107 3.469 -8.350 -4.663 745 HD21 LEU 107 HD21 LEU 107 1.265 -6.158 -7.563 746 HD22 LEU 107 HD22 LEU 107 1.697 -5.348 -6.057 747 HD23 LEU 107 HD23 LEU 107 0.514 -6.656 -6.047 748 H HIS 108 H HIS 108 4.539 -6.586 -9.709 749 HA HIS 108 HA HIS 108 7.219 -6.598 -10.606 750 HB2 HIS 108 HB2 HIS 108 5.313 -6.329 -12.122 751 HB3 HIS 108 HB3 HIS 108 4.890 -4.804 -11.362 752 HD1 HIS 108 HD1 HIS 108 5.338 -3.047 -12.999 753 HD2 HIS 108 HD2 HIS 108 8.343 -5.914 -12.995 754 HE1 HIS 108 HE1 HIS 108 7.069 -2.206 -14.613 755 HE2 HIS 108 HE2 HIS 108 8.793 -4.039 -14.723 756 H THR 109 H THR 109 8.892 -5.429 -9.980 757 HA THR 109 HA THR 109 8.435 -3.416 -7.931 758 HB THR 109 HB THR 109 9.888 -5.413 -7.513 759 HG1 THR 109 HG1 THR 109 10.132 -3.462 -6.300 760 HG21 THR 109 HG21 THR 109 12.183 -5.431 -8.402 761 HG22 THR 109 HG22 THR 109 11.779 -4.062 -9.439 762 HG23 THR 109 HG23 THR 109 10.974 -5.613 -9.676 763 H PHE 110 H PHE 110 10.776 -1.961 -8.039 764 HA PHE 110 HA PHE 110 10.009 -0.142 -10.191 765 HB2 PHE 110 HB2 PHE 110 11.732 0.453 -7.783 766 HB3 PHE 110 HB3 PHE 110 10.964 1.611 -8.860 767 HD1 PHE 110 HD1 PHE 110 8.245 0.975 -9.047 768 HD2 PHE 110 HD2 PHE 110 10.818 0.440 -5.701 769 HE1 PHE 110 HE1 PHE 110 6.304 1.085 -7.542 770 HE2 PHE 110 HE2 PHE 110 8.877 0.541 -4.193 771 HZ PHE 110 HZ PHE 110 6.621 0.869 -5.111 772 H PHE 111 H PHE 111 11.139 -0.679 -11.956 773 HA PHE 111 HA PHE 111 14.018 -1.103 -11.807 774 HB2 PHE 111 HB2 PHE 111 12.049 -1.275 -14.097 775 HB3 PHE 111 HB3 PHE 111 13.786 -1.475 -14.308 776 HD1 PHE 111 HD1 PHE 111 14.930 -3.419 -13.429 777 HD2 PHE 111 HD2 PHE 111 10.716 -2.982 -13.039 778 HE1 PHE 111 HE1 PHE 111 14.737 -5.810 -12.889 779 HE2 PHE 111 HE2 PHE 111 10.517 -5.369 -12.491 780 HZ PHE 111 HZ PHE 111 12.526 -6.786 -12.421 781 H ASN 112 H ASN 112 11.789 1.399 -12.522 782 HA ASN 112 HA ASN 112 13.980 3.158 -13.423 783 HB2 ASN 112 HB2 ASN 112 11.080 3.276 -14.333 784 HB3 ASN 112 HB3 ASN 112 12.284 4.509 -14.672 785 HD21 ASN 112 HD21 ASN 112 12.374 4.387 -16.839 786 HD22 ASN 112 HD22 ASN 112 12.815 2.967 -17.728 787 H GLU 113 H GLU 113 13.974 5.202 -12.493 788 HA GLU 113 HA GLU 113 12.795 5.334 -9.898 789 HB2 GLU 113 HB2 GLU 113 14.511 7.280 -11.438 790 HB3 GLU 113 HB3 GLU 113 13.841 7.663 -9.859 791 HG2 GLU 113 HG2 GLU 113 15.710 6.808 -9.058 792 HG3 GLU 113 HG3 GLU 113 14.968 5.248 -9.412 793 H GLY 114 H GLY 114 11.759 7.396 -9.103 794 HA2 GLY 114 HA2 GLY 114 10.416 9.291 -10.360 795 HA3 GLY 114 HA3 GLY 114 9.451 7.891 -10.803 796 H GLU 115 H GLU 115 7.858 9.290 -9.695 797 HA GLU 115 HA GLU 115 7.948 9.044 -6.773 798 HB2 GLU 115 HB2 GLU 115 7.676 11.301 -7.791 799 HB3 GLU 115 HB3 GLU 115 6.181 10.749 -8.530 800 HG2 GLU 115 HG2 GLU 115 5.145 10.492 -6.397 801 HG3 GLU 115 HG3 GLU 115 6.667 10.801 -5.566 802 H TYR 116 H TYR 116 6.891 7.350 -5.994 803 HA TYR 116 HA TYR 116 4.759 6.142 -7.646 804 HB2 TYR 116 HB2 TYR 116 6.076 4.731 -5.345 805 HB3 TYR 116 HB3 TYR 116 5.313 4.051 -6.774 806 HD1 TYR 116 HD1 TYR 116 6.579 4.567 -9.056 807 HD2 TYR 116 HD2 TYR 116 8.334 4.744 -5.188 808 HE1 TYR 116 HE1 TYR 116 8.806 4.245 -10.055 809 HE2 TYR 116 HE2 TYR 116 10.553 4.430 -6.167 810 HH TYR 116 HH TYR 116 11.082 4.478 -9.609 811 H ILE 117 H ILE 117 2.873 5.386 -6.617 812 HA ILE 117 HA ILE 117 2.560 6.142 -3.798 813 HB ILE 117 HB ILE 117 0.315 6.465 -5.843 814 HG12 ILE 117 HG12 ILE 117 0.555 8.940 -4.849 815 HG13 ILE 117 HG13 ILE 117 2.236 8.445 -4.699 816 HG21 ILE 117 HG21 ILE 117 -0.876 7.516 -3.951 817 HG22 ILE 117 HG22 ILE 117 0.462 7.068 -2.889 818 HG23 ILE 117 HG23 ILE 117 -0.505 5.814 -3.670 819 HD11 ILE 117 HD11 ILE 117 1.852 9.647 -6.770 820 HD12 ILE 117 HD12 ILE 117 0.622 8.473 -7.247 821 HD13 ILE 117 HD13 ILE 117 2.309 7.976 -7.091 822 H VAL 118 H VAL 118 2.556 4.227 -2.833 823 HA VAL 118 HA VAL 118 1.282 1.914 -4.036 824 HB VAL 118 HB VAL 118 2.488 2.164 -1.260 825 HG11 VAL 118 HG11 VAL 118 2.643 -0.276 -1.334 826 HG12 VAL 118 HG12 VAL 118 1.858 -0.283 -2.913 827 HG13 VAL 118 HG13 VAL 118 0.969 0.261 -1.489 828 HG21 VAL 118 HG21 VAL 118 4.482 1.091 -2.197 829 HG22 VAL 118 HG22 VAL 118 4.169 2.658 -2.947 830 HG23 VAL 118 HG23 VAL 118 3.763 1.173 -3.808 831 H SER 119 H SER 119 -0.754 1.209 -3.582 832 HA SER 119 HA SER 119 -2.267 2.801 -1.627 833 HB2 SER 119 HB2 SER 119 -3.314 1.581 -4.188 834 HB3 SER 119 HB3 SER 119 -4.202 2.622 -3.075 835 HG SER 119 HG SER 119 -1.822 3.657 -4.030 836 H LEU 120 H LEU 120 -3.014 1.689 -0.007 837 HA LEU 120 HA LEU 120 -3.658 -1.166 -0.369 838 HB2 LEU 120 HB2 LEU 120 -1.836 -0.599 1.287 839 HB3 LEU 120 HB3 LEU 120 -3.012 0.294 2.210 840 HG LEU 120 HG LEU 120 -2.356 -2.008 3.073 841 HD11 LEU 120 HD11 LEU 120 -4.276 -0.835 3.926 842 HD12 LEU 120 HD12 LEU 120 -4.576 -2.570 3.829 843 HD13 LEU 120 HD13 LEU 120 -5.272 -1.484 2.624 844 HD21 LEU 120 HD21 LEU 120 -2.396 -3.239 0.991 845 HD22 LEU 120 HD22 LEU 120 -4.120 -2.911 0.805 846 HD23 LEU 120 HD23 LEU 120 -3.553 -3.924 2.133 847 H ILE 121 H ILE 121 -5.741 -1.617 -0.339 848 HA ILE 121 HA ILE 121 -7.529 0.176 1.113 849 HB ILE 121 HB ILE 121 -7.866 0.841 -1.124 850 HG12 ILE 121 HG12 ILE 121 -9.967 0.193 0.306 851 HG13 ILE 121 HG13 ILE 121 -10.148 0.713 -1.357 852 HG21 ILE 121 HG21 ILE 121 -8.065 -2.032 -1.962 853 HG22 ILE 121 HG22 ILE 121 -6.782 -0.882 -2.340 854 HG23 ILE 121 HG23 ILE 121 -8.399 -0.648 -3.004 855 HD11 ILE 121 HD11 ILE 121 -11.622 -1.133 -0.857 856 HD12 ILE 121 HD12 ILE 121 -10.252 -2.126 -0.357 857 HD13 ILE 121 HD13 ILE 121 -10.410 -1.627 -2.041 858 H VAL 122 H VAL 122 -8.572 -0.855 2.614 859 HA VAL 122 HA VAL 122 -9.027 -3.745 2.273 860 HB VAL 122 HB VAL 122 -9.249 -3.804 4.815 861 HG11 VAL 122 HG11 VAL 122 -7.370 -4.765 3.635 862 HG12 VAL 122 HG12 VAL 122 -6.824 -3.996 5.126 863 HG13 VAL 122 HG13 VAL 122 -6.577 -3.191 3.575 864 HG21 VAL 122 HG21 VAL 122 -7.780 -1.181 4.574 865 HG22 VAL 122 HG22 VAL 122 -8.021 -2.095 6.062 866 HG23 VAL 122 HG23 VAL 122 -9.410 -1.404 5.220 867 H SER 123 H SER 123 -11.012 -4.585 3.260 868 HA SER 123 HA SER 123 -13.162 -2.596 3.204 869 HB2 SER 123 HB2 SER 123 -13.092 -5.145 1.563 870 HB3 SER 123 HB3 SER 123 -14.485 -4.075 1.711 871 HG SER 123 HG SER 123 -12.172 -2.798 0.979 872 H ASN 124 H ASN 124 -15.100 -3.270 4.115 873 HA ASN 124 HA ASN 124 -15.339 -5.860 5.397 874 HB2 ASN 124 HB2 ASN 124 -14.257 -4.271 7.078 875 HB3 ASN 124 HB3 ASN 124 -15.710 -3.294 6.990 876 HD21 ASN 124 HD21 ASN 124 -16.085 -3.584 9.201 877 HD22 ASN 124 HD22 ASN 124 -16.676 -5.082 9.837 878 H GLU 125 H GLU 125 -17.786 -5.691 6.490 879 HA GLU 125 HA GLU 125 -19.481 -5.017 4.271 880 HB2 GLU 125 HB2 GLU 125 -21.294 -5.920 5.738 881 HB3 GLU 125 HB3 GLU 125 -19.974 -7.039 5.445 882 HG2 GLU 125 HG2 GLU 125 -19.063 -6.558 7.658 883 HG3 GLU 125 HG3 GLU 125 -20.362 -5.401 7.945 884 H ASN 126 H ASN 126 -18.337 -3.323 6.938 885 HA ASN 126 HA ASN 126 -20.640 -1.600 7.320 886 HB2 ASN 126 HB2 ASN 126 -18.968 -2.315 9.133 887 HB3 ASN 126 HB3 ASN 126 -17.847 -1.183 8.393 888 HD21 ASN 126 HD21 ASN 126 -18.621 -0.967 11.015 889 HD22 ASN 126 HD22 ASN 126 -19.569 0.463 11.219 890 H ASP 127 H ASP 127 -17.262 -1.240 6.262 891 HA ASP 127 HA ASP 127 -17.905 0.651 4.199 892 HB2 ASP 127 HB2 ASP 127 -17.713 1.819 6.632 893 HB3 ASP 127 HB3 ASP 127 -16.009 1.792 6.206 894 H SER 128 H SER 128 -15.675 1.553 3.327 895 HA SER 128 HA SER 128 -13.551 -0.437 3.747 896 HB2 SER 128 HB2 SER 128 -12.887 -0.084 1.354 897 HB3 SER 128 HB3 SER 128 -14.457 -0.870 1.549 898 HG SER 128 HG SER 128 -15.424 1.208 1.220 899 H ASP 129 H ASP 129 -11.453 0.374 3.769 900 HA ASP 129 HA ASP 129 -11.247 3.298 3.967 901 HB2 ASP 129 HB2 ASP 129 -11.369 2.103 6.209 902 HB3 ASP 129 HB3 ASP 129 -9.836 1.342 5.794 903 H SER 130 H SER 130 -9.499 4.152 2.916 904 HA SER 130 HA SER 130 -7.519 2.240 1.875 905 HB2 SER 130 HB2 SER 130 -8.424 4.655 0.322 906 HB3 SER 130 HB3 SER 130 -7.625 3.198 -0.260 907 HG SER 130 HG SER 130 -10.294 3.384 0.695 908 H ALA 131 H ALA 131 -5.434 2.902 1.897 909 HA ALA 131 HA ALA 131 -4.803 5.709 2.513 910 HB1 ALA 131 HB1 ALA 131 -4.660 4.449 4.627 911 HB2 ALA 131 HB2 ALA 131 -3.087 5.051 4.105 912 HB3 ALA 131 HB3 ALA 131 -3.499 3.348 3.882 913 H SER 132 H SER 132 -2.798 6.405 1.825 914 HA SER 132 HA SER 132 -1.357 4.668 -0.009 915 HB2 SER 132 HB2 SER 132 -2.746 7.252 -0.742 916 HB3 SER 132 HB3 SER 132 -1.519 6.494 -1.740 917 HG SER 132 HG SER 132 -3.244 4.614 -1.147 918 H VAL 133 H VAL 133 0.796 5.228 -0.228 919 HA VAL 133 HA VAL 133 1.669 7.660 1.156 920 HB VAL 133 HB VAL 133 2.019 5.702 2.653 921 HG11 VAL 133 HG11 VAL 133 2.416 3.946 1.056 922 HG12 VAL 133 HG12 VAL 133 3.782 4.066 2.168 923 HG13 VAL 133 HG13 VAL 133 3.910 4.717 0.532 924 HG21 VAL 133 HG21 VAL 133 4.367 6.151 3.218 925 HG22 VAL 133 HG22 VAL 133 3.455 7.629 2.905 926 HG23 VAL 133 HG23 VAL 133 4.561 6.999 1.683 927 H THR 134 H THR 134 3.399 8.732 0.231 928 HA THR 134 HA THR 134 3.938 8.051 -2.529 929 HB THR 134 HB THR 134 4.706 10.487 -0.908 930 HG1 THR 134 HG1 THR 134 2.472 9.810 -2.496 931 HG21 THR 134 HG21 THR 134 5.066 11.563 -3.089 932 HG22 THR 134 HG22 THR 134 4.747 10.024 -3.890 933 HG23 THR 134 HG23 THR 134 6.159 10.199 -2.847 934 H ILE 135 H ILE 135 5.570 6.859 -3.034 935 HA ILE 135 HA ILE 135 7.918 6.627 -1.290 936 HB ILE 135 HB ILE 135 7.427 5.059 -3.831 937 HG12 ILE 135 HG12 ILE 135 5.444 4.698 -2.443 938 HG13 ILE 135 HG13 ILE 135 6.428 3.241 -2.502 939 HG21 ILE 135 HG21 ILE 135 9.674 4.939 -2.950 940 HG22 ILE 135 HG22 ILE 135 8.872 3.379 -2.757 941 HG23 ILE 135 HG23 ILE 135 9.057 4.453 -1.370 942 HD11 ILE 135 HD11 ILE 135 5.532 3.612 -0.282 943 HD12 ILE 135 HD12 ILE 135 6.295 5.200 -0.220 944 HD13 ILE 135 HD13 ILE 135 7.292 3.745 -0.268 945 H ARG 136 H ARG 136 9.765 7.688 -1.818 946 HA ARG 136 HA ARG 136 9.852 8.923 -4.486 947 HB2 ARG 136 HB2 ARG 136 11.373 9.826 -2.037 948 HB3 ARG 136 HB3 ARG 136 11.258 10.657 -3.578 949 HG2 ARG 136 HG2 ARG 136 8.730 10.759 -3.083 950 HG3 ARG 136 HG3 ARG 136 9.201 10.399 -1.423 951 HD2 ARG 136 HD2 ARG 136 10.080 12.745 -3.103 952 HD3 ARG 136 HD3 ARG 136 9.020 12.783 -1.697 953 HE ARG 136 HE ARG 136 11.035 12.055 -0.385 954 HH11 ARG 136 HH11 ARG 136 11.412 13.734 -3.455 955 HH12 ARG 136 HH12 ARG 136 12.966 14.397 -3.044 956 HH21 ARG 136 HH21 ARG 136 13.086 12.953 0.157 957 HH22 ARG 136 HH22 ARG 136 13.903 13.964 -1.000 958 H ALA 137 H ALA 137 11.218 7.988 -5.833 959 HA ALA 137 HA ALA 137 13.506 6.514 -4.744 960 HB1 ALA 137 HB1 ALA 137 12.459 6.572 -7.569 961 HB2 ALA 137 HB2 ALA 137 12.114 5.324 -6.371 962 HB3 ALA 137 HB3 ALA 137 13.763 5.555 -6.957 963 H LEU 138 H LEU 138 15.484 7.278 -4.870 964 HA LEU 138 HA LEU 138 15.854 9.965 -5.820 965 HB2 LEU 138 HB2 LEU 138 17.853 8.046 -4.615 966 HB3 LEU 138 HB3 LEU 138 18.138 9.746 -4.927 967 HG LEU 138 HG LEU 138 16.197 8.586 -2.924 968 HD11 LEU 138 HD11 LEU 138 18.736 10.178 -2.601 969 HD12 LEU 138 HD12 LEU 138 18.509 8.470 -2.219 970 HD13 LEU 138 HD13 LEU 138 17.651 9.704 -1.295 971 HD21 LEU 138 HD21 LEU 138 16.747 11.477 -3.597 972 HD22 LEU 138 HD22 LEU 138 15.731 10.893 -2.277 973 HD23 LEU 138 HD23 LEU 138 15.261 10.593 -3.951 974 H GLU 139 H GLU 139 16.838 10.639 -7.551 975 HA GLU 139 HA GLU 139 16.933 8.854 -9.754 976 HB2 GLU 139 HB2 GLU 139 17.467 10.902 -11.057 977 HB3 GLU 139 HB3 GLU 139 16.044 11.082 -10.041 978 HG2 GLU 139 HG2 GLU 139 17.367 12.324 -8.403 979 HG3 GLU 139 HG3 GLU 139 18.803 12.118 -9.399 980 H HIS 140 H HIS 140 18.628 8.163 -10.984 981 HA HIS 140 HA HIS 140 21.261 8.334 -9.857 982 HB2 HIS 140 HB2 HIS 140 22.006 6.919 -11.721 983 HB3 HIS 140 HB3 HIS 140 20.623 6.224 -10.906 984 HD1 HIS 140 HD1 HIS 140 18.394 6.087 -12.290 985 HD2 HIS 140 HD2 HIS 140 21.693 7.469 -14.430 986 HE1 HIS 140 HE1 HIS 140 17.734 5.944 -14.724 987 HE2 HIS 140 HE2 HIS 140 19.797 6.597 -15.986 988 H HIS 141 H HIS 141 22.532 10.017 -10.098 989 HA HIS 141 HA HIS 141 22.084 11.802 -12.345 990 HB2 HIS 141 HB2 HIS 141 22.444 12.723 -10.035 991 HB3 HIS 141 HB3 HIS 141 24.101 12.122 -10.103 992 HD1 HIS 141 HD1 HIS 141 25.805 13.571 -11.246 993 HD2 HIS 141 HD2 HIS 141 21.903 14.829 -11.960 994 HE1 HIS 141 HE1 HIS 141 26.010 15.761 -12.468 995 HE2 HIS 141 HE2 HIS 141 23.653 16.407 -13.045 996 H HIS 142 H HIS 142 22.863 11.077 -14.136 997 HA HIS 142 HA HIS 142 25.535 9.868 -14.198 998 HB2 HIS 142 HB2 HIS 142 23.418 8.597 -14.979 999 HB3 HIS 142 HB3 HIS 142 23.469 9.660 -16.378 1000 HD1 HIS 142 HD1 HIS 142 23.717 7.149 -17.497 1001 HD2 HIS 142 HD2 HIS 142 27.028 8.689 -15.509 1002 HE1 HIS 142 HE1 HIS 142 25.677 5.789 -18.291 1003 HE2 HIS 142 HE2 HIS 142 27.678 6.880 -17.244 1004 H HIS 143 H HIS 143 27.081 11.050 -15.031 1005 HA HIS 143 HA HIS 143 26.504 13.612 -16.181 1006 HB2 HIS 143 HB2 HIS 143 28.396 13.262 -14.617 1007 HB3 HIS 143 HB3 HIS 143 29.169 12.221 -15.802 1008 HD1 HIS 143 HD1 HIS 143 28.386 15.832 -15.105 1009 HD2 HIS 143 HD2 HIS 143 30.519 13.545 -17.847 1010 HE1 HIS 143 HE1 HIS 143 29.740 17.471 -16.455 1011 HE2 HIS 143 HE2 HIS 143 31.170 16.049 -17.948 1012 H HIS 144 H HIS 144 25.841 13.771 -18.161 1013 HA HIS 144 HA HIS 144 27.567 12.779 -20.288 1014 HB2 HIS 144 HB2 HIS 144 25.642 11.154 -20.073 1015 HB3 HIS 144 HB3 HIS 144 24.547 12.480 -20.445 1016 HD1 HIS 144 HD1 HIS 144 23.961 12.683 -22.855 1017 HD2 HIS 144 HD2 HIS 144 27.609 10.766 -22.310 1018 HE1 HIS 144 HE1 HIS 144 24.730 12.028 -25.158 1019 HE2 HIS 144 HE2 HIS 144 26.927 10.846 -24.808 1020 H HIS 145 H HIS 145 28.128 14.462 -21.418 1021 HA HIS 145 HA HIS 145 26.439 16.843 -21.446 1022 HB2 HIS 145 HB2 HIS 145 28.974 16.901 -21.013 1023 HB3 HIS 145 HB3 HIS 145 29.167 16.563 -22.730 1024 HD1 HIS 145 HD1 HIS 145 28.744 18.503 -24.370 1025 HD2 HIS 145 HD2 HIS 145 28.002 19.481 -20.398 1026 HE1 HIS 145 HE1 HIS 145 28.479 20.998 -24.329 1027 HE2 HIS 145 HE2 HIS 145 27.919 21.563 -21.940
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