NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
617329 | 5mrg | 34081 | 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 H MET 1 -6.579 -37.096 13.194 2 HA MET 1 HA MET 1 -8.859 -36.659 13.426 3 HB2 MET 1 HB2 MET 1 -9.291 -36.042 15.791 4 HB3 MET 1 HB3 MET 1 -8.078 -37.304 15.619 5 HG2 MET 1 HG2 MET 1 -6.360 -35.419 15.774 6 HG3 MET 1 HG3 MET 1 -7.695 -34.428 16.358 7 HE1 MET 1 HE1 MET 1 -9.425 -35.862 18.273 8 HE2 MET 1 HE2 MET 1 -8.536 -35.791 19.794 9 HE3 MET 1 HE3 MET 1 -8.549 -34.396 18.714 10 H ALA 2 H ALA 2 -6.848 -33.844 14.122 11 HA ALA 2 HA ALA 2 -9.035 -32.138 13.132 12 HB1 ALA 2 HB1 ALA 2 -7.759 -30.418 14.748 13 HB2 ALA 2 HB2 ALA 2 -9.125 -31.406 15.268 14 HB3 ALA 2 HB3 ALA 2 -7.477 -31.920 15.630 15 H GLY 3 H GLY 3 -8.465 -30.453 11.787 16 HA2 GLY 3 HA2 GLY 3 -6.859 -28.950 10.824 17 HA3 GLY 3 HA3 GLY 3 -5.603 -30.128 11.179 18 H SER 4 H SER 4 -7.101 -28.735 8.708 19 HA SER 4 HA SER 4 -6.493 -30.932 6.916 20 HB2 SER 4 HB2 SER 4 -8.816 -30.405 5.766 21 HB3 SER 4 HB3 SER 4 -8.705 -31.578 7.077 22 HG SER 4 HG SER 4 -10.190 -30.351 7.935 23 H HIS 5 H HIS 5 -7.884 -27.673 7.184 24 HA HIS 5 HA HIS 5 -7.537 -25.763 5.998 25 HB2 HIS 5 HB2 HIS 5 -4.982 -27.063 5.045 26 HB3 HIS 5 HB3 HIS 5 -5.334 -25.340 5.133 27 HD1 HIS 5 HD1 HIS 5 -5.273 -24.239 7.493 28 HD2 HIS 5 HD2 HIS 5 -4.155 -28.240 7.426 29 HE1 HIS 5 HE1 HIS 5 -4.183 -24.669 9.718 30 H HIS 6 H HIS 6 -6.661 -25.088 3.583 31 HA HIS 6 HA HIS 6 -7.205 -26.910 1.493 32 HB2 HIS 6 HB2 HIS 6 -9.524 -26.415 2.581 33 HB3 HIS 6 HB3 HIS 6 -9.392 -24.870 1.747 34 HD1 HIS 6 HD1 HIS 6 -10.489 -28.280 1.261 35 HD2 HIS 6 HD2 HIS 6 -9.057 -25.228 -1.167 36 HE1 HIS 6 HE1 HIS 6 -11.146 -28.920 -1.081 37 H HIS 7 H HIS 7 -5.103 -25.337 1.737 38 HA HIS 7 HA HIS 7 -5.324 -23.581 -0.540 39 HB2 HIS 7 HB2 HIS 7 -5.950 -22.236 1.574 40 HB3 HIS 7 HB3 HIS 7 -4.241 -22.349 1.983 41 HD1 HIS 7 HD1 HIS 7 -2.582 -20.999 0.528 42 HD2 HIS 7 HD2 HIS 7 -6.569 -20.505 -0.532 43 HE1 HIS 7 HE1 HIS 7 -2.627 -19.014 -1.016 44 H HIS 8 H HIS 8 -3.801 -24.811 -1.573 45 HA HIS 8 HA HIS 8 -1.074 -24.268 -0.996 46 HB2 HIS 8 HB2 HIS 8 -0.424 -26.709 -0.700 47 HB3 HIS 8 HB3 HIS 8 -1.195 -25.938 0.684 48 HD1 HIS 8 HD1 HIS 8 -1.680 -28.620 -1.846 49 HD2 HIS 8 HD2 HIS 8 -3.794 -26.873 1.275 50 HE1 HIS 8 HE1 HIS 8 -3.618 -30.160 -1.402 51 H HIS 9 H HIS 9 -2.019 -23.592 -3.229 52 HA HIS 9 HA HIS 9 -1.619 -25.779 -5.158 53 HB2 HIS 9 HB2 HIS 9 -3.141 -23.183 -5.370 54 HB3 HIS 9 HB3 HIS 9 -2.762 -24.179 -6.772 55 HD1 HIS 9 HD1 HIS 9 -4.641 -24.421 -3.485 56 HD2 HIS 9 HD2 HIS 9 -4.548 -26.177 -7.249 57 HE1 HIS 9 HE1 HIS 9 -6.617 -25.976 -3.551 58 H HIS 10 H HIS 10 -1.198 -22.236 -5.151 59 HA HIS 10 HA HIS 10 0.468 -20.901 -5.939 60 HB2 HIS 10 HB2 HIS 10 1.675 -22.702 -4.288 61 HB3 HIS 10 HB3 HIS 10 2.572 -22.962 -5.781 62 HD1 HIS 10 HD1 HIS 10 4.730 -21.809 -5.297 63 HD2 HIS 10 HD2 HIS 10 1.439 -19.448 -4.371 64 HE1 HIS 10 HE1 HIS 10 5.667 -19.552 -4.703 65 H GLY 11 H GLY 11 2.433 -20.923 -7.586 66 HA2 GLY 11 HA2 GLY 11 1.311 -21.915 -10.055 67 HA3 GLY 11 HA3 GLY 11 2.752 -20.923 -9.885 68 H SER 12 H SER 12 2.620 -23.053 -11.666 69 HA SER 12 HA SER 12 3.755 -24.906 -12.340 70 HB2 SER 12 HB2 SER 12 5.575 -23.907 -10.150 71 HB3 SER 12 HB3 SER 12 5.979 -25.305 -11.146 72 HG SER 12 HG SER 12 6.740 -23.856 -12.464 73 H MET 13 H MET 13 4.981 -26.978 -11.257 74 HA MET 13 HA MET 13 4.046 -27.955 -8.807 75 HB2 MET 13 HB2 MET 13 2.094 -28.034 -10.899 76 HB3 MET 13 HB3 MET 13 2.565 -29.681 -10.502 77 HG2 MET 13 HG2 MET 13 1.705 -29.572 -8.396 78 HG3 MET 13 HG3 MET 13 1.952 -27.832 -8.266 79 HE1 MET 13 HE1 MET 13 -1.709 -30.106 -9.504 80 HE2 MET 13 HE2 MET 13 -0.424 -30.283 -10.698 81 HE3 MET 13 HE3 MET 13 -0.127 -30.711 -9.013 82 H SER 14 H SER 14 5.004 -28.689 -12.108 83 HA SER 14 HA SER 14 6.582 -30.107 -12.940 84 HB2 SER 14 HB2 SER 14 7.401 -29.676 -10.219 85 HB3 SER 14 HB3 SER 14 7.720 -31.351 -10.668 86 HG SER 14 HG SER 14 8.434 -29.265 -12.413 87 H GLU 15 H GLU 15 5.839 -31.845 -9.932 88 HA GLU 15 HA GLU 15 4.287 -33.809 -11.435 89 HB2 GLU 15 HB2 GLU 15 6.984 -34.239 -10.704 90 HB3 GLU 15 HB3 GLU 15 6.006 -35.219 -9.620 91 HG2 GLU 15 HG2 GLU 15 4.807 -35.929 -11.832 92 HG3 GLU 15 HG3 GLU 15 6.311 -35.389 -12.575 93 H TYR 16 H TYR 16 3.881 -35.702 -9.557 94 HA TYR 16 HA TYR 16 2.881 -34.254 -7.198 95 HB2 TYR 16 HB2 TYR 16 0.887 -35.856 -7.314 96 HB3 TYR 16 HB3 TYR 16 0.927 -34.544 -8.486 97 HD1 TYR 16 HD1 TYR 16 0.789 -35.000 -10.776 98 HD2 TYR 16 HD2 TYR 16 1.726 -38.154 -8.077 99 HE1 TYR 16 HE1 TYR 16 0.572 -36.625 -12.609 100 HE2 TYR 16 HE2 TYR 16 1.513 -39.787 -9.903 101 HH TYR 16 HH TYR 16 1.782 -39.478 -12.690 102 H ILE 17 H ILE 17 2.109 -35.924 -5.492 103 HA ILE 17 HA ILE 17 4.151 -38.043 -5.326 104 HB ILE 17 HB ILE 17 4.662 -36.525 -3.609 105 HG12 ILE 17 HG12 ILE 17 2.863 -38.593 -2.328 106 HG13 ILE 17 HG13 ILE 17 4.507 -38.897 -2.876 107 HG21 ILE 17 HG21 ILE 17 2.574 -36.063 -1.954 108 HG22 ILE 17 HG22 ILE 17 3.057 -34.988 -3.265 109 HG23 ILE 17 HG23 ILE 17 1.750 -36.145 -3.511 110 HD11 ILE 17 HD11 ILE 17 5.134 -36.959 -1.287 111 HD12 ILE 17 HD12 ILE 17 3.558 -37.275 -0.560 112 HD13 ILE 17 HD13 ILE 17 4.776 -38.550 -0.616 113 H ARG 18 H ARG 18 3.416 -40.055 -5.342 114 HA ARG 18 HA ARG 18 0.631 -40.539 -4.510 115 HB2 ARG 18 HB2 ARG 18 2.280 -41.777 -6.701 116 HB3 ARG 18 HB3 ARG 18 0.870 -42.596 -6.044 117 HG2 ARG 18 HG2 ARG 18 -0.318 -40.323 -6.559 118 HG3 ARG 18 HG3 ARG 18 1.031 -40.114 -7.678 119 HD2 ARG 18 HD2 ARG 18 -0.755 -41.120 -8.891 120 HD3 ARG 18 HD3 ARG 18 0.473 -42.359 -8.633 121 HE ARG 18 HE ARG 18 -1.341 -42.560 -6.542 122 HH11 ARG 18 HH11 ARG 18 -1.328 -42.914 -10.006 123 HH12 ARG 18 HH12 ARG 18 -2.599 -44.091 -10.021 124 HH21 ARG 18 HH21 ARG 18 -3.016 -44.109 -6.549 125 HH22 ARG 18 HH22 ARG 18 -3.559 -44.769 -8.054 126 H VAL 19 H VAL 19 0.746 -41.316 -2.491 127 HA VAL 19 HA VAL 19 2.203 -43.800 -2.064 128 HB VAL 19 HB VAL 19 3.048 -42.928 0.166 129 HG11 VAL 19 HG11 VAL 19 4.496 -41.381 -1.878 130 HG12 VAL 19 HG12 VAL 19 5.077 -42.624 -0.768 131 HG13 VAL 19 HG13 VAL 19 4.241 -43.085 -2.251 132 HG21 VAL 19 HG21 VAL 19 1.662 -40.892 0.206 133 HG22 VAL 19 HG22 VAL 19 3.379 -40.536 0.391 134 HG23 VAL 19 HG23 VAL 19 2.582 -40.256 -1.157 135 H THR 20 H THR 20 1.445 -45.017 -0.275 136 HA THR 20 HA THR 20 -1.145 -44.095 0.791 137 HB THR 20 HB THR 20 -1.778 -45.858 -0.584 138 HG1 THR 20 HG1 THR 20 -2.064 -47.691 0.926 139 HG21 THR 20 HG21 THR 20 -0.311 -48.110 -0.184 140 HG22 THR 20 HG22 THR 20 0.926 -46.865 -0.011 141 HG23 THR 20 HG23 THR 20 -0.030 -46.959 -1.489 142 H GLU 21 H GLU 21 -1.645 -44.592 2.934 143 HA GLU 21 HA GLU 21 0.617 -44.786 4.684 144 HB2 GLU 21 HB2 GLU 21 -1.532 -43.434 5.055 145 HB3 GLU 21 HB3 GLU 21 -2.268 -44.959 5.526 146 HG2 GLU 21 HG2 GLU 21 0.219 -44.593 6.908 147 HG3 GLU 21 HG3 GLU 21 -0.822 -43.188 7.132 148 H ASP 22 H ASP 22 -2.223 -46.835 4.059 149 HA ASP 22 HA ASP 22 -0.959 -49.011 5.554 150 HB2 ASP 22 HB2 ASP 22 -3.709 -48.232 4.955 151 HB3 ASP 22 HB3 ASP 22 -3.411 -49.945 4.678 152 H GLU 23 H GLU 23 -0.520 -51.016 4.651 153 HA GLU 23 HA GLU 23 0.326 -51.028 1.963 154 HB2 GLU 23 HB2 GLU 23 0.746 -53.436 2.317 155 HB3 GLU 23 HB3 GLU 23 1.393 -52.443 3.616 156 HG2 GLU 23 HG2 GLU 23 -1.024 -53.011 4.636 157 HG3 GLU 23 HG3 GLU 23 -0.760 -54.451 3.655 158 H ASN 24 H ASN 24 -2.605 -52.141 3.536 159 HA ASN 24 HA ASN 24 -3.606 -53.498 1.208 160 HB2 ASN 24 HB2 ASN 24 -5.689 -53.723 2.522 161 HB3 ASN 24 HB3 ASN 24 -4.274 -54.253 3.427 162 HD21 ASN 24 HD21 ASN 24 -6.627 -51.696 3.036 163 HD22 ASN 24 HD22 ASN 24 -6.415 -51.000 4.603 164 H ASP 25 H ASP 25 -3.783 -50.296 2.539 165 HA ASP 25 HA ASP 25 -6.067 -49.421 1.086 166 HB2 ASP 25 HB2 ASP 25 -4.503 -48.372 3.107 167 HB3 ASP 25 HB3 ASP 25 -4.119 -47.338 1.734 168 H GLU 26 H GLU 26 -6.063 -47.838 -0.651 169 HA GLU 26 HA GLU 26 -4.169 -48.571 -2.708 170 HB2 GLU 26 HB2 GLU 26 -6.805 -47.291 -2.586 171 HB3 GLU 26 HB3 GLU 26 -5.734 -46.590 -3.792 172 HG2 GLU 26 HG2 GLU 26 -5.385 -49.241 -4.252 173 HG3 GLU 26 HG3 GLU 26 -7.071 -49.194 -3.738 174 HA PRO 27 HA PRO 27 -1.447 -45.142 -2.386 175 HB2 PRO 27 HB2 PRO 27 -0.757 -44.790 -4.988 176 HB3 PRO 27 HB3 PRO 27 -0.184 -46.152 -4.018 177 HG2 PRO 27 HG2 PRO 27 -2.425 -46.047 -6.001 178 HG3 PRO 27 HG3 PRO 27 -1.189 -47.298 -5.775 179 HD2 PRO 27 HD2 PRO 27 -3.708 -47.549 -4.815 180 HD3 PRO 27 HD3 PRO 27 -2.299 -48.251 -3.994 181 H ILE 28 H ILE 28 -2.561 -43.345 -1.744 182 HA ILE 28 HA ILE 28 -4.408 -41.973 -3.452 183 HB ILE 28 HB ILE 28 -4.763 -41.856 -1.077 184 HG12 ILE 28 HG12 ILE 28 -4.943 -39.429 -0.768 185 HG13 ILE 28 HG13 ILE 28 -3.825 -39.167 -2.102 186 HG21 ILE 28 HG21 ILE 28 -3.155 -40.626 0.383 187 HG22 ILE 28 HG22 ILE 28 -2.545 -42.156 -0.244 188 HG23 ILE 28 HG23 ILE 28 -2.013 -40.635 -0.960 189 HD11 ILE 28 HD11 ILE 28 -6.102 -40.809 -2.846 190 HD12 ILE 28 HD12 ILE 28 -6.557 -39.205 -2.271 191 HD13 ILE 28 HD13 ILE 28 -5.434 -39.372 -3.620 192 H GLU 29 H GLU 29 -4.080 -40.269 -4.763 193 HA GLU 29 HA GLU 29 -1.316 -39.346 -5.090 194 HB2 GLU 29 HB2 GLU 29 -2.035 -38.544 -7.295 195 HB3 GLU 29 HB3 GLU 29 -2.372 -40.258 -7.091 196 HG2 GLU 29 HG2 GLU 29 -4.468 -39.883 -7.670 197 HG3 GLU 29 HG3 GLU 29 -4.668 -38.892 -6.225 198 H ILE 30 H ILE 30 -0.736 -37.390 -4.427 199 HA ILE 30 HA ILE 30 -2.818 -35.333 -4.105 200 HB ILE 30 HB ILE 30 -1.070 -34.558 -2.219 201 HG12 ILE 30 HG12 ILE 30 -1.119 -37.497 -1.691 202 HG13 ILE 30 HG13 ILE 30 0.103 -36.868 -2.791 203 HG21 ILE 30 HG21 ILE 30 -2.967 -36.613 -1.280 204 HG22 ILE 30 HG22 ILE 30 -2.772 -34.933 -0.783 205 HG23 ILE 30 HG23 ILE 30 -3.643 -35.318 -2.267 206 HD11 ILE 30 HD11 ILE 30 0.948 -37.057 -0.519 207 HD12 ILE 30 HD12 ILE 30 0.911 -35.375 -1.048 208 HD13 ILE 30 HD13 ILE 30 -0.327 -35.981 0.052 209 HA PRO 31 HA PRO 31 -0.234 -32.694 -6.485 210 HB2 PRO 31 HB2 PRO 31 -0.962 -30.275 -5.491 211 HB3 PRO 31 HB3 PRO 31 -2.008 -31.234 -6.545 212 HG2 PRO 31 HG2 PRO 31 -2.056 -30.966 -3.563 213 HG3 PRO 31 HG3 PRO 31 -3.411 -30.976 -4.708 214 HD2 PRO 31 HD2 PRO 31 -2.715 -33.152 -3.255 215 HD3 PRO 31 HD3 PRO 31 -3.408 -33.274 -4.885 216 H SER 32 H SER 32 1.830 -32.048 -6.371 217 HA SER 32 HA SER 32 2.946 -31.464 -3.708 218 HB2 SER 32 HB2 SER 32 4.869 -32.591 -4.262 219 HB3 SER 32 HB3 SER 32 3.732 -33.473 -5.281 220 HG SER 32 HG SER 32 5.668 -32.732 -6.367 221 H GLU 33 H GLU 33 5.252 -30.270 -4.205 222 HA GLU 33 HA GLU 33 4.436 -27.701 -5.280 223 HB2 GLU 33 HB2 GLU 33 6.939 -28.589 -3.841 224 HB3 GLU 33 HB3 GLU 33 6.655 -26.945 -4.392 225 HG2 GLU 33 HG2 GLU 33 4.436 -27.914 -2.828 226 HG3 GLU 33 HG3 GLU 33 5.953 -28.041 -1.940 227 H ASP 34 H ASP 34 6.116 -26.462 -6.575 228 HA ASP 34 HA ASP 34 6.584 -27.831 -9.005 229 HB2 ASP 34 HB2 ASP 34 7.608 -25.777 -9.773 230 HB3 ASP 34 HB3 ASP 34 6.175 -25.383 -8.828 231 H ASP 35 H ASP 35 8.685 -26.908 -6.322 232 HA ASP 35 HA ASP 35 11.131 -27.637 -7.517 233 HB2 ASP 35 HB2 ASP 35 10.320 -27.509 -4.606 234 HB3 ASP 35 HB3 ASP 35 11.976 -27.739 -5.162 235 H GLY 36 H GLY 36 8.556 -29.514 -6.259 236 HA2 GLY 36 HA2 GLY 36 8.608 -31.880 -6.967 237 HA3 GLY 36 HA3 GLY 36 10.267 -31.920 -6.390 238 H THR 37 H THR 37 9.615 -30.314 -4.009 239 HA THR 37 HA THR 37 9.038 -32.440 -2.237 240 HB THR 37 HB THR 37 9.124 -30.820 -0.460 241 HG1 THR 37 HG1 THR 37 7.854 -29.169 -1.353 242 HG21 THR 37 HG21 THR 37 11.322 -30.316 -0.680 243 HG22 THR 37 HG22 THR 37 11.097 -29.551 -2.253 244 HG23 THR 37 HG23 THR 37 11.183 -31.308 -2.131 245 H VAL 38 H VAL 38 7.337 -31.589 -0.338 246 HA VAL 38 HA VAL 38 4.785 -30.999 -1.657 247 HB VAL 38 HB VAL 38 5.301 -33.373 0.133 248 HG11 VAL 38 HG11 VAL 38 2.765 -31.967 -0.577 249 HG12 VAL 38 HG12 VAL 38 2.760 -33.717 -0.353 250 HG13 VAL 38 HG13 VAL 38 3.273 -32.660 0.963 251 HG21 VAL 38 HG21 VAL 38 4.718 -34.712 -1.691 252 HG22 VAL 38 HG22 VAL 38 3.972 -33.369 -2.558 253 HG23 VAL 38 HG23 VAL 38 5.726 -33.450 -2.399 254 H LEU 39 H LEU 39 3.467 -29.706 -0.501 255 HA LEU 39 HA LEU 39 4.469 -28.427 1.830 256 HB2 LEU 39 HB2 LEU 39 2.664 -27.772 -0.088 257 HB3 LEU 39 HB3 LEU 39 1.597 -28.163 1.259 258 HG LEU 39 HG LEU 39 2.872 -26.499 2.635 259 HD11 LEU 39 HD11 LEU 39 3.993 -24.764 0.961 260 HD12 LEU 39 HD12 LEU 39 4.319 -26.246 0.063 261 HD13 LEU 39 HD13 LEU 39 4.902 -26.072 1.718 262 HD21 LEU 39 HD21 LEU 39 1.818 -24.536 1.563 263 HD22 LEU 39 HD22 LEU 39 0.729 -25.917 1.694 264 HD23 LEU 39 HD23 LEU 39 1.476 -25.527 0.144 265 H LEU 40 H LEU 40 4.122 -28.827 3.929 266 HA LEU 40 HA LEU 40 3.233 -31.241 4.892 267 HB2 LEU 40 HB2 LEU 40 4.389 -29.104 6.008 268 HB3 LEU 40 HB3 LEU 40 2.749 -28.880 6.612 269 HG LEU 40 HG LEU 40 4.522 -31.277 7.075 270 HD11 LEU 40 HD11 LEU 40 3.452 -29.717 9.321 271 HD12 LEU 40 HD12 LEU 40 4.640 -28.878 8.323 272 HD13 LEU 40 HD13 LEU 40 5.053 -30.417 9.080 273 HD21 LEU 40 HD21 LEU 40 1.632 -30.764 7.614 274 HD22 LEU 40 HD22 LEU 40 2.567 -31.738 8.750 275 HD23 LEU 40 HD23 LEU 40 2.431 -32.237 7.063 276 H SER 41 H SER 41 1.375 -28.324 4.263 277 HA SER 41 HA SER 41 -0.991 -28.924 5.569 278 HB2 SER 41 HB2 SER 41 -0.148 -27.130 3.454 279 HB3 SER 41 HB3 SER 41 -1.780 -27.731 3.163 280 HG SER 41 HG SER 41 -2.174 -27.117 5.432 281 H THR 42 H THR 42 0.221 -30.098 2.488 282 HA THR 42 HA THR 42 -2.195 -31.380 1.688 283 HB THR 42 HB THR 42 0.650 -31.869 0.785 284 HG1 THR 42 HG1 THR 42 -0.042 -30.567 -0.997 285 HG21 THR 42 HG21 THR 42 -0.427 -32.888 -1.212 286 HG22 THR 42 HG22 THR 42 -1.979 -32.786 -0.381 287 HG23 THR 42 HG23 THR 42 -0.695 -33.804 0.271 288 H VAL 43 H VAL 43 0.798 -32.518 3.223 289 HA VAL 43 HA VAL 43 0.294 -35.233 3.299 290 HB VAL 43 HB VAL 43 1.816 -33.403 5.110 291 HG11 VAL 43 HG11 VAL 43 1.182 -34.828 6.793 292 HG12 VAL 43 HG12 VAL 43 0.988 -36.203 5.705 293 HG13 VAL 43 HG13 VAL 43 2.603 -35.670 6.175 294 HG21 VAL 43 HG21 VAL 43 3.660 -34.984 4.368 295 HG22 VAL 43 HG22 VAL 43 2.488 -35.657 3.235 296 HG23 VAL 43 HG23 VAL 43 2.952 -33.959 3.120 297 H THR 44 H THR 44 -0.968 -32.683 5.361 298 HA THR 44 HA THR 44 -2.170 -34.454 7.261 299 HB THR 44 HB THR 44 -3.223 -32.504 8.204 300 HG1 THR 44 HG1 THR 44 -2.249 -30.898 6.089 301 HG21 THR 44 HG21 THR 44 -0.432 -32.699 7.722 302 HG22 THR 44 HG22 THR 44 -1.257 -31.935 9.081 303 HG23 THR 44 HG23 THR 44 -0.876 -30.995 7.639 304 H ALA 45 H ALA 45 -3.112 -33.080 4.218 305 HA ALA 45 HA ALA 45 -5.851 -33.084 4.299 306 HB1 ALA 45 HB1 ALA 45 -4.131 -32.625 2.355 307 HB2 ALA 45 HB2 ALA 45 -4.562 -34.273 1.897 308 HB3 ALA 45 HB3 ALA 45 -5.812 -33.034 2.014 309 H GLN 46 H GLN 46 -3.748 -35.872 3.617 310 HA GLN 46 HA GLN 46 -6.075 -37.631 3.993 311 HB2 GLN 46 HB2 GLN 46 -3.526 -38.702 2.906 312 HB3 GLN 46 HB3 GLN 46 -5.186 -39.112 2.492 313 HG2 GLN 46 HG2 GLN 46 -4.775 -37.991 0.610 314 HG3 GLN 46 HG3 GLN 46 -5.030 -36.553 1.598 315 HE21 GLN 46 HE21 GLN 46 -2.483 -38.831 0.661 316 HE22 GLN 46 HE22 GLN 46 -1.225 -37.651 0.558 317 H PHE 47 H PHE 47 -2.814 -36.945 5.065 318 HA PHE 47 HA PHE 47 -3.092 -39.021 7.136 319 HB2 PHE 47 HB2 PHE 47 -0.448 -37.770 6.554 320 HB3 PHE 47 HB3 PHE 47 -0.823 -39.409 7.076 321 HD1 PHE 47 HD1 PHE 47 0.637 -37.765 4.542 322 HD2 PHE 47 HD2 PHE 47 -2.553 -40.516 5.153 323 HE1 PHE 47 HE1 PHE 47 0.876 -38.553 2.223 324 HE2 PHE 47 HE2 PHE 47 -2.319 -41.308 2.836 325 HZ PHE 47 HZ PHE 47 -0.602 -40.327 1.367 326 HA PRO 48 HA PRO 48 -3.441 -34.937 9.296 327 HB2 PRO 48 HB2 PRO 48 -5.439 -35.730 10.955 328 HB3 PRO 48 HB3 PRO 48 -5.734 -35.090 9.334 329 HG2 PRO 48 HG2 PRO 48 -5.660 -37.935 10.261 330 HG3 PRO 48 HG3 PRO 48 -6.802 -37.147 9.157 331 HD2 PRO 48 HD2 PRO 48 -4.752 -38.685 8.280 332 HD3 PRO 48 HD3 PRO 48 -5.361 -37.292 7.363 333 H GLY 49 H GLY 49 -2.060 -34.559 10.908 334 HA2 GLY 49 HA2 GLY 49 -1.241 -34.802 13.106 335 HA3 GLY 49 HA3 GLY 49 -1.907 -36.427 13.150 336 H ALA 50 H ALA 50 -0.703 -37.066 10.511 337 HA ALA 50 HA ALA 50 1.575 -38.382 11.313 338 HB1 ALA 50 HB1 ALA 50 2.175 -38.494 8.907 339 HB2 ALA 50 HB2 ALA 50 0.496 -38.924 9.236 340 HB3 ALA 50 HB3 ALA 50 0.885 -37.338 8.570 341 H CYS 51 H CYS 51 3.584 -37.800 11.817 342 HA CYS 51 HA CYS 51 4.387 -35.024 11.377 343 HB2 CYS 51 HB2 CYS 51 4.552 -36.514 13.612 344 HB3 CYS 51 HB3 CYS 51 6.128 -36.870 12.915 345 HG CYS 51 HG CYS 51 5.012 -33.686 13.478 346 H GLY 52 H GLY 52 5.429 -38.328 10.700 347 HA2 GLY 52 HA2 GLY 52 7.144 -37.272 8.568 348 HA3 GLY 52 HA3 GLY 52 7.870 -38.332 9.766 349 H LEU 53 H LEU 53 7.557 -38.698 6.870 350 HA LEU 53 HA LEU 53 5.881 -41.121 6.881 351 HB2 LEU 53 HB2 LEU 53 6.728 -39.593 4.436 352 HB3 LEU 53 HB3 LEU 53 5.482 -40.833 4.567 353 HG LEU 53 HG LEU 53 4.233 -38.907 4.374 354 HD11 LEU 53 HD11 LEU 53 4.386 -38.573 7.289 355 HD12 LEU 53 HD12 LEU 53 4.111 -40.223 6.731 356 HD13 LEU 53 HD13 LEU 53 3.004 -38.936 6.254 357 HD21 LEU 53 HD21 LEU 53 4.819 -36.774 5.060 358 HD22 LEU 53 HD22 LEU 53 6.380 -37.488 4.656 359 HD23 LEU 53 HD23 LEU 53 5.876 -37.365 6.342 360 H ARG 54 H ARG 54 6.715 -43.026 6.090 361 HA ARG 54 HA ARG 54 9.630 -43.050 5.703 362 HB2 ARG 54 HB2 ARG 54 8.145 -44.479 7.479 363 HB3 ARG 54 HB3 ARG 54 8.231 -45.610 6.135 364 HG2 ARG 54 HG2 ARG 54 10.392 -46.061 6.493 365 HG3 ARG 54 HG3 ARG 54 10.791 -44.374 6.825 366 HD2 ARG 54 HD2 ARG 54 11.173 -45.660 8.815 367 HD3 ARG 54 HD3 ARG 54 9.767 -44.629 9.070 368 HE ARG 54 HE ARG 54 8.708 -46.979 8.206 369 HH11 ARG 54 HH11 ARG 54 10.884 -46.088 10.773 370 HH12 ARG 54 HH12 ARG 54 10.383 -47.375 11.820 371 HH21 ARG 54 HH21 ARG 54 8.040 -48.677 9.575 372 HH22 ARG 54 HH22 ARG 54 8.766 -48.847 11.137 373 H TYR 55 H TYR 55 10.424 -44.852 4.256 374 HA TYR 55 HA TYR 55 8.784 -44.882 1.817 375 HB2 TYR 55 HB2 TYR 55 11.561 -44.369 2.300 376 HB3 TYR 55 HB3 TYR 55 11.415 -45.785 1.266 377 HD1 TYR 55 HD1 TYR 55 11.839 -42.378 1.186 378 HD2 TYR 55 HD2 TYR 55 9.458 -45.408 -0.618 379 HE1 TYR 55 HE1 TYR 55 11.456 -40.914 -0.752 380 HE2 TYR 55 HE2 TYR 55 9.069 -43.953 -2.562 381 HH TYR 55 HH TYR 55 10.603 -41.791 -3.579 382 H ARG 56 H ARG 56 7.972 -46.734 1.084 383 HA ARG 56 HA ARG 56 9.131 -49.262 2.049 384 HB2 ARG 56 HB2 ARG 56 7.168 -49.096 3.327 385 HB3 ARG 56 HB3 ARG 56 6.251 -48.407 1.994 386 HG2 ARG 56 HG2 ARG 56 5.639 -50.744 2.543 387 HG3 ARG 56 HG3 ARG 56 6.165 -50.517 0.874 388 HD2 ARG 56 HD2 ARG 56 8.396 -51.341 1.477 389 HD3 ARG 56 HD3 ARG 56 7.852 -51.583 3.136 390 HE ARG 56 HE ARG 56 6.212 -52.971 1.262 391 HH11 ARG 56 HH11 ARG 56 9.244 -53.103 2.969 392 HH12 ARG 56 HH12 ARG 56 9.344 -54.832 2.922 393 HH21 ARG 56 HH21 ARG 56 6.333 -55.248 1.194 394 HH22 ARG 56 HH22 ARG 56 7.689 -56.051 1.912 395 H ASN 57 H ASN 57 10.178 -49.811 0.188 396 HA ASN 57 HA ASN 57 8.557 -49.986 -2.264 397 HB2 ASN 57 HB2 ASN 57 11.494 -49.547 -1.808 398 HB3 ASN 57 HB3 ASN 57 10.919 -50.207 -3.336 399 HD21 ASN 57 HD21 ASN 57 9.867 -48.903 -4.767 400 HD22 ASN 57 HD22 ASN 57 9.718 -47.194 -4.565 401 HA PRO 58 HA PRO 58 8.786 -54.383 -1.443 402 HB2 PRO 58 HB2 PRO 58 7.159 -55.098 -3.496 403 HB3 PRO 58 HB3 PRO 58 6.550 -54.456 -1.966 404 HG2 PRO 58 HG2 PRO 58 6.980 -53.049 -4.573 405 HG3 PRO 58 HG3 PRO 58 5.615 -52.927 -3.448 406 HD2 PRO 58 HD2 PRO 58 7.589 -51.077 -3.549 407 HD3 PRO 58 HD3 PRO 58 6.737 -51.483 -2.046 408 H VAL 59 H VAL 59 9.297 -52.823 -4.569 409 HA VAL 59 HA VAL 59 10.705 -55.128 -5.631 410 HB VAL 59 HB VAL 59 10.978 -53.822 -7.662 411 HG11 VAL 59 HG11 VAL 59 8.189 -53.122 -7.056 412 HG12 VAL 59 HG12 VAL 59 8.854 -54.146 -8.331 413 HG13 VAL 59 HG13 VAL 59 8.635 -54.791 -6.703 414 HG21 VAL 59 HG21 VAL 59 9.649 -51.524 -7.550 415 HG22 VAL 59 HG22 VAL 59 10.191 -51.588 -5.873 416 HG23 VAL 59 HG23 VAL 59 11.371 -51.629 -7.183 417 H SER 60 H SER 60 11.425 -52.037 -4.189 418 HA SER 60 HA SER 60 14.222 -52.126 -4.924 419 HB2 SER 60 HB2 SER 60 12.695 -50.024 -4.530 420 HB3 SER 60 HB3 SER 60 13.134 -50.267 -2.839 421 HG SER 60 HG SER 60 15.041 -50.101 -4.928 422 H GLN 61 H GLN 61 12.216 -52.938 -2.188 423 HA GLN 61 HA GLN 61 12.675 -53.805 -0.126 424 HB2 GLN 61 HB2 GLN 61 14.924 -55.122 -1.657 425 HB3 GLN 61 HB3 GLN 61 14.251 -55.673 -0.129 426 HG2 GLN 61 HG2 GLN 61 12.026 -55.825 -1.398 427 HG3 GLN 61 HG3 GLN 61 13.016 -55.726 -2.853 428 HE21 GLN 61 HE21 GLN 61 13.619 -57.586 -3.678 429 HE22 GLN 61 HE22 GLN 61 13.782 -59.079 -2.824 430 H CYS 62 H CYS 62 13.862 -51.244 -0.639 431 HA CYS 62 HA CYS 62 16.439 -51.407 0.747 432 HB2 CYS 62 HB2 CYS 62 15.545 -49.826 -1.375 433 HB3 CYS 62 HB3 CYS 62 15.604 -48.730 0.000 434 HG CYS 62 HG CYS 62 18.023 -49.509 -1.917 435 H MET 63 H MET 63 16.573 -48.984 1.981 436 HA MET 63 HA MET 63 14.338 -49.015 3.896 437 HB2 MET 63 HB2 MET 63 17.295 -49.023 4.429 438 HB3 MET 63 HB3 MET 63 16.169 -48.365 5.609 439 HG2 MET 63 HG2 MET 63 14.965 -50.667 5.281 440 HG3 MET 63 HG3 MET 63 16.555 -51.174 4.715 441 HE1 MET 63 HE1 MET 63 15.570 -52.419 8.298 442 HE2 MET 63 HE2 MET 63 15.437 -52.701 6.563 443 HE3 MET 63 HE3 MET 63 16.972 -52.981 7.387 444 H ARG 64 H ARG 64 14.599 -47.289 1.664 445 HA ARG 64 HA ARG 64 15.780 -44.819 2.220 446 HB2 ARG 64 HB2 ARG 64 14.010 -45.911 0.243 447 HB3 ARG 64 HB3 ARG 64 13.414 -44.334 0.744 448 HG2 ARG 64 HG2 ARG 64 16.302 -44.492 0.193 449 HG3 ARG 64 HG3 ARG 64 15.234 -44.707 -1.196 450 HD2 ARG 64 HD2 ARG 64 14.082 -42.601 -0.569 451 HD3 ARG 64 HD3 ARG 64 15.266 -42.377 0.718 452 HE ARG 64 HE ARG 64 15.661 -41.944 -2.104 453 HH11 ARG 64 HH11 ARG 64 17.191 -42.543 0.966 454 HH12 ARG 64 HH12 ARG 64 18.712 -41.866 0.487 455 HH21 ARG 64 HH21 ARG 64 17.659 -41.050 -2.746 456 HH22 ARG 64 HH22 ARG 64 18.977 -41.016 -1.624 457 H GLY 65 H GLY 65 14.036 -42.807 2.156 458 HA2 GLY 65 HA2 GLY 65 11.811 -43.021 3.891 459 HA3 GLY 65 HA3 GLY 65 13.218 -42.490 4.800 460 H VAL 66 H VAL 66 10.555 -41.295 3.609 461 HA VAL 66 HA VAL 66 11.310 -39.180 1.910 462 HB VAL 66 HB VAL 66 8.968 -39.383 3.807 463 HG11 VAL 66 HG11 VAL 66 7.955 -37.603 2.446 464 HG12 VAL 66 HG12 VAL 66 9.412 -37.056 3.279 465 HG13 VAL 66 HG13 VAL 66 9.469 -37.437 1.557 466 HG21 VAL 66 HG21 VAL 66 8.379 -40.968 2.326 467 HG22 VAL 66 HG22 VAL 66 7.975 -39.601 1.288 468 HG23 VAL 66 HG23 VAL 66 9.533 -40.410 1.115 469 H ARG 67 H ARG 67 12.371 -37.354 2.300 470 HA ARG 67 HA ARG 67 13.227 -36.714 4.971 471 HB2 ARG 67 HB2 ARG 67 14.827 -36.384 3.234 472 HB3 ARG 67 HB3 ARG 67 13.699 -35.423 2.287 473 HG2 ARG 67 HG2 ARG 67 15.348 -33.988 3.290 474 HG3 ARG 67 HG3 ARG 67 13.772 -33.676 4.021 475 HD2 ARG 67 HD2 ARG 67 14.509 -35.354 5.823 476 HD3 ARG 67 HD3 ARG 67 16.133 -35.120 5.178 477 HE ARG 67 HE ARG 67 14.599 -33.254 6.749 478 HH11 ARG 67 HH11 ARG 67 17.232 -33.658 4.508 479 HH12 ARG 67 HH12 ARG 67 18.033 -32.197 4.984 480 HH21 ARG 67 HH21 ARG 67 15.645 -31.329 7.385 481 HH22 ARG 67 HH22 ARG 67 17.130 -30.874 6.621 482 H LEU 68 H LEU 68 12.638 -34.987 6.226 483 HA LEU 68 HA LEU 68 10.441 -33.300 5.233 484 HB2 LEU 68 HB2 LEU 68 9.476 -34.948 6.691 485 HB3 LEU 68 HB3 LEU 68 10.688 -34.622 7.929 486 HG LEU 68 HG LEU 68 8.283 -33.694 8.208 487 HD11 LEU 68 HD11 LEU 68 9.106 -32.172 9.695 488 HD12 LEU 68 HD12 LEU 68 10.333 -31.574 8.579 489 HD13 LEU 68 HD13 LEU 68 10.564 -33.119 9.398 490 HD21 LEU 68 HD21 LEU 68 9.268 -31.290 6.792 491 HD22 LEU 68 HD22 LEU 68 7.622 -31.883 7.016 492 HD23 LEU 68 HD23 LEU 68 8.665 -32.613 5.794 493 H VAL 69 H VAL 69 10.959 -31.224 5.282 494 HA VAL 69 HA VAL 69 12.604 -30.204 7.484 495 HB VAL 69 HB VAL 69 14.224 -30.492 5.753 496 HG11 VAL 69 HG11 VAL 69 12.012 -29.839 4.028 497 HG12 VAL 69 HG12 VAL 69 13.423 -28.854 3.635 498 HG13 VAL 69 HG13 VAL 69 13.547 -30.614 3.639 499 HG21 VAL 69 HG21 VAL 69 13.584 -27.605 5.392 500 HG22 VAL 69 HG22 VAL 69 13.919 -28.204 7.016 501 HG23 VAL 69 HG23 VAL 69 15.127 -28.383 5.744 502 H GLU 70 H GLU 70 11.578 -28.571 8.415 503 HA GLU 70 HA GLU 70 10.259 -26.750 8.758 504 HB2 GLU 70 HB2 GLU 70 10.500 -26.239 5.793 505 HB3 GLU 70 HB3 GLU 70 10.139 -25.067 7.053 506 HG2 GLU 70 HG2 GLU 70 12.582 -26.222 7.771 507 HG3 GLU 70 HG3 GLU 70 12.677 -25.929 6.035 508 H GLY 71 H GLY 71 9.122 -29.364 7.961 509 HA2 GLY 71 HA2 GLY 71 6.871 -30.022 7.985 510 HA3 GLY 71 HA3 GLY 71 6.416 -28.405 7.466 511 H ILE 72 H ILE 72 8.458 -28.517 5.282 512 HA ILE 72 HA ILE 72 6.732 -29.685 3.298 513 HB ILE 72 HB ILE 72 9.441 -28.384 3.003 514 HG12 ILE 72 HG12 ILE 72 7.288 -26.896 1.856 515 HG13 ILE 72 HG13 ILE 72 6.860 -27.301 3.515 516 HG21 ILE 72 HG21 ILE 72 8.183 -28.149 0.592 517 HG22 ILE 72 HG22 ILE 72 9.406 -29.356 0.986 518 HG23 ILE 72 HG23 ILE 72 7.694 -29.763 1.107 519 HD11 ILE 72 HD11 ILE 72 8.746 -26.186 4.374 520 HD12 ILE 72 HD12 ILE 72 9.487 -26.054 2.779 521 HD13 ILE 72 HD13 ILE 72 8.048 -25.111 3.164 522 H LEU 73 H LEU 73 6.768 -31.759 2.771 523 HA LEU 73 HA LEU 73 8.933 -33.483 3.508 524 HB2 LEU 73 HB2 LEU 73 6.367 -33.874 2.004 525 HB3 LEU 73 HB3 LEU 73 7.557 -35.166 2.146 526 HG LEU 73 HG LEU 73 5.833 -35.492 3.786 527 HD11 LEU 73 HD11 LEU 73 8.317 -34.427 5.121 528 HD12 LEU 73 HD12 LEU 73 8.144 -36.036 4.421 529 HD13 LEU 73 HD13 LEU 73 7.161 -35.568 5.808 530 HD21 LEU 73 HD21 LEU 73 5.240 -33.005 3.830 531 HD22 LEU 73 HD22 LEU 73 6.516 -32.850 5.037 532 HD23 LEU 73 HD23 LEU 73 5.130 -33.897 5.347 533 H HIS 74 H HIS 74 10.790 -33.409 2.421 534 HA HIS 74 HA HIS 74 10.904 -32.688 -0.364 535 HB2 HIS 74 HB2 HIS 74 12.683 -32.574 1.768 536 HB3 HIS 74 HB3 HIS 74 13.349 -33.833 0.732 537 HD1 HIS 74 HD1 HIS 74 13.224 -32.901 -1.994 538 HD2 HIS 74 HD2 HIS 74 13.766 -30.200 1.116 539 HE1 HIS 74 HE1 HIS 74 14.246 -30.859 -3.048 540 H ALA 75 H ALA 75 11.626 -33.993 -2.073 541 HA ALA 75 HA ALA 75 11.055 -36.840 -1.692 542 HB1 ALA 75 HB1 ALA 75 11.245 -36.675 -4.329 543 HB2 ALA 75 HB2 ALA 75 9.775 -36.215 -3.469 544 HB3 ALA 75 HB3 ALA 75 10.912 -34.975 -3.996 545 HA PRO 76 HA PRO 76 15.220 -38.142 -2.169 546 HB2 PRO 76 HB2 PRO 76 14.905 -40.465 -3.538 547 HB3 PRO 76 HB3 PRO 76 14.468 -40.286 -1.834 548 HG2 PRO 76 HG2 PRO 76 12.716 -40.190 -4.260 549 HG3 PRO 76 HG3 PRO 76 12.430 -40.992 -2.704 550 HD2 PRO 76 HD2 PRO 76 11.320 -38.605 -3.339 551 HD3 PRO 76 HD3 PRO 76 11.767 -39.038 -1.676 552 H ASP 77 H ASP 77 16.643 -39.283 -4.018 553 HA ASP 77 HA ASP 77 16.762 -37.346 -6.141 554 HB2 ASP 77 HB2 ASP 77 18.846 -38.327 -6.719 555 HB3 ASP 77 HB3 ASP 77 18.764 -38.373 -4.960 556 H ALA 78 H ALA 78 14.949 -40.055 -5.725 557 HA ALA 78 HA ALA 78 14.971 -40.742 -8.587 558 HB1 ALA 78 HB1 ALA 78 15.439 -42.624 -7.117 559 HB2 ALA 78 HB2 ALA 78 13.928 -42.341 -6.252 560 HB3 ALA 78 HB3 ALA 78 13.896 -42.845 -7.942 561 H GLY 79 H GLY 79 13.053 -39.479 -5.989 562 HA2 GLY 79 HA2 GLY 79 11.204 -38.016 -6.617 563 HA3 GLY 79 HA3 GLY 79 10.802 -39.175 -7.876 564 H TRP 80 H TRP 80 8.745 -38.505 -6.415 565 HA TRP 80 HA TRP 80 8.363 -39.856 -3.977 566 HB2 TRP 80 HB2 TRP 80 6.363 -38.928 -6.047 567 HB3 TRP 80 HB3 TRP 80 5.924 -39.530 -4.451 568 HD1 TRP 80 HD1 TRP 80 6.531 -36.386 -6.185 569 HE1 TRP 80 HE1 TRP 80 6.958 -34.466 -4.524 570 HE3 TRP 80 HE3 TRP 80 7.353 -39.139 -1.957 571 HZ2 TRP 80 HZ2 TRP 80 7.565 -34.160 -1.784 572 HZ3 TRP 80 HZ3 TRP 80 7.851 -37.957 0.143 573 HH2 TRP 80 HH2 TRP 80 7.955 -35.519 0.225 574 H GLY 81 H GLY 81 7.128 -40.708 -7.222 575 HA2 GLY 81 HA2 GLY 81 7.021 -42.825 -8.191 576 HA3 GLY 81 HA3 GLY 81 7.614 -43.516 -6.688 577 H ASN 82 H ASN 82 5.957 -45.154 -7.120 578 HA ASN 82 HA ASN 82 3.341 -44.280 -6.090 579 HB2 ASN 82 HB2 ASN 82 3.820 -46.379 -8.218 580 HB3 ASN 82 HB3 ASN 82 2.254 -45.945 -7.538 581 HD21 ASN 82 HD21 ASN 82 5.034 -44.567 -9.233 582 HD22 ASN 82 HD22 ASN 82 4.127 -43.416 -10.148 583 H LEU 83 H LEU 83 5.586 -45.318 -4.620 584 HA LEU 83 HA LEU 83 4.864 -48.062 -3.969 585 HB2 LEU 83 HB2 LEU 83 6.780 -47.799 -2.319 586 HB3 LEU 83 HB3 LEU 83 7.177 -47.764 -4.036 587 HG LEU 83 HG LEU 83 8.324 -46.088 -2.440 588 HD11 LEU 83 HD11 LEU 83 7.306 -44.440 -4.580 589 HD12 LEU 83 HD12 LEU 83 7.700 -46.062 -5.148 590 HD13 LEU 83 HD13 LEU 83 8.926 -45.092 -4.331 591 HD21 LEU 83 HD21 LEU 83 6.198 -45.369 -1.373 592 HD22 LEU 83 HD22 LEU 83 5.726 -44.628 -2.903 593 HD23 LEU 83 HD23 LEU 83 7.145 -44.037 -2.036 594 H VAL 84 H VAL 84 5.204 -48.361 -1.367 595 HA VAL 84 HA VAL 84 2.975 -46.857 -0.226 596 HB VAL 84 HB VAL 84 4.380 -49.166 1.094 597 HG11 VAL 84 HG11 VAL 84 2.929 -48.506 2.678 598 HG12 VAL 84 HG12 VAL 84 1.931 -47.606 1.534 599 HG13 VAL 84 HG13 VAL 84 1.740 -49.353 1.688 600 HG21 VAL 84 HG21 VAL 84 2.350 -49.212 -1.112 601 HG22 VAL 84 HG22 VAL 84 3.846 -50.134 -0.962 602 HG23 VAL 84 HG23 VAL 84 2.461 -50.529 0.057 603 H TYR 85 H TYR 85 3.107 -46.120 2.019 604 HA TYR 85 HA TYR 85 5.829 -45.439 2.887 605 HB2 TYR 85 HB2 TYR 85 5.478 -43.197 2.896 606 HB3 TYR 85 HB3 TYR 85 4.286 -43.589 1.661 607 HD1 TYR 85 HD1 TYR 85 4.740 -42.798 5.240 608 HD2 TYR 85 HD2 TYR 85 1.959 -43.286 2.058 609 HE1 TYR 85 HE1 TYR 85 2.979 -41.795 6.634 610 HE2 TYR 85 HE2 TYR 85 0.190 -42.283 3.442 611 HH TYR 85 HH TYR 85 0.845 -40.662 6.371 612 H VAL 86 H VAL 86 6.115 -45.207 5.109 613 HA VAL 86 HA VAL 86 3.876 -46.208 6.742 614 HB VAL 86 HB VAL 86 6.843 -46.431 7.269 615 HG11 VAL 86 HG11 VAL 86 6.271 -46.711 9.399 616 HG12 VAL 86 HG12 VAL 86 4.551 -46.670 9.005 617 HG13 VAL 86 HG13 VAL 86 5.442 -48.190 8.915 618 HG21 VAL 86 HG21 VAL 86 5.316 -47.926 5.544 619 HG22 VAL 86 HG22 VAL 86 6.825 -48.446 6.295 620 HG23 VAL 86 HG23 VAL 86 5.280 -48.881 7.026 621 H VAL 87 H VAL 87 2.971 -44.757 8.030 622 HA VAL 87 HA VAL 87 3.897 -42.156 8.429 623 HB VAL 87 HB VAL 87 2.258 -42.086 10.343 624 HG11 VAL 87 HG11 VAL 87 1.500 -41.406 8.202 625 HG12 VAL 87 HG12 VAL 87 1.396 -43.073 7.633 626 HG13 VAL 87 HG13 VAL 87 0.265 -42.484 8.852 627 HG21 VAL 87 HG21 VAL 87 1.506 -44.863 9.470 628 HG22 VAL 87 HG22 VAL 87 2.560 -44.555 10.850 629 HG23 VAL 87 HG23 VAL 87 0.903 -43.950 10.853 630 H ASN 88 H ASN 88 4.494 -41.132 10.492 631 HA ASN 88 HA ASN 88 5.849 -42.860 12.411 632 HB2 ASN 88 HB2 ASN 88 7.255 -40.642 10.906 633 HB3 ASN 88 HB3 ASN 88 7.926 -41.509 12.285 634 HD21 ASN 88 HD21 ASN 88 8.184 -41.282 9.114 635 HD22 ASN 88 HD22 ASN 88 8.583 -42.910 8.694 636 H TYR 89 H TYR 89 4.268 -42.181 13.886 637 HA TYR 89 HA TYR 89 4.916 -39.909 15.412 638 HB2 TYR 89 HB2 TYR 89 3.067 -38.445 15.000 639 HB3 TYR 89 HB3 TYR 89 3.817 -38.788 13.446 640 HD1 TYR 89 HD1 TYR 89 0.767 -38.461 15.059 641 HD2 TYR 89 HD2 TYR 89 2.755 -40.968 12.255 642 HE1 TYR 89 HE1 TYR 89 -1.410 -39.191 14.178 643 HE2 TYR 89 HE2 TYR 89 0.584 -41.705 11.365 644 HH TYR 89 HH TYR 89 -1.882 -40.551 11.338 645 HA PRO 90 HA PRO 90 2.622 -42.176 18.390 646 HB2 PRO 90 HB2 PRO 90 1.935 -40.204 20.126 647 HB3 PRO 90 HB3 PRO 90 3.584 -40.823 19.979 648 HG2 PRO 90 HG2 PRO 90 2.376 -38.353 18.797 649 HG3 PRO 90 HG3 PRO 90 3.960 -38.566 19.565 650 HD2 PRO 90 HD2 PRO 90 3.640 -38.506 16.877 651 HD3 PRO 90 HD3 PRO 90 4.897 -39.479 17.667 652 H LYS 91 H LYS 91 1.062 -39.096 17.497 653 HA LYS 91 HA LYS 91 -1.312 -40.262 16.580 654 HB2 LYS 91 HB2 LYS 91 -1.161 -40.212 19.392 655 HB3 LYS 91 HB3 LYS 91 -2.260 -38.914 18.944 656 HG2 LYS 91 HG2 LYS 91 -2.525 -41.738 17.944 657 HG3 LYS 91 HG3 LYS 91 -3.344 -41.121 19.381 658 HD2 LYS 91 HD2 LYS 91 -4.485 -39.447 18.038 659 HD3 LYS 91 HD3 LYS 91 -3.622 -39.989 16.597 660 HE2 LYS 91 HE2 LYS 91 -5.547 -41.162 16.309 661 HE3 LYS 91 HE3 LYS 91 -4.678 -42.318 17.317 662 HZ1 LYS 91 HZ1 LYS 91 -6.220 -40.328 18.753 663 HZ2 LYS 91 HZ2 LYS 91 -6.061 -41.987 19.037 664 HZ3 LYS 91 HZ3 LYS 91 -7.134 -41.431 17.854 665 H ASP 92 H ASP 92 0.173 -37.477 18.144 666 HA ASP 92 HA ASP 92 -0.495 -35.740 16.011 667 HB2 ASP 92 HB2 ASP 92 -2.545 -36.065 17.916 668 HB3 ASP 92 HB3 ASP 92 -1.814 -34.498 18.251 669 H ASN 93 H ASN 93 -0.034 -33.369 16.689 670 HA ASN 93 HA ASN 93 1.783 -33.084 18.920 671 HB2 ASN 93 HB2 ASN 93 2.811 -33.752 16.365 672 HB3 ASN 93 HB3 ASN 93 3.193 -32.055 16.644 673 HD21 ASN 93 HD21 ASN 93 4.491 -34.949 16.849 674 HD22 ASN 93 HD22 ASN 93 5.510 -34.767 18.233 675 H LYS 94 H LYS 94 0.893 -31.520 15.839 676 HA LYS 94 HA LYS 94 0.028 -29.462 15.385 677 HB2 LYS 94 HB2 LYS 94 -0.926 -30.061 18.022 678 HB3 LYS 94 HB3 LYS 94 -0.526 -28.350 17.932 679 HG2 LYS 94 HG2 LYS 94 -1.988 -29.207 15.595 680 HG3 LYS 94 HG3 LYS 94 -2.869 -29.571 17.080 681 HD2 LYS 94 HD2 LYS 94 -3.186 -27.385 17.583 682 HD3 LYS 94 HD3 LYS 94 -1.621 -26.898 16.928 683 HE2 LYS 94 HE2 LYS 94 -3.681 -27.845 15.013 684 HE3 LYS 94 HE3 LYS 94 -3.925 -26.264 15.754 685 HZ1 LYS 94 HZ1 LYS 94 -1.569 -27.140 14.175 686 HZ2 LYS 94 HZ2 LYS 94 -1.668 -25.664 14.996 687 HZ3 LYS 94 HZ3 LYS 94 -2.728 -25.994 13.719 688 H ARG 95 H ARG 95 1.382 -28.789 18.602 689 HA ARG 95 HA ARG 95 2.788 -27.086 19.247 690 HB2 ARG 95 HB2 ARG 95 5.061 -27.410 18.432 691 HB3 ARG 95 HB3 ARG 95 4.295 -28.962 18.743 692 HG2 ARG 95 HG2 ARG 95 4.083 -29.449 16.473 693 HG3 ARG 95 HG3 ARG 95 4.323 -27.767 15.998 694 HD2 ARG 95 HD2 ARG 95 6.653 -27.906 16.790 695 HD3 ARG 95 HD3 ARG 95 6.398 -29.605 17.185 696 HE ARG 95 HE ARG 95 5.720 -29.246 14.507 697 HH11 ARG 95 HH11 ARG 95 8.536 -29.063 16.546 698 HH12 ARG 95 HH12 ARG 95 9.640 -29.490 15.281 699 HH21 ARG 95 HH21 ARG 95 7.164 -29.809 12.833 700 HH22 ARG 95 HH22 ARG 95 8.859 -29.913 13.169 701 H LYS 96 H LYS 96 0.903 -26.088 17.465 702 HA LYS 96 HA LYS 96 2.366 -23.836 16.383 703 HB2 LYS 96 HB2 LYS 96 1.510 -25.974 14.688 704 HB3 LYS 96 HB3 LYS 96 0.543 -24.550 14.323 705 HG2 LYS 96 HG2 LYS 96 2.953 -23.409 14.378 706 HG3 LYS 96 HG3 LYS 96 3.428 -25.045 13.916 707 HD2 LYS 96 HD2 LYS 96 2.830 -24.597 11.823 708 HD3 LYS 96 HD3 LYS 96 1.165 -24.375 12.367 709 HE2 LYS 96 HE2 LYS 96 2.968 -22.102 12.857 710 HE3 LYS 96 HE3 LYS 96 2.652 -22.459 11.160 711 HZ1 LYS 96 HZ1 LYS 96 0.573 -22.007 13.233 712 HZ2 LYS 96 HZ2 LYS 96 0.289 -22.307 11.593 713 HZ3 LYS 96 HZ3 LYS 96 1.057 -20.877 12.070 714 H MET 97 H MET 97 1.308 -22.113 17.087 715 HA MET 97 HA MET 97 -1.555 -21.901 16.749 716 HB2 MET 97 HB2 MET 97 -0.966 -23.005 19.054 717 HB3 MET 97 HB3 MET 97 -0.550 -21.360 19.517 718 HG2 MET 97 HG2 MET 97 -2.691 -21.176 20.091 719 HG3 MET 97 HG3 MET 97 -2.992 -21.014 18.362 720 HE1 MET 97 HE1 MET 97 -4.577 -23.628 21.302 721 HE2 MET 97 HE2 MET 97 -4.370 -21.895 21.043 722 HE3 MET 97 HE3 MET 97 -5.700 -22.752 20.261 723 H ASP 98 H ASP 98 -0.027 -20.424 15.313 724 HA ASP 98 HA ASP 98 -0.465 -17.759 16.238 725 HB2 ASP 98 HB2 ASP 98 1.718 -18.450 17.359 726 HB3 ASP 98 HB3 ASP 98 2.422 -18.481 15.745 727 H GLU 99 H GLU 99 -1.255 -16.842 14.471 728 HA GLU 99 HA GLU 99 0.182 -17.180 11.937 729 HB2 GLU 99 HB2 GLU 99 -2.749 -17.651 12.424 730 HB3 GLU 99 HB3 GLU 99 -2.149 -17.202 10.833 731 HG2 GLU 99 HG2 GLU 99 -0.582 -19.354 11.889 732 HG3 GLU 99 HG3 GLU 99 -2.296 -19.761 11.960 733 H THR 100 H THR 100 0.984 -15.134 11.885 734 HA THR 100 HA THR 100 -0.965 -12.994 11.471 735 HB THR 100 HB THR 100 -0.353 -12.783 13.828 736 HG1 THR 100 HG1 THR 100 -0.578 -10.756 13.228 737 HG21 THR 100 HG21 THR 100 2.011 -13.829 13.279 738 HG22 THR 100 HG22 THR 100 1.791 -12.734 14.644 739 HG23 THR 100 HG23 THR 100 2.469 -12.132 13.132 740 H ASP 101 H ASP 101 -0.066 -11.121 10.389 741 HA ASP 101 HA ASP 101 2.274 -11.833 8.751 742 HB2 ASP 101 HB2 ASP 101 -0.290 -11.018 7.991 743 HB3 ASP 101 HB3 ASP 101 0.724 -9.600 7.739 744 H ALA 102 H ALA 102 4.051 -10.603 8.814 745 HA ALA 102 HA ALA 102 4.089 -7.833 9.349 746 HB1 ALA 102 HB1 ALA 102 4.377 -7.642 11.553 747 HB2 ALA 102 HB2 ALA 102 3.759 -9.291 11.659 748 HB3 ALA 102 HB3 ALA 102 5.498 -9.002 11.611 749 H SER 103 H SER 103 6.210 -6.934 9.258 750 HA SER 103 HA SER 103 8.318 -8.834 8.475 751 HB2 SER 103 HB2 SER 103 8.949 -7.508 6.610 752 HB3 SER 103 HB3 SER 103 7.193 -7.641 6.516 753 HG SER 103 HG SER 103 7.023 -5.566 6.840 754 H SER 104 H SER 104 10.163 -8.569 9.542 755 HA SER 104 HA SER 104 10.769 -5.937 10.704 756 HB2 SER 104 HB2 SER 104 11.790 -7.353 12.650 757 HB3 SER 104 HB3 SER 104 10.054 -7.044 12.626 758 HG SER 104 HG SER 104 11.349 -9.388 11.681 759 H ALA 105 H ALA 105 11.784 -6.919 8.294 760 HA ALA 105 HA ALA 105 14.324 -8.170 8.653 761 HB1 ALA 105 HB1 ALA 105 13.650 -6.550 6.234 762 HB2 ALA 105 HB2 ALA 105 14.559 -8.057 6.359 763 HB3 ALA 105 HB3 ALA 105 12.805 -8.067 6.546 764 H VAL 106 H VAL 106 16.362 -7.286 8.672 765 HA VAL 106 HA VAL 106 16.812 -4.475 8.301 766 HB VAL 106 HB VAL 106 15.885 -4.513 10.603 767 HG11 VAL 106 HG11 VAL 106 18.339 -6.139 11.261 768 HG12 VAL 106 HG12 VAL 106 17.147 -5.529 12.410 769 HG13 VAL 106 HG13 VAL 106 16.687 -6.754 11.227 770 HG21 VAL 106 HG21 VAL 106 18.818 -3.845 10.663 771 HG22 VAL 106 HG22 VAL 106 17.635 -2.875 9.785 772 HG23 VAL 106 HG23 VAL 106 17.501 -3.059 11.533 773 H LYS 107 H LYS 107 19.001 -3.947 8.146 774 HA LYS 107 HA LYS 107 20.721 -6.129 7.462 775 HB2 LYS 107 HB2 LYS 107 21.038 -3.142 7.531 776 HB3 LYS 107 HB3 LYS 107 22.424 -4.186 7.242 777 HG2 LYS 107 HG2 LYS 107 20.098 -4.795 5.575 778 HG3 LYS 107 HG3 LYS 107 20.783 -3.189 5.317 779 HD2 LYS 107 HD2 LYS 107 22.853 -5.198 5.531 780 HD3 LYS 107 HD3 LYS 107 21.700 -5.596 4.255 781 HE2 LYS 107 HE2 LYS 107 22.334 -3.858 2.966 782 HE3 LYS 107 HE3 LYS 107 22.552 -2.782 4.345 783 HZ1 LYS 107 HZ1 LYS 107 24.511 -4.149 2.886 784 HZ2 LYS 107 HZ2 LYS 107 24.523 -4.760 4.463 785 HZ3 LYS 107 HZ3 LYS 107 24.722 -3.101 4.197 786 H VAL 108 H VAL 108 22.975 -6.277 8.320 787 HA VAL 108 HA VAL 108 23.153 -5.582 11.169 788 HB VAL 108 HB VAL 108 22.413 -7.946 10.955 789 HG11 VAL 108 HG11 VAL 108 25.131 -8.602 9.884 790 HG12 VAL 108 HG12 VAL 108 23.671 -9.593 9.907 791 HG13 VAL 108 HG13 VAL 108 23.797 -8.232 8.792 792 HG21 VAL 108 HG21 VAL 108 23.681 -7.215 12.903 793 HG22 VAL 108 HG22 VAL 108 24.096 -8.875 12.477 794 HG23 VAL 108 HG23 VAL 108 25.193 -7.558 12.063 795 H LYS 109 H LYS 109 25.231 -5.247 11.959 796 HA LYS 109 HA LYS 109 27.145 -4.353 10.051 797 HB2 LYS 109 HB2 LYS 109 26.779 -4.240 12.929 798 HB3 LYS 109 HB3 LYS 109 28.458 -4.549 12.504 799 HG2 LYS 109 HG2 LYS 109 28.357 -2.570 10.986 800 HG3 LYS 109 HG3 LYS 109 26.753 -2.226 11.638 801 HD2 LYS 109 HD2 LYS 109 27.585 -1.711 13.747 802 HD3 LYS 109 HD3 LYS 109 29.093 -2.586 13.473 803 HE2 LYS 109 HE2 LYS 109 30.063 -0.844 12.396 804 HE3 LYS 109 HE3 LYS 109 28.547 -0.311 11.669 805 HZ1 LYS 109 HZ1 LYS 109 29.807 0.546 14.100 806 HZ2 LYS 109 HZ2 LYS 109 28.176 0.154 14.315 807 HZ3 LYS 109 HZ3 LYS 109 28.623 1.315 13.168 808 H ARG 110 H ARG 110 29.487 -5.042 10.205 809 HA ARG 110 HA ARG 110 29.649 -7.837 9.634 810 HB2 ARG 110 HB2 ARG 110 31.010 -5.847 8.635 811 HB3 ARG 110 HB3 ARG 110 32.055 -6.090 10.028 812 HG2 ARG 110 HG2 ARG 110 32.732 -8.191 9.315 813 HG3 ARG 110 HG3 ARG 110 31.345 -8.380 8.241 814 HD2 ARG 110 HD2 ARG 110 32.248 -6.596 6.803 815 HD3 ARG 110 HD3 ARG 110 33.652 -6.474 7.862 816 HE ARG 110 HE ARG 110 34.507 -8.371 6.899 817 HH11 ARG 110 HH11 ARG 110 31.151 -8.047 6.032 818 HH12 ARG 110 HH12 ARG 110 31.192 -9.331 4.869 819 HH21 ARG 110 HH21 ARG 110 34.574 -10.064 5.372 820 HH22 ARG 110 HH22 ARG 110 33.140 -10.478 4.495 821 H ALA 111 H ALA 111 29.822 -9.388 11.099 822 HA ALA 111 HA ALA 111 30.935 -8.755 13.736 823 HB1 ALA 111 HB1 ALA 111 29.439 -10.165 14.603 824 HB2 ALA 111 HB2 ALA 111 28.665 -10.132 13.018 825 HB3 ALA 111 HB3 ALA 111 29.805 -11.418 13.417 826 H VAL 112 H VAL 112 33.111 -8.953 13.607 827 HA VAL 112 HA VAL 112 34.161 -11.550 12.686 828 HB VAL 112 HB VAL 112 34.806 -9.728 11.152 829 HG11 VAL 112 HG11 VAL 112 34.815 -7.989 13.013 830 HG12 VAL 112 HG12 VAL 112 36.436 -8.572 13.396 831 HG13 VAL 112 HG13 VAL 112 36.098 -7.879 11.809 832 HG21 VAL 112 HG21 VAL 112 37.056 -10.893 12.790 833 HG22 VAL 112 HG22 VAL 112 36.285 -11.626 11.382 834 HG23 VAL 112 HG23 VAL 112 37.242 -10.156 11.198 835 H GLN 113 H GLN 113 35.679 -12.553 13.947 836 HA GLN 113 HA GLN 113 36.930 -11.228 16.168 837 HB2 GLN 113 HB2 GLN 113 35.921 -12.467 17.947 838 HB3 GLN 113 HB3 GLN 113 34.624 -11.730 17.015 839 HG2 GLN 113 HG2 GLN 113 34.325 -13.895 15.834 840 HG3 GLN 113 HG3 GLN 113 35.513 -14.602 16.929 841 HE21 GLN 113 HE21 GLN 113 34.605 -15.730 18.476 842 HE22 GLN 113 HE22 GLN 113 33.116 -15.365 19.273 843 H LYS 114 H LYS 114 37.738 -13.302 17.691 844 HA LYS 114 HA LYS 114 39.354 -14.853 15.802 845 HB2 LYS 114 HB2 LYS 114 39.750 -14.591 18.784 846 HB3 LYS 114 HB3 LYS 114 40.903 -15.195 17.601 847 HG2 LYS 114 HG2 LYS 114 40.865 -12.895 16.568 848 HG3 LYS 114 HG3 LYS 114 39.966 -12.368 17.993 849 HD2 LYS 114 HD2 LYS 114 42.066 -13.723 19.104 850 HD3 LYS 114 HD3 LYS 114 42.810 -12.989 17.682 851 HE2 LYS 114 HE2 LYS 114 41.895 -10.801 18.388 852 HE3 LYS 114 HE3 LYS 114 41.268 -11.564 19.848 853 HZ1 LYS 114 HZ1 LYS 114 43.943 -12.249 19.695 854 HZ2 LYS 114 HZ2 LYS 114 43.221 -11.174 20.783 855 HZ3 LYS 114 HZ3 LYS 114 43.873 -10.598 19.332 Start of MODEL 2 1 H1 MET 1 H MET 1 -19.794 -3.543 4.129 2 HA MET 1 HA MET 1 -18.264 -3.051 2.274 3 HB2 MET 1 HB2 MET 1 -17.634 -2.254 5.056 4 HB3 MET 1 HB3 MET 1 -16.371 -1.976 3.864 5 HG2 MET 1 HG2 MET 1 -17.402 -0.170 3.122 6 HG3 MET 1 HG3 MET 1 -18.875 -1.088 2.818 7 HE1 MET 1 HE1 MET 1 -20.922 0.224 3.610 8 HE2 MET 1 HE2 MET 1 -20.831 -1.339 4.422 9 HE3 MET 1 HE3 MET 1 -21.289 0.102 5.330 10 H ALA 2 H ALA 2 -16.393 -3.546 1.198 11 HA ALA 2 HA ALA 2 -14.267 -5.041 2.389 12 HB1 ALA 2 HB1 ALA 2 -15.753 -6.544 0.263 13 HB2 ALA 2 HB2 ALA 2 -14.538 -7.133 1.399 14 HB3 ALA 2 HB3 ALA 2 -16.157 -6.730 1.970 15 H GLY 3 H GLY 3 -12.471 -4.420 1.385 16 HA2 GLY 3 HA2 GLY 3 -12.708 -3.274 -1.311 17 HA3 GLY 3 HA3 GLY 3 -11.405 -2.959 -0.175 18 H SER 4 H SER 4 -11.490 -3.943 -3.026 19 HA SER 4 HA SER 4 -10.703 -6.640 -3.120 20 HB2 SER 4 HB2 SER 4 -10.840 -4.402 -4.952 21 HB3 SER 4 HB3 SER 4 -9.376 -5.346 -5.224 22 HG SER 4 HG SER 4 -10.546 -7.029 -5.822 23 H HIS 5 H HIS 5 -9.105 -7.348 -1.832 24 HA HIS 5 HA HIS 5 -6.423 -6.365 -2.331 25 HB2 HIS 5 HB2 HIS 5 -7.534 -5.086 -0.343 26 HB3 HIS 5 HB3 HIS 5 -7.249 -6.580 0.545 27 HD1 HIS 5 HD1 HIS 5 -4.840 -5.141 -1.976 28 HD2 HIS 5 HD2 HIS 5 -5.201 -5.650 2.132 29 HE1 HIS 5 HE1 HIS 5 -2.601 -4.510 -1.021 30 H HIS 6 H HIS 6 -6.312 -8.483 -3.285 31 HA HIS 6 HA HIS 6 -5.980 -10.613 -1.275 32 HB2 HIS 6 HB2 HIS 6 -6.796 -11.036 -4.153 33 HB3 HIS 6 HB3 HIS 6 -6.742 -12.242 -2.872 34 HD1 HIS 6 HD1 HIS 6 -8.657 -9.095 -3.782 35 HD2 HIS 6 HD2 HIS 6 -9.088 -12.561 -1.532 36 HE1 HIS 6 HE1 HIS 6 -11.038 -9.080 -2.973 37 H HIS 7 H HIS 7 -3.950 -11.257 -1.070 38 HA HIS 7 HA HIS 7 -1.959 -10.507 -3.020 39 HB2 HIS 7 HB2 HIS 7 -1.972 -11.543 -0.255 40 HB3 HIS 7 HB3 HIS 7 -0.609 -12.059 -1.243 41 HD1 HIS 7 HD1 HIS 7 -2.119 -9.042 0.359 42 HD2 HIS 7 HD2 HIS 7 1.205 -10.035 -1.927 43 HE1 HIS 7 HE1 HIS 7 -0.599 -7.042 0.479 44 H HIS 8 H HIS 8 -0.993 -11.779 -4.495 45 HA HIS 8 HA HIS 8 -1.336 -14.675 -4.357 46 HB2 HIS 8 HB2 HIS 8 -3.049 -13.204 -5.913 47 HB3 HIS 8 HB3 HIS 8 -1.778 -13.613 -7.061 48 HD1 HIS 8 HD1 HIS 8 -2.141 -15.756 -8.225 49 HD2 HIS 8 HD2 HIS 8 -3.973 -15.704 -4.497 50 HE1 HIS 8 HE1 HIS 8 -3.344 -17.956 -8.037 51 H HIS 9 H HIS 9 0.067 -15.832 -5.871 52 HA HIS 9 HA HIS 9 2.438 -14.244 -6.606 53 HB2 HIS 9 HB2 HIS 9 2.246 -17.004 -5.410 54 HB3 HIS 9 HB3 HIS 9 3.700 -16.438 -6.226 55 HD1 HIS 9 HD1 HIS 9 3.249 -17.122 -3.084 56 HD2 HIS 9 HD2 HIS 9 3.635 -13.379 -4.844 57 HE1 HIS 9 HE1 HIS 9 4.041 -15.595 -1.249 58 H HIS 10 H HIS 10 3.855 -15.571 -8.215 59 HA HIS 10 HA HIS 10 2.061 -16.510 -10.351 60 HB2 HIS 10 HB2 HIS 10 4.183 -14.602 -10.337 61 HB3 HIS 10 HB3 HIS 10 4.665 -15.951 -11.362 62 HD1 HIS 10 HD1 HIS 10 3.290 -16.352 -13.518 63 HD2 HIS 10 HD2 HIS 10 2.074 -13.049 -11.310 64 HE1 HIS 10 HE1 HIS 10 1.766 -15.051 -15.038 65 H GLY 11 H GLY 11 2.172 -18.569 -10.964 66 HA2 GLY 11 HA2 GLY 11 3.160 -20.610 -11.508 67 HA3 GLY 11 HA3 GLY 11 4.674 -20.031 -10.827 68 H SER 12 H SER 12 4.653 -22.301 -9.992 69 HA SER 12 HA SER 12 3.481 -22.299 -7.312 70 HB2 SER 12 HB2 SER 12 3.389 -24.964 -8.465 71 HB3 SER 12 HB3 SER 12 2.119 -24.053 -7.648 72 HG SER 12 HG SER 12 2.780 -24.129 -10.381 73 H MET 13 H MET 13 5.236 -22.345 -6.065 74 HA MET 13 HA MET 13 7.616 -23.782 -6.893 75 HB2 MET 13 HB2 MET 13 7.347 -21.470 -5.574 76 HB3 MET 13 HB3 MET 13 7.423 -22.555 -4.192 77 HG2 MET 13 HG2 MET 13 9.548 -23.468 -5.119 78 HG3 MET 13 HG3 MET 13 9.485 -22.211 -6.352 79 HE1 MET 13 HE1 MET 13 11.909 -22.637 -4.772 80 HE2 MET 13 HE2 MET 13 12.264 -21.504 -3.468 81 HE3 MET 13 HE3 MET 13 11.344 -22.972 -3.135 82 H SER 14 H SER 14 5.284 -23.885 -4.215 83 HA SER 14 HA SER 14 6.414 -26.047 -2.839 84 HB2 SER 14 HB2 SER 14 4.717 -24.622 -1.818 85 HB3 SER 14 HB3 SER 14 3.519 -25.171 -2.990 86 HG SER 14 HG SER 14 3.534 -27.173 -2.070 87 H GLU 15 H GLU 15 5.965 -28.253 -2.834 88 HA GLU 15 HA GLU 15 4.726 -29.256 -5.311 89 HB2 GLU 15 HB2 GLU 15 7.287 -29.717 -4.284 90 HB3 GLU 15 HB3 GLU 15 6.392 -31.190 -3.941 91 HG2 GLU 15 HG2 GLU 15 6.436 -31.827 -6.066 92 HG3 GLU 15 HG3 GLU 15 5.921 -30.239 -6.635 93 H TYR 16 H TYR 16 4.444 -31.893 -4.709 94 HA TYR 16 HA TYR 16 2.734 -31.952 -2.316 95 HB2 TYR 16 HB2 TYR 16 1.246 -33.522 -3.764 96 HB3 TYR 16 HB3 TYR 16 1.101 -31.780 -3.964 97 HD1 TYR 16 HD1 TYR 16 2.580 -34.837 -5.441 98 HD2 TYR 16 HD2 TYR 16 1.565 -30.749 -6.042 99 HE1 TYR 16 HE1 TYR 16 3.044 -35.081 -7.844 100 HE2 TYR 16 HE2 TYR 16 2.024 -30.983 -8.447 101 HH TYR 16 HH TYR 16 2.324 -32.519 -10.124 102 H ILE 17 H ILE 17 1.954 -34.425 -2.106 103 HA ILE 17 HA ILE 17 4.386 -36.076 -2.328 104 HB ILE 17 HB ILE 17 4.122 -35.582 -0.017 105 HG12 ILE 17 HG12 ILE 17 2.891 -38.301 -0.515 106 HG13 ILE 17 HG13 ILE 17 4.613 -37.946 -0.586 107 HG21 ILE 17 HG21 ILE 17 1.637 -36.612 0.749 108 HG22 ILE 17 HG22 ILE 17 2.143 -34.923 0.742 109 HG23 ILE 17 HG23 ILE 17 1.322 -35.603 -0.663 110 HD11 ILE 17 HD11 ILE 17 2.871 -38.382 1.720 111 HD12 ILE 17 HD12 ILE 17 4.607 -38.632 1.538 112 HD13 ILE 17 HD13 ILE 17 3.980 -37.021 1.884 113 H ARG 18 H ARG 18 4.167 -37.896 -3.445 114 HA ARG 18 HA ARG 18 1.448 -38.942 -3.890 115 HB2 ARG 18 HB2 ARG 18 3.691 -38.431 -5.715 116 HB3 ARG 18 HB3 ARG 18 2.959 -40.019 -5.908 117 HG2 ARG 18 HG2 ARG 18 0.731 -38.587 -5.868 118 HG3 ARG 18 HG3 ARG 18 1.833 -37.330 -6.435 119 HD2 ARG 18 HD2 ARG 18 2.169 -39.905 -7.781 120 HD3 ARG 18 HD3 ARG 18 0.581 -39.177 -8.018 121 HE ARG 18 HE ARG 18 2.702 -37.312 -8.438 122 HH11 ARG 18 HH11 ARG 18 0.900 -39.901 -9.910 123 HH12 ARG 18 HH12 ARG 18 1.193 -39.359 -11.529 124 HH21 ARG 18 HH21 ARG 18 3.095 -36.588 -10.565 125 HH22 ARG 18 HH22 ARG 18 2.442 -37.475 -11.900 126 H VAL 19 H VAL 19 1.194 -40.601 -2.523 127 HA VAL 19 HA VAL 19 3.013 -42.860 -2.757 128 HB VAL 19 HB VAL 19 3.005 -43.119 -0.221 129 HG11 VAL 19 HG11 VAL 19 4.554 -40.786 -1.338 130 HG12 VAL 19 HG12 VAL 19 4.998 -41.791 0.043 131 HG13 VAL 19 HG13 VAL 19 4.977 -42.481 -1.580 132 HG21 VAL 19 HG21 VAL 19 2.271 -40.199 -0.403 133 HG22 VAL 19 HG22 VAL 19 1.302 -41.486 0.316 134 HG23 VAL 19 HG23 VAL 19 2.830 -41.014 1.058 135 H THR 20 H THR 20 2.105 -44.845 -2.076 136 HA THR 20 HA THR 20 -0.804 -44.753 -1.604 137 HB THR 20 HB THR 20 -0.649 -45.568 -3.793 138 HG1 THR 20 HG1 THR 20 -0.519 -47.981 -2.298 139 HG21 THR 20 HG21 THR 20 1.923 -46.608 -2.882 140 HG22 THR 20 HG22 THR 20 1.410 -46.114 -4.496 141 HG23 THR 20 HG23 THR 20 1.041 -47.736 -3.910 142 H GLU 21 H GLU 21 -1.682 -46.247 -0.187 143 HA GLU 21 HA GLU 21 0.059 -47.189 1.866 144 HB2 GLU 21 HB2 GLU 21 -2.395 -46.402 2.058 145 HB3 GLU 21 HB3 GLU 21 -2.808 -48.034 1.554 146 HG2 GLU 21 HG2 GLU 21 -0.908 -48.249 3.633 147 HG3 GLU 21 HG3 GLU 21 -2.126 -47.081 4.141 148 H ASP 22 H ASP 22 -1.941 -48.808 -0.585 149 HA ASP 22 HA ASP 22 -0.557 -51.328 0.016 150 HB2 ASP 22 HB2 ASP 22 -3.259 -50.637 -0.911 151 HB3 ASP 22 HB3 ASP 22 -2.522 -51.981 -1.779 152 H GLU 23 H GLU 23 0.480 -52.506 -1.582 153 HA GLU 23 HA GLU 23 1.759 -51.032 -3.612 154 HB2 GLU 23 HB2 GLU 23 2.736 -53.136 -4.304 155 HB3 GLU 23 HB3 GLU 23 2.719 -53.049 -2.549 156 HG2 GLU 23 HG2 GLU 23 0.393 -54.308 -2.940 157 HG3 GLU 23 HG3 GLU 23 1.263 -54.851 -4.374 158 H ASN 24 H ASN 24 -1.088 -53.077 -3.604 159 HA ASN 24 HA ASN 24 -1.340 -53.215 -6.448 160 HB2 ASN 24 HB2 ASN 24 -2.635 -54.365 -4.186 161 HB3 ASN 24 HB3 ASN 24 -3.869 -53.595 -5.179 162 HD21 ASN 24 HD21 ASN 24 -4.624 -54.692 -6.845 163 HD22 ASN 24 HD22 ASN 24 -3.892 -56.089 -7.551 164 H ASP 25 H ASP 25 -2.346 -50.987 -3.982 165 HA ASP 25 HA ASP 25 -4.299 -49.646 -5.613 166 HB2 ASP 25 HB2 ASP 25 -4.163 -49.767 -3.017 167 HB3 ASP 25 HB3 ASP 25 -3.023 -48.434 -3.180 168 H GLU 26 H GLU 26 -4.109 -47.666 -6.638 169 HA GLU 26 HA GLU 26 -1.564 -47.070 -7.745 170 HB2 GLU 26 HB2 GLU 26 -4.318 -46.164 -8.088 171 HB3 GLU 26 HB3 GLU 26 -3.148 -44.866 -8.275 172 HG2 GLU 26 HG2 GLU 26 -1.925 -46.381 -9.888 173 HG3 GLU 26 HG3 GLU 26 -3.349 -47.418 -9.841 174 HA PRO 27 HA PRO 27 0.105 -44.159 -4.917 175 HB2 PRO 27 HB2 PRO 27 1.423 -42.486 -6.601 176 HB3 PRO 27 HB3 PRO 27 1.980 -44.125 -6.245 177 HG2 PRO 27 HG2 PRO 27 0.447 -43.118 -8.611 178 HG3 PRO 27 HG3 PRO 27 1.813 -44.249 -8.561 179 HD2 PRO 27 HD2 PRO 27 -0.754 -45.074 -8.819 180 HD3 PRO 27 HD3 PRO 27 0.477 -46.032 -7.970 181 H ILE 28 H ILE 28 -1.545 -43.016 -3.978 182 HA ILE 28 HA ILE 28 -3.029 -41.014 -5.406 183 HB ILE 28 HB ILE 28 -4.077 -42.275 -3.589 184 HG12 ILE 28 HG12 ILE 28 -5.058 -40.349 -2.365 185 HG13 ILE 28 HG13 ILE 28 -3.790 -39.317 -3.017 186 HG21 ILE 28 HG21 ILE 28 -2.272 -42.658 -2.100 187 HG22 ILE 28 HG22 ILE 28 -1.991 -40.930 -1.890 188 HG23 ILE 28 HG23 ILE 28 -3.446 -41.674 -1.227 189 HD11 ILE 28 HD11 ILE 28 -5.336 -40.829 -5.006 190 HD12 ILE 28 HD12 ILE 28 -6.224 -39.592 -4.116 191 HD13 ILE 28 HD13 ILE 28 -4.778 -39.156 -5.025 192 H GLU 29 H GLU 29 -2.869 -38.807 -5.268 193 HA GLU 29 HA GLU 29 -0.378 -37.791 -4.086 194 HB2 GLU 29 HB2 GLU 29 -0.414 -36.039 -5.684 195 HB3 GLU 29 HB3 GLU 29 -0.805 -37.510 -6.564 196 HG2 GLU 29 HG2 GLU 29 -2.443 -36.240 -7.418 197 HG3 GLU 29 HG3 GLU 29 -3.279 -36.685 -5.932 198 H ILE 30 H ILE 30 -0.397 -36.256 -2.541 199 HA ILE 30 HA ILE 30 -2.990 -35.056 -1.827 200 HB ILE 30 HB ILE 30 -1.472 -35.172 0.528 201 HG12 ILE 30 HG12 ILE 30 -1.618 -37.907 -0.752 202 HG13 ILE 30 HG13 ILE 30 -0.144 -36.948 -0.669 203 HG21 ILE 30 HG21 ILE 30 -3.979 -36.337 -0.526 204 HG22 ILE 30 HG22 ILE 30 -3.328 -37.042 0.953 205 HG23 ILE 30 HG23 ILE 30 -3.706 -35.320 0.889 206 HD11 ILE 30 HD11 ILE 30 -1.712 -38.115 1.610 207 HD12 ILE 30 HD12 ILE 30 -0.068 -38.508 1.103 208 HD13 ILE 30 HD13 ILE 30 -0.418 -36.936 1.823 209 HA PRO 31 HA PRO 31 -0.933 -31.173 -1.958 210 HB2 PRO 31 HB2 PRO 31 -2.469 -29.767 -0.217 211 HB3 PRO 31 HB3 PRO 31 -3.020 -30.220 -1.834 212 HG2 PRO 31 HG2 PRO 31 -3.601 -31.521 0.799 213 HG3 PRO 31 HG3 PRO 31 -4.702 -31.181 -0.548 214 HD2 PRO 31 HD2 PRO 31 -3.643 -33.635 -0.116 215 HD3 PRO 31 HD3 PRO 31 -4.013 -33.028 -1.743 216 H SER 32 H SER 32 1.040 -30.990 -1.086 217 HA SER 32 HA SER 32 1.416 -31.412 1.778 218 HB2 SER 32 HB2 SER 32 3.601 -31.908 1.317 219 HB3 SER 32 HB3 SER 32 2.927 -32.246 -0.278 220 HG SER 32 HG SER 32 4.559 -30.172 0.561 221 H GLU 33 H GLU 33 3.419 -29.855 2.516 222 HA GLU 33 HA GLU 33 2.230 -27.201 2.485 223 HB2 GLU 33 HB2 GLU 33 3.872 -28.737 4.315 224 HB3 GLU 33 HB3 GLU 33 4.536 -27.129 4.062 225 HG2 GLU 33 HG2 GLU 33 1.743 -26.856 4.426 226 HG3 GLU 33 HG3 GLU 33 2.354 -27.919 5.693 227 H ASP 34 H ASP 34 3.934 -25.347 2.573 228 HA ASP 34 HA ASP 34 5.237 -25.326 0.028 229 HB2 ASP 34 HB2 ASP 34 5.864 -23.031 0.592 230 HB3 ASP 34 HB3 ASP 34 4.165 -23.314 0.961 231 H ASP 35 H ASP 35 6.279 -25.617 3.371 232 HA ASP 35 HA ASP 35 9.042 -25.279 2.950 233 HB2 ASP 35 HB2 ASP 35 7.302 -26.154 5.113 234 HB3 ASP 35 HB3 ASP 35 8.817 -27.052 5.080 235 H GLY 36 H GLY 36 6.918 -27.868 2.205 236 HA2 GLY 36 HA2 GLY 36 7.819 -29.471 0.560 237 HA3 GLY 36 HA3 GLY 36 9.251 -29.571 1.575 238 H THR 37 H THR 37 7.658 -29.582 4.051 239 HA THR 37 HA THR 37 7.308 -32.400 4.263 240 HB THR 37 HB THR 37 6.668 -32.007 6.559 241 HG1 THR 37 HG1 THR 37 6.658 -29.566 7.092 242 HG21 THR 37 HG21 THR 37 9.087 -31.435 5.570 243 HG22 THR 37 HG22 THR 37 8.699 -31.276 7.283 244 HG23 THR 37 HG23 THR 37 8.682 -29.855 6.239 245 H VAL 38 H VAL 38 5.126 -32.859 5.776 246 HA VAL 38 HA VAL 38 2.817 -31.891 4.244 247 HB VAL 38 HB VAL 38 3.484 -34.786 4.775 248 HG11 VAL 38 HG11 VAL 38 1.272 -35.260 3.713 249 HG12 VAL 38 HG12 VAL 38 1.169 -34.522 5.313 250 HG13 VAL 38 HG13 VAL 38 0.891 -33.546 3.869 251 HG21 VAL 38 HG21 VAL 38 2.698 -33.587 2.147 252 HG22 VAL 38 HG22 VAL 38 4.360 -33.468 2.723 253 HG23 VAL 38 HG23 VAL 38 3.625 -35.052 2.474 254 H LEU 39 H LEU 39 1.071 -31.446 5.456 255 HA LEU 39 HA LEU 39 1.275 -31.471 8.286 256 HB2 LEU 39 HB2 LEU 39 -1.016 -30.899 6.421 257 HB3 LEU 39 HB3 LEU 39 -1.139 -30.749 8.173 258 HG LEU 39 HG LEU 39 0.665 -29.144 6.364 259 HD11 LEU 39 HD11 LEU 39 -1.308 -28.087 6.043 260 HD12 LEU 39 HD12 LEU 39 -0.891 -27.349 7.589 261 HD13 LEU 39 HD13 LEU 39 -2.013 -28.709 7.535 262 HD21 LEU 39 HD21 LEU 39 0.383 -29.276 9.348 263 HD22 LEU 39 HD22 LEU 39 0.965 -27.822 8.538 264 HD23 LEU 39 HD23 LEU 39 1.849 -29.339 8.370 265 H LEU 40 H LEU 40 0.536 -32.877 9.769 266 HA LEU 40 HA LEU 40 0.032 -35.520 9.202 267 HB2 LEU 40 HB2 LEU 40 0.432 -34.185 11.456 268 HB3 LEU 40 HB3 LEU 40 -1.320 -34.336 11.569 269 HG LEU 40 HG LEU 40 0.685 -36.586 11.434 270 HD11 LEU 40 HD11 LEU 40 -1.226 -36.395 13.649 271 HD12 LEU 40 HD12 LEU 40 -0.035 -35.096 13.588 272 HD13 LEU 40 HD13 LEU 40 0.496 -36.776 13.659 273 HD21 LEU 40 HD21 LEU 40 -1.100 -37.494 10.296 274 HD22 LEU 40 HD22 LEU 40 -2.290 -36.531 11.173 275 HD23 LEU 40 HD23 LEU 40 -1.505 -37.899 11.964 276 H SER 41 H SER 41 -2.279 -32.875 9.536 277 HA SER 41 HA SER 41 -4.653 -34.310 9.561 278 HB2 SER 41 HB2 SER 41 -4.174 -31.658 8.182 279 HB3 SER 41 HB3 SER 41 -5.727 -32.284 8.735 280 HG SER 41 HG SER 41 -5.240 -31.250 10.500 281 H THR 42 H THR 42 -2.574 -33.442 6.866 282 HA THR 42 HA THR 42 -4.384 -34.241 4.817 283 HB THR 42 HB THR 42 -1.374 -33.972 4.695 284 HG1 THR 42 HG1 THR 42 -3.191 -32.081 3.671 285 HG21 THR 42 HG21 THR 42 -1.906 -33.566 2.234 286 HG22 THR 42 HG22 THR 42 -3.488 -34.270 2.575 287 HG23 THR 42 HG23 THR 42 -2.026 -35.228 2.809 288 H VAL 43 H VAL 43 -1.812 -35.852 6.603 289 HA VAL 43 HA VAL 43 -1.664 -38.186 5.028 290 HB VAL 43 HB VAL 43 -0.894 -37.545 7.851 291 HG11 VAL 43 HG11 VAL 43 -1.116 -40.254 6.610 292 HG12 VAL 43 HG12 VAL 43 0.169 -39.917 7.772 293 HG13 VAL 43 HG13 VAL 43 -1.521 -39.734 8.245 294 HG21 VAL 43 HG21 VAL 43 0.500 -38.118 5.271 295 HG22 VAL 43 HG22 VAL 43 0.733 -36.782 6.398 296 HG23 VAL 43 HG23 VAL 43 1.336 -38.390 6.800 297 H THR 44 H THR 44 -3.719 -37.267 7.732 298 HA THR 44 HA THR 44 -4.875 -39.860 8.075 299 HB THR 44 HB THR 44 -6.433 -38.811 9.587 300 HG1 THR 44 HG1 THR 44 -6.686 -36.601 9.677 301 HG21 THR 44 HG21 THR 44 -4.798 -38.694 11.094 302 HG22 THR 44 HG22 THR 44 -4.345 -37.099 10.493 303 HG23 THR 44 HG23 THR 44 -3.615 -38.544 9.795 304 H ALA 45 H ALA 45 -5.578 -37.069 6.111 305 HA ALA 45 HA ALA 45 -8.232 -37.381 5.486 306 HB1 ALA 45 HB1 ALA 45 -6.715 -35.571 4.674 307 HB2 ALA 45 HB2 ALA 45 -6.102 -36.701 3.467 308 HB3 ALA 45 HB3 ALA 45 -7.799 -36.221 3.444 309 H GLN 46 H GLN 46 -5.472 -39.020 3.953 310 HA GLN 46 HA GLN 46 -7.356 -40.837 2.622 311 HB2 GLN 46 HB2 GLN 46 -4.428 -40.837 2.029 312 HB3 GLN 46 HB3 GLN 46 -5.782 -41.196 0.966 313 HG2 GLN 46 HG2 GLN 46 -6.357 -38.825 0.891 314 HG3 GLN 46 HG3 GLN 46 -5.000 -38.464 1.958 315 HE21 GLN 46 HE21 GLN 46 -3.045 -40.068 0.922 316 HE22 GLN 46 HE22 GLN 46 -2.649 -39.549 -0.677 317 H PHE 47 H PHE 47 -4.643 -40.715 4.838 318 HA PHE 47 HA PHE 47 -4.970 -43.603 5.321 319 HB2 PHE 47 HB2 PHE 47 -2.491 -42.128 6.123 320 HB3 PHE 47 HB3 PHE 47 -2.695 -43.831 5.727 321 HD1 PHE 47 HD1 PHE 47 -3.906 -43.860 3.141 322 HD2 PHE 47 HD2 PHE 47 -0.968 -41.195 4.684 323 HE1 PHE 47 HE1 PHE 47 -3.106 -43.424 0.855 324 HE2 PHE 47 HE2 PHE 47 -0.164 -40.754 2.401 325 HZ PHE 47 HZ PHE 47 -1.234 -41.869 0.482 326 HA PRO 48 HA PRO 48 -6.387 -41.379 9.128 327 HB2 PRO 48 HB2 PRO 48 -8.520 -43.003 9.556 328 HB3 PRO 48 HB3 PRO 48 -8.586 -41.589 8.497 329 HG2 PRO 48 HG2 PRO 48 -8.241 -44.476 7.783 330 HG3 PRO 48 HG3 PRO 48 -9.253 -43.244 7.005 331 HD2 PRO 48 HD2 PRO 48 -6.850 -43.997 6.009 332 HD3 PRO 48 HD3 PRO 48 -7.481 -42.346 5.836 333 H GLY 49 H GLY 49 -5.498 -41.908 11.023 334 HA2 GLY 49 HA2 GLY 49 -5.105 -43.301 12.882 335 HA3 GLY 49 HA3 GLY 49 -5.455 -44.701 11.879 336 H ALA 50 H ALA 50 -3.639 -43.697 9.746 337 HA ALA 50 HA ALA 50 -1.363 -45.139 10.342 338 HB1 ALA 50 HB1 ALA 50 -1.599 -42.795 8.459 339 HB2 ALA 50 HB2 ALA 50 -0.306 -43.995 8.453 340 HB3 ALA 50 HB3 ALA 50 -1.960 -44.478 8.076 341 H CYS 51 H CYS 51 -0.104 -44.814 12.066 342 HA CYS 51 HA CYS 51 0.358 -42.221 13.187 343 HB2 CYS 51 HB2 CYS 51 0.778 -44.953 13.961 344 HB3 CYS 51 HB3 CYS 51 2.271 -44.050 14.189 345 HG CYS 51 HG CYS 51 -0.365 -42.397 15.354 346 H GLY 52 H GLY 52 2.094 -44.374 11.036 347 HA2 GLY 52 HA2 GLY 52 3.900 -42.204 10.347 348 HA3 GLY 52 HA3 GLY 52 4.661 -43.619 11.057 349 H LEU 53 H LEU 53 5.053 -42.528 8.404 350 HA LEU 53 HA LEU 53 4.016 -44.756 6.777 351 HB2 LEU 53 HB2 LEU 53 5.020 -42.137 5.702 352 HB3 LEU 53 HB3 LEU 53 4.074 -43.367 4.868 353 HG LEU 53 HG LEU 53 2.512 -41.710 5.225 354 HD11 LEU 53 HD11 LEU 53 0.938 -42.794 6.401 355 HD12 LEU 53 HD12 LEU 53 1.931 -42.874 7.856 356 HD13 LEU 53 HD13 LEU 53 2.172 -44.044 6.559 357 HD21 LEU 53 HD21 LEU 53 3.314 -41.254 8.072 358 HD22 LEU 53 HD22 LEU 53 2.453 -40.182 6.968 359 HD23 LEU 53 HD23 LEU 53 4.182 -40.463 6.756 360 H ARG 54 H ARG 54 5.418 -45.895 5.469 361 HA ARG 54 HA ARG 54 8.271 -45.484 6.050 362 HB2 ARG 54 HB2 ARG 54 6.799 -47.738 6.382 363 HB3 ARG 54 HB3 ARG 54 7.411 -47.994 4.753 364 HG2 ARG 54 HG2 ARG 54 9.674 -47.234 6.016 365 HG3 ARG 54 HG3 ARG 54 8.814 -48.039 7.331 366 HD2 ARG 54 HD2 ARG 54 8.792 -49.452 4.749 367 HD3 ARG 54 HD3 ARG 54 10.372 -49.310 5.519 368 HE ARG 54 HE ARG 54 8.701 -50.173 7.505 369 HH11 ARG 54 HH11 ARG 54 9.588 -51.318 4.339 370 HH12 ARG 54 HH12 ARG 54 9.363 -52.989 4.737 371 HH21 ARG 54 HH21 ARG 54 8.400 -52.370 8.041 372 HH22 ARG 54 HH22 ARG 54 8.686 -53.586 6.842 373 H TYR 55 H TYR 55 9.778 -46.131 4.268 374 HA TYR 55 HA TYR 55 8.786 -45.031 1.732 375 HB2 TYR 55 HB2 TYR 55 11.195 -44.652 3.243 376 HB3 TYR 55 HB3 TYR 55 11.604 -45.307 1.661 377 HD1 TYR 55 HD1 TYR 55 9.922 -44.119 -0.237 378 HD2 TYR 55 HD2 TYR 55 11.434 -42.368 3.334 379 HE1 TYR 55 HE1 TYR 55 9.666 -41.885 -1.232 380 HE2 TYR 55 HE2 TYR 55 11.180 -40.128 2.349 381 HH TYR 55 HH TYR 55 10.467 -39.660 -0.993 382 H ARG 56 H ARG 56 8.577 -46.291 0.005 383 HA ARG 56 HA ARG 56 10.046 -48.840 -0.072 384 HB2 ARG 56 HB2 ARG 56 7.619 -49.114 0.562 385 HB3 ARG 56 HB3 ARG 56 7.205 -48.487 -1.028 386 HG2 ARG 56 HG2 ARG 56 9.116 -50.695 -1.090 387 HG3 ARG 56 HG3 ARG 56 7.545 -51.117 -0.406 388 HD2 ARG 56 HD2 ARG 56 6.422 -50.672 -2.368 389 HD3 ARG 56 HD3 ARG 56 7.658 -49.555 -2.943 390 HE ARG 56 HE ARG 56 8.659 -51.312 -3.987 391 HH11 ARG 56 HH11 ARG 56 6.682 -52.548 -1.401 392 HH12 ARG 56 HH12 ARG 56 6.978 -54.210 -1.794 393 HH21 ARG 56 HH21 ARG 56 9.056 -53.496 -4.514 394 HH22 ARG 56 HH22 ARG 56 8.329 -54.747 -3.564 395 H ASN 57 H ASN 57 11.556 -48.221 -1.558 396 HA ASN 57 HA ASN 57 10.543 -47.314 -4.173 397 HB2 ASN 57 HB2 ASN 57 12.322 -45.986 -2.600 398 HB3 ASN 57 HB3 ASN 57 13.415 -46.945 -3.595 399 HD21 ASN 57 HD21 ASN 57 14.230 -45.284 -4.778 400 HD22 ASN 57 HD22 ASN 57 13.297 -44.359 -5.900 401 HA PRO 58 HA PRO 58 11.999 -51.105 -5.881 402 HB2 PRO 58 HB2 PRO 58 12.206 -50.337 -8.477 403 HB3 PRO 58 HB3 PRO 58 10.654 -50.630 -7.683 404 HG2 PRO 58 HG2 PRO 58 12.052 -48.036 -8.209 405 HG3 PRO 58 HG3 PRO 58 10.336 -48.440 -8.398 406 HD2 PRO 58 HD2 PRO 58 11.286 -47.086 -6.254 407 HD3 PRO 58 HD3 PRO 58 9.900 -48.190 -6.148 408 H VAL 59 H VAL 59 13.648 -48.185 -7.105 409 HA VAL 59 HA VAL 59 16.045 -49.544 -7.786 410 HB VAL 59 HB VAL 59 17.037 -47.320 -8.040 411 HG11 VAL 59 HG11 VAL 59 15.982 -47.004 -9.990 412 HG12 VAL 59 HG12 VAL 59 15.001 -48.394 -9.521 413 HG13 VAL 59 HG13 VAL 59 14.420 -46.757 -9.211 414 HG21 VAL 59 HG21 VAL 59 16.368 -45.766 -6.577 415 HG22 VAL 59 HG22 VAL 59 15.007 -45.509 -7.669 416 HG23 VAL 59 HG23 VAL 59 14.832 -46.579 -6.278 417 H SER 60 H SER 60 14.902 -47.931 -4.896 418 HA SER 60 HA SER 60 17.484 -47.992 -3.604 419 HB2 SER 60 HB2 SER 60 15.550 -46.290 -3.231 420 HB3 SER 60 HB3 SER 60 14.885 -47.528 -2.166 421 HG SER 60 HG SER 60 16.546 -45.778 -1.422 422 H GLN 61 H GLN 61 14.629 -49.975 -3.752 423 HA GLN 61 HA GLN 61 14.173 -52.062 -2.970 424 HB2 GLN 61 HB2 GLN 61 17.057 -52.231 -2.104 425 HB3 GLN 61 HB3 GLN 61 15.971 -53.556 -2.503 426 HG2 GLN 61 HG2 GLN 61 16.033 -51.971 -4.787 427 HG3 GLN 61 HG3 GLN 61 17.699 -52.013 -4.212 428 HE21 GLN 61 HE21 GLN 61 18.551 -53.331 -5.731 429 HE22 GLN 61 HE22 GLN 61 18.085 -54.978 -5.958 430 H CYS 62 H CYS 62 13.694 -49.858 -1.294 431 HA CYS 62 HA CYS 62 13.027 -49.419 0.836 432 HB2 CYS 62 HB2 CYS 62 13.792 -52.251 1.542 433 HB3 CYS 62 HB3 CYS 62 12.606 -51.223 2.337 434 HG CYS 62 HG CYS 62 10.794 -52.660 1.153 435 H MET 63 H MET 63 14.112 -48.217 2.247 436 HA MET 63 HA MET 63 16.251 -49.066 3.825 437 HB2 MET 63 HB2 MET 63 17.042 -48.413 1.179 438 HB3 MET 63 HB3 MET 63 17.622 -47.127 2.228 439 HG2 MET 63 HG2 MET 63 18.326 -49.311 3.661 440 HG3 MET 63 HG3 MET 63 18.472 -49.924 2.016 441 HE1 MET 63 HE1 MET 63 21.145 -50.312 2.646 442 HE2 MET 63 HE2 MET 63 22.147 -49.003 3.271 443 HE3 MET 63 HE3 MET 63 20.797 -49.616 4.229 444 H ARG 64 H ARG 64 14.661 -46.390 2.200 445 HA ARG 64 HA ARG 64 15.403 -44.523 4.301 446 HB2 ARG 64 HB2 ARG 64 14.486 -44.329 1.574 447 HB3 ARG 64 HB3 ARG 64 13.470 -43.351 2.625 448 HG2 ARG 64 HG2 ARG 64 16.363 -43.084 3.071 449 HG3 ARG 64 HG3 ARG 64 15.772 -42.499 1.515 450 HD2 ARG 64 HD2 ARG 64 14.141 -41.090 2.647 451 HD3 ARG 64 HD3 ARG 64 14.677 -41.704 4.210 452 HE ARG 64 HE ARG 64 15.982 -39.719 2.580 453 HH11 ARG 64 HH11 ARG 64 16.360 -42.060 5.129 454 HH12 ARG 64 HH12 ARG 64 17.757 -41.290 5.807 455 HH21 ARG 64 HH21 ARG 64 17.820 -38.696 3.463 456 HH22 ARG 64 HH22 ARG 64 18.585 -39.376 4.859 457 H GLY 65 H GLY 65 13.288 -42.966 4.726 458 HA2 GLY 65 HA2 GLY 65 10.833 -44.333 5.161 459 HA3 GLY 65 HA3 GLY 65 11.780 -44.284 6.641 460 H VAL 66 H VAL 66 9.361 -42.785 5.071 461 HA VAL 66 HA VAL 66 9.827 -40.073 5.119 462 HB VAL 66 HB VAL 66 7.278 -41.499 5.894 463 HG11 VAL 66 HG11 VAL 66 7.707 -38.637 5.039 464 HG12 VAL 66 HG12 VAL 66 6.145 -39.408 5.325 465 HG13 VAL 66 HG13 VAL 66 7.275 -39.180 6.660 466 HG21 VAL 66 HG21 VAL 66 8.604 -40.925 3.337 467 HG22 VAL 66 HG22 VAL 66 7.407 -42.154 3.745 468 HG23 VAL 66 HG23 VAL 66 6.892 -40.504 3.397 469 H ARG 67 H ARG 67 10.640 -38.859 6.688 470 HA ARG 67 HA ARG 67 10.599 -39.613 9.430 471 HB2 ARG 67 HB2 ARG 67 12.448 -38.319 8.592 472 HB3 ARG 67 HB3 ARG 67 11.371 -37.034 8.063 473 HG2 ARG 67 HG2 ARG 67 12.471 -36.335 10.064 474 HG3 ARG 67 HG3 ARG 67 10.771 -36.632 10.436 475 HD2 ARG 67 HD2 ARG 67 11.867 -39.073 10.924 476 HD3 ARG 67 HD3 ARG 67 13.186 -38.000 11.391 477 HE ARG 67 HE ARG 67 10.729 -37.133 12.510 478 HH11 ARG 67 HH11 ARG 67 13.220 -39.540 12.851 479 HH12 ARG 67 HH12 ARG 67 12.954 -39.763 14.548 480 HH21 ARG 67 HH21 ARG 67 10.369 -37.417 14.744 481 HH22 ARG 67 HH22 ARG 67 11.332 -38.556 15.624 482 H LEU 68 H LEU 68 9.386 -38.859 11.119 483 HA LEU 68 HA LEU 68 7.187 -37.013 10.469 484 HB2 LEU 68 HB2 LEU 68 6.259 -39.225 10.549 485 HB3 LEU 68 HB3 LEU 68 7.064 -39.554 12.082 486 HG LEU 68 HG LEU 68 4.524 -39.036 12.049 487 HD11 LEU 68 HD11 LEU 68 5.619 -37.293 14.082 488 HD12 LEU 68 HD12 LEU 68 6.527 -38.799 13.948 489 HD13 LEU 68 HD13 LEU 68 4.789 -38.841 14.247 490 HD21 LEU 68 HD21 LEU 68 5.229 -36.814 10.740 491 HD22 LEU 68 HD22 LEU 68 5.303 -36.203 12.393 492 HD23 LEU 68 HD23 LEU 68 3.806 -36.905 11.778 493 H VAL 69 H VAL 69 7.255 -35.254 11.685 494 HA VAL 69 HA VAL 69 8.093 -35.476 14.486 495 HB VAL 69 HB VAL 69 10.094 -34.717 13.419 496 HG11 VAL 69 HG11 VAL 69 8.259 -33.368 11.668 497 HG12 VAL 69 HG12 VAL 69 9.466 -32.235 12.280 498 HG13 VAL 69 HG13 VAL 69 9.975 -33.703 11.446 499 HG21 VAL 69 HG21 VAL 69 8.880 -33.377 15.439 500 HG22 VAL 69 HG22 VAL 69 10.519 -33.053 14.875 501 HG23 VAL 69 HG23 VAL 69 9.177 -32.066 14.297 502 H GLU 70 H GLU 70 6.564 -34.644 15.734 503 HA GLU 70 HA GLU 70 4.862 -33.349 16.511 504 HB2 GLU 70 HB2 GLU 70 5.636 -31.329 14.409 505 HB3 GLU 70 HB3 GLU 70 4.811 -31.033 15.933 506 HG2 GLU 70 HG2 GLU 70 7.187 -32.238 16.679 507 HG3 GLU 70 HG3 GLU 70 7.639 -31.170 15.352 508 H GLY 71 H GLY 71 4.499 -35.206 14.232 509 HA2 GLY 71 HA2 GLY 71 2.484 -35.899 13.252 510 HA3 GLY 71 HA3 GLY 71 1.841 -34.279 13.480 511 H ILE 72 H ILE 72 4.314 -33.117 12.256 512 HA ILE 72 HA ILE 72 3.362 -33.142 9.543 513 HB ILE 72 HB ILE 72 5.772 -31.769 10.739 514 HG12 ILE 72 HG12 ILE 72 3.692 -29.984 9.938 515 HG13 ILE 72 HG13 ILE 72 2.982 -31.232 10.957 516 HG21 ILE 72 HG21 ILE 72 4.627 -31.842 8.002 517 HG22 ILE 72 HG22 ILE 72 5.247 -30.302 8.595 518 HG23 ILE 72 HG23 ILE 72 6.306 -31.710 8.525 519 HD11 ILE 72 HD11 ILE 72 5.015 -29.168 11.622 520 HD12 ILE 72 HD12 ILE 72 3.580 -29.672 12.514 521 HD13 ILE 72 HD13 ILE 72 5.017 -30.693 12.506 522 H LEU 73 H LEU 73 3.928 -34.610 8.091 523 HA LEU 73 HA LEU 73 6.159 -36.366 8.498 524 HB2 LEU 73 HB2 LEU 73 4.137 -36.035 6.304 525 HB3 LEU 73 HB3 LEU 73 5.483 -37.163 6.163 526 HG LEU 73 HG LEU 73 3.515 -38.363 6.835 527 HD11 LEU 73 HD11 LEU 73 4.304 -39.397 8.879 528 HD12 LEU 73 HD12 LEU 73 5.354 -38.018 9.199 529 HD13 LEU 73 HD13 LEU 73 5.661 -39.055 7.806 530 HD21 LEU 73 HD21 LEU 73 3.317 -36.834 9.390 531 HD22 LEU 73 HD22 LEU 73 2.093 -37.785 8.549 532 HD23 LEU 73 HD23 LEU 73 2.553 -36.196 7.934 533 H HIS 74 H HIS 74 8.142 -35.531 8.254 534 HA HIS 74 HA HIS 74 8.736 -33.499 6.315 535 HB2 HIS 74 HB2 HIS 74 9.919 -34.394 8.669 536 HB3 HIS 74 HB3 HIS 74 11.058 -34.866 7.412 537 HD1 HIS 74 HD1 HIS 74 11.349 -32.655 5.590 538 HD2 HIS 74 HD2 HIS 74 10.562 -31.957 9.609 539 HE1 HIS 74 HE1 HIS 74 12.103 -30.295 6.023 540 H ALA 75 H ALA 75 10.128 -33.684 4.521 541 HA ALA 75 HA ALA 75 10.148 -36.372 3.338 542 HB1 ALA 75 HB1 ALA 75 10.085 -33.618 2.176 543 HB2 ALA 75 HB2 ALA 75 10.674 -34.974 1.214 544 HB3 ALA 75 HB3 ALA 75 9.031 -34.995 1.854 545 HA PRO 76 HA PRO 76 14.522 -36.717 3.453 546 HB2 PRO 76 HB2 PRO 76 15.033 -37.994 1.112 547 HB3 PRO 76 HB3 PRO 76 14.272 -38.790 2.495 548 HG2 PRO 76 HG2 PRO 76 13.005 -37.647 0.036 549 HG3 PRO 76 HG3 PRO 76 12.656 -39.174 0.868 550 HD2 PRO 76 HD2 PRO 76 11.123 -36.963 1.175 551 HD3 PRO 76 HD3 PRO 76 11.364 -38.146 2.476 552 H ASP 77 H ASP 77 16.473 -36.558 1.722 553 HA ASP 77 HA ASP 77 16.498 -33.791 0.937 554 HB2 ASP 77 HB2 ASP 77 18.494 -35.986 1.133 555 HB3 ASP 77 HB3 ASP 77 18.848 -34.680 0.006 556 H ALA 78 H ALA 78 15.269 -36.447 -0.514 557 HA ALA 78 HA ALA 78 16.006 -35.581 -3.228 558 HB1 ALA 78 HB1 ALA 78 16.366 -37.764 -3.509 559 HB2 ALA 78 HB2 ALA 78 15.515 -38.181 -2.021 560 HB3 ALA 78 HB3 ALA 78 14.610 -37.937 -3.515 561 H GLY 79 H GLY 79 13.325 -36.090 -1.034 562 HA2 GLY 79 HA2 GLY 79 11.467 -34.459 -1.449 563 HA3 GLY 79 HA3 GLY 79 11.502 -35.038 -3.108 564 H TRP 80 H TRP 80 9.192 -35.433 -2.660 565 HA TRP 80 HA TRP 80 8.560 -37.630 -0.885 566 HB2 TRP 80 HB2 TRP 80 6.924 -35.876 -2.706 567 HB3 TRP 80 HB3 TRP 80 6.230 -37.292 -1.922 568 HD1 TRP 80 HD1 TRP 80 6.413 -33.740 -1.417 569 HE1 TRP 80 HE1 TRP 80 6.096 -33.094 1.054 570 HE3 TRP 80 HE3 TRP 80 7.153 -38.324 0.720 571 HZ2 TRP 80 HZ2 TRP 80 6.153 -34.361 3.576 572 HZ3 TRP 80 HZ3 TRP 80 7.005 -38.522 3.168 573 HH2 TRP 80 HH2 TRP 80 6.516 -36.580 4.565 574 H GLY 81 H GLY 81 8.098 -37.034 -4.379 575 HA2 GLY 81 HA2 GLY 81 8.561 -38.511 -6.131 576 HA3 GLY 81 HA3 GLY 81 8.906 -39.767 -4.951 577 H ASN 82 H ASN 82 7.618 -40.951 -6.679 578 HA ASN 82 HA ASN 82 4.774 -40.874 -5.922 579 HB2 ASN 82 HB2 ASN 82 5.801 -41.538 -8.687 580 HB3 ASN 82 HB3 ASN 82 4.120 -41.364 -8.190 581 HD21 ASN 82 HD21 ASN 82 5.263 -39.970 -10.316 582 HD22 ASN 82 HD22 ASN 82 5.283 -38.288 -9.922 583 H LEU 83 H LEU 83 6.928 -42.489 -4.846 584 HA LEU 83 HA LEU 83 6.535 -45.146 -5.940 585 HB2 LEU 83 HB2 LEU 83 8.289 -45.834 -4.607 586 HB3 LEU 83 HB3 LEU 83 8.714 -44.163 -4.975 587 HG LEU 83 HG LEU 83 7.481 -45.129 -2.394 588 HD11 LEU 83 HD11 LEU 83 10.079 -45.447 -3.235 589 HD12 LEU 83 HD12 LEU 83 9.526 -45.426 -1.561 590 HD13 LEU 83 HD13 LEU 83 10.139 -43.950 -2.305 591 HD21 LEU 83 HD21 LEU 83 8.530 -42.419 -3.207 592 HD22 LEU 83 HD22 LEU 83 7.981 -42.869 -1.592 593 HD23 LEU 83 HD23 LEU 83 6.839 -42.844 -2.937 594 H VAL 84 H VAL 84 6.576 -46.745 -3.721 595 HA VAL 84 HA VAL 84 3.880 -46.317 -2.660 596 HB VAL 84 HB VAL 84 5.528 -48.822 -2.374 597 HG11 VAL 84 HG11 VAL 84 3.781 -49.261 -1.027 598 HG12 VAL 84 HG12 VAL 84 2.777 -48.001 -1.748 599 HG13 VAL 84 HG13 VAL 84 2.928 -49.570 -2.539 600 HG21 VAL 84 HG21 VAL 84 3.832 -47.902 -4.672 601 HG22 VAL 84 HG22 VAL 84 5.465 -48.566 -4.700 602 HG23 VAL 84 HG23 VAL 84 4.093 -49.615 -4.344 603 H TYR 85 H TYR 85 3.433 -46.752 -0.411 604 HA TYR 85 HA TYR 85 5.752 -46.444 1.370 605 HB2 TYR 85 HB2 TYR 85 4.957 -44.568 2.380 606 HB3 TYR 85 HB3 TYR 85 4.169 -44.335 0.823 607 HD1 TYR 85 HD1 TYR 85 3.660 -45.478 4.298 608 HD2 TYR 85 HD2 TYR 85 1.798 -44.436 0.617 609 HE1 TYR 85 HE1 TYR 85 1.471 -45.454 5.419 610 HE2 TYR 85 HE2 TYR 85 -0.396 -44.408 1.728 611 HH TYR 85 HH TYR 85 -1.500 -45.186 3.642 612 H VAL 86 H VAL 86 5.553 -47.370 3.412 613 HA VAL 86 HA VAL 86 3.309 -49.258 3.680 614 HB VAL 86 HB VAL 86 6.049 -49.408 4.947 615 HG11 VAL 86 HG11 VAL 86 3.765 -51.378 4.923 616 HG12 VAL 86 HG12 VAL 86 5.375 -51.686 5.575 617 HG13 VAL 86 HG13 VAL 86 4.341 -50.463 6.315 618 HG21 VAL 86 HG21 VAL 86 5.047 -50.241 2.351 619 HG22 VAL 86 HG22 VAL 86 6.705 -50.148 2.945 620 HG23 VAL 86 HG23 VAL 86 5.730 -51.581 3.272 621 H VAL 87 H VAL 87 1.833 -48.733 5.138 622 HA VAL 87 HA VAL 87 2.019 -46.619 6.946 623 HB VAL 87 HB VAL 87 0.053 -47.752 8.106 624 HG11 VAL 87 HG11 VAL 87 -0.055 -47.191 5.145 625 HG12 VAL 87 HG12 VAL 87 -1.468 -47.324 6.193 626 HG13 VAL 87 HG13 VAL 87 -0.293 -46.035 6.455 627 HG21 VAL 87 HG21 VAL 87 -0.860 -49.712 7.282 628 HG22 VAL 87 HG22 VAL 87 -0.015 -49.581 5.740 629 HG23 VAL 87 HG23 VAL 87 0.870 -50.044 7.194 630 H ASN 88 H ASN 88 1.874 -46.745 9.329 631 HA ASN 88 HA ASN 88 3.179 -49.055 10.539 632 HB2 ASN 88 HB2 ASN 88 4.832 -47.128 9.782 633 HB3 ASN 88 HB3 ASN 88 4.275 -46.375 11.274 634 HD21 ASN 88 HD21 ASN 88 6.279 -46.541 12.246 635 HD22 ASN 88 HD22 ASN 88 6.924 -48.050 12.788 636 H TYR 89 H TYR 89 1.976 -49.598 12.223 637 HA TYR 89 HA TYR 89 0.640 -47.459 13.749 638 HB2 TYR 89 HB2 TYR 89 -0.296 -50.322 13.589 639 HB3 TYR 89 HB3 TYR 89 -1.183 -48.924 14.188 640 HD1 TYR 89 HD1 TYR 89 -2.008 -47.210 12.575 641 HD2 TYR 89 HD2 TYR 89 -0.292 -50.881 11.279 642 HE1 TYR 89 HE1 TYR 89 -3.005 -46.884 10.350 643 HE2 TYR 89 HE2 TYR 89 -1.283 -50.565 9.050 644 HH TYR 89 HH TYR 89 -3.353 -49.255 8.127 645 HA PRO 90 HA PRO 90 3.703 -49.610 16.525 646 HB2 PRO 90 HB2 PRO 90 4.784 -47.323 17.512 647 HB3 PRO 90 HB3 PRO 90 5.362 -48.098 16.033 648 HG2 PRO 90 HG2 PRO 90 3.513 -45.766 16.351 649 HG3 PRO 90 HG3 PRO 90 4.853 -45.984 15.210 650 HD2 PRO 90 HD2 PRO 90 2.265 -46.348 14.503 651 HD3 PRO 90 HD3 PRO 90 3.592 -47.280 13.781 652 H LYS 91 H LYS 91 1.961 -46.572 17.214 653 HA LYS 91 HA LYS 91 0.409 -47.733 19.287 654 HB2 LYS 91 HB2 LYS 91 2.425 -47.660 20.589 655 HB3 LYS 91 HB3 LYS 91 2.752 -46.005 20.092 656 HG2 LYS 91 HG2 LYS 91 0.883 -45.194 21.359 657 HG3 LYS 91 HG3 LYS 91 0.380 -46.841 21.747 658 HD2 LYS 91 HD2 LYS 91 2.957 -46.842 22.625 659 HD3 LYS 91 HD3 LYS 91 2.480 -45.172 22.943 660 HE2 LYS 91 HE2 LYS 91 1.376 -45.833 24.751 661 HE3 LYS 91 HE3 LYS 91 0.347 -46.857 23.752 662 HZ1 LYS 91 HZ1 LYS 91 1.915 -48.648 23.979 663 HZ2 LYS 91 HZ2 LYS 91 1.488 -48.091 25.518 664 HZ3 LYS 91 HZ3 LYS 91 2.984 -47.668 24.852 665 H ASP 92 H ASP 92 -1.435 -46.640 19.274 666 HA ASP 92 HA ASP 92 -1.905 -44.348 17.784 667 HB2 ASP 92 HB2 ASP 92 -3.391 -45.895 19.813 668 HB3 ASP 92 HB3 ASP 92 -3.908 -44.222 19.618 669 H ASN 93 H ASN 93 -1.975 -42.183 18.209 670 HA ASN 93 HA ASN 93 -1.225 -41.290 20.904 671 HB2 ASN 93 HB2 ASN 93 0.588 -41.323 18.859 672 HB3 ASN 93 HB3 ASN 93 -0.075 -39.699 18.709 673 HD21 ASN 93 HD21 ASN 93 1.152 -38.278 19.688 674 HD22 ASN 93 HD22 ASN 93 1.972 -38.498 21.193 675 H LYS 94 H LYS 94 -1.155 -38.607 20.532 676 HA LYS 94 HA LYS 94 -3.869 -37.992 19.560 677 HB2 LYS 94 HB2 LYS 94 -2.670 -37.566 22.111 678 HB3 LYS 94 HB3 LYS 94 -2.957 -35.994 21.376 679 HG2 LYS 94 HG2 LYS 94 -5.284 -37.486 20.923 680 HG3 LYS 94 HG3 LYS 94 -4.817 -37.801 22.596 681 HD2 LYS 94 HD2 LYS 94 -5.049 -35.594 23.216 682 HD3 LYS 94 HD3 LYS 94 -4.781 -34.996 21.577 683 HE2 LYS 94 HE2 LYS 94 -6.964 -35.622 20.898 684 HE3 LYS 94 HE3 LYS 94 -7.223 -36.570 22.362 685 HZ1 LYS 94 HZ1 LYS 94 -7.721 -34.747 23.564 686 HZ2 LYS 94 HZ2 LYS 94 -8.141 -34.109 22.055 687 HZ3 LYS 94 HZ3 LYS 94 -6.636 -33.745 22.737 688 H ARG 95 H ARG 95 -3.960 -35.373 19.416 689 HA ARG 95 HA ARG 95 -1.777 -34.652 17.574 690 HB2 ARG 95 HB2 ARG 95 -4.285 -34.891 16.811 691 HB3 ARG 95 HB3 ARG 95 -4.439 -33.289 17.520 692 HG2 ARG 95 HG2 ARG 95 -2.474 -32.620 16.055 693 HG3 ARG 95 HG3 ARG 95 -2.734 -34.145 15.207 694 HD2 ARG 95 HD2 ARG 95 -5.126 -32.472 15.632 695 HD3 ARG 95 HD3 ARG 95 -3.919 -31.825 14.521 696 HE ARG 95 HE ARG 95 -4.341 -34.469 13.802 697 HH11 ARG 95 HH11 ARG 95 -6.175 -31.515 13.979 698 HH12 ARG 95 HH12 ARG 95 -7.239 -31.944 12.681 699 HH21 ARG 95 HH21 ARG 95 -5.736 -35.046 12.091 700 HH22 ARG 95 HH22 ARG 95 -6.989 -33.953 11.608 701 H LYS 96 H LYS 96 -0.882 -32.594 17.668 702 HA LYS 96 HA LYS 96 -1.684 -30.914 19.944 703 HB2 LYS 96 HB2 LYS 96 0.648 -32.431 19.859 704 HB3 LYS 96 HB3 LYS 96 1.174 -30.812 19.415 705 HG2 LYS 96 HG2 LYS 96 -0.371 -30.229 21.535 706 HG3 LYS 96 HG3 LYS 96 0.176 -31.845 21.985 707 HD2 LYS 96 HD2 LYS 96 2.241 -31.120 22.438 708 HD3 LYS 96 HD3 LYS 96 2.330 -30.205 20.931 709 HE2 LYS 96 HE2 LYS 96 0.652 -28.625 22.267 710 HE3 LYS 96 HE3 LYS 96 1.489 -29.342 23.643 711 HZ1 LYS 96 HZ1 LYS 96 2.353 -27.235 22.110 712 HZ2 LYS 96 HZ2 LYS 96 3.322 -28.533 21.624 713 HZ3 LYS 96 HZ3 LYS 96 3.261 -28.088 23.255 714 H MET 97 H MET 97 -0.026 -28.826 19.703 715 HA MET 97 HA MET 97 -0.348 -27.900 16.926 716 HB2 MET 97 HB2 MET 97 -1.085 -25.758 17.675 717 HB3 MET 97 HB3 MET 97 -2.064 -26.959 18.507 718 HG2 MET 97 HG2 MET 97 0.012 -26.590 20.248 719 HG3 MET 97 HG3 MET 97 -0.214 -24.978 19.573 720 HE1 MET 97 HE1 MET 97 -1.855 -25.564 23.199 721 HE2 MET 97 HE2 MET 97 -1.638 -27.207 22.598 722 HE3 MET 97 HE3 MET 97 -0.348 -26.020 22.402 723 H ASP 98 H ASP 98 0.834 -25.493 17.009 724 HA ASP 98 HA ASP 98 3.290 -25.439 18.447 725 HB2 ASP 98 HB2 ASP 98 3.336 -27.094 16.217 726 HB3 ASP 98 HB3 ASP 98 4.042 -25.588 15.636 727 H GLU 99 H GLU 99 4.843 -23.780 17.173 728 HA GLU 99 HA GLU 99 3.639 -21.797 15.576 729 HB2 GLU 99 HB2 GLU 99 2.646 -21.604 18.072 730 HB3 GLU 99 HB3 GLU 99 4.093 -20.623 18.259 731 HG2 GLU 99 HG2 GLU 99 3.372 -19.269 16.319 732 HG3 GLU 99 HG3 GLU 99 1.879 -20.204 16.266 733 H THR 100 H THR 100 5.039 -19.926 15.251 734 HA THR 100 HA THR 100 7.714 -20.067 16.376 735 HB THR 100 HB THR 100 8.788 -20.037 14.122 736 HG1 THR 100 HG1 THR 100 6.338 -21.059 13.126 737 HG21 THR 100 HG21 THR 100 8.747 -22.404 13.810 738 HG22 THR 100 HG22 THR 100 7.160 -22.536 14.567 739 HG23 THR 100 HG23 THR 100 8.566 -22.103 15.538 740 H ASP 101 H ASP 101 9.102 -18.251 15.483 741 HA ASP 101 HA ASP 101 7.639 -15.987 14.413 742 HB2 ASP 101 HB2 ASP 101 9.001 -15.785 17.107 743 HB3 ASP 101 HB3 ASP 101 8.180 -14.485 16.248 744 H ALA 102 H ALA 102 9.279 -13.986 14.509 745 HA ALA 102 HA ALA 102 11.201 -13.077 13.697 746 HB1 ALA 102 HB1 ALA 102 12.575 -15.603 14.592 747 HB2 ALA 102 HB2 ALA 102 13.291 -14.008 14.357 748 HB3 ALA 102 HB3 ALA 102 12.156 -14.279 15.679 749 H SER 103 H SER 103 13.099 -13.563 12.126 750 HA SER 103 HA SER 103 12.292 -15.573 10.140 751 HB2 SER 103 HB2 SER 103 12.842 -12.646 9.634 752 HB3 SER 103 HB3 SER 103 12.863 -13.859 8.353 753 HG SER 103 HG SER 103 10.697 -14.319 8.830 754 H SER 104 H SER 104 14.777 -13.030 10.253 755 HA SER 104 HA SER 104 16.943 -14.675 10.906 756 HB2 SER 104 HB2 SER 104 17.713 -15.559 8.971 757 HB3 SER 104 HB3 SER 104 16.064 -15.317 8.393 758 HG SER 104 HG SER 104 17.090 -14.184 6.925 759 H ALA 105 H ALA 105 19.082 -13.614 9.885 760 HA ALA 105 HA ALA 105 18.917 -10.806 9.359 761 HB1 ALA 105 HB1 ALA 105 20.419 -10.456 11.549 762 HB2 ALA 105 HB2 ALA 105 18.668 -10.240 11.535 763 HB3 ALA 105 HB3 ALA 105 19.366 -11.750 12.122 764 H VAL 106 H VAL 106 20.791 -10.023 8.494 765 HA VAL 106 HA VAL 106 23.202 -11.686 8.669 766 HB VAL 106 HB VAL 106 22.127 -10.586 6.069 767 HG11 VAL 106 HG11 VAL 106 23.975 -12.262 5.257 768 HG12 VAL 106 HG12 VAL 106 24.401 -10.621 5.746 769 HG13 VAL 106 HG13 VAL 106 24.648 -11.967 6.860 770 HG21 VAL 106 HG21 VAL 106 20.742 -12.378 6.348 771 HG22 VAL 106 HG22 VAL 106 22.130 -13.199 5.633 772 HG23 VAL 106 HG23 VAL 106 21.883 -13.242 7.379 773 H LYS 107 H LYS 107 24.979 -10.533 9.054 774 HA LYS 107 HA LYS 107 24.963 -7.663 8.392 775 HB2 LYS 107 HB2 LYS 107 26.270 -7.271 10.471 776 HB3 LYS 107 HB3 LYS 107 24.636 -7.848 10.775 777 HG2 LYS 107 HG2 LYS 107 25.611 -9.302 12.155 778 HG3 LYS 107 HG3 LYS 107 26.051 -10.180 10.688 779 HD2 LYS 107 HD2 LYS 107 28.198 -9.055 10.624 780 HD3 LYS 107 HD3 LYS 107 27.755 -8.078 12.026 781 HE2 LYS 107 HE2 LYS 107 27.759 -9.974 13.454 782 HE3 LYS 107 HE3 LYS 107 27.852 -11.086 12.089 783 HZ1 LYS 107 HZ1 LYS 107 30.067 -10.360 11.630 784 HZ2 LYS 107 HZ2 LYS 107 29.984 -10.776 13.267 785 HZ3 LYS 107 HZ3 LYS 107 29.983 -9.148 12.808 786 H VAL 108 H VAL 108 26.893 -10.563 8.963 787 HA VAL 108 HA VAL 108 29.428 -9.612 8.417 788 HB VAL 108 HB VAL 108 28.302 -12.297 7.608 789 HG11 VAL 108 HG11 VAL 108 31.087 -11.207 7.763 790 HG12 VAL 108 HG12 VAL 108 30.779 -12.930 7.992 791 HG13 VAL 108 HG13 VAL 108 30.325 -12.145 6.479 792 HG21 VAL 108 HG21 VAL 108 28.961 -11.131 10.186 793 HG22 VAL 108 HG22 VAL 108 28.084 -12.613 9.808 794 HG23 VAL 108 HG23 VAL 108 29.846 -12.624 9.875 795 H LYS 109 H LYS 109 30.603 -9.168 6.614 796 HA LYS 109 HA LYS 109 29.247 -9.426 4.013 797 HB2 LYS 109 HB2 LYS 109 30.066 -7.022 5.365 798 HB3 LYS 109 HB3 LYS 109 30.978 -7.201 3.873 799 HG2 LYS 109 HG2 LYS 109 28.010 -7.539 3.867 800 HG3 LYS 109 HG3 LYS 109 28.729 -5.927 3.852 801 HD2 LYS 109 HD2 LYS 109 30.105 -6.716 1.871 802 HD3 LYS 109 HD3 LYS 109 29.040 -8.123 1.818 803 HE2 LYS 109 HE2 LYS 109 27.701 -5.501 1.956 804 HE3 LYS 109 HE3 LYS 109 28.585 -5.831 0.467 805 HZ1 LYS 109 HZ1 LYS 109 26.299 -7.304 1.614 806 HZ2 LYS 109 HZ2 LYS 109 27.331 -8.039 0.494 807 HZ3 LYS 109 HZ3 LYS 109 26.466 -6.650 0.063 808 H ARG 110 H ARG 110 31.082 -8.722 2.265 809 HA ARG 110 HA ARG 110 33.298 -10.581 2.779 810 HB2 ARG 110 HB2 ARG 110 31.531 -10.289 0.594 811 HB3 ARG 110 HB3 ARG 110 33.114 -9.772 0.029 812 HG2 ARG 110 HG2 ARG 110 32.701 -12.369 1.475 813 HG3 ARG 110 HG3 ARG 110 32.521 -12.216 -0.274 814 HD2 ARG 110 HD2 ARG 110 34.939 -10.964 0.313 815 HD3 ARG 110 HD3 ARG 110 34.919 -12.406 1.327 816 HE ARG 110 HE ARG 110 35.219 -12.307 -1.510 817 HH11 ARG 110 HH11 ARG 110 34.002 -14.232 1.123 818 HH12 ARG 110 HH12 ARG 110 34.163 -15.732 0.272 819 HH21 ARG 110 HH21 ARG 110 35.437 -14.276 -2.640 820 HH22 ARG 110 HH22 ARG 110 34.980 -15.757 -1.868 821 H ALA 111 H ALA 111 35.426 -10.029 2.160 822 HA ALA 111 HA ALA 111 35.960 -7.265 1.408 823 HB1 ALA 111 HB1 ALA 111 36.608 -6.562 3.408 824 HB2 ALA 111 HB2 ALA 111 36.095 -8.102 4.097 825 HB3 ALA 111 HB3 ALA 111 37.754 -7.896 3.536 826 H VAL 112 H VAL 112 38.544 -7.028 1.463 827 HA VAL 112 HA VAL 112 40.505 -7.598 0.457 828 HB VAL 112 HB VAL 112 39.699 -10.449 1.047 829 HG11 VAL 112 HG11 VAL 112 42.288 -10.606 1.186 830 HG12 VAL 112 HG12 VAL 112 41.502 -10.611 -0.394 831 HG13 VAL 112 HG13 VAL 112 42.252 -9.135 0.214 832 HG21 VAL 112 HG21 VAL 112 40.940 -10.225 3.119 833 HG22 VAL 112 HG22 VAL 112 41.312 -8.543 2.742 834 HG23 VAL 112 HG23 VAL 112 39.646 -9.029 3.059 835 H GLN 113 H GLN 113 40.140 -6.968 -1.627 836 HA GLN 113 HA GLN 113 38.910 -8.911 -3.452 837 HB2 GLN 113 HB2 GLN 113 38.088 -6.485 -3.284 838 HB3 GLN 113 HB3 GLN 113 39.574 -6.052 -4.119 839 HG2 GLN 113 HG2 GLN 113 38.081 -6.211 -5.854 840 HG3 GLN 113 HG3 GLN 113 38.812 -7.815 -5.858 841 HE21 GLN 113 HE21 GLN 113 36.107 -6.642 -6.634 842 HE22 GLN 113 HE22 GLN 113 34.971 -7.715 -5.897 843 H LYS 114 H LYS 114 41.493 -6.459 -3.679 844 HA LYS 114 HA LYS 114 43.312 -8.473 -4.736 845 HB2 LYS 114 HB2 LYS 114 43.877 -7.124 -6.706 846 HB3 LYS 114 HB3 LYS 114 42.191 -7.622 -6.733 847 HG2 LYS 114 HG2 LYS 114 41.412 -5.490 -6.355 848 HG3 LYS 114 HG3 LYS 114 42.919 -4.958 -5.605 849 HD2 LYS 114 HD2 LYS 114 42.955 -3.905 -7.680 850 HD3 LYS 114 HD3 LYS 114 43.952 -5.338 -7.940 851 HE2 LYS 114 HE2 LYS 114 41.261 -6.050 -8.471 852 HE3 LYS 114 HE3 LYS 114 41.584 -4.532 -9.306 853 HZ1 LYS 114 HZ1 LYS 114 43.744 -6.350 -9.619 854 HZ2 LYS 114 HZ2 LYS 114 42.809 -5.586 -10.803 855 HZ3 LYS 114 HZ3 LYS 114 42.296 -7.054 -10.137 Start of MODEL 3 1 H1 MET 1 H MET 1 1.808 0.000 0.855 2 HA MET 1 HA MET 1 1.416 0.246 -2.047 3 HB2 MET 1 HB2 MET 1 3.905 0.774 -0.414 4 HB3 MET 1 HB3 MET 1 3.712 1.072 -2.136 5 HG2 MET 1 HG2 MET 1 1.905 2.693 -1.583 6 HG3 MET 1 HG3 MET 1 2.302 2.472 0.120 7 HE1 MET 1 HE1 MET 1 4.714 3.442 -3.277 8 HE2 MET 1 HE2 MET 1 2.983 3.764 -3.183 9 HE3 MET 1 HE3 MET 1 4.138 5.079 -2.962 10 H ALA 2 H ALA 2 3.657 -0.678 -3.117 11 HA ALA 2 HA ALA 2 3.480 -3.537 -2.624 12 HB1 ALA 2 HB1 ALA 2 3.625 -2.135 -4.921 13 HB2 ALA 2 HB2 ALA 2 5.324 -2.552 -4.697 14 HB3 ALA 2 HB3 ALA 2 4.106 -3.825 -4.769 15 H GLY 3 H GLY 3 5.167 -4.853 -2.002 16 HA2 GLY 3 HA2 GLY 3 7.831 -3.817 -1.638 17 HA3 GLY 3 HA3 GLY 3 6.964 -4.045 -0.127 18 H SER 4 H SER 4 8.201 -5.677 -2.991 19 HA SER 4 HA SER 4 8.868 -7.820 -3.362 20 HB2 SER 4 HB2 SER 4 10.196 -7.268 -1.257 21 HB3 SER 4 HB3 SER 4 8.963 -8.157 -0.363 22 HG SER 4 HG SER 4 10.942 -9.320 -1.151 23 H HIS 5 H HIS 5 7.005 -8.635 -4.260 24 HA HIS 5 HA HIS 5 5.523 -10.493 -2.578 25 HB2 HIS 5 HB2 HIS 5 4.420 -7.998 -3.591 26 HB3 HIS 5 HB3 HIS 5 3.508 -9.396 -4.152 27 HD1 HIS 5 HD1 HIS 5 3.547 -11.178 -1.700 28 HD2 HIS 5 HD2 HIS 5 2.936 -7.073 -1.523 29 HE1 HIS 5 HE1 HIS 5 2.333 -10.773 0.464 30 H HIS 6 H HIS 6 6.372 -12.212 -3.694 31 HA HIS 6 HA HIS 6 5.772 -12.344 -6.574 32 HB2 HIS 6 HB2 HIS 6 8.048 -13.317 -4.938 33 HB3 HIS 6 HB3 HIS 6 7.515 -14.368 -6.248 34 HD1 HIS 6 HD1 HIS 6 9.733 -11.636 -5.590 35 HD2 HIS 6 HD2 HIS 6 7.423 -12.840 -8.826 36 HE1 HIS 6 HE1 HIS 6 10.702 -10.451 -7.585 37 H HIS 7 H HIS 7 4.981 -14.327 -7.434 38 HA HIS 7 HA HIS 7 4.001 -16.311 -5.532 39 HB2 HIS 7 HB2 HIS 7 2.202 -14.807 -7.443 40 HB3 HIS 7 HB3 HIS 7 1.724 -16.238 -6.536 41 HD1 HIS 7 HD1 HIS 7 2.646 -12.619 -6.038 42 HD2 HIS 7 HD2 HIS 7 0.983 -15.782 -3.918 43 HE1 HIS 7 HE1 HIS 7 1.778 -11.615 -3.902 44 H HIS 8 H HIS 8 3.817 -15.370 -8.970 45 HA HIS 8 HA HIS 8 3.600 -17.981 -9.977 46 HB2 HIS 8 HB2 HIS 8 4.744 -15.524 -11.322 47 HB3 HIS 8 HB3 HIS 8 4.241 -16.998 -12.144 48 HD1 HIS 8 HD1 HIS 8 1.600 -17.171 -10.210 49 HD2 HIS 8 HD2 HIS 8 2.769 -14.067 -12.712 50 HE1 HIS 8 HE1 HIS 8 -0.504 -15.895 -10.727 51 H HIS 9 H HIS 9 5.194 -19.187 -11.220 52 HA HIS 9 HA HIS 9 7.185 -20.264 -11.443 53 HB2 HIS 9 HB2 HIS 9 7.804 -17.472 -11.487 54 HB3 HIS 9 HB3 HIS 9 9.083 -18.316 -10.620 55 HD1 HIS 9 HD1 HIS 9 7.212 -19.747 -13.569 56 HD2 HIS 9 HD2 HIS 9 10.973 -18.264 -12.614 57 HE1 HIS 9 HE1 HIS 9 8.660 -20.254 -15.562 58 H HIS 10 H HIS 10 9.209 -20.921 -10.211 59 HA HIS 10 HA HIS 10 8.781 -20.718 -7.308 60 HB2 HIS 10 HB2 HIS 10 9.407 -23.224 -8.879 61 HB3 HIS 10 HB3 HIS 10 9.452 -23.116 -7.122 62 HD1 HIS 10 HD1 HIS 10 7.423 -24.102 -6.139 63 HD2 HIS 10 HD2 HIS 10 6.612 -22.218 -9.752 64 HE1 HIS 10 HE1 HIS 10 4.952 -24.388 -6.507 65 H GLY 11 H GLY 11 10.853 -22.004 -6.285 66 HA2 GLY 11 HA2 GLY 11 13.304 -21.334 -7.688 67 HA3 GLY 11 HA3 GLY 11 12.976 -20.361 -6.262 68 H SER 12 H SER 12 15.176 -21.476 -5.853 69 HA SER 12 HA SER 12 16.415 -22.949 -4.637 70 HB2 SER 12 HB2 SER 12 14.608 -22.217 -2.963 71 HB3 SER 12 HB3 SER 12 13.857 -23.781 -3.276 72 HG SER 12 HG SER 12 16.164 -23.165 -1.882 73 H MET 13 H MET 13 16.165 -25.420 -3.684 74 HA MET 13 HA MET 13 15.205 -27.028 -5.959 75 HB2 MET 13 HB2 MET 13 17.733 -27.363 -4.342 76 HB3 MET 13 HB3 MET 13 17.115 -28.585 -5.445 77 HG2 MET 13 HG2 MET 13 17.303 -25.994 -6.713 78 HG3 MET 13 HG3 MET 13 18.850 -26.520 -6.052 79 HE1 MET 13 HE1 MET 13 18.563 -27.164 -10.011 80 HE2 MET 13 HE2 MET 13 18.337 -25.832 -8.878 81 HE3 MET 13 HE3 MET 13 19.853 -26.735 -8.886 82 H SER 14 H SER 14 13.473 -28.110 -5.283 83 HA SER 14 HA SER 14 13.695 -29.846 -2.978 84 HB2 SER 14 HB2 SER 14 12.878 -27.892 -1.850 85 HB3 SER 14 HB3 SER 14 11.663 -27.609 -3.096 86 HG SER 14 HG SER 14 10.669 -28.597 -1.361 87 H GLU 15 H GLU 15 12.077 -31.481 -2.915 88 HA GLU 15 HA GLU 15 10.638 -31.787 -5.468 89 HB2 GLU 15 HB2 GLU 15 12.531 -33.478 -4.269 90 HB3 GLU 15 HB3 GLU 15 10.979 -34.267 -4.025 91 HG2 GLU 15 HG2 GLU 15 10.607 -33.836 -6.532 92 HG3 GLU 15 HG3 GLU 15 12.347 -33.562 -6.588 93 H TYR 16 H TYR 16 9.007 -33.883 -4.877 94 HA TYR 16 HA TYR 16 7.409 -32.997 -2.574 95 HB2 TYR 16 HB2 TYR 16 5.367 -33.490 -4.046 96 HB3 TYR 16 HB3 TYR 16 6.246 -31.998 -4.361 97 HD1 TYR 16 HD1 TYR 16 7.158 -31.565 -6.485 98 HD2 TYR 16 HD2 TYR 16 5.806 -35.488 -5.546 99 HE1 TYR 16 HE1 TYR 16 7.429 -32.216 -8.841 100 HE2 TYR 16 HE2 TYR 16 6.074 -36.150 -7.899 101 HH TYR 16 HH TYR 16 7.752 -35.052 -9.940 102 H ILE 17 H ILE 17 5.469 -34.677 -2.364 103 HA ILE 17 HA ILE 17 6.690 -37.358 -2.478 104 HB ILE 17 HB ILE 17 6.501 -36.744 -0.188 105 HG12 ILE 17 HG12 ILE 17 4.094 -38.452 -0.852 106 HG13 ILE 17 HG13 ILE 17 5.752 -39.039 -0.798 107 HG21 ILE 17 HG21 ILE 17 5.080 -35.136 0.386 108 HG22 ILE 17 HG22 ILE 17 4.146 -35.358 -1.092 109 HG23 ILE 17 HG23 ILE 17 3.790 -36.337 0.331 110 HD11 ILE 17 HD11 ILE 17 5.525 -37.892 1.644 111 HD12 ILE 17 HD12 ILE 17 3.881 -38.470 1.375 112 HD13 ILE 17 HD13 ILE 17 5.235 -39.597 1.301 113 H ARG 18 H ARG 18 5.703 -38.774 -3.746 114 HA ARG 18 HA ARG 18 2.869 -38.325 -4.415 115 HB2 ARG 18 HB2 ARG 18 5.178 -39.331 -6.041 116 HB3 ARG 18 HB3 ARG 18 3.538 -39.815 -6.455 117 HG2 ARG 18 HG2 ARG 18 3.082 -37.237 -6.349 118 HG3 ARG 18 HG3 ARG 18 4.824 -37.138 -6.615 119 HD2 ARG 18 HD2 ARG 18 3.880 -37.079 -8.762 120 HD3 ARG 18 HD3 ARG 18 4.452 -38.735 -8.562 121 HE ARG 18 HE ARG 18 1.837 -38.781 -7.747 122 HH11 ARG 18 HH11 ARG 18 3.528 -37.879 -10.654 123 HH12 ARG 18 HH12 ARG 18 2.215 -38.299 -11.703 124 HH21 ARG 18 HH21 ARG 18 0.101 -39.338 -9.119 125 HH22 ARG 18 HH22 ARG 18 0.266 -39.128 -10.829 126 H VAL 19 H VAL 19 1.723 -39.636 -3.123 127 HA VAL 19 HA VAL 19 2.161 -42.502 -3.355 128 HB VAL 19 HB VAL 19 1.853 -42.740 -0.831 129 HG11 VAL 19 HG11 VAL 19 4.443 -41.552 -1.819 130 HG12 VAL 19 HG12 VAL 19 4.236 -42.596 -0.412 131 HG13 VAL 19 HG13 VAL 19 3.947 -43.230 -2.032 132 HG21 VAL 19 HG21 VAL 19 2.708 -39.852 -0.960 133 HG22 VAL 19 HG22 VAL 19 1.206 -40.487 -0.287 134 HG23 VAL 19 HG23 VAL 19 2.744 -40.841 0.500 135 H THR 20 H THR 20 0.336 -43.763 -2.719 136 HA THR 20 HA THR 20 -2.151 -42.205 -2.440 137 HB THR 20 HB THR 20 -2.362 -43.002 -4.609 138 HG1 THR 20 HG1 THR 20 -4.167 -43.715 -3.457 139 HG21 THR 20 HG21 THR 20 -1.837 -45.656 -4.840 140 HG22 THR 20 HG22 THR 20 -0.632 -45.179 -3.644 141 HG23 THR 20 HG23 THR 20 -0.680 -44.380 -5.215 142 H GLU 21 H GLU 21 -3.780 -43.067 -1.146 143 HA GLU 21 HA GLU 21 -2.876 -44.731 0.998 144 HB2 GLU 21 HB2 GLU 21 -4.575 -42.797 1.093 145 HB3 GLU 21 HB3 GLU 21 -5.742 -43.968 0.496 146 HG2 GLU 21 HG2 GLU 21 -4.358 -45.136 2.681 147 HG3 GLU 21 HG3 GLU 21 -4.884 -43.521 3.154 148 H ASP 22 H ASP 22 -5.327 -45.110 -1.553 149 HA ASP 22 HA ASP 22 -5.442 -47.981 -0.953 150 HB2 ASP 22 HB2 ASP 22 -7.332 -46.039 -2.198 151 HB3 ASP 22 HB3 ASP 22 -7.411 -47.719 -2.721 152 H GLU 23 H GLU 23 -4.969 -49.526 -2.470 153 HA GLU 23 HA GLU 23 -3.072 -48.898 -4.446 154 HB2 GLU 23 HB2 GLU 23 -3.371 -51.258 -5.176 155 HB3 GLU 23 HB3 GLU 23 -3.097 -51.088 -3.448 156 HG2 GLU 23 HG2 GLU 23 -5.872 -51.001 -3.791 157 HG3 GLU 23 HG3 GLU 23 -5.293 -52.298 -4.835 158 H ASN 24 H ASN 24 -6.550 -49.323 -4.574 159 HA ASN 24 HA ASN 24 -6.734 -49.402 -7.419 160 HB2 ASN 24 HB2 ASN 24 -8.481 -49.828 -5.286 161 HB3 ASN 24 HB3 ASN 24 -9.124 -48.406 -6.102 162 HD21 ASN 24 HD21 ASN 24 -9.218 -51.680 -5.996 163 HD22 ASN 24 HD22 ASN 24 -9.798 -52.007 -7.590 164 H ASP 25 H ASP 25 -6.585 -46.878 -5.040 165 HA ASP 25 HA ASP 25 -7.550 -44.806 -6.788 166 HB2 ASP 25 HB2 ASP 25 -7.351 -45.006 -4.089 167 HB3 ASP 25 HB3 ASP 25 -5.918 -44.045 -4.444 168 H GLU 26 H GLU 26 -6.249 -42.958 -7.447 169 HA GLU 26 HA GLU 26 -3.739 -43.821 -8.576 170 HB2 GLU 26 HB2 GLU 26 -5.641 -41.635 -9.006 171 HB3 GLU 26 HB3 GLU 26 -3.961 -41.139 -9.159 172 HG2 GLU 26 HG2 GLU 26 -4.327 -43.602 -10.545 173 HG3 GLU 26 HG3 GLU 26 -5.573 -42.462 -11.050 174 HA PRO 27 HA PRO 27 -0.973 -42.111 -5.630 175 HB2 PRO 27 HB2 PRO 27 1.076 -41.320 -7.225 176 HB3 PRO 27 HB3 PRO 27 0.729 -43.018 -6.879 177 HG2 PRO 27 HG2 PRO 27 0.007 -41.389 -9.285 178 HG3 PRO 27 HG3 PRO 27 0.627 -43.048 -9.202 179 HD2 PRO 27 HD2 PRO 27 -1.996 -42.490 -9.580 180 HD3 PRO 27 HD3 PRO 27 -1.443 -43.931 -8.702 181 H ILE 28 H ILE 28 -1.790 -40.293 -4.699 182 HA ILE 28 HA ILE 28 -2.065 -37.823 -6.151 183 HB ILE 28 HB ILE 28 -3.656 -38.367 -4.386 184 HG12 ILE 28 HG12 ILE 28 -3.542 -36.226 -3.127 185 HG13 ILE 28 HG13 ILE 28 -1.908 -35.984 -3.735 186 HG21 ILE 28 HG21 ILE 28 -2.885 -38.209 -1.997 187 HG22 ILE 28 HG22 ILE 28 -2.349 -39.642 -2.872 188 HG23 ILE 28 HG23 ILE 28 -1.232 -38.304 -2.604 189 HD11 ILE 28 HD11 ILE 28 -2.665 -35.132 -5.632 190 HD12 ILE 28 HD12 ILE 28 -3.766 -36.487 -5.883 191 HD13 ILE 28 HD13 ILE 28 -4.265 -35.115 -4.893 192 H GLU 29 H GLU 29 -0.825 -35.995 -5.998 193 HA GLU 29 HA GLU 29 1.810 -36.351 -4.747 194 HB2 GLU 29 HB2 GLU 29 2.654 -34.726 -6.300 195 HB3 GLU 29 HB3 GLU 29 1.721 -35.912 -7.202 196 HG2 GLU 29 HG2 GLU 29 0.816 -34.102 -8.158 197 HG3 GLU 29 HG3 GLU 29 -0.188 -34.078 -6.710 198 H ILE 30 H ILE 30 2.484 -35.056 -3.143 199 HA ILE 30 HA ILE 30 0.855 -32.690 -2.494 200 HB ILE 30 HB ILE 30 1.978 -33.612 -0.088 201 HG12 ILE 30 HG12 ILE 30 0.469 -35.828 -1.486 202 HG13 ILE 30 HG13 ILE 30 2.216 -35.810 -1.273 203 HG21 ILE 30 HG21 ILE 30 -0.004 -32.529 0.172 204 HG22 ILE 30 HG22 ILE 30 -0.722 -33.268 -1.259 205 HG23 ILE 30 HG23 ILE 30 -0.595 -34.189 0.239 206 HD11 ILE 30 HD11 ILE 30 1.795 -35.672 1.201 207 HD12 ILE 30 HD12 ILE 30 0.099 -35.998 0.845 208 HD13 ILE 30 HD13 ILE 30 1.332 -37.185 0.423 209 HA PRO 31 HA PRO 31 4.644 -30.457 -2.440 210 HB2 PRO 31 HB2 PRO 31 3.954 -28.426 -0.776 211 HB3 PRO 31 HB3 PRO 31 3.356 -28.554 -2.434 212 HG2 PRO 31 HG2 PRO 31 2.009 -29.315 0.128 213 HG3 PRO 31 HG3 PRO 31 1.338 -28.475 -1.281 214 HD2 PRO 31 HD2 PRO 31 0.933 -31.114 -0.829 215 HD3 PRO 31 HD3 PRO 31 1.043 -30.431 -2.464 216 H SER 32 H SER 32 6.402 -31.193 -1.431 217 HA SER 32 HA SER 32 6.299 -31.732 1.445 218 HB2 SER 32 HB2 SER 32 7.981 -33.273 1.138 219 HB3 SER 32 HB3 SER 32 7.252 -33.317 -0.467 220 HG SER 32 HG SER 32 9.082 -32.647 -1.221 221 H GLU 33 H GLU 33 8.769 -31.430 2.335 222 HA GLU 33 HA GLU 33 9.139 -28.548 2.267 223 HB2 GLU 33 HB2 GLU 33 10.145 -30.757 4.034 224 HB3 GLU 33 HB3 GLU 33 10.898 -29.169 4.074 225 HG2 GLU 33 HG2 GLU 33 8.832 -28.141 4.728 226 HG3 GLU 33 HG3 GLU 33 7.967 -29.664 4.530 227 H ASP 34 H ASP 34 11.588 -27.895 2.532 228 HA ASP 34 HA ASP 34 12.835 -28.545 0.040 229 HB2 ASP 34 HB2 ASP 34 14.601 -26.979 0.780 230 HB3 ASP 34 HB3 ASP 34 12.989 -26.285 0.929 231 H ASP 35 H ASP 35 13.386 -29.371 3.413 232 HA ASP 35 HA ASP 35 15.915 -30.574 3.102 233 HB2 ASP 35 HB2 ASP 35 14.190 -30.067 5.219 234 HB3 ASP 35 HB3 ASP 35 14.264 -31.825 5.152 235 H GLY 36 H GLY 36 12.762 -31.607 2.223 236 HA2 GLY 36 HA2 GLY 36 12.723 -33.443 0.577 237 HA3 GLY 36 HA3 GLY 36 13.833 -34.299 1.637 238 H THR 37 H THR 37 12.388 -33.451 4.057 239 HA THR 37 HA THR 37 10.587 -35.641 4.220 240 HB THR 37 HB THR 37 10.142 -34.940 6.479 241 HG1 THR 37 HG1 THR 37 11.450 -32.502 5.781 242 HG21 THR 37 HG21 THR 37 12.591 -35.640 5.591 243 HG22 THR 37 HG22 THR 37 12.212 -35.371 7.293 244 HG23 THR 37 HG23 THR 37 12.967 -34.091 6.344 245 H VAL 38 H VAL 38 8.415 -34.845 5.611 246 HA VAL 38 HA VAL 38 7.043 -32.826 3.989 247 HB VAL 38 HB VAL 38 6.055 -35.644 4.427 248 HG11 VAL 38 HG11 VAL 38 4.020 -34.888 3.206 249 HG12 VAL 38 HG12 VAL 38 4.199 -34.172 4.809 250 HG13 VAL 38 HG13 VAL 38 4.593 -33.229 3.372 251 HG21 VAL 38 HG21 VAL 38 6.282 -34.190 1.815 252 HG22 VAL 38 HG22 VAL 38 7.664 -35.036 2.512 253 HG23 VAL 38 HG23 VAL 38 6.194 -35.926 2.115 254 H LEU 39 H LEU 39 5.772 -31.524 5.159 255 HA LEU 39 HA LEU 39 5.729 -31.683 7.976 256 HB2 LEU 39 HB2 LEU 39 5.337 -29.701 6.222 257 HB3 LEU 39 HB3 LEU 39 3.657 -30.079 6.599 258 HG LEU 39 HG LEU 39 4.233 -29.734 9.023 259 HD11 LEU 39 HD11 LEU 39 6.831 -29.764 8.104 260 HD12 LEU 39 HD12 LEU 39 6.296 -29.245 9.702 261 HD13 LEU 39 HD13 LEU 39 6.525 -28.056 8.420 262 HD21 LEU 39 HD21 LEU 39 4.190 -27.638 6.924 263 HD22 LEU 39 HD22 LEU 39 4.590 -27.143 8.569 264 HD23 LEU 39 HD23 LEU 39 3.057 -27.951 8.239 265 H LEU 40 H LEU 40 4.265 -32.471 9.390 266 HA LEU 40 HA LEU 40 2.561 -34.529 8.745 267 HB2 LEU 40 HB2 LEU 40 3.400 -33.538 11.042 268 HB3 LEU 40 HB3 LEU 40 1.821 -32.754 11.017 269 HG LEU 40 HG LEU 40 2.308 -35.731 10.915 270 HD11 LEU 40 HD11 LEU 40 2.395 -33.985 13.094 271 HD12 LEU 40 HD12 LEU 40 2.279 -35.744 13.132 272 HD13 LEU 40 HD13 LEU 40 0.814 -34.763 13.172 273 HD21 LEU 40 HD21 LEU 40 0.307 -35.436 9.786 274 HD22 LEU 40 HD22 LEU 40 -0.154 -34.037 10.757 275 HD23 LEU 40 HD23 LEU 40 -0.223 -35.656 11.454 276 H SER 41 H SER 41 1.866 -31.079 8.891 277 HA SER 41 HA SER 41 -0.906 -31.141 8.724 278 HB2 SER 41 HB2 SER 41 0.856 -29.147 8.888 279 HB3 SER 41 HB3 SER 41 0.547 -29.064 7.154 280 HG SER 41 HG SER 41 -0.868 -27.868 8.811 281 H THR 42 H THR 42 1.522 -31.509 6.212 282 HA THR 42 HA THR 42 -0.282 -31.369 4.015 283 HB THR 42 HB THR 42 2.453 -32.655 4.147 284 HG1 THR 42 HG1 THR 42 3.129 -30.635 3.282 285 HG21 THR 42 HG21 THR 42 0.893 -31.687 1.749 286 HG22 THR 42 HG22 THR 42 1.058 -33.378 2.224 287 HG23 THR 42 HG23 THR 42 2.480 -32.454 1.738 288 H VAL 43 H VAL 43 0.941 -33.976 6.031 289 HA VAL 43 HA VAL 43 -0.001 -36.120 4.436 290 HB VAL 43 HB VAL 43 0.837 -35.879 7.304 291 HG11 VAL 43 HG11 VAL 43 -0.813 -37.452 7.654 292 HG12 VAL 43 HG12 VAL 43 -0.655 -38.134 6.034 293 HG13 VAL 43 HG13 VAL 43 0.570 -38.471 7.258 294 HG21 VAL 43 HG21 VAL 43 2.218 -37.926 6.089 295 HG22 VAL 43 HG22 VAL 43 1.993 -36.765 4.780 296 HG23 VAL 43 HG23 VAL 43 2.784 -36.266 6.275 297 H THR 44 H THR 44 -1.440 -34.207 7.013 298 HA THR 44 HA THR 44 -3.772 -35.851 7.272 299 HB THR 44 HB THR 44 -4.650 -34.131 8.718 300 HG1 THR 44 HG1 THR 44 -2.430 -32.473 8.131 301 HG21 THR 44 HG21 THR 44 -3.268 -34.860 10.304 302 HG22 THR 44 HG22 THR 44 -2.036 -33.718 9.763 303 HG23 THR 44 HG23 THR 44 -2.102 -35.338 9.070 304 H ALA 45 H ALA 45 -2.856 -33.099 5.334 305 HA ALA 45 HA ALA 45 -5.268 -32.036 4.567 306 HB1 ALA 45 HB1 ALA 45 -2.920 -32.525 2.740 307 HB2 ALA 45 HB2 ALA 45 -4.192 -31.323 2.523 308 HB3 ALA 45 HB3 ALA 45 -3.063 -31.179 3.870 309 H GLN 46 H GLN 46 -3.621 -34.843 3.129 310 HA GLN 46 HA GLN 46 -6.085 -35.472 1.661 311 HB2 GLN 46 HB2 GLN 46 -3.535 -36.959 1.216 312 HB3 GLN 46 HB3 GLN 46 -4.815 -36.568 0.075 313 HG2 GLN 46 HG2 GLN 46 -4.088 -34.234 0.063 314 HG3 GLN 46 HG3 GLN 46 -2.798 -34.635 1.195 315 HE21 GLN 46 HE21 GLN 46 -1.898 -37.009 0.184 316 HE22 GLN 46 HE22 GLN 46 -1.207 -36.754 -1.378 317 H PHE 47 H PHE 47 -3.812 -36.721 4.018 318 HA PHE 47 HA PHE 47 -5.571 -39.052 4.409 319 HB2 PHE 47 HB2 PHE 47 -2.739 -39.017 5.382 320 HB3 PHE 47 HB3 PHE 47 -3.746 -40.389 4.930 321 HD1 PHE 47 HD1 PHE 47 -0.874 -38.968 4.052 322 HD2 PHE 47 HD2 PHE 47 -4.648 -39.828 2.283 323 HE1 PHE 47 HE1 PHE 47 0.179 -39.000 1.828 324 HE2 PHE 47 HE2 PHE 47 -3.602 -39.862 0.057 325 HZ PHE 47 HZ PHE 47 -1.185 -39.448 -0.173 326 HA PRO 48 HA PRO 48 -5.906 -36.400 8.191 327 HB2 PRO 48 HB2 PRO 48 -8.587 -36.732 8.460 328 HB3 PRO 48 HB3 PRO 48 -7.873 -35.481 7.436 329 HG2 PRO 48 HG2 PRO 48 -8.979 -38.154 6.667 330 HG3 PRO 48 HG3 PRO 48 -9.188 -36.584 5.868 331 HD2 PRO 48 HD2 PRO 48 -7.432 -38.445 4.984 332 HD3 PRO 48 HD3 PRO 48 -7.139 -36.702 4.820 333 H GLY 49 H GLY 49 -5.511 -37.298 10.113 334 HA2 GLY 49 HA2 GLY 49 -5.968 -38.691 11.954 335 HA3 GLY 49 HA3 GLY 49 -6.935 -39.720 10.908 336 H ALA 50 H ALA 50 -4.749 -39.783 8.882 337 HA ALA 50 HA ALA 50 -3.563 -42.188 9.551 338 HB1 ALA 50 HB1 ALA 50 -1.982 -41.756 7.731 339 HB2 ALA 50 HB2 ALA 50 -3.634 -41.338 7.273 340 HB3 ALA 50 HB3 ALA 50 -2.487 -40.067 7.697 341 H CYS 51 H CYS 51 -2.438 -42.499 11.376 342 HA CYS 51 HA CYS 51 -0.750 -40.503 12.532 343 HB2 CYS 51 HB2 CYS 51 -1.674 -43.202 13.222 344 HB3 CYS 51 HB3 CYS 51 -0.036 -42.855 13.760 345 HG CYS 51 HG CYS 51 -2.940 -41.371 14.715 346 H GLY 52 H GLY 52 -0.269 -43.276 10.448 347 HA2 GLY 52 HA2 GLY 52 2.439 -42.368 9.899 348 HA3 GLY 52 HA3 GLY 52 2.304 -43.972 10.606 349 H LEU 53 H LEU 53 3.346 -43.229 7.997 350 HA LEU 53 HA LEU 53 1.396 -44.603 6.268 351 HB2 LEU 53 HB2 LEU 53 3.656 -42.862 5.322 352 HB3 LEU 53 HB3 LEU 53 2.274 -43.448 4.398 353 HG LEU 53 HG LEU 53 1.731 -41.234 4.717 354 HD11 LEU 53 HD11 LEU 53 0.506 -41.958 7.290 355 HD12 LEU 53 HD12 LEU 53 0.180 -43.063 5.956 356 HD13 LEU 53 HD13 LEU 53 -0.231 -41.355 5.806 357 HD21 LEU 53 HD21 LEU 53 3.712 -40.967 6.344 358 HD22 LEU 53 HD22 LEU 53 2.515 -41.242 7.610 359 HD23 LEU 53 HD23 LEU 53 2.336 -39.877 6.506 360 H ARG 54 H ARG 54 2.060 -46.325 5.032 361 HA ARG 54 HA ARG 54 4.702 -47.419 5.714 362 HB2 ARG 54 HB2 ARG 54 2.238 -48.589 5.938 363 HB3 ARG 54 HB3 ARG 54 2.777 -49.193 4.377 364 HG2 ARG 54 HG2 ARG 54 4.996 -49.633 5.819 365 HG3 ARG 54 HG3 ARG 54 3.776 -49.777 7.086 366 HD2 ARG 54 HD2 ARG 54 3.123 -51.165 4.584 367 HD3 ARG 54 HD3 ARG 54 4.540 -51.792 5.426 368 HE ARG 54 HE ARG 54 2.405 -51.444 7.241 369 HH11 ARG 54 HH11 ARG 54 3.462 -53.495 4.635 370 HH12 ARG 54 HH12 ARG 54 2.604 -54.887 5.208 371 HH21 ARG 54 HH21 ARG 54 1.270 -53.269 8.006 372 HH22 ARG 54 HH22 ARG 54 1.356 -54.757 7.125 373 H TYR 55 H TYR 55 5.710 -48.788 3.981 374 HA TYR 55 HA TYR 55 5.508 -47.370 1.418 375 HB2 TYR 55 HB2 TYR 55 7.718 -48.252 3.010 376 HB3 TYR 55 HB3 TYR 55 7.776 -49.075 1.456 377 HD1 TYR 55 HD1 TYR 55 8.885 -46.277 3.158 378 HD2 TYR 55 HD2 TYR 55 7.229 -47.393 -0.599 379 HE1 TYR 55 HE1 TYR 55 9.860 -44.262 2.136 380 HE2 TYR 55 HE2 TYR 55 8.200 -45.382 -1.631 381 HH TYR 55 HH TYR 55 10.403 -43.820 -0.901 382 H ARG 56 H ARG 56 4.828 -48.375 -0.366 383 HA ARG 56 HA ARG 56 4.667 -51.315 -0.343 384 HB2 ARG 56 HB2 ARG 56 2.445 -50.192 0.041 385 HB3 ARG 56 HB3 ARG 56 2.594 -49.491 -1.564 386 HG2 ARG 56 HG2 ARG 56 2.946 -52.403 -1.446 387 HG3 ARG 56 HG3 ARG 56 1.337 -51.819 -1.017 388 HD2 ARG 56 HD2 ARG 56 0.889 -51.109 -3.116 389 HD3 ARG 56 HD3 ARG 56 2.553 -50.606 -3.413 390 HE ARG 56 HE ARG 56 2.895 -52.608 -4.438 391 HH11 ARG 56 HH11 ARG 56 0.208 -52.941 -2.250 392 HH12 ARG 56 HH12 ARG 56 -0.137 -54.573 -2.716 393 HH21 ARG 56 HH21 ARG 56 2.451 -54.757 -5.060 394 HH22 ARG 56 HH22 ARG 56 1.139 -55.606 -4.314 395 H ASN 57 H ASN 57 6.348 -51.750 -1.685 396 HA ASN 57 HA ASN 57 6.238 -50.559 -4.379 397 HB2 ASN 57 HB2 ASN 57 8.394 -50.624 -2.501 398 HB3 ASN 57 HB3 ASN 57 8.834 -51.610 -3.893 399 HD21 ASN 57 HD21 ASN 57 10.378 -49.571 -3.632 400 HD22 ASN 57 HD22 ASN 57 9.988 -48.277 -4.708 401 HA PRO 58 HA PRO 58 5.830 -54.591 -6.066 402 HB2 PRO 58 HB2 PRO 58 7.168 -54.317 -8.413 403 HB3 PRO 58 HB3 PRO 58 5.589 -53.580 -8.115 404 HG2 PRO 58 HG2 PRO 58 8.314 -52.347 -7.973 405 HG3 PRO 58 HG3 PRO 58 6.823 -51.688 -8.671 406 HD2 PRO 58 HD2 PRO 58 7.730 -50.963 -6.225 407 HD3 PRO 58 HD3 PRO 58 6.001 -51.037 -6.618 408 H VAL 59 H VAL 59 9.133 -53.305 -6.498 409 HA VAL 59 HA VAL 59 10.303 -55.929 -6.479 410 HB VAL 59 HB VAL 59 12.457 -54.773 -6.555 411 HG11 VAL 59 HG11 VAL 59 11.284 -53.066 -8.507 412 HG12 VAL 59 HG12 VAL 59 12.119 -54.603 -8.742 413 HG13 VAL 59 HG13 VAL 59 10.377 -54.577 -8.466 414 HG21 VAL 59 HG21 VAL 59 12.274 -52.195 -6.797 415 HG22 VAL 59 HG22 VAL 59 10.769 -52.391 -5.898 416 HG23 VAL 59 HG23 VAL 59 12.296 -52.912 -5.186 417 H SER 60 H SER 60 9.688 -53.421 -4.140 418 HA SER 60 HA SER 60 11.484 -54.375 -2.144 419 HB2 SER 60 HB2 SER 60 10.561 -52.042 -2.243 420 HB3 SER 60 HB3 SER 60 9.002 -52.692 -1.737 421 HG SER 60 HG SER 60 11.436 -52.635 -0.298 422 H GLN 61 H GLN 61 8.213 -55.132 -3.065 423 HA GLN 61 HA GLN 61 6.674 -56.614 -2.271 424 HB2 GLN 61 HB2 GLN 61 9.117 -58.098 -1.292 425 HB3 GLN 61 HB3 GLN 61 7.532 -58.786 -1.620 426 HG2 GLN 61 HG2 GLN 61 7.886 -57.944 -4.017 427 HG3 GLN 61 HG3 GLN 61 9.580 -57.780 -3.556 428 HE21 GLN 61 HE21 GLN 61 7.582 -59.720 -5.134 429 HE22 GLN 61 HE22 GLN 61 8.302 -61.259 -4.826 430 H CYS 62 H CYS 62 6.862 -54.504 -0.602 431 HA CYS 62 HA CYS 62 6.305 -53.808 1.489 432 HB2 CYS 62 HB2 CYS 62 5.387 -56.580 1.365 433 HB3 CYS 62 HB3 CYS 62 5.749 -56.053 3.004 434 HG CYS 62 HG CYS 62 4.067 -53.624 1.752 435 H MET 63 H MET 63 8.173 -53.007 2.295 436 HA MET 63 HA MET 63 9.537 -54.550 4.299 437 HB2 MET 63 HB2 MET 63 10.607 -54.502 1.661 438 HB3 MET 63 HB3 MET 63 11.657 -53.532 2.685 439 HG2 MET 63 HG2 MET 63 11.313 -55.681 4.265 440 HG3 MET 63 HG3 MET 63 11.165 -56.430 2.677 441 HE1 MET 63 HE1 MET 63 13.000 -56.945 1.136 442 HE2 MET 63 HE2 MET 63 14.647 -57.091 1.747 443 HE3 MET 63 HE3 MET 63 13.323 -57.908 2.578 444 H ARG 64 H ARG 64 10.270 -51.727 2.238 445 HA ARG 64 HA ARG 64 11.366 -50.160 4.275 446 HB2 ARG 64 HB2 ARG 64 10.595 -49.810 1.510 447 HB3 ARG 64 HB3 ARG 64 10.199 -48.379 2.453 448 HG2 ARG 64 HG2 ARG 64 12.888 -49.540 2.857 449 HG3 ARG 64 HG3 ARG 64 12.574 -48.754 1.309 450 HD2 ARG 64 HD2 ARG 64 11.929 -46.715 2.427 451 HD3 ARG 64 HD3 ARG 64 12.077 -47.493 4.002 452 HE ARG 64 HE ARG 64 14.210 -46.459 2.364 453 HH11 ARG 64 HH11 ARG 64 13.350 -48.641 4.937 454 HH12 ARG 64 HH12 ARG 64 14.942 -48.672 5.619 455 HH21 ARG 64 HH21 ARG 64 16.311 -46.492 3.253 456 HH22 ARG 64 HH22 ARG 64 16.625 -47.449 4.661 457 H GLY 65 H GLY 65 10.232 -47.795 4.545 458 HA2 GLY 65 HA2 GLY 65 7.445 -47.695 4.907 459 HA3 GLY 65 HA3 GLY 65 8.184 -48.194 6.422 460 H VAL 66 H VAL 66 7.002 -45.603 4.879 461 HA VAL 66 HA VAL 66 8.835 -43.552 5.073 462 HB VAL 66 HB VAL 66 5.879 -43.426 5.685 463 HG11 VAL 66 HG11 VAL 66 6.056 -41.043 5.185 464 HG12 VAL 66 HG12 VAL 66 7.070 -41.479 6.562 465 HG13 VAL 66 HG13 VAL 66 7.799 -41.209 4.978 466 HG21 VAL 66 HG21 VAL 66 6.175 -42.333 3.237 467 HG22 VAL 66 HG22 VAL 66 7.458 -43.542 3.199 468 HG23 VAL 66 HG23 VAL 66 5.793 -44.033 3.512 469 H ARG 67 H ARG 67 9.971 -42.755 6.705 470 HA ARG 67 HA ARG 67 9.386 -43.507 9.421 471 HB2 ARG 67 HB2 ARG 67 11.696 -43.437 8.729 472 HB3 ARG 67 HB3 ARG 67 11.537 -41.761 8.219 473 HG2 ARG 67 HG2 ARG 67 12.707 -41.847 10.310 474 HG3 ARG 67 HG3 ARG 67 11.118 -41.125 10.569 475 HD2 ARG 67 HD2 ARG 67 10.608 -43.772 10.986 476 HD3 ARG 67 HD3 ARG 67 12.252 -43.622 11.604 477 HE ARG 67 HE ARG 67 10.460 -41.583 12.555 478 HH11 ARG 67 HH11 ARG 67 11.681 -44.802 13.077 479 HH12 ARG 67 HH12 ARG 67 11.311 -44.809 14.769 480 HH21 ARG 67 HH21 ARG 67 9.968 -41.580 14.783 481 HH22 ARG 67 HH22 ARG 67 10.336 -42.976 15.738 482 H LEU 68 H LEU 68 8.659 -42.227 11.068 483 HA LEU 68 HA LEU 68 7.829 -39.492 10.353 484 HB2 LEU 68 HB2 LEU 68 5.884 -40.919 10.443 485 HB3 LEU 68 HB3 LEU 68 6.363 -41.523 12.028 486 HG LEU 68 HG LEU 68 4.464 -39.777 11.856 487 HD11 LEU 68 HD11 LEU 68 6.360 -40.412 13.821 488 HD12 LEU 68 HD12 LEU 68 4.769 -39.686 14.049 489 HD13 LEU 68 HD13 LEU 68 6.188 -38.657 13.854 490 HD21 LEU 68 HD21 LEU 68 6.237 -38.327 10.469 491 HD22 LEU 68 HD22 LEU 68 6.575 -37.721 12.090 492 HD23 LEU 68 HD23 LEU 68 4.944 -37.607 11.428 493 H VAL 69 H VAL 69 8.665 -37.961 11.600 494 HA VAL 69 HA VAL 69 9.263 -38.536 14.405 495 HB VAL 69 HB VAL 69 11.385 -38.949 13.366 496 HG11 VAL 69 HG11 VAL 69 12.120 -36.472 12.239 497 HG12 VAL 69 HG12 VAL 69 11.896 -38.017 11.417 498 HG13 VAL 69 HG13 VAL 69 10.545 -36.893 11.568 499 HG21 VAL 69 HG21 VAL 69 11.092 -37.332 15.429 500 HG22 VAL 69 HG22 VAL 69 12.678 -37.626 14.717 501 HG23 VAL 69 HG23 VAL 69 11.790 -36.157 14.315 502 H GLU 70 H GLU 70 8.339 -37.012 15.591 503 HA GLU 70 HA GLU 70 7.548 -35.003 16.310 504 HB2 GLU 70 HB2 GLU 70 9.297 -33.721 14.214 505 HB3 GLU 70 HB3 GLU 70 8.716 -33.009 15.713 506 HG2 GLU 70 HG2 GLU 70 10.137 -35.309 16.449 507 HG3 GLU 70 HG3 GLU 70 11.106 -34.504 15.216 508 H GLY 71 H GLY 71 6.333 -36.455 14.025 509 HA2 GLY 71 HA2 GLY 71 4.270 -36.030 12.992 510 HA3 GLY 71 HA3 GLY 71 4.548 -34.307 13.195 511 H ILE 72 H ILE 72 7.293 -34.606 12.038 512 HA ILE 72 HA ILE 72 6.521 -34.194 9.296 513 HB ILE 72 HB ILE 72 9.265 -34.209 10.559 514 HG12 ILE 72 HG12 ILE 72 8.420 -31.633 9.683 515 HG13 ILE 72 HG13 ILE 72 7.129 -32.319 10.663 516 HG21 ILE 72 HG21 ILE 72 9.456 -32.670 8.326 517 HG22 ILE 72 HG22 ILE 72 9.934 -34.364 8.424 518 HG23 ILE 72 HG23 ILE 72 8.347 -33.932 7.790 519 HD11 ILE 72 HD11 ILE 72 9.626 -32.785 11.955 520 HD12 ILE 72 HD12 ILE 72 9.494 -31.079 11.527 521 HD13 ILE 72 HD13 ILE 72 8.242 -31.842 12.507 522 H LEU 73 H LEU 73 6.381 -35.726 7.807 523 HA LEU 73 HA LEU 73 7.349 -38.386 8.311 524 HB2 LEU 73 HB2 LEU 73 5.864 -37.084 6.055 525 HB3 LEU 73 HB3 LEU 73 6.475 -38.732 5.919 526 HG LEU 73 HG LEU 73 4.143 -38.787 6.503 527 HD11 LEU 73 HD11 LEU 73 5.815 -39.461 8.918 528 HD12 LEU 73 HD12 LEU 73 5.628 -40.480 7.492 529 HD13 LEU 73 HD13 LEU 73 4.234 -40.128 8.513 530 HD21 LEU 73 HD21 LEU 73 3.161 -37.648 8.271 531 HD22 LEU 73 HD22 LEU 73 4.296 -36.464 7.622 532 HD23 LEU 73 HD23 LEU 73 4.704 -37.369 9.080 533 H HIS 74 H HIS 74 9.472 -38.742 8.138 534 HA HIS 74 HA HIS 74 11.120 -37.314 6.262 535 HB2 HIS 74 HB2 HIS 74 11.568 -38.659 8.655 536 HB3 HIS 74 HB3 HIS 74 12.349 -39.673 7.445 537 HD1 HIS 74 HD1 HIS 74 13.796 -37.927 5.646 538 HD2 HIS 74 HD2 HIS 74 13.367 -36.928 9.656 539 HE1 HIS 74 HE1 HIS 74 15.651 -36.302 6.136 540 H ALA 75 H ALA 75 12.275 -38.202 4.517 541 HA ALA 75 HA ALA 75 10.935 -40.497 3.280 542 HB1 ALA 75 HB1 ALA 75 12.415 -39.593 1.278 543 HB2 ALA 75 HB2 ALA 75 10.864 -38.863 1.694 544 HB3 ALA 75 HB3 ALA 75 12.365 -38.114 2.238 545 HA PRO 76 HA PRO 76 14.375 -43.196 3.640 546 HB2 PRO 76 HB2 PRO 76 14.306 -44.517 1.269 547 HB3 PRO 76 HB3 PRO 76 13.116 -44.778 2.549 548 HG2 PRO 76 HG2 PRO 76 12.905 -43.098 0.081 549 HG3 PRO 76 HG3 PRO 76 11.705 -44.188 0.797 550 HD2 PRO 76 HD2 PRO 76 11.614 -41.503 1.129 551 HD3 PRO 76 HD3 PRO 76 11.051 -42.638 2.372 552 H ASP 77 H ASP 77 16.257 -44.106 2.101 553 HA ASP 77 HA ASP 77 17.847 -41.799 1.453 554 HB2 ASP 77 HB2 ASP 77 18.332 -44.753 1.566 555 HB3 ASP 77 HB3 ASP 77 19.489 -43.716 0.735 556 H ALA 78 H ALA 78 15.541 -43.423 -0.225 557 HA ALA 78 HA ALA 78 16.869 -43.018 -2.822 558 HB1 ALA 78 HB1 ALA 78 14.906 -44.447 -3.658 559 HB2 ALA 78 HB2 ALA 78 16.187 -45.247 -2.746 560 HB3 ALA 78 HB3 ALA 78 14.660 -44.852 -1.959 561 H GLY 79 H GLY 79 14.217 -42.045 -0.808 562 HA2 GLY 79 HA2 GLY 79 13.358 -39.783 -1.249 563 HA3 GLY 79 HA3 GLY 79 13.330 -40.215 -2.953 564 H TRP 80 H TRP 80 11.063 -39.236 -2.193 565 HA TRP 80 HA TRP 80 9.242 -40.964 -0.905 566 HB2 TRP 80 HB2 TRP 80 8.824 -38.666 -2.820 567 HB3 TRP 80 HB3 TRP 80 7.498 -39.516 -2.031 568 HD1 TRP 80 HD1 TRP 80 9.469 -36.519 -1.610 569 HE1 TRP 80 HE1 TRP 80 9.412 -35.670 0.819 570 HE3 TRP 80 HE3 TRP 80 7.614 -40.702 0.669 571 HZ2 TRP 80 HZ2 TRP 80 8.678 -36.645 3.365 572 HZ3 TRP 80 HZ3 TRP 80 7.264 -40.662 3.104 573 HH2 TRP 80 HH2 TRP 80 7.787 -38.675 4.422 574 H GLY 81 H GLY 81 9.550 -40.188 -4.381 575 HA2 GLY 81 HA2 GLY 81 9.415 -41.667 -6.180 576 HA3 GLY 81 HA3 GLY 81 9.002 -42.955 -5.059 577 H ASN 82 H ASN 82 7.464 -43.420 -6.872 578 HA ASN 82 HA ASN 82 4.965 -41.922 -6.441 579 HB2 ASN 82 HB2 ASN 82 5.503 -43.282 -9.054 580 HB3 ASN 82 HB3 ASN 82 4.453 -41.912 -8.705 581 HD21 ASN 82 HD21 ASN 82 5.741 -39.974 -7.790 582 HD22 ASN 82 HD22 ASN 82 7.162 -39.557 -8.681 583 H LEU 83 H LEU 83 5.878 -44.271 -5.054 584 HA LEU 83 HA LEU 83 4.309 -46.463 -6.153 585 HB2 LEU 83 HB2 LEU 83 5.156 -47.637 -4.057 586 HB3 LEU 83 HB3 LEU 83 6.341 -47.208 -5.289 587 HG LEU 83 HG LEU 83 6.928 -46.843 -2.805 588 HD11 LEU 83 HD11 LEU 83 7.697 -45.591 -5.179 589 HD12 LEU 83 HD12 LEU 83 8.592 -45.653 -3.661 590 HD13 LEU 83 HD13 LEU 83 7.519 -44.294 -3.997 591 HD21 LEU 83 HD21 LEU 83 4.775 -45.684 -2.299 592 HD22 LEU 83 HD22 LEU 83 5.335 -44.329 -3.281 593 HD23 LEU 83 HD23 LEU 83 6.216 -44.785 -1.821 594 H VAL 84 H VAL 84 3.244 -47.754 -4.103 595 HA VAL 84 HA VAL 84 1.155 -45.929 -3.187 596 HB VAL 84 HB VAL 84 1.181 -48.922 -2.847 597 HG11 VAL 84 HG11 VAL 84 -1.393 -48.174 -3.225 598 HG12 VAL 84 HG12 VAL 84 -0.625 -48.324 -1.643 599 HG13 VAL 84 HG13 VAL 84 -0.747 -46.744 -2.419 600 HG21 VAL 84 HG21 VAL 84 -0.422 -48.623 -4.957 601 HG22 VAL 84 HG22 VAL 84 0.691 -47.291 -5.272 602 HG23 VAL 84 HG23 VAL 84 1.307 -48.936 -5.116 603 H TYR 85 H TYR 85 0.365 -46.043 -0.987 604 HA TYR 85 HA TYR 85 2.366 -46.962 0.962 605 HB2 TYR 85 HB2 TYR 85 2.571 -44.934 1.967 606 HB3 TYR 85 HB3 TYR 85 2.119 -44.342 0.372 607 HD1 TYR 85 HD1 TYR 85 0.065 -43.199 0.024 608 HD2 TYR 85 HD2 TYR 85 0.847 -45.067 3.765 609 HE1 TYR 85 HE1 TYR 85 -1.880 -42.051 0.997 610 HE2 TYR 85 HE2 TYR 85 -1.097 -43.925 4.748 611 HH TYR 85 HH TYR 85 -2.427 -41.828 4.284 612 H VAL 86 H VAL 86 1.567 -47.647 2.949 613 HA VAL 86 HA VAL 86 -1.340 -48.112 3.002 614 HB VAL 86 HB VAL 86 0.838 -49.646 4.429 615 HG11 VAL 86 HG11 VAL 86 -2.125 -50.171 4.215 616 HG12 VAL 86 HG12 VAL 86 -0.943 -51.240 4.973 617 HG13 VAL 86 HG13 VAL 86 -1.263 -49.647 5.661 618 HG21 VAL 86 HG21 VAL 86 -0.617 -51.239 2.587 619 HG22 VAL 86 HG22 VAL 86 -0.079 -49.788 1.741 620 HG23 VAL 86 HG23 VAL 86 1.096 -50.818 2.560 621 H VAL 87 H VAL 87 -2.450 -46.919 4.391 622 HA VAL 87 HA VAL 87 -1.338 -45.187 6.276 623 HB VAL 87 HB VAL 87 -3.682 -45.136 7.262 624 HG11 VAL 87 HG11 VAL 87 -3.030 -43.486 5.666 625 HG12 VAL 87 HG12 VAL 87 -3.227 -44.620 4.328 626 HG13 VAL 87 HG13 VAL 87 -4.639 -44.052 5.220 627 HG21 VAL 87 HG21 VAL 87 -4.504 -46.708 4.853 628 HG22 VAL 87 HG22 VAL 87 -4.097 -47.533 6.357 629 HG23 VAL 87 HG23 VAL 87 -5.412 -46.359 6.324 630 H ASN 88 H ASN 88 -1.525 -45.213 8.608 631 HA ASN 88 HA ASN 88 -1.816 -47.829 9.862 632 HB2 ASN 88 HB2 ASN 88 0.711 -46.178 9.952 633 HB3 ASN 88 HB3 ASN 88 0.351 -47.440 11.127 634 HD21 ASN 88 HD21 ASN 88 2.421 -47.095 8.965 635 HD22 ASN 88 HD22 ASN 88 2.349 -48.571 8.070 636 H TYR 89 H TYR 89 -2.788 -47.697 11.791 637 HA TYR 89 HA TYR 89 -2.865 -45.074 13.130 638 HB2 TYR 89 HB2 TYR 89 -5.164 -47.026 13.124 639 HB3 TYR 89 HB3 TYR 89 -5.169 -45.347 13.654 640 HD1 TYR 89 HD1 TYR 89 -5.394 -43.546 12.075 641 HD2 TYR 89 HD2 TYR 89 -5.157 -47.576 10.730 642 HE1 TYR 89 HE1 TYR 89 -6.142 -42.838 9.842 643 HE2 TYR 89 HE2 TYR 89 -5.904 -46.879 8.493 644 HH TYR 89 HH TYR 89 -7.344 -44.813 7.595 645 HA PRO 90 HA PRO 90 -1.308 -48.411 15.996 646 HB2 PRO 90 HB2 PRO 90 0.877 -47.028 16.824 647 HB3 PRO 90 HB3 PRO 90 0.881 -48.064 15.392 648 HG2 PRO 90 HG2 PRO 90 0.598 -45.089 15.578 649 HG3 PRO 90 HG3 PRO 90 1.558 -46.053 14.441 650 HD2 PRO 90 HD2 PRO 90 -0.845 -44.992 13.785 651 HD3 PRO 90 HD3 PRO 90 -0.263 -46.527 13.110 652 H LYS 91 H LYS 91 -0.319 -47.762 18.352 653 HA LYS 91 HA LYS 91 -2.494 -46.568 19.726 654 HB2 LYS 91 HB2 LYS 91 -0.071 -47.994 20.401 655 HB3 LYS 91 HB3 LYS 91 -0.307 -46.627 21.481 656 HG2 LYS 91 HG2 LYS 91 -2.706 -47.517 21.740 657 HG3 LYS 91 HG3 LYS 91 -2.065 -49.010 21.049 658 HD2 LYS 91 HD2 LYS 91 -0.354 -49.061 22.828 659 HD3 LYS 91 HD3 LYS 91 -1.075 -47.614 23.536 660 HE2 LYS 91 HE2 LYS 91 -3.253 -48.982 23.585 661 HE3 LYS 91 HE3 LYS 91 -2.213 -50.383 23.335 662 HZ1 LYS 91 HZ1 LYS 91 -1.726 -48.455 25.524 663 HZ2 LYS 91 HZ2 LYS 91 -1.143 -50.035 25.366 664 HZ3 LYS 91 HZ3 LYS 91 -2.777 -49.768 25.714 665 H ASP 92 H ASP 92 -2.274 -44.754 21.271 666 HA ASP 92 HA ASP 92 -1.461 -42.401 19.972 667 HB2 ASP 92 HB2 ASP 92 -2.436 -43.086 22.704 668 HB3 ASP 92 HB3 ASP 92 -1.674 -41.515 22.475 669 H ASN 93 H ASN 93 -0.205 -43.420 23.139 670 HA ASN 93 HA ASN 93 1.863 -43.279 24.074 671 HB2 ASN 93 HB2 ASN 93 2.247 -44.673 21.828 672 HB3 ASN 93 HB3 ASN 93 3.227 -43.266 21.427 673 HD21 ASN 93 HD21 ASN 93 4.674 -45.355 21.499 674 HD22 ASN 93 HD22 ASN 93 5.553 -45.549 22.974 675 H LYS 94 H LYS 94 0.500 -40.859 23.479 676 HA LYS 94 HA LYS 94 2.667 -39.033 22.709 677 HB2 LYS 94 HB2 LYS 94 0.176 -39.026 21.777 678 HB3 LYS 94 HB3 LYS 94 -0.106 -38.065 23.222 679 HG2 LYS 94 HG2 LYS 94 1.103 -36.297 22.455 680 HG3 LYS 94 HG3 LYS 94 2.177 -37.309 21.486 681 HD2 LYS 94 HD2 LYS 94 0.981 -36.509 19.755 682 HD3 LYS 94 HD3 LYS 94 -0.197 -37.731 20.241 683 HE2 LYS 94 HE2 LYS 94 -1.477 -36.139 21.448 684 HE3 LYS 94 HE3 LYS 94 -0.205 -34.924 21.328 685 HZ1 LYS 94 HZ1 LYS 94 -2.131 -35.803 19.301 686 HZ2 LYS 94 HZ2 LYS 94 -0.613 -35.263 18.786 687 HZ3 LYS 94 HZ3 LYS 94 -1.613 -34.240 19.688 688 H ARG 95 H ARG 95 2.723 -36.935 23.951 689 HA ARG 95 HA ARG 95 1.700 -36.690 26.545 690 HB2 ARG 95 HB2 ARG 95 3.610 -38.644 26.512 691 HB3 ARG 95 HB3 ARG 95 4.568 -37.226 26.917 692 HG2 ARG 95 HG2 ARG 95 2.617 -36.839 28.653 693 HG3 ARG 95 HG3 ARG 95 2.437 -38.585 28.468 694 HD2 ARG 95 HD2 ARG 95 5.158 -37.457 28.917 695 HD3 ARG 95 HD3 ARG 95 4.047 -37.563 30.282 696 HE ARG 95 HE ARG 95 5.410 -39.726 28.998 697 HH11 ARG 95 HH11 ARG 95 2.554 -38.843 30.782 698 HH12 ARG 95 HH12 ARG 95 2.288 -40.439 31.400 699 HH21 ARG 95 HH21 ARG 95 5.070 -41.832 29.806 700 HH22 ARG 95 HH22 ARG 95 3.720 -42.139 30.845 701 H LYS 96 H LYS 96 4.723 -36.126 24.746 702 HA LYS 96 HA LYS 96 5.090 -33.513 25.857 703 HB2 LYS 96 HB2 LYS 96 6.410 -34.991 23.583 704 HB3 LYS 96 HB3 LYS 96 6.851 -33.346 24.024 705 HG2 LYS 96 HG2 LYS 96 6.867 -35.496 26.096 706 HG3 LYS 96 HG3 LYS 96 8.210 -35.346 24.960 707 HD2 LYS 96 HD2 LYS 96 7.257 -32.914 26.399 708 HD3 LYS 96 HD3 LYS 96 8.246 -34.089 27.269 709 HE2 LYS 96 HE2 LYS 96 10.033 -33.848 25.706 710 HE3 LYS 96 HE3 LYS 96 9.030 -32.889 24.619 711 HZ1 LYS 96 HZ1 LYS 96 10.209 -31.264 25.676 712 HZ2 LYS 96 HZ2 LYS 96 10.312 -32.107 27.138 713 HZ3 LYS 96 HZ3 LYS 96 8.866 -31.347 26.700 714 H MET 97 H MET 97 5.358 -31.581 24.385 715 HA MET 97 HA MET 97 3.352 -31.575 22.236 716 HB2 MET 97 HB2 MET 97 3.583 -29.688 24.565 717 HB3 MET 97 HB3 MET 97 2.833 -29.178 23.058 718 HG2 MET 97 HG2 MET 97 0.931 -30.019 23.802 719 HG3 MET 97 HG3 MET 97 1.647 -31.623 23.666 720 HE1 MET 97 HE1 MET 97 -0.415 -30.973 27.121 721 HE2 MET 97 HE2 MET 97 -0.267 -29.454 26.237 722 HE3 MET 97 HE3 MET 97 -0.681 -30.938 25.378 723 H ASP 98 H ASP 98 5.750 -29.416 23.765 724 HA ASP 98 HA ASP 98 7.401 -28.118 22.892 725 HB2 ASP 98 HB2 ASP 98 7.860 -30.500 21.829 726 HB3 ASP 98 HB3 ASP 98 7.416 -29.670 20.340 727 H GLU 99 H GLU 99 6.275 -26.222 22.635 728 HA GLU 99 HA GLU 99 4.983 -25.766 20.034 729 HB2 GLU 99 HB2 GLU 99 4.668 -24.449 22.722 730 HB3 GLU 99 HB3 GLU 99 4.083 -23.686 21.250 731 HG2 GLU 99 HG2 GLU 99 2.194 -24.799 21.557 732 HG3 GLU 99 HG3 GLU 99 3.078 -26.255 21.104 733 H THR 100 H THR 100 5.086 -23.234 19.533 734 HA THR 100 HA THR 100 7.659 -22.048 20.079 735 HB THR 100 HB THR 100 8.176 -23.648 18.240 736 HG1 THR 100 HG1 THR 100 8.369 -21.072 17.127 737 HG21 THR 100 HG21 THR 100 5.758 -22.633 17.168 738 HG22 THR 100 HG22 THR 100 6.821 -23.865 16.487 739 HG23 THR 100 HG23 THR 100 7.058 -22.168 16.071 740 H ASP 101 H ASP 101 7.891 -19.915 19.003 741 HA ASP 101 HA ASP 101 5.681 -18.683 17.718 742 HB2 ASP 101 HB2 ASP 101 5.425 -18.871 20.502 743 HB3 ASP 101 HB3 ASP 101 5.935 -17.212 20.198 744 H ALA 102 H ALA 102 6.033 -16.060 18.307 745 HA ALA 102 HA ALA 102 7.353 -14.252 17.895 746 HB1 ALA 102 HB1 ALA 102 9.968 -15.182 18.426 747 HB2 ALA 102 HB2 ALA 102 8.935 -14.181 19.447 748 HB3 ALA 102 HB3 ALA 102 8.892 -15.937 19.602 749 H SER 103 H SER 103 7.362 -13.867 15.765 750 HA SER 103 HA SER 103 9.619 -14.553 14.191 751 HB2 SER 103 HB2 SER 103 8.043 -16.670 14.238 752 HB3 SER 103 HB3 SER 103 7.129 -15.752 13.041 753 HG SER 103 HG SER 103 9.757 -16.748 12.894 754 H SER 104 H SER 104 9.583 -12.287 13.965 755 HA SER 104 HA SER 104 8.345 -11.323 11.641 756 HB2 SER 104 HB2 SER 104 6.496 -11.394 13.630 757 HB3 SER 104 HB3 SER 104 7.161 -9.778 13.867 758 HG SER 104 HG SER 104 6.846 -9.786 11.377 759 H ALA 105 H ALA 105 9.433 -9.582 10.932 760 HA ALA 105 HA ALA 105 10.456 -7.512 12.533 761 HB1 ALA 105 HB1 ALA 105 12.012 -9.823 12.696 762 HB2 ALA 105 HB2 ALA 105 12.885 -8.748 11.603 763 HB3 ALA 105 HB3 ALA 105 12.453 -8.197 13.221 764 H VAL 106 H VAL 106 11.698 -5.953 11.314 765 HA VAL 106 HA VAL 106 11.942 -6.405 8.446 766 HB VAL 106 HB VAL 106 10.751 -4.268 7.933 767 HG11 VAL 106 HG11 VAL 106 9.769 -6.659 7.856 768 HG12 VAL 106 HG12 VAL 106 8.834 -6.145 9.262 769 HG13 VAL 106 HG13 VAL 106 8.674 -5.283 7.732 770 HG21 VAL 106 HG21 VAL 106 10.785 -3.948 10.694 771 HG22 VAL 106 HG22 VAL 106 9.930 -2.942 9.524 772 HG23 VAL 106 HG23 VAL 106 9.098 -4.286 10.306 773 H LYS 107 H LYS 107 13.564 -5.253 7.524 774 HA LYS 107 HA LYS 107 14.591 -2.817 8.519 775 HB2 LYS 107 HB2 LYS 107 15.374 -4.752 10.168 776 HB3 LYS 107 HB3 LYS 107 16.603 -4.978 8.930 777 HG2 LYS 107 HG2 LYS 107 17.773 -3.379 9.915 778 HG3 LYS 107 HG3 LYS 107 16.541 -2.231 9.386 779 HD2 LYS 107 HD2 LYS 107 15.325 -3.190 11.569 780 HD3 LYS 107 HD3 LYS 107 17.005 -3.433 12.053 781 HE2 LYS 107 HE2 LYS 107 17.498 -1.135 11.851 782 HE3 LYS 107 HE3 LYS 107 16.007 -0.814 10.966 783 HZ1 LYS 107 HZ1 LYS 107 16.462 -0.924 13.796 784 HZ2 LYS 107 HZ2 LYS 107 15.137 -1.858 13.314 785 HZ3 LYS 107 HZ3 LYS 107 15.193 -0.211 12.933 786 H VAL 108 H VAL 108 15.555 -1.830 6.865 787 HA VAL 108 HA VAL 108 17.152 -3.329 4.959 788 HB VAL 108 HB VAL 108 15.926 -2.337 3.009 789 HG11 VAL 108 HG11 VAL 108 14.216 -4.189 4.658 790 HG12 VAL 108 HG12 VAL 108 14.297 -4.073 2.899 791 HG13 VAL 108 HG13 VAL 108 15.673 -4.701 3.807 792 HG21 VAL 108 HG21 VAL 108 14.501 -1.025 5.074 793 HG22 VAL 108 HG22 VAL 108 14.285 -0.875 3.330 794 HG23 VAL 108 HG23 VAL 108 13.368 -2.082 4.231 795 H LYS 109 H LYS 109 18.585 -2.052 3.780 796 HA LYS 109 HA LYS 109 18.487 0.811 3.865 797 HB2 LYS 109 HB2 LYS 109 19.351 0.135 6.156 798 HB3 LYS 109 HB3 LYS 109 20.777 -0.490 5.338 799 HG2 LYS 109 HG2 LYS 109 20.643 2.016 4.310 800 HG3 LYS 109 HG3 LYS 109 20.000 2.271 5.935 801 HD2 LYS 109 HD2 LYS 109 22.002 1.093 6.838 802 HD3 LYS 109 HD3 LYS 109 22.654 1.038 5.199 803 HE2 LYS 109 HE2 LYS 109 21.832 3.609 6.523 804 HE3 LYS 109 HE3 LYS 109 23.450 2.933 6.702 805 HZ1 LYS 109 HZ1 LYS 109 22.695 4.597 4.732 806 HZ2 LYS 109 HZ2 LYS 109 22.524 3.095 3.974 807 HZ3 LYS 109 HZ3 LYS 109 24.013 3.541 4.640 808 H ARG 110 H ARG 110 19.604 1.662 2.201 809 HA ARG 110 HA ARG 110 21.272 -0.184 0.634 810 HB2 ARG 110 HB2 ARG 110 19.251 1.769 -0.063 811 HB3 ARG 110 HB3 ARG 110 20.758 2.095 -0.908 812 HG2 ARG 110 HG2 ARG 110 19.688 -0.684 -0.878 813 HG3 ARG 110 HG3 ARG 110 18.956 0.515 -1.945 814 HD2 ARG 110 HD2 ARG 110 21.447 0.999 -2.599 815 HD3 ARG 110 HD3 ARG 110 21.712 -0.627 -1.973 816 HE ARG 110 HE ARG 110 19.550 -0.691 -3.755 817 HH11 ARG 110 HH11 ARG 110 22.997 -0.201 -3.759 818 HH12 ARG 110 HH12 ARG 110 23.211 -0.802 -5.370 819 HH21 ARG 110 HH21 ARG 110 19.820 -1.484 -5.876 820 HH22 ARG 110 HH22 ARG 110 21.404 -1.531 -6.574 821 H ALA 111 H ALA 111 22.924 1.125 -0.776 822 HA ALA 111 HA ALA 111 24.151 3.319 0.694 823 HB1 ALA 111 HB1 ALA 111 25.004 0.811 1.277 824 HB2 ALA 111 HB2 ALA 111 26.101 1.250 -0.033 825 HB3 ALA 111 HB3 ALA 111 25.999 2.262 1.407 826 H VAL 112 H VAL 112 24.808 4.816 -0.698 827 HA VAL 112 HA VAL 112 25.125 4.076 -3.516 828 HB VAL 112 HB VAL 112 24.887 6.435 -4.028 829 HG11 VAL 112 HG11 VAL 112 22.649 6.467 -2.259 830 HG12 VAL 112 HG12 VAL 112 22.688 6.129 -3.991 831 HG13 VAL 112 HG13 VAL 112 22.904 4.819 -2.830 832 HG21 VAL 112 HG21 VAL 112 24.241 7.955 -2.044 833 HG22 VAL 112 HG22 VAL 112 25.056 6.746 -1.052 834 HG23 VAL 112 HG23 VAL 112 25.947 7.598 -2.314 835 H GLN 113 H GLN 113 26.986 4.404 -4.644 836 HA GLN 113 HA GLN 113 29.165 5.950 -3.609 837 HB2 GLN 113 HB2 GLN 113 30.754 3.986 -3.565 838 HB3 GLN 113 HB3 GLN 113 29.600 4.060 -2.239 839 HG2 GLN 113 HG2 GLN 113 28.209 2.394 -3.341 840 HG3 GLN 113 HG3 GLN 113 29.341 2.333 -4.691 841 HE21 GLN 113 HE21 GLN 113 28.406 0.359 -2.594 842 HE22 GLN 113 HE22 GLN 113 29.870 -0.313 -1.970 843 H LYS 114 H LYS 114 30.752 6.357 -5.146 844 HA LYS 114 HA LYS 114 29.995 5.637 -7.874 845 HB2 LYS 114 HB2 LYS 114 30.380 8.021 -7.279 846 HB3 LYS 114 HB3 LYS 114 32.057 7.632 -6.917 847 HG2 LYS 114 HG2 LYS 114 32.156 6.761 -9.335 848 HG3 LYS 114 HG3 LYS 114 30.666 7.679 -9.566 849 HD2 LYS 114 HD2 LYS 114 31.722 9.675 -9.445 850 HD3 LYS 114 HD3 LYS 114 32.865 9.114 -8.222 851 HE2 LYS 114 HE2 LYS 114 33.764 7.676 -10.256 852 HE3 LYS 114 HE3 LYS 114 33.024 8.977 -11.188 853 HZ1 LYS 114 HZ1 LYS 114 35.470 9.187 -10.462 854 HZ2 LYS 114 HZ2 LYS 114 34.834 9.607 -8.952 855 HZ3 LYS 114 HZ3 LYS 114 34.459 10.536 -10.315 Start of MODEL 4 1 H1 MET 1 H MET 1 -8.398 -28.835 12.856 2 HA MET 1 HA MET 1 -7.823 -30.581 14.217 3 HB2 MET 1 HB2 MET 1 -9.123 -31.887 12.267 4 HB3 MET 1 HB3 MET 1 -7.509 -32.531 12.000 5 HG2 MET 1 HG2 MET 1 -7.982 -32.646 14.772 6 HG3 MET 1 HG3 MET 1 -9.434 -33.249 13.976 7 HE1 MET 1 HE1 MET 1 -7.842 -36.028 11.643 8 HE2 MET 1 HE2 MET 1 -9.381 -35.411 12.241 9 HE3 MET 1 HE3 MET 1 -8.305 -34.357 11.323 10 H ALA 2 H ALA 2 -5.932 -28.810 13.168 11 HA ALA 2 HA ALA 2 -3.532 -30.308 13.615 12 HB1 ALA 2 HB1 ALA 2 -4.320 -29.591 10.869 13 HB2 ALA 2 HB2 ALA 2 -2.654 -29.221 11.313 14 HB3 ALA 2 HB3 ALA 2 -3.257 -30.873 11.450 15 H GLY 3 H GLY 3 -1.686 -28.966 13.943 16 HA2 GLY 3 HA2 GLY 3 -1.056 -26.459 13.563 17 HA3 GLY 3 HA3 GLY 3 -2.435 -26.212 14.623 18 H SER 4 H SER 4 0.893 -26.877 14.440 19 HA SER 4 HA SER 4 1.125 -26.731 17.317 20 HB2 SER 4 HB2 SER 4 2.342 -29.115 15.914 21 HB3 SER 4 HB3 SER 4 2.293 -28.794 17.647 22 HG SER 4 HG SER 4 0.275 -29.701 15.939 23 H HIS 5 H HIS 5 3.321 -26.378 18.027 24 HA HIS 5 HA HIS 5 5.368 -25.395 17.895 25 HB2 HIS 5 HB2 HIS 5 5.238 -27.140 15.538 26 HB3 HIS 5 HB3 HIS 5 6.377 -25.807 15.376 27 HD1 HIS 5 HD1 HIS 5 5.767 -28.949 17.303 28 HD2 HIS 5 HD2 HIS 5 8.629 -25.949 17.033 29 HE1 HIS 5 HE1 HIS 5 7.760 -29.804 18.577 30 H HIS 6 H HIS 6 6.664 -23.725 16.623 31 HA HIS 6 HA HIS 6 4.783 -21.870 15.319 32 HB2 HIS 6 HB2 HIS 6 7.092 -21.395 17.181 33 HB3 HIS 6 HB3 HIS 6 6.544 -20.125 16.090 34 HD1 HIS 6 HD1 HIS 6 6.165 -19.120 18.690 35 HD2 HIS 6 HD2 HIS 6 3.451 -21.891 17.200 36 HE1 HIS 6 HE1 HIS 6 4.094 -18.854 20.092 37 H HIS 7 H HIS 7 6.153 -23.887 13.880 38 HA HIS 7 HA HIS 7 7.396 -24.192 11.998 39 HB2 HIS 7 HB2 HIS 7 6.255 -21.573 11.819 40 HB3 HIS 7 HB3 HIS 7 7.866 -21.538 11.108 41 HD1 HIS 7 HD1 HIS 7 8.265 -23.040 9.010 42 HD2 HIS 7 HD2 HIS 7 4.341 -22.972 10.374 43 HE1 HIS 7 HE1 HIS 7 6.889 -24.029 7.152 44 H HIS 8 H HIS 8 9.298 -24.945 12.850 45 HA HIS 8 HA HIS 8 11.345 -22.997 13.618 46 HB2 HIS 8 HB2 HIS 8 10.648 -25.235 14.895 47 HB3 HIS 8 HB3 HIS 8 11.843 -25.927 13.802 48 HD1 HIS 8 HD1 HIS 8 13.586 -23.147 14.000 49 HD2 HIS 8 HD2 HIS 8 12.402 -25.689 17.065 50 HE1 HIS 8 HE1 HIS 8 15.212 -22.742 15.875 51 H HIS 9 H HIS 9 12.819 -22.392 12.189 52 HA HIS 9 HA HIS 9 13.971 -24.306 10.347 53 HB2 HIS 9 HB2 HIS 9 11.825 -22.981 9.389 54 HB3 HIS 9 HB3 HIS 9 13.088 -21.818 8.999 55 HD1 HIS 9 HD1 HIS 9 14.268 -22.208 6.856 56 HD2 HIS 9 HD2 HIS 9 12.447 -25.662 8.276 57 HE1 HIS 9 HE1 HIS 9 14.610 -23.935 5.061 58 H HIS 10 H HIS 10 15.761 -23.268 9.050 59 HA HIS 10 HA HIS 10 16.909 -20.917 10.364 60 HB2 HIS 10 HB2 HIS 10 17.788 -23.094 11.377 61 HB3 HIS 10 HB3 HIS 10 18.581 -23.368 9.828 62 HD1 HIS 10 HD1 HIS 10 19.290 -22.069 13.034 63 HD2 HIS 10 HD2 HIS 10 20.245 -20.891 9.166 64 HE1 HIS 10 HE1 HIS 10 21.287 -20.559 13.265 65 H GLY 11 H GLY 11 17.893 -23.346 7.936 66 HA2 GLY 11 HA2 GLY 11 17.883 -22.850 5.576 67 HA3 GLY 11 HA3 GLY 11 18.113 -21.155 5.977 68 H SER 12 H SER 12 19.678 -24.314 5.917 69 HA SER 12 HA SER 12 22.113 -23.286 4.948 70 HB2 SER 12 HB2 SER 12 22.031 -22.607 7.491 71 HB3 SER 12 HB3 SER 12 22.493 -24.290 7.744 72 HG SER 12 HG SER 12 24.243 -23.843 6.221 73 H MET 13 H MET 13 22.250 -24.947 3.545 74 HA MET 13 HA MET 13 22.511 -27.054 2.725 75 HB2 MET 13 HB2 MET 13 23.863 -27.199 5.399 76 HB3 MET 13 HB3 MET 13 23.750 -28.632 4.386 77 HG2 MET 13 HG2 MET 13 25.599 -27.964 3.376 78 HG3 MET 13 HG3 MET 13 24.666 -26.638 2.684 79 HE1 MET 13 HE1 MET 13 27.780 -27.492 4.628 80 HE2 MET 13 HE2 MET 13 27.772 -26.617 3.096 81 HE3 MET 13 HE3 MET 13 28.377 -25.833 4.557 82 H SER 14 H SER 14 20.339 -27.608 2.523 83 HA SER 14 HA SER 14 19.494 -29.897 3.933 84 HB2 SER 14 HB2 SER 14 17.568 -29.005 5.142 85 HB3 SER 14 HB3 SER 14 19.050 -28.247 5.724 86 HG SER 14 HG SER 14 17.304 -26.760 5.325 87 H GLU 15 H GLU 15 17.547 -30.788 3.098 88 HA GLU 15 HA GLU 15 16.699 -29.538 0.570 89 HB2 GLU 15 HB2 GLU 15 17.671 -32.128 1.101 90 HB3 GLU 15 HB3 GLU 15 15.953 -32.313 0.779 91 HG2 GLU 15 HG2 GLU 15 16.387 -30.869 -1.294 92 HG3 GLU 15 HG3 GLU 15 18.090 -31.227 -1.012 93 H TYR 16 H TYR 16 14.446 -30.938 0.013 94 HA TYR 16 HA TYR 16 12.664 -30.541 2.314 95 HB2 TYR 16 HB2 TYR 16 10.999 -29.604 0.554 96 HB3 TYR 16 HB3 TYR 16 12.256 -28.545 1.183 97 HD1 TYR 16 HD1 TYR 16 13.717 -27.457 -0.279 98 HD2 TYR 16 HD2 TYR 16 11.458 -30.777 -1.686 99 HE1 TYR 16 HE1 TYR 16 14.487 -27.003 -2.571 100 HE2 TYR 16 HE2 TYR 16 12.222 -30.332 -3.981 101 HH TYR 16 HH TYR 16 14.666 -27.919 -4.669 102 H ILE 17 H ILE 17 10.313 -31.267 1.486 103 HA ILE 17 HA ILE 17 10.671 -33.876 0.160 104 HB ILE 17 HB ILE 17 10.222 -34.428 2.396 105 HG12 ILE 17 HG12 ILE 17 7.515 -34.383 1.046 106 HG13 ILE 17 HG13 ILE 17 8.768 -35.580 0.736 107 HG21 ILE 17 HG21 ILE 17 8.600 -31.979 2.342 108 HG22 ILE 17 HG22 ILE 17 7.949 -33.290 3.324 109 HG23 ILE 17 HG23 ILE 17 9.570 -32.672 3.641 110 HD11 ILE 17 HD11 ILE 17 7.097 -35.187 3.179 111 HD12 ILE 17 HD12 ILE 17 7.368 -36.648 2.229 112 HD13 ILE 17 HD13 ILE 17 8.646 -36.024 3.271 113 H ARG 18 H ARG 18 9.468 -34.217 -1.590 114 HA ARG 18 HA ARG 18 7.130 -32.477 -2.034 115 HB2 ARG 18 HB2 ARG 18 9.402 -33.186 -3.771 116 HB3 ARG 18 HB3 ARG 18 7.824 -33.283 -4.542 117 HG2 ARG 18 HG2 ARG 18 7.600 -30.891 -3.340 118 HG3 ARG 18 HG3 ARG 18 9.342 -30.937 -3.617 119 HD2 ARG 18 HD2 ARG 18 7.880 -31.852 -5.936 120 HD3 ARG 18 HD3 ARG 18 7.363 -30.238 -5.449 121 HE ARG 18 HE ARG 18 10.215 -30.534 -5.548 122 HH11 ARG 18 HH11 ARG 18 7.353 -29.862 -7.414 123 HH12 ARG 18 HH12 ARG 18 8.202 -28.979 -8.639 124 HH21 ARG 18 HH21 ARG 18 11.343 -29.373 -7.155 125 HH22 ARG 18 HH22 ARG 18 10.471 -28.702 -8.491 126 H VAL 19 H VAL 19 5.404 -33.702 -1.575 127 HA VAL 19 HA VAL 19 4.985 -36.119 -3.141 128 HB VAL 19 HB VAL 19 4.128 -37.323 -1.077 129 HG11 VAL 19 HG11 VAL 19 7.037 -36.988 -0.688 130 HG12 VAL 19 HG12 VAL 19 6.084 -38.452 -0.940 131 HG13 VAL 19 HG13 VAL 19 6.507 -37.427 -2.312 132 HG21 VAL 19 HG21 VAL 19 5.019 -36.658 1.074 133 HG22 VAL 19 HG22 VAL 19 5.835 -35.277 0.340 134 HG23 VAL 19 HG23 VAL 19 4.073 -35.337 0.387 135 H THR 20 H THR 20 2.812 -36.654 -3.432 136 HA THR 20 HA THR 20 0.907 -34.604 -2.505 137 HB THR 20 HB THR 20 0.987 -34.348 -4.832 138 HG1 THR 20 HG1 THR 20 -1.157 -34.514 -4.304 139 HG21 THR 20 HG21 THR 20 0.497 -36.713 -6.120 140 HG22 THR 20 HG22 THR 20 1.560 -37.220 -4.807 141 HG23 THR 20 HG23 THR 20 2.085 -35.970 -5.934 142 H GLU 21 H GLU 21 -1.187 -35.257 -1.910 143 HA GLU 21 HA GLU 21 -1.311 -37.783 -0.598 144 HB2 GLU 21 HB2 GLU 21 -2.441 -35.624 0.132 145 HB3 GLU 21 HB3 GLU 21 -3.635 -35.935 -1.120 146 HG2 GLU 21 HG2 GLU 21 -3.414 -38.310 0.354 147 HG3 GLU 21 HG3 GLU 21 -3.466 -36.997 1.529 148 H ASP 22 H ASP 22 -3.023 -36.403 -3.393 149 HA ASP 22 HA ASP 22 -3.847 -39.133 -4.132 150 HB2 ASP 22 HB2 ASP 22 -5.233 -36.544 -4.195 151 HB3 ASP 22 HB3 ASP 22 -5.392 -37.478 -5.679 152 H GLU 23 H GLU 23 -3.780 -39.720 -6.364 153 HA GLU 23 HA GLU 23 -1.409 -38.932 -7.674 154 HB2 GLU 23 HB2 GLU 23 -2.129 -40.380 -9.487 155 HB3 GLU 23 HB3 GLU 23 -2.436 -41.157 -7.940 156 HG2 GLU 23 HG2 GLU 23 -4.432 -41.593 -8.866 157 HG3 GLU 23 HG3 GLU 23 -4.805 -39.958 -8.323 158 H ASN 24 H ASN 24 -4.765 -37.968 -8.035 159 HA ASN 24 HA ASN 24 -4.389 -36.520 -10.464 160 HB2 ASN 24 HB2 ASN 24 -6.600 -37.287 -9.942 161 HB3 ASN 24 HB3 ASN 24 -6.578 -36.469 -8.382 162 HD21 ASN 24 HD21 ASN 24 -6.931 -36.104 -11.810 163 HD22 ASN 24 HD22 ASN 24 -7.534 -34.485 -11.783 164 H ASP 25 H ASP 25 -3.999 -35.798 -7.090 165 HA ASP 25 HA ASP 25 -3.966 -32.943 -7.419 166 HB2 ASP 25 HB2 ASP 25 -3.389 -34.831 -5.164 167 HB3 ASP 25 HB3 ASP 25 -2.878 -33.150 -5.041 168 H GLU 26 H GLU 26 -2.132 -31.577 -7.147 169 HA GLU 26 HA GLU 26 0.206 -32.578 -8.488 170 HB2 GLU 26 HB2 GLU 26 -0.837 -29.941 -7.662 171 HB3 GLU 26 HB3 GLU 26 0.915 -30.080 -7.705 172 HG2 GLU 26 HG2 GLU 26 0.920 -30.601 -10.002 173 HG3 GLU 26 HG3 GLU 26 -0.820 -30.886 -10.017 174 HA PRO 27 HA PRO 27 2.758 -33.536 -5.049 175 HB2 PRO 27 HB2 PRO 27 5.201 -32.820 -5.990 176 HB3 PRO 27 HB3 PRO 27 4.330 -34.246 -6.566 177 HG2 PRO 27 HG2 PRO 27 4.549 -31.530 -7.807 178 HG3 PRO 27 HG3 PRO 27 4.647 -33.124 -8.578 179 HD2 PRO 27 HD2 PRO 27 2.405 -31.608 -8.648 180 HD3 PRO 27 HD3 PRO 27 2.357 -33.382 -8.625 181 H ILE 28 H ILE 28 2.230 -32.172 -3.377 182 HA ILE 28 HA ILE 28 2.954 -29.403 -3.348 183 HB ILE 28 HB ILE 28 1.013 -30.074 -2.104 184 HG12 ILE 28 HG12 ILE 28 1.518 -29.103 0.090 185 HG13 ILE 28 HG13 ILE 28 3.239 -29.351 -0.185 186 HG21 ILE 28 HG21 ILE 28 1.224 -31.530 -0.096 187 HG22 ILE 28 HG22 ILE 28 1.542 -32.360 -1.618 188 HG23 ILE 28 HG23 ILE 28 2.883 -31.879 -0.580 189 HD11 ILE 28 HD11 ILE 28 1.977 -27.822 -2.304 190 HD12 ILE 28 HD12 ILE 28 1.826 -27.064 -0.718 191 HD13 ILE 28 HD13 ILE 28 3.420 -27.472 -1.353 192 H GLU 29 H GLU 29 4.766 -28.469 -2.635 193 HA GLU 29 HA GLU 29 6.861 -30.196 -1.542 194 HB2 GLU 29 HB2 GLU 29 8.388 -28.335 -2.096 195 HB3 GLU 29 HB3 GLU 29 7.489 -28.904 -3.495 196 HG2 GLU 29 HG2 GLU 29 5.933 -27.018 -3.236 197 HG3 GLU 29 HG3 GLU 29 6.896 -26.435 -1.880 198 H ILE 30 H ILE 30 7.438 -30.115 0.526 199 HA ILE 30 HA ILE 30 6.711 -27.734 2.099 200 HB ILE 30 HB ILE 30 6.642 -29.659 3.993 201 HG12 ILE 30 HG12 ILE 30 5.112 -30.984 1.795 202 HG13 ILE 30 HG13 ILE 30 6.845 -31.272 1.902 203 HG21 ILE 30 HG21 ILE 30 4.483 -29.033 4.235 204 HG22 ILE 30 HG22 ILE 30 4.935 -27.832 3.026 205 HG23 ILE 30 HG23 ILE 30 4.099 -29.306 2.535 206 HD11 ILE 30 HD11 ILE 30 6.558 -32.066 4.199 207 HD12 ILE 30 HD12 ILE 30 4.818 -31.808 4.059 208 HD13 ILE 30 HD13 ILE 30 5.616 -33.009 3.044 209 HA PRO 31 HA PRO 31 10.847 -27.657 3.568 210 HB2 PRO 31 HB2 PRO 31 10.506 -26.748 6.103 211 HB3 PRO 31 HB3 PRO 31 10.297 -25.722 4.678 212 HG2 PRO 31 HG2 PRO 31 8.224 -27.108 6.335 213 HG3 PRO 31 HG3 PRO 31 8.211 -25.463 5.674 214 HD2 PRO 31 HD2 PRO 31 6.863 -27.507 4.518 215 HD3 PRO 31 HD3 PRO 31 7.565 -26.174 3.579 216 H SER 32 H SER 32 12.294 -29.018 4.473 217 HA SER 32 HA SER 32 11.299 -30.985 6.428 218 HB2 SER 32 HB2 SER 32 12.270 -32.753 5.306 219 HB3 SER 32 HB3 SER 32 11.824 -31.729 3.941 220 HG SER 32 HG SER 32 14.063 -30.831 4.292 221 H GLU 33 H GLU 33 12.850 -31.800 7.925 222 HA GLU 33 HA GLU 33 14.513 -29.880 9.058 223 HB2 GLU 33 HB2 GLU 33 14.746 -32.879 9.357 224 HB3 GLU 33 HB3 GLU 33 15.383 -31.671 10.465 225 HG2 GLU 33 HG2 GLU 33 12.586 -31.228 10.075 226 HG3 GLU 33 HG3 GLU 33 12.867 -32.912 10.514 227 H ASP 34 H ASP 34 16.861 -29.952 9.357 228 HA ASP 34 HA ASP 34 18.225 -29.990 6.888 229 HB2 ASP 34 HB2 ASP 34 20.153 -29.330 8.100 230 HB3 ASP 34 HB3 ASP 34 18.789 -28.609 8.951 231 H ASP 35 H ASP 35 17.969 -32.315 9.506 232 HA ASP 35 HA ASP 35 20.050 -34.037 8.724 233 HB2 ASP 35 HB2 ASP 35 17.950 -34.023 10.673 234 HB3 ASP 35 HB3 ASP 35 17.974 -35.592 9.872 235 H GLY 36 H GLY 36 16.969 -33.437 7.354 236 HA2 GLY 36 HA2 GLY 36 16.733 -34.254 5.034 237 HA3 GLY 36 HA3 GLY 36 17.293 -35.812 5.624 238 H THR 37 H THR 37 15.697 -35.596 8.091 239 HA THR 37 HA THR 37 13.335 -36.847 7.133 240 HB THR 37 HB THR 37 12.660 -37.045 9.433 241 HG1 THR 37 HG1 THR 37 14.647 -35.062 9.905 242 HG21 THR 37 HG21 THR 37 15.541 -37.298 9.931 243 HG22 THR 37 HG22 THR 37 14.988 -38.069 8.444 244 HG23 THR 37 HG23 THR 37 14.270 -38.517 9.991 245 H VAL 38 H VAL 38 11.253 -35.984 8.614 246 HA VAL 38 HA VAL 38 10.910 -33.132 8.023 247 HB VAL 38 HB VAL 38 9.074 -35.340 7.099 248 HG11 VAL 38 HG11 VAL 38 8.512 -32.521 7.742 249 HG12 VAL 38 HG12 VAL 38 7.895 -33.091 6.190 250 HG13 VAL 38 HG13 VAL 38 7.429 -33.911 7.681 251 HG21 VAL 38 HG21 VAL 38 10.206 -33.077 5.482 252 HG22 VAL 38 HG22 VAL 38 11.090 -34.585 5.716 253 HG23 VAL 38 HG23 VAL 38 9.517 -34.600 4.918 254 H LEU 39 H LEU 39 9.878 -32.048 9.587 255 HA LEU 39 HA LEU 39 9.211 -33.337 12.024 256 HB2 LEU 39 HB2 LEU 39 9.797 -30.770 11.254 257 HB3 LEU 39 HB3 LEU 39 8.079 -30.671 11.633 258 HG LEU 39 HG LEU 39 10.227 -31.643 13.518 259 HD11 LEU 39 HD11 LEU 39 8.791 -29.245 14.266 260 HD12 LEU 39 HD12 LEU 39 9.667 -29.040 12.750 261 HD13 LEU 39 HD13 LEU 39 10.527 -29.550 14.202 262 HD21 LEU 39 HD21 LEU 39 8.428 -31.469 15.204 263 HD22 LEU 39 HD22 LEU 39 8.108 -32.698 13.980 264 HD23 LEU 39 HD23 LEU 39 7.278 -31.143 13.907 265 H LEU 40 H LEU 40 7.311 -34.039 12.810 266 HA LEU 40 HA LEU 40 5.191 -34.730 11.205 267 HB2 LEU 40 HB2 LEU 40 5.687 -35.505 13.551 268 HB3 LEU 40 HB3 LEU 40 4.917 -34.024 14.118 269 HG LEU 40 HG LEU 40 2.797 -34.724 13.203 270 HD11 LEU 40 HD11 LEU 40 4.457 -36.526 11.678 271 HD12 LEU 40 HD12 LEU 40 2.786 -36.032 11.409 272 HD13 LEU 40 HD13 LEU 40 3.142 -37.386 12.480 273 HD21 LEU 40 HD21 LEU 40 4.245 -36.727 14.906 274 HD22 LEU 40 HD22 LEU 40 2.540 -36.917 14.495 275 HD23 LEU 40 HD23 LEU 40 3.078 -35.498 15.394 276 H SER 41 H SER 41 5.632 -31.764 13.073 277 HA SER 41 HA SER 41 3.136 -30.623 12.842 278 HB2 SER 41 HB2 SER 41 4.862 -29.570 14.168 279 HB3 SER 41 HB3 SER 41 5.849 -29.286 12.734 280 HG SER 41 HG SER 41 4.806 -27.490 12.506 281 H THR 42 H THR 42 5.684 -30.844 10.440 282 HA THR 42 HA THR 42 4.465 -29.074 8.562 283 HB THR 42 HB THR 42 6.538 -31.222 8.070 284 HG1 THR 42 HG1 THR 42 6.737 -28.480 8.798 285 HG21 THR 42 HG21 THR 42 5.563 -28.898 6.420 286 HG22 THR 42 HG22 THR 42 5.620 -30.604 5.976 287 HG23 THR 42 HG23 THR 42 7.115 -29.684 6.134 288 H VAL 43 H VAL 43 4.669 -32.615 8.827 289 HA VAL 43 HA VAL 43 3.306 -33.318 6.524 290 HB VAL 43 HB VAL 43 3.571 -34.643 9.197 291 HG11 VAL 43 HG11 VAL 43 2.493 -36.656 7.912 292 HG12 VAL 43 HG12 VAL 43 1.478 -35.480 8.750 293 HG13 VAL 43 HG13 VAL 43 1.691 -35.376 7.002 294 HG21 VAL 43 HG21 VAL 43 4.605 -35.090 6.420 295 HG22 VAL 43 HG22 VAL 43 5.504 -34.899 7.925 296 HG23 VAL 43 HG23 VAL 43 4.617 -36.391 7.612 297 H THR 44 H THR 44 2.033 -32.332 9.658 298 HA THR 44 HA THR 44 -0.692 -32.910 9.037 299 HB THR 44 HB THR 44 -1.265 -31.834 11.081 300 HG1 THR 44 HG1 THR 44 0.253 -30.492 12.174 301 HG21 THR 44 HG21 THR 44 0.711 -33.809 10.948 302 HG22 THR 44 HG22 THR 44 -0.317 -33.423 12.328 303 HG23 THR 44 HG23 THR 44 1.271 -32.673 12.174 304 H ALA 45 H ALA 45 1.428 -30.232 8.461 305 HA ALA 45 HA ALA 45 -0.253 -28.079 8.228 306 HB1 ALA 45 HB1 ALA 45 1.810 -28.545 6.116 307 HB2 ALA 45 HB2 ALA 45 1.380 -27.054 6.956 308 HB3 ALA 45 HB3 ALA 45 2.299 -28.304 7.794 309 H GLN 46 H GLN 46 0.407 -30.538 5.743 310 HA GLN 46 HA GLN 46 -1.904 -29.529 4.228 311 HB2 GLN 46 HB2 GLN 46 -0.054 -31.504 3.009 312 HB3 GLN 46 HB3 GLN 46 -0.875 -30.130 2.279 313 HG2 GLN 46 HG2 GLN 46 1.126 -29.162 2.273 314 HG3 GLN 46 HG3 GLN 46 0.861 -28.912 3.997 315 HE21 GLN 46 HE21 GLN 46 2.092 -31.330 1.720 316 HE22 GLN 46 HE22 GLN 46 3.370 -31.891 2.737 317 H PHE 47 H PHE 47 -0.478 -32.373 5.698 318 HA PHE 47 HA PHE 47 -2.925 -33.884 5.064 319 HB2 PHE 47 HB2 PHE 47 -0.461 -35.264 6.028 320 HB3 PHE 47 HB3 PHE 47 -1.705 -35.834 4.920 321 HD1 PHE 47 HD1 PHE 47 1.590 -35.244 5.015 322 HD2 PHE 47 HD2 PHE 47 -1.815 -33.979 2.795 323 HE1 PHE 47 HE1 PHE 47 3.043 -34.689 3.109 324 HE2 PHE 47 HE2 PHE 47 -0.367 -33.424 0.885 325 HZ PHE 47 HZ PHE 47 2.065 -33.780 1.040 326 HA PRO 48 HA PRO 48 -3.041 -33.023 9.614 327 HB2 PRO 48 HB2 PRO 48 -5.702 -32.485 9.672 328 HB3 PRO 48 HB3 PRO 48 -4.482 -31.261 9.299 329 HG2 PRO 48 HG2 PRO 48 -6.213 -32.840 7.435 330 HG3 PRO 48 HG3 PRO 48 -5.800 -31.116 7.388 331 HD2 PRO 48 HD2 PRO 48 -4.578 -32.951 5.815 332 HD3 PRO 48 HD3 PRO 48 -3.743 -31.508 6.423 333 H GLY 49 H GLY 49 -3.221 -34.715 10.940 334 HA2 GLY 49 HA2 GLY 49 -4.383 -36.469 12.004 335 HA3 GLY 49 HA3 GLY 49 -5.441 -36.586 10.606 336 H ALA 50 H ALA 50 -3.104 -36.588 8.765 337 HA ALA 50 HA ALA 50 -2.838 -39.290 8.317 338 HB1 ALA 50 HB1 ALA 50 -2.224 -37.669 6.644 339 HB2 ALA 50 HB2 ALA 50 -0.888 -37.092 7.643 340 HB3 ALA 50 HB3 ALA 50 -0.844 -38.720 6.967 341 H CYS 51 H CYS 51 -2.086 -40.805 9.638 342 HA CYS 51 HA CYS 51 -0.113 -40.189 11.659 343 HB2 CYS 51 HB2 CYS 51 -2.083 -42.262 11.193 344 HB3 CYS 51 HB3 CYS 51 -0.527 -42.958 11.629 345 HG CYS 51 HG CYS 51 -0.384 -42.020 14.113 346 H GLY 52 H GLY 52 -0.281 -41.946 8.620 347 HA2 GLY 52 HA2 GLY 52 2.641 -42.016 8.558 348 HA3 GLY 52 HA3 GLY 52 1.803 -43.555 8.430 349 H LEU 53 H LEU 53 3.540 -42.165 6.501 350 HA LEU 53 HA LEU 53 1.613 -41.836 4.297 351 HB2 LEU 53 HB2 LEU 53 4.431 -40.791 4.338 352 HB3 LEU 53 HB3 LEU 53 3.137 -40.379 3.214 353 HG LEU 53 HG LEU 53 3.239 -38.497 4.536 354 HD11 LEU 53 HD11 LEU 53 1.390 -39.795 6.422 355 HD12 LEU 53 HD12 LEU 53 1.002 -39.990 4.713 356 HD13 LEU 53 HD13 LEU 53 1.166 -38.375 5.400 357 HD21 LEU 53 HD21 LEU 53 3.875 -38.374 6.770 358 HD22 LEU 53 HD22 LEU 53 4.866 -39.690 6.139 359 HD23 LEU 53 HD23 LEU 53 3.426 -40.048 7.093 360 H ARG 54 H ARG 54 1.970 -42.905 2.368 361 HA ARG 54 HA ARG 54 3.942 -45.082 2.505 362 HB2 ARG 54 HB2 ARG 54 1.234 -45.186 2.010 363 HB3 ARG 54 HB3 ARG 54 1.922 -45.246 0.393 364 HG2 ARG 54 HG2 ARG 54 3.484 -47.052 1.625 365 HG3 ARG 54 HG3 ARG 54 1.999 -47.234 2.562 366 HD2 ARG 54 HD2 ARG 54 1.562 -47.080 -0.323 367 HD3 ARG 54 HD3 ARG 54 2.542 -48.460 0.171 368 HE ARG 54 HE ARG 54 0.196 -48.167 1.772 369 HH11 ARG 54 HH11 ARG 54 1.397 -49.367 -1.267 370 HH12 ARG 54 HH12 ARG 54 0.144 -50.550 -1.444 371 HH21 ARG 54 HH21 ARG 54 -1.460 -49.720 1.550 372 HH22 ARG 54 HH22 ARG 54 -1.482 -50.749 0.158 373 H TYR 55 H TYR 55 4.863 -45.776 0.389 374 HA TYR 55 HA TYR 55 5.607 -43.402 -1.171 375 HB2 TYR 55 HB2 TYR 55 7.096 -45.604 -0.106 376 HB3 TYR 55 HB3 TYR 55 7.242 -45.616 -1.860 377 HD1 TYR 55 HD1 TYR 55 7.657 -43.150 -2.875 378 HD2 TYR 55 HD2 TYR 55 8.692 -44.418 1.052 379 HE1 TYR 55 HE1 TYR 55 9.348 -41.368 -2.752 380 HE2 TYR 55 HE2 TYR 55 10.385 -42.639 1.187 381 HH TYR 55 HH TYR 55 10.957 -40.437 -1.542 382 H ARG 56 H ARG 56 5.061 -43.213 -3.251 383 HA ARG 56 HA ARG 56 4.065 -45.599 -4.659 384 HB2 ARG 56 HB2 ARG 56 2.229 -44.056 -3.893 385 HB3 ARG 56 HB3 ARG 56 2.910 -42.824 -4.946 386 HG2 ARG 56 HG2 ARG 56 2.384 -45.403 -6.242 387 HG3 ARG 56 HG3 ARG 56 0.954 -44.546 -5.661 388 HD2 ARG 56 HD2 ARG 56 1.183 -42.873 -7.166 389 HD3 ARG 56 HD3 ARG 56 2.944 -42.916 -7.104 390 HE ARG 56 HE ARG 56 2.901 -44.237 -8.955 391 HH11 ARG 56 HH11 ARG 56 -0.165 -44.524 -7.332 392 HH12 ARG 56 HH12 ARG 56 -0.862 -45.542 -8.549 393 HH21 ARG 56 HH21 ARG 56 1.996 -45.577 -10.564 394 HH22 ARG 56 HH22 ARG 56 0.369 -46.141 -10.386 395 H ASN 57 H ASN 57 5.796 -45.966 -5.959 396 HA ASN 57 HA ASN 57 6.608 -43.763 -7.741 397 HB2 ASN 57 HB2 ASN 57 8.202 -45.401 -6.026 398 HB3 ASN 57 HB3 ASN 57 8.618 -45.777 -7.696 399 HD21 ASN 57 HD21 ASN 57 10.615 -44.767 -6.472 400 HD22 ASN 57 HD22 ASN 57 10.855 -43.088 -6.799 401 HA PRO 58 HA PRO 58 5.413 -46.203 -11.190 402 HB2 PRO 58 HB2 PRO 58 7.236 -45.422 -13.043 403 HB3 PRO 58 HB3 PRO 58 5.914 -44.382 -12.498 404 HG2 PRO 58 HG2 PRO 58 8.785 -44.397 -11.649 405 HG3 PRO 58 HG3 PRO 58 7.731 -43.017 -12.008 406 HD2 PRO 58 HD2 PRO 58 8.272 -43.816 -9.479 407 HD3 PRO 58 HD3 PRO 58 6.719 -43.089 -9.939 408 H VAL 59 H VAL 59 8.959 -46.129 -10.780 409 HA VAL 59 HA VAL 59 9.310 -48.696 -12.006 410 HB VAL 59 HB VAL 59 11.654 -48.496 -11.336 411 HG11 VAL 59 HG11 VAL 59 10.851 -47.348 -13.360 412 HG12 VAL 59 HG12 VAL 59 10.575 -45.889 -12.405 413 HG13 VAL 59 HG13 VAL 59 12.212 -46.513 -12.612 414 HG21 VAL 59 HG21 VAL 59 10.618 -46.190 -9.719 415 HG22 VAL 59 HG22 VAL 59 11.615 -47.547 -9.197 416 HG23 VAL 59 HG23 VAL 59 12.308 -46.285 -10.215 417 H SER 60 H SER 60 8.913 -47.504 -8.750 418 HA SER 60 HA SER 60 9.817 -49.875 -7.439 419 HB2 SER 60 HB2 SER 60 9.391 -47.360 -6.578 420 HB3 SER 60 HB3 SER 60 7.876 -48.100 -6.059 421 HG SER 60 HG SER 60 10.517 -48.783 -5.322 422 H GLN 61 H GLN 61 6.785 -48.781 -8.755 423 HA GLN 61 HA GLN 61 4.758 -49.780 -9.007 424 HB2 GLN 61 HB2 GLN 61 6.348 -52.294 -8.471 425 HB3 GLN 61 HB3 GLN 61 4.719 -52.245 -9.130 426 HG2 GLN 61 HG2 GLN 61 6.419 -50.568 -10.695 427 HG3 GLN 61 HG3 GLN 61 7.159 -52.158 -10.519 428 HE21 GLN 61 HE21 GLN 61 3.921 -50.800 -11.061 429 HE22 GLN 61 HE22 GLN 61 3.490 -51.893 -12.327 430 H CYS 62 H CYS 62 5.355 -48.737 -6.459 431 HA CYS 62 HA CYS 62 4.496 -48.669 -4.355 432 HB2 CYS 62 HB2 CYS 62 2.563 -50.186 -5.908 433 HB3 CYS 62 HB3 CYS 62 2.572 -50.684 -4.221 434 HG CYS 62 HG CYS 62 1.550 -48.505 -3.178 435 H MET 63 H MET 63 6.019 -49.336 -2.969 436 HA MET 63 HA MET 63 5.868 -51.951 -1.850 437 HB2 MET 63 HB2 MET 63 7.567 -51.687 -4.078 438 HB3 MET 63 HB3 MET 63 8.622 -51.716 -2.671 439 HG2 MET 63 HG2 MET 63 7.588 -53.806 -1.940 440 HG3 MET 63 HG3 MET 63 6.540 -53.777 -3.356 441 HE1 MET 63 HE1 MET 63 8.485 -56.617 -4.601 442 HE2 MET 63 HE2 MET 63 8.828 -56.489 -2.876 443 HE3 MET 63 HE3 MET 63 7.220 -56.099 -3.488 444 H ARG 64 H ARG 64 8.060 -49.180 -2.296 445 HA ARG 64 HA ARG 64 9.221 -49.363 0.283 446 HB2 ARG 64 HB2 ARG 64 9.821 -47.980 -1.975 447 HB3 ARG 64 HB3 ARG 64 9.127 -46.701 -0.988 448 HG2 ARG 64 HG2 ARG 64 10.773 -47.776 0.818 449 HG3 ARG 64 HG3 ARG 64 11.647 -48.202 -0.655 450 HD2 ARG 64 HD2 ARG 64 10.768 -45.505 -0.874 451 HD3 ARG 64 HD3 ARG 64 11.555 -45.707 0.690 452 HE ARG 64 HE ARG 64 13.561 -45.976 -0.387 453 HH11 ARG 64 HH11 ARG 64 10.966 -46.254 -2.691 454 HH12 ARG 64 HH12 ARG 64 12.016 -46.256 -4.069 455 HH21 ARG 64 HH21 ARG 64 14.954 -45.976 -2.193 456 HH22 ARG 64 HH22 ARG 64 14.284 -46.098 -3.785 457 H GLY 65 H GLY 65 9.125 -47.045 1.557 458 HA2 GLY 65 HA2 GLY 65 6.554 -45.862 1.795 459 HA3 GLY 65 HA3 GLY 65 6.768 -47.102 3.023 460 H VAL 66 H VAL 66 6.509 -44.138 3.204 461 HA VAL 66 HA VAL 66 9.044 -43.096 3.996 462 HB VAL 66 HB VAL 66 6.265 -42.089 4.624 463 HG11 VAL 66 HG11 VAL 66 7.967 -41.253 6.189 464 HG12 VAL 66 HG12 VAL 66 8.916 -40.663 4.823 465 HG13 VAL 66 HG13 VAL 66 7.327 -39.974 5.158 466 HG21 VAL 66 HG21 VAL 66 7.357 -40.367 2.815 467 HG22 VAL 66 HG22 VAL 66 7.994 -41.917 2.264 468 HG23 VAL 66 HG23 VAL 66 6.252 -41.683 2.416 469 H ARG 67 H ARG 67 10.117 -43.710 5.746 470 HA ARG 67 HA ARG 67 8.956 -45.165 7.879 471 HB2 ARG 67 HB2 ARG 67 11.262 -45.528 7.413 472 HB3 ARG 67 HB3 ARG 67 11.630 -43.814 7.545 473 HG2 ARG 67 HG2 ARG 67 12.442 -44.976 9.489 474 HG3 ARG 67 HG3 ARG 67 11.112 -43.912 9.949 475 HD2 ARG 67 HD2 ARG 67 9.636 -46.009 9.618 476 HD3 ARG 67 HD3 ARG 67 11.154 -46.899 9.721 477 HE ARG 67 HE ARG 67 9.765 -45.571 11.870 478 HH11 ARG 67 HH11 ARG 67 12.805 -46.842 10.747 479 HH12 ARG 67 HH12 ARG 67 13.455 -47.050 12.339 480 HH21 ARG 67 HH21 ARG 67 10.609 -45.840 13.972 481 HH22 ARG 67 HH22 ARG 67 12.205 -46.481 14.173 482 H LEU 68 H LEU 68 8.367 -44.561 9.927 483 HA LEU 68 HA LEU 68 8.385 -41.677 10.521 484 HB2 LEU 68 HB2 LEU 68 6.151 -42.308 9.851 485 HB3 LEU 68 HB3 LEU 68 6.156 -43.651 10.993 486 HG LEU 68 HG LEU 68 4.848 -41.494 11.568 487 HD11 LEU 68 HD11 LEU 68 5.694 -43.524 13.043 488 HD12 LEU 68 HD12 LEU 68 4.906 -42.117 13.755 489 HD13 LEU 68 HD13 LEU 68 6.664 -42.253 13.788 490 HD21 LEU 68 HD21 LEU 68 5.954 -39.633 12.233 491 HD22 LEU 68 HD22 LEU 68 7.157 -40.234 11.092 492 HD23 LEU 68 HD23 LEU 68 7.351 -40.536 12.819 493 H VAL 69 H VAL 69 9.368 -41.199 12.365 494 HA VAL 69 HA VAL 69 9.276 -43.101 14.590 495 HB VAL 69 HB VAL 69 11.378 -43.639 13.583 496 HG11 VAL 69 HG11 VAL 69 12.911 -41.292 13.739 497 HG12 VAL 69 HG12 VAL 69 12.405 -42.156 12.286 498 HG13 VAL 69 HG13 VAL 69 11.410 -40.847 12.926 499 HG21 VAL 69 HG21 VAL 69 12.684 -43.500 15.447 500 HG22 VAL 69 HG22 VAL 69 12.324 -41.794 15.710 501 HG23 VAL 69 HG23 VAL 69 11.138 -43.023 16.149 502 H GLU 70 H GLU 70 8.485 -42.035 16.271 503 HA GLU 70 HA GLU 70 8.081 -40.415 17.816 504 HB2 GLU 70 HB2 GLU 70 10.520 -38.984 16.771 505 HB3 GLU 70 HB3 GLU 70 9.821 -38.891 18.381 506 HG2 GLU 70 HG2 GLU 70 10.415 -41.591 17.976 507 HG3 GLU 70 HG3 GLU 70 11.798 -40.695 17.350 508 H GLY 71 H GLY 71 7.075 -40.216 15.041 509 HA2 GLY 71 HA2 GLY 71 5.479 -38.718 14.196 510 HA3 GLY 71 HA3 GLY 71 6.146 -37.461 15.227 511 H ILE 72 H ILE 72 8.904 -38.105 14.283 512 HA ILE 72 HA ILE 72 8.899 -36.315 12.034 513 HB ILE 72 HB ILE 72 11.182 -37.803 13.338 514 HG12 ILE 72 HG12 ILE 72 11.216 -34.952 13.687 515 HG13 ILE 72 HG13 ILE 72 9.656 -35.581 14.204 516 HG21 ILE 72 HG21 ILE 72 11.030 -36.140 10.945 517 HG22 ILE 72 HG22 ILE 72 12.243 -35.600 12.105 518 HG23 ILE 72 HG23 ILE 72 12.294 -37.248 11.479 519 HD11 ILE 72 HD11 ILE 72 12.224 -35.732 15.497 520 HD12 ILE 72 HD12 ILE 72 10.615 -36.068 16.137 521 HD13 ILE 72 HD13 ILE 72 11.511 -37.332 15.294 522 H LEU 73 H LEU 73 8.503 -36.970 10.033 523 HA LEU 73 HA LEU 73 8.663 -39.706 9.238 524 HB2 LEU 73 HB2 LEU 73 8.120 -37.139 7.783 525 HB3 LEU 73 HB3 LEU 73 8.257 -38.673 6.926 526 HG LEU 73 HG LEU 73 5.934 -38.149 7.271 527 HD11 LEU 73 HD11 LEU 73 5.211 -40.151 8.440 528 HD12 LEU 73 HD12 LEU 73 6.809 -40.327 9.163 529 HD13 LEU 73 HD13 LEU 73 6.607 -40.500 7.420 530 HD21 LEU 73 HD21 LEU 73 6.339 -38.233 10.241 531 HD22 LEU 73 HD22 LEU 73 4.952 -37.642 9.326 532 HD23 LEU 73 HD23 LEU 73 6.457 -36.722 9.338 533 H HIS 74 H HIS 74 10.499 -40.729 8.824 534 HA HIS 74 HA HIS 74 12.876 -39.264 8.047 535 HB2 HIS 74 HB2 HIS 74 12.432 -41.561 9.531 536 HB3 HIS 74 HB3 HIS 74 13.090 -42.174 8.016 537 HD1 HIS 74 HD1 HIS 74 15.299 -40.406 7.296 538 HD2 HIS 74 HD2 HIS 74 14.462 -41.269 11.273 539 HE1 HIS 74 HE1 HIS 74 17.432 -39.949 8.546 540 H ALA 75 H ALA 75 14.032 -39.559 6.136 541 HA ALA 75 HA ALA 75 12.401 -40.439 3.878 542 HB1 ALA 75 HB1 ALA 75 14.587 -39.416 2.706 543 HB2 ALA 75 HB2 ALA 75 13.210 -38.437 3.214 544 HB3 ALA 75 HB3 ALA 75 14.639 -38.550 4.242 545 HA PRO 76 HA PRO 76 14.632 -44.138 3.096 546 HB2 PRO 76 HB2 PRO 76 14.621 -44.214 0.382 547 HB3 PRO 76 HB3 PRO 76 13.177 -44.513 1.358 548 HG2 PRO 76 HG2 PRO 76 14.021 -42.015 -0.060 549 HG3 PRO 76 HG3 PRO 76 12.415 -42.761 0.032 550 HD2 PRO 76 HD2 PRO 76 13.129 -40.646 1.564 551 HD3 PRO 76 HD3 PRO 76 11.992 -41.889 2.123 552 H ASP 77 H ASP 77 16.386 -44.956 1.359 553 HA ASP 77 HA ASP 77 18.733 -43.388 1.910 554 HB2 ASP 77 HB2 ASP 77 18.428 -46.006 1.774 555 HB3 ASP 77 HB3 ASP 77 18.778 -45.743 0.068 556 H ALA 78 H ALA 78 16.413 -43.131 -0.394 557 HA ALA 78 HA ALA 78 18.294 -42.209 -2.463 558 HB1 ALA 78 HB1 ALA 78 16.657 -43.989 -3.095 559 HB2 ALA 78 HB2 ALA 78 15.366 -42.818 -2.824 560 HB3 ALA 78 HB3 ALA 78 16.569 -42.529 -4.081 561 H GLY 79 H GLY 79 15.745 -41.251 -0.309 562 HA2 GLY 79 HA2 GLY 79 15.778 -38.877 0.336 563 HA3 GLY 79 HA3 GLY 79 15.956 -38.501 -1.371 564 H TRP 80 H TRP 80 14.032 -37.139 -0.372 565 HA TRP 80 HA TRP 80 11.523 -38.434 -0.097 566 HB2 TRP 80 HB2 TRP 80 12.277 -35.558 -0.630 567 HB3 TRP 80 HB3 TRP 80 10.611 -36.088 -0.416 568 HD1 TRP 80 HD1 TRP 80 13.301 -34.630 1.511 569 HE1 TRP 80 HE1 TRP 80 12.982 -35.013 4.037 570 HE3 TRP 80 HE3 TRP 80 9.735 -38.290 1.334 571 HZ2 TRP 80 HZ2 TRP 80 11.425 -36.650 5.729 572 HZ3 TRP 80 HZ3 TRP 80 8.884 -39.211 3.451 573 HH2 TRP 80 HH2 TRP 80 9.714 -38.408 5.602 574 H GLY 81 H GLY 81 12.773 -36.362 -2.728 575 HA2 GLY 81 HA2 GLY 81 12.533 -36.660 -5.023 576 HA3 GLY 81 HA3 GLY 81 11.566 -38.094 -4.708 577 H ASN 82 H ASN 82 10.266 -37.182 -6.494 578 HA ASN 82 HA ASN 82 8.296 -35.267 -5.435 579 HB2 ASN 82 HB2 ASN 82 9.411 -35.400 -8.244 580 HB3 ASN 82 HB3 ASN 82 8.014 -34.432 -7.782 581 HD21 ASN 82 HD21 ASN 82 9.633 -32.855 -8.789 582 HD22 ASN 82 HD22 ASN 82 10.670 -32.035 -7.676 583 H LEU 83 H LEU 83 8.223 -38.143 -5.353 584 HA LEU 83 HA LEU 83 6.335 -38.944 -7.409 585 HB2 LEU 83 HB2 LEU 83 6.354 -41.109 -6.063 586 HB3 LEU 83 HB3 LEU 83 7.838 -40.645 -6.892 587 HG LEU 83 HG LEU 83 7.981 -41.594 -4.497 588 HD11 LEU 83 HD11 LEU 83 9.556 -39.830 -5.979 589 HD12 LEU 83 HD12 LEU 83 10.059 -40.828 -4.615 590 HD13 LEU 83 HD13 LEU 83 9.523 -39.170 -4.344 591 HD21 LEU 83 HD21 LEU 83 7.709 -40.041 -2.706 592 HD22 LEU 83 HD22 LEU 83 6.203 -40.066 -3.624 593 HD23 LEU 83 HD23 LEU 83 7.337 -38.729 -3.824 594 H VAL 84 H VAL 84 4.542 -40.519 -6.268 595 HA VAL 84 HA VAL 84 2.923 -38.656 -4.703 596 HB VAL 84 HB VAL 84 2.016 -41.291 -5.849 597 HG11 VAL 84 HG11 VAL 84 0.745 -39.008 -4.500 598 HG12 VAL 84 HG12 VAL 84 -0.105 -39.614 -5.923 599 HG13 VAL 84 HG13 VAL 84 0.253 -40.700 -4.580 600 HG21 VAL 84 HG21 VAL 84 1.117 -39.893 -7.742 601 HG22 VAL 84 HG22 VAL 84 2.159 -38.589 -7.171 602 HG23 VAL 84 HG23 VAL 84 2.868 -40.107 -7.723 603 H TYR 85 H TYR 85 1.706 -39.402 -2.859 604 HA TYR 85 HA TYR 85 2.867 -41.737 -1.501 605 HB2 TYR 85 HB2 TYR 85 3.509 -40.573 0.334 606 HB3 TYR 85 HB3 TYR 85 3.559 -39.217 -0.787 607 HD1 TYR 85 HD1 TYR 85 1.498 -40.883 1.795 608 HD2 TYR 85 HD2 TYR 85 2.076 -37.383 -0.554 609 HE1 TYR 85 HE1 TYR 85 -0.154 -39.692 3.174 610 HE2 TYR 85 HE2 TYR 85 0.426 -36.181 0.819 611 HH TYR 85 HH TYR 85 -1.509 -36.739 2.278 612 H VAL 86 H VAL 86 1.498 -42.834 -0.083 613 HA VAL 86 HA VAL 86 -1.352 -42.165 -0.391 614 HB VAL 86 HB VAL 86 -0.040 -44.826 0.175 615 HG11 VAL 86 HG11 VAL 86 -1.979 -45.181 1.290 616 HG12 VAL 86 HG12 VAL 86 -2.839 -43.904 0.427 617 HG13 VAL 86 HG13 VAL 86 -2.585 -45.472 -0.340 618 HG21 VAL 86 HG21 VAL 86 -1.549 -45.150 -2.054 619 HG22 VAL 86 HG22 VAL 86 -1.023 -43.478 -2.246 620 HG23 VAL 86 HG23 VAL 86 0.172 -44.763 -2.066 621 H VAL 87 H VAL 87 -2.462 -41.550 1.342 622 HA VAL 87 HA VAL 87 -1.259 -41.211 3.870 623 HB VAL 87 HB VAL 87 -4.232 -41.282 3.388 624 HG11 VAL 87 HG11 VAL 87 -3.769 -41.058 5.682 625 HG12 VAL 87 HG12 VAL 87 -2.436 -39.939 5.389 626 HG13 VAL 87 HG13 VAL 87 -4.100 -39.421 5.118 627 HG21 VAL 87 HG21 VAL 87 -2.238 -39.506 2.246 628 HG22 VAL 87 HG22 VAL 87 -3.949 -39.684 1.855 629 HG23 VAL 87 HG23 VAL 87 -3.453 -38.640 3.187 630 H ASN 88 H ASN 88 -1.639 -42.250 5.846 631 HA ASN 88 HA ASN 88 -3.108 -44.766 5.827 632 HB2 ASN 88 HB2 ASN 88 -0.674 -45.188 5.173 633 HB3 ASN 88 HB3 ASN 88 -0.260 -44.713 6.818 634 HD21 ASN 88 HD21 ASN 88 0.416 -46.603 7.632 635 HD22 ASN 88 HD22 ASN 88 -0.558 -48.025 7.752 636 H TYR 89 H TYR 89 -4.178 -45.067 7.679 637 HA TYR 89 HA TYR 89 -3.376 -43.452 10.010 638 HB2 TYR 89 HB2 TYR 89 -6.183 -44.365 9.374 639 HB3 TYR 89 HB3 TYR 89 -5.685 -43.219 10.613 640 HD1 TYR 89 HD1 TYR 89 -5.294 -40.921 10.086 641 HD2 TYR 89 HD2 TYR 89 -6.108 -43.717 6.984 642 HE1 TYR 89 HE1 TYR 89 -5.622 -39.065 8.507 643 HE2 TYR 89 HE2 TYR 89 -6.436 -41.869 5.396 644 HH TYR 89 HH TYR 89 -6.719 -39.635 5.204 645 HA PRO 90 HA PRO 90 -3.155 -47.987 11.096 646 HB2 PRO 90 HB2 PRO 90 -0.670 -47.865 12.181 647 HB3 PRO 90 HB3 PRO 90 -0.954 -48.151 10.460 648 HG2 PRO 90 HG2 PRO 90 -0.223 -45.609 11.863 649 HG3 PRO 90 HG3 PRO 90 0.403 -46.266 10.340 650 HD2 PRO 90 HD2 PRO 90 -1.470 -44.313 10.423 651 HD3 PRO 90 HD3 PRO 90 -1.412 -45.526 9.128 652 H LYS 91 H LYS 91 -1.794 -45.270 12.966 653 HA LYS 91 HA LYS 91 -2.976 -46.428 15.395 654 HB2 LYS 91 HB2 LYS 91 -0.444 -45.308 14.877 655 HB3 LYS 91 HB3 LYS 91 -1.286 -44.147 15.895 656 HG2 LYS 91 HG2 LYS 91 -1.805 -46.068 17.447 657 HG3 LYS 91 HG3 LYS 91 -0.669 -47.026 16.493 658 HD2 LYS 91 HD2 LYS 91 1.103 -46.055 17.451 659 HD3 LYS 91 HD3 LYS 91 0.417 -44.439 17.268 660 HE2 LYS 91 HE2 LYS 91 0.597 -44.727 19.580 661 HE3 LYS 91 HE3 LYS 91 -1.099 -45.064 19.234 662 HZ1 LYS 91 HZ1 LYS 91 -0.193 -46.706 20.735 663 HZ2 LYS 91 HZ2 LYS 91 1.035 -47.090 19.638 664 HZ3 LYS 91 HZ3 LYS 91 -0.576 -47.436 19.257 665 H ASP 92 H ASP 92 -3.361 -44.446 17.054 666 HA ASP 92 HA ASP 92 -4.767 -42.267 15.719 667 HB2 ASP 92 HB2 ASP 92 -6.069 -44.407 17.353 668 HB3 ASP 92 HB3 ASP 92 -6.697 -42.764 17.447 669 H ASN 93 H ASN 93 -2.933 -41.139 16.663 670 HA ASN 93 HA ASN 93 -2.541 -41.023 19.474 671 HB2 ASN 93 HB2 ASN 93 -0.964 -40.334 17.484 672 HB3 ASN 93 HB3 ASN 93 -1.747 -38.768 17.671 673 HD21 ASN 93 HD21 ASN 93 -1.154 -37.464 19.300 674 HD22 ASN 93 HD22 ASN 93 0.029 -37.865 20.493 675 H LYS 94 H LYS 94 -3.770 -38.508 17.258 676 HA LYS 94 HA LYS 94 -5.297 -36.846 17.540 677 HB2 LYS 94 HB2 LYS 94 -6.622 -38.951 18.331 678 HB3 LYS 94 HB3 LYS 94 -6.416 -38.262 19.936 679 HG2 LYS 94 HG2 LYS 94 -8.516 -37.528 19.185 680 HG3 LYS 94 HG3 LYS 94 -7.437 -36.141 19.013 681 HD2 LYS 94 HD2 LYS 94 -7.192 -36.601 16.638 682 HD3 LYS 94 HD3 LYS 94 -8.203 -38.040 16.794 683 HE2 LYS 94 HE2 LYS 94 -9.503 -36.208 15.893 684 HE3 LYS 94 HE3 LYS 94 -10.078 -36.615 17.509 685 HZ1 LYS 94 HZ1 LYS 94 -8.067 -34.498 17.199 686 HZ2 LYS 94 HZ2 LYS 94 -9.253 -34.685 18.390 687 HZ3 LYS 94 HZ3 LYS 94 -9.684 -34.150 16.844 688 H ARG 95 H ARG 95 -4.065 -35.137 18.153 689 HA ARG 95 HA ARG 95 -3.692 -34.738 21.049 690 HB2 ARG 95 HB2 ARG 95 -1.732 -33.329 20.455 691 HB3 ARG 95 HB3 ARG 95 -1.543 -35.014 19.989 692 HG2 ARG 95 HG2 ARG 95 -1.607 -34.553 17.760 693 HG3 ARG 95 HG3 ARG 95 -2.627 -33.128 17.972 694 HD2 ARG 95 HD2 ARG 95 -0.715 -32.010 17.565 695 HD3 ARG 95 HD3 ARG 95 -0.394 -32.335 19.268 696 HE ARG 95 HE ARG 95 0.537 -34.477 17.683 697 HH11 ARG 95 HH11 ARG 95 1.272 -31.174 18.501 698 HH12 ARG 95 HH12 ARG 95 2.973 -31.347 18.224 699 HH21 ARG 95 HH21 ARG 95 2.775 -34.717 17.315 700 HH22 ARG 95 HH22 ARG 95 3.827 -33.362 17.549 701 H LYS 96 H LYS 96 -3.302 -32.270 21.480 702 HA LYS 96 HA LYS 96 -5.638 -30.899 20.389 703 HB2 LYS 96 HB2 LYS 96 -5.414 -29.375 22.253 704 HB3 LYS 96 HB3 LYS 96 -5.331 -31.029 22.846 705 HG2 LYS 96 HG2 LYS 96 -2.937 -30.880 23.063 706 HG3 LYS 96 HG3 LYS 96 -2.940 -29.271 22.336 707 HD2 LYS 96 HD2 LYS 96 -4.534 -29.851 24.809 708 HD3 LYS 96 HD3 LYS 96 -2.813 -29.471 24.907 709 HE2 LYS 96 HE2 LYS 96 -3.629 -27.482 23.298 710 HE3 LYS 96 HE3 LYS 96 -5.110 -27.744 24.218 711 HZ1 LYS 96 HZ1 LYS 96 -2.820 -27.695 25.910 712 HZ2 LYS 96 HZ2 LYS 96 -4.227 -26.760 25.984 713 HZ3 LYS 96 HZ3 LYS 96 -2.937 -26.271 25.005 714 H MET 97 H MET 97 -5.465 -28.573 19.884 715 HA MET 97 HA MET 97 -3.100 -28.097 18.254 716 HB2 MET 97 HB2 MET 97 -4.401 -26.184 17.358 717 HB3 MET 97 HB3 MET 97 -5.236 -27.722 17.188 718 HG2 MET 97 HG2 MET 97 -6.671 -27.213 19.041 719 HG3 MET 97 HG3 MET 97 -5.761 -25.746 19.393 720 HE1 MET 97 HE1 MET 97 -8.114 -25.023 19.644 721 HE2 MET 97 HE2 MET 97 -7.743 -23.538 18.769 722 HE3 MET 97 HE3 MET 97 -9.173 -24.479 18.342 723 H ASP 98 H ASP 98 -2.121 -25.915 18.239 724 HA ASP 98 HA ASP 98 -2.434 -24.084 20.345 725 HB2 ASP 98 HB2 ASP 98 -0.106 -24.647 21.397 726 HB3 ASP 98 HB3 ASP 98 -1.539 -25.521 21.931 727 H GLU 99 H GLU 99 -2.328 -23.116 18.108 728 HA GLU 99 HA GLU 99 0.461 -22.383 17.504 729 HB2 GLU 99 HB2 GLU 99 -0.832 -23.891 15.809 730 HB3 GLU 99 HB3 GLU 99 -1.655 -22.398 15.380 731 HG2 GLU 99 HG2 GLU 99 0.446 -21.365 14.789 732 HG3 GLU 99 HG3 GLU 99 1.327 -22.799 15.313 733 H THR 100 H THR 100 0.877 -20.282 17.641 734 HA THR 100 HA THR 100 -1.149 -18.309 16.997 735 HB THR 100 HB THR 100 -1.713 -18.559 19.291 736 HG1 THR 100 HG1 THR 100 -1.646 -16.464 19.526 737 HG21 THR 100 HG21 THR 100 1.218 -18.847 19.642 738 HG22 THR 100 HG22 THR 100 -0.107 -19.699 20.435 739 HG23 THR 100 HG23 THR 100 0.326 -18.069 20.949 740 H ASP 101 H ASP 101 0.611 -18.207 15.326 741 HA ASP 101 HA ASP 101 2.322 -15.981 15.921 742 HB2 ASP 101 HB2 ASP 101 3.640 -17.959 16.749 743 HB3 ASP 101 HB3 ASP 101 3.662 -18.561 15.094 744 H ALA 102 H ALA 102 2.666 -14.786 14.137 745 HA ALA 102 HA ALA 102 2.397 -16.027 11.501 746 HB1 ALA 102 HB1 ALA 102 0.238 -14.806 12.571 747 HB2 ALA 102 HB2 ALA 102 1.005 -13.448 11.746 748 HB3 ALA 102 HB3 ALA 102 0.567 -14.896 10.840 749 H SER 103 H SER 103 4.366 -15.604 10.704 750 HA SER 103 HA SER 103 5.094 -12.935 10.046 751 HB2 SER 103 HB2 SER 103 5.844 -12.751 12.314 752 HB3 SER 103 HB3 SER 103 6.642 -14.322 12.241 753 HG SER 103 HG SER 103 8.057 -12.469 12.000 754 H SER 104 H SER 104 5.778 -13.256 8.042 755 HA SER 104 HA SER 104 8.018 -14.985 7.516 756 HB2 SER 104 HB2 SER 104 5.751 -16.347 7.389 757 HB3 SER 104 HB3 SER 104 5.640 -15.581 5.804 758 HG SER 104 HG SER 104 7.743 -17.219 6.776 759 H ALA 105 H ALA 105 8.313 -15.034 4.956 760 HA ALA 105 HA ALA 105 7.445 -12.583 3.678 761 HB1 ALA 105 HB1 ALA 105 10.081 -12.290 3.173 762 HB2 ALA 105 HB2 ALA 105 9.222 -11.443 4.459 763 HB3 ALA 105 HB3 ALA 105 10.135 -12.906 4.825 764 H VAL 106 H VAL 106 7.622 -12.634 1.449 765 HA VAL 106 HA VAL 106 9.093 -14.739 0.127 766 HB VAL 106 HB VAL 106 7.054 -15.940 0.746 767 HG11 VAL 106 HG11 VAL 106 4.916 -15.226 0.332 768 HG12 VAL 106 HG12 VAL 106 5.713 -13.681 0.630 769 HG13 VAL 106 HG13 VAL 106 5.400 -14.208 -1.024 770 HG21 VAL 106 HG21 VAL 106 6.619 -16.890 -1.350 771 HG22 VAL 106 HG22 VAL 106 6.878 -15.364 -2.196 772 HG23 VAL 106 HG23 VAL 106 8.248 -16.229 -1.500 773 H LYS 107 H LYS 107 9.462 -14.320 -2.028 774 HA LYS 107 HA LYS 107 7.989 -12.414 -3.539 775 HB2 LYS 107 HB2 LYS 107 10.235 -11.459 -1.936 776 HB3 LYS 107 HB3 LYS 107 10.421 -11.097 -3.647 777 HG2 LYS 107 HG2 LYS 107 8.765 -9.579 -3.642 778 HG3 LYS 107 HG3 LYS 107 7.769 -10.512 -2.523 779 HD2 LYS 107 HD2 LYS 107 9.636 -9.827 -0.802 780 HD3 LYS 107 HD3 LYS 107 9.918 -8.522 -1.957 781 HE2 LYS 107 HE2 LYS 107 7.365 -8.163 -1.820 782 HE3 LYS 107 HE3 LYS 107 7.463 -9.124 -0.346 783 HZ1 LYS 107 HZ1 LYS 107 7.697 -6.974 0.416 784 HZ2 LYS 107 HZ2 LYS 107 8.625 -6.476 -0.907 785 HZ3 LYS 107 HZ3 LYS 107 9.310 -7.466 0.281 786 H VAL 108 H VAL 108 8.976 -12.024 -5.682 787 HA VAL 108 HA VAL 108 11.167 -13.752 -6.458 788 HB VAL 108 HB VAL 108 9.256 -15.290 -6.554 789 HG11 VAL 108 HG11 VAL 108 7.252 -14.723 -7.343 790 HG12 VAL 108 HG12 VAL 108 7.849 -13.065 -7.437 791 HG13 VAL 108 HG13 VAL 108 7.940 -14.118 -8.849 792 HG21 VAL 108 HG21 VAL 108 11.192 -15.144 -8.307 793 HG22 VAL 108 HG22 VAL 108 9.833 -16.236 -8.572 794 HG23 VAL 108 HG23 VAL 108 9.892 -14.683 -9.405 795 H LYS 109 H LYS 109 12.126 -13.152 -8.382 796 HA LYS 109 HA LYS 109 10.871 -11.248 -10.145 797 HB2 LYS 109 HB2 LYS 109 12.496 -9.473 -9.860 798 HB3 LYS 109 HB3 LYS 109 11.706 -9.799 -8.323 799 HG2 LYS 109 HG2 LYS 109 13.662 -11.159 -7.654 800 HG3 LYS 109 HG3 LYS 109 14.457 -10.691 -9.159 801 HD2 LYS 109 HD2 LYS 109 14.599 -8.439 -8.511 802 HD3 LYS 109 HD3 LYS 109 13.408 -8.646 -7.224 803 HE2 LYS 109 HE2 LYS 109 15.900 -10.257 -7.087 804 HE3 LYS 109 HE3 LYS 109 16.016 -8.533 -6.737 805 HZ1 LYS 109 HZ1 LYS 109 15.438 -9.154 -4.684 806 HZ2 LYS 109 HZ2 LYS 109 14.825 -10.649 -5.181 807 HZ3 LYS 109 HZ3 LYS 109 13.865 -9.261 -5.298 808 H ARG 110 H ARG 110 12.044 -10.922 -12.099 809 HA ARG 110 HA ARG 110 14.434 -12.568 -12.476 810 HB2 ARG 110 HB2 ARG 110 11.789 -13.140 -13.552 811 HB3 ARG 110 HB3 ARG 110 12.999 -12.978 -14.818 812 HG2 ARG 110 HG2 ARG 110 13.448 -14.729 -12.426 813 HG3 ARG 110 HG3 ARG 110 12.586 -15.301 -13.856 814 HD2 ARG 110 HD2 ARG 110 14.650 -14.415 -15.147 815 HD3 ARG 110 HD3 ARG 110 15.448 -14.468 -13.576 816 HE ARG 110 HE ARG 110 15.554 -16.740 -13.763 817 HH11 ARG 110 HH11 ARG 110 13.141 -15.547 -15.970 818 HH12 ARG 110 HH12 ARG 110 12.867 -17.089 -16.710 819 HH21 ARG 110 HH21 ARG 110 15.202 -18.776 -14.728 820 HH22 ARG 110 HH22 ARG 110 14.039 -18.926 -16.002 821 H ALA 111 H ALA 111 15.936 -11.311 -13.339 822 HA ALA 111 HA ALA 111 15.107 -9.040 -15.009 823 HB1 ALA 111 HB1 ALA 111 17.576 -9.559 -13.378 824 HB2 ALA 111 HB2 ALA 111 17.497 -8.273 -14.583 825 HB3 ALA 111 HB3 ALA 111 16.395 -8.260 -13.206 826 H VAL 112 H VAL 112 15.255 -9.315 -17.128 827 HA VAL 112 HA VAL 112 17.608 -10.620 -18.253 828 HB VAL 112 HB VAL 112 15.870 -12.394 -18.026 829 HG11 VAL 112 HG11 VAL 112 14.060 -10.538 -18.652 830 HG12 VAL 112 HG12 VAL 112 14.313 -11.225 -20.258 831 HG13 VAL 112 HG13 VAL 112 13.791 -12.259 -18.927 832 HG21 VAL 112 HG21 VAL 112 17.626 -12.434 -19.779 833 HG22 VAL 112 HG22 VAL 112 16.150 -13.278 -20.249 834 HG23 VAL 112 HG23 VAL 112 16.487 -11.669 -20.888 835 H GLN 113 H GLN 113 18.018 -10.070 -20.437 836 HA GLN 113 HA GLN 113 16.260 -8.246 -21.816 837 HB2 GLN 113 HB2 GLN 113 17.902 -7.032 -20.066 838 HB3 GLN 113 HB3 GLN 113 18.981 -7.124 -21.451 839 HG2 GLN 113 HG2 GLN 113 17.775 -5.644 -22.672 840 HG3 GLN 113 HG3 GLN 113 16.244 -6.113 -21.936 841 HE21 GLN 113 HE21 GLN 113 18.934 -3.992 -21.817 842 HE22 GLN 113 HE22 GLN 113 18.394 -3.018 -20.497 843 H LYS 114 H LYS 114 16.788 -7.977 -24.002 844 HA LYS 114 HA LYS 114 19.081 -9.532 -24.983 845 HB2 LYS 114 HB2 LYS 114 16.885 -10.798 -25.139 846 HB3 LYS 114 HB3 LYS 114 16.366 -9.583 -26.300 847 HG2 LYS 114 HG2 LYS 114 18.965 -10.718 -26.943 848 HG3 LYS 114 HG3 LYS 114 17.678 -11.924 -26.881 849 HD2 LYS 114 HD2 LYS 114 16.365 -10.665 -28.469 850 HD3 LYS 114 HD3 LYS 114 17.545 -9.351 -28.454 851 HE2 LYS 114 HE2 LYS 114 17.955 -10.609 -30.420 852 HE3 LYS 114 HE3 LYS 114 19.241 -11.017 -29.285 853 HZ1 LYS 114 HZ1 LYS 114 18.154 -12.920 -30.521 854 HZ2 LYS 114 HZ2 LYS 114 16.798 -12.667 -29.543 855 HZ3 LYS 114 HZ3 LYS 114 18.280 -13.088 -28.843 Start of MODEL 5 1 H1 MET 1 H MET 1 -6.964 -20.786 -1.884 2 HA MET 1 HA MET 1 -9.300 -21.223 -0.214 3 HB2 MET 1 HB2 MET 1 -10.640 -19.537 -1.451 4 HB3 MET 1 HB3 MET 1 -9.370 -18.823 -0.466 5 HG2 MET 1 HG2 MET 1 -8.083 -19.099 -2.827 6 HG3 MET 1 HG3 MET 1 -9.735 -18.824 -3.376 7 HE1 MET 1 HE1 MET 1 -11.078 -16.123 -2.043 8 HE2 MET 1 HE2 MET 1 -10.247 -15.366 -3.402 9 HE3 MET 1 HE3 MET 1 -10.848 -17.018 -3.546 10 H ALA 2 H ALA 2 -11.096 -22.129 -1.376 11 HA ALA 2 HA ALA 2 -12.040 -23.555 -2.877 12 HB1 ALA 2 HB1 ALA 2 -12.247 -22.551 -4.844 13 HB2 ALA 2 HB2 ALA 2 -10.954 -21.443 -4.383 14 HB3 ALA 2 HB3 ALA 2 -10.573 -22.929 -5.253 15 H GLY 3 H GLY 3 -11.359 -25.180 -4.770 16 HA2 GLY 3 HA2 GLY 3 -8.714 -26.315 -4.227 17 HA3 GLY 3 HA3 GLY 3 -10.116 -27.319 -3.888 18 H SER 4 H SER 4 -8.448 -28.404 -5.589 19 HA SER 4 HA SER 4 -8.694 -27.673 -8.299 20 HB2 SER 4 HB2 SER 4 -8.119 -30.408 -7.132 21 HB3 SER 4 HB3 SER 4 -7.800 -29.903 -8.791 22 HG SER 4 HG SER 4 -6.526 -28.147 -7.621 23 H HIS 5 H HIS 5 -10.621 -27.493 -9.255 24 HA HIS 5 HA HIS 5 -12.556 -29.687 -8.903 25 HB2 HIS 5 HB2 HIS 5 -13.046 -27.144 -8.246 26 HB3 HIS 5 HB3 HIS 5 -13.452 -27.051 -9.957 27 HD1 HIS 5 HD1 HIS 5 -15.635 -26.655 -7.857 28 HD2 HIS 5 HD2 HIS 5 -14.728 -30.326 -9.578 29 HE1 HIS 5 HE1 HIS 5 -17.713 -28.049 -7.603 30 H HIS 6 H HIS 6 -11.869 -27.123 -11.290 31 HA HIS 6 HA HIS 6 -11.187 -28.860 -13.385 32 HB2 HIS 6 HB2 HIS 6 -13.888 -28.996 -12.887 33 HB3 HIS 6 HB3 HIS 6 -13.803 -27.784 -14.162 34 HD1 HIS 6 HD1 HIS 6 -14.541 -31.111 -13.985 35 HD2 HIS 6 HD2 HIS 6 -11.683 -29.045 -16.182 36 HE1 HIS 6 HE1 HIS 6 -13.969 -32.609 -15.922 37 H HIS 7 H HIS 7 -9.751 -27.503 -14.247 38 HA HIS 7 HA HIS 7 -10.625 -24.756 -14.858 39 HB2 HIS 7 HB2 HIS 7 -8.342 -25.681 -13.450 40 HB3 HIS 7 HB3 HIS 7 -7.775 -25.014 -14.978 41 HD1 HIS 7 HD1 HIS 7 -8.575 -24.023 -11.639 42 HD2 HIS 7 HD2 HIS 7 -8.926 -22.268 -15.388 43 HE1 HIS 7 HE1 HIS 7 -8.816 -21.558 -11.207 44 H HIS 8 H HIS 8 -8.676 -27.482 -16.015 45 HA HIS 8 HA HIS 8 -8.409 -26.310 -18.649 46 HB2 HIS 8 HB2 HIS 8 -7.387 -28.767 -17.293 47 HB3 HIS 8 HB3 HIS 8 -7.432 -28.739 -19.053 48 HD1 HIS 8 HD1 HIS 8 -6.289 -26.297 -19.983 49 HD2 HIS 8 HD2 HIS 8 -4.997 -27.928 -16.387 50 HE1 HIS 8 HE1 HIS 8 -4.027 -25.282 -19.558 51 H HIS 9 H HIS 9 -9.756 -26.608 -20.296 52 HA HIS 9 HA HIS 9 -12.169 -28.059 -20.003 53 HB2 HIS 9 HB2 HIS 9 -10.892 -26.943 -22.508 54 HB3 HIS 9 HB3 HIS 9 -12.562 -27.484 -22.367 55 HD1 HIS 9 HD1 HIS 9 -11.476 -24.518 -23.028 56 HD2 HIS 9 HD2 HIS 9 -13.084 -25.874 -19.445 57 HE1 HIS 9 HE1 HIS 9 -12.339 -22.465 -21.858 58 H HIS 10 H HIS 10 -12.021 -30.219 -19.747 59 HA HIS 10 HA HIS 10 -11.671 -32.415 -20.227 60 HB2 HIS 10 HB2 HIS 10 -11.310 -31.408 -23.057 61 HB3 HIS 10 HB3 HIS 10 -11.655 -33.068 -22.582 62 HD1 HIS 10 HD1 HIS 10 -13.321 -30.305 -23.944 63 HD2 HIS 10 HD2 HIS 10 -14.257 -32.993 -20.917 64 HE1 HIS 10 HE1 HIS 10 -15.819 -30.186 -23.688 65 H GLY 11 H GLY 11 -9.715 -32.423 -19.004 66 HA2 GLY 11 HA2 GLY 11 -7.559 -33.668 -20.064 67 HA3 GLY 11 HA3 GLY 11 -7.197 -31.972 -20.349 68 H SER 12 H SER 12 -7.270 -34.518 -18.059 69 HA SER 12 HA SER 12 -6.457 -32.653 -15.927 70 HB2 SER 12 HB2 SER 12 -8.247 -33.686 -14.937 71 HB3 SER 12 HB3 SER 12 -8.074 -35.150 -15.905 72 HG SER 12 HG SER 12 -6.958 -34.495 -13.469 73 H MET 13 H MET 13 -5.986 -36.105 -16.701 74 HA MET 13 HA MET 13 -4.149 -37.444 -16.603 75 HB2 MET 13 HB2 MET 13 -3.261 -34.932 -17.825 76 HB3 MET 13 HB3 MET 13 -1.957 -35.864 -17.102 77 HG2 MET 13 HG2 MET 13 -1.889 -37.026 -18.984 78 HG3 MET 13 HG3 MET 13 -3.423 -37.744 -18.499 79 HE1 MET 13 HE1 MET 13 -1.425 -35.483 -20.402 80 HE2 MET 13 HE2 MET 13 -2.244 -35.555 -21.963 81 HE3 MET 13 HE3 MET 13 -2.492 -34.169 -20.899 82 H SER 14 H SER 14 -4.274 -37.864 -14.380 83 HA SER 14 HA SER 14 -2.094 -36.672 -12.836 84 HB2 SER 14 HB2 SER 14 -3.668 -36.614 -10.822 85 HB3 SER 14 HB3 SER 14 -3.905 -35.362 -12.041 86 HG SER 14 HG SER 14 -5.437 -37.702 -11.610 87 H GLU 15 H GLU 15 -1.433 -37.962 -11.009 88 HA GLU 15 HA GLU 15 -2.116 -40.804 -11.366 89 HB2 GLU 15 HB2 GLU 15 0.413 -39.452 -10.439 90 HB3 GLU 15 HB3 GLU 15 0.121 -41.167 -10.185 91 HG2 GLU 15 HG2 GLU 15 -0.422 -40.736 -12.882 92 HG3 GLU 15 HG3 GLU 15 1.024 -39.786 -12.542 93 H TYR 16 H TYR 16 -1.305 -41.977 -9.147 94 HA TYR 16 HA TYR 16 -2.581 -40.558 -6.910 95 HB2 TYR 16 HB2 TYR 16 -3.446 -42.930 -6.267 96 HB3 TYR 16 HB3 TYR 16 -4.312 -41.999 -7.484 97 HD1 TYR 16 HD1 TYR 16 -1.811 -44.709 -7.051 98 HD2 TYR 16 HD2 TYR 16 -4.619 -42.852 -9.653 99 HE1 TYR 16 HE1 TYR 16 -1.558 -46.568 -8.642 100 HE2 TYR 16 HE2 TYR 16 -4.374 -44.707 -11.250 101 HH TYR 16 HH TYR 16 -3.562 -47.381 -10.855 102 H ILE 17 H ILE 17 -2.260 -42.113 -4.851 103 HA ILE 17 HA ILE 17 0.593 -42.854 -4.817 104 HB ILE 17 HB ILE 17 0.407 -40.860 -3.536 105 HG12 ILE 17 HG12 ILE 17 0.330 -43.183 -1.599 106 HG13 ILE 17 HG13 ILE 17 1.742 -42.700 -2.532 107 HG21 ILE 17 HG21 ILE 17 -1.589 -40.262 -2.764 108 HG22 ILE 17 HG22 ILE 17 -2.193 -41.915 -2.878 109 HG23 ILE 17 HG23 ILE 17 -1.339 -41.386 -1.429 110 HD11 ILE 17 HD11 ILE 17 1.185 -40.373 -1.340 111 HD12 ILE 17 HD12 ILE 17 0.548 -41.487 -0.130 112 HD13 ILE 17 HD13 ILE 17 2.234 -41.601 -0.633 113 H ARG 18 H ARG 18 1.000 -44.893 -4.287 114 HA ARG 18 HA ARG 18 -1.079 -46.406 -2.846 115 HB2 ARG 18 HB2 ARG 18 0.495 -47.016 -5.246 116 HB3 ARG 18 HB3 ARG 18 0.485 -48.311 -4.057 117 HG2 ARG 18 HG2 ARG 18 -2.136 -47.701 -4.111 118 HG3 ARG 18 HG3 ARG 18 -1.679 -47.290 -5.766 119 HD2 ARG 18 HD2 ARG 18 -0.552 -49.819 -4.852 120 HD3 ARG 18 HD3 ARG 18 -2.315 -49.801 -4.839 121 HE ARG 18 HE ARG 18 -1.408 -48.755 -7.281 122 HH11 ARG 18 HH11 ARG 18 -1.546 -51.768 -5.542 123 HH12 ARG 18 HH12 ARG 18 -1.594 -52.742 -6.974 124 HH21 ARG 18 HH21 ARG 18 -1.471 -50.027 -9.173 125 HH22 ARG 18 HH22 ARG 18 -1.551 -51.751 -9.039 126 H VAL 19 H VAL 19 -0.448 -46.485 -0.776 127 HA VAL 19 HA VAL 19 2.094 -47.764 -0.167 128 HB VAL 19 HB VAL 19 2.508 -46.031 1.663 129 HG11 VAL 19 HG11 VAL 19 3.885 -46.284 -0.368 130 HG12 VAL 19 HG12 VAL 19 2.834 -45.135 -1.199 131 HG13 VAL 19 HG13 VAL 19 3.794 -44.612 0.186 132 HG21 VAL 19 HG21 VAL 19 0.636 -44.448 -0.095 133 HG22 VAL 19 HG22 VAL 19 0.376 -44.892 1.592 134 HG23 VAL 19 HG23 VAL 19 1.661 -43.762 1.166 135 H THR 20 H THR 20 2.202 -48.617 1.977 136 HA THR 20 HA THR 20 -0.412 -48.778 3.331 137 HB THR 20 HB THR 20 -0.246 -50.921 2.468 138 HG1 THR 20 HG1 THR 20 0.260 -52.229 4.243 139 HG21 THR 20 HG21 THR 20 2.173 -52.079 2.883 140 HG22 THR 20 HG22 THR 20 2.650 -50.408 2.581 141 HG23 THR 20 HG23 THR 20 1.699 -51.284 1.382 142 H GLU 21 H GLU 21 -0.417 -48.808 5.569 143 HA GLU 21 HA GLU 21 1.779 -47.512 6.840 144 HB2 GLU 21 HB2 GLU 21 -0.735 -47.355 7.403 145 HB3 GLU 21 HB3 GLU 21 -0.486 -48.847 8.300 146 HG2 GLU 21 HG2 GLU 21 1.556 -47.046 9.061 147 HG3 GLU 21 HG3 GLU 21 0.026 -46.173 9.106 148 H ASP 22 H ASP 22 0.386 -50.771 7.095 149 HA ASP 22 HA ASP 22 2.666 -51.623 8.714 150 HB2 ASP 22 HB2 ASP 22 -0.091 -52.569 8.302 151 HB3 ASP 22 HB3 ASP 22 1.111 -53.851 8.421 152 H GLU 23 H GLU 23 3.685 -53.731 8.185 153 HA GLU 23 HA GLU 23 4.474 -53.741 5.409 154 HB2 GLU 23 HB2 GLU 23 6.113 -55.418 6.090 155 HB3 GLU 23 HB3 GLU 23 6.146 -54.038 7.178 156 HG2 GLU 23 HG2 GLU 23 4.829 -55.287 8.810 157 HG3 GLU 23 HG3 GLU 23 4.793 -56.672 7.719 158 H ASN 24 H ASN 24 2.606 -55.772 7.582 159 HA ASN 24 HA ASN 24 2.329 -57.915 5.682 160 HB2 ASN 24 HB2 ASN 24 2.124 -57.844 8.363 161 HB3 ASN 24 HB3 ASN 24 0.420 -57.683 7.944 162 HD21 ASN 24 HD21 ASN 24 -0.676 -59.410 7.172 163 HD22 ASN 24 HD22 ASN 24 0.005 -60.990 7.008 164 H ASP 25 H ASP 25 0.593 -55.025 6.516 165 HA ASP 25 HA ASP 25 -1.892 -55.735 5.325 166 HB2 ASP 25 HB2 ASP 25 -1.738 -53.948 6.989 167 HB3 ASP 25 HB3 ASP 25 -0.714 -53.010 5.905 168 H GLU 26 H GLU 26 -2.790 -54.952 3.356 169 HA GLU 26 HA GLU 26 -0.923 -55.017 1.177 170 HB2 GLU 26 HB2 GLU 26 -3.847 -55.131 1.510 171 HB3 GLU 26 HB3 GLU 26 -3.307 -54.361 0.025 172 HG2 GLU 26 HG2 GLU 26 -2.965 -56.340 -0.886 173 HG3 GLU 26 HG3 GLU 26 -1.789 -56.725 0.370 174 HA PRO 27 HA PRO 27 -0.301 -50.721 0.516 175 HB2 PRO 27 HB2 PRO 27 -0.016 -50.659 -2.183 176 HB3 PRO 27 HB3 PRO 27 1.217 -51.320 -1.102 177 HG2 PRO 27 HG2 PRO 27 -0.863 -52.757 -2.706 178 HG3 PRO 27 HG3 PRO 27 0.847 -53.164 -2.470 179 HD2 PRO 27 HD2 PRO 27 -1.145 -54.390 -1.105 180 HD3 PRO 27 HD3 PRO 27 0.464 -54.117 -0.406 181 H ILE 28 H ILE 28 -2.100 -49.547 0.985 182 HA ILE 28 HA ILE 28 -4.474 -49.671 -0.637 183 HB ILE 28 HB ILE 28 -4.658 -49.270 1.766 184 HG12 ILE 28 HG12 ILE 28 -6.184 -47.322 1.677 185 HG13 ILE 28 HG13 ILE 28 -5.541 -46.908 0.091 186 HG21 ILE 28 HG21 ILE 28 -4.023 -46.993 2.634 187 HG22 ILE 28 HG22 ILE 28 -2.677 -48.068 2.259 188 HG23 ILE 28 HG23 ILE 28 -3.105 -46.770 1.145 189 HD11 ILE 28 HD11 ILE 28 -7.660 -48.039 -0.124 190 HD12 ILE 28 HD12 ILE 28 -6.369 -49.049 -0.776 191 HD13 ILE 28 HD13 ILE 28 -7.054 -49.408 0.808 192 H GLU 29 H GLU 29 -5.222 -48.185 -2.092 193 HA GLU 29 HA GLU 29 -3.263 -46.197 -3.005 194 HB2 GLU 29 HB2 GLU 29 -4.315 -46.289 -5.152 195 HB3 GLU 29 HB3 GLU 29 -4.062 -47.944 -4.615 196 HG2 GLU 29 HG2 GLU 29 -6.188 -48.220 -5.250 197 HG3 GLU 29 HG3 GLU 29 -6.555 -47.501 -3.683 198 H ILE 30 H ILE 30 -3.707 -44.066 -3.014 199 HA ILE 30 HA ILE 30 -6.438 -43.225 -2.302 200 HB ILE 30 HB ILE 30 -4.686 -41.257 -1.326 201 HG12 ILE 30 HG12 ILE 30 -3.901 -43.987 -0.291 202 HG13 ILE 30 HG13 ILE 30 -2.937 -43.060 -1.436 203 HG21 ILE 30 HG21 ILE 30 -6.631 -43.204 -0.234 204 HG22 ILE 30 HG22 ILE 30 -5.553 -42.409 0.913 205 HG23 ILE 30 HG23 ILE 30 -6.603 -41.444 -0.125 206 HD11 ILE 30 HD11 ILE 30 -3.020 -41.209 0.361 207 HD12 ILE 30 HD12 ILE 30 -3.477 -42.521 1.448 208 HD13 ILE 30 HD13 ILE 30 -1.940 -42.585 0.586 209 HA PRO 31 HA PRO 31 -6.207 -40.524 -5.764 210 HB2 PRO 31 HB2 PRO 31 -7.965 -38.611 -4.978 211 HB3 PRO 31 HB3 PRO 31 -8.469 -40.223 -5.501 212 HG2 PRO 31 HG2 PRO 31 -8.136 -39.150 -2.726 213 HG3 PRO 31 HG3 PRO 31 -9.433 -40.163 -3.385 214 HD2 PRO 31 HD2 PRO 31 -7.407 -41.174 -1.900 215 HD3 PRO 31 HD3 PRO 31 -8.189 -42.095 -3.200 216 H SER 32 H SER 32 -4.397 -39.383 -6.093 217 HA SER 32 HA SER 32 -3.538 -37.406 -4.124 218 HB2 SER 32 HB2 SER 32 -1.420 -37.694 -4.915 219 HB3 SER 32 HB3 SER 32 -2.090 -39.210 -5.518 220 HG SER 32 HG SER 32 -1.038 -37.225 -6.916 221 H GLU 33 H GLU 33 -2.289 -35.498 -5.455 222 HA GLU 33 HA GLU 33 -4.463 -34.081 -6.764 223 HB2 GLU 33 HB2 GLU 33 -2.111 -33.355 -5.231 224 HB3 GLU 33 HB3 GLU 33 -2.223 -32.415 -6.712 225 HG2 GLU 33 HG2 GLU 33 -4.611 -32.706 -4.947 226 HG3 GLU 33 HG3 GLU 33 -3.343 -31.552 -4.541 227 H ASP 34 H ASP 34 -3.689 -32.544 -8.603 228 HA ASP 34 HA ASP 34 -2.856 -34.218 -10.763 229 HB2 ASP 34 HB2 ASP 34 -3.134 -32.216 -12.151 230 HB3 ASP 34 HB3 ASP 34 -4.515 -32.435 -11.079 231 H ASP 35 H ASP 35 -1.341 -31.704 -8.831 232 HA ASP 35 HA ASP 35 0.961 -31.337 -10.413 233 HB2 ASP 35 HB2 ASP 35 -0.046 -30.291 -8.017 234 HB3 ASP 35 HB3 ASP 35 1.500 -31.016 -7.586 235 H GLY 36 H GLY 36 -0.008 -33.890 -8.335 236 HA2 GLY 36 HA2 GLY 36 1.232 -35.995 -8.675 237 HA3 GLY 36 HA3 GLY 36 2.705 -35.047 -8.530 238 H THR 37 H THR 37 1.613 -33.441 -6.317 239 HA THR 37 HA THR 37 2.488 -35.092 -4.175 240 HB THR 37 HB THR 37 2.031 -33.221 -2.724 241 HG1 THR 37 HG1 THR 37 1.021 -31.308 -3.897 242 HG21 THR 37 HG21 THR 37 3.669 -31.894 -3.542 243 HG22 THR 37 HG22 THR 37 2.863 -31.682 -5.096 244 HG23 THR 37 HG23 THR 37 3.792 -33.146 -4.777 245 H VAL 38 H VAL 38 0.897 -34.632 -2.048 246 HA VAL 38 HA VAL 38 -1.771 -35.631 -2.755 247 HB VAL 38 HB VAL 38 0.101 -36.908 -0.762 248 HG11 VAL 38 HG11 VAL 38 -1.910 -38.476 -0.436 249 HG12 VAL 38 HG12 VAL 38 -1.932 -36.911 0.381 250 HG13 VAL 38 HG13 VAL 38 -2.868 -37.151 -1.094 251 HG21 VAL 38 HG21 VAL 38 0.044 -38.808 -2.111 252 HG22 VAL 38 HG22 VAL 38 -1.399 -38.272 -2.972 253 HG23 VAL 38 HG23 VAL 38 0.150 -37.483 -3.271 254 H LEU 39 H LEU 39 -3.344 -34.626 -1.679 255 HA LEU 39 HA LEU 39 -2.794 -32.517 0.118 256 HB2 LEU 39 HB2 LEU 39 -5.097 -33.663 -1.192 257 HB3 LEU 39 HB3 LEU 39 -5.470 -33.224 0.473 258 HG LEU 39 HG LEU 39 -6.043 -31.446 -1.121 259 HD11 LEU 39 HD11 LEU 39 -3.770 -30.772 0.740 260 HD12 LEU 39 HD12 LEU 39 -5.480 -30.849 1.162 261 HD13 LEU 39 HD13 LEU 39 -4.903 -29.614 0.043 262 HD21 LEU 39 HD21 LEU 39 -4.691 -30.806 -2.764 263 HD22 LEU 39 HD22 LEU 39 -3.618 -32.131 -2.314 264 HD23 LEU 39 HD23 LEU 39 -3.362 -30.521 -1.639 265 H LEU 40 H LEU 40 -2.814 -32.395 2.300 266 HA LEU 40 HA LEU 40 -2.245 -34.563 3.890 267 HB2 LEU 40 HB2 LEU 40 -1.984 -32.128 4.453 268 HB3 LEU 40 HB3 LEU 40 -3.702 -32.107 4.846 269 HG LEU 40 HG LEU 40 -3.349 -33.638 6.675 270 HD11 LEU 40 HD11 LEU 40 -1.694 -35.111 6.526 271 HD12 LEU 40 HD12 LEU 40 -0.595 -33.813 6.990 272 HD13 LEU 40 HD13 LEU 40 -0.873 -34.165 5.284 273 HD21 LEU 40 HD21 LEU 40 -2.453 -32.126 8.130 274 HD22 LEU 40 HD22 LEU 40 -2.712 -31.074 6.739 275 HD23 LEU 40 HD23 LEU 40 -1.106 -31.727 7.063 276 H SER 41 H SER 41 -5.405 -33.121 3.226 277 HA SER 41 HA SER 41 -6.977 -34.497 5.028 278 HB2 SER 41 HB2 SER 41 -7.574 -32.693 3.206 279 HB3 SER 41 HB3 SER 41 -7.979 -34.107 2.232 280 HG SER 41 HG SER 41 -9.758 -33.266 3.467 281 H THR 42 H THR 42 -5.617 -35.596 1.988 282 HA THR 42 HA THR 42 -7.109 -38.025 1.859 283 HB THR 42 HB THR 42 -4.491 -37.334 0.510 284 HG1 THR 42 HG1 THR 42 -5.670 -36.291 -0.918 285 HG21 THR 42 HG21 THR 42 -5.064 -39.096 -1.068 286 HG22 THR 42 HG22 THR 42 -6.548 -39.437 -0.178 287 HG23 THR 42 HG23 THR 42 -4.980 -39.750 0.567 288 H VAL 43 H VAL 43 -3.926 -37.127 3.096 289 HA VAL 43 HA VAL 43 -2.996 -39.729 3.643 290 HB VAL 43 HB VAL 43 -2.274 -37.019 4.706 291 HG11 VAL 43 HG11 VAL 43 -1.793 -38.119 6.649 292 HG12 VAL 43 HG12 VAL 43 -1.544 -39.668 5.842 293 HG13 VAL 43 HG13 VAL 43 -0.300 -38.420 5.762 294 HG21 VAL 43 HG21 VAL 43 -0.032 -38.299 3.731 295 HG22 VAL 43 HG22 VAL 43 -1.320 -38.851 2.660 296 HG23 VAL 43 HG23 VAL 43 -1.020 -37.125 2.861 297 H THR 44 H THR 44 -4.921 -37.454 5.523 298 HA THR 44 HA THR 44 -4.873 -39.011 7.924 299 HB THR 44 HB THR 44 -6.514 -37.473 8.789 300 HG1 THR 44 HG1 THR 44 -7.916 -36.572 7.494 301 HG21 THR 44 HG21 THR 44 -4.889 -35.969 9.029 302 HG22 THR 44 HG22 THR 44 -5.209 -35.352 7.408 303 HG23 THR 44 HG23 THR 44 -4.048 -36.658 7.641 304 H ALA 45 H ALA 45 -6.883 -38.885 5.081 305 HA ALA 45 HA ALA 45 -9.242 -40.014 5.917 306 HB1 ALA 45 HB1 ALA 45 -7.832 -40.745 3.357 307 HB2 ALA 45 HB2 ALA 45 -9.567 -40.783 3.674 308 HB3 ALA 45 HB3 ALA 45 -8.716 -39.240 3.608 309 H GLN 46 H GLN 46 -6.274 -41.731 4.967 310 HA GLN 46 HA GLN 46 -7.413 -44.202 6.074 311 HB2 GLN 46 HB2 GLN 46 -4.850 -44.159 4.541 312 HB3 GLN 46 HB3 GLN 46 -6.071 -45.421 4.642 313 HG2 GLN 46 HG2 GLN 46 -7.565 -44.093 3.243 314 HG3 GLN 46 HG3 GLN 46 -6.344 -42.826 3.143 315 HE21 GLN 46 HE21 GLN 46 -4.063 -44.286 2.782 316 HE22 GLN 46 HE22 GLN 46 -4.132 -45.113 1.267 317 H PHE 47 H PHE 47 -4.723 -41.971 6.325 318 HA PHE 47 HA PHE 47 -3.767 -43.464 8.680 319 HB2 PHE 47 HB2 PHE 47 -2.029 -41.504 7.229 320 HB3 PHE 47 HB3 PHE 47 -1.567 -42.906 8.188 321 HD1 PHE 47 HD1 PHE 47 -2.996 -45.100 7.043 322 HD2 PHE 47 HD2 PHE 47 -1.225 -41.756 5.095 323 HE1 PHE 47 HE1 PHE 47 -2.757 -46.429 4.987 324 HE2 PHE 47 HE2 PHE 47 -0.983 -43.079 3.036 325 HZ PHE 47 HZ PHE 47 -1.750 -45.419 2.979 326 HA PRO 48 HA PRO 48 -5.455 -39.421 10.179 327 HB2 PRO 48 HB2 PRO 48 -6.649 -40.479 12.376 328 HB3 PRO 48 HB3 PRO 48 -7.433 -40.415 10.793 329 HG2 PRO 48 HG2 PRO 48 -6.026 -42.700 12.119 330 HG3 PRO 48 HG3 PRO 48 -7.549 -42.700 11.211 331 HD2 PRO 48 HD2 PRO 48 -5.205 -43.511 10.124 332 HD3 PRO 48 HD3 PRO 48 -6.478 -42.723 9.170 333 H GLY 49 H GLY 49 -4.187 -38.152 11.380 334 HA2 GLY 49 HA2 GLY 49 -3.007 -37.534 13.322 335 HA3 GLY 49 HA3 GLY 49 -2.885 -39.231 13.761 336 H ALA 50 H ALA 50 -1.942 -39.935 11.031 337 HA ALA 50 HA ALA 50 0.782 -39.989 11.466 338 HB1 ALA 50 HB1 ALA 50 -0.316 -41.421 9.841 339 HB2 ALA 50 HB2 ALA 50 -0.655 -40.026 8.814 340 HB3 ALA 50 HB3 ALA 50 1.011 -40.537 9.085 341 H CYS 51 H CYS 51 1.991 -38.237 11.854 342 HA CYS 51 HA CYS 51 1.502 -35.708 10.599 343 HB2 CYS 51 HB2 CYS 51 2.962 -36.652 12.844 344 HB3 CYS 51 HB3 CYS 51 4.100 -35.812 11.797 345 HG CYS 51 HG CYS 51 2.550 -33.444 11.726 346 H GLY 52 H GLY 52 3.724 -38.379 10.117 347 HA2 GLY 52 HA2 GLY 52 4.460 -37.253 7.530 348 HA3 GLY 52 HA3 GLY 52 5.774 -37.512 8.668 349 H LEU 53 H LEU 53 5.299 -38.751 6.059 350 HA LEU 53 HA LEU 53 5.023 -41.560 6.904 351 HB2 LEU 53 HB2 LEU 53 4.701 -40.535 4.097 352 HB3 LEU 53 HB3 LEU 53 4.245 -42.113 4.737 353 HG LEU 53 HG LEU 53 2.202 -41.073 4.519 354 HD11 LEU 53 HD11 LEU 53 1.396 -41.123 6.618 355 HD12 LEU 53 HD12 LEU 53 2.558 -39.935 7.208 356 HD13 LEU 53 HD13 LEU 53 3.038 -41.622 7.027 357 HD21 LEU 53 HD21 LEU 53 3.144 -38.496 5.720 358 HD22 LEU 53 HD22 LEU 53 1.751 -38.799 4.681 359 HD23 LEU 53 HD23 LEU 53 3.381 -38.836 4.006 360 H ARG 54 H ARG 54 6.561 -43.043 6.277 361 HA ARG 54 HA ARG 54 9.049 -41.890 5.219 362 HB2 ARG 54 HB2 ARG 54 8.657 -43.327 7.511 363 HB3 ARG 54 HB3 ARG 54 9.158 -44.585 6.390 364 HG2 ARG 54 HG2 ARG 54 11.278 -43.886 6.374 365 HG3 ARG 54 HG3 ARG 54 10.815 -42.187 6.269 366 HD2 ARG 54 HD2 ARG 54 11.984 -42.559 8.339 367 HD3 ARG 54 HD3 ARG 54 10.288 -42.225 8.686 368 HE ARG 54 HE ARG 54 10.600 -44.992 8.505 369 HH11 ARG 54 HH11 ARG 54 11.621 -42.355 10.536 370 HH12 ARG 54 HH12 ARG 54 11.743 -43.330 11.963 371 HH21 ARG 54 HH21 ARG 54 10.757 -46.286 10.377 372 HH22 ARG 54 HH22 ARG 54 11.252 -45.565 11.871 373 H TYR 55 H TYR 55 10.416 -43.447 3.942 374 HA TYR 55 HA TYR 55 8.697 -44.848 2.014 375 HB2 TYR 55 HB2 TYR 55 10.914 -43.057 1.724 376 HB3 TYR 55 HB3 TYR 55 11.340 -44.610 1.013 377 HD1 TYR 55 HD1 TYR 55 10.025 -41.519 0.265 378 HD2 TYR 55 HD2 TYR 55 9.242 -45.648 -0.398 379 HE1 TYR 55 HE1 TYR 55 8.734 -40.945 -1.747 380 HE2 TYR 55 HE2 TYR 55 7.949 -45.085 -2.413 381 HH TYR 55 HH TYR 55 7.015 -41.876 -3.160 382 H ARG 56 H ARG 56 8.822 -46.987 1.782 383 HA ARG 56 HA ARG 56 11.159 -48.390 2.891 384 HB2 ARG 56 HB2 ARG 56 9.526 -48.799 4.525 385 HB3 ARG 56 HB3 ARG 56 8.242 -48.951 3.333 386 HG2 ARG 56 HG2 ARG 56 8.899 -51.093 4.388 387 HG3 ARG 56 HG3 ARG 56 9.055 -51.087 2.630 388 HD2 ARG 56 HD2 ARG 56 11.458 -50.656 2.854 389 HD3 ARG 56 HD3 ARG 56 11.295 -50.681 4.609 390 HE ARG 56 HE ARG 56 10.316 -53.080 3.433 391 HH11 ARG 56 HH11 ARG 56 13.234 -51.412 4.340 392 HH12 ARG 56 HH12 ARG 56 14.154 -52.865 4.549 393 HH21 ARG 56 HH21 ARG 56 11.517 -55.000 3.705 394 HH22 ARG 56 HH22 ARG 56 13.177 -54.905 4.187 395 H ASN 57 H ASN 57 12.127 -48.886 0.977 396 HA ASN 57 HA ASN 57 10.526 -50.367 -1.001 397 HB2 ASN 57 HB2 ASN 57 12.981 -48.646 -1.274 398 HB3 ASN 57 HB3 ASN 57 12.537 -49.808 -2.521 399 HD21 ASN 57 HD21 ASN 57 11.595 -48.830 -4.147 400 HD22 ASN 57 HD22 ASN 57 10.441 -47.548 -4.040 401 HA PRO 58 HA PRO 58 12.879 -53.862 0.525 402 HB2 PRO 58 HB2 PRO 58 11.549 -55.710 -0.953 403 HB3 PRO 58 HB3 PRO 58 10.894 -55.018 0.536 404 HG2 PRO 58 HG2 PRO 58 10.306 -54.294 -2.309 405 HG3 PRO 58 HG3 PRO 58 9.185 -54.481 -0.947 406 HD2 PRO 58 HD2 PRO 58 10.036 -52.060 -1.812 407 HD3 PRO 58 HD3 PRO 58 9.656 -52.386 -0.109 408 H VAL 59 H VAL 59 12.226 -53.111 -2.863 409 HA VAL 59 HA VAL 59 14.415 -54.776 -3.787 410 HB VAL 59 HB VAL 59 13.806 -54.041 -6.028 411 HG11 VAL 59 HG11 VAL 59 12.321 -55.645 -4.401 412 HG12 VAL 59 HG12 VAL 59 11.106 -54.510 -4.993 413 HG13 VAL 59 HG13 VAL 59 12.066 -55.452 -6.135 414 HG21 VAL 59 HG21 VAL 59 11.700 -52.587 -6.205 415 HG22 VAL 59 HG22 VAL 59 12.047 -52.116 -4.541 416 HG23 VAL 59 HG23 VAL 59 13.222 -51.786 -5.814 417 H SER 60 H SER 60 13.774 -51.422 -3.097 418 HA SER 60 HA SER 60 16.172 -50.487 -4.419 419 HB2 SER 60 HB2 SER 60 13.897 -49.221 -4.046 420 HB3 SER 60 HB3 SER 60 14.612 -48.810 -2.487 421 HG SER 60 HG SER 60 15.141 -47.793 -4.933 422 H GLN 61 H GLN 61 15.140 -51.369 -1.208 423 HA GLN 61 HA GLN 61 16.206 -51.423 0.810 424 HB2 GLN 61 HB2 GLN 61 18.692 -51.853 -0.846 425 HB3 GLN 61 HB3 GLN 61 18.383 -52.419 0.791 426 HG2 GLN 61 HG2 GLN 61 16.327 -53.561 -0.562 427 HG3 GLN 61 HG3 GLN 61 17.597 -53.567 -1.784 428 HE21 GLN 61 HE21 GLN 61 16.340 -55.775 -0.316 429 HE22 GLN 61 HE22 GLN 61 17.633 -56.621 0.456 430 H CYS 62 H CYS 62 15.921 -48.813 -0.333 431 HA CYS 62 HA CYS 62 18.392 -47.459 0.483 432 HB2 CYS 62 HB2 CYS 62 16.676 -47.029 -1.662 433 HB3 CYS 62 HB3 CYS 62 16.277 -45.737 -0.537 434 HG CYS 62 HG CYS 62 18.867 -46.024 -2.552 435 H MET 63 H MET 63 17.471 -45.011 1.231 436 HA MET 63 HA MET 63 15.711 -45.550 3.527 437 HB2 MET 63 HB2 MET 63 18.384 -45.163 3.797 438 HB3 MET 63 HB3 MET 63 17.806 -43.506 3.912 439 HG2 MET 63 HG2 MET 63 17.538 -43.953 6.076 440 HG3 MET 63 HG3 MET 63 16.083 -44.806 5.567 441 HE1 MET 63 HE1 MET 63 15.620 -46.914 5.511 442 HE2 MET 63 HE2 MET 63 16.813 -48.033 4.852 443 HE3 MET 63 HE3 MET 63 16.357 -48.132 6.553 444 H ARG 64 H ARG 64 14.985 -44.445 0.994 445 HA ARG 64 HA ARG 64 14.915 -41.652 0.935 446 HB2 ARG 64 HB2 ARG 64 14.043 -43.654 -0.714 447 HB3 ARG 64 HB3 ARG 64 12.524 -42.987 -0.131 448 HG2 ARG 64 HG2 ARG 64 13.885 -40.726 -0.765 449 HG3 ARG 64 HG3 ARG 64 14.499 -41.857 -1.973 450 HD2 ARG 64 HD2 ARG 64 11.709 -42.253 -1.803 451 HD3 ARG 64 HD3 ARG 64 11.979 -40.513 -1.877 452 HE ARG 64 HE ARG 64 12.714 -40.744 -4.041 453 HH11 ARG 64 HH11 ARG 64 12.502 -43.877 -2.537 454 HH12 ARG 64 HH12 ARG 64 12.754 -44.747 -4.014 455 HH21 ARG 64 HH21 ARG 64 13.048 -41.879 -5.992 456 HH22 ARG 64 HH22 ARG 64 13.065 -43.610 -5.978 457 H GLY 65 H GLY 65 12.439 -40.685 0.812 458 HA2 GLY 65 HA2 GLY 65 10.719 -41.482 2.934 459 HA3 GLY 65 HA3 GLY 65 11.732 -40.135 3.431 460 H VAL 66 H VAL 66 8.765 -40.492 2.828 461 HA VAL 66 HA VAL 66 8.187 -38.909 0.539 462 HB VAL 66 HB VAL 66 6.478 -39.542 2.948 463 HG11 VAL 66 HG11 VAL 66 5.688 -37.526 1.834 464 HG12 VAL 66 HG12 VAL 66 5.694 -38.366 0.283 465 HG13 VAL 66 HG13 VAL 66 4.579 -38.868 1.554 466 HG21 VAL 66 HG21 VAL 66 6.525 -41.586 2.031 467 HG22 VAL 66 HG22 VAL 66 5.447 -40.902 0.815 468 HG23 VAL 66 HG23 VAL 66 7.181 -40.992 0.506 469 H ARG 67 H ARG 67 8.406 -36.792 0.298 470 HA ARG 67 HA ARG 67 9.140 -35.096 2.474 471 HB2 ARG 67 HB2 ARG 67 10.066 -34.661 0.295 472 HB3 ARG 67 HB3 ARG 67 8.462 -34.507 -0.408 473 HG2 ARG 67 HG2 ARG 67 9.391 -32.324 -0.156 474 HG3 ARG 67 HG3 ARG 67 8.090 -32.511 1.022 475 HD2 ARG 67 HD2 ARG 67 10.154 -33.345 2.511 476 HD3 ARG 67 HD3 ARG 67 11.007 -32.243 1.431 477 HE ARG 67 HE ARG 67 8.632 -31.123 2.606 478 HH11 ARG 67 HH11 ARG 67 12.047 -31.673 3.000 479 HH12 ARG 67 HH12 ARG 67 12.264 -30.356 4.104 480 HH21 ARG 67 HH21 ARG 67 8.905 -29.386 4.058 481 HH22 ARG 67 HH22 ARG 67 10.477 -29.056 4.706 482 H LEU 68 H LEU 68 7.972 -33.531 3.515 483 HA LEU 68 HA LEU 68 5.115 -33.317 2.847 484 HB2 LEU 68 HB2 LEU 68 5.286 -34.772 4.753 485 HB3 LEU 68 HB3 LEU 68 6.348 -33.632 5.578 486 HG LEU 68 HG LEU 68 3.860 -33.817 6.286 487 HD11 LEU 68 HD11 LEU 68 5.783 -31.810 6.426 488 HD12 LEU 68 HD12 LEU 68 4.331 -31.966 7.415 489 HD13 LEU 68 HD13 LEU 68 4.298 -30.988 5.947 490 HD21 LEU 68 HD21 LEU 68 3.353 -31.696 4.286 491 HD22 LEU 68 HD22 LEU 68 2.246 -32.861 5.012 492 HD23 LEU 68 HD23 LEU 68 3.325 -33.363 3.710 493 H VAL 69 H VAL 69 4.574 -31.293 2.412 494 HA VAL 69 HA VAL 69 5.814 -29.116 3.935 495 HB VAL 69 HB VAL 69 7.104 -29.118 1.923 496 HG11 VAL 69 HG11 VAL 69 6.273 -30.059 0.089 497 HG12 VAL 69 HG12 VAL 69 4.629 -29.970 0.727 498 HG13 VAL 69 HG13 VAL 69 5.309 -28.604 -0.159 499 HG21 VAL 69 HG21 VAL 69 5.015 -27.003 1.474 500 HG22 VAL 69 HG22 VAL 69 6.155 -26.936 2.818 501 HG23 VAL 69 HG23 VAL 69 6.748 -26.917 1.157 502 H GLU 70 H GLU 70 4.285 -27.882 4.790 503 HA GLU 70 HA GLU 70 2.310 -26.814 5.152 504 HB2 GLU 70 HB2 GLU 70 1.938 -27.041 2.162 505 HB3 GLU 70 HB3 GLU 70 1.110 -25.925 3.238 506 HG2 GLU 70 HG2 GLU 70 4.092 -25.916 2.933 507 HG3 GLU 70 HG3 GLU 70 3.035 -25.016 1.848 508 H GLY 71 H GLY 71 2.469 -29.768 5.109 509 HA2 GLY 71 HA2 GLY 71 0.834 -31.302 5.804 510 HA3 GLY 71 HA3 GLY 71 -0.405 -30.250 5.135 511 H ILE 72 H ILE 72 1.124 -30.046 2.574 512 HA ILE 72 HA ILE 72 -0.078 -32.331 1.306 513 HB ILE 72 HB ILE 72 1.628 -30.134 0.128 514 HG12 ILE 72 HG12 ILE 72 -1.100 -30.032 -0.690 515 HG13 ILE 72 HG13 ILE 72 -1.067 -30.156 1.066 516 HG21 ILE 72 HG21 ILE 72 0.091 -31.084 -1.902 517 HG22 ILE 72 HG22 ILE 72 1.761 -31.560 -1.600 518 HG23 ILE 72 HG23 ILE 72 0.437 -32.562 -1.005 519 HD11 ILE 72 HD11 ILE 72 0.802 -28.267 0.704 520 HD12 ILE 72 HD12 ILE 72 -0.227 -27.958 -0.695 521 HD13 ILE 72 HD13 ILE 72 -0.912 -27.922 0.930 522 H LEU 73 H LEU 73 0.868 -34.238 1.084 523 HA LEU 73 HA LEU 73 3.670 -34.598 1.596 524 HB2 LEU 73 HB2 LEU 73 1.431 -36.444 0.829 525 HB3 LEU 73 HB3 LEU 73 3.100 -37.001 0.918 526 HG LEU 73 HG LEU 73 1.949 -37.593 2.945 527 HD11 LEU 73 HD11 LEU 73 3.786 -35.257 3.450 528 HD12 LEU 73 HD12 LEU 73 4.302 -36.909 3.114 529 HD13 LEU 73 HD13 LEU 73 3.396 -36.550 4.584 530 HD21 LEU 73 HD21 LEU 73 1.492 -34.729 3.646 531 HD22 LEU 73 HD22 LEU 73 0.684 -36.178 4.245 532 HD23 LEU 73 HD23 LEU 73 0.324 -35.571 2.628 533 H HIS 74 H HIS 74 5.092 -33.984 0.096 534 HA HIS 74 HA HIS 74 4.485 -34.062 -2.716 535 HB2 HIS 74 HB2 HIS 74 6.247 -32.619 -1.124 536 HB3 HIS 74 HB3 HIS 74 7.296 -33.680 -2.059 537 HD1 HIS 74 HD1 HIS 74 6.338 -33.661 -4.792 538 HD2 HIS 74 HD2 HIS 74 5.994 -30.272 -2.413 539 HE1 HIS 74 HE1 HIS 74 6.108 -31.735 -6.394 540 H ALA 75 H ALA 75 5.512 -35.324 -4.295 541 HA ALA 75 HA ALA 75 6.432 -37.920 -3.304 542 HB1 ALA 75 HB1 ALA 75 6.218 -38.304 -5.952 543 HB2 ALA 75 HB2 ALA 75 4.864 -38.473 -4.833 544 HB3 ALA 75 HB3 ALA 75 5.071 -36.979 -5.748 545 HA PRO 76 HA PRO 76 10.622 -37.357 -4.484 546 HB2 PRO 76 HB2 PRO 76 11.283 -39.847 -5.341 547 HB3 PRO 76 HB3 PRO 76 11.024 -39.455 -3.637 548 HG2 PRO 76 HG2 PRO 76 9.157 -40.745 -5.590 549 HG3 PRO 76 HG3 PRO 76 9.476 -41.171 -3.898 550 HD2 PRO 76 HD2 PRO 76 7.299 -39.751 -4.657 551 HD3 PRO 76 HD3 PRO 76 8.096 -39.512 -3.088 552 H ASP 77 H ASP 77 12.177 -38.208 -6.391 553 HA ASP 77 HA ASP 77 11.112 -37.005 -8.777 554 HB2 ASP 77 HB2 ASP 77 13.792 -38.115 -7.990 555 HB3 ASP 77 HB3 ASP 77 13.451 -37.694 -9.666 556 H ALA 78 H ALA 78 10.824 -40.023 -7.523 557 HA ALA 78 HA ALA 78 10.821 -41.330 -10.161 558 HB1 ALA 78 HB1 ALA 78 11.003 -42.524 -7.399 559 HB2 ALA 78 HB2 ALA 78 10.863 -43.461 -8.887 560 HB3 ALA 78 HB3 ALA 78 12.280 -42.447 -8.614 561 H GLY 79 H GLY 79 8.869 -40.418 -7.439 562 HA2 GLY 79 HA2 GLY 79 6.484 -40.085 -7.944 563 HA3 GLY 79 HA3 GLY 79 6.531 -41.630 -8.779 564 H TRP 80 H TRP 80 4.585 -41.628 -7.136 565 HA TRP 80 HA TRP 80 5.177 -42.160 -4.409 566 HB2 TRP 80 HB2 TRP 80 2.737 -42.706 -6.103 567 HB3 TRP 80 HB3 TRP 80 2.812 -43.071 -4.381 568 HD1 TRP 80 HD1 TRP 80 1.608 -40.472 -6.578 569 HE1 TRP 80 HE1 TRP 80 1.359 -38.222 -5.354 570 HE3 TRP 80 HE3 TRP 80 4.348 -41.519 -2.391 571 HZ2 TRP 80 HZ2 TRP 80 2.211 -37.046 -2.933 572 HZ3 TRP 80 HZ3 TRP 80 4.583 -39.777 -0.669 573 HH2 TRP 80 HH2 TRP 80 3.536 -37.587 -0.937 574 H GLY 81 H GLY 81 4.063 -44.348 -7.008 575 HA2 GLY 81 HA2 GLY 81 4.799 -46.508 -7.469 576 HA3 GLY 81 HA3 GLY 81 5.856 -46.419 -6.067 577 H ASN 82 H ASN 82 5.071 -48.660 -5.779 578 HA ASN 82 HA ASN 82 2.559 -48.659 -4.243 579 HB2 ASN 82 HB2 ASN 82 3.455 -51.117 -5.702 580 HB3 ASN 82 HB3 ASN 82 1.835 -50.654 -5.190 581 HD21 ASN 82 HD21 ASN 82 0.827 -48.859 -6.337 582 HD22 ASN 82 HD22 ASN 82 1.180 -48.641 -8.014 583 H LEU 83 H LEU 83 5.248 -48.281 -3.284 584 HA LEU 83 HA LEU 83 5.995 -50.795 -2.036 585 HB2 LEU 83 HB2 LEU 83 7.774 -49.320 -0.969 586 HB3 LEU 83 HB3 LEU 83 7.853 -49.563 -2.713 587 HG LEU 83 HG LEU 83 8.287 -47.208 -1.746 588 HD11 LEU 83 HD11 LEU 83 7.307 -48.155 -4.180 589 HD12 LEU 83 HD12 LEU 83 8.079 -46.601 -3.870 590 HD13 LEU 83 HD13 LEU 83 6.322 -46.742 -3.798 591 HD21 LEU 83 HD21 LEU 83 6.361 -45.834 -1.383 592 HD22 LEU 83 HD22 LEU 83 6.243 -47.236 -0.318 593 HD23 LEU 83 HD23 LEU 83 5.273 -47.162 -1.791 594 H VAL 84 H VAL 84 6.815 -50.261 0.415 595 HA VAL 84 HA VAL 84 4.336 -49.650 1.829 596 HB VAL 84 HB VAL 84 6.878 -50.669 3.079 597 HG11 VAL 84 HG11 VAL 84 4.800 -51.810 4.395 598 HG12 VAL 84 HG12 VAL 84 5.576 -50.299 4.876 599 HG13 VAL 84 HG13 VAL 84 4.093 -50.265 3.921 600 HG21 VAL 84 HG21 VAL 84 4.928 -52.084 1.360 601 HG22 VAL 84 HG22 VAL 84 6.644 -52.396 1.623 602 HG23 VAL 84 HG23 VAL 84 5.460 -52.916 2.821 603 H TYR 85 H TYR 85 4.396 -48.358 3.802 604 HA TYR 85 HA TYR 85 6.541 -46.353 3.860 605 HB2 TYR 85 HB2 TYR 85 5.163 -44.573 3.562 606 HB3 TYR 85 HB3 TYR 85 4.166 -45.756 2.721 607 HD1 TYR 85 HD1 TYR 85 2.039 -46.391 3.567 608 HD2 TYR 85 HD2 TYR 85 4.616 -43.953 5.916 609 HE1 TYR 85 HE1 TYR 85 0.186 -45.941 5.121 610 HE2 TYR 85 HE2 TYR 85 2.771 -43.497 7.478 611 HH TYR 85 HH TYR 85 -0.235 -45.209 7.322 612 H VAL 86 H VAL 86 6.973 -45.454 5.873 613 HA VAL 86 HA VAL 86 5.731 -46.866 8.139 614 HB VAL 86 HB VAL 86 8.444 -45.543 7.984 615 HG11 VAL 86 HG11 VAL 86 8.302 -47.250 10.195 616 HG12 VAL 86 HG12 VAL 86 8.367 -45.486 10.206 617 HG13 VAL 86 HG13 VAL 86 6.808 -46.312 10.224 618 HG21 VAL 86 HG21 VAL 86 8.036 -47.742 6.732 619 HG22 VAL 86 HG22 VAL 86 9.398 -47.675 7.850 620 HG23 VAL 86 HG23 VAL 86 7.902 -48.475 8.331 621 H VAL 87 H VAL 87 4.396 -45.715 9.353 622 HA VAL 87 HA VAL 87 3.929 -42.973 9.052 623 HB VAL 87 HB VAL 87 2.724 -43.177 11.279 624 HG11 VAL 87 HG11 VAL 87 2.082 -45.060 9.015 625 HG12 VAL 87 HG12 VAL 87 0.968 -44.679 10.330 626 HG13 VAL 87 HG13 VAL 87 1.507 -43.407 9.233 627 HG21 VAL 87 HG21 VAL 87 3.044 -46.127 11.036 628 HG22 VAL 87 HG22 VAL 87 4.310 -45.204 11.845 629 HG23 VAL 87 HG23 VAL 87 2.654 -45.147 12.449 630 H ASN 88 H ASN 88 4.224 -41.254 10.619 631 HA ASN 88 HA ASN 88 6.394 -41.602 12.535 632 HB2 ASN 88 HB2 ASN 88 7.240 -40.847 10.184 633 HB3 ASN 88 HB3 ASN 88 6.563 -39.285 10.636 634 HD21 ASN 88 HD21 ASN 88 8.657 -38.398 10.574 635 HD22 ASN 88 HD22 ASN 88 9.776 -38.658 11.864 636 H TYR 89 H TYR 89 5.961 -40.556 14.365 637 HA TYR 89 HA TYR 89 4.059 -38.307 14.273 638 HB2 TYR 89 HB2 TYR 89 4.308 -40.225 16.587 639 HB3 TYR 89 HB3 TYR 89 3.040 -39.041 16.292 640 HD1 TYR 89 HD1 TYR 89 4.319 -42.357 15.430 641 HD2 TYR 89 HD2 TYR 89 1.271 -39.486 14.678 642 HE1 TYR 89 HE1 TYR 89 2.977 -44.085 14.307 643 HE2 TYR 89 HE2 TYR 89 -0.080 -41.206 13.554 644 HH TYR 89 HH TYR 89 -0.203 -43.323 12.912 645 HA PRO 90 HA PRO 90 8.098 -36.986 16.204 646 HB2 PRO 90 HB2 PRO 90 8.379 -34.751 14.688 647 HB3 PRO 90 HB3 PRO 90 8.980 -36.335 14.184 648 HG2 PRO 90 HG2 PRO 90 6.462 -34.924 13.391 649 HG3 PRO 90 HG3 PRO 90 7.602 -35.831 12.380 650 HD2 PRO 90 HD2 PRO 90 5.263 -36.886 13.246 651 HD3 PRO 90 HD3 PRO 90 6.719 -37.870 12.996 652 H LYS 91 H LYS 91 5.426 -34.901 15.093 653 HA LYS 91 HA LYS 91 4.222 -33.279 16.138 654 HB2 LYS 91 HB2 LYS 91 3.970 -35.134 17.839 655 HB3 LYS 91 HB3 LYS 91 5.294 -34.397 18.730 656 HG2 LYS 91 HG2 LYS 91 4.040 -32.471 19.213 657 HG3 LYS 91 HG3 LYS 91 2.814 -32.870 18.007 658 HD2 LYS 91 HD2 LYS 91 2.856 -35.067 19.706 659 HD3 LYS 91 HD3 LYS 91 3.017 -33.678 20.783 660 HE2 LYS 91 HE2 LYS 91 1.052 -32.662 19.584 661 HE3 LYS 91 HE3 LYS 91 0.838 -34.213 18.773 662 HZ1 LYS 91 HZ1 LYS 91 -0.560 -33.917 20.777 663 HZ2 LYS 91 HZ2 LYS 91 0.843 -33.872 21.721 664 HZ3 LYS 91 HZ3 LYS 91 0.450 -35.272 20.858 665 H ASP 92 H ASP 92 6.246 -32.145 15.095 666 HA ASP 92 HA ASP 92 7.186 -30.246 17.100 667 HB2 ASP 92 HB2 ASP 92 8.877 -32.232 16.415 668 HB3 ASP 92 HB3 ASP 92 9.245 -31.077 15.137 669 H ASN 93 H ASN 93 7.373 -28.186 16.350 670 HA ASN 93 HA ASN 93 7.429 -27.646 13.504 671 HB2 ASN 93 HB2 ASN 93 5.089 -27.823 13.639 672 HB3 ASN 93 HB3 ASN 93 5.033 -27.062 15.227 673 HD21 ASN 93 HD21 ASN 93 4.053 -25.187 15.102 674 HD22 ASN 93 HD22 ASN 93 4.251 -24.011 13.852 675 H LYS 94 H LYS 94 6.336 -25.748 16.307 676 HA LYS 94 HA LYS 94 7.068 -23.781 17.186 677 HB2 LYS 94 HB2 LYS 94 9.030 -25.406 17.621 678 HB3 LYS 94 HB3 LYS 94 9.846 -24.545 16.322 679 HG2 LYS 94 HG2 LYS 94 9.585 -22.447 17.570 680 HG3 LYS 94 HG3 LYS 94 8.815 -23.341 18.884 681 HD2 LYS 94 HD2 LYS 94 10.821 -24.575 19.309 682 HD3 LYS 94 HD3 LYS 94 11.591 -23.923 17.860 683 HE2 LYS 94 HE2 LYS 94 11.641 -21.718 18.813 684 HE3 LYS 94 HE3 LYS 94 10.694 -22.250 20.202 685 HZ1 LYS 94 HZ1 LYS 94 12.472 -23.334 21.116 686 HZ2 LYS 94 HZ2 LYS 94 13.269 -22.048 20.361 687 HZ3 LYS 94 HZ3 LYS 94 13.252 -23.575 19.634 688 H ARG 95 H ARG 95 5.967 -22.685 15.412 689 HA ARG 95 HA ARG 95 7.125 -21.937 13.004 690 HB2 ARG 95 HB2 ARG 95 4.785 -21.565 13.378 691 HB3 ARG 95 HB3 ARG 95 5.116 -20.498 14.736 692 HG2 ARG 95 HG2 ARG 95 6.128 -18.874 13.212 693 HG3 ARG 95 HG3 ARG 95 5.777 -19.943 11.852 694 HD2 ARG 95 HD2 ARG 95 3.571 -19.100 13.679 695 HD3 ARG 95 HD3 ARG 95 4.155 -17.981 12.447 696 HE ARG 95 HE ARG 95 3.615 -20.515 11.308 697 HH11 ARG 95 HH11 ARG 95 2.033 -17.676 12.559 698 HH12 ARG 95 HH12 ARG 95 0.620 -17.871 11.576 699 HH21 ARG 95 HH21 ARG 95 1.760 -20.782 10.009 700 HH22 ARG 95 HH22 ARG 95 0.465 -19.639 10.126 701 H LYS 96 H LYS 96 6.727 -19.679 15.730 702 HA LYS 96 HA LYS 96 8.013 -17.962 16.486 703 HB2 LYS 96 HB2 LYS 96 9.617 -19.921 16.772 704 HB3 LYS 96 HB3 LYS 96 10.374 -19.395 15.274 705 HG2 LYS 96 HG2 LYS 96 11.694 -18.185 16.605 706 HG3 LYS 96 HG3 LYS 96 10.322 -17.078 16.699 707 HD2 LYS 96 HD2 LYS 96 9.596 -18.718 18.645 708 HD3 LYS 96 HD3 LYS 96 11.332 -19.036 18.699 709 HE2 LYS 96 HE2 LYS 96 11.533 -17.210 19.953 710 HE3 LYS 96 HE3 LYS 96 11.124 -16.268 18.520 711 HZ1 LYS 96 HZ1 LYS 96 8.875 -16.186 19.148 712 HZ2 LYS 96 HZ2 LYS 96 9.741 -15.843 20.559 713 HZ3 LYS 96 HZ3 LYS 96 9.064 -17.377 20.335 714 H MET 97 H MET 97 7.233 -16.334 15.182 715 HA MET 97 HA MET 97 8.042 -15.932 12.494 716 HB2 MET 97 HB2 MET 97 6.233 -14.725 14.344 717 HB3 MET 97 HB3 MET 97 7.232 -13.459 13.642 718 HG2 MET 97 HG2 MET 97 6.276 -15.339 11.652 719 HG3 MET 97 HG3 MET 97 4.963 -14.567 12.539 720 HE1 MET 97 HE1 MET 97 7.494 -14.167 9.629 721 HE2 MET 97 HE2 MET 97 5.768 -14.464 9.425 722 HE3 MET 97 HE3 MET 97 6.471 -12.939 8.883 723 H ASP 98 H ASP 98 9.348 -14.220 11.645 724 HA ASP 98 HA ASP 98 11.256 -13.007 13.505 725 HB2 ASP 98 HB2 ASP 98 12.057 -15.244 12.357 726 HB3 ASP 98 HB3 ASP 98 12.332 -14.186 10.976 727 H GLU 99 H GLU 99 12.292 -11.129 12.708 728 HA GLU 99 HA GLU 99 11.053 -10.006 10.281 729 HB2 GLU 99 HB2 GLU 99 10.270 -9.012 12.473 730 HB3 GLU 99 HB3 GLU 99 11.906 -8.411 12.696 731 HG2 GLU 99 HG2 GLU 99 11.137 -6.577 11.686 732 HG3 GLU 99 HG3 GLU 99 11.357 -7.504 10.203 733 H THR 100 H THR 100 12.423 -9.409 8.740 734 HA THR 100 HA THR 100 15.203 -9.780 8.957 735 HB THR 100 HB THR 100 15.074 -8.214 6.779 736 HG1 THR 100 HG1 THR 100 13.040 -8.394 5.832 737 HG21 THR 100 HG21 THR 100 13.972 -10.631 5.882 738 HG22 THR 100 HG22 THR 100 14.888 -11.034 7.334 739 HG23 THR 100 HG23 THR 100 15.681 -10.209 5.992 740 H ASP 101 H ASP 101 16.594 -8.564 10.042 741 HA ASP 101 HA ASP 101 16.337 -5.645 9.895 742 HB2 ASP 101 HB2 ASP 101 16.217 -7.326 12.306 743 HB3 ASP 101 HB3 ASP 101 17.356 -5.986 12.411 744 H ALA 102 H ALA 102 18.363 -4.523 10.528 745 HA ALA 102 HA ALA 102 20.762 -6.171 10.135 746 HB1 ALA 102 HB1 ALA 102 20.408 -5.324 7.967 747 HB2 ALA 102 HB2 ALA 102 19.994 -3.721 8.574 748 HB3 ALA 102 HB3 ALA 102 21.656 -4.299 8.675 749 H SER 103 H SER 103 21.708 -5.955 12.077 750 HA SER 103 HA SER 103 22.280 -3.222 13.003 751 HB2 SER 103 HB2 SER 103 20.953 -5.428 14.458 752 HB3 SER 103 HB3 SER 103 22.208 -4.574 15.356 753 HG SER 103 HG SER 103 20.111 -3.251 13.986 754 H SER 104 H SER 104 24.356 -3.317 12.139 755 HA SER 104 HA SER 104 26.226 -4.946 13.694 756 HB2 SER 104 HB2 SER 104 25.789 -6.148 11.558 757 HB3 SER 104 HB3 SER 104 26.354 -4.730 10.676 758 HG SER 104 HG SER 104 27.803 -6.536 12.267 759 H ALA 105 H ALA 105 27.639 -3.615 14.589 760 HA ALA 105 HA ALA 105 29.134 -1.717 13.097 761 HB1 ALA 105 HB1 ALA 105 27.459 -0.368 15.167 762 HB2 ALA 105 HB2 ALA 105 28.282 0.315 13.764 763 HB3 ALA 105 HB3 ALA 105 26.807 -0.627 13.548 764 H VAL 106 H VAL 106 31.052 -1.458 14.060 765 HA VAL 106 HA VAL 106 31.499 -2.660 16.644 766 HB VAL 106 HB VAL 106 33.859 -2.179 16.267 767 HG11 VAL 106 HG11 VAL 106 34.026 -3.955 14.932 768 HG12 VAL 106 HG12 VAL 106 32.270 -3.884 14.771 769 HG13 VAL 106 HG13 VAL 106 33.299 -3.095 13.575 770 HG21 VAL 106 HG21 VAL 106 32.765 -0.454 14.096 771 HG22 VAL 106 HG22 VAL 106 34.055 -0.125 15.253 772 HG23 VAL 106 HG23 VAL 106 34.350 -1.197 13.885 773 H LYS 107 H LYS 107 33.057 -1.425 18.161 774 HA LYS 107 HA LYS 107 32.750 1.427 18.269 775 HB2 LYS 107 HB2 LYS 107 30.560 0.396 19.166 776 HB3 LYS 107 HB3 LYS 107 31.519 -0.086 20.559 777 HG2 LYS 107 HG2 LYS 107 31.824 2.081 21.272 778 HG3 LYS 107 HG3 LYS 107 31.558 2.759 19.664 779 HD2 LYS 107 HD2 LYS 107 29.155 1.603 20.125 780 HD3 LYS 107 HD3 LYS 107 29.623 2.048 21.768 781 HE2 LYS 107 HE2 LYS 107 28.385 3.867 20.837 782 HE3 LYS 107 HE3 LYS 107 30.076 4.356 20.931 783 HZ1 LYS 107 HZ1 LYS 107 29.460 3.121 18.434 784 HZ2 LYS 107 HZ2 LYS 107 30.162 4.628 18.742 785 HZ3 LYS 107 HZ3 LYS 107 28.478 4.470 18.717 786 H VAL 108 H VAL 108 34.838 1.834 18.667 787 HA VAL 108 HA VAL 108 36.222 0.284 20.741 788 HB VAL 108 HB VAL 108 37.430 2.203 18.747 789 HG11 VAL 108 HG11 VAL 108 39.502 0.837 19.349 790 HG12 VAL 108 HG12 VAL 108 38.915 1.989 20.550 791 HG13 VAL 108 HG13 VAL 108 38.576 0.268 20.737 792 HG21 VAL 108 HG21 VAL 108 36.748 0.565 17.314 793 HG22 VAL 108 HG22 VAL 108 38.271 -0.144 17.850 794 HG23 VAL 108 HG23 VAL 108 36.749 -0.683 18.560 795 H LYS 109 H LYS 109 37.052 1.213 22.551 796 HA LYS 109 HA LYS 109 37.419 3.997 22.907 797 HB2 LYS 109 HB2 LYS 109 34.812 3.514 22.990 798 HB3 LYS 109 HB3 LYS 109 35.189 3.030 24.638 799 HG2 LYS 109 HG2 LYS 109 36.335 5.604 23.829 800 HG3 LYS 109 HG3 LYS 109 34.571 5.552 23.868 801 HD2 LYS 109 HD2 LYS 109 36.068 4.398 26.167 802 HD3 LYS 109 HD3 LYS 109 35.991 6.155 26.017 803 HE2 LYS 109 HE2 LYS 109 33.528 5.997 25.883 804 HE3 LYS 109 HE3 LYS 109 33.650 4.256 26.132 805 HZ1 LYS 109 HZ1 LYS 109 35.090 5.308 28.185 806 HZ2 LYS 109 HZ2 LYS 109 33.503 4.732 28.286 807 HZ3 LYS 109 HZ3 LYS 109 33.790 6.382 28.046 808 H ARG 110 H ARG 110 38.533 4.459 24.784 809 HA ARG 110 HA ARG 110 39.048 2.181 26.580 810 HB2 ARG 110 HB2 ARG 110 40.911 3.858 25.052 811 HB3 ARG 110 HB3 ARG 110 41.328 3.697 26.753 812 HG2 ARG 110 HG2 ARG 110 40.678 1.276 25.126 813 HG3 ARG 110 HG3 ARG 110 42.280 2.011 25.044 814 HD2 ARG 110 HD2 ARG 110 42.659 0.563 26.752 815 HD3 ARG 110 HD3 ARG 110 42.024 1.914 27.689 816 HE ARG 110 HE ARG 110 39.985 0.098 26.826 817 HH11 ARG 110 HH11 ARG 110 42.410 0.697 29.251 818 HH12 ARG 110 HH12 ARG 110 41.615 -0.249 30.466 819 HH21 ARG 110 HH21 ARG 110 38.929 -1.150 28.417 820 HH22 ARG 110 HH22 ARG 110 39.636 -1.300 29.990 821 H ALA 111 H ALA 111 39.465 2.671 28.767 822 HA ALA 111 HA ALA 111 39.113 5.429 29.645 823 HB1 ALA 111 HB1 ALA 111 37.382 4.642 31.330 824 HB2 ALA 111 HB2 ALA 111 36.850 4.789 29.654 825 HB3 ALA 111 HB3 ALA 111 37.217 3.200 30.327 826 H VAL 112 H VAL 112 40.983 5.623 30.730 827 HA VAL 112 HA VAL 112 42.010 3.454 32.353 828 HB VAL 112 HB VAL 112 43.918 4.912 32.785 829 HG11 VAL 112 HG11 VAL 112 43.348 3.704 30.459 830 HG12 VAL 112 HG12 VAL 112 43.535 5.365 29.892 831 HG13 VAL 112 HG13 VAL 112 44.854 4.572 30.754 832 HG21 VAL 112 HG21 VAL 112 42.282 6.976 31.325 833 HG22 VAL 112 HG22 VAL 112 42.887 7.053 32.980 834 HG23 VAL 112 HG23 VAL 112 44.012 7.134 31.625 835 H GLN 113 H GLN 113 43.013 4.300 34.555 836 HA GLN 113 HA GLN 113 41.169 6.055 35.972 837 HB2 GLN 113 HB2 GLN 113 40.233 3.746 36.139 838 HB3 GLN 113 HB3 GLN 113 41.720 3.243 36.932 839 HG2 GLN 113 HG2 GLN 113 41.193 4.263 38.884 840 HG3 GLN 113 HG3 GLN 113 40.294 5.557 38.094 841 HE21 GLN 113 HE21 GLN 113 40.111 2.034 38.498 842 HE22 GLN 113 HE22 GLN 113 38.412 1.988 38.809 843 H LYS 114 H LYS 114 43.787 3.721 36.641 844 HA LYS 114 HA LYS 114 45.405 5.896 37.725 845 HB2 LYS 114 HB2 LYS 114 43.990 4.641 39.531 846 HB3 LYS 114 HB3 LYS 114 45.184 3.367 39.320 847 HG2 LYS 114 HG2 LYS 114 46.938 5.157 39.762 848 HG3 LYS 114 HG3 LYS 114 45.599 6.166 40.316 849 HD2 LYS 114 HD2 LYS 114 45.095 4.710 42.090 850 HD3 LYS 114 HD3 LYS 114 46.049 3.398 41.395 851 HE2 LYS 114 HE2 LYS 114 47.779 5.606 41.754 852 HE3 LYS 114 HE3 LYS 114 46.852 5.420 43.241 853 HZ1 LYS 114 HZ1 LYS 114 48.308 3.840 43.754 854 HZ2 LYS 114 HZ2 LYS 114 48.941 3.777 42.187 855 HZ3 LYS 114 HZ3 LYS 114 47.564 2.875 42.580 Start of MODEL 6 1 H1 MET 1 H MET 1 17.835 -25.191 -18.152 2 HA MET 1 HA MET 1 19.185 -23.300 -19.169 3 HB2 MET 1 HB2 MET 1 21.027 -25.635 -19.714 4 HB3 MET 1 HB3 MET 1 21.251 -23.986 -20.281 5 HG2 MET 1 HG2 MET 1 22.609 -23.892 -18.488 6 HG3 MET 1 HG3 MET 1 21.099 -23.496 -17.672 7 HE1 MET 1 HE1 MET 1 23.205 -27.565 -17.683 8 HE2 MET 1 HE2 MET 1 23.158 -26.383 -18.991 9 HE3 MET 1 HE3 MET 1 24.151 -26.081 -17.564 10 H ALA 2 H ALA 2 18.973 -22.901 -21.403 11 HA ALA 2 HA ALA 2 17.901 -23.079 -23.406 12 HB1 ALA 2 HB1 ALA 2 19.200 -25.747 -23.069 13 HB2 ALA 2 HB2 ALA 2 18.165 -25.441 -24.464 14 HB3 ALA 2 HB3 ALA 2 19.591 -24.441 -24.187 15 H GLY 3 H GLY 3 15.806 -22.706 -22.559 16 HA2 GLY 3 HA2 GLY 3 14.162 -25.138 -22.235 17 HA3 GLY 3 HA3 GLY 3 13.801 -23.590 -21.487 18 H SER 4 H SER 4 12.352 -25.440 -23.431 19 HA SER 4 HA SER 4 12.131 -24.128 -25.916 20 HB2 SER 4 HB2 SER 4 10.554 -25.705 -26.415 21 HB3 SER 4 HB3 SER 4 11.228 -26.484 -24.984 22 HG SER 4 HG SER 4 9.535 -25.703 -23.776 23 H HIS 5 H HIS 5 11.144 -22.307 -26.484 24 HA HIS 5 HA HIS 5 9.112 -21.183 -24.671 25 HB2 HIS 5 HB2 HIS 5 11.630 -20.087 -25.275 26 HB3 HIS 5 HB3 HIS 5 10.464 -19.135 -26.191 27 HD1 HIS 5 HD1 HIS 5 8.148 -19.129 -24.136 28 HD2 HIS 5 HD2 HIS 5 12.127 -18.377 -23.207 29 HE1 HIS 5 HE1 HIS 5 8.100 -17.784 -22.012 30 H HIS 6 H HIS 6 7.241 -21.471 -25.714 31 HA HIS 6 HA HIS 6 6.786 -20.106 -28.195 32 HB2 HIS 6 HB2 HIS 6 7.688 -22.669 -28.502 33 HB3 HIS 6 HB3 HIS 6 5.944 -22.912 -28.479 34 HD1 HIS 6 HD1 HIS 6 8.295 -22.825 -30.902 35 HD2 HIS 6 HD2 HIS 6 4.951 -20.436 -30.292 36 HE1 HIS 6 HE1 HIS 6 7.747 -21.848 -33.153 37 H HIS 7 H HIS 7 5.377 -22.798 -26.319 38 HA HIS 7 HA HIS 7 3.255 -21.246 -25.282 39 HB2 HIS 7 HB2 HIS 7 2.863 -22.363 -27.931 40 HB3 HIS 7 HB3 HIS 7 1.683 -22.999 -26.788 41 HD1 HIS 7 HD1 HIS 7 2.202 -20.244 -29.005 42 HD2 HIS 7 HD2 HIS 7 0.369 -20.736 -25.310 43 HE1 HIS 7 HE1 HIS 7 0.670 -18.267 -28.746 44 H HIS 8 H HIS 8 2.599 -22.221 -23.480 45 HA HIS 8 HA HIS 8 2.855 -25.150 -23.299 46 HB2 HIS 8 HB2 HIS 8 3.670 -23.031 -21.327 47 HB3 HIS 8 HB3 HIS 8 3.303 -24.670 -20.797 48 HD1 HIS 8 HD1 HIS 8 5.511 -25.679 -20.297 49 HD2 HIS 8 HD2 HIS 8 5.533 -23.590 -23.888 50 HE1 HIS 8 HE1 HIS 8 7.777 -26.098 -21.304 51 H HIS 9 H HIS 9 0.963 -26.098 -22.981 52 HA HIS 9 HA HIS 9 -1.185 -24.562 -21.681 53 HB2 HIS 9 HB2 HIS 9 -1.114 -26.345 -23.993 54 HB3 HIS 9 HB3 HIS 9 -2.380 -26.772 -22.846 55 HD1 HIS 9 HD1 HIS 9 -4.515 -25.723 -23.471 56 HD2 HIS 9 HD2 HIS 9 -1.283 -23.282 -24.397 57 HE1 HIS 9 HE1 HIS 9 -5.509 -23.646 -24.482 58 H HIS 10 H HIS 10 -2.205 -25.347 -19.907 59 HA HIS 10 HA HIS 10 -0.901 -27.324 -18.351 60 HB2 HIS 10 HB2 HIS 10 -3.482 -25.809 -18.053 61 HB3 HIS 10 HB3 HIS 10 -3.036 -27.075 -16.913 62 HD1 HIS 10 HD1 HIS 10 -3.302 -24.404 -15.693 63 HD2 HIS 10 HD2 HIS 10 0.244 -25.638 -17.472 64 HE1 HIS 10 HE1 HIS 10 -1.505 -22.967 -14.679 65 H GLY 11 H GLY 11 -1.606 -29.382 -17.712 66 HA2 GLY 11 HA2 GLY 11 -3.950 -30.548 -18.952 67 HA3 GLY 11 HA3 GLY 11 -2.421 -31.166 -19.558 68 H SER 12 H SER 12 -0.854 -31.441 -17.424 69 HA SER 12 HA SER 12 -2.391 -33.115 -15.549 70 HB2 SER 12 HB2 SER 12 0.414 -33.820 -16.363 71 HB3 SER 12 HB3 SER 12 -0.837 -34.858 -15.680 72 HG SER 12 HG SER 12 -0.937 -35.390 -17.754 73 H MET 13 H MET 13 -2.404 -31.540 -13.949 74 HA MET 13 HA MET 13 0.180 -31.146 -12.621 75 HB2 MET 13 HB2 MET 13 -1.858 -28.970 -13.123 76 HB3 MET 13 HB3 MET 13 -0.432 -28.802 -12.109 77 HG2 MET 13 HG2 MET 13 0.456 -29.759 -14.601 78 HG3 MET 13 HG3 MET 13 -0.692 -28.463 -14.927 79 HE1 MET 13 HE1 MET 13 3.148 -28.282 -15.076 80 HE2 MET 13 HE2 MET 13 3.451 -28.426 -13.345 81 HE3 MET 13 HE3 MET 13 2.492 -29.651 -14.177 82 H SER 14 H SER 14 0.035 -30.741 -10.349 83 HA SER 14 HA SER 14 -0.771 -31.101 -8.252 84 HB2 SER 14 HB2 SER 14 -2.428 -29.349 -9.008 85 HB3 SER 14 HB3 SER 14 -3.525 -30.666 -9.422 86 HG SER 14 HG SER 14 -2.732 -29.721 -6.929 87 H GLU 15 H GLU 15 -0.332 -33.199 -7.843 88 HA GLU 15 HA GLU 15 -2.303 -35.206 -8.711 89 HB2 GLU 15 HB2 GLU 15 0.495 -35.186 -8.926 90 HB3 GLU 15 HB3 GLU 15 0.134 -36.336 -7.646 91 HG2 GLU 15 HG2 GLU 15 -1.246 -37.630 -9.095 92 HG3 GLU 15 HG3 GLU 15 -1.157 -36.406 -10.360 93 H TYR 16 H TYR 16 -1.755 -37.252 -7.011 94 HA TYR 16 HA TYR 16 -2.125 -36.175 -4.306 95 HB2 TYR 16 HB2 TYR 16 -3.881 -38.070 -4.045 96 HB3 TYR 16 HB3 TYR 16 -4.358 -36.574 -4.839 97 HD1 TYR 16 HD1 TYR 16 -5.387 -36.667 -6.918 98 HD2 TYR 16 HD2 TYR 16 -3.068 -39.988 -5.615 99 HE1 TYR 16 HE1 TYR 16 -6.114 -37.942 -8.892 100 HE2 TYR 16 HE2 TYR 16 -3.787 -41.271 -7.586 101 HH TYR 16 HH TYR 16 -6.082 -39.911 -9.927 102 H ILE 17 H ILE 17 -2.328 -38.264 -2.772 103 HA ILE 17 HA ILE 17 -0.086 -40.034 -3.501 104 HB ILE 17 HB ILE 17 0.718 -38.629 -1.768 105 HG12 ILE 17 HG12 ILE 17 -0.229 -41.188 -0.459 106 HG13 ILE 17 HG13 ILE 17 1.178 -41.058 -1.509 107 HG21 ILE 17 HG21 ILE 17 -0.757 -37.539 -0.512 108 HG22 ILE 17 HG22 ILE 17 -2.025 -38.707 -0.878 109 HG23 ILE 17 HG23 ILE 17 -0.911 -39.005 0.457 110 HD11 ILE 17 HD11 ILE 17 2.035 -39.327 0.157 111 HD12 ILE 17 HD12 ILE 17 0.782 -39.939 1.237 112 HD13 ILE 17 HD13 ILE 17 2.045 -41.020 0.649 113 H ARG 18 H ARG 18 -0.578 -42.117 -3.612 114 HA ARG 18 HA ARG 18 -2.979 -43.067 -2.193 115 HB2 ARG 18 HB2 ARG 18 -2.025 -43.446 -4.924 116 HB3 ARG 18 HB3 ARG 18 -2.395 -44.967 -4.123 117 HG2 ARG 18 HG2 ARG 18 -4.536 -43.309 -3.499 118 HG3 ARG 18 HG3 ARG 18 -4.174 -42.966 -5.192 119 HD2 ARG 18 HD2 ARG 18 -4.180 -45.813 -4.421 120 HD3 ARG 18 HD3 ARG 18 -5.743 -44.999 -4.368 121 HE ARG 18 HE ARG 18 -4.394 -44.452 -6.804 122 HH11 ARG 18 HH11 ARG 18 -6.187 -46.925 -5.133 123 HH12 ARG 18 HH12 ARG 18 -6.759 -47.675 -6.587 124 HH21 ARG 18 HH21 ARG 18 -5.141 -45.431 -8.724 125 HH22 ARG 18 HH22 ARG 18 -6.162 -46.825 -8.629 126 H VAL 19 H VAL 19 -2.292 -43.985 -0.354 127 HA VAL 19 HA VAL 19 -0.508 -46.275 -0.555 128 HB VAL 19 HB VAL 19 0.732 -45.458 1.529 129 HG11 VAL 19 HG11 VAL 19 1.220 -43.997 -1.065 130 HG12 VAL 19 HG12 VAL 19 2.402 -44.303 0.209 131 HG13 VAL 19 HG13 VAL 19 1.733 -45.647 -0.716 132 HG21 VAL 19 HG21 VAL 19 0.435 -42.679 0.700 133 HG22 VAL 19 HG22 VAL 19 -1.044 -43.366 1.371 134 HG23 VAL 19 HG23 VAL 19 0.445 -43.384 2.316 135 H THR 20 H THR 20 -0.617 -47.687 1.274 136 HA THR 20 HA THR 20 -2.957 -47.210 3.003 137 HB THR 20 HB THR 20 -3.788 -48.923 1.719 138 HG1 THR 20 HG1 THR 20 -2.270 -50.572 3.446 139 HG21 THR 20 HG21 THR 20 -0.933 -49.604 1.303 140 HG22 THR 20 HG22 THR 20 -2.258 -49.516 0.142 141 HG23 THR 20 HG23 THR 20 -2.094 -50.926 1.188 142 H GLU 21 H GLU 21 -2.880 -48.110 5.113 143 HA GLU 21 HA GLU 21 -0.254 -48.062 6.269 144 HB2 GLU 21 HB2 GLU 21 -2.428 -47.178 7.308 145 HB3 GLU 21 HB3 GLU 21 -2.785 -48.855 7.696 146 HG2 GLU 21 HG2 GLU 21 -0.151 -48.350 8.563 147 HG3 GLU 21 HG3 GLU 21 -1.145 -46.996 9.096 148 H ASP 22 H ASP 22 -2.816 -50.516 5.992 149 HA ASP 22 HA ASP 22 -0.830 -52.574 6.679 150 HB2 ASP 22 HB2 ASP 22 -3.807 -52.416 6.978 151 HB3 ASP 22 HB3 ASP 22 -3.028 -53.992 6.864 152 H GLU 23 H GLU 23 -0.466 -54.312 5.343 153 HA GLU 23 HA GLU 23 -0.777 -53.931 2.580 154 HB2 GLU 23 HB2 GLU 23 0.162 -56.135 2.319 155 HB3 GLU 23 HB3 GLU 23 0.995 -55.318 3.634 156 HG2 GLU 23 HG2 GLU 23 -0.907 -56.580 5.033 157 HG3 GLU 23 HG3 GLU 23 -0.748 -57.694 3.676 158 H ASN 24 H ASN 24 -2.706 -55.670 4.933 159 HA ASN 24 HA ASN 24 -4.319 -57.061 3.041 160 HB2 ASN 24 HB2 ASN 24 -3.938 -57.467 5.619 161 HB3 ASN 24 HB3 ASN 24 -5.323 -56.392 5.778 162 HD21 ASN 24 HD21 ASN 24 -7.324 -57.131 5.323 163 HD22 ASN 24 HD22 ASN 24 -7.671 -58.754 4.841 164 H ASP 25 H ASP 25 -4.396 -53.891 4.454 165 HA ASP 25 HA ASP 25 -7.127 -53.354 3.697 166 HB2 ASP 25 HB2 ASP 25 -4.907 -51.679 4.852 167 HB3 ASP 25 HB3 ASP 25 -6.423 -50.957 4.319 168 H GLU 26 H GLU 26 -7.746 -51.680 2.189 169 HA GLU 26 HA GLU 26 -6.260 -51.871 -0.266 170 HB2 GLU 26 HB2 GLU 26 -8.939 -51.139 0.537 171 HB3 GLU 26 HB3 GLU 26 -8.284 -49.955 -0.586 172 HG2 GLU 26 HG2 GLU 26 -7.598 -52.376 -1.719 173 HG3 GLU 26 HG3 GLU 26 -9.209 -52.658 -1.063 174 HA PRO 27 HA PRO 27 -3.929 -48.157 -0.069 175 HB2 PRO 27 HB2 PRO 27 -3.901 -47.421 -2.682 176 HB3 PRO 27 HB3 PRO 27 -2.977 -48.794 -2.061 177 HG2 PRO 27 HG2 PRO 27 -5.614 -48.771 -3.479 178 HG3 PRO 27 HG3 PRO 27 -4.232 -49.860 -3.704 179 HD2 PRO 27 HD2 PRO 27 -6.419 -50.558 -2.268 180 HD3 PRO 27 HD3 PRO 27 -4.791 -51.150 -1.878 181 H ILE 28 H ILE 28 -4.907 -46.508 0.974 182 HA ILE 28 HA ILE 28 -7.268 -45.230 -0.100 183 HB ILE 28 HB ILE 28 -7.068 -45.534 2.317 184 HG12 ILE 28 HG12 ILE 28 -7.595 -43.208 3.001 185 HG13 ILE 28 HG13 ILE 28 -6.985 -42.635 1.453 186 HG21 ILE 28 HG21 ILE 28 -4.724 -45.408 2.669 187 HG22 ILE 28 HG22 ILE 28 -4.647 -43.773 2.016 188 HG23 ILE 28 HG23 ILE 28 -5.445 -44.068 3.561 189 HD11 ILE 28 HD11 ILE 28 -8.863 -43.187 0.377 190 HD12 ILE 28 HD12 ILE 28 -9.043 -44.705 1.256 191 HD13 ILE 28 HD13 ILE 28 -9.578 -43.192 1.989 192 H GLU 29 H GLU 29 -7.413 -43.209 -0.979 193 HA GLU 29 HA GLU 29 -4.867 -41.977 -1.769 194 HB2 GLU 29 HB2 GLU 29 -6.068 -40.948 -3.589 195 HB3 GLU 29 HB3 GLU 29 -6.428 -42.668 -3.571 196 HG2 GLU 29 HG2 GLU 29 -8.553 -42.181 -2.422 197 HG3 GLU 29 HG3 GLU 29 -8.197 -40.459 -2.548 198 H ILE 30 H ILE 30 -4.340 -39.941 -1.197 199 HA ILE 30 HA ILE 30 -6.352 -38.361 0.262 200 HB ILE 30 HB ILE 30 -3.827 -37.623 1.258 201 HG12 ILE 30 HG12 ILE 30 -4.222 -40.614 1.453 202 HG13 ILE 30 HG13 ILE 30 -3.068 -39.849 0.367 203 HG21 ILE 30 HG21 ILE 30 -4.900 -38.970 3.303 204 HG22 ILE 30 HG22 ILE 30 -5.482 -37.389 2.785 205 HG23 ILE 30 HG23 ILE 30 -6.320 -38.851 2.265 206 HD11 ILE 30 HD11 ILE 30 -3.045 -39.941 3.358 207 HD12 ILE 30 HD12 ILE 30 -1.811 -40.485 2.221 208 HD13 ILE 30 HD13 ILE 30 -2.094 -38.761 2.456 209 HA PRO 31 HA PRO 31 -5.319 -35.052 -2.443 210 HB2 PRO 31 HB2 PRO 31 -5.969 -32.940 -0.866 211 HB3 PRO 31 HB3 PRO 31 -7.179 -33.985 -1.620 212 HG2 PRO 31 HG2 PRO 31 -6.124 -34.023 1.181 213 HG3 PRO 31 HG3 PRO 31 -7.795 -34.196 0.613 214 HD2 PRO 31 HD2 PRO 31 -6.275 -36.317 1.337 215 HD3 PRO 31 HD3 PRO 31 -7.511 -36.418 0.067 216 H SER 32 H SER 32 -3.228 -34.693 -2.887 217 HA SER 32 HA SER 32 -1.407 -33.871 -0.756 218 HB2 SER 32 HB2 SER 32 0.304 -34.715 -2.021 219 HB3 SER 32 HB3 SER 32 -1.015 -35.657 -2.719 220 HG SER 32 HG SER 32 0.582 -33.857 -3.905 221 H GLU 33 H GLU 33 0.429 -32.341 -1.883 222 HA GLU 33 HA GLU 33 -1.016 -29.872 -2.419 223 HB2 GLU 33 HB2 GLU 33 1.483 -30.580 -1.169 224 HB3 GLU 33 HB3 GLU 33 1.755 -29.376 -2.420 225 HG2 GLU 33 HG2 GLU 33 -0.537 -28.662 -0.855 226 HG3 GLU 33 HG3 GLU 33 0.848 -28.962 0.192 227 H ASP 34 H ASP 34 0.108 -28.335 -4.016 228 HA ASP 34 HA ASP 34 0.016 -29.553 -6.589 229 HB2 ASP 34 HB2 ASP 34 0.435 -26.795 -5.540 230 HB3 ASP 34 HB3 ASP 34 0.946 -27.132 -7.192 231 H ASP 35 H ASP 35 2.594 -28.447 -4.474 232 HA ASP 35 HA ASP 35 4.706 -28.573 -6.334 233 HB2 ASP 35 HB2 ASP 35 4.402 -28.180 -3.487 234 HB3 ASP 35 HB3 ASP 35 5.774 -29.234 -3.822 235 H GLY 36 H GLY 36 2.920 -31.026 -4.728 236 HA2 GLY 36 HA2 GLY 36 3.130 -33.261 -5.749 237 HA3 GLY 36 HA3 GLY 36 4.871 -33.033 -5.677 238 H THR 37 H THR 37 4.732 -31.814 -3.000 239 HA THR 37 HA THR 37 4.986 -34.207 -1.479 240 HB THR 37 HB THR 37 5.510 -32.794 0.403 241 HG1 THR 37 HG1 THR 37 3.928 -31.198 0.198 242 HG21 THR 37 HG21 THR 37 6.730 -31.124 -1.699 243 HG22 THR 37 HG22 THR 37 6.958 -32.863 -1.878 244 HG23 THR 37 HG23 THR 37 7.487 -32.051 -0.405 245 H VAL 38 H VAL 38 3.932 -33.765 0.961 246 HA VAL 38 HA VAL 38 1.048 -33.372 0.582 247 HB VAL 38 HB VAL 38 2.330 -35.792 1.848 248 HG11 VAL 38 HG11 VAL 38 0.560 -35.142 3.307 249 HG12 VAL 38 HG12 VAL 38 -0.527 -34.844 1.949 250 HG13 VAL 38 HG13 VAL 38 -0.025 -36.491 2.334 251 HG21 VAL 38 HG21 VAL 38 1.923 -35.613 -0.685 252 HG22 VAL 38 HG22 VAL 38 1.340 -37.052 0.153 253 HG23 VAL 38 HG23 VAL 38 0.214 -35.764 -0.276 254 H LEU 39 H LEU 39 0.085 -32.294 2.201 255 HA LEU 39 HA LEU 39 1.658 -31.112 4.246 256 HB2 LEU 39 HB2 LEU 39 -0.821 -30.644 3.079 257 HB3 LEU 39 HB3 LEU 39 -1.192 -31.037 4.756 258 HG LEU 39 HG LEU 39 -1.003 -28.637 4.455 259 HD11 LEU 39 HD11 LEU 39 1.506 -29.267 5.902 260 HD12 LEU 39 HD12 LEU 39 0.016 -30.013 6.479 261 HD13 LEU 39 HD13 LEU 39 0.142 -28.256 6.380 262 HD21 LEU 39 HD21 LEU 39 1.727 -28.195 4.087 263 HD22 LEU 39 HD22 LEU 39 0.425 -27.846 2.948 264 HD23 LEU 39 HD23 LEU 39 1.280 -29.387 2.865 265 H LEU 40 H LEU 40 1.922 -31.628 6.349 266 HA LEU 40 HA LEU 40 1.670 -34.204 7.274 267 HB2 LEU 40 HB2 LEU 40 2.993 -32.304 8.277 268 HB3 LEU 40 HB3 LEU 40 1.496 -31.775 9.043 269 HG LEU 40 HG LEU 40 3.085 -33.093 10.492 270 HD11 LEU 40 HD11 LEU 40 1.356 -33.912 11.734 271 HD12 LEU 40 HD12 LEU 40 0.525 -34.593 10.336 272 HD13 LEU 40 HD13 LEU 40 0.462 -32.857 10.639 273 HD21 LEU 40 HD21 LEU 40 3.739 -34.731 8.771 274 HD22 LEU 40 HD22 LEU 40 2.105 -35.396 8.808 275 HD23 LEU 40 HD23 LEU 40 3.132 -35.498 10.239 276 H SER 41 H SER 41 -0.618 -31.530 7.632 277 HA SER 41 HA SER 41 -2.434 -32.690 9.373 278 HB2 SER 41 HB2 SER 41 -2.325 -30.350 7.911 279 HB3 SER 41 HB3 SER 41 -3.724 -31.175 7.225 280 HG SER 41 HG SER 41 -3.345 -30.119 9.758 281 H THR 42 H THR 42 -2.042 -33.145 5.911 282 HA THR 42 HA THR 42 -4.440 -34.627 5.521 283 HB THR 42 HB THR 42 -1.933 -34.689 3.831 284 HG1 THR 42 HG1 THR 42 -2.520 -32.613 3.705 285 HG21 THR 42 HG21 THR 42 -4.744 -35.634 3.444 286 HG22 THR 42 HG22 THR 42 -3.227 -36.432 3.032 287 HG23 THR 42 HG23 THR 42 -3.808 -35.085 2.054 288 H VAL 43 H VAL 43 -1.128 -35.478 6.337 289 HA VAL 43 HA VAL 43 -1.369 -38.270 5.945 290 HB VAL 43 HB VAL 43 0.538 -36.553 7.494 291 HG11 VAL 43 HG11 VAL 43 0.116 -39.481 7.763 292 HG12 VAL 43 HG12 VAL 43 1.774 -38.880 7.735 293 HG13 VAL 43 HG13 VAL 43 0.645 -38.299 8.960 294 HG21 VAL 43 HG21 VAL 43 1.170 -36.548 5.286 295 HG22 VAL 43 HG22 VAL 43 2.087 -37.930 5.884 296 HG23 VAL 43 HG23 VAL 43 0.583 -38.186 5.000 297 H THR 44 H THR 44 -1.894 -36.176 8.740 298 HA THR 44 HA THR 44 -2.361 -38.301 10.582 299 HB THR 44 HB THR 44 -3.262 -36.548 12.074 300 HG1 THR 44 HG1 THR 44 -2.650 -34.665 10.046 301 HG21 THR 44 HG21 THR 44 -1.057 -34.972 11.520 302 HG22 THR 44 HG22 THR 44 -0.622 -36.546 10.852 303 HG23 THR 44 HG23 THR 44 -1.080 -36.404 12.549 304 H ALA 45 H ALA 45 -4.331 -36.563 8.309 305 HA ALA 45 HA ALA 45 -6.878 -36.863 9.289 306 HB1 ALA 45 HB1 ALA 45 -6.150 -37.339 6.407 307 HB2 ALA 45 HB2 ALA 45 -7.667 -36.712 7.052 308 HB3 ALA 45 HB3 ALA 45 -6.199 -35.740 7.149 309 H GLN 46 H GLN 46 -5.010 -39.253 7.432 310 HA GLN 46 HA GLN 46 -7.014 -41.283 8.138 311 HB2 GLN 46 HB2 GLN 46 -4.827 -41.813 6.175 312 HB3 GLN 46 HB3 GLN 46 -6.465 -42.451 6.223 313 HG2 GLN 46 HG2 GLN 46 -7.333 -40.292 5.490 314 HG3 GLN 46 HG3 GLN 46 -5.694 -39.646 5.450 315 HE21 GLN 46 HE21 GLN 46 -4.316 -41.719 4.320 316 HE22 GLN 46 HE22 GLN 46 -4.856 -41.964 2.697 317 H PHE 47 H PHE 47 -3.618 -40.459 8.358 318 HA PHE 47 HA PHE 47 -3.201 -42.826 10.063 319 HB2 PHE 47 HB2 PHE 47 -0.924 -41.365 8.777 320 HB3 PHE 47 HB3 PHE 47 -1.020 -43.046 9.290 321 HD1 PHE 47 HD1 PHE 47 -3.354 -44.080 7.993 322 HD2 PHE 47 HD2 PHE 47 -0.481 -41.304 6.525 323 HE1 PHE 47 HE1 PHE 47 -3.885 -44.754 5.687 324 HE2 PHE 47 HE2 PHE 47 -1.008 -41.973 4.217 325 HZ PHE 47 HZ PHE 47 -2.713 -43.699 3.795 326 HA PRO 48 HA PRO 48 -2.854 -39.082 12.763 327 HB2 PRO 48 HB2 PRO 48 -4.188 -40.190 14.852 328 HB3 PRO 48 HB3 PRO 48 -5.005 -39.366 13.519 329 HG2 PRO 48 HG2 PRO 48 -4.600 -42.297 13.969 330 HG3 PRO 48 HG3 PRO 48 -6.050 -41.441 13.413 331 HD2 PRO 48 HD2 PRO 48 -4.384 -42.738 11.718 332 HD3 PRO 48 HD3 PRO 48 -5.276 -41.276 11.249 333 H GLY 49 H GLY 49 -1.067 -38.816 13.945 334 HA2 GLY 49 HA2 GLY 49 0.424 -39.306 15.702 335 HA3 GLY 49 HA3 GLY 49 -0.145 -40.969 15.691 336 H ALA 50 H ALA 50 0.171 -41.121 12.738 337 HA ALA 50 HA ALA 50 2.648 -42.334 12.589 338 HB1 ALA 50 HB1 ALA 50 2.404 -42.246 10.167 339 HB2 ALA 50 HB2 ALA 50 0.872 -42.662 10.937 340 HB3 ALA 50 HB3 ALA 50 1.138 -41.029 10.328 341 H CYS 51 H CYS 51 4.503 -41.361 13.134 342 HA CYS 51 HA CYS 51 5.008 -38.588 12.591 343 HB2 CYS 51 HB2 CYS 51 6.233 -40.713 14.146 344 HB3 CYS 51 HB3 CYS 51 7.439 -39.779 13.270 345 HG CYS 51 HG CYS 51 5.682 -38.964 15.966 346 H GLY 52 H GLY 52 5.908 -41.664 11.157 347 HA2 GLY 52 HA2 GLY 52 6.880 -40.227 8.805 348 HA3 GLY 52 HA3 GLY 52 8.010 -41.315 9.597 349 H LEU 53 H LEU 53 6.835 -41.407 6.893 350 HA LEU 53 HA LEU 53 5.450 -44.001 7.084 351 HB2 LEU 53 HB2 LEU 53 5.368 -42.156 4.715 352 HB3 LEU 53 HB3 LEU 53 4.318 -43.527 5.067 353 HG LEU 53 HG LEU 53 2.940 -41.731 5.503 354 HD11 LEU 53 HD11 LEU 53 3.673 -43.274 7.607 355 HD12 LEU 53 HD12 LEU 53 2.366 -42.091 7.641 356 HD13 LEU 53 HD13 LEU 53 3.962 -41.658 8.252 357 HD21 LEU 53 HD21 LEU 53 3.563 -39.626 6.244 358 HD22 LEU 53 HD22 LEU 53 4.963 -40.129 5.296 359 HD23 LEU 53 HD23 LEU 53 5.008 -40.227 7.058 360 H ARG 54 H ARG 54 6.162 -45.708 5.857 361 HA ARG 54 HA ARG 54 8.791 -45.343 4.592 362 HB2 ARG 54 HB2 ARG 54 8.056 -47.107 6.545 363 HB3 ARG 54 HB3 ARG 54 7.860 -48.087 5.099 364 HG2 ARG 54 HG2 ARG 54 10.030 -48.534 5.332 365 HG3 ARG 54 HG3 ARG 54 10.292 -46.919 4.671 366 HD2 ARG 54 HD2 ARG 54 9.813 -47.186 7.594 367 HD3 ARG 54 HD3 ARG 54 11.380 -47.687 6.958 368 HE ARG 54 HE ARG 54 10.609 -45.098 6.030 369 HH11 ARG 54 HH11 ARG 54 11.996 -46.829 8.714 370 HH12 ARG 54 HH12 ARG 54 12.876 -45.460 9.310 371 HH21 ARG 54 HH21 ARG 54 11.763 -43.290 6.805 372 HH22 ARG 54 HH22 ARG 54 12.742 -43.448 8.223 373 H TYR 55 H TYR 55 9.246 -46.840 2.741 374 HA TYR 55 HA TYR 55 6.919 -46.873 0.949 375 HB2 TYR 55 HB2 TYR 55 9.650 -46.075 0.616 376 HB3 TYR 55 HB3 TYR 55 9.307 -47.402 -0.489 377 HD1 TYR 55 HD1 TYR 55 6.872 -47.113 -1.668 378 HD2 TYR 55 HD2 TYR 55 9.344 -43.961 -0.234 379 HE1 TYR 55 HE1 TYR 55 5.760 -45.549 -3.207 380 HE2 TYR 55 HE2 TYR 55 8.239 -42.388 -1.768 381 HH TYR 55 HH TYR 55 6.463 -42.096 -3.141 382 H ARG 56 H ARG 56 6.077 -48.735 0.279 383 HA ARG 56 HA ARG 56 7.690 -51.184 0.533 384 HB2 ARG 56 HB2 ARG 56 6.222 -51.408 2.334 385 HB3 ARG 56 HB3 ARG 56 4.891 -50.651 1.469 386 HG2 ARG 56 HG2 ARG 56 4.605 -53.083 1.816 387 HG3 ARG 56 HG3 ARG 56 4.577 -52.603 0.118 388 HD2 ARG 56 HD2 ARG 56 6.991 -53.228 -0.016 389 HD3 ARG 56 HD3 ARG 56 6.864 -53.864 1.623 390 HE ARG 56 HE ARG 56 4.946 -54.943 -0.245 391 HH11 ARG 56 HH11 ARG 56 8.103 -55.273 1.184 392 HH12 ARG 56 HH12 ARG 56 8.222 -56.968 0.847 393 HH21 ARG 56 HH21 ARG 56 5.091 -57.174 -0.695 394 HH22 ARG 56 HH22 ARG 56 6.508 -58.048 -0.223 395 H ASN 57 H ASN 57 8.150 -51.515 -1.584 396 HA ASN 57 HA ASN 57 5.873 -51.655 -3.450 397 HB2 ASN 57 HB2 ASN 57 8.715 -50.786 -3.814 398 HB3 ASN 57 HB3 ASN 57 7.853 -51.488 -5.180 399 HD21 ASN 57 HD21 ASN 57 6.336 -50.311 -6.224 400 HD22 ASN 57 HD22 ASN 57 5.949 -48.672 -5.837 401 HA PRO 58 HA PRO 58 6.618 -56.001 -3.685 402 HB2 PRO 58 HB2 PRO 58 5.201 -56.499 -5.947 403 HB3 PRO 58 HB3 PRO 58 4.437 -56.173 -4.387 404 HG2 PRO 58 HG2 PRO 58 4.896 -54.322 -6.694 405 HG3 PRO 58 HG3 PRO 58 3.456 -54.504 -5.675 406 HD2 PRO 58 HD2 PRO 58 5.247 -52.503 -5.323 407 HD3 PRO 58 HD3 PRO 58 4.343 -53.224 -3.975 408 H VAL 59 H VAL 59 6.890 -54.149 -6.720 409 HA VAL 59 HA VAL 59 8.728 -56.045 -7.867 410 HB VAL 59 HB VAL 59 8.907 -54.433 -9.728 411 HG11 VAL 59 HG11 VAL 59 6.791 -54.850 -10.606 412 HG12 VAL 59 HG12 VAL 59 6.983 -56.114 -9.389 413 HG13 VAL 59 HG13 VAL 59 6.002 -54.691 -9.037 414 HG21 VAL 59 HG21 VAL 59 6.915 -52.591 -9.299 415 HG22 VAL 59 HG22 VAL 59 7.730 -52.657 -7.736 416 HG23 VAL 59 HG23 VAL 59 8.647 -52.276 -9.194 417 H SER 60 H SER 60 8.934 -53.051 -6.101 418 HA SER 60 HA SER 60 11.717 -52.614 -6.737 419 HB2 SER 60 HB2 SER 60 9.714 -50.947 -5.930 420 HB3 SER 60 HB3 SER 60 10.578 -51.197 -4.414 421 HG SER 60 HG SER 60 11.909 -50.508 -6.811 422 H GLN 61 H GLN 61 9.852 -54.136 -4.225 423 HA GLN 61 HA GLN 61 10.440 -55.429 -2.448 424 HB2 GLN 61 HB2 GLN 61 13.260 -55.387 -3.511 425 HB3 GLN 61 HB3 GLN 61 12.504 -56.616 -2.505 426 HG2 GLN 61 HG2 GLN 61 10.922 -56.462 -4.798 427 HG3 GLN 61 HG3 GLN 61 12.589 -56.387 -5.367 428 HE21 GLN 61 HE21 GLN 61 13.915 -57.966 -3.640 429 HE22 GLN 61 HE22 GLN 61 13.336 -59.591 -3.731 430 H CYS 62 H CYS 62 10.501 -52.577 -2.217 431 HA CYS 62 HA CYS 62 11.041 -50.994 -0.676 432 HB2 CYS 62 HB2 CYS 62 10.948 -53.214 0.781 433 HB3 CYS 62 HB3 CYS 62 12.674 -52.904 0.931 434 HG CYS 62 HG CYS 62 10.077 -51.257 2.288 435 H MET 63 H MET 63 12.720 -49.553 -0.168 436 HA MET 63 HA MET 63 15.453 -50.074 -0.378 437 HB2 MET 63 HB2 MET 63 14.179 -49.968 -2.907 438 HB3 MET 63 HB3 MET 63 15.114 -48.488 -2.740 439 HG2 MET 63 HG2 MET 63 16.560 -50.879 -1.909 440 HG3 MET 63 HG3 MET 63 16.071 -50.896 -3.601 441 HE1 MET 63 HE1 MET 63 19.561 -50.548 -2.815 442 HE2 MET 63 HE2 MET 63 18.417 -51.282 -3.939 443 HE3 MET 63 HE3 MET 63 19.461 -49.966 -4.477 444 H ARG 64 H ARG 64 12.956 -47.670 -1.128 445 HA ARG 64 HA ARG 64 14.567 -45.670 0.319 446 HB2 ARG 64 HB2 ARG 64 13.169 -43.997 -1.026 447 HB3 ARG 64 HB3 ARG 64 14.423 -44.879 -1.886 448 HG2 ARG 64 HG2 ARG 64 12.951 -45.964 -3.194 449 HG3 ARG 64 HG3 ARG 64 11.763 -46.132 -1.899 450 HD2 ARG 64 HD2 ARG 64 10.614 -44.400 -2.680 451 HD3 ARG 64 HD3 ARG 64 12.041 -43.369 -2.572 452 HE ARG 64 HE ARG 64 12.313 -43.577 -4.833 453 HH11 ARG 64 HH11 ARG 64 10.157 -46.072 -3.716 454 HH12 ARG 64 HH12 ARG 64 9.746 -46.612 -5.310 455 HH21 ARG 64 HH21 ARG 64 11.780 -44.279 -6.937 456 HH22 ARG 64 HH22 ARG 64 10.670 -45.592 -7.141 457 H GLY 65 H GLY 65 12.856 -43.737 0.879 458 HA2 GLY 65 HA2 GLY 65 10.392 -44.839 1.971 459 HA3 GLY 65 HA3 GLY 65 11.574 -44.288 3.149 460 H VAL 66 H VAL 66 8.827 -43.330 2.384 461 HA VAL 66 HA VAL 66 8.825 -40.938 1.019 462 HB VAL 66 HB VAL 66 7.241 -41.621 3.500 463 HG11 VAL 66 HG11 VAL 66 5.667 -39.914 2.759 464 HG12 VAL 66 HG12 VAL 66 7.258 -39.212 3.055 465 HG13 VAL 66 HG13 VAL 66 6.721 -39.515 1.403 466 HG21 VAL 66 HG21 VAL 66 5.536 -41.824 1.395 467 HG22 VAL 66 HG22 VAL 66 7.042 -42.393 0.674 468 HG23 VAL 66 HG23 VAL 66 6.401 -43.182 2.115 469 H ARG 67 H ARG 67 10.139 -39.258 1.263 470 HA ARG 67 HA ARG 67 11.567 -38.697 3.646 471 HB2 ARG 67 HB2 ARG 67 12.493 -38.058 1.513 472 HB3 ARG 67 HB3 ARG 67 11.098 -37.047 1.160 473 HG2 ARG 67 HG2 ARG 67 12.928 -35.644 1.790 474 HG3 ARG 67 HG3 ARG 67 11.721 -35.605 3.077 475 HD2 ARG 67 HD2 ARG 67 13.292 -37.672 3.879 476 HD3 ARG 67 HD3 ARG 67 14.474 -36.627 3.092 477 HE ARG 67 HE ARG 67 12.755 -35.230 4.917 478 HH11 ARG 67 HH11 ARG 67 15.660 -37.126 4.617 479 HH12 ARG 67 HH12 ARG 67 16.384 -36.481 6.053 480 HH21 ARG 67 HH21 ARG 67 13.698 -34.374 6.809 481 HH22 ARG 67 HH22 ARG 67 15.267 -34.917 7.299 482 H LEU 68 H LEU 68 11.251 -37.176 5.222 483 HA LEU 68 HA LEU 68 8.731 -35.658 5.125 484 HB2 LEU 68 HB2 LEU 68 8.395 -37.512 6.610 485 HB3 LEU 68 HB3 LEU 68 9.908 -37.173 7.447 486 HG LEU 68 HG LEU 68 7.656 -36.533 8.557 487 HD11 LEU 68 HD11 LEU 68 8.960 -35.390 9.946 488 HD12 LEU 68 HD12 LEU 68 9.273 -34.144 8.738 489 HD13 LEU 68 HD13 LEU 68 10.261 -35.604 8.775 490 HD21 LEU 68 HD21 LEU 68 7.957 -33.920 7.207 491 HD22 LEU 68 HD22 LEU 68 6.515 -34.713 7.841 492 HD23 LEU 68 HD23 LEU 68 7.181 -35.205 6.283 493 H VAL 69 H VAL 69 9.065 -33.548 5.252 494 HA VAL 69 HA VAL 69 11.242 -32.540 6.942 495 HB VAL 69 HB VAL 69 12.215 -32.462 4.764 496 HG11 VAL 69 HG11 VAL 69 10.622 -30.758 3.233 497 HG12 VAL 69 HG12 VAL 69 10.886 -32.484 2.981 498 HG13 VAL 69 HG13 VAL 69 9.508 -31.932 3.932 499 HG21 VAL 69 HG21 VAL 69 12.189 -30.371 6.326 500 HG22 VAL 69 HG22 VAL 69 12.848 -30.245 4.695 501 HG23 VAL 69 HG23 VAL 69 11.219 -29.660 5.035 502 H GLU 70 H GLU 70 10.444 -31.142 8.354 503 HA GLU 70 HA GLU 70 9.146 -29.555 9.340 504 HB2 GLU 70 HB2 GLU 70 8.394 -28.689 6.548 505 HB3 GLU 70 HB3 GLU 70 8.376 -27.716 8.013 506 HG2 GLU 70 HG2 GLU 70 10.998 -28.698 7.719 507 HG3 GLU 70 HG3 GLU 70 10.486 -28.112 6.138 508 H GLY 71 H GLY 71 8.027 -32.182 8.554 509 HA2 GLY 71 HA2 GLY 71 5.956 -33.100 9.162 510 HA3 GLY 71 HA3 GLY 71 5.235 -31.502 9.036 511 H ILE 72 H ILE 72 6.490 -31.127 6.348 512 HA ILE 72 HA ILE 72 4.328 -32.262 4.829 513 HB ILE 72 HB ILE 72 6.710 -30.647 3.911 514 HG12 ILE 72 HG12 ILE 72 4.214 -29.275 3.701 515 HG13 ILE 72 HG13 ILE 72 4.355 -29.914 5.335 516 HG21 ILE 72 HG21 ILE 72 4.528 -31.969 2.471 517 HG22 ILE 72 HG22 ILE 72 4.754 -30.270 2.055 518 HG23 ILE 72 HG23 ILE 72 6.095 -31.404 1.891 519 HD11 ILE 72 HD11 ILE 72 6.844 -28.765 4.650 520 HD12 ILE 72 HD12 ILE 72 5.577 -27.619 4.213 521 HD13 ILE 72 HD13 ILE 72 5.680 -28.233 5.863 522 H LEU 73 H LEU 73 4.367 -34.290 4.133 523 HA LEU 73 HA LEU 73 6.770 -35.812 3.909 524 HB2 LEU 73 HB2 LEU 73 3.903 -36.334 3.184 525 HB3 LEU 73 HB3 LEU 73 5.180 -37.495 2.825 526 HG LEU 73 HG LEU 73 4.053 -38.158 4.839 527 HD11 LEU 73 HD11 LEU 73 6.476 -38.506 4.730 528 HD12 LEU 73 HD12 LEU 73 5.922 -38.246 6.384 529 HD13 LEU 73 HD13 LEU 73 6.730 -36.945 5.511 530 HD21 LEU 73 HD21 LEU 73 3.665 -36.803 6.687 531 HD22 LEU 73 HD22 LEU 73 3.333 -35.730 5.327 532 HD23 LEU 73 HD23 LEU 73 4.867 -35.611 6.190 533 H HIS 74 H HIS 74 8.181 -35.554 2.316 534 HA HIS 74 HA HIS 74 7.365 -34.504 -0.255 535 HB2 HIS 74 HB2 HIS 74 9.701 -34.374 1.243 536 HB3 HIS 74 HB3 HIS 74 10.117 -35.448 -0.089 537 HD1 HIS 74 HD1 HIS 74 9.031 -34.285 -2.511 538 HD2 HIS 74 HD2 HIS 74 10.368 -31.854 0.582 539 HE1 HIS 74 HE1 HIS 74 9.511 -32.054 -3.569 540 H ALA 75 H ALA 75 7.597 -35.555 -2.243 541 HA ALA 75 HA ALA 75 7.421 -38.471 -2.064 542 HB1 ALA 75 HB1 ALA 75 6.780 -38.029 -4.603 543 HB2 ALA 75 HB2 ALA 75 5.611 -37.852 -3.294 544 HB3 ALA 75 HB3 ALA 75 6.410 -36.429 -3.961 545 HA PRO 76 HA PRO 76 11.311 -39.252 -3.940 546 HB2 PRO 76 HB2 PRO 76 10.757 -41.417 -5.481 547 HB3 PRO 76 HB3 PRO 76 10.846 -41.491 -3.717 548 HG2 PRO 76 HG2 PRO 76 8.438 -41.301 -5.486 549 HG3 PRO 76 HG3 PRO 76 8.694 -42.308 -4.049 550 HD2 PRO 76 HD2 PRO 76 7.281 -40.000 -3.977 551 HD3 PRO 76 HD3 PRO 76 8.241 -40.575 -2.599 552 H ASP 77 H ASP 77 12.174 -40.013 -6.273 553 HA ASP 77 HA ASP 77 11.514 -37.833 -8.030 554 HB2 ASP 77 HB2 ASP 77 13.617 -39.904 -7.868 555 HB3 ASP 77 HB3 ASP 77 13.213 -39.358 -9.493 556 H ALA 78 H ALA 78 10.079 -40.733 -7.497 557 HA ALA 78 HA ALA 78 9.285 -41.080 -10.311 558 HB1 ALA 78 HB1 ALA 78 8.317 -43.292 -9.105 559 HB2 ALA 78 HB2 ALA 78 9.922 -43.186 -9.831 560 HB3 ALA 78 HB3 ALA 78 9.724 -42.963 -8.093 561 H GLY 79 H GLY 79 8.157 -40.356 -7.107 562 HA2 GLY 79 HA2 GLY 79 6.107 -38.992 -7.023 563 HA3 GLY 79 HA3 GLY 79 5.416 -40.112 -8.188 564 H TRP 80 H TRP 80 3.817 -39.842 -6.217 565 HA TRP 80 HA TRP 80 4.361 -41.341 -3.872 566 HB2 TRP 80 HB2 TRP 80 1.784 -40.393 -5.126 567 HB3 TRP 80 HB3 TRP 80 1.841 -41.255 -3.591 568 HD1 TRP 80 HD1 TRP 80 1.665 -37.866 -4.823 569 HE1 TRP 80 HE1 TRP 80 2.487 -36.167 -3.073 570 HE3 TRP 80 HE3 TRP 80 4.044 -41.075 -1.631 571 HZ2 TRP 80 HZ2 TRP 80 3.950 -36.185 -0.659 572 HZ3 TRP 80 HZ3 TRP 80 5.130 -40.153 0.375 573 HH2 TRP 80 HH2 TRP 80 5.083 -37.758 0.849 574 H GLY 81 H GLY 81 2.211 -42.079 -6.630 575 HA2 GLY 81 HA2 GLY 81 1.951 -44.123 -7.721 576 HA3 GLY 81 HA3 GLY 81 3.037 -44.858 -6.551 577 H ASN 82 H ASN 82 1.408 -46.602 -6.653 578 HA ASN 82 HA ASN 82 -0.767 -46.069 -4.742 579 HB2 ASN 82 HB2 ASN 82 -1.072 -48.158 -6.870 580 HB3 ASN 82 HB3 ASN 82 -2.316 -47.284 -5.981 581 HD21 ASN 82 HD21 ASN 82 -2.481 -44.949 -6.444 582 HD22 ASN 82 HD22 ASN 82 -2.219 -44.425 -8.070 583 H LEU 83 H LEU 83 1.890 -47.043 -4.208 584 HA LEU 83 HA LEU 83 1.583 -49.892 -3.713 585 HB2 LEU 83 HB2 LEU 83 3.899 -49.594 -2.695 586 HB3 LEU 83 HB3 LEU 83 3.734 -49.360 -4.434 587 HG LEU 83 HG LEU 83 5.209 -47.732 -3.081 588 HD11 LEU 83 HD11 LEU 83 3.484 -45.979 -4.572 589 HD12 LEU 83 HD12 LEU 83 3.719 -47.501 -5.431 590 HD13 LEU 83 HD13 LEU 83 5.114 -46.538 -4.947 591 HD21 LEU 83 HD21 LEU 83 2.516 -46.490 -2.546 592 HD22 LEU 83 HD22 LEU 83 4.097 -45.870 -2.070 593 HD23 LEU 83 HD23 LEU 83 3.470 -47.346 -1.335 594 H VAL 84 H VAL 84 2.735 -50.424 -1.399 595 HA VAL 84 HA VAL 84 0.881 -49.285 0.549 596 HB VAL 84 HB VAL 84 2.789 -51.553 1.064 597 HG11 VAL 84 HG11 VAL 84 0.523 -50.304 2.445 598 HG12 VAL 84 HG12 VAL 84 0.487 -52.068 2.415 599 HG13 VAL 84 HG13 VAL 84 1.881 -51.224 3.092 600 HG21 VAL 84 HG21 VAL 84 0.472 -52.828 0.550 601 HG22 VAL 84 HG22 VAL 84 0.367 -51.511 -0.618 602 HG23 VAL 84 HG23 VAL 84 1.751 -52.604 -0.645 603 H TYR 85 H TYR 85 1.656 -48.763 2.722 604 HA TYR 85 HA TYR 85 4.460 -47.891 2.809 605 HB2 TYR 85 HB2 TYR 85 3.977 -45.709 3.189 606 HB3 TYR 85 HB3 TYR 85 2.481 -46.101 2.348 607 HD1 TYR 85 HD1 TYR 85 4.002 -45.652 5.690 608 HD2 TYR 85 HD2 TYR 85 0.392 -46.032 3.470 609 HE1 TYR 85 HE1 TYR 85 2.717 -44.970 7.673 610 HE2 TYR 85 HE2 TYR 85 -0.903 -45.350 5.447 611 HH TYR 85 HH TYR 85 0.710 -44.522 8.503 612 H VAL 86 H VAL 86 5.401 -47.842 4.856 613 HA VAL 86 HA VAL 86 3.879 -49.277 6.926 614 HB VAL 86 HB VAL 86 6.864 -49.088 6.508 615 HG11 VAL 86 HG11 VAL 86 5.225 -50.041 8.788 616 HG12 VAL 86 HG12 VAL 86 6.643 -50.994 8.345 617 HG13 VAL 86 HG13 VAL 86 6.821 -49.292 8.774 618 HG21 VAL 86 HG21 VAL 86 6.386 -50.723 5.038 619 HG22 VAL 86 HG22 VAL 86 6.233 -51.726 6.481 620 HG23 VAL 86 HG23 VAL 86 4.795 -51.027 5.737 621 H VAL 87 H VAL 87 3.401 -48.272 8.767 622 HA VAL 87 HA VAL 87 4.003 -45.537 9.171 623 HB VAL 87 HB VAL 87 3.055 -47.420 11.323 624 HG11 VAL 87 HG11 VAL 87 3.487 -45.295 12.221 625 HG12 VAL 87 HG12 VAL 87 2.811 -44.469 10.816 626 HG13 VAL 87 HG13 VAL 87 1.747 -45.320 11.937 627 HG21 VAL 87 HG21 VAL 87 1.328 -47.938 10.005 628 HG22 VAL 87 HG22 VAL 87 0.795 -46.273 10.234 629 HG23 VAL 87 HG23 VAL 87 1.757 -46.705 8.820 630 H ASN 88 H ASN 88 5.268 -44.545 10.783 631 HA ASN 88 HA ASN 88 7.165 -46.201 12.251 632 HB2 ASN 88 HB2 ASN 88 8.128 -45.560 9.960 633 HB3 ASN 88 HB3 ASN 88 8.192 -43.913 10.580 634 HD21 ASN 88 HD21 ASN 88 10.294 -43.557 10.846 635 HD22 ASN 88 HD22 ASN 88 11.357 -44.531 11.798 636 H TYR 89 H TYR 89 7.507 -45.428 14.236 637 HA TYR 89 HA TYR 89 6.760 -42.628 14.775 638 HB2 TYR 89 HB2 TYR 89 6.578 -44.928 16.727 639 HB3 TYR 89 HB3 TYR 89 5.974 -43.290 16.952 640 HD1 TYR 89 HD1 TYR 89 3.882 -42.596 15.995 641 HD2 TYR 89 HD2 TYR 89 5.422 -46.484 15.213 642 HE1 TYR 89 HE1 TYR 89 1.700 -43.270 15.083 643 HE2 TYR 89 HE2 TYR 89 3.245 -47.169 14.298 644 HH TYR 89 HH TYR 89 0.443 -45.031 14.426 645 HA PRO 90 HA PRO 90 11.259 -43.294 15.835 646 HB2 PRO 90 HB2 PRO 90 12.159 -41.117 14.486 647 HB3 PRO 90 HB3 PRO 90 11.962 -42.702 13.729 648 HG2 PRO 90 HG2 PRO 90 10.144 -40.325 13.648 649 HG3 PRO 90 HG3 PRO 90 10.619 -41.416 12.333 650 HD2 PRO 90 HD2 PRO 90 8.243 -41.626 13.615 651 HD3 PRO 90 HD3 PRO 90 9.103 -43.035 12.961 652 H LYS 91 H LYS 91 9.580 -40.162 15.504 653 HA LYS 91 HA LYS 91 10.868 -39.245 17.971 654 HB2 LYS 91 HB2 LYS 91 10.269 -37.976 15.544 655 HB3 LYS 91 HB3 LYS 91 9.141 -37.296 16.709 656 HG2 LYS 91 HG2 LYS 91 11.053 -36.764 18.186 657 HG3 LYS 91 HG3 LYS 91 12.144 -37.345 16.926 658 HD2 LYS 91 HD2 LYS 91 11.081 -35.657 15.386 659 HD3 LYS 91 HD3 LYS 91 10.266 -34.992 16.804 660 HE2 LYS 91 HE2 LYS 91 12.420 -34.548 17.850 661 HE3 LYS 91 HE3 LYS 91 13.253 -35.258 16.467 662 HZ1 LYS 91 HZ1 LYS 91 11.470 -32.893 16.285 663 HZ2 LYS 91 HZ2 LYS 91 12.471 -33.513 15.071 664 HZ3 LYS 91 HZ3 LYS 91 13.152 -32.795 16.442 665 H ASP 92 H ASP 92 9.261 -37.584 19.152 666 HA ASP 92 HA ASP 92 6.817 -39.128 19.722 667 HB2 ASP 92 HB2 ASP 92 8.606 -38.931 21.537 668 HB3 ASP 92 HB3 ASP 92 8.164 -37.230 21.639 669 H ASN 93 H ASN 93 4.982 -37.824 20.563 670 HA ASN 93 HA ASN 93 4.689 -35.419 18.933 671 HB2 ASN 93 HB2 ASN 93 3.006 -37.490 19.235 672 HB3 ASN 93 HB3 ASN 93 2.410 -36.457 20.531 673 HD21 ASN 93 HD21 ASN 93 0.610 -35.567 19.807 674 HD22 ASN 93 HD22 ASN 93 0.423 -34.756 18.293 675 H LYS 94 H LYS 94 4.021 -33.432 19.760 676 HA LYS 94 HA LYS 94 3.853 -33.118 22.655 677 HB2 LYS 94 HB2 LYS 94 6.217 -32.533 21.206 678 HB3 LYS 94 HB3 LYS 94 5.489 -30.992 21.642 679 HG2 LYS 94 HG2 LYS 94 5.335 -31.895 24.005 680 HG3 LYS 94 HG3 LYS 94 6.389 -33.203 23.462 681 HD2 LYS 94 HD2 LYS 94 7.168 -30.365 22.946 682 HD3 LYS 94 HD3 LYS 94 7.410 -31.058 24.552 683 HE2 LYS 94 HE2 LYS 94 9.127 -32.329 23.869 684 HE3 LYS 94 HE3 LYS 94 8.321 -32.776 22.366 685 HZ1 LYS 94 HZ1 LYS 94 9.562 -31.322 21.278 686 HZ2 LYS 94 HZ2 LYS 94 10.403 -30.970 22.702 687 HZ3 LYS 94 HZ3 LYS 94 9.047 -30.055 22.273 688 H ARG 95 H ARG 95 4.047 -31.229 19.632 689 HA ARG 95 HA ARG 95 2.818 -29.475 18.859 690 HB2 ARG 95 HB2 ARG 95 1.129 -31.324 18.813 691 HB3 ARG 95 HB3 ARG 95 0.564 -30.782 20.388 692 HG2 ARG 95 HG2 ARG 95 -0.245 -28.753 19.515 693 HG3 ARG 95 HG3 ARG 95 0.627 -28.970 17.997 694 HD2 ARG 95 HD2 ARG 95 -0.972 -31.236 18.232 695 HD3 ARG 95 HD3 ARG 95 -1.996 -29.907 18.773 696 HE ARG 95 HE ARG 95 -0.859 -29.004 16.460 697 HH11 ARG 95 HH11 ARG 95 -2.757 -31.781 17.360 698 HH12 ARG 95 HH12 ARG 95 -3.497 -31.943 15.802 699 HH21 ARG 95 HH21 ARG 95 -1.827 -29.207 14.404 700 HH22 ARG 95 HH22 ARG 95 -2.966 -30.479 14.121 701 H LYS 96 H LYS 96 3.939 -27.908 20.095 702 HA LYS 96 HA LYS 96 2.260 -26.666 22.152 703 HB2 LYS 96 HB2 LYS 96 4.722 -27.979 22.671 704 HB3 LYS 96 HB3 LYS 96 5.008 -26.251 22.836 705 HG2 LYS 96 HG2 LYS 96 4.190 -26.406 24.888 706 HG3 LYS 96 HG3 LYS 96 2.606 -26.695 24.163 707 HD2 LYS 96 HD2 LYS 96 3.367 -29.158 24.032 708 HD3 LYS 96 HD3 LYS 96 4.600 -28.681 25.201 709 HE2 LYS 96 HE2 LYS 96 1.610 -28.463 25.525 710 HE3 LYS 96 HE3 LYS 96 2.687 -29.575 26.368 711 HZ1 LYS 96 HZ1 LYS 96 2.075 -26.843 26.955 712 HZ2 LYS 96 HZ2 LYS 96 3.743 -27.118 26.882 713 HZ3 LYS 96 HZ3 LYS 96 2.782 -28.024 27.939 714 H MET 97 H MET 97 1.828 -24.658 21.546 715 HA MET 97 HA MET 97 3.178 -23.354 19.427 716 HB2 MET 97 HB2 MET 97 1.078 -22.545 21.404 717 HB3 MET 97 HB3 MET 97 1.833 -21.322 20.391 718 HG2 MET 97 HG2 MET 97 0.594 -21.890 18.647 719 HG3 MET 97 HG3 MET 97 1.015 -23.592 18.821 720 HE1 MET 97 HE1 MET 97 -1.677 -20.783 20.016 721 HE2 MET 97 HE2 MET 97 -1.587 -21.364 18.353 722 HE3 MET 97 HE3 MET 97 -2.966 -21.796 19.365 723 H ASP 98 H ASP 98 4.675 -21.726 19.414 724 HA ASP 98 HA ASP 98 5.498 -20.254 21.670 725 HB2 ASP 98 HB2 ASP 98 6.407 -22.733 21.991 726 HB3 ASP 98 HB3 ASP 98 7.675 -22.148 20.917 727 H GLU 99 H GLU 99 5.711 -18.450 20.484 728 HA GLU 99 HA GLU 99 7.970 -18.200 18.735 729 HB2 GLU 99 HB2 GLU 99 5.432 -18.826 17.584 730 HB3 GLU 99 HB3 GLU 99 5.843 -17.172 17.152 731 HG2 GLU 99 HG2 GLU 99 8.146 -18.183 16.519 732 HG3 GLU 99 HG3 GLU 99 7.264 -19.708 16.484 733 H THR 100 H THR 100 8.770 -16.451 19.726 734 HA THR 100 HA THR 100 7.284 -13.969 19.556 735 HB THR 100 HB THR 100 8.457 -14.285 22.233 736 HG1 THR 100 HG1 THR 100 5.971 -15.561 21.762 737 HG21 THR 100 HG21 THR 100 6.213 -12.924 20.901 738 HG22 THR 100 HG22 THR 100 7.250 -12.378 22.219 739 HG23 THR 100 HG23 THR 100 5.892 -13.452 22.552 740 H ASP 101 H ASP 101 8.633 -12.085 20.118 741 HA ASP 101 HA ASP 101 11.496 -12.535 20.274 742 HB2 ASP 101 HB2 ASP 101 10.315 -12.237 17.766 743 HB3 ASP 101 HB3 ASP 101 10.959 -10.641 18.138 744 H ALA 102 H ALA 102 12.683 -10.388 20.345 745 HA ALA 102 HA ALA 102 11.030 -8.198 21.361 746 HB1 ALA 102 HB1 ALA 102 12.888 -9.833 22.957 747 HB2 ALA 102 HB2 ALA 102 13.024 -8.087 23.171 748 HB3 ALA 102 HB3 ALA 102 11.481 -8.893 23.456 749 H SER 103 H SER 103 11.992 -6.153 21.229 750 HA SER 103 HA SER 103 14.690 -5.734 20.465 751 HB2 SER 103 HB2 SER 103 14.600 -5.429 18.193 752 HB3 SER 103 HB3 SER 103 13.341 -6.653 18.347 753 HG SER 103 HG SER 103 12.183 -5.187 17.367 754 H SER 104 H SER 104 15.217 -3.754 21.115 755 HA SER 104 HA SER 104 13.625 -1.451 20.675 756 HB2 SER 104 HB2 SER 104 13.018 -0.923 22.984 757 HB3 SER 104 HB3 SER 104 12.291 -2.455 22.501 758 HG SER 104 HG SER 104 13.194 -3.105 24.299 759 H ALA 105 H ALA 105 15.093 0.074 20.371 760 HA ALA 105 HA ALA 105 17.019 0.828 22.274 761 HB1 ALA 105 HB1 ALA 105 17.859 -1.217 20.358 762 HB2 ALA 105 HB2 ALA 105 18.921 0.190 20.424 763 HB3 ALA 105 HB3 ALA 105 18.582 -0.729 21.890 764 H VAL 106 H VAL 106 16.120 2.843 21.774 765 HA VAL 106 HA VAL 106 17.173 4.035 19.306 766 HB VAL 106 HB VAL 106 15.048 5.410 19.172 767 HG11 VAL 106 HG11 VAL 106 15.161 3.937 17.438 768 HG12 VAL 106 HG12 VAL 106 15.325 2.533 18.494 769 HG13 VAL 106 HG13 VAL 106 13.746 3.285 18.264 770 HG21 VAL 106 HG21 VAL 106 13.557 3.246 20.508 771 HG22 VAL 106 HG22 VAL 106 14.443 4.339 21.570 772 HG23 VAL 106 HG23 VAL 106 13.238 4.980 20.454 773 H LYS 107 H LYS 107 18.754 4.629 21.081 774 HA LYS 107 HA LYS 107 17.979 7.244 22.148 775 HB2 LYS 107 HB2 LYS 107 19.189 6.727 24.271 776 HB3 LYS 107 HB3 LYS 107 17.716 5.793 24.043 777 HG2 LYS 107 HG2 LYS 107 19.172 3.934 23.160 778 HG3 LYS 107 HG3 LYS 107 20.557 4.867 23.732 779 HD2 LYS 107 HD2 LYS 107 19.929 4.649 25.971 780 HD3 LYS 107 HD3 LYS 107 18.269 4.214 25.559 781 HE2 LYS 107 HE2 LYS 107 20.607 2.480 24.813 782 HE3 LYS 107 HE3 LYS 107 19.808 2.348 26.379 783 HZ1 LYS 107 HZ1 LYS 107 18.776 1.693 23.709 784 HZ2 LYS 107 HZ2 LYS 107 17.688 2.166 24.913 785 HZ3 LYS 107 HZ3 LYS 107 18.670 0.809 25.147 786 H VAL 108 H VAL 108 19.976 8.438 22.974 787 HA VAL 108 HA VAL 108 21.838 8.668 20.886 788 HB VAL 108 HB VAL 108 21.361 10.545 22.347 789 HG11 VAL 108 HG11 VAL 108 22.116 10.628 24.648 790 HG12 VAL 108 HG12 VAL 108 21.028 9.258 24.420 791 HG13 VAL 108 HG13 VAL 108 22.769 8.995 24.518 792 HG21 VAL 108 HG21 VAL 108 24.231 9.902 22.895 793 HG22 VAL 108 HG22 VAL 108 23.673 10.135 21.238 794 HG23 VAL 108 HG23 VAL 108 23.500 11.435 22.418 795 H LYS 109 H LYS 109 23.956 8.023 20.663 796 HA LYS 109 HA LYS 109 24.795 5.836 22.439 797 HB2 LYS 109 HB2 LYS 109 24.541 5.798 19.743 798 HB3 LYS 109 HB3 LYS 109 26.228 6.274 19.889 799 HG2 LYS 109 HG2 LYS 109 26.359 3.976 19.773 800 HG3 LYS 109 HG3 LYS 109 26.405 4.270 21.513 801 HD2 LYS 109 HD2 LYS 109 23.944 3.868 21.573 802 HD3 LYS 109 HD3 LYS 109 24.025 3.410 19.871 803 HE2 LYS 109 HE2 LYS 109 24.078 1.410 21.179 804 HE3 LYS 109 HE3 LYS 109 25.685 1.657 20.497 805 HZ1 LYS 109 HZ1 LYS 109 26.540 1.681 22.523 806 HZ2 LYS 109 HZ2 LYS 109 25.019 1.313 23.165 807 HZ3 LYS 109 HZ3 LYS 109 25.505 2.927 23.011 808 H ARG 110 H ARG 110 25.875 8.828 20.921 809 HA ARG 110 HA ARG 110 28.546 8.831 21.635 810 HB2 ARG 110 HB2 ARG 110 26.685 10.702 20.626 811 HB3 ARG 110 HB3 ARG 110 27.459 11.464 22.009 812 HG2 ARG 110 HG2 ARG 110 29.522 10.254 20.554 813 HG3 ARG 110 HG3 ARG 110 28.473 11.030 19.365 814 HD2 ARG 110 HD2 ARG 110 28.819 13.139 20.240 815 HD3 ARG 110 HD3 ARG 110 29.263 12.518 21.830 816 HE ARG 110 HE ARG 110 31.431 12.479 21.136 817 HH11 ARG 110 HH11 ARG 110 29.373 12.436 18.328 818 HH12 ARG 110 HH12 ARG 110 30.686 12.542 17.203 819 HH21 ARG 110 HH21 ARG 110 33.168 12.619 19.664 820 HH22 ARG 110 HH22 ARG 110 32.845 12.646 17.964 821 H ALA 111 H ALA 111 29.610 8.903 23.502 822 HA ALA 111 HA ALA 111 28.715 10.359 25.776 823 HB1 ALA 111 HB1 ALA 111 28.736 7.392 26.220 824 HB2 ALA 111 HB2 ALA 111 28.103 8.664 27.266 825 HB3 ALA 111 HB3 ALA 111 27.263 8.252 25.771 826 H VAL 112 H VAL 112 30.578 7.376 25.150 827 HA VAL 112 HA VAL 112 32.729 8.263 26.846 828 HB VAL 112 HB VAL 112 32.167 5.884 26.715 829 HG11 VAL 112 HG11 VAL 112 31.423 5.595 24.495 830 HG12 VAL 112 HG12 VAL 112 32.935 6.212 23.826 831 HG13 VAL 112 HG13 VAL 112 32.901 4.643 24.630 832 HG21 VAL 112 HG21 VAL 112 34.858 5.959 25.475 833 HG22 VAL 112 HG22 VAL 112 34.612 6.916 26.936 834 HG23 VAL 112 HG23 VAL 112 34.316 5.178 26.960 835 H GLN 113 H GLN 113 34.799 8.856 26.233 836 HA GLN 113 HA GLN 113 35.104 9.600 23.399 837 HB2 GLN 113 HB2 GLN 113 35.074 11.309 25.513 838 HB3 GLN 113 HB3 GLN 113 36.796 10.974 25.385 839 HG2 GLN 113 HG2 GLN 113 36.893 12.532 23.819 840 HG3 GLN 113 HG3 GLN 113 35.980 11.445 22.774 841 HE21 GLN 113 HE21 GLN 113 36.096 14.495 23.757 842 HE22 GLN 113 HE22 GLN 113 34.422 14.919 23.709 843 H LYS 114 H LYS 114 37.440 9.792 22.716 844 HA LYS 114 HA LYS 114 39.263 8.002 24.112 845 HB2 LYS 114 HB2 LYS 114 37.727 6.840 22.260 846 HB3 LYS 114 HB3 LYS 114 38.971 7.484 21.197 847 HG2 LYS 114 HG2 LYS 114 39.906 6.025 23.588 848 HG3 LYS 114 HG3 LYS 114 39.115 5.072 22.330 849 HD2 LYS 114 HD2 LYS 114 40.684 6.217 20.689 850 HD3 LYS 114 HD3 LYS 114 41.576 6.788 22.101 851 HE2 LYS 114 HE2 LYS 114 41.227 4.087 22.584 852 HE3 LYS 114 HE3 LYS 114 41.541 4.165 20.851 853 HZ1 LYS 114 HZ1 LYS 114 43.250 5.421 22.929 854 HZ2 LYS 114 HZ2 LYS 114 43.568 5.353 21.269 855 HZ3 LYS 114 HZ3 LYS 114 43.573 3.934 22.190 Start of MODEL 7 1 H1 MET 1 H MET 1 9.347 -18.020 -31.844 2 HA MET 1 HA MET 1 10.349 -19.385 -30.166 3 HB2 MET 1 HB2 MET 1 11.331 -16.562 -29.713 4 HB3 MET 1 HB3 MET 1 12.203 -18.039 -29.324 5 HG2 MET 1 HG2 MET 1 13.183 -17.720 -31.302 6 HG3 MET 1 HG3 MET 1 11.702 -18.416 -31.956 7 HE1 MET 1 HE1 MET 1 13.967 -16.632 -33.098 8 HE2 MET 1 HE2 MET 1 12.777 -16.609 -34.399 9 HE3 MET 1 HE3 MET 1 13.412 -15.093 -33.757 10 H ALA 2 H ALA 2 11.309 -19.004 -27.756 11 HA ALA 2 HA ALA 2 8.917 -18.623 -26.110 12 HB1 ALA 2 HB1 ALA 2 11.473 -19.740 -25.047 13 HB2 ALA 2 HB2 ALA 2 9.809 -20.099 -24.584 14 HB3 ALA 2 HB3 ALA 2 10.458 -20.727 -26.099 15 H GLY 3 H GLY 3 9.774 -18.015 -23.686 16 HA2 GLY 3 HA2 GLY 3 11.439 -15.597 -23.963 17 HA3 GLY 3 HA3 GLY 3 9.884 -15.521 -23.147 18 H SER 4 H SER 4 10.012 -17.963 -21.751 19 HA SER 4 HA SER 4 11.825 -17.177 -19.623 20 HB2 SER 4 HB2 SER 4 9.799 -19.426 -19.696 21 HB3 SER 4 HB3 SER 4 10.637 -18.823 -18.266 22 HG SER 4 HG SER 4 8.614 -17.605 -19.792 23 H HIS 5 H HIS 5 13.211 -18.733 -18.550 24 HA HIS 5 HA HIS 5 14.990 -20.011 -20.253 25 HB2 HIS 5 HB2 HIS 5 14.448 -20.326 -17.307 26 HB3 HIS 5 HB3 HIS 5 15.709 -21.251 -18.116 27 HD1 HIS 5 HD1 HIS 5 17.847 -20.014 -18.772 28 HD2 HIS 5 HD2 HIS 5 14.961 -17.556 -17.071 29 HE1 HIS 5 HE1 HIS 5 19.015 -17.838 -18.292 30 H HIS 6 H HIS 6 15.423 -22.213 -20.684 31 HA HIS 6 HA HIS 6 13.027 -23.807 -20.980 32 HB2 HIS 6 HB2 HIS 6 15.881 -24.388 -21.800 33 HB3 HIS 6 HB3 HIS 6 14.470 -25.337 -22.260 34 HD1 HIS 6 HD1 HIS 6 16.083 -24.255 -24.516 35 HD2 HIS 6 HD2 HIS 6 13.027 -22.073 -22.740 36 HE1 HIS 6 HE1 HIS 6 15.379 -22.562 -26.236 37 H HIS 7 H HIS 7 12.933 -26.066 -20.338 38 HA HIS 7 HA HIS 7 12.983 -27.710 -18.766 39 HB2 HIS 7 HB2 HIS 7 15.390 -27.760 -19.567 40 HB3 HIS 7 HB3 HIS 7 15.793 -26.792 -18.152 41 HD1 HIS 7 HD1 HIS 7 16.704 -28.198 -16.350 42 HD2 HIS 7 HD2 HIS 7 13.816 -30.215 -18.552 43 HE1 HIS 7 HE1 HIS 7 16.531 -30.477 -15.302 44 H HIS 8 H HIS 8 11.553 -25.795 -17.816 45 HA HIS 8 HA HIS 8 12.615 -25.076 -15.168 46 HB2 HIS 8 HB2 HIS 8 11.653 -23.345 -16.913 47 HB3 HIS 8 HB3 HIS 8 10.104 -23.878 -16.266 48 HD1 HIS 8 HD1 HIS 8 9.347 -22.141 -14.684 49 HD2 HIS 8 HD2 HIS 8 13.416 -22.893 -14.314 50 HE1 HIS 8 HE1 HIS 8 10.123 -20.713 -12.765 51 H HIS 9 H HIS 9 9.821 -26.456 -16.833 52 HA HIS 9 HA HIS 9 8.887 -27.506 -14.242 53 HB2 HIS 9 HB2 HIS 9 7.392 -26.482 -16.625 54 HB3 HIS 9 HB3 HIS 9 6.652 -27.717 -15.610 55 HD1 HIS 9 HD1 HIS 9 8.406 -24.388 -14.978 56 HD2 HIS 9 HD2 HIS 9 5.117 -26.587 -13.709 57 HE1 HIS 9 HE1 HIS 9 7.256 -22.950 -13.266 58 H HIS 10 H HIS 10 10.468 -29.243 -14.691 59 HA HIS 10 HA HIS 10 9.787 -31.081 -16.834 60 HB2 HIS 10 HB2 HIS 10 11.732 -32.371 -16.051 61 HB3 HIS 10 HB3 HIS 10 12.148 -30.684 -16.340 62 HD1 HIS 10 HD1 HIS 10 12.557 -29.195 -14.206 63 HD2 HIS 10 HD2 HIS 10 12.098 -33.257 -13.463 64 HE1 HIS 10 HE1 HIS 10 13.392 -29.548 -11.860 65 H GLY 11 H GLY 11 9.360 -33.351 -16.430 66 HA2 GLY 11 HA2 GLY 11 8.917 -34.754 -14.210 67 HA3 GLY 11 HA3 GLY 11 7.533 -33.671 -14.185 68 H SER 12 H SER 12 9.221 -35.659 -16.621 69 HA SER 12 HA SER 12 6.680 -36.310 -17.860 70 HB2 SER 12 HB2 SER 12 8.477 -37.797 -19.235 71 HB3 SER 12 HB3 SER 12 8.145 -36.102 -19.589 72 HG SER 12 HG SER 12 10.202 -35.867 -19.230 73 H MET 13 H MET 13 5.633 -38.221 -17.748 74 HA MET 13 HA MET 13 5.016 -40.277 -16.997 75 HB2 MET 13 HB2 MET 13 7.226 -40.783 -18.263 76 HB3 MET 13 HB3 MET 13 7.914 -40.990 -16.658 77 HG2 MET 13 HG2 MET 13 5.592 -42.492 -16.591 78 HG3 MET 13 HG3 MET 13 6.242 -42.770 -18.205 79 HE1 MET 13 HE1 MET 13 7.232 -44.365 -14.299 80 HE2 MET 13 HE2 MET 13 5.757 -43.904 -15.149 81 HE3 MET 13 HE3 MET 13 6.537 -45.445 -15.507 82 H SER 14 H SER 14 4.151 -39.437 -15.061 83 HA SER 14 HA SER 14 5.733 -40.126 -12.680 84 HB2 SER 14 HB2 SER 14 5.809 -37.728 -12.780 85 HB3 SER 14 HB3 SER 14 4.079 -37.631 -13.110 86 HG SER 14 HG SER 14 5.197 -38.689 -10.726 87 H GLU 15 H GLU 15 4.602 -41.018 -10.974 88 HA GLU 15 HA GLU 15 1.788 -41.687 -11.538 89 HB2 GLU 15 HB2 GLU 15 3.966 -43.402 -11.115 90 HB3 GLU 15 HB3 GLU 15 3.042 -43.451 -9.621 91 HG2 GLU 15 HG2 GLU 15 2.203 -45.188 -10.955 92 HG3 GLU 15 HG3 GLU 15 1.004 -43.898 -11.037 93 H TYR 16 H TYR 16 1.032 -42.726 -9.141 94 HA TYR 16 HA TYR 16 1.517 -40.590 -7.180 95 HB2 TYR 16 HB2 TYR 16 -0.973 -40.806 -6.610 96 HB3 TYR 16 HB3 TYR 16 -0.557 -39.936 -8.082 97 HD1 TYR 16 HD1 TYR 16 -1.484 -43.362 -6.922 98 HD2 TYR 16 HD2 TYR 16 -1.645 -40.485 -10.052 99 HE1 TYR 16 HE1 TYR 16 -2.954 -44.855 -8.211 100 HE2 TYR 16 HE2 TYR 16 -3.116 -41.969 -11.349 101 HH TYR 16 HH TYR 16 -3.663 -45.245 -10.464 102 H ILE 17 H ILE 17 0.201 -41.314 -5.057 103 HA ILE 17 HA ILE 17 0.984 -44.109 -4.537 104 HB ILE 17 HB ILE 17 2.478 -42.749 -3.299 105 HG12 ILE 17 HG12 ILE 17 0.250 -43.545 -1.413 106 HG13 ILE 17 HG13 ILE 17 1.458 -44.647 -2.064 107 HG21 ILE 17 HG21 ILE 17 0.223 -40.966 -3.151 108 HG22 ILE 17 HG22 ILE 17 0.943 -41.197 -1.558 109 HG23 ILE 17 HG23 ILE 17 1.936 -40.631 -2.900 110 HD11 ILE 17 HD11 ILE 17 3.176 -43.082 -0.996 111 HD12 ILE 17 HD12 ILE 17 1.811 -42.428 -0.091 112 HD13 ILE 17 HD13 ILE 17 2.235 -44.133 0.062 113 H ARG 18 H ARG 18 -0.636 -45.417 -4.039 114 HA ARG 18 HA ARG 18 -3.124 -44.240 -2.993 115 HB2 ARG 18 HB2 ARG 18 -2.569 -46.493 -4.866 116 HB3 ARG 18 HB3 ARG 18 -3.984 -46.611 -3.828 117 HG2 ARG 18 HG2 ARG 18 -4.120 -44.048 -4.874 118 HG3 ARG 18 HG3 ARG 18 -3.572 -45.048 -6.221 119 HD2 ARG 18 HD2 ARG 18 -5.727 -45.557 -6.514 120 HD3 ARG 18 HD3 ARG 18 -5.550 -46.579 -5.088 121 HE ARG 18 HE ARG 18 -6.157 -44.212 -3.995 122 HH11 ARG 18 HH11 ARG 18 -7.597 -45.989 -6.619 123 HH12 ARG 18 HH12 ARG 18 -9.189 -45.366 -6.340 124 HH21 ARG 18 HH21 ARG 18 -8.249 -43.384 -3.617 125 HH22 ARG 18 HH22 ARG 18 -9.559 -43.884 -4.633 126 H VAL 19 H VAL 19 -3.089 -44.431 -0.836 127 HA VAL 19 HA VAL 19 -2.920 -47.107 0.298 128 HB VAL 19 HB VAL 19 -1.447 -46.185 2.176 129 HG11 VAL 19 HG11 VAL 19 -0.643 -47.857 0.639 130 HG12 VAL 19 HG12 VAL 19 -0.312 -46.628 -0.583 131 HG13 VAL 19 HG13 VAL 19 0.627 -46.664 0.910 132 HG21 VAL 19 HG21 VAL 19 -0.077 -44.376 0.367 133 HG22 VAL 19 HG22 VAL 19 -1.711 -43.830 0.745 134 HG23 VAL 19 HG23 VAL 19 -0.562 -44.141 2.047 135 H THR 20 H THR 20 -3.486 -47.052 2.680 136 HA THR 20 HA THR 20 -5.215 -44.794 3.386 137 HB THR 20 HB THR 20 -6.908 -46.144 2.577 138 HG1 THR 20 HG1 THR 20 -7.959 -46.926 4.403 139 HG21 THR 20 HG21 THR 20 -6.147 -48.142 1.845 140 HG22 THR 20 HG22 THR 20 -6.752 -48.721 3.397 141 HG23 THR 20 HG23 THR 20 -5.042 -48.335 3.206 142 H GLU 21 H GLU 21 -5.598 -44.548 5.618 143 HA GLU 21 HA GLU 21 -3.486 -45.599 7.277 144 HB2 GLU 21 HB2 GLU 21 -4.497 -43.211 7.302 145 HB3 GLU 21 HB3 GLU 21 -5.773 -43.928 8.276 146 HG2 GLU 21 HG2 GLU 21 -3.196 -44.691 9.286 147 HG3 GLU 21 HG3 GLU 21 -3.315 -42.938 9.147 148 H ASP 22 H ASP 22 -6.992 -45.919 7.041 149 HA ASP 22 HA ASP 22 -6.913 -47.985 9.133 150 HB2 ASP 22 HB2 ASP 22 -9.131 -46.232 8.095 151 HB3 ASP 22 HB3 ASP 22 -9.465 -47.682 9.039 152 H GLU 23 H GLU 23 -7.520 -50.051 8.716 153 HA GLU 23 HA GLU 23 -7.405 -51.010 6.077 154 HB2 GLU 23 HB2 GLU 23 -7.999 -53.178 7.015 155 HB3 GLU 23 HB3 GLU 23 -6.815 -52.373 8.036 156 HG2 GLU 23 HG2 GLU 23 -8.952 -51.553 9.318 157 HG3 GLU 23 HG3 GLU 23 -9.680 -52.968 8.558 158 H ASN 24 H ASN 24 -10.097 -50.141 8.148 159 HA ASN 24 HA ASN 24 -12.119 -51.276 6.481 160 HB2 ASN 24 HB2 ASN 24 -12.054 -50.281 9.044 161 HB3 ASN 24 HB3 ASN 24 -12.938 -49.027 8.178 162 HD21 ASN 24 HD21 ASN 24 -13.166 -51.954 9.747 163 HD22 ASN 24 HD22 ASN 24 -14.737 -52.426 9.205 164 H ASP 25 H ASP 25 -10.412 -48.254 6.572 165 HA ASP 25 HA ASP 25 -12.277 -46.881 4.848 166 HB2 ASP 25 HB2 ASP 25 -10.726 -45.835 6.640 167 HB3 ASP 25 HB3 ASP 25 -9.469 -45.966 5.413 168 H GLU 26 H GLU 26 -11.782 -46.124 2.723 169 HA GLU 26 HA GLU 26 -10.472 -48.113 1.123 170 HB2 GLU 26 HB2 GLU 26 -12.187 -45.765 0.659 171 HB3 GLU 26 HB3 GLU 26 -11.011 -46.076 -0.610 172 HG2 GLU 26 HG2 GLU 26 -12.046 -47.947 -1.304 173 HG3 GLU 26 HG3 GLU 26 -12.524 -48.419 0.325 174 HA PRO 27 HA PRO 27 -6.477 -46.351 0.688 175 HB2 PRO 27 HB2 PRO 27 -5.879 -47.013 -1.876 176 HB3 PRO 27 HB3 PRO 27 -5.928 -48.197 -0.565 177 HG2 PRO 27 HG2 PRO 27 -8.002 -47.573 -2.632 178 HG3 PRO 27 HG3 PRO 27 -7.462 -49.151 -2.031 179 HD2 PRO 27 HD2 PRO 27 -9.746 -47.971 -1.180 180 HD3 PRO 27 HD3 PRO 27 -8.761 -49.013 -0.132 181 H ILE 28 H ILE 28 -6.515 -44.156 0.771 182 HA ILE 28 HA ILE 28 -7.696 -42.541 -1.276 183 HB ILE 28 HB ILE 28 -7.630 -41.739 1.022 184 HG12 ILE 28 HG12 ILE 28 -6.700 -39.476 0.597 185 HG13 ILE 28 HG13 ILE 28 -5.923 -40.091 -0.857 186 HG21 ILE 28 HG21 ILE 28 -5.414 -40.945 1.936 187 HG22 ILE 28 HG22 ILE 28 -5.643 -42.692 1.878 188 HG23 ILE 28 HG23 ILE 28 -4.648 -41.892 0.661 189 HD11 ILE 28 HD11 ILE 28 -8.693 -40.746 -0.942 190 HD12 ILE 28 HD12 ILE 28 -8.510 -39.030 -0.580 191 HD13 ILE 28 HD13 ILE 28 -7.758 -39.712 -2.022 192 H GLU 29 H GLU 29 -6.722 -41.367 -2.881 193 HA GLU 29 HA GLU 29 -3.975 -42.158 -3.536 194 HB2 GLU 29 HB2 GLU 29 -4.561 -41.199 -5.805 195 HB3 GLU 29 HB3 GLU 29 -5.454 -42.635 -5.325 196 HG2 GLU 29 HG2 GLU 29 -7.408 -41.578 -5.399 197 HG3 GLU 29 HG3 GLU 29 -6.781 -40.174 -4.536 198 H ILE 30 H ILE 30 -2.336 -40.736 -3.603 199 HA ILE 30 HA ILE 30 -2.972 -37.874 -3.326 200 HB ILE 30 HB ILE 30 -0.465 -38.338 -2.107 201 HG12 ILE 30 HG12 ILE 30 -2.625 -40.094 -0.927 202 HG13 ILE 30 HG13 ILE 30 -1.271 -40.700 -1.875 203 HG21 ILE 30 HG21 ILE 30 -1.558 -36.544 -1.252 204 HG22 ILE 30 HG22 ILE 30 -3.138 -37.320 -1.351 205 HG23 ILE 30 HG23 ILE 30 -2.035 -37.731 -0.038 206 HD11 ILE 30 HD11 ILE 30 -1.185 -39.352 0.807 207 HD12 ILE 30 HD12 ILE 30 -0.725 -41.006 0.402 208 HD13 ILE 30 HD13 ILE 30 0.248 -39.654 -0.176 209 HA PRO 31 HA PRO 31 -0.271 -37.254 -6.743 210 HB2 PRO 31 HB2 PRO 31 0.442 -34.674 -6.290 211 HB3 PRO 31 HB3 PRO 31 -1.160 -35.139 -6.874 212 HG2 PRO 31 HG2 PRO 31 -0.282 -34.456 -4.095 213 HG3 PRO 31 HG3 PRO 31 -1.753 -33.966 -4.956 214 HD2 PRO 31 HD2 PRO 31 -1.730 -35.969 -3.135 215 HD3 PRO 31 HD3 PRO 31 -2.814 -35.969 -4.540 216 H SER 32 H SER 32 1.609 -38.348 -6.686 217 HA SER 32 HA SER 32 3.605 -37.730 -4.654 218 HB2 SER 32 HB2 SER 32 4.527 -39.792 -5.083 219 HB3 SER 32 HB3 SER 32 2.875 -40.105 -5.616 220 HG SER 32 HG SER 32 4.185 -40.782 -7.250 221 H GLU 33 H GLU 33 5.976 -38.073 -5.758 222 HA GLU 33 HA GLU 33 6.228 -35.761 -7.508 223 HB2 GLU 33 HB2 GLU 33 8.290 -37.428 -6.060 224 HB3 GLU 33 HB3 GLU 33 8.677 -36.048 -7.077 225 HG2 GLU 33 HG2 GLU 33 7.026 -35.995 -4.562 226 HG3 GLU 33 HG3 GLU 33 8.684 -35.425 -4.739 227 H ASP 34 H ASP 34 7.858 -35.878 -9.298 228 HA ASP 34 HA ASP 34 7.105 -37.873 -11.150 229 HB2 ASP 34 HB2 ASP 34 8.760 -36.865 -12.635 230 HB3 ASP 34 HB3 ASP 34 7.827 -35.613 -11.820 231 H ASP 35 H ASP 35 9.889 -37.495 -9.038 232 HA ASP 35 HA ASP 35 11.497 -39.525 -10.143 233 HB2 ASP 35 HB2 ASP 35 11.542 -37.811 -7.824 234 HB3 ASP 35 HB3 ASP 35 12.015 -39.448 -7.377 235 H GLY 36 H GLY 36 8.649 -39.650 -8.230 236 HA2 GLY 36 HA2 GLY 36 7.504 -41.835 -8.269 237 HA3 GLY 36 HA3 GLY 36 9.054 -42.555 -7.860 238 H THR 37 H THR 37 9.694 -40.410 -5.946 239 HA THR 37 HA THR 37 8.537 -41.604 -3.637 240 HB THR 37 HB THR 37 9.808 -40.010 -2.345 241 HG1 THR 37 HG1 THR 37 10.393 -38.686 -4.801 242 HG21 THR 37 HG21 THR 37 11.712 -40.423 -4.575 243 HG22 THR 37 HG22 THR 37 10.916 -41.861 -3.937 244 HG23 THR 37 HG23 THR 37 11.863 -40.829 -2.866 245 H VAL 38 H VAL 38 7.967 -39.654 -1.872 246 HA VAL 38 HA VAL 38 5.841 -38.021 -3.066 247 HB VAL 38 HB VAL 38 5.501 -39.887 -0.719 248 HG11 VAL 38 HG11 VAL 38 4.399 -37.945 -0.019 249 HG12 VAL 38 HG12 VAL 38 3.823 -37.578 -1.646 250 HG13 VAL 38 HG13 VAL 38 3.128 -38.927 -0.748 251 HG21 VAL 38 HG21 VAL 38 3.933 -41.033 -2.017 252 HG22 VAL 38 HG22 VAL 38 3.780 -39.708 -3.171 253 HG23 VAL 38 HG23 VAL 38 5.245 -40.689 -3.145 254 H LEU 39 H LEU 39 5.937 -35.985 -2.390 255 HA LEU 39 HA LEU 39 7.852 -35.084 -0.538 256 HB2 LEU 39 HB2 LEU 39 6.120 -33.940 -2.405 257 HB3 LEU 39 HB3 LEU 39 5.664 -33.229 -0.858 258 HG LEU 39 HG LEU 39 7.247 -31.800 -1.984 259 HD11 LEU 39 HD11 LEU 39 7.345 -32.164 0.520 260 HD12 LEU 39 HD12 LEU 39 8.786 -31.481 -0.230 261 HD13 LEU 39 HD13 LEU 39 8.751 -33.186 0.219 262 HD21 LEU 39 HD21 LEU 39 9.564 -32.605 -2.402 263 HD22 LEU 39 HD22 LEU 39 8.348 -33.363 -3.431 264 HD23 LEU 39 HD23 LEU 39 9.011 -34.243 -2.053 265 H LEU 40 H LEU 40 7.756 -34.570 1.590 266 HA LEU 40 HA LEU 40 6.042 -35.849 3.312 267 HB2 LEU 40 HB2 LEU 40 8.210 -34.710 3.866 268 HB3 LEU 40 HB3 LEU 40 7.327 -33.185 3.879 269 HG LEU 40 HG LEU 40 6.016 -33.912 5.773 270 HD11 LEU 40 HD11 LEU 40 5.824 -36.270 5.249 271 HD12 LEU 40 HD12 LEU 40 6.469 -36.059 6.877 272 HD13 LEU 40 HD13 LEU 40 7.546 -36.501 5.552 273 HD21 LEU 40 HD21 LEU 40 7.616 -33.347 7.226 274 HD22 LEU 40 HD22 LEU 40 8.687 -33.285 5.826 275 HD23 LEU 40 HD23 LEU 40 8.610 -34.744 6.814 276 H SER 41 H SER 41 5.771 -32.542 2.058 277 HA SER 41 HA SER 41 3.596 -31.650 3.498 278 HB2 SER 41 HB2 SER 41 4.626 -31.064 0.751 279 HB3 SER 41 HB3 SER 41 3.063 -30.403 1.231 280 HG SER 41 HG SER 41 4.217 -28.904 2.140 281 H THR 42 H THR 42 3.677 -33.808 0.732 282 HA THR 42 HA THR 42 0.867 -33.813 0.264 283 HB THR 42 HB THR 42 2.817 -35.992 -0.492 284 HG1 THR 42 HG1 THR 42 2.148 -33.602 -1.900 285 HG21 THR 42 HG21 THR 42 0.375 -36.452 -0.746 286 HG22 THR 42 HG22 THR 42 1.270 -36.479 -2.265 287 HG23 THR 42 HG23 THR 42 0.281 -35.080 -1.848 288 H VAL 43 H VAL 43 3.042 -35.746 2.235 289 HA VAL 43 HA VAL 43 1.184 -37.793 2.875 290 HB VAL 43 HB VAL 43 3.773 -36.887 4.084 291 HG11 VAL 43 HG11 VAL 43 3.432 -39.037 5.538 292 HG12 VAL 43 HG12 VAL 43 2.785 -37.485 6.073 293 HG13 VAL 43 HG13 VAL 43 1.722 -38.670 5.313 294 HG21 VAL 43 HG21 VAL 43 4.464 -38.320 2.515 295 HG22 VAL 43 HG22 VAL 43 3.868 -39.591 3.584 296 HG23 VAL 43 HG23 VAL 43 2.845 -38.981 2.283 297 H THR 44 H THR 44 2.112 -34.771 4.465 298 HA THR 44 HA THR 44 0.513 -35.162 6.778 299 HB THR 44 HB THR 44 0.971 -32.886 7.336 300 HG1 THR 44 HG1 THR 44 1.512 -32.613 4.564 301 HG21 THR 44 HG21 THR 44 3.117 -33.342 7.731 302 HG22 THR 44 HG22 THR 44 3.520 -33.115 6.029 303 HG23 THR 44 HG23 THR 44 2.994 -34.696 6.608 304 H ALA 45 H ALA 45 -0.125 -33.940 3.588 305 HA ALA 45 HA ALA 45 -2.340 -32.356 3.929 306 HB1 ALA 45 HB1 ALA 45 -1.917 -34.401 1.752 307 HB2 ALA 45 HB2 ALA 45 -3.028 -33.032 1.686 308 HB3 ALA 45 HB3 ALA 45 -1.288 -32.752 1.762 309 H GLN 46 H GLN 46 -2.275 -35.904 3.672 310 HA GLN 46 HA GLN 46 -5.070 -35.966 4.573 311 HB2 GLN 46 HB2 GLN 46 -3.651 -38.414 3.628 312 HB3 GLN 46 HB3 GLN 46 -5.346 -37.973 3.472 313 HG2 GLN 46 HG2 GLN 46 -4.777 -36.345 1.755 314 HG3 GLN 46 HG3 GLN 46 -3.071 -36.755 1.923 315 HE21 GLN 46 HE21 GLN 46 -3.159 -39.474 2.093 316 HE22 GLN 46 HE22 GLN 46 -3.752 -40.137 0.612 317 H PHE 47 H PHE 47 -1.836 -37.116 5.312 318 HA PHE 47 HA PHE 47 -2.855 -38.210 7.850 319 HB2 PHE 47 HB2 PHE 47 -0.164 -38.934 6.751 320 HB3 PHE 47 HB3 PHE 47 -1.213 -39.855 7.824 321 HD1 PHE 47 HD1 PHE 47 0.210 -40.148 4.842 322 HD2 PHE 47 HD2 PHE 47 -3.723 -40.005 6.463 323 HE1 PHE 47 HE1 PHE 47 -0.628 -41.426 2.913 324 HE2 PHE 47 HE2 PHE 47 -4.567 -41.283 4.538 325 HZ PHE 47 HZ PHE 47 -3.019 -41.996 2.760 326 HA PRO 48 HA PRO 48 -0.379 -34.446 8.912 327 HB2 PRO 48 HB2 PRO 48 -2.086 -33.596 10.844 328 HB3 PRO 48 HB3 PRO 48 -2.291 -33.192 9.136 329 HG2 PRO 48 HG2 PRO 48 -3.648 -35.311 10.758 330 HG3 PRO 48 HG3 PRO 48 -4.343 -34.200 9.563 331 HD2 PRO 48 HD2 PRO 48 -3.749 -36.777 8.983 332 HD3 PRO 48 HD3 PRO 48 -3.638 -35.477 7.779 333 H GLY 49 H GLY 49 1.253 -34.652 10.310 334 HA2 GLY 49 HA2 GLY 49 2.210 -34.964 12.441 335 HA3 GLY 49 HA3 GLY 49 0.780 -35.865 12.925 336 H ALA 50 H ALA 50 0.882 -37.521 10.471 337 HA ALA 50 HA ALA 50 2.194 -39.745 11.436 338 HB1 ALA 50 HB1 ALA 50 1.938 -40.716 9.258 339 HB2 ALA 50 HB2 ALA 50 0.521 -39.722 9.597 340 HB3 ALA 50 HB3 ALA 50 1.779 -39.124 8.516 341 H CYS 51 H CYS 51 4.277 -39.758 12.029 342 HA CYS 51 HA CYS 51 6.298 -38.277 10.646 343 HB2 CYS 51 HB2 CYS 51 6.052 -39.661 13.138 344 HB3 CYS 51 HB3 CYS 51 7.487 -40.250 12.307 345 HG CYS 51 HG CYS 51 6.850 -37.167 13.550 346 H GLY 52 H GLY 52 5.186 -41.603 10.658 347 HA2 GLY 52 HA2 GLY 52 6.732 -42.096 8.238 348 HA3 GLY 52 HA3 GLY 52 7.105 -43.122 9.615 349 H LEU 53 H LEU 53 6.006 -43.844 7.001 350 HA LEU 53 HA LEU 53 3.404 -44.930 7.856 351 HB2 LEU 53 HB2 LEU 53 4.334 -44.622 5.014 352 HB3 LEU 53 HB3 LEU 53 2.705 -44.970 5.590 353 HG LEU 53 HG LEU 53 2.523 -42.764 4.967 354 HD11 LEU 53 HD11 LEU 53 1.916 -41.738 6.876 355 HD12 LEU 53 HD12 LEU 53 3.486 -41.988 7.638 356 HD13 LEU 53 HD13 LEU 53 2.307 -43.299 7.599 357 HD21 LEU 53 HD21 LEU 53 5.138 -42.001 6.223 358 HD22 LEU 53 HD22 LEU 53 4.202 -41.139 5.003 359 HD23 LEU 53 HD23 LEU 53 5.051 -42.625 4.576 360 H ARG 54 H ARG 54 2.988 -47.100 7.590 361 HA ARG 54 HA ARG 54 5.340 -48.761 6.998 362 HB2 ARG 54 HB2 ARG 54 3.741 -48.769 9.215 363 HB3 ARG 54 HB3 ARG 54 3.012 -50.048 8.252 364 HG2 ARG 54 HG2 ARG 54 4.535 -51.343 9.259 365 HG3 ARG 54 HG3 ARG 54 5.629 -50.690 8.039 366 HD2 ARG 54 HD2 ARG 54 5.261 -49.124 10.530 367 HD3 ARG 54 HD3 ARG 54 6.182 -50.623 10.642 368 HE ARG 54 HE ARG 54 7.010 -48.886 8.500 369 HH11 ARG 54 HH11 ARG 54 7.402 -49.703 11.861 370 HH12 ARG 54 HH12 ARG 54 8.994 -49.028 11.974 371 HH21 ARG 54 HH21 ARG 54 9.105 -47.993 8.636 372 HH22 ARG 54 HH22 ARG 54 9.961 -48.055 10.139 373 H TYR 55 H TYR 55 4.765 -50.981 6.110 374 HA TYR 55 HA TYR 55 2.870 -50.613 3.894 375 HB2 TYR 55 HB2 TYR 55 5.538 -51.644 4.036 376 HB3 TYR 55 HB3 TYR 55 4.464 -52.922 3.479 377 HD1 TYR 55 HD1 TYR 55 2.629 -51.919 1.696 378 HD2 TYR 55 HD2 TYR 55 6.570 -50.460 2.360 379 HE1 TYR 55 HE1 TYR 55 2.645 -50.952 -0.565 380 HE2 TYR 55 HE2 TYR 55 6.597 -49.488 0.101 381 HH TYR 55 HH TYR 55 4.510 -50.316 -2.282 382 H ARG 56 H ARG 56 1.081 -51.803 3.791 383 HA ARG 56 HA ARG 56 0.935 -54.274 5.383 384 HB2 ARG 56 HB2 ARG 56 -0.321 -52.755 6.671 385 HB3 ARG 56 HB3 ARG 56 -1.032 -52.004 5.249 386 HG2 ARG 56 HG2 ARG 56 -2.616 -53.409 6.517 387 HG3 ARG 56 HG3 ARG 56 -2.402 -53.933 4.845 388 HD2 ARG 56 HD2 ARG 56 -0.817 -55.653 5.610 389 HD3 ARG 56 HD3 ARG 56 -1.089 -55.143 7.276 390 HE ARG 56 HE ARG 56 -3.529 -55.822 5.983 391 HH11 ARG 56 HH11 ARG 56 -0.705 -57.190 7.490 392 HH12 ARG 56 HH12 ARG 56 -1.503 -58.656 7.956 393 HH21 ARG 56 HH21 ARG 56 -4.591 -57.747 6.591 394 HH22 ARG 56 HH22 ARG 56 -3.713 -58.972 7.443 395 H ASN 57 H ASN 57 1.115 -55.692 3.705 396 HA ASN 57 HA ASN 57 -0.845 -55.444 1.521 397 HB2 ASN 57 HB2 ASN 57 1.914 -56.627 1.638 398 HB3 ASN 57 HB3 ASN 57 0.767 -57.166 0.414 399 HD21 ASN 57 HD21 ASN 57 0.374 -55.909 -1.320 400 HD22 ASN 57 HD22 ASN 57 1.130 -54.382 -1.607 401 HA PRO 58 HA PRO 58 -2.753 -58.933 3.585 402 HB2 PRO 58 HB2 PRO 58 -4.914 -59.031 1.945 403 HB3 PRO 58 HB3 PRO 58 -4.755 -57.855 3.255 404 HG2 PRO 58 HG2 PRO 58 -4.237 -57.511 0.326 405 HG3 PRO 58 HG3 PRO 58 -5.060 -56.417 1.453 406 HD2 PRO 58 HD2 PRO 58 -2.490 -56.051 0.682 407 HD3 PRO 58 HD3 PRO 58 -3.079 -55.587 2.291 408 H VAL 59 H VAL 59 -2.201 -58.619 0.112 409 HA VAL 59 HA VAL 59 -2.459 -61.478 -0.316 410 HB VAL 59 HB VAL 59 -1.923 -60.976 -2.663 411 HG11 VAL 59 HG11 VAL 59 -3.900 -58.878 -2.164 412 HG12 VAL 59 HG12 VAL 59 -4.044 -60.382 -3.076 413 HG13 VAL 59 HG13 VAL 59 -4.226 -60.392 -1.321 414 HG21 VAL 59 HG21 VAL 59 -1.709 -58.113 -1.738 415 HG22 VAL 59 HG22 VAL 59 -0.365 -59.124 -2.268 416 HG23 VAL 59 HG23 VAL 59 -1.632 -58.675 -3.408 417 H SER 60 H SER 60 0.050 -59.095 0.107 418 HA SER 60 HA SER 60 2.160 -60.883 -0.750 419 HB2 SER 60 HB2 SER 60 2.073 -58.261 -0.900 420 HB3 SER 60 HB3 SER 60 2.671 -58.342 0.757 421 HG SER 60 HG SER 60 4.338 -58.252 -0.869 422 H GLN 61 H GLN 61 0.670 -59.839 2.227 423 HA GLN 61 HA GLN 61 1.046 -60.356 4.419 424 HB2 GLN 61 HB2 GLN 61 2.004 -63.008 3.353 425 HB3 GLN 61 HB3 GLN 61 1.209 -62.685 4.887 426 HG2 GLN 61 HG2 GLN 61 -0.790 -61.934 3.483 427 HG3 GLN 61 HG3 GLN 61 0.024 -62.731 2.138 428 HE21 GLN 61 HE21 GLN 61 -0.813 -64.645 1.771 429 HE22 GLN 61 HE22 GLN 61 -1.335 -65.780 2.964 430 H CYS 62 H CYS 62 3.245 -59.071 3.092 431 HA CYS 62 HA CYS 62 5.593 -60.342 4.298 432 HB2 CYS 62 HB2 CYS 62 5.230 -59.065 1.860 433 HB3 CYS 62 HB3 CYS 62 6.079 -57.869 2.832 434 HG CYS 62 HG CYS 62 8.078 -59.892 3.540 435 H MET 63 H MET 63 7.224 -58.214 4.757 436 HA MET 63 HA MET 63 5.769 -56.590 6.736 437 HB2 MET 63 HB2 MET 63 8.345 -58.110 7.058 438 HB3 MET 63 HB3 MET 63 7.965 -56.730 8.080 439 HG2 MET 63 HG2 MET 63 5.748 -57.995 8.528 440 HG3 MET 63 HG3 MET 63 6.636 -59.396 7.935 441 HE1 MET 63 HE1 MET 63 5.595 -57.270 10.506 442 HE2 MET 63 HE2 MET 63 5.604 -58.745 11.473 443 HE3 MET 63 HE3 MET 63 6.674 -57.407 11.895 444 H ARG 64 H ARG 64 6.418 -55.832 4.074 445 HA ARG 64 HA ARG 64 8.791 -54.382 3.817 446 HB2 ARG 64 HB2 ARG 64 6.345 -54.698 2.350 447 HB3 ARG 64 HB3 ARG 64 6.778 -52.994 2.395 448 HG2 ARG 64 HG2 ARG 64 8.969 -54.855 1.756 449 HG3 ARG 64 HG3 ARG 64 7.685 -54.722 0.553 450 HD2 ARG 64 HD2 ARG 64 7.967 -52.261 0.594 451 HD3 ARG 64 HD3 ARG 64 9.323 -52.466 1.702 452 HE ARG 64 HE ARG 64 9.309 -52.946 -1.140 453 HH11 ARG 64 HH11 ARG 64 10.878 -53.622 1.894 454 HH12 ARG 64 HH12 ARG 64 12.396 -54.033 1.166 455 HH21 ARG 64 HH21 ARG 64 11.303 -53.485 -2.109 456 HH22 ARG 64 HH22 ARG 64 12.637 -53.953 -1.111 457 H GLY 65 H GLY 65 8.372 -51.811 3.262 458 HA2 GLY 65 HA2 GLY 65 6.783 -50.394 5.143 459 HA3 GLY 65 HA3 GLY 65 8.440 -50.518 5.716 460 H VAL 66 H VAL 66 6.542 -48.349 4.491 461 HA VAL 66 HA VAL 66 7.821 -47.426 2.140 462 HB VAL 66 HB VAL 66 6.151 -45.924 4.160 463 HG11 VAL 66 HG11 VAL 66 5.869 -44.238 2.393 464 HG12 VAL 66 HG12 VAL 66 7.548 -44.375 2.918 465 HG13 VAL 66 HG13 VAL 66 7.036 -45.104 1.396 466 HG21 VAL 66 HG21 VAL 66 4.572 -47.263 3.275 467 HG22 VAL 66 HG22 VAL 66 4.648 -46.140 1.918 468 HG23 VAL 66 HG23 VAL 66 5.548 -47.655 1.860 469 H ARG 67 H ARG 67 9.845 -46.735 2.003 470 HA ARG 67 HA ARG 67 11.408 -45.971 4.236 471 HB2 ARG 67 HB2 ARG 67 12.466 -46.941 2.296 472 HB3 ARG 67 HB3 ARG 67 11.874 -45.641 1.270 473 HG2 ARG 67 HG2 ARG 67 14.197 -45.283 1.719 474 HG3 ARG 67 HG3 ARG 67 13.260 -44.050 2.565 475 HD2 ARG 67 HD2 ARG 67 13.391 -45.945 4.476 476 HD3 ARG 67 HD3 ARG 67 14.908 -46.252 3.631 477 HE ARG 67 HE ARG 67 14.546 -43.482 4.197 478 HH11 ARG 67 HH11 ARG 67 15.499 -46.523 5.596 479 HH12 ARG 67 HH12 ARG 67 16.506 -45.800 6.807 480 HH21 ARG 67 HH21 ARG 67 15.868 -42.517 5.786 481 HH22 ARG 67 HH22 ARG 67 16.714 -43.521 6.914 482 H LEU 68 H LEU 68 12.039 -43.986 4.982 483 HA LEU 68 HA LEU 68 10.848 -41.623 3.697 484 HB2 LEU 68 HB2 LEU 68 9.476 -42.142 5.596 485 HB3 LEU 68 HB3 LEU 68 10.893 -42.299 6.632 486 HG LEU 68 HG LEU 68 9.420 -40.172 6.786 487 HD11 LEU 68 HD11 LEU 68 11.890 -40.730 7.599 488 HD12 LEU 68 HD12 LEU 68 11.165 -39.135 7.798 489 HD13 LEU 68 HD13 LEU 68 12.271 -39.440 6.459 490 HD21 LEU 68 HD21 LEU 68 11.203 -39.023 4.727 491 HD22 LEU 68 HD22 LEU 68 9.559 -38.577 5.186 492 HD23 LEU 68 HD23 LEU 68 9.837 -39.978 4.149 493 H VAL 69 H VAL 69 12.347 -40.195 3.153 494 HA VAL 69 HA VAL 69 14.669 -39.812 4.900 495 HB VAL 69 HB VAL 69 15.545 -41.275 3.225 496 HG11 VAL 69 HG11 VAL 69 13.701 -39.880 1.511 497 HG12 VAL 69 HG12 VAL 69 15.312 -39.922 0.792 498 HG13 VAL 69 HG13 VAL 69 14.515 -41.424 1.261 499 HG21 VAL 69 HG21 VAL 69 17.364 -40.031 2.514 500 HG22 VAL 69 HG22 VAL 69 16.391 -38.593 2.203 501 HG23 VAL 69 HG23 VAL 69 16.755 -39.069 3.861 502 H GLU 70 H GLU 70 14.920 -37.731 5.355 503 HA GLU 70 HA GLU 70 14.795 -35.462 5.262 504 HB2 GLU 70 HB2 GLU 70 14.637 -35.810 2.267 505 HB3 GLU 70 HB3 GLU 70 15.163 -34.379 3.142 506 HG2 GLU 70 HG2 GLU 70 16.765 -36.572 3.974 507 HG3 GLU 70 HG3 GLU 70 16.715 -36.550 2.212 508 H GLY 71 H GLY 71 12.347 -37.117 5.342 509 HA2 GLY 71 HA2 GLY 71 10.141 -36.410 5.710 510 HA3 GLY 71 HA3 GLY 71 10.474 -34.960 4.774 511 H ILE 72 H ILE 72 11.648 -36.623 2.583 512 HA ILE 72 HA ILE 72 9.193 -37.027 1.143 513 HB ILE 72 HB ILE 72 12.043 -37.567 0.302 514 HG12 ILE 72 HG12 ILE 72 10.841 -35.383 -1.075 515 HG13 ILE 72 HG13 ILE 72 10.586 -35.135 0.649 516 HG21 ILE 72 HG21 ILE 72 10.720 -37.192 -2.000 517 HG22 ILE 72 HG22 ILE 72 10.969 -38.779 -1.274 518 HG23 ILE 72 HG23 ILE 72 9.440 -37.933 -1.040 519 HD11 ILE 72 HD11 ILE 72 13.121 -35.231 -0.900 520 HD12 ILE 72 HD12 ILE 72 12.594 -34.092 0.339 521 HD13 ILE 72 HD13 ILE 72 13.131 -35.708 0.797 522 H LEU 73 H LEU 73 8.054 -38.839 1.117 523 HA LEU 73 HA LEU 73 9.101 -41.273 2.233 524 HB2 LEU 73 HB2 LEU 73 6.459 -40.487 1.044 525 HB3 LEU 73 HB3 LEU 73 6.811 -42.151 1.505 526 HG LEU 73 HG LEU 73 5.537 -41.091 3.246 527 HD11 LEU 73 HD11 LEU 73 7.286 -42.676 3.912 528 HD12 LEU 73 HD12 LEU 73 7.017 -41.437 5.137 529 HD13 LEU 73 HD13 LEU 73 8.424 -41.338 4.079 530 HD21 LEU 73 HD21 LEU 73 6.538 -38.763 2.528 531 HD22 LEU 73 HD22 LEU 73 7.687 -39.114 3.819 532 HD23 LEU 73 HD23 LEU 73 5.959 -39.042 4.170 533 H HIS 74 H HIS 74 10.515 -42.388 1.036 534 HA HIS 74 HA HIS 74 10.374 -42.475 -1.833 535 HB2 HIS 74 HB2 HIS 74 12.373 -42.882 0.053 536 HB3 HIS 74 HB3 HIS 74 12.087 -44.489 -0.608 537 HD1 HIS 74 HD1 HIS 74 11.860 -44.230 -3.478 538 HD2 HIS 74 HD2 HIS 74 14.347 -41.689 -1.331 539 HE1 HIS 74 HE1 HIS 74 13.521 -43.347 -5.147 540 H ALA 75 H ALA 75 9.958 -44.285 -3.129 541 HA ALA 75 HA ALA 75 8.143 -46.223 -1.894 542 HB1 ALA 75 HB1 ALA 75 7.756 -46.758 -4.427 543 HB2 ALA 75 HB2 ALA 75 7.032 -45.326 -3.693 544 HB3 ALA 75 HB3 ALA 75 8.498 -45.175 -4.662 545 HA PRO 76 HA PRO 76 10.874 -49.638 -2.267 546 HB2 PRO 76 HB2 PRO 76 9.166 -51.640 -2.932 547 HB3 PRO 76 HB3 PRO 76 9.222 -50.922 -1.318 548 HG2 PRO 76 HG2 PRO 76 7.324 -50.377 -3.567 549 HG3 PRO 76 HG3 PRO 76 6.983 -50.572 -1.838 550 HD2 PRO 76 HD2 PRO 76 7.134 -48.145 -3.028 551 HD3 PRO 76 HD3 PRO 76 7.617 -48.412 -1.341 552 H ASP 77 H ASP 77 11.109 -51.714 -3.823 553 HA ASP 77 HA ASP 77 11.785 -50.610 -6.392 554 HB2 ASP 77 HB2 ASP 77 12.544 -52.899 -4.822 555 HB3 ASP 77 HB3 ASP 77 12.118 -53.412 -6.452 556 H ALA 78 H ALA 78 8.956 -51.705 -5.165 557 HA ALA 78 HA ALA 78 8.065 -52.867 -7.720 558 HB1 ALA 78 HB1 ALA 78 6.041 -53.261 -5.849 559 HB2 ALA 78 HB2 ALA 78 7.191 -54.461 -6.440 560 HB3 ALA 78 HB3 ALA 78 7.540 -53.556 -4.967 561 H GLY 79 H GLY 79 7.588 -50.277 -5.447 562 HA2 GLY 79 HA2 GLY 79 6.705 -48.200 -6.446 563 HA3 GLY 79 HA3 GLY 79 5.476 -49.196 -7.210 564 H TRP 80 H TRP 80 4.280 -47.322 -6.036 565 HA TRP 80 HA TRP 80 3.929 -47.552 -3.217 566 HB2 TRP 80 HB2 TRP 80 2.358 -46.133 -5.369 567 HB3 TRP 80 HB3 TRP 80 1.908 -46.076 -3.667 568 HD1 TRP 80 HD1 TRP 80 3.701 -44.090 -6.082 569 HE1 TRP 80 HE1 TRP 80 5.360 -42.475 -4.957 570 HE3 TRP 80 HE3 TRP 80 3.837 -46.183 -1.420 571 HZ2 TRP 80 HZ2 TRP 80 6.567 -42.134 -2.428 572 HZ3 TRP 80 HZ3 TRP 80 5.269 -45.152 0.295 573 HH2 TRP 80 HH2 TRP 80 6.605 -43.170 -0.201 574 H GLY 81 H GLY 81 1.715 -48.284 -5.927 575 HA2 GLY 81 HA2 GLY 81 0.313 -50.131 -6.158 576 HA3 GLY 81 HA3 GLY 81 0.798 -50.668 -4.556 577 H ASN 82 H ASN 82 -1.546 -51.139 -4.408 578 HA ASN 82 HA ASN 82 -2.993 -48.750 -3.476 579 HB2 ASN 82 HB2 ASN 82 -4.180 -51.111 -4.951 580 HB3 ASN 82 HB3 ASN 82 -5.088 -49.751 -4.297 581 HD21 ASN 82 HD21 ASN 82 -2.494 -50.561 -6.552 582 HD22 ASN 82 HD22 ASN 82 -2.827 -49.285 -7.669 583 H LEU 83 H LEU 83 -1.379 -50.565 -1.938 584 HA LEU 83 HA LEU 83 -3.266 -52.235 -0.486 585 HB2 LEU 83 HB2 LEU 83 -1.199 -52.761 0.893 586 HB3 LEU 83 HB3 LEU 83 -1.206 -53.291 -0.788 587 HG LEU 83 HG LEU 83 0.944 -52.256 0.204 588 HD11 LEU 83 HD11 LEU 83 0.539 -50.784 -2.238 589 HD12 LEU 83 HD12 LEU 83 -0.129 -52.411 -2.363 590 HD13 LEU 83 HD13 LEU 83 1.564 -52.185 -1.925 591 HD21 LEU 83 HD21 LEU 83 1.112 -49.863 0.088 592 HD22 LEU 83 HD22 LEU 83 -0.224 -50.283 1.160 593 HD23 LEU 83 HD23 LEU 83 -0.551 -49.730 -0.483 594 H VAL 84 H VAL 84 -2.591 -52.144 2.067 595 HA VAL 84 HA VAL 84 -3.432 -49.468 2.881 596 HB VAL 84 HB VAL 84 -3.149 -51.837 4.711 597 HG11 VAL 84 HG11 VAL 84 -5.333 -50.415 5.492 598 HG12 VAL 84 HG12 VAL 84 -3.706 -50.194 6.137 599 HG13 VAL 84 HG13 VAL 84 -4.296 -49.142 4.850 600 HG21 VAL 84 HG21 VAL 84 -5.792 -51.813 4.131 601 HG22 VAL 84 HG22 VAL 84 -5.106 -51.401 2.559 602 HG23 VAL 84 HG23 VAL 84 -4.621 -52.890 3.370 603 H TYR 85 H TYR 85 -2.468 -48.491 4.814 604 HA TYR 85 HA TYR 85 0.335 -49.247 5.252 605 HB2 TYR 85 HB2 TYR 85 1.184 -47.226 4.655 606 HB3 TYR 85 HB3 TYR 85 -0.261 -47.158 3.653 607 HD1 TYR 85 HD1 TYR 85 -1.957 -45.547 4.054 608 HD2 TYR 85 HD2 TYR 85 1.216 -46.027 6.848 609 HE1 TYR 85 HE1 TYR 85 -2.655 -43.482 5.194 610 HE2 TYR 85 HE2 TYR 85 0.526 -43.964 7.996 611 HH TYR 85 HH TYR 85 -2.453 -42.386 7.307 612 H VAL 86 H VAL 86 1.163 -48.775 7.290 613 HA VAL 86 HA VAL 86 -0.869 -48.067 9.299 614 HB VAL 86 HB VAL 86 1.685 -49.634 9.683 615 HG11 VAL 86 HG11 VAL 86 0.042 -50.136 11.825 616 HG12 VAL 86 HG12 VAL 86 1.416 -49.028 11.819 617 HG13 VAL 86 HG13 VAL 86 -0.213 -48.416 11.531 618 HG21 VAL 86 HG21 VAL 86 -1.156 -50.636 9.741 619 HG22 VAL 86 HG22 VAL 86 -0.085 -50.788 8.349 620 HG23 VAL 86 HG23 VAL 86 0.321 -51.592 9.865 621 H VAL 87 H VAL 87 -0.684 -46.123 10.176 622 HA VAL 87 HA VAL 87 1.431 -44.354 9.727 623 HB VAL 87 HB VAL 87 0.453 -43.058 11.680 624 HG11 VAL 87 HG11 VAL 87 -1.279 -43.922 9.373 625 HG12 VAL 87 HG12 VAL 87 -1.680 -42.583 10.449 626 HG13 VAL 87 HG13 VAL 87 -0.221 -42.515 9.461 627 HG21 VAL 87 HG21 VAL 87 -1.532 -43.789 12.718 628 HG22 VAL 87 HG22 VAL 87 -1.738 -45.116 11.574 629 HG23 VAL 87 HG23 VAL 87 -0.441 -45.174 12.768 630 H ASN 88 H ASN 88 2.872 -43.377 11.334 631 HA ASN 88 HA ASN 88 3.581 -45.069 13.601 632 HB2 ASN 88 HB2 ASN 88 4.903 -45.818 11.568 633 HB3 ASN 88 HB3 ASN 88 5.684 -44.240 11.598 634 HD21 ASN 88 HD21 ASN 88 7.700 -44.734 12.183 635 HD22 ASN 88 HD22 ASN 88 8.135 -45.561 13.636 636 H TYR 89 H TYR 89 3.712 -43.765 15.292 637 HA TYR 89 HA TYR 89 4.745 -41.034 14.887 638 HB2 TYR 89 HB2 TYR 89 2.861 -41.863 17.092 639 HB3 TYR 89 HB3 TYR 89 3.276 -40.231 16.578 640 HD1 TYR 89 HD1 TYR 89 1.147 -43.110 15.993 641 HD2 TYR 89 HD2 TYR 89 2.381 -39.345 14.440 642 HE1 TYR 89 HE1 TYR 89 -0.807 -43.091 14.500 643 HE2 TYR 89 HE2 TYR 89 0.430 -39.316 12.944 644 HH TYR 89 HH TYR 89 -1.132 -40.879 11.926 645 HA PRO 90 HA PRO 90 7.590 -43.358 17.764 646 HB2 PRO 90 HB2 PRO 90 9.874 -42.650 16.479 647 HB3 PRO 90 HB3 PRO 90 8.926 -44.075 16.038 648 HG2 PRO 90 HG2 PRO 90 8.969 -41.364 14.770 649 HG3 PRO 90 HG3 PRO 90 8.953 -42.960 13.998 650 HD2 PRO 90 HD2 PRO 90 6.727 -41.438 14.247 651 HD3 PRO 90 HD3 PRO 90 6.680 -43.213 14.282 652 H LYS 91 H LYS 91 8.239 -40.227 16.179 653 HA LYS 91 HA LYS 91 8.634 -39.041 18.833 654 HB2 LYS 91 HB2 LYS 91 10.611 -39.258 16.659 655 HB3 LYS 91 HB3 LYS 91 10.451 -37.649 17.351 656 HG2 LYS 91 HG2 LYS 91 11.653 -38.238 19.111 657 HG3 LYS 91 HG3 LYS 91 10.567 -39.587 19.453 658 HD2 LYS 91 HD2 LYS 91 12.473 -40.770 19.078 659 HD3 LYS 91 HD3 LYS 91 11.903 -40.657 17.412 660 HE2 LYS 91 HE2 LYS 91 13.687 -39.471 16.810 661 HE3 LYS 91 HE3 LYS 91 13.443 -38.329 18.131 662 HZ1 LYS 91 HZ1 LYS 91 14.449 -40.306 19.510 663 HZ2 LYS 91 HZ2 LYS 91 15.446 -39.194 18.715 664 HZ3 LYS 91 HZ3 LYS 91 15.144 -40.707 18.020 665 H ASP 92 H ASP 92 8.892 -36.531 18.502 666 HA ASP 92 HA ASP 92 6.659 -35.714 16.777 667 HB2 ASP 92 HB2 ASP 92 6.752 -33.615 18.260 668 HB3 ASP 92 HB3 ASP 92 6.160 -35.104 18.991 669 H ASN 93 H ASN 93 6.957 -33.152 16.336 670 HA ASN 93 HA ASN 93 9.553 -32.229 15.730 671 HB2 ASN 93 HB2 ASN 93 9.490 -33.988 14.023 672 HB3 ASN 93 HB3 ASN 93 7.988 -33.327 13.384 673 HD21 ASN 93 HD21 ASN 93 11.419 -32.906 13.663 674 HD22 ASN 93 HD22 ASN 93 11.572 -31.672 12.463 675 H LYS 94 H LYS 94 9.545 -30.159 14.672 676 HA LYS 94 HA LYS 94 7.046 -28.917 13.976 677 HB2 LYS 94 HB2 LYS 94 7.714 -28.861 16.660 678 HB3 LYS 94 HB3 LYS 94 8.307 -27.315 16.067 679 HG2 LYS 94 HG2 LYS 94 5.690 -27.793 15.020 680 HG3 LYS 94 HG3 LYS 94 5.679 -28.007 16.772 681 HD2 LYS 94 HD2 LYS 94 6.355 -25.822 17.170 682 HD3 LYS 94 HD3 LYS 94 7.027 -25.630 15.549 683 HE2 LYS 94 HE2 LYS 94 4.541 -25.973 14.807 684 HE3 LYS 94 HE3 LYS 94 4.188 -25.482 16.463 685 HZ1 LYS 94 HZ1 LYS 94 4.180 -23.486 15.362 686 HZ2 LYS 94 HZ2 LYS 94 5.409 -23.928 14.287 687 HZ3 LYS 94 HZ3 LYS 94 5.787 -23.541 15.890 688 H ARG 95 H ARG 95 7.488 -26.416 13.718 689 HA ARG 95 HA ARG 95 10.214 -25.804 12.955 690 HB2 ARG 95 HB2 ARG 95 8.347 -26.762 11.025 691 HB3 ARG 95 HB3 ARG 95 8.637 -25.058 10.704 692 HG2 ARG 95 HG2 ARG 95 11.157 -26.160 11.192 693 HG3 ARG 95 HG3 ARG 95 10.311 -27.327 10.172 694 HD2 ARG 95 HD2 ARG 95 9.776 -25.533 8.585 695 HD3 ARG 95 HD3 ARG 95 10.645 -24.384 9.601 696 HE ARG 95 HE ARG 95 12.310 -26.566 8.888 697 HH11 ARG 95 HH11 ARG 95 10.901 -23.643 7.627 698 HH12 ARG 95 HH12 ARG 95 12.156 -23.386 6.461 699 HH21 ARG 95 HH21 ARG 95 13.968 -26.239 7.356 700 HH22 ARG 95 HH22 ARG 95 13.900 -24.864 6.307 701 H LYS 96 H LYS 96 10.061 -23.525 11.690 702 HA LYS 96 HA LYS 96 7.986 -21.755 12.373 703 HB2 LYS 96 HB2 LYS 96 9.372 -22.378 14.611 704 HB3 LYS 96 HB3 LYS 96 10.320 -21.013 14.034 705 HG2 LYS 96 HG2 LYS 96 7.829 -20.007 13.797 706 HG3 LYS 96 HG3 LYS 96 7.610 -21.094 15.170 707 HD2 LYS 96 HD2 LYS 96 10.018 -19.370 15.196 708 HD3 LYS 96 HD3 LYS 96 8.462 -18.571 15.431 709 HE2 LYS 96 HE2 LYS 96 8.573 -19.174 17.569 710 HE3 LYS 96 HE3 LYS 96 8.357 -20.843 17.041 711 HZ1 LYS 96 HZ1 LYS 96 10.899 -19.425 17.587 712 HZ2 LYS 96 HZ2 LYS 96 10.840 -20.896 16.755 713 HZ3 LYS 96 HZ3 LYS 96 10.291 -20.806 18.353 714 H MET 97 H MET 97 8.620 -19.447 12.007 715 HA MET 97 HA MET 97 11.095 -18.729 10.890 716 HB2 MET 97 HB2 MET 97 10.560 -20.154 9.038 717 HB3 MET 97 HB3 MET 97 8.940 -19.481 8.915 718 HG2 MET 97 HG2 MET 97 9.890 -17.328 8.250 719 HG3 MET 97 HG3 MET 97 11.508 -18.015 8.360 720 HE1 MET 97 HE1 MET 97 8.285 -19.956 6.766 721 HE2 MET 97 HE2 MET 97 8.063 -18.207 6.775 722 HE3 MET 97 HE3 MET 97 8.298 -19.058 5.248 723 H ASP 98 H ASP 98 11.219 -16.537 10.471 724 HA ASP 98 HA ASP 98 8.987 -14.861 10.035 725 HB2 ASP 98 HB2 ASP 98 9.196 -15.652 12.684 726 HB3 ASP 98 HB3 ASP 98 9.979 -14.074 12.664 727 H GLU 99 H GLU 99 9.624 -12.479 10.455 728 HA GLU 99 HA GLU 99 12.306 -11.717 10.721 729 HB2 GLU 99 HB2 GLU 99 11.976 -12.990 8.333 730 HB3 GLU 99 HB3 GLU 99 11.671 -11.322 7.871 731 HG2 GLU 99 HG2 GLU 99 13.818 -10.637 8.643 732 HG3 GLU 99 HG3 GLU 99 14.117 -12.212 9.375 733 H THR 100 H THR 100 12.581 -9.482 10.617 734 HA THR 100 HA THR 100 10.620 -7.733 9.508 735 HB THR 100 HB THR 100 10.570 -7.007 12.275 736 HG1 THR 100 HG1 THR 100 9.349 -9.524 11.858 737 HG21 THR 100 HG21 THR 100 8.053 -7.499 11.830 738 HG22 THR 100 HG22 THR 100 8.579 -7.750 10.166 739 HG23 THR 100 HG23 THR 100 8.848 -6.194 10.950 740 H ASP 101 H ASP 101 10.992 -5.418 10.657 741 HA ASP 101 HA ASP 101 13.706 -4.962 11.494 742 HB2 ASP 101 HB2 ASP 101 12.831 -4.396 8.694 743 HB3 ASP 101 HB3 ASP 101 13.926 -3.261 9.478 744 H ALA 102 H ALA 102 14.125 -2.530 11.667 745 HA ALA 102 HA ALA 102 12.013 -0.678 11.670 746 HB1 ALA 102 HB1 ALA 102 12.486 -0.994 14.495 747 HB2 ALA 102 HB2 ALA 102 10.962 -0.945 13.609 748 HB3 ALA 102 HB3 ALA 102 11.823 -2.472 13.797 749 H SER 103 H SER 103 12.607 1.185 13.378 750 HA SER 103 HA SER 103 15.282 1.548 14.134 751 HB2 SER 103 HB2 SER 103 14.710 2.070 11.323 752 HB3 SER 103 HB3 SER 103 15.359 3.488 12.146 753 HG SER 103 HG SER 103 16.516 0.914 11.921 754 H SER 104 H SER 104 15.763 3.946 14.533 755 HA SER 104 HA SER 104 13.731 5.871 14.597 756 HB2 SER 104 HB2 SER 104 13.171 3.929 16.439 757 HB3 SER 104 HB3 SER 104 14.087 5.080 17.412 758 HG SER 104 HG SER 104 12.535 6.524 17.197 759 H ALA 105 H ALA 105 14.280 7.513 16.553 760 HA ALA 105 HA ALA 105 17.104 7.630 17.155 761 HB1 ALA 105 HB1 ALA 105 16.153 8.875 14.803 762 HB2 ALA 105 HB2 ALA 105 16.529 10.151 15.961 763 HB3 ALA 105 HB3 ALA 105 17.763 8.971 15.518 764 H VAL 106 H VAL 106 17.591 9.046 18.822 765 HA VAL 106 HA VAL 106 15.307 10.493 19.997 766 HB VAL 106 HB VAL 106 16.364 9.993 22.242 767 HG11 VAL 106 HG11 VAL 106 15.546 7.509 22.117 768 HG12 VAL 106 HG12 VAL 106 14.403 8.838 21.909 769 HG13 VAL 106 HG13 VAL 106 15.024 7.978 20.500 770 HG21 VAL 106 HG21 VAL 106 18.134 8.621 22.474 771 HG22 VAL 106 HG22 VAL 106 17.620 7.564 21.159 772 HG23 VAL 106 HG23 VAL 106 18.462 9.071 20.800 773 H LYS 107 H LYS 107 16.172 12.048 21.783 774 HA LYS 107 HA LYS 107 18.722 13.261 21.027 775 HB2 LYS 107 HB2 LYS 107 16.614 14.278 19.820 776 HB3 LYS 107 HB3 LYS 107 16.366 15.073 21.369 777 HG2 LYS 107 HG2 LYS 107 18.720 15.936 21.182 778 HG3 LYS 107 HG3 LYS 107 18.726 15.326 19.525 779 HD2 LYS 107 HD2 LYS 107 16.827 16.746 18.977 780 HD3 LYS 107 HD3 LYS 107 16.754 17.320 20.644 781 HE2 LYS 107 HE2 LYS 107 19.287 17.931 20.138 782 HE3 LYS 107 HE3 LYS 107 18.684 17.975 18.482 783 HZ1 LYS 107 HZ1 LYS 107 17.098 19.375 20.481 784 HZ2 LYS 107 HZ2 LYS 107 17.449 19.804 18.883 785 HZ3 LYS 107 HZ3 LYS 107 18.596 20.062 20.100 786 H VAL 108 H VAL 108 19.592 14.679 22.622 787 HA VAL 108 HA VAL 108 18.355 14.364 25.280 788 HB VAL 108 HB VAL 108 20.586 14.372 26.263 789 HG11 VAL 108 HG11 VAL 108 20.723 12.314 24.099 790 HG12 VAL 108 HG12 VAL 108 21.100 12.162 25.816 791 HG13 VAL 108 HG13 VAL 108 19.420 12.265 25.286 792 HG21 VAL 108 HG21 VAL 108 22.579 14.186 24.807 793 HG22 VAL 108 HG22 VAL 108 21.555 14.515 23.409 794 HG23 VAL 108 HG23 VAL 108 21.761 15.742 24.659 795 H LYS 109 H LYS 109 19.533 16.037 26.847 796 HA LYS 109 HA LYS 109 19.879 18.628 25.554 797 HB2 LYS 109 HB2 LYS 109 18.250 19.706 27.067 798 HB3 LYS 109 HB3 LYS 109 17.490 18.554 25.976 799 HG2 LYS 109 HG2 LYS 109 16.938 17.117 27.651 800 HG3 LYS 109 HG3 LYS 109 18.316 17.579 28.653 801 HD2 LYS 109 HD2 LYS 109 17.250 19.568 29.365 802 HD3 LYS 109 HD3 LYS 109 16.000 19.428 28.127 803 HE2 LYS 109 HE2 LYS 109 14.986 17.595 29.228 804 HE3 LYS 109 HE3 LYS 109 16.368 17.383 30.302 805 HZ1 LYS 109 HZ1 LYS 109 14.232 18.581 31.130 806 HZ2 LYS 109 HZ2 LYS 109 14.900 19.926 30.351 807 HZ3 LYS 109 HZ3 LYS 109 15.755 19.155 31.591 808 H ARG 110 H ARG 110 20.085 20.312 27.571 809 HA ARG 110 HA ARG 110 21.963 19.074 29.474 810 HB2 ARG 110 HB2 ARG 110 23.456 20.913 29.275 811 HB3 ARG 110 HB3 ARG 110 23.069 20.408 27.636 812 HG2 ARG 110 HG2 ARG 110 21.495 22.242 27.416 813 HG3 ARG 110 HG3 ARG 110 21.813 22.732 29.082 814 HD2 ARG 110 HD2 ARG 110 23.403 24.060 28.260 815 HD3 ARG 110 HD3 ARG 110 24.328 22.594 27.938 816 HE ARG 110 HE ARG 110 22.476 23.290 25.849 817 HH11 ARG 110 HH11 ARG 110 25.685 23.758 27.115 818 HH12 ARG 110 HH12 ARG 110 26.361 24.219 25.588 819 HH21 ARG 110 HH21 ARG 110 23.354 23.894 23.833 820 HH22 ARG 110 HH22 ARG 110 25.034 24.297 23.722 821 H ALA 111 H ALA 111 22.474 20.823 31.271 822 HA ALA 111 HA ALA 111 20.214 22.468 31.993 823 HB1 ALA 111 HB1 ALA 111 20.680 20.752 34.248 824 HB2 ALA 111 HB2 ALA 111 19.172 21.107 33.404 825 HB3 ALA 111 HB3 ALA 111 20.212 19.799 32.840 826 H VAL 112 H VAL 112 20.740 24.044 33.455 827 HA VAL 112 HA VAL 112 23.546 24.077 34.351 828 HB VAL 112 HB VAL 112 22.882 25.881 32.771 829 HG11 VAL 112 HG11 VAL 112 20.529 25.991 33.894 830 HG12 VAL 112 HG12 VAL 112 21.310 27.157 34.965 831 HG13 VAL 112 HG13 VAL 112 21.258 27.451 33.226 832 HG21 VAL 112 HG21 VAL 112 24.710 26.148 34.426 833 HG22 VAL 112 HG22 VAL 112 23.936 27.672 33.990 834 HG23 VAL 112 HG23 VAL 112 23.556 26.898 35.529 835 H GLN 113 H GLN 113 24.042 24.850 36.438 836 HA GLN 113 HA GLN 113 21.927 25.444 38.305 837 HB2 GLN 113 HB2 GLN 113 23.271 22.790 38.234 838 HB3 GLN 113 HB3 GLN 113 22.977 23.509 39.812 839 HG2 GLN 113 HG2 GLN 113 20.928 22.688 39.733 840 HG3 GLN 113 HG3 GLN 113 20.583 23.805 38.414 841 HE21 GLN 113 HE21 GLN 113 22.397 20.773 38.794 842 HE22 GLN 113 HE22 GLN 113 21.677 19.976 37.442 843 H LYS 114 H LYS 114 22.765 27.174 39.258 844 HA LYS 114 HA LYS 114 25.502 27.767 39.443 845 HB2 LYS 114 HB2 LYS 114 23.516 29.365 39.609 846 HB3 LYS 114 HB3 LYS 114 23.389 28.866 41.290 847 HG2 LYS 114 HG2 LYS 114 26.088 29.655 40.556 848 HG3 LYS 114 HG3 LYS 114 24.904 30.943 40.321 849 HD2 LYS 114 HD2 LYS 114 24.087 30.347 42.683 850 HD3 LYS 114 HD3 LYS 114 25.613 29.473 42.842 851 HE2 LYS 114 HE2 LYS 114 26.381 31.911 41.812 852 HE3 LYS 114 HE3 LYS 114 25.074 32.336 42.917 853 HZ1 LYS 114 HZ1 LYS 114 26.676 32.264 44.456 854 HZ2 LYS 114 HZ2 LYS 114 27.725 31.352 43.492 855 HZ3 LYS 114 HZ3 LYS 114 26.501 30.583 44.372 Start of MODEL 8 1 H1 MET 1 H MET 1 1.390 -43.970 21.241 2 HA MET 1 HA MET 1 0.751 -45.175 18.866 3 HB2 MET 1 HB2 MET 1 -1.496 -43.403 19.835 4 HB3 MET 1 HB3 MET 1 -1.309 -43.929 18.168 5 HG2 MET 1 HG2 MET 1 -1.779 -46.147 18.684 6 HG3 MET 1 HG3 MET 1 -1.456 -45.913 20.400 7 HE1 MET 1 HE1 MET 1 -4.950 -44.708 17.872 8 HE2 MET 1 HE2 MET 1 -3.504 -45.637 17.474 9 HE3 MET 1 HE3 MET 1 -4.888 -46.436 18.222 10 H ALA 2 H ALA 2 0.766 -42.107 20.596 11 HA ALA 2 HA ALA 2 1.529 -40.569 18.290 12 HB1 ALA 2 HB1 ALA 2 0.297 -39.839 20.499 13 HB2 ALA 2 HB2 ALA 2 1.946 -39.549 21.054 14 HB3 ALA 2 HB3 ALA 2 1.339 -38.719 19.621 15 H GLY 3 H GLY 3 3.547 -39.151 18.452 16 HA2 GLY 3 HA2 GLY 3 5.813 -40.938 18.887 17 HA3 GLY 3 HA3 GLY 3 5.842 -39.413 18.012 18 H SER 4 H SER 4 7.331 -38.199 18.992 19 HA SER 4 HA SER 4 6.919 -37.529 21.799 20 HB2 SER 4 HB2 SER 4 9.758 -37.981 21.105 21 HB3 SER 4 HB3 SER 4 8.896 -38.313 22.607 22 HG SER 4 HG SER 4 9.545 -40.009 20.656 23 H HIS 5 H HIS 5 9.055 -35.949 22.277 24 HA HIS 5 HA HIS 5 8.911 -33.923 20.140 25 HB2 HIS 5 HB2 HIS 5 9.286 -32.261 22.027 26 HB3 HIS 5 HB3 HIS 5 7.711 -33.049 21.990 27 HD1 HIS 5 HD1 HIS 5 7.314 -34.943 23.800 28 HD2 HIS 5 HD2 HIS 5 10.755 -32.672 24.315 29 HE1 HIS 5 HE1 HIS 5 8.066 -35.386 26.159 30 H HIS 6 H HIS 6 10.866 -35.844 20.005 31 HA HIS 6 HA HIS 6 13.278 -35.197 21.308 32 HB2 HIS 6 HB2 HIS 6 12.542 -37.287 19.850 33 HB3 HIS 6 HB3 HIS 6 13.331 -36.375 18.567 34 HD1 HIS 6 HD1 HIS 6 15.340 -37.896 18.306 35 HD2 HIS 6 HD2 HIS 6 14.812 -36.545 22.199 36 HE1 HIS 6 HE1 HIS 6 17.431 -38.557 19.536 37 H HIS 7 H HIS 7 15.288 -34.541 20.003 38 HA HIS 7 HA HIS 7 15.074 -32.847 17.771 39 HB2 HIS 7 HB2 HIS 7 14.075 -31.599 19.998 40 HB3 HIS 7 HB3 HIS 7 15.755 -31.068 20.008 41 HD1 HIS 7 HD1 HIS 7 13.275 -31.484 17.144 42 HD2 HIS 7 HD2 HIS 7 15.778 -28.636 18.842 43 HE1 HIS 7 HE1 HIS 7 13.072 -29.451 15.678 44 H HIS 8 H HIS 8 17.054 -32.488 16.923 45 HA HIS 8 HA HIS 8 19.418 -32.452 18.588 46 HB2 HIS 8 HB2 HIS 8 18.585 -34.851 17.139 47 HB3 HIS 8 HB3 HIS 8 20.210 -34.322 16.712 48 HD1 HIS 8 HD1 HIS 8 18.836 -36.684 18.773 49 HD2 HIS 8 HD2 HIS 8 21.486 -33.573 19.524 50 HE1 HIS 8 HE1 HIS 8 20.038 -37.320 20.889 51 H HIS 9 H HIS 9 21.296 -31.735 17.476 52 HA HIS 9 HA HIS 9 20.801 -30.682 14.772 53 HB2 HIS 9 HB2 HIS 9 21.666 -29.253 17.224 54 HB3 HIS 9 HB3 HIS 9 22.486 -28.816 15.728 55 HD1 HIS 9 HD1 HIS 9 20.783 -28.095 13.716 56 HD2 HIS 9 HD2 HIS 9 19.288 -27.999 17.592 57 HE1 HIS 9 HE1 HIS 9 18.731 -26.644 13.610 58 H HIS 10 H HIS 10 22.093 -31.832 13.486 59 HA HIS 10 HA HIS 10 24.910 -32.143 14.285 60 HB2 HIS 10 HB2 HIS 10 22.983 -34.186 13.636 61 HB3 HIS 10 HB3 HIS 10 24.307 -34.213 12.475 62 HD1 HIS 10 HD1 HIS 10 26.774 -33.916 13.959 63 HD2 HIS 10 HD2 HIS 10 23.530 -35.893 15.641 64 HE1 HIS 10 HE1 HIS 10 27.738 -35.367 15.772 65 H GLY 11 H GLY 11 26.461 -31.961 12.652 66 HA2 GLY 11 HA2 GLY 11 25.522 -30.480 10.308 67 HA3 GLY 11 HA3 GLY 11 27.176 -30.543 10.899 68 H SER 12 H SER 12 28.489 -31.541 9.541 69 HA SER 12 HA SER 12 29.299 -32.958 7.956 70 HB2 SER 12 HB2 SER 12 27.366 -35.117 8.482 71 HB3 SER 12 HB3 SER 12 29.129 -35.144 8.527 72 HG SER 12 HG SER 12 27.529 -35.145 10.574 73 H MET 13 H MET 13 28.305 -34.759 6.244 74 HA MET 13 HA MET 13 26.820 -33.148 4.421 75 HB2 MET 13 HB2 MET 13 28.570 -35.088 4.017 76 HB3 MET 13 HB3 MET 13 27.126 -36.091 4.015 77 HG2 MET 13 HG2 MET 13 26.510 -35.400 1.990 78 HG3 MET 13 HG3 MET 13 26.872 -33.714 2.356 79 HE1 MET 13 HE1 MET 13 30.343 -33.482 2.515 80 HE2 MET 13 HE2 MET 13 29.954 -32.834 0.922 81 HE3 MET 13 HE3 MET 13 28.827 -32.617 2.261 82 H SER 14 H SER 14 24.739 -32.728 4.835 83 HA SER 14 HA SER 14 22.914 -34.995 5.101 84 HB2 SER 14 HB2 SER 14 21.695 -33.962 6.946 85 HB3 SER 14 HB3 SER 14 23.380 -34.207 7.406 86 HG SER 14 HG SER 14 21.974 -31.919 7.286 87 H GLU 15 H GLU 15 20.852 -34.631 4.288 88 HA GLU 15 HA GLU 15 20.568 -32.142 2.740 89 HB2 GLU 15 HB2 GLU 15 20.392 -34.830 1.938 90 HB3 GLU 15 HB3 GLU 15 18.741 -34.226 1.937 91 HG2 GLU 15 HG2 GLU 15 19.652 -32.255 0.595 92 HG3 GLU 15 HG3 GLU 15 21.092 -33.245 0.362 93 H TYR 16 H TYR 16 17.926 -32.211 2.113 94 HA TYR 16 HA TYR 16 16.497 -32.287 4.678 95 HB2 TYR 16 HB2 TYR 16 15.349 -30.116 3.809 96 HB3 TYR 16 HB3 TYR 16 16.925 -30.003 4.586 97 HD1 TYR 16 HD1 TYR 16 18.726 -29.012 3.469 98 HD2 TYR 16 HD2 TYR 16 15.288 -30.180 1.251 99 HE1 TYR 16 HE1 TYR 16 19.628 -27.874 1.483 100 HE2 TYR 16 HE2 TYR 16 16.180 -29.046 -0.741 101 HH TYR 16 HH TYR 16 19.138 -27.131 -0.594 102 H ILE 17 H ILE 17 14.047 -31.647 4.114 103 HA ILE 17 HA ILE 17 13.275 -33.273 1.780 104 HB ILE 17 HB ILE 17 12.681 -34.609 3.613 105 HG12 ILE 17 HG12 ILE 17 10.209 -32.971 3.013 106 HG13 ILE 17 HG13 ILE 17 10.845 -34.241 1.974 107 HG21 ILE 17 HG21 ILE 17 12.208 -32.026 4.938 108 HG22 ILE 17 HG22 ILE 17 11.108 -33.325 5.397 109 HG23 ILE 17 HG23 ILE 17 12.849 -33.536 5.585 110 HD11 ILE 17 HD11 ILE 17 9.164 -35.309 3.136 111 HD12 ILE 17 HD12 ILE 17 10.603 -35.738 4.062 112 HD13 ILE 17 HD13 ILE 17 9.528 -34.466 4.642 113 H ARG 18 H ARG 18 12.052 -32.269 0.328 114 HA ARG 18 HA ARG 18 10.612 -29.835 1.158 115 HB2 ARG 18 HB2 ARG 18 12.422 -30.362 -1.076 116 HB3 ARG 18 HB3 ARG 18 10.897 -29.649 -1.583 117 HG2 ARG 18 HG2 ARG 18 11.659 -28.154 0.628 118 HG3 ARG 18 HG3 ARG 18 13.155 -28.431 -0.266 119 HD2 ARG 18 HD2 ARG 18 10.711 -27.592 -1.752 120 HD3 ARG 18 HD3 ARG 18 11.602 -26.386 -0.824 121 HE ARG 18 HE ARG 18 13.477 -27.712 -2.349 122 HH11 ARG 18 HH11 ARG 18 10.617 -25.813 -2.925 123 HH12 ARG 18 HH12 ARG 18 11.170 -25.205 -4.450 124 HH21 ARG 18 HH21 ARG 18 14.216 -26.919 -4.356 125 HH22 ARG 18 HH22 ARG 18 13.216 -25.835 -5.264 126 H VAL 19 H VAL 19 8.542 -30.422 1.404 127 HA VAL 19 HA VAL 19 7.138 -31.493 -0.909 128 HB VAL 19 HB VAL 19 5.895 -33.125 0.588 129 HG11 VAL 19 HG11 VAL 19 8.018 -33.472 -1.031 130 HG12 VAL 19 HG12 VAL 19 8.675 -34.101 0.481 131 HG13 VAL 19 HG13 VAL 19 7.199 -34.792 -0.196 132 HG21 VAL 19 HG21 VAL 19 6.777 -32.118 2.709 133 HG22 VAL 19 HG22 VAL 19 6.918 -33.873 2.608 134 HG23 VAL 19 HG23 VAL 19 8.334 -32.857 2.336 135 H THR 20 H THR 20 4.916 -31.047 -0.919 136 HA THR 20 HA THR 20 4.039 -29.150 1.160 137 HB THR 20 HB THR 20 4.176 -27.823 -0.748 138 HG1 THR 20 HG1 THR 20 1.867 -27.752 -1.521 139 HG21 THR 20 HG21 THR 20 2.877 -28.914 -2.881 140 HG22 THR 20 HG22 THR 20 3.619 -30.340 -2.155 141 HG23 THR 20 HG23 THR 20 4.621 -28.970 -2.634 142 H GLU 21 H GLU 21 1.862 -29.210 1.815 143 HA GLU 21 HA GLU 21 0.713 -31.827 1.839 144 HB2 GLU 21 HB2 GLU 21 0.620 -30.089 3.705 145 HB3 GLU 21 HB3 GLU 21 -0.632 -29.293 2.763 146 HG2 GLU 21 HG2 GLU 21 -1.349 -32.010 2.935 147 HG3 GLU 21 HG3 GLU 21 -0.852 -31.503 4.549 148 H ASP 22 H ASP 22 -0.319 -28.705 0.481 149 HA ASP 22 HA ASP 22 -2.286 -30.145 -1.165 150 HB2 ASP 22 HB2 ASP 22 -2.206 -27.430 0.037 151 HB3 ASP 22 HB3 ASP 22 -2.967 -27.575 -1.545 152 H GLU 23 H GLU 23 -2.431 -29.735 -3.392 153 HA GLU 23 HA GLU 23 0.029 -29.418 -4.725 154 HB2 GLU 23 HB2 GLU 23 -1.397 -29.331 -6.798 155 HB3 GLU 23 HB3 GLU 23 -1.659 -30.733 -5.770 156 HG2 GLU 23 HG2 GLU 23 -3.439 -28.655 -4.973 157 HG3 GLU 23 HG3 GLU 23 -3.555 -28.881 -6.717 158 H ASN 24 H ASN 24 -2.584 -27.188 -4.010 159 HA ASN 24 HA ASN 24 -1.626 -25.092 -5.701 160 HB2 ASN 24 HB2 ASN 24 -3.995 -25.563 -4.459 161 HB3 ASN 24 HB3 ASN 24 -3.298 -24.360 -3.377 162 HD21 ASN 24 HD21 ASN 24 -5.599 -24.143 -5.125 163 HD22 ASN 24 HD22 ASN 24 -5.273 -22.830 -6.199 164 H ASP 25 H ASP 25 -0.995 -26.128 -2.447 165 HA ASP 25 HA ASP 25 0.219 -23.676 -1.586 166 HB2 ASP 25 HB2 ASP 25 0.071 -26.461 -0.464 167 HB3 ASP 25 HB3 ASP 25 1.129 -25.254 0.262 168 H GLU 26 H GLU 26 2.464 -23.377 -1.101 169 HA GLU 26 HA GLU 26 4.171 -24.403 -3.178 170 HB2 GLU 26 HB2 GLU 26 4.643 -22.487 -0.896 171 HB3 GLU 26 HB3 GLU 26 5.903 -22.955 -2.029 172 HG2 GLU 26 HG2 GLU 26 4.748 -21.963 -3.852 173 HG3 GLU 26 HG3 GLU 26 3.303 -21.709 -2.875 174 HA PRO 27 HA PRO 27 6.112 -27.702 -1.031 175 HB2 PRO 27 HB2 PRO 27 8.618 -27.595 -2.070 176 HB3 PRO 27 HB3 PRO 27 7.220 -28.163 -2.990 177 HG2 PRO 27 HG2 PRO 27 8.547 -25.480 -3.024 178 HG3 PRO 27 HG3 PRO 27 7.955 -26.452 -4.383 179 HD2 PRO 27 HD2 PRO 27 6.560 -24.365 -3.368 180 HD3 PRO 27 HD3 PRO 27 5.769 -25.793 -4.065 181 H ILE 28 H ILE 28 6.256 -27.211 1.122 182 HA ILE 28 HA ILE 28 8.057 -25.235 2.146 183 HB ILE 28 HB ILE 28 6.037 -25.672 3.374 184 HG12 ILE 28 HG12 ILE 28 6.953 -26.076 5.615 185 HG13 ILE 28 HG13 ILE 28 8.417 -26.746 4.904 186 HG21 ILE 28 HG21 ILE 28 5.692 -27.860 4.514 187 HG22 ILE 28 HG22 ILE 28 5.594 -27.942 2.756 188 HG23 ILE 28 HG23 ILE 28 7.046 -28.502 3.585 189 HD11 ILE 28 HD11 ILE 28 7.799 -24.070 3.945 190 HD12 ILE 28 HD12 ILE 28 8.059 -24.155 5.688 191 HD13 ILE 28 HD13 ILE 28 9.304 -24.733 4.581 192 H GLU 29 H GLU 29 10.104 -25.457 2.805 193 HA GLU 29 HA GLU 29 11.327 -28.108 2.594 194 HB2 GLU 29 HB2 GLU 29 13.477 -26.858 2.614 195 HB3 GLU 29 HB3 GLU 29 12.416 -26.403 1.289 196 HG2 GLU 29 HG2 GLU 29 12.563 -24.289 1.901 197 HG3 GLU 29 HG3 GLU 29 11.834 -24.689 3.456 198 H ILE 30 H ILE 30 11.903 -29.228 4.334 199 HA ILE 30 HA ILE 30 12.263 -27.791 6.880 200 HB ILE 30 HB ILE 30 11.425 -30.199 7.759 201 HG12 ILE 30 HG12 ILE 30 9.453 -29.709 5.570 202 HG13 ILE 30 HG13 ILE 30 10.921 -30.602 5.187 203 HG21 ILE 30 HG21 ILE 30 9.727 -29.024 8.673 204 HG22 ILE 30 HG22 ILE 30 10.602 -27.653 7.995 205 HG23 ILE 30 HG23 ILE 30 9.227 -28.336 7.129 206 HD11 ILE 30 HD11 ILE 30 9.078 -32.091 5.730 207 HD12 ILE 30 HD12 ILE 30 10.383 -32.235 6.908 208 HD13 ILE 30 HD13 ILE 30 8.923 -31.333 7.315 209 HA PRO 31 HA PRO 31 16.073 -29.920 7.351 210 HB2 PRO 31 HB2 PRO 31 16.168 -30.281 10.040 211 HB3 PRO 31 HB3 PRO 31 16.387 -28.703 9.275 212 HG2 PRO 31 HG2 PRO 31 13.946 -29.862 10.562 213 HG3 PRO 31 HG3 PRO 31 14.608 -28.223 10.694 214 HD2 PRO 31 HD2 PRO 31 12.521 -28.825 9.078 215 HD3 PRO 31 HD3 PRO 31 13.701 -27.559 8.682 216 H SER 32 H SER 32 16.884 -31.961 7.353 217 HA SER 32 HA SER 32 15.176 -34.116 8.405 218 HB2 SER 32 HB2 SER 32 15.300 -35.354 6.460 219 HB3 SER 32 HB3 SER 32 15.288 -33.723 5.790 220 HG SER 32 HG SER 32 16.957 -34.903 4.856 221 H GLU 33 H GLU 33 16.274 -36.029 9.059 222 HA GLU 33 HA GLU 33 18.615 -35.617 10.502 223 HB2 GLU 33 HB2 GLU 33 16.779 -37.589 10.429 224 HB3 GLU 33 HB3 GLU 33 18.090 -38.378 9.564 225 HG2 GLU 33 HG2 GLU 33 19.446 -37.393 11.666 226 HG3 GLU 33 HG3 GLU 33 17.864 -37.643 12.403 227 H ASP 34 H ASP 34 20.719 -36.672 10.231 228 HA ASP 34 HA ASP 34 21.888 -36.033 7.743 229 HB2 ASP 34 HB2 ASP 34 23.008 -36.119 10.044 230 HB3 ASP 34 HB3 ASP 34 23.128 -37.859 9.796 231 H ASP 35 H ASP 35 20.732 -39.042 9.134 232 HA ASP 35 HA ASP 35 21.879 -40.814 7.275 233 HB2 ASP 35 HB2 ASP 35 20.310 -41.065 9.532 234 HB3 ASP 35 HB3 ASP 35 19.237 -41.615 8.248 235 H GLY 36 H GLY 36 19.309 -38.570 6.980 236 HA2 GLY 36 HA2 GLY 36 18.702 -38.051 4.641 237 HA3 GLY 36 HA3 GLY 36 18.566 -39.785 4.390 238 H THR 37 H THR 37 17.262 -40.192 7.000 239 HA THR 37 HA THR 37 14.573 -39.894 6.140 240 HB THR 37 HB THR 37 13.928 -40.882 8.236 241 HG1 THR 37 HG1 THR 37 15.253 -39.712 9.657 242 HG21 THR 37 HG21 THR 37 15.558 -42.101 6.434 243 HG22 THR 37 HG22 THR 37 14.793 -42.919 7.796 244 HG23 THR 37 HG23 THR 37 16.457 -42.351 7.930 245 H VAL 38 H VAL 38 13.078 -39.134 8.249 246 HA VAL 38 HA VAL 38 13.954 -36.437 8.996 247 HB VAL 38 HB VAL 38 11.343 -37.104 7.639 248 HG11 VAL 38 HG11 VAL 38 11.269 -34.418 8.024 249 HG12 VAL 38 HG12 VAL 38 10.452 -35.598 9.050 250 HG13 VAL 38 HG13 VAL 38 12.027 -34.958 9.522 251 HG21 VAL 38 HG21 VAL 38 13.302 -34.951 6.904 252 HG22 VAL 38 HG22 VAL 38 13.475 -36.603 6.310 253 HG23 VAL 38 HG23 VAL 38 12.030 -35.671 5.918 254 H LEU 39 H LEU 39 13.441 -35.879 11.032 255 HA LEU 39 HA LEU 39 12.359 -37.827 12.793 256 HB2 LEU 39 HB2 LEU 39 12.987 -34.908 13.194 257 HB3 LEU 39 HB3 LEU 39 12.506 -36.005 14.487 258 HG LEU 39 HG LEU 39 15.006 -36.266 12.816 259 HD11 LEU 39 HD11 LEU 39 15.253 -34.366 14.219 260 HD12 LEU 39 HD12 LEU 39 16.123 -35.693 14.988 261 HD13 LEU 39 HD13 LEU 39 14.540 -35.208 15.595 262 HD21 LEU 39 HD21 LEU 39 15.383 -37.771 15.034 263 HD22 LEU 39 HD22 LEU 39 14.814 -38.403 13.489 264 HD23 LEU 39 HD23 LEU 39 13.657 -38.009 14.761 265 H LEU 40 H LEU 40 10.340 -38.126 13.512 266 HA LEU 40 HA LEU 40 8.110 -37.145 12.240 267 HB2 LEU 40 HB2 LEU 40 8.516 -39.011 14.112 268 HB3 LEU 40 HB3 LEU 40 7.822 -37.747 15.125 269 HG LEU 40 HG LEU 40 6.517 -39.059 12.742 270 HD11 LEU 40 HD11 LEU 40 5.258 -39.122 15.393 271 HD12 LEU 40 HD12 LEU 40 6.750 -40.051 15.251 272 HD13 LEU 40 HD13 LEU 40 5.399 -40.383 14.168 273 HD21 LEU 40 HD21 LEU 40 5.773 -36.687 14.402 274 HD22 LEU 40 HD22 LEU 40 4.515 -37.722 13.726 275 HD23 LEU 40 HD23 LEU 40 5.663 -36.915 12.656 276 H SER 41 H SER 41 9.810 -35.808 15.011 277 HA SER 41 HA SER 41 7.963 -33.942 15.895 278 HB2 SER 41 HB2 SER 41 10.841 -33.151 15.776 279 HB3 SER 41 HB3 SER 41 9.689 -32.999 17.102 280 HG SER 41 HG SER 41 10.973 -34.641 17.713 281 H THR 42 H THR 42 10.158 -33.802 13.155 282 HA THR 42 HA THR 42 9.707 -31.049 12.562 283 HB THR 42 HB THR 42 10.763 -33.268 10.798 284 HG1 THR 42 HG1 THR 42 12.435 -32.985 12.068 285 HG21 THR 42 HG21 THR 42 11.809 -31.130 9.674 286 HG22 THR 42 HG22 THR 42 10.392 -30.339 10.366 287 HG23 THR 42 HG23 THR 42 10.191 -31.678 9.237 288 H VAL 43 H VAL 43 8.433 -34.090 11.239 289 HA VAL 43 HA VAL 43 6.869 -33.092 9.191 290 HB VAL 43 HB VAL 43 6.599 -35.496 10.953 291 HG11 VAL 43 HG11 VAL 43 4.520 -34.363 9.146 292 HG12 VAL 43 HG12 VAL 43 4.730 -36.114 9.211 293 HG13 VAL 43 HG13 VAL 43 4.340 -35.217 10.679 294 HG21 VAL 43 HG21 VAL 43 8.214 -35.775 9.282 295 HG22 VAL 43 HG22 VAL 43 6.780 -36.575 8.638 296 HG23 VAL 43 HG23 VAL 43 7.224 -34.968 8.065 297 H THR 44 H THR 44 6.208 -33.205 12.640 298 HA THR 44 HA THR 44 3.471 -32.408 12.414 299 HB THR 44 HB THR 44 3.487 -32.170 14.812 300 HG1 THR 44 HG1 THR 44 5.603 -32.494 15.891 301 HG21 THR 44 HG21 THR 44 4.344 -34.515 13.460 302 HG22 THR 44 HG22 THR 44 3.445 -34.390 14.972 303 HG23 THR 44 HG23 THR 44 5.208 -34.430 14.994 304 H ALA 45 H ALA 45 6.513 -30.755 12.551 305 HA ALA 45 HA ALA 45 5.890 -28.280 13.552 306 HB1 ALA 45 HB1 ALA 45 7.800 -27.500 12.549 307 HB2 ALA 45 HB2 ALA 45 8.095 -29.239 12.508 308 HB3 ALA 45 HB3 ALA 45 7.522 -28.408 11.062 309 H GLN 46 H GLN 46 5.414 -29.400 10.209 310 HA GLN 46 HA GLN 46 3.719 -27.044 9.733 311 HB2 GLN 46 HB2 GLN 46 4.548 -28.783 7.474 312 HB3 GLN 46 HB3 GLN 46 4.366 -27.035 7.540 313 HG2 GLN 46 HG2 GLN 46 6.593 -27.005 7.493 314 HG3 GLN 46 HG3 GLN 46 6.479 -27.418 9.203 315 HE21 GLN 46 HE21 GLN 46 6.551 -28.933 6.002 316 HE22 GLN 46 HE22 GLN 46 7.487 -30.303 6.480 317 H PHE 47 H PHE 47 3.837 -30.544 9.613 318 HA PHE 47 HA PHE 47 0.972 -30.582 8.933 319 HB2 PHE 47 HB2 PHE 47 2.635 -33.050 8.738 320 HB3 PHE 47 HB3 PHE 47 1.255 -32.548 7.768 321 HD1 PHE 47 HD1 PHE 47 4.501 -33.329 7.447 322 HD2 PHE 47 HD2 PHE 47 1.905 -30.055 6.632 323 HE1 PHE 47 HE1 PHE 47 6.031 -32.560 5.680 324 HE2 PHE 47 HE2 PHE 47 3.431 -29.282 4.864 325 HZ PHE 47 HZ PHE 47 5.496 -30.535 4.385 326 HA PRO 48 HA PRO 48 1.317 -31.895 13.365 327 HB2 PRO 48 HB2 PRO 48 -0.843 -30.475 14.192 328 HB3 PRO 48 HB3 PRO 48 0.781 -29.784 14.096 329 HG2 PRO 48 HG2 PRO 48 -1.493 -29.551 12.163 330 HG3 PRO 48 HG3 PRO 48 -0.373 -28.299 12.728 331 HD2 PRO 48 HD2 PRO 48 -0.095 -29.529 10.332 332 HD3 PRO 48 HD3 PRO 48 1.294 -28.959 11.279 333 H GLY 49 H GLY 49 0.432 -33.782 13.922 334 HA2 GLY 49 HA2 GLY 49 -1.365 -35.231 14.406 335 HA3 GLY 49 HA3 GLY 49 -2.381 -34.297 13.319 336 H ALA 50 H ALA 50 -0.267 -34.378 11.215 337 HA ALA 50 HA ALA 50 -1.203 -36.453 9.669 338 HB1 ALA 50 HB1 ALA 50 0.048 -34.667 8.682 339 HB2 ALA 50 HB2 ALA 50 1.493 -35.111 9.591 340 HB3 ALA 50 HB3 ALA 50 0.879 -36.182 8.332 341 H CYS 51 H CYS 51 -1.054 -38.586 9.817 342 HA CYS 51 HA CYS 51 0.900 -39.775 11.612 343 HB2 CYS 51 HB2 CYS 51 -1.718 -40.507 10.568 344 HB3 CYS 51 HB3 CYS 51 -0.573 -41.839 10.473 345 HG CYS 51 HG CYS 51 -0.399 -40.370 13.429 346 H GLY 52 H GLY 52 0.113 -39.681 8.187 347 HA2 GLY 52 HA2 GLY 52 2.766 -40.738 7.589 348 HA3 GLY 52 HA3 GLY 52 1.401 -41.663 6.982 349 H LEU 53 H LEU 53 3.513 -40.279 5.505 350 HA LEU 53 HA LEU 53 1.870 -38.324 4.035 351 HB2 LEU 53 HB2 LEU 53 4.869 -38.501 3.958 352 HB3 LEU 53 HB3 LEU 53 3.842 -37.190 3.380 353 HG LEU 53 HG LEU 53 4.716 -36.293 5.310 354 HD11 LEU 53 HD11 LEU 53 2.528 -37.553 6.821 355 HD12 LEU 53 HD12 LEU 53 2.068 -36.797 5.296 356 HD13 LEU 53 HD13 LEU 53 2.884 -35.849 6.539 357 HD21 LEU 53 HD21 LEU 53 5.744 -38.570 5.927 358 HD22 LEU 53 HD22 LEU 53 4.295 -38.794 6.908 359 HD23 LEU 53 HD23 LEU 53 5.376 -37.437 7.227 360 H ARG 54 H ARG 54 1.719 -38.475 1.818 361 HA ARG 54 HA ARG 54 2.661 -41.014 0.673 362 HB2 ARG 54 HB2 ARG 54 0.126 -39.975 0.734 363 HB3 ARG 54 HB3 ARG 54 0.684 -39.472 -0.856 364 HG2 ARG 54 HG2 ARG 54 1.428 -42.171 -0.550 365 HG3 ARG 54 HG3 ARG 54 -0.242 -42.027 0.002 366 HD2 ARG 54 HD2 ARG 54 -0.411 -40.562 -2.221 367 HD3 ARG 54 HD3 ARG 54 0.918 -41.619 -2.694 368 HE ARG 54 HE ARG 54 -1.840 -42.333 -2.422 369 HH11 ARG 54 HH11 ARG 54 1.426 -43.527 -2.247 370 HH12 ARG 54 HH12 ARG 54 0.984 -45.166 -2.597 371 HH21 ARG 54 HH21 ARG 54 -2.434 -44.487 -2.884 372 HH22 ARG 54 HH22 ARG 54 -1.212 -45.710 -2.960 373 H TYR 55 H TYR 55 3.086 -40.917 -1.734 374 HA TYR 55 HA TYR 55 4.732 -38.547 -2.292 375 HB2 TYR 55 HB2 TYR 55 5.195 -41.359 -2.571 376 HB3 TYR 55 HB3 TYR 55 5.271 -40.611 -4.163 377 HD1 TYR 55 HD1 TYR 55 6.636 -38.269 -4.116 378 HD2 TYR 55 HD2 TYR 55 7.186 -41.526 -1.433 379 HE1 TYR 55 HE1 TYR 55 8.920 -37.487 -3.644 380 HE2 TYR 55 HE2 TYR 55 9.470 -40.751 -0.952 381 HH TYR 55 HH TYR 55 11.128 -38.648 -2.812 382 H ARG 56 H ARG 56 4.222 -37.220 -3.910 383 HA ARG 56 HA ARG 56 2.319 -38.157 -5.951 384 HB2 ARG 56 HB2 ARG 56 0.957 -36.781 -4.646 385 HB3 ARG 56 HB3 ARG 56 2.258 -35.646 -4.312 386 HG2 ARG 56 HG2 ARG 56 0.524 -34.760 -5.836 387 HG3 ARG 56 HG3 ARG 56 2.144 -34.765 -6.536 388 HD2 ARG 56 HD2 ARG 56 1.572 -36.923 -7.652 389 HD3 ARG 56 HD3 ARG 56 -0.080 -36.728 -7.068 390 HE ARG 56 HE ARG 56 0.938 -34.496 -8.590 391 HH11 ARG 56 HH11 ARG 56 -0.759 -37.534 -8.680 392 HH12 ARG 56 HH12 ARG 56 -1.558 -37.192 -10.179 393 HH21 ARG 56 HH21 ARG 56 -0.108 -34.034 -10.563 394 HH22 ARG 56 HH22 ARG 56 -1.186 -35.201 -11.250 395 H ASN 57 H ASN 57 3.707 -38.401 -7.629 396 HA ASN 57 HA ASN 57 5.326 -36.056 -8.382 397 HB2 ASN 57 HB2 ASN 57 5.881 -38.981 -8.486 398 HB3 ASN 57 HB3 ASN 57 6.527 -37.983 -9.786 399 HD21 ASN 57 HD21 ASN 57 8.111 -36.473 -9.338 400 HD22 ASN 57 HD22 ASN 57 8.990 -36.465 -7.850 401 HA PRO 58 HA PRO 58 2.776 -35.745 -11.971 402 HB2 PRO 58 HB2 PRO 58 4.400 -34.151 -13.451 403 HB3 PRO 58 HB3 PRO 58 3.465 -33.556 -12.074 404 HG2 PRO 58 HG2 PRO 58 6.353 -34.334 -12.208 405 HG3 PRO 58 HG3 PRO 58 5.606 -32.940 -11.407 406 HD2 PRO 58 HD2 PRO 58 6.354 -35.166 -10.059 407 HD3 PRO 58 HD3 PRO 58 4.960 -34.180 -9.574 408 H VAL 59 H VAL 59 6.202 -36.579 -12.297 409 HA VAL 59 HA VAL 59 5.788 -37.744 -14.921 410 HB VAL 59 HB VAL 59 8.164 -38.249 -14.894 411 HG11 VAL 59 HG11 VAL 59 8.306 -36.151 -15.624 412 HG12 VAL 59 HG12 VAL 59 7.065 -35.603 -14.496 413 HG13 VAL 59 HG13 VAL 59 8.750 -35.693 -13.980 414 HG21 VAL 59 HG21 VAL 59 9.555 -37.583 -12.952 415 HG22 VAL 59 HG22 VAL 59 8.077 -37.280 -12.038 416 HG23 VAL 59 HG23 VAL 59 8.451 -38.911 -12.595 417 H SER 60 H SER 60 6.023 -38.770 -11.606 418 HA SER 60 HA SER 60 6.451 -41.547 -12.220 419 HB2 SER 60 HB2 SER 60 6.971 -40.136 -10.016 420 HB3 SER 60 HB3 SER 60 5.364 -40.712 -9.573 421 HG SER 60 HG SER 60 7.414 -42.429 -10.504 422 H GLN 61 H GLN 61 3.720 -39.453 -11.701 423 HA GLN 61 HA GLN 61 1.481 -39.766 -11.949 424 HB2 GLN 61 HB2 GLN 61 2.131 -42.475 -13.106 425 HB3 GLN 61 HB3 GLN 61 0.696 -41.499 -13.392 426 HG2 GLN 61 HG2 GLN 61 2.360 -39.771 -14.358 427 HG3 GLN 61 HG3 GLN 61 3.463 -41.143 -14.454 428 HE21 GLN 61 HE21 GLN 61 3.311 -40.553 -16.771 429 HE22 GLN 61 HE22 GLN 61 2.049 -41.275 -17.705 430 H CYS 62 H CYS 62 2.674 -40.432 -9.487 431 HA CYS 62 HA CYS 62 2.105 -41.358 -7.489 432 HB2 CYS 62 HB2 CYS 62 -0.254 -40.921 -8.543 433 HB3 CYS 62 HB3 CYS 62 -0.297 -42.672 -8.707 434 HG CYS 62 HG CYS 62 -0.707 -43.267 -6.205 435 H MET 63 H MET 63 3.162 -43.018 -6.641 436 HA MET 63 HA MET 63 2.659 -45.711 -7.176 437 HB2 MET 63 HB2 MET 63 4.383 -44.468 -9.099 438 HB3 MET 63 HB3 MET 63 5.310 -45.640 -8.172 439 HG2 MET 63 HG2 MET 63 3.699 -47.374 -8.722 440 HG3 MET 63 HG3 MET 63 2.730 -46.204 -9.614 441 HE1 MET 63 HE1 MET 63 3.167 -48.415 -11.662 442 HE2 MET 63 HE2 MET 63 2.550 -46.770 -11.823 443 HE3 MET 63 HE3 MET 63 3.789 -47.361 -12.933 444 H ARG 64 H ARG 64 4.993 -43.288 -6.166 445 HA ARG 64 HA ARG 64 6.302 -45.120 -4.336 446 HB2 ARG 64 HB2 ARG 64 6.876 -42.514 -5.485 447 HB3 ARG 64 HB3 ARG 64 7.169 -42.537 -3.751 448 HG2 ARG 64 HG2 ARG 64 8.239 -44.784 -5.364 449 HG3 ARG 64 HG3 ARG 64 9.030 -43.212 -5.499 450 HD2 ARG 64 HD2 ARG 64 9.526 -43.160 -3.186 451 HD3 ARG 64 HD3 ARG 64 8.448 -44.515 -2.852 452 HE ARG 64 HE ARG 64 11.164 -44.649 -3.775 453 HH11 ARG 64 HH11 ARG 64 8.101 -46.299 -3.662 454 HH12 ARG 64 HH12 ARG 64 8.795 -47.875 -3.853 455 HH21 ARG 64 HH21 ARG 64 12.090 -46.718 -4.026 456 HH22 ARG 64 HH22 ARG 64 11.064 -48.112 -4.059 457 H GLY 65 H GLY 65 6.792 -43.833 -2.087 458 HA2 GLY 65 HA2 GLY 65 4.687 -42.363 -0.929 459 HA3 GLY 65 HA3 GLY 65 4.434 -44.070 -0.593 460 H VAL 66 H VAL 66 5.683 -41.318 0.648 461 HA VAL 66 HA VAL 66 8.157 -41.905 1.712 462 HB VAL 66 HB VAL 66 5.913 -40.417 3.084 463 HG11 VAL 66 HG11 VAL 66 7.715 -41.093 4.616 464 HG12 VAL 66 HG12 VAL 66 8.887 -40.289 3.571 465 HG13 VAL 66 HG13 VAL 66 7.646 -39.345 4.397 466 HG21 VAL 66 HG21 VAL 66 7.603 -38.520 2.172 467 HG22 VAL 66 HG22 VAL 66 7.772 -39.733 0.903 468 HG23 VAL 66 HG23 VAL 66 6.181 -39.076 1.289 469 H ARG 67 H ARG 67 8.845 -43.537 2.914 470 HA ARG 67 HA ARG 67 7.004 -45.254 4.305 471 HB2 ARG 67 HB2 ARG 67 8.884 -46.271 3.197 472 HB3 ARG 67 HB3 ARG 67 10.016 -45.257 4.083 473 HG2 ARG 67 HG2 ARG 67 10.042 -47.466 5.011 474 HG3 ARG 67 HG3 ARG 67 9.308 -46.362 6.176 475 HD2 ARG 67 HD2 ARG 67 7.131 -47.201 4.776 476 HD3 ARG 67 HD3 ARG 67 8.148 -48.641 4.737 477 HE ARG 67 HE ARG 67 7.992 -47.554 7.359 478 HH11 ARG 67 HH11 ARG 67 6.227 -49.438 5.023 479 HH12 ARG 67 HH12 ARG 67 5.302 -50.290 6.214 480 HH21 ARG 67 HH21 ARG 67 6.780 -48.669 8.937 481 HH22 ARG 67 HH22 ARG 67 5.616 -49.851 8.441 482 H LEU 68 H LEU 68 6.731 -45.495 6.486 483 HA LEU 68 HA LEU 68 8.102 -43.536 8.209 484 HB2 LEU 68 HB2 LEU 68 5.795 -42.889 7.891 485 HB3 LEU 68 HB3 LEU 68 5.250 -44.501 8.347 486 HG LEU 68 HG LEU 68 5.042 -42.576 10.052 487 HD11 LEU 68 HD11 LEU 68 4.706 -44.214 11.517 488 HD12 LEU 68 HD12 LEU 68 6.405 -44.684 11.495 489 HD13 LEU 68 HD13 LEU 68 5.299 -45.322 10.279 490 HD21 LEU 68 HD21 LEU 68 7.656 -42.191 9.576 491 HD22 LEU 68 HD22 LEU 68 7.761 -43.282 10.959 492 HD23 LEU 68 HD23 LEU 68 6.872 -41.764 11.097 493 H VAL 69 H VAL 69 9.189 -44.357 9.872 494 HA VAL 69 HA VAL 69 8.374 -46.915 11.028 495 HB VAL 69 HB VAL 69 10.008 -47.634 9.432 496 HG11 VAL 69 HG11 VAL 69 12.405 -46.394 10.234 497 HG12 VAL 69 HG12 VAL 69 11.559 -46.227 8.694 498 HG13 VAL 69 HG13 VAL 69 11.219 -45.108 10.014 499 HG21 VAL 69 HG21 VAL 69 11.740 -47.555 11.833 500 HG22 VAL 69 HG22 VAL 69 10.131 -48.253 12.025 501 HG23 VAL 69 HG23 VAL 69 11.247 -48.923 10.834 502 H GLU 70 H GLU 70 8.147 -46.543 13.125 503 HA GLU 70 HA GLU 70 8.529 -45.837 15.254 504 HB2 GLU 70 HB2 GLU 70 11.325 -45.112 14.392 505 HB3 GLU 70 HB3 GLU 70 10.769 -45.551 16.001 506 HG2 GLU 70 HG2 GLU 70 10.119 -47.730 14.393 507 HG3 GLU 70 HG3 GLU 70 11.724 -47.226 13.866 508 H GLY 71 H GLY 71 7.647 -43.990 13.122 509 HA2 GLY 71 HA2 GLY 71 6.847 -41.797 13.363 510 HA3 GLY 71 HA3 GLY 71 8.024 -41.531 14.641 511 H ILE 72 H ILE 72 10.184 -42.648 12.895 512 HA ILE 72 HA ILE 72 10.910 -40.152 11.662 513 HB ILE 72 HB ILE 72 12.344 -42.811 11.676 514 HG12 ILE 72 HG12 ILE 72 13.662 -40.754 13.158 515 HG13 ILE 72 HG13 ILE 72 11.986 -40.830 13.690 516 HG21 ILE 72 HG21 ILE 72 14.242 -40.899 11.255 517 HG22 ILE 72 HG22 ILE 72 13.514 -41.898 9.999 518 HG23 ILE 72 HG23 ILE 72 12.886 -40.281 10.312 519 HD11 ILE 72 HD11 ILE 72 12.394 -42.656 14.865 520 HD12 ILE 72 HD12 ILE 72 13.069 -43.474 13.456 521 HD13 ILE 72 HD13 ILE 72 14.103 -42.469 14.472 522 H LEU 73 H LEU 73 10.310 -39.576 9.690 523 HA LEU 73 HA LEU 73 9.205 -41.451 7.827 524 HB2 LEU 73 HB2 LEU 73 9.789 -38.510 7.739 525 HB3 LEU 73 HB3 LEU 73 9.233 -39.381 6.311 526 HG LEU 73 HG LEU 73 7.370 -38.268 7.348 527 HD11 LEU 73 HD11 LEU 73 6.976 -40.473 6.349 528 HD12 LEU 73 HD12 LEU 73 5.880 -40.150 7.693 529 HD13 LEU 73 HD13 LEU 73 7.259 -41.226 7.918 530 HD21 LEU 73 HD21 LEU 73 7.625 -39.893 9.833 531 HD22 LEU 73 HD22 LEU 73 6.817 -38.347 9.574 532 HD23 LEU 73 HD23 LEU 73 8.577 -38.417 9.671 533 H HIS 74 H HIS 74 10.463 -42.794 6.718 534 HA HIS 74 HA HIS 74 13.200 -42.125 6.083 535 HB2 HIS 74 HB2 HIS 74 11.820 -44.498 6.515 536 HB3 HIS 74 HB3 HIS 74 12.155 -44.516 4.787 537 HD1 HIS 74 HD1 HIS 74 14.896 -43.626 4.434 538 HD2 HIS 74 HD2 HIS 74 13.793 -45.801 7.798 539 HE1 HIS 74 HE1 HIS 74 17.026 -44.634 5.311 540 H ALA 75 H ALA 75 14.081 -41.954 4.001 541 HA ALA 75 HA ALA 75 12.173 -40.999 1.995 542 HB1 ALA 75 HB1 ALA 75 14.581 -40.384 0.947 543 HB2 ALA 75 HB2 ALA 75 13.689 -39.334 2.049 544 HB3 ALA 75 HB3 ALA 75 14.970 -40.375 2.668 545 HA PRO 76 HA PRO 76 12.726 -44.392 -0.734 546 HB2 PRO 76 HB2 PRO 76 12.672 -43.168 -3.157 547 HB3 PRO 76 HB3 PRO 76 11.235 -43.360 -2.145 548 HG2 PRO 76 HG2 PRO 76 13.009 -40.972 -2.485 549 HG3 PRO 76 HG3 PRO 76 11.238 -41.050 -2.412 550 HD2 PRO 76 HD2 PRO 76 12.753 -40.317 -0.291 551 HD3 PRO 76 HD3 PRO 76 11.214 -41.183 -0.111 552 H ASP 77 H ASP 77 13.994 -44.866 -2.947 553 HA ASP 77 HA ASP 77 16.778 -44.675 -2.247 554 HB2 ASP 77 HB2 ASP 77 15.170 -46.131 -4.283 555 HB3 ASP 77 HB3 ASP 77 16.870 -45.850 -4.650 556 H ALA 78 H ALA 78 14.738 -42.582 -3.739 557 HA ALA 78 HA ALA 78 16.818 -41.534 -5.539 558 HB1 ALA 78 HB1 ALA 78 14.938 -41.881 -6.856 559 HB2 ALA 78 HB2 ALA 78 13.830 -41.348 -5.591 560 HB3 ALA 78 HB3 ALA 78 14.826 -40.170 -6.446 561 H GLY 79 H GLY 79 14.887 -40.865 -2.737 562 HA2 GLY 79 HA2 GLY 79 15.851 -39.241 -1.168 563 HA3 GLY 79 HA3 GLY 79 16.168 -38.209 -2.555 564 H TRP 80 H TRP 80 14.938 -36.907 -0.705 565 HA TRP 80 HA TRP 80 12.124 -37.188 -0.561 566 HB2 TRP 80 HB2 TRP 80 13.942 -34.847 0.027 567 HB3 TRP 80 HB3 TRP 80 12.209 -34.833 0.339 568 HD1 TRP 80 HD1 TRP 80 15.340 -35.474 2.065 569 HE1 TRP 80 HE1 TRP 80 14.970 -36.837 4.217 570 HE3 TRP 80 HE3 TRP 80 10.569 -37.089 1.191 571 HZ2 TRP 80 HZ2 TRP 80 12.926 -38.392 5.388 572 HZ3 TRP 80 HZ3 TRP 80 9.478 -38.511 2.877 573 HH2 TRP 80 HH2 TRP 80 10.634 -39.148 4.932 574 H GLY 81 H GLY 81 14.095 -34.727 -2.247 575 HA2 GLY 81 HA2 GLY 81 13.754 -33.853 -4.382 576 HA3 GLY 81 HA3 GLY 81 12.270 -34.787 -4.501 577 H ASN 82 H ASN 82 11.446 -32.769 -5.454 578 HA ASN 82 HA ASN 82 10.508 -30.945 -3.343 579 HB2 ASN 82 HB2 ASN 82 10.950 -29.973 -6.147 580 HB3 ASN 82 HB3 ASN 82 10.885 -29.050 -4.648 581 HD21 ASN 82 HD21 ASN 82 12.645 -30.342 -3.058 582 HD22 ASN 82 HD22 ASN 82 14.236 -30.252 -3.725 583 H LEU 83 H LEU 83 9.211 -33.290 -4.395 584 HA LEU 83 HA LEU 83 7.112 -32.290 -6.142 585 HB2 LEU 83 HB2 LEU 83 6.252 -34.671 -5.872 586 HB3 LEU 83 HB3 LEU 83 7.777 -34.446 -6.727 587 HG LEU 83 HG LEU 83 7.552 -36.389 -5.043 588 HD11 LEU 83 HD11 LEU 83 9.978 -35.065 -4.232 589 HD12 LEU 83 HD12 LEU 83 9.693 -34.859 -5.960 590 HD13 LEU 83 HD13 LEU 83 9.758 -36.478 -5.264 591 HD21 LEU 83 HD21 LEU 83 8.178 -34.157 -3.117 592 HD22 LEU 83 HD22 LEU 83 8.024 -35.876 -2.752 593 HD23 LEU 83 HD23 LEU 83 6.607 -34.947 -3.244 594 H VAL 84 H VAL 84 4.855 -33.448 -5.392 595 HA VAL 84 HA VAL 84 4.219 -32.095 -2.882 596 HB VAL 84 HB VAL 84 2.229 -33.392 -4.730 597 HG11 VAL 84 HG11 VAL 84 2.143 -31.631 -2.384 598 HG12 VAL 84 HG12 VAL 84 1.081 -31.153 -3.710 599 HG13 VAL 84 HG13 VAL 84 0.939 -32.762 -3.001 600 HG21 VAL 84 HG21 VAL 84 3.278 -31.987 -6.245 601 HG22 VAL 84 HG22 VAL 84 1.995 -30.961 -5.603 602 HG23 VAL 84 HG23 VAL 84 3.649 -30.774 -5.020 603 H TYR 85 H TYR 85 2.758 -33.139 -1.341 604 HA TYR 85 HA TYR 85 2.946 -36.071 -1.325 605 HB2 TYR 85 HB2 TYR 85 4.018 -36.188 0.672 606 HB3 TYR 85 HB3 TYR 85 4.604 -34.593 0.214 607 HD1 TYR 85 HD1 TYR 85 2.097 -36.385 2.257 608 HD2 TYR 85 HD2 TYR 85 3.979 -32.657 1.442 609 HE1 TYR 85 HE1 TYR 85 1.094 -35.439 4.294 610 HE2 TYR 85 HE2 TYR 85 2.983 -31.702 3.477 611 HH TYR 85 HH TYR 85 0.667 -33.517 5.415 612 H VAL 86 H VAL 86 1.276 -37.149 -0.267 613 HA VAL 86 HA VAL 86 -1.074 -35.474 0.319 614 HB VAL 86 HB VAL 86 -0.935 -38.358 -0.569 615 HG11 VAL 86 HG11 VAL 86 -3.125 -36.733 0.579 616 HG12 VAL 86 HG12 VAL 86 -3.527 -37.750 -0.806 617 HG13 VAL 86 HG13 VAL 86 -2.843 -38.472 0.652 618 HG21 VAL 86 HG21 VAL 86 -2.453 -37.073 -2.397 619 HG22 VAL 86 HG22 VAL 86 -1.333 -35.786 -1.949 620 HG23 VAL 86 HG23 VAL 86 -0.714 -37.320 -2.560 621 H VAL 87 H VAL 87 -1.798 -35.396 2.339 622 HA VAL 87 HA VAL 87 -0.523 -36.686 4.479 623 HB VAL 87 HB VAL 87 -3.333 -35.603 4.585 624 HG11 VAL 87 HG11 VAL 87 -2.944 -36.459 6.666 625 HG12 VAL 87 HG12 VAL 87 -1.198 -36.226 6.557 626 HG13 VAL 87 HG13 VAL 87 -2.254 -34.850 6.878 627 HG21 VAL 87 HG21 VAL 87 -0.861 -34.216 3.959 628 HG22 VAL 87 HG22 VAL 87 -2.528 -33.648 3.870 629 HG23 VAL 87 HG23 VAL 87 -1.649 -33.566 5.397 630 H ASN 88 H ASN 88 -1.410 -38.224 5.996 631 HA ASN 88 HA ASN 88 -3.543 -39.950 5.005 632 HB2 ASN 88 HB2 ASN 88 -1.273 -40.782 4.169 633 HB3 ASN 88 HB3 ASN 88 -0.912 -41.155 5.852 634 HD21 ASN 88 HD21 ASN 88 -0.736 -43.352 5.288 635 HD22 ASN 88 HD22 ASN 88 -2.141 -44.324 5.030 636 H TYR 89 H TYR 89 -4.744 -39.196 6.776 637 HA TYR 89 HA TYR 89 -3.732 -39.534 9.460 638 HB2 TYR 89 HB2 TYR 89 -6.463 -38.727 8.441 639 HB3 TYR 89 HB3 TYR 89 -5.990 -38.735 10.136 640 HD1 TYR 89 HD1 TYR 89 -6.094 -36.834 7.126 641 HD2 TYR 89 HD2 TYR 89 -3.991 -37.255 10.801 642 HE1 TYR 89 HE1 TYR 89 -5.234 -34.542 6.890 643 HE2 TYR 89 HE2 TYR 89 -3.127 -34.963 10.575 644 HH TYR 89 HH TYR 89 -4.099 -32.891 7.867 645 HA PRO 90 HA PRO 90 -5.222 -43.579 10.287 646 HB2 PRO 90 HB2 PRO 90 -5.923 -43.362 12.901 647 HB3 PRO 90 HB3 PRO 90 -4.242 -43.388 12.356 648 HG2 PRO 90 HG2 PRO 90 -5.956 -41.049 13.098 649 HG3 PRO 90 HG3 PRO 90 -4.262 -41.371 13.512 650 HD2 PRO 90 HD2 PRO 90 -4.980 -39.679 11.524 651 HD3 PRO 90 HD3 PRO 90 -3.493 -40.646 11.463 652 H LYS 91 H LYS 91 -7.153 -44.648 11.627 653 HA LYS 91 HA LYS 91 -9.622 -43.261 10.809 654 HB2 LYS 91 HB2 LYS 91 -8.970 -45.336 9.491 655 HB3 LYS 91 HB3 LYS 91 -9.275 -46.254 10.960 656 HG2 LYS 91 HG2 LYS 91 -11.538 -45.953 10.846 657 HG3 LYS 91 HG3 LYS 91 -11.403 -44.435 9.955 658 HD2 LYS 91 HD2 LYS 91 -12.266 -46.066 8.448 659 HD3 LYS 91 HD3 LYS 91 -10.585 -45.774 7.994 660 HE2 LYS 91 HE2 LYS 91 -9.885 -47.832 8.744 661 HE3 LYS 91 HE3 LYS 91 -11.204 -47.977 9.904 662 HZ1 LYS 91 HZ1 LYS 91 -12.376 -47.892 7.402 663 HZ2 LYS 91 HZ2 LYS 91 -12.243 -49.232 8.424 664 HZ3 LYS 91 HZ3 LYS 91 -11.060 -48.944 7.250 665 H ASP 92 H ASP 92 -9.892 -42.323 12.864 666 HA ASP 92 HA ASP 92 -11.449 -43.792 14.671 667 HB2 ASP 92 HB2 ASP 92 -8.657 -44.149 15.060 668 HB3 ASP 92 HB3 ASP 92 -9.250 -43.147 16.382 669 H ASN 93 H ASN 93 -12.298 -42.505 16.360 670 HA ASN 93 HA ASN 93 -12.655 -39.816 15.774 671 HB2 ASN 93 HB2 ASN 93 -13.651 -41.624 17.660 672 HB3 ASN 93 HB3 ASN 93 -12.945 -40.325 18.616 673 HD21 ASN 93 HD21 ASN 93 -13.776 -38.239 18.435 674 HD22 ASN 93 HD22 ASN 93 -15.334 -37.935 17.753 675 H LYS 94 H LYS 94 -11.676 -37.947 16.359 676 HA LYS 94 HA LYS 94 -9.799 -37.742 18.490 677 HB2 LYS 94 HB2 LYS 94 -8.510 -38.962 16.655 678 HB3 LYS 94 HB3 LYS 94 -8.602 -37.464 15.737 679 HG2 LYS 94 HG2 LYS 94 -7.310 -36.296 17.346 680 HG3 LYS 94 HG3 LYS 94 -7.425 -37.628 18.498 681 HD2 LYS 94 HD2 LYS 94 -5.465 -38.328 17.693 682 HD3 LYS 94 HD3 LYS 94 -6.343 -38.800 16.236 683 HE2 LYS 94 HE2 LYS 94 -5.229 -36.035 16.646 684 HE3 LYS 94 HE3 LYS 94 -4.299 -37.336 15.905 685 HZ1 LYS 94 HZ1 LYS 94 -5.444 -37.177 14.006 686 HZ2 LYS 94 HZ2 LYS 94 -5.888 -35.642 14.561 687 HZ3 LYS 94 HZ3 LYS 94 -6.932 -36.955 14.781 688 H ARG 95 H ARG 95 -9.386 -35.630 19.023 689 HA ARG 95 HA ARG 95 -10.173 -33.531 17.146 690 HB2 ARG 95 HB2 ARG 95 -11.568 -34.231 19.648 691 HB3 ARG 95 HB3 ARG 95 -11.210 -32.521 19.449 692 HG2 ARG 95 HG2 ARG 95 -12.456 -33.980 17.179 693 HG3 ARG 95 HG3 ARG 95 -13.454 -33.564 18.573 694 HD2 ARG 95 HD2 ARG 95 -11.896 -31.290 17.901 695 HD3 ARG 95 HD3 ARG 95 -12.622 -31.906 16.417 696 HE ARG 95 HE ARG 95 -14.705 -31.886 18.119 697 HH11 ARG 95 HH11 ARG 95 -12.325 -29.487 17.284 698 HH12 ARG 95 HH12 ARG 95 -13.387 -28.147 17.564 699 HH21 ARG 95 HH21 ARG 95 -16.113 -30.131 18.490 700 HH22 ARG 95 HH22 ARG 95 -15.542 -28.514 18.251 701 H LYS 96 H LYS 96 -8.674 -31.999 17.093 702 HA LYS 96 HA LYS 96 -7.468 -30.869 19.386 703 HB2 LYS 96 HB2 LYS 96 -5.100 -31.594 18.806 704 HB3 LYS 96 HB3 LYS 96 -6.120 -32.801 19.577 705 HG2 LYS 96 HG2 LYS 96 -5.994 -34.178 17.831 706 HG3 LYS 96 HG3 LYS 96 -6.271 -32.876 16.672 707 HD2 LYS 96 HD2 LYS 96 -3.770 -32.273 17.468 708 HD3 LYS 96 HD3 LYS 96 -3.742 -34.026 17.673 709 HE2 LYS 96 HE2 LYS 96 -3.135 -33.953 15.491 710 HE3 LYS 96 HE3 LYS 96 -4.881 -33.900 15.260 711 HZ1 LYS 96 HZ1 LYS 96 -4.077 -31.286 15.636 712 HZ2 LYS 96 HZ2 LYS 96 -4.583 -32.000 14.189 713 HZ3 LYS 96 HZ3 LYS 96 -2.938 -31.958 14.580 714 H MET 97 H MET 97 -6.668 -28.896 18.907 715 HA MET 97 HA MET 97 -5.924 -28.297 16.140 716 HB2 MET 97 HB2 MET 97 -8.118 -26.994 17.714 717 HB3 MET 97 HB3 MET 97 -7.227 -26.064 16.517 718 HG2 MET 97 HG2 MET 97 -7.802 -28.097 14.968 719 HG3 MET 97 HG3 MET 97 -9.092 -28.348 16.142 720 HE1 MET 97 HE1 MET 97 -10.623 -26.839 16.883 721 HE2 MET 97 HE2 MET 97 -10.593 -25.108 16.549 722 HE3 MET 97 HE3 MET 97 -11.667 -26.164 15.631 723 H ASP 98 H ASP 98 -4.898 -26.100 15.968 724 HA ASP 98 HA ASP 98 -3.775 -25.027 18.414 725 HB2 ASP 98 HB2 ASP 98 -2.322 -26.924 16.811 726 HB3 ASP 98 HB3 ASP 98 -1.514 -25.359 16.756 727 H GLU 99 H GLU 99 -2.265 -23.153 17.888 728 HA GLU 99 HA GLU 99 -3.486 -21.617 15.713 729 HB2 GLU 99 HB2 GLU 99 -2.766 -19.645 16.854 730 HB3 GLU 99 HB3 GLU 99 -3.483 -20.713 18.053 731 HG2 GLU 99 HG2 GLU 99 -1.245 -21.429 18.742 732 HG3 GLU 99 HG3 GLU 99 -0.539 -20.328 17.560 733 H THR 100 H THR 100 -2.243 -20.464 14.210 734 HA THR 100 HA THR 100 0.626 -20.718 14.163 735 HB THR 100 HB THR 100 -0.210 -21.707 11.607 736 HG1 THR 100 HG1 THR 100 -1.636 -23.169 12.134 737 HG21 THR 100 HG21 THR 100 1.444 -22.841 13.861 738 HG22 THR 100 HG22 THR 100 2.020 -22.007 12.418 739 HG23 THR 100 HG23 THR 100 1.290 -23.606 12.280 740 H ASP 101 H ASP 101 1.510 -19.037 13.120 741 HA ASP 101 HA ASP 101 -0.107 -17.585 11.146 742 HB2 ASP 101 HB2 ASP 101 0.352 -15.466 12.127 743 HB3 ASP 101 HB3 ASP 101 -0.220 -16.500 13.433 744 H ALA 102 H ALA 102 1.020 -16.693 9.463 745 HA ALA 102 HA ALA 102 3.827 -16.287 9.461 746 HB1 ALA 102 HB1 ALA 102 4.018 -18.135 7.530 747 HB2 ALA 102 HB2 ALA 102 4.383 -18.466 9.224 748 HB3 ALA 102 HB3 ALA 102 2.812 -18.910 8.558 749 H SER 103 H SER 103 4.641 -15.739 7.254 750 HA SER 103 HA SER 103 2.523 -14.965 5.384 751 HB2 SER 103 HB2 SER 103 4.618 -13.087 6.498 752 HB3 SER 103 HB3 SER 103 3.577 -12.714 5.125 753 HG SER 103 HG SER 103 2.496 -13.511 7.606 754 H SER 104 H SER 104 3.057 -15.246 3.299 755 HA SER 104 HA SER 104 5.756 -15.147 2.351 756 HB2 SER 104 HB2 SER 104 5.797 -17.378 3.372 757 HB3 SER 104 HB3 SER 104 4.374 -17.841 2.440 758 HG SER 104 HG SER 104 6.719 -18.289 1.674 759 H ALA 105 H ALA 105 4.743 -13.612 0.982 760 HA ALA 105 HA ALA 105 2.861 -14.693 -0.995 761 HB1 ALA 105 HB1 ALA 105 1.878 -12.695 -1.012 762 HB2 ALA 105 HB2 ALA 105 2.869 -12.300 0.394 763 HB3 ALA 105 HB3 ALA 105 3.415 -11.857 -1.223 764 H VAL 106 H VAL 106 3.332 -14.795 -3.139 765 HA VAL 106 HA VAL 106 5.753 -13.566 -4.173 766 HB VAL 106 HB VAL 106 6.493 -15.769 -3.282 767 HG11 VAL 106 HG11 VAL 106 4.329 -16.932 -3.740 768 HG12 VAL 106 HG12 VAL 106 4.768 -16.956 -5.449 769 HG13 VAL 106 HG13 VAL 106 5.759 -17.817 -4.270 770 HG21 VAL 106 HG21 VAL 106 7.494 -14.591 -5.299 771 HG22 VAL 106 HG22 VAL 106 7.837 -16.314 -5.140 772 HG23 VAL 106 HG23 VAL 106 6.616 -15.760 -6.286 773 H LYS 107 H LYS 107 5.662 -13.150 -6.338 774 HA LYS 107 HA LYS 107 3.261 -14.094 -7.763 775 HB2 LYS 107 HB2 LYS 107 4.314 -11.398 -7.344 776 HB3 LYS 107 HB3 LYS 107 3.999 -11.759 -9.037 777 HG2 LYS 107 HG2 LYS 107 1.701 -12.352 -8.499 778 HG3 LYS 107 HG3 LYS 107 2.011 -12.036 -6.790 779 HD2 LYS 107 HD2 LYS 107 2.097 -9.757 -7.089 780 HD3 LYS 107 HD3 LYS 107 2.581 -9.890 -8.782 781 HE2 LYS 107 HE2 LYS 107 0.441 -10.100 -9.518 782 HE3 LYS 107 HE3 LYS 107 -0.093 -10.939 -8.062 783 HZ1 LYS 107 HZ1 LYS 107 0.667 -8.141 -7.764 784 HZ2 LYS 107 HZ2 LYS 107 -0.576 -9.010 -7.016 785 HZ3 LYS 107 HZ3 LYS 107 -0.771 -8.449 -8.600 786 H VAL 108 H VAL 108 3.632 -13.556 -10.261 787 HA VAL 108 HA VAL 108 6.349 -14.329 -11.044 788 HB VAL 108 HB VAL 108 5.541 -16.041 -12.571 789 HG11 VAL 108 HG11 VAL 108 6.115 -16.571 -10.175 790 HG12 VAL 108 HG12 VAL 108 4.380 -16.598 -9.849 791 HG13 VAL 108 HG13 VAL 108 5.083 -17.747 -10.988 792 HG21 VAL 108 HG21 VAL 108 3.407 -15.454 -13.233 793 HG22 VAL 108 HG22 VAL 108 3.087 -16.801 -12.140 794 HG23 VAL 108 HG23 VAL 108 2.866 -15.142 -11.583 795 H LYS 109 H LYS 109 6.166 -14.561 -13.676 796 HA LYS 109 HA LYS 109 4.903 -12.058 -14.585 797 HB2 LYS 109 HB2 LYS 109 7.658 -13.031 -14.835 798 HB3 LYS 109 HB3 LYS 109 6.962 -12.487 -16.355 799 HG2 LYS 109 HG2 LYS 109 6.549 -10.314 -15.481 800 HG3 LYS 109 HG3 LYS 109 6.951 -10.834 -13.843 801 HD2 LYS 109 HD2 LYS 109 8.855 -9.683 -14.600 802 HD3 LYS 109 HD3 LYS 109 9.262 -11.392 -14.767 803 HE2 LYS 109 HE2 LYS 109 9.263 -11.308 -17.037 804 HE3 LYS 109 HE3 LYS 109 7.997 -10.084 -17.101 805 HZ1 LYS 109 HZ1 LYS 109 10.789 -9.530 -16.264 806 HZ2 LYS 109 HZ2 LYS 109 9.568 -8.397 -16.558 807 HZ3 LYS 109 HZ3 LYS 109 10.213 -9.296 -17.838 808 H ARG 110 H ARG 110 3.169 -12.650 -15.730 809 HA ARG 110 HA ARG 110 3.145 -15.077 -17.295 810 HB2 ARG 110 HB2 ARG 110 1.057 -12.896 -17.142 811 HB3 ARG 110 HB3 ARG 110 0.834 -14.521 -17.777 812 HG2 ARG 110 HG2 ARG 110 1.827 -14.569 -15.062 813 HG3 ARG 110 HG3 ARG 110 0.323 -13.656 -15.197 814 HD2 ARG 110 HD2 ARG 110 -0.881 -15.483 -15.909 815 HD3 ARG 110 HD3 ARG 110 0.541 -16.298 -16.560 816 HE ARG 110 HE ARG 110 0.854 -16.142 -13.799 817 HH11 ARG 110 HH11 ARG 110 -1.268 -17.654 -16.107 818 HH12 ARG 110 HH12 ARG 110 -1.626 -19.008 -15.087 819 HH21 ARG 110 HH21 ARG 110 0.391 -17.920 -12.447 820 HH22 ARG 110 HH22 ARG 110 -0.682 -19.158 -13.005 821 H ALA 111 H ALA 111 3.625 -15.256 -19.384 822 HA ALA 111 HA ALA 111 4.238 -12.830 -20.891 823 HB1 ALA 111 HB1 ALA 111 5.900 -14.659 -20.780 824 HB2 ALA 111 HB2 ALA 111 4.766 -15.703 -21.638 825 HB3 ALA 111 HB3 ALA 111 5.412 -14.265 -22.429 826 H VAL 112 H VAL 112 3.866 -13.480 -23.452 827 HA VAL 112 HA VAL 112 0.967 -13.500 -23.682 828 HB VAL 112 HB VAL 112 1.328 -12.855 -26.015 829 HG11 VAL 112 HG11 VAL 112 1.566 -11.267 -23.924 830 HG12 VAL 112 HG12 VAL 112 3.218 -11.107 -24.524 831 HG13 VAL 112 HG13 VAL 112 1.857 -10.677 -25.560 832 HG21 VAL 112 HG21 VAL 112 3.555 -12.481 -26.900 833 HG22 VAL 112 HG22 VAL 112 4.274 -13.020 -25.383 834 HG23 VAL 112 HG23 VAL 112 3.383 -14.161 -26.390 835 H GLN 113 H GLN 113 0.022 -14.693 -25.599 836 HA GLN 113 HA GLN 113 1.362 -17.250 -26.103 837 HB2 GLN 113 HB2 GLN 113 -1.459 -16.916 -25.078 838 HB3 GLN 113 HB3 GLN 113 -0.836 -18.415 -25.756 839 HG2 GLN 113 HG2 GLN 113 0.521 -17.073 -23.450 840 HG3 GLN 113 HG3 GLN 113 -0.863 -18.138 -23.210 841 HE21 GLN 113 HE21 GLN 113 2.114 -18.274 -22.598 842 HE22 GLN 113 HE22 GLN 113 2.581 -19.834 -23.172 843 H LYS 114 H LYS 114 1.646 -15.812 -28.095 844 HA LYS 114 HA LYS 114 -0.627 -16.278 -29.911 845 HB2 LYS 114 HB2 LYS 114 1.284 -13.938 -29.865 846 HB3 LYS 114 HB3 LYS 114 0.155 -14.259 -31.174 847 HG2 LYS 114 HG2 LYS 114 -1.703 -13.779 -29.855 848 HG3 LYS 114 HG3 LYS 114 -0.797 -13.960 -28.351 849 HD2 LYS 114 HD2 LYS 114 0.597 -11.956 -29.405 850 HD3 LYS 114 HD3 LYS 114 -0.937 -11.662 -30.228 851 HE2 LYS 114 HE2 LYS 114 -1.892 -11.987 -27.782 852 HE3 LYS 114 HE3 LYS 114 -0.259 -11.495 -27.336 853 HZ1 LYS 114 HZ1 LYS 114 -1.541 -9.863 -29.359 854 HZ2 LYS 114 HZ2 LYS 114 -0.612 -9.401 -28.023 855 HZ3 LYS 114 HZ3 LYS 114 -2.247 -9.786 -27.823 Start of MODEL 9 1 H1 MET 1 H MET 1 8.614 -44.185 21.808 2 HA MET 1 HA MET 1 9.415 -42.540 20.021 3 HB2 MET 1 HB2 MET 1 7.065 -43.886 18.683 4 HB3 MET 1 HB3 MET 1 7.778 -42.378 18.126 5 HG2 MET 1 HG2 MET 1 9.269 -44.979 18.369 6 HG3 MET 1 HG3 MET 1 8.540 -44.376 16.883 7 HE1 MET 1 HE1 MET 1 11.751 -45.119 17.859 8 HE2 MET 1 HE2 MET 1 12.689 -43.666 18.205 9 HE3 MET 1 HE3 MET 1 11.470 -44.223 19.352 10 H ALA 2 H ALA 2 8.936 -41.282 21.854 11 HA ALA 2 HA ALA 2 6.129 -40.595 22.313 12 HB1 ALA 2 HB1 ALA 2 8.080 -41.099 24.095 13 HB2 ALA 2 HB2 ALA 2 8.217 -39.345 23.975 14 HB3 ALA 2 HB3 ALA 2 6.682 -40.080 24.438 15 H GLY 3 H GLY 3 5.265 -38.652 21.824 16 HA2 GLY 3 HA2 GLY 3 6.942 -36.808 20.294 17 HA3 GLY 3 HA3 GLY 3 5.186 -36.816 20.341 18 H SER 4 H SER 4 8.031 -35.438 21.591 19 HA SER 4 HA SER 4 6.485 -34.003 23.649 20 HB2 SER 4 HB2 SER 4 9.492 -34.187 23.600 21 HB3 SER 4 HB3 SER 4 8.438 -33.783 24.955 22 HG SER 4 HG SER 4 7.615 -36.042 24.595 23 H HIS 5 H HIS 5 6.380 -33.232 20.947 24 HA HIS 5 HA HIS 5 7.759 -30.635 21.085 25 HB2 HIS 5 HB2 HIS 5 7.868 -32.672 18.984 26 HB3 HIS 5 HB3 HIS 5 7.439 -31.074 18.383 27 HD1 HIS 5 HD1 HIS 5 10.175 -32.768 20.387 28 HD2 HIS 5 HD2 HIS 5 9.549 -29.378 18.068 29 HE1 HIS 5 HE1 HIS 5 12.436 -31.694 20.142 30 H HIS 6 H HIS 6 6.180 -29.229 21.518 31 HA HIS 6 HA HIS 6 3.812 -29.250 19.776 32 HB2 HIS 6 HB2 HIS 6 3.564 -30.076 22.296 33 HB3 HIS 6 HB3 HIS 6 3.483 -28.342 22.596 34 HD1 HIS 6 HD1 HIS 6 1.138 -27.615 22.752 35 HD2 HIS 6 HD2 HIS 6 1.619 -30.635 19.940 36 HE1 HIS 6 HE1 HIS 6 -1.151 -28.004 21.785 37 H HIS 7 H HIS 7 2.849 -27.198 19.407 38 HA HIS 7 HA HIS 7 2.910 -24.980 18.903 39 HB2 HIS 7 HB2 HIS 7 2.897 -25.009 21.509 40 HB3 HIS 7 HB3 HIS 7 4.575 -24.496 21.355 41 HD1 HIS 7 HD1 HIS 7 1.207 -23.375 19.964 42 HD2 HIS 7 HD2 HIS 7 4.807 -21.811 21.326 43 HE1 HIS 7 HE1 HIS 7 0.935 -20.877 19.865 44 H HIS 8 H HIS 8 4.194 -25.129 17.066 45 HA HIS 8 HA HIS 8 7.078 -24.710 17.419 46 HB2 HIS 8 HB2 HIS 8 5.970 -26.570 15.910 47 HB3 HIS 8 HB3 HIS 8 5.843 -25.250 14.750 48 HD1 HIS 8 HD1 HIS 8 8.756 -25.903 17.081 49 HD2 HIS 8 HD2 HIS 8 7.846 -25.937 13.028 50 HE1 HIS 8 HE1 HIS 8 10.947 -26.271 15.903 51 H HIS 9 H HIS 9 8.146 -22.997 16.460 52 HA HIS 9 HA HIS 9 6.513 -20.663 15.952 53 HB2 HIS 9 HB2 HIS 9 9.177 -21.164 16.868 54 HB3 HIS 9 HB3 HIS 9 9.256 -20.107 15.461 55 HD1 HIS 9 HD1 HIS 9 7.977 -20.241 18.982 56 HD2 HIS 9 HD2 HIS 9 8.283 -17.527 15.851 57 HE1 HIS 9 HE1 HIS 9 7.425 -18.000 19.979 58 H HIS 10 H HIS 10 8.644 -22.811 14.157 59 HA HIS 10 HA HIS 10 9.074 -23.051 11.935 60 HB2 HIS 10 HB2 HIS 10 6.474 -23.198 12.105 61 HB3 HIS 10 HB3 HIS 10 6.508 -21.624 11.317 62 HD1 HIS 10 HD1 HIS 10 7.339 -21.548 8.857 63 HD2 HIS 10 HD2 HIS 10 7.128 -25.367 10.480 64 HE1 HIS 10 HE1 HIS 10 7.534 -23.120 6.904 65 H GLY 11 H GLY 11 10.741 -21.335 12.423 66 HA2 GLY 11 HA2 GLY 11 10.164 -18.715 11.287 67 HA3 GLY 11 HA3 GLY 11 11.650 -19.199 12.091 68 H SER 12 H SER 12 13.284 -20.206 10.913 69 HA SER 12 HA SER 12 13.215 -19.625 8.073 70 HB2 SER 12 HB2 SER 12 15.300 -20.144 10.099 71 HB3 SER 12 HB3 SER 12 15.658 -20.754 8.483 72 HG SER 12 HG SER 12 16.351 -18.714 8.378 73 H MET 13 H MET 13 14.310 -21.294 6.600 74 HA MET 13 HA MET 13 13.996 -24.057 7.268 75 HB2 MET 13 HB2 MET 13 12.269 -24.492 5.484 76 HB3 MET 13 HB3 MET 13 11.671 -23.676 6.923 77 HG2 MET 13 HG2 MET 13 11.752 -21.539 5.756 78 HG3 MET 13 HG3 MET 13 12.372 -22.345 4.317 79 HE1 MET 13 HE1 MET 13 10.779 -23.273 2.430 80 HE2 MET 13 HE2 MET 13 9.219 -22.451 2.439 81 HE3 MET 13 HE3 MET 13 10.700 -21.535 2.720 82 H SER 14 H SER 14 14.398 -25.466 5.318 83 HA SER 14 HA SER 14 16.290 -24.103 3.519 84 HB2 SER 14 HB2 SER 14 17.310 -26.421 3.281 85 HB3 SER 14 HB3 SER 14 17.495 -25.660 4.860 86 HG SER 14 HG SER 14 16.743 -27.950 4.753 87 H GLU 15 H GLU 15 14.663 -27.262 3.390 88 HA GLU 15 HA GLU 15 13.677 -26.536 0.709 89 HB2 GLU 15 HB2 GLU 15 15.388 -28.613 1.394 90 HB3 GLU 15 HB3 GLU 15 13.822 -29.396 1.237 91 HG2 GLU 15 HG2 GLU 15 14.871 -29.525 -0.873 92 HG3 GLU 15 HG3 GLU 15 13.604 -28.306 -1.006 93 H TYR 16 H TYR 16 11.965 -28.592 0.231 94 HA TYR 16 HA TYR 16 10.044 -28.571 2.451 95 HB2 TYR 16 HB2 TYR 16 8.256 -28.286 0.586 96 HB3 TYR 16 HB3 TYR 16 9.116 -26.864 1.166 97 HD1 TYR 16 HD1 TYR 16 9.033 -29.368 -1.573 98 HD2 TYR 16 HD2 TYR 16 10.369 -25.530 -0.311 99 HE1 TYR 16 HE1 TYR 16 9.735 -28.862 -3.875 100 HE2 TYR 16 HE2 TYR 16 11.074 -25.014 -2.610 101 HH TYR 16 HH TYR 16 10.482 -25.771 -4.932 102 H ILE 17 H ILE 17 8.042 -30.007 1.622 103 HA ILE 17 HA ILE 17 9.210 -32.486 0.536 104 HB ILE 17 HB ILE 17 8.768 -32.894 2.835 105 HG12 ILE 17 HG12 ILE 17 6.402 -33.960 1.278 106 HG13 ILE 17 HG13 ILE 17 8.024 -34.643 1.226 107 HG21 ILE 17 HG21 ILE 17 6.020 -32.527 3.208 108 HG22 ILE 17 HG22 ILE 17 7.333 -31.591 3.920 109 HG23 ILE 17 HG23 ILE 17 6.593 -31.063 2.409 110 HD11 ILE 17 HD11 ILE 17 7.772 -34.884 3.770 111 HD12 ILE 17 HD12 ILE 17 6.050 -34.649 3.468 112 HD13 ILE 17 HD13 ILE 17 6.899 -36.003 2.723 113 H ARG 18 H ARG 18 8.333 -33.171 -1.296 114 HA ARG 18 HA ARG 18 5.625 -32.240 -1.989 115 HB2 ARG 18 HB2 ARG 18 8.120 -32.287 -3.481 116 HB3 ARG 18 HB3 ARG 18 6.828 -33.113 -4.341 117 HG2 ARG 18 HG2 ARG 18 5.590 -30.828 -3.487 118 HG3 ARG 18 HG3 ARG 18 7.228 -30.272 -3.837 119 HD2 ARG 18 HD2 ARG 18 5.963 -32.059 -5.829 120 HD3 ARG 18 HD3 ARG 18 5.306 -30.428 -5.693 121 HE ARG 18 HE ARG 18 8.134 -30.360 -5.864 122 HH11 ARG 18 HH11 ARG 18 5.271 -30.865 -7.780 123 HH12 ARG 18 HH12 ARG 18 6.006 -30.332 -9.256 124 HH21 ARG 18 HH21 ARG 18 9.113 -29.655 -7.800 125 HH22 ARG 18 HH22 ARG 18 8.192 -29.645 -9.266 126 H VAL 19 H VAL 19 4.265 -33.852 -1.488 127 HA VAL 19 HA VAL 19 4.621 -36.407 -2.834 128 HB VAL 19 HB VAL 19 3.943 -37.604 -0.674 129 HG11 VAL 19 HG11 VAL 19 6.259 -37.863 0.027 130 HG12 VAL 19 HG12 VAL 19 6.146 -37.814 -1.733 131 HG13 VAL 19 HG13 VAL 19 6.702 -36.395 -0.844 132 HG21 VAL 19 HG21 VAL 19 3.823 -35.042 0.319 133 HG22 VAL 19 HG22 VAL 19 3.869 -36.519 1.280 134 HG23 VAL 19 HG23 VAL 19 5.360 -35.639 0.945 135 H THR 20 H THR 20 2.676 -37.661 -2.949 136 HA THR 20 HA THR 20 0.235 -36.122 -2.346 137 HB THR 20 HB THR 20 0.323 -35.962 -4.666 138 HG1 THR 20 HG1 THR 20 -1.304 -37.413 -5.393 139 HG21 THR 20 HG21 THR 20 1.953 -37.172 -5.633 140 HG22 THR 20 HG22 THR 20 0.705 -38.399 -5.852 141 HG23 THR 20 HG23 THR 20 1.794 -38.487 -4.468 142 H GLU 21 H GLU 21 -1.605 -37.294 -1.749 143 HA GLU 21 HA GLU 21 -1.061 -39.755 -0.383 144 HB2 GLU 21 HB2 GLU 21 -2.687 -37.856 0.296 145 HB3 GLU 21 HB3 GLU 21 -3.810 -38.622 -0.818 146 HG2 GLU 21 HG2 GLU 21 -2.775 -40.665 0.815 147 HG3 GLU 21 HG3 GLU 21 -3.186 -39.318 1.876 148 H ASP 22 H ASP 22 -3.042 -38.817 -3.174 149 HA ASP 22 HA ASP 22 -3.439 -41.660 -3.797 150 HB2 ASP 22 HB2 ASP 22 -4.917 -39.164 -4.599 151 HB3 ASP 22 HB3 ASP 22 -5.121 -40.673 -5.483 152 H GLU 23 H GLU 23 -2.848 -42.523 -5.765 153 HA GLU 23 HA GLU 23 -0.579 -41.431 -7.024 154 HB2 GLU 23 HB2 GLU 23 -0.742 -43.274 -8.574 155 HB3 GLU 23 HB3 GLU 23 -1.124 -43.851 -6.958 156 HG2 GLU 23 HG2 GLU 23 -3.584 -43.408 -7.673 157 HG3 GLU 23 HG3 GLU 23 -2.922 -43.471 -9.305 158 H ASN 24 H ASN 24 -4.000 -41.291 -7.781 159 HA ASN 24 HA ASN 24 -3.645 -40.171 -10.392 160 HB2 ASN 24 HB2 ASN 24 -5.909 -40.862 -8.635 161 HB3 ASN 24 HB3 ASN 24 -6.197 -39.496 -9.708 162 HD21 ASN 24 HD21 ASN 24 -5.670 -42.897 -9.478 163 HD22 ASN 24 HD22 ASN 24 -6.008 -43.277 -11.129 164 H ASP 25 H ASP 25 -3.883 -38.924 -7.160 165 HA ASP 25 HA ASP 25 -4.473 -36.224 -7.932 166 HB2 ASP 25 HB2 ASP 25 -5.154 -36.959 -5.740 167 HB3 ASP 25 HB3 ASP 25 -3.503 -37.420 -5.331 168 H GLU 26 H GLU 26 -3.067 -34.424 -7.799 169 HA GLU 26 HA GLU 26 -0.431 -34.959 -8.780 170 HB2 GLU 26 HB2 GLU 26 -1.799 -32.374 -8.018 171 HB3 GLU 26 HB3 GLU 26 -0.208 -32.468 -8.759 172 HG2 GLU 26 HG2 GLU 26 -1.031 -33.007 -10.801 173 HG3 GLU 26 HG3 GLU 26 -2.426 -33.857 -10.138 174 HA PRO 27 HA PRO 27 1.909 -34.883 -5.068 175 HB2 PRO 27 HB2 PRO 27 4.212 -33.731 -5.929 176 HB3 PRO 27 HB3 PRO 27 3.743 -35.381 -6.359 177 HG2 PRO 27 HG2 PRO 27 3.472 -32.859 -7.949 178 HG3 PRO 27 HG3 PRO 27 4.000 -34.466 -8.481 179 HD2 PRO 27 HD2 PRO 27 1.494 -33.537 -8.917 180 HD3 PRO 27 HD3 PRO 27 1.842 -35.257 -8.649 181 H ILE 28 H ILE 28 1.010 -33.511 -3.594 182 HA ILE 28 HA ILE 28 1.096 -30.652 -3.919 183 HB ILE 28 HB ILE 28 -0.798 -31.678 -2.777 184 HG12 ILE 28 HG12 ILE 28 -0.805 -30.249 -0.740 185 HG13 ILE 28 HG13 ILE 28 0.916 -29.960 -0.969 186 HG21 ILE 28 HG21 ILE 28 0.181 -33.589 -1.760 187 HG22 ILE 28 HG22 ILE 28 1.282 -32.596 -0.806 188 HG23 ILE 28 HG23 ILE 28 -0.446 -32.580 -0.456 189 HD11 ILE 28 HD11 ILE 28 -1.100 -28.389 -1.915 190 HD12 ILE 28 HD12 ILE 28 0.556 -28.408 -2.525 191 HD13 ILE 28 HD13 ILE 28 -0.690 -29.364 -3.326 192 H GLU 29 H GLU 29 2.378 -29.189 -2.866 193 HA GLU 29 HA GLU 29 4.732 -30.307 -1.507 194 HB2 GLU 29 HB2 GLU 29 5.938 -28.367 -2.168 195 HB3 GLU 29 HB3 GLU 29 5.039 -28.903 -3.581 196 HG2 GLU 29 HG2 GLU 29 3.324 -27.199 -3.096 197 HG3 GLU 29 HG3 GLU 29 4.310 -26.629 -1.751 198 H ILE 30 H ILE 30 5.202 -29.798 0.554 199 HA ILE 30 HA ILE 30 3.566 -27.734 1.872 200 HB ILE 30 HB ILE 30 4.257 -29.591 3.850 201 HG12 ILE 30 HG12 ILE 30 2.965 -31.022 1.524 202 HG13 ILE 30 HG13 ILE 30 4.676 -31.160 1.911 203 HG21 ILE 30 HG21 ILE 30 2.256 -28.586 4.213 204 HG22 ILE 30 HG22 ILE 30 1.799 -28.631 2.511 205 HG23 ILE 30 HG23 ILE 30 1.658 -30.084 3.501 206 HD11 ILE 30 HD11 ILE 30 3.891 -32.990 2.993 207 HD12 ILE 30 HD12 ILE 30 3.708 -31.803 4.284 208 HD13 ILE 30 HD13 ILE 30 2.314 -32.267 3.310 209 HA PRO 31 HA PRO 31 7.342 -26.038 3.350 210 HB2 PRO 31 HB2 PRO 31 6.475 -24.860 5.637 211 HB3 PRO 31 HB3 PRO 31 6.103 -24.226 4.030 212 HG2 PRO 31 HG2 PRO 31 4.409 -25.900 5.845 213 HG3 PRO 31 HG3 PRO 31 3.950 -24.492 4.869 214 HD2 PRO 31 HD2 PRO 31 3.436 -27.034 4.091 215 HD3 PRO 31 HD3 PRO 31 3.777 -25.732 2.934 216 H SER 32 H SER 32 8.909 -27.322 4.098 217 HA SER 32 HA SER 32 8.419 -28.982 6.458 218 HB2 SER 32 HB2 SER 32 10.093 -30.393 5.717 219 HB3 SER 32 HB3 SER 32 9.514 -29.752 4.180 220 HG SER 32 HG SER 32 11.684 -29.503 4.113 221 H GLU 33 H GLU 33 10.766 -29.308 7.628 222 HA GLU 33 HA GLU 33 11.262 -26.710 8.828 223 HB2 GLU 33 HB2 GLU 33 11.099 -29.251 9.859 224 HB3 GLU 33 HB3 GLU 33 12.835 -28.981 9.810 225 HG2 GLU 33 HG2 GLU 33 12.565 -26.941 11.113 226 HG3 GLU 33 HG3 GLU 33 10.821 -27.191 11.150 227 H ASP 34 H ASP 34 13.595 -26.228 9.455 228 HA ASP 34 HA ASP 34 15.126 -25.988 7.069 229 HB2 ASP 34 HB2 ASP 34 16.692 -24.754 8.378 230 HB3 ASP 34 HB3 ASP 34 15.092 -24.343 8.988 231 H ASP 35 H ASP 35 15.265 -28.096 9.874 232 HA ASP 35 HA ASP 35 17.808 -29.210 9.408 233 HB2 ASP 35 HB2 ASP 35 16.131 -29.409 11.447 234 HB3 ASP 35 HB3 ASP 35 15.632 -30.872 10.602 235 H GLY 36 H GLY 36 14.800 -29.636 7.812 236 HA2 GLY 36 HA2 GLY 36 14.982 -30.656 5.573 237 HA3 GLY 36 HA3 GLY 36 15.939 -31.923 6.325 238 H THR 37 H THR 37 14.181 -32.033 8.685 239 HA THR 37 HA THR 37 12.358 -33.990 7.709 240 HB THR 37 HB THR 37 11.634 -34.255 9.997 241 HG1 THR 37 HG1 THR 37 12.967 -31.775 10.395 242 HG21 THR 37 HG21 THR 37 14.484 -33.669 10.511 243 HG22 THR 37 HG22 THR 37 14.145 -34.735 9.147 244 HG23 THR 37 HG23 THR 37 13.569 -35.156 10.759 245 H VAL 38 H VAL 38 10.038 -33.721 9.048 246 HA VAL 38 HA VAL 38 8.905 -31.126 8.275 247 HB VAL 38 HB VAL 38 7.818 -33.819 7.453 248 HG11 VAL 38 HG11 VAL 38 6.528 -31.098 7.324 249 HG12 VAL 38 HG12 VAL 38 5.944 -32.520 6.455 250 HG13 VAL 38 HG13 VAL 38 5.962 -32.508 8.219 251 HG21 VAL 38 HG21 VAL 38 9.642 -32.576 6.110 252 HG22 VAL 38 HG22 VAL 38 8.226 -33.187 5.253 253 HG23 VAL 38 HG23 VAL 38 8.339 -31.475 5.662 254 H LEU 39 H LEU 39 7.392 -30.351 9.646 255 HA LEU 39 HA LEU 39 7.063 -31.614 12.178 256 HB2 LEU 39 HB2 LEU 39 6.647 -29.046 11.059 257 HB3 LEU 39 HB3 LEU 39 5.126 -29.560 11.785 258 HG LEU 39 HG LEU 39 6.507 -28.209 13.310 259 HD11 LEU 39 HD11 LEU 39 5.363 -30.786 13.832 260 HD12 LEU 39 HD12 LEU 39 5.384 -29.344 14.847 261 HD13 LEU 39 HD13 LEU 39 6.720 -30.492 14.921 262 HD21 LEU 39 HD21 LEU 39 8.435 -30.526 13.233 263 HD22 LEU 39 HD22 LEU 39 8.574 -29.059 14.202 264 HD23 LEU 39 HD23 LEU 39 8.701 -28.971 12.444 265 H LEU 40 H LEU 40 5.469 -32.878 12.923 266 HA LEU 40 HA LEU 40 3.751 -34.271 11.289 267 HB2 LEU 40 HB2 LEU 40 4.403 -34.434 13.877 268 HB3 LEU 40 HB3 LEU 40 2.800 -33.719 14.038 269 HG LEU 40 HG LEU 40 3.487 -36.358 12.751 270 HD11 LEU 40 HD11 LEU 40 1.513 -36.324 14.872 271 HD12 LEU 40 HD12 LEU 40 3.076 -35.709 15.408 272 HD13 LEU 40 HD13 LEU 40 2.960 -37.315 14.688 273 HD21 LEU 40 HD21 LEU 40 0.994 -36.584 12.570 274 HD22 LEU 40 HD22 LEU 40 1.721 -35.416 11.466 275 HD23 LEU 40 HD23 LEU 40 0.881 -34.858 12.914 276 H SER 41 H SER 41 3.195 -31.223 12.960 277 HA SER 41 HA SER 41 0.453 -30.969 12.636 278 HB2 SER 41 HB2 SER 41 2.611 -28.850 12.586 279 HB3 SER 41 HB3 SER 41 0.887 -28.489 12.659 280 HG SER 41 HG SER 41 2.490 -29.816 14.572 281 H THR 42 H THR 42 3.049 -30.403 10.338 282 HA THR 42 HA THR 42 1.408 -29.186 8.346 283 HB THR 42 HB THR 42 4.116 -30.510 8.094 284 HG1 THR 42 HG1 THR 42 4.849 -28.655 8.793 285 HG21 THR 42 HG21 THR 42 4.090 -28.833 6.042 286 HG22 THR 42 HG22 THR 42 2.354 -29.128 6.134 287 HG23 THR 42 HG23 THR 42 3.466 -30.476 5.899 288 H VAL 43 H VAL 43 2.562 -32.474 8.943 289 HA VAL 43 HA VAL 43 1.716 -33.672 6.571 290 HB VAL 43 HB VAL 43 2.100 -34.730 9.352 291 HG11 VAL 43 HG11 VAL 43 0.790 -36.083 7.046 292 HG12 VAL 43 HG12 VAL 43 1.867 -37.022 8.082 293 HG13 VAL 43 HG13 VAL 43 0.457 -36.218 8.772 294 HG21 VAL 43 HG21 VAL 43 3.602 -36.086 7.374 295 HG22 VAL 43 HG22 VAL 43 3.724 -34.358 7.040 296 HG23 VAL 43 HG23 VAL 43 4.183 -34.985 8.623 297 H THR 44 H THR 44 -0.052 -32.950 9.531 298 HA THR 44 HA THR 44 -2.426 -34.343 8.740 299 HB THR 44 HB THR 44 -3.473 -33.377 10.682 300 HG1 THR 44 HG1 THR 44 -1.171 -31.702 10.870 301 HG21 THR 44 HG21 THR 44 -2.337 -34.815 11.946 302 HG22 THR 44 HG22 THR 44 -1.020 -33.653 12.104 303 HG23 THR 44 HG23 THR 44 -1.024 -34.805 10.770 304 H ALA 45 H ALA 45 -1.160 -31.137 8.296 305 HA ALA 45 HA ALA 45 -3.399 -29.618 7.825 306 HB1 ALA 45 HB1 ALA 45 -2.026 -28.098 6.799 307 HB2 ALA 45 HB2 ALA 45 -0.836 -29.067 7.669 308 HB3 ALA 45 HB3 ALA 45 -1.105 -29.337 5.947 309 H GLN 46 H GLN 46 -1.706 -31.711 5.499 310 HA GLN 46 HA GLN 46 -4.003 -31.445 3.684 311 HB2 GLN 46 HB2 GLN 46 -1.464 -32.747 2.822 312 HB3 GLN 46 HB3 GLN 46 -2.600 -31.781 1.891 313 HG2 GLN 46 HG2 GLN 46 -1.792 -29.759 2.976 314 HG3 GLN 46 HG3 GLN 46 -0.672 -30.718 3.943 315 HE21 GLN 46 HE21 GLN 46 0.324 -32.465 2.121 316 HE22 GLN 46 HE22 GLN 46 1.207 -31.616 0.902 317 H PHE 47 H PHE 47 -2.041 -33.724 5.467 318 HA PHE 47 HA PHE 47 -3.841 -35.890 4.599 319 HB2 PHE 47 HB2 PHE 47 -1.138 -36.417 5.785 320 HB3 PHE 47 HB3 PHE 47 -2.096 -37.430 4.710 321 HD1 PHE 47 HD1 PHE 47 0.864 -35.940 4.772 322 HD2 PHE 47 HD2 PHE 47 -2.712 -35.758 2.471 323 HE1 PHE 47 HE1 PHE 47 2.148 -35.101 2.848 324 HE2 PHE 47 HE2 PHE 47 -1.434 -34.921 0.543 325 HZ PHE 47 HZ PHE 47 1.000 -34.592 0.730 326 HA PRO 48 HA PRO 48 -4.648 -35.133 9.093 327 HB2 PRO 48 HB2 PRO 48 -7.339 -35.426 8.887 328 HB3 PRO 48 HB3 PRO 48 -6.515 -33.889 8.598 329 HG2 PRO 48 HG2 PRO 48 -7.500 -35.912 6.623 330 HG3 PRO 48 HG3 PRO 48 -7.623 -34.144 6.569 331 HD2 PRO 48 HD2 PRO 48 -5.758 -35.518 5.167 332 HD3 PRO 48 HD3 PRO 48 -5.461 -33.891 5.812 333 H GLY 49 H GLY 49 -4.438 -36.804 10.440 334 HA2 GLY 49 HA2 GLY 49 -5.108 -38.831 11.437 335 HA3 GLY 49 HA3 GLY 49 -5.949 -39.257 9.954 336 H ALA 50 H ALA 50 -3.471 -38.468 8.409 337 HA ALA 50 HA ALA 50 -2.373 -41.024 8.111 338 HB1 ALA 50 HB1 ALA 50 -0.632 -39.913 6.761 339 HB2 ALA 50 HB2 ALA 50 -2.262 -39.388 6.337 340 HB3 ALA 50 HB3 ALA 50 -1.229 -38.349 7.319 341 H CYS 51 H CYS 51 -1.594 -41.937 9.970 342 HA CYS 51 HA CYS 51 0.140 -40.556 11.771 343 HB2 CYS 51 HB2 CYS 51 -1.436 -42.663 12.116 344 HB3 CYS 51 HB3 CYS 51 0.034 -43.537 11.703 345 HG CYS 51 HG CYS 51 0.816 -43.583 14.142 346 H GLY 52 H GLY 52 0.584 -42.729 9.050 347 HA2 GLY 52 HA2 GLY 52 3.458 -42.121 9.130 348 HA3 GLY 52 HA3 GLY 52 2.951 -43.802 9.040 349 H LEU 53 H LEU 53 4.474 -42.030 7.161 350 HA LEU 53 HA LEU 53 2.718 -42.311 4.812 351 HB2 LEU 53 HB2 LEU 53 5.159 -40.567 4.955 352 HB3 LEU 53 HB3 LEU 53 3.856 -40.529 3.768 353 HG LEU 53 HG LEU 53 3.435 -38.644 5.030 354 HD11 LEU 53 HD11 LEU 53 1.337 -39.029 5.716 355 HD12 LEU 53 HD12 LEU 53 1.832 -40.266 6.870 356 HD13 LEU 53 HD13 LEU 53 1.637 -40.678 5.167 357 HD21 LEU 53 HD21 LEU 53 3.771 -40.006 7.665 358 HD22 LEU 53 HD22 LEU 53 3.947 -38.301 7.250 359 HD23 LEU 53 HD23 LEU 53 5.193 -39.458 6.778 360 H ARG 54 H ARG 54 3.452 -43.388 3.022 361 HA ARG 54 HA ARG 54 5.944 -44.904 3.388 362 HB2 ARG 54 HB2 ARG 54 3.396 -45.786 2.788 363 HB3 ARG 54 HB3 ARG 54 4.188 -45.769 1.219 364 HG2 ARG 54 HG2 ARG 54 6.091 -46.980 2.676 365 HG3 ARG 54 HG3 ARG 54 4.652 -47.493 3.560 366 HD2 ARG 54 HD2 ARG 54 4.268 -47.699 0.703 367 HD3 ARG 54 HD3 ARG 54 5.681 -48.613 1.227 368 HE ARG 54 HE ARG 54 2.951 -49.267 1.704 369 HH11 ARG 54 HH11 ARG 54 6.149 -49.467 3.065 370 HH12 ARG 54 HH12 ARG 54 5.798 -50.872 4.016 371 HH21 ARG 54 HH21 ARG 54 2.477 -51.118 2.950 372 HH22 ARG 54 HH22 ARG 54 3.710 -51.811 3.949 373 H TYR 55 H TYR 55 7.119 -45.453 1.346 374 HA TYR 55 HA TYR 55 7.271 -43.058 -0.348 375 HB2 TYR 55 HB2 TYR 55 9.247 -44.707 0.914 376 HB3 TYR 55 HB3 TYR 55 9.481 -44.767 -0.829 377 HD1 TYR 55 HD1 TYR 55 10.465 -43.106 2.025 378 HD2 TYR 55 HD2 TYR 55 9.186 -42.299 -1.951 379 HE1 TYR 55 HE1 TYR 55 11.599 -40.925 2.110 380 HE2 TYR 55 HE2 TYR 55 10.316 -40.116 -1.878 381 HH TYR 55 HH TYR 55 11.996 -38.950 -0.707 382 H ARG 56 H ARG 56 6.777 -43.149 -2.445 383 HA ARG 56 HA ARG 56 6.585 -45.788 -3.732 384 HB2 ARG 56 HB2 ARG 56 4.330 -45.260 -3.364 385 HB3 ARG 56 HB3 ARG 56 4.579 -43.553 -3.706 386 HG2 ARG 56 HG2 ARG 56 3.331 -44.767 -5.469 387 HG3 ARG 56 HG3 ARG 56 4.804 -43.985 -6.046 388 HD2 ARG 56 HD2 ARG 56 5.983 -46.132 -5.908 389 HD3 ARG 56 HD3 ARG 56 4.499 -46.905 -5.354 390 HE ARG 56 HE ARG 56 4.113 -45.572 -7.836 391 HH11 ARG 56 HH11 ARG 56 5.450 -48.450 -6.403 392 HH12 ARG 56 HH12 ARG 56 5.252 -49.410 -7.832 393 HH21 ARG 56 HH21 ARG 56 3.848 -46.826 -9.723 394 HH22 ARG 56 HH22 ARG 56 4.342 -48.485 -9.719 395 H ASN 57 H ASN 57 8.423 -45.644 -4.939 396 HA ASN 57 HA ASN 57 8.676 -43.327 -6.737 397 HB2 ASN 57 HB2 ASN 57 10.718 -45.198 -5.558 398 HB3 ASN 57 HB3 ASN 57 11.082 -44.227 -6.982 399 HD21 ASN 57 HD21 ASN 57 12.337 -42.623 -6.366 400 HD22 ASN 57 HD22 ASN 57 12.078 -41.599 -4.999 401 HA PRO 58 HA PRO 58 7.437 -46.294 -9.858 402 HB2 PRO 58 HB2 PRO 58 7.319 -44.484 -11.877 403 HB3 PRO 58 HB3 PRO 58 6.044 -44.655 -10.665 404 HG2 PRO 58 HG2 PRO 58 8.266 -42.654 -10.808 405 HG3 PRO 58 HG3 PRO 58 6.559 -42.403 -10.396 406 HD2 PRO 58 HD2 PRO 58 8.502 -42.570 -8.517 407 HD3 PRO 58 HD3 PRO 58 6.844 -43.136 -8.230 408 H VAL 59 H VAL 59 10.068 -43.955 -10.141 409 HA VAL 59 HA VAL 59 11.322 -45.434 -12.299 410 HB VAL 59 HB VAL 59 13.051 -43.725 -12.245 411 HG11 VAL 59 HG11 VAL 59 11.712 -42.460 -13.483 412 HG12 VAL 59 HG12 VAL 59 10.318 -43.286 -12.783 413 HG13 VAL 59 HG13 VAL 59 10.939 -41.814 -12.036 414 HG21 VAL 59 HG21 VAL 59 12.963 -41.870 -10.659 415 HG22 VAL 59 HG22 VAL 59 11.591 -42.622 -9.845 416 HG23 VAL 59 HG23 VAL 59 13.169 -43.409 -9.823 417 H SER 60 H SER 60 11.602 -45.082 -8.845 418 HA SER 60 HA SER 60 14.171 -46.408 -8.718 419 HB2 SER 60 HB2 SER 60 13.177 -44.594 -7.097 420 HB3 SER 60 HB3 SER 60 12.426 -45.987 -6.318 421 HG SER 60 HG SER 60 14.743 -45.169 -5.772 422 H GLN 61 H GLN 61 10.797 -47.222 -8.388 423 HA GLN 61 HA GLN 61 9.703 -49.176 -7.951 424 HB2 GLN 61 HB2 GLN 61 12.144 -50.337 -9.305 425 HB3 GLN 61 HB3 GLN 61 10.594 -51.145 -9.109 426 HG2 GLN 61 HG2 GLN 61 9.910 -48.792 -10.349 427 HG3 GLN 61 HG3 GLN 61 11.454 -49.204 -11.093 428 HE21 GLN 61 HE21 GLN 61 8.668 -49.213 -12.124 429 HE22 GLN 61 HE22 GLN 61 8.431 -50.800 -12.762 430 H CYS 62 H CYS 62 11.352 -48.218 -5.818 431 HA CYS 62 HA CYS 62 12.395 -50.688 -4.626 432 HB2 CYS 62 HB2 CYS 62 13.415 -48.110 -4.674 433 HB3 CYS 62 HB3 CYS 62 12.738 -48.253 -3.056 434 HG CYS 62 HG CYS 62 15.591 -48.845 -3.308 435 H MET 63 H MET 63 12.173 -50.173 -1.968 436 HA MET 63 HA MET 63 9.284 -49.857 -1.507 437 HB2 MET 63 HB2 MET 63 11.071 -51.954 -0.262 438 HB3 MET 63 HB3 MET 63 9.373 -51.700 0.117 439 HG2 MET 63 HG2 MET 63 10.376 -52.422 -2.622 440 HG3 MET 63 HG3 MET 63 9.852 -53.604 -1.425 441 HE1 MET 63 HE1 MET 63 6.912 -53.592 -4.027 442 HE2 MET 63 HE2 MET 63 8.615 -53.330 -4.404 443 HE3 MET 63 HE3 MET 63 8.151 -54.561 -3.229 444 H ARG 64 H ARG 64 11.346 -47.902 -1.159 445 HA ARG 64 HA ARG 64 12.297 -47.700 1.463 446 HB2 ARG 64 HB2 ARG 64 12.604 -46.225 -0.790 447 HB3 ARG 64 HB3 ARG 64 11.536 -45.175 0.132 448 HG2 ARG 64 HG2 ARG 64 13.395 -45.855 2.004 449 HG3 ARG 64 HG3 ARG 64 14.361 -45.802 0.528 450 HD2 ARG 64 HD2 ARG 64 12.673 -43.560 0.445 451 HD3 ARG 64 HD3 ARG 64 13.300 -43.640 2.091 452 HE ARG 64 HE ARG 64 15.394 -43.133 1.291 453 HH11 ARG 64 HH11 ARG 64 13.289 -43.934 -1.364 454 HH12 ARG 64 HH12 ARG 64 14.410 -43.416 -2.579 455 HH21 ARG 64 HH21 ARG 64 16.878 -42.448 -0.300 456 HH22 ARG 64 HH22 ARG 64 16.452 -42.572 -1.973 457 H GLY 65 H GLY 65 11.520 -45.455 2.665 458 HA2 GLY 65 HA2 GLY 65 8.706 -45.059 2.799 459 HA3 GLY 65 HA3 GLY 65 9.240 -46.134 4.083 460 H VAL 66 H VAL 66 8.176 -43.284 3.975 461 HA VAL 66 HA VAL 66 10.252 -41.548 4.804 462 HB VAL 66 HB VAL 66 7.278 -41.390 5.308 463 HG11 VAL 66 HG11 VAL 66 9.416 -39.293 5.668 464 HG12 VAL 66 HG12 VAL 66 7.677 -39.009 5.777 465 HG13 VAL 66 HG13 VAL 66 8.476 -40.061 6.947 466 HG21 VAL 66 HG21 VAL 66 7.912 -39.437 3.516 467 HG22 VAL 66 HG22 VAL 66 9.012 -40.730 3.039 468 HG23 VAL 66 HG23 VAL 66 7.274 -41.025 3.092 469 H ARG 67 H ARG 67 11.122 -41.143 6.758 470 HA ARG 67 HA ARG 67 10.546 -42.990 8.905 471 HB2 ARG 67 HB2 ARG 67 12.856 -42.528 8.511 472 HB3 ARG 67 HB3 ARG 67 12.583 -40.792 8.568 473 HG2 ARG 67 HG2 ARG 67 13.658 -41.511 10.594 474 HG3 ARG 67 HG3 ARG 67 12.012 -40.986 10.956 475 HD2 ARG 67 HD2 ARG 67 11.389 -43.467 10.710 476 HD3 ARG 67 HD3 ARG 67 13.120 -43.771 10.847 477 HE ARG 67 HE ARG 67 11.325 -42.951 12.948 478 HH11 ARG 67 HH11 ARG 67 14.634 -43.109 11.877 479 HH12 ARG 67 HH12 ARG 67 15.292 -43.031 13.478 480 HH21 ARG 67 HH21 ARG 67 12.180 -42.849 15.060 481 HH22 ARG 67 HH22 ARG 67 13.896 -42.884 15.288 482 H LEU 68 H LEU 68 9.686 -42.510 10.891 483 HA LEU 68 HA LEU 68 8.696 -39.770 11.298 484 HB2 LEU 68 HB2 LEU 68 6.826 -41.070 10.540 485 HB3 LEU 68 HB3 LEU 68 7.190 -42.349 11.697 486 HG LEU 68 HG LEU 68 5.227 -40.712 12.152 487 HD11 LEU 68 HD11 LEU 68 5.279 -41.524 14.233 488 HD12 LEU 68 HD12 LEU 68 6.852 -40.807 14.577 489 HD13 LEU 68 HD13 LEU 68 6.753 -42.346 13.722 490 HD21 LEU 68 HD21 LEU 68 7.044 -38.789 11.841 491 HD22 LEU 68 HD22 LEU 68 7.236 -39.062 13.573 492 HD23 LEU 68 HD23 LEU 68 5.658 -38.620 12.918 493 H VAL 69 H VAL 69 9.506 -38.958 13.104 494 HA VAL 69 HA VAL 69 9.769 -40.689 15.458 495 HB VAL 69 HB VAL 69 11.999 -40.655 14.622 496 HG11 VAL 69 HG11 VAL 69 12.575 -39.045 13.198 497 HG12 VAL 69 HG12 VAL 69 11.289 -37.983 13.775 498 HG13 VAL 69 HG13 VAL 69 12.849 -38.010 14.599 499 HG21 VAL 69 HG21 VAL 69 12.463 -38.495 16.529 500 HG22 VAL 69 HG22 VAL 69 11.326 -39.711 17.109 501 HG23 VAL 69 HG23 VAL 69 12.944 -40.190 16.598 502 H GLU 70 H GLU 70 8.675 -39.816 17.079 503 HA GLU 70 HA GLU 70 7.683 -38.309 18.465 504 HB2 GLU 70 HB2 GLU 70 9.711 -36.303 17.487 505 HB3 GLU 70 HB3 GLU 70 8.893 -36.341 19.043 506 HG2 GLU 70 HG2 GLU 70 10.169 -38.760 18.992 507 HG3 GLU 70 HG3 GLU 70 11.311 -37.704 18.161 508 H GLY 71 H GLY 71 6.846 -38.520 15.648 509 HA2 GLY 71 HA2 GLY 71 4.967 -37.551 14.629 510 HA3 GLY 71 HA3 GLY 71 5.213 -36.107 15.600 511 H ILE 72 H ILE 72 8.102 -36.061 14.825 512 HA ILE 72 HA ILE 72 7.764 -34.466 12.452 513 HB ILE 72 HB ILE 72 10.273 -35.186 13.973 514 HG12 ILE 72 HG12 ILE 72 9.533 -32.428 14.142 515 HG13 ILE 72 HG13 ILE 72 8.138 -33.409 14.579 516 HG21 ILE 72 HG21 ILE 72 9.817 -33.732 11.475 517 HG22 ILE 72 HG22 ILE 72 10.792 -32.856 12.654 518 HG23 ILE 72 HG23 ILE 72 11.291 -34.459 12.113 519 HD11 ILE 72 HD11 ILE 72 10.806 -33.224 15.899 520 HD12 ILE 72 HD12 ILE 72 9.193 -33.089 16.601 521 HD13 ILE 72 HD13 ILE 72 9.809 -34.664 16.100 522 H LEU 73 H LEU 73 7.650 -35.372 10.510 523 HA LEU 73 HA LEU 73 8.651 -37.984 9.946 524 HB2 LEU 73 HB2 LEU 73 7.446 -35.806 8.270 525 HB3 LEU 73 HB3 LEU 73 8.068 -37.289 7.549 526 HG LEU 73 HG LEU 73 5.683 -37.460 7.789 527 HD11 LEU 73 HD11 LEU 73 7.050 -39.122 9.900 528 HD12 LEU 73 HD12 LEU 73 7.022 -39.481 8.174 529 HD13 LEU 73 HD13 LEU 73 5.522 -39.491 9.101 530 HD21 LEU 73 HD21 LEU 73 5.716 -35.789 9.773 531 HD22 LEU 73 HD22 LEU 73 5.894 -37.237 10.764 532 HD23 LEU 73 HD23 LEU 73 4.482 -37.049 9.723 533 H HIS 74 H HIS 74 10.745 -38.402 9.736 534 HA HIS 74 HA HIS 74 12.622 -36.371 8.918 535 HB2 HIS 74 HB2 HIS 74 12.771 -38.690 10.458 536 HB3 HIS 74 HB3 HIS 74 13.696 -39.069 9.009 537 HD1 HIS 74 HD1 HIS 74 15.402 -36.857 8.393 538 HD2 HIS 74 HD2 HIS 74 14.371 -37.629 12.343 539 HE1 HIS 74 HE1 HIS 74 17.164 -35.721 9.782 540 H ALA 75 H ALA 75 14.013 -36.498 7.103 541 HA ALA 75 HA ALA 75 12.766 -37.828 4.810 542 HB1 ALA 75 HB1 ALA 75 14.564 -36.311 3.615 543 HB2 ALA 75 HB2 ALA 75 13.031 -35.647 4.184 544 HB3 ALA 75 HB3 ALA 75 14.496 -35.433 5.144 545 HA PRO 76 HA PRO 76 15.942 -40.824 4.346 546 HB2 PRO 76 HB2 PRO 76 16.035 -41.072 1.644 547 HB3 PRO 76 HB3 PRO 76 14.700 -41.696 2.621 548 HG2 PRO 76 HG2 PRO 76 14.868 -39.157 1.043 549 HG3 PRO 76 HG3 PRO 76 13.526 -40.310 1.168 550 HD2 PRO 76 HD2 PRO 76 13.585 -37.987 2.558 551 HD3 PRO 76 HD3 PRO 76 12.817 -39.458 3.189 552 H ASP 77 H ASP 77 17.907 -41.235 2.696 553 HA ASP 77 HA ASP 77 19.714 -39.047 3.162 554 HB2 ASP 77 HB2 ASP 77 19.983 -41.822 2.055 555 HB3 ASP 77 HB3 ASP 77 21.294 -40.664 1.848 556 H ALA 78 H ALA 78 17.490 -39.608 0.809 557 HA ALA 78 HA ALA 78 19.104 -38.305 -1.282 558 HB1 ALA 78 HB1 ALA 78 18.193 -39.684 -2.766 559 HB2 ALA 78 HB2 ALA 78 17.477 -40.567 -1.417 560 HB3 ALA 78 HB3 ALA 78 16.563 -39.290 -2.219 561 H GLY 79 H GLY 79 16.340 -37.995 0.776 562 HA2 GLY 79 HA2 GLY 79 15.604 -35.712 1.246 563 HA3 GLY 79 HA3 GLY 79 15.769 -35.380 -0.472 564 H TRP 80 H TRP 80 13.468 -34.614 0.412 565 HA TRP 80 HA TRP 80 11.436 -36.564 0.645 566 HB2 TRP 80 HB2 TRP 80 11.337 -33.635 -0.089 567 HB3 TRP 80 HB3 TRP 80 9.897 -34.626 0.136 568 HD1 TRP 80 HD1 TRP 80 11.937 -32.287 1.987 569 HE1 TRP 80 HE1 TRP 80 11.644 -32.567 4.529 570 HE3 TRP 80 HE3 TRP 80 9.657 -36.863 2.042 571 HZ2 TRP 80 HZ2 TRP 80 10.587 -34.475 6.320 572 HZ3 TRP 80 HZ3 TRP 80 9.037 -37.845 4.211 573 HH2 TRP 80 HH2 TRP 80 9.494 -36.675 6.305 574 H GLY 81 H GLY 81 12.178 -34.374 -2.081 575 HA2 GLY 81 HA2 GLY 81 12.186 -34.879 -4.355 576 HA3 GLY 81 HA3 GLY 81 11.640 -36.504 -3.969 577 H ASN 82 H ASN 82 10.252 -36.108 -5.876 578 HA ASN 82 HA ASN 82 7.766 -34.763 -5.053 579 HB2 ASN 82 HB2 ASN 82 8.507 -34.914 -7.947 580 HB3 ASN 82 HB3 ASN 82 7.484 -33.747 -7.115 581 HD21 ASN 82 HD21 ASN 82 9.019 -32.826 -5.126 582 HD22 ASN 82 HD22 ASN 82 10.431 -32.047 -5.748 583 H LEU 83 H LEU 83 8.486 -37.530 -4.740 584 HA LEU 83 HA LEU 83 7.014 -38.959 -6.798 585 HB2 LEU 83 HB2 LEU 83 7.571 -40.944 -5.297 586 HB3 LEU 83 HB3 LEU 83 8.904 -40.132 -6.116 587 HG LEU 83 HG LEU 83 9.196 -40.850 -3.657 588 HD11 LEU 83 HD11 LEU 83 10.270 -38.795 -5.214 589 HD12 LEU 83 HD12 LEU 83 10.976 -39.533 -3.777 590 HD13 LEU 83 HD13 LEU 83 9.981 -38.085 -3.626 591 HD21 LEU 83 HD21 LEU 83 8.409 -39.339 -1.988 592 HD22 LEU 83 HD22 LEU 83 7.018 -39.844 -2.947 593 HD23 LEU 83 HD23 LEU 83 7.737 -38.254 -3.206 594 H VAL 84 H VAL 84 5.674 -40.902 -5.613 595 HA VAL 84 HA VAL 84 3.512 -39.486 -4.255 596 HB VAL 84 HB VAL 84 3.460 -42.358 -5.158 597 HG11 VAL 84 HG11 VAL 84 0.969 -41.355 -5.502 598 HG12 VAL 84 HG12 VAL 84 1.517 -42.172 -4.036 599 HG13 VAL 84 HG13 VAL 84 1.519 -40.410 -4.119 600 HG21 VAL 84 HG21 VAL 84 3.368 -39.881 -6.761 601 HG22 VAL 84 HG22 VAL 84 3.853 -41.514 -7.220 602 HG23 VAL 84 HG23 VAL 84 2.142 -41.095 -7.129 603 H TYR 85 H TYR 85 2.430 -40.477 -2.413 604 HA TYR 85 HA TYR 85 4.145 -42.238 -0.808 605 HB2 TYR 85 HB2 TYR 85 4.352 -40.797 0.926 606 HB3 TYR 85 HB3 TYR 85 4.058 -39.573 -0.304 607 HD1 TYR 85 HD1 TYR 85 2.457 -41.562 2.373 608 HD2 TYR 85 HD2 TYR 85 2.098 -38.239 -0.259 609 HE1 TYR 85 HE1 TYR 85 0.476 -40.800 3.615 610 HE2 TYR 85 HE2 TYR 85 0.117 -37.467 0.976 611 HH TYR 85 HH TYR 85 -0.787 -38.774 4.004 612 H VAL 86 H VAL 86 3.065 -43.560 0.668 613 HA VAL 86 HA VAL 86 0.163 -43.757 0.216 614 HB VAL 86 HB VAL 86 2.026 -45.910 1.225 615 HG11 VAL 86 HG11 VAL 86 0.195 -47.413 0.943 616 HG12 VAL 86 HG12 VAL 86 -0.383 -46.047 1.898 617 HG13 VAL 86 HG13 VAL 86 -0.790 -46.163 0.185 618 HG21 VAL 86 HG21 VAL 86 2.707 -46.050 -0.899 619 HG22 VAL 86 HG22 VAL 86 1.103 -46.698 -1.245 620 HG23 VAL 86 HG23 VAL 86 1.427 -44.979 -1.470 621 H VAL 87 H VAL 87 -1.211 -43.501 1.865 622 HA VAL 87 HA VAL 87 -0.233 -42.637 4.411 623 HB VAL 87 HB VAL 87 -2.676 -42.592 5.032 624 HG11 VAL 87 HG11 VAL 87 -1.696 -40.573 4.284 625 HG12 VAL 87 HG12 VAL 87 -1.677 -41.119 2.606 626 HG13 VAL 87 HG13 VAL 87 -3.209 -40.742 3.395 627 HG21 VAL 87 HG21 VAL 87 -2.897 -44.264 2.794 628 HG22 VAL 87 HG22 VAL 87 -4.205 -43.609 3.779 629 HG23 VAL 87 HG23 VAL 87 -3.667 -42.743 2.340 630 H ASN 88 H ASN 88 -0.283 -43.669 6.366 631 HA ASN 88 HA ASN 88 -1.412 -46.348 6.548 632 HB2 ASN 88 HB2 ASN 88 1.003 -46.518 5.763 633 HB3 ASN 88 HB3 ASN 88 1.462 -45.876 7.337 634 HD21 ASN 88 HD21 ASN 88 1.772 -47.269 8.922 635 HD22 ASN 88 HD22 ASN 88 1.256 -48.918 8.933 636 H TYR 89 H TYR 89 -1.779 -47.052 8.683 637 HA TYR 89 HA TYR 89 -0.935 -45.717 10.998 638 HB2 TYR 89 HB2 TYR 89 -3.392 -44.819 11.472 639 HB3 TYR 89 HB3 TYR 89 -2.183 -43.823 10.668 640 HD1 TYR 89 HD1 TYR 89 -4.374 -46.581 9.418 641 HD2 TYR 89 HD2 TYR 89 -3.253 -42.487 9.115 642 HE1 TYR 89 HE1 TYR 89 -5.881 -46.317 7.492 643 HE2 TYR 89 HE2 TYR 89 -4.758 -42.212 7.189 644 HH TYR 89 HH TYR 89 -6.609 -43.206 6.141 645 HA PRO 90 HA PRO 90 -2.712 -49.246 12.903 646 HB2 PRO 90 HB2 PRO 90 -3.422 -48.304 15.348 647 HB3 PRO 90 HB3 PRO 90 -1.740 -48.561 14.868 648 HG2 PRO 90 HG2 PRO 90 -3.329 -46.024 14.922 649 HG3 PRO 90 HG3 PRO 90 -1.659 -46.309 15.445 650 HD2 PRO 90 HD2 PRO 90 -2.266 -45.175 13.062 651 HD3 PRO 90 HD3 PRO 90 -0.834 -46.199 13.295 652 H LYS 91 H LYS 91 -4.672 -46.307 13.282 653 HA LYS 91 HA LYS 91 -7.022 -47.644 12.337 654 HB2 LYS 91 HB2 LYS 91 -8.354 -47.144 14.428 655 HB3 LYS 91 HB3 LYS 91 -7.217 -48.481 14.550 656 HG2 LYS 91 HG2 LYS 91 -5.602 -46.915 15.623 657 HG3 LYS 91 HG3 LYS 91 -6.878 -45.697 15.639 658 HD2 LYS 91 HD2 LYS 91 -8.278 -47.467 16.865 659 HD3 LYS 91 HD3 LYS 91 -6.745 -48.302 17.126 660 HE2 LYS 91 HE2 LYS 91 -7.024 -47.005 19.049 661 HE3 LYS 91 HE3 LYS 91 -5.905 -46.070 18.058 662 HZ1 LYS 91 HZ1 LYS 91 -8.409 -45.226 17.313 663 HZ2 LYS 91 HZ2 LYS 91 -7.308 -44.386 18.285 664 HZ3 LYS 91 HZ3 LYS 91 -8.493 -45.361 18.998 665 H ASP 92 H ASP 92 -5.714 -44.839 14.055 666 HA ASP 92 HA ASP 92 -6.695 -43.020 12.110 667 HB2 ASP 92 HB2 ASP 92 -8.569 -43.726 14.076 668 HB3 ASP 92 HB3 ASP 92 -7.968 -42.141 14.552 669 H ASN 93 H ASN 93 -6.130 -42.972 15.635 670 HA ASN 93 HA ASN 93 -4.679 -41.788 16.926 671 HB2 ASN 93 HB2 ASN 93 -3.052 -43.017 15.407 672 HB3 ASN 93 HB3 ASN 93 -2.948 -41.532 14.466 673 HD21 ASN 93 HD21 ASN 93 -2.621 -42.754 17.769 674 HD22 ASN 93 HD22 ASN 93 -1.338 -41.688 18.222 675 H LYS 94 H LYS 94 -6.355 -40.112 16.907 676 HA LYS 94 HA LYS 94 -6.120 -37.871 15.146 677 HB2 LYS 94 HB2 LYS 94 -7.719 -38.484 17.604 678 HB3 LYS 94 HB3 LYS 94 -7.636 -36.828 17.016 679 HG2 LYS 94 HG2 LYS 94 -8.504 -37.565 14.846 680 HG3 LYS 94 HG3 LYS 94 -8.614 -39.216 15.462 681 HD2 LYS 94 HD2 LYS 94 -9.930 -37.154 17.106 682 HD3 LYS 94 HD3 LYS 94 -10.650 -37.438 15.520 683 HE2 LYS 94 HE2 LYS 94 -11.776 -39.003 16.743 684 HE3 LYS 94 HE3 LYS 94 -10.386 -39.963 16.240 685 HZ1 LYS 94 HZ1 LYS 94 -9.939 -38.517 18.679 686 HZ2 LYS 94 HZ2 LYS 94 -9.683 -40.152 18.331 687 HZ3 LYS 94 HZ3 LYS 94 -11.219 -39.617 18.795 688 H ARG 95 H ARG 95 -6.122 -35.605 16.412 689 HA ARG 95 HA ARG 95 -4.291 -35.383 18.583 690 HB2 ARG 95 HB2 ARG 95 -2.714 -35.938 16.754 691 HB3 ARG 95 HB3 ARG 95 -3.281 -34.531 15.864 692 HG2 ARG 95 HG2 ARG 95 -1.923 -33.179 16.979 693 HG3 ARG 95 HG3 ARG 95 -2.461 -33.814 18.536 694 HD2 ARG 95 HD2 ARG 95 -0.813 -35.436 18.590 695 HD3 ARG 95 HD3 ARG 95 -0.598 -35.419 16.841 696 HE ARG 95 HE ARG 95 0.747 -33.777 18.756 697 HH11 ARG 95 HH11 ARG 95 -0.398 -33.923 15.471 698 HH12 ARG 95 HH12 ARG 95 0.759 -32.778 14.879 699 HH21 ARG 95 HH21 ARG 95 2.275 -32.268 17.989 700 HH22 ARG 95 HH22 ARG 95 2.280 -31.838 16.312 701 H LYS 96 H LYS 96 -5.560 -33.699 15.721 702 HA LYS 96 HA LYS 96 -6.572 -31.678 15.464 703 HB2 LYS 96 HB2 LYS 96 -7.405 -32.644 18.074 704 HB3 LYS 96 HB3 LYS 96 -7.374 -30.887 18.015 705 HG2 LYS 96 HG2 LYS 96 -8.665 -32.302 15.756 706 HG3 LYS 96 HG3 LYS 96 -9.503 -32.301 17.310 707 HD2 LYS 96 HD2 LYS 96 -10.204 -30.224 16.943 708 HD3 LYS 96 HD3 LYS 96 -8.533 -29.671 16.807 709 HE2 LYS 96 HE2 LYS 96 -8.613 -29.595 14.560 710 HE3 LYS 96 HE3 LYS 96 -9.558 -31.079 14.444 711 HZ1 LYS 96 HZ1 LYS 96 -10.532 -28.328 14.927 712 HZ2 LYS 96 HZ2 LYS 96 -11.488 -29.684 15.250 713 HZ3 LYS 96 HZ3 LYS 96 -10.952 -29.384 13.674 714 H MET 97 H MET 97 -6.602 -29.332 16.450 715 HA MET 97 HA MET 97 -5.417 -27.456 16.946 716 HB2 MET 97 HB2 MET 97 -5.180 -28.766 19.138 717 HB3 MET 97 HB3 MET 97 -3.560 -29.168 18.585 718 HG2 MET 97 HG2 MET 97 -2.763 -27.173 19.145 719 HG3 MET 97 HG3 MET 97 -4.114 -26.331 18.391 720 HE1 MET 97 HE1 MET 97 -6.129 -25.271 19.763 721 HE2 MET 97 HE2 MET 97 -5.561 -24.701 21.332 722 HE3 MET 97 HE3 MET 97 -4.549 -24.500 19.901 723 H ASP 98 H ASP 98 -4.750 -27.459 14.701 724 HA ASP 98 HA ASP 98 -1.862 -27.971 14.406 725 HB2 ASP 98 HB2 ASP 98 -2.216 -28.544 12.078 726 HB3 ASP 98 HB3 ASP 98 -3.244 -29.560 13.085 727 H GLU 99 H GLU 99 -0.953 -26.670 12.490 728 HA GLU 99 HA GLU 99 -2.146 -23.977 12.479 729 HB2 GLU 99 HB2 GLU 99 0.129 -23.034 12.484 730 HB3 GLU 99 HB3 GLU 99 -0.199 -23.968 13.937 731 HG2 GLU 99 HG2 GLU 99 1.385 -25.484 13.480 732 HG3 GLU 99 HG3 GLU 99 1.035 -25.485 11.753 733 H THR 100 H THR 100 -1.023 -22.611 10.677 734 HA THR 100 HA THR 100 -0.251 -24.107 8.331 735 HB THR 100 HB THR 100 -2.347 -22.451 7.375 736 HG1 THR 100 HG1 THR 100 -3.541 -22.560 9.188 737 HG21 THR 100 HG21 THR 100 -1.834 -25.408 7.504 738 HG22 THR 100 HG22 THR 100 -1.730 -24.324 6.116 739 HG23 THR 100 HG23 THR 100 -3.305 -24.765 6.774 740 H ASP 101 H ASP 101 0.712 -22.834 6.744 741 HA ASP 101 HA ASP 101 0.593 -20.046 6.572 742 HB2 ASP 101 HB2 ASP 101 2.331 -21.046 8.668 743 HB3 ASP 101 HB3 ASP 101 3.238 -20.125 7.471 744 H ALA 102 H ALA 102 2.630 -19.176 5.361 745 HA ALA 102 HA ALA 102 4.120 -21.100 3.844 746 HB1 ALA 102 HB1 ALA 102 1.772 -21.019 2.807 747 HB2 ALA 102 HB2 ALA 102 2.245 -19.427 2.211 748 HB3 ALA 102 HB3 ALA 102 3.162 -20.856 1.734 749 H SER 103 H SER 103 5.710 -20.128 2.478 750 HA SER 103 HA SER 103 6.276 -17.343 3.227 751 HB2 SER 103 HB2 SER 103 7.879 -19.549 3.461 752 HB3 SER 103 HB3 SER 103 8.420 -18.880 1.921 753 HG SER 103 HG SER 103 9.604 -17.907 3.529 754 H SER 104 H SER 104 6.411 -15.780 1.731 755 HA SER 104 HA SER 104 5.740 -16.475 -1.015 756 HB2 SER 104 HB2 SER 104 5.508 -14.079 0.685 757 HB3 SER 104 HB3 SER 104 5.933 -13.749 -0.994 758 HG SER 104 HG SER 104 3.821 -13.896 -1.190 759 H ALA 105 H ALA 105 7.925 -13.972 0.254 760 HA ALA 105 HA ALA 105 9.963 -13.240 -0.454 761 HB1 ALA 105 HB1 ALA 105 11.314 -14.863 0.238 762 HB2 ALA 105 HB2 ALA 105 10.128 -16.105 -0.166 763 HB3 ALA 105 HB3 ALA 105 11.251 -15.523 -1.396 764 H VAL 106 H VAL 106 9.239 -12.022 -2.220 765 HA VAL 106 HA VAL 106 9.095 -13.287 -4.836 766 HB VAL 106 HB VAL 106 8.703 -10.392 -4.063 767 HG11 VAL 106 HG11 VAL 106 9.136 -10.202 -6.293 768 HG12 VAL 106 HG12 VAL 106 8.611 -11.848 -6.650 769 HG13 VAL 106 HG13 VAL 106 7.416 -10.581 -6.369 770 HG21 VAL 106 HG21 VAL 106 6.270 -11.039 -4.611 771 HG22 VAL 106 HG22 VAL 106 6.813 -12.700 -4.370 772 HG23 VAL 106 HG23 VAL 106 6.937 -11.532 -3.055 773 H LYS 107 H LYS 107 10.566 -13.074 -6.440 774 HA LYS 107 HA LYS 107 13.023 -11.581 -5.798 775 HB2 LYS 107 HB2 LYS 107 12.618 -14.055 -7.484 776 HB3 LYS 107 HB3 LYS 107 14.132 -13.162 -7.409 777 HG2 LYS 107 HG2 LYS 107 14.661 -13.962 -5.369 778 HG3 LYS 107 HG3 LYS 107 12.983 -13.981 -4.820 779 HD2 LYS 107 HD2 LYS 107 13.994 -15.926 -6.873 780 HD3 LYS 107 HD3 LYS 107 14.161 -16.235 -5.143 781 HE2 LYS 107 HE2 LYS 107 11.478 -15.390 -5.941 782 HE3 LYS 107 HE3 LYS 107 11.994 -16.903 -6.684 783 HZ1 LYS 107 HZ1 LYS 107 12.397 -17.841 -4.546 784 HZ2 LYS 107 HZ2 LYS 107 10.843 -17.175 -4.524 785 HZ3 LYS 107 HZ3 LYS 107 12.120 -16.364 -3.768 786 H VAL 108 H VAL 108 14.073 -10.425 -7.465 787 HA VAL 108 HA VAL 108 12.233 -9.381 -9.465 788 HB VAL 108 HB VAL 108 15.039 -8.476 -8.803 789 HG11 VAL 108 HG11 VAL 108 14.080 -6.330 -9.882 790 HG12 VAL 108 HG12 VAL 108 14.607 -7.649 -10.929 791 HG13 VAL 108 HG13 VAL 108 12.890 -7.417 -10.598 792 HG21 VAL 108 HG21 VAL 108 12.412 -7.290 -7.916 793 HG22 VAL 108 HG22 VAL 108 13.461 -8.281 -6.902 794 HG23 VAL 108 HG23 VAL 108 14.027 -6.720 -7.495 795 H LYS 109 H LYS 109 12.538 -9.477 -11.659 796 HA LYS 109 HA LYS 109 14.136 -11.665 -12.628 797 HB2 LYS 109 HB2 LYS 109 11.955 -11.328 -13.597 798 HB3 LYS 109 HB3 LYS 109 12.353 -9.671 -14.033 799 HG2 LYS 109 HG2 LYS 109 12.438 -11.045 -15.995 800 HG3 LYS 109 HG3 LYS 109 14.076 -10.533 -15.581 801 HD2 LYS 109 HD2 LYS 109 14.657 -12.656 -14.778 802 HD3 LYS 109 HD3 LYS 109 12.972 -13.163 -14.643 803 HE2 LYS 109 HE2 LYS 109 12.945 -12.800 -17.222 804 HE3 LYS 109 HE3 LYS 109 14.697 -12.929 -17.075 805 HZ1 LYS 109 HZ1 LYS 109 12.903 -14.974 -15.922 806 HZ2 LYS 109 HZ2 LYS 109 14.545 -15.106 -16.305 807 HZ3 LYS 109 HZ3 LYS 109 13.392 -15.045 -17.541 808 H ARG 110 H ARG 110 13.904 -8.317 -13.833 809 HA ARG 110 HA ARG 110 15.466 -6.887 -14.663 810 HB2 ARG 110 HB2 ARG 110 16.496 -7.795 -12.294 811 HB3 ARG 110 HB3 ARG 110 17.789 -8.189 -13.420 812 HG2 ARG 110 HG2 ARG 110 17.148 -5.628 -14.140 813 HG3 ARG 110 HG3 ARG 110 16.921 -5.605 -12.390 814 HD2 ARG 110 HD2 ARG 110 19.399 -6.430 -13.894 815 HD3 ARG 110 HD3 ARG 110 19.192 -4.991 -12.897 816 HE ARG 110 HE ARG 110 18.682 -7.274 -11.340 817 HH11 ARG 110 HH11 ARG 110 21.316 -5.621 -12.906 818 HH12 ARG 110 HH12 ARG 110 22.509 -6.183 -11.782 819 HH21 ARG 110 HH21 ARG 110 20.243 -8.021 -9.854 820 HH22 ARG 110 HH22 ARG 110 21.897 -7.549 -10.047 821 H ALA 111 H ALA 111 17.645 -6.834 -15.890 822 HA ALA 111 HA ALA 111 18.687 -9.165 -17.066 823 HB1 ALA 111 HB1 ALA 111 17.682 -8.480 -19.429 824 HB2 ALA 111 HB2 ALA 111 16.880 -9.633 -18.362 825 HB3 ALA 111 HB3 ALA 111 16.340 -7.955 -18.412 826 H VAL 112 H VAL 112 19.758 -8.495 -19.327 827 HA VAL 112 HA VAL 112 20.665 -5.725 -19.281 828 HB VAL 112 HB VAL 112 23.052 -6.408 -19.391 829 HG11 VAL 112 HG11 VAL 112 22.111 -5.570 -17.311 830 HG12 VAL 112 HG12 VAL 112 21.591 -7.199 -16.872 831 HG13 VAL 112 HG13 VAL 112 23.311 -6.821 -16.986 832 HG21 VAL 112 HG21 VAL 112 22.566 -9.000 -18.113 833 HG22 VAL 112 HG22 VAL 112 22.092 -8.926 -19.810 834 HG23 VAL 112 HG23 VAL 112 23.748 -8.542 -19.339 835 H GLN 113 H GLN 113 22.514 -5.594 -21.109 836 HA GLN 113 HA GLN 113 21.522 -7.090 -23.443 837 HB2 GLN 113 HB2 GLN 113 20.881 -4.554 -23.172 838 HB3 GLN 113 HB3 GLN 113 22.525 -4.287 -23.737 839 HG2 GLN 113 HG2 GLN 113 21.038 -4.183 -25.604 840 HG3 GLN 113 HG3 GLN 113 22.015 -5.644 -25.738 841 HE21 GLN 113 HE21 GLN 113 20.794 -7.102 -26.710 842 HE22 GLN 113 HE22 GLN 113 19.179 -7.526 -26.267 843 H LYS 114 H LYS 114 23.061 -8.255 -24.364 844 HA LYS 114 HA LYS 114 25.094 -9.015 -25.044 845 HB2 LYS 114 HB2 LYS 114 25.065 -6.763 -26.184 846 HB3 LYS 114 HB3 LYS 114 26.008 -6.144 -24.834 847 HG2 LYS 114 HG2 LYS 114 27.069 -8.559 -26.148 848 HG3 LYS 114 HG3 LYS 114 27.086 -7.078 -27.107 849 HD2 LYS 114 HD2 LYS 114 28.034 -6.150 -24.752 850 HD3 LYS 114 HD3 LYS 114 28.641 -7.807 -24.710 851 HE2 LYS 114 HE2 LYS 114 30.304 -7.170 -26.038 852 HE3 LYS 114 HE3 LYS 114 29.119 -6.881 -27.311 853 HZ1 LYS 114 HZ1 LYS 114 29.865 -4.867 -25.264 854 HZ2 LYS 114 HZ2 LYS 114 28.911 -4.621 -26.638 855 HZ3 LYS 114 HZ3 LYS 114 30.562 -4.948 -26.804 Start of MODEL 10 1 H1 MET 1 H MET 1 -0.075 -22.039 -38.335 2 HA MET 1 HA MET 1 -1.636 -24.417 -37.696 3 HB2 MET 1 HB2 MET 1 -0.240 -25.129 -39.570 4 HB3 MET 1 HB3 MET 1 1.198 -24.543 -38.743 5 HG2 MET 1 HG2 MET 1 0.907 -26.199 -37.002 6 HG3 MET 1 HG3 MET 1 -0.587 -26.754 -37.754 7 HE1 MET 1 HE1 MET 1 2.266 -27.914 -36.808 8 HE2 MET 1 HE2 MET 1 1.438 -29.331 -37.451 9 HE3 MET 1 HE3 MET 1 3.034 -28.891 -38.059 10 H ALA 2 H ALA 2 -1.820 -23.234 -35.690 11 HA ALA 2 HA ALA 2 0.571 -23.558 -34.000 12 HB1 ALA 2 HB1 ALA 2 0.162 -21.175 -34.520 13 HB2 ALA 2 HB2 ALA 2 -1.426 -21.312 -33.765 14 HB3 ALA 2 HB3 ALA 2 0.032 -21.540 -32.800 15 H GLY 3 H GLY 3 0.079 -25.317 -32.820 16 HA2 GLY 3 HA2 GLY 3 -1.580 -25.306 -30.658 17 HA3 GLY 3 HA3 GLY 3 -2.607 -25.887 -31.960 18 H SER 4 H SER 4 0.304 -26.542 -30.097 19 HA SER 4 HA SER 4 0.898 -29.049 -31.257 20 HB2 SER 4 HB2 SER 4 1.877 -27.436 -29.063 21 HB3 SER 4 HB3 SER 4 1.792 -29.135 -28.598 22 HG SER 4 HG SER 4 3.596 -29.293 -29.659 23 H HIS 5 H HIS 5 0.225 -31.082 -30.808 24 HA HIS 5 HA HIS 5 -2.209 -31.362 -29.275 25 HB2 HIS 5 HB2 HIS 5 -1.909 -32.501 -31.458 26 HB3 HIS 5 HB3 HIS 5 -0.612 -33.463 -30.755 27 HD1 HIS 5 HD1 HIS 5 -1.430 -35.741 -30.303 28 HD2 HIS 5 HD2 HIS 5 -4.354 -32.886 -29.555 29 HE1 HIS 5 HE1 HIS 5 -3.424 -37.024 -29.467 30 H HIS 6 H HIS 6 0.903 -33.113 -29.269 31 HA HIS 6 HA HIS 6 1.063 -33.017 -26.404 32 HB2 HIS 6 HB2 HIS 6 -0.577 -34.894 -26.903 33 HB3 HIS 6 HB3 HIS 6 0.771 -35.754 -27.643 34 HD1 HIS 6 HD1 HIS 6 1.357 -37.549 -26.041 35 HD2 HIS 6 HD2 HIS 6 0.701 -33.918 -24.131 36 HE1 HIS 6 HE1 HIS 6 1.915 -37.951 -23.622 37 H HIS 7 H HIS 7 3.125 -32.352 -26.370 38 HA HIS 7 HA HIS 7 5.117 -33.069 -28.211 39 HB2 HIS 7 HB2 HIS 7 4.909 -31.428 -25.881 40 HB3 HIS 7 HB3 HIS 7 6.349 -32.430 -25.727 41 HD1 HIS 7 HD1 HIS 7 4.776 -30.126 -28.315 42 HD2 HIS 7 HD2 HIS 7 8.504 -31.406 -27.002 43 HE1 HIS 7 HE1 HIS 7 6.449 -28.788 -29.633 44 H HIS 8 H HIS 8 6.964 -34.414 -27.965 45 HA HIS 8 HA HIS 8 6.403 -36.810 -26.376 46 HB2 HIS 8 HB2 HIS 8 6.918 -36.822 -28.918 47 HB3 HIS 8 HB3 HIS 8 8.591 -36.583 -28.424 48 HD1 HIS 8 HD1 HIS 8 9.397 -38.875 -29.187 49 HD2 HIS 8 HD2 HIS 8 6.254 -39.051 -26.475 50 HE1 HIS 8 HE1 HIS 8 9.237 -41.289 -28.498 51 H HIS 9 H HIS 9 7.478 -37.202 -24.564 52 HA HIS 9 HA HIS 9 10.200 -36.160 -24.252 53 HB2 HIS 9 HB2 HIS 9 8.255 -34.759 -23.122 54 HB3 HIS 9 HB3 HIS 9 8.375 -36.013 -21.892 55 HD1 HIS 9 HD1 HIS 9 10.187 -33.081 -23.302 56 HD2 HIS 9 HD2 HIS 9 10.760 -35.992 -20.393 57 HE1 HIS 9 HE1 HIS 9 12.143 -32.290 -21.934 58 H HIS 10 H HIS 10 11.510 -37.766 -23.717 59 HA HIS 10 HA HIS 10 10.416 -40.016 -22.159 60 HB2 HIS 10 HB2 HIS 10 11.116 -40.384 -24.642 61 HB3 HIS 10 HB3 HIS 10 12.760 -40.320 -24.012 62 HD1 HIS 10 HD1 HIS 10 11.941 -41.869 -21.305 63 HD2 HIS 10 HD2 HIS 10 11.274 -43.108 -25.214 64 HE1 HIS 10 HE1 HIS 10 11.710 -44.370 -21.188 65 H GLY 11 H GLY 11 11.291 -38.042 -20.646 66 HA2 GLY 11 HA2 GLY 11 13.878 -39.043 -19.661 67 HA3 GLY 11 HA3 GLY 11 13.645 -37.316 -19.884 68 H SER 12 H SER 12 13.936 -39.386 -17.534 69 HA SER 12 HA SER 12 11.734 -38.290 -15.913 70 HB2 SER 12 HB2 SER 12 13.347 -40.775 -15.312 71 HB3 SER 12 HB3 SER 12 11.868 -40.240 -14.516 72 HG SER 12 HG SER 12 12.219 -41.501 -16.965 73 H MET 13 H MET 13 12.781 -36.386 -15.320 74 HA MET 13 HA MET 13 15.386 -36.496 -14.065 75 HB2 MET 13 HB2 MET 13 13.458 -34.306 -14.755 76 HB3 MET 13 HB3 MET 13 14.776 -33.994 -13.633 77 HG2 MET 13 HG2 MET 13 15.845 -33.408 -15.521 78 HG3 MET 13 HG3 MET 13 16.161 -35.139 -15.605 79 HE1 MET 13 HE1 MET 13 16.271 -33.540 -18.586 80 HE2 MET 13 HE2 MET 13 16.759 -35.071 -17.860 81 HE3 MET 13 HE3 MET 13 15.658 -35.060 -19.238 82 H SER 14 H SER 14 12.032 -35.927 -13.095 83 HA SER 14 HA SER 14 12.722 -36.678 -10.368 84 HB2 SER 14 HB2 SER 14 12.984 -34.296 -10.220 85 HB3 SER 14 HB3 SER 14 11.477 -34.019 -11.094 86 HG SER 14 HG SER 14 11.163 -33.763 -8.865 87 H GLU 15 H GLU 15 11.021 -37.556 -9.212 88 HA GLU 15 HA GLU 15 8.557 -37.995 -10.764 89 HB2 GLU 15 HB2 GLU 15 10.321 -39.847 -9.620 90 HB3 GLU 15 HB3 GLU 15 8.915 -39.840 -8.565 91 HG2 GLU 15 HG2 GLU 15 7.514 -40.645 -10.190 92 HG3 GLU 15 HG3 GLU 15 8.508 -40.024 -11.507 93 H TYR 16 H TYR 16 6.906 -38.985 -8.847 94 HA TYR 16 HA TYR 16 6.790 -36.954 -6.734 95 HB2 TYR 16 HB2 TYR 16 4.239 -36.911 -7.219 96 HB3 TYR 16 HB3 TYR 16 5.313 -35.961 -8.239 97 HD1 TYR 16 HD1 TYR 16 3.605 -39.270 -8.080 98 HD2 TYR 16 HD2 TYR 16 5.239 -36.216 -10.552 99 HE1 TYR 16 HE1 TYR 16 2.715 -40.412 -10.068 100 HE2 TYR 16 HE2 TYR 16 4.352 -37.350 -12.547 101 HH TYR 16 HH TYR 16 2.891 -38.952 -13.258 102 H ILE 17 H ILE 17 4.668 -37.543 -5.351 103 HA ILE 17 HA ILE 17 4.820 -40.439 -4.815 104 HB ILE 17 HB ILE 17 5.919 -39.363 -3.005 105 HG12 ILE 17 HG12 ILE 17 3.069 -39.879 -2.130 106 HG13 ILE 17 HG13 ILE 17 4.274 -41.132 -2.410 107 HG21 ILE 17 HG21 ILE 17 5.540 -37.199 -2.661 108 HG22 ILE 17 HG22 ILE 17 3.995 -37.273 -3.508 109 HG23 ILE 17 HG23 ILE 17 4.079 -37.665 -1.790 110 HD11 ILE 17 HD11 ILE 17 5.659 -39.794 -0.661 111 HD12 ILE 17 HD12 ILE 17 4.084 -39.144 -0.203 112 HD13 ILE 17 HD13 ILE 17 4.375 -40.882 -0.136 113 H ARG 18 H ARG 18 2.962 -41.503 -4.951 114 HA ARG 18 HA ARG 18 0.454 -39.963 -4.800 115 HB2 ARG 18 HB2 ARG 18 1.438 -41.887 -6.744 116 HB3 ARG 18 HB3 ARG 18 -0.126 -42.359 -6.093 117 HG2 ARG 18 HG2 ARG 18 -0.331 -39.624 -6.649 118 HG3 ARG 18 HG3 ARG 18 0.510 -40.340 -8.026 119 HD2 ARG 18 HD2 ARG 18 -1.852 -41.792 -6.987 120 HD3 ARG 18 HD3 ARG 18 -2.155 -40.268 -7.821 121 HE ARG 18 HE ARG 18 -0.398 -41.990 -9.280 122 HH11 ARG 18 HH11 ARG 18 -3.736 -41.320 -8.553 123 HH12 ARG 18 HH12 ARG 18 -4.332 -42.021 -10.021 124 HH21 ARG 18 HH21 ARG 18 -1.171 -42.915 -11.217 125 HH22 ARG 18 HH22 ARG 18 -2.872 -42.928 -11.535 126 H VAL 19 H VAL 19 -0.325 -40.266 -2.801 127 HA VAL 19 HA VAL 19 -0.968 -42.984 -1.983 128 HB VAL 19 HB VAL 19 -0.159 -42.440 0.380 129 HG11 VAL 19 HG11 VAL 19 2.056 -43.306 -0.060 130 HG12 VAL 19 HG12 VAL 19 0.887 -44.099 -1.118 131 HG13 VAL 19 HG13 VAL 19 1.936 -42.831 -1.754 132 HG21 VAL 19 HG21 VAL 19 0.392 -39.987 -0.684 133 HG22 VAL 19 HG22 VAL 19 1.079 -40.620 0.812 134 HG23 VAL 19 HG23 VAL 19 1.979 -40.756 -0.699 135 H THR 20 H THR 20 -2.592 -43.089 -0.342 136 HA THR 20 HA THR 20 -4.065 -40.562 0.034 137 HB THR 20 HB THR 20 -5.509 -41.652 -1.392 138 HG1 THR 20 HG1 THR 20 -6.701 -41.290 0.475 139 HG21 THR 20 HG21 THR 20 -4.247 -44.100 -0.314 140 HG22 THR 20 HG22 THR 20 -4.693 -43.689 -1.970 141 HG23 THR 20 HG23 THR 20 -5.924 -44.251 -0.838 142 H GLU 21 H GLU 21 -5.211 -40.311 1.989 143 HA GLU 21 HA GLU 21 -3.945 -41.539 4.244 144 HB2 GLU 21 HB2 GLU 21 -4.835 -39.138 4.061 145 HB3 GLU 21 HB3 GLU 21 -6.423 -39.834 4.349 146 HG2 GLU 21 HG2 GLU 21 -4.701 -40.869 6.324 147 HG3 GLU 21 HG3 GLU 21 -4.399 -39.135 6.225 148 H ASP 22 H ASP 22 -7.258 -41.568 2.949 149 HA ASP 22 HA ASP 22 -7.826 -43.912 4.633 150 HB2 ASP 22 HB2 ASP 22 -9.555 -41.757 3.470 151 HB3 ASP 22 HB3 ASP 22 -10.258 -43.324 3.859 152 H GLU 23 H GLU 23 -8.566 -45.807 3.749 153 HA GLU 23 HA GLU 23 -7.748 -46.459 1.146 154 HB2 GLU 23 HB2 GLU 23 -8.900 -48.591 1.505 155 HB3 GLU 23 HB3 GLU 23 -7.954 -48.132 2.914 156 HG2 GLU 23 HG2 GLU 23 -10.245 -47.095 3.692 157 HG3 GLU 23 HG3 GLU 23 -10.899 -48.287 2.571 158 H ASN 24 H ASN 24 -10.827 -45.390 2.429 159 HA ASN 24 HA ASN 24 -12.364 -46.010 0.112 160 HB2 ASN 24 HB2 ASN 24 -14.073 -44.527 1.142 161 HB3 ASN 24 HB3 ASN 24 -13.460 -45.743 2.260 162 HD21 ASN 24 HD21 ASN 24 -13.241 -42.366 1.326 163 HD22 ASN 24 HD22 ASN 24 -12.703 -41.784 2.861 164 H ASP 25 H ASP 25 -10.359 -43.340 1.068 165 HA ASP 25 HA ASP 25 -11.386 -41.540 -0.940 166 HB2 ASP 25 HB2 ASP 25 -9.480 -41.405 1.280 167 HB3 ASP 25 HB3 ASP 25 -8.964 -40.497 -0.138 168 H GLU 26 H GLU 26 -10.070 -40.660 -2.669 169 HA GLU 26 HA GLU 26 -8.699 -42.746 -4.099 170 HB2 GLU 26 HB2 GLU 26 -8.819 -41.365 -5.970 171 HB3 GLU 26 HB3 GLU 26 -10.251 -40.912 -5.057 172 HG2 GLU 26 HG2 GLU 26 -8.875 -39.028 -4.085 173 HG3 GLU 26 HG3 GLU 26 -7.664 -39.412 -5.307 174 HA PRO 27 HA PRO 27 -4.538 -41.795 -3.075 175 HB2 PRO 27 HB2 PRO 27 -3.278 -42.398 -5.403 176 HB3 PRO 27 HB3 PRO 27 -3.941 -43.630 -4.323 177 HG2 PRO 27 HG2 PRO 27 -5.113 -42.475 -6.823 178 HG3 PRO 27 HG3 PRO 27 -5.067 -44.164 -6.286 179 HD2 PRO 27 HD2 PRO 27 -7.269 -42.610 -6.021 180 HD3 PRO 27 HD3 PRO 27 -6.859 -43.891 -4.862 181 H ILE 28 H ILE 28 -4.154 -39.669 -2.741 182 HA ILE 28 HA ILE 28 -4.288 -37.751 -4.899 183 HB ILE 28 HB ILE 28 -5.037 -37.099 -2.665 184 HG12 ILE 28 HG12 ILE 28 -3.755 -34.981 -2.478 185 HG13 ILE 28 HG13 ILE 28 -2.555 -35.634 -3.588 186 HG21 ILE 28 HG21 ILE 28 -2.184 -37.662 -1.896 187 HG22 ILE 28 HG22 ILE 28 -3.279 -36.697 -0.907 188 HG23 ILE 28 HG23 ILE 28 -3.650 -38.389 -1.240 189 HD11 ILE 28 HD11 ILE 28 -4.586 -34.072 -4.350 190 HD12 ILE 28 HD12 ILE 28 -3.849 -35.286 -5.396 191 HD13 ILE 28 HD13 ILE 28 -5.344 -35.653 -4.535 192 H GLU 29 H GLU 29 -2.600 -36.704 -5.871 193 HA GLU 29 HA GLU 29 0.050 -37.890 -5.439 194 HB2 GLU 29 HB2 GLU 29 0.602 -37.201 -7.671 195 HB3 GLU 29 HB3 GLU 29 -0.956 -38.013 -7.719 196 HG2 GLU 29 HG2 GLU 29 -1.631 -36.260 -8.910 197 HG3 GLU 29 HG3 GLU 29 -1.684 -35.407 -7.368 198 H ILE 30 H ILE 30 1.769 -36.697 -4.824 199 HA ILE 30 HA ILE 30 1.402 -33.784 -4.587 200 HB ILE 30 HB ILE 30 3.204 -34.579 -2.574 201 HG12 ILE 30 HG12 ILE 30 0.623 -36.145 -2.404 202 HG13 ILE 30 HG13 ILE 30 2.175 -36.850 -2.843 203 HG21 ILE 30 HG21 ILE 30 0.546 -33.304 -2.780 204 HG22 ILE 30 HG22 ILE 30 1.014 -33.907 -1.191 205 HG23 ILE 30 HG23 ILE 30 2.028 -32.726 -2.019 206 HD11 ILE 30 HD11 ILE 30 1.964 -37.337 -0.590 207 HD12 ILE 30 HD12 ILE 30 2.993 -35.905 -0.598 208 HD13 ILE 30 HD13 ILE 30 1.279 -35.758 -0.210 209 HA PRO 31 HA PRO 31 5.237 -33.408 -6.706 210 HB2 PRO 31 HB2 PRO 31 6.043 -30.988 -5.777 211 HB3 PRO 31 HB3 PRO 31 4.726 -31.180 -6.940 212 HG2 PRO 31 HG2 PRO 31 4.592 -30.764 -3.978 213 HG3 PRO 31 HG3 PRO 31 3.615 -30.020 -5.258 214 HD2 PRO 31 HD2 PRO 31 2.718 -32.086 -3.755 215 HD3 PRO 31 HD3 PRO 31 2.238 -31.859 -5.449 216 H SER 32 H SER 32 6.859 -34.723 -6.121 217 HA SER 32 HA SER 32 8.011 -34.518 -3.446 218 HB2 SER 32 HB2 SER 32 8.741 -36.677 -3.700 219 HB3 SER 32 HB3 SER 32 7.402 -36.713 -4.846 220 HG SER 32 HG SER 32 8.997 -37.414 -6.082 221 H GLU 33 H GLU 33 10.560 -35.164 -3.663 222 HA GLU 33 HA GLU 33 11.717 -32.843 -4.984 223 HB2 GLU 33 HB2 GLU 33 12.876 -34.856 -3.051 224 HB3 GLU 33 HB3 GLU 33 13.787 -33.519 -3.740 225 HG2 GLU 33 HG2 GLU 33 11.538 -32.301 -2.715 226 HG3 GLU 33 HG3 GLU 33 11.912 -33.551 -1.531 227 H ASP 34 H ASP 34 13.911 -33.162 -6.025 228 HA ASP 34 HA ASP 34 13.632 -34.950 -8.212 229 HB2 ASP 34 HB2 ASP 34 15.936 -33.227 -7.291 230 HB3 ASP 34 HB3 ASP 34 15.971 -34.177 -8.774 231 H ASP 35 H ASP 35 15.467 -35.028 -5.219 232 HA ASP 35 HA ASP 35 17.150 -37.197 -5.841 233 HB2 ASP 35 HB2 ASP 35 16.450 -35.646 -3.488 234 HB3 ASP 35 HB3 ASP 35 16.664 -37.350 -3.096 235 H GLY 36 H GLY 36 13.798 -37.042 -5.118 236 HA2 GLY 36 HA2 GLY 36 12.531 -39.055 -5.770 237 HA3 GLY 36 HA3 GLY 36 13.735 -39.988 -4.895 238 H THR 37 H THR 37 13.836 -38.039 -2.690 239 HA THR 37 HA THR 37 11.767 -39.175 -1.090 240 HB THR 37 HB THR 37 12.646 -37.859 0.733 241 HG1 THR 37 HG1 THR 37 14.053 -36.461 -1.312 242 HG21 THR 37 HG21 THR 37 14.598 -38.994 0.921 243 HG22 THR 37 HG22 THR 37 15.194 -38.438 -0.643 244 HG23 THR 37 HG23 THR 37 14.041 -39.769 -0.562 245 H VAL 38 H VAL 38 10.822 -37.253 0.539 246 HA VAL 38 HA VAL 38 9.506 -35.267 -1.177 247 HB VAL 38 HB VAL 38 8.108 -37.154 0.718 248 HG11 VAL 38 HG11 VAL 38 7.193 -34.577 -0.513 249 HG12 VAL 38 HG12 VAL 38 6.047 -35.845 -0.073 250 HG13 VAL 38 HG13 VAL 38 7.070 -35.110 1.163 251 HG21 VAL 38 HG21 VAL 38 7.018 -38.028 -1.138 252 HG22 VAL 38 HG22 VAL 38 7.389 -36.625 -2.141 253 HG23 VAL 38 HG23 VAL 38 8.661 -37.775 -1.729 254 H LEU 39 H LEU 39 9.331 -33.296 -0.285 255 HA LEU 39 HA LEU 39 10.638 -32.740 2.175 256 HB2 LEU 39 HB2 LEU 39 9.872 -31.294 -0.059 257 HB3 LEU 39 HB3 LEU 39 8.876 -30.633 1.236 258 HG LEU 39 HG LEU 39 11.888 -30.720 1.121 259 HD11 LEU 39 HD11 LEU 39 9.917 -28.439 1.113 260 HD12 LEU 39 HD12 LEU 39 10.900 -28.980 -0.247 261 HD13 LEU 39 HD13 LEU 39 11.672 -28.277 1.174 262 HD21 LEU 39 HD21 LEU 39 11.788 -29.490 3.264 263 HD22 LEU 39 HD22 LEU 39 11.200 -31.148 3.392 264 HD23 LEU 39 HD23 LEU 39 10.054 -29.808 3.335 265 H LEU 40 H LEU 40 9.850 -32.415 4.181 266 HA LEU 40 HA LEU 40 7.483 -33.514 5.037 267 HB2 LEU 40 HB2 LEU 40 9.458 -32.773 6.422 268 HB3 LEU 40 HB3 LEU 40 8.787 -31.145 6.357 269 HG LEU 40 HG LEU 40 8.331 -32.450 8.464 270 HD11 LEU 40 HD11 LEU 40 6.942 -30.512 7.368 271 HD12 LEU 40 HD12 LEU 40 6.339 -31.369 8.785 272 HD13 LEU 40 HD13 LEU 40 5.729 -31.778 7.182 273 HD21 LEU 40 HD21 LEU 40 7.911 -34.616 7.363 274 HD22 LEU 40 HD22 LEU 40 6.430 -33.955 6.670 275 HD23 LEU 40 HD23 LEU 40 6.587 -34.123 8.419 276 H SER 41 H SER 41 8.111 -30.145 4.144 277 HA SER 41 HA SER 41 5.703 -28.999 4.874 278 HB2 SER 41 HB2 SER 41 7.444 -28.376 2.478 279 HB3 SER 41 HB3 SER 41 6.143 -27.339 3.063 280 HG SER 41 HG SER 41 8.655 -27.442 3.902 281 H THR 42 H THR 42 6.489 -30.919 2.039 282 HA THR 42 HA THR 42 4.055 -30.430 0.648 283 HB THR 42 HB THR 42 5.884 -32.818 0.345 284 HG1 THR 42 HG1 THR 42 6.090 -30.153 -0.522 285 HG21 THR 42 HG21 THR 42 4.926 -32.243 -2.123 286 HG22 THR 42 HG22 THR 42 3.549 -31.780 -1.123 287 HG23 THR 42 HG23 THR 42 4.195 -33.418 -1.031 288 H VAL 43 H VAL 43 5.114 -32.843 2.975 289 HA VAL 43 HA VAL 43 2.928 -34.613 2.679 290 HB VAL 43 HB VAL 43 4.957 -34.167 4.838 291 HG11 VAL 43 HG11 VAL 43 2.395 -35.674 5.052 292 HG12 VAL 43 HG12 VAL 43 3.840 -36.325 5.829 293 HG13 VAL 43 HG13 VAL 43 3.249 -34.722 6.267 294 HG21 VAL 43 HG21 VAL 43 5.851 -35.457 3.133 295 HG22 VAL 43 HG22 VAL 43 5.271 -36.677 4.268 296 HG23 VAL 43 HG23 VAL 43 4.328 -36.293 2.828 297 H THR 44 H THR 44 3.489 -31.809 4.747 298 HA THR 44 HA THR 44 1.112 -32.119 6.286 299 HB THR 44 HB THR 44 1.528 -29.823 7.060 300 HG1 THR 44 HG1 THR 44 3.829 -29.745 5.415 301 HG21 THR 44 HG21 THR 44 4.228 -30.466 7.380 302 HG22 THR 44 HG22 THR 44 3.400 -32.015 7.219 303 HG23 THR 44 HG23 THR 44 2.902 -30.874 8.468 304 H ALA 45 H ALA 45 1.860 -30.646 3.229 305 HA ALA 45 HA ALA 45 -0.135 -28.793 2.892 306 HB1 ALA 45 HB1 ALA 45 0.077 -29.118 0.537 307 HB2 ALA 45 HB2 ALA 45 1.670 -29.354 1.257 308 HB3 ALA 45 HB3 ALA 45 0.710 -30.748 0.762 309 H GLN 46 H GLN 46 -0.364 -32.298 2.329 310 HA GLN 46 HA GLN 46 -3.282 -32.019 2.132 311 HB2 GLN 46 HB2 GLN 46 -1.878 -34.582 1.520 312 HB3 GLN 46 HB3 GLN 46 -3.343 -33.914 0.814 313 HG2 GLN 46 HG2 GLN 46 -2.014 -32.270 -0.403 314 HG3 GLN 46 HG3 GLN 46 -0.543 -32.931 0.309 315 HE21 GLN 46 HE21 GLN 46 -1.022 -35.620 0.145 316 HE22 GLN 46 HE22 GLN 46 -1.096 -36.098 -1.513 317 H PHE 47 H PHE 47 -0.705 -33.612 3.895 318 HA PHE 47 HA PHE 47 -2.714 -34.691 5.762 319 HB2 PHE 47 HB2 PHE 47 0.085 -35.753 5.634 320 HB3 PHE 47 HB3 PHE 47 -1.389 -36.560 6.160 321 HD1 PHE 47 HD1 PHE 47 -3.215 -36.243 3.972 322 HD2 PHE 47 HD2 PHE 47 0.984 -36.936 3.883 323 HE1 PHE 47 HE1 PHE 47 -3.437 -37.285 1.754 324 HE2 PHE 47 HE2 PHE 47 0.768 -37.977 1.665 325 HZ PHE 47 HZ PHE 47 -1.444 -38.152 0.597 326 HA PRO 48 HA PRO 48 -0.364 -31.397 8.011 327 HB2 PRO 48 HB2 PRO 48 -2.547 -30.385 9.268 328 HB3 PRO 48 HB3 PRO 48 -2.049 -29.877 7.650 329 HG2 PRO 48 HG2 PRO 48 -4.166 -31.836 8.453 330 HG3 PRO 48 HG3 PRO 48 -4.221 -30.579 7.205 331 HD2 PRO 48 HD2 PRO 48 -3.781 -33.187 6.626 332 HD3 PRO 48 HD3 PRO 48 -3.068 -31.865 5.679 333 H GLY 49 H GLY 49 0.581 -31.890 9.889 334 HA2 GLY 49 HA2 GLY 49 0.622 -32.443 12.179 335 HA3 GLY 49 HA3 GLY 49 -0.977 -33.153 12.013 336 H ALA 50 H ALA 50 -0.116 -34.667 9.600 337 HA ALA 50 HA ALA 50 0.464 -37.107 10.758 338 HB1 ALA 50 HB1 ALA 50 -0.395 -36.841 8.478 339 HB2 ALA 50 HB2 ALA 50 1.177 -36.228 7.962 340 HB3 ALA 50 HB3 ALA 50 1.021 -37.892 8.526 341 H CYS 51 H CYS 51 2.173 -37.630 11.949 342 HA CYS 51 HA CYS 51 4.727 -36.333 11.565 343 HB2 CYS 51 HB2 CYS 51 3.676 -36.974 13.817 344 HB3 CYS 51 HB3 CYS 51 4.169 -38.621 13.444 345 HG CYS 51 HG CYS 51 6.923 -37.809 13.160 346 H GLY 52 H GLY 52 3.277 -39.474 10.964 347 HA2 GLY 52 HA2 GLY 52 5.561 -40.148 9.269 348 HA3 GLY 52 HA3 GLY 52 5.183 -41.257 10.578 349 H LEU 53 H LEU 53 5.128 -41.649 7.655 350 HA LEU 53 HA LEU 53 2.278 -42.324 7.337 351 HB2 LEU 53 HB2 LEU 53 4.263 -42.056 5.099 352 HB3 LEU 53 HB3 LEU 53 2.505 -42.106 4.996 353 HG LEU 53 HG LEU 53 2.955 -39.882 4.594 354 HD11 LEU 53 HD11 LEU 53 1.785 -38.863 6.216 355 HD12 LEU 53 HD12 LEU 53 2.888 -39.388 7.487 356 HD13 LEU 53 HD13 LEU 53 1.648 -40.488 6.887 357 HD21 LEU 53 HD21 LEU 53 4.736 -38.638 5.400 358 HD22 LEU 53 HD22 LEU 53 5.424 -40.257 5.273 359 HD23 LEU 53 HD23 LEU 53 4.914 -39.635 6.844 360 H ARG 54 H ARG 54 1.707 -44.378 6.712 361 HA ARG 54 HA ARG 54 3.857 -46.378 6.849 362 HB2 ARG 54 HB2 ARG 54 1.536 -46.224 8.299 363 HB3 ARG 54 HB3 ARG 54 1.085 -47.334 7.011 364 HG2 ARG 54 HG2 ARG 54 3.443 -48.399 7.707 365 HG3 ARG 54 HG3 ARG 54 2.967 -47.689 9.251 366 HD2 ARG 54 HD2 ARG 54 0.840 -49.150 7.849 367 HD3 ARG 54 HD3 ARG 54 2.201 -50.143 8.369 368 HE ARG 54 HE ARG 54 1.296 -48.433 10.455 369 HH11 ARG 54 HH11 ARG 54 0.573 -51.391 8.768 370 HH12 ARG 54 HH12 ARG 54 -0.269 -52.101 10.105 371 HH21 ARG 54 HH21 ARG 54 0.190 -49.356 12.223 372 HH22 ARG 54 HH22 ARG 54 -0.488 -50.942 12.070 373 H TYR 55 H TYR 55 3.454 -48.388 5.548 374 HA TYR 55 HA TYR 55 2.552 -47.615 2.862 375 HB2 TYR 55 HB2 TYR 55 4.847 -49.027 3.836 376 HB3 TYR 55 HB3 TYR 55 3.924 -50.095 2.784 377 HD1 TYR 55 HD1 TYR 55 3.027 -48.763 0.575 378 HD2 TYR 55 HD2 TYR 55 6.532 -47.850 2.808 379 HE1 TYR 55 HE1 TYR 55 3.990 -47.657 -1.400 380 HE2 TYR 55 HE2 TYR 55 7.504 -46.741 0.840 381 HH TYR 55 HH TYR 55 6.983 -45.852 -1.218 382 H ARG 56 H ARG 56 0.839 -48.558 1.955 383 HA ARG 56 HA ARG 56 -0.175 -51.059 3.128 384 HB2 ARG 56 HB2 ARG 56 -1.676 -49.476 3.989 385 HB3 ARG 56 HB3 ARG 56 -1.668 -48.528 2.508 386 HG2 ARG 56 HG2 ARG 56 -3.774 -49.773 2.902 387 HG3 ARG 56 HG3 ARG 56 -2.986 -50.167 1.373 388 HD2 ARG 56 HD2 ARG 56 -2.030 -52.180 2.395 389 HD3 ARG 56 HD3 ARG 56 -2.833 -51.785 3.914 390 HE ARG 56 HE ARG 56 -4.687 -51.947 1.761 391 HH11 ARG 56 HH11 ARG 56 -2.806 -53.872 3.969 392 HH12 ARG 56 HH12 ARG 56 -3.888 -55.224 3.916 393 HH21 ARG 56 HH21 ARG 56 -6.119 -53.720 1.683 394 HH22 ARG 56 HH22 ARG 56 -5.771 -55.137 2.615 395 H ASN 57 H ASN 57 0.478 -52.410 1.515 396 HA ASN 57 HA ASN 57 -0.426 -51.784 -1.216 397 HB2 ASN 57 HB2 ASN 57 1.872 -53.430 -0.179 398 HB3 ASN 57 HB3 ASN 57 1.265 -53.641 -1.819 399 HD21 ASN 57 HD21 ASN 57 2.523 -52.651 -3.207 400 HD22 ASN 57 HD22 ASN 57 3.254 -51.099 -3.000 401 HA PRO 58 HA PRO 58 -3.409 -55.023 -0.380 402 HB2 PRO 58 HB2 PRO 58 -4.764 -54.708 -2.711 403 HB3 PRO 58 HB3 PRO 58 -4.976 -53.633 -1.324 404 HG2 PRO 58 HG2 PRO 58 -3.330 -53.237 -3.793 405 HG3 PRO 58 HG3 PRO 58 -4.380 -52.082 -2.951 406 HD2 PRO 58 HD2 PRO 58 -1.688 -52.084 -2.660 407 HD3 PRO 58 HD3 PRO 58 -2.789 -51.610 -1.351 408 H VAL 59 H VAL 59 -1.529 -54.636 -3.344 409 HA VAL 59 HA VAL 59 -1.956 -57.396 -4.127 410 HB VAL 59 HB VAL 59 -0.558 -56.890 -6.056 411 HG11 VAL 59 HG11 VAL 59 -2.971 -56.248 -6.014 412 HG12 VAL 59 HG12 VAL 59 -2.472 -54.610 -5.587 413 HG13 VAL 59 HG13 VAL 59 -1.988 -55.306 -7.134 414 HG21 VAL 59 HG21 VAL 59 0.329 -54.601 -6.377 415 HG22 VAL 59 HG22 VAL 59 -0.133 -54.219 -4.718 416 HG23 VAL 59 HG23 VAL 59 1.089 -55.452 -5.031 417 H SER 60 H SER 60 0.465 -55.459 -2.541 418 HA SER 60 HA SER 60 2.508 -57.500 -2.732 419 HB2 SER 60 HB2 SER 60 2.799 -54.890 -2.608 420 HB3 SER 60 HB3 SER 60 2.701 -55.162 -0.868 421 HG SER 60 HG SER 60 4.748 -55.656 -2.577 422 H GLN 61 H GLN 61 0.111 -56.413 -0.444 423 HA GLN 61 HA GLN 61 -0.475 -57.114 1.647 424 HB2 GLN 61 HB2 GLN 61 0.549 -59.794 0.710 425 HB3 GLN 61 HB3 GLN 61 -0.704 -59.486 1.906 426 HG2 GLN 61 HG2 GLN 61 -1.987 -58.365 -0.001 427 HG3 GLN 61 HG3 GLN 61 -0.834 -59.165 -1.068 428 HE21 GLN 61 HE21 GLN 61 -3.287 -59.854 -1.538 429 HE22 GLN 61 HE22 GLN 61 -3.687 -61.403 -0.887 430 H CYS 62 H CYS 62 2.179 -56.055 1.427 431 HA CYS 62 HA CYS 62 3.709 -57.696 3.315 432 HB2 CYS 62 HB2 CYS 62 4.480 -56.253 1.060 433 HB3 CYS 62 HB3 CYS 62 5.027 -55.268 2.410 434 HG CYS 62 HG CYS 62 5.771 -58.590 2.301 435 H MET 63 H MET 63 5.246 -55.836 4.569 436 HA MET 63 HA MET 63 3.320 -54.094 5.954 437 HB2 MET 63 HB2 MET 63 4.175 -56.334 7.110 438 HB3 MET 63 HB3 MET 63 5.551 -55.313 7.507 439 HG2 MET 63 HG2 MET 63 3.841 -53.659 8.421 440 HG3 MET 63 HG3 MET 63 2.686 -54.986 8.319 441 HE1 MET 63 HE1 MET 63 3.176 -57.331 10.715 442 HE2 MET 63 HE2 MET 63 3.331 -57.250 8.960 443 HE3 MET 63 HE3 MET 63 4.721 -57.700 9.948 444 H ARG 64 H ARG 64 5.122 -53.379 3.854 445 HA ARG 64 HA ARG 64 7.535 -52.277 4.737 446 HB2 ARG 64 HB2 ARG 64 6.247 -52.467 2.328 447 HB3 ARG 64 HB3 ARG 64 6.148 -50.741 2.651 448 HG2 ARG 64 HG2 ARG 64 8.751 -51.241 3.239 449 HG3 ARG 64 HG3 ARG 64 8.453 -52.397 1.939 450 HD2 ARG 64 HD2 ARG 64 7.249 -49.959 1.179 451 HD3 ARG 64 HD3 ARG 64 8.860 -49.573 1.783 452 HE ARG 64 HE ARG 64 9.771 -50.644 -0.034 453 HH11 ARG 64 HH11 ARG 64 6.379 -51.398 0.187 454 HH12 ARG 64 HH12 ARG 64 6.315 -52.165 -1.365 455 HH21 ARG 64 HH21 ARG 64 9.699 -51.652 -2.079 456 HH22 ARG 64 HH22 ARG 64 8.205 -52.310 -2.653 457 H GLY 65 H GLY 65 7.710 -49.666 4.260 458 HA2 GLY 65 HA2 GLY 65 5.642 -48.081 5.403 459 HA3 GLY 65 HA3 GLY 65 6.881 -48.434 6.598 460 H VAL 66 H VAL 66 5.986 -45.934 5.108 461 HA VAL 66 HA VAL 66 8.149 -45.145 3.439 462 HB VAL 66 HB VAL 66 6.100 -43.467 4.892 463 HG11 VAL 66 HG11 VAL 66 8.078 -42.149 4.371 464 HG12 VAL 66 HG12 VAL 66 8.018 -42.695 2.694 465 HG13 VAL 66 HG13 VAL 66 6.728 -41.678 3.339 466 HG21 VAL 66 HG21 VAL 66 6.084 -45.009 2.406 467 HG22 VAL 66 HG22 VAL 66 4.740 -44.407 3.376 468 HG23 VAL 66 HG23 VAL 66 5.540 -43.342 2.221 469 H ARG 67 H ARG 67 10.133 -44.574 4.011 470 HA ARG 67 HA ARG 67 10.885 -44.305 6.753 471 HB2 ARG 67 HB2 ARG 67 12.449 -45.295 5.217 472 HB3 ARG 67 HB3 ARG 67 12.408 -43.874 4.182 473 HG2 ARG 67 HG2 ARG 67 14.450 -43.863 5.423 474 HG3 ARG 67 HG3 ARG 67 13.419 -42.564 6.028 475 HD2 ARG 67 HD2 ARG 67 12.689 -44.637 7.635 476 HD3 ARG 67 HD3 ARG 67 14.396 -44.985 7.366 477 HE ARG 67 HE ARG 67 13.863 -42.256 8.105 478 HH11 ARG 67 HH11 ARG 67 14.487 -45.477 9.269 479 HH12 ARG 67 HH12 ARG 67 15.097 -44.946 10.801 480 HH21 ARG 67 HH21 ARG 67 14.663 -41.544 10.119 481 HH22 ARG 67 HH22 ARG 67 15.195 -42.708 11.284 482 H LEU 68 H LEU 68 11.462 -42.501 7.899 483 HA LEU 68 HA LEU 68 11.097 -39.897 6.578 484 HB2 LEU 68 HB2 LEU 68 9.097 -40.321 7.834 485 HB3 LEU 68 HB3 LEU 68 10.034 -40.773 9.257 486 HG LEU 68 HG LEU 68 8.876 -38.452 9.155 487 HD11 LEU 68 HD11 LEU 68 10.941 -39.482 10.601 488 HD12 LEU 68 HD12 LEU 68 10.181 -37.919 10.892 489 HD13 LEU 68 HD13 LEU 68 11.660 -38.015 9.938 490 HD21 LEU 68 HD21 LEU 68 9.794 -36.787 7.921 491 HD22 LEU 68 HD22 LEU 68 10.208 -38.137 6.865 492 HD23 LEU 68 HD23 LEU 68 11.413 -37.484 7.976 493 H VAL 69 H VAL 69 12.890 -38.737 6.706 494 HA VAL 69 HA VAL 69 14.487 -38.842 9.167 495 HB VAL 69 HB VAL 69 15.705 -40.276 7.701 496 HG11 VAL 69 HG11 VAL 69 15.365 -40.121 5.509 497 HG12 VAL 69 HG12 VAL 69 14.722 -38.485 5.665 498 HG13 VAL 69 HG13 VAL 69 16.460 -38.738 5.501 499 HG21 VAL 69 HG21 VAL 69 17.353 -37.941 7.123 500 HG22 VAL 69 HG22 VAL 69 16.766 -37.987 8.785 501 HG23 VAL 69 HG23 VAL 69 17.691 -39.343 8.139 502 H GLU 70 H GLU 70 14.668 -36.863 9.963 503 HA GLU 70 HA GLU 70 14.840 -34.601 10.137 504 HB2 GLU 70 HB2 GLU 70 15.826 -34.606 7.287 505 HB3 GLU 70 HB3 GLU 70 16.174 -33.429 8.545 506 HG2 GLU 70 HG2 GLU 70 17.056 -35.832 9.602 507 HG3 GLU 70 HG3 GLU 70 17.517 -35.904 7.902 508 H GLY 71 H GLY 71 12.402 -35.868 9.051 509 HA2 GLY 71 HA2 GLY 71 10.322 -34.861 8.642 510 HA3 GLY 71 HA3 GLY 71 11.155 -33.414 8.091 511 H ILE 72 H ILE 72 12.906 -35.070 6.324 512 HA ILE 72 HA ILE 72 11.187 -35.002 4.020 513 HB ILE 72 HB ILE 72 14.063 -35.891 4.266 514 HG12 ILE 72 HG12 ILE 72 13.716 -33.457 2.815 515 HG13 ILE 72 HG13 ILE 72 12.864 -33.308 4.348 516 HG21 ILE 72 HG21 ILE 72 12.166 -35.876 2.035 517 HG22 ILE 72 HG22 ILE 72 13.711 -35.104 1.685 518 HG23 ILE 72 HG23 ILE 72 13.668 -36.776 2.244 519 HD11 ILE 72 HD11 ILE 72 15.551 -32.889 3.913 520 HD12 ILE 72 HD12 ILE 72 14.761 -33.092 5.477 521 HD13 ILE 72 HD13 ILE 72 15.491 -34.480 4.671 522 H LEU 73 H LEU 73 9.840 -36.610 3.569 523 HA LEU 73 HA LEU 73 10.161 -39.248 4.608 524 HB2 LEU 73 HB2 LEU 73 8.253 -38.000 2.654 525 HB3 LEU 73 HB3 LEU 73 8.219 -39.725 3.014 526 HG LEU 73 HG LEU 73 6.521 -38.616 4.299 527 HD11 LEU 73 HD11 LEU 73 8.855 -39.315 6.073 528 HD12 LEU 73 HD12 LEU 73 7.725 -40.468 5.365 529 HD13 LEU 73 HD13 LEU 73 7.155 -39.285 6.542 530 HD21 LEU 73 HD21 LEU 73 7.750 -36.381 4.232 531 HD22 LEU 73 HD22 LEU 73 8.628 -36.956 5.650 532 HD23 LEU 73 HD23 LEU 73 6.873 -36.778 5.710 533 H HIS 74 H HIS 74 11.652 -40.601 3.862 534 HA HIS 74 HA HIS 74 12.631 -40.427 1.151 535 HB2 HIS 74 HB2 HIS 74 13.703 -41.293 3.566 536 HB3 HIS 74 HB3 HIS 74 13.485 -42.777 2.642 537 HD1 HIS 74 HD1 HIS 74 14.395 -42.280 -0.054 538 HD2 HIS 74 HD2 HIS 74 16.184 -40.340 3.155 539 HE1 HIS 74 HE1 HIS 74 16.660 -41.563 -0.879 540 H ALA 75 H ALA 75 12.511 -42.061 -0.418 541 HA ALA 75 HA ALA 75 10.115 -43.725 -0.188 542 HB1 ALA 75 HB1 ALA 75 11.613 -42.514 -2.436 543 HB2 ALA 75 HB2 ALA 75 10.806 -44.052 -2.742 544 HB3 ALA 75 HB3 ALA 75 9.875 -42.664 -2.179 545 HA PRO 76 HA PRO 76 12.281 -47.529 0.139 546 HB2 PRO 76 HB2 PRO 76 10.676 -49.186 -1.292 547 HB3 PRO 76 HB3 PRO 76 10.229 -48.551 0.296 548 HG2 PRO 76 HG2 PRO 76 9.405 -47.606 -2.423 549 HG3 PRO 76 HG3 PRO 76 8.420 -47.808 -0.962 550 HD2 PRO 76 HD2 PRO 76 9.349 -45.397 -1.772 551 HD3 PRO 76 HD3 PRO 76 9.124 -45.807 -0.059 552 H ASP 77 H ASP 77 12.782 -49.553 -1.422 553 HA ASP 77 HA ASP 77 14.518 -48.482 -3.449 554 HB2 ASP 77 HB2 ASP 77 14.148 -51.055 -2.077 555 HB3 ASP 77 HB3 ASP 77 14.631 -51.202 -3.765 556 H ALA 78 H ALA 78 11.306 -49.157 -3.437 557 HA ALA 78 HA ALA 78 11.280 -50.022 -6.252 558 HB1 ALA 78 HB1 ALA 78 9.917 -51.067 -4.099 559 HB2 ALA 78 HB2 ALA 78 8.708 -50.062 -4.899 560 HB3 ALA 78 HB3 ALA 78 9.534 -51.333 -5.800 561 H GLY 79 H GLY 79 10.383 -47.497 -4.046 562 HA2 GLY 79 HA2 GLY 79 10.197 -45.260 -5.047 563 HA3 GLY 79 HA3 GLY 79 9.232 -45.997 -6.318 564 H TRP 80 H TRP 80 7.997 -43.971 -5.377 565 HA TRP 80 HA TRP 80 6.557 -44.323 -2.957 566 HB2 TRP 80 HB2 TRP 80 6.096 -42.542 -5.353 567 HB3 TRP 80 HB3 TRP 80 5.082 -42.497 -3.913 568 HD1 TRP 80 HD1 TRP 80 7.896 -40.739 -5.336 569 HE1 TRP 80 HE1 TRP 80 9.249 -39.485 -3.541 570 HE3 TRP 80 HE3 TRP 80 6.025 -43.027 -1.164 571 HZ2 TRP 80 HZ2 TRP 80 9.491 -39.469 -0.729 572 HZ3 TRP 80 HZ3 TRP 80 6.871 -42.334 1.040 573 HH2 TRP 80 HH2 TRP 80 8.569 -40.592 1.251 574 H GLY 81 H GLY 81 5.444 -44.504 -6.350 575 HA2 GLY 81 HA2 GLY 81 3.992 -46.062 -7.292 576 HA3 GLY 81 HA3 GLY 81 3.778 -46.786 -5.705 577 H ASN 82 H ASN 82 1.504 -46.867 -6.446 578 HA ASN 82 HA ASN 82 0.141 -44.340 -5.793 579 HB2 ASN 82 HB2 ASN 82 -1.123 -46.298 -7.671 580 HB3 ASN 82 HB3 ASN 82 -1.369 -44.559 -7.539 581 HD21 ASN 82 HD21 ASN 82 1.102 -43.537 -7.720 582 HD22 ASN 82 HD22 ASN 82 1.815 -43.922 -9.246 583 H LEU 83 H LEU 83 0.830 -46.508 -4.030 584 HA LEU 83 HA LEU 83 -1.648 -47.949 -3.556 585 HB2 LEU 83 HB2 LEU 83 -0.316 -48.858 -1.585 586 HB3 LEU 83 HB3 LEU 83 0.224 -49.290 -3.206 587 HG LEU 83 HG LEU 83 1.978 -48.656 -1.421 588 HD11 LEU 83 HD11 LEU 83 1.893 -48.477 -4.204 589 HD12 LEU 83 HD12 LEU 83 3.326 -48.561 -3.180 590 HD13 LEU 83 HD13 LEU 83 2.678 -46.994 -3.662 591 HD21 LEU 83 HD21 LEU 83 0.772 -46.581 -0.739 592 HD22 LEU 83 HD22 LEU 83 1.182 -45.888 -2.309 593 HD23 LEU 83 HD23 LEU 83 2.462 -46.327 -1.176 594 H VAL 84 H VAL 84 -1.983 -48.128 -0.945 595 HA VAL 84 HA VAL 84 -2.751 -45.417 -0.183 596 HB VAL 84 HB VAL 84 -3.445 -47.927 1.325 597 HG11 VAL 84 HG11 VAL 84 -4.277 -46.325 2.661 598 HG12 VAL 84 HG12 VAL 84 -4.237 -45.102 1.389 599 HG13 VAL 84 HG13 VAL 84 -5.575 -46.248 1.470 600 HG21 VAL 84 HG21 VAL 84 -4.264 -48.536 -0.746 601 HG22 VAL 84 HG22 VAL 84 -5.644 -47.684 -0.053 602 HG23 VAL 84 HG23 VAL 84 -4.602 -46.871 -1.220 603 H TYR 85 H TYR 85 -2.464 -44.709 2.056 604 HA TYR 85 HA TYR 85 -0.150 -45.913 3.404 605 HB2 TYR 85 HB2 TYR 85 1.119 -44.038 3.343 606 HB3 TYR 85 HB3 TYR 85 0.147 -43.662 1.924 607 HD1 TYR 85 HD1 TYR 85 0.528 -43.007 5.545 608 HD2 TYR 85 HD2 TYR 85 -1.337 -41.812 1.912 609 HE1 TYR 85 HE1 TYR 85 -0.235 -40.934 6.626 610 HE2 TYR 85 HE2 TYR 85 -2.104 -39.734 2.983 611 HH TYR 85 HH TYR 85 -2.521 -38.826 5.149 612 H VAL 86 H VAL 86 -0.095 -45.668 5.640 613 HA VAL 86 HA VAL 86 -2.627 -44.749 6.829 614 HB VAL 86 HB VAL 86 -0.637 -46.777 7.853 615 HG11 VAL 86 HG11 VAL 86 -2.883 -45.358 9.166 616 HG12 VAL 86 HG12 VAL 86 -2.708 -47.082 9.499 617 HG13 VAL 86 HG13 VAL 86 -1.379 -45.976 9.847 618 HG21 VAL 86 HG21 VAL 86 -3.201 -46.931 6.397 619 HG22 VAL 86 HG22 VAL 86 -1.827 -48.035 6.395 620 HG23 VAL 86 HG23 VAL 86 -2.986 -48.073 7.723 621 H VAL 87 H VAL 87 -2.596 -43.032 8.120 622 HA VAL 87 HA VAL 87 -0.265 -41.522 8.581 623 HB VAL 87 HB VAL 87 -2.795 -41.295 10.201 624 HG11 VAL 87 HG11 VAL 87 -1.273 -39.813 11.102 625 HG12 VAL 87 HG12 VAL 87 -0.500 -39.497 9.547 626 HG13 VAL 87 HG13 VAL 87 -2.084 -38.806 9.903 627 HG21 VAL 87 HG21 VAL 87 -2.992 -39.470 8.135 628 HG22 VAL 87 HG22 VAL 87 -2.413 -40.936 7.344 629 HG23 VAL 87 HG23 VAL 87 -3.902 -40.974 8.289 630 H ASN 88 H ASN 88 0.742 -40.983 10.603 631 HA ASN 88 HA ASN 88 0.355 -42.850 12.810 632 HB2 ASN 88 HB2 ASN 88 2.136 -43.721 11.164 633 HB3 ASN 88 HB3 ASN 88 3.136 -42.394 11.748 634 HD21 ASN 88 HD21 ASN 88 4.646 -43.411 12.899 635 HD22 ASN 88 HD22 ASN 88 4.336 -44.465 14.232 636 H TYR 89 H TYR 89 -0.230 -41.300 14.243 637 HA TYR 89 HA TYR 89 1.381 -38.882 14.491 638 HB2 TYR 89 HB2 TYR 89 -1.154 -39.709 15.920 639 HB3 TYR 89 HB3 TYR 89 -0.365 -38.143 16.068 640 HD1 TYR 89 HD1 TYR 89 -0.243 -36.646 14.050 641 HD2 TYR 89 HD2 TYR 89 -2.630 -40.167 14.132 642 HE1 TYR 89 HE1 TYR 89 -1.532 -35.810 12.129 643 HE2 TYR 89 HE2 TYR 89 -3.924 -39.342 12.211 644 HH TYR 89 HH TYR 89 -3.953 -36.232 11.214 645 HA PRO 90 HA PRO 90 3.706 -40.194 17.975 646 HB2 PRO 90 HB2 PRO 90 3.940 -37.869 19.357 647 HB3 PRO 90 HB3 PRO 90 4.806 -38.181 17.848 648 HG2 PRO 90 HG2 PRO 90 2.287 -36.627 18.300 649 HG3 PRO 90 HG3 PRO 90 3.676 -36.232 17.271 650 HD2 PRO 90 HD2 PRO 90 1.381 -37.274 16.282 651 HD3 PRO 90 HD3 PRO 90 2.971 -37.617 15.569 652 H LYS 91 H LYS 91 0.846 -38.227 18.705 653 HA LYS 91 HA LYS 91 -0.687 -38.310 20.384 654 HB2 LYS 91 HB2 LYS 91 -0.749 -40.709 19.482 655 HB3 LYS 91 HB3 LYS 91 0.211 -41.141 20.890 656 HG2 LYS 91 HG2 LYS 91 -1.605 -40.123 22.303 657 HG3 LYS 91 HG3 LYS 91 -2.576 -40.020 20.832 658 HD2 LYS 91 HD2 LYS 91 -1.344 -42.643 21.343 659 HD3 LYS 91 HD3 LYS 91 -2.568 -42.146 22.514 660 HE2 LYS 91 HE2 LYS 91 -3.087 -41.930 19.572 661 HE3 LYS 91 HE3 LYS 91 -3.293 -43.468 20.408 662 HZ1 LYS 91 HZ1 LYS 91 -4.733 -42.125 22.014 663 HZ2 LYS 91 HZ2 LYS 91 -5.381 -42.495 20.496 664 HZ3 LYS 91 HZ3 LYS 91 -4.774 -40.946 20.801 665 H ASP 92 H ASP 92 1.078 -36.866 21.370 666 HA ASP 92 HA ASP 92 1.410 -37.695 24.111 667 HB2 ASP 92 HB2 ASP 92 3.498 -38.326 22.470 668 HB3 ASP 92 HB3 ASP 92 3.970 -36.723 23.026 669 H ASN 93 H ASN 93 3.074 -35.799 25.070 670 HA ASN 93 HA ASN 93 1.926 -33.254 24.132 671 HB2 ASN 93 HB2 ASN 93 2.415 -34.052 27.011 672 HB3 ASN 93 HB3 ASN 93 1.787 -32.501 26.461 673 HD21 ASN 93 HD21 ASN 93 0.869 -35.189 27.905 674 HD22 ASN 93 HD22 ASN 93 -0.752 -35.344 27.326 675 H LYS 94 H LYS 94 3.590 -32.257 23.177 676 HA LYS 94 HA LYS 94 5.837 -31.443 24.761 677 HB2 LYS 94 HB2 LYS 94 7.558 -32.370 23.225 678 HB3 LYS 94 HB3 LYS 94 6.687 -33.608 24.121 679 HG2 LYS 94 HG2 LYS 94 5.436 -34.240 22.222 680 HG3 LYS 94 HG3 LYS 94 5.947 -32.810 21.321 681 HD2 LYS 94 HD2 LYS 94 8.341 -33.781 21.697 682 HD3 LYS 94 HD3 LYS 94 7.477 -35.296 21.970 683 HE2 LYS 94 HE2 LYS 94 6.316 -34.255 19.679 684 HE3 LYS 94 HE3 LYS 94 8.030 -33.887 19.494 685 HZ1 LYS 94 HZ1 LYS 94 8.016 -35.971 18.650 686 HZ2 LYS 94 HZ2 LYS 94 6.682 -36.472 19.561 687 HZ3 LYS 94 HZ3 LYS 94 8.213 -36.391 20.277 688 H ARG 95 H ARG 95 7.064 -29.770 23.777 689 HA ARG 95 HA ARG 95 6.605 -28.875 21.126 690 HB2 ARG 95 HB2 ARG 95 4.512 -28.237 22.741 691 HB3 ARG 95 HB3 ARG 95 5.537 -26.824 22.956 692 HG2 ARG 95 HG2 ARG 95 5.423 -27.431 20.182 693 HG3 ARG 95 HG3 ARG 95 3.780 -27.420 20.825 694 HD2 ARG 95 HD2 ARG 95 4.284 -25.211 21.870 695 HD3 ARG 95 HD3 ARG 95 5.833 -25.223 21.028 696 HE ARG 95 HE ARG 95 3.708 -25.619 19.202 697 HH11 ARG 95 HH11 ARG 95 5.245 -23.164 21.133 698 HH12 ARG 95 HH12 ARG 95 4.792 -21.867 20.078 699 HH21 ARG 95 HH21 ARG 95 3.106 -23.920 17.805 700 HH22 ARG 95 HH22 ARG 95 3.575 -22.297 18.186 701 H LYS 96 H LYS 96 7.431 -26.496 20.916 702 HA LYS 96 HA LYS 96 9.195 -25.470 22.867 703 HB2 LYS 96 HB2 LYS 96 11.339 -26.010 21.913 704 HB3 LYS 96 HB3 LYS 96 10.473 -27.509 22.221 705 HG2 LYS 96 HG2 LYS 96 9.736 -27.172 19.702 706 HG3 LYS 96 HG3 LYS 96 11.241 -26.251 19.649 707 HD2 LYS 96 HD2 LYS 96 12.513 -28.098 19.813 708 HD3 LYS 96 HD3 LYS 96 11.454 -28.836 21.016 709 HE2 LYS 96 HE2 LYS 96 11.187 -30.263 19.227 710 HE3 LYS 96 HE3 LYS 96 9.839 -29.150 18.995 711 HZ1 LYS 96 HZ1 LYS 96 10.816 -29.323 16.908 712 HZ2 LYS 96 HZ2 LYS 96 12.393 -29.274 17.518 713 HZ3 LYS 96 HZ3 LYS 96 11.446 -27.872 17.511 714 H MET 97 H MET 97 10.938 -23.992 21.571 715 HA MET 97 HA MET 97 9.805 -22.855 19.162 716 HB2 MET 97 HB2 MET 97 9.439 -20.652 20.030 717 HB3 MET 97 HB3 MET 97 8.546 -21.781 21.040 718 HG2 MET 97 HG2 MET 97 10.285 -21.674 22.731 719 HG3 MET 97 HG3 MET 97 11.226 -20.588 21.712 720 HE1 MET 97 HE1 MET 97 10.429 -19.830 24.794 721 HE2 MET 97 HE2 MET 97 8.793 -19.201 24.989 722 HE3 MET 97 HE3 MET 97 9.042 -20.899 24.580 723 H ASP 98 H ASP 98 11.145 -20.556 18.914 724 HA ASP 98 HA ASP 98 13.970 -21.340 19.222 725 HB2 ASP 98 HB2 ASP 98 14.474 -20.327 17.134 726 HB3 ASP 98 HB3 ASP 98 13.022 -21.288 16.865 727 H GLU 99 H GLU 99 15.281 -19.092 18.624 728 HA GLU 99 HA GLU 99 14.170 -16.855 20.100 729 HB2 GLU 99 HB2 GLU 99 16.034 -16.714 21.673 730 HB3 GLU 99 HB3 GLU 99 15.160 -18.227 21.872 731 HG2 GLU 99 HG2 GLU 99 16.926 -19.474 21.289 732 HG3 GLU 99 HG3 GLU 99 17.427 -18.359 20.020 733 H THR 100 H THR 100 16.266 -15.236 20.384 734 HA THR 100 HA THR 100 17.839 -15.222 17.935 735 HB THR 100 HB THR 100 15.718 -14.044 17.361 736 HG1 THR 100 HG1 THR 100 16.976 -12.911 16.103 737 HG21 THR 100 HG21 THR 100 15.197 -11.912 18.347 738 HG22 THR 100 HG22 THR 100 16.647 -11.973 19.350 739 HG23 THR 100 HG23 THR 100 15.326 -13.105 19.638 740 H ASP 101 H ASP 101 19.272 -13.170 17.919 741 HA ASP 101 HA ASP 101 20.362 -12.870 20.629 742 HB2 ASP 101 HB2 ASP 101 21.757 -12.156 18.051 743 HB3 ASP 101 HB3 ASP 101 22.477 -12.417 19.638 744 H ALA 102 H ALA 102 21.861 -10.623 20.393 745 HA ALA 102 HA ALA 102 20.228 -8.450 19.387 746 HB1 ALA 102 HB1 ALA 102 20.897 -8.345 22.302 747 HB2 ALA 102 HB2 ALA 102 19.687 -7.433 21.397 748 HB3 ALA 102 HB3 ALA 102 19.424 -9.141 21.749 749 H SER 103 H SER 103 21.368 -6.323 20.617 750 HA SER 103 HA SER 103 24.268 -6.646 20.374 751 HB2 SER 103 HB2 SER 103 23.766 -4.200 19.130 752 HB3 SER 103 HB3 SER 103 24.266 -5.695 18.339 753 HG SER 103 HG SER 103 22.279 -6.012 17.644 754 H SER 104 H SER 104 25.255 -4.284 20.782 755 HA SER 104 HA SER 104 24.191 -3.504 23.388 756 HB2 SER 104 HB2 SER 104 26.346 -2.407 23.735 757 HB3 SER 104 HB3 SER 104 26.595 -4.068 23.197 758 HG SER 104 HG SER 104 26.697 -1.758 21.548 759 H ALA 105 H ALA 105 25.036 -0.960 23.694 760 HA ALA 105 HA ALA 105 24.170 0.688 21.484 761 HB1 ALA 105 HB1 ALA 105 22.072 -0.113 22.686 762 HB2 ALA 105 HB2 ALA 105 22.588 0.910 24.027 763 HB3 ALA 105 HB3 ALA 105 22.249 1.626 22.451 764 H VAL 106 H VAL 106 23.764 3.065 22.677 765 HA VAL 106 HA VAL 106 26.207 3.502 24.270 766 HB VAL 106 HB VAL 106 26.427 4.378 21.972 767 HG11 VAL 106 HG11 VAL 106 23.985 4.872 21.697 768 HG12 VAL 106 HG12 VAL 106 24.229 6.307 22.695 769 HG13 VAL 106 HG13 VAL 106 25.066 6.152 21.150 770 HG21 VAL 106 HG21 VAL 106 26.279 6.899 23.438 771 HG22 VAL 106 HG22 VAL 106 27.090 5.611 24.329 772 HG23 VAL 106 HG23 VAL 106 27.671 6.078 22.731 773 H LYS 107 H LYS 107 26.116 4.955 25.959 774 HA LYS 107 HA LYS 107 23.508 5.399 27.086 775 HB2 LYS 107 HB2 LYS 107 24.641 6.128 29.040 776 HB3 LYS 107 HB3 LYS 107 25.585 4.791 28.396 777 HG2 LYS 107 HG2 LYS 107 27.346 6.130 28.601 778 HG3 LYS 107 HG3 LYS 107 26.720 6.988 27.192 779 HD2 LYS 107 HD2 LYS 107 25.394 8.418 28.772 780 HD3 LYS 107 HD3 LYS 107 26.271 7.651 30.099 781 HE2 LYS 107 HE2 LYS 107 28.270 8.423 28.357 782 HE3 LYS 107 HE3 LYS 107 27.111 9.749 28.266 783 HZ1 LYS 107 HZ1 LYS 107 27.228 9.351 30.899 784 HZ2 LYS 107 HZ2 LYS 107 28.209 10.455 30.075 785 HZ3 LYS 107 HZ3 LYS 107 28.807 8.922 30.466 786 H VAL 108 H VAL 108 22.627 7.433 27.687 787 HA VAL 108 HA VAL 108 23.790 9.821 26.482 788 HB VAL 108 HB VAL 108 21.551 10.440 25.500 789 HG11 VAL 108 HG11 VAL 108 22.406 8.021 24.035 790 HG12 VAL 108 HG12 VAL 108 22.213 9.682 23.472 791 HG13 VAL 108 HG13 VAL 108 23.656 9.217 24.375 792 HG21 VAL 108 HG21 VAL 108 19.783 9.109 25.709 793 HG22 VAL 108 HG22 VAL 108 20.679 7.731 25.068 794 HG23 VAL 108 HG23 VAL 108 20.738 8.097 26.792 795 H LYS 109 H LYS 109 22.960 11.783 27.324 796 HA LYS 109 HA LYS 109 21.807 11.472 29.989 797 HB2 LYS 109 HB2 LYS 109 22.966 13.932 28.665 798 HB3 LYS 109 HB3 LYS 109 22.508 13.783 30.356 799 HG2 LYS 109 HG2 LYS 109 24.626 13.242 30.742 800 HG3 LYS 109 HG3 LYS 109 24.264 11.690 29.984 801 HD2 LYS 109 HD2 LYS 109 26.097 12.375 28.767 802 HD3 LYS 109 HD3 LYS 109 24.773 12.981 27.770 803 HE2 LYS 109 HE2 LYS 109 25.155 15.170 28.357 804 HE3 LYS 109 HE3 LYS 109 25.896 14.740 29.898 805 HZ1 LYS 109 HZ1 LYS 109 27.269 15.527 27.749 806 HZ2 LYS 109 HZ2 LYS 109 27.330 13.850 27.543 807 HZ3 LYS 109 HZ3 LYS 109 27.915 14.548 28.968 808 H ARG 110 H ARG 110 19.632 11.206 29.711 809 HA ARG 110 HA ARG 110 18.134 12.934 27.943 810 HB2 ARG 110 HB2 ARG 110 17.739 10.389 28.903 811 HB3 ARG 110 HB3 ARG 110 16.610 11.332 29.867 812 HG2 ARG 110 HG2 ARG 110 16.264 12.250 27.263 813 HG3 ARG 110 HG3 ARG 110 16.431 10.499 27.117 814 HD2 ARG 110 HD2 ARG 110 14.773 10.640 29.233 815 HD3 ARG 110 HD3 ARG 110 14.304 12.110 28.379 816 HE ARG 110 HE ARG 110 13.320 10.815 26.771 817 HH11 ARG 110 HH11 ARG 110 15.473 8.837 28.662 818 HH12 ARG 110 HH12 ARG 110 14.964 7.352 27.928 819 HH21 ARG 110 HH21 ARG 110 12.642 8.867 25.796 820 HH22 ARG 110 HH22 ARG 110 13.355 7.371 26.297 821 H ALA 111 H ALA 111 16.788 14.589 28.512 822 HA ALA 111 HA ALA 111 17.077 15.584 31.259 823 HB1 ALA 111 HB1 ALA 111 17.521 16.885 28.936 824 HB2 ALA 111 HB2 ALA 111 15.840 17.328 29.236 825 HB3 ALA 111 HB3 ALA 111 17.074 17.684 30.444 826 H VAL 112 H VAL 112 15.068 17.041 31.861 827 HA VAL 112 HA VAL 112 12.566 15.709 31.129 828 HB VAL 112 HB VAL 112 13.387 14.581 33.169 829 HG11 VAL 112 HG11 VAL 112 14.392 16.936 33.933 830 HG12 VAL 112 HG12 VAL 112 12.875 16.972 34.834 831 HG13 VAL 112 HG13 VAL 112 14.012 15.643 35.071 832 HG21 VAL 112 HG21 VAL 112 11.041 16.247 33.985 833 HG22 VAL 112 HG22 VAL 112 10.911 15.136 32.622 834 HG23 VAL 112 HG23 VAL 112 11.324 14.523 34.223 835 H GLN 113 H GLN 113 10.827 17.040 31.070 836 HA GLN 113 HA GLN 113 10.803 19.570 32.446 837 HB2 GLN 113 HB2 GLN 113 11.652 19.393 29.672 838 HB3 GLN 113 HB3 GLN 113 10.239 20.423 29.859 839 HG2 GLN 113 HG2 GLN 113 11.454 22.065 30.709 840 HG3 GLN 113 HG3 GLN 113 12.193 20.990 31.894 841 HE21 GLN 113 HE21 GLN 113 12.917 23.083 29.564 842 HE22 GLN 113 HE22 GLN 113 14.408 22.426 28.990 843 H LYS 114 H LYS 114 8.763 20.780 32.015 844 HA LYS 114 HA LYS 114 6.584 18.897 31.391 845 HB2 LYS 114 HB2 LYS 114 6.707 19.641 33.762 846 HB3 LYS 114 HB3 LYS 114 6.492 21.301 33.223 847 HG2 LYS 114 HG2 LYS 114 4.446 19.445 32.253 848 HG3 LYS 114 HG3 LYS 114 4.491 19.641 34.007 849 HD2 LYS 114 HD2 LYS 114 4.547 22.162 33.525 850 HD3 LYS 114 HD3 LYS 114 4.040 21.724 31.891 851 HE2 LYS 114 HE2 LYS 114 1.946 21.252 32.543 852 HE3 LYS 114 HE3 LYS 114 2.486 20.434 34.009 853 HZ1 LYS 114 HZ1 LYS 114 1.209 22.405 34.537 854 HZ2 LYS 114 HZ2 LYS 114 2.268 23.373 33.641 855 HZ3 LYS 114 HZ3 LYS 114 2.812 22.600 35.044 Start of MODEL 11 1 H1 MET 1 H MET 1 44.532 -24.474 9.627 2 HA MET 1 HA MET 1 45.410 -25.215 11.911 3 HB2 MET 1 HB2 MET 1 42.530 -25.962 11.934 4 HB3 MET 1 HB3 MET 1 43.661 -27.071 12.699 5 HG2 MET 1 HG2 MET 1 44.484 -24.758 13.782 6 HG3 MET 1 HG3 MET 1 42.781 -24.385 13.524 7 HE1 MET 1 HE1 MET 1 40.945 -25.377 14.364 8 HE2 MET 1 HE2 MET 1 40.796 -26.540 15.682 9 HE3 MET 1 HE3 MET 1 41.247 -24.869 16.026 10 H ALA 2 H ALA 2 43.260 -27.096 9.772 11 HA ALA 2 HA ALA 2 45.511 -28.548 8.701 12 HB1 ALA 2 HB1 ALA 2 45.438 -30.284 10.082 13 HB2 ALA 2 HB2 ALA 2 44.011 -29.642 10.895 14 HB3 ALA 2 HB3 ALA 2 43.829 -30.650 9.459 15 H GLY 3 H GLY 3 42.075 -29.413 9.057 16 HA2 GLY 3 HA2 GLY 3 41.884 -29.442 6.119 17 HA3 GLY 3 HA3 GLY 3 40.848 -30.345 7.214 18 H SER 4 H SER 4 40.940 -27.766 5.184 19 HA SER 4 HA SER 4 38.801 -26.367 6.653 20 HB2 SER 4 HB2 SER 4 39.536 -24.489 4.895 21 HB3 SER 4 HB3 SER 4 40.330 -24.670 6.459 22 HG SER 4 HG SER 4 41.966 -24.649 5.020 23 H HIS 5 H HIS 5 37.090 -27.538 5.825 24 HA HIS 5 HA HIS 5 36.778 -28.080 3.042 25 HB2 HIS 5 HB2 HIS 5 35.733 -29.418 4.889 26 HB3 HIS 5 HB3 HIS 5 34.634 -28.071 5.174 27 HD1 HIS 5 HD1 HIS 5 35.669 -29.761 1.921 28 HD2 HIS 5 HD2 HIS 5 32.270 -28.858 4.133 29 HE1 HIS 5 HE1 HIS 5 33.729 -30.523 0.514 30 H HIS 6 H HIS 6 35.393 -27.119 1.549 31 HA HIS 6 HA HIS 6 33.848 -24.792 2.226 32 HB2 HIS 6 HB2 HIS 6 36.480 -24.265 1.759 33 HB3 HIS 6 HB3 HIS 6 35.814 -24.114 0.136 34 HD1 HIS 6 HD1 HIS 6 36.607 -22.064 2.847 35 HD2 HIS 6 HD2 HIS 6 33.258 -22.376 0.407 36 HE1 HIS 6 HE1 HIS 6 35.408 -19.864 3.066 37 H HIS 7 H HIS 7 32.054 -25.383 1.181 38 HA HIS 7 HA HIS 7 31.884 -25.297 -1.623 39 HB2 HIS 7 HB2 HIS 7 32.874 -27.727 -0.798 40 HB3 HIS 7 HB3 HIS 7 31.148 -28.050 -0.927 41 HD1 HIS 7 HD1 HIS 7 33.292 -29.284 -2.848 42 HD2 HIS 7 HD2 HIS 7 30.981 -25.929 -3.663 43 HE1 HIS 7 HE1 HIS 7 33.226 -29.106 -5.355 44 H HIS 8 H HIS 8 29.974 -24.340 -1.788 45 HA HIS 8 HA HIS 8 27.965 -24.310 0.122 46 HB2 HIS 8 HB2 HIS 8 28.365 -22.907 -2.101 47 HB3 HIS 8 HB3 HIS 8 27.189 -24.049 -2.746 48 HD1 HIS 8 HD1 HIS 8 26.267 -21.244 -2.724 49 HD2 HIS 8 HD2 HIS 8 25.845 -23.703 0.598 50 HE1 HIS 8 HE1 HIS 8 24.412 -20.226 -1.366 51 H HIS 9 H HIS 9 28.027 -26.187 -2.911 52 HA HIS 9 HA HIS 9 26.082 -28.034 -1.688 53 HB2 HIS 9 HB2 HIS 9 26.238 -26.824 -4.372 54 HB3 HIS 9 HB3 HIS 9 25.879 -28.548 -4.357 55 HD1 HIS 9 HD1 HIS 9 23.517 -29.195 -3.884 56 HD2 HIS 9 HD2 HIS 9 24.312 -25.253 -2.841 57 HE1 HIS 9 HE1 HIS 9 21.293 -28.204 -3.255 58 H HIS 10 H HIS 10 26.311 -30.278 -2.154 59 HA HIS 10 HA HIS 10 29.088 -31.033 -2.766 60 HB2 HIS 10 HB2 HIS 10 26.994 -32.556 -1.200 61 HB3 HIS 10 HB3 HIS 10 28.654 -33.078 -1.473 62 HD1 HIS 10 HD1 HIS 10 27.524 -32.670 1.378 63 HD2 HIS 10 HD2 HIS 10 29.660 -29.806 -0.742 64 HE1 HIS 10 HE1 HIS 10 28.492 -31.131 3.115 65 H GLY 11 H GLY 11 25.776 -32.330 -3.093 66 HA2 GLY 11 HA2 GLY 11 24.766 -33.369 -4.887 67 HA3 GLY 11 HA3 GLY 11 26.148 -32.906 -5.869 68 H SER 12 H SER 12 24.765 -35.365 -3.828 69 HA SER 12 HA SER 12 26.834 -37.235 -4.779 70 HB2 SER 12 HB2 SER 12 25.409 -37.584 -2.149 71 HB3 SER 12 HB3 SER 12 26.905 -38.338 -2.698 72 HG SER 12 HG SER 12 27.206 -36.604 -1.174 73 H MET 13 H MET 13 25.998 -39.593 -4.451 74 HA MET 13 HA MET 13 23.692 -39.873 -6.093 75 HB2 MET 13 HB2 MET 13 25.548 -41.468 -6.185 76 HB3 MET 13 HB3 MET 13 25.229 -41.951 -4.525 77 HG2 MET 13 HG2 MET 13 23.864 -43.513 -5.275 78 HG3 MET 13 HG3 MET 13 22.809 -42.253 -5.911 79 HE1 MET 13 HE1 MET 13 22.472 -43.371 -9.269 80 HE2 MET 13 HE2 MET 13 21.864 -42.656 -7.775 81 HE3 MET 13 HE3 MET 13 22.843 -41.691 -8.881 82 H SER 14 H SER 14 21.837 -39.138 -5.166 83 HA SER 14 HA SER 14 20.469 -40.806 -3.355 84 HB2 SER 14 HB2 SER 14 20.257 -39.150 -1.468 85 HB3 SER 14 HB3 SER 14 21.856 -39.878 -1.624 86 HG SER 14 HG SER 14 22.660 -38.010 -2.350 87 H GLU 15 H GLU 15 18.287 -40.273 -3.175 88 HA GLU 15 HA GLU 15 17.434 -38.046 -4.902 89 HB2 GLU 15 HB2 GLU 15 16.726 -40.790 -4.900 90 HB3 GLU 15 HB3 GLU 15 15.309 -39.893 -4.373 91 HG2 GLU 15 HG2 GLU 15 14.951 -39.820 -6.602 92 HG3 GLU 15 HG3 GLU 15 15.959 -38.382 -6.450 93 H TYR 16 H TYR 16 14.841 -37.766 -4.243 94 HA TYR 16 HA TYR 16 14.789 -37.258 -1.349 95 HB2 TYR 16 HB2 TYR 16 13.499 -35.098 -2.024 96 HB3 TYR 16 HB3 TYR 16 15.258 -35.105 -2.094 97 HD1 TYR 16 HD1 TYR 16 16.373 -34.610 -4.096 98 HD2 TYR 16 HD2 TYR 16 12.216 -35.510 -4.189 99 HE1 TYR 16 HE1 TYR 16 16.287 -33.936 -6.460 100 HE2 TYR 16 HE2 TYR 16 12.118 -34.840 -6.554 101 HH TYR 16 HH TYR 16 13.973 -33.029 -8.030 102 H ILE 17 H ILE 17 12.406 -36.346 -0.863 103 HA ILE 17 HA ILE 17 10.520 -38.171 -2.205 104 HB ILE 17 HB ILE 17 10.798 -39.127 -0.081 105 HG12 ILE 17 HG12 ILE 17 8.436 -37.257 0.205 106 HG13 ILE 17 HG13 ILE 17 8.427 -38.745 -0.736 107 HG21 ILE 17 HG21 ILE 17 11.933 -37.827 1.357 108 HG22 ILE 17 HG22 ILE 17 11.182 -36.344 0.769 109 HG23 ILE 17 HG23 ILE 17 10.329 -37.366 1.926 110 HD11 ILE 17 HD11 ILE 17 8.539 -38.388 2.226 111 HD12 ILE 17 HD12 ILE 17 7.440 -39.369 1.255 112 HD13 ILE 17 HD13 ILE 17 9.115 -39.876 1.474 113 H ARG 18 H ARG 18 8.810 -37.224 -3.094 114 HA ARG 18 HA ARG 18 8.092 -34.511 -2.194 115 HB2 ARG 18 HB2 ARG 18 8.606 -35.597 -4.849 116 HB3 ARG 18 HB3 ARG 18 7.044 -34.797 -4.746 117 HG2 ARG 18 HG2 ARG 18 8.856 -33.098 -3.455 118 HG3 ARG 18 HG3 ARG 18 9.666 -33.656 -4.920 119 HD2 ARG 18 HD2 ARG 18 6.830 -32.759 -5.090 120 HD3 ARG 18 HD3 ARG 18 8.100 -31.543 -4.951 121 HE ARG 18 HE ARG 18 8.701 -33.430 -6.987 122 HH11 ARG 18 HH11 ARG 18 6.721 -30.656 -6.276 123 HH12 ARG 18 HH12 ARG 18 6.600 -30.155 -7.930 124 HH21 ARG 18 HH21 ARG 18 8.549 -32.781 -9.168 125 HH22 ARG 18 HH22 ARG 18 7.639 -31.366 -9.575 126 H VAL 19 H VAL 19 6.362 -34.752 -0.913 127 HA VAL 19 HA VAL 19 3.961 -35.924 -2.062 128 HB VAL 19 HB VAL 19 3.490 -37.135 0.119 129 HG11 VAL 19 HG11 VAL 19 5.820 -38.498 -1.071 130 HG12 VAL 19 HG12 VAL 19 4.166 -39.068 -0.836 131 HG13 VAL 19 HG13 VAL 19 4.552 -38.009 -2.194 132 HG21 VAL 19 HG21 VAL 19 6.466 -36.769 0.454 133 HG22 VAL 19 HG22 VAL 19 5.208 -36.083 1.482 134 HG23 VAL 19 HG23 VAL 19 5.449 -37.829 1.430 135 H THR 20 H THR 20 2.037 -35.167 -1.134 136 HA THR 20 HA THR 20 2.381 -32.890 0.708 137 HB THR 20 HB THR 20 1.659 -31.864 -1.245 138 HG1 THR 20 HG1 THR 20 -0.626 -31.440 -0.879 139 HG21 THR 20 HG21 THR 20 1.137 -33.336 -2.876 140 HG22 THR 20 HG22 THR 20 -0.520 -33.045 -2.347 141 HG23 THR 20 HG23 THR 20 0.359 -34.455 -1.758 142 H GLU 21 H GLU 21 0.796 -32.550 2.299 143 HA GLU 21 HA GLU 21 -0.348 -34.937 3.362 144 HB2 GLU 21 HB2 GLU 21 0.542 -32.941 4.674 145 HB3 GLU 21 HB3 GLU 21 -0.960 -32.126 4.262 146 HG2 GLU 21 HG2 GLU 21 -1.665 -34.650 5.285 147 HG3 GLU 21 HG3 GLU 21 -0.434 -33.986 6.358 148 H ASP 22 H ASP 22 -1.742 -31.950 2.023 149 HA ASP 22 HA ASP 22 -4.349 -33.286 1.862 150 HB2 ASP 22 HB2 ASP 22 -3.829 -30.373 1.295 151 HB3 ASP 22 HB3 ASP 22 -5.348 -31.147 1.738 152 H GLU 23 H GLU 23 -5.668 -32.740 -0.114 153 HA GLU 23 HA GLU 23 -4.129 -33.440 -2.449 154 HB2 GLU 23 HB2 GLU 23 -7.067 -32.781 -2.403 155 HB3 GLU 23 HB3 GLU 23 -6.201 -33.818 -3.528 156 HG2 GLU 23 HG2 GLU 23 -5.848 -35.462 -1.786 157 HG3 GLU 23 HG3 GLU 23 -6.638 -34.412 -0.610 158 H ASN 24 H ASN 24 -5.845 -30.625 -1.234 159 HA ASN 24 HA ASN 24 -5.597 -29.127 -3.668 160 HB2 ASN 24 HB2 ASN 24 -6.410 -28.409 -0.855 161 HB3 ASN 24 HB3 ASN 24 -6.261 -27.192 -2.120 162 HD21 ASN 24 HD21 ASN 24 -8.641 -27.597 -0.855 163 HD22 ASN 24 HD22 ASN 24 -9.772 -28.314 -1.948 164 H ASP 25 H ASP 25 -3.677 -29.607 -0.814 165 HA ASP 25 HA ASP 25 -2.024 -27.306 -1.103 166 HB2 ASP 25 HB2 ASP 25 -2.344 -28.712 0.999 167 HB3 ASP 25 HB3 ASP 25 -1.246 -29.879 0.267 168 H GLU 26 H GLU 26 0.286 -27.362 -1.621 169 HA GLU 26 HA GLU 26 0.728 -28.850 -4.066 170 HB2 GLU 26 HB2 GLU 26 1.833 -26.455 -2.799 171 HB3 GLU 26 HB3 GLU 26 3.057 -27.464 -3.556 172 HG2 GLU 26 HG2 GLU 26 1.894 -27.360 -5.668 173 HG3 GLU 26 HG3 GLU 26 0.580 -26.446 -4.928 174 HA PRO 27 HA PRO 27 3.225 -32.064 -2.420 175 HB2 PRO 27 HB2 PRO 27 4.936 -32.489 -4.485 176 HB3 PRO 27 HB3 PRO 27 3.235 -32.966 -4.533 177 HG2 PRO 27 HG2 PRO 27 4.558 -30.548 -5.702 178 HG3 PRO 27 HG3 PRO 27 3.328 -31.606 -6.418 179 HD2 PRO 27 HD2 PRO 27 2.723 -29.208 -5.316 180 HD3 PRO 27 HD3 PRO 27 1.605 -30.586 -5.277 181 H ILE 28 H ILE 28 4.419 -31.319 -0.718 182 HA ILE 28 HA ILE 28 6.606 -29.497 -1.037 183 HB ILE 28 HB ILE 28 5.396 -29.462 1.041 184 HG12 ILE 28 HG12 ILE 28 7.246 -29.678 2.640 185 HG13 ILE 28 HG13 ILE 28 8.149 -30.645 1.478 186 HG21 ILE 28 HG21 ILE 28 4.576 -31.711 1.140 187 HG22 ILE 28 HG22 ILE 28 6.211 -32.351 1.301 188 HG23 ILE 28 HG23 ILE 28 5.505 -31.397 2.606 189 HD11 ILE 28 HD11 ILE 28 7.295 -28.039 0.465 190 HD12 ILE 28 HD12 ILE 28 8.417 -27.970 1.825 191 HD13 ILE 28 HD13 ILE 28 8.859 -28.848 0.361 192 H GLU 29 H GLU 29 8.698 -29.920 -1.376 193 HA GLU 29 HA GLU 29 9.507 -32.724 -1.607 194 HB2 GLU 29 HB2 GLU 29 11.474 -31.809 -2.824 195 HB3 GLU 29 HB3 GLU 29 9.936 -31.397 -3.571 196 HG2 GLU 29 HG2 GLU 29 10.044 -29.173 -2.564 197 HG3 GLU 29 HG3 GLU 29 11.591 -29.585 -1.828 198 H ILE 30 H ILE 30 10.768 -33.657 -0.143 199 HA ILE 30 HA ILE 30 12.403 -31.944 1.609 200 HB ILE 30 HB ILE 30 11.934 -34.039 3.238 201 HG12 ILE 30 HG12 ILE 30 9.191 -33.588 2.147 202 HG13 ILE 30 HG13 ILE 30 10.238 -34.739 1.324 203 HG21 ILE 30 HG21 ILE 30 11.487 -31.392 3.309 204 HG22 ILE 30 HG22 ILE 30 9.825 -31.978 3.319 205 HG23 ILE 30 HG23 ILE 30 10.952 -32.502 4.571 206 HD11 ILE 30 HD11 ILE 30 9.456 -34.837 4.228 207 HD12 ILE 30 HD12 ILE 30 8.794 -35.841 2.937 208 HD13 ILE 30 HD13 ILE 30 10.491 -35.996 3.393 209 HA PRO 31 HA PRO 31 15.817 -34.541 0.678 210 HB2 PRO 31 HB2 PRO 31 17.177 -34.515 3.027 211 HB3 PRO 31 HB3 PRO 31 17.100 -33.118 1.947 212 HG2 PRO 31 HG2 PRO 31 15.517 -33.687 4.423 213 HG3 PRO 31 HG3 PRO 31 16.266 -32.167 3.898 214 HD2 PRO 31 HD2 PRO 31 13.623 -32.671 3.591 215 HD3 PRO 31 HD3 PRO 31 14.544 -31.673 2.447 216 H SER 32 H SER 32 16.444 -36.655 0.754 217 HA SER 32 HA SER 32 15.289 -38.345 2.869 218 HB2 SER 32 HB2 SER 32 14.387 -39.850 1.379 219 HB3 SER 32 HB3 SER 32 14.208 -38.369 0.439 220 HG SER 32 HG SER 32 15.182 -40.177 -0.700 221 H GLU 33 H GLU 33 16.443 -40.283 3.331 222 HA GLU 33 HA GLU 33 19.207 -40.010 3.460 223 HB2 GLU 33 HB2 GLU 33 17.249 -42.107 4.058 224 HB3 GLU 33 HB3 GLU 33 18.835 -42.730 3.624 225 HG2 GLU 33 HG2 GLU 33 19.683 -40.968 5.348 226 HG3 GLU 33 HG3 GLU 33 18.029 -41.055 5.951 227 H ASP 34 H ASP 34 20.867 -41.413 2.501 228 HA ASP 34 HA ASP 34 20.786 -41.324 -0.319 229 HB2 ASP 34 HB2 ASP 34 22.952 -42.490 -0.221 230 HB3 ASP 34 HB3 ASP 34 22.885 -41.152 0.923 231 H ASP 35 H ASP 35 20.200 -43.887 2.006 232 HA ASP 35 HA ASP 35 20.221 -46.062 0.221 233 HB2 ASP 35 HB2 ASP 35 19.889 -45.755 2.937 234 HB3 ASP 35 HB3 ASP 35 18.293 -46.288 2.416 235 H GLY 36 H GLY 36 17.972 -43.519 0.673 236 HA2 GLY 36 HA2 GLY 36 16.381 -43.250 -1.198 237 HA3 GLY 36 HA3 GLY 36 16.025 -44.961 -1.019 238 H THR 37 H THR 37 16.066 -44.794 1.922 239 HA THR 37 HA THR 37 13.314 -44.224 2.316 240 HB THR 37 HB THR 37 13.659 -44.794 4.628 241 HG1 THR 37 HG1 THR 37 16.040 -45.259 5.147 242 HG21 THR 37 HG21 THR 37 14.068 -46.977 4.249 243 HG22 THR 37 HG22 THR 37 15.647 -46.657 3.532 244 HG23 THR 37 HG23 THR 37 14.186 -46.485 2.560 245 H VAL 38 H VAL 38 13.027 -42.954 4.673 246 HA VAL 38 HA VAL 38 14.323 -40.337 4.397 247 HB VAL 38 HB VAL 38 11.345 -40.805 4.534 248 HG11 VAL 38 HG11 VAL 38 12.975 -38.501 5.389 249 HG12 VAL 38 HG12 VAL 38 11.565 -38.127 4.395 250 HG13 VAL 38 HG13 VAL 38 11.370 -39.013 5.908 251 HG21 VAL 38 HG21 VAL 38 12.615 -40.819 2.314 252 HG22 VAL 38 HG22 VAL 38 11.223 -39.744 2.447 253 HG23 VAL 38 HG23 VAL 38 12.856 -39.093 2.584 254 H LEU 39 H LEU 39 14.933 -39.481 6.287 255 HA LEU 39 HA LEU 39 14.653 -40.955 8.693 256 HB2 LEU 39 HB2 LEU 39 16.216 -38.809 7.746 257 HB3 LEU 39 HB3 LEU 39 15.395 -38.236 9.196 258 HG LEU 39 HG LEU 39 17.653 -39.143 9.633 259 HD11 LEU 39 HD11 LEU 39 15.346 -40.651 10.853 260 HD12 LEU 39 HD12 LEU 39 16.034 -39.128 11.417 261 HD13 LEU 39 HD13 LEU 39 16.985 -40.610 11.504 262 HD21 LEU 39 HD21 LEU 39 16.923 -41.122 7.860 263 HD22 LEU 39 HD22 LEU 39 16.860 -41.933 9.426 264 HD23 LEU 39 HD23 LEU 39 18.344 -41.134 8.904 265 H LEU 40 H LEU 40 13.255 -40.766 10.348 266 HA LEU 40 HA LEU 40 10.754 -39.661 10.068 267 HB2 LEU 40 HB2 LEU 40 11.525 -41.317 11.795 268 HB3 LEU 40 HB3 LEU 40 12.182 -39.956 12.703 269 HG LEU 40 HG LEU 40 9.969 -39.054 13.037 270 HD11 LEU 40 HD11 LEU 40 8.422 -39.441 11.491 271 HD12 LEU 40 HD12 LEU 40 8.213 -41.037 12.210 272 HD13 LEU 40 HD13 LEU 40 9.311 -40.822 10.847 273 HD21 LEU 40 HD21 LEU 40 8.925 -41.084 14.219 274 HD22 LEU 40 HD22 LEU 40 10.516 -40.536 14.749 275 HD23 LEU 40 HD23 LEU 40 10.372 -41.949 13.702 276 H SER 41 H SER 41 13.650 -38.192 11.450 277 HA SER 41 HA SER 41 12.596 -35.917 12.594 278 HB2 SER 41 HB2 SER 41 15.119 -36.834 12.155 279 HB3 SER 41 HB3 SER 41 15.067 -35.474 11.035 280 HG SER 41 HG SER 41 15.737 -34.685 12.994 281 H THR 42 H THR 42 13.153 -36.623 9.204 282 HA THR 42 HA THR 42 12.661 -33.964 8.278 283 HB THR 42 HB THR 42 12.546 -36.570 6.748 284 HG1 THR 42 HG1 THR 42 14.678 -36.179 6.286 285 HG21 THR 42 HG21 THR 42 13.248 -34.701 4.936 286 HG22 THR 42 HG22 THR 42 12.200 -33.739 5.979 287 HG23 THR 42 HG23 THR 42 11.582 -35.205 5.218 288 H VAL 43 H VAL 43 10.727 -36.947 8.363 289 HA VAL 43 HA VAL 43 8.431 -36.036 7.120 290 HB VAL 43 HB VAL 43 8.904 -38.096 9.239 291 HG11 VAL 43 HG11 VAL 43 6.284 -36.940 8.425 292 HG12 VAL 43 HG12 VAL 43 6.391 -38.678 8.714 293 HG13 VAL 43 HG13 VAL 43 6.814 -37.542 9.996 294 HG21 VAL 43 HG21 VAL 43 7.848 -39.493 7.349 295 HG22 VAL 43 HG22 VAL 43 8.125 -38.071 6.344 296 HG23 VAL 43 HG23 VAL 43 9.486 -38.879 7.123 297 H THR 44 H THR 44 9.507 -35.564 10.433 298 HA THR 44 HA THR 44 7.054 -34.411 11.346 299 HB THR 44 HB THR 44 8.178 -33.923 13.384 300 HG1 THR 44 HG1 THR 44 10.496 -34.038 11.777 301 HG21 THR 44 HG21 THR 44 8.368 -36.073 13.949 302 HG22 THR 44 HG22 THR 44 9.828 -36.257 12.977 303 HG23 THR 44 HG23 THR 44 8.242 -36.469 12.236 304 H ALA 45 H ALA 45 9.879 -33.226 9.731 305 HA ALA 45 HA ALA 45 9.977 -30.570 10.412 306 HB1 ALA 45 HB1 ALA 45 10.194 -31.181 7.521 307 HB2 ALA 45 HB2 ALA 45 11.280 -30.276 8.576 308 HB3 ALA 45 HB3 ALA 45 11.280 -32.039 8.616 309 H GLN 46 H GLN 46 7.882 -32.062 7.953 310 HA GLN 46 HA GLN 46 6.321 -29.570 7.870 311 HB2 GLN 46 HB2 GLN 46 5.855 -31.712 5.866 312 HB3 GLN 46 HB3 GLN 46 5.830 -29.964 5.671 313 HG2 GLN 46 HG2 GLN 46 7.763 -30.246 4.605 314 HG3 GLN 46 HG3 GLN 46 8.458 -30.422 6.216 315 HE21 GLN 46 HE21 GLN 46 6.893 -32.315 3.663 316 HE22 GLN 46 HE22 GLN 46 7.849 -33.736 3.890 317 H PHE 47 H PHE 47 6.148 -33.028 8.398 318 HA PHE 47 HA PHE 47 3.310 -32.740 9.129 319 HB2 PHE 47 HB2 PHE 47 4.520 -35.429 8.682 320 HB3 PHE 47 HB3 PHE 47 2.878 -34.873 8.375 321 HD1 PHE 47 HD1 PHE 47 5.530 -36.157 6.765 322 HD2 PHE 47 HD2 PHE 47 3.054 -32.699 6.600 323 HE1 PHE 47 HE1 PHE 47 6.076 -35.884 4.382 324 HE2 PHE 47 HE2 PHE 47 3.595 -32.421 4.216 325 HZ PHE 47 HZ PHE 47 5.107 -34.015 3.104 326 HA PRO 48 HA PRO 48 5.668 -33.452 13.062 327 HB2 PRO 48 HB2 PRO 48 4.298 -31.595 14.491 328 HB3 PRO 48 HB3 PRO 48 5.720 -31.201 13.519 329 HG2 PRO 48 HG2 PRO 48 2.821 -30.866 12.855 330 HG3 PRO 48 HG3 PRO 48 4.169 -29.749 12.574 331 HD2 PRO 48 HD2 PRO 48 3.153 -31.328 10.622 332 HD3 PRO 48 HD3 PRO 48 4.867 -30.870 10.684 333 H GLY 49 H GLY 49 5.020 -35.057 14.353 334 HA2 GLY 49 HA2 GLY 49 3.573 -36.107 15.888 335 HA3 GLY 49 HA3 GLY 49 2.233 -35.186 15.221 336 H ALA 50 H ALA 50 3.085 -35.926 12.451 337 HA ALA 50 HA ALA 50 1.357 -38.007 11.957 338 HB1 ALA 50 HB1 ALA 50 2.141 -36.635 10.163 339 HB2 ALA 50 HB2 ALA 50 3.803 -37.174 10.408 340 HB3 ALA 50 HB3 ALA 50 2.589 -38.304 9.809 341 H CYS 51 H CYS 51 1.412 -40.171 12.100 342 HA CYS 51 HA CYS 51 3.864 -41.394 13.144 343 HB2 CYS 51 HB2 CYS 51 1.618 -41.595 14.353 344 HB3 CYS 51 HB3 CYS 51 1.137 -42.674 13.050 345 HG CYS 51 HG CYS 51 3.836 -44.023 13.808 346 H GLY 52 H GLY 52 1.449 -41.713 10.589 347 HA2 GLY 52 HA2 GLY 52 3.386 -43.270 9.041 348 HA3 GLY 52 HA3 GLY 52 1.810 -43.993 9.332 349 H LEU 53 H LEU 53 3.125 -43.167 6.816 350 HA LEU 53 HA LEU 53 1.139 -41.195 5.895 351 HB2 LEU 53 HB2 LEU 53 3.738 -41.835 4.527 352 HB3 LEU 53 HB3 LEU 53 2.662 -40.469 4.234 353 HG LEU 53 HG LEU 53 4.397 -39.472 5.369 354 HD11 LEU 53 HD11 LEU 53 3.378 -38.595 7.172 355 HD12 LEU 53 HD12 LEU 53 3.074 -40.171 7.902 356 HD13 LEU 53 HD13 LEU 53 2.012 -39.569 6.629 357 HD21 LEU 53 HD21 LEU 53 4.575 -41.646 7.424 358 HD22 LEU 53 HD22 LEU 53 5.781 -40.442 6.970 359 HD23 LEU 53 HD23 LEU 53 5.416 -41.780 5.879 360 H ARG 54 H ARG 54 -0.036 -41.610 4.050 361 HA ARG 54 HA ARG 54 0.075 -44.389 3.098 362 HB2 ARG 54 HB2 ARG 54 -2.056 -42.996 4.096 363 HB3 ARG 54 HB3 ARG 54 -2.264 -42.765 2.365 364 HG2 ARG 54 HG2 ARG 54 -3.337 -44.714 2.408 365 HG3 ARG 54 HG3 ARG 54 -1.735 -45.444 2.539 366 HD2 ARG 54 HD2 ARG 54 -3.014 -44.509 5.044 367 HD3 ARG 54 HD3 ARG 54 -3.696 -45.943 4.277 368 HE ARG 54 HE ARG 54 -1.178 -45.741 5.637 369 HH11 ARG 54 HH11 ARG 54 -2.977 -47.467 3.208 370 HH12 ARG 54 HH12 ARG 54 -2.037 -48.915 3.354 371 HH21 ARG 54 HH21 ARG 54 0.068 -47.641 5.839 372 HH22 ARG 54 HH22 ARG 54 -0.306 -49.013 4.851 373 H TYR 55 H TYR 55 -0.609 -44.696 0.789 374 HA TYR 55 HA TYR 55 0.733 -42.680 -0.874 375 HB2 TYR 55 HB2 TYR 55 0.833 -45.541 -0.795 376 HB3 TYR 55 HB3 TYR 55 0.221 -45.038 -2.366 377 HD1 TYR 55 HD1 TYR 55 1.609 -42.912 -3.343 378 HD2 TYR 55 HD2 TYR 55 3.106 -45.854 -0.658 379 HE1 TYR 55 HE1 TYR 55 3.902 -42.407 -4.077 380 HE2 TYR 55 HE2 TYR 55 5.403 -45.356 -1.384 381 HH TYR 55 HH TYR 55 6.054 -42.884 -3.853 382 H ARG 56 H ARG 56 -0.390 -41.511 -2.288 383 HA ARG 56 HA ARG 56 -3.060 -42.455 -3.091 384 HB2 ARG 56 HB2 ARG 56 -3.609 -40.763 -1.582 385 HB3 ARG 56 HB3 ARG 56 -2.232 -39.770 -2.044 386 HG2 ARG 56 HG2 ARG 56 -4.409 -38.865 -2.788 387 HG3 ARG 56 HG3 ARG 56 -3.282 -39.168 -4.111 388 HD2 ARG 56 HD2 ARG 56 -4.424 -41.357 -4.480 389 HD3 ARG 56 HD3 ARG 56 -5.621 -40.875 -3.279 390 HE ARG 56 HE ARG 56 -5.264 -39.004 -5.448 391 HH11 ARG 56 HH11 ARG 56 -6.999 -41.784 -4.274 392 HH12 ARG 56 HH12 ARG 56 -8.364 -41.533 -5.311 393 HH21 ARG 56 HH21 ARG 56 -7.055 -38.662 -6.818 394 HH22 ARG 56 HH22 ARG 56 -8.394 -39.757 -6.758 395 H ASN 57 H ASN 57 -2.606 -43.082 -5.141 396 HA ASN 57 HA ASN 57 -1.347 -41.092 -6.912 397 HB2 ASN 57 HB2 ASN 57 -1.212 -44.081 -6.836 398 HB3 ASN 57 HB3 ASN 57 -1.032 -43.256 -8.381 399 HD21 ASN 57 HD21 ASN 57 0.833 -42.220 -8.844 400 HD22 ASN 57 HD22 ASN 57 2.208 -42.188 -7.798 401 HA PRO 58 HA PRO 58 -5.235 -40.789 -8.982 402 HB2 PRO 58 HB2 PRO 58 -4.353 -39.602 -11.259 403 HB3 PRO 58 HB3 PRO 58 -4.499 -38.742 -9.721 404 HG2 PRO 58 HG2 PRO 58 -2.069 -39.932 -11.004 405 HG3 PRO 58 HG3 PRO 58 -2.250 -38.371 -10.182 406 HD2 PRO 58 HD2 PRO 58 -1.144 -40.531 -8.980 407 HD3 PRO 58 HD3 PRO 58 -2.075 -39.312 -8.085 408 H VAL 59 H VAL 59 -2.452 -41.910 -10.908 409 HA VAL 59 HA VAL 59 -4.139 -43.365 -12.735 410 HB VAL 59 HB VAL 59 -2.007 -44.184 -13.702 411 HG11 VAL 59 HG11 VAL 59 -3.137 -41.832 -14.077 412 HG12 VAL 59 HG12 VAL 59 -1.631 -41.252 -13.362 413 HG13 VAL 59 HG13 VAL 59 -1.593 -42.236 -14.826 414 HG21 VAL 59 HG21 VAL 59 -0.192 -44.255 -12.421 415 HG22 VAL 59 HG22 VAL 59 -0.133 -42.493 -12.476 416 HG23 VAL 59 HG23 VAL 59 -0.988 -43.307 -11.165 417 H SER 60 H SER 60 -2.312 -44.051 -9.851 418 HA SER 60 HA SER 60 -2.433 -46.917 -10.195 419 HB2 SER 60 HB2 SER 60 -0.761 -45.287 -8.785 420 HB3 SER 60 HB3 SER 60 -1.834 -45.857 -7.508 421 HG SER 60 HG SER 60 0.120 -47.187 -8.850 422 H GLN 61 H GLN 61 -4.272 -44.426 -8.607 423 HA GLN 61 HA GLN 61 -6.283 -44.445 -7.545 424 HB2 GLN 61 HB2 GLN 61 -6.582 -47.307 -8.449 425 HB3 GLN 61 HB3 GLN 61 -7.858 -46.158 -8.067 426 HG2 GLN 61 HG2 GLN 61 -7.332 -44.854 -10.022 427 HG3 GLN 61 HG3 GLN 61 -5.951 -45.890 -10.378 428 HE21 GLN 61 HE21 GLN 61 -6.405 -48.145 -10.863 429 HE22 GLN 61 HE22 GLN 61 -7.880 -48.550 -11.667 430 H CYS 62 H CYS 62 -3.908 -45.165 -6.116 431 HA CYS 62 HA CYS 62 -3.306 -45.863 -4.038 432 HB2 CYS 62 HB2 CYS 62 -5.716 -44.981 -3.593 433 HB3 CYS 62 HB3 CYS 62 -6.137 -46.685 -3.469 434 HG CYS 62 HG CYS 62 -4.014 -44.923 -1.456 435 H MET 63 H MET 63 -2.718 -47.759 -2.937 436 HA MET 63 HA MET 63 -3.840 -50.286 -3.300 437 HB2 MET 63 HB2 MET 63 -2.214 -49.405 -5.513 438 HB3 MET 63 HB3 MET 63 -1.486 -50.809 -4.745 439 HG2 MET 63 HG2 MET 63 -4.343 -51.119 -5.117 440 HG3 MET 63 HG3 MET 63 -3.494 -50.820 -6.632 441 HE1 MET 63 HE1 MET 63 -4.131 -54.637 -4.667 442 HE2 MET 63 HE2 MET 63 -3.438 -53.568 -3.447 443 HE3 MET 63 HE3 MET 63 -4.848 -53.052 -4.373 444 H ARG 64 H ARG 64 -0.757 -48.562 -2.995 445 HA ARG 64 HA ARG 64 -0.039 -50.406 -0.811 446 HB2 ARG 64 HB2 ARG 64 2.349 -49.640 -1.339 447 HB3 ARG 64 HB3 ARG 64 1.584 -50.746 -2.472 448 HG2 ARG 64 HG2 ARG 64 1.532 -49.224 -4.136 449 HG3 ARG 64 HG3 ARG 64 1.256 -47.871 -3.037 450 HD2 ARG 64 HD2 ARG 64 3.412 -47.347 -3.099 451 HD3 ARG 64 HD3 ARG 64 3.841 -48.960 -2.530 452 HE ARG 64 HE ARG 64 4.523 -49.448 -4.646 453 HH11 ARG 64 HH11 ARG 64 2.258 -46.808 -4.801 454 HH12 ARG 64 HH12 ARG 64 2.445 -46.577 -6.508 455 HH21 ARG 64 HH21 ARG 64 4.777 -49.153 -6.893 456 HH22 ARG 64 HH22 ARG 64 3.878 -47.912 -7.697 457 H GLY 65 H GLY 65 1.887 -49.155 0.493 458 HA2 GLY 65 HA2 GLY 65 1.156 -46.377 0.973 459 HA3 GLY 65 HA3 GLY 65 0.839 -47.495 2.292 460 H VAL 66 H VAL 66 2.731 -45.182 1.972 461 HA VAL 66 HA VAL 66 5.373 -45.929 1.746 462 HB VAL 66 HB VAL 66 4.218 -43.930 3.696 463 HG11 VAL 66 HG11 VAL 66 6.516 -44.588 4.257 464 HG12 VAL 66 HG12 VAL 66 7.027 -44.167 2.621 465 HG13 VAL 66 HG13 VAL 66 6.425 -42.915 3.707 466 HG21 VAL 66 HG21 VAL 66 3.623 -42.874 1.813 467 HG22 VAL 66 HG22 VAL 66 5.343 -42.529 1.629 468 HG23 VAL 66 HG23 VAL 66 4.628 -43.914 0.803 469 H ARG 67 H ARG 67 6.372 -47.576 2.693 470 HA ARG 67 HA ARG 67 5.515 -48.778 5.110 471 HB2 ARG 67 HB2 ARG 67 6.681 -50.091 3.454 472 HB3 ARG 67 HB3 ARG 67 8.091 -49.044 3.556 473 HG2 ARG 67 HG2 ARG 67 8.544 -51.074 4.738 474 HG3 ARG 67 HG3 ARG 67 8.395 -49.760 5.907 475 HD2 ARG 67 HD2 ARG 67 5.834 -50.642 5.784 476 HD3 ARG 67 HD3 ARG 67 6.719 -52.141 5.506 477 HE ARG 67 HE ARG 67 7.814 -50.756 7.711 478 HH11 ARG 67 HH11 ARG 67 5.036 -52.632 6.770 479 HH12 ARG 67 HH12 ARG 67 4.722 -53.212 8.372 480 HH21 ARG 67 HH21 ARG 67 7.410 -51.513 9.825 481 HH22 ARG 67 HH22 ARG 67 6.072 -52.574 10.109 482 H LEU 68 H LEU 68 6.297 -48.644 7.177 483 HA LEU 68 HA LEU 68 8.344 -46.591 7.695 484 HB2 LEU 68 HB2 LEU 68 6.197 -45.661 8.259 485 HB3 LEU 68 HB3 LEU 68 5.783 -47.090 9.204 486 HG LEU 68 HG LEU 68 6.485 -44.918 10.421 487 HD11 LEU 68 HD11 LEU 68 8.083 -47.204 11.410 488 HD12 LEU 68 HD12 LEU 68 6.353 -47.465 11.187 489 HD13 LEU 68 HD13 LEU 68 6.920 -46.179 12.253 490 HD21 LEU 68 HD21 LEU 68 8.665 -45.031 8.868 491 HD22 LEU 68 HD22 LEU 68 9.255 -45.935 10.263 492 HD23 LEU 68 HD23 LEU 68 8.657 -44.288 10.468 493 H VAL 69 H VAL 69 10.039 -47.350 8.762 494 HA VAL 69 HA VAL 69 9.671 -49.496 10.723 495 HB VAL 69 HB VAL 69 10.350 -50.721 8.786 496 HG11 VAL 69 HG11 VAL 69 11.432 -49.684 7.147 497 HG12 VAL 69 HG12 VAL 69 11.861 -48.345 8.213 498 HG13 VAL 69 HG13 VAL 69 12.898 -49.769 8.122 499 HG21 VAL 69 HG21 VAL 69 11.899 -51.942 9.851 500 HG22 VAL 69 HG22 VAL 69 13.026 -50.590 9.966 501 HG23 VAL 69 HG23 VAL 69 11.725 -50.757 11.145 502 H GLU 70 H GLU 70 10.499 -48.819 12.577 503 HA GLU 70 HA GLU 70 11.856 -47.837 14.118 504 HB2 GLU 70 HB2 GLU 70 13.951 -47.645 11.958 505 HB3 GLU 70 HB3 GLU 70 14.198 -47.726 13.696 506 HG2 GLU 70 HG2 GLU 70 12.783 -50.035 13.083 507 HG3 GLU 70 HG3 GLU 70 13.943 -49.854 11.768 508 H GLY 71 H GLY 71 10.171 -46.245 12.274 509 HA2 GLY 71 HA2 GLY 71 9.673 -43.956 12.398 510 HA3 GLY 71 HA3 GLY 71 11.314 -43.651 12.949 511 H ILE 72 H ILE 72 12.399 -45.290 10.699 512 HA ILE 72 HA ILE 72 12.593 -43.137 8.802 513 HB ILE 72 HB ILE 72 13.753 -45.924 8.710 514 HG12 ILE 72 HG12 ILE 72 15.702 -43.868 9.035 515 HG13 ILE 72 HG13 ILE 72 14.443 -43.618 10.239 516 HG21 ILE 72 HG21 ILE 72 15.344 -44.372 7.138 517 HG22 ILE 72 HG22 ILE 72 14.066 -45.432 6.545 518 HG23 ILE 72 HG23 ILE 72 13.746 -43.715 6.788 519 HD11 ILE 72 HD11 ILE 72 16.429 -45.773 9.992 520 HD12 ILE 72 HD12 ILE 72 15.711 -45.041 11.427 521 HD13 ILE 72 HD13 ILE 72 14.817 -46.257 10.515 522 H LEU 73 H LEU 73 11.106 -42.795 7.297 523 HA LEU 73 HA LEU 73 9.221 -44.783 6.497 524 HB2 LEU 73 HB2 LEU 73 9.831 -41.997 5.563 525 HB3 LEU 73 HB3 LEU 73 8.627 -43.002 4.758 526 HG LEU 73 HG LEU 73 7.523 -41.495 6.269 527 HD11 LEU 73 HD11 LEU 73 7.575 -44.277 7.430 528 HD12 LEU 73 HD12 LEU 73 6.607 -43.756 6.052 529 HD13 LEU 73 HD13 LEU 73 6.302 -43.076 7.650 530 HD21 LEU 73 HD21 LEU 73 8.005 -41.293 8.566 531 HD22 LEU 73 HD22 LEU 73 9.568 -41.232 7.750 532 HD23 LEU 73 HD23 LEU 73 9.050 -42.714 8.554 533 H HIS 74 H HIS 74 9.708 -46.414 5.194 534 HA HIS 74 HA HIS 74 11.897 -46.224 3.309 535 HB2 HIS 74 HB2 HIS 74 10.774 -48.299 4.765 536 HB3 HIS 74 HB3 HIS 74 10.247 -48.622 3.115 537 HD1 HIS 74 HD1 HIS 74 12.544 -48.148 1.390 538 HD2 HIS 74 HD2 HIS 74 13.041 -49.673 5.222 539 HE1 HIS 74 HE1 HIS 74 14.780 -49.298 1.371 540 H ALA 75 H ALA 75 11.735 -46.431 1.070 541 HA ALA 75 HA ALA 75 9.174 -45.544 -0.026 542 HB1 ALA 75 HB1 ALA 75 12.001 -45.288 -0.834 543 HB2 ALA 75 HB2 ALA 75 10.824 -45.442 -2.140 544 HB3 ALA 75 HB3 ALA 75 10.671 -44.137 -0.964 545 HA PRO 76 HA PRO 76 8.163 -49.356 -1.953 546 HB2 PRO 76 HB2 PRO 76 7.029 -48.512 -4.271 547 HB3 PRO 76 HB3 PRO 76 6.241 -48.341 -2.698 548 HG2 PRO 76 HG2 PRO 76 7.771 -46.312 -4.281 549 HG3 PRO 76 HG3 PRO 76 6.248 -46.121 -3.392 550 HD2 PRO 76 HD2 PRO 76 8.631 -45.308 -2.394 551 HD3 PRO 76 HD3 PRO 76 7.316 -45.906 -1.360 552 H ASP 77 H ASP 77 8.186 -50.320 -4.368 553 HA ASP 77 HA ASP 77 10.973 -50.445 -5.069 554 HB2 ASP 77 HB2 ASP 77 8.614 -52.055 -5.494 555 HB3 ASP 77 HB3 ASP 77 9.484 -51.831 -7.009 556 H ALA 78 H ALA 78 8.615 -48.299 -5.831 557 HA ALA 78 HA ALA 78 9.641 -47.837 -8.552 558 HB1 ALA 78 HB1 ALA 78 6.998 -47.785 -7.456 559 HB2 ALA 78 HB2 ALA 78 7.404 -46.194 -8.100 560 HB3 ALA 78 HB3 ALA 78 7.512 -47.618 -9.135 561 H GLY 79 H GLY 79 9.319 -46.488 -5.367 562 HA2 GLY 79 HA2 GLY 79 11.045 -44.834 -4.772 563 HA3 GLY 79 HA3 GLY 79 10.713 -44.061 -6.315 564 H TRP 80 H TRP 80 10.610 -42.316 -4.458 565 HA TRP 80 HA TRP 80 8.209 -42.164 -2.947 566 HB2 TRP 80 HB2 TRP 80 10.257 -40.083 -3.721 567 HB3 TRP 80 HB3 TRP 80 8.879 -39.735 -2.681 568 HD1 TRP 80 HD1 TRP 80 12.387 -40.606 -2.421 569 HE1 TRP 80 HE1 TRP 80 12.954 -41.580 -0.107 570 HE3 TRP 80 HE3 TRP 80 7.649 -41.587 -0.770 571 HZ2 TRP 80 HZ2 TRP 80 11.575 -42.627 2.123 572 HZ3 TRP 80 HZ3 TRP 80 7.360 -42.576 1.465 573 HH2 TRP 80 HH2 TRP 80 9.284 -43.084 2.879 574 H GLY 81 H GLY 81 9.283 -40.283 -5.791 575 HA2 GLY 81 HA2 GLY 81 8.018 -39.654 -7.643 576 HA3 GLY 81 HA3 GLY 81 6.604 -40.378 -6.892 577 H ASN 82 H ASN 82 5.562 -38.402 -7.728 578 HA ASN 82 HA ASN 82 5.845 -36.205 -5.790 579 HB2 ASN 82 HB2 ASN 82 4.968 -35.666 -8.605 580 HB3 ASN 82 HB3 ASN 82 5.703 -34.570 -7.440 581 HD21 ASN 82 HD21 ASN 82 7.912 -35.891 -6.645 582 HD22 ASN 82 HD22 ASN 82 8.985 -36.132 -7.978 583 H LEU 83 H LEU 83 4.058 -38.460 -5.696 584 HA LEU 83 HA LEU 83 1.453 -37.420 -6.458 585 HB2 LEU 83 HB2 LEU 83 0.674 -39.589 -5.379 586 HB3 LEU 83 HB3 LEU 83 1.631 -39.710 -6.853 587 HG LEU 83 HG LEU 83 2.099 -41.342 -4.908 588 HD11 LEU 83 HD11 LEU 83 3.932 -41.782 -6.079 589 HD12 LEU 83 HD12 LEU 83 4.701 -40.286 -5.549 590 HD13 LEU 83 HD13 LEU 83 3.653 -40.283 -6.967 591 HD21 LEU 83 HD21 LEU 83 2.201 -39.538 -3.193 592 HD22 LEU 83 HD22 LEU 83 3.694 -38.973 -3.943 593 HD23 LEU 83 HD23 LEU 83 3.622 -40.582 -3.223 594 H VAL 84 H VAL 84 -0.260 -38.113 -4.570 595 HA VAL 84 HA VAL 84 0.450 -36.353 -2.348 596 HB VAL 84 HB VAL 84 -2.261 -37.560 -2.855 597 HG11 VAL 84 HG11 VAL 84 -2.549 -36.564 -0.859 598 HG12 VAL 84 HG12 VAL 84 -1.128 -35.536 -1.051 599 HG13 VAL 84 HG13 VAL 84 -2.652 -35.088 -1.819 600 HG21 VAL 84 HG21 VAL 84 -2.091 -36.490 -4.856 601 HG22 VAL 84 HG22 VAL 84 -2.580 -35.118 -3.861 602 HG23 VAL 84 HG23 VAL 84 -0.880 -35.349 -4.270 603 H TYR 85 H TYR 85 -0.168 -36.946 -0.151 604 HA TYR 85 HA TYR 85 -0.229 -39.845 0.329 605 HB2 TYR 85 HB2 TYR 85 1.643 -39.863 1.612 606 HB3 TYR 85 HB3 TYR 85 2.063 -38.448 0.653 607 HD1 TYR 85 HD1 TYR 85 0.651 -39.549 3.892 608 HD2 TYR 85 HD2 TYR 85 2.261 -36.308 1.654 609 HE1 TYR 85 HE1 TYR 85 0.793 -38.207 5.948 610 HE2 TYR 85 HE2 TYR 85 2.408 -34.958 3.704 611 HH TYR 85 HH TYR 85 1.472 -34.834 5.897 612 H VAL 86 H VAL 86 -1.281 -40.503 2.210 613 HA VAL 86 HA VAL 86 -2.950 -38.424 3.459 614 HB VAL 86 HB VAL 86 -3.459 -41.387 3.169 615 HG11 VAL 86 HG11 VAL 86 -4.747 -39.295 4.827 616 HG12 VAL 86 HG12 VAL 86 -5.804 -40.450 4.012 617 HG13 VAL 86 HG13 VAL 86 -4.560 -41.023 5.124 618 HG21 VAL 86 HG21 VAL 86 -5.555 -40.144 2.007 619 HG22 VAL 86 HG22 VAL 86 -4.265 -38.994 1.653 620 HG23 VAL 86 HG23 VAL 86 -4.117 -40.673 1.133 621 H VAL 87 H VAL 87 -2.695 -37.995 5.551 622 HA VAL 87 HA VAL 87 -0.645 -39.160 7.089 623 HB VAL 87 HB VAL 87 -2.990 -37.652 8.233 624 HG11 VAL 87 HG11 VAL 87 -1.578 -38.535 9.926 625 HG12 VAL 87 HG12 VAL 87 -0.122 -38.028 9.068 626 HG13 VAL 87 HG13 VAL 87 -1.192 -36.821 9.782 627 HG21 VAL 87 HG21 VAL 87 -0.971 -35.812 7.807 628 HG22 VAL 87 HG22 VAL 87 -0.998 -36.757 6.318 629 HG23 VAL 87 HG23 VAL 87 -2.465 -35.955 6.881 630 H ASN 88 H ASN 88 -0.814 -40.359 9.071 631 HA ASN 88 HA ASN 88 -3.297 -41.823 9.519 632 HB2 ASN 88 HB2 ASN 88 -1.794 -43.094 7.875 633 HB3 ASN 88 HB3 ASN 88 -0.707 -43.341 9.239 634 HD21 ASN 88 HD21 ASN 88 -0.954 -45.532 9.332 635 HD22 ASN 88 HD22 ASN 88 -2.426 -46.302 9.808 636 H TYR 89 H TYR 89 -3.482 -40.824 11.510 637 HA TYR 89 HA TYR 89 -2.193 -42.051 13.687 638 HB2 TYR 89 HB2 TYR 89 -0.672 -40.468 14.462 639 HB3 TYR 89 HB3 TYR 89 -0.393 -40.439 12.724 640 HD1 TYR 89 HD1 TYR 89 -0.289 -38.345 15.294 641 HD2 TYR 89 HD2 TYR 89 -2.500 -38.769 11.683 642 HE1 TYR 89 HE1 TYR 89 -0.708 -35.922 15.273 643 HE2 TYR 89 HE2 TYR 89 -2.924 -36.346 11.652 644 HH TYR 89 HH TYR 89 -1.448 -34.191 14.022 645 HA PRO 90 HA PRO 90 -5.696 -40.401 15.754 646 HB2 PRO 90 HB2 PRO 90 -4.810 -40.321 18.318 647 HB3 PRO 90 HB3 PRO 90 -5.199 -41.829 17.484 648 HG2 PRO 90 HG2 PRO 90 -2.530 -40.553 17.944 649 HG3 PRO 90 HG3 PRO 90 -2.996 -42.258 18.090 650 HD2 PRO 90 HD2 PRO 90 -1.697 -41.283 15.923 651 HD3 PRO 90 HD3 PRO 90 -2.860 -42.620 15.817 652 H LYS 91 H LYS 91 -6.050 -38.750 17.779 653 HA LYS 91 HA LYS 91 -5.690 -36.198 16.767 654 HB2 LYS 91 HB2 LYS 91 -7.355 -36.682 18.465 655 HB3 LYS 91 HB3 LYS 91 -6.099 -37.067 19.634 656 HG2 LYS 91 HG2 LYS 91 -5.382 -34.792 19.719 657 HG3 LYS 91 HG3 LYS 91 -6.441 -34.355 18.375 658 HD2 LYS 91 HD2 LYS 91 -8.296 -35.326 19.989 659 HD3 LYS 91 HD3 LYS 91 -7.104 -34.911 21.224 660 HE2 LYS 91 HE2 LYS 91 -7.060 -32.652 19.775 661 HE3 LYS 91 HE3 LYS 91 -8.720 -33.163 19.470 662 HZ1 LYS 91 HZ1 LYS 91 -8.305 -33.487 22.180 663 HZ2 LYS 91 HZ2 LYS 91 -9.239 -32.296 21.426 664 HZ3 LYS 91 HZ3 LYS 91 -7.618 -31.989 21.799 665 H ASP 92 H ASP 92 -4.136 -37.221 19.799 666 HA ASP 92 HA ASP 92 -2.140 -36.662 20.739 667 HB2 ASP 92 HB2 ASP 92 -1.589 -37.861 18.353 668 HB3 ASP 92 HB3 ASP 92 -0.733 -36.333 18.170 669 H ASN 93 H ASN 93 -0.072 -35.045 20.123 670 HA ASN 93 HA ASN 93 0.614 -32.877 20.111 671 HB2 ASN 93 HB2 ASN 93 -1.430 -33.015 18.012 672 HB3 ASN 93 HB3 ASN 93 -1.211 -31.399 18.678 673 HD21 ASN 93 HD21 ASN 93 1.110 -30.703 18.871 674 HD22 ASN 93 HD22 ASN 93 2.152 -31.094 17.549 675 H LYS 94 H LYS 94 0.288 -32.485 22.288 676 HA LYS 94 HA LYS 94 -1.909 -30.669 22.885 677 HB2 LYS 94 HB2 LYS 94 -1.571 -33.370 24.072 678 HB3 LYS 94 HB3 LYS 94 -2.000 -32.068 25.175 679 HG2 LYS 94 HG2 LYS 94 -4.043 -31.694 24.144 680 HG3 LYS 94 HG3 LYS 94 -3.548 -32.497 22.652 681 HD2 LYS 94 HD2 LYS 94 -4.623 -34.298 23.415 682 HD3 LYS 94 HD3 LYS 94 -3.306 -34.470 24.578 683 HE2 LYS 94 HE2 LYS 94 -4.683 -32.795 26.001 684 HE3 LYS 94 HE3 LYS 94 -6.021 -33.262 24.952 685 HZ1 LYS 94 HZ1 LYS 94 -4.799 -35.611 25.756 686 HZ2 LYS 94 HZ2 LYS 94 -6.305 -35.018 26.247 687 HZ3 LYS 94 HZ3 LYS 94 -4.920 -34.658 27.149 688 H ARG 95 H ARG 95 -0.015 -29.243 22.793 689 HA ARG 95 HA ARG 95 1.399 -29.219 25.374 690 HB2 ARG 95 HB2 ARG 95 2.975 -29.929 23.664 691 HB3 ARG 95 HB3 ARG 95 2.549 -28.549 22.661 692 HG2 ARG 95 HG2 ARG 95 3.432 -27.047 24.409 693 HG3 ARG 95 HG3 ARG 95 3.932 -28.465 25.334 694 HD2 ARG 95 HD2 ARG 95 5.702 -28.867 24.001 695 HD3 ARG 95 HD3 ARG 95 4.827 -28.424 22.536 696 HE ARG 95 HE ARG 95 5.332 -26.105 24.032 697 HH11 ARG 95 HH11 ARG 95 7.025 -28.508 22.167 698 HH12 ARG 95 HH12 ARG 95 8.302 -27.435 21.701 699 HH21 ARG 95 HH21 ARG 95 7.008 -24.682 23.425 700 HH22 ARG 95 HH22 ARG 95 8.292 -25.259 22.417 701 H LYS 96 H LYS 96 0.740 -27.184 22.518 702 HA LYS 96 HA LYS 96 1.051 -24.710 23.730 703 HB2 LYS 96 HB2 LYS 96 0.293 -25.618 21.229 704 HB3 LYS 96 HB3 LYS 96 -1.134 -24.758 21.791 705 HG2 LYS 96 HG2 LYS 96 0.107 -22.743 22.086 706 HG3 LYS 96 HG3 LYS 96 1.633 -23.577 21.785 707 HD2 LYS 96 HD2 LYS 96 1.081 -22.420 19.787 708 HD3 LYS 96 HD3 LYS 96 0.747 -24.128 19.490 709 HE2 LYS 96 HE2 LYS 96 -1.338 -23.609 18.937 710 HE3 LYS 96 HE3 LYS 96 -1.604 -22.981 20.563 711 HZ1 LYS 96 HZ1 LYS 96 -1.710 -20.945 19.739 712 HZ2 LYS 96 HZ2 LYS 96 -1.519 -21.555 18.174 713 HZ3 LYS 96 HZ3 LYS 96 -0.163 -21.086 19.070 714 H MET 97 H MET 97 0.082 -23.985 25.503 715 HA MET 97 HA MET 97 -2.437 -24.977 26.411 716 HB2 MET 97 HB2 MET 97 -0.370 -23.124 27.395 717 HB3 MET 97 HB3 MET 97 -2.005 -22.746 27.920 718 HG2 MET 97 HG2 MET 97 -1.608 -24.181 29.572 719 HG3 MET 97 HG3 MET 97 -1.882 -25.431 28.361 720 HE1 MET 97 HE1 MET 97 1.242 -26.372 30.776 721 HE2 MET 97 HE2 MET 97 0.201 -25.025 31.237 722 HE3 MET 97 HE3 MET 97 -0.509 -26.516 30.615 723 H ASP 98 H ASP 98 -1.557 -21.563 25.946 724 HA ASP 98 HA ASP 98 -4.056 -21.168 24.456 725 HB2 ASP 98 HB2 ASP 98 -3.260 -19.925 27.034 726 HB3 ASP 98 HB3 ASP 98 -4.015 -18.870 25.843 727 H GLU 99 H GLU 99 -1.368 -19.174 25.697 728 HA GLU 99 HA GLU 99 0.029 -17.700 24.672 729 HB2 GLU 99 HB2 GLU 99 0.163 -20.001 23.202 730 HB3 GLU 99 HB3 GLU 99 -0.275 -18.824 21.971 731 HG2 GLU 99 HG2 GLU 99 1.765 -17.648 23.502 732 HG3 GLU 99 HG3 GLU 99 2.262 -19.309 23.189 733 H THR 100 H THR 100 0.188 -16.199 22.633 734 HA THR 100 HA THR 100 -2.403 -14.888 22.428 735 HB THR 100 HB THR 100 0.079 -13.811 21.143 736 HG1 THR 100 HG1 THR 100 0.870 -13.148 23.074 737 HG21 THR 100 HG21 THR 100 -2.251 -12.539 22.586 738 HG22 THR 100 HG22 THR 100 -2.021 -12.610 20.839 739 HG23 THR 100 HG23 THR 100 -0.913 -11.669 21.838 740 H ASP 101 H ASP 101 -3.472 -16.310 21.001 741 HA ASP 101 HA ASP 101 -2.367 -16.814 18.379 742 HB2 ASP 101 HB2 ASP 101 -3.663 -18.590 19.287 743 HB3 ASP 101 HB3 ASP 101 -4.994 -17.508 19.688 744 H ALA 102 H ALA 102 -2.230 -15.025 17.140 745 HA ALA 102 HA ALA 102 -4.652 -13.888 16.119 746 HB1 ALA 102 HB1 ALA 102 -4.761 -12.388 17.840 747 HB2 ALA 102 HB2 ALA 102 -3.014 -12.369 18.084 748 HB3 ALA 102 HB3 ALA 102 -3.725 -11.497 16.726 749 H SER 103 H SER 103 -3.601 -14.840 14.257 750 HA SER 103 HA SER 103 -1.431 -13.156 13.187 751 HB2 SER 103 HB2 SER 103 -1.679 -16.031 13.381 752 HB3 SER 103 HB3 SER 103 -1.498 -15.536 11.698 753 HG SER 103 HG SER 103 0.447 -14.696 12.132 754 H SER 104 H SER 104 -1.405 -13.024 10.780 755 HA SER 104 HA SER 104 -3.691 -13.603 9.233 756 HB2 SER 104 HB2 SER 104 -4.558 -11.300 8.931 757 HB3 SER 104 HB3 SER 104 -4.767 -11.878 10.584 758 HG SER 104 HG SER 104 -3.666 -9.659 9.912 759 H ALA 105 H ALA 105 -3.469 -12.955 7.050 760 HA ALA 105 HA ALA 105 -0.714 -12.411 6.304 761 HB1 ALA 105 HB1 ALA 105 -2.299 -12.638 3.994 762 HB2 ALA 105 HB2 ALA 105 -1.214 -13.845 4.686 763 HB3 ALA 105 HB3 ALA 105 -2.917 -13.825 5.143 764 H VAL 106 H VAL 106 0.025 -10.494 5.673 765 HA VAL 106 HA VAL 106 -1.543 -8.161 5.758 766 HB VAL 106 HB VAL 106 0.415 -7.021 4.756 767 HG11 VAL 106 HG11 VAL 106 1.140 -8.981 6.932 768 HG12 VAL 106 HG12 VAL 106 1.950 -7.452 6.585 769 HG13 VAL 106 HG13 VAL 106 0.287 -7.457 7.174 770 HG21 VAL 106 HG21 VAL 106 1.010 -9.695 3.880 771 HG22 VAL 106 HG22 VAL 106 1.744 -8.168 3.390 772 HG23 VAL 106 HG23 VAL 106 2.362 -9.032 4.798 773 H LYS 107 H LYS 107 -2.640 -7.047 4.248 774 HA LYS 107 HA LYS 107 -2.193 -7.215 1.464 775 HB2 LYS 107 HB2 LYS 107 -3.573 -9.405 2.396 776 HB3 LYS 107 HB3 LYS 107 -4.871 -8.328 1.898 777 HG2 LYS 107 HG2 LYS 107 -4.506 -8.751 -0.248 778 HG3 LYS 107 HG3 LYS 107 -2.777 -8.431 -0.087 779 HD2 LYS 107 HD2 LYS 107 -2.531 -10.729 0.877 780 HD3 LYS 107 HD3 LYS 107 -4.222 -11.020 0.463 781 HE2 LYS 107 HE2 LYS 107 -2.013 -10.312 -1.467 782 HE3 LYS 107 HE3 LYS 107 -2.725 -11.910 -1.248 783 HZ1 LYS 107 HZ1 LYS 107 -4.907 -10.781 -1.843 784 HZ2 LYS 107 HZ2 LYS 107 -3.801 -11.026 -3.098 785 HZ3 LYS 107 HZ3 LYS 107 -3.967 -9.492 -2.406 786 H VAL 108 H VAL 108 -2.832 -5.319 0.688 787 HA VAL 108 HA VAL 108 -5.300 -4.102 1.678 788 HB VAL 108 HB VAL 108 -4.143 -1.871 1.804 789 HG11 VAL 108 HG11 VAL 108 -4.777 -3.027 3.821 790 HG12 VAL 108 HG12 VAL 108 -3.318 -4.018 3.754 791 HG13 VAL 108 HG13 VAL 108 -3.194 -2.284 4.054 792 HG21 VAL 108 HG21 VAL 108 -2.140 -2.426 0.545 793 HG22 VAL 108 HG22 VAL 108 -1.712 -1.874 2.165 794 HG23 VAL 108 HG23 VAL 108 -1.666 -3.594 1.778 795 H LYS 109 H LYS 109 -6.444 -3.093 0.128 796 HA LYS 109 HA LYS 109 -5.135 -2.247 -2.337 797 HB2 LYS 109 HB2 LYS 109 -6.941 -3.420 -3.675 798 HB3 LYS 109 HB3 LYS 109 -5.709 -4.458 -2.968 799 HG2 LYS 109 HG2 LYS 109 -7.266 -4.954 -1.105 800 HG3 LYS 109 HG3 LYS 109 -8.505 -4.015 -1.942 801 HD2 LYS 109 HD2 LYS 109 -7.402 -5.859 -3.797 802 HD3 LYS 109 HD3 LYS 109 -7.782 -6.741 -2.316 803 HE2 LYS 109 HE2 LYS 109 -9.706 -6.784 -3.749 804 HE3 LYS 109 HE3 LYS 109 -10.055 -5.742 -2.371 805 HZ1 LYS 109 HZ1 LYS 109 -10.574 -4.159 -3.808 806 HZ2 LYS 109 HZ2 LYS 109 -10.091 -5.108 -5.122 807 HZ3 LYS 109 HZ3 LYS 109 -8.966 -4.120 -4.335 808 H ARG 110 H ARG 110 -6.827 -1.196 -3.832 809 HA ARG 110 HA ARG 110 -8.975 0.086 -2.307 810 HB2 ARG 110 HB2 ARG 110 -8.331 2.293 -3.298 811 HB3 ARG 110 HB3 ARG 110 -7.184 1.666 -2.122 812 HG2 ARG 110 HG2 ARG 110 -6.665 0.980 -4.943 813 HG3 ARG 110 HG3 ARG 110 -6.467 2.674 -4.492 814 HD2 ARG 110 HD2 ARG 110 -5.251 1.206 -2.447 815 HD3 ARG 110 HD3 ARG 110 -4.762 0.417 -3.946 816 HE ARG 110 HE ARG 110 -4.341 3.034 -4.469 817 HH11 ARG 110 HH11 ARG 110 -3.380 0.940 -1.858 818 HH12 ARG 110 HH12 ARG 110 -1.907 1.795 -1.542 819 HH21 ARG 110 HH21 ARG 110 -2.404 4.167 -4.062 820 HH22 ARG 110 HH22 ARG 110 -1.353 3.631 -2.795 821 H ALA 111 H ALA 111 -10.518 1.247 -3.713 822 HA ALA 111 HA ALA 111 -10.571 0.173 -6.454 823 HB1 ALA 111 HB1 ALA 111 -12.296 -1.102 -5.851 824 HB2 ALA 111 HB2 ALA 111 -12.465 -0.278 -4.301 825 HB3 ALA 111 HB3 ALA 111 -13.230 0.389 -5.742 826 H VAL 112 H VAL 112 -10.094 2.005 -7.556 827 HA VAL 112 HA VAL 112 -11.149 4.571 -6.846 828 HB VAL 112 HB VAL 112 -8.964 4.288 -7.988 829 HG11 VAL 112 HG11 VAL 112 -10.368 2.634 -9.695 830 HG12 VAL 112 HG12 VAL 112 -10.068 4.076 -10.667 831 HG13 VAL 112 HG13 VAL 112 -8.719 3.213 -9.928 832 HG21 VAL 112 HG21 VAL 112 -10.679 5.908 -9.817 833 HG22 VAL 112 HG22 VAL 112 -10.548 6.361 -8.117 834 HG23 VAL 112 HG23 VAL 112 -9.102 6.289 -9.124 835 H GLN 113 H GLN 113 -12.635 5.833 -8.017 836 HA GLN 113 HA GLN 113 -14.565 6.247 -9.147 837 HB2 GLN 113 HB2 GLN 113 -13.016 4.515 -10.873 838 HB3 GLN 113 HB3 GLN 113 -14.740 4.249 -11.098 839 HG2 GLN 113 HG2 GLN 113 -13.980 7.067 -10.990 840 HG3 GLN 113 HG3 GLN 113 -13.261 6.176 -12.330 841 HE21 GLN 113 HE21 GLN 113 -14.518 7.435 -13.764 842 HE22 GLN 113 HE22 GLN 113 -16.193 7.092 -14.014 843 H LYS 114 H LYS 114 -16.715 5.274 -9.762 844 HA LYS 114 HA LYS 114 -17.424 3.289 -7.745 845 HB2 LYS 114 HB2 LYS 114 -19.692 3.993 -8.050 846 HB3 LYS 114 HB3 LYS 114 -18.694 5.439 -7.965 847 HG2 LYS 114 HG2 LYS 114 -18.804 5.722 -10.348 848 HG3 LYS 114 HG3 LYS 114 -19.657 4.187 -10.527 849 HD2 LYS 114 HD2 LYS 114 -21.636 5.054 -9.842 850 HD3 LYS 114 HD3 LYS 114 -20.877 6.157 -8.693 851 HE2 LYS 114 HE2 LYS 114 -20.724 6.548 -11.672 852 HE3 LYS 114 HE3 LYS 114 -22.028 7.215 -10.690 853 HZ1 LYS 114 HZ1 LYS 114 -20.698 8.941 -10.350 854 HZ2 LYS 114 HZ2 LYS 114 -19.360 8.158 -11.025 855 HZ3 LYS 114 HZ3 LYS 114 -19.730 7.940 -9.389 Start of MODEL 12 1 H1 MET 1 H MET 1 24.435 5.590 -14.269 2 HA MET 1 HA MET 1 23.744 3.927 -12.521 3 HB2 MET 1 HB2 MET 1 22.749 6.368 -11.440 4 HB3 MET 1 HB3 MET 1 21.381 5.297 -11.709 5 HG2 MET 1 HG2 MET 1 21.940 3.977 -10.009 6 HG3 MET 1 HG3 MET 1 23.638 3.946 -10.479 7 HE1 MET 1 HE1 MET 1 21.914 4.068 -7.721 8 HE2 MET 1 HE2 MET 1 23.634 3.950 -7.352 9 HE3 MET 1 HE3 MET 1 22.665 5.240 -6.638 10 H ALA 2 H ALA 2 22.617 2.400 -13.530 11 HA ALA 2 HA ALA 2 20.556 3.238 -15.464 12 HB1 ALA 2 HB1 ALA 2 21.105 1.395 -16.831 13 HB2 ALA 2 HB2 ALA 2 22.643 2.117 -16.356 14 HB3 ALA 2 HB3 ALA 2 22.077 0.647 -15.563 15 H GLY 3 H GLY 3 21.409 0.261 -13.678 16 HA2 GLY 3 HA2 GLY 3 20.039 -0.745 -12.016 17 HA3 GLY 3 HA3 GLY 3 18.673 0.180 -12.622 18 H SER 4 H SER 4 20.619 -2.676 -13.028 19 HA SER 4 HA SER 4 18.784 -3.634 -15.119 20 HB2 SER 4 HB2 SER 4 21.167 -3.662 -15.734 21 HB3 SER 4 HB3 SER 4 21.518 -4.679 -14.337 22 HG SER 4 HG SER 4 21.056 -6.295 -15.581 23 H HIS 5 H HIS 5 20.394 -4.631 -12.116 24 HA HIS 5 HA HIS 5 19.820 -6.127 -10.501 25 HB2 HIS 5 HB2 HIS 5 17.535 -4.787 -11.030 26 HB3 HIS 5 HB3 HIS 5 17.025 -6.423 -11.435 27 HD1 HIS 5 HD1 HIS 5 18.654 -4.597 -8.524 28 HD2 HIS 5 HD2 HIS 5 16.204 -7.863 -9.293 29 HE1 HIS 5 HE1 HIS 5 17.983 -5.480 -6.267 30 H HIS 6 H HIS 6 20.995 -7.884 -11.161 31 HA HIS 6 HA HIS 6 19.816 -9.724 -13.100 32 HB2 HIS 6 HB2 HIS 6 22.476 -8.990 -12.408 33 HB3 HIS 6 HB3 HIS 6 22.285 -10.703 -12.049 34 HD1 HIS 6 HD1 HIS 6 21.459 -12.212 -14.114 35 HD2 HIS 6 HD2 HIS 6 22.811 -8.397 -15.052 36 HE1 HIS 6 HE1 HIS 6 21.917 -12.250 -16.587 37 H HIS 7 H HIS 7 19.673 -12.007 -12.636 38 HA HIS 7 HA HIS 7 19.921 -13.015 -9.988 39 HB2 HIS 7 HB2 HIS 7 17.562 -11.588 -10.462 40 HB3 HIS 7 HB3 HIS 7 17.098 -13.282 -10.590 41 HD1 HIS 7 HD1 HIS 7 15.929 -13.639 -8.412 42 HD2 HIS 7 HD2 HIS 7 19.634 -11.821 -7.938 43 HE1 HIS 7 HE1 HIS 7 16.332 -13.571 -5.930 44 H HIS 8 H HIS 8 19.946 -15.210 -9.982 45 HA HIS 8 HA HIS 8 18.883 -16.631 -12.314 46 HB2 HIS 8 HB2 HIS 8 21.648 -16.165 -11.836 47 HB3 HIS 8 HB3 HIS 8 21.340 -17.876 -11.556 48 HD1 HIS 8 HD1 HIS 8 21.140 -19.330 -13.577 49 HD2 HIS 8 HD2 HIS 8 20.858 -15.289 -14.501 50 HE1 HIS 8 HE1 HIS 8 21.133 -19.213 -16.089 51 H HIS 9 H HIS 9 19.463 -19.153 -11.829 52 HA HIS 9 HA HIS 9 19.064 -19.811 -9.035 53 HB2 HIS 9 HB2 HIS 9 16.933 -20.140 -11.120 54 HB3 HIS 9 HB3 HIS 9 17.038 -21.281 -9.783 55 HD1 HIS 9 HD1 HIS 9 16.465 -20.390 -7.417 56 HD2 HIS 9 HD2 HIS 9 15.999 -17.595 -10.455 57 HE1 HIS 9 HE1 HIS 9 15.160 -18.498 -6.396 58 H HIS 10 H HIS 10 18.570 -21.359 -12.214 59 HA HIS 10 HA HIS 10 19.420 -23.261 -13.127 60 HB2 HIS 10 HB2 HIS 10 21.561 -21.832 -12.450 61 HB3 HIS 10 HB3 HIS 10 21.815 -23.186 -11.352 62 HD1 HIS 10 HD1 HIS 10 20.611 -23.238 -14.959 63 HD2 HIS 10 HD2 HIS 10 23.727 -24.647 -12.599 64 HE1 HIS 10 HE1 HIS 10 21.994 -24.697 -16.471 65 H GLY 11 H GLY 11 17.591 -23.721 -11.161 66 HA2 GLY 11 HA2 GLY 11 18.509 -25.473 -9.116 67 HA3 GLY 11 HA3 GLY 11 16.843 -25.278 -9.641 68 H SER 12 H SER 12 17.866 -27.747 -8.901 69 HA SER 12 HA SER 12 18.504 -29.185 -11.349 70 HB2 SER 12 HB2 SER 12 18.012 -30.561 -8.736 71 HB3 SER 12 HB3 SER 12 19.168 -30.955 -10.008 72 HG SER 12 HG SER 12 19.349 -29.059 -7.953 73 H MET 13 H MET 13 17.324 -31.480 -11.371 74 HA MET 13 HA MET 13 14.433 -30.919 -11.243 75 HB2 MET 13 HB2 MET 13 16.064 -31.723 -13.443 76 HB3 MET 13 HB3 MET 13 14.961 -33.040 -13.066 77 HG2 MET 13 HG2 MET 13 13.380 -31.983 -14.186 78 HG3 MET 13 HG3 MET 13 13.426 -30.699 -12.980 79 HE1 MET 13 HE1 MET 13 13.427 -28.270 -15.874 80 HE2 MET 13 HE2 MET 13 12.412 -29.703 -15.719 81 HE3 MET 13 HE3 MET 13 12.794 -28.735 -14.295 82 H SER 14 H SER 14 13.716 -31.925 -9.463 83 HA SER 14 HA SER 14 14.567 -34.710 -9.011 84 HB2 SER 14 HB2 SER 14 15.110 -32.987 -7.220 85 HB3 SER 14 HB3 SER 14 13.374 -32.869 -6.933 86 HG SER 14 HG SER 14 14.910 -35.252 -6.769 87 H GLU 15 H GLU 15 12.653 -35.566 -7.288 88 HA GLU 15 HA GLU 15 10.184 -35.388 -8.887 89 HB2 GLU 15 HB2 GLU 15 11.746 -37.645 -8.262 90 HB3 GLU 15 HB3 GLU 15 10.304 -37.766 -7.264 91 HG2 GLU 15 HG2 GLU 15 9.771 -38.911 -9.222 92 HG3 GLU 15 HG3 GLU 15 8.984 -37.343 -9.394 93 H TYR 16 H TYR 16 8.427 -36.659 -7.259 94 HA TYR 16 HA TYR 16 8.509 -35.222 -4.701 95 HB2 TYR 16 HB2 TYR 16 5.965 -34.863 -5.096 96 HB3 TYR 16 HB3 TYR 16 7.110 -33.776 -5.874 97 HD1 TYR 16 HD1 TYR 16 5.050 -36.813 -6.474 98 HD2 TYR 16 HD2 TYR 16 7.096 -33.506 -8.200 99 HE1 TYR 16 HE1 TYR 16 4.063 -37.352 -8.661 100 HE2 TYR 16 HE2 TYR 16 6.114 -34.035 -10.392 101 HH TYR 16 HH TYR 16 4.962 -35.562 -11.573 102 H ILE 17 H ILE 17 6.355 -35.958 -3.445 103 HA ILE 17 HA ILE 17 6.221 -38.895 -3.662 104 HB ILE 17 HB ILE 17 7.485 -38.536 -1.715 105 HG12 ILE 17 HG12 ILE 17 4.616 -38.727 -0.775 106 HG13 ILE 17 HG13 ILE 17 5.548 -40.070 -1.427 107 HG21 ILE 17 HG21 ILE 17 5.838 -36.122 -1.478 108 HG22 ILE 17 HG22 ILE 17 6.206 -36.915 0.053 109 HG23 ILE 17 HG23 ILE 17 7.515 -36.404 -1.013 110 HD11 ILE 17 HD11 ILE 17 5.681 -40.347 0.872 111 HD12 ILE 17 HD12 ILE 17 7.208 -39.566 0.459 112 HD13 ILE 17 HD13 ILE 17 5.897 -38.622 1.165 113 H ARG 18 H ARG 18 4.245 -39.695 -3.924 114 HA ARG 18 HA ARG 18 1.945 -38.008 -3.179 115 HB2 ARG 18 HB2 ARG 18 2.556 -39.544 -5.626 116 HB3 ARG 18 HB3 ARG 18 0.909 -39.700 -5.031 117 HG2 ARG 18 HG2 ARG 18 1.160 -37.042 -4.897 118 HG3 ARG 18 HG3 ARG 18 2.289 -37.375 -6.212 119 HD2 ARG 18 HD2 ARG 18 -0.167 -38.872 -6.514 120 HD3 ARG 18 HD3 ARG 18 -0.477 -37.140 -6.395 121 HE ARG 18 HE ARG 18 1.632 -37.796 -8.227 122 HH11 ARG 18 HH11 ARG 18 -1.812 -37.468 -7.843 123 HH12 ARG 18 HH12 ARG 18 -2.103 -37.175 -9.526 124 HH21 ARG 18 HH21 ARG 18 1.262 -37.411 -10.444 125 HH22 ARG 18 HH22 ARG 18 -0.354 -37.144 -11.005 126 H VAL 19 H VAL 19 1.203 -38.806 -1.309 127 HA VAL 19 HA VAL 19 0.299 -41.573 -1.261 128 HB VAL 19 HB VAL 19 1.241 -41.845 1.083 129 HG11 VAL 19 HG11 VAL 19 3.582 -41.705 -0.701 130 HG12 VAL 19 HG12 VAL 19 2.933 -43.063 0.220 131 HG13 VAL 19 HG13 VAL 19 2.200 -42.610 -1.319 132 HG21 VAL 19 HG21 VAL 19 3.033 -39.594 0.174 133 HG22 VAL 19 HG22 VAL 19 1.815 -39.485 1.445 134 HG23 VAL 19 HG23 VAL 19 3.214 -40.539 1.653 135 H THR 20 H THR 20 -1.352 -41.974 0.249 136 HA THR 20 HA THR 20 -2.499 -39.552 1.480 137 HB THR 20 HB THR 20 -4.005 -40.083 -0.237 138 HG1 THR 20 HG1 THR 20 -5.826 -40.632 0.911 139 HG21 THR 20 HG21 THR 20 -3.716 -42.078 -1.222 140 HG22 THR 20 HG22 THR 20 -4.845 -42.695 -0.015 141 HG23 THR 20 HG23 THR 20 -3.107 -42.816 0.259 142 H GLU 21 H GLU 21 -3.434 -39.735 3.514 143 HA GLU 21 HA GLU 21 -2.327 -41.748 5.203 144 HB2 GLU 21 HB2 GLU 21 -2.894 -39.311 5.795 145 HB3 GLU 21 HB3 GLU 21 -4.550 -39.872 5.979 146 HG2 GLU 21 HG2 GLU 21 -2.858 -41.630 7.426 147 HG3 GLU 21 HG3 GLU 21 -2.429 -39.974 7.848 148 H ASP 22 H ASP 22 -5.641 -40.990 4.158 149 HA ASP 22 HA ASP 22 -6.490 -43.630 5.135 150 HB2 ASP 22 HB2 ASP 22 -7.717 -41.015 5.160 151 HB3 ASP 22 HB3 ASP 22 -8.755 -42.174 4.334 152 H GLU 23 H GLU 23 -7.653 -45.032 3.806 153 HA GLU 23 HA GLU 23 -6.885 -45.078 1.093 154 HB2 GLU 23 HB2 GLU 23 -8.264 -47.045 0.896 155 HB3 GLU 23 HB3 GLU 23 -7.429 -47.093 2.442 156 HG2 GLU 23 HG2 GLU 23 -9.610 -46.002 3.346 157 HG3 GLU 23 HG3 GLU 23 -10.319 -46.646 1.866 158 H ASN 24 H ASN 24 -9.789 -43.973 2.726 159 HA ASN 24 HA ASN 24 -11.352 -43.646 0.367 160 HB2 ASN 24 HB2 ASN 24 -11.993 -43.717 2.964 161 HB3 ASN 24 HB3 ASN 24 -11.908 -41.970 2.762 162 HD21 ASN 24 HD21 ASN 24 -14.021 -41.476 2.886 163 HD22 ASN 24 HD22 ASN 24 -15.222 -42.038 1.779 164 H ASP 25 H ASP 25 -9.002 -41.705 2.029 165 HA ASP 25 HA ASP 25 -9.716 -39.238 0.740 166 HB2 ASP 25 HB2 ASP 25 -7.585 -40.149 2.604 167 HB3 ASP 25 HB3 ASP 25 -7.239 -38.730 1.620 168 H GLU 26 H GLU 26 -8.265 -38.060 -0.702 169 HA GLU 26 HA GLU 26 -7.297 -39.794 -2.804 170 HB2 GLU 26 HB2 GLU 26 -8.020 -36.951 -2.534 171 HB3 GLU 26 HB3 GLU 26 -6.685 -37.269 -3.632 172 HG2 GLU 26 HG2 GLU 26 -8.708 -39.161 -4.191 173 HG3 GLU 26 HG3 GLU 26 -9.474 -37.578 -4.072 174 HA PRO 27 HA PRO 27 -3.008 -39.670 -1.881 175 HB2 PRO 27 HB2 PRO 27 -1.931 -39.667 -4.373 176 HB3 PRO 27 HB3 PRO 27 -2.706 -41.088 -3.663 177 HG2 PRO 27 HG2 PRO 27 -3.815 -39.097 -5.604 178 HG3 PRO 27 HG3 PRO 27 -3.969 -40.863 -5.603 179 HD2 PRO 27 HD2 PRO 27 -5.937 -39.229 -4.714 180 HD3 PRO 27 HD3 PRO 27 -5.652 -40.841 -4.028 181 H ILE 28 H ILE 28 -2.588 -37.704 -0.918 182 HA ILE 28 HA ILE 28 -2.506 -35.244 -2.362 183 HB ILE 28 HB ILE 28 -2.985 -35.176 -0.007 184 HG12 ILE 28 HG12 ILE 28 -1.346 -33.507 0.738 185 HG13 ILE 28 HG13 ILE 28 -0.236 -34.022 -0.527 186 HG21 ILE 28 HG21 ILE 28 -0.286 -36.467 0.344 187 HG22 ILE 28 HG22 ILE 28 -1.223 -35.761 1.660 188 HG23 ILE 28 HG23 ILE 28 -1.861 -37.141 0.765 189 HD11 ILE 28 HD11 ILE 28 -2.861 -33.271 -1.535 190 HD12 ILE 28 HD12 ILE 28 -2.016 -31.962 -0.708 191 HD13 ILE 28 HD13 ILE 28 -1.253 -32.783 -2.069 192 H GLU 29 H GLU 29 -0.857 -34.263 -3.375 193 HA GLU 29 HA GLU 29 1.689 -35.705 -3.512 194 HB2 GLU 29 HB2 GLU 29 2.118 -34.328 -5.520 195 HB3 GLU 29 HB3 GLU 29 0.638 -35.268 -5.651 196 HG2 GLU 29 HG2 GLU 29 -0.653 -33.260 -5.033 197 HG3 GLU 29 HG3 GLU 29 0.847 -32.335 -5.014 198 H ILE 30 H ILE 30 3.439 -34.965 -2.516 199 HA ILE 30 HA ILE 30 3.556 -32.110 -1.803 200 HB ILE 30 HB ILE 30 5.035 -33.183 0.172 201 HG12 ILE 30 HG12 ILE 30 2.723 -35.072 0.166 202 HG13 ILE 30 HG13 ILE 30 4.126 -35.470 -0.819 203 HG21 ILE 30 HG21 ILE 30 3.474 -32.282 1.529 204 HG22 ILE 30 HG22 ILE 30 2.797 -31.701 0.008 205 HG23 ILE 30 HG23 ILE 30 2.148 -33.157 0.763 206 HD11 ILE 30 HD11 ILE 30 4.227 -36.516 1.379 207 HD12 ILE 30 HD12 ILE 30 5.548 -35.370 1.147 208 HD13 ILE 30 HD13 ILE 30 4.161 -34.927 2.140 209 HA PRO 31 HA PRO 31 7.558 -32.015 -3.606 210 HB2 PRO 31 HB2 PRO 31 8.802 -30.182 -2.037 211 HB3 PRO 31 HB3 PRO 31 7.552 -29.752 -3.211 212 HG2 PRO 31 HG2 PRO 31 7.319 -30.136 -0.251 213 HG3 PRO 31 HG3 PRO 31 6.610 -28.874 -1.275 214 HD2 PRO 31 HD2 PRO 31 5.195 -31.015 -0.410 215 HD3 PRO 31 HD3 PRO 31 4.886 -30.235 -1.974 216 H SER 32 H SER 32 9.523 -32.995 -3.447 217 HA SER 32 HA SER 32 10.305 -34.033 -0.802 218 HB2 SER 32 HB2 SER 32 10.553 -36.155 -1.588 219 HB3 SER 32 HB3 SER 32 9.377 -35.621 -2.789 220 HG SER 32 HG SER 32 11.139 -35.112 -4.162 221 H GLU 33 H GLU 33 12.624 -34.581 -0.635 222 HA GLU 33 HA GLU 33 14.240 -32.416 -1.415 223 HB2 GLU 33 HB2 GLU 33 14.591 -34.931 0.054 224 HB3 GLU 33 HB3 GLU 33 16.036 -34.399 -0.794 225 HG2 GLU 33 HG2 GLU 33 14.460 -32.676 1.101 226 HG3 GLU 33 HG3 GLU 33 15.878 -33.618 1.556 227 H ASP 34 H ASP 34 16.332 -32.655 -2.618 228 HA ASP 34 HA ASP 34 15.818 -33.482 -5.272 229 HB2 ASP 34 HB2 ASP 34 18.553 -32.935 -4.121 230 HB3 ASP 34 HB3 ASP 34 18.011 -32.715 -5.783 231 H ASP 35 H ASP 35 17.617 -34.930 -2.610 232 HA ASP 35 HA ASP 35 18.827 -37.014 -4.068 233 HB2 ASP 35 HB2 ASP 35 18.608 -36.214 -1.323 234 HB3 ASP 35 HB3 ASP 35 18.294 -37.943 -1.445 235 H GLY 36 H GLY 36 15.587 -36.509 -3.083 236 HA2 GLY 36 HA2 GLY 36 13.954 -37.938 -4.266 237 HA3 GLY 36 HA3 GLY 36 14.949 -39.307 -3.793 238 H THR 37 H THR 37 15.418 -38.199 -1.103 239 HA THR 37 HA THR 37 13.261 -39.439 0.228 240 HB THR 37 HB THR 37 14.287 -38.737 2.290 241 HG1 THR 37 HG1 THR 37 15.837 -36.973 0.669 242 HG21 THR 37 HG21 THR 37 15.539 -40.269 0.415 243 HG22 THR 37 HG22 THR 37 16.101 -40.055 2.073 244 HG23 THR 37 HG23 THR 37 16.781 -39.071 0.776 245 H VAL 38 H VAL 38 12.529 -37.926 2.337 246 HA VAL 38 HA VAL 38 11.378 -35.454 1.253 247 HB VAL 38 HB VAL 38 9.822 -37.685 2.557 248 HG11 VAL 38 HG11 VAL 38 7.906 -35.930 2.170 249 HG12 VAL 38 HG12 VAL 38 8.870 -35.905 3.648 250 HG13 VAL 38 HG13 VAL 38 9.226 -34.774 2.343 251 HG21 VAL 38 HG21 VAL 38 8.577 -37.772 0.566 252 HG22 VAL 38 HG22 VAL 38 9.206 -36.223 0.004 253 HG23 VAL 38 HG23 VAL 38 10.257 -37.639 0.046 254 H LEU 39 H LEU 39 11.466 -33.797 2.638 255 HA LEU 39 HA LEU 39 12.766 -34.080 5.145 256 HB2 LEU 39 HB2 LEU 39 12.395 -32.033 3.417 257 HB3 LEU 39 HB3 LEU 39 11.215 -31.624 4.661 258 HG LEU 39 HG LEU 39 13.048 -31.700 6.342 259 HD11 LEU 39 HD11 LEU 39 15.094 -32.419 5.859 260 HD12 LEU 39 HD12 LEU 39 15.194 -31.391 4.430 261 HD13 LEU 39 HD13 LEU 39 14.447 -32.984 4.319 262 HD21 LEU 39 HD21 LEU 39 13.606 -29.788 4.081 263 HD22 LEU 39 HD22 LEU 39 13.935 -29.551 5.798 264 HD23 LEU 39 HD23 LEU 39 12.269 -29.607 5.217 265 H LEU 40 H LEU 40 11.975 -34.274 7.158 266 HA LEU 40 HA LEU 40 9.459 -35.241 7.695 267 HB2 LEU 40 HB2 LEU 40 11.532 -35.158 9.187 268 HB3 LEU 40 HB3 LEU 40 10.974 -33.556 9.665 269 HG LEU 40 HG LEU 40 10.397 -35.384 11.262 270 HD11 LEU 40 HD11 LEU 40 8.980 -33.187 10.562 271 HD12 LEU 40 HD12 LEU 40 8.564 -34.256 11.901 272 HD13 LEU 40 HD13 LEU 40 7.770 -34.450 10.338 273 HD21 LEU 40 HD21 LEU 40 8.119 -36.328 9.740 274 HD22 LEU 40 HD22 LEU 40 9.335 -37.238 10.635 275 HD23 LEU 40 HD23 LEU 40 9.649 -36.748 8.970 276 H SER 41 H SER 41 10.541 -31.894 7.607 277 HA SER 41 HA SER 41 8.384 -30.622 8.783 278 HB2 SER 41 HB2 SER 41 10.387 -29.849 6.716 279 HB3 SER 41 HB3 SER 41 8.983 -28.803 6.925 280 HG SER 41 HG SER 41 11.055 -28.571 8.299 281 H THR 42 H THR 42 8.699 -31.954 5.551 282 HA THR 42 HA THR 42 6.284 -30.820 4.535 283 HB THR 42 HB THR 42 7.853 -33.207 3.540 284 HG1 THR 42 HG1 THR 42 9.078 -31.780 2.541 285 HG21 THR 42 HG21 THR 42 6.699 -32.749 1.394 286 HG22 THR 42 HG22 THR 42 5.698 -31.554 2.219 287 HG23 THR 42 HG23 THR 42 5.595 -33.255 2.671 288 H VAL 43 H VAL 43 7.164 -34.042 5.757 289 HA VAL 43 HA VAL 43 4.767 -35.358 5.366 290 HB VAL 43 HB VAL 43 6.919 -35.647 7.425 291 HG11 VAL 43 HG11 VAL 43 5.576 -37.833 8.000 292 HG12 VAL 43 HG12 VAL 43 5.235 -36.314 8.832 293 HG13 VAL 43 HG13 VAL 43 4.196 -36.850 7.511 294 HG21 VAL 43 HG21 VAL 43 5.854 -37.366 5.192 295 HG22 VAL 43 HG22 VAL 43 7.404 -36.528 5.256 296 HG23 VAL 43 HG23 VAL 43 7.093 -37.890 6.333 297 H THR 44 H THR 44 5.680 -33.124 7.926 298 HA THR 44 HA THR 44 3.346 -33.570 9.516 299 HB THR 44 HB THR 44 4.038 -31.604 10.785 300 HG1 THR 44 HG1 THR 44 6.123 -30.631 9.978 301 HG21 THR 44 HG21 THR 44 5.675 -33.903 10.289 302 HG22 THR 44 HG22 THR 44 5.457 -32.998 11.788 303 HG23 THR 44 HG23 THR 44 6.703 -32.514 10.638 304 H ALA 45 H ALA 45 4.127 -31.551 6.806 305 HA ALA 45 HA ALA 45 2.366 -29.460 6.994 306 HB1 ALA 45 HB1 ALA 45 4.023 -30.020 5.129 307 HB2 ALA 45 HB2 ALA 45 2.710 -30.958 4.417 308 HB3 ALA 45 HB3 ALA 45 2.517 -29.224 4.671 309 H GLN 46 H GLN 46 1.658 -32.717 5.749 310 HA GLN 46 HA GLN 46 -1.208 -32.078 5.906 311 HB2 GLN 46 HB2 GLN 46 -0.283 -34.550 4.544 312 HB3 GLN 46 HB3 GLN 46 -1.605 -33.467 4.132 313 HG2 GLN 46 HG2 GLN 46 -0.278 -32.823 2.461 314 HG3 GLN 46 HG3 GLN 46 0.542 -31.868 3.695 315 HE21 GLN 46 HE21 GLN 46 0.540 -35.123 2.292 316 HE22 GLN 46 HE22 GLN 46 2.253 -35.336 2.347 317 H PHE 47 H PHE 47 1.276 -34.323 6.935 318 HA PHE 47 HA PHE 47 -0.708 -35.693 8.627 319 HB2 PHE 47 HB2 PHE 47 1.991 -36.869 8.148 320 HB3 PHE 47 HB3 PHE 47 0.446 -37.674 8.404 321 HD1 PHE 47 HD1 PHE 47 2.893 -37.380 6.112 322 HD2 PHE 47 HD2 PHE 47 -1.312 -36.792 6.409 323 HE1 PHE 47 HE1 PHE 47 2.677 -37.724 3.685 324 HE2 PHE 47 HE2 PHE 47 -1.535 -37.136 3.983 325 HZ PHE 47 HZ PHE 47 0.461 -37.604 2.618 326 HA PRO 48 HA PRO 48 1.951 -33.204 11.484 327 HB2 PRO 48 HB2 PRO 48 -0.103 -32.432 13.083 328 HB3 PRO 48 HB3 PRO 48 0.354 -31.557 11.617 329 HG2 PRO 48 HG2 PRO 48 -1.847 -33.544 12.029 330 HG3 PRO 48 HG3 PRO 48 -1.877 -32.009 11.141 331 HD2 PRO 48 HD2 PRO 48 -1.634 -34.405 9.903 332 HD3 PRO 48 HD3 PRO 48 -0.880 -32.925 9.276 333 H GLY 49 H GLY 49 2.973 -34.280 13.048 334 HA2 GLY 49 HA2 GLY 49 3.103 -35.392 15.124 335 HA3 GLY 49 HA3 GLY 49 1.433 -35.902 14.930 336 H ALA 50 H ALA 50 1.933 -36.840 12.170 337 HA ALA 50 HA ALA 50 2.338 -39.524 12.618 338 HB1 ALA 50 HB1 ALA 50 1.381 -38.731 10.559 339 HB2 ALA 50 HB2 ALA 50 2.895 -37.945 10.111 340 HB3 ALA 50 HB3 ALA 50 2.805 -39.705 10.191 341 H CYS 51 H CYS 51 4.036 -40.642 13.290 342 HA CYS 51 HA CYS 51 6.693 -39.474 13.160 343 HB2 CYS 51 HB2 CYS 51 5.337 -41.416 14.831 344 HB3 CYS 51 HB3 CYS 51 6.891 -42.030 14.280 345 HG CYS 51 HG CYS 51 8.448 -40.306 15.561 346 H GLY 52 H GLY 52 5.086 -42.477 12.121 347 HA2 GLY 52 HA2 GLY 52 7.141 -42.714 10.018 348 HA3 GLY 52 HA3 GLY 52 6.679 -44.109 10.981 349 H LEU 53 H LEU 53 6.500 -43.688 8.085 350 HA LEU 53 HA LEU 53 3.582 -43.922 7.753 351 HB2 LEU 53 HB2 LEU 53 5.551 -43.256 5.581 352 HB3 LEU 53 HB3 LEU 53 3.794 -43.118 5.532 353 HG LEU 53 HG LEU 53 4.445 -40.918 5.731 354 HD11 LEU 53 HD11 LEU 53 3.437 -40.264 7.635 355 HD12 LEU 53 HD12 LEU 53 4.471 -41.264 8.655 356 HD13 LEU 53 HD13 LEU 53 3.104 -41.988 7.808 357 HD21 LEU 53 HD21 LEU 53 6.876 -41.661 6.162 358 HD22 LEU 53 HD22 LEU 53 6.465 -41.487 7.869 359 HD23 LEU 53 HD23 LEU 53 6.346 -40.099 6.787 360 H ARG 54 H ARG 54 2.753 -45.626 6.571 361 HA ARG 54 HA ARG 54 4.636 -47.833 6.095 362 HB2 ARG 54 HB2 ARG 54 2.332 -47.802 7.584 363 HB3 ARG 54 HB3 ARG 54 1.767 -48.454 6.052 364 HG2 ARG 54 HG2 ARG 54 4.005 -49.920 6.416 365 HG3 ARG 54 HG3 ARG 54 3.512 -49.647 8.088 366 HD2 ARG 54 HD2 ARG 54 1.326 -50.388 6.283 367 HD3 ARG 54 HD3 ARG 54 2.563 -51.630 6.473 368 HE ARG 54 HE ARG 54 1.763 -50.575 8.988 369 HH11 ARG 54 HH11 ARG 54 0.777 -52.741 6.447 370 HH12 ARG 54 HH12 ARG 54 -0.190 -53.731 7.489 371 HH21 ARG 54 HH21 ARG 54 0.494 -51.871 10.369 372 HH22 ARG 54 HH22 ARG 54 -0.351 -53.235 9.719 373 H TYR 55 H TYR 55 4.112 -49.294 4.276 374 HA TYR 55 HA TYR 55 3.256 -47.720 1.949 375 HB2 TYR 55 HB2 TYR 55 5.445 -49.500 2.418 376 HB3 TYR 55 HB3 TYR 55 4.437 -50.174 1.143 377 HD1 TYR 55 HD1 TYR 55 3.608 -48.216 -0.580 378 HD2 TYR 55 HD2 TYR 55 7.204 -48.211 1.694 379 HE1 TYR 55 HE1 TYR 55 4.626 -46.674 -2.205 380 HE2 TYR 55 HE2 TYR 55 8.231 -46.668 0.076 381 HH TYR 55 HH TYR 55 7.765 -45.221 -1.640 382 H ARG 56 H ARG 56 1.447 -48.213 0.896 383 HA ARG 56 HA ARG 56 0.265 -50.879 1.295 384 HB2 ARG 56 HB2 ARG 56 -0.878 -49.098 2.651 385 HB3 ARG 56 HB3 ARG 56 -1.310 -48.307 1.141 386 HG2 ARG 56 HG2 ARG 56 -2.049 -51.132 1.250 387 HG3 ARG 56 HG3 ARG 56 -2.843 -50.127 2.464 388 HD2 ARG 56 HD2 ARG 56 -3.940 -48.859 0.894 389 HD3 ARG 56 HD3 ARG 56 -2.726 -49.158 -0.350 390 HE ARG 56 HE ARG 56 -3.976 -50.931 -1.038 391 HH11 ARG 56 HH11 ARG 56 -4.778 -50.243 2.280 392 HH12 ARG 56 HH12 ARG 56 -6.030 -51.438 2.361 393 HH21 ARG 56 HH21 ARG 56 -5.622 -52.508 -0.943 394 HH22 ARG 56 HH22 ARG 56 -6.508 -52.726 0.528 395 H ASN 57 H ASN 57 0.785 -51.719 -0.674 396 HA ASN 57 HA ASN 57 -0.190 -50.263 -3.042 397 HB2 ASN 57 HB2 ASN 57 2.368 -51.055 -2.609 398 HB3 ASN 57 HB3 ASN 57 1.734 -52.472 -3.441 399 HD21 ASN 57 HD21 ASN 57 3.537 -51.534 -4.878 400 HD22 ASN 57 HD22 ASN 57 3.003 -50.478 -6.137 401 HA PRO 58 HA PRO 58 -3.151 -53.599 -3.203 402 HB2 PRO 58 HB2 PRO 58 -4.443 -52.697 -5.414 403 HB3 PRO 58 HB3 PRO 58 -4.689 -52.003 -3.807 404 HG2 PRO 58 HG2 PRO 58 -2.977 -51.014 -6.055 405 HG3 PRO 58 HG3 PRO 58 -4.046 -50.098 -4.977 406 HD2 PRO 58 HD2 PRO 58 -1.363 -50.197 -4.628 407 HD3 PRO 58 HD3 PRO 58 -2.498 -50.057 -3.270 408 H VAL 59 H VAL 59 -1.154 -52.510 -5.897 409 HA VAL 59 HA VAL 59 -1.620 -54.888 -7.458 410 HB VAL 59 HB VAL 59 0.076 -53.992 -8.984 411 HG11 VAL 59 HG11 VAL 59 -1.113 -52.002 -9.674 412 HG12 VAL 59 HG12 VAL 59 -2.264 -53.221 -9.121 413 HG13 VAL 59 HG13 VAL 59 -1.853 -51.857 -8.080 414 HG21 VAL 59 HG21 VAL 59 0.787 -51.534 -8.314 415 HG22 VAL 59 HG22 VAL 59 0.597 -52.180 -6.684 416 HG23 VAL 59 HG23 VAL 59 1.727 -52.937 -7.807 417 H SER 60 H SER 60 0.825 -53.697 -5.244 418 HA SER 60 HA SER 60 2.632 -55.890 -5.802 419 HB2 SER 60 HB2 SER 60 3.216 -53.440 -5.059 420 HB3 SER 60 HB3 SER 60 2.934 -54.072 -3.437 421 HG SER 60 HG SER 60 5.045 -54.454 -3.794 422 H GLN 61 H GLN 61 0.202 -55.037 -3.448 423 HA GLN 61 HA GLN 61 -0.609 -56.100 -1.595 424 HB2 GLN 61 HB2 GLN 61 0.061 -58.524 -3.272 425 HB3 GLN 61 HB3 GLN 61 -1.048 -58.497 -1.908 426 HG2 GLN 61 HG2 GLN 61 -2.158 -56.574 -3.384 427 HG3 GLN 61 HG3 GLN 61 -1.409 -57.518 -4.670 428 HE21 GLN 61 HE21 GLN 61 -4.093 -57.179 -2.731 429 HE22 GLN 61 HE22 GLN 61 -4.820 -58.722 -3.004 430 H CYS 62 H CYS 62 2.186 -55.451 -1.475 431 HA CYS 62 HA CYS 62 3.300 -57.701 0.046 432 HB2 CYS 62 HB2 CYS 62 4.463 -56.062 -1.849 433 HB3 CYS 62 HB3 CYS 62 5.036 -55.377 -0.334 434 HG CYS 62 HG CYS 62 6.984 -57.025 -0.144 435 H MET 63 H MET 63 5.050 -56.431 1.702 436 HA MET 63 HA MET 63 3.316 -54.768 3.407 437 HB2 MET 63 HB2 MET 63 4.569 -55.826 5.347 438 HB3 MET 63 HB3 MET 63 3.429 -56.863 4.500 439 HG2 MET 63 HG2 MET 63 5.091 -58.133 3.537 440 HG3 MET 63 HG3 MET 63 6.302 -56.864 3.705 441 HE1 MET 63 HE1 MET 63 7.415 -56.311 6.452 442 HE2 MET 63 HE2 MET 63 8.257 -57.856 6.560 443 HE3 MET 63 HE3 MET 63 8.059 -57.067 4.994 444 H ARG 64 H ARG 64 5.184 -53.805 1.475 445 HA ARG 64 HA ARG 64 7.694 -53.151 2.497 446 HB2 ARG 64 HB2 ARG 64 6.448 -52.716 0.143 447 HB3 ARG 64 HB3 ARG 64 6.347 -51.103 0.836 448 HG2 ARG 64 HG2 ARG 64 8.949 -51.723 1.309 449 HG3 ARG 64 HG3 ARG 64 8.654 -52.565 -0.214 450 HD2 ARG 64 HD2 ARG 64 7.455 -50.014 -0.417 451 HD3 ARG 64 HD3 ARG 64 9.070 -49.779 0.250 452 HE ARG 64 HE ARG 64 9.969 -50.432 -1.761 453 HH11 ARG 64 HH11 ARG 64 6.570 -51.181 -1.700 454 HH12 ARG 64 HH12 ARG 64 6.495 -51.583 -3.384 455 HH21 ARG 64 HH21 ARG 64 9.884 -50.958 -3.978 456 HH22 ARG 64 HH22 ARG 64 8.381 -51.457 -4.678 457 H GLY 65 H GLY 65 8.178 -50.576 2.677 458 HA2 GLY 65 HA2 GLY 65 6.284 -49.078 4.197 459 HA3 GLY 65 HA3 GLY 65 7.485 -49.825 5.240 460 H VAL 66 H VAL 66 6.940 -46.980 4.621 461 HA VAL 66 HA VAL 66 9.132 -46.037 3.030 462 HB VAL 66 HB VAL 66 7.321 -44.549 4.937 463 HG11 VAL 66 HG11 VAL 66 9.445 -43.385 4.618 464 HG12 VAL 66 HG12 VAL 66 9.238 -43.479 2.868 465 HG13 VAL 66 HG13 VAL 66 8.121 -42.521 3.839 466 HG21 VAL 66 HG21 VAL 66 6.668 -43.715 2.443 467 HG22 VAL 66 HG22 VAL 66 7.084 -45.400 2.133 468 HG23 VAL 66 HG23 VAL 66 5.832 -45.004 3.310 469 H ARG 67 H ARG 67 11.176 -45.997 3.665 470 HA ARG 67 HA ARG 67 11.992 -46.477 6.333 471 HB2 ARG 67 HB2 ARG 67 13.448 -47.163 4.572 472 HB3 ARG 67 HB3 ARG 67 13.484 -45.545 3.884 473 HG2 ARG 67 HG2 ARG 67 15.563 -45.999 5.003 474 HG3 ARG 67 HG3 ARG 67 14.681 -44.748 5.882 475 HD2 ARG 67 HD2 ARG 67 13.784 -46.680 7.318 476 HD3 ARG 67 HD3 ARG 67 15.090 -47.630 6.610 477 HE ARG 67 HE ARG 67 15.328 -45.538 8.578 478 HH11 ARG 67 HH11 ARG 67 16.960 -47.390 6.123 479 HH12 ARG 67 HH12 ARG 67 18.539 -47.118 6.783 480 HH21 ARG 67 HH21 ARG 67 17.402 -45.173 9.457 481 HH22 ARG 67 HH22 ARG 67 18.789 -45.858 8.680 482 H LEU 68 H LEU 68 12.769 -45.122 7.902 483 HA LEU 68 HA LEU 68 12.642 -42.233 7.359 484 HB2 LEU 68 HB2 LEU 68 10.642 -42.833 8.558 485 HB3 LEU 68 HB3 LEU 68 11.585 -43.703 9.767 486 HG LEU 68 HG LEU 68 10.626 -41.361 10.327 487 HD11 LEU 68 HD11 LEU 68 12.145 -41.219 12.013 488 HD12 LEU 68 HD12 LEU 68 13.522 -41.509 10.950 489 HD13 LEU 68 HD13 LEU 68 12.500 -42.854 11.455 490 HD21 LEU 68 HD21 LEU 68 13.183 -40.299 9.278 491 HD22 LEU 68 HD22 LEU 68 11.626 -39.500 9.502 492 HD23 LEU 68 HD23 LEU 68 11.883 -40.559 8.114 493 H VAL 69 H VAL 69 14.517 -41.277 7.750 494 HA VAL 69 HA VAL 69 16.168 -42.212 9.986 495 HB VAL 69 HB VAL 69 17.198 -43.292 8.123 496 HG11 VAL 69 HG11 VAL 69 16.842 -42.502 6.075 497 HG12 VAL 69 HG12 VAL 69 16.354 -40.928 6.707 498 HG13 VAL 69 HG13 VAL 69 18.058 -41.268 6.402 499 HG21 VAL 69 HG21 VAL 69 18.916 -40.866 8.362 500 HG22 VAL 69 HG22 VAL 69 18.572 -41.822 9.803 501 HG23 VAL 69 HG23 VAL 69 19.362 -42.572 8.416 502 H GLU 70 H GLU 70 16.603 -40.556 11.273 503 HA GLU 70 HA GLU 70 17.013 -38.455 12.042 504 HB2 GLU 70 HB2 GLU 70 17.868 -37.791 9.224 505 HB3 GLU 70 HB3 GLU 70 18.356 -36.983 10.707 506 HG2 GLU 70 HG2 GLU 70 19.043 -39.692 11.008 507 HG3 GLU 70 HG3 GLU 70 19.551 -39.214 9.389 508 H GLY 71 H GLY 71 14.415 -39.169 10.799 509 HA2 GLY 71 HA2 GLY 71 12.424 -37.927 10.830 510 HA3 GLY 71 HA3 GLY 71 13.367 -36.453 10.666 511 H ILE 72 H ILE 72 14.887 -37.654 8.389 512 HA ILE 72 HA ILE 72 13.091 -36.784 6.317 513 HB ILE 72 HB ILE 72 15.890 -37.903 6.129 514 HG12 ILE 72 HG12 ILE 72 15.696 -35.151 5.416 515 HG13 ILE 72 HG13 ILE 72 14.894 -35.364 6.968 516 HG21 ILE 72 HG21 ILE 72 13.916 -37.151 4.100 517 HG22 ILE 72 HG22 ILE 72 15.503 -36.413 3.885 518 HG23 ILE 72 HG23 ILE 72 15.351 -38.168 3.968 519 HD11 ILE 72 HD11 ILE 72 16.835 -36.084 8.009 520 HD12 ILE 72 HD12 ILE 72 17.618 -36.493 6.482 521 HD13 ILE 72 HD13 ILE 72 17.395 -34.804 6.934 522 H LEU 73 H LEU 73 11.617 -38.071 5.446 523 HA LEU 73 HA LEU 73 11.703 -40.913 5.692 524 HB2 LEU 73 HB2 LEU 73 9.901 -38.999 4.245 525 HB3 LEU 73 HB3 LEU 73 9.716 -40.744 4.082 526 HG LEU 73 HG LEU 73 8.132 -39.916 5.691 527 HD11 LEU 73 HD11 LEU 73 10.393 -41.335 7.093 528 HD12 LEU 73 HD12 LEU 73 9.152 -42.108 6.108 529 HD13 LEU 73 HD13 LEU 73 8.706 -41.290 7.606 530 HD21 LEU 73 HD21 LEU 73 8.651 -38.610 7.551 531 HD22 LEU 73 HD22 LEU 73 9.616 -37.897 6.258 532 HD23 LEU 73 HD23 LEU 73 10.375 -38.965 7.440 533 H HIS 74 H HIS 74 12.961 -42.186 4.516 534 HA HIS 74 HA HIS 74 13.958 -41.318 1.936 535 HB2 HIS 74 HB2 HIS 74 14.995 -42.890 3.971 536 HB3 HIS 74 HB3 HIS 74 14.609 -44.055 2.707 537 HD1 HIS 74 HD1 HIS 74 15.474 -42.875 0.186 538 HD2 HIS 74 HD2 HIS 74 17.572 -42.164 3.701 539 HE1 HIS 74 HE1 HIS 74 17.783 -42.191 -0.536 540 H ALA 75 H ALA 75 13.623 -42.381 -0.022 541 HA ALA 75 HA ALA 75 11.099 -43.845 -0.167 542 HB1 ALA 75 HB1 ALA 75 10.930 -42.293 -1.801 543 HB2 ALA 75 HB2 ALA 75 12.676 -42.185 -2.032 544 HB3 ALA 75 HB3 ALA 75 11.773 -43.525 -2.741 545 HA PRO 76 HA PRO 76 12.878 -47.780 -0.957 546 HB2 PRO 76 HB2 PRO 76 11.109 -48.824 -2.731 547 HB3 PRO 76 HB3 PRO 76 10.736 -48.608 -1.017 548 HG2 PRO 76 HG2 PRO 76 9.994 -46.883 -3.348 549 HG3 PRO 76 HG3 PRO 76 9.003 -47.382 -1.965 550 HD2 PRO 76 HD2 PRO 76 10.162 -44.940 -2.120 551 HD3 PRO 76 HD3 PRO 76 9.907 -45.780 -0.577 552 H ASP 77 H ASP 77 13.172 -49.337 -3.021 553 HA ASP 77 HA ASP 77 14.990 -47.918 -4.740 554 HB2 ASP 77 HB2 ASP 77 14.299 -50.760 -4.220 555 HB3 ASP 77 HB3 ASP 77 14.974 -50.382 -5.803 556 H ALA 78 H ALA 78 11.730 -48.267 -4.805 557 HA ALA 78 HA ALA 78 11.600 -48.338 -7.746 558 HB1 ALA 78 HB1 ALA 78 10.252 -49.955 -6.165 559 HB2 ALA 78 HB2 ALA 78 9.151 -48.580 -6.074 560 HB3 ALA 78 HB3 ALA 78 9.530 -49.304 -7.637 561 H GLY 79 H GLY 79 10.964 -46.428 -4.917 562 HA2 GLY 79 HA2 GLY 79 11.000 -43.995 -5.284 563 HA3 GLY 79 HA3 GLY 79 9.953 -44.273 -6.667 564 H TRP 80 H TRP 80 8.936 -42.465 -5.180 565 HA TRP 80 HA TRP 80 7.489 -43.324 -2.891 566 HB2 TRP 80 HB2 TRP 80 7.208 -40.913 -4.688 567 HB3 TRP 80 HB3 TRP 80 6.208 -41.167 -3.261 568 HD1 TRP 80 HD1 TRP 80 9.205 -39.394 -4.240 569 HE1 TRP 80 HE1 TRP 80 10.681 -38.822 -2.211 570 HE3 TRP 80 HE3 TRP 80 7.075 -42.503 -0.785 571 HZ2 TRP 80 HZ2 TRP 80 10.912 -39.588 0.496 572 HZ3 TRP 80 HZ3 TRP 80 7.983 -42.523 1.501 573 HH2 TRP 80 HH2 TRP 80 9.863 -41.095 2.127 574 H GLY 81 H GLY 81 6.347 -42.455 -6.165 575 HA2 GLY 81 HA2 GLY 81 4.726 -43.527 -7.446 576 HA3 GLY 81 HA3 GLY 81 4.456 -44.647 -6.119 577 H ASN 82 H ASN 82 2.178 -44.301 -6.755 578 HA ASN 82 HA ASN 82 1.088 -41.945 -5.367 579 HB2 ASN 82 HB2 ASN 82 -0.345 -43.173 -7.699 580 HB3 ASN 82 HB3 ASN 82 -0.495 -41.549 -7.033 581 HD21 ASN 82 HD21 ASN 82 1.353 -40.108 -7.324 582 HD22 ASN 82 HD22 ASN 82 2.292 -40.247 -8.768 583 H LEU 83 H LEU 83 1.570 -44.586 -4.321 584 HA LEU 83 HA LEU 83 -1.034 -45.863 -4.179 585 HB2 LEU 83 HB2 LEU 83 0.214 -47.410 -2.589 586 HB3 LEU 83 HB3 LEU 83 0.705 -47.411 -4.281 587 HG LEU 83 HG LEU 83 2.516 -47.469 -2.440 588 HD11 LEU 83 HD11 LEU 83 3.362 -45.318 -4.157 589 HD12 LEU 83 HD12 LEU 83 2.444 -46.521 -5.062 590 HD13 LEU 83 HD13 LEU 83 3.866 -47.009 -4.140 591 HD21 LEU 83 HD21 LEU 83 1.525 -45.569 -1.170 592 HD22 LEU 83 HD22 LEU 83 1.981 -44.503 -2.500 593 HD23 LEU 83 HD23 LEU 83 3.226 -45.350 -1.581 594 H VAL 84 H VAL 84 -1.368 -46.738 -1.712 595 HA VAL 84 HA VAL 84 -1.839 -44.289 -0.190 596 HB VAL 84 HB VAL 84 -2.840 -47.052 0.484 597 HG11 VAL 84 HG11 VAL 84 -3.241 -44.337 1.539 598 HG12 VAL 84 HG12 VAL 84 -4.713 -45.289 1.333 599 HG13 VAL 84 HG13 VAL 84 -3.397 -45.902 2.337 600 HG21 VAL 84 HG21 VAL 84 -4.014 -44.983 -1.357 601 HG22 VAL 84 HG22 VAL 84 -3.652 -46.673 -1.707 602 HG23 VAL 84 HG23 VAL 84 -4.977 -46.262 -0.617 603 H TYR 85 H TYR 85 -1.379 -44.180 2.079 604 HA TYR 85 HA TYR 85 0.725 -46.021 2.992 605 HB2 TYR 85 HB2 TYR 85 2.214 -44.365 3.432 606 HB3 TYR 85 HB3 TYR 85 1.323 -43.519 2.173 607 HD1 TYR 85 HD1 TYR 85 0.054 -41.571 2.664 608 HD2 TYR 85 HD2 TYR 85 1.729 -43.868 5.830 609 HE1 TYR 85 HE1 TYR 85 -0.479 -39.767 4.248 610 HE2 TYR 85 HE2 TYR 85 1.199 -42.070 7.422 611 HH TYR 85 HH TYR 85 -0.870 -39.503 6.676 612 H VAL 86 H VAL 86 0.804 -46.417 5.205 613 HA VAL 86 HA VAL 86 -1.591 -45.557 6.687 614 HB VAL 86 HB VAL 86 0.122 -48.012 7.100 615 HG11 VAL 86 HG11 VAL 86 -1.622 -46.647 8.885 616 HG12 VAL 86 HG12 VAL 86 -2.370 -48.181 8.436 617 HG13 VAL 86 HG13 VAL 86 -0.750 -48.159 9.134 618 HG21 VAL 86 HG21 VAL 86 -1.108 -48.624 5.284 619 HG22 VAL 86 HG22 VAL 86 -2.283 -49.000 6.544 620 HG23 VAL 86 HG23 VAL 86 -2.409 -47.489 5.642 621 H VAL 87 H VAL 87 -1.263 -44.116 8.236 622 HA VAL 87 HA VAL 87 1.241 -43.202 9.073 623 HB VAL 87 HB VAL 87 -0.038 -42.181 11.012 624 HG11 VAL 87 HG11 VAL 87 0.351 -40.898 9.032 625 HG12 VAL 87 HG12 VAL 87 -0.953 -41.725 8.177 626 HG13 VAL 87 HG13 VAL 87 -1.324 -40.644 9.522 627 HG21 VAL 87 HG21 VAL 87 -1.786 -44.008 10.986 628 HG22 VAL 87 HG22 VAL 87 -2.396 -42.357 11.102 629 HG23 VAL 87 HG23 VAL 87 -2.464 -43.216 9.563 630 H ASN 88 H ASN 88 2.230 -43.323 11.188 631 HA ASN 88 HA ASN 88 1.515 -45.619 12.835 632 HB2 ASN 88 HB2 ASN 88 4.205 -45.283 11.498 633 HB3 ASN 88 HB3 ASN 88 3.917 -46.380 12.846 634 HD21 ASN 88 HD21 ASN 88 4.530 -46.580 9.823 635 HD22 ASN 88 HD22 ASN 88 3.449 -47.820 9.294 636 H TYR 89 H TYR 89 1.342 -44.795 14.806 637 HA TYR 89 HA TYR 89 3.212 -42.675 15.624 638 HB2 TYR 89 HB2 TYR 89 0.598 -43.352 16.969 639 HB3 TYR 89 HB3 TYR 89 1.563 -41.892 17.153 640 HD1 TYR 89 HD1 TYR 89 1.633 -40.218 15.323 641 HD2 TYR 89 HD2 TYR 89 -0.966 -43.585 15.182 642 HE1 TYR 89 HE1 TYR 89 0.312 -39.118 13.564 643 HE2 TYR 89 HE2 TYR 89 -2.293 -42.494 13.421 644 HH TYR 89 HH TYR 89 -1.706 -39.175 12.468 645 HA PRO 90 HA PRO 90 5.063 -45.268 18.644 646 HB2 PRO 90 HB2 PRO 90 5.639 -43.466 20.592 647 HB3 PRO 90 HB3 PRO 90 6.517 -43.538 19.059 648 HG2 PRO 90 HG2 PRO 90 4.303 -41.702 19.890 649 HG3 PRO 90 HG3 PRO 90 5.796 -41.327 19.011 650 HD2 PRO 90 HD2 PRO 90 3.409 -41.622 17.768 651 HD3 PRO 90 HD3 PRO 90 4.947 -42.066 16.999 652 H LYS 91 H LYS 91 2.709 -42.964 20.003 653 HA LYS 91 HA LYS 91 1.070 -43.199 21.562 654 HB2 LYS 91 HB2 LYS 91 1.352 -46.181 21.219 655 HB3 LYS 91 HB3 LYS 91 -0.070 -45.284 21.735 656 HG2 LYS 91 HG2 LYS 91 -0.063 -44.219 19.439 657 HG3 LYS 91 HG3 LYS 91 1.132 -45.437 18.988 658 HD2 LYS 91 HD2 LYS 91 -0.692 -47.047 20.073 659 HD3 LYS 91 HD3 LYS 91 -1.761 -45.731 19.582 660 HE2 LYS 91 HE2 LYS 91 0.069 -46.311 17.462 661 HE3 LYS 91 HE3 LYS 91 -0.701 -47.807 17.991 662 HZ1 LYS 91 HZ1 LYS 91 -1.822 -46.311 16.204 663 HZ2 LYS 91 HZ2 LYS 91 -2.365 -45.431 17.542 664 HZ3 LYS 91 HZ3 LYS 91 -2.765 -47.067 17.387 665 H ASP 92 H ASP 92 3.545 -42.775 22.585 666 HA ASP 92 HA ASP 92 3.737 -44.613 24.876 667 HB2 ASP 92 HB2 ASP 92 6.036 -43.523 25.156 668 HB3 ASP 92 HB3 ASP 92 5.826 -44.600 23.778 669 H ASN 93 H ASN 93 1.706 -42.758 24.944 670 HA ASN 93 HA ASN 93 0.779 -41.150 26.258 671 HB2 ASN 93 HB2 ASN 93 3.205 -41.429 28.034 672 HB3 ASN 93 HB3 ASN 93 1.580 -40.928 28.495 673 HD21 ASN 93 HD21 ASN 93 3.713 -43.422 28.535 674 HD22 ASN 93 HD22 ASN 93 2.613 -44.740 28.729 675 H LYS 94 H LYS 94 1.111 -39.573 24.610 676 HA LYS 94 HA LYS 94 3.200 -37.608 25.291 677 HB2 LYS 94 HB2 LYS 94 3.536 -38.834 23.101 678 HB3 LYS 94 HB3 LYS 94 2.070 -38.051 22.526 679 HG2 LYS 94 HG2 LYS 94 3.305 -35.866 23.252 680 HG3 LYS 94 HG3 LYS 94 4.745 -36.877 23.108 681 HD2 LYS 94 HD2 LYS 94 2.782 -36.948 20.881 682 HD3 LYS 94 HD3 LYS 94 3.768 -35.494 21.056 683 HE2 LYS 94 HE2 LYS 94 5.702 -37.290 21.297 684 HE3 LYS 94 HE3 LYS 94 4.569 -38.274 20.372 685 HZ1 LYS 94 HZ1 LYS 94 5.858 -35.733 19.588 686 HZ2 LYS 94 HZ2 LYS 94 4.466 -36.292 18.806 687 HZ3 LYS 94 HZ3 LYS 94 5.880 -37.220 18.781 688 H ARG 95 H ARG 95 2.470 -35.669 25.862 689 HA ARG 95 HA ARG 95 -0.363 -35.088 25.610 690 HB2 ARG 95 HB2 ARG 95 0.667 -34.651 27.753 691 HB3 ARG 95 HB3 ARG 95 1.886 -33.630 27.003 692 HG2 ARG 95 HG2 ARG 95 0.387 -31.899 26.622 693 HG3 ARG 95 HG3 ARG 95 -1.019 -32.955 26.777 694 HD2 ARG 95 HD2 ARG 95 0.532 -32.999 29.195 695 HD3 ARG 95 HD3 ARG 95 0.143 -31.337 28.754 696 HE ARG 95 HE ARG 95 -2.128 -33.058 28.586 697 HH11 ARG 95 HH11 ARG 95 -0.143 -31.231 30.786 698 HH12 ARG 95 HH12 ARG 95 -1.401 -31.029 31.960 699 HH21 ARG 95 HH21 ARG 95 -3.793 -32.800 30.124 700 HH22 ARG 95 HH22 ARG 95 -3.476 -31.923 31.583 701 H LYS 96 H LYS 96 2.623 -33.236 24.973 702 HA LYS 96 HA LYS 96 3.153 -31.708 23.374 703 HB2 LYS 96 HB2 LYS 96 2.463 -33.619 21.882 704 HB3 LYS 96 HB3 LYS 96 0.872 -32.878 21.777 705 HG2 LYS 96 HG2 LYS 96 2.321 -30.776 21.052 706 HG3 LYS 96 HG3 LYS 96 3.439 -32.050 20.556 707 HD2 LYS 96 HD2 LYS 96 1.367 -33.101 19.421 708 HD3 LYS 96 HD3 LYS 96 0.655 -31.495 19.592 709 HE2 LYS 96 HE2 LYS 96 2.475 -30.521 18.325 710 HE3 LYS 96 HE3 LYS 96 3.280 -32.086 18.227 711 HZ1 LYS 96 HZ1 LYS 96 0.572 -31.606 17.126 712 HZ2 LYS 96 HZ2 LYS 96 1.594 -32.921 16.832 713 HZ3 LYS 96 HZ3 LYS 96 1.980 -31.394 16.213 714 H MET 97 H MET 97 2.600 -29.864 24.492 715 HA MET 97 HA MET 97 0.120 -28.580 23.610 716 HB2 MET 97 HB2 MET 97 0.462 -29.595 26.198 717 HB3 MET 97 HB3 MET 97 0.712 -27.861 26.350 718 HG2 MET 97 HG2 MET 97 -1.442 -27.424 25.356 719 HG3 MET 97 HG3 MET 97 -1.688 -29.145 25.068 720 HE1 MET 97 HE1 MET 97 -4.290 -28.938 27.828 721 HE2 MET 97 HE2 MET 97 -4.059 -27.975 26.369 722 HE3 MET 97 HE3 MET 97 -3.799 -29.719 26.325 723 H ASP 98 H ASP 98 0.388 -26.506 23.035 724 HA ASP 98 HA ASP 98 2.551 -24.917 24.128 725 HB2 ASP 98 HB2 ASP 98 2.416 -25.397 21.145 726 HB3 ASP 98 HB3 ASP 98 3.600 -24.419 22.009 727 H GLU 99 H GLU 99 2.542 -22.681 22.965 728 HA GLU 99 HA GLU 99 0.206 -21.774 21.683 729 HB2 GLU 99 HB2 GLU 99 -0.937 -22.174 23.757 730 HB3 GLU 99 HB3 GLU 99 0.323 -21.359 24.671 731 HG2 GLU 99 HG2 GLU 99 -0.753 -19.597 22.679 732 HG3 GLU 99 HG3 GLU 99 -2.046 -20.267 23.672 733 H THR 100 H THR 100 1.528 -20.560 20.415 734 HA THR 100 HA THR 100 2.767 -18.231 21.697 735 HB THR 100 HB THR 100 4.507 -18.690 19.635 736 HG1 THR 100 HG1 THR 100 5.060 -20.884 19.735 737 HG21 THR 100 HG21 THR 100 4.525 -18.887 22.542 738 HG22 THR 100 HG22 THR 100 5.719 -18.186 21.450 739 HG23 THR 100 HG23 THR 100 5.736 -19.917 21.781 740 H ASP 101 H ASP 101 3.162 -16.446 20.216 741 HA ASP 101 HA ASP 101 1.039 -16.248 18.248 742 HB2 ASP 101 HB2 ASP 101 2.950 -14.267 19.468 743 HB3 ASP 101 HB3 ASP 101 1.942 -13.842 18.088 744 H ALA 102 H ALA 102 1.628 -14.969 16.188 745 HA ALA 102 HA ALA 102 4.183 -15.935 15.093 746 HB1 ALA 102 HB1 ALA 102 1.708 -16.981 14.418 747 HB2 ALA 102 HB2 ALA 102 2.084 -15.870 13.100 748 HB3 ALA 102 HB3 ALA 102 3.211 -17.163 13.512 749 H SER 103 H SER 103 4.108 -14.919 12.603 750 HA SER 103 HA SER 103 4.228 -12.052 13.119 751 HB2 SER 103 HB2 SER 103 6.076 -13.477 11.971 752 HB3 SER 103 HB3 SER 103 5.054 -13.359 10.540 753 HG SER 103 HG SER 103 5.329 -11.189 10.508 754 H SER 104 H SER 104 3.399 -10.520 11.541 755 HA SER 104 HA SER 104 0.867 -11.461 10.379 756 HB2 SER 104 HB2 SER 104 1.660 -8.621 11.061 757 HB3 SER 104 HB3 SER 104 0.060 -9.186 10.581 758 HG SER 104 HG SER 104 1.436 -9.571 13.001 759 H ALA 105 H ALA 105 0.143 -10.196 8.418 760 HA ALA 105 HA ALA 105 2.183 -9.055 6.745 761 HB1 ALA 105 HB1 ALA 105 1.039 -11.749 6.021 762 HB2 ALA 105 HB2 ALA 105 1.998 -10.731 4.946 763 HB3 ALA 105 HB3 ALA 105 2.720 -11.388 6.415 764 H VAL 106 H VAL 106 0.753 -7.309 6.652 765 HA VAL 106 HA VAL 106 -1.513 -7.716 4.833 766 HB VAL 106 HB VAL 106 -2.854 -6.077 6.149 767 HG11 VAL 106 HG11 VAL 106 -2.711 -8.745 6.421 768 HG12 VAL 106 HG12 VAL 106 -2.343 -8.254 8.076 769 HG13 VAL 106 HG13 VAL 106 -3.849 -7.737 7.316 770 HG21 VAL 106 HG21 VAL 106 -1.482 -6.515 8.657 771 HG22 VAL 106 HG22 VAL 106 -0.459 -5.663 7.501 772 HG23 VAL 106 HG23 VAL 106 -2.041 -5.009 7.928 773 H LYS 107 H LYS 107 -2.390 -5.475 4.136 774 HA LYS 107 HA LYS 107 -0.239 -4.078 2.905 775 HB2 LYS 107 HB2 LYS 107 -3.212 -3.626 3.032 776 HB3 LYS 107 HB3 LYS 107 -2.144 -2.478 2.235 777 HG2 LYS 107 HG2 LYS 107 -1.600 -3.953 0.545 778 HG3 LYS 107 HG3 LYS 107 -2.039 -5.371 1.500 779 HD2 LYS 107 HD2 LYS 107 -4.338 -4.999 1.192 780 HD3 LYS 107 HD3 LYS 107 -4.083 -3.340 0.648 781 HE2 LYS 107 HE2 LYS 107 -4.184 -4.123 -1.434 782 HE3 LYS 107 HE3 LYS 107 -2.619 -4.878 -1.136 783 HZ1 LYS 107 HZ1 LYS 107 -3.871 -6.832 -0.270 784 HZ2 LYS 107 HZ2 LYS 107 -4.084 -6.546 -1.924 785 HZ3 LYS 107 HZ3 LYS 107 -5.297 -6.113 -0.827 786 H VAL 108 H VAL 108 1.036 -3.311 4.637 787 HA VAL 108 HA VAL 108 0.053 -0.796 5.754 788 HB VAL 108 HB VAL 108 1.055 -1.362 7.979 789 HG11 VAL 108 HG11 VAL 108 -1.299 -1.378 7.851 790 HG12 VAL 108 HG12 VAL 108 -1.318 -2.896 6.951 791 HG13 VAL 108 HG13 VAL 108 -0.858 -2.884 8.654 792 HG21 VAL 108 HG21 VAL 108 1.024 -4.178 6.895 793 HG22 VAL 108 HG22 VAL 108 2.470 -3.222 7.223 794 HG23 VAL 108 HG23 VAL 108 1.410 -3.701 8.549 795 H LYS 109 H LYS 109 1.862 0.445 6.809 796 HA LYS 109 HA LYS 109 4.529 -0.238 5.865 797 HB2 LYS 109 HB2 LYS 109 3.261 1.125 4.083 798 HB3 LYS 109 HB3 LYS 109 3.414 2.477 5.197 799 HG2 LYS 109 HG2 LYS 109 5.554 2.808 4.672 800 HG3 LYS 109 HG3 LYS 109 5.931 1.085 4.736 801 HD2 LYS 109 HD2 LYS 109 4.266 1.766 2.455 802 HD3 LYS 109 HD3 LYS 109 5.791 2.656 2.460 803 HE2 LYS 109 HE2 LYS 109 5.772 -0.288 2.980 804 HE3 LYS 109 HE3 LYS 109 5.653 0.314 1.328 805 HZ1 LYS 109 HZ1 LYS 109 7.728 1.647 2.719 806 HZ2 LYS 109 HZ2 LYS 109 7.817 0.719 1.307 807 HZ3 LYS 109 HZ3 LYS 109 7.952 -0.027 2.819 808 H ARG 110 H ARG 110 4.820 -0.446 8.170 809 HA ARG 110 HA ARG 110 5.259 2.162 9.460 810 HB2 ARG 110 HB2 ARG 110 4.215 -0.340 10.800 811 HB3 ARG 110 HB3 ARG 110 4.608 1.168 11.615 812 HG2 ARG 110 HG2 ARG 110 2.816 2.308 10.568 813 HG3 ARG 110 HG3 ARG 110 2.537 0.974 9.447 814 HD2 ARG 110 HD2 ARG 110 1.165 -0.013 10.889 815 HD3 ARG 110 HD3 ARG 110 2.400 0.021 12.146 816 HE ARG 110 HE ARG 110 1.378 1.861 13.062 817 HH11 ARG 110 HH11 ARG 110 0.096 1.285 9.877 818 HH12 ARG 110 HH12 ARG 110 -1.181 2.444 10.040 819 HH21 ARG 110 HH21 ARG 110 -0.299 3.390 13.288 820 HH22 ARG 110 HH22 ARG 110 -1.405 3.642 11.980 821 H ALA 111 H ALA 111 7.449 2.164 9.012 822 HA ALA 111 HA ALA 111 9.016 0.117 10.439 823 HB1 ALA 111 HB1 ALA 111 10.737 0.925 8.500 824 HB2 ALA 111 HB2 ALA 111 9.720 -0.513 8.402 825 HB3 ALA 111 HB3 ALA 111 9.196 0.990 7.644 826 H VAL 112 H VAL 112 9.894 1.073 12.152 827 HA VAL 112 HA VAL 112 10.664 3.892 12.008 828 HB VAL 112 HB VAL 112 10.991 3.692 14.470 829 HG11 VAL 112 HG11 VAL 112 8.726 4.115 13.114 830 HG12 VAL 112 HG12 VAL 112 8.246 2.685 14.029 831 HG13 VAL 112 HG13 VAL 112 8.805 4.128 14.876 832 HG21 VAL 112 HG21 VAL 112 9.695 0.989 14.211 833 HG22 VAL 112 HG22 VAL 112 11.437 1.208 14.377 834 HG23 VAL 112 HG23 VAL 112 10.354 1.744 15.662 835 H GLN 113 H GLN 113 12.261 2.076 10.554 836 HA GLN 113 HA GLN 113 14.527 1.151 11.905 837 HB2 GLN 113 HB2 GLN 113 13.641 1.299 9.233 838 HB3 GLN 113 HB3 GLN 113 15.219 2.074 9.269 839 HG2 GLN 113 HG2 GLN 113 15.607 -0.192 8.780 840 HG3 GLN 113 HG3 GLN 113 16.071 0.033 10.466 841 HE21 GLN 113 HE21 GLN 113 13.751 -1.364 8.288 842 HE22 GLN 113 HE22 GLN 113 12.995 -2.407 9.439 843 H LYS 114 H LYS 114 16.665 2.006 12.013 844 HA LYS 114 HA LYS 114 16.818 4.637 12.955 845 HB2 LYS 114 HB2 LYS 114 18.442 3.031 13.674 846 HB3 LYS 114 HB3 LYS 114 18.962 2.728 12.021 847 HG2 LYS 114 HG2 LYS 114 20.168 4.681 11.896 848 HG3 LYS 114 HG3 LYS 114 19.219 5.473 13.157 849 HD2 LYS 114 HD2 LYS 114 21.368 4.991 14.074 850 HD3 LYS 114 HD3 LYS 114 20.221 3.860 14.795 851 HE2 LYS 114 HE2 LYS 114 21.081 2.059 13.670 852 HE3 LYS 114 HE3 LYS 114 21.657 3.039 12.322 853 HZ1 LYS 114 HZ1 LYS 114 23.207 2.044 14.295 854 HZ2 LYS 114 HZ2 LYS 114 22.953 3.631 14.822 855 HZ3 LYS 114 HZ3 LYS 114 23.626 3.343 13.296 Start of MODEL 13 1 H1 MET 1 H MET 1 -1.399 -10.284 -7.575 2 HA MET 1 HA MET 1 0.100 -8.716 -8.614 3 HB2 MET 1 HB2 MET 1 -0.487 -7.061 -6.153 4 HB3 MET 1 HB3 MET 1 0.668 -6.629 -7.407 5 HG2 MET 1 HG2 MET 1 -1.090 -6.441 -9.034 6 HG3 MET 1 HG3 MET 1 -2.276 -7.033 -7.873 7 HE1 MET 1 HE1 MET 1 -3.956 -4.682 -8.085 8 HE2 MET 1 HE2 MET 1 -3.703 -5.777 -6.725 9 HE3 MET 1 HE3 MET 1 -3.708 -4.032 -6.464 10 H ALA 2 H ALA 2 0.696 -11.034 -7.481 11 HA ALA 2 HA ALA 2 3.265 -10.519 -6.266 12 HB1 ALA 2 HB1 ALA 2 1.497 -12.383 -4.735 13 HB2 ALA 2 HB2 ALA 2 2.961 -11.547 -4.216 14 HB3 ALA 2 HB3 ALA 2 1.455 -10.650 -4.413 15 H GLY 3 H GLY 3 3.818 -11.463 -8.343 16 HA2 GLY 3 HA2 GLY 3 4.581 -14.137 -8.186 17 HA3 GLY 3 HA3 GLY 3 3.065 -14.092 -9.074 18 H SER 4 H SER 4 6.002 -12.068 -9.030 19 HA SER 4 HA SER 4 6.163 -12.439 -11.949 20 HB2 SER 4 HB2 SER 4 6.411 -10.207 -12.307 21 HB3 SER 4 HB3 SER 4 5.569 -10.073 -10.764 22 HG SER 4 HG SER 4 7.308 -9.235 -9.959 23 H HIS 5 H HIS 5 8.071 -13.080 -12.756 24 HA HIS 5 HA HIS 5 10.225 -13.806 -12.861 25 HB2 HIS 5 HB2 HIS 5 10.334 -11.394 -11.189 26 HB3 HIS 5 HB3 HIS 5 11.683 -12.499 -10.941 27 HD1 HIS 5 HD1 HIS 5 13.574 -11.552 -12.224 28 HD2 HIS 5 HD2 HIS 5 10.019 -11.400 -14.368 29 HE1 HIS 5 HE1 HIS 5 14.196 -10.668 -14.494 30 H HIS 6 H HIS 6 12.087 -14.700 -11.391 31 HA HIS 6 HA HIS 6 12.738 -16.339 -9.954 32 HB2 HIS 6 HB2 HIS 6 10.587 -15.106 -8.221 33 HB3 HIS 6 HB3 HIS 6 11.785 -16.269 -7.659 34 HD1 HIS 6 HD1 HIS 6 11.264 -12.998 -7.093 35 HD2 HIS 6 HD2 HIS 6 14.487 -14.935 -8.860 36 HE1 HIS 6 HE1 HIS 6 13.212 -11.426 -6.844 37 H HIS 7 H HIS 7 11.722 -17.734 -11.662 38 HA HIS 7 HA HIS 7 10.557 -19.600 -12.241 39 HB2 HIS 7 HB2 HIS 7 10.869 -19.734 -9.356 40 HB3 HIS 7 HB3 HIS 7 9.401 -20.550 -9.886 41 HD1 HIS 7 HD1 HIS 7 9.744 -22.524 -11.639 42 HD2 HIS 7 HD2 HIS 7 13.202 -21.096 -9.834 43 HE1 HIS 7 HE1 HIS 7 11.496 -24.277 -12.063 44 H HIS 8 H HIS 8 8.255 -20.725 -11.756 45 HA HIS 8 HA HIS 8 6.287 -18.533 -11.835 46 HB2 HIS 8 HB2 HIS 8 6.765 -20.791 -13.614 47 HB3 HIS 8 HB3 HIS 8 5.094 -20.722 -13.061 48 HD1 HIS 8 HD1 HIS 8 4.586 -17.726 -13.066 49 HD2 HIS 8 HD2 HIS 8 6.634 -19.703 -16.093 50 HE1 HIS 8 HE1 HIS 8 4.377 -16.253 -15.093 51 H HIS 9 H HIS 9 4.098 -19.099 -11.111 52 HA HIS 9 HA HIS 9 4.228 -20.665 -8.669 53 HB2 HIS 9 HB2 HIS 9 3.143 -18.348 -8.895 54 HB3 HIS 9 HB3 HIS 9 1.814 -19.183 -9.694 55 HD1 HIS 9 HD1 HIS 9 3.194 -18.399 -6.384 56 HD2 HIS 9 HD2 HIS 9 0.418 -21.044 -7.985 57 HE1 HIS 9 HE1 HIS 9 1.867 -19.250 -4.424 58 H HIS 10 H HIS 10 2.442 -20.647 -11.723 59 HA HIS 10 HA HIS 10 0.810 -22.889 -11.091 60 HB2 HIS 10 HB2 HIS 10 1.355 -21.231 -13.479 61 HB3 HIS 10 HB3 HIS 10 0.807 -22.874 -13.799 62 HD1 HIS 10 HD1 HIS 10 -1.541 -23.522 -12.620 63 HD2 HIS 10 HD2 HIS 10 -0.630 -19.475 -12.851 64 HE1 HIS 10 HE1 HIS 10 -3.719 -22.320 -12.248 65 H GLY 11 H GLY 11 1.323 -24.976 -11.063 66 HA2 GLY 11 HA2 GLY 11 3.937 -25.795 -12.077 67 HA3 GLY 11 HA3 GLY 11 2.892 -26.732 -11.020 68 H SER 12 H SER 12 4.274 -27.069 -13.793 69 HA SER 12 HA SER 12 1.935 -27.854 -15.365 70 HB2 SER 12 HB2 SER 12 4.859 -27.851 -16.152 71 HB3 SER 12 HB3 SER 12 3.487 -28.111 -17.229 72 HG SER 12 HG SER 12 4.134 -25.971 -17.378 73 H MET 13 H MET 13 5.113 -29.288 -14.595 74 HA MET 13 HA MET 13 3.983 -31.950 -14.935 75 HB2 MET 13 HB2 MET 13 6.792 -30.941 -14.508 76 HB3 MET 13 HB3 MET 13 6.392 -32.653 -14.502 77 HG2 MET 13 HG2 MET 13 5.921 -32.694 -16.750 78 HG3 MET 13 HG3 MET 13 5.565 -30.969 -16.814 79 HE1 MET 13 HE1 MET 13 8.171 -29.212 -17.883 80 HE2 MET 13 HE2 MET 13 7.920 -30.419 -19.144 81 HE3 MET 13 HE3 MET 13 6.554 -29.851 -18.182 82 H SER 14 H SER 14 2.600 -31.908 -13.080 83 HA SER 14 HA SER 14 4.060 -32.314 -10.551 84 HB2 SER 14 HB2 SER 14 2.030 -31.459 -9.383 85 HB3 SER 14 HB3 SER 14 2.801 -30.244 -10.403 86 HG SER 14 HG SER 14 0.301 -31.249 -10.539 87 H GLU 15 H GLU 15 3.699 -34.175 -9.502 88 HA GLU 15 HA GLU 15 1.588 -35.938 -10.555 89 HB2 GLU 15 HB2 GLU 15 4.354 -36.380 -10.248 90 HB3 GLU 15 HB3 GLU 15 3.568 -37.338 -9.001 91 HG2 GLU 15 HG2 GLU 15 3.815 -38.712 -10.916 92 HG3 GLU 15 HG3 GLU 15 2.105 -38.309 -10.769 93 H TYR 16 H TYR 16 1.481 -37.845 -8.632 94 HA TYR 16 HA TYR 16 0.829 -36.410 -6.150 95 HB2 TYR 16 HB2 TYR 16 -1.161 -38.073 -6.023 96 HB3 TYR 16 HB3 TYR 16 -1.307 -36.652 -7.051 97 HD1 TYR 16 HD1 TYR 16 -1.717 -36.870 -9.358 98 HD2 TYR 16 HD2 TYR 16 -0.562 -40.286 -7.100 99 HE1 TYR 16 HE1 TYR 16 -2.233 -38.311 -11.284 100 HE2 TYR 16 HE2 TYR 16 -1.074 -41.736 -9.020 101 HH TYR 16 HH TYR 16 -2.787 -40.624 -11.756 102 H ILE 17 H ILE 17 0.113 -38.257 -4.467 103 HA ILE 17 HA ILE 17 2.179 -40.355 -4.594 104 HB ILE 17 HB ILE 17 2.991 -38.885 -2.956 105 HG12 ILE 17 HG12 ILE 17 1.340 -40.921 -1.445 106 HG13 ILE 17 HG13 ILE 17 2.878 -41.259 -2.232 107 HG21 ILE 17 HG21 ILE 17 1.153 -38.417 -1.001 108 HG22 ILE 17 HG22 ILE 17 1.536 -37.305 -2.314 109 HG23 ILE 17 HG23 ILE 17 0.150 -38.387 -2.452 110 HD11 ILE 17 HD11 ILE 17 2.329 -39.616 0.202 111 HD12 ILE 17 HD12 ILE 17 3.453 -40.959 -0.012 112 HD13 ILE 17 HD13 ILE 17 3.807 -39.390 -0.734 113 H ARG 18 H ARG 18 1.471 -42.374 -4.356 114 HA ARG 18 HA ARG 18 -1.216 -42.781 -3.215 115 HB2 ARG 18 HB2 ARG 18 0.019 -43.762 -5.704 116 HB3 ARG 18 HB3 ARG 18 -0.830 -44.987 -4.770 117 HG2 ARG 18 HG2 ARG 18 -2.672 -43.041 -4.723 118 HG3 ARG 18 HG3 ARG 18 -1.878 -42.666 -6.254 119 HD2 ARG 18 HD2 ARG 18 -2.449 -45.512 -5.845 120 HD3 ARG 18 HD3 ARG 18 -3.881 -44.487 -5.930 121 HE ARG 18 HE ARG 18 -2.083 -43.884 -8.036 122 HH11 ARG 18 HH11 ARG 18 -4.415 -46.250 -6.996 123 HH12 ARG 18 HH12 ARG 18 -4.816 -46.754 -8.604 124 HH21 ARG 18 HH21 ARG 18 -2.602 -44.539 -10.159 125 HH22 ARG 18 HH22 ARG 18 -3.783 -45.780 -10.403 126 H VAL 19 H VAL 19 -0.881 -43.524 -1.209 127 HA VAL 19 HA VAL 19 0.581 -46.021 -0.898 128 HB VAL 19 HB VAL 19 1.702 -45.114 1.193 129 HG11 VAL 19 HG11 VAL 19 3.632 -44.703 0.034 130 HG12 VAL 19 HG12 VAL 19 2.665 -45.457 -1.236 131 HG13 VAL 19 HG13 VAL 19 2.825 -43.701 -1.172 132 HG21 VAL 19 HG21 VAL 19 0.383 -43.057 1.377 133 HG22 VAL 19 HG22 VAL 19 2.111 -42.713 1.288 134 HG23 VAL 19 HG23 VAL 19 1.089 -42.472 -0.129 135 H THR 20 H THR 20 -0.004 -47.202 0.962 136 HA THR 20 HA THR 20 -2.400 -46.186 2.348 137 HB THR 20 HB THR 20 -3.256 -47.914 1.035 138 HG1 THR 20 HG1 THR 20 -3.816 -49.465 2.544 139 HG21 THR 20 HG21 THR 20 -0.560 -49.025 1.302 140 HG22 THR 20 HG22 THR 20 -1.715 -49.161 -0.024 141 HG23 THR 20 HG23 THR 20 -1.840 -50.236 1.369 142 H GLU 21 H GLU 21 -2.618 -46.628 4.538 143 HA GLU 21 HA GLU 21 -0.173 -46.925 5.984 144 HB2 GLU 21 HB2 GLU 21 -2.254 -45.545 6.624 145 HB3 GLU 21 HB3 GLU 21 -2.917 -47.065 7.207 146 HG2 GLU 21 HG2 GLU 21 -0.287 -46.768 8.245 147 HG3 GLU 21 HG3 GLU 21 -1.182 -45.278 8.534 148 H ASP 22 H ASP 22 -3.113 -48.909 5.707 149 HA ASP 22 HA ASP 22 -1.681 -51.139 6.963 150 HB2 ASP 22 HB2 ASP 22 -4.406 -50.216 7.033 151 HB3 ASP 22 HB3 ASP 22 -4.355 -51.878 6.452 152 H GLU 23 H GLU 23 -1.478 -53.137 5.968 153 HA GLU 23 HA GLU 23 -1.149 -53.125 3.170 154 HB2 GLU 23 HB2 GLU 23 -0.696 -55.520 3.395 155 HB3 GLU 23 HB3 GLU 23 0.142 -54.597 4.635 156 HG2 GLU 23 HG2 GLU 23 -2.198 -55.218 5.886 157 HG3 GLU 23 HG3 GLU 23 -1.927 -56.643 4.885 158 H ASN 24 H ASN 24 -3.768 -54.188 5.250 159 HA ASN 24 HA ASN 24 -5.227 -55.523 3.184 160 HB2 ASN 24 HB2 ASN 24 -5.455 -56.007 5.639 161 HB3 ASN 24 HB3 ASN 24 -6.289 -54.464 5.810 162 HD21 ASN 24 HD21 ASN 24 -8.395 -54.657 5.881 163 HD22 ASN 24 HD22 ASN 24 -9.344 -55.840 5.054 164 H ASP 25 H ASP 25 -5.018 -52.262 4.358 165 HA ASP 25 HA ASP 25 -7.463 -51.350 3.178 166 HB2 ASP 25 HB2 ASP 25 -5.141 -50.092 4.549 167 HB3 ASP 25 HB3 ASP 25 -6.115 -49.065 3.502 168 H GLU 26 H GLU 26 -7.606 -49.806 1.421 169 HA GLU 26 HA GLU 26 -5.946 -50.603 -0.803 170 HB2 GLU 26 HB2 GLU 26 -8.428 -48.973 -0.469 171 HB3 GLU 26 HB3 GLU 26 -7.482 -48.778 -1.938 172 HG2 GLU 26 HG2 GLU 26 -7.661 -51.211 -2.329 173 HG3 GLU 26 HG3 GLU 26 -8.704 -51.329 -0.913 174 HA PRO 27 HA PRO 27 -3.106 -47.256 -0.814 175 HB2 PRO 27 HB2 PRO 27 -2.701 -46.927 -3.478 176 HB3 PRO 27 HB3 PRO 27 -2.065 -48.306 -2.573 177 HG2 PRO 27 HG2 PRO 27 -4.509 -48.133 -4.293 178 HG3 PRO 27 HG3 PRO 27 -3.294 -49.421 -4.201 179 HD2 PRO 27 HD2 PRO 27 -5.697 -49.593 -2.964 180 HD3 PRO 27 HD3 PRO 27 -4.227 -50.338 -2.303 181 H ILE 28 H ILE 28 -4.133 -45.445 -0.043 182 HA ILE 28 HA ILE 28 -6.101 -44.014 -1.543 183 HB ILE 28 HB ILE 28 -6.173 -43.888 0.860 184 HG12 ILE 28 HG12 ILE 28 -6.255 -41.452 1.173 185 HG13 ILE 28 HG13 ILE 28 -5.312 -41.227 -0.297 186 HG21 ILE 28 HG21 ILE 28 -4.381 -42.691 2.116 187 HG22 ILE 28 HG22 ILE 28 -3.875 -44.231 1.423 188 HG23 ILE 28 HG23 ILE 28 -3.405 -42.719 0.648 189 HD11 ILE 28 HD11 ILE 28 -8.049 -41.217 -0.104 190 HD12 ILE 28 HD12 ILE 28 -7.111 -41.397 -1.587 191 HD13 ILE 28 HD13 ILE 28 -7.694 -42.825 -0.732 192 H GLU 29 H GLU 29 -5.873 -42.339 -2.907 193 HA GLU 29 HA GLU 29 -3.141 -41.498 -3.554 194 HB2 GLU 29 HB2 GLU 29 -4.092 -40.666 -5.657 195 HB3 GLU 29 HB3 GLU 29 -4.463 -42.367 -5.411 196 HG2 GLU 29 HG2 GLU 29 -6.537 -41.762 -5.974 197 HG3 GLU 29 HG3 GLU 29 -6.641 -41.210 -4.303 198 H ILE 30 H ILE 30 -2.419 -39.562 -2.978 199 HA ILE 30 HA ILE 30 -4.376 -37.437 -2.402 200 HB ILE 30 HB ILE 30 -2.376 -36.729 -0.751 201 HG12 ILE 30 HG12 ILE 30 -2.476 -39.663 -0.209 202 HG13 ILE 30 HG13 ILE 30 -1.376 -39.082 -1.454 203 HG21 ILE 30 HG21 ILE 30 -3.909 -37.025 0.878 204 HG22 ILE 30 HG22 ILE 30 -4.966 -37.397 -0.483 205 HG23 ILE 30 HG23 ILE 30 -4.216 -38.704 0.434 206 HD11 ILE 30 HD11 ILE 30 -0.278 -39.313 0.711 207 HD12 ILE 30 HD12 ILE 30 -0.287 -37.637 0.161 208 HD13 ILE 30 HD13 ILE 30 -1.416 -38.162 1.411 209 HA PRO 31 HA PRO 31 -2.018 -34.796 -4.997 210 HB2 PRO 31 HB2 PRO 31 -2.313 -32.403 -3.751 211 HB3 PRO 31 HB3 PRO 31 -3.624 -33.193 -4.635 212 HG2 PRO 31 HG2 PRO 31 -3.090 -33.137 -1.690 213 HG3 PRO 31 HG3 PRO 31 -4.629 -32.951 -2.552 214 HD2 PRO 31 HD2 PRO 31 -3.886 -35.277 -1.381 215 HD3 PRO 31 HD3 PRO 31 -4.879 -35.223 -2.852 216 H SER 32 H SER 32 0.022 -33.985 -5.247 217 HA SER 32 HA SER 32 1.661 -33.655 -2.825 218 HB2 SER 32 HB2 SER 32 3.351 -35.022 -3.602 219 HB3 SER 32 HB3 SER 32 1.948 -35.854 -4.272 220 HG SER 32 HG SER 32 3.001 -35.602 -6.081 221 H GLU 33 H GLU 33 3.472 -32.240 -3.041 222 HA GLU 33 HA GLU 33 2.950 -29.872 -4.407 223 HB2 GLU 33 HB2 GLU 33 4.595 -30.427 -2.437 224 HB3 GLU 33 HB3 GLU 33 5.764 -30.638 -3.733 225 HG2 GLU 33 HG2 GLU 33 5.877 -28.434 -4.178 226 HG3 GLU 33 HG3 GLU 33 4.169 -28.165 -3.833 227 H ASP 34 H ASP 34 4.255 -28.835 -6.096 228 HA ASP 34 HA ASP 34 4.356 -30.412 -8.436 229 HB2 ASP 34 HB2 ASP 34 5.401 -28.390 -9.469 230 HB3 ASP 34 HB3 ASP 34 3.905 -28.049 -8.602 231 H ASP 35 H ASP 35 6.806 -29.380 -6.143 232 HA ASP 35 HA ASP 35 9.082 -30.063 -7.645 233 HB2 ASP 35 HB2 ASP 35 8.638 -28.927 -5.187 234 HB3 ASP 35 HB3 ASP 35 9.313 -30.494 -4.750 235 H GLY 36 H GLY 36 6.730 -32.003 -6.085 236 HA2 GLY 36 HA2 GLY 36 6.731 -34.361 -6.823 237 HA3 GLY 36 HA3 GLY 36 8.453 -34.374 -6.470 238 H THR 37 H THR 37 8.091 -32.805 -4.004 239 HA THR 37 HA THR 37 7.741 -34.980 -2.211 240 HB THR 37 HB THR 37 8.129 -33.403 -0.430 241 HG1 THR 37 HG1 THR 37 7.577 -31.451 -2.425 242 HG21 THR 37 HG21 THR 37 9.899 -32.148 -2.420 243 HG22 THR 37 HG22 THR 37 9.907 -33.912 -2.418 244 HG23 THR 37 HG23 THR 37 10.295 -33.027 -0.943 245 H VAL 38 H VAL 38 6.362 -34.103 -0.067 246 HA VAL 38 HA VAL 38 3.665 -33.430 -1.003 247 HB VAL 38 HB VAL 38 4.378 -35.822 0.690 248 HG11 VAL 38 HG11 VAL 38 1.686 -35.954 0.419 249 HG12 VAL 38 HG12 VAL 38 2.512 -35.310 1.839 250 HG13 VAL 38 HG13 VAL 38 1.920 -34.215 0.590 251 HG21 VAL 38 HG21 VAL 38 4.404 -35.917 -1.864 252 HG22 VAL 38 HG22 VAL 38 3.444 -37.131 -1.017 253 HG23 VAL 38 HG23 VAL 38 2.651 -35.745 -1.765 254 H LEU 39 H LEU 39 2.614 -32.044 0.293 255 HA LEU 39 HA LEU 39 3.972 -30.843 2.481 256 HB2 LEU 39 HB2 LEU 39 1.557 -30.391 0.945 257 HB3 LEU 39 HB3 LEU 39 1.306 -30.082 2.662 258 HG LEU 39 HG LEU 39 1.876 -28.028 1.536 259 HD11 LEU 39 HD11 LEU 39 2.757 -28.513 3.837 260 HD12 LEU 39 HD12 LEU 39 3.648 -27.290 2.930 261 HD13 LEU 39 HD13 LEU 39 4.298 -28.923 3.081 262 HD21 LEU 39 HD21 LEU 39 4.219 -29.609 0.525 263 HD22 LEU 39 HD22 LEU 39 4.239 -27.846 0.582 264 HD23 LEU 39 HD23 LEU 39 3.031 -28.684 -0.393 265 H LEU 40 H LEU 40 3.821 -31.188 4.620 266 HA LEU 40 HA LEU 40 2.948 -33.561 5.697 267 HB2 LEU 40 HB2 LEU 40 4.416 -31.733 6.723 268 HB3 LEU 40 HB3 LEU 40 2.907 -30.997 7.258 269 HG LEU 40 HG LEU 40 4.076 -32.347 8.996 270 HD11 LEU 40 HD11 LEU 40 2.107 -32.833 9.956 271 HD12 LEU 40 HD12 LEU 40 1.569 -33.822 8.598 272 HD13 LEU 40 HD13 LEU 40 1.424 -32.066 8.522 273 HD21 LEU 40 HD21 LEU 40 4.352 -34.195 6.943 274 HD22 LEU 40 HD22 LEU 40 3.145 -34.906 8.015 275 HD23 LEU 40 HD23 LEU 40 4.727 -34.446 8.648 276 H SER 41 H SER 41 1.163 -30.546 5.317 277 HA SER 41 HA SER 41 -1.069 -31.057 6.856 278 HB2 SER 41 HB2 SER 41 -0.849 -29.623 4.202 279 HB3 SER 41 HB3 SER 41 -2.302 -29.607 5.201 280 HG SER 41 HG SER 41 -0.523 -27.878 5.407 281 H THR 42 H THR 42 -0.232 -32.309 3.689 282 HA THR 42 HA THR 42 -2.785 -33.477 3.159 283 HB THR 42 HB THR 42 -0.094 -34.126 1.938 284 HG1 THR 42 HG1 THR 42 -2.054 -32.174 1.422 285 HG21 THR 42 HG21 THR 42 -2.903 -34.935 1.266 286 HG22 THR 42 HG22 THR 42 -1.452 -35.932 1.369 287 HG23 THR 42 HG23 THR 42 -1.671 -34.831 0.010 288 H VAL 43 H VAL 43 0.333 -34.766 4.281 289 HA VAL 43 HA VAL 43 -0.306 -37.448 4.446 290 HB VAL 43 HB VAL 43 1.565 -35.713 6.008 291 HG11 VAL 43 HG11 VAL 43 2.373 -38.033 6.942 292 HG12 VAL 43 HG12 VAL 43 1.114 -37.113 7.768 293 HG13 VAL 43 HG13 VAL 43 0.677 -38.465 6.723 294 HG21 VAL 43 HG21 VAL 43 1.956 -38.108 4.214 295 HG22 VAL 43 HG22 VAL 43 2.186 -36.420 3.757 296 HG23 VAL 43 HG23 VAL 43 3.243 -37.159 4.960 297 H THR 44 H THR 44 -1.085 -34.839 6.670 298 HA THR 44 HA THR 44 -2.097 -36.539 8.734 299 HB THR 44 HB THR 44 -2.950 -34.508 9.769 300 HG1 THR 44 HG1 THR 44 -3.505 -32.896 8.528 301 HG21 THR 44 HG21 THR 44 -0.559 -33.188 9.055 302 HG22 THR 44 HG22 THR 44 -0.228 -34.919 8.985 303 HG23 THR 44 HG23 THR 44 -0.858 -34.201 10.467 304 H ALA 45 H ALA 45 -3.402 -35.123 5.851 305 HA ALA 45 HA ALA 45 -6.095 -34.972 6.332 306 HB1 ALA 45 HB1 ALA 45 -6.410 -34.993 4.055 307 HB2 ALA 45 HB2 ALA 45 -4.699 -34.579 4.159 308 HB3 ALA 45 HB3 ALA 45 -5.185 -36.232 3.786 309 H GLN 46 H GLN 46 -4.273 -37.879 5.387 310 HA GLN 46 HA GLN 46 -6.614 -39.501 6.122 311 HB2 GLN 46 HB2 GLN 46 -4.315 -40.721 4.689 312 HB3 GLN 46 HB3 GLN 46 -6.037 -41.038 4.528 313 HG2 GLN 46 HG2 GLN 46 -5.842 -39.954 2.590 314 HG3 GLN 46 HG3 GLN 46 -5.877 -38.499 3.586 315 HE21 GLN 46 HE21 GLN 46 -3.613 -40.914 2.321 316 HE22 GLN 46 HE22 GLN 46 -2.324 -39.803 2.023 317 H PHE 47 H PHE 47 -3.190 -39.011 6.685 318 HA PHE 47 HA PHE 47 -3.283 -41.046 8.811 319 HB2 PHE 47 HB2 PHE 47 -0.684 -39.971 7.821 320 HB3 PHE 47 HB3 PHE 47 -1.078 -41.579 8.420 321 HD1 PHE 47 HD1 PHE 47 -3.110 -42.620 6.804 322 HD2 PHE 47 HD2 PHE 47 0.055 -40.014 5.660 323 HE1 PHE 47 HE1 PHE 47 -3.274 -43.441 4.490 324 HE2 PHE 47 HE2 PHE 47 -0.105 -40.830 3.344 325 HZ PHE 47 HZ PHE 47 -1.772 -42.545 2.756 326 HA PRO 48 HA PRO 48 -3.058 -36.938 10.937 327 HB2 PRO 48 HB2 PRO 48 -4.807 -37.608 12.902 328 HB3 PRO 48 HB3 PRO 48 -5.320 -36.964 11.337 329 HG2 PRO 48 HG2 PRO 48 -5.252 -39.802 12.287 330 HG3 PRO 48 HG3 PRO 48 -6.511 -38.961 11.364 331 HD2 PRO 48 HD2 PRO 48 -4.711 -40.616 10.200 332 HD3 PRO 48 HD3 PRO 48 -5.382 -39.199 9.368 333 H GLY 49 H GLY 49 -1.415 -36.629 12.299 334 HA2 GLY 49 HA2 GLY 49 -0.267 -36.898 14.339 335 HA3 GLY 49 HA3 GLY 49 -1.015 -38.477 14.526 336 H ALA 50 H ALA 50 -0.294 -39.236 11.751 337 HA ALA 50 HA ALA 50 2.007 -40.673 12.212 338 HB1 ALA 50 HB1 ALA 50 2.191 -40.879 9.748 339 HB2 ALA 50 HB2 ALA 50 0.566 -41.189 10.358 340 HB3 ALA 50 HB3 ALA 50 0.938 -39.648 9.586 341 H CYS 51 H CYS 51 4.088 -40.179 12.410 342 HA CYS 51 HA CYS 51 4.965 -37.474 11.755 343 HB2 CYS 51 HB2 CYS 51 5.410 -38.670 14.000 344 HB3 CYS 51 HB3 CYS 51 6.637 -39.571 13.119 345 HG CYS 51 HG CYS 51 7.020 -36.358 12.536 346 H GLY 52 H GLY 52 6.086 -40.822 11.248 347 HA2 GLY 52 HA2 GLY 52 7.359 -39.887 8.752 348 HA3 GLY 52 HA3 GLY 52 8.177 -40.999 9.840 349 H LEU 53 H LEU 53 7.407 -41.323 7.018 350 HA LEU 53 HA LEU 53 5.599 -43.633 7.294 351 HB2 LEU 53 HB2 LEU 53 6.160 -42.141 4.746 352 HB3 LEU 53 HB3 LEU 53 4.876 -43.306 5.062 353 HG LEU 53 HG LEU 53 3.728 -41.308 5.060 354 HD11 LEU 53 HD11 LEU 53 2.800 -41.271 7.108 355 HD12 LEU 53 HD12 LEU 53 4.345 -41.025 7.922 356 HD13 LEU 53 HD13 LEU 53 3.871 -42.642 7.401 357 HD21 LEU 53 HD21 LEU 53 4.534 -39.219 5.668 358 HD22 LEU 53 HD22 LEU 53 5.964 -40.015 5.010 359 HD23 LEU 53 HD23 LEU 53 5.748 -39.892 6.757 360 H ARG 54 H ARG 54 6.171 -45.580 6.369 361 HA ARG 54 HA ARG 54 8.990 -45.794 5.564 362 HB2 ARG 54 HB2 ARG 54 7.654 -47.160 7.514 363 HB3 ARG 54 HB3 ARG 54 7.513 -48.270 6.157 364 HG2 ARG 54 HG2 ARG 54 10.088 -47.820 5.930 365 HG3 ARG 54 HG3 ARG 54 9.934 -47.370 7.630 366 HD2 ARG 54 HD2 ARG 54 8.736 -49.929 6.667 367 HD3 ARG 54 HD3 ARG 54 10.473 -49.839 6.951 368 HE ARG 54 HE ARG 54 9.343 -48.821 9.223 369 HH11 ARG 54 HH11 ARG 54 9.084 -51.808 7.452 370 HH12 ARG 54 HH12 ARG 54 8.735 -52.761 8.856 371 HH21 ARG 54 HH21 ARG 54 8.884 -50.066 11.078 372 HH22 ARG 54 HH22 ARG 54 8.621 -51.769 10.918 373 H TYR 55 H TYR 55 9.500 -47.462 3.931 374 HA TYR 55 HA TYR 55 7.481 -47.426 1.799 375 HB2 TYR 55 HB2 TYR 55 10.310 -46.970 1.842 376 HB3 TYR 55 HB3 TYR 55 9.971 -48.354 0.809 377 HD1 TYR 55 HD1 TYR 55 7.794 -47.918 -0.763 378 HD2 TYR 55 HD2 TYR 55 10.398 -44.930 0.786 379 HE1 TYR 55 HE1 TYR 55 7.127 -46.402 -2.581 380 HE2 TYR 55 HE2 TYR 55 9.737 -43.406 -1.028 381 HH TYR 55 HH TYR 55 7.064 -43.955 -3.009 382 H ARG 56 H ARG 56 6.527 -49.245 1.160 383 HA ARG 56 HA ARG 56 7.776 -51.815 1.863 384 HB2 ARG 56 HB2 ARG 56 6.056 -51.683 3.442 385 HB3 ARG 56 HB3 ARG 56 4.954 -50.901 2.316 386 HG2 ARG 56 HG2 ARG 56 4.349 -53.239 2.844 387 HG3 ARG 56 HG3 ARG 56 4.617 -52.950 1.124 388 HD2 ARG 56 HD2 ARG 56 6.898 -53.855 1.357 389 HD3 ARG 56 HD3 ARG 56 6.570 -54.197 3.056 390 HE ARG 56 HE ARG 56 4.645 -55.404 1.333 391 HH11 ARG 56 HH11 ARG 56 7.870 -55.740 2.602 392 HH12 ARG 56 HH12 ARG 56 7.899 -57.464 2.430 393 HH21 ARG 56 HH21 ARG 56 4.671 -57.673 1.101 394 HH22 ARG 56 HH22 ARG 56 6.079 -58.562 1.575 395 H ASN 57 H ASN 57 8.491 -52.360 -0.144 396 HA ASN 57 HA ASN 57 6.498 -52.428 -2.312 397 HB2 ASN 57 HB2 ASN 57 9.478 -52.055 -2.319 398 HB3 ASN 57 HB3 ASN 57 8.658 -52.673 -3.750 399 HD21 ASN 57 HD21 ASN 57 7.423 -51.321 -4.975 400 HD22 ASN 57 HD22 ASN 57 7.342 -49.614 -4.721 401 HA PRO 58 HA PRO 58 6.724 -56.848 -1.685 402 HB2 PRO 58 HB2 PRO 58 4.854 -57.464 -3.554 403 HB3 PRO 58 HB3 PRO 58 4.441 -56.854 -1.947 404 HG2 PRO 58 HG2 PRO 58 4.605 -55.381 -4.548 405 HG3 PRO 58 HG3 PRO 58 3.382 -55.262 -3.270 406 HD2 PRO 58 HD2 PRO 58 5.379 -53.455 -3.548 407 HD3 PRO 58 HD3 PRO 58 4.695 -53.886 -1.968 408 H VAL 59 H VAL 59 6.863 -55.236 -4.829 409 HA VAL 59 HA VAL 59 8.115 -57.531 -6.086 410 HB VAL 59 HB VAL 59 8.135 -56.209 -8.119 411 HG11 VAL 59 HG11 VAL 59 5.477 -55.648 -6.853 412 HG12 VAL 59 HG12 VAL 59 5.838 -56.151 -8.506 413 HG13 VAL 59 HG13 VAL 59 6.002 -57.299 -7.177 414 HG21 VAL 59 HG21 VAL 59 7.120 -53.937 -6.413 415 HG22 VAL 59 HG22 VAL 59 8.723 -54.048 -7.139 416 HG23 VAL 59 HG23 VAL 59 7.297 -53.913 -8.168 417 H SER 60 H SER 60 9.032 -54.459 -4.713 418 HA SER 60 HA SER 60 11.716 -54.558 -5.788 419 HB2 SER 60 HB2 SER 60 10.236 -52.461 -5.140 420 HB3 SER 60 HB3 SER 60 10.960 -52.721 -3.553 421 HG SER 60 HG SER 60 12.637 -52.719 -5.789 422 H GLN 61 H GLN 61 10.055 -55.425 -2.850 423 HA GLN 61 HA GLN 61 10.743 -56.371 -0.893 424 HB2 GLN 61 HB2 GLN 61 12.866 -57.533 -2.705 425 HB3 GLN 61 HB3 GLN 61 12.425 -58.148 -1.118 426 HG2 GLN 61 HG2 GLN 61 10.107 -57.930 -2.811 427 HG3 GLN 61 HG3 GLN 61 11.365 -58.897 -3.579 428 HE21 GLN 61 HE21 GLN 61 12.172 -60.737 -2.441 429 HE22 GLN 61 HE22 GLN 61 11.180 -61.551 -1.285 430 H CYS 62 H CYS 62 11.767 -53.742 -1.425 431 HA CYS 62 HA CYS 62 14.513 -53.759 -0.478 432 HB2 CYS 62 HB2 CYS 62 13.069 -52.041 -2.094 433 HB3 CYS 62 HB3 CYS 62 13.175 -51.162 -0.574 434 HG CYS 62 HG CYS 62 15.516 -50.237 -1.032 435 H MET 63 H MET 63 14.648 -51.559 1.123 436 HA MET 63 HA MET 63 12.761 -51.917 3.313 437 HB2 MET 63 HB2 MET 63 15.695 -52.543 3.472 438 HB3 MET 63 HB3 MET 63 14.809 -52.017 4.897 439 HG2 MET 63 HG2 MET 63 13.176 -53.965 4.043 440 HG3 MET 63 HG3 MET 63 14.716 -54.574 3.440 441 HE1 MET 63 HE1 MET 63 13.201 -53.923 7.604 442 HE2 MET 63 HE2 MET 63 12.410 -53.770 6.035 443 HE3 MET 63 HE3 MET 63 12.629 -55.363 6.761 444 H ARG 64 H ARG 64 13.238 -49.768 1.485 445 HA ARG 64 HA ARG 64 14.668 -47.750 3.022 446 HB2 ARG 64 HB2 ARG 64 14.361 -46.311 1.106 447 HB3 ARG 64 HB3 ARG 64 14.940 -47.879 0.560 448 HG2 ARG 64 HG2 ARG 64 13.142 -48.208 -0.704 449 HG3 ARG 64 HG3 ARG 64 12.046 -47.737 0.597 450 HD2 ARG 64 HD2 ARG 64 11.741 -46.209 -1.215 451 HD3 ARG 64 HD3 ARG 64 12.574 -45.356 0.083 452 HE ARG 64 HE ARG 64 14.320 -45.028 -1.342 453 HH11 ARG 64 HH11 ARG 64 12.450 -47.731 -2.491 454 HH12 ARG 64 HH12 ARG 64 13.378 -47.924 -3.941 455 HH21 ARG 64 HH21 ARG 64 15.549 -45.273 -3.248 456 HH22 ARG 64 HH22 ARG 64 15.141 -46.526 -4.370 457 H GLY 65 H GLY 65 13.359 -45.462 2.654 458 HA2 GLY 65 HA2 GLY 65 10.562 -45.791 3.406 459 HA3 GLY 65 HA3 GLY 65 11.616 -45.093 4.626 460 H VAL 66 H VAL 66 9.550 -43.590 3.876 461 HA VAL 66 HA VAL 66 10.239 -41.844 1.684 462 HB VAL 66 HB VAL 66 8.064 -41.611 3.767 463 HG11 VAL 66 HG11 VAL 66 7.081 -39.926 2.295 464 HG12 VAL 66 HG12 VAL 66 8.678 -39.428 2.858 465 HG13 VAL 66 HG13 VAL 66 8.473 -40.048 1.220 466 HG21 VAL 66 HG21 VAL 66 8.102 -42.678 0.955 467 HG22 VAL 66 HG22 VAL 66 7.629 -43.517 2.432 468 HG23 VAL 66 HG23 VAL 66 6.615 -42.227 1.787 469 H ARG 67 H ARG 67 11.610 -40.206 1.824 470 HA ARG 67 HA ARG 67 12.851 -39.400 4.214 471 HB2 ARG 67 HB2 ARG 67 13.979 -39.100 2.109 472 HB3 ARG 67 HB3 ARG 67 12.692 -38.061 1.512 473 HG2 ARG 67 HG2 ARG 67 14.572 -36.707 2.111 474 HG3 ARG 67 HG3 ARG 67 13.270 -36.413 3.265 475 HD2 ARG 67 HD2 ARG 67 14.630 -38.462 4.451 476 HD3 ARG 67 HD3 ARG 67 15.932 -37.563 3.674 477 HE ARG 67 HE ARG 67 14.138 -35.881 5.140 478 HH11 ARG 67 HH11 ARG 67 16.905 -37.978 5.396 479 HH12 ARG 67 HH12 ARG 67 17.512 -37.218 6.830 480 HH21 ARG 67 HH21 ARG 67 14.927 -34.872 7.027 481 HH22 ARG 67 HH22 ARG 67 16.385 -35.452 7.757 482 H LEU 68 H LEU 68 12.559 -37.661 5.557 483 HA LEU 68 HA LEU 68 10.187 -35.987 5.077 484 HB2 LEU 68 HB2 LEU 68 9.603 -37.640 6.732 485 HB3 LEU 68 HB3 LEU 68 11.050 -37.265 7.666 486 HG LEU 68 HG LEU 68 8.747 -36.373 8.453 487 HD11 LEU 68 HD11 LEU 68 9.880 -34.909 9.742 488 HD12 LEU 68 HD12 LEU 68 10.683 -34.150 8.368 489 HD13 LEU 68 HD13 LEU 68 11.282 -35.682 9.002 490 HD21 LEU 68 HD21 LEU 68 9.346 -33.992 6.798 491 HD22 LEU 68 HD22 LEU 68 7.805 -34.591 7.412 492 HD23 LEU 68 HD23 LEU 68 8.546 -35.348 6.001 493 H VAL 69 H VAL 69 10.683 -33.906 5.003 494 HA VAL 69 HA VAL 69 12.786 -32.865 6.758 495 HB VAL 69 HB VAL 69 13.975 -33.153 4.712 496 HG11 VAL 69 HG11 VAL 69 12.735 -31.587 2.786 497 HG12 VAL 69 HG12 VAL 69 12.800 -33.350 2.830 498 HG13 VAL 69 HG13 VAL 69 11.419 -32.500 3.522 499 HG21 VAL 69 HG21 VAL 69 13.991 -30.876 5.974 500 HG22 VAL 69 HG22 VAL 69 14.795 -31.014 4.411 501 HG23 VAL 69 HG23 VAL 69 13.198 -30.274 4.518 502 H GLU 70 H GLU 70 12.077 -31.153 7.838 503 HA GLU 70 HA GLU 70 10.782 -29.403 8.504 504 HB2 GLU 70 HB2 GLU 70 10.508 -28.787 5.562 505 HB3 GLU 70 HB3 GLU 70 10.404 -27.659 6.906 506 HG2 GLU 70 HG2 GLU 70 12.915 -28.906 7.103 507 HG3 GLU 70 HG3 GLU 70 12.691 -28.479 5.407 508 H GLY 71 H GLY 71 9.484 -31.971 7.860 509 HA2 GLY 71 HA2 GLY 71 7.257 -32.597 8.256 510 HA3 GLY 71 HA3 GLY 71 6.748 -30.967 7.840 511 H ILE 72 H ILE 72 8.385 -31.064 5.344 512 HA ILE 72 HA ILE 72 6.338 -32.181 3.662 513 HB ILE 72 HB ILE 72 8.981 -30.910 2.941 514 HG12 ILE 72 HG12 ILE 72 6.706 -29.379 2.162 515 HG13 ILE 72 HG13 ILE 72 6.512 -29.814 3.856 516 HG21 ILE 72 HG21 ILE 72 6.925 -32.240 1.336 517 HG22 ILE 72 HG22 ILE 72 7.370 -30.634 0.762 518 HG23 ILE 72 HG23 ILE 72 8.607 -31.876 0.952 519 HD11 ILE 72 HD11 ILE 72 7.669 -27.631 3.388 520 HD12 ILE 72 HD12 ILE 72 8.525 -28.745 4.455 521 HD13 ILE 72 HD13 ILE 72 9.023 -28.579 2.772 522 H LEU 73 H LEU 73 6.248 -34.269 3.187 523 HA LEU 73 HA LEU 73 8.465 -36.033 3.517 524 HB2 LEU 73 HB2 LEU 73 5.685 -36.341 2.438 525 HB3 LEU 73 HB3 LEU 73 6.853 -37.657 2.336 526 HG LEU 73 HG LEU 73 5.408 -37.997 4.234 527 HD11 LEU 73 HD11 LEU 73 7.763 -38.652 4.442 528 HD12 LEU 73 HD12 LEU 73 7.064 -38.191 5.994 529 HD13 LEU 73 HD13 LEU 73 8.131 -37.076 5.142 530 HD21 LEU 73 HD21 LEU 73 5.087 -35.392 4.429 531 HD22 LEU 73 HD22 LEU 73 6.399 -35.544 5.599 532 HD23 LEU 73 HD23 LEU 73 4.899 -36.442 5.834 533 H HIS 74 H HIS 74 10.089 -36.265 2.143 534 HA HIS 74 HA HIS 74 9.824 -35.393 -0.612 535 HB2 HIS 74 HB2 HIS 74 11.914 -35.400 1.223 536 HB3 HIS 74 HB3 HIS 74 12.355 -36.658 0.072 537 HD1 HIS 74 HD1 HIS 74 11.839 -35.649 -2.583 538 HD2 HIS 74 HD2 HIS 74 12.994 -33.060 0.454 539 HE1 HIS 74 HE1 HIS 74 12.775 -33.625 -3.745 540 H ALA 75 H ALA 75 10.212 -36.697 -2.427 541 HA ALA 75 HA ALA 75 9.545 -39.512 -2.006 542 HB1 ALA 75 HB1 ALA 75 9.312 -37.632 -4.310 543 HB2 ALA 75 HB2 ALA 75 9.364 -39.370 -4.609 544 HB3 ALA 75 HB3 ALA 75 8.097 -38.688 -3.591 545 HA PRO 76 HA PRO 76 13.535 -41.056 -2.990 546 HB2 PRO 76 HB2 PRO 76 12.910 -43.344 -4.312 547 HB3 PRO 76 HB3 PRO 76 12.698 -43.154 -2.567 548 HG2 PRO 76 HG2 PRO 76 10.670 -42.929 -4.757 549 HG3 PRO 76 HG3 PRO 76 10.529 -43.726 -3.179 550 HD2 PRO 76 HD2 PRO 76 9.499 -41.271 -3.668 551 HD3 PRO 76 HD3 PRO 76 10.120 -41.745 -2.074 552 H ASP 77 H ASP 77 14.637 -42.276 -5.007 553 HA ASP 77 HA ASP 77 14.617 -40.328 -7.123 554 HB2 ASP 77 HB2 ASP 77 16.264 -42.740 -6.465 555 HB3 ASP 77 HB3 ASP 77 16.335 -42.067 -8.091 556 H ALA 78 H ALA 78 12.677 -42.891 -6.490 557 HA ALA 78 HA ALA 78 12.310 -43.566 -9.333 558 HB1 ALA 78 HB1 ALA 78 11.015 -45.181 -7.205 559 HB2 ALA 78 HB2 ALA 78 11.682 -45.680 -8.760 560 HB3 ALA 78 HB3 ALA 78 12.761 -45.328 -7.410 561 H GLY 79 H GLY 79 10.807 -42.211 -6.512 562 HA2 GLY 79 HA2 GLY 79 9.002 -40.605 -6.966 563 HA3 GLY 79 HA3 GLY 79 8.349 -41.782 -8.096 564 H TRP 80 H TRP 80 6.495 -41.047 -6.524 565 HA TRP 80 HA TRP 80 6.412 -42.249 -3.949 566 HB2 TRP 80 HB2 TRP 80 4.264 -41.131 -5.752 567 HB3 TRP 80 HB3 TRP 80 3.921 -41.785 -4.153 568 HD1 TRP 80 HD1 TRP 80 4.504 -38.595 -5.740 569 HE1 TRP 80 HE1 TRP 80 5.279 -36.813 -4.052 570 HE3 TRP 80 HE3 TRP 80 5.760 -41.659 -1.845 571 HZ2 TRP 80 HZ2 TRP 80 6.290 -36.719 -1.418 572 HZ3 TRP 80 HZ3 TRP 80 6.624 -40.644 0.223 573 HH2 TRP 80 HH2 TRP 80 6.884 -38.225 0.430 574 H GLY 81 H GLY 81 4.654 -43.064 -6.953 575 HA2 GLY 81 HA2 GLY 81 4.206 -45.169 -7.830 576 HA3 GLY 81 HA3 GLY 81 5.026 -45.887 -6.451 577 H ASN 82 H ASN 82 3.195 -47.411 -6.586 578 HA ASN 82 HA ASN 82 0.898 -46.377 -5.062 579 HB2 ASN 82 HB2 ASN 82 0.570 -48.653 -6.987 580 HB3 ASN 82 HB3 ASN 82 -0.644 -47.538 -6.366 581 HD21 ASN 82 HD21 ASN 82 -0.487 -45.292 -7.100 582 HD22 ASN 82 HD22 ASN 82 0.057 -44.988 -8.711 583 H LEU 83 H LEU 83 3.306 -47.606 -4.070 584 HA LEU 83 HA LEU 83 2.565 -50.317 -3.338 585 HB2 LEU 83 HB2 LEU 83 4.728 -50.164 -2.007 586 HB3 LEU 83 HB3 LEU 83 4.847 -50.106 -3.765 587 HG LEU 83 HG LEU 83 6.299 -48.508 -2.342 588 HD11 LEU 83 HD11 LEU 83 5.038 -46.776 -4.272 589 HD12 LEU 83 HD12 LEU 83 5.255 -48.402 -4.919 590 HD13 LEU 83 HD13 LEU 83 6.642 -47.510 -4.294 591 HD21 LEU 83 HD21 LEU 83 4.384 -47.732 -0.952 592 HD22 LEU 83 HD22 LEU 83 3.729 -46.933 -2.381 593 HD23 LEU 83 HD23 LEU 83 5.286 -46.427 -1.723 594 H VAL 84 H VAL 84 3.290 -50.707 -0.834 595 HA VAL 84 HA VAL 84 1.336 -49.154 0.681 596 HB VAL 84 HB VAL 84 2.844 -51.569 1.664 597 HG11 VAL 84 HG11 VAL 84 1.789 -50.874 3.528 598 HG12 VAL 84 HG12 VAL 84 0.617 -49.907 2.630 599 HG13 VAL 84 HG13 VAL 84 0.388 -51.649 2.790 600 HG21 VAL 84 HG21 VAL 84 0.344 -51.438 -0.004 601 HG22 VAL 84 HG22 VAL 84 1.826 -52.335 -0.330 602 HG23 VAL 84 HG23 VAL 84 0.763 -52.838 0.984 603 H TYR 85 H TYR 85 1.838 -48.420 2.852 604 HA TYR 85 HA TYR 85 4.691 -47.909 3.330 605 HB2 TYR 85 HB2 TYR 85 4.482 -45.650 3.375 606 HB3 TYR 85 HB3 TYR 85 3.108 -45.963 2.321 607 HD1 TYR 85 HD1 TYR 85 0.885 -45.506 3.032 608 HD2 TYR 85 HD2 TYR 85 4.102 -45.224 5.802 609 HE1 TYR 85 HE1 TYR 85 -0.609 -44.403 4.645 610 HE2 TYR 85 HE2 TYR 85 2.617 -44.121 7.423 611 HH TYR 85 HH TYR 85 0.539 -42.833 7.434 612 H VAL 86 H VAL 86 5.297 -47.714 5.487 613 HA VAL 86 HA VAL 86 3.250 -48.584 7.419 614 HB VAL 86 HB VAL 86 6.244 -48.973 7.532 615 HG11 VAL 86 HG11 VAL 86 4.075 -49.906 9.410 616 HG12 VAL 86 HG12 VAL 86 5.777 -50.366 9.501 617 HG13 VAL 86 HG13 VAL 86 5.302 -48.686 9.754 618 HG21 VAL 86 HG21 VAL 86 5.799 -50.685 6.163 619 HG22 VAL 86 HG22 VAL 86 5.061 -51.450 7.570 620 HG23 VAL 86 HG23 VAL 86 4.059 -50.558 6.424 621 H VAL 87 H VAL 87 2.617 -47.099 8.825 622 HA VAL 87 HA VAL 87 3.733 -44.551 9.077 623 HB VAL 87 HB VAL 87 2.382 -44.421 11.219 624 HG11 VAL 87 HG11 VAL 87 0.197 -44.587 10.002 625 HG12 VAL 87 HG12 VAL 87 1.428 -43.622 9.185 626 HG13 VAL 87 HG13 VAL 87 1.082 -45.263 8.635 627 HG21 VAL 87 HG21 VAL 87 1.355 -47.120 10.369 628 HG22 VAL 87 HG22 VAL 87 2.551 -46.901 11.647 629 HG23 VAL 87 HG23 VAL 87 0.939 -46.206 11.820 630 H ASN 88 H ASN 88 4.668 -43.569 11.028 631 HA ASN 88 HA ASN 88 6.158 -45.376 12.764 632 HB2 ASN 88 HB2 ASN 88 7.574 -44.841 10.728 633 HB3 ASN 88 HB3 ASN 88 7.585 -43.168 11.278 634 HD21 ASN 88 HD21 ASN 88 9.940 -43.672 11.225 635 HD22 ASN 88 HD22 ASN 88 10.646 -44.316 12.664 636 H TYR 89 H TYR 89 4.825 -44.587 14.423 637 HA TYR 89 HA TYR 89 5.821 -42.359 15.825 638 HB2 TYR 89 HB2 TYR 89 4.048 -40.770 15.639 639 HB3 TYR 89 HB3 TYR 89 4.533 -41.187 14.000 640 HD1 TYR 89 HD1 TYR 89 1.786 -40.592 16.014 641 HD2 TYR 89 HD2 TYR 89 3.155 -43.322 13.051 642 HE1 TYR 89 HE1 TYR 89 -0.544 -41.172 15.480 643 HE2 TYR 89 HE2 TYR 89 0.829 -43.908 12.508 644 HH TYR 89 HH TYR 89 -1.859 -42.720 14.419 645 HA PRO 90 HA PRO 90 3.806 -44.461 19.110 646 HB2 PRO 90 HB2 PRO 90 3.487 -42.444 20.898 647 HB3 PRO 90 HB3 PRO 90 5.058 -43.170 20.540 648 HG2 PRO 90 HG2 PRO 90 3.863 -40.629 19.500 649 HG3 PRO 90 HG3 PRO 90 5.519 -40.943 20.052 650 HD2 PRO 90 HD2 PRO 90 4.847 -40.870 17.430 651 HD3 PRO 90 HD3 PRO 90 6.133 -41.921 18.057 652 H LYS 91 H LYS 91 2.343 -41.272 18.460 653 HA LYS 91 HA LYS 91 -0.202 -42.276 17.848 654 HB2 LYS 91 HB2 LYS 91 -0.412 -42.918 20.147 655 HB3 LYS 91 HB3 LYS 91 0.176 -41.354 20.698 656 HG2 LYS 91 HG2 LYS 91 -1.817 -40.269 20.072 657 HG3 LYS 91 HG3 LYS 91 -2.360 -41.651 19.118 658 HD2 LYS 91 HD2 LYS 91 -2.283 -42.932 21.364 659 HD3 LYS 91 HD3 LYS 91 -2.272 -41.326 22.097 660 HE2 LYS 91 HE2 LYS 91 -4.337 -40.791 20.835 661 HE3 LYS 91 HE3 LYS 91 -4.363 -42.448 20.234 662 HZ1 LYS 91 HZ1 LYS 91 -5.533 -42.933 22.040 663 HZ2 LYS 91 HZ2 LYS 91 -5.232 -41.427 22.750 664 HZ3 LYS 91 HZ3 LYS 91 -4.127 -42.693 22.951 665 H ASP 92 H ASP 92 1.606 -39.601 19.280 666 HA ASP 92 HA ASP 92 0.704 -37.797 17.254 667 HB2 ASP 92 HB2 ASP 92 -0.610 -36.309 18.514 668 HB3 ASP 92 HB3 ASP 92 -1.204 -37.902 18.974 669 H ASN 93 H ASN 93 1.586 -35.556 17.640 670 HA ASN 93 HA ASN 93 3.580 -35.098 19.588 671 HB2 ASN 93 HB2 ASN 93 4.448 -36.770 17.534 672 HB3 ASN 93 HB3 ASN 93 5.069 -35.182 17.092 673 HD21 ASN 93 HD21 ASN 93 7.134 -35.176 17.629 674 HD22 ASN 93 HD22 ASN 93 7.779 -35.639 19.164 675 H LYS 94 H LYS 94 4.952 -33.138 18.977 676 HA LYS 94 HA LYS 94 5.050 -30.945 18.385 677 HB2 LYS 94 HB2 LYS 94 4.608 -32.343 16.038 678 HB3 LYS 94 HB3 LYS 94 3.365 -31.099 16.005 679 HG2 LYS 94 HG2 LYS 94 4.955 -29.832 15.083 680 HG3 LYS 94 HG3 LYS 94 5.550 -29.656 16.736 681 HD2 LYS 94 HD2 LYS 94 7.207 -31.285 16.433 682 HD3 LYS 94 HD3 LYS 94 6.432 -31.929 14.984 683 HE2 LYS 94 HE2 LYS 94 7.183 -29.098 14.817 684 HE3 LYS 94 HE3 LYS 94 8.543 -30.206 14.994 685 HZ1 LYS 94 HZ1 LYS 94 8.111 -29.916 12.687 686 HZ2 LYS 94 HZ2 LYS 94 6.465 -30.251 12.877 687 HZ3 LYS 94 HZ3 LYS 94 7.608 -31.478 13.097 688 H ARG 95 H ARG 95 3.512 -29.043 17.561 689 HA ARG 95 HA ARG 95 1.000 -29.333 19.073 690 HB2 ARG 95 HB2 ARG 95 3.100 -27.358 19.181 691 HB3 ARG 95 HB3 ARG 95 1.570 -26.598 18.765 692 HG2 ARG 95 HG2 ARG 95 0.562 -27.740 20.750 693 HG3 ARG 95 HG3 ARG 95 2.191 -28.251 21.198 694 HD2 ARG 95 HD2 ARG 95 2.908 -25.994 21.461 695 HD3 ARG 95 HD3 ARG 95 1.418 -25.377 20.748 696 HE ARG 95 HE ARG 95 0.549 -26.763 22.903 697 HH11 ARG 95 HH11 ARG 95 2.935 -24.267 22.458 698 HH12 ARG 95 HH12 ARG 95 2.723 -23.601 24.043 699 HH21 ARG 95 HH21 ARG 95 0.261 -25.895 24.993 700 HH22 ARG 95 HH22 ARG 95 1.202 -24.528 25.485 701 H LYS 96 H LYS 96 -0.684 -27.656 18.361 702 HA LYS 96 HA LYS 96 -0.752 -27.582 15.415 703 HB2 LYS 96 HB2 LYS 96 -2.385 -29.141 16.570 704 HB3 LYS 96 HB3 LYS 96 -3.160 -27.708 17.231 705 HG2 LYS 96 HG2 LYS 96 -4.374 -27.541 15.394 706 HG3 LYS 96 HG3 LYS 96 -2.901 -27.295 14.453 707 HD2 LYS 96 HD2 LYS 96 -2.877 -29.996 14.824 708 HD3 LYS 96 HD3 LYS 96 -4.607 -29.668 14.708 709 HE2 LYS 96 HE2 LYS 96 -3.821 -30.119 12.507 710 HE3 LYS 96 HE3 LYS 96 -4.130 -28.387 12.609 711 HZ1 LYS 96 HZ1 LYS 96 -1.760 -29.667 11.892 712 HZ2 LYS 96 HZ2 LYS 96 -1.471 -28.879 13.360 713 HZ3 LYS 96 HZ3 LYS 96 -2.044 -28.004 12.030 714 H MET 97 H MET 97 -1.616 -25.903 18.396 715 HA MET 97 HA MET 97 -2.805 -23.635 17.277 716 HB2 MET 97 HB2 MET 97 -1.724 -24.416 19.866 717 HB3 MET 97 HB3 MET 97 -1.481 -22.707 19.532 718 HG2 MET 97 HG2 MET 97 -3.647 -22.226 19.776 719 HG3 MET 97 HG3 MET 97 -4.165 -23.666 18.903 720 HE1 MET 97 HE1 MET 97 -6.067 -25.094 21.730 721 HE2 MET 97 HE2 MET 97 -6.206 -23.910 20.431 722 HE3 MET 97 HE3 MET 97 -5.507 -25.496 20.107 723 H ASP 98 H ASP 98 -1.878 -21.417 17.256 724 HA ASP 98 HA ASP 98 0.985 -21.232 16.817 725 HB2 ASP 98 HB2 ASP 98 -0.951 -20.455 14.627 726 HB3 ASP 98 HB3 ASP 98 0.804 -20.309 14.578 727 H GLU 99 H GLU 99 1.293 -18.790 15.828 728 HA GLU 99 HA GLU 99 1.303 -16.583 16.382 729 HB2 GLU 99 HB2 GLU 99 -1.511 -17.368 16.321 730 HB3 GLU 99 HB3 GLU 99 -1.211 -15.982 17.359 731 HG2 GLU 99 HG2 GLU 99 -1.723 -15.102 15.247 732 HG3 GLU 99 HG3 GLU 99 0.025 -14.952 15.416 733 H THR 100 H THR 100 2.682 -16.538 18.101 734 HA THR 100 HA THR 100 1.469 -16.130 20.709 735 HB THR 100 HB THR 100 1.939 -18.550 20.693 736 HG1 THR 100 HG1 THR 100 2.274 -17.141 22.610 737 HG21 THR 100 HG21 THR 100 4.845 -18.259 20.818 738 HG22 THR 100 HG22 THR 100 4.169 -17.889 19.232 739 HG23 THR 100 HG23 THR 100 3.863 -19.457 19.977 740 H ASP 101 H ASP 101 2.706 -14.331 18.941 741 HA ASP 101 HA ASP 101 5.414 -13.855 19.363 742 HB2 ASP 101 HB2 ASP 101 4.013 -12.685 17.679 743 HB3 ASP 101 HB3 ASP 101 3.249 -11.777 18.981 744 H ALA 102 H ALA 102 6.557 -12.537 20.796 745 HA ALA 102 HA ALA 102 5.314 -11.164 22.961 746 HB1 ALA 102 HB1 ALA 102 6.259 -12.610 24.769 747 HB2 ALA 102 HB2 ALA 102 4.926 -13.335 23.869 748 HB3 ALA 102 HB3 ALA 102 6.586 -13.832 23.540 749 H SER 103 H SER 103 6.868 -9.845 21.527 750 HA SER 103 HA SER 103 9.668 -10.156 22.259 751 HB2 SER 103 HB2 SER 103 8.551 -7.922 20.578 752 HB3 SER 103 HB3 SER 103 10.168 -8.625 20.543 753 HG SER 103 HG SER 103 8.898 -9.337 18.784 754 H SER 104 H SER 104 10.612 -7.626 22.359 755 HA SER 104 HA SER 104 9.107 -5.982 24.170 756 HB2 SER 104 HB2 SER 104 9.777 -7.371 25.917 757 HB3 SER 104 HB3 SER 104 11.332 -7.731 25.168 758 HG SER 104 HG SER 104 10.804 -5.898 26.988 759 H ALA 105 H ALA 105 12.490 -6.701 23.291 760 HA ALA 105 HA ALA 105 12.771 -3.885 22.470 761 HB1 ALA 105 HB1 ALA 105 14.712 -3.600 23.609 762 HB2 ALA 105 HB2 ALA 105 13.971 -4.805 24.663 763 HB3 ALA 105 HB3 ALA 105 15.174 -5.297 23.470 764 H VAL 106 H VAL 106 15.062 -3.767 21.232 765 HA VAL 106 HA VAL 106 15.380 -6.046 19.440 766 HB VAL 106 HB VAL 106 15.200 -4.680 17.420 767 HG11 VAL 106 HG11 VAL 106 12.789 -4.447 17.368 768 HG12 VAL 106 HG12 VAL 106 13.232 -5.905 18.259 769 HG13 VAL 106 HG13 VAL 106 12.725 -4.457 19.130 770 HG21 VAL 106 HG21 VAL 106 15.344 -2.468 17.537 771 HG22 VAL 106 HG22 VAL 106 13.773 -2.424 18.337 772 HG23 VAL 106 HG23 VAL 106 15.248 -2.528 19.297 773 H LYS 107 H LYS 107 17.212 -5.608 17.851 774 HA LYS 107 HA LYS 107 19.356 -4.196 19.287 775 HB2 LYS 107 HB2 LYS 107 19.218 -6.800 18.220 776 HB3 LYS 107 HB3 LYS 107 20.312 -5.906 17.174 777 HG2 LYS 107 HG2 LYS 107 20.790 -5.478 20.024 778 HG3 LYS 107 HG3 LYS 107 21.009 -7.148 19.496 779 HD2 LYS 107 HD2 LYS 107 22.285 -5.827 17.511 780 HD3 LYS 107 HD3 LYS 107 22.580 -4.735 18.867 781 HE2 LYS 107 HE2 LYS 107 22.992 -7.627 19.352 782 HE3 LYS 107 HE3 LYS 107 24.157 -6.822 18.302 783 HZ1 LYS 107 HZ1 LYS 107 24.621 -5.241 20.033 784 HZ2 LYS 107 HZ2 LYS 107 24.820 -6.804 20.649 785 HZ3 LYS 107 HZ3 LYS 107 23.435 -5.913 21.035 786 H VAL 108 H VAL 108 21.143 -3.390 17.789 787 HA VAL 108 HA VAL 108 20.565 -2.692 15.114 788 HB VAL 108 HB VAL 108 18.930 -1.178 16.072 789 HG11 VAL 108 HG11 VAL 108 20.775 -0.931 18.154 790 HG12 VAL 108 HG12 VAL 108 20.696 0.665 17.405 791 HG13 VAL 108 HG13 VAL 108 19.224 -0.106 17.997 792 HG21 VAL 108 HG21 VAL 108 21.145 0.679 15.377 793 HG22 VAL 108 HG22 VAL 108 20.660 -0.525 14.183 794 HG23 VAL 108 HG23 VAL 108 19.481 0.636 14.794 795 H LYS 109 H LYS 109 22.384 -2.043 14.092 796 HA LYS 109 HA LYS 109 24.704 -1.374 15.783 797 HB2 LYS 109 HB2 LYS 109 26.127 -2.535 14.278 798 HB3 LYS 109 HB3 LYS 109 24.765 -3.603 14.588 799 HG2 LYS 109 HG2 LYS 109 23.769 -2.605 12.436 800 HG3 LYS 109 HG3 LYS 109 25.412 -2.046 12.117 801 HD2 LYS 109 HD2 LYS 109 25.123 -4.877 12.913 802 HD3 LYS 109 HD3 LYS 109 24.481 -4.441 11.327 803 HE2 LYS 109 HE2 LYS 109 26.544 -4.551 10.514 804 HE3 LYS 109 HE3 LYS 109 26.981 -3.180 11.533 805 HZ1 LYS 109 HZ1 LYS 109 26.950 -5.814 12.788 806 HZ2 LYS 109 HZ2 LYS 109 27.990 -4.506 13.045 807 HZ3 LYS 109 HZ3 LYS 109 28.203 -5.503 11.695 808 H ARG 110 H ARG 110 26.502 -0.459 14.076 809 HA ARG 110 HA ARG 110 25.474 1.333 12.108 810 HB2 ARG 110 HB2 ARG 110 26.213 3.421 13.303 811 HB3 ARG 110 HB3 ARG 110 24.765 2.665 13.954 812 HG2 ARG 110 HG2 ARG 110 25.859 1.915 15.859 813 HG3 ARG 110 HG3 ARG 110 27.454 2.069 15.120 814 HD2 ARG 110 HD2 ARG 110 27.529 4.349 15.438 815 HD3 ARG 110 HD3 ARG 110 25.774 4.506 15.475 816 HE ARG 110 HE ARG 110 26.612 3.004 17.696 817 HH11 ARG 110 HH11 ARG 110 26.727 6.253 16.452 818 HH12 ARG 110 HH12 ARG 110 26.792 6.990 18.019 819 HH21 ARG 110 HH21 ARG 110 26.697 3.962 19.764 820 HH22 ARG 110 HH22 ARG 110 26.775 5.686 19.902 821 H ALA 111 H ALA 111 27.279 2.931 11.433 822 HA ALA 111 HA ALA 111 29.848 1.491 11.564 823 HB1 ALA 111 HB1 ALA 111 28.516 1.714 9.336 824 HB2 ALA 111 HB2 ALA 111 29.174 3.351 9.326 825 HB3 ALA 111 HB3 ALA 111 30.262 1.963 9.346 826 H VAL 112 H VAL 112 31.786 2.754 11.540 827 HA VAL 112 HA VAL 112 31.549 5.606 12.073 828 HB VAL 112 HB VAL 112 31.328 4.529 14.294 829 HG11 VAL 112 HG11 VAL 112 33.048 2.672 13.434 830 HG12 VAL 112 HG12 VAL 112 34.174 3.722 14.297 831 HG13 VAL 112 HG13 VAL 112 32.793 3.023 15.143 832 HG21 VAL 112 HG21 VAL 112 32.476 6.766 13.852 833 HG22 VAL 112 HG22 VAL 112 32.787 5.994 15.407 834 HG23 VAL 112 HG23 VAL 112 33.992 5.906 14.122 835 H GLN 113 H GLN 113 33.471 6.760 11.761 836 HA GLN 113 HA GLN 113 35.789 5.227 10.820 837 HB2 GLN 113 HB2 GLN 113 34.468 5.924 8.852 838 HB3 GLN 113 HB3 GLN 113 34.597 7.598 9.372 839 HG2 GLN 113 HG2 GLN 113 36.860 7.712 8.875 840 HG3 GLN 113 HG3 GLN 113 37.049 5.960 8.885 841 HE21 GLN 113 HE21 GLN 113 36.107 8.731 7.053 842 HE22 GLN 113 HE22 GLN 113 35.941 7.933 5.530 843 H LYS 114 H LYS 114 34.525 8.398 11.770 844 HA LYS 114 HA LYS 114 36.890 8.870 13.370 845 HB2 LYS 114 HB2 LYS 114 37.210 9.730 10.908 846 HB3 LYS 114 HB3 LYS 114 36.182 11.052 11.446 847 HG2 LYS 114 HG2 LYS 114 37.765 11.539 13.251 848 HG3 LYS 114 HG3 LYS 114 38.803 10.229 12.682 849 HD2 LYS 114 HD2 LYS 114 38.919 11.411 10.471 850 HD3 LYS 114 HD3 LYS 114 38.085 12.771 11.227 851 HE2 LYS 114 HE2 LYS 114 40.389 13.282 11.323 852 HE3 LYS 114 HE3 LYS 114 39.935 12.778 12.950 853 HZ1 LYS 114 HZ1 LYS 114 40.901 10.643 12.577 854 HZ2 LYS 114 HZ2 LYS 114 42.050 11.810 12.153 855 HZ3 LYS 114 HZ3 LYS 114 41.195 10.987 10.947 Start of MODEL 14 1 H1 MET 1 H MET 1 0.977 -4.918 -8.662 2 HA MET 1 HA MET 1 -0.937 -6.705 -8.351 3 HB2 MET 1 HB2 MET 1 1.902 -7.004 -9.108 4 HB3 MET 1 HB3 MET 1 1.072 -8.498 -8.693 5 HG2 MET 1 HG2 MET 1 0.131 -8.555 -10.687 6 HG3 MET 1 HG3 MET 1 -0.616 -6.985 -10.402 7 HE1 MET 1 HE1 MET 1 0.149 -8.151 -13.194 8 HE2 MET 1 HE2 MET 1 1.659 -7.583 -13.907 9 HE3 MET 1 HE3 MET 1 1.678 -8.904 -12.737 10 H ALA 2 H ALA 2 -1.772 -6.986 -6.310 11 HA ALA 2 HA ALA 2 -0.097 -8.531 -4.438 12 HB1 ALA 2 HB1 ALA 2 -0.454 -6.928 -2.944 13 HB2 ALA 2 HB2 ALA 2 -1.580 -6.100 -4.020 14 HB3 ALA 2 HB3 ALA 2 -2.159 -7.377 -2.951 15 H GLY 3 H GLY 3 -0.874 -10.438 -3.735 16 HA2 GLY 3 HA2 GLY 3 -3.536 -11.152 -3.375 17 HA3 GLY 3 HA3 GLY 3 -3.116 -11.605 -5.020 18 H SER 4 H SER 4 -3.778 -13.202 -2.568 19 HA SER 4 HA SER 4 -1.419 -14.531 -1.715 20 HB2 SER 4 HB2 SER 4 -4.165 -14.585 -1.049 21 HB3 SER 4 HB3 SER 4 -3.730 -16.232 -1.503 22 HG SER 4 HG SER 4 -2.590 -14.606 0.511 23 H HIS 5 H HIS 5 -4.043 -15.600 -3.885 24 HA HIS 5 HA HIS 5 -2.260 -16.765 -5.758 25 HB2 HIS 5 HB2 HIS 5 -2.022 -18.447 -3.974 26 HB3 HIS 5 HB3 HIS 5 -3.765 -18.694 -3.976 27 HD1 HIS 5 HD1 HIS 5 -2.107 -18.314 -7.271 28 HD2 HIS 5 HD2 HIS 5 -3.310 -21.387 -4.747 29 HE1 HIS 5 HE1 HIS 5 -2.013 -20.405 -8.665 30 H HIS 6 H HIS 6 -3.764 -15.272 -6.855 31 HA HIS 6 HA HIS 6 -6.308 -16.603 -7.522 32 HB2 HIS 6 HB2 HIS 6 -5.624 -13.663 -7.422 33 HB3 HIS 6 HB3 HIS 6 -7.087 -14.285 -8.181 34 HD1 HIS 6 HD1 HIS 6 -6.508 -12.535 -5.385 35 HD2 HIS 6 HD2 HIS 6 -8.063 -16.357 -5.868 36 HE1 HIS 6 HE1 HIS 6 -7.831 -12.991 -3.296 37 H HIS 7 H HIS 7 -3.847 -17.236 -8.776 38 HA HIS 7 HA HIS 7 -4.496 -16.430 -11.517 39 HB2 HIS 7 HB2 HIS 7 -2.184 -16.016 -12.076 40 HB3 HIS 7 HB3 HIS 7 -2.619 -15.005 -10.702 41 HD1 HIS 7 HD1 HIS 7 -1.538 -15.586 -8.414 42 HD2 HIS 7 HD2 HIS 7 -0.238 -17.947 -11.575 43 HE1 HIS 7 HE1 HIS 7 0.507 -16.779 -7.565 44 H HIS 8 H HIS 8 -4.170 -17.996 -13.053 45 HA HIS 8 HA HIS 8 -3.461 -20.652 -12.015 46 HB2 HIS 8 HB2 HIS 8 -5.061 -19.873 -14.461 47 HB3 HIS 8 HB3 HIS 8 -4.693 -21.527 -13.984 48 HD1 HIS 8 HD1 HIS 8 -7.563 -19.959 -14.159 49 HD2 HIS 8 HD2 HIS 8 -5.484 -21.163 -10.770 50 HE1 HIS 8 HE1 HIS 8 -9.292 -20.154 -12.343 51 H HIS 9 H HIS 9 -2.273 -22.107 -13.438 52 HA HIS 9 HA HIS 9 -0.910 -21.190 -15.741 53 HB2 HIS 9 HB2 HIS 9 1.391 -21.144 -14.773 54 HB3 HIS 9 HB3 HIS 9 0.368 -19.821 -14.219 55 HD1 HIS 9 HD1 HIS 9 2.240 -19.802 -12.246 56 HD2 HIS 9 HD2 HIS 9 -0.421 -22.992 -12.282 57 HE1 HIS 9 HE1 HIS 9 2.370 -20.812 -9.946 58 H HIS 10 H HIS 10 1.219 -22.721 -15.970 59 HA HIS 10 HA HIS 10 0.410 -25.429 -15.150 60 HB2 HIS 10 HB2 HIS 10 -0.133 -24.795 -17.587 61 HB3 HIS 10 HB3 HIS 10 1.606 -24.860 -17.853 62 HD1 HIS 10 HD1 HIS 10 1.401 -26.889 -19.426 63 HD2 HIS 10 HD2 HIS 10 -0.053 -27.571 -15.594 64 HE1 HIS 10 HE1 HIS 10 1.075 -29.378 -19.263 65 H GLY 11 H GLY 11 1.996 -25.314 -13.496 66 HA2 GLY 11 HA2 GLY 11 4.478 -26.418 -14.142 67 HA3 GLY 11 HA3 GLY 11 4.711 -24.686 -13.959 68 H SER 12 H SER 12 6.092 -25.131 -12.166 69 HA SER 12 HA SER 12 6.601 -25.408 -9.963 70 HB2 SER 12 HB2 SER 12 3.719 -24.522 -9.729 71 HB3 SER 12 HB3 SER 12 4.813 -24.667 -8.353 72 HG SER 12 HG SER 12 5.628 -22.814 -8.879 73 H MET 13 H MET 13 5.898 -27.771 -11.332 74 HA MET 13 HA MET 13 5.498 -29.526 -9.152 75 HB2 MET 13 HB2 MET 13 3.119 -28.602 -10.448 76 HB3 MET 13 HB3 MET 13 3.325 -30.313 -10.796 77 HG2 MET 13 HG2 MET 13 3.850 -30.210 -8.121 78 HG3 MET 13 HG3 MET 13 2.610 -28.972 -8.306 79 HE1 MET 13 HE1 MET 13 0.303 -29.407 -9.505 80 HE2 MET 13 HE2 MET 13 0.993 -30.274 -10.877 81 HE3 MET 13 HE3 MET 13 -0.314 -31.000 -9.942 82 H SER 14 H SER 14 6.359 -31.468 -9.622 83 HA SER 14 HA SER 14 7.007 -31.999 -12.444 84 HB2 SER 14 HB2 SER 14 8.826 -33.476 -11.460 85 HB3 SER 14 HB3 SER 14 9.028 -31.743 -11.203 86 HG SER 14 HG SER 14 9.359 -32.625 -9.238 87 H GLU 15 H GLU 15 6.875 -34.069 -9.555 88 HA GLU 15 HA GLU 15 5.030 -35.840 -11.021 89 HB2 GLU 15 HB2 GLU 15 7.625 -36.426 -10.153 90 HB3 GLU 15 HB3 GLU 15 6.569 -37.211 -8.987 91 HG2 GLU 15 HG2 GLU 15 6.658 -38.888 -10.481 92 HG3 GLU 15 HG3 GLU 15 5.357 -37.974 -11.242 93 H TYR 16 H TYR 16 4.400 -37.617 -9.064 94 HA TYR 16 HA TYR 16 3.354 -36.010 -6.839 95 HB2 TYR 16 HB2 TYR 16 1.228 -37.475 -7.094 96 HB3 TYR 16 HB3 TYR 16 1.442 -36.101 -8.173 97 HD1 TYR 16 HD1 TYR 16 1.265 -36.412 -10.469 98 HD2 TYR 16 HD2 TYR 16 2.057 -39.775 -7.986 99 HE1 TYR 16 HE1 TYR 16 1.024 -37.897 -12.414 100 HE2 TYR 16 HE2 TYR 16 1.819 -41.269 -9.924 101 HH TYR 16 HH TYR 16 2.130 -40.640 -12.782 102 H ILE 17 H ILE 17 2.127 -37.704 -5.298 103 HA ILE 17 HA ILE 17 3.994 -39.951 -4.900 104 HB ILE 17 HB ILE 17 4.430 -38.412 -3.149 105 HG12 ILE 17 HG12 ILE 17 2.499 -40.468 -2.054 106 HG13 ILE 17 HG13 ILE 17 4.178 -40.790 -2.476 107 HG21 ILE 17 HG21 ILE 17 2.055 -38.079 -1.723 108 HG22 ILE 17 HG22 ILE 17 2.912 -36.863 -2.669 109 HG23 ILE 17 HG23 ILE 17 1.627 -37.813 -3.413 110 HD11 ILE 17 HD11 ILE 17 3.084 -39.157 -0.226 111 HD12 ILE 17 HD12 ILE 17 4.231 -40.497 -0.181 112 HD13 ILE 17 HD13 ILE 17 4.734 -38.925 -0.802 113 H ARG 18 H ARG 18 3.095 -41.894 -4.979 114 HA ARG 18 HA ARG 18 0.193 -42.116 -4.521 115 HB2 ARG 18 HB2 ARG 18 1.986 -43.252 -6.558 116 HB3 ARG 18 HB3 ARG 18 0.861 -44.405 -5.855 117 HG2 ARG 18 HG2 ARG 18 -0.818 -42.366 -6.349 118 HG3 ARG 18 HG3 ARG 18 0.364 -42.115 -7.635 119 HD2 ARG 18 HD2 ARG 18 -0.414 -44.907 -7.312 120 HD3 ARG 18 HD3 ARG 18 -1.768 -43.852 -7.714 121 HE ARG 18 HE ARG 18 0.504 -43.394 -9.384 122 HH11 ARG 18 HH11 ARG 18 -2.258 -45.453 -8.885 123 HH12 ARG 18 HH12 ARG 18 -2.370 -45.925 -10.549 124 HH21 ARG 18 HH21 ARG 18 0.366 -44.007 -11.577 125 HH22 ARG 18 HH22 ARG 18 -0.877 -45.103 -12.079 126 H VAL 19 H VAL 19 -0.063 -42.777 -2.472 127 HA VAL 19 HA VAL 19 1.072 -45.346 -1.715 128 HB VAL 19 HB VAL 19 1.638 -44.382 0.589 129 HG11 VAL 19 HG11 VAL 19 3.359 -43.581 -1.755 130 HG12 VAL 19 HG12 VAL 19 3.898 -43.820 -0.092 131 HG13 VAL 19 HG13 VAL 19 3.302 -45.188 -1.032 132 HG21 VAL 19 HG21 VAL 19 0.611 -42.070 -0.497 133 HG22 VAL 19 HG22 VAL 19 1.588 -42.179 0.967 134 HG23 VAL 19 HG23 VAL 19 2.354 -41.812 -0.578 135 H THR 20 H THR 20 -0.007 -46.328 0.089 136 HA THR 20 HA THR 20 -2.616 -45.112 0.721 137 HB THR 20 HB THR 20 -3.249 -46.843 -0.706 138 HG1 THR 20 HG1 THR 20 -3.830 -48.630 0.911 139 HG21 THR 20 HG21 THR 20 -1.601 -48.243 -1.310 140 HG22 THR 20 HG22 THR 20 -2.128 -49.232 0.051 141 HG23 THR 20 HG23 THR 20 -0.789 -48.102 0.249 142 H GLU 21 H GLU 21 -3.448 -45.482 2.788 143 HA GLU 21 HA GLU 21 -1.469 -45.862 4.826 144 HB2 GLU 21 HB2 GLU 21 -3.544 -44.300 4.837 145 HB3 GLU 21 HB3 GLU 21 -4.424 -45.734 5.347 146 HG2 GLU 21 HG2 GLU 21 -2.127 -45.557 6.971 147 HG3 GLU 21 HG3 GLU 21 -2.842 -43.947 6.901 148 H ASP 22 H ASP 22 -4.346 -47.647 3.761 149 HA ASP 22 HA ASP 22 -3.525 -49.901 5.457 150 HB2 ASP 22 HB2 ASP 22 -6.108 -48.830 4.594 151 HB3 ASP 22 HB3 ASP 22 -5.980 -50.576 4.392 152 H GLU 23 H GLU 23 -3.178 -51.934 4.614 153 HA GLU 23 HA GLU 23 -2.151 -52.087 1.996 154 HB2 GLU 23 HB2 GLU 23 -2.010 -54.525 2.420 155 HB3 GLU 23 HB3 GLU 23 -1.336 -53.563 3.728 156 HG2 GLU 23 HG2 GLU 23 -2.587 -54.745 5.116 157 HG3 GLU 23 HG3 GLU 23 -3.992 -53.925 4.438 158 H ASN 24 H ASN 24 -5.284 -52.876 3.361 159 HA ASN 24 HA ASN 24 -6.257 -54.248 1.051 160 HB2 ASN 24 HB2 ASN 24 -7.112 -53.947 3.669 161 HB3 ASN 24 HB3 ASN 24 -8.307 -53.042 2.744 162 HD21 ASN 24 HD21 ASN 24 -8.249 -55.708 4.206 163 HD22 ASN 24 HD22 ASN 24 -8.945 -56.811 3.074 164 H ASP 25 H ASP 25 -6.108 -50.934 2.075 165 HA ASP 25 HA ASP 25 -8.063 -49.982 0.191 166 HB2 ASP 25 HB2 ASP 25 -7.230 -48.920 2.457 167 HB3 ASP 25 HB3 ASP 25 -6.011 -48.186 1.419 168 H GLU 26 H GLU 26 -7.664 -48.740 -1.672 169 HA GLU 26 HA GLU 26 -5.417 -49.620 -3.203 170 HB2 GLU 26 HB2 GLU 26 -7.872 -48.062 -3.681 171 HB3 GLU 26 HB3 GLU 26 -6.507 -47.616 -4.696 172 HG2 GLU 26 HG2 GLU 26 -6.743 -49.422 -5.957 173 HG3 GLU 26 HG3 GLU 26 -6.818 -50.482 -4.551 174 HA PRO 27 HA PRO 27 -2.511 -46.413 -2.472 175 HB2 PRO 27 HB2 PRO 27 -1.321 -46.215 -4.904 176 HB3 PRO 27 HB3 PRO 27 -1.062 -47.584 -3.817 177 HG2 PRO 27 HG2 PRO 27 -2.877 -47.365 -6.187 178 HG3 PRO 27 HG3 PRO 27 -1.820 -48.705 -5.707 179 HD2 PRO 27 HD2 PRO 27 -4.486 -48.710 -5.233 180 HD3 PRO 27 HD3 PRO 27 -3.322 -49.497 -4.148 181 H ILE 28 H ILE 28 -3.532 -44.496 -2.089 182 HA ILE 28 HA ILE 28 -4.881 -43.038 -4.169 183 HB ILE 28 HB ILE 28 -5.683 -42.897 -1.868 184 HG12 ILE 28 HG12 ILE 28 -5.834 -40.420 -1.700 185 HG13 ILE 28 HG13 ILE 28 -4.585 -40.285 -2.933 186 HG21 ILE 28 HG21 ILE 28 -4.343 -41.531 -0.230 187 HG22 ILE 28 HG22 ILE 28 -3.696 -43.129 -0.597 188 HG23 ILE 28 HG23 ILE 28 -2.976 -41.697 -1.332 189 HD11 ILE 28 HD11 ILE 28 -6.837 -41.956 -3.729 190 HD12 ILE 28 HD12 ILE 28 -7.270 -40.281 -3.388 191 HD13 ILE 28 HD13 ILE 28 -6.030 -40.644 -4.588 192 H GLU 29 H GLU 29 -4.220 -41.195 -5.212 193 HA GLU 29 HA GLU 29 -1.348 -40.604 -5.031 194 HB2 GLU 29 HB2 GLU 29 -1.441 -39.846 -7.283 195 HB3 GLU 29 HB3 GLU 29 -2.326 -41.364 -7.228 196 HG2 GLU 29 HG2 GLU 29 -3.852 -40.213 -8.396 197 HG3 GLU 29 HG3 GLU 29 -4.340 -39.635 -6.804 198 H ILE 30 H ILE 30 -0.625 -38.626 -4.488 199 HA ILE 30 HA ILE 30 -2.609 -36.469 -4.190 200 HB ILE 30 HB ILE 30 -0.589 -35.989 -2.303 201 HG12 ILE 30 HG12 ILE 30 -1.679 -38.788 -1.972 202 HG13 ILE 30 HG13 ILE 30 -0.061 -38.440 -2.573 203 HG21 ILE 30 HG21 ILE 30 -2.640 -36.745 -0.770 204 HG22 ILE 30 HG22 ILE 30 -2.620 -35.220 -1.654 205 HG23 ILE 30 HG23 ILE 30 -3.481 -36.611 -2.315 206 HD11 ILE 30 HD11 ILE 30 -1.171 -38.171 0.163 207 HD12 ILE 30 HD12 ILE 30 0.390 -38.791 -0.374 208 HD13 ILE 30 HD13 ILE 30 0.096 -37.053 -0.343 209 HA PRO 31 HA PRO 31 0.148 -33.963 -6.524 210 HB2 PRO 31 HB2 PRO 31 -0.524 -31.510 -5.575 211 HB3 PRO 31 HB3 PRO 31 -1.568 -32.441 -6.656 212 HG2 PRO 31 HG2 PRO 31 -1.707 -32.143 -3.680 213 HG3 PRO 31 HG3 PRO 31 -3.021 -32.115 -4.870 214 HD2 PRO 31 HD2 PRO 31 -2.456 -34.301 -3.377 215 HD3 PRO 31 HD3 PRO 31 -3.097 -34.413 -5.029 216 H SER 32 H SER 32 2.270 -34.057 -6.106 217 HA SER 32 HA SER 32 3.279 -33.200 -3.500 218 HB2 SER 32 HB2 SER 32 5.135 -34.513 -3.883 219 HB3 SER 32 HB3 SER 32 3.947 -35.378 -4.859 220 HG SER 32 HG SER 32 4.734 -33.944 -6.622 221 H GLU 33 H GLU 33 5.714 -32.266 -3.909 222 HA GLU 33 HA GLU 33 5.227 -29.714 -5.213 223 HB2 GLU 33 HB2 GLU 33 6.804 -30.627 -3.001 224 HB3 GLU 33 HB3 GLU 33 7.855 -29.823 -4.158 225 HG2 GLU 33 HG2 GLU 33 5.314 -28.478 -3.439 226 HG3 GLU 33 HG3 GLU 33 6.602 -28.512 -2.236 227 H ASP 34 H ASP 34 7.157 -28.732 -6.402 228 HA ASP 34 HA ASP 34 7.712 -30.355 -8.670 229 HB2 ASP 34 HB2 ASP 34 7.504 -28.054 -9.115 230 HB3 ASP 34 HB3 ASP 34 8.592 -27.611 -7.803 231 H ASP 35 H ASP 35 9.551 -29.391 -5.835 232 HA ASP 35 HA ASP 35 12.087 -30.252 -6.702 233 HB2 ASP 35 HB2 ASP 35 11.204 -28.926 -4.522 234 HB3 ASP 35 HB3 ASP 35 11.450 -30.523 -3.821 235 H GLY 36 H GLY 36 9.303 -31.990 -5.699 236 HA2 GLY 36 HA2 GLY 36 9.314 -34.371 -6.340 237 HA3 GLY 36 HA3 GLY 36 10.911 -34.469 -5.613 238 H THR 37 H THR 37 10.121 -32.782 -3.332 239 HA THR 37 HA THR 37 9.225 -34.863 -1.612 240 HB THR 37 HB THR 37 9.348 -33.252 0.178 241 HG1 THR 37 HG1 THR 37 8.369 -31.463 -0.794 242 HG21 THR 37 HG21 THR 37 11.600 -33.028 0.144 243 HG22 THR 37 HG22 THR 37 11.603 -32.238 -1.433 244 HG23 THR 37 HG23 THR 37 11.465 -33.992 -1.326 245 H VAL 38 H VAL 38 7.495 -33.793 0.162 246 HA VAL 38 HA VAL 38 5.128 -32.955 -1.355 247 HB VAL 38 HB VAL 38 5.241 -35.315 0.523 248 HG11 VAL 38 HG11 VAL 38 3.184 -34.705 1.157 249 HG12 VAL 38 HG12 VAL 38 3.041 -33.516 -0.139 250 HG13 VAL 38 HG13 VAL 38 2.681 -35.214 -0.455 251 HG21 VAL 38 HG21 VAL 38 4.136 -35.265 -2.264 252 HG22 VAL 38 HG22 VAL 38 5.857 -35.512 -1.967 253 HG23 VAL 38 HG23 VAL 38 4.677 -36.646 -1.310 254 H LEU 39 H LEU 39 3.947 -31.439 -0.352 255 HA LEU 39 HA LEU 39 4.893 -30.263 2.054 256 HB2 LEU 39 HB2 LEU 39 3.175 -29.549 -0.047 257 HB3 LEU 39 HB3 LEU 39 2.204 -29.472 1.421 258 HG LEU 39 HG LEU 39 3.150 -27.298 0.878 259 HD11 LEU 39 HD11 LEU 39 4.731 -28.179 3.242 260 HD12 LEU 39 HD12 LEU 39 2.973 -28.306 3.293 261 HD13 LEU 39 HD13 LEU 39 3.736 -26.740 3.020 262 HD21 LEU 39 HD21 LEU 39 5.419 -26.861 0.634 263 HD22 LEU 39 HD22 LEU 39 5.209 -28.385 -0.229 264 HD23 LEU 39 HD23 LEU 39 5.895 -28.379 1.396 265 H LEU 40 H LEU 40 4.230 -30.478 4.116 266 HA LEU 40 HA LEU 40 2.965 -32.742 5.036 267 HB2 LEU 40 HB2 LEU 40 4.306 -30.981 6.316 268 HB3 LEU 40 HB3 LEU 40 2.781 -30.111 6.472 269 HG LEU 40 HG LEU 40 3.423 -31.465 8.467 270 HD11 LEU 40 HD11 LEU 40 0.996 -30.933 7.503 271 HD12 LEU 40 HD12 LEU 40 1.253 -31.855 8.983 272 HD13 LEU 40 HD13 LEU 40 0.925 -32.695 7.468 273 HD21 LEU 40 HD21 LEU 40 2.504 -33.980 7.358 274 HD22 LEU 40 HD22 LEU 40 3.926 -33.631 8.342 275 HD23 LEU 40 HD23 LEU 40 3.991 -33.420 6.591 276 H SER 41 H SER 41 1.548 -29.641 4.155 277 HA SER 41 HA SER 41 -1.017 -29.981 5.170 278 HB2 SER 41 HB2 SER 41 -0.135 -27.877 4.159 279 HB3 SER 41 HB3 SER 41 -0.295 -28.616 2.566 280 HG SER 41 HG SER 41 -2.124 -27.286 3.817 281 H THR 42 H THR 42 0.444 -31.237 2.236 282 HA THR 42 HA THR 42 -1.987 -32.218 1.103 283 HB THR 42 HB THR 42 0.870 -33.019 0.515 284 HG1 THR 42 HG1 THR 42 0.820 -31.030 -0.259 285 HG21 THR 42 HG21 THR 42 -0.072 -33.806 -1.645 286 HG22 THR 42 HG22 THR 42 -1.690 -33.519 -1.005 287 HG23 THR 42 HG23 THR 42 -0.648 -34.730 -0.258 288 H VAL 43 H VAL 43 0.601 -33.641 3.049 289 HA VAL 43 HA VAL 43 -0.204 -36.314 2.930 290 HB VAL 43 HB VAL 43 1.316 -34.745 4.989 291 HG11 VAL 43 HG11 VAL 43 0.179 -37.477 5.237 292 HG12 VAL 43 HG12 VAL 43 1.815 -37.203 5.839 293 HG13 VAL 43 HG13 VAL 43 0.470 -36.255 6.475 294 HG21 VAL 43 HG21 VAL 43 2.008 -35.953 2.593 295 HG22 VAL 43 HG22 VAL 43 3.116 -35.413 3.855 296 HG23 VAL 43 HG23 VAL 43 2.563 -37.088 3.825 297 H THR 44 H THR 44 -1.013 -33.817 5.335 298 HA THR 44 HA THR 44 -2.703 -35.431 6.902 299 HB THR 44 HB THR 44 -3.625 -33.295 7.778 300 HG1 THR 44 HG1 THR 44 -1.806 -32.001 6.021 301 HG21 THR 44 HG21 THR 44 -1.817 -33.711 9.066 302 HG22 THR 44 HG22 THR 44 -1.121 -32.340 8.201 303 HG23 THR 44 HG23 THR 44 -0.765 -33.986 7.679 304 H ALA 45 H ALA 45 -3.208 -33.757 3.910 305 HA ALA 45 HA ALA 45 -5.919 -33.331 3.839 306 HB1 ALA 45 HB1 ALA 45 -4.037 -32.989 2.039 307 HB2 ALA 45 HB2 ALA 45 -4.635 -34.536 1.436 308 HB3 ALA 45 HB3 ALA 45 -5.727 -33.156 1.562 309 H GLN 46 H GLN 46 -4.212 -36.358 3.079 310 HA GLN 46 HA GLN 46 -6.796 -37.758 3.147 311 HB2 GLN 46 HB2 GLN 46 -4.310 -39.102 2.199 312 HB3 GLN 46 HB3 GLN 46 -5.971 -39.311 1.662 313 HG2 GLN 46 HG2 GLN 46 -5.880 -37.201 0.472 314 HG3 GLN 46 HG3 GLN 46 -4.239 -36.926 1.055 315 HE21 GLN 46 HE21 GLN 46 -3.073 -39.346 0.724 316 HE22 GLN 46 HE22 GLN 46 -3.026 -39.766 -0.951 317 H PHE 47 H PHE 47 -3.579 -37.657 4.532 318 HA PHE 47 HA PHE 47 -4.380 -39.749 6.445 319 HB2 PHE 47 HB2 PHE 47 -1.523 -38.944 6.020 320 HB3 PHE 47 HB3 PHE 47 -2.171 -40.474 6.602 321 HD1 PHE 47 HD1 PHE 47 -0.366 -39.244 4.069 322 HD2 PHE 47 HD2 PHE 47 -4.010 -41.366 4.649 323 HE1 PHE 47 HE1 PHE 47 -0.179 -40.179 1.801 324 HE2 PHE 47 HE2 PHE 47 -3.828 -42.305 2.383 325 HZ PHE 47 HZ PHE 47 -1.910 -41.713 0.956 326 HA PRO 48 HA PRO 48 -4.180 -35.773 8.809 327 HB2 PRO 48 HB2 PRO 48 -6.396 -36.284 10.291 328 HB3 PRO 48 HB3 PRO 48 -6.462 -35.531 8.693 329 HG2 PRO 48 HG2 PRO 48 -6.935 -38.385 9.464 330 HG3 PRO 48 HG3 PRO 48 -7.846 -37.365 8.335 331 HD2 PRO 48 HD2 PRO 48 -6.027 -39.191 7.505 332 HD3 PRO 48 HD3 PRO 48 -6.326 -37.676 6.631 333 H GLY 49 H GLY 49 -2.810 -35.754 10.472 334 HA2 GLY 49 HA2 GLY 49 -2.240 -36.218 12.728 335 HA3 GLY 49 HA3 GLY 49 -3.149 -37.719 12.621 336 H ALA 50 H ALA 50 -1.814 -38.289 9.981 337 HA ALA 50 HA ALA 50 0.217 -39.967 10.919 338 HB1 ALA 50 HB1 ALA 50 0.656 -40.499 8.671 339 HB2 ALA 50 HB2 ALA 50 -1.065 -40.117 8.730 340 HB3 ALA 50 HB3 ALA 50 0.080 -38.932 8.102 341 H CYS 51 H CYS 51 1.784 -38.971 12.121 342 HA CYS 51 HA CYS 51 3.093 -36.573 11.283 343 HB2 CYS 51 HB2 CYS 51 2.814 -37.697 13.680 344 HB3 CYS 51 HB3 CYS 51 4.369 -38.405 13.259 345 HG CYS 51 HG CYS 51 3.690 -35.384 14.370 346 H GLY 52 H GLY 52 3.777 -40.012 11.036 347 HA2 GLY 52 HA2 GLY 52 5.962 -39.362 9.178 348 HA3 GLY 52 HA3 GLY 52 6.261 -40.491 10.491 349 H LEU 53 H LEU 53 6.255 -40.776 7.499 350 HA LEU 53 HA LEU 53 4.277 -42.950 7.302 351 HB2 LEU 53 HB2 LEU 53 5.579 -41.585 4.967 352 HB3 LEU 53 HB3 LEU 53 4.135 -42.596 4.979 353 HG LEU 53 HG LEU 53 3.264 -40.480 4.672 354 HD11 LEU 53 HD11 LEU 53 3.132 -40.122 7.571 355 HD12 LEU 53 HD12 LEU 53 2.719 -41.747 7.024 356 HD13 LEU 53 HD13 LEU 53 1.840 -40.355 6.392 357 HD21 LEU 53 HD21 LEU 53 4.137 -38.480 5.423 358 HD22 LEU 53 HD22 LEU 53 5.591 -39.459 5.224 359 HD23 LEU 53 HD23 LEU 53 4.901 -39.219 6.830 360 H ARG 54 H ARG 54 4.929 -44.959 6.654 361 HA ARG 54 HA ARG 54 7.836 -45.372 6.508 362 HB2 ARG 54 HB2 ARG 54 5.841 -46.635 8.035 363 HB3 ARG 54 HB3 ARG 54 6.320 -47.807 6.814 364 HG2 ARG 54 HG2 ARG 54 8.743 -47.009 7.600 365 HG3 ARG 54 HG3 ARG 54 7.845 -46.703 9.088 366 HD2 ARG 54 HD2 ARG 54 7.111 -49.252 7.980 367 HD3 ARG 54 HD3 ARG 54 8.861 -49.149 8.171 368 HE ARG 54 HE ARG 54 6.931 -49.393 10.246 369 HH11 ARG 54 HH11 ARG 54 10.016 -47.983 9.465 370 HH12 ARG 54 HH12 ARG 54 10.568 -47.959 11.108 371 HH21 ARG 54 HH21 ARG 54 7.646 -49.368 12.412 372 HH22 ARG 54 HH22 ARG 54 9.219 -48.749 12.783 373 H TYR 55 H TYR 55 8.550 -47.215 5.126 374 HA TYR 55 HA TYR 55 7.094 -47.133 2.576 375 HB2 TYR 55 HB2 TYR 55 9.866 -46.932 3.269 376 HB3 TYR 55 HB3 TYR 55 9.637 -48.348 2.249 377 HD1 TYR 55 HD1 TYR 55 7.945 -47.830 0.184 378 HD2 TYR 55 HD2 TYR 55 10.404 -44.984 2.173 379 HE1 TYR 55 HE1 TYR 55 7.878 -46.388 -1.808 380 HE2 TYR 55 HE2 TYR 55 10.343 -43.534 0.187 381 HH TYR 55 HH TYR 55 9.084 -44.610 -2.834 382 H ARG 56 H ARG 56 6.135 -48.895 1.799 383 HA ARG 56 HA ARG 56 6.901 -51.516 2.898 384 HB2 ARG 56 HB2 ARG 56 4.870 -51.144 3.983 385 HB3 ARG 56 HB3 ARG 56 4.174 -50.306 2.602 386 HG2 ARG 56 HG2 ARG 56 3.194 -52.539 3.015 387 HG3 ARG 56 HG3 ARG 56 3.904 -52.365 1.409 388 HD2 ARG 56 HD2 ARG 56 5.971 -53.456 2.292 389 HD3 ARG 56 HD3 ARG 56 5.102 -53.764 3.795 390 HE ARG 56 HE ARG 56 3.796 -54.757 1.420 391 HH11 ARG 56 HH11 ARG 56 6.036 -55.440 3.995 392 HH12 ARG 56 HH12 ARG 56 5.854 -57.159 3.874 393 HH21 ARG 56 HH21 ARG 56 3.547 -57.018 1.250 394 HH22 ARG 56 HH22 ARG 56 4.439 -58.055 2.311 395 H ASN 57 H ASN 57 8.013 -52.288 1.172 396 HA ASN 57 HA ASN 57 6.577 -52.395 -1.400 397 HB2 ASN 57 HB2 ASN 57 9.019 -51.220 -0.944 398 HB3 ASN 57 HB3 ASN 57 9.479 -52.825 -1.507 399 HD21 ASN 57 HD21 ASN 57 10.314 -52.054 -3.426 400 HD22 ASN 57 HD22 ASN 57 9.312 -51.462 -4.704 401 HA PRO 58 HA PRO 58 6.582 -56.781 -0.931 402 HB2 PRO 58 HB2 PRO 58 6.097 -57.449 -3.517 403 HB3 PRO 58 HB3 PRO 58 4.856 -56.785 -2.448 404 HG2 PRO 58 HG2 PRO 58 6.506 -55.399 -4.526 405 HG3 PRO 58 HG3 PRO 58 4.775 -55.232 -4.177 406 HD2 PRO 58 HD2 PRO 58 6.615 -53.444 -3.310 407 HD3 PRO 58 HD3 PRO 58 5.143 -53.821 -2.392 408 H VAL 59 H VAL 59 8.556 -55.240 -3.418 409 HA VAL 59 HA VAL 59 10.225 -57.589 -3.742 410 HB VAL 59 HB VAL 59 11.533 -56.173 -5.298 411 HG11 VAL 59 HG11 VAL 59 8.581 -56.005 -5.872 412 HG12 VAL 59 HG12 VAL 59 9.902 -56.117 -7.037 413 HG13 VAL 59 HG13 VAL 59 9.522 -57.491 -5.998 414 HG21 VAL 59 HG21 VAL 59 11.456 -53.962 -5.103 415 HG22 VAL 59 HG22 VAL 59 9.787 -53.996 -5.671 416 HG23 VAL 59 HG23 VAL 59 10.132 -54.075 -3.944 417 H SER 60 H SER 60 10.278 -54.547 -2.037 418 HA SER 60 HA SER 60 13.081 -54.771 -1.346 419 HB2 SER 60 HB2 SER 60 11.631 -52.597 -1.685 420 HB3 SER 60 HB3 SER 60 11.220 -52.856 0.011 421 HG SER 60 HG SER 60 13.310 -51.638 -0.842 422 H GLN 61 H GLN 61 9.980 -55.525 0.044 423 HA GLN 61 HA GLN 61 9.375 -56.665 1.917 424 HB2 GLN 61 HB2 GLN 61 12.287 -57.369 2.262 425 HB3 GLN 61 HB3 GLN 61 10.888 -58.258 2.848 426 HG2 GLN 61 HG2 GLN 61 10.555 -58.087 0.081 427 HG3 GLN 61 HG3 GLN 61 12.260 -58.453 0.334 428 HE21 GLN 61 HE21 GLN 61 12.563 -60.169 2.140 429 HE22 GLN 61 HE22 GLN 61 11.567 -61.571 1.984 430 H CYS 62 H CYS 62 10.035 -53.889 2.100 431 HA CYS 62 HA CYS 62 10.195 -52.275 3.695 432 HB2 CYS 62 HB2 CYS 62 8.891 -54.106 4.998 433 HB3 CYS 62 HB3 CYS 62 10.419 -54.384 5.823 434 HG CYS 62 HG CYS 62 10.271 -51.296 6.149 435 H MET 63 H MET 63 11.830 -51.089 4.596 436 HA MET 63 HA MET 63 14.131 -52.085 5.821 437 HB2 MET 63 HB2 MET 63 14.169 -52.267 2.945 438 HB3 MET 63 HB3 MET 63 15.409 -51.149 3.495 439 HG2 MET 63 HG2 MET 63 15.440 -53.479 5.145 440 HG3 MET 63 HG3 MET 63 15.494 -53.956 3.449 441 HE1 MET 63 HE1 MET 63 19.167 -54.323 3.752 442 HE2 MET 63 HE2 MET 63 17.586 -55.094 3.879 443 HE3 MET 63 HE3 MET 63 18.052 -54.277 2.386 444 H ARG 64 H ARG 64 13.051 -49.576 3.545 445 HA ARG 64 HA ARG 64 14.317 -47.566 5.287 446 HB2 ARG 64 HB2 ARG 64 14.202 -46.075 3.267 447 HB3 ARG 64 HB3 ARG 64 15.281 -47.454 3.106 448 HG2 ARG 64 HG2 ARG 64 14.076 -48.371 1.449 449 HG3 ARG 64 HG3 ARG 64 12.534 -47.907 2.172 450 HD2 ARG 64 HD2 ARG 64 12.461 -46.470 0.436 451 HD3 ARG 64 HD3 ARG 64 13.478 -45.483 1.485 452 HE ARG 64 HE ARG 64 15.160 -45.739 -0.027 453 HH11 ARG 64 HH11 ARG 64 12.902 -48.356 -0.441 454 HH12 ARG 64 HH12 ARG 64 13.720 -49.016 -1.818 455 HH21 ARG 64 HH21 ARG 64 16.246 -46.598 -1.839 456 HH22 ARG 64 HH22 ARG 64 15.622 -48.016 -2.612 457 H GLY 65 H GLY 65 13.118 -45.309 4.810 458 HA2 GLY 65 HA2 GLY 65 10.226 -45.644 4.719 459 HA3 GLY 65 HA3 GLY 65 10.890 -45.092 6.250 460 H VAL 66 H VAL 66 9.078 -43.745 4.357 461 HA VAL 66 HA VAL 66 10.253 -41.789 2.812 462 HB VAL 66 HB VAL 66 7.771 -41.533 4.516 463 HG11 VAL 66 HG11 VAL 66 8.676 -39.869 2.167 464 HG12 VAL 66 HG12 VAL 66 7.130 -39.723 3.006 465 HG13 VAL 66 HG13 VAL 66 8.632 -39.345 3.850 466 HG21 VAL 66 HG21 VAL 66 8.370 -42.843 1.961 467 HG22 VAL 66 HG22 VAL 66 7.053 -43.124 3.100 468 HG23 VAL 66 HG23 VAL 66 6.946 -41.802 1.938 469 H ARG 67 H ARG 67 11.462 -40.047 3.192 470 HA ARG 67 HA ARG 67 12.293 -39.435 5.869 471 HB2 ARG 67 HB2 ARG 67 13.921 -39.299 4.097 472 HB3 ARG 67 HB3 ARG 67 12.925 -38.154 3.208 473 HG2 ARG 67 HG2 ARG 67 14.726 -36.972 4.245 474 HG3 ARG 67 HG3 ARG 67 13.221 -36.533 5.057 475 HD2 ARG 67 HD2 ARG 67 14.023 -38.654 6.547 476 HD3 ARG 67 HD3 ARG 67 15.576 -37.968 6.074 477 HE ARG 67 HE ARG 67 13.783 -35.976 7.045 478 HH11 ARG 67 HH11 ARG 67 15.975 -38.494 8.034 479 HH12 ARG 67 HH12 ARG 67 16.311 -37.775 9.574 480 HH21 ARG 67 HH21 ARG 67 14.218 -35.020 9.070 481 HH22 ARG 67 HH22 ARG 67 15.311 -35.800 10.163 482 H LEU 68 H LEU 68 11.848 -37.639 7.089 483 HA LEU 68 HA LEU 68 9.839 -35.768 6.030 484 HB2 LEU 68 HB2 LEU 68 8.677 -37.288 7.475 485 HB3 LEU 68 HB3 LEU 68 9.894 -37.094 8.734 486 HG LEU 68 HG LEU 68 7.591 -35.913 8.960 487 HD11 LEU 68 HD11 LEU 68 9.734 -33.954 9.440 488 HD12 LEU 68 HD12 LEU 68 9.994 -35.557 10.125 489 HD13 LEU 68 HD13 LEU 68 8.549 -34.641 10.550 490 HD21 LEU 68 HD21 LEU 68 8.138 -34.868 6.572 491 HD22 LEU 68 HD22 LEU 68 8.892 -33.634 7.582 492 HD23 LEU 68 HD23 LEU 68 7.181 -34.015 7.783 493 H VAL 69 H VAL 69 10.629 -33.780 6.011 494 HA VAL 69 HA VAL 69 12.281 -32.881 8.265 495 HB VAL 69 HB VAL 69 13.911 -33.350 6.589 496 HG11 VAL 69 HG11 VAL 69 13.228 -33.490 4.473 497 HG12 VAL 69 HG12 VAL 69 11.820 -32.473 4.785 498 HG13 VAL 69 HG13 VAL 69 13.376 -31.734 4.402 499 HG21 VAL 69 HG21 VAL 69 14.923 -31.212 6.279 500 HG22 VAL 69 HG22 VAL 69 13.366 -30.392 6.397 501 HG23 VAL 69 HG23 VAL 69 14.063 -31.170 7.818 502 H GLU 70 H GLU 70 11.539 -31.052 9.108 503 HA GLU 70 HA GLU 70 10.322 -29.152 9.412 504 HB2 GLU 70 HB2 GLU 70 10.820 -28.682 6.470 505 HB3 GLU 70 HB3 GLU 70 10.463 -27.469 7.692 506 HG2 GLU 70 HG2 GLU 70 12.756 -28.938 8.514 507 HG3 GLU 70 HG3 GLU 70 12.979 -28.423 6.844 508 H GLY 71 H GLY 71 8.952 -31.623 8.535 509 HA2 GLY 71 HA2 GLY 71 6.641 -32.020 8.430 510 HA3 GLY 71 HA3 GLY 71 6.404 -30.369 7.879 511 H ILE 72 H ILE 72 8.541 -30.719 5.822 512 HA ILE 72 HA ILE 72 6.818 -31.732 3.747 513 HB ILE 72 HB ILE 72 9.646 -30.679 3.600 514 HG12 ILE 72 HG12 ILE 72 7.735 -29.007 2.314 515 HG13 ILE 72 HG13 ILE 72 7.122 -29.378 3.922 516 HG21 ILE 72 HG21 ILE 72 8.585 -30.359 1.117 517 HG22 ILE 72 HG22 ILE 72 9.632 -31.693 1.599 518 HG23 ILE 72 HG23 ILE 72 7.880 -31.901 1.605 519 HD11 ILE 72 HD11 ILE 72 9.348 -27.685 3.103 520 HD12 ILE 72 HD12 ILE 72 8.375 -27.657 4.575 521 HD13 ILE 72 HD13 ILE 72 9.730 -28.777 4.434 522 H LEU 73 H LEU 73 6.673 -33.823 3.306 523 HA LEU 73 HA LEU 73 8.624 -35.727 4.148 524 HB2 LEU 73 HB2 LEU 73 6.143 -35.889 2.469 525 HB3 LEU 73 HB3 LEU 73 7.193 -37.285 2.702 526 HG LEU 73 HG LEU 73 5.329 -37.424 4.215 527 HD11 LEU 73 HD11 LEU 73 6.503 -37.593 6.333 528 HD12 LEU 73 HD12 LEU 73 7.821 -36.606 5.702 529 HD13 LEU 73 HD13 LEU 73 7.509 -38.202 5.018 530 HD21 LEU 73 HD21 LEU 73 6.164 -34.899 5.584 531 HD22 LEU 73 HD22 LEU 73 4.621 -35.752 5.650 532 HD23 LEU 73 HD23 LEU 73 5.066 -34.843 4.205 533 H HIS 74 H HIS 74 10.487 -36.115 3.169 534 HA HIS 74 HA HIS 74 10.901 -35.320 0.412 535 HB2 HIS 74 HB2 HIS 74 12.532 -35.457 2.669 536 HB3 HIS 74 HB3 HIS 74 13.111 -36.759 1.634 537 HD1 HIS 74 HD1 HIS 74 13.315 -35.776 -1.051 538 HD2 HIS 74 HD2 HIS 74 13.878 -33.187 2.149 539 HE1 HIS 74 HE1 HIS 74 14.622 -33.837 -1.977 540 H ALA 75 H ALA 75 11.616 -36.716 -1.244 541 HA ALA 75 HA ALA 75 10.609 -39.447 -0.959 542 HB1 ALA 75 HB1 ALA 75 11.121 -37.653 -3.294 543 HB2 ALA 75 HB2 ALA 75 11.012 -39.399 -3.523 544 HB3 ALA 75 HB3 ALA 75 9.648 -38.512 -2.842 545 HA PRO 76 HA PRO 76 14.570 -41.342 -0.947 546 HB2 PRO 76 HB2 PRO 76 14.055 -43.636 -2.304 547 HB3 PRO 76 HB3 PRO 76 13.478 -43.342 -0.659 548 HG2 PRO 76 HG2 PRO 76 12.016 -43.069 -3.257 549 HG3 PRO 76 HG3 PRO 76 11.457 -43.771 -1.727 550 HD2 PRO 76 HD2 PRO 76 10.783 -41.269 -2.514 551 HD3 PRO 76 HD3 PRO 76 10.990 -41.710 -0.807 552 H ASP 77 H ASP 77 15.988 -42.737 -2.618 553 HA ASP 77 HA ASP 77 16.607 -40.906 -4.748 554 HB2 ASP 77 HB2 ASP 77 17.922 -43.128 -3.390 555 HB3 ASP 77 HB3 ASP 77 18.188 -43.152 -5.131 556 H ALA 78 H ALA 78 14.379 -43.305 -4.481 557 HA ALA 78 HA ALA 78 14.586 -44.065 -7.319 558 HB1 ALA 78 HB1 ALA 78 14.279 -45.672 -5.084 559 HB2 ALA 78 HB2 ALA 78 12.662 -45.595 -5.785 560 HB3 ALA 78 HB3 ALA 78 14.023 -46.146 -6.763 561 H GLY 79 H GLY 79 12.644 -42.467 -4.942 562 HA2 GLY 79 HA2 GLY 79 11.079 -40.790 -5.794 563 HA3 GLY 79 HA3 GLY 79 10.610 -41.956 -7.022 564 H TRP 80 H TRP 80 8.545 -40.974 -5.820 565 HA TRP 80 HA TRP 80 7.807 -42.104 -3.339 566 HB2 TRP 80 HB2 TRP 80 6.165 -40.962 -5.602 567 HB3 TRP 80 HB3 TRP 80 5.462 -41.498 -4.079 568 HD1 TRP 80 HD1 TRP 80 6.572 -38.448 -5.664 569 HE1 TRP 80 HE1 TRP 80 7.105 -36.612 -3.940 570 HE3 TRP 80 HE3 TRP 80 6.792 -41.333 -1.449 571 HZ2 TRP 80 HZ2 TRP 80 7.559 -36.414 -1.161 572 HZ3 TRP 80 HZ3 TRP 80 7.281 -40.243 0.702 573 HH2 TRP 80 HH2 TRP 80 7.657 -37.834 0.841 574 H GLY 81 H GLY 81 6.691 -42.940 -6.631 575 HA2 GLY 81 HA2 GLY 81 6.351 -45.068 -7.519 576 HA3 GLY 81 HA3 GLY 81 6.736 -45.758 -5.950 577 H ASN 82 H ASN 82 4.881 -47.161 -6.510 578 HA ASN 82 HA ASN 82 2.365 -45.894 -5.653 579 HB2 ASN 82 HB2 ASN 82 2.329 -48.240 -7.514 580 HB3 ASN 82 HB3 ASN 82 1.117 -46.984 -7.279 581 HD21 ASN 82 HD21 ASN 82 1.692 -44.811 -8.034 582 HD22 ASN 82 HD22 ASN 82 2.658 -44.666 -9.459 583 H LEU 83 H LEU 83 4.332 -47.230 -4.035 584 HA LEU 83 HA LEU 83 3.193 -49.836 -3.429 585 HB2 LEU 83 HB2 LEU 83 4.991 -49.788 -1.620 586 HB3 LEU 83 HB3 LEU 83 5.515 -49.866 -3.301 587 HG LEU 83 HG LEU 83 6.771 -48.314 -1.672 588 HD11 LEU 83 HD11 LEU 83 7.623 -47.506 -3.553 589 HD12 LEU 83 HD12 LEU 83 6.163 -46.571 -3.871 590 HD13 LEU 83 HD13 LEU 83 6.278 -48.241 -4.426 591 HD21 LEU 83 HD21 LEU 83 4.665 -47.298 -0.781 592 HD22 LEU 83 HD22 LEU 83 4.462 -46.497 -2.339 593 HD23 LEU 83 HD23 LEU 83 5.867 -46.133 -1.336 594 H VAL 84 H VAL 84 3.287 -50.143 -0.806 595 HA VAL 84 HA VAL 84 1.189 -48.348 0.149 596 HB VAL 84 HB VAL 84 2.188 -50.813 1.560 597 HG11 VAL 84 HG11 VAL 84 -0.477 -50.625 2.022 598 HG12 VAL 84 HG12 VAL 84 0.766 -49.943 3.071 599 HG13 VAL 84 HG13 VAL 84 -0.039 -48.924 1.878 600 HG21 VAL 84 HG21 VAL 84 -0.023 -51.720 0.371 601 HG22 VAL 84 HG22 VAL 84 0.505 -50.579 -0.866 602 HG23 VAL 84 HG23 VAL 84 1.579 -51.880 -0.350 603 H TYR 85 H TYR 85 1.242 -47.566 2.371 604 HA TYR 85 HA TYR 85 3.945 -47.257 3.476 605 HB2 TYR 85 HB2 TYR 85 3.938 -44.992 3.395 606 HB3 TYR 85 HB3 TYR 85 2.805 -45.242 2.072 607 HD1 TYR 85 HD1 TYR 85 0.544 -44.544 2.247 608 HD2 TYR 85 HD2 TYR 85 3.065 -44.440 5.673 609 HE1 TYR 85 HE1 TYR 85 -1.159 -43.242 3.453 610 HE2 TYR 85 HE2 TYR 85 1.368 -43.139 6.889 611 HH TYR 85 HH TYR 85 -1.823 -42.709 5.696 612 H VAL 86 H VAL 86 4.053 -46.969 5.712 613 HA VAL 86 HA VAL 86 1.572 -47.658 7.139 614 HB VAL 86 HB VAL 86 4.425 -48.038 8.058 615 HG11 VAL 86 HG11 VAL 86 3.487 -49.316 9.876 616 HG12 VAL 86 HG12 VAL 86 2.766 -47.705 9.865 617 HG13 VAL 86 HG13 VAL 86 1.857 -49.083 9.244 618 HG21 VAL 86 HG21 VAL 86 4.418 -49.792 6.677 619 HG22 VAL 86 HG22 VAL 86 3.267 -50.526 7.793 620 HG23 VAL 86 HG23 VAL 86 2.686 -49.653 6.375 621 H VAL 87 H VAL 87 0.728 -46.268 8.554 622 HA VAL 87 HA VAL 87 1.856 -43.664 8.873 623 HB VAL 87 HB VAL 87 -0.055 -43.325 10.483 624 HG11 VAL 87 HG11 VAL 87 -0.610 -44.318 7.693 625 HG12 VAL 87 HG12 VAL 87 -1.799 -43.484 8.695 626 HG13 VAL 87 HG13 VAL 87 -0.320 -42.656 8.206 627 HG21 VAL 87 HG21 VAL 87 -1.219 -45.046 11.273 628 HG22 VAL 87 HG22 VAL 87 -1.556 -45.628 9.643 629 HG23 VAL 87 HG23 VAL 87 -0.081 -46.128 10.470 630 H ASN 88 H ASN 88 2.747 -42.708 10.678 631 HA ASN 88 HA ASN 88 3.137 -44.302 13.085 632 HB2 ASN 88 HB2 ASN 88 5.565 -43.003 11.902 633 HB3 ASN 88 HB3 ASN 88 5.463 -44.332 13.053 634 HD21 ASN 88 HD21 ASN 88 5.791 -43.448 9.810 635 HD22 ASN 88 HD22 ASN 88 5.705 -45.028 9.115 636 H TYR 89 H TYR 89 3.559 -43.086 14.931 637 HA TYR 89 HA TYR 89 4.249 -40.369 14.975 638 HB2 TYR 89 HB2 TYR 89 1.830 -39.691 15.843 639 HB3 TYR 89 HB3 TYR 89 2.262 -39.591 14.139 640 HD1 TYR 89 HD1 TYR 89 0.386 -40.093 12.884 641 HD2 TYR 89 HD2 TYR 89 1.272 -42.479 16.293 642 HE1 TYR 89 HE1 TYR 89 -1.486 -41.584 12.319 643 HE2 TYR 89 HE2 TYR 89 -0.597 -43.978 15.737 644 HH TYR 89 HH TYR 89 -2.963 -43.482 14.221 645 HA PRO 90 HA PRO 90 4.682 -41.211 19.258 646 HB2 PRO 90 HB2 PRO 90 4.218 -38.786 20.387 647 HB3 PRO 90 HB3 PRO 90 5.682 -39.153 19.467 648 HG2 PRO 90 HG2 PRO 90 3.206 -37.715 18.592 649 HG3 PRO 90 HG3 PRO 90 4.904 -37.314 18.274 650 HD2 PRO 90 HD2 PRO 90 3.332 -38.550 16.448 651 HD3 PRO 90 HD3 PRO 90 5.077 -38.851 16.565 652 H LYS 91 H LYS 91 3.568 -40.711 21.473 653 HA LYS 91 HA LYS 91 0.676 -40.492 21.288 654 HB2 LYS 91 HB2 LYS 91 1.216 -42.908 20.910 655 HB3 LYS 91 HB3 LYS 91 1.951 -42.946 22.507 656 HG2 LYS 91 HG2 LYS 91 -0.479 -41.936 23.110 657 HG3 LYS 91 HG3 LYS 91 -0.880 -42.955 21.726 658 HD2 LYS 91 HD2 LYS 91 0.904 -44.388 23.425 659 HD3 LYS 91 HD3 LYS 91 -0.406 -43.734 24.410 660 HE2 LYS 91 HE2 LYS 91 -1.964 -44.663 22.593 661 HE3 LYS 91 HE3 LYS 91 -0.565 -45.593 22.058 662 HZ1 LYS 91 HZ1 LYS 91 -1.455 -47.060 23.517 663 HZ2 LYS 91 HZ2 LYS 91 -2.164 -45.869 24.486 664 HZ3 LYS 91 HZ3 LYS 91 -0.507 -46.188 24.614 665 H ASP 92 H ASP 92 1.535 -38.532 22.441 666 HA ASP 92 HA ASP 92 1.065 -38.817 25.236 667 HB2 ASP 92 HB2 ASP 92 3.473 -39.532 25.038 668 HB3 ASP 92 HB3 ASP 92 3.843 -37.905 24.472 669 H ASN 93 H ASN 93 -0.176 -37.115 25.616 670 HA ASN 93 HA ASN 93 -0.914 -34.964 25.743 671 HB2 ASN 93 HB2 ASN 93 1.929 -34.710 25.449 672 HB3 ASN 93 HB3 ASN 93 1.138 -33.430 24.533 673 HD21 ASN 93 HD21 ASN 93 -0.844 -32.525 25.848 674 HD22 ASN 93 HD22 ASN 93 -0.457 -32.061 27.466 675 H LYS 94 H LYS 94 1.146 -34.665 22.864 676 HA LYS 94 HA LYS 94 0.676 -34.154 20.698 677 HB2 LYS 94 HB2 LYS 94 -1.327 -36.077 21.516 678 HB3 LYS 94 HB3 LYS 94 -1.976 -34.974 20.308 679 HG2 LYS 94 HG2 LYS 94 0.694 -36.164 19.801 680 HG3 LYS 94 HG3 LYS 94 -0.723 -37.205 19.648 681 HD2 LYS 94 HD2 LYS 94 -0.881 -36.401 17.565 682 HD3 LYS 94 HD3 LYS 94 -1.499 -34.929 18.319 683 HE2 LYS 94 HE2 LYS 94 1.091 -34.414 18.552 684 HE3 LYS 94 HE3 LYS 94 1.182 -35.507 17.172 685 HZ1 LYS 94 HZ1 LYS 94 -0.761 -33.301 17.143 686 HZ2 LYS 94 HZ2 LYS 94 0.000 -34.075 15.846 687 HZ3 LYS 94 HZ3 LYS 94 0.863 -32.976 16.800 688 H ARG 95 H ARG 95 -1.232 -33.120 19.274 689 HA ARG 95 HA ARG 95 -2.299 -31.159 18.821 690 HB2 ARG 95 HB2 ARG 95 -3.476 -31.408 21.585 691 HB3 ARG 95 HB3 ARG 95 -4.193 -30.651 20.169 692 HG2 ARG 95 HG2 ARG 95 -4.032 -33.044 19.152 693 HG3 ARG 95 HG3 ARG 95 -3.929 -33.542 20.842 694 HD2 ARG 95 HD2 ARG 95 -6.156 -33.478 20.871 695 HD3 ARG 95 HD3 ARG 95 -6.012 -31.722 20.810 696 HE ARG 95 HE ARG 95 -6.748 -31.772 18.643 697 HH11 ARG 95 HH11 ARG 95 -5.793 -34.980 19.600 698 HH12 ARG 95 HH12 ARG 95 -6.407 -35.732 18.165 699 HH21 ARG 95 HH21 ARG 95 -7.561 -32.750 16.750 700 HH22 ARG 95 HH22 ARG 95 -7.412 -34.463 16.544 701 H LYS 96 H LYS 96 -0.309 -29.970 18.864 702 HA LYS 96 HA LYS 96 -0.313 -27.925 20.946 703 HB2 LYS 96 HB2 LYS 96 1.356 -29.847 21.453 704 HB3 LYS 96 HB3 LYS 96 2.305 -29.161 20.141 705 HG2 LYS 96 HG2 LYS 96 3.199 -27.756 21.595 706 HG3 LYS 96 HG3 LYS 96 1.613 -27.005 21.788 707 HD2 LYS 96 HD2 LYS 96 1.197 -28.980 23.444 708 HD3 LYS 96 HD3 LYS 96 2.960 -29.065 23.485 709 HE2 LYS 96 HE2 LYS 96 2.521 -27.626 25.232 710 HE3 LYS 96 HE3 LYS 96 2.799 -26.500 23.904 711 HZ1 LYS 96 HZ1 LYS 96 0.060 -27.319 24.119 712 HZ2 LYS 96 HZ2 LYS 96 0.716 -25.763 24.018 713 HZ3 LYS 96 HZ3 LYS 96 0.614 -26.543 25.516 714 H MET 97 H MET 97 0.676 -25.959 20.321 715 HA MET 97 HA MET 97 0.755 -25.599 17.427 716 HB2 MET 97 HB2 MET 97 0.343 -23.814 19.774 717 HB3 MET 97 HB3 MET 97 1.034 -23.104 18.321 718 HG2 MET 97 HG2 MET 97 -0.869 -23.556 17.051 719 HG3 MET 97 HG3 MET 97 -1.476 -24.730 18.216 720 HE1 MET 97 HE1 MET 97 -4.272 -22.993 18.956 721 HE2 MET 97 HE2 MET 97 -3.867 -21.949 17.594 722 HE3 MET 97 HE3 MET 97 -3.500 -23.674 17.524 723 H ASP 98 H ASP 98 2.674 -24.357 20.170 724 HA ASP 98 HA ASP 98 4.901 -23.959 20.411 725 HB2 ASP 98 HB2 ASP 98 4.966 -26.412 19.727 726 HB3 ASP 98 HB3 ASP 98 5.359 -25.850 18.105 727 H GLU 99 H GLU 99 3.790 -21.942 19.218 728 HA GLU 99 HA GLU 99 4.696 -21.363 16.588 729 HB2 GLU 99 HB2 GLU 99 3.836 -19.162 16.940 730 HB3 GLU 99 HB3 GLU 99 2.732 -20.287 17.720 731 HG2 GLU 99 HG2 GLU 99 2.884 -18.742 19.364 732 HG3 GLU 99 HG3 GLU 99 4.254 -19.755 19.816 733 H THR 100 H THR 100 6.169 -19.585 16.029 734 HA THR 100 HA THR 100 8.241 -19.000 17.999 735 HB THR 100 HB THR 100 9.032 -20.059 15.290 736 HG1 THR 100 HG1 THR 100 9.666 -21.932 16.805 737 HG21 THR 100 HG21 THR 100 10.647 -19.951 17.827 738 HG22 THR 100 HG22 THR 100 10.582 -18.600 16.694 739 HG23 THR 100 HG23 THR 100 11.218 -20.160 16.172 740 H ASP 101 H ASP 101 8.791 -16.927 17.888 741 HA ASP 101 HA ASP 101 8.661 -15.544 15.304 742 HB2 ASP 101 HB2 ASP 101 7.083 -14.953 17.733 743 HB3 ASP 101 HB3 ASP 101 7.830 -13.561 16.954 744 H ALA 102 H ALA 102 10.872 -15.425 15.133 745 HA ALA 102 HA ALA 102 12.153 -13.347 16.631 746 HB1 ALA 102 HB1 ALA 102 12.280 -15.703 17.912 747 HB2 ALA 102 HB2 ALA 102 13.702 -15.846 16.878 748 HB3 ALA 102 HB3 ALA 102 13.553 -14.484 17.989 749 H SER 103 H SER 103 13.366 -12.301 15.207 750 HA SER 103 HA SER 103 15.185 -13.647 13.455 751 HB2 SER 103 HB2 SER 103 14.155 -13.464 11.429 752 HB3 SER 103 HB3 SER 103 12.696 -13.555 12.416 753 HG SER 103 HG SER 103 12.792 -11.773 10.875 754 H SER 104 H SER 104 16.912 -12.388 13.286 755 HA SER 104 HA SER 104 16.765 -9.587 12.775 756 HB2 SER 104 HB2 SER 104 17.053 -10.515 15.558 757 HB3 SER 104 HB3 SER 104 18.247 -9.320 15.051 758 HG SER 104 HG SER 104 16.653 -8.019 15.585 759 H ALA 105 H ALA 105 18.326 -9.446 11.312 760 HA ALA 105 HA ALA 105 21.017 -10.316 12.020 761 HB1 ALA 105 HB1 ALA 105 19.750 -12.147 10.718 762 HB2 ALA 105 HB2 ALA 105 19.967 -11.088 9.324 763 HB3 ALA 105 HB3 ALA 105 21.374 -11.703 10.191 764 H VAL 106 H VAL 106 20.933 -7.880 12.164 765 HA VAL 106 HA VAL 106 21.295 -6.643 9.516 766 HB VAL 106 HB VAL 106 20.734 -5.281 12.154 767 HG11 VAL 106 HG11 VAL 106 21.656 -3.542 11.068 768 HG12 VAL 106 HG12 VAL 106 21.499 -4.313 9.489 769 HG13 VAL 106 HG13 VAL 106 20.116 -3.491 10.212 770 HG21 VAL 106 HG21 VAL 106 18.504 -4.939 11.396 771 HG22 VAL 106 HG22 VAL 106 18.878 -5.596 9.802 772 HG23 VAL 106 HG23 VAL 106 18.856 -6.657 11.211 773 H LYS 107 H LYS 107 23.400 -6.784 9.012 774 HA LYS 107 HA LYS 107 25.501 -6.702 10.931 775 HB2 LYS 107 HB2 LYS 107 25.660 -7.863 8.736 776 HB3 LYS 107 HB3 LYS 107 25.663 -6.295 7.939 777 HG2 LYS 107 HG2 LYS 107 27.730 -5.734 9.221 778 HG3 LYS 107 HG3 LYS 107 27.753 -7.402 9.799 779 HD2 LYS 107 HD2 LYS 107 27.433 -7.585 7.029 780 HD3 LYS 107 HD3 LYS 107 28.637 -6.318 7.274 781 HE2 LYS 107 HE2 LYS 107 29.914 -7.850 8.721 782 HE3 LYS 107 HE3 LYS 107 28.728 -9.115 8.403 783 HZ1 LYS 107 HZ1 LYS 107 30.730 -7.952 6.590 784 HZ2 LYS 107 HZ2 LYS 107 29.315 -8.616 5.946 785 HZ3 LYS 107 HZ3 LYS 107 30.355 -9.578 6.870 786 H VAL 108 H VAL 108 26.879 -5.062 11.492 787 HA VAL 108 HA VAL 108 26.936 -2.534 10.184 788 HB VAL 108 HB VAL 108 24.778 -2.258 11.300 789 HG11 VAL 108 HG11 VAL 108 24.354 -2.978 13.362 790 HG12 VAL 108 HG12 VAL 108 25.958 -3.713 13.359 791 HG13 VAL 108 HG13 VAL 108 25.730 -2.095 14.021 792 HG21 VAL 108 HG21 VAL 108 26.573 -0.553 12.940 793 HG22 VAL 108 HG22 VAL 108 26.715 -0.448 11.185 794 HG23 VAL 108 HG23 VAL 108 25.170 -0.112 11.966 795 H LYS 109 H LYS 109 28.835 -1.590 10.596 796 HA LYS 109 HA LYS 109 30.154 -1.989 13.161 797 HB2 LYS 109 HB2 LYS 109 30.948 -3.326 10.696 798 HB3 LYS 109 HB3 LYS 109 32.249 -2.361 11.381 799 HG2 LYS 109 HG2 LYS 109 31.674 -3.550 13.591 800 HG3 LYS 109 HG3 LYS 109 30.817 -4.704 12.567 801 HD2 LYS 109 HD2 LYS 109 32.968 -4.903 11.237 802 HD3 LYS 109 HD3 LYS 109 33.748 -4.017 12.549 803 HE2 LYS 109 HE2 LYS 109 32.353 -6.683 12.706 804 HE3 LYS 109 HE3 LYS 109 34.071 -6.357 12.932 805 HZ1 LYS 109 HZ1 LYS 109 31.863 -5.454 14.700 806 HZ2 LYS 109 HZ2 LYS 109 33.489 -5.035 14.898 807 HZ3 LYS 109 HZ3 LYS 109 33.008 -6.649 15.053 808 H ARG 110 H ARG 110 31.710 -0.421 13.647 809 HA ARG 110 HA ARG 110 32.568 1.687 13.665 810 HB2 ARG 110 HB2 ARG 110 32.784 0.948 10.759 811 HB3 ARG 110 HB3 ARG 110 33.309 2.526 11.333 812 HG2 ARG 110 HG2 ARG 110 34.397 0.457 12.999 813 HG3 ARG 110 HG3 ARG 110 34.769 0.143 11.303 814 HD2 ARG 110 HD2 ARG 110 35.164 2.868 12.480 815 HD3 ARG 110 HD3 ARG 110 36.381 1.611 12.697 816 HE ARG 110 HE ARG 110 35.694 1.813 9.971 817 HH11 ARG 110 HH11 ARG 110 37.406 3.526 12.472 818 HH12 ARG 110 HH12 ARG 110 38.497 4.304 11.373 819 HH21 ARG 110 HH21 ARG 110 37.124 2.831 8.514 820 HH22 ARG 110 HH22 ARG 110 38.335 3.908 9.122 821 H ALA 111 H ALA 111 30.765 2.794 14.401 822 HA ALA 111 HA ALA 111 29.579 4.607 12.479 823 HB1 ALA 111 HB1 ALA 111 28.063 2.394 13.728 824 HB2 ALA 111 HB2 ALA 111 27.270 3.968 13.656 825 HB3 ALA 111 HB3 ALA 111 27.832 3.194 12.174 826 H VAL 112 H VAL 112 28.557 6.425 13.456 827 HA VAL 112 HA VAL 112 28.300 8.062 15.018 828 HB VAL 112 HB VAL 112 28.596 5.919 17.121 829 HG11 VAL 112 HG11 VAL 112 28.584 7.921 18.255 830 HG12 VAL 112 HG12 VAL 112 27.553 8.714 17.064 831 HG13 VAL 112 HG13 VAL 112 26.861 7.553 18.197 832 HG21 VAL 112 HG21 VAL 112 26.231 6.662 15.424 833 HG22 VAL 112 HG22 VAL 112 26.917 5.064 15.717 834 HG23 VAL 112 HG23 VAL 112 26.047 5.899 17.003 835 H GLN 113 H GLN 113 29.523 9.405 16.413 836 HA GLN 113 HA GLN 113 32.152 8.512 17.256 837 HB2 GLN 113 HB2 GLN 113 33.312 10.355 16.085 838 HB3 GLN 113 HB3 GLN 113 32.602 9.192 14.974 839 HG2 GLN 113 HG2 GLN 113 32.067 11.211 14.004 840 HG3 GLN 113 HG3 GLN 113 30.604 10.821 14.907 841 HE21 GLN 113 HE21 GLN 113 30.229 13.142 14.682 842 HE22 GLN 113 HE22 GLN 113 30.926 14.212 15.845 843 H LYS 114 H LYS 114 33.018 9.729 18.909 844 HA LYS 114 HA LYS 114 31.229 11.195 20.511 845 HB2 LYS 114 HB2 LYS 114 33.499 9.950 21.059 846 HB3 LYS 114 HB3 LYS 114 34.178 11.554 20.819 847 HG2 LYS 114 HG2 LYS 114 31.870 11.099 22.674 848 HG3 LYS 114 HG3 LYS 114 33.540 10.859 23.193 849 HD2 LYS 114 HD2 LYS 114 34.065 13.166 22.585 850 HD3 LYS 114 HD3 LYS 114 32.405 13.407 22.037 851 HE2 LYS 114 HE2 LYS 114 31.648 12.852 24.354 852 HE3 LYS 114 HE3 LYS 114 33.341 12.838 24.846 853 HZ1 LYS 114 HZ1 LYS 114 32.710 15.216 23.427 854 HZ2 LYS 114 HZ2 LYS 114 33.345 15.037 24.984 855 HZ3 LYS 114 HZ3 LYS 114 31.670 15.020 24.747 Start of MODEL 15 1 H1 MET 1 H MET 1 24.385 -21.594 21.216 2 HA MET 1 HA MET 1 21.787 -22.154 22.466 3 HB2 MET 1 HB2 MET 1 23.209 -19.496 22.389 4 HB3 MET 1 HB3 MET 1 21.881 -19.978 23.436 5 HG2 MET 1 HG2 MET 1 23.830 -21.829 24.011 6 HG3 MET 1 HG3 MET 1 24.743 -20.343 23.759 7 HE1 MET 1 HE1 MET 1 23.984 -18.117 26.616 8 HE2 MET 1 HE2 MET 1 24.843 -18.449 25.112 9 HE3 MET 1 HE3 MET 1 23.171 -17.888 25.067 10 H ALA 2 H ALA 2 20.104 -22.087 21.141 11 HA ALA 2 HA ALA 2 20.108 -20.097 18.965 12 HB1 ALA 2 HB1 ALA 2 19.800 -22.937 18.829 13 HB2 ALA 2 HB2 ALA 2 18.313 -22.156 18.289 14 HB3 ALA 2 HB3 ALA 2 19.848 -21.757 17.518 15 H GLY 3 H GLY 3 17.795 -22.200 20.701 16 HA2 GLY 3 HA2 GLY 3 16.337 -20.354 22.060 17 HA3 GLY 3 HA3 GLY 3 15.699 -20.240 20.426 18 H SER 4 H SER 4 13.818 -21.261 20.329 19 HA SER 4 HA SER 4 13.566 -24.032 20.668 20 HB2 SER 4 HB2 SER 4 11.918 -23.910 22.642 21 HB3 SER 4 HB3 SER 4 13.639 -23.809 23.014 22 HG SER 4 HG SER 4 13.432 -21.731 23.512 23 H HIS 5 H HIS 5 11.480 -21.227 21.390 24 HA HIS 5 HA HIS 5 9.247 -22.269 19.999 25 HB2 HIS 5 HB2 HIS 5 8.220 -20.118 20.363 26 HB3 HIS 5 HB3 HIS 5 9.128 -20.550 21.809 27 HD1 HIS 5 HD1 HIS 5 8.440 -17.707 19.930 28 HD2 HIS 5 HD2 HIS 5 11.968 -19.327 21.411 29 HE1 HIS 5 HE1 HIS 5 10.079 -15.800 19.999 30 H HIS 6 H HIS 6 8.296 -21.539 18.038 31 HA HIS 6 HA HIS 6 10.074 -21.336 15.880 32 HB2 HIS 6 HB2 HIS 6 8.148 -21.098 14.490 33 HB3 HIS 6 HB3 HIS 6 7.691 -22.173 15.807 34 HD1 HIS 6 HD1 HIS 6 5.710 -20.384 14.076 35 HD2 HIS 6 HD2 HIS 6 7.089 -19.539 17.902 36 HE1 HIS 6 HE1 HIS 6 4.001 -18.837 15.080 37 H HIS 7 H HIS 7 10.348 -19.597 14.355 38 HA HIS 7 HA HIS 7 10.171 -16.946 15.630 39 HB2 HIS 7 HB2 HIS 7 12.464 -18.175 14.952 40 HB3 HIS 7 HB3 HIS 7 12.106 -17.380 13.422 41 HD1 HIS 7 HD1 HIS 7 13.744 -15.498 13.422 42 HD2 HIS 7 HD2 HIS 7 11.648 -15.766 16.999 43 HE1 HIS 7 HE1 HIS 7 14.399 -13.458 14.740 44 H HIS 8 H HIS 8 9.750 -15.130 14.268 45 HA HIS 8 HA HIS 8 7.730 -15.614 12.337 46 HB2 HIS 8 HB2 HIS 8 7.661 -13.210 12.057 47 HB3 HIS 8 HB3 HIS 8 7.833 -13.583 13.770 48 HD1 HIS 8 HD1 HIS 8 9.142 -11.398 11.291 49 HD2 HIS 8 HD2 HIS 8 10.763 -13.443 14.524 50 HE1 HIS 8 HE1 HIS 8 11.301 -10.222 11.816 51 H HIS 9 H HIS 9 7.743 -14.954 10.097 52 HA HIS 9 HA HIS 9 10.187 -15.757 8.773 53 HB2 HIS 9 HB2 HIS 9 7.415 -15.094 7.785 54 HB3 HIS 9 HB3 HIS 9 8.752 -15.429 6.688 55 HD1 HIS 9 HD1 HIS 9 6.290 -17.067 8.899 56 HD2 HIS 9 HD2 HIS 9 9.700 -18.124 6.774 57 HE1 HIS 9 HE1 HIS 9 6.284 -19.581 8.825 58 H HIS 10 H HIS 10 11.732 -14.352 8.305 59 HA HIS 10 HA HIS 10 10.995 -11.705 7.295 60 HB2 HIS 10 HB2 HIS 10 11.521 -11.567 9.761 61 HB3 HIS 10 HB3 HIS 10 13.160 -12.079 9.369 62 HD1 HIS 10 HD1 HIS 10 14.652 -10.121 9.419 63 HD2 HIS 10 HD2 HIS 10 10.928 -9.171 7.839 64 HE1 HIS 10 HE1 HIS 10 14.792 -7.693 8.779 65 H GLY 11 H GLY 11 11.637 -13.408 5.483 66 HA2 GLY 11 HA2 GLY 11 13.663 -12.520 3.986 67 HA3 GLY 11 HA3 GLY 11 14.515 -13.582 5.098 68 H SER 12 H SER 12 15.146 -14.883 3.313 69 HA SER 12 HA SER 12 13.077 -16.809 2.559 70 HB2 SER 12 HB2 SER 12 14.784 -15.228 0.646 71 HB3 SER 12 HB3 SER 12 14.124 -16.802 0.200 72 HG SER 12 HG SER 12 12.495 -15.568 -0.381 73 H MET 13 H MET 13 15.133 -17.044 4.474 74 HA MET 13 HA MET 13 17.243 -18.619 3.242 75 HB2 MET 13 HB2 MET 13 17.703 -17.033 5.121 76 HB3 MET 13 HB3 MET 13 16.754 -18.074 6.174 77 HG2 MET 13 HG2 MET 13 18.790 -18.908 6.652 78 HG3 MET 13 HG3 MET 13 18.449 -19.893 5.231 79 HE1 MET 13 HE1 MET 13 20.475 -20.588 4.695 80 HE2 MET 13 HE2 MET 13 21.691 -19.699 3.778 81 HE3 MET 13 HE3 MET 13 21.778 -19.751 5.540 82 H SER 14 H SER 14 14.588 -19.084 5.554 83 HA SER 14 HA SER 14 15.028 -21.935 5.669 84 HB2 SER 14 HB2 SER 14 13.100 -21.968 7.170 85 HB3 SER 14 HB3 SER 14 14.209 -20.680 7.640 86 HG SER 14 HG SER 14 12.677 -19.297 7.293 87 H GLU 15 H GLU 15 13.676 -23.539 4.857 88 HA GLU 15 HA GLU 15 11.854 -22.650 2.717 89 HB2 GLU 15 HB2 GLU 15 14.093 -24.335 2.565 90 HB3 GLU 15 HB3 GLU 15 12.700 -25.401 2.453 91 HG2 GLU 15 HG2 GLU 15 12.483 -24.868 0.324 92 HG3 GLU 15 HG3 GLU 15 12.174 -23.195 0.785 93 H TYR 16 H TYR 16 10.576 -24.981 2.145 94 HA TYR 16 HA TYR 16 9.340 -25.843 4.667 95 HB2 TYR 16 HB2 TYR 16 7.126 -25.790 3.297 96 HB3 TYR 16 HB3 TYR 16 7.740 -24.295 3.994 97 HD1 TYR 16 HD1 TYR 16 7.300 -26.198 0.875 98 HD2 TYR 16 HD2 TYR 16 8.516 -22.502 2.596 99 HE1 TYR 16 HE1 TYR 16 7.270 -25.157 -1.354 100 HE2 TYR 16 HE2 TYR 16 8.489 -21.451 0.373 101 HH TYR 16 HH TYR 16 6.957 -22.454 -2.118 102 H ILE 17 H ILE 17 7.588 -27.636 3.984 103 HA ILE 17 HA ILE 17 9.020 -29.523 2.229 104 HB ILE 17 HB ILE 17 9.160 -30.383 4.433 105 HG12 ILE 17 HG12 ILE 17 6.798 -31.748 3.125 106 HG13 ILE 17 HG13 ILE 17 8.477 -31.995 2.660 107 HG21 ILE 17 HG21 ILE 17 6.585 -29.122 4.740 108 HG22 ILE 17 HG22 ILE 17 6.562 -30.774 5.357 109 HG23 ILE 17 HG23 ILE 17 7.747 -29.620 5.970 110 HD11 ILE 17 HD11 ILE 17 8.682 -32.556 5.254 111 HD12 ILE 17 HD12 ILE 17 6.990 -32.990 5.005 112 HD13 ILE 17 HD13 ILE 17 8.250 -33.761 4.042 113 H ARG 18 H ARG 18 7.955 -30.274 0.516 114 HA ARG 18 HA ARG 18 5.033 -29.902 0.424 115 HB2 ARG 18 HB2 ARG 18 7.143 -29.190 -1.453 116 HB3 ARG 18 HB3 ARG 18 5.891 -30.170 -2.203 117 HG2 ARG 18 HG2 ARG 18 4.499 -28.288 -0.710 118 HG3 ARG 18 HG3 ARG 18 5.842 -27.394 -1.426 119 HD2 ARG 18 HD2 ARG 18 4.170 -29.255 -3.076 120 HD3 ARG 18 HD3 ARG 18 3.636 -27.607 -2.751 121 HE ARG 18 HE ARG 18 6.230 -27.414 -3.682 122 HH11 ARG 18 HH11 ARG 18 3.173 -28.592 -4.859 123 HH12 ARG 18 HH12 ARG 18 3.532 -28.249 -6.519 124 HH21 ARG 18 HH21 ARG 18 6.714 -26.958 -5.864 125 HH22 ARG 18 HH22 ARG 18 5.547 -27.321 -7.090 126 H VAL 19 H VAL 19 4.177 -31.841 0.885 127 HA VAL 19 HA VAL 19 4.773 -34.053 -0.906 128 HB VAL 19 HB VAL 19 4.852 -35.640 1.090 129 HG11 VAL 19 HG11 VAL 19 6.782 -35.055 -0.364 130 HG12 VAL 19 HG12 VAL 19 7.196 -33.769 0.772 131 HG13 VAL 19 HG13 VAL 19 7.238 -35.454 1.292 132 HG21 VAL 19 HG21 VAL 19 6.090 -33.630 2.786 133 HG22 VAL 19 HG22 VAL 19 4.373 -33.327 2.521 134 HG23 VAL 19 HG23 VAL 19 4.903 -34.872 3.186 135 H THR 20 H THR 20 3.213 -35.857 -0.627 136 HA THR 20 HA THR 20 0.688 -35.029 0.622 137 HB THR 20 HB THR 20 0.118 -34.450 -1.540 138 HG1 THR 20 HG1 THR 20 -1.507 -35.800 -1.434 139 HG21 THR 20 HG21 THR 20 1.792 -34.879 -3.001 140 HG22 THR 20 HG22 THR 20 0.803 -36.282 -3.405 141 HG23 THR 20 HG23 THR 20 2.155 -36.449 -2.286 142 H GLU 21 H GLU 21 -0.655 -36.712 1.296 143 HA GLU 21 HA GLU 21 0.705 -39.175 1.876 144 HB2 GLU 21 HB2 GLU 21 -1.020 -37.869 3.329 145 HB3 GLU 21 HB3 GLU 21 -2.219 -38.724 2.368 146 HG2 GLU 21 HG2 GLU 21 -0.269 -40.589 3.284 147 HG3 GLU 21 HG3 GLU 21 -0.837 -39.628 4.648 148 H ASP 22 H ASP 22 -2.095 -38.229 -0.086 149 HA ASP 22 HA ASP 22 -2.183 -40.926 -1.232 150 HB2 ASP 22 HB2 ASP 22 -4.150 -38.770 -0.827 151 HB3 ASP 22 HB3 ASP 22 -4.276 -39.601 -2.375 152 H GLU 23 H GLU 23 -1.730 -41.343 -3.332 153 HA GLU 23 HA GLU 23 -0.110 -39.549 -4.776 154 HB2 GLU 23 HB2 GLU 23 -0.377 -41.193 -6.650 155 HB3 GLU 23 HB3 GLU 23 0.164 -41.897 -5.132 156 HG2 GLU 23 HG2 GLU 23 -1.512 -43.329 -5.191 157 HG3 GLU 23 HG3 GLU 23 -2.664 -41.996 -5.166 158 H ASN 24 H ASN 24 -3.542 -40.268 -4.905 159 HA ASN 24 HA ASN 24 -4.053 -38.865 -7.331 160 HB2 ASN 24 HB2 ASN 24 -5.641 -40.518 -6.691 161 HB3 ASN 24 HB3 ASN 24 -5.835 -39.814 -5.088 162 HD21 ASN 24 HD21 ASN 24 -6.317 -39.143 -8.521 163 HD22 ASN 24 HD22 ASN 24 -7.712 -38.146 -8.312 164 H ASP 25 H ASP 25 -3.787 -37.953 -3.991 165 HA ASP 25 HA ASP 25 -5.046 -35.378 -4.359 166 HB2 ASP 25 HB2 ASP 25 -3.568 -36.639 -2.049 167 HB3 ASP 25 HB3 ASP 25 -4.178 -34.987 -2.003 168 H GLU 26 H GLU 26 -3.973 -33.352 -4.131 169 HA GLU 26 HA GLU 26 -1.457 -33.265 -5.501 170 HB2 GLU 26 HB2 GLU 26 -3.309 -31.185 -4.376 171 HB3 GLU 26 HB3 GLU 26 -1.715 -30.744 -4.971 172 HG2 GLU 26 HG2 GLU 26 -2.273 -31.663 -7.161 173 HG3 GLU 26 HG3 GLU 26 -3.870 -32.111 -6.566 174 HA PRO 27 HA PRO 27 1.363 -33.066 -2.146 175 HB2 PRO 27 HB2 PRO 27 3.208 -31.310 -3.086 176 HB3 PRO 27 HB3 PRO 27 3.042 -32.956 -3.710 177 HG2 PRO 27 HG2 PRO 27 1.999 -30.388 -4.841 178 HG3 PRO 27 HG3 PRO 27 2.771 -31.747 -5.678 179 HD2 PRO 27 HD2 PRO 27 0.088 -31.382 -5.658 180 HD3 PRO 27 HD3 PRO 27 0.832 -32.993 -5.707 181 H ILE 28 H ILE 28 0.560 -32.142 -0.335 182 HA ILE 28 HA ILE 28 -0.138 -29.355 -0.209 183 HB ILE 28 HB ILE 28 -1.412 -30.973 1.091 184 HG12 ILE 28 HG12 ILE 28 -1.298 -29.833 3.306 185 HG13 ILE 28 HG13 ILE 28 0.191 -29.049 2.790 186 HG21 ILE 28 HG21 ILE 28 0.182 -32.649 1.590 187 HG22 ILE 28 HG22 ILE 28 1.227 -31.505 2.431 188 HG23 ILE 28 HG23 ILE 28 -0.320 -31.970 3.138 189 HD11 ILE 28 HD11 ILE 28 -2.253 -27.953 2.569 190 HD12 ILE 28 HD12 ILE 28 -0.892 -27.548 1.523 191 HD13 ILE 28 HD13 ILE 28 -2.102 -28.713 0.985 192 H GLU 29 H GLU 29 0.928 -27.713 0.831 193 HA GLU 29 HA GLU 29 3.751 -28.225 1.432 194 HB2 GLU 29 HB2 GLU 29 2.586 -25.475 1.267 195 HB3 GLU 29 HB3 GLU 29 4.208 -26.024 0.868 196 HG2 GLU 29 HG2 GLU 29 3.510 -25.807 -1.243 197 HG3 GLU 29 HG3 GLU 29 2.758 -27.377 -0.967 198 H ILE 30 H ILE 30 4.598 -27.954 3.415 199 HA ILE 30 HA ILE 30 2.884 -26.777 5.500 200 HB ILE 30 HB ILE 30 4.582 -28.672 6.730 201 HG12 ILE 30 HG12 ILE 30 2.964 -29.905 4.492 202 HG13 ILE 30 HG13 ILE 30 4.712 -29.701 4.449 203 HG21 ILE 30 HG21 ILE 30 2.641 -28.348 7.857 204 HG22 ILE 30 HG22 ILE 30 1.683 -28.194 6.385 205 HG23 ILE 30 HG23 ILE 30 2.170 -29.789 6.957 206 HD11 ILE 30 HD11 ILE 30 4.323 -31.929 5.080 207 HD12 ILE 30 HD12 ILE 30 4.788 -31.086 6.558 208 HD13 ILE 30 HD13 ILE 30 3.093 -31.464 6.255 209 HA PRO 31 HA PRO 31 6.347 -24.252 6.492 210 HB2 PRO 31 HB2 PRO 31 5.768 -23.692 9.084 211 HB3 PRO 31 HB3 PRO 31 4.884 -22.983 7.727 212 HG2 PRO 31 HG2 PRO 31 4.139 -25.301 9.469 213 HG3 PRO 31 HG3 PRO 31 3.125 -23.968 8.886 214 HD2 PRO 31 HD2 PRO 31 3.104 -26.423 7.743 215 HD3 PRO 31 HD3 PRO 31 2.826 -24.935 6.815 216 H SER 32 H SER 32 8.285 -25.228 6.601 217 HA SER 32 HA SER 32 8.801 -27.213 8.679 218 HB2 SER 32 HB2 SER 32 10.446 -28.052 7.331 219 HB3 SER 32 HB3 SER 32 9.496 -27.243 6.084 220 HG SER 32 HG SER 32 11.601 -26.596 5.832 221 H GLU 33 H GLU 33 11.368 -27.025 9.281 222 HA GLU 33 HA GLU 33 11.501 -24.551 10.806 223 HB2 GLU 33 HB2 GLU 33 12.163 -27.155 11.399 224 HB3 GLU 33 HB3 GLU 33 13.732 -26.429 11.084 225 HG2 GLU 33 HG2 GLU 33 13.604 -25.027 12.882 226 HG3 GLU 33 HG3 GLU 33 11.842 -24.994 12.872 227 H ASP 34 H ASP 34 13.839 -23.674 11.092 228 HA ASP 34 HA ASP 34 14.668 -22.707 8.536 229 HB2 ASP 34 HB2 ASP 34 16.434 -21.519 9.846 230 HB3 ASP 34 HB3 ASP 34 14.799 -21.230 10.436 231 H ASP 35 H ASP 35 15.893 -25.081 10.816 232 HA ASP 35 HA ASP 35 18.428 -25.469 9.652 233 HB2 ASP 35 HB2 ASP 35 17.150 -26.429 11.875 234 HB3 ASP 35 HB3 ASP 35 17.187 -27.855 10.841 235 H GLY 36 H GLY 36 15.282 -26.405 8.650 236 HA2 GLY 36 HA2 GLY 36 15.128 -27.046 6.273 237 HA3 GLY 36 HA3 GLY 36 16.483 -28.126 6.568 238 H THR 37 H THR 37 15.413 -28.977 9.175 239 HA THR 37 HA THR 37 13.875 -31.184 8.257 240 HB THR 37 HB THR 37 13.776 -31.900 10.559 241 HG1 THR 37 HG1 THR 37 14.355 -29.191 11.054 242 HG21 THR 37 HG21 THR 37 15.983 -32.371 10.755 243 HG22 THR 37 HG22 THR 37 16.464 -30.680 10.617 244 HG23 THR 37 HG23 THR 37 16.071 -31.606 9.169 245 H VAL 38 H VAL 38 11.927 -31.664 10.058 246 HA VAL 38 HA VAL 38 10.108 -29.363 9.971 247 HB VAL 38 HB VAL 38 9.482 -32.126 8.932 248 HG11 VAL 38 HG11 VAL 38 7.558 -31.598 10.137 249 HG12 VAL 38 HG12 VAL 38 7.669 -29.881 9.745 250 HG13 VAL 38 HG13 VAL 38 7.190 -31.041 8.505 251 HG21 VAL 38 HG21 VAL 38 10.608 -30.312 7.486 252 HG22 VAL 38 HG22 VAL 38 9.194 -31.144 6.841 253 HG23 VAL 38 HG23 VAL 38 9.031 -29.523 7.517 254 H LEU 39 H LEU 39 8.957 -29.099 11.786 255 HA LEU 39 HA LEU 39 9.460 -30.733 14.050 256 HB2 LEU 39 HB2 LEU 39 8.467 -28.185 13.588 257 HB3 LEU 39 HB3 LEU 39 7.102 -29.059 14.281 258 HG LEU 39 HG LEU 39 9.824 -28.773 15.553 259 HD11 LEU 39 HD11 LEU 39 8.326 -26.708 15.374 260 HD12 LEU 39 HD12 LEU 39 8.916 -27.157 16.973 261 HD13 LEU 39 HD13 LEU 39 7.260 -27.542 16.505 262 HD21 LEU 39 HD21 LEU 39 8.243 -29.543 17.545 263 HD22 LEU 39 HD22 LEU 39 9.091 -30.697 16.516 264 HD23 LEU 39 HD23 LEU 39 7.391 -30.332 16.217 265 H LEU 40 H LEU 40 8.310 -32.352 14.948 266 HA LEU 40 HA LEU 40 6.602 -33.937 13.495 267 HB2 LEU 40 HB2 LEU 40 7.786 -34.451 15.679 268 HB3 LEU 40 HB3 LEU 40 6.431 -33.665 16.485 269 HG LEU 40 HG LEU 40 6.347 -36.173 16.418 270 HD11 LEU 40 HD11 LEU 40 4.051 -36.195 16.309 271 HD12 LEU 40 HD12 LEU 40 3.995 -35.093 14.934 272 HD13 LEU 40 HD13 LEU 40 4.368 -34.476 16.543 273 HD21 LEU 40 HD21 LEU 40 7.014 -35.860 13.777 274 HD22 LEU 40 HD22 LEU 40 5.287 -36.206 13.699 275 HD23 LEU 40 HD23 LEU 40 6.376 -37.333 14.508 276 H SER 41 H SER 41 5.743 -31.379 15.797 277 HA SER 41 HA SER 41 3.002 -31.683 15.861 278 HB2 SER 41 HB2 SER 41 4.895 -29.511 16.385 279 HB3 SER 41 HB3 SER 41 3.308 -28.939 15.870 280 HG SER 41 HG SER 41 2.913 -29.227 17.937 281 H THR 42 H THR 42 5.007 -30.220 13.381 282 HA THR 42 HA THR 42 2.867 -29.069 11.893 283 HB THR 42 HB THR 42 5.573 -29.857 10.810 284 HG1 THR 42 HG1 THR 42 6.401 -28.266 11.931 285 HG21 THR 42 HG21 THR 42 3.618 -27.695 10.018 286 HG22 THR 42 HG22 THR 42 3.931 -29.185 9.129 287 HG23 THR 42 HG23 THR 42 5.198 -27.969 9.287 288 H VAL 43 H VAL 43 4.556 -32.158 11.801 289 HA VAL 43 HA VAL 43 3.476 -33.097 9.369 290 HB VAL 43 HB VAL 43 4.722 -34.439 11.738 291 HG11 VAL 43 HG11 VAL 43 4.553 -36.575 10.322 292 HG12 VAL 43 HG12 VAL 43 3.131 -36.074 11.239 293 HG13 VAL 43 HG13 VAL 43 3.218 -35.761 9.505 294 HG21 VAL 43 HG21 VAL 43 6.311 -33.520 10.285 295 HG22 VAL 43 HG22 VAL 43 6.253 -35.226 9.843 296 HG23 VAL 43 HG23 VAL 43 5.424 -34.029 8.848 297 H THR 44 H THR 44 2.367 -33.311 12.712 298 HA THR 44 HA THR 44 0.189 -35.063 12.180 299 HB THR 44 HB THR 44 -0.609 -34.489 14.415 300 HG1 THR 44 HG1 THR 44 -0.247 -32.409 14.820 301 HG21 THR 44 HG21 THR 44 2.024 -35.460 13.807 302 HG22 THR 44 HG22 THR 44 0.927 -35.951 15.098 303 HG23 THR 44 HG23 THR 44 2.041 -34.608 15.350 304 H ALA 45 H ALA 45 0.639 -31.621 11.994 305 HA ALA 45 HA ALA 45 -1.906 -30.617 12.203 306 HB1 ALA 45 HB1 ALA 45 0.109 -29.770 10.127 307 HB2 ALA 45 HB2 ALA 45 -1.207 -28.799 10.789 308 HB3 ALA 45 HB3 ALA 45 0.142 -29.277 11.820 309 H GLN 46 H GLN 46 -0.403 -32.024 9.301 310 HA GLN 46 HA GLN 46 -3.049 -32.084 8.026 311 HB2 GLN 46 HB2 GLN 46 -0.556 -32.764 6.536 312 HB3 GLN 46 HB3 GLN 46 -2.023 -31.979 5.966 313 HG2 GLN 46 HG2 GLN 46 -1.393 -29.932 7.119 314 HG3 GLN 46 HG3 GLN 46 0.063 -30.716 7.730 315 HE21 GLN 46 HE21 GLN 46 0.943 -32.068 5.537 316 HE22 GLN 46 HE22 GLN 46 1.382 -30.953 4.292 317 H PHE 47 H PHE 47 -0.315 -34.085 8.962 318 HA PHE 47 HA PHE 47 -1.871 -36.476 8.227 319 HB2 PHE 47 HB2 PHE 47 1.073 -36.568 8.779 320 HB3 PHE 47 HB3 PHE 47 0.096 -37.628 7.767 321 HD1 PHE 47 HD1 PHE 47 -1.267 -35.870 5.963 322 HD2 PHE 47 HD2 PHE 47 2.700 -35.601 7.481 323 HE1 PHE 47 HE1 PHE 47 -0.595 -34.588 3.972 324 HE2 PHE 47 HE2 PHE 47 3.378 -34.318 5.494 325 HZ PHE 47 HZ PHE 47 1.729 -33.810 3.737 326 HA PRO 48 HA PRO 48 -1.794 -36.333 12.853 327 HB2 PRO 48 HB2 PRO 48 -4.367 -37.149 13.143 328 HB3 PRO 48 HB3 PRO 48 -3.916 -35.456 12.909 329 HG2 PRO 48 HG2 PRO 48 -4.931 -37.439 10.909 330 HG3 PRO 48 HG3 PRO 48 -5.378 -35.737 11.122 331 HD2 PRO 48 HD2 PRO 48 -3.651 -36.560 9.206 332 HD3 PRO 48 HD3 PRO 48 -3.517 -34.976 9.996 333 H GLY 49 H GLY 49 -1.036 -38.046 13.925 334 HA2 GLY 49 HA2 GLY 49 -1.110 -40.256 14.741 335 HA3 GLY 49 HA3 GLY 49 -2.127 -40.701 13.378 336 H ALA 50 H ALA 50 -0.290 -39.375 11.466 337 HA ALA 50 HA ALA 50 1.190 -41.543 10.627 338 HB1 ALA 50 HB1 ALA 50 2.386 -40.027 9.175 339 HB2 ALA 50 HB2 ALA 50 0.686 -39.561 9.248 340 HB3 ALA 50 HB3 ALA 50 1.890 -38.648 10.157 341 H CYS 51 H CYS 51 2.878 -42.561 11.466 342 HA CYS 51 HA CYS 51 4.482 -41.254 13.514 343 HB2 CYS 51 HB2 CYS 51 3.501 -43.716 13.499 344 HB3 CYS 51 HB3 CYS 51 4.990 -44.060 12.627 345 HG CYS 51 HG CYS 51 4.515 -43.665 15.858 346 H GLY 52 H GLY 52 4.804 -42.570 10.270 347 HA2 GLY 52 HA2 GLY 52 7.358 -41.168 10.013 348 HA3 GLY 52 HA3 GLY 52 7.357 -42.899 9.707 349 H LEU 53 H LEU 53 7.949 -40.655 7.901 350 HA LEU 53 HA LEU 53 5.833 -41.096 5.899 351 HB2 LEU 53 HB2 LEU 53 7.789 -38.817 5.885 352 HB3 LEU 53 HB3 LEU 53 6.295 -38.979 4.964 353 HG LEU 53 HG LEU 53 5.718 -37.422 6.564 354 HD11 LEU 53 HD11 LEU 53 4.973 -39.608 8.373 355 HD12 LEU 53 HD12 LEU 53 4.504 -39.842 6.689 356 HD13 LEU 53 HD13 LEU 53 3.967 -38.407 7.562 357 HD21 LEU 53 HD21 LEU 53 7.939 -37.890 7.814 358 HD22 LEU 53 HD22 LEU 53 6.951 -38.944 8.826 359 HD23 LEU 53 HD23 LEU 53 6.571 -37.225 8.708 360 H ARG 54 H ARG 54 6.390 -41.732 3.850 361 HA ARG 54 HA ARG 54 9.178 -42.602 3.510 362 HB2 ARG 54 HB2 ARG 54 6.895 -44.076 3.299 363 HB3 ARG 54 HB3 ARG 54 7.149 -43.605 1.624 364 HG2 ARG 54 HG2 ARG 54 9.648 -44.441 2.591 365 HG3 ARG 54 HG3 ARG 54 8.468 -45.624 3.157 366 HD2 ARG 54 HD2 ARG 54 7.673 -45.228 0.579 367 HD3 ARG 54 HD3 ARG 54 9.422 -45.055 0.446 368 HE ARG 54 HE ARG 54 9.648 -47.298 0.872 369 HH11 ARG 54 HH11 ARG 54 6.405 -46.292 1.643 370 HH12 ARG 54 HH12 ARG 54 5.821 -47.905 1.878 371 HH21 ARG 54 HH21 ARG 54 8.890 -49.428 1.179 372 HH22 ARG 54 HH22 ARG 54 7.235 -49.688 1.615 373 H TYR 55 H TYR 55 9.935 -42.637 1.190 374 HA TYR 55 HA TYR 55 9.210 -40.083 -0.068 375 HB2 TYR 55 HB2 TYR 55 11.716 -41.350 0.496 376 HB3 TYR 55 HB3 TYR 55 11.558 -41.152 -1.246 377 HD1 TYR 55 HD1 TYR 55 10.462 -38.701 -1.834 378 HD2 TYR 55 HD2 TYR 55 12.850 -39.657 1.555 379 HE1 TYR 55 HE1 TYR 55 11.103 -36.336 -1.626 380 HE2 TYR 55 HE2 TYR 55 13.496 -37.294 1.773 381 HH TYR 55 HH TYR 55 12.313 -34.846 -0.515 382 H ARG 56 H ARG 56 8.235 -40.052 -1.985 383 HA ARG 56 HA ARG 56 8.343 -42.468 -3.662 384 HB2 ARG 56 HB2 ARG 56 6.184 -42.595 -2.746 385 HB3 ARG 56 HB3 ARG 56 5.947 -40.855 -2.834 386 HG2 ARG 56 HG2 ARG 56 4.622 -42.139 -4.485 387 HG3 ARG 56 HG3 ARG 56 5.697 -40.943 -5.211 388 HD2 ARG 56 HD2 ARG 56 7.329 -42.715 -5.682 389 HD3 ARG 56 HD3 ARG 56 6.234 -43.902 -4.975 390 HE ARG 56 HE ARG 56 4.991 -42.429 -7.074 391 HH11 ARG 56 HH11 ARG 56 7.184 -45.051 -6.416 392 HH12 ARG 56 HH12 ARG 56 6.857 -45.871 -7.907 393 HH21 ARG 56 HH21 ARG 56 4.552 -43.499 -9.040 394 HH22 ARG 56 HH22 ARG 56 5.361 -44.987 -9.399 395 H ASN 57 H ASN 57 9.753 -41.696 -5.170 396 HA ASN 57 HA ASN 57 9.014 -39.199 -6.545 397 HB2 ASN 57 HB2 ASN 57 11.662 -40.540 -6.076 398 HB3 ASN 57 HB3 ASN 57 11.456 -39.413 -7.414 399 HD21 ASN 57 HD21 ASN 57 11.160 -37.243 -6.996 400 HD22 ASN 57 HD22 ASN 57 11.442 -36.549 -5.439 401 HA PRO 58 HA PRO 58 7.848 -42.008 -9.834 402 HB2 PRO 58 HB2 PRO 58 6.835 -40.078 -11.452 403 HB3 PRO 58 HB3 PRO 58 5.954 -40.729 -10.065 404 HG2 PRO 58 HG2 PRO 58 7.532 -38.195 -10.287 405 HG3 PRO 58 HG3 PRO 58 5.958 -38.469 -9.519 406 HD2 PRO 58 HD2 PRO 58 8.262 -38.315 -8.104 407 HD3 PRO 58 HD3 PRO 58 6.902 -39.342 -7.605 408 H VAL 59 H VAL 59 9.703 -39.027 -10.207 409 HA VAL 59 HA VAL 59 10.746 -39.850 -12.787 410 HB VAL 59 HB VAL 59 12.028 -37.749 -12.715 411 HG11 VAL 59 HG11 VAL 59 9.839 -37.647 -13.670 412 HG12 VAL 59 HG12 VAL 59 9.090 -37.536 -12.076 413 HG13 VAL 59 HG13 VAL 59 10.068 -36.201 -12.688 414 HG21 VAL 59 HG21 VAL 59 10.922 -36.339 -10.598 415 HG22 VAL 59 HG22 VAL 59 11.344 -37.904 -9.903 416 HG23 VAL 59 HG23 VAL 59 12.577 -36.937 -10.712 417 H SER 60 H SER 60 11.725 -39.813 -9.441 418 HA SER 60 HA SER 60 14.494 -40.404 -10.043 419 HB2 SER 60 HB2 SER 60 13.498 -39.109 -7.982 420 HB3 SER 60 HB3 SER 60 13.308 -40.728 -7.309 421 HG SER 60 HG SER 60 15.760 -39.869 -8.412 422 H GLN 61 H GLN 61 11.585 -42.126 -9.176 423 HA GLN 61 HA GLN 61 11.131 -44.338 -8.833 424 HB2 GLN 61 HB2 GLN 61 13.369 -44.807 -10.800 425 HB3 GLN 61 HB3 GLN 61 11.951 -45.809 -10.526 426 HG2 GLN 61 HG2 GLN 61 10.532 -43.997 -11.397 427 HG3 GLN 61 HG3 GLN 61 11.982 -43.052 -11.731 428 HE21 GLN 61 HE21 GLN 61 12.904 -43.277 -13.648 429 HE22 GLN 61 HE22 GLN 61 12.574 -44.535 -14.784 430 H CYS 62 H CYS 62 13.028 -43.203 -7.001 431 HA CYS 62 HA CYS 62 14.902 -45.405 -6.523 432 HB2 CYS 62 HB2 CYS 62 15.185 -42.651 -6.298 433 HB3 CYS 62 HB3 CYS 62 15.019 -43.191 -4.632 434 HG CYS 62 HG CYS 62 17.223 -44.764 -4.569 435 H MET 63 H MET 63 15.242 -45.289 -3.826 436 HA MET 63 HA MET 63 12.582 -45.910 -2.727 437 HB2 MET 63 HB2 MET 63 14.138 -47.904 -3.346 438 HB3 MET 63 HB3 MET 63 15.026 -47.444 -1.900 439 HG2 MET 63 HG2 MET 63 12.570 -47.522 -0.869 440 HG3 MET 63 HG3 MET 63 12.359 -48.679 -2.181 441 HE1 MET 63 HE1 MET 63 13.668 -49.217 1.819 442 HE2 MET 63 HE2 MET 63 15.127 -48.437 1.207 443 HE3 MET 63 HE3 MET 63 13.554 -47.670 0.978 444 H ARG 64 H ARG 64 13.982 -43.451 -2.471 445 HA ARG 64 HA ARG 64 15.495 -43.203 -0.136 446 HB2 ARG 64 HB2 ARG 64 14.239 -41.449 -2.031 447 HB3 ARG 64 HB3 ARG 64 13.945 -40.854 -0.402 448 HG2 ARG 64 HG2 ARG 64 16.711 -41.683 -0.984 449 HG3 ARG 64 HG3 ARG 64 16.128 -40.256 -1.845 450 HD2 ARG 64 HD2 ARG 64 15.441 -39.280 0.321 451 HD3 ARG 64 HD3 ARG 64 16.129 -40.681 1.141 452 HE ARG 64 HE ARG 64 17.561 -38.458 -0.005 453 HH11 ARG 64 HH11 ARG 64 17.739 -41.770 1.052 454 HH12 ARG 64 HH12 ARG 64 19.452 -41.733 1.309 455 HH21 ARG 64 HH21 ARG 64 19.817 -38.396 0.329 456 HH22 ARG 64 HH22 ARG 64 20.633 -39.813 0.898 457 H GLY 65 H GLY 65 14.430 -41.496 1.608 458 HA2 GLY 65 HA2 GLY 65 11.783 -42.059 2.445 459 HA3 GLY 65 HA3 GLY 65 12.913 -43.078 3.323 460 H VAL 66 H VAL 66 11.143 -40.533 3.828 461 HA VAL 66 HA VAL 66 12.910 -38.496 4.668 462 HB VAL 66 HB VAL 66 10.094 -39.107 5.574 463 HG11 VAL 66 HG11 VAL 66 11.246 -37.765 7.242 464 HG12 VAL 66 HG12 VAL 66 11.761 -36.627 5.995 465 HG13 VAL 66 HG13 VAL 66 10.049 -36.792 6.388 466 HG21 VAL 66 HG21 VAL 66 9.852 -36.914 4.084 467 HG22 VAL 66 HG22 VAL 66 11.273 -37.609 3.303 468 HG23 VAL 66 HG23 VAL 66 9.776 -38.536 3.395 469 H ARG 67 H ARG 67 14.327 -38.570 6.271 470 HA ARG 67 HA ARG 67 14.322 -40.627 8.240 471 HB2 ARG 67 HB2 ARG 67 16.421 -39.713 7.482 472 HB3 ARG 67 HB3 ARG 67 15.948 -38.095 7.984 473 HG2 ARG 67 HG2 ARG 67 17.493 -38.963 9.581 474 HG3 ARG 67 HG3 ARG 67 15.898 -38.901 10.332 475 HD2 ARG 67 HD2 ARG 67 15.887 -41.402 9.277 476 HD3 ARG 67 HD3 ARG 67 17.595 -41.207 9.672 477 HE ARG 67 HE ARG 67 15.825 -40.459 11.808 478 HH11 ARG 67 HH11 ARG 67 17.515 -43.093 10.282 479 HH12 ARG 67 HH12 ARG 67 17.541 -44.075 11.710 480 HH21 ARG 67 HH21 ARG 67 15.854 -41.742 13.694 481 HH22 ARG 67 HH22 ARG 67 16.595 -43.306 13.649 482 H LEU 68 H LEU 68 13.789 -40.565 10.386 483 HA LEU 68 HA LEU 68 12.527 -38.098 11.379 484 HB2 LEU 68 HB2 LEU 68 10.760 -39.612 10.813 485 HB3 LEU 68 HB3 LEU 68 11.558 -40.935 11.661 486 HG LEU 68 HG LEU 68 9.512 -39.758 12.739 487 HD11 LEU 68 HD11 LEU 68 10.148 -40.905 14.530 488 HD12 LEU 68 HD12 LEU 68 11.499 -39.813 14.829 489 HD13 LEU 68 HD13 LEU 68 11.695 -41.176 13.727 490 HD21 LEU 68 HD21 LEU 68 10.917 -37.511 12.393 491 HD22 LEU 68 HD22 LEU 68 11.486 -37.951 14.003 492 HD23 LEU 68 HD23 LEU 68 9.761 -37.725 13.708 493 H VAL 69 H VAL 69 13.547 -37.356 13.107 494 HA VAL 69 HA VAL 69 14.602 -39.267 15.072 495 HB VAL 69 HB VAL 69 16.549 -38.632 13.836 496 HG11 VAL 69 HG11 VAL 69 15.187 -36.104 13.628 497 HG12 VAL 69 HG12 VAL 69 16.844 -35.877 14.191 498 HG13 VAL 69 HG13 VAL 69 16.534 -36.734 12.680 499 HG21 VAL 69 HG21 VAL 69 17.910 -37.724 15.555 500 HG22 VAL 69 HG22 VAL 69 16.543 -36.888 16.291 501 HG23 VAL 69 HG23 VAL 69 16.638 -38.648 16.354 502 H GLU 70 H GLU 70 13.907 -38.826 17.054 503 HA GLU 70 HA GLU 70 12.966 -37.755 18.828 504 HB2 GLU 70 HB2 GLU 70 14.287 -35.295 17.669 505 HB3 GLU 70 HB3 GLU 70 13.749 -35.511 19.329 506 HG2 GLU 70 HG2 GLU 70 15.561 -37.611 18.561 507 HG3 GLU 70 HG3 GLU 70 16.278 -36.023 18.290 508 H GLY 71 H GLY 71 11.538 -37.879 16.229 509 HA2 GLY 71 HA2 GLY 71 9.296 -37.333 15.800 510 HA3 GLY 71 HA3 GLY 71 9.427 -35.998 16.936 511 H ILE 72 H ILE 72 11.950 -35.095 15.606 512 HA ILE 72 HA ILE 72 10.687 -33.381 13.670 513 HB ILE 72 HB ILE 72 13.588 -33.590 14.483 514 HG12 ILE 72 HG12 ILE 72 12.336 -31.163 15.297 515 HG13 ILE 72 HG13 ILE 72 11.309 -32.498 15.807 516 HG21 ILE 72 HG21 ILE 72 12.205 -32.009 12.441 517 HG22 ILE 72 HG22 ILE 72 13.237 -31.070 13.519 518 HG23 ILE 72 HG23 ILE 72 13.914 -32.415 12.600 519 HD11 ILE 72 HD11 ILE 72 13.991 -31.707 16.728 520 HD12 ILE 72 HD12 ILE 72 12.646 -32.428 17.613 521 HD13 ILE 72 HD13 ILE 72 13.681 -33.439 16.605 522 H LEU 73 H LEU 73 10.350 -33.980 11.641 523 HA LEU 73 HA LEU 73 11.696 -36.188 10.435 524 HB2 LEU 73 HB2 LEU 73 9.754 -34.134 9.424 525 HB3 LEU 73 HB3 LEU 73 10.469 -35.342 8.358 526 HG LEU 73 HG LEU 73 8.274 -36.063 9.012 527 HD11 LEU 73 HD11 LEU 73 10.364 -37.628 10.520 528 HD12 LEU 73 HD12 LEU 73 10.015 -37.775 8.797 529 HD13 LEU 73 HD13 LEU 73 8.792 -38.224 9.985 530 HD21 LEU 73 HD21 LEU 73 7.494 -36.219 11.203 531 HD22 LEU 73 HD22 LEU 73 8.360 -34.683 11.177 532 HD23 LEU 73 HD23 LEU 73 9.115 -36.108 11.890 533 H HIS 74 H HIS 74 13.709 -36.103 9.704 534 HA HIS 74 HA HIS 74 14.904 -33.583 8.917 535 HB2 HIS 74 HB2 HIS 74 15.880 -35.918 10.067 536 HB3 HIS 74 HB3 HIS 74 16.522 -35.954 8.427 537 HD1 HIS 74 HD1 HIS 74 17.475 -33.293 7.804 538 HD2 HIS 74 HD2 HIS 74 17.671 -34.741 11.694 539 HE1 HIS 74 HE1 HIS 74 19.241 -31.914 8.947 540 H ALA 75 H ALA 75 15.775 -33.127 6.879 541 HA ALA 75 HA ALA 75 14.453 -34.550 4.688 542 HB1 ALA 75 HB1 ALA 75 15.482 -32.475 3.420 543 HB2 ALA 75 HB2 ALA 75 13.991 -32.340 4.352 544 HB3 ALA 75 HB3 ALA 75 15.518 -31.799 5.048 545 HA PRO 76 HA PRO 76 18.110 -36.425 3.147 546 HB2 PRO 76 HB2 PRO 76 17.713 -36.277 0.466 547 HB3 PRO 76 HB3 PRO 76 16.803 -37.372 1.512 548 HG2 PRO 76 HG2 PRO 76 16.009 -34.701 0.417 549 HG3 PRO 76 HG3 PRO 76 15.052 -36.189 0.542 550 HD2 PRO 76 HD2 PRO 76 14.809 -34.148 2.304 551 HD3 PRO 76 HD3 PRO 76 14.576 -35.845 2.771 552 H ASP 77 H ASP 77 19.733 -36.046 1.146 553 HA ASP 77 HA ASP 77 20.999 -33.528 1.715 554 HB2 ASP 77 HB2 ASP 77 21.713 -35.930 0.062 555 HB3 ASP 77 HB3 ASP 77 22.634 -34.437 -0.100 556 H ALA 78 H ALA 78 18.539 -34.341 -0.295 557 HA ALA 78 HA ALA 78 19.324 -32.399 -2.364 558 HB1 ALA 78 HB1 ALA 78 18.760 -34.682 -3.147 559 HB2 ALA 78 HB2 ALA 78 17.129 -34.461 -2.510 560 HB3 ALA 78 HB3 ALA 78 17.712 -33.433 -3.820 561 H GLY 79 H GLY 79 17.018 -33.114 0.135 562 HA2 GLY 79 HA2 GLY 79 15.946 -31.139 1.142 563 HA3 GLY 79 HA3 GLY 79 15.635 -30.579 -0.494 564 H TRP 80 H TRP 80 13.461 -30.497 0.807 565 HA TRP 80 HA TRP 80 12.035 -32.933 1.137 566 HB2 TRP 80 HB2 TRP 80 11.138 -30.056 0.955 567 HB3 TRP 80 HB3 TRP 80 10.022 -31.390 1.233 568 HD1 TRP 80 HD1 TRP 80 11.828 -28.895 3.116 569 HE1 TRP 80 HE1 TRP 80 12.132 -29.585 5.577 570 HE3 TRP 80 HE3 TRP 80 10.684 -33.862 2.713 571 HZ2 TRP 80 HZ2 TRP 80 11.916 -31.925 7.140 572 HZ3 TRP 80 HZ3 TRP 80 10.757 -35.257 4.739 573 HH2 TRP 80 HH2 TRP 80 11.361 -34.307 6.905 574 H GLY 81 H GLY 81 11.648 -30.324 -1.275 575 HA2 GLY 81 HA2 GLY 81 11.276 -30.550 -3.566 576 HA3 GLY 81 HA3 GLY 81 11.179 -32.292 -3.352 577 H ASN 82 H ASN 82 9.357 -32.026 -4.875 578 HA ASN 82 HA ASN 82 6.885 -31.410 -3.399 579 HB2 ASN 82 HB2 ASN 82 6.998 -31.051 -6.368 580 HB3 ASN 82 HB3 ASN 82 5.953 -30.267 -5.186 581 HD21 ASN 82 HD21 ASN 82 7.652 -29.240 -3.390 582 HD22 ASN 82 HD22 ASN 82 8.696 -28.076 -4.126 583 H LEU 83 H LEU 83 8.219 -33.945 -3.673 584 HA LEU 83 HA LEU 83 6.651 -35.437 -5.615 585 HB2 LEU 83 HB2 LEU 83 7.944 -37.390 -4.620 586 HB3 LEU 83 HB3 LEU 83 8.859 -36.180 -5.517 587 HG LEU 83 HG LEU 83 9.830 -37.117 -3.316 588 HD11 LEU 83 HD11 LEU 83 10.007 -34.266 -2.966 589 HD12 LEU 83 HD12 LEU 83 10.092 -34.694 -4.675 590 HD13 LEU 83 HD13 LEU 83 11.228 -35.408 -3.530 591 HD21 LEU 83 HD21 LEU 83 7.980 -35.029 -2.174 592 HD22 LEU 83 HD22 LEU 83 9.140 -36.028 -1.298 593 HD23 LEU 83 HD23 LEU 83 7.720 -36.768 -2.038 594 H VAL 84 H VAL 84 6.054 -37.767 -4.531 595 HA VAL 84 HA VAL 84 4.024 -37.081 -2.548 596 HB VAL 84 HB VAL 84 4.337 -39.763 -3.874 597 HG11 VAL 84 HG11 VAL 84 1.679 -39.264 -3.597 598 HG12 VAL 84 HG12 VAL 84 2.663 -40.139 -2.422 599 HG13 VAL 84 HG13 VAL 84 2.339 -38.419 -2.197 600 HG21 VAL 84 HG21 VAL 84 2.461 -38.690 -5.402 601 HG22 VAL 84 HG22 VAL 84 3.338 -37.209 -5.020 602 HG23 VAL 84 HG23 VAL 84 4.173 -38.551 -5.802 603 H TYR 85 H TYR 85 3.617 -38.554 -0.742 604 HA TYR 85 HA TYR 85 6.002 -40.003 0.174 605 HB2 TYR 85 HB2 TYR 85 6.233 -38.812 2.092 606 HB3 TYR 85 HB3 TYR 85 5.437 -37.549 1.160 607 HD1 TYR 85 HD1 TYR 85 4.904 -40.182 3.698 608 HD2 TYR 85 HD2 TYR 85 3.264 -36.778 1.741 609 HE1 TYR 85 HE1 TYR 85 3.098 -40.101 5.365 610 HE2 TYR 85 HE2 TYR 85 1.454 -36.688 3.404 611 HH TYR 85 HH TYR 85 1.515 -38.514 6.289 612 H VAL 86 H VAL 86 5.615 -41.760 1.523 613 HA VAL 86 HA VAL 86 2.800 -42.619 1.643 614 HB VAL 86 HB VAL 86 5.297 -44.320 1.606 615 HG11 VAL 86 HG11 VAL 86 2.673 -44.892 2.543 616 HG12 VAL 86 HG12 VAL 86 2.949 -45.808 1.060 617 HG13 VAL 86 HG13 VAL 86 4.060 -45.973 2.419 618 HG21 VAL 86 HG21 VAL 86 3.190 -43.794 -0.485 619 HG22 VAL 86 HG22 VAL 86 4.902 -43.376 -0.565 620 HG23 VAL 86 HG23 VAL 86 4.405 -45.068 -0.597 621 H VAL 87 H VAL 87 1.912 -42.607 3.591 622 HA VAL 87 HA VAL 87 3.270 -42.054 5.968 623 HB VAL 87 HB VAL 87 1.167 -42.913 7.098 624 HG11 VAL 87 HG11 VAL 87 -0.242 -41.066 6.151 625 HG12 VAL 87 HG12 VAL 87 1.381 -40.584 6.647 626 HG13 VAL 87 HG13 VAL 87 1.013 -40.820 4.938 627 HG21 VAL 87 HG21 VAL 87 -0.140 -42.974 4.434 628 HG22 VAL 87 HG22 VAL 87 0.768 -44.400 4.935 629 HG23 VAL 87 HG23 VAL 87 -0.568 -43.814 5.925 630 H ASN 88 H ASN 88 3.392 -43.437 7.907 631 HA ASN 88 HA ASN 88 3.610 -46.299 7.395 632 HB2 ASN 88 HB2 ASN 88 5.909 -44.627 8.433 633 HB3 ASN 88 HB3 ASN 88 5.876 -46.388 8.408 634 HD21 ASN 88 HD21 ASN 88 7.170 -43.884 6.904 635 HD22 ASN 88 HD22 ASN 88 7.288 -44.491 5.291 636 H TYR 89 H TYR 89 1.874 -46.563 8.810 637 HA TYR 89 HA TYR 89 2.524 -46.914 11.524 638 HB2 TYR 89 HB2 TYR 89 1.251 -45.192 12.600 639 HB3 TYR 89 HB3 TYR 89 2.344 -44.407 11.465 640 HD1 TYR 89 HD1 TYR 89 -0.989 -44.601 12.596 641 HD2 TYR 89 HD2 TYR 89 1.330 -43.906 9.097 642 HE1 TYR 89 HE1 TYR 89 -2.899 -43.443 11.567 643 HE2 TYR 89 HE2 TYR 89 -0.574 -42.746 8.058 644 HH TYR 89 HH TYR 89 -3.675 -42.969 9.142 645 HA PRO 90 HA PRO 90 -1.000 -49.518 11.260 646 HB2 PRO 90 HB2 PRO 90 -1.719 -49.684 13.873 647 HB3 PRO 90 HB3 PRO 90 -0.282 -50.480 13.220 648 HG2 PRO 90 HG2 PRO 90 -0.501 -47.898 14.720 649 HG3 PRO 90 HG3 PRO 90 0.692 -49.199 14.898 650 HD2 PRO 90 HD2 PRO 90 1.214 -46.921 13.530 651 HD3 PRO 90 HD3 PRO 90 1.927 -48.485 13.088 652 H LYS 91 H LYS 91 -3.313 -49.657 12.464 653 HA LYS 91 HA LYS 91 -4.721 -47.318 11.572 654 HB2 LYS 91 HB2 LYS 91 -5.498 -49.748 11.375 655 HB3 LYS 91 HB3 LYS 91 -5.912 -49.639 13.080 656 HG2 LYS 91 HG2 LYS 91 -7.899 -49.214 11.901 657 HG3 LYS 91 HG3 LYS 91 -7.337 -47.643 12.477 658 HD2 LYS 91 HD2 LYS 91 -6.700 -46.950 10.363 659 HD3 LYS 91 HD3 LYS 91 -6.547 -48.601 9.757 660 HE2 LYS 91 HE2 LYS 91 -8.825 -48.834 9.441 661 HE3 LYS 91 HE3 LYS 91 -9.220 -47.575 10.609 662 HZ1 LYS 91 HZ1 LYS 91 -7.990 -47.115 7.946 663 HZ2 LYS 91 HZ2 LYS 91 -8.419 -45.918 9.060 664 HZ3 LYS 91 HZ3 LYS 91 -9.618 -46.859 8.327 665 H ASP 92 H ASP 92 -4.995 -45.560 12.761 666 HA ASP 92 HA ASP 92 -5.079 -45.835 15.692 667 HB2 ASP 92 HB2 ASP 92 -3.713 -43.979 13.927 668 HB3 ASP 92 HB3 ASP 92 -4.717 -43.132 15.100 669 H ASN 93 H ASN 93 -6.767 -45.013 16.836 670 HA ASN 93 HA ASN 93 -9.098 -44.191 15.282 671 HB2 ASN 93 HB2 ASN 93 -9.006 -46.011 17.189 672 HB3 ASN 93 HB3 ASN 93 -9.182 -44.611 18.242 673 HD21 ASN 93 HD21 ASN 93 -11.166 -43.986 18.683 674 HD22 ASN 93 HD22 ASN 93 -12.580 -44.375 17.770 675 H LYS 94 H LYS 94 -8.643 -42.050 14.803 676 HA LYS 94 HA LYS 94 -9.168 -40.185 16.947 677 HB2 LYS 94 HB2 LYS 94 -7.188 -38.869 16.713 678 HB3 LYS 94 HB3 LYS 94 -6.680 -40.532 16.981 679 HG2 LYS 94 HG2 LYS 94 -6.368 -40.765 14.524 680 HG3 LYS 94 HG3 LYS 94 -6.715 -39.042 14.366 681 HD2 LYS 94 HD2 LYS 94 -4.524 -40.135 16.122 682 HD3 LYS 94 HD3 LYS 94 -4.272 -39.657 14.441 683 HE2 LYS 94 HE2 LYS 94 -3.776 -37.658 15.351 684 HE3 LYS 94 HE3 LYS 94 -5.528 -37.464 15.395 685 HZ1 LYS 94 HZ1 LYS 94 -4.760 -36.919 17.529 686 HZ2 LYS 94 HZ2 LYS 94 -3.729 -38.257 17.608 687 HZ3 LYS 94 HZ3 LYS 94 -5.404 -38.476 17.684 688 H ARG 95 H ARG 95 -10.151 -38.348 16.238 689 HA ARG 95 HA ARG 95 -11.191 -38.322 13.600 690 HB2 ARG 95 HB2 ARG 95 -12.260 -37.361 15.707 691 HB3 ARG 95 HB3 ARG 95 -11.187 -35.984 15.502 692 HG2 ARG 95 HG2 ARG 95 -12.228 -35.315 13.524 693 HG3 ARG 95 HG3 ARG 95 -13.003 -36.884 13.297 694 HD2 ARG 95 HD2 ARG 95 -14.663 -35.315 14.023 695 HD3 ARG 95 HD3 ARG 95 -14.350 -36.446 15.339 696 HE ARG 95 HE ARG 95 -12.695 -34.403 15.916 697 HH11 ARG 95 HH11 ARG 95 -16.083 -34.542 15.127 698 HH12 ARG 95 HH12 ARG 95 -16.493 -33.148 16.071 699 HH21 ARG 95 HH21 ARG 95 -13.223 -32.566 17.161 700 HH22 ARG 95 HH22 ARG 95 -14.866 -32.024 17.227 701 H LYS 96 H LYS 96 -10.748 -36.984 11.866 702 HA LYS 96 HA LYS 96 -8.176 -35.553 12.005 703 HB2 LYS 96 HB2 LYS 96 -7.942 -36.004 9.600 704 HB3 LYS 96 HB3 LYS 96 -8.078 -37.491 10.529 705 HG2 LYS 96 HG2 LYS 96 -10.265 -37.888 9.787 706 HG3 LYS 96 HG3 LYS 96 -10.455 -36.234 9.201 707 HD2 LYS 96 HD2 LYS 96 -8.275 -37.871 8.024 708 HD3 LYS 96 HD3 LYS 96 -9.933 -38.267 7.568 709 HE2 LYS 96 HE2 LYS 96 -10.300 -35.978 6.838 710 HE3 LYS 96 HE3 LYS 96 -8.675 -35.533 7.357 711 HZ1 LYS 96 HZ1 LYS 96 -8.006 -36.066 5.327 712 HZ2 LYS 96 HZ2 LYS 96 -9.512 -36.716 4.917 713 HZ3 LYS 96 HZ3 LYS 96 -8.351 -37.686 5.673 714 H MET 97 H MET 97 -7.989 -33.773 10.338 715 HA MET 97 HA MET 97 -10.550 -32.425 9.859 716 HB2 MET 97 HB2 MET 97 -9.514 -30.270 10.571 717 HB3 MET 97 HB3 MET 97 -9.737 -31.418 11.884 718 HG2 MET 97 HG2 MET 97 -7.371 -32.041 11.724 719 HG3 MET 97 HG3 MET 97 -7.159 -30.854 10.438 720 HE1 MET 97 HE1 MET 97 -6.149 -30.095 14.573 721 HE2 MET 97 HE2 MET 97 -6.728 -31.637 13.944 722 HE3 MET 97 HE3 MET 97 -5.344 -30.842 13.193 723 H ASP 98 H ASP 98 -10.172 -30.425 8.429 724 HA ASP 98 HA ASP 98 -8.182 -31.119 6.368 725 HB2 ASP 98 HB2 ASP 98 -11.008 -30.130 6.147 726 HB3 ASP 98 HB3 ASP 98 -9.856 -29.815 4.852 727 H GLU 99 H GLU 99 -7.662 -29.172 4.928 728 HA GLU 99 HA GLU 99 -7.520 -26.705 6.520 729 HB2 GLU 99 HB2 GLU 99 -5.374 -28.102 6.558 730 HB3 GLU 99 HB3 GLU 99 -5.208 -27.688 4.857 731 HG2 GLU 99 HG2 GLU 99 -5.156 -25.322 5.423 732 HG3 GLU 99 HG3 GLU 99 -5.356 -25.720 7.129 733 H THR 100 H THR 100 -7.566 -24.790 5.366 734 HA THR 100 HA THR 100 -8.968 -24.778 2.942 735 HB THR 100 HB THR 100 -9.009 -22.872 4.480 736 HG1 THR 100 HG1 THR 100 -9.489 -22.465 2.285 737 HG21 THR 100 HG21 THR 100 -7.141 -21.349 4.674 738 HG22 THR 100 HG22 THR 100 -6.189 -22.321 3.552 739 HG23 THR 100 HG23 THR 100 -6.619 -22.968 5.135 740 H ASP 101 H ASP 101 -8.287 -23.918 0.867 741 HA ASP 101 HA ASP 101 -6.038 -25.227 -0.175 742 HB2 ASP 101 HB2 ASP 101 -6.475 -23.986 -2.233 743 HB3 ASP 101 HB3 ASP 101 -7.984 -24.571 -1.538 744 H ALA 102 H ALA 102 -3.990 -24.570 -0.688 745 HA ALA 102 HA ALA 102 -2.981 -22.287 0.777 746 HB1 ALA 102 HB1 ALA 102 -1.938 -24.763 0.023 747 HB2 ALA 102 HB2 ALA 102 -1.015 -23.570 -0.892 748 HB3 ALA 102 HB3 ALA 102 -1.098 -23.462 0.866 749 H SER 103 H SER 103 -1.083 -21.108 -0.504 750 HA SER 103 HA SER 103 -2.103 -20.313 -3.145 751 HB2 SER 103 HB2 SER 103 -2.816 -18.437 -2.047 752 HB3 SER 103 HB3 SER 103 -1.643 -18.625 -0.743 753 HG SER 103 HG SER 103 -1.057 -16.857 -1.977 754 H SER 104 H SER 104 -0.603 -20.364 -4.679 755 HA SER 104 HA SER 104 2.157 -19.706 -4.107 756 HB2 SER 104 HB2 SER 104 3.005 -21.852 -5.083 757 HB3 SER 104 HB3 SER 104 2.195 -22.052 -3.530 758 HG SER 104 HG SER 104 1.648 -23.316 -5.733 759 H ALA 105 H ALA 105 3.459 -19.519 -6.052 760 HA ALA 105 HA ALA 105 1.920 -19.401 -8.549 761 HB1 ALA 105 HB1 ALA 105 3.281 -17.218 -8.979 762 HB2 ALA 105 HB2 ALA 105 1.797 -17.162 -8.026 763 HB3 ALA 105 HB3 ALA 105 3.365 -17.154 -7.218 764 H VAL 106 H VAL 106 3.309 -21.485 -8.510 765 HA VAL 106 HA VAL 106 5.939 -20.868 -9.694 766 HB VAL 106 HB VAL 106 6.739 -23.038 -8.934 767 HG11 VAL 106 HG11 VAL 106 6.230 -20.822 -7.331 768 HG12 VAL 106 HG12 VAL 106 5.740 -22.207 -6.353 769 HG13 VAL 106 HG13 VAL 106 7.376 -22.123 -7.008 770 HG21 VAL 106 HG21 VAL 106 5.254 -24.236 -7.207 771 HG22 VAL 106 HG22 VAL 106 3.926 -23.332 -7.935 772 HG23 VAL 106 HG23 VAL 106 4.878 -24.445 -8.917 773 H LYS 107 H LYS 107 6.495 -21.848 -11.598 774 HA LYS 107 HA LYS 107 4.599 -23.746 -12.783 775 HB2 LYS 107 HB2 LYS 107 5.487 -21.119 -13.937 776 HB3 LYS 107 HB3 LYS 107 5.018 -22.446 -14.991 777 HG2 LYS 107 HG2 LYS 107 3.214 -21.499 -12.796 778 HG3 LYS 107 HG3 LYS 107 3.252 -20.699 -14.369 779 HD2 LYS 107 HD2 LYS 107 3.073 -23.350 -15.051 780 HD3 LYS 107 HD3 LYS 107 2.085 -23.263 -13.591 781 HE2 LYS 107 HE2 LYS 107 1.141 -21.107 -14.806 782 HE3 LYS 107 HE3 LYS 107 1.693 -21.971 -16.241 783 HZ1 LYS 107 HZ1 LYS 107 -0.690 -22.350 -15.424 784 HZ2 LYS 107 HZ2 LYS 107 0.010 -23.320 -14.229 785 HZ3 LYS 107 HZ3 LYS 107 0.226 -23.703 -15.862 786 H VAL 108 H VAL 108 6.114 -25.391 -12.462 787 HA VAL 108 HA VAL 108 7.932 -25.826 -14.562 788 HB VAL 108 HB VAL 108 9.351 -24.199 -13.461 789 HG11 VAL 108 HG11 VAL 108 8.351 -24.465 -11.199 790 HG12 VAL 108 HG12 VAL 108 9.264 -25.964 -11.018 791 HG13 VAL 108 HG13 VAL 108 10.114 -24.429 -11.197 792 HG21 VAL 108 HG21 VAL 108 10.366 -26.997 -12.969 793 HG22 VAL 108 HG22 VAL 108 10.402 -26.155 -14.518 794 HG23 VAL 108 HG23 VAL 108 11.351 -25.547 -13.161 795 H LYS 109 H LYS 109 8.605 -27.940 -14.642 796 HA LYS 109 HA LYS 109 8.732 -29.684 -12.428 797 HB2 LYS 109 HB2 LYS 109 6.132 -29.175 -13.092 798 HB3 LYS 109 HB3 LYS 109 6.463 -30.603 -14.064 799 HG2 LYS 109 HG2 LYS 109 6.526 -31.959 -12.281 800 HG3 LYS 109 HG3 LYS 109 7.374 -30.776 -11.282 801 HD2 LYS 109 HD2 LYS 109 5.304 -30.948 -10.241 802 HD3 LYS 109 HD3 LYS 109 5.111 -29.522 -11.264 803 HE2 LYS 109 HE2 LYS 109 3.869 -30.735 -12.875 804 HE3 LYS 109 HE3 LYS 109 4.302 -32.282 -12.147 805 HZ1 LYS 109 HZ1 LYS 109 3.086 -31.315 -10.099 806 HZ2 LYS 109 HZ2 LYS 109 2.178 -31.952 -11.375 807 HZ3 LYS 109 HZ3 LYS 109 2.359 -30.277 -11.219 808 H ARG 110 H ARG 110 7.730 -29.733 -15.853 809 HA ARG 110 HA ARG 110 8.671 -30.733 -17.675 810 HB2 ARG 110 HB2 ARG 110 10.837 -30.006 -16.429 811 HB3 ARG 110 HB3 ARG 110 10.968 -31.709 -16.010 812 HG2 ARG 110 HG2 ARG 110 12.265 -31.504 -17.924 813 HG3 ARG 110 HG3 ARG 110 10.734 -32.145 -18.525 814 HD2 ARG 110 HD2 ARG 110 10.047 -29.830 -19.092 815 HD3 ARG 110 HD3 ARG 110 11.645 -29.272 -18.601 816 HE ARG 110 HE ARG 110 12.136 -31.212 -20.458 817 HH11 ARG 110 HH11 ARG 110 10.284 -28.265 -20.402 818 HH12 ARG 110 HH12 ARG 110 10.498 -27.945 -22.092 819 HH21 ARG 110 HH21 ARG 110 12.425 -30.801 -22.684 820 HH22 ARG 110 HH22 ARG 110 11.715 -29.389 -23.388 821 H ALA 111 H ALA 111 9.756 -32.818 -14.993 822 HA ALA 111 HA ALA 111 9.428 -35.028 -14.559 823 HB1 ALA 111 HB1 ALA 111 6.779 -34.704 -15.949 824 HB2 ALA 111 HB2 ALA 111 7.206 -35.851 -14.678 825 HB3 ALA 111 HB3 ALA 111 7.092 -34.129 -14.311 826 H VAL 112 H VAL 112 8.348 -37.133 -15.817 827 HA VAL 112 HA VAL 112 9.295 -37.099 -18.589 828 HB VAL 112 HB VAL 112 10.548 -39.176 -18.291 829 HG11 VAL 112 HG11 VAL 112 11.451 -36.736 -17.790 830 HG12 VAL 112 HG12 VAL 112 11.699 -37.427 -16.185 831 HG13 VAL 112 HG13 VAL 112 12.467 -38.163 -17.592 832 HG21 VAL 112 HG21 VAL 112 11.074 -39.523 -15.666 833 HG22 VAL 112 HG22 VAL 112 9.388 -39.010 -15.588 834 HG23 VAL 112 HG23 VAL 112 9.837 -40.420 -16.548 835 H GLN 113 H GLN 113 8.942 -39.532 -19.444 836 HA GLN 113 HA GLN 113 6.109 -40.067 -18.936 837 HB2 GLN 113 HB2 GLN 113 7.561 -39.841 -21.287 838 HB3 GLN 113 HB3 GLN 113 7.338 -41.576 -21.105 839 HG2 GLN 113 HG2 GLN 113 5.573 -40.531 -22.445 840 HG3 GLN 113 HG3 GLN 113 4.949 -41.304 -20.988 841 HE21 GLN 113 HE21 GLN 113 3.696 -40.150 -19.688 842 HE22 GLN 113 HE22 GLN 113 3.468 -38.439 -19.769 843 H LYS 114 H LYS 114 5.367 -41.969 -18.160 844 HA LYS 114 HA LYS 114 7.269 -43.743 -16.926 845 HB2 LYS 114 HB2 LYS 114 4.249 -43.803 -17.052 846 HB3 LYS 114 HB3 LYS 114 5.222 -44.936 -16.124 847 HG2 LYS 114 HG2 LYS 114 6.109 -43.072 -14.799 848 HG3 LYS 114 HG3 LYS 114 5.094 -41.955 -15.714 849 HD2 LYS 114 HD2 LYS 114 3.859 -42.364 -13.778 850 HD3 LYS 114 HD3 LYS 114 3.138 -43.450 -14.967 851 HE2 LYS 114 HE2 LYS 114 4.630 -45.258 -14.090 852 HE3 LYS 114 HE3 LYS 114 5.119 -44.153 -12.807 853 HZ1 LYS 114 HZ1 LYS 114 2.483 -45.394 -13.268 854 HZ2 LYS 114 HZ2 LYS 114 2.617 -43.975 -12.357 855 HZ3 LYS 114 HZ3 LYS 114 3.418 -45.380 -11.858 Start of MODEL 16 1 H1 MET 1 H MET 1 -16.000 -24.071 -14.991 2 HA MET 1 HA MET 1 -15.962 -23.154 -17.250 3 HB2 MET 1 HB2 MET 1 -15.409 -20.548 -15.821 4 HB3 MET 1 HB3 MET 1 -15.543 -20.776 -17.560 5 HG2 MET 1 HG2 MET 1 -17.922 -21.760 -16.743 6 HG3 MET 1 HG3 MET 1 -17.633 -20.529 -15.516 7 HE1 MET 1 HE1 MET 1 -17.727 -17.238 -17.248 8 HE2 MET 1 HE2 MET 1 -18.771 -18.031 -16.068 9 HE3 MET 1 HE3 MET 1 -17.019 -18.203 -15.953 10 H ALA 2 H ALA 2 -14.088 -23.361 -18.366 11 HA ALA 2 HA ALA 2 -11.554 -22.733 -17.063 12 HB1 ALA 2 HB1 ALA 2 -12.488 -25.277 -16.871 13 HB2 ALA 2 HB2 ALA 2 -11.528 -25.369 -18.348 14 HB3 ALA 2 HB3 ALA 2 -10.782 -24.829 -16.844 15 H GLY 3 H GLY 3 -9.701 -23.407 -18.698 16 HA2 GLY 3 HA2 GLY 3 -10.459 -23.151 -21.481 17 HA3 GLY 3 HA3 GLY 3 -9.658 -21.736 -20.813 18 H SER 4 H SER 4 -9.229 -24.746 -22.264 19 HA SER 4 HA SER 4 -6.682 -25.441 -21.216 20 HB2 SER 4 HB2 SER 4 -7.737 -26.197 -23.943 21 HB3 SER 4 HB3 SER 4 -6.588 -27.084 -22.943 22 HG SER 4 HG SER 4 -8.312 -28.104 -22.299 23 H HIS 5 H HIS 5 -4.746 -25.633 -22.762 24 HA HIS 5 HA HIS 5 -4.487 -23.200 -24.393 25 HB2 HIS 5 HB2 HIS 5 -2.140 -22.986 -23.522 26 HB3 HIS 5 HB3 HIS 5 -3.393 -22.670 -22.326 27 HD1 HIS 5 HD1 HIS 5 -0.544 -24.897 -23.072 28 HD2 HIS 5 HD2 HIS 5 -3.675 -24.714 -20.347 29 HE1 HIS 5 HE1 HIS 5 0.053 -26.526 -21.252 30 H HIS 6 H HIS 6 -3.155 -26.388 -23.609 31 HA HIS 6 HA HIS 6 -2.406 -26.677 -26.437 32 HB2 HIS 6 HB2 HIS 6 -0.635 -26.647 -24.173 33 HB3 HIS 6 HB3 HIS 6 -0.599 -28.238 -24.927 34 HD1 HIS 6 HD1 HIS 6 0.527 -28.438 -27.198 35 HD2 HIS 6 HD2 HIS 6 0.276 -24.524 -25.829 36 HE1 HIS 6 HE1 HIS 6 1.980 -27.090 -28.746 37 H HIS 7 H HIS 7 -2.292 -28.718 -23.516 38 HA HIS 7 HA HIS 7 -3.469 -30.912 -25.012 39 HB2 HIS 7 HB2 HIS 7 -1.624 -30.752 -22.927 40 HB3 HIS 7 HB3 HIS 7 -3.073 -31.417 -22.179 41 HD1 HIS 7 HD1 HIS 7 -2.581 -33.843 -21.988 42 HD2 HIS 7 HD2 HIS 7 -1.611 -32.344 -25.739 43 HE1 HIS 7 HE1 HIS 7 -1.913 -35.843 -23.359 44 H HIS 8 H HIS 8 -5.399 -31.948 -24.484 45 HA HIS 8 HA HIS 8 -7.523 -30.303 -23.677 46 HB2 HIS 8 HB2 HIS 8 -7.810 -32.264 -25.138 47 HB3 HIS 8 HB3 HIS 8 -7.421 -33.326 -23.788 48 HD1 HIS 8 HD1 HIS 8 -9.180 -33.204 -21.729 49 HD2 HIS 8 HD2 HIS 8 -10.449 -31.642 -25.364 50 HE1 HIS 8 HE1 HIS 8 -11.685 -33.061 -21.562 51 H HIS 9 H HIS 9 -5.884 -32.949 -21.955 52 HA HIS 9 HA HIS 9 -7.068 -31.934 -19.454 53 HB2 HIS 9 HB2 HIS 9 -7.357 -34.447 -20.475 54 HB3 HIS 9 HB3 HIS 9 -5.956 -34.663 -19.431 55 HD1 HIS 9 HD1 HIS 9 -8.550 -36.080 -18.722 56 HD2 HIS 9 HD2 HIS 9 -7.542 -32.306 -17.306 57 HE1 HIS 9 HE1 HIS 9 -9.887 -35.773 -16.615 58 H HIS 10 H HIS 10 -5.727 -31.178 -17.948 59 HA HIS 10 HA HIS 10 -2.955 -30.914 -18.443 60 HB2 HIS 10 HB2 HIS 10 -4.394 -29.361 -17.058 61 HB3 HIS 10 HB3 HIS 10 -4.330 -30.567 -15.775 62 HD1 HIS 10 HD1 HIS 10 -2.309 -27.936 -17.452 63 HD2 HIS 10 HD2 HIS 10 -1.820 -30.819 -14.501 64 HE1 HIS 10 HE1 HIS 10 -0.152 -27.356 -16.296 65 H GLY 11 H GLY 11 -1.713 -32.697 -18.521 66 HA2 GLY 11 HA2 GLY 11 -0.432 -34.407 -17.644 67 HA3 GLY 11 HA3 GLY 11 -1.198 -34.126 -16.088 68 H SER 12 H SER 12 -0.919 -36.235 -18.670 69 HA SER 12 HA SER 12 -3.511 -37.506 -18.182 70 HB2 SER 12 HB2 SER 12 -2.649 -37.090 -20.536 71 HB3 SER 12 HB3 SER 12 -1.436 -38.330 -20.218 72 HG SER 12 HG SER 12 -3.140 -39.363 -21.155 73 H MET 13 H MET 13 -0.216 -38.752 -18.744 74 HA MET 13 HA MET 13 -0.732 -41.086 -17.161 75 HB2 MET 13 HB2 MET 13 1.586 -40.022 -18.711 76 HB3 MET 13 HB3 MET 13 1.887 -41.268 -17.507 77 HG2 MET 13 HG2 MET 13 -0.317 -41.738 -19.424 78 HG3 MET 13 HG3 MET 13 1.332 -41.821 -20.041 79 HE1 MET 13 HE1 MET 13 2.090 -43.978 -20.507 80 HE2 MET 13 HE2 MET 13 1.620 -45.482 -19.715 81 HE3 MET 13 HE3 MET 13 0.426 -44.552 -20.622 82 H SER 14 H SER 14 -1.176 -40.435 -15.069 83 HA SER 14 HA SER 14 1.156 -39.707 -13.491 84 HB2 SER 14 HB2 SER 14 0.293 -37.764 -12.529 85 HB3 SER 14 HB3 SER 14 -0.205 -37.601 -14.213 86 HG SER 14 HG SER 14 -1.730 -38.099 -11.939 87 H GLU 15 H GLU 15 1.065 -40.410 -11.371 88 HA GLU 15 HA GLU 15 -1.239 -42.126 -10.729 89 HB2 GLU 15 HB2 GLU 15 1.510 -42.700 -10.785 90 HB3 GLU 15 HB3 GLU 15 1.079 -42.621 -9.082 91 HG2 GLU 15 HG2 GLU 15 -0.953 -44.102 -10.298 92 HG3 GLU 15 HG3 GLU 15 0.552 -44.683 -11.007 93 H TYR 16 H TYR 16 -0.851 -42.547 -8.072 94 HA TYR 16 HA TYR 16 -0.907 -39.874 -6.848 95 HB2 TYR 16 HB2 TYR 16 -2.793 -40.917 -5.369 96 HB3 TYR 16 HB3 TYR 16 -3.190 -40.266 -6.955 97 HD1 TYR 16 HD1 TYR 16 -2.431 -43.432 -5.164 98 HD2 TYR 16 HD2 TYR 16 -4.204 -41.619 -8.581 99 HE1 TYR 16 HE1 TYR 16 -3.402 -45.600 -5.803 100 HE2 TYR 16 HE2 TYR 16 -5.181 -43.781 -9.228 101 HH TYR 16 HH TYR 16 -4.454 -46.359 -8.703 102 H ILE 17 H ILE 17 -1.114 -40.235 -4.318 103 HA ILE 17 HA ILE 17 0.903 -42.260 -3.593 104 HB ILE 17 HB ILE 17 1.934 -40.166 -3.269 105 HG12 ILE 17 HG12 ILE 17 0.766 -40.907 -0.579 106 HG13 ILE 17 HG13 ILE 17 2.099 -41.757 -1.352 107 HG21 ILE 17 HG21 ILE 17 0.402 -38.667 -1.512 108 HG22 ILE 17 HG22 ILE 17 0.632 -38.361 -3.233 109 HG23 ILE 17 HG23 ILE 17 -0.761 -39.291 -2.682 110 HD11 ILE 17 HD11 ILE 17 3.206 -40.355 0.081 111 HD12 ILE 17 HD12 ILE 17 3.198 -39.397 -1.400 112 HD13 ILE 17 HD13 ILE 17 2.037 -39.050 -0.119 113 H ARG 18 H ARG 18 0.267 -43.781 -2.221 114 HA ARG 18 HA ARG 18 -2.143 -43.285 -0.601 115 HB2 ARG 18 HB2 ARG 18 -1.319 -45.521 -2.271 116 HB3 ARG 18 HB3 ARG 18 -1.726 -46.033 -0.639 117 HG2 ARG 18 HG2 ARG 18 -3.764 -44.287 -1.339 118 HG3 ARG 18 HG3 ARG 18 -3.452 -45.218 -2.805 119 HD2 ARG 18 HD2 ARG 18 -3.579 -46.729 -0.264 120 HD3 ARG 18 HD3 ARG 18 -5.094 -46.050 -0.859 121 HE ARG 18 HE ARG 18 -3.655 -47.463 -2.886 122 HH11 ARG 18 HH11 ARG 18 -5.810 -47.832 -0.176 123 HH12 ARG 18 HH12 ARG 18 -6.477 -49.328 -0.743 124 HH21 ARG 18 HH21 ARG 18 -4.525 -49.431 -3.643 125 HH22 ARG 18 HH22 ARG 18 -5.744 -50.236 -2.715 126 H VAL 19 H VAL 19 -1.492 -42.718 1.383 127 HA VAL 19 HA VAL 19 0.176 -44.593 2.866 128 HB VAL 19 HB VAL 19 1.400 -42.558 3.877 129 HG11 VAL 19 HG11 VAL 19 3.179 -42.737 2.243 130 HG12 VAL 19 HG12 VAL 19 2.452 -44.322 2.515 131 HG13 VAL 19 HG13 VAL 19 2.058 -43.407 1.059 132 HG21 VAL 19 HG21 VAL 19 -0.229 -41.165 2.162 133 HG22 VAL 19 HG22 VAL 19 1.232 -40.539 2.927 134 HG23 VAL 19 HG23 VAL 19 1.307 -41.205 1.295 135 H THR 20 H THR 20 0.247 -43.964 5.237 136 HA THR 20 HA THR 20 -2.061 -42.406 6.111 137 HB THR 20 HB THR 20 -3.226 -44.382 6.175 138 HG1 THR 20 HG1 THR 20 -2.849 -43.530 8.378 139 HG21 THR 20 HG21 THR 20 -0.543 -45.647 6.476 140 HG22 THR 20 HG22 THR 20 -1.840 -46.014 5.339 141 HG23 THR 20 HG23 THR 20 -1.965 -46.537 7.018 142 H GLU 21 H GLU 21 -1.695 -41.327 7.965 143 HA GLU 21 HA GLU 21 0.917 -41.293 9.074 144 HB2 GLU 21 HB2 GLU 21 -0.878 -39.412 8.965 145 HB3 GLU 21 HB3 GLU 21 -1.471 -40.119 10.461 146 HG2 GLU 21 HG2 GLU 21 1.381 -39.736 10.566 147 HG3 GLU 21 HG3 GLU 21 0.552 -38.233 10.168 148 H ASP 22 H ASP 22 -2.120 -42.767 10.037 149 HA ASP 22 HA ASP 22 -0.943 -43.737 12.527 150 HB2 ASP 22 HB2 ASP 22 -3.643 -43.247 11.550 151 HB3 ASP 22 HB3 ASP 22 -3.491 -44.828 12.311 152 H GLU 23 H GLU 23 -1.382 -46.068 13.094 153 HA GLU 23 HA GLU 23 -0.443 -47.724 10.896 154 HB2 GLU 23 HB2 GLU 23 0.027 -49.395 12.589 155 HB3 GLU 23 HB3 GLU 23 0.672 -47.841 13.096 156 HG2 GLU 23 HG2 GLU 23 -1.280 -47.520 14.548 157 HG3 GLU 23 HG3 GLU 23 -1.883 -49.104 14.063 158 H ASN 24 H ASN 24 -3.237 -47.398 13.000 159 HA ASN 24 HA ASN 24 -4.511 -49.758 11.892 160 HB2 ASN 24 HB2 ASN 24 -4.685 -48.571 14.333 161 HB3 ASN 24 HB3 ASN 24 -6.116 -47.913 13.546 162 HD21 ASN 24 HD21 ASN 24 -6.039 -49.705 15.766 163 HD22 ASN 24 HD22 ASN 24 -6.838 -51.157 15.279 164 H ASP 25 H ASP 25 -4.544 -46.312 11.471 165 HA ASP 25 HA ASP 25 -7.035 -46.132 10.108 166 HB2 ASP 25 HB2 ASP 25 -5.571 -44.262 11.207 167 HB3 ASP 25 HB3 ASP 25 -4.788 -44.205 9.630 168 H GLU 26 H GLU 26 -7.541 -46.513 8.041 169 HA GLU 26 HA GLU 26 -5.869 -47.963 6.346 170 HB2 GLU 26 HB2 GLU 26 -7.592 -47.900 4.787 171 HB3 GLU 26 HB3 GLU 26 -8.442 -47.659 6.306 172 HG2 GLU 26 HG2 GLU 26 -7.667 -45.522 4.335 173 HG3 GLU 26 HG3 GLU 26 -9.288 -46.158 4.616 174 HA PRO 27 HA PRO 27 -3.293 -45.038 4.328 175 HB2 PRO 27 HB2 PRO 27 -3.097 -46.125 1.848 176 HB3 PRO 27 HB3 PRO 27 -2.304 -46.820 3.267 177 HG2 PRO 27 HG2 PRO 27 -4.867 -47.625 1.946 178 HG3 PRO 27 HG3 PRO 27 -3.559 -48.648 2.568 179 HD2 PRO 27 HD2 PRO 27 -5.852 -48.217 3.943 180 HD3 PRO 27 HD3 PRO 27 -4.290 -48.474 4.747 181 H ILE 28 H ILE 28 -4.071 -43.058 3.918 182 HA ILE 28 HA ILE 28 -6.419 -42.569 2.383 183 HB ILE 28 HB ILE 28 -5.782 -41.037 4.154 184 HG12 ILE 28 HG12 ILE 28 -5.997 -38.909 2.924 185 HG13 ILE 28 HG13 ILE 28 -5.598 -39.740 1.425 186 HG21 ILE 28 HG21 ILE 28 -3.776 -39.440 3.323 187 HG22 ILE 28 HG22 ILE 28 -3.552 -40.819 4.398 188 HG23 ILE 28 HG23 ILE 28 -3.239 -40.987 2.670 189 HD11 ILE 28 HD11 ILE 28 -7.763 -41.103 2.654 190 HD12 ILE 28 HD12 ILE 28 -8.128 -39.377 2.613 191 HD13 ILE 28 HD13 ILE 28 -7.727 -40.229 1.122 192 H GLU 29 H GLU 29 -6.643 -41.691 0.336 193 HA GLU 29 HA GLU 29 -4.274 -41.962 -1.386 194 HB2 GLU 29 HB2 GLU 29 -5.926 -42.176 -3.247 195 HB3 GLU 29 HB3 GLU 29 -6.026 -43.460 -2.050 196 HG2 GLU 29 HG2 GLU 29 -8.163 -43.022 -1.710 197 HG3 GLU 29 HG3 GLU 29 -7.784 -41.354 -1.283 198 H ILE 30 H ILE 30 -3.338 -40.102 -1.887 199 HA ILE 30 HA ILE 30 -5.050 -37.742 -2.325 200 HB ILE 30 HB ILE 30 -2.559 -36.695 -1.860 201 HG12 ILE 30 HG12 ILE 30 -2.960 -38.790 0.270 202 HG13 ILE 30 HG13 ILE 30 -1.920 -39.067 -1.123 203 HG21 ILE 30 HG21 ILE 30 -4.059 -35.491 -0.725 204 HG22 ILE 30 HG22 ILE 30 -5.114 -36.881 -0.477 205 HG23 ILE 30 HG23 ILE 30 -3.757 -36.600 0.613 206 HD11 ILE 30 HD11 ILE 30 -0.590 -37.098 -0.476 207 HD12 ILE 30 HD12 ILE 30 -1.598 -36.922 0.960 208 HD13 ILE 30 HD13 ILE 30 -0.600 -38.361 0.755 209 HA PRO 31 HA PRO 31 -3.463 -37.415 -6.406 210 HB2 PRO 31 HB2 PRO 31 -3.475 -34.723 -6.755 211 HB3 PRO 31 HB3 PRO 31 -4.952 -35.693 -6.716 212 HG2 PRO 31 HG2 PRO 31 -3.707 -34.051 -4.545 213 HG3 PRO 31 HG3 PRO 31 -5.413 -34.184 -5.008 214 HD2 PRO 31 HD2 PRO 31 -4.370 -35.512 -2.892 215 HD3 PRO 31 HD3 PRO 31 -5.697 -36.169 -3.871 216 H SER 32 H SER 32 -1.532 -37.293 -7.428 217 HA SER 32 HA SER 32 0.655 -35.884 -6.042 218 HB2 SER 32 HB2 SER 32 2.065 -37.676 -6.267 219 HB3 SER 32 HB3 SER 32 0.538 -38.556 -6.204 220 HG SER 32 HG SER 32 1.204 -39.321 -8.050 221 H GLU 33 H GLU 33 2.643 -35.945 -7.784 222 HA GLU 33 HA GLU 33 1.651 -34.289 -9.962 223 HB2 GLU 33 HB2 GLU 33 3.972 -34.284 -8.350 224 HB3 GLU 33 HB3 GLU 33 4.505 -34.621 -9.991 225 HG2 GLU 33 HG2 GLU 33 2.715 -32.559 -10.325 226 HG3 GLU 33 HG3 GLU 33 3.528 -32.153 -8.815 227 H ASP 34 H ASP 34 2.768 -34.528 -12.121 228 HA ASP 34 HA ASP 34 2.237 -37.099 -13.165 229 HB2 ASP 34 HB2 ASP 34 2.307 -34.716 -14.306 230 HB3 ASP 34 HB3 ASP 34 3.972 -35.174 -14.653 231 H ASP 35 H ASP 35 5.231 -35.433 -12.312 232 HA ASP 35 HA ASP 35 7.012 -37.354 -13.354 233 HB2 ASP 35 HB2 ASP 35 7.174 -34.953 -11.755 234 HB3 ASP 35 HB3 ASP 35 8.258 -36.189 -11.124 235 H GLY 36 H GLY 36 4.985 -37.380 -10.597 236 HA2 GLY 36 HA2 GLY 36 4.648 -39.631 -9.632 237 HA3 GLY 36 HA3 GLY 36 6.400 -39.775 -9.595 238 H THR 37 H THR 37 6.736 -36.985 -8.706 239 HA THR 37 HA THR 37 6.757 -37.442 -5.925 240 HB THR 37 HB THR 37 7.510 -35.173 -5.675 241 HG1 THR 37 HG1 THR 37 7.510 -33.950 -7.852 242 HG21 THR 37 HG21 THR 37 8.744 -35.673 -8.303 243 HG22 THR 37 HG22 THR 37 8.807 -37.023 -7.170 244 HG23 THR 37 HG23 THR 37 9.491 -35.461 -6.720 245 H VAL 38 H VAL 38 5.863 -35.237 -4.651 246 HA VAL 38 HA VAL 38 3.027 -34.928 -5.317 247 HB VAL 38 HB VAL 38 4.072 -35.911 -2.663 248 HG11 VAL 38 HG11 VAL 38 1.729 -34.284 -3.273 249 HG12 VAL 38 HG12 VAL 38 1.343 -35.778 -2.416 250 HG13 VAL 38 HG13 VAL 38 2.494 -34.635 -1.724 251 HG21 VAL 38 HG21 VAL 38 2.791 -37.832 -3.028 252 HG22 VAL 38 HG22 VAL 38 1.837 -37.067 -4.299 253 HG23 VAL 38 HG23 VAL 38 3.520 -37.500 -4.600 254 H LEU 39 H LEU 39 2.336 -32.898 -5.061 255 HA LEU 39 HA LEU 39 4.107 -30.822 -4.361 256 HB2 LEU 39 HB2 LEU 39 1.679 -31.007 -5.631 257 HB3 LEU 39 HB3 LEU 39 1.272 -30.163 -4.138 258 HG LEU 39 HG LEU 39 3.365 -29.266 -6.119 259 HD11 LEU 39 HD11 LEU 39 1.128 -27.503 -5.829 260 HD12 LEU 39 HD12 LEU 39 0.569 -29.107 -6.301 261 HD13 LEU 39 HD13 LEU 39 1.767 -28.267 -7.284 262 HD21 LEU 39 HD21 LEU 39 3.922 -28.486 -3.937 263 HD22 LEU 39 HD22 LEU 39 2.251 -28.028 -3.609 264 HD23 LEU 39 HD23 LEU 39 3.190 -27.139 -4.809 265 H LEU 40 H LEU 40 4.438 -29.709 -2.509 266 HA LEU 40 HA LEU 40 4.020 -30.831 -0.036 267 HB2 LEU 40 HB2 LEU 40 5.563 -28.942 -0.618 268 HB3 LEU 40 HB3 LEU 40 4.168 -27.867 -0.549 269 HG LEU 40 HG LEU 40 3.904 -28.276 1.807 270 HD11 LEU 40 HD11 LEU 40 5.627 -30.557 1.230 271 HD12 LEU 40 HD12 LEU 40 4.461 -30.313 2.530 272 HD13 LEU 40 HD13 LEU 40 6.096 -29.668 2.680 273 HD21 LEU 40 HD21 LEU 40 5.782 -27.128 2.603 274 HD22 LEU 40 HD22 LEU 40 5.659 -26.647 0.911 275 HD23 LEU 40 HD23 LEU 40 6.848 -27.855 1.401 276 H SER 41 H SER 41 1.985 -28.490 -1.735 277 HA SER 41 HA SER 41 0.182 -27.852 0.253 278 HB2 SER 41 HB2 SER 41 -0.286 -28.231 -2.710 279 HB3 SER 41 HB3 SER 41 -1.472 -27.520 -1.616 280 HG SER 41 HG SER 41 1.146 -26.545 -2.127 281 H THR 42 H THR 42 0.372 -30.751 -1.714 282 HA THR 42 HA THR 42 -2.151 -31.815 -0.912 283 HB THR 42 HB THR 42 0.229 -33.328 -2.002 284 HG1 THR 42 HG1 THR 42 -0.212 -31.952 -3.610 285 HG21 THR 42 HG21 THR 42 -1.067 -35.133 -1.863 286 HG22 THR 42 HG22 THR 42 -2.291 -34.339 -2.854 287 HG23 THR 42 HG23 THR 42 -2.330 -34.169 -1.099 288 H VAL 43 H VAL 43 1.183 -32.242 0.182 289 HA VAL 43 HA VAL 43 0.722 -34.339 1.996 290 HB VAL 43 HB VAL 43 2.853 -32.243 1.771 291 HG11 VAL 43 HG11 VAL 43 2.912 -32.361 4.062 292 HG12 VAL 43 HG12 VAL 43 2.298 -34.015 4.103 293 HG13 VAL 43 HG13 VAL 43 3.972 -33.705 3.640 294 HG21 VAL 43 HG21 VAL 43 2.459 -34.995 0.961 295 HG22 VAL 43 HG22 VAL 43 3.661 -33.823 0.422 296 HG23 VAL 43 HG23 VAL 43 3.956 -34.786 1.869 297 H THR 44 H THR 44 0.358 -30.863 2.283 298 HA THR 44 HA THR 44 -0.032 -30.897 5.129 299 HB THR 44 HB THR 44 -0.542 -28.559 4.953 300 HG1 THR 44 HG1 THR 44 -0.589 -27.710 2.656 301 HG21 THR 44 HG21 THR 44 1.617 -28.128 4.619 302 HG22 THR 44 HG22 THR 44 1.402 -28.308 2.878 303 HG23 THR 44 HG23 THR 44 1.805 -29.712 3.867 304 H ALA 45 H ALA 45 -2.073 -31.023 2.285 305 HA ALA 45 HA ALA 45 -4.543 -30.361 3.310 306 HB1 ALA 45 HB1 ALA 45 -5.271 -32.325 1.648 307 HB2 ALA 45 HB2 ALA 45 -4.722 -30.746 1.086 308 HB3 ALA 45 HB3 ALA 45 -3.602 -32.108 1.119 309 H GLN 46 H GLN 46 -2.962 -33.547 3.367 310 HA GLN 46 HA GLN 46 -5.026 -34.500 5.219 311 HB2 GLN 46 HB2 GLN 46 -3.425 -35.735 3.143 312 HB3 GLN 46 HB3 GLN 46 -3.284 -36.612 4.661 313 HG2 GLN 46 HG2 GLN 46 -5.993 -35.834 3.725 314 HG3 GLN 46 HG3 GLN 46 -5.169 -37.166 2.916 315 HE21 GLN 46 HE21 GLN 46 -3.876 -38.424 4.898 316 HE22 GLN 46 HE22 GLN 46 -4.989 -39.038 6.068 317 H PHE 47 H PHE 47 -1.624 -33.777 4.980 318 HA PHE 47 HA PHE 47 -1.339 -34.418 7.841 319 HB2 PHE 47 HB2 PHE 47 1.014 -34.502 5.987 320 HB3 PHE 47 HB3 PHE 47 0.781 -35.321 7.528 321 HD1 PHE 47 HD1 PHE 47 -1.649 -36.772 7.279 322 HD2 PHE 47 HD2 PHE 47 1.323 -36.044 4.321 323 HE1 PHE 47 HE1 PHE 47 -2.337 -38.814 6.091 324 HE2 PHE 47 HE2 PHE 47 0.640 -38.083 3.127 325 HZ PHE 47 HZ PHE 47 -1.192 -39.471 4.011 326 HA PRO 48 HA PRO 48 -0.521 -29.910 7.171 327 HB2 PRO 48 HB2 PRO 48 -1.874 -29.107 9.384 328 HB3 PRO 48 HB3 PRO 48 -2.658 -29.374 7.823 329 HG2 PRO 48 HG2 PRO 48 -2.525 -31.178 10.208 330 HG3 PRO 48 HG3 PRO 48 -3.904 -30.817 9.154 331 HD2 PRO 48 HD2 PRO 48 -2.442 -33.083 8.914 332 HD3 PRO 48 HD3 PRO 48 -3.204 -32.287 7.522 333 H GLY 49 H GLY 49 1.341 -29.091 7.892 334 HA2 GLY 49 HA2 GLY 49 2.856 -28.358 9.537 335 HA3 GLY 49 HA3 GLY 49 2.107 -29.458 10.685 336 H ALA 50 H ALA 50 2.260 -31.697 8.735 337 HA ALA 50 HA ALA 50 4.569 -32.932 9.602 338 HB1 ALA 50 HB1 ALA 50 3.073 -33.422 7.029 339 HB2 ALA 50 HB2 ALA 50 4.242 -34.524 7.758 340 HB3 ALA 50 HB3 ALA 50 2.734 -34.158 8.596 341 H CYS 51 H CYS 51 6.589 -32.240 9.357 342 HA CYS 51 HA CYS 51 7.392 -30.659 7.088 343 HB2 CYS 51 HB2 CYS 51 8.604 -31.495 9.662 344 HB3 CYS 51 HB3 CYS 51 9.721 -31.160 8.345 345 HG CYS 51 HG CYS 51 8.780 -28.542 7.940 346 H GLY 52 H GLY 52 7.739 -33.974 8.163 347 HA2 GLY 52 HA2 GLY 52 8.708 -34.700 5.512 348 HA3 GLY 52 HA3 GLY 52 9.780 -35.068 6.855 349 H LEU 53 H LEU 53 8.418 -36.868 4.972 350 HA LEU 53 HA LEU 53 6.774 -38.391 6.885 351 HB2 LEU 53 HB2 LEU 53 6.739 -38.732 3.901 352 HB3 LEU 53 HB3 LEU 53 5.572 -39.327 5.080 353 HG LEU 53 HG LEU 53 4.427 -37.586 4.094 354 HD11 LEU 53 HD11 LEU 53 5.116 -37.301 6.697 355 HD12 LEU 53 HD12 LEU 53 3.958 -36.274 5.854 356 HD13 LEU 53 HD13 LEU 53 5.630 -35.747 6.041 357 HD21 LEU 53 HD21 LEU 53 6.594 -36.844 2.888 358 HD22 LEU 53 HD22 LEU 53 6.743 -35.693 4.216 359 HD23 LEU 53 HD23 LEU 53 5.321 -35.657 3.171 360 H ARG 54 H ARG 54 7.226 -40.529 7.248 361 HA ARG 54 HA ARG 54 9.780 -41.489 6.156 362 HB2 ARG 54 HB2 ARG 54 8.992 -41.265 8.768 363 HB3 ARG 54 HB3 ARG 54 8.615 -42.948 8.425 364 HG2 ARG 54 HG2 ARG 54 10.775 -43.548 8.326 365 HG3 ARG 54 HG3 ARG 54 11.260 -42.058 7.514 366 HD2 ARG 54 HD2 ARG 54 12.295 -41.987 9.626 367 HD3 ARG 54 HD3 ARG 54 10.910 -40.902 9.745 368 HE ARG 54 HE ARG 54 10.084 -43.414 10.612 369 HH11 ARG 54 HH11 ARG 54 12.326 -40.928 11.568 370 HH12 ARG 54 HH12 ARG 54 12.228 -41.306 13.256 371 HH21 ARG 54 HH21 ARG 54 9.945 -43.921 12.832 372 HH22 ARG 54 HH22 ARG 54 10.874 -43.009 13.973 373 H TYR 55 H TYR 55 9.951 -43.881 5.883 374 HA TYR 55 HA TYR 55 7.504 -44.884 4.605 375 HB2 TYR 55 HB2 TYR 55 10.264 -44.872 3.838 376 HB3 TYR 55 HB3 TYR 55 9.721 -46.540 3.979 377 HD1 TYR 55 HD1 TYR 55 7.252 -46.888 2.904 378 HD2 TYR 55 HD2 TYR 55 10.078 -43.924 1.751 379 HE1 TYR 55 HE1 TYR 55 6.176 -46.729 0.698 380 HE2 TYR 55 HE2 TYR 55 9.009 -43.755 -0.457 381 HH TYR 55 HH TYR 55 6.661 -46.015 -1.539 382 H ARG 56 H ARG 56 6.472 -46.614 5.376 383 HA ARG 56 HA ARG 56 7.857 -48.314 7.340 384 HB2 ARG 56 HB2 ARG 56 6.239 -46.709 8.401 385 HB3 ARG 56 HB3 ARG 56 4.952 -47.505 7.505 386 HG2 ARG 56 HG2 ARG 56 6.657 -49.312 9.062 387 HG3 ARG 56 HG3 ARG 56 5.723 -48.158 10.018 388 HD2 ARG 56 HD2 ARG 56 3.740 -49.103 9.467 389 HD3 ARG 56 HD3 ARG 56 4.274 -49.528 7.841 390 HE ARG 56 HE ARG 56 4.771 -51.603 8.629 391 HH11 ARG 56 HH11 ARG 56 4.793 -49.378 11.307 392 HH12 ARG 56 HH12 ARG 56 5.076 -50.608 12.495 393 HH21 ARG 56 HH21 ARG 56 5.144 -53.230 10.183 394 HH22 ARG 56 HH22 ARG 56 5.276 -52.798 11.854 395 H ASN 57 H ASN 57 8.217 -50.058 6.051 396 HA ASN 57 HA ASN 57 5.853 -51.297 4.800 397 HB2 ASN 57 HB2 ASN 57 8.391 -50.625 3.678 398 HB3 ASN 57 HB3 ASN 57 8.246 -52.380 3.701 399 HD21 ASN 57 HD21 ASN 57 7.500 -53.144 1.874 400 HD22 ASN 57 HD22 ASN 57 6.312 -52.403 0.862 401 HA PRO 58 HA PRO 58 6.395 -54.832 7.347 402 HB2 PRO 58 HB2 PRO 58 5.527 -56.800 5.691 403 HB3 PRO 58 HB3 PRO 58 4.438 -55.629 6.444 404 HG2 PRO 58 HG2 PRO 58 5.573 -55.651 3.674 405 HG3 PRO 58 HG3 PRO 58 3.921 -55.280 4.204 406 HD2 PRO 58 HD2 PRO 58 5.720 -53.353 3.585 407 HD3 PRO 58 HD3 PRO 58 4.469 -53.129 4.825 408 H VAL 59 H VAL 59 7.474 -55.421 3.996 409 HA VAL 59 HA VAL 59 9.396 -57.391 4.801 410 HB VAL 59 HB VAL 59 10.124 -57.366 2.457 411 HG11 VAL 59 HG11 VAL 59 7.118 -57.298 2.537 412 HG12 VAL 59 HG12 VAL 59 8.163 -58.295 1.524 413 HG13 VAL 59 HG13 VAL 59 8.062 -58.600 3.258 414 HG21 VAL 59 HG21 VAL 59 8.665 -54.818 2.468 415 HG22 VAL 59 HG22 VAL 59 10.020 -55.347 1.471 416 HG23 VAL 59 HG23 VAL 59 8.377 -55.833 1.055 417 H SER 60 H SER 60 9.421 -53.957 4.207 418 HA SER 60 HA SER 60 12.294 -53.760 4.089 419 HB2 SER 60 HB2 SER 60 10.418 -52.171 3.087 420 HB3 SER 60 HB3 SER 60 10.578 -51.381 4.656 421 HG SER 60 HG SER 60 12.774 -51.954 2.958 422 H GLN 61 H GLN 61 9.811 -53.537 6.520 423 HA GLN 61 HA GLN 61 9.866 -53.220 8.773 424 HB2 GLN 61 HB2 GLN 61 12.725 -54.159 8.493 425 HB3 GLN 61 HB3 GLN 61 11.766 -54.169 9.967 426 HG2 GLN 61 HG2 GLN 61 10.150 -55.666 8.590 427 HG3 GLN 61 HG3 GLN 61 11.562 -55.925 7.566 428 HE21 GLN 61 HE21 GLN 61 10.419 -58.029 8.843 429 HE22 GLN 61 HE22 GLN 61 11.454 -58.593 10.106 430 H CYS 62 H CYS 62 10.217 -50.895 7.368 431 HA CYS 62 HA CYS 62 10.831 -48.724 7.644 432 HB2 CYS 62 HB2 CYS 62 10.783 -49.829 10.242 433 HB3 CYS 62 HB3 CYS 62 12.243 -48.851 10.148 434 HG CYS 62 HG CYS 62 11.019 -46.670 10.685 435 H MET 63 H MET 63 12.362 -48.242 6.194 436 HA MET 63 HA MET 63 15.148 -48.437 7.033 437 HB2 MET 63 HB2 MET 63 13.936 -49.972 4.829 438 HB3 MET 63 HB3 MET 63 15.420 -49.126 4.412 439 HG2 MET 63 HG2 MET 63 16.476 -50.208 6.416 440 HG3 MET 63 HG3 MET 63 15.022 -51.193 6.554 441 HE1 MET 63 HE1 MET 63 17.588 -50.066 3.645 442 HE2 MET 63 HE2 MET 63 18.400 -50.712 5.070 443 HE3 MET 63 HE3 MET 63 18.426 -51.615 3.555 444 H ARG 64 H ARG 64 13.588 -47.750 3.911 445 HA ARG 64 HA ARG 64 15.081 -45.300 3.657 446 HB2 ARG 64 HB2 ARG 64 13.894 -45.097 1.485 447 HB3 ARG 64 HB3 ARG 64 14.724 -46.635 1.678 448 HG2 ARG 64 HG2 ARG 64 12.809 -47.827 1.673 449 HG3 ARG 64 HG3 ARG 64 11.898 -46.572 2.514 450 HD2 ARG 64 HD2 ARG 64 10.940 -46.214 0.520 451 HD3 ARG 64 HD3 ARG 64 12.435 -45.363 0.133 452 HE ARG 64 HE ARG 64 12.888 -46.998 -1.384 453 HH11 ARG 64 HH11 ARG 64 10.671 -48.273 0.978 454 HH12 ARG 64 HH12 ARG 64 10.482 -49.794 0.171 455 HH21 ARG 64 HH21 ARG 64 12.648 -48.997 -2.456 456 HH22 ARG 64 HH22 ARG 64 11.607 -50.205 -1.782 457 H GLY 65 H GLY 65 13.568 -43.445 2.565 458 HA2 GLY 65 HA2 GLY 65 11.088 -43.074 4.016 459 HA3 GLY 65 HA3 GLY 65 12.394 -42.012 4.519 460 H VAL 66 H VAL 66 9.768 -41.521 3.148 461 HA VAL 66 HA VAL 66 10.020 -40.844 0.486 462 HB VAL 66 HB VAL 66 8.482 -39.335 2.604 463 HG11 VAL 66 HG11 VAL 66 7.114 -38.497 0.782 464 HG12 VAL 66 HG12 VAL 66 8.800 -38.036 0.541 465 HG13 VAL 66 HG13 VAL 66 8.106 -39.365 -0.389 466 HG21 VAL 66 HG21 VAL 66 7.628 -41.487 2.682 467 HG22 VAL 66 HG22 VAL 66 6.578 -40.707 1.498 468 HG23 VAL 66 HG23 VAL 66 7.884 -41.761 0.958 469 H ARG 67 H ARG 67 11.470 -39.615 -0.500 470 HA ARG 67 HA ARG 67 13.131 -37.759 0.860 471 HB2 ARG 67 HB2 ARG 67 13.973 -38.896 -1.088 472 HB3 ARG 67 HB3 ARG 67 12.669 -38.260 -2.081 473 HG2 ARG 67 HG2 ARG 67 14.668 -37.049 -2.572 474 HG3 ARG 67 HG3 ARG 67 13.565 -35.979 -1.706 475 HD2 ARG 67 HD2 ARG 67 14.937 -37.010 0.365 476 HD3 ARG 67 HD3 ARG 67 16.175 -37.090 -0.887 477 HE ARG 67 HE ARG 67 14.859 -34.542 -0.735 478 HH11 ARG 67 HH11 ARG 67 17.430 -36.512 0.540 479 HH12 ARG 67 HH12 ARG 67 18.381 -35.162 1.064 480 HH21 ARG 67 HH21 ARG 67 16.101 -32.756 -0.049 481 HH22 ARG 67 HH22 ARG 67 17.624 -33.026 0.729 482 H LEU 68 H LEU 68 13.101 -35.547 0.925 483 HA LEU 68 HA LEU 68 10.737 -34.221 -0.228 484 HB2 LEU 68 HB2 LEU 68 10.413 -34.429 2.146 485 HB3 LEU 68 HB3 LEU 68 12.018 -33.773 2.461 486 HG LEU 68 HG LEU 68 9.926 -32.280 2.808 487 HD11 LEU 68 HD11 LEU 68 11.638 -30.598 1.267 488 HD12 LEU 68 HD12 LEU 68 12.618 -31.779 2.136 489 HD13 LEU 68 HD13 LEU 68 11.501 -30.738 3.020 490 HD21 LEU 68 HD21 LEU 68 9.329 -32.917 0.286 491 HD22 LEU 68 HD22 LEU 68 10.299 -31.475 -0.017 492 HD23 LEU 68 HD23 LEU 68 8.871 -31.377 1.015 493 H VAL 69 H VAL 69 11.262 -32.716 -1.656 494 HA VAL 69 HA VAL 69 13.649 -31.077 -1.204 495 HB VAL 69 HB VAL 69 14.474 -32.701 -2.741 496 HG11 VAL 69 HG11 VAL 69 12.377 -33.653 -3.487 497 HG12 VAL 69 HG12 VAL 69 11.995 -32.179 -4.378 498 HG13 VAL 69 HG13 VAL 69 13.352 -33.188 -4.880 499 HG21 VAL 69 HG21 VAL 69 14.694 -30.127 -3.206 500 HG22 VAL 69 HG22 VAL 69 15.301 -31.306 -4.368 501 HG23 VAL 69 HG23 VAL 69 13.745 -30.521 -4.639 502 H GLU 70 H GLU 70 13.247 -28.979 -1.472 503 HA GLU 70 HA GLU 70 12.142 -27.041 -1.926 504 HB2 GLU 70 HB2 GLU 70 11.370 -28.534 -4.439 505 HB3 GLU 70 HB3 GLU 70 11.239 -26.797 -4.205 506 HG2 GLU 70 HG2 GLU 70 13.724 -28.462 -4.413 507 HG3 GLU 70 HG3 GLU 70 13.196 -27.141 -5.455 508 H GLY 71 H GLY 71 10.723 -29.246 -0.521 509 HA2 GLY 71 HA2 GLY 71 8.651 -29.148 0.572 510 HA3 GLY 71 HA3 GLY 71 8.067 -28.059 -0.678 511 H ILE 72 H ILE 72 9.069 -29.918 -2.793 512 HA ILE 72 HA ILE 72 6.672 -31.503 -2.979 513 HB ILE 72 HB ILE 72 9.057 -31.362 -4.828 514 HG12 ILE 72 HG12 ILE 72 6.672 -30.252 -5.930 515 HG13 ILE 72 HG13 ILE 72 6.917 -29.541 -4.339 516 HG21 ILE 72 HG21 ILE 72 6.955 -32.186 -6.344 517 HG22 ILE 72 HG22 ILE 72 8.175 -33.253 -5.650 518 HG23 ILE 72 HG23 ILE 72 6.637 -33.015 -4.820 519 HD11 ILE 72 HD11 ILE 72 9.419 -29.411 -5.426 520 HD12 ILE 72 HD12 ILE 72 8.377 -29.130 -6.822 521 HD13 ILE 72 HD13 ILE 72 8.240 -28.100 -5.397 522 H LEU 73 H LEU 73 6.465 -33.437 -2.086 523 HA LEU 73 HA LEU 73 8.699 -34.927 -1.111 524 HB2 LEU 73 HB2 LEU 73 5.749 -35.440 -1.274 525 HB3 LEU 73 HB3 LEU 73 6.866 -36.691 -0.731 526 HG LEU 73 HG LEU 73 5.863 -35.608 1.175 527 HD11 LEU 73 HD11 LEU 73 8.720 -34.706 0.845 528 HD12 LEU 73 HD12 LEU 73 8.208 -36.319 1.340 529 HD13 LEU 73 HD13 LEU 73 7.858 -34.930 2.368 530 HD21 LEU 73 HD21 LEU 73 5.691 -33.359 1.504 531 HD22 LEU 73 HD22 LEU 73 5.628 -33.398 -0.259 532 HD23 LEU 73 HD23 LEU 73 7.137 -32.995 0.561 533 H HIS 74 H HIS 74 10.002 -36.079 -2.360 534 HA HIS 74 HA HIS 74 9.133 -37.042 -4.946 535 HB2 HIS 74 HB2 HIS 74 11.575 -36.235 -3.882 536 HB3 HIS 74 HB3 HIS 74 11.749 -37.976 -4.081 537 HD1 HIS 74 HD1 HIS 74 10.706 -38.707 -6.655 538 HD2 HIS 74 HD2 HIS 74 12.422 -34.965 -6.097 539 HE1 HIS 74 HE1 HIS 74 11.357 -37.917 -8.952 540 H ALA 75 H ALA 75 9.132 -39.215 -5.611 541 HA ALA 75 HA ALA 75 8.617 -41.101 -3.426 542 HB1 ALA 75 HB1 ALA 75 7.764 -40.975 -6.290 543 HB2 ALA 75 HB2 ALA 75 7.712 -42.502 -5.408 544 HB3 ALA 75 HB3 ALA 75 6.779 -41.120 -4.834 545 HA PRO 76 HA PRO 76 12.211 -43.512 -4.154 546 HB2 PRO 76 HB2 PRO 76 11.284 -46.030 -3.741 547 HB3 PRO 76 HB3 PRO 76 11.520 -44.866 -2.431 548 HG2 PRO 76 HG2 PRO 76 9.002 -45.623 -3.862 549 HG3 PRO 76 HG3 PRO 76 9.270 -45.366 -2.128 550 HD2 PRO 76 HD2 PRO 76 8.136 -43.492 -3.719 551 HD3 PRO 76 HD3 PRO 76 9.144 -43.073 -2.319 552 H ASP 77 H ASP 77 12.789 -45.777 -5.276 553 HA ASP 77 HA ASP 77 12.204 -45.382 -8.064 554 HB2 ASP 77 HB2 ASP 77 14.122 -46.950 -6.472 555 HB3 ASP 77 HB3 ASP 77 13.611 -47.720 -7.972 556 H ALA 78 H ALA 78 10.546 -46.875 -5.658 557 HA ALA 78 HA ALA 78 9.485 -48.975 -7.428 558 HB1 ALA 78 HB1 ALA 78 8.798 -50.182 -5.515 559 HB2 ALA 78 HB2 ALA 78 10.443 -49.635 -5.187 560 HB3 ALA 78 HB3 ALA 78 9.074 -48.801 -4.454 561 H GLY 79 H GLY 79 8.719 -46.078 -5.683 562 HA2 GLY 79 HA2 GLY 79 6.826 -44.789 -6.557 563 HA3 GLY 79 HA3 GLY 79 5.934 -46.301 -6.645 564 H TRP 80 H TRP 80 4.542 -44.537 -5.418 565 HA TRP 80 HA TRP 80 5.104 -44.078 -2.683 566 HB2 TRP 80 HB2 TRP 80 2.536 -43.971 -4.269 567 HB3 TRP 80 HB3 TRP 80 2.630 -43.532 -2.565 568 HD1 TRP 80 HD1 TRP 80 2.669 -41.948 -5.812 569 HE1 TRP 80 HE1 TRP 80 3.763 -39.620 -5.727 570 HE3 TRP 80 HE3 TRP 80 4.973 -42.298 -1.261 571 HZ2 TRP 80 HZ2 TRP 80 5.388 -38.129 -3.965 572 HZ3 TRP 80 HZ3 TRP 80 6.277 -40.376 -0.449 573 HH2 TRP 80 HH2 TRP 80 6.480 -38.336 -1.774 574 H GLY 81 H GLY 81 2.710 -46.265 -4.189 575 HA2 GLY 81 HA2 GLY 81 2.189 -48.449 -3.563 576 HA3 GLY 81 HA3 GLY 81 3.284 -48.292 -2.197 577 H ASN 82 H ASN 82 1.523 -49.414 -1.058 578 HA ASN 82 HA ASN 82 -0.476 -47.477 -0.097 579 HB2 ASN 82 HB2 ASN 82 -1.104 -50.401 -0.104 580 HB3 ASN 82 HB3 ASN 82 -2.197 -49.022 -0.178 581 HD21 ASN 82 HD21 ASN 82 -1.318 -47.586 -2.252 582 HD22 ASN 82 HD22 ASN 82 -1.405 -48.499 -3.717 583 H LEU 83 H LEU 83 2.120 -48.047 1.000 584 HA LEU 83 HA LEU 83 1.616 -49.679 3.356 585 HB2 LEU 83 HB2 LEU 83 4.013 -49.004 3.889 586 HB3 LEU 83 HB3 LEU 83 3.749 -50.044 2.491 587 HG LEU 83 HG LEU 83 5.444 -48.107 2.314 588 HD11 LEU 83 HD11 LEU 83 5.318 -48.547 0.142 589 HD12 LEU 83 HD12 LEU 83 3.752 -47.748 0.007 590 HD13 LEU 83 HD13 LEU 83 3.838 -49.447 0.475 591 HD21 LEU 83 HD21 LEU 83 4.565 -45.967 1.707 592 HD22 LEU 83 HD22 LEU 83 3.865 -46.422 3.261 593 HD23 LEU 83 HD23 LEU 83 2.908 -46.566 1.785 594 H VAL 84 H VAL 84 2.909 -48.533 5.368 595 HA VAL 84 HA VAL 84 1.299 -46.151 5.913 596 HB VAL 84 HB VAL 84 2.973 -47.645 7.920 597 HG11 VAL 84 HG11 VAL 84 2.230 -45.528 8.715 598 HG12 VAL 84 HG12 VAL 84 0.596 -45.804 8.109 599 HG13 VAL 84 HG13 VAL 84 1.207 -46.753 9.465 600 HG21 VAL 84 HG21 VAL 84 0.610 -48.663 8.461 601 HG22 VAL 84 HG22 VAL 84 0.330 -48.363 6.746 602 HG23 VAL 84 HG23 VAL 84 1.660 -49.404 7.253 603 H TYR 85 H TYR 85 2.245 -44.320 7.004 604 HA TYR 85 HA TYR 85 5.136 -44.015 6.552 605 HB2 TYR 85 HB2 TYR 85 4.905 -42.121 5.316 606 HB3 TYR 85 HB3 TYR 85 3.341 -42.830 4.928 607 HD1 TYR 85 HD1 TYR 85 1.304 -41.853 5.730 608 HD2 TYR 85 HD2 TYR 85 5.065 -40.287 6.959 609 HE1 TYR 85 HE1 TYR 85 0.174 -39.865 6.635 610 HE2 TYR 85 HE2 TYR 85 3.945 -38.296 7.869 611 HH TYR 85 HH TYR 85 1.861 -37.061 7.576 612 H VAL 86 H VAL 86 6.235 -42.678 7.995 613 HA VAL 86 HA VAL 86 4.734 -42.036 10.446 614 HB VAL 86 HB VAL 86 7.695 -42.560 10.149 615 HG11 VAL 86 HG11 VAL 86 5.956 -41.867 12.492 616 HG12 VAL 86 HG12 VAL 86 7.476 -42.738 12.700 617 HG13 VAL 86 HG13 VAL 86 7.472 -41.127 11.980 618 HG21 VAL 86 HG21 VAL 86 7.278 -44.729 10.390 619 HG22 VAL 86 HG22 VAL 86 6.301 -44.424 11.826 620 HG23 VAL 86 HG23 VAL 86 5.556 -44.381 10.228 621 H VAL 87 H VAL 87 4.356 -39.950 10.750 622 HA VAL 87 HA VAL 87 5.412 -37.867 9.232 623 HB VAL 87 HB VAL 87 4.594 -36.378 11.123 624 HG11 VAL 87 HG11 VAL 87 2.192 -36.975 10.703 625 HG12 VAL 87 HG12 VAL 87 3.175 -36.776 9.252 626 HG13 VAL 87 HG13 VAL 87 2.768 -38.393 9.828 627 HG21 VAL 87 HG21 VAL 87 3.540 -38.978 12.224 628 HG22 VAL 87 HG22 VAL 87 4.918 -38.106 12.894 629 HG23 VAL 87 HG23 VAL 87 3.319 -37.363 12.897 630 H ASN 88 H ASN 88 6.714 -36.024 10.010 631 HA ASN 88 HA ASN 88 8.648 -36.649 12.101 632 HB2 ASN 88 HB2 ASN 88 9.399 -37.395 9.684 633 HB3 ASN 88 HB3 ASN 88 9.749 -35.679 9.494 634 HD21 ASN 88 HD21 ASN 88 11.955 -36.349 9.249 635 HD22 ASN 88 HD22 ASN 88 12.918 -36.670 10.647 636 H TYR 89 H TYR 89 8.702 -34.931 13.376 637 HA TYR 89 HA TYR 89 8.444 -32.262 12.154 638 HB2 TYR 89 HB2 TYR 89 7.620 -32.936 14.975 639 HB3 TYR 89 HB3 TYR 89 7.228 -31.494 14.044 640 HD1 TYR 89 HD1 TYR 89 6.339 -34.947 14.750 641 HD2 TYR 89 HD2 TYR 89 5.550 -31.607 12.234 642 HE1 TYR 89 HE1 TYR 89 4.235 -35.996 14.027 643 HE2 TYR 89 HE2 TYR 89 3.443 -32.646 11.506 644 HH TYR 89 HH TYR 89 1.809 -34.353 12.449 645 HA PRO 90 HA PRO 90 12.585 -32.578 14.230 646 HB2 PRO 90 HB2 PRO 90 13.950 -31.398 12.202 647 HB3 PRO 90 HB3 PRO 90 13.614 -33.133 12.252 648 HG2 PRO 90 HG2 PRO 90 12.187 -30.970 10.752 649 HG3 PRO 90 HG3 PRO 90 12.650 -32.593 10.206 650 HD2 PRO 90 HD2 PRO 90 10.133 -31.985 11.000 651 HD3 PRO 90 HD3 PRO 90 10.849 -33.591 11.242 652 H LYS 91 H LYS 91 11.439 -29.888 12.184 653 HA LYS 91 HA LYS 91 11.217 -28.027 14.254 654 HB2 LYS 91 HB2 LYS 91 13.214 -26.581 13.631 655 HB3 LYS 91 HB3 LYS 91 13.560 -28.032 14.564 656 HG2 LYS 91 HG2 LYS 91 14.146 -29.175 12.424 657 HG3 LYS 91 HG3 LYS 91 13.981 -27.616 11.615 658 HD2 LYS 91 HD2 LYS 91 15.855 -26.740 12.629 659 HD3 LYS 91 HD3 LYS 91 15.742 -27.828 14.014 660 HE2 LYS 91 HE2 LYS 91 16.445 -29.697 12.606 661 HE3 LYS 91 HE3 LYS 91 16.540 -28.619 11.214 662 HZ1 LYS 91 HZ1 LYS 91 18.330 -28.842 13.518 663 HZ2 LYS 91 HZ2 LYS 91 18.133 -27.315 12.818 664 HZ3 LYS 91 HZ3 LYS 91 18.699 -28.607 11.884 665 H ASP 92 H ASP 92 12.303 -28.284 10.877 666 HA ASP 92 HA ASP 92 9.992 -26.911 9.917 667 HB2 ASP 92 HB2 ASP 92 12.073 -25.251 10.739 668 HB3 ASP 92 HB3 ASP 92 12.264 -25.352 8.991 669 H ASN 93 H ASN 93 10.802 -26.089 7.457 670 HA ASN 93 HA ASN 93 11.933 -28.543 6.282 671 HB2 ASN 93 HB2 ASN 93 9.678 -28.463 5.594 672 HB3 ASN 93 HB3 ASN 93 9.732 -26.723 5.328 673 HD21 ASN 93 HD21 ASN 93 8.950 -26.943 3.235 674 HD22 ASN 93 HD22 ASN 93 9.931 -27.547 1.948 675 H LYS 94 H LYS 94 11.387 -25.133 5.377 676 HA LYS 94 HA LYS 94 14.175 -24.682 4.904 677 HB2 LYS 94 HB2 LYS 94 13.961 -24.205 2.483 678 HB3 LYS 94 HB3 LYS 94 13.705 -25.902 2.866 679 HG2 LYS 94 HG2 LYS 94 11.244 -25.459 2.800 680 HG3 LYS 94 HG3 LYS 94 11.618 -23.843 2.193 681 HD2 LYS 94 HD2 LYS 94 13.041 -25.182 0.436 682 HD3 LYS 94 HD3 LYS 94 11.947 -26.497 0.871 683 HE2 LYS 94 HE2 LYS 94 10.194 -25.545 -0.169 684 HE3 LYS 94 HE3 LYS 94 10.633 -23.923 0.362 685 HZ1 LYS 94 HZ1 LYS 94 11.279 -25.298 -2.097 686 HZ2 LYS 94 HZ2 LYS 94 12.576 -24.465 -1.401 687 HZ3 LYS 94 HZ3 LYS 94 11.150 -23.640 -1.784 688 H ARG 95 H ARG 95 10.853 -23.618 4.333 689 HA ARG 95 HA ARG 95 11.608 -20.837 4.191 690 HB2 ARG 95 HB2 ARG 95 9.284 -22.406 3.580 691 HB3 ARG 95 HB3 ARG 95 8.825 -21.076 4.634 692 HG2 ARG 95 HG2 ARG 95 9.721 -19.468 3.100 693 HG3 ARG 95 HG3 ARG 95 10.394 -20.748 2.088 694 HD2 ARG 95 HD2 ARG 95 8.472 -20.972 0.993 695 HD3 ARG 95 HD3 ARG 95 7.582 -21.175 2.502 696 HE ARG 95 HE ARG 95 8.183 -18.449 2.103 697 HH11 ARG 95 HH11 ARG 95 6.134 -20.985 0.883 698 HH12 ARG 95 HH12 ARG 95 4.882 -19.904 0.368 699 HH21 ARG 95 HH21 ARG 95 6.542 -17.015 1.429 700 HH22 ARG 95 HH22 ARG 95 5.116 -17.646 0.678 701 H LYS 96 H LYS 96 10.786 -19.209 5.663 702 HA LYS 96 HA LYS 96 10.895 -20.143 8.431 703 HB2 LYS 96 HB2 LYS 96 11.080 -17.350 7.286 704 HB3 LYS 96 HB3 LYS 96 11.257 -17.762 8.987 705 HG2 LYS 96 HG2 LYS 96 13.426 -18.021 8.647 706 HG3 LYS 96 HG3 LYS 96 13.065 -19.400 7.605 707 HD2 LYS 96 HD2 LYS 96 14.403 -17.925 6.322 708 HD3 LYS 96 HD3 LYS 96 12.752 -17.741 5.726 709 HE2 LYS 96 HE2 LYS 96 13.018 -15.888 7.806 710 HE3 LYS 96 HE3 LYS 96 14.515 -15.778 6.881 711 HZ1 LYS 96 HZ1 LYS 96 11.752 -15.470 5.843 712 HZ2 LYS 96 HZ2 LYS 96 13.128 -15.542 4.861 713 HZ3 LYS 96 HZ3 LYS 96 12.938 -14.269 5.959 714 H MET 97 H MET 97 9.351 -19.578 9.981 715 HA MET 97 HA MET 97 6.673 -19.549 9.091 716 HB2 MET 97 HB2 MET 97 7.899 -19.060 11.804 717 HB3 MET 97 HB3 MET 97 6.163 -19.106 11.532 718 HG2 MET 97 HG2 MET 97 7.783 -21.399 10.576 719 HG3 MET 97 HG3 MET 97 7.521 -21.229 12.310 720 HE1 MET 97 HE1 MET 97 5.844 -24.036 11.561 721 HE2 MET 97 HE2 MET 97 6.496 -23.040 12.862 722 HE3 MET 97 HE3 MET 97 4.758 -23.319 12.752 723 H ASP 98 H ASP 98 8.512 -17.049 10.852 724 HA ASP 98 HA ASP 98 8.236 -14.794 11.015 725 HB2 ASP 98 HB2 ASP 98 7.503 -15.355 8.157 726 HB3 ASP 98 HB3 ASP 98 7.403 -13.717 8.797 727 H GLU 99 H GLU 99 6.412 -15.640 12.514 728 HA GLU 99 HA GLU 99 3.944 -14.258 11.714 729 HB2 GLU 99 HB2 GLU 99 2.558 -15.974 12.590 730 HB3 GLU 99 HB3 GLU 99 3.735 -16.772 11.556 731 HG2 GLU 99 HG2 GLU 99 5.010 -16.900 13.926 732 HG3 GLU 99 HG3 GLU 99 3.332 -16.956 14.460 733 H THR 100 H THR 100 2.479 -14.418 13.952 734 HA THR 100 HA THR 100 3.596 -12.492 15.639 735 HB THR 100 HB THR 100 1.731 -13.026 17.202 736 HG1 THR 100 HG1 THR 100 1.100 -15.051 17.077 737 HG21 THR 100 HG21 THR 100 1.594 -11.721 14.886 738 HG22 THR 100 HG22 THR 100 0.172 -11.987 15.896 739 HG23 THR 100 HG23 THR 100 0.477 -13.033 14.509 740 H ASP 101 H ASP 101 5.511 -12.948 16.601 741 HA ASP 101 HA ASP 101 5.467 -14.899 18.752 742 HB2 ASP 101 HB2 ASP 101 6.352 -16.027 16.628 743 HB3 ASP 101 HB3 ASP 101 7.756 -14.976 16.793 744 H ALA 102 H ALA 102 7.322 -14.664 20.213 745 HA ALA 102 HA ALA 102 8.521 -11.975 20.062 746 HB1 ALA 102 HB1 ALA 102 6.835 -13.118 22.104 747 HB2 ALA 102 HB2 ALA 102 8.400 -12.641 22.764 748 HB3 ALA 102 HB3 ALA 102 7.404 -11.460 21.913 749 H SER 103 H SER 103 10.642 -12.129 19.796 750 HA SER 103 HA SER 103 12.077 -14.307 21.170 751 HB2 SER 103 HB2 SER 103 12.046 -14.635 18.723 752 HB3 SER 103 HB3 SER 103 12.778 -13.046 18.507 753 HG SER 103 HG SER 103 13.929 -15.249 19.880 754 H SER 104 H SER 104 11.642 -11.959 22.495 755 HA SER 104 HA SER 104 14.123 -10.416 22.224 756 HB2 SER 104 HB2 SER 104 12.865 -8.924 23.963 757 HB3 SER 104 HB3 SER 104 12.364 -8.888 22.272 758 HG SER 104 HG SER 104 10.577 -9.993 22.756 759 H ALA 105 H ALA 105 15.724 -10.637 23.641 760 HA ALA 105 HA ALA 105 15.313 -11.233 26.398 761 HB1 ALA 105 HB1 ALA 105 15.164 -13.460 26.181 762 HB2 ALA 105 HB2 ALA 105 15.836 -13.446 24.549 763 HB3 ALA 105 HB3 ALA 105 16.911 -13.387 25.946 764 H VAL 106 H VAL 106 16.554 -9.269 26.416 765 HA VAL 106 HA VAL 106 19.426 -9.702 25.903 766 HB VAL 106 HB VAL 106 18.486 -7.962 24.452 767 HG11 VAL 106 HG11 VAL 106 17.800 -6.539 27.022 768 HG12 VAL 106 HG12 VAL 106 17.638 -5.874 25.396 769 HG13 VAL 106 HG13 VAL 106 16.646 -7.246 25.891 770 HG21 VAL 106 HG21 VAL 106 20.281 -6.577 24.651 771 HG22 VAL 106 HG22 VAL 106 20.086 -6.390 26.394 772 HG23 VAL 106 HG23 VAL 106 20.810 -7.859 25.740 773 H LYS 107 H LYS 107 20.904 -9.051 27.451 774 HA LYS 107 HA LYS 107 20.038 -7.740 29.871 775 HB2 LYS 107 HB2 LYS 107 19.766 -10.466 29.845 776 HB3 LYS 107 HB3 LYS 107 21.379 -10.274 30.519 777 HG2 LYS 107 HG2 LYS 107 20.042 -10.289 32.398 778 HG3 LYS 107 HG3 LYS 107 20.261 -8.563 32.100 779 HD2 LYS 107 HD2 LYS 107 18.097 -8.445 31.015 780 HD3 LYS 107 HD3 LYS 107 17.884 -10.188 31.193 781 HE2 LYS 107 HE2 LYS 107 17.171 -9.978 33.297 782 HE3 LYS 107 HE3 LYS 107 18.492 -8.889 33.717 783 HZ1 LYS 107 HZ1 LYS 107 16.462 -7.706 32.043 784 HZ2 LYS 107 HZ2 LYS 107 17.205 -7.100 33.436 785 HZ3 LYS 107 HZ3 LYS 107 15.905 -8.174 33.570 786 H VAL 108 H VAL 108 21.595 -6.285 30.119 787 HA VAL 108 HA VAL 108 24.393 -7.170 29.846 788 HB VAL 108 HB VAL 108 24.926 -4.825 29.112 789 HG11 VAL 108 HG11 VAL 108 24.344 -6.980 27.646 790 HG12 VAL 108 HG12 VAL 108 23.085 -5.893 27.055 791 HG13 VAL 108 HG13 VAL 108 24.783 -5.430 26.931 792 HG21 VAL 108 HG21 VAL 108 22.431 -4.201 29.906 793 HG22 VAL 108 HG22 VAL 108 23.347 -3.254 28.734 794 HG23 VAL 108 HG23 VAL 108 22.156 -4.431 28.179 795 H LYS 109 H LYS 109 25.838 -6.435 31.358 796 HA LYS 109 HA LYS 109 24.817 -4.649 33.456 797 HB2 LYS 109 HB2 LYS 109 26.280 -7.258 33.893 798 HB3 LYS 109 HB3 LYS 109 25.946 -6.080 35.154 799 HG2 LYS 109 HG2 LYS 109 23.542 -6.783 33.721 800 HG3 LYS 109 HG3 LYS 109 24.343 -8.211 34.381 801 HD2 LYS 109 HD2 LYS 109 24.532 -6.662 36.521 802 HD3 LYS 109 HD3 LYS 109 23.128 -5.886 35.784 803 HE2 LYS 109 HE2 LYS 109 21.780 -7.630 36.231 804 HE3 LYS 109 HE3 LYS 109 23.021 -8.818 35.838 805 HZ1 LYS 109 HZ1 LYS 109 22.832 -9.142 38.068 806 HZ2 LYS 109 HZ2 LYS 109 22.421 -7.535 38.400 807 HZ3 LYS 109 HZ3 LYS 109 24.030 -7.948 38.078 808 H ARG 110 H ARG 110 26.056 -2.962 32.593 809 HA ARG 110 HA ARG 110 28.932 -3.307 32.361 810 HB2 ARG 110 HB2 ARG 110 26.951 -1.424 31.372 811 HB3 ARG 110 HB3 ARG 110 28.355 -0.602 32.040 812 HG2 ARG 110 HG2 ARG 110 28.561 -2.810 30.012 813 HG3 ARG 110 HG3 ARG 110 28.440 -1.104 29.580 814 HD2 ARG 110 HD2 ARG 110 30.433 -0.979 31.375 815 HD3 ARG 110 HD3 ARG 110 30.686 -2.613 30.765 816 HE ARG 110 HE ARG 110 30.370 -0.922 28.572 817 HH11 ARG 110 HH11 ARG 110 32.606 -1.442 31.188 818 HH12 ARG 110 HH12 ARG 110 33.980 -0.871 30.301 819 HH21 ARG 110 HH21 ARG 110 32.171 -0.168 27.393 820 HH22 ARG 110 HH22 ARG 110 33.732 -0.145 28.142 821 H ALA 111 H ALA 111 29.762 -3.544 34.394 822 HA ALA 111 HA ALA 111 29.256 -1.355 36.302 823 HB1 ALA 111 HB1 ALA 111 30.323 -4.076 37.012 824 HB2 ALA 111 HB2 ALA 111 29.668 -2.843 38.091 825 HB3 ALA 111 HB3 ALA 111 28.600 -3.700 36.980 826 H VAL 112 H VAL 112 30.869 0.028 36.572 827 HA VAL 112 HA VAL 112 33.395 -0.252 35.373 828 HB VAL 112 HB VAL 112 32.367 1.928 35.963 829 HG11 VAL 112 HG11 VAL 112 31.749 2.450 38.034 830 HG12 VAL 112 HG12 VAL 112 32.130 0.789 38.496 831 HG13 VAL 112 HG13 VAL 112 33.345 2.056 38.673 832 HG21 VAL 112 HG21 VAL 112 34.395 3.029 36.341 833 HG22 VAL 112 HG22 VAL 112 35.031 1.714 37.328 834 HG23 VAL 112 HG23 VAL 112 34.870 1.508 35.584 835 H GLN 113 H GLN 113 35.406 -0.764 36.178 836 HA GLN 113 HA GLN 113 35.392 -2.358 38.628 837 HB2 GLN 113 HB2 GLN 113 36.401 -2.990 36.242 838 HB3 GLN 113 HB3 GLN 113 37.809 -2.170 36.903 839 HG2 GLN 113 HG2 GLN 113 38.110 -3.740 38.568 840 HG3 GLN 113 HG3 GLN 113 36.437 -4.292 38.490 841 HE21 GLN 113 HE21 GLN 113 39.477 -5.199 37.872 842 HE22 GLN 113 HE22 GLN 113 39.217 -6.315 36.579 843 H LYS 114 H LYS 114 36.978 -2.094 40.255 844 HA LYS 114 HA LYS 114 37.827 0.679 40.570 845 HB2 LYS 114 HB2 LYS 114 36.983 -1.426 42.341 846 HB3 LYS 114 HB3 LYS 114 38.560 -0.828 42.839 847 HG2 LYS 114 HG2 LYS 114 37.661 1.000 43.707 848 HG3 LYS 114 HG3 LYS 114 36.816 1.365 42.201 849 HD2 LYS 114 HD2 LYS 114 35.182 -0.506 42.979 850 HD3 LYS 114 HD3 LYS 114 35.879 -0.201 44.572 851 HE2 LYS 114 HE2 LYS 114 34.913 2.091 42.920 852 HE3 LYS 114 HE3 LYS 114 33.745 1.092 43.784 853 HZ1 LYS 114 HZ1 LYS 114 34.288 2.039 45.702 854 HZ2 LYS 114 HZ2 LYS 114 35.149 3.195 44.816 855 HZ3 LYS 114 HZ3 LYS 114 35.947 1.839 45.439 Start of MODEL 17 1 H1 MET 1 H MET 1 -6.892 -12.718 -8.761 2 HA MET 1 HA MET 1 -8.016 -14.005 -11.021 3 HB2 MET 1 HB2 MET 1 -9.414 -11.653 -9.943 4 HB3 MET 1 HB3 MET 1 -9.040 -11.552 -11.658 5 HG2 MET 1 HG2 MET 1 -10.151 -13.742 -11.978 6 HG3 MET 1 HG3 MET 1 -10.614 -13.712 -10.279 7 HE1 MET 1 HE1 MET 1 -12.359 -11.604 -13.827 8 HE2 MET 1 HE2 MET 1 -11.029 -10.631 -13.200 9 HE3 MET 1 HE3 MET 1 -10.752 -12.311 -13.660 10 H ALA 2 H ALA 2 -6.184 -14.027 -12.159 11 HA ALA 2 HA ALA 2 -4.337 -13.336 -13.297 12 HB1 ALA 2 HB1 ALA 2 -5.674 -10.633 -13.268 13 HB2 ALA 2 HB2 ALA 2 -4.428 -11.189 -14.386 14 HB3 ALA 2 HB3 ALA 2 -6.032 -11.922 -14.418 15 H GLY 3 H GLY 3 -2.642 -11.342 -13.309 16 HA2 GLY 3 HA2 GLY 3 -2.182 -9.936 -10.925 17 HA3 GLY 3 HA3 GLY 3 -1.338 -11.474 -10.822 18 H SER 4 H SER 4 0.626 -11.631 -11.710 19 HA SER 4 HA SER 4 2.553 -11.049 -12.771 20 HB2 SER 4 HB2 SER 4 1.141 -11.355 -14.789 21 HB3 SER 4 HB3 SER 4 0.705 -9.648 -14.719 22 HG SER 4 HG SER 4 3.023 -9.236 -14.873 23 H HIS 5 H HIS 5 1.930 -9.480 -10.621 24 HA HIS 5 HA HIS 5 2.424 -6.713 -11.442 25 HB2 HIS 5 HB2 HIS 5 1.337 -8.014 -8.993 26 HB3 HIS 5 HB3 HIS 5 2.190 -6.486 -8.794 27 HD1 HIS 5 HD1 HIS 5 -1.082 -7.776 -9.402 28 HD2 HIS 5 HD2 HIS 5 1.027 -4.422 -10.652 29 HE1 HIS 5 HE1 HIS 5 -2.822 -6.148 -10.205 30 H HIS 6 H HIS 6 3.562 -8.648 -8.677 31 HA HIS 6 HA HIS 6 6.305 -8.481 -9.421 32 HB2 HIS 6 HB2 HIS 6 6.979 -7.048 -7.442 33 HB3 HIS 6 HB3 HIS 6 6.201 -6.194 -8.772 34 HD1 HIS 6 HD1 HIS 6 5.503 -4.306 -7.113 35 HD2 HIS 6 HD2 HIS 6 3.866 -8.033 -6.283 36 HE1 HIS 6 HE1 HIS 6 3.654 -3.876 -5.465 37 H HIS 7 H HIS 7 4.799 -10.637 -8.774 38 HA HIS 7 HA HIS 7 5.999 -11.478 -6.232 39 HB2 HIS 7 HB2 HIS 7 3.166 -11.255 -6.823 40 HB3 HIS 7 HB3 HIS 7 3.606 -12.904 -6.392 41 HD1 HIS 7 HD1 HIS 7 5.224 -12.914 -4.076 42 HD2 HIS 7 HD2 HIS 7 2.542 -9.793 -4.649 43 HE1 HIS 7 HE1 HIS 7 4.870 -11.905 -1.800 44 H HIS 8 H HIS 8 4.414 -12.490 -9.236 45 HA HIS 8 HA HIS 8 4.646 -14.345 -10.540 46 HB2 HIS 8 HB2 HIS 8 6.912 -13.292 -10.748 47 HB3 HIS 8 HB3 HIS 8 7.473 -14.363 -9.468 48 HD1 HIS 8 HD1 HIS 8 5.311 -15.252 -12.460 49 HD2 HIS 8 HD2 HIS 8 9.039 -16.109 -10.840 50 HE1 HIS 8 HE1 HIS 8 6.269 -17.073 -13.905 51 H HIS 9 H HIS 9 3.188 -15.382 -8.912 52 HA HIS 9 HA HIS 9 4.437 -17.301 -7.130 53 HB2 HIS 9 HB2 HIS 9 2.254 -15.936 -6.716 54 HB3 HIS 9 HB3 HIS 9 1.490 -17.188 -7.690 55 HD1 HIS 9 HD1 HIS 9 0.177 -17.653 -5.377 56 HD2 HIS 9 HD2 HIS 9 4.212 -18.642 -5.450 57 HE1 HIS 9 HE1 HIS 9 0.525 -19.200 -3.426 58 H HIS 10 H HIS 10 2.035 -17.512 -9.764 59 HA HIS 10 HA HIS 10 2.029 -20.263 -10.057 60 HB2 HIS 10 HB2 HIS 10 1.432 -17.981 -11.887 61 HB3 HIS 10 HB3 HIS 10 1.533 -19.600 -12.573 62 HD1 HIS 10 HD1 HIS 10 -1.062 -19.248 -13.095 63 HD2 HIS 10 HD2 HIS 10 -0.044 -19.550 -9.078 64 HE1 HIS 10 HE1 HIS 10 -3.217 -19.723 -11.889 65 H GLY 11 H GLY 11 3.397 -21.732 -10.866 66 HA2 GLY 11 HA2 GLY 11 4.986 -22.031 -12.859 67 HA3 GLY 11 HA3 GLY 11 5.880 -20.725 -12.094 68 H SER 12 H SER 12 4.240 -23.455 -10.549 69 HA SER 12 HA SER 12 6.728 -24.815 -10.011 70 HB2 SER 12 HB2 SER 12 6.141 -24.718 -7.458 71 HB3 SER 12 HB3 SER 12 7.030 -23.387 -8.201 72 HG SER 12 HG SER 12 4.400 -23.486 -7.278 73 H MET 13 H MET 13 3.305 -24.502 -9.120 74 HA MET 13 HA MET 13 1.643 -26.036 -8.890 75 HB2 MET 13 HB2 MET 13 3.424 -27.930 -10.423 76 HB3 MET 13 HB3 MET 13 1.671 -27.978 -10.294 77 HG2 MET 13 HG2 MET 13 1.645 -26.909 -12.237 78 HG3 MET 13 HG3 MET 13 2.137 -25.481 -11.329 79 HE1 MET 13 HE1 MET 13 4.478 -28.021 -14.229 80 HE2 MET 13 HE2 MET 13 4.498 -28.738 -12.618 81 HE3 MET 13 HE3 MET 13 2.960 -28.403 -13.415 82 H SER 14 H SER 14 1.280 -28.473 -8.191 83 HA SER 14 HA SER 14 3.315 -29.257 -6.230 84 HB2 SER 14 HB2 SER 14 1.677 -29.503 -4.466 85 HB3 SER 14 HB3 SER 14 1.579 -27.858 -5.093 86 HG SER 14 HG SER 14 -0.455 -29.150 -4.776 87 H GLU 15 H GLU 15 3.088 -31.462 -5.469 88 HA GLU 15 HA GLU 15 1.751 -33.163 -7.464 89 HB2 GLU 15 HB2 GLU 15 4.190 -33.656 -5.754 90 HB3 GLU 15 HB3 GLU 15 3.399 -34.915 -6.692 91 HG2 GLU 15 HG2 GLU 15 5.155 -34.223 -8.042 92 HG3 GLU 15 HG3 GLU 15 3.752 -33.387 -8.707 93 H TYR 16 H TYR 16 1.593 -35.540 -6.325 94 HA TYR 16 HA TYR 16 0.207 -35.160 -3.758 95 HB2 TYR 16 HB2 TYR 16 -1.394 -36.998 -4.682 96 HB3 TYR 16 HB3 TYR 16 -1.631 -35.324 -5.172 97 HD1 TYR 16 HD1 TYR 16 -1.549 -34.710 -7.443 98 HD2 TYR 16 HD2 TYR 16 -0.170 -38.557 -6.259 99 HE1 TYR 16 HE1 TYR 16 -1.394 -35.375 -9.806 100 HE2 TYR 16 HE2 TYR 16 -0.010 -39.233 -8.618 101 HH TYR 16 HH TYR 16 -1.128 -37.121 -11.214 102 H ILE 17 H ILE 17 -0.428 -37.524 -2.941 103 HA ILE 17 HA ILE 17 1.984 -39.197 -3.216 104 HB ILE 17 HB ILE 17 2.162 -38.313 -1.052 105 HG12 ILE 17 HG12 ILE 17 0.660 -40.918 -0.710 106 HG13 ILE 17 HG13 ILE 17 2.356 -40.790 -1.164 107 HG21 ILE 17 HG21 ILE 17 -0.773 -38.377 -1.128 108 HG22 ILE 17 HG22 ILE 17 -0.059 -38.743 0.441 109 HG23 ILE 17 HG23 ILE 17 0.320 -37.222 -0.366 110 HD11 ILE 17 HD11 ILE 17 1.052 -40.193 1.452 111 HD12 ILE 17 HD12 ILE 17 2.453 -41.205 1.102 112 HD13 ILE 17 HD13 ILE 17 2.593 -39.449 1.028 113 H ARG 18 H ARG 18 1.637 -41.217 -3.861 114 HA ARG 18 HA ARG 18 -1.080 -42.325 -3.582 115 HB2 ARG 18 HB2 ARG 18 0.767 -42.208 -5.880 116 HB3 ARG 18 HB3 ARG 18 -0.015 -43.763 -5.630 117 HG2 ARG 18 HG2 ARG 18 -2.149 -42.164 -5.403 118 HG3 ARG 18 HG3 ARG 18 -1.155 -41.179 -6.479 119 HD2 ARG 18 HD2 ARG 18 -1.098 -43.923 -7.320 120 HD3 ARG 18 HD3 ARG 18 -2.767 -43.380 -7.151 121 HE ARG 18 HE ARG 18 -1.093 -41.542 -8.595 122 HH11 ARG 18 HH11 ARG 18 -3.113 -44.368 -8.831 123 HH12 ARG 18 HH12 ARG 18 -3.463 -44.138 -10.512 124 HH21 ARG 18 HH21 ARG 18 -1.546 -41.228 -10.808 125 HH22 ARG 18 HH22 ARG 18 -2.570 -42.352 -11.636 126 H VAL 19 H VAL 19 -0.984 -43.698 -1.911 127 HA VAL 19 HA VAL 19 0.857 -45.945 -2.087 128 HB VAL 19 HB VAL 19 1.374 -45.733 0.388 129 HG11 VAL 19 HG11 VAL 19 2.749 -44.924 -1.781 130 HG12 VAL 19 HG12 VAL 19 2.652 -43.404 -0.890 131 HG13 VAL 19 HG13 VAL 19 3.373 -44.826 -0.135 132 HG21 VAL 19 HG21 VAL 19 1.264 -43.507 1.368 133 HG22 VAL 19 HG22 VAL 19 0.498 -42.885 -0.093 134 HG23 VAL 19 HG23 VAL 19 -0.346 -44.063 0.912 135 H THR 20 H THR 20 0.172 -47.786 -0.942 136 HA THR 20 HA THR 20 -2.596 -47.635 0.066 137 HB THR 20 HB THR 20 -2.812 -48.882 -1.892 138 HG1 THR 20 HG1 THR 20 -3.660 -50.050 -0.114 139 HG21 THR 20 HG21 THR 20 -0.859 -49.438 -2.864 140 HG22 THR 20 HG22 THR 20 -1.045 -50.962 -1.995 141 HG23 THR 20 HG23 THR 20 -0.047 -49.675 -1.317 142 H GLU 21 H GLU 21 -3.136 -48.845 1.878 143 HA GLU 21 HA GLU 21 -1.002 -49.331 3.716 144 HB2 GLU 21 HB2 GLU 21 -3.378 -48.507 4.240 145 HB3 GLU 21 HB3 GLU 21 -3.860 -50.192 4.104 146 HG2 GLU 21 HG2 GLU 21 -1.577 -49.986 5.813 147 HG3 GLU 21 HG3 GLU 21 -2.826 -48.862 6.347 148 H ASP 22 H ASP 22 -3.393 -51.422 2.115 149 HA ASP 22 HA ASP 22 -1.857 -53.774 2.948 150 HB2 ASP 22 HB2 ASP 22 -4.660 -53.238 2.457 151 HB3 ASP 22 HB3 ASP 22 -4.111 -54.625 1.520 152 H GLU 23 H GLU 23 -1.047 -55.270 1.485 153 HA GLU 23 HA GLU 23 -0.076 -54.244 -0.953 154 HB2 GLU 23 HB2 GLU 23 0.831 -56.448 -1.339 155 HB3 GLU 23 HB3 GLU 23 1.033 -56.035 0.358 156 HG2 GLU 23 HG2 GLU 23 -1.283 -57.315 0.547 157 HG3 GLU 23 HG3 GLU 23 -0.669 -58.100 -0.907 158 H ASN 24 H ASN 24 -2.862 -56.221 -0.152 159 HA ASN 24 HA ASN 24 -3.505 -56.831 -2.884 160 HB2 ASN 24 HB2 ASN 24 -4.139 -58.115 -0.682 161 HB3 ASN 24 HB3 ASN 24 -5.508 -57.008 -0.664 162 HD21 ASN 24 HD21 ASN 24 -5.403 -59.912 -1.032 163 HD22 ASN 24 HD22 ASN 24 -6.185 -60.222 -2.541 164 H ASP 25 H ASP 25 -4.263 -54.311 -0.619 165 HA ASP 25 HA ASP 25 -6.567 -53.307 -1.960 166 HB2 ASP 25 HB2 ASP 25 -4.781 -52.370 0.228 167 HB3 ASP 25 HB3 ASP 25 -5.745 -51.154 -0.604 168 H GLU 26 H GLU 26 -6.720 -51.281 -3.109 169 HA GLU 26 HA GLU 26 -4.595 -50.998 -5.039 170 HB2 GLU 26 HB2 GLU 26 -7.405 -50.199 -4.815 171 HB3 GLU 26 HB3 GLU 26 -6.390 -48.986 -5.582 172 HG2 GLU 26 HG2 GLU 26 -5.542 -50.920 -7.044 173 HG3 GLU 26 HG3 GLU 26 -6.963 -51.785 -6.464 174 HA PRO 27 HA PRO 27 -2.489 -47.559 -3.306 175 HB2 PRO 27 HB2 PRO 27 -1.705 -46.250 -5.552 176 HB3 PRO 27 HB3 PRO 27 -0.981 -47.774 -5.026 177 HG2 PRO 27 HG2 PRO 27 -3.083 -47.291 -7.103 178 HG3 PRO 27 HG3 PRO 27 -1.677 -48.371 -7.164 179 HD2 PRO 27 HD2 PRO 27 -4.177 -49.263 -6.630 180 HD3 PRO 27 HD3 PRO 27 -2.726 -50.012 -5.932 181 H ILE 28 H ILE 28 -3.957 -46.281 -2.241 182 HA ILE 28 HA ILE 28 -5.875 -44.653 -3.601 183 HB ILE 28 HB ILE 28 -6.397 -45.408 -1.380 184 HG12 ILE 28 HG12 ILE 28 -6.992 -43.282 -0.309 185 HG13 ILE 28 HG13 ILE 28 -5.848 -42.432 -1.342 186 HG21 ILE 28 HG21 ILE 28 -3.901 -43.945 -0.543 187 HG22 ILE 28 HG22 ILE 28 -5.111 -44.561 0.582 188 HG23 ILE 28 HG23 ILE 28 -4.212 -45.678 -0.445 189 HD11 ILE 28 HD11 ILE 28 -7.373 -42.217 -2.926 190 HD12 ILE 28 HD12 ILE 28 -7.674 -43.955 -2.940 191 HD13 ILE 28 HD13 ILE 28 -8.555 -42.916 -1.820 192 H GLU 29 H GLU 29 -5.723 -42.598 -4.277 193 HA GLU 29 HA GLU 29 -3.142 -41.252 -3.936 194 HB2 GLU 29 HB2 GLU 29 -3.870 -39.831 -5.820 195 HB3 GLU 29 HB3 GLU 29 -3.856 -41.539 -6.234 196 HG2 GLU 29 HG2 GLU 29 -5.932 -41.323 -6.955 197 HG3 GLU 29 HG3 GLU 29 -6.433 -41.023 -5.292 198 H ILE 30 H ILE 30 -2.936 -39.560 -2.632 199 HA ILE 30 HA ILE 30 -5.352 -38.046 -1.893 200 HB ILE 30 HB ILE 30 -3.854 -37.715 0.319 201 HG12 ILE 30 HG12 ILE 30 -3.482 -40.643 -0.133 202 HG13 ILE 30 HG13 ILE 30 -2.309 -39.534 -0.836 203 HG21 ILE 30 HG21 ILE 30 -6.273 -38.732 -0.244 204 HG22 ILE 30 HG22 ILE 30 -5.466 -40.186 0.340 205 HG23 ILE 30 HG23 ILE 30 -5.562 -38.758 1.369 206 HD11 ILE 30 HD11 ILE 30 -1.557 -40.340 1.317 207 HD12 ILE 30 HD12 ILE 30 -1.874 -38.606 1.385 208 HD13 ILE 30 HD13 ILE 30 -3.031 -39.743 2.078 209 HA PRO 31 HA PRO 31 -3.145 -34.387 -2.905 210 HB2 PRO 31 HB2 PRO 31 -4.168 -32.631 -1.104 211 HB3 PRO 31 HB3 PRO 31 -5.090 -33.238 -2.485 212 HG2 PRO 31 HG2 PRO 31 -5.153 -34.127 0.373 213 HG3 PRO 31 HG3 PRO 31 -6.503 -33.865 -0.747 214 HD2 PRO 31 HD2 PRO 31 -5.528 -36.329 -0.193 215 HD3 PRO 31 HD3 PRO 31 -6.210 -35.906 -1.776 216 H SER 32 H SER 32 -1.296 -33.305 -2.389 217 HA SER 32 HA SER 32 -0.253 -33.622 0.346 218 HB2 SER 32 HB2 SER 32 1.763 -34.434 -0.373 219 HB3 SER 32 HB3 SER 32 0.759 -35.043 -1.688 220 HG SER 32 HG SER 32 2.693 -33.890 -2.349 221 H GLU 33 H GLU 33 1.447 -32.043 0.904 222 HA GLU 33 HA GLU 33 0.610 -29.410 0.338 223 HB2 GLU 33 HB2 GLU 33 2.294 -30.652 2.198 224 HB3 GLU 33 HB3 GLU 33 3.329 -29.531 1.325 225 HG2 GLU 33 HG2 GLU 33 2.427 -28.455 3.274 226 HG3 GLU 33 HG3 GLU 33 1.752 -27.715 1.824 227 H ASP 34 H ASP 34 2.041 -27.678 -0.509 228 HA ASP 34 HA ASP 34 2.852 -28.264 -3.150 229 HB2 ASP 34 HB2 ASP 34 2.113 -26.002 -1.943 230 HB3 ASP 34 HB3 ASP 34 3.859 -25.798 -1.819 231 H ASP 35 H ASP 35 4.612 -27.894 -0.131 232 HA ASP 35 HA ASP 35 7.212 -27.790 -1.209 233 HB2 ASP 35 HB2 ASP 35 6.193 -27.521 1.285 234 HB3 ASP 35 HB3 ASP 35 6.874 -29.141 1.401 235 H GLY 36 H GLY 36 4.970 -30.363 -0.909 236 HA2 GLY 36 HA2 GLY 36 5.499 -32.319 -2.320 237 HA3 GLY 36 HA3 GLY 36 7.106 -32.283 -1.609 238 H THR 37 H THR 37 6.047 -31.686 1.074 239 HA THR 37 HA THR 37 5.774 -34.349 1.993 240 HB THR 37 HB THR 37 5.516 -33.433 4.198 241 HG1 THR 37 HG1 THR 37 5.214 -30.855 3.031 242 HG21 THR 37 HG21 THR 37 7.611 -32.617 4.341 243 HG22 THR 37 HG22 THR 37 7.289 -31.320 3.190 244 HG23 THR 37 HG23 THR 37 7.674 -32.940 2.609 245 H VAL 38 H VAL 38 3.863 -34.407 3.903 246 HA VAL 38 HA VAL 38 1.314 -33.806 2.586 247 HB VAL 38 HB VAL 38 2.151 -36.529 3.580 248 HG11 VAL 38 HG11 VAL 38 -0.035 -36.233 4.434 249 HG12 VAL 38 HG12 VAL 38 -0.589 -35.456 2.949 250 HG13 VAL 38 HG13 VAL 38 -0.211 -37.180 2.957 251 HG21 VAL 38 HG21 VAL 38 1.856 -37.272 1.382 252 HG22 VAL 38 HG22 VAL 38 0.936 -35.839 0.923 253 HG23 VAL 38 HG23 VAL 38 2.673 -35.719 1.203 254 H LEU 39 H LEU 39 -0.218 -33.099 3.949 255 HA LEU 39 HA LEU 39 0.438 -32.563 6.661 256 HB2 LEU 39 HB2 LEU 39 -1.339 -31.547 4.855 257 HB3 LEU 39 HB3 LEU 39 -2.400 -32.444 5.939 258 HG LEU 39 HG LEU 39 -1.519 -31.146 7.839 259 HD11 LEU 39 HD11 LEU 39 0.298 -29.880 7.700 260 HD12 LEU 39 HD12 LEU 39 -0.341 -29.010 6.305 261 HD13 LEU 39 HD13 LEU 39 0.544 -30.518 6.074 262 HD21 LEU 39 HD21 LEU 39 -2.391 -28.851 6.878 263 HD22 LEU 39 HD22 LEU 39 -3.484 -30.211 7.138 264 HD23 LEU 39 HD23 LEU 39 -2.873 -29.866 5.519 265 H LEU 40 H LEU 40 -0.069 -33.617 8.497 266 HA LEU 40 HA LEU 40 -0.602 -36.312 8.562 267 HB2 LEU 40 HB2 LEU 40 0.226 -34.828 10.431 268 HB3 LEU 40 HB3 LEU 40 -1.459 -34.400 10.721 269 HG LEU 40 HG LEU 40 -1.979 -36.684 11.316 270 HD11 LEU 40 HD11 LEU 40 0.473 -37.961 11.574 271 HD12 LEU 40 HD12 LEU 40 0.525 -37.218 9.976 272 HD13 LEU 40 HD13 LEU 40 -0.789 -38.317 10.394 273 HD21 LEU 40 HD21 LEU 40 -1.298 -35.439 13.177 274 HD22 LEU 40 HD22 LEU 40 0.393 -35.444 12.676 275 HD23 LEU 40 HD23 LEU 40 -0.355 -36.926 13.275 276 H SER 41 H SER 41 -2.899 -33.632 8.716 277 HA SER 41 HA SER 41 -5.219 -34.960 9.371 278 HB2 SER 41 HB2 SER 41 -4.627 -32.416 8.596 279 HB3 SER 41 HB3 SER 41 -5.528 -32.990 7.194 280 HG SER 41 HG SER 41 -6.382 -32.524 9.792 281 H THR 42 H THR 42 -3.526 -34.886 6.302 282 HA THR 42 HA THR 42 -5.609 -36.137 4.798 283 HB THR 42 HB THR 42 -2.659 -35.962 4.152 284 HG1 THR 42 HG1 THR 42 -3.270 -34.106 2.985 285 HG21 THR 42 HG21 THR 42 -4.956 -37.123 2.777 286 HG22 THR 42 HG22 THR 42 -3.231 -37.331 2.472 287 HG23 THR 42 HG23 THR 42 -4.085 -35.944 1.796 288 H VAL 43 H VAL 43 -2.545 -37.287 6.193 289 HA VAL 43 HA VAL 43 -2.623 -39.920 5.356 290 HB VAL 43 HB VAL 43 -1.474 -38.612 7.793 291 HG11 VAL 43 HG11 VAL 43 -1.876 -40.607 8.837 292 HG12 VAL 43 HG12 VAL 43 -1.855 -41.526 7.331 293 HG13 VAL 43 HG13 VAL 43 -0.341 -40.978 8.053 294 HG21 VAL 43 HG21 VAL 43 -0.053 -38.227 6.044 295 HG22 VAL 43 HG22 VAL 43 0.588 -39.767 6.614 296 HG23 VAL 43 HG23 VAL 43 -0.487 -39.722 5.217 297 H THR 44 H THR 44 -4.257 -38.406 8.089 298 HA THR 44 HA THR 44 -5.256 -40.844 9.187 299 HB THR 44 HB THR 44 -6.529 -39.512 10.687 300 HG1 THR 44 HG1 THR 44 -6.071 -37.317 8.923 301 HG21 THR 44 HG21 THR 44 -3.798 -39.091 10.302 302 HG22 THR 44 HG22 THR 44 -4.730 -38.736 11.756 303 HG23 THR 44 HG23 THR 44 -4.477 -37.482 10.543 304 H ALA 45 H ALA 45 -6.303 -38.678 6.693 305 HA ALA 45 HA ALA 45 -9.016 -39.051 6.572 306 HB1 ALA 45 HB1 ALA 45 -7.479 -39.201 4.025 307 HB2 ALA 45 HB2 ALA 45 -8.926 -38.272 4.417 308 HB3 ALA 45 HB3 ALA 45 -7.352 -37.747 5.016 309 H GLN 46 H GLN 46 -6.519 -41.170 5.182 310 HA GLN 46 HA GLN 46 -8.580 -43.231 4.796 311 HB2 GLN 46 HB2 GLN 46 -5.873 -43.558 3.618 312 HB3 GLN 46 HB3 GLN 46 -7.443 -44.012 2.970 313 HG2 GLN 46 HG2 GLN 46 -7.178 -42.285 1.595 314 HG3 GLN 46 HG3 GLN 46 -7.599 -41.287 2.986 315 HE21 GLN 46 HE21 GLN 46 -4.809 -42.853 1.464 316 HE22 GLN 46 HE22 GLN 46 -3.689 -41.584 1.810 317 H PHE 47 H PHE 47 -5.477 -42.541 6.265 318 HA PHE 47 HA PHE 47 -5.527 -45.195 7.540 319 HB2 PHE 47 HB2 PHE 47 -3.062 -43.518 7.571 320 HB3 PHE 47 HB3 PHE 47 -3.226 -45.270 7.519 321 HD1 PHE 47 HD1 PHE 47 -4.734 -45.895 5.229 322 HD2 PHE 47 HD2 PHE 47 -1.937 -42.729 5.744 323 HE1 PHE 47 HE1 PHE 47 -4.332 -45.861 2.802 324 HE2 PHE 47 HE2 PHE 47 -1.531 -42.688 3.317 325 HZ PHE 47 HZ PHE 47 -2.730 -44.255 1.843 326 HA PRO 48 HA PRO 48 -6.482 -42.106 10.859 327 HB2 PRO 48 HB2 PRO 48 -8.401 -43.625 12.035 328 HB3 PRO 48 HB3 PRO 48 -8.734 -42.532 10.686 329 HG2 PRO 48 HG2 PRO 48 -8.305 -45.495 10.661 330 HG3 PRO 48 HG3 PRO 48 -9.511 -44.531 9.788 331 HD2 PRO 48 HD2 PRO 48 -7.250 -45.447 8.613 332 HD3 PRO 48 HD3 PRO 48 -8.014 -43.914 8.147 333 H GLY 49 H GLY 49 -5.198 -42.114 12.591 334 HA2 GLY 49 HA2 GLY 49 -4.420 -42.959 14.652 335 HA3 GLY 49 HA3 GLY 49 -4.862 -44.578 14.128 336 H ALA 50 H ALA 50 -3.513 -44.191 11.516 337 HA ALA 50 HA ALA 50 -1.104 -45.414 12.007 338 HB1 ALA 50 HB1 ALA 50 -0.432 -44.709 9.747 339 HB2 ALA 50 HB2 ALA 50 -2.083 -45.327 9.795 340 HB3 ALA 50 HB3 ALA 50 -1.794 -43.590 9.707 341 H CYS 51 H CYS 51 0.538 -44.741 13.215 342 HA CYS 51 HA CYS 51 1.045 -41.937 13.651 343 HB2 CYS 51 HB2 CYS 51 2.044 -44.501 14.767 344 HB3 CYS 51 HB3 CYS 51 3.135 -43.123 14.854 345 HG CYS 51 HG CYS 51 0.692 -41.665 15.968 346 H GLY 52 H GLY 52 2.489 -44.571 11.829 347 HA2 GLY 52 HA2 GLY 52 4.063 -42.625 10.333 348 HA3 GLY 52 HA3 GLY 52 4.968 -43.869 11.182 349 H LEU 53 H LEU 53 4.811 -43.368 8.321 350 HA LEU 53 HA LEU 53 3.570 -45.892 7.444 351 HB2 LEU 53 HB2 LEU 53 4.216 -43.529 5.699 352 HB3 LEU 53 HB3 LEU 53 3.252 -44.944 5.282 353 HG LEU 53 HG LEU 53 1.619 -43.362 5.583 354 HD11 LEU 53 HD11 LEU 53 1.656 -43.944 8.472 355 HD12 LEU 53 HD12 LEU 53 1.689 -45.342 7.398 356 HD13 LEU 53 HD13 LEU 53 0.376 -44.172 7.280 357 HD21 LEU 53 HD21 LEU 53 3.328 -41.661 6.391 358 HD22 LEU 53 HD22 LEU 53 2.957 -42.223 8.021 359 HD23 LEU 53 HD23 LEU 53 1.689 -41.507 7.025 360 H ARG 54 H ARG 54 4.736 -47.287 6.149 361 HA ARG 54 HA ARG 54 7.627 -46.761 6.050 362 HB2 ARG 54 HB2 ARG 54 6.303 -48.907 7.112 363 HB3 ARG 54 HB3 ARG 54 6.700 -49.497 5.503 364 HG2 ARG 54 HG2 ARG 54 9.075 -48.469 6.192 365 HG3 ARG 54 HG3 ARG 54 8.458 -48.892 7.790 366 HD2 ARG 54 HD2 ARG 54 8.099 -50.942 5.709 367 HD3 ARG 54 HD3 ARG 54 9.771 -50.605 6.157 368 HE ARG 54 HE ARG 54 8.446 -50.903 8.535 369 HH11 ARG 54 HH11 ARG 54 8.925 -52.851 5.690 370 HH12 ARG 54 HH12 ARG 54 8.838 -54.355 6.546 371 HH21 ARG 54 HH21 ARG 54 8.329 -52.876 9.673 372 HH22 ARG 54 HH22 ARG 54 8.498 -54.368 8.812 373 H TYR 55 H TYR 55 8.773 -47.841 4.186 374 HA TYR 55 HA TYR 55 7.258 -47.315 1.723 375 HB2 TYR 55 HB2 TYR 55 9.886 -46.583 2.598 376 HB3 TYR 55 HB3 TYR 55 10.024 -47.587 1.159 377 HD1 TYR 55 HD1 TYR 55 8.154 -46.912 -0.705 378 HD2 TYR 55 HD2 TYR 55 9.819 -44.316 2.226 379 HE1 TYR 55 HE1 TYR 55 7.598 -44.975 -2.114 380 HE2 TYR 55 HE2 TYR 55 9.267 -42.371 0.825 381 HH TYR 55 HH TYR 55 8.574 -42.526 -2.343 382 H ARG 56 H ARG 56 6.859 -48.901 0.314 383 HA ARG 56 HA ARG 56 8.356 -51.421 0.574 384 HB2 ARG 56 HB2 ARG 56 6.311 -51.968 1.582 385 HB3 ARG 56 HB3 ARG 56 5.385 -51.000 0.443 386 HG2 ARG 56 HG2 ARG 56 5.136 -53.444 0.128 387 HG3 ARG 56 HG3 ARG 56 5.733 -52.599 -1.301 388 HD2 ARG 56 HD2 ARG 56 8.021 -53.271 -0.731 389 HD3 ARG 56 HD3 ARG 56 7.412 -54.127 0.685 390 HE ARG 56 HE ARG 56 6.146 -55.024 -1.699 391 HH11 ARG 56 HH11 ARG 56 9.082 -55.272 0.155 392 HH12 ARG 56 HH12 ARG 56 9.484 -56.845 -0.448 393 HH21 ARG 56 HH21 ARG 56 6.664 -57.096 -2.500 394 HH22 ARG 56 HH22 ARG 56 8.109 -57.882 -1.959 395 H ASN 57 H ASN 57 9.611 -51.194 -1.220 396 HA ASN 57 HA ASN 57 8.228 -50.760 -3.784 397 HB2 ASN 57 HB2 ASN 57 11.046 -50.164 -2.901 398 HB3 ASN 57 HB3 ASN 57 10.609 -50.243 -4.605 399 HD21 ASN 57 HD21 ASN 57 10.490 -48.261 -5.362 400 HD22 ASN 57 HD22 ASN 57 9.703 -46.926 -4.598 401 HA PRO 58 HA PRO 58 9.132 -55.112 -4.355 402 HB2 PRO 58 HB2 PRO 58 7.782 -55.332 -6.700 403 HB3 PRO 58 HB3 PRO 58 6.977 -55.317 -5.126 404 HG2 PRO 58 HG2 PRO 58 7.330 -53.089 -7.094 405 HG3 PRO 58 HG3 PRO 58 5.895 -53.532 -6.151 406 HD2 PRO 58 HD2 PRO 58 7.534 -51.497 -5.440 407 HD3 PRO 58 HD3 PRO 58 6.668 -52.487 -4.248 408 H VAL 59 H VAL 59 9.558 -52.568 -6.769 409 HA VAL 59 HA VAL 59 11.408 -54.178 -8.320 410 HB VAL 59 HB VAL 59 11.574 -52.262 -9.808 411 HG11 VAL 59 HG11 VAL 59 8.721 -52.068 -9.554 412 HG12 VAL 59 HG12 VAL 59 9.680 -52.912 -10.771 413 HG13 VAL 59 HG13 VAL 59 9.244 -53.727 -9.268 414 HG21 VAL 59 HG21 VAL 59 11.537 -50.486 -8.141 415 HG22 VAL 59 HG22 VAL 59 10.310 -50.205 -9.376 416 HG23 VAL 59 HG23 VAL 59 9.842 -50.828 -7.794 417 H SER 60 H SER 60 11.490 -51.657 -5.917 418 HA SER 60 HA SER 60 14.296 -51.083 -6.329 419 HB2 SER 60 HB2 SER 60 12.377 -49.495 -5.449 420 HB3 SER 60 HB3 SER 60 12.814 -50.190 -3.888 421 HG SER 60 HG SER 60 14.822 -49.345 -4.060 422 H GLN 61 H GLN 61 12.313 -53.041 -4.232 423 HA GLN 61 HA GLN 61 12.797 -54.469 -2.518 424 HB2 GLN 61 HB2 GLN 61 15.362 -54.826 -4.078 425 HB3 GLN 61 HB3 GLN 61 14.681 -55.961 -2.920 426 HG2 GLN 61 HG2 GLN 61 12.618 -55.642 -4.674 427 HG3 GLN 61 HG3 GLN 61 14.024 -55.516 -5.729 428 HE21 GLN 61 HE21 GLN 61 15.788 -57.233 -4.857 429 HE22 GLN 61 HE22 GLN 61 15.171 -58.845 -4.807 430 H CYS 62 H CYS 62 13.509 -51.725 -2.052 431 HA CYS 62 HA CYS 62 15.977 -51.918 -0.489 432 HB2 CYS 62 HB2 CYS 62 14.935 -49.893 -2.083 433 HB3 CYS 62 HB3 CYS 62 14.638 -49.332 -0.442 434 HG CYS 62 HG CYS 62 16.959 -48.109 -0.947 435 H MET 63 H MET 63 15.563 -50.080 1.474 436 HA MET 63 HA MET 63 13.254 -51.098 2.985 437 HB2 MET 63 HB2 MET 63 15.584 -52.085 3.587 438 HB3 MET 63 HB3 MET 63 15.871 -50.521 4.338 439 HG2 MET 63 HG2 MET 63 14.143 -50.833 5.897 440 HG3 MET 63 HG3 MET 63 13.469 -52.190 4.997 441 HE1 MET 63 HE1 MET 63 14.574 -51.296 7.914 442 HE2 MET 63 HE2 MET 63 15.361 -52.688 8.657 443 HE3 MET 63 HE3 MET 63 16.334 -51.412 7.923 444 H ARG 64 H ARG 64 13.485 -48.649 1.515 445 HA ARG 64 HA ARG 64 14.163 -46.448 3.119 446 HB2 ARG 64 HB2 ARG 64 13.321 -46.785 0.537 447 HB3 ARG 64 HB3 ARG 64 11.913 -46.031 1.274 448 HG2 ARG 64 HG2 ARG 64 14.072 -44.541 2.195 449 HG3 ARG 64 HG3 ARG 64 14.432 -44.866 0.499 450 HD2 ARG 64 HD2 ARG 64 13.084 -43.155 0.021 451 HD3 ARG 64 HD3 ARG 64 11.750 -44.215 0.478 452 HE ARG 64 HE ARG 64 11.412 -42.881 2.289 453 HH11 ARG 64 HH11 ARG 64 14.710 -42.494 1.244 454 HH12 ARG 64 HH12 ARG 64 15.071 -41.261 2.406 455 HH21 ARG 64 HH21 ARG 64 11.875 -41.258 3.824 456 HH22 ARG 64 HH22 ARG 64 13.458 -40.559 3.874 457 H GLY 65 H GLY 65 12.131 -44.742 3.380 458 HA2 GLY 65 HA2 GLY 65 9.718 -45.782 4.407 459 HA3 GLY 65 HA3 GLY 65 10.847 -45.544 5.732 460 H VAL 66 H VAL 66 8.267 -44.190 4.631 461 HA VAL 66 HA VAL 66 8.859 -41.560 3.903 462 HB VAL 66 HB VAL 66 6.477 -42.612 5.434 463 HG11 VAL 66 HG11 VAL 66 5.340 -40.559 4.660 464 HG12 VAL 66 HG12 VAL 66 6.666 -40.227 5.776 465 HG13 VAL 66 HG13 VAL 66 6.882 -39.966 4.044 466 HG21 VAL 66 HG21 VAL 66 7.049 -42.215 2.511 467 HG22 VAL 66 HG22 VAL 66 6.539 -43.686 3.340 468 HG23 VAL 66 HG23 VAL 66 5.406 -42.349 3.140 469 H ARG 67 H ARG 67 9.985 -40.095 4.986 470 HA ARG 67 HA ARG 67 10.453 -40.306 7.806 471 HB2 ARG 67 HB2 ARG 67 12.244 -39.474 6.466 472 HB3 ARG 67 HB3 ARG 67 11.216 -38.243 5.744 473 HG2 ARG 67 HG2 ARG 67 12.701 -37.231 7.344 474 HG3 ARG 67 HG3 ARG 67 11.042 -37.137 7.936 475 HD2 ARG 67 HD2 ARG 67 11.934 -39.531 8.956 476 HD3 ARG 67 HD3 ARG 67 13.360 -38.499 9.061 477 HE ARG 67 HE ARG 67 10.969 -37.260 10.060 478 HH11 ARG 67 HH11 ARG 67 13.650 -39.341 10.835 479 HH12 ARG 67 HH12 ARG 67 13.581 -39.014 12.535 480 HH21 ARG 67 HH21 ARG 67 10.868 -36.822 12.296 481 HH22 ARG 67 HH22 ARG 67 11.998 -37.582 13.365 482 H LEU 68 H LEU 68 9.003 -39.717 9.272 483 HA LEU 68 HA LEU 68 7.062 -37.627 8.634 484 HB2 LEU 68 HB2 LEU 68 6.138 -39.666 9.500 485 HB3 LEU 68 HB3 LEU 68 7.227 -39.620 10.886 486 HG LEU 68 HG LEU 68 4.777 -38.984 11.258 487 HD11 LEU 68 HD11 LEU 68 5.445 -37.931 13.122 488 HD12 LEU 68 HD12 LEU 68 6.368 -36.720 12.231 489 HD13 LEU 68 HD13 LEU 68 7.069 -38.308 12.545 490 HD21 LEU 68 HD21 LEU 68 5.360 -36.209 10.576 491 HD22 LEU 68 HD22 LEU 68 3.898 -37.160 10.313 492 HD23 LEU 68 HD23 LEU 68 5.237 -37.266 9.170 493 H VAL 69 H VAL 69 6.994 -35.684 9.623 494 HA VAL 69 HA VAL 69 8.576 -35.196 12.016 495 HB VAL 69 HB VAL 69 10.205 -34.734 10.292 496 HG11 VAL 69 HG11 VAL 69 7.959 -33.832 8.832 497 HG12 VAL 69 HG12 VAL 69 9.069 -32.470 8.988 498 HG13 VAL 69 HG13 VAL 69 9.627 -33.988 8.284 499 HG21 VAL 69 HG21 VAL 69 9.284 -32.001 11.054 500 HG22 VAL 69 HG22 VAL 69 9.748 -33.139 12.318 501 HG23 VAL 69 HG23 VAL 69 10.909 -32.686 11.071 502 H GLU 70 H GLU 70 7.379 -34.035 13.363 503 HA GLU 70 HA GLU 70 5.804 -32.620 14.194 504 HB2 GLU 70 HB2 GLU 70 6.142 -31.191 11.551 505 HB3 GLU 70 HB3 GLU 70 5.403 -30.524 13.000 506 HG2 GLU 70 HG2 GLU 70 8.245 -31.483 12.943 507 HG3 GLU 70 HG3 GLU 70 7.787 -29.838 12.505 508 H GLY 71 H GLY 71 5.031 -34.956 12.548 509 HA2 GLY 71 HA2 GLY 71 2.891 -35.857 12.232 510 HA3 GLY 71 HA3 GLY 71 2.227 -34.230 12.249 511 H ILE 72 H ILE 72 4.279 -33.356 10.256 512 HA ILE 72 HA ILE 72 2.743 -34.033 7.913 513 HB ILE 72 HB ILE 72 5.225 -32.330 8.164 514 HG12 ILE 72 HG12 ILE 72 3.022 -30.722 7.587 515 HG13 ILE 72 HG13 ILE 72 2.426 -31.856 8.795 516 HG21 ILE 72 HG21 ILE 72 5.237 -32.166 5.952 517 HG22 ILE 72 HG22 ILE 72 3.957 -33.376 5.879 518 HG23 ILE 72 HG23 ILE 72 3.547 -31.663 5.948 519 HD11 ILE 72 HD11 ILE 72 4.193 -29.589 9.091 520 HD12 ILE 72 HD12 ILE 72 3.294 -30.492 10.311 521 HD13 ILE 72 HD13 ILE 72 4.879 -31.059 9.784 522 H LEU 73 H LEU 73 3.113 -35.777 6.728 523 HA LEU 73 HA LEU 73 5.482 -37.342 6.992 524 HB2 LEU 73 HB2 LEU 73 3.091 -37.475 5.182 525 HB3 LEU 73 HB3 LEU 73 4.451 -38.583 5.005 526 HG LEU 73 HG LEU 73 2.697 -39.670 6.235 527 HD11 LEU 73 HD11 LEU 73 4.924 -38.854 8.096 528 HD12 LEU 73 HD12 LEU 73 5.003 -40.147 6.900 529 HD13 LEU 73 HD13 LEU 73 3.892 -40.274 8.264 530 HD21 LEU 73 HD21 LEU 73 1.644 -38.822 8.131 531 HD22 LEU 73 HD22 LEU 73 1.760 -37.423 7.062 532 HD23 LEU 73 HD23 LEU 73 2.894 -37.607 8.401 533 H HIS 74 H HIS 74 7.368 -36.824 6.119 534 HA HIS 74 HA HIS 74 7.498 -35.104 3.784 535 HB2 HIS 74 HB2 HIS 74 9.099 -35.407 6.016 536 HB3 HIS 74 HB3 HIS 74 10.032 -36.197 4.748 537 HD1 HIS 74 HD1 HIS 74 9.803 -34.472 2.386 538 HD2 HIS 74 HD2 HIS 74 9.979 -32.871 6.216 539 HE1 HIS 74 HE1 HIS 74 10.592 -32.103 2.088 540 H ALA 75 H ALA 75 8.414 -35.653 1.811 541 HA ALA 75 HA ALA 75 8.382 -38.516 1.217 542 HB1 ALA 75 HB1 ALA 75 7.142 -37.679 -0.456 543 HB2 ALA 75 HB2 ALA 75 7.835 -36.064 -0.300 544 HB3 ALA 75 HB3 ALA 75 8.703 -37.313 -1.193 545 HA PRO 76 HA PRO 76 12.719 -38.923 0.688 546 HB2 PRO 76 HB2 PRO 76 12.868 -40.605 -1.439 547 HB3 PRO 76 HB3 PRO 76 12.341 -41.129 0.165 548 HG2 PRO 76 HG2 PRO 76 10.694 -40.415 -2.230 549 HG3 PRO 76 HG3 PRO 76 10.493 -41.763 -1.096 550 HD2 PRO 76 HD2 PRO 76 9.008 -39.504 -0.951 551 HD3 PRO 76 HD3 PRO 76 9.460 -40.443 0.486 552 H ASP 77 H ASP 77 14.386 -39.090 -1.302 553 HA ASP 77 HA ASP 77 14.250 -36.514 -2.574 554 HB2 ASP 77 HB2 ASP 77 16.289 -38.448 -1.953 555 HB3 ASP 77 HB3 ASP 77 16.410 -37.979 -3.646 556 H ALA 78 H ALA 78 12.904 -39.413 -3.325 557 HA ALA 78 HA ALA 78 13.161 -39.002 -6.229 558 HB1 ALA 78 HB1 ALA 78 12.451 -41.452 -4.631 559 HB2 ALA 78 HB2 ALA 78 12.264 -41.349 -6.382 560 HB3 ALA 78 HB3 ALA 78 13.863 -41.194 -5.656 561 H GLY 79 H GLY 79 10.942 -39.079 -3.557 562 HA2 GLY 79 HA2 GLY 79 8.918 -37.708 -3.867 563 HA3 GLY 79 HA3 GLY 79 8.743 -38.476 -5.438 564 H TRP 80 H TRP 80 6.545 -38.652 -4.149 565 HA TRP 80 HA TRP 80 6.329 -40.720 -2.216 566 HB2 TRP 80 HB2 TRP 80 4.270 -39.423 -4.009 567 HB3 TRP 80 HB3 TRP 80 3.873 -40.596 -2.756 568 HD1 TRP 80 HD1 TRP 80 4.060 -36.994 -3.259 569 HE1 TRP 80 HE1 TRP 80 4.137 -35.737 -1.014 570 HE3 TRP 80 HE3 TRP 80 5.138 -40.920 -0.167 571 HZ2 TRP 80 HZ2 TRP 80 4.594 -36.332 1.707 572 HZ3 TRP 80 HZ3 TRP 80 5.380 -40.491 2.243 573 HH2 TRP 80 HH2 TRP 80 5.114 -38.244 3.159 574 H GLY 81 H GLY 81 5.303 -40.636 -5.639 575 HA2 GLY 81 HA2 GLY 81 5.533 -42.321 -7.234 576 HA3 GLY 81 HA3 GLY 81 6.191 -43.374 -5.990 577 H ASN 82 H ASN 82 4.797 -44.980 -7.057 578 HA ASN 82 HA ASN 82 2.066 -44.856 -5.963 579 HB2 ASN 82 HB2 ASN 82 2.880 -46.033 -8.630 580 HB3 ASN 82 HB3 ASN 82 1.259 -46.072 -7.944 581 HD21 ASN 82 HD21 ASN 82 3.816 -43.875 -8.987 582 HD22 ASN 82 HD22 ASN 82 2.761 -42.604 -9.493 583 H LEU 83 H LEU 83 4.426 -46.022 -4.787 584 HA LEU 83 HA LEU 83 4.123 -48.893 -5.131 585 HB2 LEU 83 HB2 LEU 83 5.915 -48.934 -3.325 586 HB3 LEU 83 HB3 LEU 83 6.357 -48.267 -4.896 587 HG LEU 83 HG LEU 83 7.163 -47.080 -2.747 588 HD11 LEU 83 HD11 LEU 83 5.972 -44.965 -4.302 589 HD12 LEU 83 HD12 LEU 83 6.621 -46.232 -5.343 590 HD13 LEU 83 HD13 LEU 83 7.664 -45.443 -4.159 591 HD21 LEU 83 HD21 LEU 83 5.659 -45.483 -1.788 592 HD22 LEU 83 HD22 LEU 83 4.903 -47.074 -1.699 593 HD23 LEU 83 HD23 LEU 83 4.388 -45.920 -2.929 594 H VAL 84 H VAL 84 4.430 -50.007 -2.753 595 HA VAL 84 HA VAL 84 1.943 -49.331 -1.379 596 HB VAL 84 HB VAL 84 3.689 -51.703 -0.769 597 HG11 VAL 84 HG11 VAL 84 1.092 -52.470 -0.502 598 HG12 VAL 84 HG12 VAL 84 2.101 -51.863 0.812 599 HG13 VAL 84 HG13 VAL 84 1.006 -50.771 -0.037 600 HG21 VAL 84 HG21 VAL 84 2.062 -51.181 -3.160 601 HG22 VAL 84 HG22 VAL 84 3.387 -52.319 -2.914 602 HG23 VAL 84 HG23 VAL 84 1.760 -52.730 -2.373 603 H TYR 85 H TYR 85 1.872 -49.367 0.983 604 HA TYR 85 HA TYR 85 4.407 -48.623 2.265 605 HB2 TYR 85 HB2 TYR 85 3.685 -46.588 2.970 606 HB3 TYR 85 HB3 TYR 85 2.640 -46.709 1.559 607 HD1 TYR 85 HD1 TYR 85 0.279 -46.874 1.789 608 HD2 TYR 85 HD2 TYR 85 2.771 -47.112 5.229 609 HE1 TYR 85 HE1 TYR 85 -1.701 -46.652 3.231 610 HE2 TYR 85 HE2 TYR 85 0.798 -46.892 6.681 611 HH TYR 85 HH TYR 85 -2.412 -47.115 5.465 612 H VAL 86 H VAL 86 4.566 -49.106 4.457 613 HA VAL 86 HA VAL 86 2.474 -50.917 5.465 614 HB VAL 86 HB VAL 86 5.391 -50.810 6.245 615 HG11 VAL 86 HG11 VAL 86 4.943 -52.859 7.470 616 HG12 VAL 86 HG12 VAL 86 3.905 -51.557 8.053 617 HG13 VAL 86 HG13 VAL 86 3.249 -52.799 6.987 618 HG21 VAL 86 HG21 VAL 86 4.681 -53.286 5.085 619 HG22 VAL 86 HG22 VAL 86 4.096 -52.018 4.008 620 HG23 VAL 86 HG23 VAL 86 5.799 -52.072 4.463 621 H VAL 87 H VAL 87 1.251 -50.126 7.034 622 HA VAL 87 HA VAL 87 1.661 -47.686 8.324 623 HB VAL 87 HB VAL 87 -0.055 -48.517 9.982 624 HG11 VAL 87 HG11 VAL 87 -1.869 -48.664 8.253 625 HG12 VAL 87 HG12 VAL 87 -0.794 -47.274 8.091 626 HG13 VAL 87 HG13 VAL 87 -0.604 -48.667 7.025 627 HG21 VAL 87 HG21 VAL 87 -1.055 -50.626 9.743 628 HG22 VAL 87 HG22 VAL 87 -0.293 -50.907 8.177 629 HG23 VAL 87 HG23 VAL 87 0.678 -50.942 9.649 630 H ASN 88 H ASN 88 2.020 -47.272 10.613 631 HA ASN 88 HA ASN 88 3.511 -49.310 12.071 632 HB2 ASN 88 HB2 ASN 88 5.131 -47.944 10.674 633 HB3 ASN 88 HB3 ASN 88 4.688 -46.559 11.668 634 HD21 ASN 88 HD21 ASN 88 6.645 -46.265 12.617 635 HD22 ASN 88 HD22 ASN 88 7.358 -47.395 13.712 636 H TYR 89 H TYR 89 2.861 -49.339 14.115 637 HA TYR 89 HA TYR 89 1.778 -46.857 15.279 638 HB2 TYR 89 HB2 TYR 89 0.840 -49.632 16.002 639 HB3 TYR 89 HB3 TYR 89 0.092 -48.095 16.419 640 HD1 TYR 89 HD1 TYR 89 0.560 -50.598 13.790 641 HD2 TYR 89 HD2 TYR 89 -1.247 -46.880 14.795 642 HE1 TYR 89 HE1 TYR 89 -0.873 -50.763 11.798 643 HE2 TYR 89 HE2 TYR 89 -2.686 -47.035 12.806 644 HH TYR 89 HH TYR 89 -3.331 -49.680 11.204 645 HA PRO 90 HA PRO 90 5.350 -48.453 17.824 646 HB2 PRO 90 HB2 PRO 90 6.650 -46.073 17.948 647 HB3 PRO 90 HB3 PRO 90 6.889 -47.231 16.634 648 HG2 PRO 90 HG2 PRO 90 5.185 -44.771 16.704 649 HG3 PRO 90 HG3 PRO 90 6.249 -45.359 15.413 650 HD2 PRO 90 HD2 PRO 90 3.565 -45.707 15.360 651 HD3 PRO 90 HD3 PRO 90 4.694 -46.880 14.651 652 H LYS 91 H LYS 91 3.836 -45.228 18.040 653 HA LYS 91 HA LYS 91 2.686 -45.697 20.570 654 HB2 LYS 91 HB2 LYS 91 4.089 -44.121 21.900 655 HB3 LYS 91 HB3 LYS 91 4.922 -45.602 21.447 656 HG2 LYS 91 HG2 LYS 91 6.569 -44.295 20.734 657 HG3 LYS 91 HG3 LYS 91 5.517 -43.881 19.378 658 HD2 LYS 91 HD2 LYS 91 4.587 -42.025 20.779 659 HD3 LYS 91 HD3 LYS 91 5.833 -42.385 21.977 660 HE2 LYS 91 HE2 LYS 91 6.752 -42.007 19.195 661 HE3 LYS 91 HE3 LYS 91 6.136 -40.574 20.016 662 HZ1 LYS 91 HZ1 LYS 91 8.599 -41.065 20.230 663 HZ2 LYS 91 HZ2 LYS 91 8.162 -42.330 21.263 664 HZ3 LYS 91 HZ3 LYS 91 7.763 -40.736 21.664 665 H ASP 92 H ASP 92 1.273 -44.075 21.153 666 HA ASP 92 HA ASP 92 0.502 -42.259 19.117 667 HB2 ASP 92 HB2 ASP 92 -1.198 -41.503 20.684 668 HB3 ASP 92 HB3 ASP 92 -1.091 -43.261 20.723 669 H ASN 93 H ASN 93 0.363 -39.933 19.289 670 HA ASN 93 HA ASN 93 1.912 -38.530 21.247 671 HB2 ASN 93 HB2 ASN 93 3.497 -39.570 19.364 672 HB3 ASN 93 HB3 ASN 93 2.996 -38.116 18.504 673 HD21 ASN 93 HD21 ASN 93 4.431 -39.275 21.504 674 HD22 ASN 93 HD22 ASN 93 5.365 -37.856 21.817 675 H LYS 94 H LYS 94 2.275 -36.141 20.292 676 HA LYS 94 HA LYS 94 -0.078 -35.341 18.743 677 HB2 LYS 94 HB2 LYS 94 -0.125 -35.165 21.462 678 HB3 LYS 94 HB3 LYS 94 0.525 -33.588 21.036 679 HG2 LYS 94 HG2 LYS 94 -1.666 -34.105 19.319 680 HG3 LYS 94 HG3 LYS 94 -2.167 -34.479 20.970 681 HD2 LYS 94 HD2 LYS 94 -0.632 -31.981 20.603 682 HD3 LYS 94 HD3 LYS 94 -2.257 -32.007 19.914 683 HE2 LYS 94 HE2 LYS 94 -3.247 -32.431 22.010 684 HE3 LYS 94 HE3 LYS 94 -1.702 -32.860 22.742 685 HZ1 LYS 94 HZ1 LYS 94 -1.019 -30.631 22.751 686 HZ2 LYS 94 HZ2 LYS 94 -2.621 -30.593 23.295 687 HZ3 LYS 94 HZ3 LYS 94 -2.257 -30.143 21.705 688 H ARG 95 H ARG 95 0.075 -32.754 18.566 689 HA ARG 95 HA ARG 95 2.870 -32.050 17.983 690 HB2 ARG 95 HB2 ARG 95 2.300 -31.143 15.854 691 HB3 ARG 95 HB3 ARG 95 1.618 -32.763 15.917 692 HG2 ARG 95 HG2 ARG 95 -0.578 -31.851 16.384 693 HG3 ARG 95 HG3 ARG 95 0.088 -30.217 16.408 694 HD2 ARG 95 HD2 ARG 95 0.191 -30.089 14.160 695 HD3 ARG 95 HD3 ARG 95 0.678 -31.775 13.986 696 HE ARG 95 HE ARG 95 -1.966 -31.829 14.756 697 HH11 ARG 95 HH11 ARG 95 -0.126 -30.524 12.104 698 HH12 ARG 95 HH12 ARG 95 -1.424 -30.661 10.965 699 HH21 ARG 95 HH21 ARG 95 -3.683 -32.015 13.266 700 HH22 ARG 95 HH22 ARG 95 -3.447 -31.509 11.627 701 H LYS 96 H LYS 96 2.750 -29.553 17.189 702 HA LYS 96 HA LYS 96 0.863 -27.924 18.573 703 HB2 LYS 96 HB2 LYS 96 3.009 -28.871 20.120 704 HB3 LYS 96 HB3 LYS 96 3.407 -27.203 19.732 705 HG2 LYS 96 HG2 LYS 96 0.641 -27.570 20.584 706 HG3 LYS 96 HG3 LYS 96 1.831 -28.025 21.807 707 HD2 LYS 96 HD2 LYS 96 1.442 -25.752 22.201 708 HD3 LYS 96 HD3 LYS 96 2.947 -25.778 21.279 709 HE2 LYS 96 HE2 LYS 96 2.038 -24.505 19.704 710 HE3 LYS 96 HE3 LYS 96 0.745 -25.679 19.465 711 HZ1 LYS 96 HZ1 LYS 96 -0.507 -24.637 21.228 712 HZ2 LYS 96 HZ2 LYS 96 -0.100 -23.482 20.061 713 HZ3 LYS 96 HZ3 LYS 96 0.746 -23.539 21.525 714 H MET 97 H MET 97 4.321 -27.750 17.695 715 HA MET 97 HA MET 97 5.461 -26.385 16.279 716 HB2 MET 97 HB2 MET 97 3.030 -26.991 14.959 717 HB3 MET 97 HB3 MET 97 3.344 -25.282 14.693 718 HG2 MET 97 HG2 MET 97 5.747 -26.807 14.322 719 HG3 MET 97 HG3 MET 97 4.443 -27.457 13.331 720 HE1 MET 97 HE1 MET 97 3.468 -24.854 10.926 721 HE2 MET 97 HE2 MET 97 4.426 -26.305 10.629 722 HE3 MET 97 HE3 MET 97 3.110 -26.342 11.804 723 H ASP 98 H ASP 98 5.695 -24.078 15.581 724 HA ASP 98 HA ASP 98 4.040 -22.046 16.627 725 HB2 ASP 98 HB2 ASP 98 5.767 -23.233 18.537 726 HB3 ASP 98 HB3 ASP 98 6.420 -21.639 18.168 727 H GLU 99 H GLU 99 7.548 -22.616 16.280 728 HA GLU 99 HA GLU 99 9.131 -21.604 14.998 729 HB2 GLU 99 HB2 GLU 99 6.931 -21.918 13.334 730 HB3 GLU 99 HB3 GLU 99 7.368 -20.227 13.133 731 HG2 GLU 99 HG2 GLU 99 9.473 -20.738 12.296 732 HG3 GLU 99 HG3 GLU 99 9.441 -22.374 12.951 733 H THR 100 H THR 100 9.934 -19.442 14.260 734 HA THR 100 HA THR 100 8.558 -17.139 15.375 735 HB THR 100 HB THR 100 10.690 -16.447 16.599 736 HG1 THR 100 HG1 THR 100 11.916 -18.336 17.322 737 HG21 THR 100 HG21 THR 100 10.015 -17.509 18.627 738 HG22 THR 100 HG22 THR 100 9.280 -18.852 17.749 739 HG23 THR 100 HG23 THR 100 8.557 -17.245 17.670 740 H ASP 101 H ASP 101 10.238 -15.169 15.167 741 HA ASP 101 HA ASP 101 11.806 -15.406 12.720 742 HB2 ASP 101 HB2 ASP 101 9.709 -13.250 12.988 743 HB3 ASP 101 HB3 ASP 101 10.698 -13.621 11.578 744 H ALA 102 H ALA 102 10.519 -12.847 14.850 745 HA ALA 102 HA ALA 102 11.561 -11.267 16.121 746 HB1 ALA 102 HB1 ALA 102 13.394 -13.470 16.103 747 HB2 ALA 102 HB2 ALA 102 14.285 -11.948 16.081 748 HB3 ALA 102 HB3 ALA 102 13.110 -12.263 17.358 749 H SER 103 H SER 103 14.290 -12.072 13.997 750 HA SER 103 HA SER 103 15.449 -10.846 12.471 751 HB2 SER 103 HB2 SER 103 12.992 -10.789 11.532 752 HB3 SER 103 HB3 SER 103 13.073 -9.087 11.987 753 HG SER 103 HG SER 103 14.400 -8.725 10.390 754 H SER 104 H SER 104 16.951 -9.774 13.641 755 HA SER 104 HA SER 104 16.242 -7.061 14.545 756 HB2 SER 104 HB2 SER 104 17.946 -9.137 15.918 757 HB3 SER 104 HB3 SER 104 18.070 -7.421 16.307 758 HG SER 104 HG SER 104 16.473 -8.972 17.457 759 H ALA 105 H ALA 105 18.421 -5.809 14.984 760 HA ALA 105 HA ALA 105 20.616 -6.444 13.264 761 HB1 ALA 105 HB1 ALA 105 18.967 -5.677 11.600 762 HB2 ALA 105 HB2 ALA 105 18.872 -4.127 12.437 763 HB3 ALA 105 HB3 ALA 105 20.385 -4.630 11.682 764 H VAL 106 H VAL 106 22.233 -4.632 13.214 765 HA VAL 106 HA VAL 106 22.031 -2.440 14.988 766 HB VAL 106 HB VAL 106 22.140 -4.354 16.631 767 HG11 VAL 106 HG11 VAL 106 25.045 -4.585 16.309 768 HG12 VAL 106 HG12 VAL 106 23.840 -5.819 16.683 769 HG13 VAL 106 HG13 VAL 106 24.103 -5.319 15.012 770 HG21 VAL 106 HG21 VAL 106 22.823 -2.712 17.960 771 HG22 VAL 106 HG22 VAL 106 24.490 -3.051 17.496 772 HG23 VAL 106 HG23 VAL 106 23.546 -1.868 16.591 773 H LYS 107 H LYS 107 22.987 -3.132 12.324 774 HA LYS 107 HA LYS 107 25.738 -3.271 12.063 775 HB2 LYS 107 HB2 LYS 107 25.464 -2.432 9.852 776 HB3 LYS 107 HB3 LYS 107 24.020 -3.368 10.218 777 HG2 LYS 107 HG2 LYS 107 22.972 -1.572 9.370 778 HG3 LYS 107 HG3 LYS 107 23.202 -0.927 10.997 779 HD2 LYS 107 HD2 LYS 107 25.492 -0.112 10.032 780 HD3 LYS 107 HD3 LYS 107 24.680 -0.301 8.476 781 HE2 LYS 107 HE2 LYS 107 23.221 1.408 8.876 782 HE3 LYS 107 HE3 LYS 107 23.237 1.159 10.621 783 HZ1 LYS 107 HZ1 LYS 107 24.574 3.109 9.254 784 HZ2 LYS 107 HZ2 LYS 107 25.784 1.987 9.628 785 HZ3 LYS 107 HZ3 LYS 107 24.842 2.657 10.862 786 H VAL 108 H VAL 108 27.275 -1.569 11.456 787 HA VAL 108 HA VAL 108 26.820 1.162 11.961 788 HB VAL 108 HB VAL 108 26.627 0.339 14.306 789 HG11 VAL 108 HG11 VAL 108 28.327 -0.730 15.429 790 HG12 VAL 108 HG12 VAL 108 28.491 -1.431 13.818 791 HG13 VAL 108 HG13 VAL 108 29.572 -0.134 14.331 792 HG21 VAL 108 HG21 VAL 108 27.604 2.214 15.140 793 HG22 VAL 108 HG22 VAL 108 29.118 1.945 14.277 794 HG23 VAL 108 HG23 VAL 108 27.721 2.602 13.424 795 H LYS 109 H LYS 109 28.669 2.446 11.606 796 HA LYS 109 HA LYS 109 31.178 1.077 11.013 797 HB2 LYS 109 HB2 LYS 109 29.370 2.262 9.014 798 HB3 LYS 109 HB3 LYS 109 31.045 2.782 8.883 799 HG2 LYS 109 HG2 LYS 109 31.569 0.241 9.029 800 HG3 LYS 109 HG3 LYS 109 29.879 0.056 8.554 801 HD2 LYS 109 HD2 LYS 109 30.655 0.218 6.456 802 HD3 LYS 109 HD3 LYS 109 30.763 1.948 6.790 803 HE2 LYS 109 HE2 LYS 109 33.013 1.918 6.876 804 HE3 LYS 109 HE3 LYS 109 33.061 0.360 7.700 805 HZ1 LYS 109 HZ1 LYS 109 32.330 -0.535 5.401 806 HZ2 LYS 109 HZ2 LYS 109 33.954 -0.140 5.659 807 HZ3 LYS 109 HZ3 LYS 109 32.948 0.928 4.816 808 H ARG 110 H ARG 110 32.781 2.915 10.145 809 HA ARG 110 HA ARG 110 32.355 5.463 11.461 810 HB2 ARG 110 HB2 ARG 110 33.415 3.605 13.052 811 HB3 ARG 110 HB3 ARG 110 34.887 4.098 12.226 812 HG2 ARG 110 HG2 ARG 110 33.897 6.509 12.868 813 HG3 ARG 110 HG3 ARG 110 33.239 5.545 14.191 814 HD2 ARG 110 HD2 ARG 110 35.767 4.630 14.161 815 HD3 ARG 110 HD3 ARG 110 36.033 6.269 13.569 816 HE ARG 110 HE ARG 110 35.252 5.486 16.228 817 HH11 ARG 110 HH11 ARG 110 35.308 8.057 13.882 818 HH12 ARG 110 HH12 ARG 110 35.200 9.317 15.067 819 HH21 ARG 110 HH21 ARG 110 35.110 7.135 17.798 820 HH22 ARG 110 HH22 ARG 110 35.088 8.791 17.294 821 H ALA 111 H ALA 111 34.042 7.027 10.960 822 HA ALA 111 HA ALA 111 35.294 6.431 8.370 823 HB1 ALA 111 HB1 ALA 111 33.627 8.408 8.831 824 HB2 ALA 111 HB2 ALA 111 35.083 9.207 9.426 825 HB3 ALA 111 HB3 ALA 111 35.015 8.622 7.763 826 H VAL 112 H VAL 112 37.216 8.288 8.164 827 HA VAL 112 HA VAL 112 38.923 8.207 10.517 828 HB VAL 112 HB VAL 112 40.816 7.202 9.361 829 HG11 VAL 112 HG11 VAL 112 38.363 5.456 9.173 830 HG12 VAL 112 HG12 VAL 112 40.034 4.902 9.287 831 HG13 VAL 112 HG13 VAL 112 39.294 5.759 10.639 832 HG21 VAL 112 HG21 VAL 112 40.498 7.757 7.101 833 HG22 VAL 112 HG22 VAL 112 40.323 6.004 7.165 834 HG23 VAL 112 HG23 VAL 112 38.892 7.029 7.059 835 H GLN 113 H GLN 113 41.239 9.108 9.653 836 HA GLN 113 HA GLN 113 40.661 11.439 7.953 837 HB2 GLN 113 HB2 GLN 113 41.285 11.451 10.729 838 HB3 GLN 113 HB3 GLN 113 42.664 12.121 9.867 839 HG2 GLN 113 HG2 GLN 113 40.065 13.140 8.982 840 HG3 GLN 113 HG3 GLN 113 40.484 13.528 10.650 841 HE21 GLN 113 HE21 GLN 113 41.331 15.468 10.787 842 HE22 GLN 113 HE22 GLN 113 42.436 16.184 9.670 843 H LYS 114 H LYS 114 43.047 12.610 7.751 844 HA LYS 114 HA LYS 114 44.440 11.080 5.898 845 HB2 LYS 114 HB2 LYS 114 44.598 13.530 6.045 846 HB3 LYS 114 HB3 LYS 114 45.480 13.384 7.559 847 HG2 LYS 114 HG2 LYS 114 47.298 12.242 6.396 848 HG3 LYS 114 HG3 LYS 114 46.412 12.381 4.876 849 HD2 LYS 114 HD2 LYS 114 46.452 14.854 5.151 850 HD3 LYS 114 HD3 LYS 114 47.472 14.638 6.575 851 HE2 LYS 114 HE2 LYS 114 48.960 15.092 4.814 852 HE3 LYS 114 HE3 LYS 114 49.051 13.349 5.056 853 HZ1 LYS 114 HZ1 LYS 114 47.049 14.142 3.151 854 HZ2 LYS 114 HZ2 LYS 114 48.251 12.960 3.025 855 HZ3 LYS 114 HZ3 LYS 114 48.617 14.577 2.687 Start of MODEL 18 1 H1 MET 1 H MET 1 23.795 -33.450 12.801 2 HA MET 1 HA MET 1 21.917 -31.893 14.325 3 HB2 MET 1 HB2 MET 1 24.588 -30.957 14.115 4 HB3 MET 1 HB3 MET 1 23.597 -29.942 13.076 5 HG2 MET 1 HG2 MET 1 22.060 -29.604 15.018 6 HG3 MET 1 HG3 MET 1 23.243 -30.444 16.018 7 HE1 MET 1 HE1 MET 1 24.945 -27.682 17.471 8 HE2 MET 1 HE2 MET 1 24.263 -29.309 17.501 9 HE3 MET 1 HE3 MET 1 25.821 -29.019 16.725 10 H ALA 2 H ALA 2 20.367 -30.996 13.047 11 HA ALA 2 HA ALA 2 20.180 -31.862 10.354 12 HB1 ALA 2 HB1 ALA 2 18.351 -29.740 10.824 13 HB2 ALA 2 HB2 ALA 2 18.034 -31.474 10.751 14 HB3 ALA 2 HB3 ALA 2 18.453 -30.718 12.288 15 H GLY 3 H GLY 3 19.633 -30.287 8.547 16 HA2 GLY 3 HA2 GLY 3 20.047 -27.821 7.989 17 HA3 GLY 3 HA3 GLY 3 21.676 -28.162 8.552 18 H SER 4 H SER 4 19.702 -27.996 5.877 19 HA SER 4 HA SER 4 21.741 -28.772 4.088 20 HB2 SER 4 HB2 SER 4 19.698 -30.822 4.798 21 HB3 SER 4 HB3 SER 4 20.165 -30.688 3.103 22 HG SER 4 HG SER 4 21.883 -31.760 3.619 23 H HIS 5 H HIS 5 21.435 -27.433 2.449 24 HA HIS 5 HA HIS 5 18.906 -27.247 1.102 25 HB2 HIS 5 HB2 HIS 5 18.691 -24.781 1.376 26 HB3 HIS 5 HB3 HIS 5 18.442 -25.670 2.875 27 HD1 HIS 5 HD1 HIS 5 20.617 -25.707 4.513 28 HD2 HIS 5 HD2 HIS 5 20.546 -22.804 1.542 29 HE1 HIS 5 HE1 HIS 5 22.303 -23.981 5.220 30 H HIS 6 H HIS 6 19.162 -26.683 -0.998 31 HA HIS 6 HA HIS 6 21.415 -25.155 -1.914 32 HB2 HIS 6 HB2 HIS 6 22.264 -26.976 -3.422 33 HB3 HIS 6 HB3 HIS 6 22.574 -27.244 -1.709 34 HD1 HIS 6 HD1 HIS 6 22.719 -29.790 -1.966 35 HD2 HIS 6 HD2 HIS 6 19.095 -28.189 -3.215 36 HE1 HIS 6 HE1 HIS 6 21.184 -31.758 -2.272 37 H HIS 7 H HIS 7 21.464 -25.542 -4.519 38 HA HIS 7 HA HIS 7 18.696 -25.024 -5.350 39 HB2 HIS 7 HB2 HIS 7 21.245 -23.815 -5.987 40 HB3 HIS 7 HB3 HIS 7 20.422 -24.341 -7.452 41 HD1 HIS 7 HD1 HIS 7 17.520 -23.692 -6.700 42 HD2 HIS 7 HD2 HIS 7 20.727 -21.146 -5.997 43 HE1 HIS 7 HE1 HIS 7 16.525 -21.389 -6.532 44 H HIS 8 H HIS 8 17.944 -25.858 -7.384 45 HA HIS 8 HA HIS 8 19.428 -28.146 -8.451 46 HB2 HIS 8 HB2 HIS 8 17.224 -29.425 -8.506 47 HB3 HIS 8 HB3 HIS 8 17.988 -29.249 -6.929 48 HD1 HIS 8 HD1 HIS 8 14.880 -28.579 -8.739 49 HD2 HIS 8 HD2 HIS 8 16.712 -27.252 -5.254 50 HE1 HIS 8 HE1 HIS 8 13.067 -27.445 -7.416 51 H HIS 9 H HIS 9 19.749 -26.453 -10.114 52 HA HIS 9 HA HIS 9 17.432 -25.788 -11.733 53 HB2 HIS 9 HB2 HIS 9 19.399 -24.214 -11.222 54 HB3 HIS 9 HB3 HIS 9 20.298 -25.154 -12.410 55 HD1 HIS 9 HD1 HIS 9 20.480 -23.370 -14.189 56 HD2 HIS 9 HD2 HIS 9 16.566 -24.054 -12.976 57 HE1 HIS 9 HE1 HIS 9 19.040 -22.104 -15.817 58 H HIS 10 H HIS 10 20.330 -27.785 -11.923 59 HA HIS 10 HA HIS 10 19.091 -29.400 -13.980 60 HB2 HIS 10 HB2 HIS 10 20.842 -27.353 -14.755 61 HB3 HIS 10 HB3 HIS 10 21.796 -28.831 -14.838 62 HD1 HIS 10 HD1 HIS 10 20.578 -30.821 -16.290 63 HD2 HIS 10 HD2 HIS 10 19.308 -26.919 -16.944 64 HE1 HIS 10 HE1 HIS 10 19.396 -30.861 -18.509 65 H GLY 11 H GLY 11 19.561 -31.483 -13.653 66 HA2 GLY 11 HA2 GLY 11 22.135 -32.344 -12.700 67 HA3 GLY 11 HA3 GLY 11 20.875 -32.484 -11.483 68 H SER 12 H SER 12 19.184 -33.968 -11.785 69 HA SER 12 HA SER 12 19.462 -35.818 -14.046 70 HB2 SER 12 HB2 SER 12 20.688 -36.884 -12.255 71 HB3 SER 12 HB3 SER 12 19.361 -36.610 -11.126 72 HG SER 12 HG SER 12 19.669 -38.552 -13.057 73 H MET 13 H MET 13 17.568 -37.164 -14.396 74 HA MET 13 HA MET 13 15.178 -35.738 -14.355 75 HB2 MET 13 HB2 MET 13 15.982 -38.513 -14.979 76 HB3 MET 13 HB3 MET 13 14.284 -38.285 -14.584 77 HG2 MET 13 HG2 MET 13 14.675 -38.159 -16.982 78 HG3 MET 13 HG3 MET 13 14.069 -36.633 -16.342 79 HE1 MET 13 HE1 MET 13 14.601 -35.627 -18.494 80 HE2 MET 13 HE2 MET 13 16.189 -35.041 -18.988 81 HE3 MET 13 HE3 MET 13 15.706 -36.697 -19.358 82 H SER 14 H SER 14 16.371 -38.238 -12.154 83 HA SER 14 HA SER 14 15.638 -38.976 -10.127 84 HB2 SER 14 HB2 SER 14 15.224 -37.315 -8.536 85 HB3 SER 14 HB3 SER 14 16.120 -36.440 -9.779 86 HG SER 14 HG SER 14 13.487 -36.196 -8.988 87 H GLU 15 H GLU 15 13.465 -38.578 -8.573 88 HA GLU 15 HA GLU 15 11.144 -39.049 -10.315 89 HB2 GLU 15 HB2 GLU 15 12.096 -40.759 -8.022 90 HB3 GLU 15 HB3 GLU 15 10.444 -40.822 -8.619 91 HG2 GLU 15 HG2 GLU 15 12.833 -41.278 -10.380 92 HG3 GLU 15 HG3 GLU 15 12.017 -42.573 -9.506 93 H TYR 16 H TYR 16 9.150 -39.366 -8.623 94 HA TYR 16 HA TYR 16 9.302 -37.144 -6.701 95 HB2 TYR 16 HB2 TYR 16 6.860 -36.685 -7.411 96 HB3 TYR 16 HB3 TYR 16 8.152 -36.124 -8.465 97 HD1 TYR 16 HD1 TYR 16 8.021 -36.599 -10.725 98 HD2 TYR 16 HD2 TYR 16 5.928 -39.086 -7.980 99 HE1 TYR 16 HE1 TYR 16 7.025 -37.828 -12.608 100 HE2 TYR 16 HE2 TYR 16 4.928 -40.324 -9.855 101 HH TYR 16 HH TYR 16 5.157 -39.229 -13.109 102 H ILE 17 H ILE 17 7.021 -37.164 -5.456 103 HA ILE 17 HA ILE 17 6.590 -39.946 -4.580 104 HB ILE 17 HB ILE 17 7.743 -38.848 -2.815 105 HG12 ILE 17 HG12 ILE 17 4.790 -38.769 -2.160 106 HG13 ILE 17 HG13 ILE 17 5.784 -40.222 -2.162 107 HG21 ILE 17 HG21 ILE 17 7.736 -36.626 -2.754 108 HG22 ILE 17 HG22 ILE 17 6.268 -36.543 -3.725 109 HG23 ILE 17 HG23 ILE 17 6.157 -36.720 -1.974 110 HD11 ILE 17 HD11 ILE 17 7.233 -38.820 -0.474 111 HD12 ILE 17 HD12 ILE 17 5.703 -37.978 -0.226 112 HD13 ILE 17 HD13 ILE 17 5.809 -39.716 0.053 113 H ARG 18 H ARG 18 4.589 -40.671 -4.828 114 HA ARG 18 HA ARG 18 2.404 -38.708 -5.056 115 HB2 ARG 18 HB2 ARG 18 3.069 -41.150 -6.583 116 HB3 ARG 18 HB3 ARG 18 1.367 -40.938 -6.191 117 HG2 ARG 18 HG2 ARG 18 1.972 -38.470 -7.104 118 HG3 ARG 18 HG3 ARG 18 3.077 -39.457 -8.063 119 HD2 ARG 18 HD2 ARG 18 0.546 -40.749 -8.007 120 HD3 ARG 18 HD3 ARG 18 0.290 -39.055 -8.423 121 HE ARG 18 HE ARG 18 2.408 -40.335 -9.899 122 HH11 ARG 18 HH11 ARG 18 -0.998 -39.630 -9.766 123 HH12 ARG 18 HH12 ARG 18 -1.234 -39.805 -11.474 124 HH21 ARG 18 HH21 ARG 18 2.111 -40.567 -12.149 125 HH22 ARG 18 HH22 ARG 18 0.535 -40.339 -12.828 126 H VAL 19 H VAL 19 1.436 -38.629 -3.119 127 HA VAL 19 HA VAL 19 0.240 -41.073 -2.088 128 HB VAL 19 HB VAL 19 0.964 -40.415 0.270 129 HG11 VAL 19 HG11 VAL 19 2.982 -41.475 -1.703 130 HG12 VAL 19 HG12 VAL 19 3.127 -41.608 0.051 131 HG13 VAL 19 HG13 VAL 19 1.798 -42.409 -0.789 132 HG21 VAL 19 HG21 VAL 19 1.820 -38.209 -0.178 133 HG22 VAL 19 HG22 VAL 19 3.140 -39.229 0.395 134 HG23 VAL 19 HG23 VAL 19 2.996 -38.856 -1.322 135 H THR 20 H THR 20 -1.529 -40.708 -0.682 136 HA THR 20 HA THR 20 -2.509 -37.927 -0.673 137 HB THR 20 HB THR 20 -3.989 -38.938 -2.142 138 HG1 THR 20 HG1 THR 20 -5.899 -39.016 -1.015 139 HG21 THR 20 HG21 THR 20 -4.993 -41.287 -1.238 140 HG22 THR 20 HG22 THR 20 -3.342 -41.379 -0.626 141 HG23 THR 20 HG23 THR 20 -3.632 -41.158 -2.351 142 H GLU 21 H GLU 21 -3.756 -37.260 1.122 143 HA GLU 21 HA GLU 21 -2.927 -38.443 3.601 144 HB2 GLU 21 HB2 GLU 21 -3.289 -35.947 3.096 145 HB3 GLU 21 HB3 GLU 21 -5.001 -36.283 3.310 146 HG2 GLU 21 HG2 GLU 21 -3.604 -37.393 5.515 147 HG3 GLU 21 HG3 GLU 21 -3.045 -35.738 5.279 148 H ASP 22 H ASP 22 -6.063 -37.961 1.990 149 HA ASP 22 HA ASP 22 -7.263 -39.885 3.856 150 HB2 ASP 22 HB2 ASP 22 -8.312 -37.596 2.273 151 HB3 ASP 22 HB3 ASP 22 -9.393 -38.964 2.520 152 H GLU 23 H GLU 23 -8.426 -41.668 3.118 153 HA GLU 23 HA GLU 23 -7.411 -42.941 0.819 154 HB2 GLU 23 HB2 GLU 23 -9.137 -44.658 1.260 155 HB3 GLU 23 HB3 GLU 23 -8.220 -44.234 2.698 156 HG2 GLU 23 HG2 GLU 23 -10.093 -42.702 3.333 157 HG3 GLU 23 HG3 GLU 23 -11.015 -43.385 1.995 158 H ASN 24 H ASN 24 -10.317 -41.064 1.403 159 HA ASN 24 HA ASN 24 -11.559 -41.716 -1.090 160 HB2 ASN 24 HB2 ASN 24 -12.087 -39.726 1.089 161 HB3 ASN 24 HB3 ASN 24 -12.921 -39.568 -0.454 162 HD21 ASN 24 HD21 ASN 24 -14.029 -40.136 2.152 163 HD22 ASN 24 HD22 ASN 24 -14.835 -41.659 2.023 164 H ASP 25 H ASP 25 -9.281 -39.333 0.000 165 HA ASP 25 HA ASP 25 -9.610 -37.563 -2.232 166 HB2 ASP 25 HB2 ASP 25 -8.060 -37.634 0.215 167 HB3 ASP 25 HB3 ASP 25 -7.067 -37.127 -1.149 168 H GLU 26 H GLU 26 -8.176 -37.250 -3.969 169 HA GLU 26 HA GLU 26 -7.088 -39.669 -5.036 170 HB2 GLU 26 HB2 GLU 26 -7.376 -36.855 -5.979 171 HB3 GLU 26 HB3 GLU 26 -6.204 -37.883 -6.790 172 HG2 GLU 26 HG2 GLU 26 -8.430 -37.824 -7.876 173 HG3 GLU 26 HG3 GLU 26 -7.892 -39.440 -7.421 174 HA PRO 27 HA PRO 27 -2.910 -39.418 -3.712 175 HB2 PRO 27 HB2 PRO 27 -1.627 -40.513 -5.839 176 HB3 PRO 27 HB3 PRO 27 -2.601 -41.463 -4.711 177 HG2 PRO 27 HG2 PRO 27 -3.330 -40.401 -7.413 178 HG3 PRO 27 HG3 PRO 27 -3.662 -41.995 -6.710 179 HD2 PRO 27 HD2 PRO 27 -5.523 -40.030 -6.810 180 HD3 PRO 27 HD3 PRO 27 -5.464 -41.224 -5.497 181 H ILE 28 H ILE 28 -2.225 -37.332 -3.563 182 HA ILE 28 HA ILE 28 -1.784 -35.703 -5.897 183 HB ILE 28 HB ILE 28 -2.554 -34.665 -3.826 184 HG12 ILE 28 HG12 ILE 28 -0.888 -32.827 -3.713 185 HG13 ILE 28 HG13 ILE 28 0.238 -33.820 -4.631 186 HG21 ILE 28 HG21 ILE 28 0.061 -35.663 -2.720 187 HG22 ILE 28 HG22 ILE 28 -0.909 -34.414 -1.941 188 HG23 ILE 28 HG23 ILE 28 -1.568 -36.035 -2.156 189 HD11 ILE 28 HD11 ILE 28 -1.519 -32.001 -5.672 190 HD12 ILE 28 HD12 ILE 28 -0.724 -33.297 -6.566 191 HD13 ILE 28 HD13 ILE 28 -2.350 -33.536 -5.926 192 H GLU 29 H GLU 29 0.150 -35.077 -6.783 193 HA GLU 29 HA GLU 29 2.478 -36.684 -5.991 194 HB2 GLU 29 HB2 GLU 29 3.328 -36.333 -8.226 195 HB3 GLU 29 HB3 GLU 29 1.675 -36.923 -8.323 196 HG2 GLU 29 HG2 GLU 29 0.961 -34.520 -8.587 197 HG3 GLU 29 HG3 GLU 29 2.668 -34.128 -8.784 198 H ILE 30 H ILE 30 4.320 -35.759 -5.297 199 HA ILE 30 HA ILE 30 4.527 -32.824 -5.435 200 HB ILE 30 HB ILE 30 5.934 -33.656 -3.146 201 HG12 ILE 30 HG12 ILE 30 3.096 -34.698 -3.099 202 HG13 ILE 30 HG13 ILE 30 4.515 -35.724 -3.282 203 HG21 ILE 30 HG21 ILE 30 3.594 -31.973 -3.803 204 HG22 ILE 30 HG22 ILE 30 3.798 -32.427 -2.112 205 HG23 ILE 30 HG23 ILE 30 5.085 -31.564 -2.954 206 HD11 ILE 30 HD11 ILE 30 3.868 -35.812 -1.010 207 HD12 ILE 30 HD12 ILE 30 5.323 -34.817 -1.089 208 HD13 ILE 30 HD13 ILE 30 3.742 -34.056 -0.908 209 HA PRO 31 HA PRO 31 8.543 -33.461 -7.107 210 HB2 PRO 31 HB2 PRO 31 9.734 -31.140 -6.356 211 HB3 PRO 31 HB3 PRO 31 8.522 -31.227 -7.640 212 HG2 PRO 31 HG2 PRO 31 8.195 -30.414 -4.777 213 HG3 PRO 31 HG3 PRO 31 7.516 -29.669 -6.236 214 HD2 PRO 31 HD2 PRO 31 6.078 -31.313 -4.636 215 HD3 PRO 31 HD3 PRO 31 5.818 -31.219 -6.390 216 H SER 32 H SER 32 9.909 -34.901 -6.260 217 HA SER 32 HA SER 32 10.771 -34.621 -3.479 218 HB2 SER 32 HB2 SER 32 11.064 -36.885 -3.434 219 HB3 SER 32 HB3 SER 32 9.932 -36.823 -4.785 220 HG SER 32 HG SER 32 12.128 -37.980 -4.945 221 H GLU 33 H GLU 33 13.168 -35.723 -3.332 222 HA GLU 33 HA GLU 33 14.860 -33.786 -4.690 223 HB2 GLU 33 HB2 GLU 33 14.928 -35.178 -2.184 224 HB3 GLU 33 HB3 GLU 33 16.413 -35.507 -3.065 225 HG2 GLU 33 HG2 GLU 33 15.419 -32.705 -2.806 226 HG3 GLU 33 HG3 GLU 33 16.280 -33.470 -1.472 227 H ASP 34 H ASP 34 17.092 -34.639 -5.370 228 HA ASP 34 HA ASP 34 16.709 -36.478 -7.494 229 HB2 ASP 34 HB2 ASP 34 19.004 -34.942 -6.383 230 HB3 ASP 34 HB3 ASP 34 19.374 -36.327 -7.407 231 H ASP 35 H ASP 35 18.170 -36.729 -4.296 232 HA ASP 35 HA ASP 35 19.302 -39.288 -4.602 233 HB2 ASP 35 HB2 ASP 35 18.444 -37.662 -2.227 234 HB3 ASP 35 HB3 ASP 35 19.005 -39.319 -2.018 235 H GLY 36 H GLY 36 16.050 -38.261 -4.241 236 HA2 GLY 36 HA2 GLY 36 14.380 -39.961 -4.880 237 HA3 GLY 36 HA3 GLY 36 15.233 -41.069 -3.815 238 H THR 37 H THR 37 15.629 -39.000 -1.759 239 HA THR 37 HA THR 37 13.269 -39.472 -0.264 240 HB THR 37 HB THR 37 14.250 -38.114 1.470 241 HG1 THR 37 HG1 THR 37 15.789 -37.112 -0.668 242 HG21 THR 37 HG21 THR 37 15.962 -39.521 1.951 243 HG22 THR 37 HG22 THR 37 16.739 -39.283 0.386 244 HG23 THR 37 HG23 THR 37 15.365 -40.379 0.531 245 H VAL 38 H VAL 38 12.606 -37.202 1.038 246 HA VAL 38 HA VAL 38 11.820 -35.247 -1.003 247 HB VAL 38 HB VAL 38 9.926 -36.624 0.902 248 HG11 VAL 38 HG11 VAL 38 8.202 -35.102 -0.057 249 HG12 VAL 38 HG12 VAL 38 9.399 -34.285 0.951 250 HG13 VAL 38 HG13 VAL 38 9.503 -34.177 -0.807 251 HG21 VAL 38 HG21 VAL 38 9.618 -36.326 -2.066 252 HG22 VAL 38 HG22 VAL 38 10.566 -37.642 -1.373 253 HG23 VAL 38 HG23 VAL 38 8.853 -37.488 -0.982 254 H LEU 39 H LEU 39 11.911 -33.183 -0.329 255 HA LEU 39 HA LEU 39 13.081 -32.582 2.191 256 HB2 LEU 39 HB2 LEU 39 11.849 -30.806 0.092 257 HB3 LEU 39 HB3 LEU 39 12.712 -30.214 1.509 258 HG LEU 39 HG LEU 39 13.951 -31.953 -0.621 259 HD11 LEU 39 HD11 LEU 39 13.148 -29.614 -1.319 260 HD12 LEU 39 HD12 LEU 39 14.822 -30.059 -1.653 261 HD13 LEU 39 HD13 LEU 39 14.444 -29.017 -0.281 262 HD21 LEU 39 HD21 LEU 39 14.807 -30.972 1.974 263 HD22 LEU 39 HD22 LEU 39 15.902 -30.490 0.678 264 HD23 LEU 39 HD23 LEU 39 15.532 -32.196 0.931 265 H LEU 40 H LEU 40 12.181 -31.993 4.073 266 HA LEU 40 HA LEU 40 9.569 -32.526 4.734 267 HB2 LEU 40 HB2 LEU 40 11.729 -31.816 6.133 268 HB3 LEU 40 HB3 LEU 40 10.864 -30.281 6.168 269 HG LEU 40 HG LEU 40 9.871 -32.928 7.222 270 HD11 LEU 40 HD11 LEU 40 10.051 -30.618 9.001 271 HD12 LEU 40 HD12 LEU 40 11.609 -31.174 8.391 272 HD13 LEU 40 HD13 LEU 40 10.551 -32.291 9.254 273 HD21 LEU 40 HD21 LEU 40 7.913 -31.934 6.539 274 HD22 LEU 40 HD22 LEU 40 8.530 -30.299 6.777 275 HD23 LEU 40 HD23 LEU 40 8.076 -31.282 8.170 276 H SER 41 H SER 41 10.961 -29.425 3.735 277 HA SER 41 HA SER 41 8.795 -27.763 4.134 278 HB2 SER 41 HB2 SER 41 11.275 -27.567 2.856 279 HB3 SER 41 HB3 SER 41 10.095 -27.157 1.611 280 HG SER 41 HG SER 41 10.309 -25.979 4.186 281 H THR 42 H THR 42 9.382 -30.051 1.537 282 HA THR 42 HA THR 42 7.225 -29.189 -0.115 283 HB THR 42 HB THR 42 8.523 -31.917 -0.109 284 HG1 THR 42 HG1 THR 42 9.285 -29.604 -1.592 285 HG21 THR 42 HG21 THR 42 7.970 -31.513 -2.650 286 HG22 THR 42 HG22 THR 42 6.762 -30.411 -1.989 287 HG23 THR 42 HG23 THR 42 6.736 -32.117 -1.545 288 H VAL 43 H VAL 43 7.582 -31.575 2.442 289 HA VAL 43 HA VAL 43 5.140 -32.928 2.057 290 HB VAL 43 HB VAL 43 6.993 -32.624 4.391 291 HG11 VAL 43 HG11 VAL 43 4.205 -33.721 4.434 292 HG12 VAL 43 HG12 VAL 43 5.448 -34.356 5.515 293 HG13 VAL 43 HG13 VAL 43 5.000 -32.652 5.590 294 HG21 VAL 43 HG21 VAL 43 7.609 -34.190 2.651 295 HG22 VAL 43 HG22 VAL 43 7.168 -35.070 4.114 296 HG23 VAL 43 HG23 VAL 43 6.035 -34.978 2.765 297 H THR 44 H THR 44 5.997 -30.058 3.922 298 HA THR 44 HA THR 44 3.470 -29.784 5.203 299 HB THR 44 HB THR 44 4.212 -27.599 5.899 300 HG1 THR 44 HG1 THR 44 5.548 -26.463 4.714 301 HG21 THR 44 HG21 THR 44 6.856 -28.626 6.174 302 HG22 THR 44 HG22 THR 44 5.719 -29.970 6.289 303 HG23 THR 44 HG23 THR 44 5.561 -28.586 7.370 304 H ALA 45 H ALA 45 4.742 -28.832 2.115 305 HA ALA 45 HA ALA 45 3.145 -26.717 1.385 306 HB1 ALA 45 HB1 ALA 45 3.532 -27.322 -0.887 307 HB2 ALA 45 HB2 ALA 45 4.977 -27.756 0.028 308 HB3 ALA 45 HB3 ALA 45 3.828 -29.006 -0.450 309 H GLN 46 H GLN 46 2.367 -30.179 1.128 310 HA GLN 46 HA GLN 46 -0.424 -29.455 0.570 311 HB2 GLN 46 HB2 GLN 46 0.543 -32.269 0.388 312 HB3 GLN 46 HB3 GLN 46 -0.678 -31.441 -0.568 313 HG2 GLN 46 HG2 GLN 46 1.072 -30.213 -1.746 314 HG3 GLN 46 HG3 GLN 46 2.297 -31.041 -0.786 315 HE21 GLN 46 HE21 GLN 46 1.354 -33.600 -0.761 316 HE22 GLN 46 HE22 GLN 46 1.367 -34.246 -2.363 317 H PHE 47 H PHE 47 1.646 -31.245 2.765 318 HA PHE 47 HA PHE 47 -0.694 -31.755 4.481 319 HB2 PHE 47 HB2 PHE 47 1.883 -33.254 4.789 320 HB3 PHE 47 HB3 PHE 47 0.250 -33.749 5.220 321 HD1 PHE 47 HD1 PHE 47 -1.287 -33.438 2.834 322 HD2 PHE 47 HD2 PHE 47 2.745 -34.734 3.263 323 HE1 PHE 47 HE1 PHE 47 -1.467 -34.687 0.721 324 HE2 PHE 47 HE2 PHE 47 2.572 -35.984 1.151 325 HZ PHE 47 HZ PHE 47 0.465 -35.961 -0.123 326 HA PRO 48 HA PRO 48 1.910 -28.628 6.672 327 HB2 PRO 48 HB2 PRO 48 -0.203 -27.204 7.610 328 HB3 PRO 48 HB3 PRO 48 0.502 -26.937 6.011 329 HG2 PRO 48 HG2 PRO 48 -1.939 -28.496 6.769 330 HG3 PRO 48 HG3 PRO 48 -1.703 -27.376 5.414 331 HD2 PRO 48 HD2 PRO 48 -1.599 -30.065 5.116 332 HD3 PRO 48 HD3 PRO 48 -0.622 -28.957 4.132 333 H GLY 49 H GLY 49 2.615 -29.080 8.661 334 HA2 GLY 49 HA2 GLY 49 2.390 -29.402 10.983 335 HA3 GLY 49 HA3 GLY 49 0.713 -29.864 10.734 336 H ALA 50 H ALA 50 1.446 -31.744 8.571 337 HA ALA 50 HA ALA 50 1.551 -34.106 9.994 338 HB1 ALA 50 HB1 ALA 50 0.892 -33.934 7.632 339 HB2 ALA 50 HB2 ALA 50 2.580 -33.668 7.193 340 HB3 ALA 50 HB3 ALA 50 2.084 -35.206 7.901 341 H CYS 51 H CYS 51 3.075 -34.773 11.352 342 HA CYS 51 HA CYS 51 5.834 -33.958 11.016 343 HB2 CYS 51 HB2 CYS 51 4.491 -34.168 13.241 344 HB3 CYS 51 HB3 CYS 51 4.883 -35.879 13.118 345 HG CYS 51 HG CYS 51 6.749 -33.379 14.181 346 H GLY 52 H GLY 52 3.983 -36.989 11.053 347 HA2 GLY 52 HA2 GLY 52 6.208 -38.238 9.572 348 HA3 GLY 52 HA3 GLY 52 5.460 -39.068 10.929 349 H LEU 53 H LEU 53 5.662 -39.778 8.050 350 HA LEU 53 HA LEU 53 2.786 -39.964 7.440 351 HB2 LEU 53 HB2 LEU 53 5.000 -40.337 5.448 352 HB3 LEU 53 HB3 LEU 53 3.290 -40.039 5.142 353 HG LEU 53 HG LEU 53 4.253 -38.014 4.597 354 HD11 LEU 53 HD11 LEU 53 2.631 -38.094 6.787 355 HD12 LEU 53 HD12 LEU 53 3.122 -36.628 5.940 356 HD13 LEU 53 HD13 LEU 53 3.998 -37.149 7.379 357 HD21 LEU 53 HD21 LEU 53 6.491 -38.821 5.659 358 HD22 LEU 53 HD22 LEU 53 5.957 -37.872 7.047 359 HD23 LEU 53 HD23 LEU 53 6.176 -37.095 5.478 360 H ARG 54 H ARG 54 1.890 -41.936 6.998 361 HA ARG 54 HA ARG 54 3.601 -44.264 7.544 362 HB2 ARG 54 HB2 ARG 54 1.318 -43.554 8.806 363 HB3 ARG 54 HB3 ARG 54 0.660 -44.581 7.539 364 HG2 ARG 54 HG2 ARG 54 1.254 -46.404 8.642 365 HG3 ARG 54 HG3 ARG 54 2.929 -45.855 8.734 366 HD2 ARG 54 HD2 ARG 54 2.537 -45.839 10.950 367 HD3 ARG 54 HD3 ARG 54 1.790 -44.279 10.607 368 HE ARG 54 HE ARG 54 -0.253 -45.191 11.088 369 HH11 ARG 54 HH11 ARG 54 2.057 -47.751 10.612 370 HH12 ARG 54 HH12 ARG 54 0.977 -49.000 11.136 371 HH21 ARG 54 HH21 ARG 54 -1.685 -46.826 11.780 372 HH22 ARG 54 HH22 ARG 54 -1.152 -48.473 11.800 373 H TYR 55 H TYR 55 2.948 -46.301 6.412 374 HA TYR 55 HA TYR 55 2.403 -45.696 3.591 375 HB2 TYR 55 HB2 TYR 55 4.321 -47.362 4.909 376 HB3 TYR 55 HB3 TYR 55 3.293 -48.373 3.900 377 HD1 TYR 55 HD1 TYR 55 2.822 -47.220 1.482 378 HD2 TYR 55 HD2 TYR 55 6.250 -46.594 3.923 379 HE1 TYR 55 HE1 TYR 55 4.106 -46.548 -0.505 380 HE2 TYR 55 HE2 TYR 55 7.544 -45.919 1.943 381 HH TYR 55 HH TYR 55 6.888 -46.599 -1.001 382 H ARG 56 H ARG 56 0.605 -46.400 2.638 383 HA ARG 56 HA ARG 56 -0.941 -48.532 3.954 384 HB2 ARG 56 HB2 ARG 56 -2.207 -46.645 4.488 385 HB3 ARG 56 HB3 ARG 56 -1.860 -45.859 2.954 386 HG2 ARG 56 HG2 ARG 56 -4.197 -46.641 3.174 387 HG3 ARG 56 HG3 ARG 56 -3.346 -47.332 1.791 388 HD2 ARG 56 HD2 ARG 56 -2.873 -49.346 3.191 389 HD3 ARG 56 HD3 ARG 56 -3.912 -48.658 4.438 390 HE ARG 56 HE ARG 56 -5.147 -48.909 1.841 391 HH11 ARG 56 HH11 ARG 56 -4.519 -50.428 4.910 392 HH12 ARG 56 HH12 ARG 56 -5.863 -51.515 4.794 393 HH21 ARG 56 HH21 ARG 56 -6.920 -50.335 1.677 394 HH22 ARG 56 HH22 ARG 56 -7.227 -51.462 2.955 395 H ASN 57 H ASN 57 -0.472 -50.177 2.578 396 HA ASN 57 HA ASN 57 -1.135 -49.763 -0.264 397 HB2 ASN 57 HB2 ASN 57 1.304 -50.541 0.752 398 HB3 ASN 57 HB3 ASN 57 0.556 -52.081 0.338 399 HD21 ASN 57 HD21 ASN 57 2.026 -52.434 -1.322 400 HD22 ASN 57 HD22 ASN 57 1.949 -51.569 -2.816 401 HA PRO 58 HA PRO 58 -4.330 -52.746 0.319 402 HB2 PRO 58 HB2 PRO 58 -4.747 -53.384 -2.287 403 HB3 PRO 58 HB3 PRO 58 -5.285 -51.859 -1.574 404 HG2 PRO 58 HG2 PRO 58 -2.852 -52.425 -3.224 405 HG3 PRO 58 HG3 PRO 58 -3.971 -51.052 -3.314 406 HD2 PRO 58 HD2 PRO 58 -1.568 -50.894 -2.076 407 HD3 PRO 58 HD3 PRO 58 -2.983 -49.969 -1.535 408 H VAL 59 H VAL 59 -1.500 -53.505 -1.647 409 HA VAL 59 HA VAL 59 -1.983 -56.351 -1.557 410 HB VAL 59 HB VAL 59 0.183 -56.560 -2.693 411 HG11 VAL 59 HG11 VAL 59 -2.074 -55.786 -3.799 412 HG12 VAL 59 HG12 VAL 59 -1.159 -54.309 -4.107 413 HG13 VAL 59 HG13 VAL 59 -0.581 -55.854 -4.734 414 HG21 VAL 59 HG21 VAL 59 0.960 -54.051 -3.422 415 HG22 VAL 59 HG22 VAL 59 0.475 -53.802 -1.745 416 HG23 VAL 59 HG23 VAL 59 1.704 -55.004 -2.138 417 H SER 60 H SER 60 -0.073 -53.995 0.180 418 HA SER 60 HA SER 60 1.449 -56.009 1.597 419 HB2 SER 60 HB2 SER 60 2.406 -53.773 0.989 420 HB3 SER 60 HB3 SER 60 1.296 -53.036 2.144 421 HG SER 60 HG SER 60 3.431 -54.820 2.649 422 H GLN 61 H GLN 61 -1.401 -54.071 2.087 423 HA GLN 61 HA GLN 61 -3.003 -54.077 3.702 424 HB2 GLN 61 HB2 GLN 61 -1.693 -56.584 4.753 425 HB3 GLN 61 HB3 GLN 61 -3.361 -56.074 4.978 426 HG2 GLN 61 HG2 GLN 61 -3.850 -56.444 2.663 427 HG3 GLN 61 HG3 GLN 61 -2.154 -56.770 2.313 428 HE21 GLN 61 HE21 GLN 61 -5.124 -58.043 3.422 429 HE22 GLN 61 HE22 GLN 61 -4.593 -59.665 3.687 430 H CYS 62 H CYS 62 -0.843 -52.455 4.168 431 HA CYS 62 HA CYS 62 0.081 -51.179 5.809 432 HB2 CYS 62 HB2 CYS 62 -2.295 -52.185 6.931 433 HB3 CYS 62 HB3 CYS 62 -1.058 -52.401 8.162 434 HG CYS 62 HG CYS 62 -0.507 -49.820 8.580 435 H MET 63 H MET 63 2.154 -51.455 6.265 436 HA MET 63 HA MET 63 3.112 -53.196 8.245 437 HB2 MET 63 HB2 MET 63 2.650 -54.538 5.858 438 HB3 MET 63 HB3 MET 63 4.375 -54.201 5.821 439 HG2 MET 63 HG2 MET 63 2.964 -55.534 8.117 440 HG3 MET 63 HG3 MET 63 3.773 -56.396 6.810 441 HE1 MET 63 HE1 MET 63 3.951 -56.225 10.008 442 HE2 MET 63 HE2 MET 63 5.593 -55.918 10.574 443 HE3 MET 63 HE3 MET 63 4.470 -54.576 10.355 444 H ARG 64 H ARG 64 3.797 -51.378 5.315 445 HA ARG 64 HA ARG 64 6.534 -50.855 6.128 446 HB2 ARG 64 HB2 ARG 64 5.157 -50.885 3.676 447 HB3 ARG 64 HB3 ARG 64 5.622 -49.210 3.942 448 HG2 ARG 64 HG2 ARG 64 7.917 -50.540 4.582 449 HG3 ARG 64 HG3 ARG 64 7.259 -51.534 3.280 450 HD2 ARG 64 HD2 ARG 64 6.933 -48.859 2.479 451 HD3 ARG 64 HD3 ARG 64 8.563 -48.982 3.141 452 HE ARG 64 HE ARG 64 9.160 -50.277 1.347 453 HH11 ARG 64 HH11 ARG 64 5.689 -50.058 1.504 454 HH12 ARG 64 HH12 ARG 64 5.441 -50.819 -0.033 455 HH21 ARG 64 HH21 ARG 64 8.847 -51.280 -0.678 456 HH22 ARG 64 HH22 ARG 64 7.238 -51.514 -1.272 457 H GLY 65 H GLY 65 7.056 -48.318 5.521 458 HA2 GLY 65 HA2 GLY 65 5.207 -46.380 6.398 459 HA3 GLY 65 HA3 GLY 65 6.202 -46.873 7.760 460 H VAL 66 H VAL 66 5.902 -44.517 5.604 461 HA VAL 66 HA VAL 66 8.350 -44.136 4.367 462 HB VAL 66 HB VAL 66 6.537 -42.027 5.550 463 HG11 VAL 66 HG11 VAL 66 8.774 -41.151 5.123 464 HG12 VAL 66 HG12 VAL 66 8.709 -41.768 3.472 465 HG13 VAL 66 HG13 VAL 66 7.607 -40.488 3.979 466 HG21 VAL 66 HG21 VAL 66 6.200 -41.973 2.843 467 HG22 VAL 66 HG22 VAL 66 6.412 -43.697 3.146 468 HG23 VAL 66 HG23 VAL 66 5.137 -42.806 3.978 469 H ARG 67 H ARG 67 10.332 -43.496 4.993 470 HA ARG 67 HA ARG 67 10.854 -43.315 7.843 471 HB2 ARG 67 HB2 ARG 67 12.359 -44.710 6.627 472 HB3 ARG 67 HB3 ARG 67 12.645 -43.461 5.422 473 HG2 ARG 67 HG2 ARG 67 14.554 -43.645 6.872 474 HG3 ARG 67 HG3 ARG 67 13.758 -42.093 7.140 475 HD2 ARG 67 HD2 ARG 67 12.516 -43.300 9.043 476 HD3 ARG 67 HD3 ARG 67 13.765 -44.534 8.883 477 HE ARG 67 HE ARG 67 14.061 -41.892 9.997 478 HH11 ARG 67 HH11 ARG 67 15.685 -44.627 8.581 479 HH12 ARG 67 HH12 ARG 67 17.219 -44.250 9.294 480 HH21 ARG 67 HH21 ARG 67 16.075 -41.386 10.940 481 HH22 ARG 67 HH22 ARG 67 17.439 -42.407 10.636 482 H LEU 68 H LEU 68 11.668 -41.550 8.909 483 HA LEU 68 HA LEU 68 11.892 -39.051 7.368 484 HB2 LEU 68 HB2 LEU 68 9.782 -39.006 8.514 485 HB3 LEU 68 HB3 LEU 68 10.547 -39.482 10.029 486 HG LEU 68 HG LEU 68 9.833 -37.013 9.657 487 HD11 LEU 68 HD11 LEU 68 11.458 -38.199 11.400 488 HD12 LEU 68 HD12 LEU 68 11.216 -36.453 11.363 489 HD13 LEU 68 HD13 LEU 68 12.637 -37.163 10.595 490 HD21 LEU 68 HD21 LEU 68 11.313 -37.143 7.448 491 HD22 LEU 68 HD22 LEU 68 12.568 -36.635 8.579 492 HD23 LEU 68 HD23 LEU 68 11.118 -35.652 8.370 493 H VAL 69 H VAL 69 13.866 -38.241 7.523 494 HA VAL 69 HA VAL 69 15.265 -38.366 10.098 495 HB VAL 69 HB VAL 69 16.254 -40.186 8.919 496 HG11 VAL 69 HG11 VAL 69 15.788 -38.514 6.612 497 HG12 VAL 69 HG12 VAL 69 17.436 -39.145 6.625 498 HG13 VAL 69 HG13 VAL 69 16.065 -40.253 6.703 499 HG21 VAL 69 HG21 VAL 69 17.697 -38.171 9.927 500 HG22 VAL 69 HG22 VAL 69 18.428 -39.620 9.235 501 HG23 VAL 69 HG23 VAL 69 18.300 -38.150 8.269 502 H GLU 70 H GLU 70 15.805 -36.376 10.676 503 HA GLU 70 HA GLU 70 16.427 -34.189 10.606 504 HB2 GLU 70 HB2 GLU 70 17.559 -34.784 7.872 505 HB3 GLU 70 HB3 GLU 70 18.046 -33.507 8.977 506 HG2 GLU 70 HG2 GLU 70 18.410 -35.794 10.463 507 HG3 GLU 70 HG3 GLU 70 18.894 -36.280 8.839 508 H GLY 71 H GLY 71 13.850 -35.090 9.460 509 HA2 GLY 71 HA2 GLY 71 12.044 -33.765 8.767 510 HA3 GLY 71 HA3 GLY 71 13.181 -32.577 8.148 511 H ILE 72 H ILE 72 14.681 -34.734 6.718 512 HA ILE 72 HA ILE 72 13.140 -34.625 4.285 513 HB ILE 72 HB ILE 72 15.806 -35.932 4.838 514 HG12 ILE 72 HG12 ILE 72 15.978 -33.662 3.126 515 HG13 ILE 72 HG13 ILE 72 15.050 -33.195 4.546 516 HG21 ILE 72 HG21 ILE 72 15.377 -36.968 2.894 517 HG22 ILE 72 HG22 ILE 72 14.071 -35.859 2.478 518 HG23 ILE 72 HG23 ILE 72 15.747 -35.402 2.172 519 HD11 ILE 72 HD11 ILE 72 17.131 -32.735 5.304 520 HD12 ILE 72 HD12 ILE 72 17.044 -34.433 5.777 521 HD13 ILE 72 HD13 ILE 72 17.892 -33.970 4.302 522 H LEU 73 H LEU 73 11.577 -36.037 3.888 523 HA LEU 73 HA LEU 73 11.378 -38.554 5.218 524 HB2 LEU 73 HB2 LEU 73 9.838 -37.237 3.005 525 HB3 LEU 73 HB3 LEU 73 9.495 -38.890 3.511 526 HG LEU 73 HG LEU 73 7.922 -37.402 4.550 527 HD11 LEU 73 HD11 LEU 73 9.984 -38.289 6.561 528 HD12 LEU 73 HD12 LEU 73 8.721 -39.306 5.868 529 HD13 LEU 73 HD13 LEU 73 8.287 -37.935 6.889 530 HD21 LEU 73 HD21 LEU 73 9.587 -35.431 4.399 531 HD22 LEU 73 HD22 LEU 73 10.130 -35.978 5.985 532 HD23 LEU 73 HD23 LEU 73 8.452 -35.487 5.748 533 H HIS 74 H HIS 74 12.568 -40.267 4.731 534 HA HIS 74 HA HIS 74 13.798 -40.547 2.129 535 HB2 HIS 74 HB2 HIS 74 14.449 -41.372 4.717 536 HB3 HIS 74 HB3 HIS 74 14.062 -42.862 3.860 537 HD1 HIS 74 HD1 HIS 74 15.338 -42.834 1.307 538 HD2 HIS 74 HD2 HIS 74 17.067 -40.797 4.489 539 HE1 HIS 74 HE1 HIS 74 17.760 -42.559 0.692 540 H ALA 75 H ALA 75 13.545 -42.369 0.753 541 HA ALA 75 HA ALA 75 10.834 -43.478 0.843 542 HB1 ALA 75 HB1 ALA 75 11.530 -44.199 -1.560 543 HB2 ALA 75 HB2 ALA 75 11.114 -42.516 -1.234 544 HB3 ALA 75 HB3 ALA 75 12.806 -42.999 -1.349 545 HA PRO 76 HA PRO 76 12.147 -47.556 1.803 546 HB2 PRO 76 HB2 PRO 76 10.356 -49.032 0.395 547 HB3 PRO 76 HB3 PRO 76 9.924 -48.132 1.853 548 HG2 PRO 76 HG2 PRO 76 9.531 -47.387 -1.020 549 HG3 PRO 76 HG3 PRO 76 8.412 -47.211 0.345 550 HD2 PRO 76 HD2 PRO 76 9.877 -45.145 -0.612 551 HD3 PRO 76 HD3 PRO 76 9.437 -45.291 1.101 552 H ASP 77 H ASP 77 12.370 -49.810 0.538 553 HA ASP 77 HA ASP 77 14.430 -49.351 -1.414 554 HB2 ASP 77 HB2 ASP 77 13.661 -51.472 0.346 555 HB3 ASP 77 HB3 ASP 77 13.774 -52.111 -1.291 556 H ALA 78 H ALA 78 11.150 -49.437 -1.639 557 HA ALA 78 HA ALA 78 11.184 -50.608 -4.341 558 HB1 ALA 78 HB1 ALA 78 8.710 -50.075 -2.722 559 HB2 ALA 78 HB2 ALA 78 8.909 -51.143 -4.113 560 HB3 ALA 78 HB3 ALA 78 9.635 -51.569 -2.563 561 H GLY 79 H GLY 79 10.652 -47.726 -2.507 562 HA2 GLY 79 HA2 GLY 79 10.901 -45.618 -3.713 563 HA3 GLY 79 HA3 GLY 79 9.946 -46.324 -5.008 564 H TRP 80 H TRP 80 9.067 -43.983 -4.302 565 HA TRP 80 HA TRP 80 7.359 -43.836 -2.066 566 HB2 TRP 80 HB2 TRP 80 7.386 -42.305 -4.670 567 HB3 TRP 80 HB3 TRP 80 6.304 -41.921 -3.334 568 HD1 TRP 80 HD1 TRP 80 9.476 -40.847 -4.695 569 HE1 TRP 80 HE1 TRP 80 10.903 -39.622 -2.939 570 HE3 TRP 80 HE3 TRP 80 6.949 -42.245 -0.477 571 HZ2 TRP 80 HZ2 TRP 80 10.952 -39.292 -0.136 572 HZ3 TRP 80 HZ3 TRP 80 7.751 -41.432 1.702 573 HH2 TRP 80 HH2 TRP 80 9.711 -39.986 1.867 574 H GLY 81 H GLY 81 6.512 -44.240 -5.516 575 HA2 GLY 81 HA2 GLY 81 4.907 -45.671 -6.422 576 HA3 GLY 81 HA3 GLY 81 4.421 -46.118 -4.794 577 H ASN 82 H ASN 82 2.245 -45.923 -5.758 578 HA ASN 82 HA ASN 82 1.309 -43.137 -5.595 579 HB2 ASN 82 HB2 ASN 82 0.240 -45.263 -7.465 580 HB3 ASN 82 HB3 ASN 82 -0.349 -43.609 -7.330 581 HD21 ASN 82 HD21 ASN 82 2.508 -45.524 -8.108 582 HD22 ASN 82 HD22 ASN 82 3.174 -44.400 -9.238 583 H LEU 83 H LEU 83 1.436 -45.101 -3.499 584 HA LEU 83 HA LEU 83 -1.307 -46.000 -3.126 585 HB2 LEU 83 HB2 LEU 83 -0.332 -46.875 -0.938 586 HB3 LEU 83 HB3 LEU 83 0.221 -47.616 -2.439 587 HG LEU 83 HG LEU 83 1.942 -47.107 -0.590 588 HD11 LEU 83 HD11 LEU 83 2.083 -47.250 -3.377 589 HD12 LEU 83 HD12 LEU 83 3.393 -47.494 -2.222 590 HD13 LEU 83 HD13 LEU 83 3.117 -45.897 -2.918 591 HD21 LEU 83 HD21 LEU 83 2.858 -44.905 -0.539 592 HD22 LEU 83 HD22 LEU 83 1.122 -44.768 -0.257 593 HD23 LEU 83 HD23 LEU 83 1.794 -44.370 -1.839 594 H VAL 84 H VAL 84 -1.849 -45.775 -0.545 595 HA VAL 84 HA VAL 84 -2.116 -42.889 -0.176 596 HB VAL 84 HB VAL 84 -3.422 -45.006 1.519 597 HG11 VAL 84 HG11 VAL 84 -5.168 -42.941 1.268 598 HG12 VAL 84 HG12 VAL 84 -4.005 -43.114 2.584 599 HG13 VAL 84 HG13 VAL 84 -3.623 -42.095 1.195 600 HG21 VAL 84 HG21 VAL 84 -5.403 -44.413 -0.137 601 HG22 VAL 84 HG22 VAL 84 -4.064 -44.152 -1.254 602 HG23 VAL 84 HG23 VAL 84 -4.270 -45.721 -0.477 603 H TYR 85 H TYR 85 -1.862 -41.967 1.986 604 HA TYR 85 HA TYR 85 0.046 -43.413 3.686 605 HB2 TYR 85 HB2 TYR 85 1.673 -41.844 3.543 606 HB3 TYR 85 HB3 TYR 85 0.904 -41.464 2.006 607 HD1 TYR 85 HD1 TYR 85 1.159 -40.451 5.553 608 HD2 TYR 85 HD2 TYR 85 -0.182 -39.380 1.660 609 HE1 TYR 85 HE1 TYR 85 0.759 -38.153 6.330 610 HE2 TYR 85 HE2 TYR 85 -0.585 -37.078 2.426 611 HH TYR 85 HH TYR 85 -1.010 -35.884 4.523 612 H VAL 86 H VAL 86 -0.012 -42.885 5.878 613 HA VAL 86 HA VAL 86 -2.404 -41.378 6.698 614 HB VAL 86 HB VAL 86 -0.892 -43.520 8.201 615 HG11 VAL 86 HG11 VAL 86 -3.373 -43.143 9.383 616 HG12 VAL 86 HG12 VAL 86 -1.811 -42.627 10.023 617 HG13 VAL 86 HG13 VAL 86 -2.787 -41.511 9.067 618 HG21 VAL 86 HG21 VAL 86 -3.210 -43.554 6.387 619 HG22 VAL 86 HG22 VAL 86 -2.069 -44.835 6.796 620 HG23 VAL 86 HG23 VAL 86 -3.405 -44.464 7.885 621 H VAL 87 H VAL 87 -2.236 -39.666 8.034 622 HA VAL 87 HA VAL 87 0.386 -38.578 8.528 623 HB VAL 87 HB VAL 87 -2.140 -37.405 9.639 624 HG11 VAL 87 HG11 VAL 87 0.293 -36.097 8.433 625 HG12 VAL 87 HG12 VAL 87 -1.002 -35.320 9.346 626 HG13 VAL 87 HG13 VAL 87 0.102 -36.434 10.154 627 HG21 VAL 87 HG21 VAL 87 -1.441 -37.786 6.805 628 HG22 VAL 87 HG22 VAL 87 -3.012 -37.522 7.562 629 HG23 VAL 87 HG23 VAL 87 -1.941 -36.155 7.254 630 H ASN 88 H ASN 88 1.320 -38.136 10.528 631 HA ASN 88 HA ASN 88 0.024 -39.161 12.930 632 HB2 ASN 88 HB2 ASN 88 1.352 -41.045 11.925 633 HB3 ASN 88 HB3 ASN 88 2.801 -40.070 12.151 634 HD21 ASN 88 HD21 ASN 88 3.889 -40.456 13.928 635 HD22 ASN 88 HD22 ASN 88 3.251 -41.103 15.397 636 H TYR 89 H TYR 89 0.148 -37.562 14.348 637 HA TYR 89 HA TYR 89 2.575 -36.448 15.232 638 HB2 TYR 89 HB2 TYR 89 2.332 -34.143 14.443 639 HB3 TYR 89 HB3 TYR 89 2.505 -35.252 13.088 640 HD1 TYR 89 HD1 TYR 89 0.171 -36.146 12.141 641 HD2 TYR 89 HD2 TYR 89 0.711 -32.512 14.288 642 HE1 TYR 89 HE1 TYR 89 -1.896 -35.258 11.147 643 HE2 TYR 89 HE2 TYR 89 -1.356 -31.615 13.301 644 HH TYR 89 HH TYR 89 -3.627 -32.969 12.239 645 HA PRO 90 HA PRO 90 -1.266 -36.041 17.875 646 HB2 PRO 90 HB2 PRO 90 -0.337 -37.561 19.923 647 HB3 PRO 90 HB3 PRO 90 -1.206 -38.239 18.541 648 HG2 PRO 90 HG2 PRO 90 1.740 -38.136 19.062 649 HG3 PRO 90 HG3 PRO 90 0.762 -39.473 18.428 650 HD2 PRO 90 HD2 PRO 90 2.250 -37.870 16.831 651 HD3 PRO 90 HD3 PRO 90 0.721 -38.597 16.297 652 H LYS 91 H LYS 91 2.175 -36.017 18.736 653 HA LYS 91 HA LYS 91 1.641 -33.896 20.698 654 HB2 LYS 91 HB2 LYS 91 2.922 -36.019 21.333 655 HB3 LYS 91 HB3 LYS 91 4.239 -35.384 20.355 656 HG2 LYS 91 HG2 LYS 91 3.871 -33.251 21.859 657 HG3 LYS 91 HG3 LYS 91 3.186 -34.442 22.967 658 HD2 LYS 91 HD2 LYS 91 5.236 -35.025 23.594 659 HD3 LYS 91 HD3 LYS 91 5.601 -35.512 21.937 660 HE2 LYS 91 HE2 LYS 91 5.697 -32.615 22.553 661 HE3 LYS 91 HE3 LYS 91 6.976 -33.623 23.228 662 HZ1 LYS 91 HZ1 LYS 91 7.815 -34.094 21.185 663 HZ2 LYS 91 HZ2 LYS 91 7.173 -32.566 20.847 664 HZ3 LYS 91 HZ3 LYS 91 6.324 -33.958 20.396 665 H ASP 92 H ASP 92 1.350 -32.400 18.870 666 HA ASP 92 HA ASP 92 3.853 -31.072 18.276 667 HB2 ASP 92 HB2 ASP 92 3.852 -32.451 16.359 668 HB3 ASP 92 HB3 ASP 92 2.113 -32.283 16.137 669 H ASN 93 H ASN 93 3.571 -28.960 18.526 670 HA ASN 93 HA ASN 93 1.143 -27.656 17.648 671 HB2 ASN 93 HB2 ASN 93 0.386 -28.287 19.824 672 HB3 ASN 93 HB3 ASN 93 1.908 -27.801 20.566 673 HD21 ASN 93 HD21 ASN 93 -0.580 -26.370 18.473 674 HD22 ASN 93 HD22 ASN 93 -0.695 -24.882 19.344 675 H LYS 94 H LYS 94 1.382 -25.443 17.346 676 HA LYS 94 HA LYS 94 2.450 -23.455 17.031 677 HB2 LYS 94 HB2 LYS 94 3.568 -24.476 19.465 678 HB3 LYS 94 HB3 LYS 94 4.839 -23.692 18.537 679 HG2 LYS 94 HG2 LYS 94 2.519 -22.042 18.479 680 HG3 LYS 94 HG3 LYS 94 2.856 -22.500 20.150 681 HD2 LYS 94 HD2 LYS 94 5.337 -21.895 19.396 682 HD3 LYS 94 HD3 LYS 94 4.460 -20.867 18.260 683 HE2 LYS 94 HE2 LYS 94 4.719 -19.452 20.059 684 HE3 LYS 94 HE3 LYS 94 3.129 -20.141 20.380 685 HZ1 LYS 94 HZ1 LYS 94 4.238 -21.772 21.846 686 HZ2 LYS 94 HZ2 LYS 94 4.403 -20.176 22.382 687 HZ3 LYS 94 HZ3 LYS 94 5.700 -20.951 21.621 688 H ARG 95 H ARG 95 5.283 -25.510 17.653 689 HA ARG 95 HA ARG 95 6.985 -26.209 16.309 690 HB2 ARG 95 HB2 ARG 95 4.702 -26.150 14.577 691 HB3 ARG 95 HB3 ARG 95 6.112 -25.591 13.687 692 HG2 ARG 95 HG2 ARG 95 6.897 -27.871 15.161 693 HG3 ARG 95 HG3 ARG 95 5.366 -28.247 14.366 694 HD2 ARG 95 HD2 ARG 95 6.451 -27.228 12.268 695 HD3 ARG 95 HD3 ARG 95 7.972 -27.412 13.139 696 HE ARG 95 HE ARG 95 6.742 -29.863 13.287 697 HH11 ARG 95 HH11 ARG 95 7.812 -27.737 10.746 698 HH12 ARG 95 HH12 ARG 95 8.141 -29.022 9.632 699 HH21 ARG 95 HH21 ARG 95 7.171 -31.563 11.828 700 HH22 ARG 95 HH22 ARG 95 7.776 -31.198 10.248 701 H LYS 96 H LYS 96 5.657 -23.647 14.235 702 HA LYS 96 HA LYS 96 6.584 -21.745 13.397 703 HB2 LYS 96 HB2 LYS 96 7.875 -21.683 16.131 704 HB3 LYS 96 HB3 LYS 96 7.816 -20.328 15.012 705 HG2 LYS 96 HG2 LYS 96 5.278 -21.642 15.862 706 HG3 LYS 96 HG3 LYS 96 6.089 -20.510 16.948 707 HD2 LYS 96 HD2 LYS 96 5.530 -19.788 14.090 708 HD3 LYS 96 HD3 LYS 96 4.294 -19.600 15.337 709 HE2 LYS 96 HE2 LYS 96 5.511 -17.980 16.473 710 HE3 LYS 96 HE3 LYS 96 7.037 -18.470 15.737 711 HZ1 LYS 96 HZ1 LYS 96 5.932 -16.323 14.934 712 HZ2 LYS 96 HZ2 LYS 96 4.864 -17.333 14.096 713 HZ3 LYS 96 HZ3 LYS 96 6.521 -17.395 13.765 714 H MET 97 H MET 97 7.819 -22.684 11.762 715 HA MET 97 HA MET 97 10.647 -23.183 12.389 716 HB2 MET 97 HB2 MET 97 9.121 -24.928 11.210 717 HB3 MET 97 HB3 MET 97 9.342 -23.918 9.788 718 HG2 MET 97 HG2 MET 97 11.141 -25.161 9.397 719 HG3 MET 97 HG3 MET 97 11.904 -24.223 10.679 720 HE1 MET 97 HE1 MET 97 13.254 -25.819 12.669 721 HE2 MET 97 HE2 MET 97 13.470 -27.351 11.823 722 HE3 MET 97 HE3 MET 97 13.580 -25.830 10.936 723 H ASP 98 H ASP 98 8.726 -21.908 9.663 724 HA ASP 98 HA ASP 98 9.077 -20.170 8.237 725 HB2 ASP 98 HB2 ASP 98 9.877 -19.240 10.822 726 HB3 ASP 98 HB3 ASP 98 10.967 -18.561 9.616 727 H GLU 99 H GLU 99 10.991 -18.782 7.237 728 HA GLU 99 HA GLU 99 13.477 -20.288 7.117 729 HB2 GLU 99 HB2 GLU 99 11.595 -21.004 5.336 730 HB3 GLU 99 HB3 GLU 99 12.310 -19.655 4.464 731 HG2 GLU 99 HG2 GLU 99 13.957 -20.959 3.792 732 HG3 GLU 99 HG3 GLU 99 14.425 -21.242 5.468 733 H THR 100 H THR 100 13.156 -17.822 8.209 734 HA THR 100 HA THR 100 13.975 -15.698 8.187 735 HB THR 100 HB THR 100 15.570 -16.408 5.735 736 HG1 THR 100 HG1 THR 100 17.072 -17.391 7.126 737 HG21 THR 100 HG21 THR 100 17.066 -14.785 6.444 738 HG22 THR 100 HG22 THR 100 16.527 -14.875 8.122 739 HG23 THR 100 HG23 THR 100 15.517 -14.084 6.912 740 H ASP 101 H ASP 101 11.935 -14.818 7.611 741 HA ASP 101 HA ASP 101 11.411 -14.282 4.802 742 HB2 ASP 101 HB2 ASP 101 9.707 -14.860 6.765 743 HB3 ASP 101 HB3 ASP 101 9.725 -13.109 6.961 744 H ALA 102 H ALA 102 11.525 -12.316 3.820 745 HA ALA 102 HA ALA 102 12.575 -10.084 5.436 746 HB1 ALA 102 HB1 ALA 102 14.010 -9.433 3.669 747 HB2 ALA 102 HB2 ALA 102 14.236 -11.170 3.881 748 HB3 ALA 102 HB3 ALA 102 13.256 -10.565 2.545 749 H SER 103 H SER 103 9.831 -10.499 5.002 750 HA SER 103 HA SER 103 9.157 -8.000 3.724 751 HB2 SER 103 HB2 SER 103 7.389 -10.065 2.667 752 HB3 SER 103 HB3 SER 103 8.214 -8.754 1.825 753 HG SER 103 HG SER 103 8.787 -11.275 1.668 754 H SER 104 H SER 104 6.491 -8.091 3.605 755 HA SER 104 HA SER 104 5.705 -7.978 6.313 756 HB2 SER 104 HB2 SER 104 4.111 -7.921 3.746 757 HB3 SER 104 HB3 SER 104 3.380 -7.704 5.336 758 HG SER 104 HG SER 104 3.903 -5.700 4.406 759 H ALA 105 H ALA 105 5.385 -9.658 7.601 760 HA ALA 105 HA ALA 105 3.594 -11.777 6.839 761 HB1 ALA 105 HB1 ALA 105 5.546 -13.429 7.663 762 HB2 ALA 105 HB2 ALA 105 5.246 -13.045 5.968 763 HB3 ALA 105 HB3 ALA 105 6.513 -12.196 6.853 764 H VAL 106 H VAL 106 2.408 -11.006 8.613 765 HA VAL 106 HA VAL 106 2.956 -12.268 11.079 766 HB VAL 106 HB VAL 106 4.593 -10.513 11.402 767 HG11 VAL 106 HG11 VAL 106 2.387 -8.485 11.138 768 HG12 VAL 106 HG12 VAL 106 4.123 -8.199 11.272 769 HG13 VAL 106 HG13 VAL 106 3.456 -8.916 9.805 770 HG21 VAL 106 HG21 VAL 106 4.004 -9.989 13.548 771 HG22 VAL 106 HG22 VAL 106 2.351 -9.559 13.109 772 HG23 VAL 106 HG23 VAL 106 2.822 -11.255 13.218 773 H LYS 107 H LYS 107 1.116 -12.478 12.231 774 HA LYS 107 HA LYS 107 -1.257 -11.108 11.205 775 HB2 LYS 107 HB2 LYS 107 -1.197 -13.378 13.189 776 HB3 LYS 107 HB3 LYS 107 -2.548 -12.846 12.196 777 HG2 LYS 107 HG2 LYS 107 -1.987 -14.437 10.760 778 HG3 LYS 107 HG3 LYS 107 -0.558 -13.478 10.368 779 HD2 LYS 107 HD2 LYS 107 0.606 -14.630 12.280 780 HD3 LYS 107 HD3 LYS 107 -0.789 -15.707 12.382 781 HE2 LYS 107 HE2 LYS 107 -0.030 -16.939 10.694 782 HE3 LYS 107 HE3 LYS 107 0.127 -15.516 9.665 783 HZ1 LYS 107 HZ1 LYS 107 2.206 -16.917 10.274 784 HZ2 LYS 107 HZ2 LYS 107 2.164 -16.036 11.718 785 HZ3 LYS 107 HZ3 LYS 107 2.313 -15.229 10.239 786 H VAL 108 H VAL 108 -0.712 -9.089 12.251 787 HA VAL 108 HA VAL 108 -1.526 -9.081 15.077 788 HB VAL 108 HB VAL 108 0.926 -8.762 14.930 789 HG11 VAL 108 HG11 VAL 108 0.562 -7.456 12.663 790 HG12 VAL 108 HG12 VAL 108 0.540 -6.062 13.745 791 HG13 VAL 108 HG13 VAL 108 1.946 -7.126 13.704 792 HG21 VAL 108 HG21 VAL 108 -0.865 -7.418 16.469 793 HG22 VAL 108 HG22 VAL 108 0.885 -7.349 16.679 794 HG23 VAL 108 HG23 VAL 108 0.055 -6.087 15.768 795 H LYS 109 H LYS 109 -2.948 -7.518 15.651 796 HA LYS 109 HA LYS 109 -3.455 -5.294 13.826 797 HB2 LYS 109 HB2 LYS 109 -5.222 -7.586 14.209 798 HB3 LYS 109 HB3 LYS 109 -6.016 -6.055 14.553 799 HG2 LYS 109 HG2 LYS 109 -5.925 -5.361 12.394 800 HG3 LYS 109 HG3 LYS 109 -4.428 -6.233 12.059 801 HD2 LYS 109 HD2 LYS 109 -5.890 -8.354 12.337 802 HD3 LYS 109 HD3 LYS 109 -7.246 -7.251 12.090 803 HE2 LYS 109 HE2 LYS 109 -6.497 -6.659 9.932 804 HE3 LYS 109 HE3 LYS 109 -4.910 -7.379 10.201 805 HZ1 LYS 109 HZ1 LYS 109 -7.436 -8.934 10.105 806 HZ2 LYS 109 HZ2 LYS 109 -5.860 -9.548 10.146 807 HZ3 LYS 109 HZ3 LYS 109 -6.409 -8.720 8.777 808 H ARG 110 H ARG 110 -3.113 -3.611 15.129 809 HA ARG 110 HA ARG 110 -4.856 -2.977 17.235 810 HB2 ARG 110 HB2 ARG 110 -3.178 -3.036 19.111 811 HB3 ARG 110 HB3 ARG 110 -3.748 -4.610 18.572 812 HG2 ARG 110 HG2 ARG 110 -1.726 -5.106 17.505 813 HG3 ARG 110 HG3 ARG 110 -1.200 -3.422 17.535 814 HD2 ARG 110 HD2 ARG 110 -1.126 -3.565 20.024 815 HD3 ARG 110 HD3 ARG 110 -1.473 -5.288 19.886 816 HE ARG 110 HE ARG 110 0.726 -4.854 18.297 817 HH11 ARG 110 HH11 ARG 110 -0.083 -4.393 21.652 818 HH12 ARG 110 HH12 ARG 110 1.541 -4.630 22.210 819 HH21 ARG 110 HH21 ARG 110 2.866 -5.166 19.020 820 HH22 ARG 110 HH22 ARG 110 3.217 -5.068 20.712 821 H ALA 111 H ALA 111 -3.738 -1.124 18.654 822 HA ALA 111 HA ALA 111 -2.935 0.867 16.739 823 HB1 ALA 111 HB1 ALA 111 -3.096 1.174 19.730 824 HB2 ALA 111 HB2 ALA 111 -3.165 2.443 18.507 825 HB3 ALA 111 HB3 ALA 111 -4.492 1.291 18.659 826 H VAL 112 H VAL 112 -0.894 0.515 15.994 827 HA VAL 112 HA VAL 112 1.288 -0.337 17.569 828 HB VAL 112 HB VAL 112 2.706 0.368 15.687 829 HG11 VAL 112 HG11 VAL 112 0.848 -0.824 13.961 830 HG12 VAL 112 HG12 VAL 112 2.121 -1.621 14.888 831 HG13 VAL 112 HG13 VAL 112 0.499 -1.467 15.565 832 HG21 VAL 112 HG21 VAL 112 1.800 2.378 14.923 833 HG22 VAL 112 HG22 VAL 112 1.424 1.235 13.634 834 HG23 VAL 112 HG23 VAL 112 0.176 1.705 14.788 835 H GLN 113 H GLN 113 3.230 0.896 18.074 836 HA GLN 113 HA GLN 113 2.705 3.175 19.600 837 HB2 GLN 113 HB2 GLN 113 5.124 3.392 19.821 838 HB3 GLN 113 HB3 GLN 113 4.639 1.709 19.978 839 HG2 GLN 113 HG2 GLN 113 5.429 1.187 17.806 840 HG3 GLN 113 HG3 GLN 113 5.655 2.889 17.410 841 HE21 GLN 113 HE21 GLN 113 7.822 2.391 16.857 842 HE22 GLN 113 HE22 GLN 113 9.024 2.193 18.082 843 H LYS 114 H LYS 114 2.923 5.343 19.257 844 HA LYS 114 HA LYS 114 2.669 6.278 16.576 845 HB2 LYS 114 HB2 LYS 114 3.100 7.841 19.130 846 HB3 LYS 114 HB3 LYS 114 2.584 8.515 17.589 847 HG2 LYS 114 HG2 LYS 114 0.510 7.316 17.691 848 HG3 LYS 114 HG3 LYS 114 1.036 6.447 19.134 849 HD2 LYS 114 HD2 LYS 114 -0.254 8.092 20.081 850 HD3 LYS 114 HD3 LYS 114 1.328 8.876 20.097 851 HE2 LYS 114 HE2 LYS 114 0.425 9.590 17.645 852 HE3 LYS 114 HE3 LYS 114 -1.090 9.506 18.541 853 HZ1 LYS 114 HZ1 LYS 114 0.821 11.542 18.575 854 HZ2 LYS 114 HZ2 LYS 114 0.805 10.843 20.114 855 HZ3 LYS 114 HZ3 LYS 114 -0.625 11.454 19.448 Start of MODEL 19 1 H1 MET 1 H MET 1 -7.593 -30.311 2.956 2 HA MET 1 HA MET 1 -9.674 -30.105 1.278 3 HB2 MET 1 HB2 MET 1 -8.002 -28.155 2.685 4 HB3 MET 1 HB3 MET 1 -8.832 -27.484 1.287 5 HG2 MET 1 HG2 MET 1 -10.962 -28.390 2.203 6 HG3 MET 1 HG3 MET 1 -10.077 -28.855 3.654 7 HE1 MET 1 HE1 MET 1 -11.139 -24.703 2.152 8 HE2 MET 1 HE2 MET 1 -11.178 -26.240 1.290 9 HE3 MET 1 HE3 MET 1 -12.415 -25.872 2.493 10 H ALA 2 H ALA 2 -6.606 -28.448 0.507 11 HA ALA 2 HA ALA 2 -6.666 -29.350 -2.216 12 HB1 ALA 2 HB1 ALA 2 -6.598 -26.645 -2.729 13 HB2 ALA 2 HB2 ALA 2 -7.962 -27.725 -3.024 14 HB3 ALA 2 HB3 ALA 2 -7.878 -26.799 -1.525 15 H GLY 3 H GLY 3 -4.580 -30.076 -1.617 16 HA2 GLY 3 HA2 GLY 3 -2.591 -27.926 -1.241 17 HA3 GLY 3 HA3 GLY 3 -2.389 -29.576 -0.669 18 H SER 4 H SER 4 -0.582 -28.068 -2.332 19 HA SER 4 HA SER 4 0.077 -30.026 -4.229 20 HB2 SER 4 HB2 SER 4 -0.765 -29.311 -6.221 21 HB3 SER 4 HB3 SER 4 -2.010 -28.602 -5.193 22 HG SER 4 HG SER 4 -0.825 -26.650 -5.236 23 H HIS 5 H HIS 5 0.243 -26.600 -3.393 24 HA HIS 5 HA HIS 5 1.969 -25.118 -3.314 25 HB2 HIS 5 HB2 HIS 5 2.854 -27.535 -2.145 26 HB3 HIS 5 HB3 HIS 5 4.194 -26.925 -3.112 27 HD1 HIS 5 HD1 HIS 5 1.856 -25.738 -0.367 28 HD2 HIS 5 HD2 HIS 5 5.633 -24.955 -1.911 29 HE1 HIS 5 HE1 HIS 5 2.891 -24.067 1.202 30 H HIS 6 H HIS 6 4.474 -24.954 -4.196 31 HA HIS 6 HA HIS 6 4.550 -25.923 -6.954 32 HB2 HIS 6 HB2 HIS 6 4.691 -23.014 -6.149 33 HB3 HIS 6 HB3 HIS 6 5.189 -23.613 -7.728 34 HD1 HIS 6 HD1 HIS 6 2.519 -21.883 -6.435 35 HD2 HIS 6 HD2 HIS 6 2.738 -25.380 -8.666 36 HE1 HIS 6 HE1 HIS 6 0.260 -22.137 -7.510 37 H HIS 7 H HIS 7 6.519 -26.601 -7.506 38 HA HIS 7 HA HIS 7 8.805 -25.687 -5.885 39 HB2 HIS 7 HB2 HIS 7 9.818 -27.935 -6.407 40 HB3 HIS 7 HB3 HIS 7 8.408 -27.984 -5.354 41 HD1 HIS 7 HD1 HIS 7 9.702 -29.235 -8.555 42 HD2 HIS 7 HD2 HIS 7 6.019 -28.940 -6.655 43 HE1 HIS 7 HE1 HIS 7 8.169 -30.778 -9.817 44 H HIS 8 H HIS 8 7.690 -26.669 -9.081 45 HA HIS 8 HA HIS 8 8.487 -26.273 -11.175 46 HB2 HIS 8 HB2 HIS 8 9.902 -23.984 -9.792 47 HB3 HIS 8 HB3 HIS 8 9.700 -24.153 -11.533 48 HD1 HIS 8 HD1 HIS 8 6.626 -25.175 -11.105 49 HD2 HIS 8 HD2 HIS 8 8.361 -21.630 -9.806 50 HE1 HIS 8 HE1 HIS 8 4.719 -23.564 -10.804 51 H HIS 9 H HIS 9 10.724 -25.731 -12.382 52 HA HIS 9 HA HIS 9 12.784 -26.509 -12.952 53 HB2 HIS 9 HB2 HIS 9 12.941 -26.088 -10.042 54 HB3 HIS 9 HB3 HIS 9 14.136 -27.211 -10.684 55 HD1 HIS 9 HD1 HIS 9 15.144 -26.015 -13.154 56 HD2 HIS 9 HD2 HIS 9 14.072 -23.650 -9.911 57 HE1 HIS 9 HE1 HIS 9 16.372 -23.844 -13.471 58 H HIS 10 H HIS 10 11.921 -28.367 -13.944 59 HA HIS 10 HA HIS 10 11.883 -30.823 -12.349 60 HB2 HIS 10 HB2 HIS 10 10.626 -31.821 -14.114 61 HB3 HIS 10 HB3 HIS 10 9.943 -30.219 -13.851 62 HD1 HIS 10 HD1 HIS 10 9.703 -31.842 -16.539 63 HD2 HIS 10 HD2 HIS 10 12.439 -28.812 -15.771 64 HE1 HIS 10 HE1 HIS 10 10.358 -30.941 -18.794 65 H GLY 11 H GLY 11 12.613 -32.820 -13.749 66 HA2 GLY 11 HA2 GLY 11 14.230 -33.793 -15.160 67 HA3 GLY 11 HA3 GLY 11 14.997 -32.221 -15.329 68 H SER 12 H SER 12 15.060 -35.217 -13.745 69 HA SER 12 HA SER 12 17.582 -34.814 -12.608 70 HB2 SER 12 HB2 SER 12 15.568 -33.650 -11.046 71 HB3 SER 12 HB3 SER 12 15.954 -35.168 -10.236 72 HG SER 12 HG SER 12 18.225 -34.451 -10.495 73 H MET 13 H MET 13 18.472 -36.722 -11.903 74 HA MET 13 HA MET 13 17.121 -39.117 -12.628 75 HB2 MET 13 HB2 MET 13 19.744 -38.589 -11.237 76 HB3 MET 13 HB3 MET 13 19.168 -40.213 -11.588 77 HG2 MET 13 HG2 MET 13 19.106 -39.659 -13.977 78 HG3 MET 13 HG3 MET 13 19.728 -38.053 -13.606 79 HE1 MET 13 HE1 MET 13 22.915 -39.462 -15.209 80 HE2 MET 13 HE2 MET 13 21.271 -39.782 -15.759 81 HE3 MET 13 HE3 MET 13 21.707 -38.177 -15.169 82 H SER 14 H SER 14 15.305 -39.432 -11.389 83 HA SER 14 HA SER 14 15.662 -40.674 -8.862 84 HB2 SER 14 HB2 SER 14 15.862 -38.292 -8.170 85 HB3 SER 14 HB3 SER 14 14.246 -37.998 -8.812 86 HG SER 14 HG SER 14 14.965 -39.720 -6.676 87 H GLU 15 H GLU 15 13.390 -41.003 -7.794 88 HA GLU 15 HA GLU 15 11.455 -41.512 -9.958 89 HB2 GLU 15 HB2 GLU 15 12.697 -43.348 -8.195 90 HB3 GLU 15 HB3 GLU 15 11.012 -43.232 -7.708 91 HG2 GLU 15 HG2 GLU 15 10.351 -44.450 -9.433 92 HG3 GLU 15 HG3 GLU 15 11.231 -43.429 -10.570 93 H TYR 16 H TYR 16 9.267 -42.243 -8.574 94 HA TYR 16 HA TYR 16 8.719 -40.001 -6.747 95 HB2 TYR 16 HB2 TYR 16 6.353 -40.080 -7.807 96 HB3 TYR 16 HB3 TYR 16 7.644 -39.267 -8.684 97 HD1 TYR 16 HD1 TYR 16 8.206 -39.930 -10.862 98 HD2 TYR 16 HD2 TYR 16 5.787 -42.478 -8.462 99 HE1 TYR 16 HE1 TYR 16 7.784 -41.361 -12.818 100 HE2 TYR 16 HE2 TYR 16 5.359 -43.916 -10.411 101 HH TYR 16 HH TYR 16 5.360 -43.632 -12.943 102 H ILE 17 H ILE 17 6.326 -40.445 -5.828 103 HA ILE 17 HA ILE 17 6.320 -43.234 -4.872 104 HB ILE 17 HB ILE 17 6.964 -41.988 -2.993 105 HG12 ILE 17 HG12 ILE 17 3.949 -42.169 -2.818 106 HG13 ILE 17 HG13 ILE 17 5.051 -43.523 -2.591 107 HG21 ILE 17 HG21 ILE 17 5.366 -39.897 -4.233 108 HG22 ILE 17 HG22 ILE 17 5.139 -39.991 -2.488 109 HG23 ILE 17 HG23 ILE 17 6.756 -39.771 -3.155 110 HD11 ILE 17 HD11 ILE 17 6.093 -42.049 -0.745 111 HD12 ILE 17 HD12 ILE 17 4.570 -41.163 -0.832 112 HD13 ILE 17 HD13 ILE 17 4.570 -42.881 -0.432 113 H ARG 18 H ARG 18 4.485 -44.344 -5.119 114 HA ARG 18 HA ARG 18 2.042 -42.844 -5.804 115 HB2 ARG 18 HB2 ARG 18 3.377 -45.084 -7.147 116 HB3 ARG 18 HB3 ARG 18 1.657 -45.339 -6.885 117 HG2 ARG 18 HG2 ARG 18 1.639 -42.819 -7.855 118 HG3 ARG 18 HG3 ARG 18 3.042 -43.487 -8.692 119 HD2 ARG 18 HD2 ARG 18 0.748 -45.289 -8.655 120 HD3 ARG 18 HD3 ARG 18 0.419 -43.760 -9.468 121 HE ARG 18 HE ARG 18 2.883 -44.976 -10.291 122 HH11 ARG 18 HH11 ARG 18 -0.561 -44.894 -10.790 123 HH12 ARG 18 HH12 ARG 18 -0.471 -45.482 -12.417 124 HH21 ARG 18 HH21 ARG 18 3.015 -45.751 -12.433 125 HH22 ARG 18 HH22 ARG 18 1.563 -45.970 -13.350 126 H VAL 19 H VAL 19 0.820 -42.890 -4.020 127 HA VAL 19 HA VAL 19 0.003 -45.484 -2.982 128 HB VAL 19 HB VAL 19 0.251 -44.603 -0.605 129 HG11 VAL 19 HG11 VAL 19 1.687 -46.347 -1.767 130 HG12 VAL 19 HG12 VAL 19 2.877 -45.064 -1.994 131 HG13 VAL 19 HG13 VAL 19 2.396 -45.545 -0.366 132 HG21 VAL 19 HG21 VAL 19 0.685 -42.259 -1.248 133 HG22 VAL 19 HG22 VAL 19 1.942 -42.920 -0.202 134 HG23 VAL 19 HG23 VAL 19 2.232 -42.755 -1.934 135 H THR 20 H THR 20 -2.016 -45.472 -1.979 136 HA THR 20 HA THR 20 -3.509 -42.941 -2.224 137 HB THR 20 HB THR 20 -4.460 -44.327 -3.853 138 HG1 THR 20 HG1 THR 20 -6.234 -43.668 -2.821 139 HG21 THR 20 HG21 THR 20 -3.804 -46.476 -3.777 140 HG22 THR 20 HG22 THR 20 -5.250 -46.726 -2.798 141 HG23 THR 20 HG23 THR 20 -3.689 -46.475 -2.017 142 H GLU 21 H GLU 21 -4.980 -42.401 -0.616 143 HA GLU 21 HA GLU 21 -4.366 -43.372 1.995 144 HB2 GLU 21 HB2 GLU 21 -5.112 -41.008 1.314 145 HB3 GLU 21 HB3 GLU 21 -6.744 -41.661 1.302 146 HG2 GLU 21 HG2 GLU 21 -5.528 -42.433 3.738 147 HG3 GLU 21 HG3 GLU 21 -5.220 -40.714 3.499 148 H ASP 22 H ASP 22 -7.269 -43.549 -0.054 149 HA ASP 22 HA ASP 22 -8.311 -45.657 1.711 150 HB2 ASP 22 HB2 ASP 22 -9.598 -43.614 -0.040 151 HB3 ASP 22 HB3 ASP 22 -10.428 -45.151 0.186 152 H GLU 23 H GLU 23 -9.012 -47.623 0.872 153 HA GLU 23 HA GLU 23 -7.534 -48.663 -1.280 154 HB2 GLU 23 HB2 GLU 23 -8.850 -50.685 -0.995 155 HB3 GLU 23 HB3 GLU 23 -8.398 -50.037 0.575 156 HG2 GLU 23 HG2 GLU 23 -10.782 -48.855 0.280 157 HG3 GLU 23 HG3 GLU 23 -11.054 -50.313 -0.672 158 H ASN 24 H ASN 24 -10.766 -47.322 -1.076 159 HA ASN 24 HA ASN 24 -11.589 -48.172 -3.677 160 HB2 ASN 24 HB2 ASN 24 -12.684 -45.996 -1.881 161 HB3 ASN 24 HB3 ASN 24 -13.470 -46.594 -3.339 162 HD21 ASN 24 HD21 ASN 24 -12.874 -47.107 -0.017 163 HD22 ASN 24 HD22 ASN 24 -13.791 -48.561 0.157 164 H ASP 25 H ASP 25 -9.849 -45.449 -2.405 165 HA ASP 25 HA ASP 25 -10.186 -43.781 -4.715 166 HB2 ASP 25 HB2 ASP 25 -8.436 -43.663 -2.273 167 HB3 ASP 25 HB3 ASP 25 -8.197 -42.543 -3.611 168 H GLU 26 H GLU 26 -8.456 -43.125 -6.145 169 HA GLU 26 HA GLU 26 -6.934 -45.395 -7.060 170 HB2 GLU 26 HB2 GLU 26 -6.561 -44.194 -9.019 171 HB3 GLU 26 HB3 GLU 26 -8.131 -43.603 -8.493 172 HG2 GLU 26 HG2 GLU 26 -6.902 -41.686 -7.403 173 HG3 GLU 26 HG3 GLU 26 -5.471 -42.231 -8.275 174 HA PRO 27 HA PRO 27 -3.062 -44.496 -5.198 175 HB2 PRO 27 HB2 PRO 27 -1.350 -45.374 -7.113 176 HB3 PRO 27 HB3 PRO 27 -2.308 -46.467 -6.106 177 HG2 PRO 27 HG2 PRO 27 -2.823 -45.528 -8.902 178 HG3 PRO 27 HG3 PRO 27 -2.996 -47.155 -8.219 179 HD2 PRO 27 HD2 PRO 27 -5.107 -45.504 -8.603 180 HD3 PRO 27 HD3 PRO 27 -5.042 -46.676 -7.271 181 H ILE 28 H ILE 28 -2.964 -42.257 -5.079 182 HA ILE 28 HA ILE 28 -2.413 -40.599 -7.332 183 HB ILE 28 HB ILE 28 -3.570 -39.631 -5.466 184 HG12 ILE 28 HG12 ILE 28 -1.563 -38.407 -6.765 185 HG13 ILE 28 HG13 ILE 28 -2.531 -37.602 -5.535 186 HG21 ILE 28 HG21 ILE 28 -2.296 -39.274 -3.295 187 HG22 ILE 28 HG22 ILE 28 -2.871 -40.908 -3.622 188 HG23 ILE 28 HG23 ILE 28 -1.174 -40.502 -3.879 189 HD11 ILE 28 HD11 ILE 28 0.066 -38.993 -4.950 190 HD12 ILE 28 HD12 ILE 28 -0.067 -37.276 -5.334 191 HD13 ILE 28 HD13 ILE 28 -0.851 -37.921 -3.892 192 H GLU 29 H GLU 29 -0.515 -39.647 -7.983 193 HA GLU 29 HA GLU 29 1.939 -40.789 -6.822 194 HB2 GLU 29 HB2 GLU 29 2.979 -40.571 -8.969 195 HB3 GLU 29 HB3 GLU 29 1.433 -41.374 -9.201 196 HG2 GLU 29 HG2 GLU 29 1.156 -39.897 -10.849 197 HG3 GLU 29 HG3 GLU 29 0.732 -38.779 -9.553 198 H ILE 30 H ILE 30 3.413 -39.469 -5.957 199 HA ILE 30 HA ILE 30 3.204 -36.585 -6.510 200 HB ILE 30 HB ILE 30 4.206 -36.608 -3.983 201 HG12 ILE 30 HG12 ILE 30 1.939 -38.558 -3.794 202 HG13 ILE 30 HG13 ILE 30 3.570 -39.154 -4.079 203 HG21 ILE 30 HG21 ILE 30 1.275 -36.576 -4.060 204 HG22 ILE 30 HG22 ILE 30 2.413 -35.327 -3.557 205 HG23 ILE 30 HG23 ILE 30 2.056 -35.556 -5.269 206 HD11 ILE 30 HD11 ILE 30 2.854 -39.129 -1.693 207 HD12 ILE 30 HD12 ILE 30 4.341 -38.241 -2.025 208 HD13 ILE 30 HD13 ILE 30 2.829 -37.368 -1.779 209 HA PRO 31 HA PRO 31 7.522 -36.641 -7.309 210 HB2 PRO 31 HB2 PRO 31 8.228 -34.146 -6.503 211 HB3 PRO 31 HB3 PRO 31 7.301 -34.454 -7.977 212 HG2 PRO 31 HG2 PRO 31 6.337 -33.590 -5.278 213 HG3 PRO 31 HG3 PRO 31 5.850 -33.005 -6.880 214 HD2 PRO 31 HD2 PRO 31 4.371 -34.778 -5.465 215 HD3 PRO 31 HD3 PRO 31 4.435 -34.788 -7.239 216 H SER 32 H SER 32 9.161 -37.552 -6.249 217 HA SER 32 HA SER 32 9.391 -37.084 -3.350 218 HB2 SER 32 HB2 SER 32 9.856 -39.288 -3.024 219 HB3 SER 32 HB3 SER 32 9.000 -39.476 -4.554 220 HG SER 32 HG SER 32 11.118 -40.508 -4.413 221 H GLU 33 H GLU 33 11.525 -36.997 -2.438 222 HA GLU 33 HA GLU 33 13.269 -35.279 -3.761 223 HB2 GLU 33 HB2 GLU 33 13.546 -37.053 -1.361 224 HB3 GLU 33 HB3 GLU 33 14.950 -36.194 -1.979 225 HG2 GLU 33 HG2 GLU 33 13.099 -34.205 -1.873 226 HG3 GLU 33 HG3 GLU 33 12.636 -35.200 -0.495 227 H ASP 34 H ASP 34 15.686 -35.831 -4.056 228 HA ASP 34 HA ASP 34 15.857 -37.764 -6.148 229 HB2 ASP 34 HB2 ASP 34 17.231 -35.504 -5.596 230 HB3 ASP 34 HB3 ASP 34 18.363 -36.705 -4.980 231 H ASP 35 H ASP 35 16.840 -37.659 -2.779 232 HA ASP 35 HA ASP 35 18.487 -39.939 -2.768 233 HB2 ASP 35 HB2 ASP 35 16.834 -38.680 -0.573 234 HB3 ASP 35 HB3 ASP 35 17.983 -39.988 -0.305 235 H GLY 36 H GLY 36 15.082 -39.592 -3.000 236 HA2 GLY 36 HA2 GLY 36 13.919 -41.607 -3.824 237 HA3 GLY 36 HA3 GLY 36 14.779 -42.502 -2.580 238 H THR 37 H THR 37 14.395 -40.367 -0.589 239 HA THR 37 HA THR 37 11.936 -41.284 0.494 240 HB THR 37 HB THR 37 12.332 -39.766 2.328 241 HG1 THR 37 HG1 THR 37 14.482 -38.652 0.831 242 HG21 THR 37 HG21 THR 37 15.134 -40.507 1.699 243 HG22 THR 37 HG22 THR 37 13.945 -41.809 1.722 244 HG23 THR 37 HG23 THR 37 14.182 -40.806 3.152 245 H VAL 38 H VAL 38 10.649 -39.183 1.586 246 HA VAL 38 HA VAL 38 9.880 -37.428 -0.640 247 HB VAL 38 HB VAL 38 7.987 -39.068 1.044 248 HG11 VAL 38 HG11 VAL 38 7.516 -36.646 -0.651 249 HG12 VAL 38 HG12 VAL 38 6.257 -37.869 -0.461 250 HG13 VAL 38 HG13 VAL 38 6.890 -37.025 0.954 251 HG21 VAL 38 HG21 VAL 38 9.124 -40.013 -1.059 252 HG22 VAL 38 HG22 VAL 38 7.372 -40.158 -0.926 253 HG23 VAL 38 HG23 VAL 38 8.078 -38.907 -1.949 254 H LEU 39 H LEU 39 9.263 -35.383 -0.068 255 HA LEU 39 HA LEU 39 10.005 -34.496 2.556 256 HB2 LEU 39 HB2 LEU 39 9.994 -33.338 0.105 257 HB3 LEU 39 HB3 LEU 39 8.536 -32.640 0.808 258 HG LEU 39 HG LEU 39 9.870 -31.772 2.680 259 HD11 LEU 39 HD11 LEU 39 11.833 -33.565 1.612 260 HD12 LEU 39 HD12 LEU 39 11.845 -32.670 3.132 261 HD13 LEU 39 HD13 LEU 39 12.480 -31.925 1.666 262 HD21 LEU 39 HD21 LEU 39 9.552 -30.644 0.327 263 HD22 LEU 39 HD22 LEU 39 11.300 -30.859 0.233 264 HD23 LEU 39 HD23 LEU 39 10.596 -29.919 1.549 265 H LEU 40 H LEU 40 8.739 -34.095 4.262 266 HA LEU 40 HA LEU 40 6.185 -35.079 4.535 267 HB2 LEU 40 HB2 LEU 40 7.954 -34.017 6.228 268 HB3 LEU 40 HB3 LEU 40 6.850 -32.649 6.096 269 HG LEU 40 HG LEU 40 6.224 -35.419 7.107 270 HD11 LEU 40 HD11 LEU 40 5.500 -33.148 8.749 271 HD12 LEU 40 HD12 LEU 40 7.227 -33.181 8.395 272 HD13 LEU 40 HD13 LEU 40 6.455 -34.575 9.151 273 HD21 LEU 40 HD21 LEU 40 4.345 -34.701 5.796 274 HD22 LEU 40 HD22 LEU 40 4.377 -33.103 6.542 275 HD23 LEU 40 HD23 LEU 40 3.943 -34.518 7.503 276 H SER 41 H SER 41 7.171 -31.790 3.666 277 HA SER 41 HA SER 41 4.735 -30.504 3.710 278 HB2 SER 41 HB2 SER 41 7.273 -30.136 2.236 279 HB3 SER 41 HB3 SER 41 5.862 -29.349 1.529 280 HG SER 41 HG SER 41 7.289 -28.654 3.711 281 H THR 42 H THR 42 6.009 -32.725 1.316 282 HA THR 42 HA THR 42 3.980 -32.241 -0.636 283 HB THR 42 HB THR 42 5.726 -34.693 -0.367 284 HG1 THR 42 HG1 THR 42 6.237 -32.104 -1.310 285 HG21 THR 42 HG21 THR 42 5.247 -34.043 -3.051 286 HG22 THR 42 HG22 THR 42 3.689 -33.893 -2.238 287 HG23 THR 42 HG23 THR 42 4.589 -35.406 -2.147 288 H VAL 43 H VAL 43 4.514 -34.766 1.804 289 HA VAL 43 HA VAL 43 2.397 -36.442 1.230 290 HB VAL 43 HB VAL 43 3.813 -35.760 3.773 291 HG11 VAL 43 HG11 VAL 43 2.436 -37.633 4.832 292 HG12 VAL 43 HG12 VAL 43 1.665 -36.054 4.668 293 HG13 VAL 43 HG13 VAL 43 1.276 -37.349 3.535 294 HG21 VAL 43 HG21 VAL 43 4.394 -38.158 3.660 295 HG22 VAL 43 HG22 VAL 43 3.458 -38.293 2.171 296 HG23 VAL 43 HG23 VAL 43 4.894 -37.269 2.221 297 H THR 44 H THR 44 2.393 -33.379 2.950 298 HA THR 44 HA THR 44 -0.292 -33.582 3.896 299 HB THR 44 HB THR 44 -0.100 -31.261 4.522 300 HG1 THR 44 HG1 THR 44 1.969 -31.289 2.622 301 HG21 THR 44 HG21 THR 44 1.770 -33.257 5.278 302 HG22 THR 44 HG22 THR 44 1.191 -31.886 6.225 303 HG23 THR 44 HG23 THR 44 2.626 -31.717 5.215 304 H ALA 45 H ALA 45 1.188 -32.534 0.937 305 HA ALA 45 HA ALA 45 -0.643 -30.814 -0.156 306 HB1 ALA 45 HB1 ALA 45 0.329 -31.232 -2.179 307 HB2 ALA 45 HB2 ALA 45 1.556 -31.914 -1.111 308 HB3 ALA 45 HB3 ALA 45 0.397 -32.974 -1.913 309 H GLN 46 H GLN 46 -0.773 -34.370 -0.233 310 HA GLN 46 HA GLN 46 -3.571 -34.184 -1.117 311 HB2 GLN 46 HB2 GLN 46 -2.213 -36.814 -1.090 312 HB3 GLN 46 HB3 GLN 46 -3.311 -36.124 -2.278 313 HG2 GLN 46 HG2 GLN 46 -1.435 -36.076 -3.522 314 HG3 GLN 46 HG3 GLN 46 -1.213 -34.536 -2.691 315 HE21 GLN 46 HE21 GLN 46 -0.643 -37.966 -1.958 316 HE22 GLN 46 HE22 GLN 46 0.977 -37.751 -1.398 317 H PHE 47 H PHE 47 -1.449 -35.491 1.347 318 HA PHE 47 HA PHE 47 -3.809 -36.454 2.822 319 HB2 PHE 47 HB2 PHE 47 -1.021 -37.279 3.537 320 HB3 PHE 47 HB3 PHE 47 -2.536 -38.145 3.773 321 HD1 PHE 47 HD1 PHE 47 0.369 -38.571 2.246 322 HD2 PHE 47 HD2 PHE 47 -3.736 -38.238 1.170 323 HE1 PHE 47 HE1 PHE 47 0.802 -39.873 0.203 324 HE2 PHE 47 HE2 PHE 47 -3.310 -39.540 -0.873 325 HZ PHE 47 HZ PHE 47 -1.039 -40.360 -1.359 326 HA PRO 48 HA PRO 48 -2.272 -32.721 5.093 327 HB2 PRO 48 HB2 PRO 48 -4.750 -31.742 5.617 328 HB3 PRO 48 HB3 PRO 48 -3.879 -31.400 4.117 329 HG2 PRO 48 HG2 PRO 48 -6.035 -33.410 4.639 330 HG3 PRO 48 HG3 PRO 48 -5.829 -32.325 3.252 331 HD2 PRO 48 HD2 PRO 48 -5.132 -34.940 3.171 332 HD3 PRO 48 HD3 PRO 48 -4.264 -33.692 2.254 333 H GLY 49 H GLY 49 -1.793 -32.941 7.185 334 HA2 GLY 49 HA2 GLY 49 -2.288 -33.206 9.470 335 HA3 GLY 49 HA3 GLY 49 -3.790 -34.005 9.030 336 H ALA 50 H ALA 50 -2.336 -35.763 7.109 337 HA ALA 50 HA ALA 50 -2.013 -38.007 8.697 338 HB1 ALA 50 HB1 ALA 50 -0.727 -37.440 6.028 339 HB2 ALA 50 HB2 ALA 50 -0.896 -39.031 6.772 340 HB3 ALA 50 HB3 ALA 50 -2.331 -38.127 6.287 341 H CYS 51 H CYS 51 -0.600 -38.346 10.275 342 HA CYS 51 HA CYS 51 1.964 -36.988 10.283 343 HB2 CYS 51 HB2 CYS 51 0.183 -37.926 12.267 344 HB3 CYS 51 HB3 CYS 51 1.666 -38.854 12.448 345 HG CYS 51 HG CYS 51 1.877 -35.475 12.190 346 H GLY 52 H GLY 52 0.680 -40.242 9.945 347 HA2 GLY 52 HA2 GLY 52 3.313 -41.109 8.988 348 HA3 GLY 52 HA3 GLY 52 2.565 -42.021 10.290 349 H LEU 53 H LEU 53 3.289 -42.811 7.531 350 HA LEU 53 HA LEU 53 0.612 -43.580 6.569 351 HB2 LEU 53 HB2 LEU 53 3.123 -43.563 4.919 352 HB3 LEU 53 HB3 LEU 53 1.455 -43.680 4.362 353 HG LEU 53 HG LEU 53 2.000 -41.516 3.793 354 HD11 LEU 53 HD11 LEU 53 1.188 -40.663 6.488 355 HD12 LEU 53 HD12 LEU 53 0.132 -41.843 5.712 356 HD13 LEU 53 HD13 LEU 53 0.473 -40.307 4.916 357 HD21 LEU 53 HD21 LEU 53 3.510 -40.114 4.866 358 HD22 LEU 53 HD22 LEU 53 4.211 -41.714 5.107 359 HD23 LEU 53 HD23 LEU 53 3.323 -40.933 6.416 360 H ARG 54 H ARG 54 0.195 -45.711 6.095 361 HA ARG 54 HA ARG 54 2.201 -47.629 7.065 362 HB2 ARG 54 HB2 ARG 54 -0.428 -47.333 7.796 363 HB3 ARG 54 HB3 ARG 54 -0.521 -48.623 6.604 364 HG2 ARG 54 HG2 ARG 54 -0.026 -50.004 8.272 365 HG3 ARG 54 HG3 ARG 54 1.617 -49.370 8.165 366 HD2 ARG 54 HD2 ARG 54 1.320 -47.939 9.962 367 HD3 ARG 54 HD3 ARG 54 -0.436 -47.939 9.799 368 HE ARG 54 HE ARG 54 0.536 -50.521 10.474 369 HH11 ARG 54 HH11 ARG 54 -0.141 -47.377 11.806 370 HH12 ARG 54 HH12 ARG 54 -0.420 -47.973 13.409 371 HH21 ARG 54 HH21 ARG 54 0.171 -51.318 12.580 372 HH22 ARG 54 HH22 ARG 54 -0.242 -50.214 13.848 373 H TYR 55 H TYR 55 2.198 -49.775 5.977 374 HA TYR 55 HA TYR 55 2.004 -49.397 3.070 375 HB2 TYR 55 HB2 TYR 55 4.000 -50.547 4.775 376 HB3 TYR 55 HB3 TYR 55 3.403 -51.787 3.678 377 HD1 TYR 55 HD1 TYR 55 3.085 -50.800 1.154 378 HD2 TYR 55 HD2 TYR 55 5.862 -49.405 4.060 379 HE1 TYR 55 HE1 TYR 55 4.501 -49.897 -0.642 380 HE2 TYR 55 HE2 TYR 55 7.285 -48.497 2.271 381 HH TYR 55 HH TYR 55 7.379 -49.317 -0.599 382 H ARG 56 H ARG 56 0.579 -50.519 1.912 383 HA ARG 56 HA ARG 56 -0.628 -52.923 3.105 384 HB2 ARG 56 HB2 ARG 56 -2.137 -50.924 3.256 385 HB3 ARG 56 HB3 ARG 56 -2.136 -50.857 1.499 386 HG2 ARG 56 HG2 ARG 56 -2.834 -53.480 2.579 387 HG3 ARG 56 HG3 ARG 56 -3.953 -52.191 3.029 388 HD2 ARG 56 HD2 ARG 56 -4.587 -51.798 0.857 389 HD3 ARG 56 HD3 ARG 56 -3.066 -52.394 0.194 390 HE ARG 56 HE ARG 56 -4.030 -54.447 0.012 391 HH11 ARG 56 HH11 ARG 56 -5.766 -52.625 2.418 392 HH12 ARG 56 HH12 ARG 56 -6.969 -53.847 2.664 393 HH21 ARG 56 HH21 ARG 56 -5.608 -56.064 0.327 394 HH22 ARG 56 HH22 ARG 56 -6.878 -55.803 1.475 395 H ASN 57 H ASN 57 0.416 -54.418 1.875 396 HA ASN 57 HA ASN 57 0.178 -54.159 -1.049 397 HB2 ASN 57 HB2 ASN 57 2.247 -55.464 0.697 398 HB3 ASN 57 HB3 ASN 57 2.036 -55.978 -0.975 399 HD21 ASN 57 HD21 ASN 57 2.870 -54.775 -2.576 400 HD22 ASN 57 HD22 ASN 57 3.716 -53.286 -2.344 401 HA PRO 58 HA PRO 58 -2.766 -57.491 -0.578 402 HB2 PRO 58 HB2 PRO 58 -3.425 -57.618 -3.209 403 HB3 PRO 58 HB3 PRO 58 -4.054 -56.375 -2.120 404 HG2 PRO 58 HG2 PRO 58 -1.797 -56.212 -4.080 405 HG3 PRO 58 HG3 PRO 58 -3.079 -55.032 -3.749 406 HD2 PRO 58 HD2 PRO 58 -0.578 -54.785 -2.743 407 HD3 PRO 58 HD3 PRO 58 -2.017 -54.215 -1.874 408 H VAL 59 H VAL 59 -0.181 -57.392 -2.991 409 HA VAL 59 HA VAL 59 -0.263 -60.267 -3.370 410 HB VAL 59 HB VAL 59 1.576 -59.937 -4.941 411 HG11 VAL 59 HG11 VAL 59 -0.195 -59.613 -6.271 412 HG12 VAL 59 HG12 VAL 59 -0.979 -58.531 -5.118 413 HG13 VAL 59 HG13 VAL 59 0.253 -57.908 -6.216 414 HG21 VAL 59 HG21 VAL 59 2.991 -58.294 -4.290 415 HG22 VAL 59 HG22 VAL 59 1.982 -57.319 -5.359 416 HG23 VAL 59 HG23 VAL 59 1.700 -57.297 -3.618 417 H SER 60 H SER 60 1.590 -57.898 -1.604 418 HA SER 60 HA SER 60 3.693 -59.765 -0.921 419 HB2 SER 60 HB2 SER 60 3.788 -57.128 -1.174 420 HB3 SER 60 HB3 SER 60 3.332 -57.176 0.529 421 HG SER 60 HG SER 60 5.728 -57.425 -0.424 422 H GLN 61 H GLN 61 0.735 -58.554 0.467 423 HA GLN 61 HA GLN 61 -0.357 -58.980 2.423 424 HB2 GLN 61 HB2 GLN 61 1.077 -61.634 2.242 425 HB3 GLN 61 HB3 GLN 61 -0.421 -61.303 3.102 426 HG2 GLN 61 HG2 GLN 61 -1.278 -60.582 0.747 427 HG3 GLN 61 HG3 GLN 61 0.065 -61.571 0.176 428 HE21 GLN 61 HE21 GLN 61 -2.381 -61.833 2.739 429 HE22 GLN 61 HE22 GLN 61 -2.889 -63.431 2.324 430 H CYS 62 H CYS 62 2.181 -57.666 2.686 431 HA CYS 62 HA CYS 62 3.431 -58.811 5.043 432 HB2 CYS 62 HB2 CYS 62 4.332 -57.195 2.961 433 HB3 CYS 62 HB3 CYS 62 4.286 -56.118 4.352 434 HG CYS 62 HG CYS 62 5.910 -57.808 5.935 435 H MET 63 H MET 63 4.129 -56.636 6.523 436 HA MET 63 HA MET 63 1.698 -55.187 7.210 437 HB2 MET 63 HB2 MET 63 2.013 -57.483 8.499 438 HB3 MET 63 HB3 MET 63 3.112 -56.517 9.475 439 HG2 MET 63 HG2 MET 63 1.359 -55.002 10.065 440 HG3 MET 63 HG3 MET 63 0.248 -55.779 8.940 441 HE1 MET 63 HE1 MET 63 -1.823 -57.293 10.796 442 HE2 MET 63 HE2 MET 63 -1.073 -57.372 9.201 443 HE3 MET 63 HE3 MET 63 -0.997 -58.765 10.282 444 H ARG 64 H ARG 64 4.197 -54.369 6.089 445 HA ARG 64 HA ARG 64 5.610 -53.038 8.264 446 HB2 ARG 64 HB2 ARG 64 7.239 -52.401 6.592 447 HB3 ARG 64 HB3 ARG 64 6.887 -54.117 6.436 448 HG2 ARG 64 HG2 ARG 64 6.151 -53.882 4.349 449 HG3 ARG 64 HG3 ARG 64 5.179 -52.467 4.761 450 HD2 ARG 64 HD2 ARG 64 6.821 -51.783 3.170 451 HD3 ARG 64 HD3 ARG 64 7.280 -51.116 4.736 452 HE ARG 64 HE ARG 64 9.209 -52.320 4.610 453 HH11 ARG 64 HH11 ARG 64 6.856 -53.779 2.500 454 HH12 ARG 64 HH12 ARG 64 7.963 -54.947 1.858 455 HH21 ARG 64 HH21 ARG 64 10.676 -53.852 3.772 456 HH22 ARG 64 HH22 ARG 64 10.136 -54.988 2.583 457 H GLY 65 H GLY 65 6.415 -50.692 7.304 458 HA2 GLY 65 HA2 GLY 65 4.165 -49.210 6.212 459 HA3 GLY 65 HA3 GLY 65 4.579 -48.835 7.878 460 H VAL 66 H VAL 66 4.658 -46.920 5.866 461 HA VAL 66 HA VAL 66 7.272 -46.593 4.788 462 HB VAL 66 HB VAL 66 5.083 -44.554 5.209 463 HG11 VAL 66 HG11 VAL 66 7.270 -43.490 5.009 464 HG12 VAL 66 HG12 VAL 66 7.578 -44.389 3.521 465 HG13 VAL 66 HG13 VAL 66 6.286 -43.189 3.577 466 HG21 VAL 66 HG21 VAL 66 5.883 -46.038 2.710 467 HG22 VAL 66 HG22 VAL 66 4.506 -46.458 3.728 468 HG23 VAL 66 HG23 VAL 66 4.541 -44.908 2.888 469 H ARG 67 H ARG 67 9.049 -46.084 5.867 470 HA ARG 67 HA ARG 67 9.087 -45.317 8.573 471 HB2 ARG 67 HB2 ARG 67 10.989 -46.447 7.683 472 HB3 ARG 67 HB3 ARG 67 11.199 -45.240 6.422 473 HG2 ARG 67 HG2 ARG 67 12.882 -44.951 8.115 474 HG3 ARG 67 HG3 ARG 67 11.774 -43.577 8.143 475 HD2 ARG 67 HD2 ARG 67 10.528 -44.885 9.970 476 HD3 ARG 67 HD3 ARG 67 11.993 -45.860 10.076 477 HE ARG 67 HE ARG 67 11.636 -43.151 10.990 478 HH11 ARG 67 HH11 ARG 67 13.921 -45.594 10.026 479 HH12 ARG 67 HH12 ARG 67 15.244 -44.883 10.891 480 HH21 ARG 67 HH21 ARG 67 13.369 -42.206 12.133 481 HH22 ARG 67 HH22 ARG 67 14.928 -42.957 12.090 482 H LEU 68 H LEU 68 9.359 -43.369 9.583 483 HA LEU 68 HA LEU 68 9.342 -40.967 7.881 484 HB2 LEU 68 HB2 LEU 68 7.106 -41.313 8.721 485 HB3 LEU 68 HB3 LEU 68 7.717 -41.484 10.366 486 HG LEU 68 HG LEU 68 6.580 -39.269 9.633 487 HD11 LEU 68 HD11 LEU 68 8.264 -39.948 11.647 488 HD12 LEU 68 HD12 LEU 68 7.486 -38.375 11.479 489 HD13 LEU 68 HD13 LEU 68 9.138 -38.606 10.907 490 HD21 LEU 68 HD21 LEU 68 8.348 -39.253 7.650 491 HD22 LEU 68 HD22 LEU 68 9.312 -38.408 8.862 492 HD23 LEU 68 HD23 LEU 68 7.741 -37.766 8.380 493 H VAL 69 H VAL 69 11.049 -39.734 8.258 494 HA VAL 69 HA VAL 69 12.065 -39.500 11.004 495 HB VAL 69 HB VAL 69 13.593 -41.044 10.034 496 HG11 VAL 69 HG11 VAL 69 14.791 -39.806 7.858 497 HG12 VAL 69 HG12 VAL 69 13.686 -41.181 7.813 498 HG13 VAL 69 HG13 VAL 69 13.064 -39.542 7.618 499 HG21 VAL 69 HG21 VAL 69 15.168 -38.583 9.552 500 HG22 VAL 69 HG22 VAL 69 14.400 -38.747 11.131 501 HG23 VAL 69 HG23 VAL 69 15.528 -39.980 10.567 502 H GLU 70 H GLU 70 11.937 -37.434 11.556 503 HA GLU 70 HA GLU 70 12.027 -35.162 11.490 504 HB2 GLU 70 HB2 GLU 70 13.757 -35.445 9.037 505 HB3 GLU 70 HB3 GLU 70 13.735 -34.122 10.194 506 HG2 GLU 70 HG2 GLU 70 14.323 -36.335 11.738 507 HG3 GLU 70 HG3 GLU 70 15.215 -36.610 10.243 508 H GLY 71 H GLY 71 9.984 -36.638 9.969 509 HA2 GLY 71 HA2 GLY 71 8.088 -35.768 8.892 510 HA3 GLY 71 HA3 GLY 71 9.038 -34.378 8.389 511 H ILE 72 H ILE 72 11.198 -36.184 7.392 512 HA ILE 72 HA ILE 72 10.167 -36.478 4.727 513 HB ILE 72 HB ILE 72 12.858 -37.247 5.863 514 HG12 ILE 72 HG12 ILE 72 12.938 -35.049 4.038 515 HG13 ILE 72 HG13 ILE 72 11.711 -34.713 5.255 516 HG21 ILE 72 HG21 ILE 72 13.571 -37.229 3.475 517 HG22 ILE 72 HG22 ILE 72 12.450 -38.527 3.883 518 HG23 ILE 72 HG23 ILE 72 11.872 -37.102 3.020 519 HD11 ILE 72 HD11 ILE 72 13.476 -33.877 6.367 520 HD12 ILE 72 HD12 ILE 72 13.699 -35.562 6.838 521 HD13 ILE 72 HD13 ILE 72 14.637 -34.887 5.506 522 H LEU 73 H LEU 73 8.961 -38.161 4.165 523 HA LEU 73 HA LEU 73 8.968 -40.632 5.592 524 HB2 LEU 73 HB2 LEU 73 7.646 -39.675 3.076 525 HB3 LEU 73 HB3 LEU 73 7.521 -41.354 3.595 526 HG LEU 73 HG LEU 73 5.543 -40.168 4.266 527 HD11 LEU 73 HD11 LEU 73 5.563 -40.595 6.651 528 HD12 LEU 73 HD12 LEU 73 7.326 -40.614 6.656 529 HD13 LEU 73 HD13 LEU 73 6.434 -41.869 5.797 530 HD21 LEU 73 HD21 LEU 73 5.479 -38.148 5.353 531 HD22 LEU 73 HD22 LEU 73 6.911 -37.933 4.345 532 HD23 LEU 73 HD23 LEU 73 7.087 -38.347 6.051 533 H HIS 74 H HIS 74 10.529 -42.092 5.432 534 HA HIS 74 HA HIS 74 12.207 -42.235 3.076 535 HB2 HIS 74 HB2 HIS 74 12.602 -42.748 5.782 536 HB3 HIS 74 HB3 HIS 74 12.617 -44.345 5.039 537 HD1 HIS 74 HD1 HIS 74 14.210 -44.200 2.642 538 HD2 HIS 74 HD2 HIS 74 15.108 -41.778 5.896 539 HE1 HIS 74 HE1 HIS 74 16.617 -43.537 2.343 540 H ALA 75 H ALA 75 12.484 -44.077 1.775 541 HA ALA 75 HA ALA 75 10.085 -45.744 1.595 542 HB1 ALA 75 HB1 ALA 75 11.111 -46.383 -0.645 543 HB2 ALA 75 HB2 ALA 75 10.557 -44.718 -0.464 544 HB3 ALA 75 HB3 ALA 75 12.277 -45.092 -0.353 545 HA PRO 76 HA PRO 76 12.034 -49.420 2.996 546 HB2 PRO 76 HB2 PRO 76 10.836 -51.291 1.436 547 HB3 PRO 76 HB3 PRO 76 9.998 -50.456 2.749 548 HG2 PRO 76 HG2 PRO 76 9.930 -49.908 -0.194 549 HG3 PRO 76 HG3 PRO 76 8.593 -49.930 0.972 550 HD2 PRO 76 HD2 PRO 76 9.737 -47.632 0.111 551 HD3 PRO 76 HD3 PRO 76 9.065 -47.811 1.744 552 H ASP 77 H ASP 77 12.895 -51.627 1.912 553 HA ASP 77 HA ASP 77 15.116 -50.802 0.280 554 HB2 ASP 77 HB2 ASP 77 14.286 -53.454 1.456 555 HB3 ASP 77 HB3 ASP 77 15.699 -53.280 0.419 556 H ALA 78 H ALA 78 12.010 -51.513 -0.464 557 HA ALA 78 HA ALA 78 12.703 -52.784 -3.028 558 HB1 ALA 78 HB1 ALA 78 9.874 -52.608 -2.168 559 HB2 ALA 78 HB2 ALA 78 10.725 -53.898 -3.019 560 HB3 ALA 78 HB3 ALA 78 10.924 -53.710 -1.277 561 H GLY 79 H GLY 79 11.284 -49.988 -1.524 562 HA2 GLY 79 HA2 GLY 79 11.445 -47.921 -2.860 563 HA3 GLY 79 HA3 GLY 79 10.818 -48.851 -4.213 564 H TRP 80 H TRP 80 9.400 -46.782 -4.011 565 HA TRP 80 HA TRP 80 7.390 -46.758 -1.992 566 HB2 TRP 80 HB2 TRP 80 7.630 -45.371 -4.662 567 HB3 TRP 80 HB3 TRP 80 6.251 -45.139 -3.591 568 HD1 TRP 80 HD1 TRP 80 9.370 -43.527 -4.415 569 HE1 TRP 80 HE1 TRP 80 10.187 -41.990 -2.519 570 HE3 TRP 80 HE3 TRP 80 6.388 -45.246 -0.634 571 HZ2 TRP 80 HZ2 TRP 80 9.640 -41.563 0.218 572 HZ3 TRP 80 HZ3 TRP 80 6.597 -44.220 1.592 573 HH2 TRP 80 HH2 TRP 80 8.191 -42.418 2.008 574 H GLY 81 H GLY 81 7.192 -47.486 -5.487 575 HA2 GLY 81 HA2 GLY 81 5.984 -49.172 -6.536 576 HA3 GLY 81 HA3 GLY 81 5.384 -49.682 -4.965 577 H ASN 82 H ASN 82 3.360 -49.919 -6.224 578 HA ASN 82 HA ASN 82 1.897 -47.365 -6.261 579 HB2 ASN 82 HB2 ASN 82 1.158 -49.590 -8.130 580 HB3 ASN 82 HB3 ASN 82 0.835 -47.865 -8.272 581 HD21 ASN 82 HD21 ASN 82 2.693 -46.468 -8.686 582 HD22 ASN 82 HD22 ASN 82 3.985 -47.076 -9.660 583 H LEU 83 H LEU 83 2.117 -49.285 -4.123 584 HA LEU 83 HA LEU 83 -0.400 -50.730 -4.090 585 HB2 LEU 83 HB2 LEU 83 0.384 -51.311 -1.737 586 HB3 LEU 83 HB3 LEU 83 1.327 -51.933 -3.090 587 HG LEU 83 HG LEU 83 2.553 -50.990 -1.020 588 HD11 LEU 83 HD11 LEU 83 4.313 -51.083 -2.367 589 HD12 LEU 83 HD12 LEU 83 3.805 -49.631 -3.227 590 HD13 LEU 83 HD13 LEU 83 3.196 -51.209 -3.726 591 HD21 LEU 83 HD21 LEU 83 2.952 -48.632 -1.003 592 HD22 LEU 83 HD22 LEU 83 1.207 -48.890 -0.977 593 HD23 LEU 83 HD23 LEU 83 2.006 -48.408 -2.475 594 H VAL 84 H VAL 84 -1.395 -50.569 -1.651 595 HA VAL 84 HA VAL 84 -2.315 -47.799 -1.482 596 HB VAL 84 HB VAL 84 -3.432 -50.175 0.002 597 HG11 VAL 84 HG11 VAL 84 -5.486 -48.466 -0.441 598 HG12 VAL 84 HG12 VAL 84 -4.497 -48.474 1.021 599 HG13 VAL 84 HG13 VAL 84 -4.142 -47.336 -0.280 600 HG21 VAL 84 HG21 VAL 84 -3.713 -49.380 -2.820 601 HG22 VAL 84 HG22 VAL 84 -3.936 -50.953 -2.055 602 HG23 VAL 84 HG23 VAL 84 -5.218 -49.745 -1.975 603 H TYR 85 H TYR 85 -2.496 -46.715 0.548 604 HA TYR 85 HA TYR 85 -0.713 -47.747 2.650 605 HB2 TYR 85 HB2 TYR 85 0.549 -45.861 2.716 606 HB3 TYR 85 HB3 TYR 85 0.032 -45.713 1.040 607 HD1 TYR 85 HD1 TYR 85 -0.614 -44.536 4.484 608 HD2 TYR 85 HD2 TYR 85 -1.371 -43.927 0.342 609 HE1 TYR 85 HE1 TYR 85 -1.618 -42.349 4.996 610 HE2 TYR 85 HE2 TYR 85 -2.376 -41.738 0.842 611 HH TYR 85 HH TYR 85 -3.386 -40.551 2.669 612 H VAL 86 H VAL 86 -1.263 -47.238 4.768 613 HA VAL 86 HA VAL 86 -4.002 -46.214 5.109 614 HB VAL 86 HB VAL 86 -2.413 -47.987 6.969 615 HG11 VAL 86 HG11 VAL 86 -5.301 -47.123 7.082 616 HG12 VAL 86 HG12 VAL 86 -4.504 -48.235 8.196 617 HG13 VAL 86 HG13 VAL 86 -4.011 -46.542 8.134 618 HG21 VAL 86 HG21 VAL 86 -4.460 -48.559 4.865 619 HG22 VAL 86 HG22 VAL 86 -2.939 -49.386 5.199 620 HG23 VAL 86 HG23 VAL 86 -4.318 -49.609 6.275 621 H VAL 87 H VAL 87 -4.189 -44.255 5.952 622 HA VAL 87 HA VAL 87 -2.056 -42.718 6.907 623 HB VAL 87 HB VAL 87 -3.872 -41.220 7.858 624 HG11 VAL 87 HG11 VAL 87 -3.898 -42.059 4.967 625 HG12 VAL 87 HG12 VAL 87 -4.748 -40.636 5.574 626 HG13 VAL 87 HG13 VAL 87 -2.992 -40.738 5.704 627 HG21 VAL 87 HG21 VAL 87 -5.796 -42.966 6.371 628 HG22 VAL 87 HG22 VAL 87 -5.448 -43.261 8.074 629 HG23 VAL 87 HG23 VAL 87 -6.124 -41.712 7.568 630 H ASN 88 H ASN 88 -1.702 -41.849 9.045 631 HA ASN 88 HA ASN 88 -2.783 -43.386 11.275 632 HB2 ASN 88 HB2 ASN 88 -0.583 -44.417 10.356 633 HB3 ASN 88 HB3 ASN 88 0.196 -43.026 11.103 634 HD21 ASN 88 HD21 ASN 88 1.293 -44.220 12.615 635 HD22 ASN 88 HD22 ASN 88 0.511 -45.015 13.934 636 H TYR 89 H TYR 89 -3.352 -42.028 12.831 637 HA TYR 89 HA TYR 89 -1.922 -39.459 13.045 638 HB2 TYR 89 HB2 TYR 89 -4.790 -39.915 13.861 639 HB3 TYR 89 HB3 TYR 89 -3.953 -38.380 13.662 640 HD1 TYR 89 HD1 TYR 89 -3.450 -37.529 11.398 641 HD2 TYR 89 HD2 TYR 89 -5.750 -41.059 11.990 642 HE1 TYR 89 HE1 TYR 89 -4.253 -37.387 9.077 643 HE2 TYR 89 HE2 TYR 89 -6.559 -40.928 9.670 644 HH TYR 89 HH TYR 89 -5.904 -38.157 7.650 645 HA PRO 90 HA PRO 90 -1.428 -41.868 17.012 646 HB2 PRO 90 HB2 PRO 90 1.260 -41.528 17.176 647 HB3 PRO 90 HB3 PRO 90 0.513 -42.866 16.295 648 HG2 PRO 90 HG2 PRO 90 1.608 -40.285 15.247 649 HG3 PRO 90 HG3 PRO 90 1.790 -41.924 14.595 650 HD2 PRO 90 HD2 PRO 90 0.017 -40.143 13.586 651 HD3 PRO 90 HD3 PRO 90 -0.287 -41.892 13.596 652 H LYS 91 H LYS 91 0.397 -38.964 16.025 653 HA LYS 91 HA LYS 91 -0.329 -37.745 18.609 654 HB2 LYS 91 HB2 LYS 91 2.236 -38.267 17.637 655 HB3 LYS 91 HB3 LYS 91 1.999 -36.548 17.356 656 HG2 LYS 91 HG2 LYS 91 1.932 -36.049 19.572 657 HG3 LYS 91 HG3 LYS 91 1.254 -37.616 20.019 658 HD2 LYS 91 HD2 LYS 91 3.454 -37.629 20.857 659 HD3 LYS 91 HD3 LYS 91 3.515 -38.599 19.384 660 HE2 LYS 91 HE2 LYS 91 4.997 -37.222 18.459 661 HE3 LYS 91 HE3 LYS 91 3.989 -35.817 18.800 662 HZ1 LYS 91 HZ1 LYS 91 5.230 -36.785 21.166 663 HZ2 LYS 91 HZ2 LYS 91 5.307 -35.245 20.471 664 HZ3 LYS 91 HZ3 LYS 91 6.390 -36.449 19.981 665 H ASP 92 H ASP 92 0.435 -35.177 18.182 666 HA ASP 92 HA ASP 92 -0.452 -34.138 15.678 667 HB2 ASP 92 HB2 ASP 92 -2.649 -34.701 16.480 668 HB3 ASP 92 HB3 ASP 92 -2.320 -33.966 18.047 669 H ASN 93 H ASN 93 0.951 -32.530 15.462 670 HA ASN 93 HA ASN 93 1.480 -30.808 17.794 671 HB2 ASN 93 HB2 ASN 93 3.264 -31.978 15.743 672 HB3 ASN 93 HB3 ASN 93 3.589 -30.301 16.171 673 HD21 ASN 93 HD21 ASN 93 4.320 -29.803 18.214 674 HD22 ASN 93 HD22 ASN 93 4.882 -31.004 19.322 675 H LYS 94 H LYS 94 2.444 -28.600 16.938 676 HA LYS 94 HA LYS 94 1.265 -27.620 14.507 677 HB2 LYS 94 HB2 LYS 94 -0.633 -27.646 16.188 678 HB3 LYS 94 HB3 LYS 94 0.261 -26.431 17.093 679 HG2 LYS 94 HG2 LYS 94 0.147 -24.908 15.207 680 HG3 LYS 94 HG3 LYS 94 -0.692 -26.133 14.251 681 HD2 LYS 94 HD2 LYS 94 -2.659 -25.851 15.368 682 HD3 LYS 94 HD3 LYS 94 -1.862 -25.417 16.882 683 HE2 LYS 94 HE2 LYS 94 -1.400 -23.481 14.755 684 HE3 LYS 94 HE3 LYS 94 -3.108 -23.680 15.140 685 HZ1 LYS 94 HZ1 LYS 94 -1.273 -23.411 17.389 686 HZ2 LYS 94 HZ2 LYS 94 -2.842 -22.810 17.195 687 HZ3 LYS 94 HZ3 LYS 94 -1.539 -22.024 16.457 688 H ARG 95 H ARG 95 3.795 -27.544 14.758 689 HA ARG 95 HA ARG 95 5.669 -26.257 14.817 690 HB2 ARG 95 HB2 ARG 95 4.211 -24.748 13.479 691 HB3 ARG 95 HB3 ARG 95 3.722 -23.950 14.968 692 HG2 ARG 95 HG2 ARG 95 6.453 -23.827 15.108 693 HG3 ARG 95 HG3 ARG 95 6.144 -23.635 13.381 694 HD2 ARG 95 HD2 ARG 95 4.771 -22.037 15.536 695 HD3 ARG 95 HD3 ARG 95 6.207 -21.496 14.668 696 HE ARG 95 HE ARG 95 4.459 -22.078 12.684 697 HH11 ARG 95 HH11 ARG 95 4.276 -20.103 15.545 698 HH12 ARG 95 HH12 ARG 95 3.156 -18.976 14.853 699 HH21 ARG 95 HH21 ARG 95 2.985 -20.602 11.763 700 HH22 ARG 95 HH22 ARG 95 2.421 -19.262 12.702 701 H LYS 96 H LYS 96 6.573 -26.824 16.747 702 HA LYS 96 HA LYS 96 5.805 -25.259 19.117 703 HB2 LYS 96 HB2 LYS 96 5.757 -27.838 19.114 704 HB3 LYS 96 HB3 LYS 96 7.512 -27.736 19.158 705 HG2 LYS 96 HG2 LYS 96 7.249 -26.295 21.216 706 HG3 LYS 96 HG3 LYS 96 5.548 -26.769 21.214 707 HD2 LYS 96 HD2 LYS 96 7.540 -28.947 20.993 708 HD3 LYS 96 HD3 LYS 96 7.442 -28.116 22.547 709 HE2 LYS 96 HE2 LYS 96 4.877 -28.898 21.304 710 HE3 LYS 96 HE3 LYS 96 5.898 -30.212 21.885 711 HZ1 LYS 96 HZ1 LYS 96 4.198 -29.113 23.471 712 HZ2 LYS 96 HZ2 LYS 96 5.369 -27.903 23.628 713 HZ3 LYS 96 HZ3 LYS 96 5.741 -29.499 24.049 714 H MET 97 H MET 97 7.022 -23.416 18.773 715 HA MET 97 HA MET 97 9.682 -23.450 19.676 716 HB2 MET 97 HB2 MET 97 9.495 -24.131 16.983 717 HB3 MET 97 HB3 MET 97 9.931 -22.427 16.967 718 HG2 MET 97 HG2 MET 97 12.029 -22.920 17.443 719 HG3 MET 97 HG3 MET 97 11.531 -23.776 18.901 720 HE1 MET 97 HE1 MET 97 12.801 -25.770 19.204 721 HE2 MET 97 HE2 MET 97 11.187 -26.456 19.017 722 HE3 MET 97 HE3 MET 97 12.568 -27.223 18.231 723 H ASP 98 H ASP 98 10.735 -21.167 18.671 724 HA ASP 98 HA ASP 98 8.887 -19.043 18.357 725 HB2 ASP 98 HB2 ASP 98 9.146 -19.900 21.000 726 HB3 ASP 98 HB3 ASP 98 10.178 -18.477 20.896 727 H GLU 99 H GLU 99 10.179 -16.869 19.111 728 HA GLU 99 HA GLU 99 13.017 -17.047 18.647 729 HB2 GLU 99 HB2 GLU 99 11.324 -16.787 16.412 730 HB3 GLU 99 HB3 GLU 99 12.014 -15.193 16.684 731 HG2 GLU 99 HG2 GLU 99 14.075 -17.145 16.927 732 HG3 GLU 99 HG3 GLU 99 13.194 -17.419 15.425 733 H THR 100 H THR 100 13.793 -14.601 18.184 734 HA THR 100 HA THR 100 12.285 -12.514 19.354 735 HB THR 100 HB THR 100 12.613 -13.588 21.464 736 HG1 THR 100 HG1 THR 100 13.090 -11.676 22.213 737 HG21 THR 100 HG21 THR 100 15.513 -13.793 20.658 738 HG22 THR 100 HG22 THR 100 14.390 -15.115 20.977 739 HG23 THR 100 HG23 THR 100 14.928 -14.077 22.297 740 H ASP 101 H ASP 101 13.408 -10.508 19.378 741 HA ASP 101 HA ASP 101 16.116 -10.522 18.259 742 HB2 ASP 101 HB2 ASP 101 13.976 -8.714 17.142 743 HB3 ASP 101 HB3 ASP 101 15.585 -9.025 16.496 744 H ALA 102 H ALA 102 16.616 -7.920 17.952 745 HA ALA 102 HA ALA 102 15.820 -6.582 20.440 746 HB1 ALA 102 HB1 ALA 102 18.247 -7.825 20.211 747 HB2 ALA 102 HB2 ALA 102 18.628 -6.162 19.761 748 HB3 ALA 102 HB3 ALA 102 17.875 -6.503 21.318 749 H SER 103 H SER 103 17.919 -6.081 17.594 750 HA SER 103 HA SER 103 18.084 -4.366 16.109 751 HB2 SER 103 HB2 SER 103 15.233 -4.472 16.800 752 HB3 SER 103 HB3 SER 103 15.763 -2.895 16.213 753 HG SER 103 HG SER 103 15.235 -5.047 14.789 754 H SER 104 H SER 104 19.654 -3.117 17.000 755 HA SER 104 HA SER 104 19.063 -1.300 19.172 756 HB2 SER 104 HB2 SER 104 21.621 -1.426 17.574 757 HB3 SER 104 HB3 SER 104 21.396 -0.825 19.216 758 HG SER 104 HG SER 104 22.031 -3.274 18.462 759 H ALA 105 H ALA 105 20.352 0.963 18.736 760 HA ALA 105 HA ALA 105 19.396 2.061 16.187 761 HB1 ALA 105 HB1 ALA 105 17.787 2.438 18.157 762 HB2 ALA 105 HB2 ALA 105 18.994 3.588 18.734 763 HB3 ALA 105 HB3 ALA 105 18.231 3.826 17.162 764 H VAL 106 H VAL 106 20.070 4.659 16.462 765 HA VAL 106 HA VAL 106 22.902 4.680 17.253 766 HB VAL 106 HB VAL 106 23.420 6.030 15.225 767 HG11 VAL 106 HG11 VAL 106 23.097 4.006 13.612 768 HG12 VAL 106 HG12 VAL 106 24.156 3.855 15.015 769 HG13 VAL 106 HG13 VAL 106 22.524 3.186 15.064 770 HG21 VAL 106 HG21 VAL 106 20.943 6.612 14.886 771 HG22 VAL 106 HG22 VAL 106 21.918 6.288 13.453 772 HG23 VAL 106 HG23 VAL 106 20.827 5.050 14.076 773 H LYS 107 H LYS 107 23.683 7.136 16.810 774 HA LYS 107 HA LYS 107 21.829 8.775 18.390 775 HB2 LYS 107 HB2 LYS 107 24.724 8.446 18.326 776 HB3 LYS 107 HB3 LYS 107 24.244 10.136 18.255 777 HG2 LYS 107 HG2 LYS 107 23.763 10.157 20.416 778 HG3 LYS 107 HG3 LYS 107 22.721 8.741 20.256 779 HD2 LYS 107 HD2 LYS 107 24.386 7.282 20.835 780 HD3 LYS 107 HD3 LYS 107 25.666 8.325 20.212 781 HE2 LYS 107 HE2 LYS 107 24.665 9.840 22.239 782 HE3 LYS 107 HE3 LYS 107 24.443 8.212 22.878 783 HZ1 LYS 107 HZ1 LYS 107 27.018 9.169 21.766 784 HZ2 LYS 107 HZ2 LYS 107 26.740 7.772 22.678 785 HZ3 LYS 107 HZ3 LYS 107 26.622 9.295 23.406 786 H VAL 108 H VAL 108 21.843 11.140 17.915 787 HA VAL 108 HA VAL 108 22.458 11.861 15.163 788 HB VAL 108 HB VAL 108 19.649 12.087 16.254 789 HG11 VAL 108 HG11 VAL 108 19.358 12.702 13.695 790 HG12 VAL 108 HG12 VAL 108 19.755 13.923 14.905 791 HG13 VAL 108 HG13 VAL 108 21.025 13.240 13.889 792 HG21 VAL 108 HG21 VAL 108 20.782 10.364 14.053 793 HG22 VAL 108 HG22 VAL 108 20.153 9.808 15.604 794 HG23 VAL 108 HG23 VAL 108 19.066 10.539 14.423 795 H LYS 109 H LYS 109 22.735 14.052 14.847 796 HA LYS 109 HA LYS 109 21.986 15.966 16.865 797 HB2 LYS 109 HB2 LYS 109 24.200 16.681 17.473 798 HB3 LYS 109 HB3 LYS 109 24.070 14.956 17.790 799 HG2 LYS 109 HG2 LYS 109 25.033 15.084 15.200 800 HG3 LYS 109 HG3 LYS 109 25.874 16.389 16.041 801 HD2 LYS 109 HD2 LYS 109 25.959 14.288 17.838 802 HD3 LYS 109 HD3 LYS 109 26.197 13.508 16.272 803 HE2 LYS 109 HE2 LYS 109 27.907 15.405 15.859 804 HE3 LYS 109 HE3 LYS 109 27.853 15.618 17.608 805 HZ1 LYS 109 HZ1 LYS 109 28.228 13.026 17.526 806 HZ2 LYS 109 HZ2 LYS 109 29.523 14.112 17.460 807 HZ3 LYS 109 HZ3 LYS 109 28.938 13.406 16.038 808 H ARG 110 H ARG 110 21.902 18.026 16.074 809 HA ARG 110 HA ARG 110 23.345 18.931 13.810 810 HB2 ARG 110 HB2 ARG 110 21.772 17.401 12.664 811 HB3 ARG 110 HB3 ARG 110 20.425 18.309 13.337 812 HG2 ARG 110 HG2 ARG 110 20.666 19.086 11.141 813 HG3 ARG 110 HG3 ARG 110 21.390 20.335 12.156 814 HD2 ARG 110 HD2 ARG 110 23.113 20.170 10.723 815 HD3 ARG 110 HD3 ARG 110 23.536 18.753 11.683 816 HE ARG 110 HE ARG 110 23.083 17.467 9.860 817 HH11 ARG 110 HH11 ARG 110 21.417 20.503 9.508 818 HH12 ARG 110 HH12 ARG 110 20.834 20.147 7.916 819 HH21 ARG 110 HH21 ARG 110 22.322 16.987 7.765 820 HH22 ARG 110 HH22 ARG 110 21.348 18.146 6.925 821 H ALA 111 H ALA 111 20.302 19.288 15.606 822 HA ALA 111 HA ALA 111 19.318 21.088 16.593 823 HB1 ALA 111 HB1 ALA 111 21.362 23.045 16.597 824 HB2 ALA 111 HB2 ALA 111 20.803 22.041 17.935 825 HB3 ALA 111 HB3 ALA 111 22.118 21.481 16.903 826 H VAL 112 H VAL 112 19.132 23.653 16.277 827 HA VAL 112 HA VAL 112 18.794 24.058 13.378 828 HB VAL 112 HB VAL 112 17.026 25.678 13.949 829 HG11 VAL 112 HG11 VAL 112 15.486 23.876 15.099 830 HG12 VAL 112 HG12 VAL 112 16.060 23.665 13.444 831 HG13 VAL 112 HG13 VAL 112 16.861 22.822 14.771 832 HG21 VAL 112 HG21 VAL 112 16.201 25.909 16.194 833 HG22 VAL 112 HG22 VAL 112 17.351 24.710 16.788 834 HG23 VAL 112 HG23 VAL 112 17.928 26.267 16.191 835 H GLN 113 H GLN 113 18.800 26.427 12.740 836 HA GLN 113 HA GLN 113 20.843 27.907 14.256 837 HB2 GLN 113 HB2 GLN 113 21.504 26.729 11.988 838 HB3 GLN 113 HB3 GLN 113 20.722 28.136 11.280 839 HG2 GLN 113 HG2 GLN 113 22.231 29.585 12.597 840 HG3 GLN 113 HG3 GLN 113 23.058 28.139 13.177 841 HE21 GLN 113 HE21 GLN 113 24.359 30.170 11.809 842 HE22 GLN 113 HE22 GLN 113 24.887 29.566 10.279 843 H LYS 114 H LYS 114 20.832 30.230 13.901 844 HA LYS 114 HA LYS 114 19.756 32.236 13.950 845 HB2 LYS 114 HB2 LYS 114 19.774 31.720 11.479 846 HB3 LYS 114 HB3 LYS 114 18.127 31.130 11.660 847 HG2 LYS 114 HG2 LYS 114 17.370 33.311 12.341 848 HG3 LYS 114 HG3 LYS 114 19.024 33.925 12.329 849 HD2 LYS 114 HD2 LYS 114 19.144 33.932 10.022 850 HD3 LYS 114 HD3 LYS 114 17.887 32.704 9.850 851 HE2 LYS 114 HE2 LYS 114 17.303 35.446 10.932 852 HE3 LYS 114 HE3 LYS 114 17.295 35.105 9.202 853 HZ1 LYS 114 HZ1 LYS 114 15.228 34.714 10.990 854 HZ2 LYS 114 HZ2 LYS 114 15.782 33.163 10.604 855 HZ3 LYS 114 HZ3 LYS 114 15.288 34.215 9.374 Start of MODEL 20 1 H1 MET 1 H MET 1 12.374 -12.021 -10.872 2 HA MET 1 HA MET 1 10.499 -13.417 -11.213 3 HB2 MET 1 HB2 MET 1 13.080 -14.813 -10.842 4 HB3 MET 1 HB3 MET 1 11.653 -15.840 -10.872 5 HG2 MET 1 HG2 MET 1 11.029 -14.956 -13.039 6 HG3 MET 1 HG3 MET 1 12.405 -13.857 -13.005 7 HE1 MET 1 HE1 MET 1 15.165 -15.299 -14.263 8 HE2 MET 1 HE2 MET 1 14.600 -14.360 -12.881 9 HE3 MET 1 HE3 MET 1 15.307 -15.957 -12.632 10 H ALA 2 H ALA 2 8.921 -14.781 -10.364 11 HA ALA 2 HA ALA 2 7.588 -15.698 -8.764 12 HB1 ALA 2 HB1 ALA 2 9.732 -16.200 -6.820 13 HB2 ALA 2 HB2 ALA 2 8.541 -17.302 -7.511 14 HB3 ALA 2 HB3 ALA 2 9.994 -16.892 -8.421 15 H GLY 3 H GLY 3 6.418 -13.953 -8.087 16 HA2 GLY 3 HA2 GLY 3 7.251 -12.780 -5.533 17 HA3 GLY 3 HA3 GLY 3 6.887 -11.688 -6.861 18 H SER 4 H SER 4 5.605 -12.252 -4.172 19 HA SER 4 HA SER 4 3.519 -12.336 -3.266 20 HB2 SER 4 HB2 SER 4 3.334 -10.821 -5.679 21 HB3 SER 4 HB3 SER 4 1.860 -11.774 -5.513 22 HG SER 4 HG SER 4 1.281 -10.568 -3.891 23 H HIS 5 H HIS 5 1.101 -13.166 -3.943 24 HA HIS 5 HA HIS 5 1.333 -15.968 -4.069 25 HB2 HIS 5 HB2 HIS 5 -1.072 -14.175 -4.447 26 HB3 HIS 5 HB3 HIS 5 -1.161 -15.928 -4.301 27 HD1 HIS 5 HD1 HIS 5 -1.437 -16.800 -1.998 28 HD2 HIS 5 HD2 HIS 5 0.111 -12.944 -2.025 29 HE1 HIS 5 HE1 HIS 5 -1.322 -16.104 0.416 30 H HIS 6 H HIS 6 0.145 -17.345 -5.681 31 HA HIS 6 HA HIS 6 -0.142 -16.338 -8.356 32 HB2 HIS 6 HB2 HIS 6 2.395 -17.432 -7.525 33 HB3 HIS 6 HB3 HIS 6 1.674 -18.449 -8.770 34 HD1 HIS 6 HD1 HIS 6 4.188 -16.345 -8.920 35 HD2 HIS 6 HD2 HIS 6 0.401 -15.975 -10.589 36 HE1 HIS 6 HE1 HIS 6 4.452 -14.737 -10.836 37 H HIS 7 H HIS 7 -1.776 -17.417 -9.227 38 HA HIS 7 HA HIS 7 -2.120 -20.260 -8.578 39 HB2 HIS 7 HB2 HIS 7 -3.666 -19.012 -7.150 40 HB3 HIS 7 HB3 HIS 7 -4.317 -18.178 -8.558 41 HD1 HIS 7 HD1 HIS 7 -3.725 -21.895 -7.984 42 HD2 HIS 7 HD2 HIS 7 -6.784 -19.233 -8.891 43 HE1 HIS 7 HE1 HIS 7 -5.760 -23.319 -8.378 44 H HIS 8 H HIS 8 -2.316 -21.466 -10.342 45 HA HIS 8 HA HIS 8 -2.933 -20.138 -12.885 46 HB2 HIS 8 HB2 HIS 8 -1.107 -22.246 -12.088 47 HB3 HIS 8 HB3 HIS 8 -2.130 -22.761 -13.426 48 HD1 HIS 8 HD1 HIS 8 0.804 -20.722 -12.631 49 HD2 HIS 8 HD2 HIS 8 -1.904 -21.061 -15.764 50 HE1 HIS 8 HE1 HIS 8 1.878 -19.546 -14.578 51 H HIS 9 H HIS 9 -4.025 -21.710 -14.512 52 HA HIS 9 HA HIS 9 -6.036 -23.409 -13.265 53 HB2 HIS 9 HB2 HIS 9 -7.830 -22.242 -14.655 54 HB3 HIS 9 HB3 HIS 9 -7.252 -21.380 -13.233 55 HD1 HIS 9 HD1 HIS 9 -7.319 -18.981 -13.834 56 HD2 HIS 9 HD2 HIS 9 -5.758 -21.305 -16.904 57 HE1 HIS 9 HE1 HIS 9 -6.591 -17.352 -15.607 58 H HIS 10 H HIS 10 -4.002 -24.382 -14.693 59 HA HIS 10 HA HIS 10 -4.343 -24.527 -17.479 60 HB2 HIS 10 HB2 HIS 10 -2.894 -26.171 -15.445 61 HB3 HIS 10 HB3 HIS 10 -3.073 -26.807 -17.078 62 HD1 HIS 10 HD1 HIS 10 -1.404 -24.064 -15.147 63 HD2 HIS 10 HD2 HIS 10 -1.519 -25.556 -19.023 64 HE1 HIS 10 HE1 HIS 10 0.487 -22.933 -16.360 65 H GLY 11 H GLY 11 -4.933 -27.202 -15.191 66 HA2 GLY 11 HA2 GLY 11 -7.067 -28.316 -15.045 67 HA3 GLY 11 HA3 GLY 11 -7.375 -27.844 -16.710 68 H SER 12 H SER 12 -4.394 -29.249 -15.452 69 HA SER 12 HA SER 12 -4.710 -31.447 -17.361 70 HB2 SER 12 HB2 SER 12 -2.585 -29.886 -17.045 71 HB3 SER 12 HB3 SER 12 -2.201 -31.061 -15.787 72 HG SER 12 HG SER 12 -1.994 -31.300 -18.467 73 H MET 13 H MET 13 -3.230 -33.432 -16.359 74 HA MET 13 HA MET 13 -4.913 -34.767 -14.608 75 HB2 MET 13 HB2 MET 13 -2.420 -35.277 -15.905 76 HB3 MET 13 HB3 MET 13 -2.285 -35.782 -14.226 77 HG2 MET 13 HG2 MET 13 -3.012 -37.660 -15.456 78 HG3 MET 13 HG3 MET 13 -4.400 -37.079 -14.539 79 HE1 MET 13 HE1 MET 13 -5.418 -38.722 -17.964 80 HE2 MET 13 HE2 MET 13 -3.718 -38.389 -18.293 81 HE3 MET 13 HE3 MET 13 -4.199 -39.062 -16.735 82 H SER 14 H SER 14 -4.334 -35.609 -12.415 83 HA SER 14 HA SER 14 -2.800 -33.699 -10.806 84 HB2 SER 14 HB2 SER 14 -4.526 -33.151 -9.381 85 HB3 SER 14 HB3 SER 14 -5.429 -33.340 -10.884 86 HG SER 14 HG SER 14 -6.523 -34.569 -9.468 87 H GLU 15 H GLU 15 -1.518 -34.674 -9.375 88 HA GLU 15 HA GLU 15 -1.974 -37.532 -8.844 89 HB2 GLU 15 HB2 GLU 15 0.311 -36.163 -9.741 90 HB3 GLU 15 HB3 GLU 15 0.648 -36.607 -8.074 91 HG2 GLU 15 HG2 GLU 15 -0.542 -38.785 -9.571 92 HG3 GLU 15 HG3 GLU 15 0.957 -38.208 -10.295 93 H TYR 16 H TYR 16 -0.375 -37.928 -6.681 94 HA TYR 16 HA TYR 16 -1.345 -36.087 -4.611 95 HB2 TYR 16 HB2 TYR 16 -1.671 -38.279 -3.212 96 HB3 TYR 16 HB3 TYR 16 -2.937 -37.740 -4.308 97 HD1 TYR 16 HD1 TYR 16 -0.059 -40.073 -4.033 98 HD2 TYR 16 HD2 TYR 16 -3.691 -39.133 -6.040 99 HE1 TYR 16 HE1 TYR 16 0.020 -42.246 -5.181 100 HE2 TYR 16 HE2 TYR 16 -3.623 -41.304 -7.192 101 HH TYR 16 HH TYR 16 -0.982 -43.156 -7.469 102 H ILE 17 H ILE 17 -0.326 -36.872 -2.399 103 HA ILE 17 HA ILE 17 2.534 -37.358 -2.921 104 HB ILE 17 HB ILE 17 2.348 -35.148 -2.100 105 HG12 ILE 17 HG12 ILE 17 2.961 -36.862 0.315 106 HG13 ILE 17 HG13 ILE 17 4.080 -36.596 -1.017 107 HG21 ILE 17 HG21 ILE 17 0.470 -34.556 -1.067 108 HG22 ILE 17 HG22 ILE 17 0.107 -36.226 -0.635 109 HG23 ILE 17 HG23 ILE 17 1.145 -35.252 0.405 110 HD11 ILE 17 HD11 ILE 17 3.731 -34.090 -0.474 111 HD12 ILE 17 HD12 ILE 17 3.149 -34.692 1.079 112 HD13 ILE 17 HD13 ILE 17 4.788 -35.066 0.546 113 H ARG 18 H ARG 18 3.371 -39.147 -2.085 114 HA ARG 18 HA ARG 18 1.914 -40.485 0.098 115 HB2 ARG 18 HB2 ARG 18 3.032 -41.459 -2.408 116 HB3 ARG 18 HB3 ARG 18 3.614 -42.373 -1.023 117 HG2 ARG 18 HG2 ARG 18 0.909 -42.152 -0.547 118 HG3 ARG 18 HG3 ARG 18 1.008 -42.375 -2.295 119 HD2 ARG 18 HD2 ARG 18 2.683 -44.126 -0.581 120 HD3 ARG 18 HD3 ARG 18 0.945 -44.422 -0.599 121 HE ARG 18 HE ARG 18 1.708 -44.224 -3.240 122 HH11 ARG 18 HH11 ARG 18 2.496 -46.245 -0.516 123 HH12 ARG 18 HH12 ARG 18 2.856 -47.635 -1.485 124 HH21 ARG 18 HH21 ARG 18 2.180 -46.047 -4.527 125 HH22 ARG 18 HH22 ARG 18 2.677 -47.521 -3.767 126 H VAL 19 H VAL 19 2.907 -39.967 1.950 127 HA VAL 19 HA VAL 19 5.722 -40.666 2.237 128 HB VAL 19 HB VAL 19 6.026 -38.500 3.607 129 HG11 VAL 19 HG11 VAL 19 6.842 -37.312 1.667 130 HG12 VAL 19 HG12 VAL 19 7.177 -39.036 1.488 131 HG13 VAL 19 HG13 VAL 19 5.840 -38.300 0.603 132 HG21 VAL 19 HG21 VAL 19 4.493 -36.877 3.522 133 HG22 VAL 19 HG22 VAL 19 4.252 -37.075 1.787 134 HG23 VAL 19 HG23 VAL 19 3.391 -38.115 2.921 135 H THR 20 H THR 20 6.391 -40.490 4.599 136 HA THR 20 HA THR 20 4.179 -40.806 6.475 137 HB THR 20 HB THR 20 4.320 -43.066 6.055 138 HG1 THR 20 HG1 THR 20 4.808 -42.782 8.257 139 HG21 THR 20 HG21 THR 20 7.089 -42.434 5.236 140 HG22 THR 20 HG22 THR 20 5.902 -43.506 4.492 141 HG23 THR 20 HG23 THR 20 6.821 -44.047 5.896 142 H GLU 21 H GLU 21 4.633 -39.913 8.389 143 HA GLU 21 HA GLU 21 7.060 -38.542 8.826 144 HB2 GLU 21 HB2 GLU 21 4.681 -38.137 9.815 145 HB3 GLU 21 HB3 GLU 21 5.196 -39.265 11.061 146 HG2 GLU 21 HG2 GLU 21 7.222 -37.283 10.629 147 HG3 GLU 21 HG3 GLU 21 5.667 -36.512 10.937 148 H ASP 22 H ASP 22 5.869 -41.674 9.868 149 HA ASP 22 HA ASP 22 8.243 -42.112 11.511 150 HB2 ASP 22 HB2 ASP 22 5.575 -43.390 11.263 151 HB3 ASP 22 HB3 ASP 22 6.916 -44.443 11.705 152 H GLU 23 H GLU 23 9.382 -44.223 11.284 153 HA GLU 23 HA GLU 23 10.016 -44.655 8.479 154 HB2 GLU 23 HB2 GLU 23 11.945 -45.896 9.302 155 HB3 GLU 23 HB3 GLU 23 11.843 -44.328 10.090 156 HG2 GLU 23 HG2 GLU 23 10.513 -45.747 11.893 157 HG3 GLU 23 HG3 GLU 23 11.493 -47.045 11.211 158 H ASN 24 H ASN 24 8.663 -46.390 11.217 159 HA ASN 24 HA ASN 24 8.519 -48.889 9.763 160 HB2 ASN 24 HB2 ASN 24 7.561 -49.810 11.773 161 HB3 ASN 24 HB3 ASN 24 8.921 -48.789 12.231 162 HD21 ASN 24 HD21 ASN 24 5.508 -49.240 12.358 163 HD22 ASN 24 HD22 ASN 24 5.161 -47.946 13.449 164 H ASP 25 H ASP 25 6.477 -46.168 10.461 165 HA ASP 25 HA ASP 25 3.998 -47.439 9.836 166 HB2 ASP 25 HB2 ASP 25 4.529 -45.196 11.136 167 HB3 ASP 25 HB3 ASP 25 4.359 -44.490 9.532 168 H GLU 26 H GLU 26 2.903 -47.564 7.938 169 HA GLU 26 HA GLU 26 4.348 -47.462 5.521 170 HB2 GLU 26 HB2 GLU 26 1.468 -47.850 6.235 171 HB3 GLU 26 HB3 GLU 26 1.910 -47.600 4.552 172 HG2 GLU 26 HG2 GLU 26 2.850 -49.634 4.352 173 HG3 GLU 26 HG3 GLU 26 3.485 -49.622 5.996 174 HA PRO 27 HA PRO 27 3.940 -43.319 4.134 175 HB2 PRO 27 HB2 PRO 27 3.673 -43.668 1.455 176 HB3 PRO 27 HB3 PRO 27 5.199 -43.926 2.311 177 HG2 PRO 27 HG2 PRO 27 3.167 -45.934 1.412 178 HG3 PRO 27 HG3 PRO 27 4.936 -46.010 1.312 179 HD2 PRO 27 HD2 PRO 27 3.529 -47.297 3.235 180 HD3 PRO 27 HD3 PRO 27 5.159 -46.651 3.515 181 H ILE 28 H ILE 28 2.142 -42.231 4.674 182 HA ILE 28 HA ILE 28 -0.487 -43.069 3.966 183 HB ILE 28 HB ILE 28 -0.116 -41.793 5.999 184 HG12 ILE 28 HG12 ILE 28 -1.880 -40.066 5.693 185 HG13 ILE 28 HG13 ILE 28 -1.765 -40.295 3.951 186 HG21 ILE 28 HG21 ILE 28 1.184 -39.931 4.131 187 HG22 ILE 28 HG22 ILE 28 0.201 -39.180 5.387 188 HG23 ILE 28 HG23 ILE 28 1.523 -40.259 5.830 189 HD11 ILE 28 HD11 ILE 28 -2.684 -42.299 5.993 190 HD12 ILE 28 HD12 ILE 28 -3.652 -41.506 4.751 191 HD13 ILE 28 HD13 ILE 28 -2.411 -42.670 4.291 192 H GLU 29 H GLU 29 -1.911 -42.226 2.469 193 HA GLU 29 HA GLU 29 -0.662 -40.683 0.302 194 HB2 GLU 29 HB2 GLU 29 -2.525 -41.546 -1.099 195 HB3 GLU 29 HB3 GLU 29 -1.509 -42.816 -0.432 196 HG2 GLU 29 HG2 GLU 29 -3.281 -43.788 0.452 197 HG3 GLU 29 HG3 GLU 29 -3.623 -42.339 1.395 198 H ILE 30 H ILE 30 -1.105 -38.589 0.302 199 HA ILE 30 HA ILE 30 -3.780 -37.717 1.184 200 HB ILE 30 HB ILE 30 -2.186 -35.472 1.370 201 HG12 ILE 30 HG12 ILE 30 -0.669 -37.735 2.669 202 HG13 ILE 30 HG13 ILE 30 -0.226 -37.077 1.098 203 HG21 ILE 30 HG21 ILE 30 -3.973 -36.656 2.907 204 HG22 ILE 30 HG22 ILE 30 -2.533 -37.188 3.773 205 HG23 ILE 30 HG23 ILE 30 -2.846 -35.466 3.559 206 HD11 ILE 30 HD11 ILE 30 -0.137 -35.749 3.778 207 HD12 ILE 30 HD12 ILE 30 1.164 -35.986 2.611 208 HD13 ILE 30 HD13 ILE 30 -0.115 -34.819 2.280 209 HA PRO 31 HA PRO 31 -4.420 -35.823 -2.724 210 HB2 PRO 31 HB2 PRO 31 -5.863 -33.631 -2.030 211 HB3 PRO 31 HB3 PRO 31 -6.523 -35.270 -1.983 212 HG2 PRO 31 HG2 PRO 31 -5.439 -33.600 0.253 213 HG3 PRO 31 HG3 PRO 31 -6.887 -34.623 0.221 214 HD2 PRO 31 HD2 PRO 31 -4.561 -35.424 1.353 215 HD3 PRO 31 HD3 PRO 31 -5.681 -36.556 0.569 216 H SER 32 H SER 32 -3.486 -34.368 -4.088 217 HA SER 32 HA SER 32 -1.942 -32.166 -2.894 218 HB2 SER 32 HB2 SER 32 -0.002 -32.735 -3.981 219 HB3 SER 32 HB3 SER 32 -0.685 -34.349 -3.783 220 HG SER 32 HG SER 32 -0.098 -33.058 -6.042 221 H GLU 33 H GLU 33 -1.428 -30.425 -4.415 222 HA GLU 33 HA GLU 33 -3.702 -29.595 -5.857 223 HB2 GLU 33 HB2 GLU 33 -0.966 -28.557 -5.394 224 HB3 GLU 33 HB3 GLU 33 -1.795 -27.950 -6.820 225 HG2 GLU 33 HG2 GLU 33 -3.655 -27.205 -5.438 226 HG3 GLU 33 HG3 GLU 33 -2.849 -27.836 -4.003 227 H ASP 34 H ASP 34 -3.726 -28.973 -8.162 228 HA ASP 34 HA ASP 34 -3.159 -31.190 -9.814 229 HB2 ASP 34 HB2 ASP 34 -3.952 -29.795 -11.654 230 HB3 ASP 34 HB3 ASP 34 -5.006 -29.618 -10.254 231 H ASP 35 H ASP 35 -1.499 -28.139 -9.260 232 HA ASP 35 HA ASP 35 0.343 -28.319 -11.386 233 HB2 ASP 35 HB2 ASP 35 -0.242 -26.388 -9.620 234 HB3 ASP 35 HB3 ASP 35 1.208 -27.028 -8.853 235 H GLY 36 H GLY 36 0.092 -30.045 -8.448 236 HA2 GLY 36 HA2 GLY 36 1.461 -32.104 -8.389 237 HA3 GLY 36 HA3 GLY 36 2.827 -31.096 -8.841 238 H THR 37 H THR 37 1.974 -28.918 -7.045 239 HA THR 37 HA THR 37 3.423 -29.708 -4.748 240 HB THR 37 HB THR 37 2.941 -27.532 -3.847 241 HG1 THR 37 HG1 THR 37 0.887 -27.477 -5.814 242 HG21 THR 37 HG21 THR 37 3.024 -26.738 -6.683 243 HG22 THR 37 HG22 THR 37 4.232 -27.926 -6.196 244 HG23 THR 37 HG23 THR 37 4.141 -26.371 -5.369 245 H VAL 38 H VAL 38 2.171 -28.763 -2.555 246 HA VAL 38 HA VAL 38 -0.388 -30.179 -2.346 247 HB VAL 38 HB VAL 38 2.004 -30.642 -0.566 248 HG11 VAL 38 HG11 VAL 38 -0.862 -30.824 0.016 249 HG12 VAL 38 HG12 VAL 38 0.055 -32.282 0.400 250 HG13 VAL 38 HG13 VAL 38 0.517 -30.736 1.112 251 HG21 VAL 38 HG21 VAL 38 1.636 -31.942 -2.749 252 HG22 VAL 38 HG22 VAL 38 1.934 -32.866 -1.277 253 HG23 VAL 38 HG23 VAL 38 0.293 -32.711 -1.904 254 H LEU 39 H LEU 39 -1.864 -29.055 -1.248 255 HA LEU 39 HA LEU 39 -1.325 -26.461 -0.279 256 HB2 LEU 39 HB2 LEU 39 -3.569 -27.892 -0.960 257 HB3 LEU 39 HB3 LEU 39 -3.739 -27.710 0.785 258 HG LEU 39 HG LEU 39 -3.376 -25.434 -1.163 259 HD11 LEU 39 HD11 LEU 39 -5.734 -24.958 -0.741 260 HD12 LEU 39 HD12 LEU 39 -5.857 -26.417 0.241 261 HD13 LEU 39 HD13 LEU 39 -5.522 -26.542 -1.486 262 HD21 LEU 39 HD21 LEU 39 -4.123 -24.091 0.816 263 HD22 LEU 39 HD22 LEU 39 -2.525 -24.819 0.976 264 HD23 LEU 39 HD23 LEU 39 -3.909 -25.539 1.800 265 H LEU 40 H LEU 40 -0.944 -25.677 1.727 266 HA LEU 40 HA LEU 40 0.287 -27.181 3.669 267 HB2 LEU 40 HB2 LEU 40 0.245 -24.683 3.472 268 HB3 LEU 40 HB3 LEU 40 -1.353 -24.715 4.215 269 HG LEU 40 HG LEU 40 -0.438 -25.551 6.276 270 HD11 LEU 40 HD11 LEU 40 1.860 -26.163 4.577 271 HD12 LEU 40 HD12 LEU 40 1.320 -26.917 6.077 272 HD13 LEU 40 HD13 LEU 40 2.284 -25.442 6.130 273 HD21 LEU 40 HD21 LEU 40 1.450 -23.378 5.440 274 HD22 LEU 40 HD22 LEU 40 0.663 -23.629 6.998 275 HD23 LEU 40 HD23 LEU 40 -0.279 -23.072 5.614 276 H SER 41 H SER 41 -3.142 -26.382 3.380 277 HA SER 41 HA SER 41 -4.074 -27.293 5.817 278 HB2 SER 41 HB2 SER 41 -5.353 -27.364 3.082 279 HB3 SER 41 HB3 SER 41 -6.217 -27.811 4.553 280 HG SER 41 HG SER 41 -6.530 -25.611 4.008 281 H THR 42 H THR 42 -3.171 -29.117 2.959 282 HA THR 42 HA THR 42 -4.210 -31.616 3.864 283 HB THR 42 HB THR 42 -2.046 -31.131 1.808 284 HG1 THR 42 HG1 THR 42 -3.869 -30.075 1.106 285 HG21 THR 42 HG21 THR 42 -1.924 -33.362 1.776 286 HG22 THR 42 HG22 THR 42 -3.560 -33.361 1.118 287 HG23 THR 42 HG23 THR 42 -3.308 -33.519 2.856 288 H VAL 43 H VAL 43 -1.037 -30.062 3.979 289 HA VAL 43 HA VAL 43 0.419 -32.244 4.986 290 HB VAL 43 HB VAL 43 0.842 -29.279 5.054 291 HG11 VAL 43 HG11 VAL 43 1.783 -29.749 7.121 292 HG12 VAL 43 HG12 VAL 43 2.323 -31.354 6.623 293 HG13 VAL 43 HG13 VAL 43 3.154 -29.917 6.025 294 HG21 VAL 43 HG21 VAL 43 1.755 -29.812 3.092 295 HG22 VAL 43 HG22 VAL 43 3.059 -30.565 4.009 296 HG23 VAL 43 HG23 VAL 43 1.699 -31.538 3.449 297 H THR 44 H THR 44 -1.583 -29.833 6.556 298 HA THR 44 HA THR 44 -0.757 -30.526 9.218 299 HB THR 44 HB THR 44 -2.449 -29.014 9.995 300 HG1 THR 44 HG1 THR 44 -3.803 -28.047 8.164 301 HG21 THR 44 HG21 THR 44 -1.197 -27.284 9.361 302 HG22 THR 44 HG22 THR 44 -1.922 -27.318 7.753 303 HG23 THR 44 HG23 THR 44 -0.488 -28.286 8.096 304 H ALA 45 H ALA 45 -3.333 -31.460 7.036 305 HA ALA 45 HA ALA 45 -5.146 -32.637 8.745 306 HB1 ALA 45 HB1 ALA 45 -4.369 -33.055 5.926 307 HB2 ALA 45 HB2 ALA 45 -5.289 -34.351 6.690 308 HB3 ALA 45 HB3 ALA 45 -5.949 -32.717 6.632 309 H GLN 46 H GLN 46 -2.242 -34.117 7.319 310 HA GLN 46 HA GLN 46 -2.572 -36.413 9.111 311 HB2 GLN 46 HB2 GLN 46 -1.514 -36.051 6.438 312 HB3 GLN 46 HB3 GLN 46 -0.351 -36.865 7.475 313 HG2 GLN 46 HG2 GLN 46 -3.167 -37.812 7.481 314 HG3 GLN 46 HG3 GLN 46 -2.140 -38.206 6.103 315 HE21 GLN 46 HE21 GLN 46 0.263 -38.662 7.200 316 HE22 GLN 46 HE22 GLN 46 0.198 -39.998 8.293 317 H PHE 47 H PHE 47 -0.467 -33.722 8.396 318 HA PHE 47 HA PHE 47 1.195 -34.475 10.709 319 HB2 PHE 47 HB2 PHE 47 2.274 -32.771 8.491 320 HB3 PHE 47 HB3 PHE 47 3.144 -33.780 9.643 321 HD1 PHE 47 HD1 PHE 47 2.717 -33.498 6.362 322 HD2 PHE 47 HD2 PHE 47 1.969 -36.372 9.411 323 HE1 PHE 47 HE1 PHE 47 2.833 -35.298 4.689 324 HE2 PHE 47 HE2 PHE 47 2.085 -38.177 7.743 325 HZ PHE 47 HZ PHE 47 2.518 -37.641 5.379 326 HA PRO 48 HA PRO 48 -0.864 -30.418 11.569 327 HB2 PRO 48 HB2 PRO 48 -1.441 -31.005 14.156 328 HB3 PRO 48 HB3 PRO 48 -2.497 -31.452 12.811 329 HG2 PRO 48 HG2 PRO 48 -0.500 -33.124 14.287 330 HG3 PRO 48 HG3 PRO 48 -2.139 -33.546 13.758 331 HD2 PRO 48 HD2 PRO 48 0.074 -34.319 12.403 332 HD3 PRO 48 HD3 PRO 48 -1.466 -33.968 11.594 333 H GLY 49 H GLY 49 0.376 -28.741 12.124 334 HA2 GLY 49 HA2 GLY 49 1.762 -27.493 13.560 335 HA3 GLY 49 HA3 GLY 49 2.239 -28.985 14.358 336 H ALA 50 H ALA 50 2.785 -30.282 11.738 337 HA ALA 50 HA ALA 50 5.514 -29.915 11.581 338 HB1 ALA 50 HB1 ALA 50 5.395 -31.028 9.390 339 HB2 ALA 50 HB2 ALA 50 4.409 -31.838 10.609 340 HB3 ALA 50 HB3 ALA 50 3.644 -30.815 9.393 341 H CYS 51 H CYS 51 6.733 -28.276 10.934 342 HA CYS 51 HA CYS 51 5.550 -26.129 9.366 343 HB2 CYS 51 HB2 CYS 51 7.135 -25.966 11.488 344 HB3 CYS 51 HB3 CYS 51 8.396 -26.067 10.265 345 HG CYS 51 HG CYS 51 7.949 -23.378 11.015 346 H GLY 52 H GLY 52 8.011 -28.615 9.091 347 HA2 GLY 52 HA2 GLY 52 8.076 -28.173 6.207 348 HA3 GLY 52 HA3 GLY 52 9.604 -28.016 7.061 349 H LEU 53 H LEU 53 8.767 -29.943 5.000 350 HA LEU 53 HA LEU 53 9.064 -32.435 6.545 351 HB2 LEU 53 HB2 LEU 53 8.044 -32.256 3.727 352 HB3 LEU 53 HB3 LEU 53 7.918 -33.607 4.851 353 HG LEU 53 HG LEU 53 5.763 -32.784 4.818 354 HD11 LEU 53 HD11 LEU 53 5.417 -32.351 6.989 355 HD12 LEU 53 HD12 LEU 53 6.468 -30.935 6.980 356 HD13 LEU 53 HD13 LEU 53 7.163 -32.548 7.134 357 HD21 LEU 53 HD21 LEU 53 5.098 -30.604 4.450 358 HD22 LEU 53 HD22 LEU 53 6.597 -30.690 3.524 359 HD23 LEU 53 HD23 LEU 53 6.584 -29.926 5.114 360 H ARG 54 H ARG 54 10.659 -33.871 5.997 361 HA ARG 54 HA ARG 54 12.664 -32.873 4.093 362 HB2 ARG 54 HB2 ARG 54 13.007 -33.555 6.700 363 HB3 ARG 54 HB3 ARG 54 13.390 -35.080 5.913 364 HG2 ARG 54 HG2 ARG 54 14.826 -33.368 4.396 365 HG3 ARG 54 HG3 ARG 54 14.875 -32.549 5.958 366 HD2 ARG 54 HD2 ARG 54 15.350 -35.441 6.076 367 HD3 ARG 54 HD3 ARG 54 16.569 -34.535 5.180 368 HE ARG 54 HE ARG 54 16.322 -33.102 7.445 369 HH11 ARG 54 HH11 ARG 54 16.807 -36.497 6.844 370 HH12 ARG 54 HH12 ARG 54 17.697 -36.762 8.306 371 HH21 ARG 54 HH21 ARG 54 17.493 -33.438 9.373 372 HH22 ARG 54 HH22 ARG 54 18.087 -35.022 9.745 373 H TYR 55 H TYR 55 13.954 -34.614 2.985 374 HA TYR 55 HA TYR 55 12.107 -36.674 1.992 375 HB2 TYR 55 HB2 TYR 55 13.884 -34.849 0.685 376 HB3 TYR 55 HB3 TYR 55 14.402 -36.494 0.333 377 HD1 TYR 55 HD1 TYR 55 12.446 -33.911 -0.843 378 HD2 TYR 55 HD2 TYR 55 12.272 -38.112 -0.192 379 HE1 TYR 55 HE1 TYR 55 10.680 -34.096 -2.545 380 HE2 TYR 55 HE2 TYR 55 10.506 -38.309 -1.892 381 HH TYR 55 HH TYR 55 9.502 -37.208 -3.640 382 H ARG 56 H ARG 56 12.520 -38.762 2.323 383 HA ARG 56 HA ARG 56 15.234 -39.543 3.153 384 HB2 ARG 56 HB2 ARG 56 14.087 -39.650 5.181 385 HB3 ARG 56 HB3 ARG 56 12.599 -40.199 4.422 386 HG2 ARG 56 HG2 ARG 56 13.740 -41.935 5.767 387 HG3 ARG 56 HG3 ARG 56 13.506 -42.386 4.077 388 HD2 ARG 56 HD2 ARG 56 15.848 -41.633 3.636 389 HD3 ARG 56 HD3 ARG 56 16.045 -41.411 5.374 390 HE ARG 56 HE ARG 56 15.158 -44.042 4.582 391 HH11 ARG 56 HH11 ARG 56 17.881 -41.979 5.252 392 HH12 ARG 56 HH12 ARG 56 18.959 -43.293 5.592 393 HH21 ARG 56 HH21 ARG 56 16.567 -45.780 5.028 394 HH22 ARG 56 HH22 ARG 56 18.210 -45.454 5.464 395 H ASN 57 H ASN 57 15.886 -40.501 1.289 396 HA ASN 57 HA ASN 57 14.233 -42.728 0.291 397 HB2 ASN 57 HB2 ASN 57 14.993 -40.494 -1.132 398 HB3 ASN 57 HB3 ASN 57 16.221 -41.672 -1.585 399 HD21 ASN 57 HD21 ASN 57 15.452 -41.784 -3.689 400 HD22 ASN 57 HD22 ASN 57 13.984 -42.601 -4.089 401 HA PRO 58 HA PRO 58 17.599 -45.362 1.375 402 HB2 PRO 58 HB2 PRO 58 16.942 -47.498 -0.167 403 HB3 PRO 58 HB3 PRO 58 16.070 -47.076 1.312 404 HG2 PRO 58 HG2 PRO 58 15.352 -46.507 -1.538 405 HG3 PRO 58 HG3 PRO 58 14.314 -47.062 -0.212 406 HD2 PRO 58 HD2 PRO 58 14.390 -44.478 -1.017 407 HD3 PRO 58 HD3 PRO 58 14.092 -44.944 0.670 408 H VAL 59 H VAL 59 16.830 -44.736 -2.010 409 HA VAL 59 HA VAL 59 19.383 -45.696 -2.955 410 HB VAL 59 HB VAL 59 18.662 -44.890 -5.153 411 HG11 VAL 59 HG11 VAL 59 16.478 -46.237 -5.255 412 HG12 VAL 59 HG12 VAL 59 17.940 -47.068 -4.721 413 HG13 VAL 59 HG13 VAL 59 16.744 -46.536 -3.538 414 HG21 VAL 59 HG21 VAL 59 17.403 -43.028 -5.095 415 HG22 VAL 59 HG22 VAL 59 16.054 -44.158 -4.972 416 HG23 VAL 59 HG23 VAL 59 16.718 -43.416 -3.517 417 H SER 60 H SER 60 17.928 -42.633 -2.104 418 HA SER 60 HA SER 60 20.118 -41.087 -3.200 419 HB2 SER 60 HB2 SER 60 18.714 -39.332 -3.030 420 HB3 SER 60 HB3 SER 60 17.472 -40.520 -2.634 421 HG SER 60 HG SER 60 17.544 -38.926 -1.041 422 H GLN 61 H GLN 61 19.136 -42.408 -0.132 423 HA GLN 61 HA GLN 61 20.184 -42.555 1.881 424 HB2 GLN 61 HB2 GLN 61 22.656 -41.481 0.531 425 HB3 GLN 61 HB3 GLN 61 22.563 -42.507 1.956 426 HG2 GLN 61 HG2 GLN 61 21.264 -43.928 -0.064 427 HG3 GLN 61 HG3 GLN 61 22.698 -43.234 -0.818 428 HE21 GLN 61 HE21 GLN 61 21.610 -45.105 1.968 429 HE22 GLN 61 HE22 GLN 61 23.065 -46.018 2.151 430 H CYS 62 H CYS 62 18.679 -40.303 1.484 431 HA CYS 62 HA CYS 62 18.243 -38.277 2.420 432 HB2 CYS 62 HB2 CYS 62 19.594 -39.526 4.336 433 HB3 CYS 62 HB3 CYS 62 20.790 -38.287 3.974 434 HG CYS 62 HG CYS 62 18.205 -36.519 4.193 435 H MET 63 H MET 63 18.389 -36.619 1.068 436 HA MET 63 HA MET 63 20.706 -35.018 0.877 437 HB2 MET 63 HB2 MET 63 20.791 -37.210 -0.827 438 HB3 MET 63 HB3 MET 63 20.228 -35.900 -1.857 439 HG2 MET 63 HG2 MET 63 22.224 -34.606 -0.740 440 HG3 MET 63 HG3 MET 63 22.828 -36.237 -0.462 441 HE1 MET 63 HE1 MET 63 21.219 -33.905 -2.800 442 HE2 MET 63 HE2 MET 63 22.336 -33.811 -4.162 443 HE3 MET 63 HE3 MET 63 21.010 -34.974 -4.188 444 H ARG 64 H ARG 64 17.643 -35.991 -0.560 445 HA ARG 64 HA ARG 64 17.173 -33.369 -1.690 446 HB2 ARG 64 HB2 ARG 64 16.210 -35.951 -2.194 447 HB3 ARG 64 HB3 ARG 64 14.830 -35.060 -1.568 448 HG2 ARG 64 HG2 ARG 64 15.858 -33.280 -3.347 449 HG3 ARG 64 HG3 ARG 64 16.225 -34.820 -4.127 450 HD2 ARG 64 HD2 ARG 64 13.592 -35.008 -3.135 451 HD3 ARG 64 HD3 ARG 64 13.726 -33.441 -3.933 452 HE ARG 64 HE ARG 64 13.928 -34.515 -5.954 453 HH11 ARG 64 HH11 ARG 64 14.275 -36.817 -3.366 454 HH12 ARG 64 HH12 ARG 64 14.212 -38.198 -4.411 455 HH21 ARG 64 HH21 ARG 64 13.844 -36.325 -7.340 456 HH22 ARG 64 HH22 ARG 64 13.967 -37.917 -6.671 457 H GLY 65 H GLY 65 14.630 -32.742 -1.254 458 HA2 GLY 65 HA2 GLY 65 13.678 -33.006 1.388 459 HA3 GLY 65 HA3 GLY 65 14.622 -31.529 1.265 460 H VAL 66 H VAL 66 11.595 -32.480 1.376 461 HA VAL 66 HA VAL 66 10.293 -31.454 -0.869 462 HB VAL 66 HB VAL 66 9.322 -31.497 1.992 463 HG11 VAL 66 HG11 VAL 66 7.757 -31.243 -0.575 464 HG12 VAL 66 HG12 VAL 66 7.079 -31.363 1.050 465 HG13 VAL 66 HG13 VAL 66 8.034 -29.952 0.594 466 HG21 VAL 66 HG21 VAL 66 9.510 -33.532 -0.144 467 HG22 VAL 66 HG22 VAL 66 9.564 -33.718 1.609 468 HG23 VAL 66 HG23 VAL 66 8.016 -33.504 0.792 469 H ARG 67 H ARG 67 10.000 -29.462 -1.621 470 HA ARG 67 HA ARG 67 11.060 -27.209 -0.163 471 HB2 ARG 67 HB2 ARG 67 11.470 -27.326 -2.541 472 HB3 ARG 67 HB3 ARG 67 9.747 -27.428 -2.875 473 HG2 ARG 67 HG2 ARG 67 10.489 -25.215 -3.371 474 HG3 ARG 67 HG3 ARG 67 9.482 -25.152 -1.923 475 HD2 ARG 67 HD2 ARG 67 11.901 -25.497 -0.796 476 HD3 ARG 67 HD3 ARG 67 12.368 -24.630 -2.259 477 HE ARG 67 HE ARG 67 10.188 -23.354 -0.961 478 HH11 ARG 67 HH11 ARG 67 13.635 -23.815 -0.784 479 HH12 ARG 67 HH12 ARG 67 13.924 -22.319 0.041 480 HH21 ARG 67 HH21 ARG 67 10.556 -21.382 0.125 481 HH22 ARG 67 HH22 ARG 67 12.172 -20.936 0.558 482 H LEU 68 H LEU 68 9.939 -25.498 0.687 483 HA LEU 68 HA LEU 68 7.001 -25.700 0.682 484 HB2 LEU 68 HB2 LEU 68 7.786 -26.469 2.818 485 HB3 LEU 68 HB3 LEU 68 8.823 -25.055 2.992 486 HG LEU 68 HG LEU 68 6.596 -25.196 4.318 487 HD11 LEU 68 HD11 LEU 68 7.036 -23.060 4.728 488 HD12 LEU 68 HD12 LEU 68 6.542 -22.583 3.104 489 HD13 LEU 68 HD13 LEU 68 8.199 -23.108 3.403 490 HD21 LEU 68 HD21 LEU 68 4.629 -24.788 3.266 491 HD22 LEU 68 HD22 LEU 68 5.461 -25.599 1.939 492 HD23 LEU 68 HD23 LEU 68 5.380 -23.838 1.985 493 H VAL 69 H VAL 69 6.099 -23.967 -0.189 494 HA VAL 69 HA VAL 69 7.278 -21.330 0.313 495 HB VAL 69 HB VAL 69 8.136 -21.849 -1.854 496 HG11 VAL 69 HG11 VAL 69 7.117 -23.408 -3.070 497 HG12 VAL 69 HG12 VAL 69 5.618 -23.226 -2.157 498 HG13 VAL 69 HG13 VAL 69 5.943 -22.180 -3.540 499 HG21 VAL 69 HG21 VAL 69 7.348 -20.024 -3.087 500 HG22 VAL 69 HG22 VAL 69 5.709 -20.188 -2.456 501 HG23 VAL 69 HG23 VAL 69 7.000 -19.593 -1.413 502 H GLU 70 H GLU 70 5.787 -19.979 1.055 503 HA GLU 70 HA GLU 70 3.783 -19.026 1.556 504 HB2 GLU 70 HB2 GLU 70 2.939 -20.208 -1.096 505 HB3 GLU 70 HB3 GLU 70 2.083 -18.952 -0.213 506 HG2 GLU 70 HG2 GLU 70 4.668 -17.978 -0.470 507 HG3 GLU 70 HG3 GLU 70 4.320 -18.740 -2.021 508 H GLY 71 H GLY 71 4.363 -21.822 2.336 509 HA2 GLY 71 HA2 GLY 71 3.142 -23.187 3.802 510 HA3 GLY 71 HA3 GLY 71 1.654 -22.494 3.174 511 H ILE 72 H ILE 72 2.585 -22.981 0.375 512 HA ILE 72 HA ILE 72 1.517 -25.648 0.150 513 HB ILE 72 HB ILE 72 2.535 -23.773 -1.989 514 HG12 ILE 72 HG12 ILE 72 -0.286 -24.217 -2.065 515 HG13 ILE 72 HG13 ILE 72 0.155 -23.750 -0.426 516 HG21 ILE 72 HG21 ILE 72 0.782 -25.463 -3.207 517 HG22 ILE 72 HG22 ILE 72 2.535 -25.637 -3.234 518 HG23 ILE 72 HG23 ILE 72 1.578 -26.540 -2.060 519 HD11 ILE 72 HD11 ILE 72 1.532 -22.021 -2.168 520 HD12 ILE 72 HD12 ILE 72 -0.134 -22.123 -2.739 521 HD13 ILE 72 HD13 ILE 72 0.200 -21.643 -1.076 522 H LEU 73 H LEU 73 2.686 -27.439 0.198 523 HA LEU 73 HA LEU 73 5.556 -27.357 0.080 524 HB2 LEU 73 HB2 LEU 73 3.535 -29.546 0.434 525 HB3 LEU 73 HB3 LEU 73 5.250 -29.900 0.235 526 HG LEU 73 HG LEU 73 4.680 -29.958 2.573 527 HD11 LEU 73 HD11 LEU 73 6.876 -29.057 1.936 528 HD12 LEU 73 HD12 LEU 73 6.277 -28.359 3.440 529 HD13 LEU 73 HD13 LEU 73 6.197 -27.429 1.944 530 HD21 LEU 73 HD21 LEU 73 3.460 -28.399 3.695 531 HD22 LEU 73 HD22 LEU 73 2.760 -28.191 2.090 532 HD23 LEU 73 HD23 LEU 73 3.996 -27.072 2.664 533 H HIS 74 H HIS 74 6.578 -27.186 -1.800 534 HA HIS 74 HA HIS 74 5.395 -28.099 -4.264 535 HB2 HIS 74 HB2 HIS 74 7.278 -26.162 -3.575 536 HB3 HIS 74 HB3 HIS 74 8.205 -27.379 -4.446 537 HD1 HIS 74 HD1 HIS 74 6.740 -28.148 -6.787 538 HD2 HIS 74 HD2 HIS 74 6.360 -24.295 -5.280 539 HE1 HIS 74 HE1 HIS 74 5.892 -26.757 -8.703 540 H ALA 75 H ALA 75 6.279 -29.665 -5.674 541 HA ALA 75 HA ALA 75 7.688 -31.812 -4.262 542 HB1 ALA 75 HB1 ALA 75 5.909 -31.750 -6.670 543 HB2 ALA 75 HB2 ALA 75 6.970 -33.125 -6.361 544 HB3 ALA 75 HB3 ALA 75 5.737 -32.679 -5.181 545 HA PRO 76 HA PRO 76 11.425 -31.340 -6.516 546 HB2 PRO 76 HB2 PRO 76 12.218 -33.922 -6.791 547 HB3 PRO 76 HB3 PRO 76 12.271 -33.060 -5.249 548 HG2 PRO 76 HG2 PRO 76 10.225 -34.993 -6.268 549 HG3 PRO 76 HG3 PRO 76 10.946 -34.876 -4.653 550 HD2 PRO 76 HD2 PRO 76 8.489 -33.893 -5.226 551 HD3 PRO 76 HD3 PRO 76 9.558 -33.147 -4.021 552 H ASP 77 H ASP 77 12.646 -32.579 -8.438 553 HA ASP 77 HA ASP 77 10.941 -32.236 -10.728 554 HB2 ASP 77 HB2 ASP 77 13.861 -32.791 -10.321 555 HB3 ASP 77 HB3 ASP 77 13.142 -32.997 -11.916 556 H ALA 78 H ALA 78 11.401 -34.761 -8.675 557 HA ALA 78 HA ALA 78 11.016 -36.784 -10.780 558 HB1 ALA 78 HB1 ALA 78 12.065 -38.352 -9.477 559 HB2 ALA 78 HB2 ALA 78 12.931 -36.894 -8.990 560 HB3 ALA 78 HB3 ALA 78 11.647 -37.539 -7.968 561 H GLY 79 H GLY 79 9.583 -35.241 -8.036 562 HA2 GLY 79 HA2 GLY 79 7.145 -35.290 -7.923 563 HA3 GLY 79 HA3 GLY 79 7.227 -36.994 -8.346 564 H TRP 80 H TRP 80 5.731 -36.602 -6.273 565 HA TRP 80 HA TRP 80 6.999 -36.352 -3.764 566 HB2 TRP 80 HB2 TRP 80 4.367 -37.598 -4.569 567 HB3 TRP 80 HB3 TRP 80 4.883 -37.428 -2.894 568 HD1 TRP 80 HD1 TRP 80 2.812 -35.723 -5.314 569 HE1 TRP 80 HE1 TRP 80 2.463 -33.249 -4.699 570 HE3 TRP 80 HE3 TRP 80 6.527 -35.219 -1.839 571 HZ2 TRP 80 HZ2 TRP 80 3.611 -31.336 -2.970 572 HZ3 TRP 80 HZ3 TRP 80 6.835 -33.034 -0.751 573 HH2 TRP 80 HH2 TRP 80 5.407 -31.133 -1.307 574 H GLY 81 H GLY 81 5.710 -39.275 -5.369 575 HA2 GLY 81 HA2 GLY 81 6.685 -41.390 -5.464 576 HA3 GLY 81 HA3 GLY 81 7.976 -40.816 -4.419 577 H ASN 82 H ASN 82 7.656 -42.941 -3.394 578 HA ASN 82 HA ASN 82 5.516 -42.794 -1.376 579 HB2 ASN 82 HB2 ASN 82 6.539 -45.450 -2.297 580 HB3 ASN 82 HB3 ASN 82 4.973 -45.034 -1.609 581 HD21 ASN 82 HD21 ASN 82 4.082 -43.045 -3.164 582 HD22 ASN 82 HD22 ASN 82 3.894 -43.577 -4.796 583 H LEU 83 H LEU 83 8.221 -41.837 -1.175 584 HA LEU 83 HA LEU 83 9.601 -43.784 0.490 585 HB2 LEU 83 HB2 LEU 83 11.295 -41.892 0.668 586 HB3 LEU 83 HB3 LEU 83 11.074 -42.644 -0.910 587 HG LEU 83 HG LEU 83 11.307 -40.078 -0.761 588 HD11 LEU 83 HD11 LEU 83 8.925 -40.457 -2.338 589 HD12 LEU 83 HD12 LEU 83 10.041 -41.806 -2.542 590 HD13 LEU 83 HD13 LEU 83 10.583 -40.158 -2.858 591 HD21 LEU 83 HD21 LEU 83 8.376 -40.330 -0.106 592 HD22 LEU 83 HD22 LEU 83 9.296 -38.846 -0.350 593 HD23 LEU 83 HD23 LEU 83 9.616 -39.861 1.057 594 H VAL 84 H VAL 84 10.792 -42.420 2.428 595 HA VAL 84 HA VAL 84 8.562 -41.645 4.151 596 HB VAL 84 HB VAL 84 11.402 -41.984 5.069 597 HG11 VAL 84 HG11 VAL 84 9.956 -41.046 6.710 598 HG12 VAL 84 HG12 VAL 84 8.700 -42.239 6.375 599 HG13 VAL 84 HG13 VAL 84 10.207 -42.736 7.145 600 HG21 VAL 84 HG21 VAL 84 10.393 -44.381 5.658 601 HG22 VAL 84 HG22 VAL 84 9.499 -44.070 4.170 602 HG23 VAL 84 HG23 VAL 84 11.262 -44.061 4.157 603 H TYR 85 H TYR 85 8.837 -39.829 5.644 604 HA TYR 85 HA TYR 85 10.616 -37.721 4.633 605 HB2 TYR 85 HB2 TYR 85 8.949 -36.235 4.229 606 HB3 TYR 85 HB3 TYR 85 7.986 -37.692 4.016 607 HD1 TYR 85 HD1 TYR 85 6.268 -38.280 5.576 608 HD2 TYR 85 HD2 TYR 85 8.794 -34.940 6.328 609 HE1 TYR 85 HE1 TYR 85 4.755 -37.548 7.371 610 HE2 TYR 85 HE2 TYR 85 7.288 -34.199 8.126 611 HH TYR 85 HH TYR 85 4.910 -34.477 8.767 612 H VAL 86 H VAL 86 11.314 -36.219 6.160 613 HA VAL 86 HA VAL 86 10.803 -36.990 8.958 614 HB VAL 86 HB VAL 86 13.232 -35.598 7.821 615 HG11 VAL 86 HG11 VAL 86 12.711 -34.964 10.139 616 HG12 VAL 86 HG12 VAL 86 12.727 -36.669 10.596 617 HG13 VAL 86 HG13 VAL 86 14.205 -35.894 10.024 618 HG21 VAL 86 HG21 VAL 86 12.581 -38.444 8.338 619 HG22 VAL 86 HG22 VAL 86 13.612 -37.724 7.102 620 HG23 VAL 86 HG23 VAL 86 14.204 -37.894 8.754 621 H VAL 87 H VAL 87 9.604 -35.609 10.071 622 HA VAL 87 HA VAL 87 8.759 -33.110 9.159 623 HB VAL 87 HB VAL 87 8.103 -32.705 11.577 624 HG11 VAL 87 HG11 VAL 87 6.499 -33.605 10.060 625 HG12 VAL 87 HG12 VAL 87 7.230 -35.209 10.147 626 HG13 VAL 87 HG13 VAL 87 6.399 -34.539 11.552 627 HG21 VAL 87 HG21 VAL 87 9.988 -34.245 12.392 628 HG22 VAL 87 HG22 VAL 87 8.427 -34.349 13.206 629 HG23 VAL 87 HG23 VAL 87 8.885 -35.568 12.016 630 H ASN 88 H ASN 88 9.127 -30.998 10.217 631 HA ASN 88 HA ASN 88 11.750 -30.657 11.445 632 HB2 ASN 88 HB2 ASN 88 12.285 -30.415 9.107 633 HB3 ASN 88 HB3 ASN 88 10.922 -29.328 8.859 634 HD21 ASN 88 HD21 ASN 88 12.004 -27.558 8.192 635 HD22 ASN 88 HD22 ASN 88 13.138 -26.689 9.164 636 H TYR 89 H TYR 89 10.646 -30.028 13.311 637 HA TYR 89 HA TYR 89 10.090 -27.279 13.551 638 HB2 TYR 89 HB2 TYR 89 7.721 -27.252 13.911 639 HB3 TYR 89 HB3 TYR 89 8.008 -28.019 12.353 640 HD1 TYR 89 HD1 TYR 89 8.117 -30.627 12.372 641 HD2 TYR 89 HD2 TYR 89 6.343 -28.296 15.458 642 HE1 TYR 89 HE1 TYR 89 6.810 -32.583 13.089 643 HE2 TYR 89 HE2 TYR 89 5.031 -30.246 16.184 644 HH TYR 89 HH TYR 89 4.734 -32.456 15.952 645 HA PRO 90 HA PRO 90 10.837 -28.255 17.765 646 HB2 PRO 90 HB2 PRO 90 9.596 -26.183 19.005 647 HB3 PRO 90 HB3 PRO 90 11.109 -26.000 18.111 648 HG2 PRO 90 HG2 PRO 90 8.309 -25.395 17.240 649 HG3 PRO 90 HG3 PRO 90 9.787 -24.447 16.993 650 HD2 PRO 90 HD2 PRO 90 8.723 -26.016 15.060 651 HD3 PRO 90 HD3 PRO 90 10.470 -25.741 15.212 652 H LYS 91 H LYS 91 9.586 -28.253 19.974 653 HA LYS 91 HA LYS 91 7.578 -30.199 19.814 654 HB2 LYS 91 HB2 LYS 91 9.126 -29.553 21.789 655 HB3 LYS 91 HB3 LYS 91 7.883 -28.372 22.182 656 HG2 LYS 91 HG2 LYS 91 7.163 -30.091 23.469 657 HG3 LYS 91 HG3 LYS 91 6.320 -30.501 21.973 658 HD2 LYS 91 HD2 LYS 91 8.430 -31.879 21.423 659 HD3 LYS 91 HD3 LYS 91 8.795 -31.728 23.144 660 HE2 LYS 91 HE2 LYS 91 7.525 -33.546 23.414 661 HE3 LYS 91 HE3 LYS 91 6.149 -32.479 23.136 662 HZ1 LYS 91 HZ1 LYS 91 6.736 -33.025 20.646 663 HZ2 LYS 91 HZ2 LYS 91 5.751 -34.048 21.564 664 HZ3 LYS 91 HZ3 LYS 91 7.384 -34.426 21.338 665 H ASP 92 H ASP 92 5.684 -29.837 18.841 666 HA ASP 92 HA ASP 92 3.853 -27.945 19.985 667 HB2 ASP 92 HB2 ASP 92 5.326 -26.732 18.178 668 HB3 ASP 92 HB3 ASP 92 4.274 -27.573 17.043 669 H ASN 93 H ASN 93 1.686 -28.077 18.916 670 HA ASN 93 HA ASN 93 1.128 -30.238 17.140 671 HB2 ASN 93 HB2 ASN 93 -0.383 -31.369 18.963 672 HB3 ASN 93 HB3 ASN 93 1.329 -31.771 18.865 673 HD21 ASN 93 HD21 ASN 93 2.649 -31.293 20.536 674 HD22 ASN 93 HD22 ASN 93 2.120 -30.567 22.012 675 H LYS 94 H LYS 94 -0.296 -28.308 19.773 676 HA LYS 94 HA LYS 94 -2.222 -27.103 19.910 677 HB2 LYS 94 HB2 LYS 94 -1.472 -26.758 17.017 678 HB3 LYS 94 HB3 LYS 94 -2.907 -25.992 17.685 679 HG2 LYS 94 HG2 LYS 94 -1.574 -24.757 19.263 680 HG3 LYS 94 HG3 LYS 94 -0.116 -25.607 18.745 681 HD2 LYS 94 HD2 LYS 94 -0.076 -24.522 16.677 682 HD3 LYS 94 HD3 LYS 94 -1.770 -24.039 16.795 683 HE2 LYS 94 HE2 LYS 94 -1.089 -22.599 18.756 684 HE3 LYS 94 HE3 LYS 94 0.584 -22.935 18.313 685 HZ1 LYS 94 HZ1 LYS 94 -1.325 -21.167 17.076 686 HZ2 LYS 94 HZ2 LYS 94 -0.495 -22.144 15.973 687 HZ3 LYS 94 HZ3 LYS 94 0.366 -21.139 17.026 688 H ARG 95 H ARG 95 -3.486 -28.942 20.468 689 HA ARG 95 HA ARG 95 -5.255 -30.361 20.289 690 HB2 ARG 95 HB2 ARG 95 -5.880 -28.422 18.067 691 HB3 ARG 95 HB3 ARG 95 -6.965 -29.735 18.503 692 HG2 ARG 95 HG2 ARG 95 -7.825 -28.529 20.144 693 HG3 ARG 95 HG3 ARG 95 -6.228 -28.304 20.861 694 HD2 ARG 95 HD2 ARG 95 -6.766 -26.127 20.445 695 HD3 ARG 95 HD3 ARG 95 -5.994 -26.536 18.913 696 HE ARG 95 HE ARG 95 -8.580 -27.115 18.439 697 HH11 ARG 95 HH11 ARG 95 -6.996 -24.309 19.758 698 HH12 ARG 95 HH12 ARG 95 -8.185 -23.197 19.165 699 HH21 ARG 95 HH21 ARG 95 -10.152 -25.661 17.653 700 HH22 ARG 95 HH22 ARG 95 -9.980 -23.967 17.968 701 H LYS 96 H LYS 96 -3.942 -32.155 19.764 702 HA LYS 96 HA LYS 96 -3.792 -32.853 16.916 703 HB2 LYS 96 HB2 LYS 96 -2.169 -34.590 17.663 704 HB3 LYS 96 HB3 LYS 96 -1.657 -32.946 18.024 705 HG2 LYS 96 HG2 LYS 96 -2.259 -33.201 20.330 706 HG3 LYS 96 HG3 LYS 96 -2.975 -34.783 20.011 707 HD2 LYS 96 HD2 LYS 96 -0.817 -35.699 19.451 708 HD3 LYS 96 HD3 LYS 96 -0.065 -34.108 19.587 709 HE2 LYS 96 HE2 LYS 96 -0.775 -34.075 21.987 710 HE3 LYS 96 HE3 LYS 96 -1.294 -35.749 21.796 711 HZ1 LYS 96 HZ1 LYS 96 0.786 -36.198 22.448 712 HZ2 LYS 96 HZ2 LYS 96 1.372 -34.663 22.047 713 HZ3 LYS 96 HZ3 LYS 96 1.209 -35.845 20.848 714 H MET 97 H MET 97 -4.817 -34.603 16.092 715 HA MET 97 HA MET 97 -7.016 -35.694 17.486 716 HB2 MET 97 HB2 MET 97 -6.224 -35.572 14.853 717 HB3 MET 97 HB3 MET 97 -6.056 -37.283 15.220 718 HG2 MET 97 HG2 MET 97 -8.544 -36.251 16.238 719 HG3 MET 97 HG3 MET 97 -8.377 -35.925 14.515 720 HE1 MET 97 HE1 MET 97 -8.936 -37.546 12.737 721 HE2 MET 97 HE2 MET 97 -9.841 -39.002 13.148 722 HE3 MET 97 HE3 MET 97 -10.371 -37.433 13.757 723 H ASP 98 H ASP 98 -7.397 -37.967 17.962 724 HA ASP 98 HA ASP 98 -5.066 -39.157 19.239 725 HB2 ASP 98 HB2 ASP 98 -6.749 -40.704 20.256 726 HB3 ASP 98 HB3 ASP 98 -7.038 -39.003 20.611 727 H GLU 99 H GLU 99 -4.323 -39.528 16.884 728 HA GLU 99 HA GLU 99 -4.657 -42.327 16.337 729 HB2 GLU 99 HB2 GLU 99 -6.620 -41.307 15.178 730 HB3 GLU 99 HB3 GLU 99 -5.503 -40.363 14.202 731 HG2 GLU 99 HG2 GLU 99 -4.529 -42.467 13.350 732 HG3 GLU 99 HG3 GLU 99 -5.746 -43.362 14.258 733 H THR 100 H THR 100 -2.462 -42.524 16.578 734 HA THR 100 HA THR 100 -0.863 -41.629 14.323 735 HB THR 100 HB THR 100 0.114 -41.048 17.119 736 HG1 THR 100 HG1 THR 100 -0.342 -38.826 16.523 737 HG21 THR 100 HG21 THR 100 1.187 -40.750 14.376 738 HG22 THR 100 HG22 THR 100 2.029 -41.053 15.897 739 HG23 THR 100 HG23 THR 100 1.497 -39.421 15.492 740 H ASP 101 H ASP 101 -0.771 -43.248 17.491 741 HA ASP 101 HA ASP 101 0.237 -45.162 18.198 742 HB2 ASP 101 HB2 ASP 101 -1.105 -45.753 15.826 743 HB3 ASP 101 HB3 ASP 101 0.485 -46.483 15.622 744 H ALA 102 H ALA 102 2.079 -46.868 17.289 745 HA ALA 102 HA ALA 102 4.310 -47.161 16.945 746 HB1 ALA 102 HB1 ALA 102 5.284 -46.174 15.086 747 HB2 ALA 102 HB2 ALA 102 3.563 -46.114 14.704 748 HB3 ALA 102 HB3 ALA 102 4.387 -44.669 15.289 749 H SER 103 H SER 103 6.510 -45.927 17.090 750 HA SER 103 HA SER 103 6.681 -43.487 18.469 751 HB2 SER 103 HB2 SER 103 5.747 -44.406 20.408 752 HB3 SER 103 HB3 SER 103 6.536 -45.965 20.165 753 HG SER 103 HG SER 103 7.738 -43.526 20.969 754 H SER 104 H SER 104 8.696 -42.759 18.231 755 HA SER 104 HA SER 104 10.696 -44.462 17.082 756 HB2 SER 104 HB2 SER 104 11.726 -41.903 17.953 757 HB3 SER 104 HB3 SER 104 11.520 -42.522 16.315 758 HG SER 104 HG SER 104 9.784 -41.360 16.124 759 H ALA 105 H ALA 105 12.955 -44.488 17.934 760 HA ALA 105 HA ALA 105 12.890 -45.011 20.821 761 HB1 ALA 105 HB1 ALA 105 15.286 -45.852 19.384 762 HB2 ALA 105 HB2 ALA 105 14.225 -46.766 20.457 763 HB3 ALA 105 HB3 ALA 105 13.800 -46.567 18.757 764 H VAL 106 H VAL 106 15.286 -43.828 18.451 765 HA VAL 106 HA VAL 106 15.809 -41.450 19.947 766 HB VAL 106 HB VAL 106 17.034 -42.977 21.383 767 HG11 VAL 106 HG11 VAL 106 18.122 -44.761 20.626 768 HG12 VAL 106 HG12 VAL 106 17.586 -44.338 18.999 769 HG13 VAL 106 HG13 VAL 106 19.143 -43.761 19.594 770 HG21 VAL 106 HG21 VAL 106 18.982 -41.747 21.533 771 HG22 VAL 106 HG22 VAL 106 19.176 -41.641 19.783 772 HG23 VAL 106 HG23 VAL 106 17.950 -40.667 20.595 773 H LYS 107 H LYS 107 16.442 -39.945 18.550 774 HA LYS 107 HA LYS 107 18.376 -40.367 16.521 775 HB2 LYS 107 HB2 LYS 107 15.684 -41.030 15.833 776 HB3 LYS 107 HB3 LYS 107 16.139 -39.579 14.950 777 HG2 LYS 107 HG2 LYS 107 18.223 -41.593 14.888 778 HG3 LYS 107 HG3 LYS 107 16.695 -42.183 14.232 779 HD2 LYS 107 HD2 LYS 107 16.627 -40.054 12.856 780 HD3 LYS 107 HD3 LYS 107 18.302 -39.796 13.348 781 HE2 LYS 107 HE2 LYS 107 17.780 -42.486 12.338 782 HE3 LYS 107 HE3 LYS 107 17.474 -41.219 11.151 783 HZ1 LYS 107 HZ1 LYS 107 19.862 -40.566 12.375 784 HZ2 LYS 107 HZ2 LYS 107 19.647 -41.156 10.804 785 HZ3 LYS 107 HZ3 LYS 107 19.951 -42.229 12.076 786 H VAL 108 H VAL 108 19.116 -38.449 15.662 787 HA VAL 108 HA VAL 108 17.667 -36.011 15.737 788 HB VAL 108 HB VAL 108 18.073 -36.158 18.140 789 HG11 VAL 108 HG11 VAL 108 20.969 -35.782 17.987 790 HG12 VAL 108 HG12 VAL 108 20.010 -36.782 19.079 791 HG13 VAL 108 HG13 VAL 108 20.426 -37.378 17.472 792 HG21 VAL 108 HG21 VAL 108 18.286 -33.980 16.737 793 HG22 VAL 108 HG22 VAL 108 18.768 -33.971 18.433 794 HG23 VAL 108 HG23 VAL 108 19.993 -34.081 17.169 795 H LYS 109 H LYS 109 18.718 -34.360 14.646 796 HA LYS 109 HA LYS 109 21.510 -34.641 13.926 797 HB2 LYS 109 HB2 LYS 109 20.077 -36.008 12.281 798 HB3 LYS 109 HB3 LYS 109 19.505 -34.454 11.689 799 HG2 LYS 109 HG2 LYS 109 22.360 -34.420 11.833 800 HG3 LYS 109 HG3 LYS 109 21.826 -35.847 10.941 801 HD2 LYS 109 HD2 LYS 109 20.854 -34.606 9.272 802 HD3 LYS 109 HD3 LYS 109 20.558 -33.222 10.326 803 HE2 LYS 109 HE2 LYS 109 22.904 -32.646 10.292 804 HE3 LYS 109 HE3 LYS 109 23.278 -34.094 9.358 805 HZ1 LYS 109 HZ1 LYS 109 23.153 -32.046 8.011 806 HZ2 LYS 109 HZ2 LYS 109 21.514 -31.905 8.406 807 HZ3 LYS 109 HZ3 LYS 109 22.057 -33.233 7.510 808 H ARG 110 H ARG 110 22.414 -32.737 13.044 809 HA ARG 110 HA ARG 110 20.781 -30.422 12.563 810 HB2 ARG 110 HB2 ARG 110 21.848 -29.057 14.363 811 HB3 ARG 110 HB3 ARG 110 20.759 -30.302 14.959 812 HG2 ARG 110 HG2 ARG 110 22.613 -31.704 15.571 813 HG3 ARG 110 HG3 ARG 110 23.754 -30.574 14.840 814 HD2 ARG 110 HD2 ARG 110 23.793 -30.202 17.191 815 HD3 ARG 110 HD3 ARG 110 22.940 -28.845 16.458 816 HE ARG 110 HE ARG 110 21.206 -30.961 17.341 817 HH11 ARG 110 HH11 ARG 110 22.896 -28.064 18.274 818 HH12 ARG 110 HH12 ARG 110 21.828 -27.709 19.591 819 HH21 ARG 110 HH21 ARG 110 19.793 -30.504 19.072 820 HH22 ARG 110 HH22 ARG 110 20.063 -29.098 20.044 821 H ALA 111 H ALA 111 22.273 -28.428 12.288 822 HA ALA 111 HA ALA 111 24.775 -29.311 11.003 823 HB1 ALA 111 HB1 ALA 111 24.285 -28.201 9.119 824 HB2 ALA 111 HB2 ALA 111 22.622 -28.262 9.705 825 HB3 ALA 111 HB3 ALA 111 23.605 -26.826 9.990 826 H VAL 112 H VAL 112 25.932 -26.934 10.432 827 HA VAL 112 HA VAL 112 26.303 -25.707 13.088 828 HB VAL 112 HB VAL 112 28.613 -25.252 12.489 829 HG11 VAL 112 HG11 VAL 112 28.891 -27.980 11.788 830 HG12 VAL 112 HG12 VAL 112 29.065 -27.235 13.378 831 HG13 VAL 112 HG13 VAL 112 27.494 -27.844 12.856 832 HG21 VAL 112 HG21 VAL 112 27.701 -26.181 9.833 833 HG22 VAL 112 HG22 VAL 112 28.874 -24.935 10.258 834 HG23 VAL 112 HG23 VAL 112 29.334 -26.636 10.316 835 H GLN 113 H GLN 113 27.420 -23.468 12.840 836 HA GLN 113 HA GLN 113 27.207 -21.283 12.244 837 HB2 GLN 113 HB2 GLN 113 27.818 -22.645 9.930 838 HB3 GLN 113 HB3 GLN 113 26.376 -21.748 9.475 839 HG2 GLN 113 HG2 GLN 113 27.403 -19.735 9.628 840 HG3 GLN 113 HG3 GLN 113 28.488 -20.261 10.915 841 HE21 GLN 113 HE21 GLN 113 30.085 -21.991 10.173 842 HE22 GLN 113 HE22 GLN 113 30.863 -21.701 8.658 843 H LYS 114 H LYS 114 25.632 -19.675 11.121 844 HA LYS 114 HA LYS 114 23.009 -20.259 12.160 845 HB2 LYS 114 HB2 LYS 114 24.193 -18.019 12.320 846 HB3 LYS 114 HB3 LYS 114 23.850 -17.811 10.607 847 HG2 LYS 114 HG2 LYS 114 22.067 -16.714 11.484 848 HG3 LYS 114 HG3 LYS 114 21.387 -18.340 11.399 849 HD2 LYS 114 HD2 LYS 114 20.880 -17.968 13.564 850 HD3 LYS 114 HD3 LYS 114 22.565 -18.419 13.833 851 HE2 LYS 114 HE2 LYS 114 23.207 -16.282 14.276 852 HE3 LYS 114 HE3 LYS 114 22.012 -15.581 13.185 853 HZ1 LYS 114 HZ1 LYS 114 20.530 -16.738 15.166 854 HZ2 LYS 114 HZ2 LYS 114 20.866 -15.088 15.007 855 HZ3 LYS 114 HZ3 LYS 114 21.838 -16.057 15.996
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