NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
22458 | 2joq | 15190 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLN 1 HT1 GLN 1 2.220 -0.049 0.948 2 2H GLN 1 HT2 GLN 1 1.069 -1.087 0.271 3 3H GLN 1 HT3 GLN 1 0.698 0.546 0.513 4 HA GLN 1 HA GLN 1 1.185 -0.055 -1.813 5 1HB GLN 1 HB2 GLN 1 2.796 1.847 -2.198 6 2HB GLN 1 HB1 GLN 1 1.378 2.255 -1.249 7 1HG GLN 1 HG2 GLN 1 4.056 1.610 -0.032 8 2HG GLN 1 HG1 GLN 1 3.543 3.242 -0.458 9 1HE2 GLN 1 HE21 GLN 1 4.209 2.133 2.154 10 2HE2 GLN 1 HE22 GLN 1 2.813 2.371 3.145 11 H GLY 2 HN GLY 2 2.608 -0.838 -3.331 12 1HA GLY 2 HA2 GLY 2 4.471 -1.956 -4.145 13 2HA GLY 2 HA1 GLY 2 5.272 -1.703 -2.599 14 H HIS 3 HN HIS 3 5.693 -4.108 -3.599 15 HA HIS 3 HA HIS 3 4.115 -5.827 -1.832 16 1HB HIS 3 HB2 HIS 3 3.717 -7.516 -3.494 17 2HB HIS 3 HB1 HIS 3 3.116 -5.993 -4.134 18 HD1 HIS 3 HD1 HIS 3 5.563 -8.695 -4.773 19 HD2 HIS 3 HD2 HIS 3 4.675 -4.920 -6.275 20 HE1 HIS 3 HE1 HIS 3 6.755 -8.543 -6.981 21 HE2 HIS 3 HE2 HIS 3 6.050 -6.325 -7.947 22 H MET 4 HN MET 4 5.197 -7.674 -1.125 23 HA MET 4 HA MET 4 8.051 -7.553 -1.088 24 1HB MET 4 HB2 MET 4 6.066 -9.632 -0.137 25 2HB MET 4 HB1 MET 4 7.803 -9.842 0.033 26 1HG MET 4 HG2 MET 4 7.911 -7.817 1.407 27 2HG MET 4 HG1 MET 4 6.168 -7.615 1.237 28 1HE MET 4 HE1 MET 4 7.929 -7.827 4.016 29 2HE MET 4 HE2 MET 4 6.800 -8.756 5.002 30 3HE MET 4 HE3 MET 4 6.204 -7.452 3.976 31 HA PRO 5 HA PRO 5 9.096 -10.073 -4.631 32 1HB PRO 5 HB2 PRO 5 10.992 -11.553 -2.884 33 2HB PRO 5 HB1 PRO 5 11.305 -10.642 -4.366 34 1HG PRO 5 HG2 PRO 5 12.034 -9.679 -1.983 35 2HG PRO 5 HG1 PRO 5 11.409 -8.608 -3.252 36 1HD PRO 5 HD2 PRO 5 10.009 -9.696 -0.829 37 2HD PRO 5 HD1 PRO 5 9.942 -8.065 -1.534 38 H SER 6 HN SER 6 9.586 -12.554 -5.076 39 HA SER 6 HA SER 6 7.343 -14.013 -3.888 40 1HB SER 6 HB2 SER 6 9.036 -14.665 -6.317 41 2HB SER 6 HB1 SER 6 7.580 -15.523 -5.808 42 HG SER 6 HG SER 6 6.618 -14.125 -7.050 43 H ASP 7 HN ASP 7 10.274 -13.555 -2.898 44 HA ASP 7 HA ASP 7 11.294 -16.247 -2.650 45 1HB ASP 7 HB2 ASP 7 12.746 -14.171 -2.796 46 2HB ASP 7 HB1 ASP 7 12.207 -13.763 -1.171 47 H SER 8 HN SER 8 11.411 -17.439 -0.708 48 HA SER 8 HA SER 8 10.612 -18.326 1.226 49 1HB SER 8 HB2 SER 8 9.922 -15.467 1.985 50 2HB SER 8 HB1 SER 8 10.121 -16.832 3.086 51 HG SER 8 HG SER 8 12.158 -15.815 1.379 52 H LYS 9 HN LYS 9 8.942 -17.933 -1.120 53 HA LYS 9 HA LYS 9 6.304 -17.187 -0.466 54 1HB LYS 9 HB2 LYS 9 7.187 -17.356 -2.778 55 2HB LYS 9 HB1 LYS 9 7.291 -19.099 -2.603 56 1HG LYS 9 HG2 LYS 9 5.322 -18.949 -3.734 57 2HG LYS 9 HG1 LYS 9 4.705 -18.860 -2.087 58 1HD LYS 9 HD2 LYS 9 5.312 -16.448 -3.809 59 2HD LYS 9 HD1 LYS 9 3.718 -17.186 -3.669 60 1HE LYS 9 HE2 LYS 9 3.749 -16.730 -1.243 61 2HE LYS 9 HE1 LYS 9 5.316 -15.944 -1.428 62 1HZ LYS 9 HZ1 LYS 9 3.493 -14.355 -1.376 63 2HZ LYS 9 HZ2 LYS 9 2.801 -15.070 -2.741 64 3HZ LYS 9 HZ3 LYS 9 4.303 -14.300 -2.861 65 H LYS 10 HN LYS 10 4.832 -18.217 0.757 66 HA LYS 10 HA LYS 10 5.180 -20.787 1.861 67 1HB LYS 10 HB2 LYS 10 2.956 -18.818 1.712 68 2HB LYS 10 HB1 LYS 10 2.495 -20.479 2.039 69 1HG LYS 10 HG2 LYS 10 2.730 -19.222 4.097 70 2HG LYS 10 HG1 LYS 10 3.930 -20.506 4.017 71 1HD LYS 10 HD2 LYS 10 4.689 -17.764 3.087 72 2HD LYS 10 HD1 LYS 10 4.563 -18.064 4.819 73 1HE LYS 10 HE2 LYS 10 6.161 -19.944 4.571 74 2HE LYS 10 HE1 LYS 10 6.327 -19.544 2.863 75 1HZ LYS 10 HZ1 LYS 10 7.059 -17.804 5.156 76 2HZ LYS 10 HZ2 LYS 10 7.138 -17.342 3.529 77 3HZ LYS 10 HZ3 LYS 10 8.126 -18.589 4.102 78 HA PRO 11 HA PRO 11 4.308 -23.131 -1.818 79 1HB PRO 11 HB2 PRO 11 4.299 -25.610 -0.680 80 2HB PRO 11 HB1 PRO 11 5.780 -24.699 -1.000 81 1HG PRO 11 HG2 PRO 11 4.248 -24.978 1.563 82 2HG PRO 11 HG1 PRO 11 6.000 -25.063 1.291 83 1HD PRO 11 HD2 PRO 11 4.798 -22.837 2.243 84 2HD PRO 11 HD1 PRO 11 6.224 -22.762 1.186 85 H THR 12 HN THR 12 2.616 -24.240 -2.781 86 HA THR 12 HA THR 12 0.019 -23.766 -1.726 87 HB THR 12 HB THR 12 0.801 -25.481 -4.102 88 HG1 THR 12 HG1 THR 12 0.291 -23.456 -5.245 89 1HG2 THR 12 HG21 THR 12 -1.799 -24.080 -3.429 90 2HG2 THR 12 HG22 THR 12 -1.523 -25.821 -3.374 91 3HG2 THR 12 HG23 THR 12 -1.461 -24.968 -4.916 92 H ILE 13 HN ILE 13 -1.113 -25.014 -0.375 93 HA ILE 13 HA ILE 13 -0.330 -27.835 -0.023 94 HB ILE 13 HB ILE 13 -2.023 -26.087 1.788 95 1HG1 ILE 13 HG12 ILE 13 0.330 -25.348 1.717 96 2HG1 ILE 13 HG11 ILE 13 -0.074 -26.043 3.283 97 1HG2 ILE 13 HG21 ILE 13 -0.907 -28.865 2.217 98 2HG2 ILE 13 HG22 ILE 13 -2.604 -28.441 1.989 99 3HG2 ILE 13 HG23 ILE 13 -1.747 -27.900 3.432 100 1HD1 ILE 13 HD11 ILE 13 1.431 -27.432 1.075 101 2HD1 ILE 13 HD12 ILE 13 1.036 -28.119 2.651 102 3HD1 ILE 13 HD13 ILE 13 2.129 -26.740 2.539 103 H ILE 14 HN ILE 14 -1.768 -29.444 -0.463 104 HA ILE 14 HA ILE 14 -4.094 -28.668 -2.033 105 HB ILE 14 HB ILE 14 -2.879 -31.408 -1.601 106 1HG1 ILE 14 HG12 ILE 14 -1.336 -29.897 -2.778 107 2HG1 ILE 14 HG11 ILE 14 -1.950 -31.130 -3.873 108 1HG2 ILE 14 HG21 ILE 14 -4.977 -30.479 -3.569 109 2HG2 ILE 14 HG22 ILE 14 -5.229 -31.561 -2.199 110 3HG2 ILE 14 HG23 ILE 14 -4.226 -32.076 -3.555 111 1HD1 ILE 14 HD11 ILE 14 -3.522 -29.513 -4.812 112 2HD1 ILE 14 HD12 ILE 14 -1.854 -28.956 -4.950 113 3HD1 ILE 14 HD13 ILE 14 -2.910 -28.278 -3.711 114 H TYR 15 HN TYR 15 -5.831 -28.232 -0.816 115 HA TYR 15 HA TYR 15 -6.630 -30.125 1.287 116 1HB TYR 15 HB2 TYR 15 -7.627 -27.345 0.597 117 2HB TYR 15 HB1 TYR 15 -8.359 -28.368 1.828 118 HD1 TYR 15 HD1 TYR 15 -7.263 -28.728 3.962 119 HD2 TYR 15 HD2 TYR 15 -5.425 -26.320 0.970 120 HE1 TYR 15 HE1 TYR 15 -5.697 -27.842 5.639 121 HE2 TYR 15 HE2 TYR 15 -3.856 -25.432 2.642 122 HH TYR 15 HH TYR 15 -3.716 -25.137 5.062 123 HA PRO 16 HA PRO 16 -8.525 -30.713 2.315 124 1HB PRO 16 HB2 PRO 16 -9.889 -33.255 1.958 125 2HB PRO 16 HB1 PRO 16 -10.464 -31.801 2.775 126 1HG PRO 16 HG2 PRO 16 -11.526 -32.733 0.438 127 2HG PRO 16 HG1 PRO 16 -11.547 -31.024 0.911 128 1HD PRO 16 HD2 PRO 16 -9.690 -32.448 -0.971 129 2HD PRO 16 HD1 PRO 16 -10.461 -30.855 -1.141 130 H CYS 17 HN CYS 17 -7.353 -32.188 3.611 131 HA CYS 17 HA CYS 17 -6.191 -34.585 2.578 132 1HB CYS 17 HB2 CYS 17 -4.751 -32.952 1.413 133 2HB CYS 17 HB1 CYS 17 -4.367 -32.186 2.950 134 HG CYS 17 HG CYS 17 -3.118 -34.568 3.950 135 H LEU 18 HN LEU 18 -4.902 -35.679 4.163 136 HA LEU 18 HA LEU 18 -5.651 -35.246 6.868 137 1HB LEU 18 HB2 LEU 18 -3.511 -36.973 5.609 138 2HB LEU 18 HB1 LEU 18 -3.890 -37.002 7.320 139 HG LEU 18 HG LEU 18 -5.944 -37.619 5.193 140 1HD1 LEU 18 HD11 LEU 18 -5.542 -39.985 5.658 141 2HD1 LEU 18 HD12 LEU 18 -4.183 -39.555 6.698 142 3HD1 LEU 18 HD13 LEU 18 -4.117 -39.210 4.969 143 1HD2 LEU 18 HD21 LEU 18 -6.836 -36.982 7.374 144 2HD2 LEU 18 HD22 LEU 18 -5.830 -38.202 8.156 145 3HD2 LEU 18 HD23 LEU 18 -7.120 -38.694 7.057 146 H TRP 19 HN TRP 19 -4.812 -33.832 8.262 147 HA TRP 19 HA TRP 19 -2.057 -32.871 7.831 148 1HB TRP 19 HB2 TRP 19 -3.991 -31.176 7.797 149 2HB TRP 19 HB1 TRP 19 -4.151 -31.484 9.524 150 HD1 TRP 19 HD1 TRP 19 -2.216 -30.540 11.124 151 HE1 TRP 19 HE1 TRP 19 -0.381 -28.776 10.759 152 HE3 TRP 19 HE3 TRP 19 -2.425 -30.198 6.025 153 HZ2 TRP 19 HZ2 TRP 19 0.819 -27.418 8.595 154 HZ3 TRP 19 HZ3 TRP 19 -0.895 -28.642 4.884 155 HH2 TRP 19 HH2 TRP 19 0.692 -27.279 6.146 156 H ASP 20 HN ASP 20 -0.644 -32.849 9.606 157 HA ASP 20 HA ASP 20 -1.400 -34.800 11.678 158 1HB ASP 20 HB2 ASP 20 0.435 -35.437 10.099 159 2HB ASP 20 HB1 ASP 20 1.380 -34.081 10.707 160 H TYR 21 HN TYR 21 -1.469 -34.191 13.717 161 HA TYR 21 HA TYR 21 -0.193 -31.663 14.549 162 1HB TYR 21 HB2 TYR 21 -2.713 -32.919 15.685 163 2HB TYR 21 HB1 TYR 21 -2.008 -31.383 16.168 164 HD1 TYR 21 HD1 TYR 21 -2.293 -29.391 14.785 165 HD2 TYR 21 HD2 TYR 21 -3.956 -33.128 13.592 166 HE1 TYR 21 HE1 TYR 21 -3.712 -28.231 13.142 167 HE2 TYR 21 HE2 TYR 21 -5.371 -31.978 11.944 168 HH TYR 21 HH TYR 21 -6.335 -29.686 11.625 169 H ARG 22 HN ARG 22 1.143 -31.768 16.289 170 HA ARG 22 HA ARG 22 1.382 -34.343 17.699 171 1HB ARG 22 HB2 ARG 22 3.450 -33.525 16.680 172 2HB ARG 22 HB1 ARG 22 3.294 -31.999 17.534 173 1HG ARG 22 HG2 ARG 22 4.947 -33.369 18.621 174 2HG ARG 22 HG1 ARG 22 3.546 -33.189 19.677 175 1HD ARG 22 HD2 ARG 22 4.335 -35.482 19.721 176 2HD ARG 22 HD1 ARG 22 2.744 -35.407 18.967 177 HE ARG 22 HE ARG 22 3.888 -35.598 16.801 178 1HH1 ARG 22 HH11 ARG 22 5.690 -36.500 19.661 179 2HH1 ARG 22 HH12 ARG 22 6.708 -37.629 18.823 180 1HH2 ARG 22 HH21 ARG 22 5.234 -37.065 15.682 181 2HH2 ARG 22 HH22 ARG 22 6.445 -37.951 16.554 182 H VAL 23 HN VAL 23 0.485 -34.497 19.636 183 HA VAL 23 HA VAL 23 -0.055 -32.029 21.178 184 HB VAL 23 HB VAL 23 -1.729 -34.557 21.178 185 1HG1 VAL 23 HG11 VAL 23 -2.234 -31.818 22.353 186 2HG1 VAL 23 HG12 VAL 23 -1.900 -33.302 23.246 187 3HG1 VAL 23 HG13 VAL 23 -3.396 -33.146 22.326 188 1HG2 VAL 23 HG21 VAL 23 -3.387 -33.276 19.875 189 2HG2 VAL 23 HG22 VAL 23 -1.884 -33.524 18.988 190 3HG2 VAL 23 HG23 VAL 23 -2.226 -31.956 19.718 191 H ILE 24 HN ILE 24 1.374 -32.010 22.838 192 HA ILE 24 HA ILE 24 2.042 -34.532 24.193 193 HB ILE 24 HB ILE 24 3.276 -31.787 24.563 194 1HG1 ILE 24 HG12 ILE 24 4.304 -34.176 22.996 195 2HG1 ILE 24 HG11 ILE 24 3.666 -32.695 22.290 196 1HG2 ILE 24 HG21 ILE 24 5.072 -33.004 25.725 197 2HG2 ILE 24 HG22 ILE 24 4.177 -34.511 25.521 198 3HG2 ILE 24 HG23 ILE 24 3.515 -33.222 26.527 199 1HD1 ILE 24 HD11 ILE 24 6.144 -32.914 23.990 200 2HD1 ILE 24 HD12 ILE 24 5.504 -31.430 23.283 201 3HD1 ILE 24 HD13 ILE 24 6.091 -32.722 22.238 202 H MET 25 HN MET 25 0.683 -35.054 25.807 203 HA MET 25 HA MET 25 -0.280 -32.896 27.592 204 1HB MET 25 HB2 MET 25 -1.726 -35.447 26.820 205 2HB MET 25 HB1 MET 25 -2.291 -34.296 28.022 206 1HG MET 25 HG2 MET 25 -2.263 -32.565 26.164 207 2HG MET 25 HG1 MET 25 -2.056 -33.917 25.053 208 1HE MET 25 HE1 MET 25 -3.828 -36.192 26.432 209 2HE MET 25 HE2 MET 25 -3.875 -35.840 24.704 210 3HE MET 25 HE3 MET 25 -5.376 -35.937 25.626 211 H THR 26 HN THR 26 -0.632 -33.502 29.831 212 HA THR 26 HA THR 26 1.363 -35.433 30.747 213 HB THR 26 HB THR 26 0.814 -34.426 33.027 214 HG1 THR 26 HG1 THR 26 -0.957 -33.258 32.989 215 1HG2 THR 26 HG21 THR 26 2.090 -32.370 32.601 216 2HG2 THR 26 HG22 THR 26 1.833 -32.570 30.867 217 3HG2 THR 26 HG23 THR 26 2.794 -33.751 31.758 218 H THR 27 HN THR 27 -1.423 -36.112 29.670 219 HA THR 27 HA THR 27 -2.124 -37.950 31.850 220 HB THR 27 HB THR 27 -3.771 -36.040 31.830 221 HG1 THR 27 HG1 THR 27 -5.437 -37.421 32.164 222 1HG2 THR 27 HG21 THR 27 -5.400 -35.926 29.993 223 2HG2 THR 27 HG22 THR 27 -4.496 -37.154 29.109 224 3HG2 THR 27 HG23 THR 27 -3.768 -35.577 29.420 225 H LYS 28 HN LYS 28 -2.797 -39.973 31.179 226 HA LYS 28 HA LYS 28 -2.527 -40.607 28.339 227 1HB LYS 28 HB2 LYS 28 -2.963 -42.369 30.766 228 2HB LYS 28 HB1 LYS 28 -2.849 -42.973 29.118 229 1HG LYS 28 HG2 LYS 28 -0.571 -42.078 28.950 230 2HG LYS 28 HG1 LYS 28 -0.684 -41.492 30.609 231 1HD LYS 28 HD2 LYS 28 -0.911 -44.390 29.777 232 2HD LYS 28 HD1 LYS 28 0.549 -43.634 30.415 233 1HE LYS 28 HE2 LYS 28 -2.090 -43.902 31.862 234 2HE LYS 28 HE1 LYS 28 -0.646 -44.870 32.154 235 1HZ LYS 28 HZ1 LYS 28 -0.802 -43.136 33.785 236 2HZ LYS 28 HZ2 LYS 28 -0.926 -41.947 32.592 237 3HZ LYS 28 HZ3 LYS 28 0.517 -42.810 32.776 238 H ASP 29 HN ASP 29 -4.888 -39.671 30.517 239 HA ASP 29 HA ASP 29 -7.082 -41.112 29.264 240 1HB ASP 29 HB2 ASP 29 -7.169 -40.713 31.689 241 2HB ASP 29 HB1 ASP 29 -7.096 -38.975 31.420 242 H THR 30 HN THR 30 -6.673 -40.284 27.143 243 HA THR 30 HA THR 30 -7.109 -37.442 26.711 244 HB THR 30 HB THR 30 -5.345 -38.387 25.397 245 HG1 THR 30 HG1 THR 30 -6.333 -38.064 23.207 246 1HG2 THR 30 HG21 THR 30 -6.048 -40.740 25.401 247 2HG2 THR 30 HG22 THR 30 -5.670 -40.182 23.771 248 3HG2 THR 30 HG23 THR 30 -7.351 -40.353 24.276 249 H SER 31 HN SER 31 -9.188 -36.963 27.051 250 HA SER 31 HA SER 31 -11.224 -38.392 25.473 251 1HB SER 31 HB2 SER 31 -12.840 -37.265 27.069 252 2HB SER 31 HB1 SER 31 -11.763 -38.442 27.821 253 HG SER 31 HG SER 31 -11.574 -36.734 29.124 254 H THR 32 HN THR 32 -10.794 -35.120 26.795 255 HA THR 32 HA THR 32 -12.352 -33.680 25.099 256 HB THR 32 HB THR 32 -9.669 -32.681 26.076 257 HG1 THR 32 HG1 THR 32 -12.074 -32.582 27.577 258 1HG2 THR 32 HG21 THR 32 -12.331 -31.287 25.671 259 2HG2 THR 32 HG22 THR 32 -10.914 -31.126 24.632 260 3HG2 THR 32 HG23 THR 32 -10.859 -30.538 26.293 261 H LEU 33 HN LEU 33 -9.028 -34.729 24.488 262 HA LEU 33 HA LEU 33 -8.521 -33.218 22.186 263 1HB LEU 33 HB2 LEU 33 -6.757 -34.397 23.385 264 2HB LEU 33 HB1 LEU 33 -7.471 -35.944 22.969 265 HG LEU 33 HG LEU 33 -6.983 -35.523 20.582 266 1HD1 LEU 33 HD11 LEU 33 -7.069 -33.093 20.573 267 2HD1 LEU 33 HD12 LEU 33 -5.526 -33.661 19.937 268 3HD1 LEU 33 HD13 LEU 33 -5.621 -33.018 21.578 269 1HD2 LEU 33 HD21 LEU 33 -5.379 -36.759 21.943 270 2HD2 LEU 33 HD22 LEU 33 -4.577 -35.252 22.386 271 3HD2 LEU 33 HD23 LEU 33 -4.561 -35.801 20.710 272 H LYS 34 HN LYS 34 -9.861 -36.508 22.515 273 HA LYS 34 HA LYS 34 -10.224 -36.804 19.682 274 1HB LYS 34 HB2 LYS 34 -11.363 -38.440 21.965 275 2HB LYS 34 HB1 LYS 34 -11.432 -38.882 20.262 276 1HG LYS 34 HG2 LYS 34 -8.939 -38.895 20.228 277 2HG LYS 34 HG1 LYS 34 -8.958 -38.626 21.971 278 1HD LYS 34 HD2 LYS 34 -10.119 -41.006 20.506 279 2HD LYS 34 HD1 LYS 34 -8.644 -40.992 21.473 280 1HE LYS 34 HE2 LYS 34 -9.996 -40.396 23.459 281 2HE LYS 34 HE1 LYS 34 -11.453 -40.511 22.474 282 1HZ LYS 34 HZ1 LYS 34 -10.860 -42.856 22.039 283 2HZ LYS 34 HZ2 LYS 34 -11.158 -42.540 23.672 284 3HZ LYS 34 HZ3 LYS 34 -9.569 -42.713 23.124 285 H GLU 35 HN GLU 35 -12.201 -35.841 22.404 286 HA GLU 35 HA GLU 35 -14.741 -35.897 21.292 287 1HB GLU 35 HB2 GLU 35 -13.517 -34.001 23.306 288 2HB GLU 35 HB1 GLU 35 -15.229 -34.004 22.910 289 1HG GLU 35 HG2 GLU 35 -13.723 -36.368 24.019 290 2HG GLU 35 HG1 GLU 35 -14.681 -35.241 24.979 291 H LEU 36 HN LEU 36 -12.385 -33.213 21.281 292 HA LEU 36 HA LEU 36 -14.008 -31.388 19.895 293 1HB LEU 36 HB2 LEU 36 -12.110 -30.002 19.719 294 2HB LEU 36 HB1 LEU 36 -11.883 -30.904 21.200 295 HG LEU 36 HG LEU 36 -10.466 -32.493 19.581 296 1HD1 LEU 36 HD11 LEU 36 -10.213 -29.782 18.279 297 2HD1 LEU 36 HD12 LEU 36 -10.903 -31.231 17.549 298 3HD1 LEU 36 HD13 LEU 36 -9.190 -31.184 17.959 299 1HD2 LEU 36 HD21 LEU 36 -8.454 -31.308 20.312 300 2HD2 LEU 36 HD22 LEU 36 -9.634 -31.435 21.616 301 3HD2 LEU 36 HD23 LEU 36 -9.433 -29.908 20.755 302 H LEU 37 HN LEU 37 -11.961 -33.988 18.796 303 HA LEU 37 HA LEU 37 -11.956 -33.260 16.023 304 1HB LEU 37 HB2 LEU 37 -11.447 -35.959 17.299 305 2HB LEU 37 HB1 LEU 37 -11.028 -35.496 15.660 306 HG LEU 37 HG LEU 37 -9.838 -34.237 18.140 307 1HD1 LEU 37 HD11 LEU 37 -8.677 -36.341 16.314 308 2HD1 LEU 37 HD12 LEU 37 -9.191 -36.577 17.985 309 3HD1 LEU 37 HD13 LEU 37 -7.825 -35.523 17.626 310 1HD2 LEU 37 HD21 LEU 37 -9.819 -32.766 16.191 311 2HD2 LEU 37 HD22 LEU 37 -9.052 -34.032 15.232 312 3HD2 LEU 37 HD23 LEU 37 -8.190 -33.310 16.591 313 H GLU 38 HN GLU 38 -13.806 -35.488 18.048 314 HA GLU 38 HA GLU 38 -15.171 -36.821 15.981 315 1HB GLU 38 HB2 GLU 38 -15.830 -36.481 18.910 316 2HB GLU 38 HB1 GLU 38 -16.746 -37.523 17.829 317 1HG GLU 38 HG2 GLU 38 -14.693 -38.815 17.374 318 2HG GLU 38 HG1 GLU 38 -13.824 -37.798 18.523 319 H THR 39 HN THR 39 -15.792 -33.770 17.535 320 HA THR 39 HA THR 39 -18.545 -33.546 17.014 321 HB THR 39 HB THR 39 -18.208 -31.084 17.171 322 HG1 THR 39 HG1 THR 39 -15.471 -31.573 17.705 323 1HG2 THR 39 HG21 THR 39 -18.489 -32.430 19.204 324 2HG2 THR 39 HG22 THR 39 -17.405 -31.067 19.486 325 3HG2 THR 39 HG23 THR 39 -16.745 -32.689 19.276 326 H TYR 40 HN TYR 40 -15.787 -33.225 14.925 327 HA TYR 40 HA TYR 40 -17.151 -31.845 12.804 328 1HB TYR 40 HB2 TYR 40 -14.548 -33.399 12.836 329 2HB TYR 40 HB1 TYR 40 -15.139 -32.488 11.450 330 HD1 TYR 40 HD1 TYR 40 -14.880 -30.119 11.332 331 HD2 TYR 40 HD2 TYR 40 -13.927 -32.180 14.937 332 HE1 TYR 40 HE1 TYR 40 -13.824 -28.082 12.215 333 HE2 TYR 40 HE2 TYR 40 -12.865 -30.143 15.826 334 HH TYR 40 HH TYR 40 -13.094 -27.081 14.151 335 H GLN 41 HN GLN 41 -17.304 -34.961 13.982 336 HA GLN 41 HA GLN 41 -18.345 -36.854 13.320 337 1HB GLN 41 HB2 GLN 41 -19.456 -35.078 11.134 338 2HB GLN 41 HB1 GLN 41 -20.040 -36.694 11.506 339 1HG GLN 41 HG2 GLN 41 -20.106 -34.334 13.387 340 2HG GLN 41 HG1 GLN 41 -21.470 -34.937 12.448 341 1HE2 GLN 41 HE21 GLN 41 -19.389 -35.510 15.171 342 2HE2 GLN 41 HE22 GLN 41 -20.329 -36.773 15.882 343 H ARG 42 HN ARG 42 -15.759 -35.768 11.950 344 HA ARG 42 HA ARG 42 -15.727 -37.643 9.683 345 1HB ARG 42 HB2 ARG 42 -13.848 -36.425 8.812 346 2HB ARG 42 HB1 ARG 42 -15.083 -35.254 9.247 347 1HG ARG 42 HG2 ARG 42 -13.885 -34.638 11.238 348 2HG ARG 42 HG1 ARG 42 -12.714 -35.932 10.983 349 1HD ARG 42 HD2 ARG 42 -11.612 -34.013 10.224 350 2HD ARG 42 HD1 ARG 42 -12.193 -34.781 8.751 351 HE ARG 42 HE ARG 42 -13.235 -32.324 9.977 352 1HH1 ARG 42 HH11 ARG 42 -13.338 -34.601 7.314 353 2HH1 ARG 42 HH12 ARG 42 -14.086 -33.480 6.224 354 1HH2 ARG 42 HH21 ARG 42 -14.175 -30.828 8.509 355 2HH2 ARG 42 HH22 ARG 42 -14.564 -31.357 6.898 356 HA PRO 43 HA PRO 43 -13.040 -40.369 11.918 357 1HB PRO 43 HB2 PRO 43 -11.466 -41.387 9.955 358 2HB PRO 43 HB1 PRO 43 -13.176 -41.806 10.113 359 1HG PRO 43 HG2 PRO 43 -11.881 -39.807 8.287 360 2HG PRO 43 HG1 PRO 43 -13.142 -41.001 7.920 361 1HD PRO 43 HD2 PRO 43 -13.704 -38.388 8.383 362 2HD PRO 43 HD1 PRO 43 -14.822 -39.694 8.828 363 H PHE 44 HN PHE 44 -10.812 -40.746 12.542 364 HA PHE 44 HA PHE 44 -8.733 -38.960 11.690 365 1HB PHE 44 HB2 PHE 44 -8.393 -37.870 13.875 366 2HB PHE 44 HB1 PHE 44 -9.965 -37.458 13.200 367 HD1 PHE 44 HD1 PHE 44 -8.205 -39.175 15.898 368 HD2 PHE 44 HD2 PHE 44 -12.028 -38.353 14.192 369 HE1 PHE 44 HE1 PHE 44 -9.291 -39.918 17.975 370 HE2 PHE 44 HE2 PHE 44 -13.114 -39.094 16.270 371 HZ PHE 44 HZ PHE 44 -11.749 -39.878 18.162 372 H LYS 45 HN LYS 45 -6.698 -39.535 12.559 373 HA LYS 45 HA LYS 45 -6.595 -42.241 13.679 374 1HB LYS 45 HB2 LYS 45 -5.306 -41.765 11.600 375 2HB LYS 45 HB1 LYS 45 -4.384 -40.547 12.472 376 1HG LYS 45 HG2 LYS 45 -3.705 -42.428 14.060 377 2HG LYS 45 HG1 LYS 45 -4.357 -43.531 12.847 378 1HD LYS 45 HD2 LYS 45 -1.972 -43.305 12.516 379 2HD LYS 45 HD1 LYS 45 -2.813 -42.530 11.172 380 1HE LYS 45 HE2 LYS 45 -2.448 -40.345 12.149 381 2HE LYS 45 HE1 LYS 45 -1.735 -41.070 13.588 382 1HZ LYS 45 HZ1 LYS 45 0.104 -41.848 12.298 383 2HZ LYS 45 HZ2 LYS 45 -0.089 -40.195 12.002 384 3HZ LYS 45 HZ3 LYS 45 -0.607 -41.322 10.857 385 H LEU 46 HN LEU 46 -6.202 -42.473 15.791 386 HA LEU 46 HA LEU 46 -4.831 -40.302 17.245 387 1HB LEU 46 HB2 LEU 46 -7.198 -41.047 17.914 388 2HB LEU 46 HB1 LEU 46 -6.469 -42.543 18.455 389 HG LEU 46 HG LEU 46 -6.930 -40.912 20.285 390 1HD1 LEU 46 HD11 LEU 46 -3.999 -41.526 19.921 391 2HD1 LEU 46 HD12 LEU 46 -5.209 -42.631 20.572 392 3HD1 LEU 46 HD13 LEU 46 -4.810 -41.150 21.441 393 1HD2 LEU 46 HD21 LEU 46 -5.520 -38.937 20.528 394 2HD2 LEU 46 HD22 LEU 46 -6.481 -38.854 19.053 395 3HD2 LEU 46 HD23 LEU 46 -4.768 -39.265 18.966 396 H GLU 47 HN GLU 47 -2.779 -40.705 17.754 397 HA GLU 47 HA GLU 47 -1.882 -43.486 18.050 398 1HB GLU 47 HB2 GLU 47 -0.577 -41.270 16.490 399 2HB GLU 47 HB1 GLU 47 0.297 -42.708 16.993 400 1HG GLU 47 HG2 GLU 47 -2.160 -42.701 15.251 401 2HG GLU 47 HG1 GLU 47 -0.501 -42.805 14.666 402 H PHE 48 HN PHE 48 -0.107 -43.834 19.441 403 HA PHE 48 HA PHE 48 0.690 -41.539 21.126 404 1HB PHE 48 HB2 PHE 48 -0.544 -43.170 22.456 405 2HB PHE 48 HB1 PHE 48 0.467 -44.478 21.854 406 HD1 PHE 48 HD1 PHE 48 2.397 -45.103 23.016 407 HD2 PHE 48 HD2 PHE 48 0.603 -41.323 23.826 408 HE1 PHE 48 HE1 PHE 48 3.933 -44.780 24.909 409 HE2 PHE 48 HE2 PHE 48 2.139 -41.000 25.717 410 HZ PHE 48 HZ PHE 48 3.805 -42.726 26.263 411 H LYS 49 HN LYS 49 2.733 -40.930 20.754 412 HA LYS 49 HA LYS 49 4.436 -42.654 19.152 413 1HB LYS 49 HB2 LYS 49 4.717 -39.786 20.065 414 2HB LYS 49 HB1 LYS 49 5.959 -40.626 19.146 415 1HG LYS 49 HG2 LYS 49 3.127 -40.122 18.225 416 2HG LYS 49 HG1 LYS 49 4.561 -39.230 17.709 417 1HD LYS 49 HD2 LYS 49 5.500 -41.357 16.815 418 2HD LYS 49 HD1 LYS 49 3.989 -42.164 17.239 419 1HE LYS 49 HE2 LYS 49 2.771 -40.652 15.732 420 2HE LYS 49 HE1 LYS 49 4.288 -39.863 15.300 421 1HZ LYS 49 HZ1 LYS 49 3.517 -42.676 14.748 422 2HZ LYS 49 HZ2 LYS 49 5.064 -42.052 14.476 423 3HZ LYS 49 HZ3 LYS 49 3.741 -41.439 13.620 424 H ASN 50 HN ASN 50 4.889 -40.804 22.184 425 HA ASN 50 HA ASN 50 6.374 -42.881 23.445 426 1HB ASN 50 HB2 ASN 50 8.052 -42.151 21.759 427 2HB ASN 50 HB1 ASN 50 7.969 -40.515 22.398 428 1HD2 ASN 50 HD21 ASN 50 9.032 -40.025 24.288 429 2HD2 ASN 50 HD22 ASN 50 10.118 -41.121 25.072 430 H THR 51 HN THR 51 7.407 -42.040 25.511 431 HA THR 51 HA THR 51 6.072 -39.618 26.517 432 HB THR 51 HB THR 51 4.809 -41.598 27.308 433 HG1 THR 51 HG1 THR 51 5.140 -39.672 28.650 434 1HG2 THR 51 HG21 THR 51 7.393 -42.382 28.678 435 2HG2 THR 51 HG22 THR 51 6.632 -43.242 27.338 436 3HG2 THR 51 HG23 THR 51 5.825 -43.160 28.904 437 H SER 52 HN SER 52 7.235 -38.489 28.135 438 HA SER 52 HA SER 52 10.006 -38.456 27.860 439 1HB SER 52 HB2 SER 52 10.009 -36.927 29.804 440 2HB SER 52 HB1 SER 52 8.752 -36.510 28.645 441 HG SER 52 HG SER 52 8.335 -36.716 31.097 442 H LYS 53 HN LYS 53 11.578 -38.696 29.754 443 HA LYS 53 HA LYS 53 11.660 -41.466 30.322 444 1HB LYS 53 HB2 LYS 53 13.377 -39.246 31.460 445 2HB LYS 53 HB1 LYS 53 13.752 -40.965 31.515 446 1HG LYS 53 HG2 LYS 53 13.563 -39.227 29.057 447 2HG LYS 53 HG1 LYS 53 15.021 -39.939 29.753 448 1HD LYS 53 HD2 LYS 53 14.205 -42.176 29.251 449 2HD LYS 53 HD1 LYS 53 12.690 -41.513 28.635 450 1HE LYS 53 HE2 LYS 53 13.972 -40.326 26.876 451 2HE LYS 53 HE1 LYS 53 15.444 -41.098 27.468 452 1HZ LYS 53 HZ1 LYS 53 14.577 -42.310 25.602 453 2HZ LYS 53 HZ2 LYS 53 13.068 -42.474 26.345 454 3HZ LYS 53 HZ3 LYS 53 14.420 -43.257 26.997 455 H ASN 54 HN ASN 54 10.279 -38.856 32.035 456 HA ASN 54 HA ASN 54 10.172 -40.383 34.548 457 1HB ASN 54 HB2 ASN 54 10.869 -37.957 34.561 458 2HB ASN 54 HB1 ASN 54 9.245 -37.541 34.028 459 1HD2 ASN 54 HD21 ASN 54 7.527 -37.732 35.482 460 2HD2 ASN 54 HD22 ASN 54 7.779 -37.903 37.181 461 H ALA 55 HN ALA 55 8.525 -40.407 31.806 462 HA ALA 55 HA ALA 55 6.416 -40.861 31.099 463 1HB ALA 55 HB1 ALA 55 4.998 -42.197 32.576 464 2HB ALA 55 HB2 ALA 55 6.018 -41.779 33.954 465 3HB ALA 55 HB3 ALA 55 6.669 -42.759 32.639 466 H LYS 56 HN LYS 56 7.050 -38.236 32.200 467 HA LYS 56 HA LYS 56 4.664 -37.331 33.597 468 1HB LYS 56 HB2 LYS 56 6.922 -36.516 34.241 469 2HB LYS 56 HB1 LYS 56 7.094 -35.784 32.653 470 1HG LYS 56 HG2 LYS 56 6.503 -34.071 34.208 471 2HG LYS 56 HG1 LYS 56 5.115 -34.357 33.155 472 1HD LYS 56 HD2 LYS 56 4.059 -35.717 34.894 473 2HD LYS 56 HD1 LYS 56 5.462 -35.489 35.941 474 1HE LYS 56 HE2 LYS 56 5.031 -33.045 35.911 475 2HE LYS 56 HE1 LYS 56 3.575 -33.343 34.961 476 1HZ LYS 56 HZ1 LYS 56 4.098 -34.367 37.700 477 2HZ LYS 56 HZ2 LYS 56 2.705 -34.668 36.789 478 3HZ LYS 56 HZ3 LYS 56 3.057 -33.096 37.301 479 H PHE 57 HN PHE 57 6.237 -36.973 30.467 480 HA PHE 57 HA PHE 57 3.911 -35.450 29.483 481 1HB PHE 57 HB2 PHE 57 6.743 -35.452 28.392 482 2HB PHE 57 HB1 PHE 57 5.401 -34.477 27.801 483 HD1 PHE 57 HD1 PHE 57 8.232 -34.485 29.873 484 HD2 PHE 57 HD2 PHE 57 4.264 -32.949 29.633 485 HE1 PHE 57 HE1 PHE 57 8.826 -32.705 31.463 486 HE2 PHE 57 HE2 PHE 57 4.858 -31.168 31.220 487 HZ PHE 57 HZ PHE 57 7.139 -31.044 32.139 488 H TYR 58 HN TYR 58 2.661 -36.503 28.108 489 HA TYR 58 HA TYR 58 3.702 -38.899 26.755 490 1HB TYR 58 HB2 TYR 58 0.810 -38.093 27.165 491 2HB TYR 58 HB1 TYR 58 1.405 -39.648 26.598 492 HD1 TYR 58 HD1 TYR 58 2.719 -41.109 28.234 493 HD2 TYR 58 HD2 TYR 58 0.550 -37.655 29.457 494 HE1 TYR 58 HE1 TYR 58 2.736 -41.921 30.558 495 HE2 TYR 58 HE2 TYR 58 0.566 -38.458 31.774 496 HH TYR 58 HH TYR 58 2.557 -40.881 32.877 497 H SER 59 HN SER 59 4.194 -38.657 24.688 498 HA SER 59 HA SER 59 3.214 -36.380 23.181 499 1HB SER 59 HB2 SER 59 5.161 -38.581 22.420 500 2HB SER 59 HB1 SER 59 4.823 -37.139 21.464 501 HG SER 59 HG SER 59 6.394 -37.446 23.702 502 H PHE 60 HN PHE 60 1.296 -36.545 22.246 503 HA PHE 60 HA PHE 60 0.411 -39.134 21.169 504 1HB PHE 60 HB2 PHE 60 -1.164 -36.641 21.872 505 2HB PHE 60 HB1 PHE 60 -1.859 -38.069 21.115 506 HD1 PHE 60 HD1 PHE 60 -0.947 -36.503 24.205 507 HD2 PHE 60 HD2 PHE 60 -1.748 -40.271 22.379 508 HE1 PHE 60 HE1 PHE 60 -1.350 -37.493 26.422 509 HE2 PHE 60 HE2 PHE 60 -2.149 -41.261 24.593 510 HZ PHE 60 HZ PHE 60 -1.950 -39.873 26.618 511 H ASN 61 HN ASN 61 -0.411 -39.276 19.116 512 HA ASN 61 HA ASN 61 0.321 -37.113 17.256 513 1HB ASN 61 HB2 ASN 61 1.806 -38.841 16.732 514 2HB ASN 61 HB1 ASN 61 0.640 -40.097 17.103 515 1HD2 ASN 61 HD21 ASN 61 -0.168 -37.394 15.033 516 2HD2 ASN 61 HD22 ASN 61 -0.242 -38.300 13.573 517 H VAL 62 HN VAL 62 -1.353 -36.210 16.297 518 HA VAL 62 HA VAL 62 -3.818 -37.793 15.898 519 HB VAL 62 HB VAL 62 -3.566 -34.797 16.313 520 1HG1 VAL 62 HG11 VAL 62 -5.387 -35.325 14.782 521 2HG1 VAL 62 HG12 VAL 62 -6.032 -34.798 16.337 522 3HG1 VAL 62 HG13 VAL 62 -6.027 -36.513 15.919 523 1HG2 VAL 62 HG21 VAL 62 -4.762 -35.192 18.422 524 2HG2 VAL 62 HG22 VAL 62 -3.217 -36.041 18.384 525 3HG2 VAL 62 HG23 VAL 62 -4.716 -36.930 18.120 526 H SER 63 HN SER 63 -4.599 -37.908 13.853 527 HA SER 63 HA SER 63 -3.641 -35.992 11.843 528 1HB SER 63 HB2 SER 63 -3.708 -38.990 11.374 529 2HB SER 63 HB1 SER 63 -3.146 -37.754 10.247 530 HG SER 63 HG SER 63 -1.593 -37.242 12.061 531 H MET 64 HN MET 64 -5.359 -35.144 10.817 532 HA MET 64 HA MET 64 -7.746 -36.793 10.387 533 1HB MET 64 HB2 MET 64 -9.247 -35.118 11.305 534 2HB MET 64 HB1 MET 64 -8.098 -35.611 12.540 535 1HG MET 64 HG2 MET 64 -6.784 -33.578 12.106 536 2HG MET 64 HG1 MET 64 -7.977 -33.081 10.907 537 1HE MET 64 HE1 MET 64 -10.685 -34.125 12.448 538 2HE MET 64 HE2 MET 64 -10.552 -32.627 11.527 539 3HE MET 64 HE3 MET 64 -11.168 -32.595 13.180 540 H GLU 65 HN GLU 65 -9.178 -35.953 8.781 541 HA GLU 65 HA GLU 65 -7.831 -34.580 6.656 542 1HB GLU 65 HB2 GLU 65 -10.716 -35.456 6.936 543 2HB GLU 65 HB1 GLU 65 -10.002 -34.813 5.463 544 1HG GLU 65 HG2 GLU 65 -8.487 -36.698 5.335 545 2HG GLU 65 HG1 GLU 65 -9.110 -37.329 6.859 546 H VAL 66 HN VAL 66 -7.638 -32.446 6.527 547 HA VAL 66 HA VAL 66 -9.810 -30.745 7.565 548 HB VAL 66 HB VAL 66 -8.153 -28.863 7.405 549 1HG1 VAL 66 HG11 VAL 66 -7.349 -31.183 9.176 550 2HG1 VAL 66 HG12 VAL 66 -8.582 -29.974 9.537 551 3HG1 VAL 66 HG13 VAL 66 -6.889 -29.495 9.418 552 1HG2 VAL 66 HG21 VAL 66 -6.641 -29.842 5.743 553 2HG2 VAL 66 HG22 VAL 66 -6.169 -31.094 6.892 554 3HG2 VAL 66 HG23 VAL 66 -5.763 -29.406 7.211 555 H SER 67 HN SER 67 -11.040 -29.645 6.145 556 HA SER 67 HA SER 67 -10.563 -30.140 3.322 557 1HB SER 67 HB2 SER 67 -12.813 -30.525 4.294 558 2HB SER 67 HB1 SER 67 -12.926 -28.807 4.670 559 HG SER 67 HG SER 67 -12.709 -28.409 2.400 560 H ASN 68 HN ASN 68 -10.161 -27.606 5.582 561 HA ASN 68 HA ASN 68 -9.056 -25.946 3.477 562 1HB ASN 68 HB2 ASN 68 -10.283 -23.916 4.194 563 2HB ASN 68 HB1 ASN 68 -11.361 -25.141 3.534 564 1HD2 ASN 68 HD21 ASN 68 -12.826 -26.123 4.846 565 2HD2 ASN 68 HD22 ASN 68 -13.169 -25.598 6.455 566 H GLU 69 HN GLU 69 -8.324 -23.764 4.651 567 HA GLU 69 HA GLU 69 -6.306 -24.695 6.479 568 1HB GLU 69 HB2 GLU 69 -5.856 -23.051 4.653 569 2HB GLU 69 HB1 GLU 69 -6.850 -21.877 5.506 570 1HG GLU 69 HG2 GLU 69 -5.293 -21.997 7.422 571 2HG GLU 69 HG1 GLU 69 -4.278 -23.102 6.497 572 H SER 70 HN SER 70 -9.311 -22.940 6.705 573 HA SER 70 HA SER 70 -8.881 -21.665 9.187 574 1HB SER 70 HB2 SER 70 -10.746 -21.142 7.559 575 2HB SER 70 HB1 SER 70 -11.556 -22.607 8.109 576 HG SER 70 HG SER 70 -12.199 -21.574 9.815 577 H GLU 71 HN GLU 71 -10.418 -24.778 8.355 578 HA GLU 71 HA GLU 71 -10.940 -25.687 10.939 579 1HB GLU 71 HB2 GLU 71 -10.149 -27.264 8.476 580 2HB GLU 71 HB1 GLU 71 -10.725 -27.998 9.967 581 1HG GLU 71 HG2 GLU 71 -12.860 -26.824 9.718 582 2HG GLU 71 HG1 GLU 71 -12.283 -26.095 8.220 583 H ARG 72 HN ARG 72 -8.030 -26.003 8.958 584 HA ARG 72 HA ARG 72 -6.504 -27.641 10.591 585 1HB ARG 72 HB2 ARG 72 -5.952 -26.994 8.262 586 2HB ARG 72 HB1 ARG 72 -5.557 -25.375 8.810 587 1HG ARG 72 HG2 ARG 72 -4.097 -27.769 9.891 588 2HG ARG 72 HG1 ARG 72 -3.650 -27.046 8.347 589 1HD ARG 72 HD2 ARG 72 -3.391 -24.855 9.539 590 2HD ARG 72 HD1 ARG 72 -3.645 -25.714 11.058 591 HE ARG 72 HE ARG 72 -1.534 -26.790 9.414 592 1HH1 ARG 72 HH11 ARG 72 -2.346 -24.541 11.964 593 2HH1 ARG 72 HH12 ARG 72 -0.722 -24.403 12.538 594 1HH2 ARG 72 HH21 ARG 72 0.629 -26.605 10.163 595 2HH2 ARG 72 HH22 ARG 72 0.966 -25.593 11.526 596 H ASN 73 HN ASN 73 -7.104 -24.182 10.812 597 HA ASN 73 HA ASN 73 -5.136 -23.811 12.909 598 1HB ASN 73 HB2 ASN 73 -7.088 -21.962 11.548 599 2HB ASN 73 HB1 ASN 73 -6.231 -21.465 13.003 600 1HD2 ASN 73 HD21 ASN 73 -5.948 -22.189 9.623 601 2HD2 ASN 73 HD22 ASN 73 -4.332 -21.605 9.432 602 H GLU 74 HN GLU 74 -8.698 -23.797 12.670 603 HA GLU 74 HA GLU 74 -9.167 -22.991 15.319 604 1HB GLU 74 HB2 GLU 74 -11.447 -23.604 14.985 605 2HB GLU 74 HB1 GLU 74 -10.857 -22.986 13.453 606 1HG GLU 74 HG2 GLU 74 -10.615 -25.260 12.619 607 2HG GLU 74 HG1 GLU 74 -11.189 -25.889 14.163 608 H ILE 75 HN ILE 75 -8.916 -26.205 13.871 609 HA ILE 75 HA ILE 75 -9.527 -27.739 16.134 610 HB ILE 75 HB ILE 75 -7.699 -28.367 13.801 611 1HG1 ILE 75 HG12 ILE 75 -10.548 -29.279 14.240 612 2HG1 ILE 75 HG11 ILE 75 -10.165 -27.785 13.394 613 1HG2 ILE 75 HG21 ILE 75 -8.037 -30.734 14.377 614 2HG2 ILE 75 HG22 ILE 75 -8.927 -30.253 15.820 615 3HG2 ILE 75 HG23 ILE 75 -7.214 -29.862 15.671 616 1HD1 ILE 75 HD11 ILE 75 -9.288 -30.540 12.570 617 2HD1 ILE 75 HD12 ILE 75 -8.936 -29.034 11.720 618 3HD1 ILE 75 HD13 ILE 75 -10.599 -29.601 11.856 619 H PHE 76 HN PHE 76 -6.455 -26.464 14.933 620 HA PHE 76 HA PHE 76 -4.763 -27.554 16.880 621 1HB PHE 76 HB2 PHE 76 -3.848 -26.564 14.877 622 2HB PHE 76 HB1 PHE 76 -4.556 -25.000 15.266 623 HD1 PHE 76 HD1 PHE 76 -3.205 -23.399 16.241 624 HD2 PHE 76 HD2 PHE 76 -2.197 -27.514 16.707 625 HE1 PHE 76 HE1 PHE 76 -1.138 -22.758 17.408 626 HE2 PHE 76 HE2 PHE 76 -0.128 -26.876 17.873 627 HZ PHE 76 HZ PHE 76 0.404 -24.496 18.225 628 H GLN 77 HN GLN 77 -6.834 -24.721 16.908 629 HA GLN 77 HA GLN 77 -5.762 -23.597 19.313 630 1HB GLN 77 HB2 GLN 77 -8.434 -23.118 17.960 631 2HB GLN 77 HB1 GLN 77 -7.759 -22.140 19.260 632 1HG GLN 77 HG2 GLN 77 -5.891 -21.500 17.825 633 2HG GLN 77 HG1 GLN 77 -6.539 -22.498 16.525 634 1HE2 GLN 77 HE21 GLN 77 -6.893 -19.557 18.331 635 2HE2 GLN 77 HE22 GLN 77 -8.042 -18.808 17.279 636 H LYS 78 HN LYS 78 -8.368 -25.812 18.514 637 HA LYS 78 HA LYS 78 -9.522 -25.938 21.107 638 1HB LYS 78 HB2 LYS 78 -9.532 -28.141 19.028 639 2HB LYS 78 HB1 LYS 78 -10.694 -27.892 20.325 640 1HG LYS 78 HG2 LYS 78 -11.260 -25.683 19.197 641 2HG LYS 78 HG1 LYS 78 -10.321 -26.263 17.827 642 1HD LYS 78 HD2 LYS 78 -11.786 -28.181 17.581 643 2HD LYS 78 HD1 LYS 78 -12.700 -27.697 19.013 644 1HE LYS 78 HE2 LYS 78 -13.413 -25.657 17.903 645 2HE LYS 78 HE1 LYS 78 -12.431 -26.052 16.492 646 1HZ LYS 78 HZ1 LYS 78 -14.714 -27.679 17.475 647 2HZ LYS 78 HZ2 LYS 78 -13.812 -27.951 16.072 648 3HZ LYS 78 HZ3 LYS 78 -14.790 -26.581 16.193 649 H ILE 79 HN ILE 79 -6.876 -27.575 19.517 650 HA ILE 79 HA ILE 79 -6.409 -29.628 21.374 651 HB ILE 79 HB ILE 79 -4.482 -28.193 19.534 652 1HG1 ILE 79 HG12 ILE 79 -5.908 -30.860 19.273 653 2HG1 ILE 79 HG11 ILE 79 -6.314 -29.389 18.398 654 1HG2 ILE 79 HG21 ILE 79 -4.057 -30.768 21.056 655 2HG2 ILE 79 HG22 ILE 79 -3.245 -29.232 21.364 656 3HG2 ILE 79 HG23 ILE 79 -2.966 -30.088 19.849 657 1HD1 ILE 79 HD11 ILE 79 -3.756 -30.958 18.151 658 2HD1 ILE 79 HD12 ILE 79 -4.120 -29.454 17.302 659 3HD1 ILE 79 HD13 ILE 79 -5.078 -30.900 16.984 660 H SER 80 HN SER 80 -5.561 -26.222 21.426 661 HA SER 80 HA SER 80 -3.812 -26.581 23.720 662 1HB SER 80 HB2 SER 80 -3.584 -24.099 23.613 663 2HB SER 80 HB1 SER 80 -3.159 -24.914 22.110 664 HG SER 80 HG SER 80 -5.804 -24.195 22.263 665 H GLN 81 HN GLN 81 -7.094 -26.479 23.310 666 HA GLN 81 HA GLN 81 -7.666 -24.990 25.765 667 1HB GLN 81 HB2 GLN 81 -9.520 -26.274 23.736 668 2HB GLN 81 HB1 GLN 81 -10.052 -25.383 25.160 669 1HG GLN 81 HG2 GLN 81 -8.844 -23.387 24.282 670 2HG GLN 81 HG1 GLN 81 -8.513 -24.298 22.811 671 1HE2 GLN 81 HE21 GLN 81 -11.126 -25.640 22.857 672 2HE2 GLN 81 HE22 GLN 81 -12.282 -24.445 22.381 673 H LEU 82 HN LEU 82 -6.620 -27.990 25.149 674 HA LEU 82 HA LEU 82 -8.434 -29.612 26.639 675 1HB LEU 82 HB2 LEU 82 -5.496 -30.194 26.271 676 2HB LEU 82 HB1 LEU 82 -6.808 -31.337 26.475 677 HG LEU 82 HG LEU 82 -6.415 -29.599 24.035 678 1HD1 LEU 82 HD11 LEU 82 -5.801 -32.524 24.440 679 2HD1 LEU 82 HD12 LEU 82 -4.629 -31.224 24.209 680 3HD1 LEU 82 HD13 LEU 82 -5.732 -31.656 22.904 681 1HD2 LEU 82 HD21 LEU 82 -8.748 -30.173 24.414 682 2HD2 LEU 82 HD22 LEU 82 -8.321 -31.880 24.549 683 3HD2 LEU 82 HD23 LEU 82 -8.108 -31.035 23.015 684 H ASP 83 HN ASP 83 -5.659 -27.659 27.418 685 HA ASP 83 HA ASP 83 -4.768 -26.912 29.362 686 1HB ASP 83 HB2 ASP 83 -7.039 -26.822 30.326 687 2HB ASP 83 HB1 ASP 83 -6.909 -28.515 30.790 688 H LYS 84 HN LYS 84 -5.561 -30.347 29.234 689 HA LYS 84 HA LYS 84 -3.501 -31.310 30.878 690 1HB LYS 84 HB2 LYS 84 -4.811 -32.573 28.457 691 2HB LYS 84 HB1 LYS 84 -3.671 -33.415 29.493 692 1HG LYS 84 HG2 LYS 84 -5.721 -34.135 30.273 693 2HG LYS 84 HG1 LYS 84 -5.304 -32.848 31.399 694 1HD LYS 84 HD2 LYS 84 -6.762 -31.309 30.218 695 2HD LYS 84 HD1 LYS 84 -7.129 -32.548 29.016 696 1HE LYS 84 HE2 LYS 84 -8.937 -32.360 30.641 697 2HE LYS 84 HE1 LYS 84 -8.156 -33.935 30.758 698 1HZ LYS 84 HZ1 LYS 84 -8.595 -32.968 32.936 699 2HZ LYS 84 HZ2 LYS 84 -7.637 -31.628 32.554 700 3HZ LYS 84 HZ3 LYS 84 -6.934 -33.158 32.683 701 H VAL 85 HN VAL 85 -3.471 -29.984 27.703 702 HA VAL 85 HA VAL 85 -1.016 -31.188 26.845 703 HB VAL 85 HB VAL 85 -2.728 -30.535 25.216 704 1HG1 VAL 85 HG11 VAL 85 -2.094 -27.687 26.003 705 2HG1 VAL 85 HG12 VAL 85 -3.604 -28.545 26.316 706 3HG1 VAL 85 HG13 VAL 85 -3.124 -28.181 24.657 707 1HG2 VAL 85 HG21 VAL 85 -1.259 -29.438 23.587 708 2HG2 VAL 85 HG22 VAL 85 -0.408 -30.696 24.481 709 3HG2 VAL 85 HG23 VAL 85 -0.147 -29.000 24.885 710 H VAL 86 HN VAL 86 0.997 -30.483 27.110 711 HA VAL 86 HA VAL 86 1.428 -27.923 28.495 712 HB VAL 86 HB VAL 86 3.651 -28.782 29.072 713 1HG1 VAL 86 HG11 VAL 86 1.790 -29.233 30.587 714 2HG1 VAL 86 HG12 VAL 86 2.955 -30.557 30.613 715 3HG1 VAL 86 HG13 VAL 86 1.441 -30.735 29.726 716 1HG2 VAL 86 HG21 VAL 86 4.278 -31.103 28.573 717 2HG2 VAL 86 HG22 VAL 86 4.062 -30.165 27.097 718 3HG2 VAL 86 HG23 VAL 86 2.811 -31.295 27.614 719 H GLN 87 HN GLN 87 1.877 -29.507 25.480 720 HA GLN 87 HA GLN 87 3.005 -27.109 24.347 721 1HB GLN 87 HB2 GLN 87 5.018 -28.318 25.158 722 2HB GLN 87 HB1 GLN 87 4.566 -29.701 24.173 723 1HG GLN 87 HG2 GLN 87 6.329 -28.337 23.139 724 2HG GLN 87 HG1 GLN 87 4.871 -28.416 22.148 725 1HE2 GLN 87 HE21 GLN 87 3.698 -26.564 21.773 726 2HE2 GLN 87 HE22 GLN 87 4.237 -24.989 22.238 727 H THR 88 HN THR 88 1.810 -26.794 22.619 728 HA THR 88 HA THR 88 0.831 -29.066 21.041 729 HB THR 88 HB THR 88 -0.535 -27.341 19.859 730 HG1 THR 88 HG1 THR 88 -0.352 -25.322 21.578 731 1HG2 THR 88 HG21 THR 88 -1.489 -28.504 21.793 732 2HG2 THR 88 HG22 THR 88 -2.062 -26.837 21.718 733 3HG2 THR 88 HG23 THR 88 -0.804 -27.287 22.871 734 H LEU 89 HN LEU 89 1.701 -29.544 19.074 735 HA LEU 89 HA LEU 89 3.553 -27.572 17.890 736 1HB LEU 89 HB2 LEU 89 3.579 -30.586 17.628 737 2HB LEU 89 HB1 LEU 89 4.625 -29.503 16.735 738 HG LEU 89 HG LEU 89 5.929 -30.407 18.498 739 1HD1 LEU 89 HD11 LEU 89 5.058 -27.643 19.330 740 2HD1 LEU 89 HD12 LEU 89 6.280 -28.031 18.119 741 3HD1 LEU 89 HD13 LEU 89 6.552 -28.451 19.810 742 1HD2 LEU 89 HD21 LEU 89 3.754 -29.594 20.429 743 2HD2 LEU 89 HD22 LEU 89 5.301 -30.323 20.856 744 3HD2 LEU 89 HD23 LEU 89 4.125 -31.239 19.916 745 H GLY 90 HN GLY 90 2.421 -26.503 16.414 746 1HA GLY 90 HA2 GLY 90 0.631 -28.018 14.609 747 2HA GLY 90 HA1 GLY 90 0.413 -26.329 15.043 748 H SER 91 HN SER 91 3.017 -28.361 13.744 749 HA SER 91 HA SER 91 3.916 -26.235 12.009 750 1HB SER 91 HB2 SER 91 4.878 -29.103 12.249 751 2HB SER 91 HB1 SER 91 5.719 -27.776 11.451 752 HG SER 91 HG SER 91 5.178 -26.948 13.885 Start of MODEL 2 1 1H GLN 1 HT1 GLN 1 -4.208 -17.998 11.782 2 2H GLN 1 HT2 GLN 1 -4.326 -16.322 11.969 3 3H GLN 1 HT3 GLN 1 -4.248 -17.323 13.332 4 HA GLN 1 HA GLN 1 -2.146 -16.199 12.901 5 1HB GLN 1 HB2 GLN 1 -2.194 -18.410 14.015 6 2HB GLN 1 HB1 GLN 1 -2.081 -19.199 12.449 7 1HG GLN 1 HG2 GLN 1 0.131 -18.236 12.104 8 2HG GLN 1 HG1 GLN 1 0.018 -17.395 13.650 9 1HE2 GLN 1 HE21 GLN 1 0.150 -18.593 15.571 10 2HE2 GLN 1 HE22 GLN 1 0.807 -20.193 15.601 11 H GLY 2 HN GLY 2 -1.791 -14.957 11.124 12 1HA GLY 2 HA2 GLY 2 -1.698 -16.149 8.469 13 2HA GLY 2 HA1 GLY 2 -1.541 -14.444 8.861 14 H HIS 3 HN HIS 3 0.093 -17.029 7.678 15 HA HIS 3 HA HIS 3 2.639 -16.715 8.912 16 1HB HIS 3 HB2 HIS 3 3.503 -18.108 7.081 17 2HB HIS 3 HB1 HIS 3 2.040 -18.798 7.769 18 HD1 HIS 3 HD1 HIS 3 -0.027 -18.966 6.238 19 HD2 HIS 3 HD2 HIS 3 3.275 -17.223 4.412 20 HE1 HIS 3 HE1 HIS 3 -0.563 -18.914 3.788 21 HE2 HIS 3 HE2 HIS 3 1.538 -18.064 2.692 22 H MET 4 HN MET 4 4.410 -15.562 8.292 23 HA MET 4 HA MET 4 3.957 -13.054 7.090 24 1HB MET 4 HB2 MET 4 6.499 -14.498 7.867 25 2HB MET 4 HB1 MET 4 6.495 -12.861 7.227 26 1HG MET 4 HG2 MET 4 6.642 -12.865 9.651 27 2HG MET 4 HG1 MET 4 5.148 -12.108 9.106 28 1HE MET 4 HE1 MET 4 6.780 -15.144 10.959 29 2HE MET 4 HE2 MET 4 6.172 -15.917 9.495 30 3HE MET 4 HE3 MET 4 5.440 -16.284 11.058 31 HA PRO 5 HA PRO 5 4.652 -13.818 2.785 32 1HB PRO 5 HB2 PRO 5 5.785 -11.464 2.002 33 2HB PRO 5 HB1 PRO 5 4.068 -11.618 2.394 34 1HG PRO 5 HG2 PRO 5 6.314 -10.597 4.102 35 2HG PRO 5 HG1 PRO 5 4.685 -9.928 3.877 36 1HD PRO 5 HD2 PRO 5 5.342 -11.411 6.039 37 2HD PRO 5 HD1 PRO 5 3.719 -11.459 5.321 38 H SER 6 HN SER 6 6.295 -14.272 1.255 39 HA SER 6 HA SER 6 9.064 -13.855 1.812 40 1HB SER 6 HB2 SER 6 9.610 -16.323 2.030 41 2HB SER 6 HB1 SER 6 8.803 -15.615 3.428 42 HG SER 6 HG SER 6 6.800 -16.412 2.300 43 H ASP 7 HN ASP 7 10.449 -14.854 0.156 44 HA ASP 7 HA ASP 7 9.233 -14.709 -2.431 45 1HB ASP 7 HB2 ASP 7 11.448 -14.964 -3.314 46 2HB ASP 7 HB1 ASP 7 11.586 -13.952 -1.882 47 H SER 8 HN SER 8 10.449 -17.263 -0.357 48 HA SER 8 HA SER 8 10.245 -19.372 -2.246 49 1HB SER 8 HB2 SER 8 11.696 -19.483 -0.242 50 2HB SER 8 HB1 SER 8 10.265 -19.496 0.786 51 HG SER 8 HG SER 8 11.437 -21.534 -0.599 52 H LYS 9 HN LYS 9 8.420 -20.110 -3.082 53 HA LYS 9 HA LYS 9 5.850 -19.762 -1.826 54 1HB LYS 9 HB2 LYS 9 6.639 -21.326 -4.305 55 2HB LYS 9 HB1 LYS 9 4.990 -20.975 -3.806 56 1HG LYS 9 HG2 LYS 9 7.033 -18.869 -4.493 57 2HG LYS 9 HG1 LYS 9 5.849 -19.518 -5.628 58 1HD LYS 9 HD2 LYS 9 5.163 -18.139 -3.025 59 2HD LYS 9 HD1 LYS 9 5.161 -17.356 -4.605 60 1HE LYS 9 HE2 LYS 9 3.441 -18.940 -5.373 61 2HE LYS 9 HE1 LYS 9 3.432 -19.695 -3.779 62 1HZ LYS 9 HZ1 LYS 9 1.618 -18.127 -4.024 63 2HZ LYS 9 HZ2 LYS 9 2.705 -16.876 -4.366 64 3HZ LYS 9 HZ3 LYS 9 2.696 -17.593 -2.835 65 H LYS 10 HN LYS 10 4.748 -21.228 -0.638 66 HA LYS 10 HA LYS 10 6.104 -23.535 0.354 67 1HB LYS 10 HB2 LYS 10 3.363 -22.361 0.789 68 2HB LYS 10 HB1 LYS 10 3.756 -23.956 1.418 69 1HG LYS 10 HG2 LYS 10 4.072 -22.255 3.121 70 2HG LYS 10 HG1 LYS 10 5.608 -23.012 2.700 71 1HD LYS 10 HD2 LYS 10 5.911 -21.023 1.084 72 2HD LYS 10 HD1 LYS 10 4.608 -20.262 1.998 73 1HE LYS 10 HE2 LYS 10 5.908 -20.514 4.057 74 2HE LYS 10 HE1 LYS 10 7.198 -21.297 3.143 75 1HZ LYS 10 HZ1 LYS 10 7.718 -18.989 3.519 76 2HZ LYS 10 HZ2 LYS 10 6.266 -18.497 2.806 77 3HZ LYS 10 HZ3 LYS 10 7.459 -19.242 1.868 78 HA PRO 11 HA PRO 11 4.940 -26.615 -2.611 79 1HB PRO 11 HB2 PRO 11 4.432 -28.732 -0.870 80 2HB PRO 11 HB1 PRO 11 6.024 -28.282 -1.485 81 1HG PRO 11 HG2 PRO 11 4.744 -27.607 1.134 82 2HG PRO 11 HG1 PRO 11 6.429 -28.043 0.788 83 1HD PRO 11 HD2 PRO 11 5.718 -25.498 1.227 84 2HD PRO 11 HD1 PRO 11 6.951 -25.907 0.014 85 H THR 12 HN THR 12 3.066 -26.923 -3.631 86 HA THR 12 HA THR 12 0.608 -26.070 -2.578 87 HB THR 12 HB THR 12 1.047 -27.864 -4.982 88 HG1 THR 12 HG1 THR 12 0.846 -25.661 -6.025 89 1HG2 THR 12 HG21 THR 12 -1.301 -27.740 -4.268 90 2HG2 THR 12 HG22 THR 12 -1.058 -26.891 -5.794 91 3HG2 THR 12 HG23 THR 12 -1.220 -25.977 -4.294 92 H ILE 13 HN ILE 13 -0.449 -27.065 -0.999 93 HA ILE 13 HA ILE 13 -0.379 -29.976 -0.741 94 HB ILE 13 HB ILE 13 -1.637 -27.885 1.059 95 1HG1 ILE 13 HG12 ILE 13 0.822 -27.695 0.958 96 2HG1 ILE 13 HG11 ILE 13 0.285 -28.252 2.540 97 1HG2 ILE 13 HG21 ILE 13 -1.761 -29.689 2.732 98 2HG2 ILE 13 HG22 ILE 13 -1.170 -30.834 1.528 99 3HG2 ILE 13 HG23 ILE 13 -2.732 -30.047 1.302 100 1HD1 ILE 13 HD11 ILE 13 1.395 -30.000 0.355 101 2HD1 ILE 13 HD12 ILE 13 0.909 -30.526 1.967 102 3HD1 ILE 13 HD13 ILE 13 2.277 -29.430 1.771 103 H ILE 14 HN ILE 14 -2.167 -31.270 -1.010 104 HA ILE 14 HA ILE 14 -4.348 -30.172 -2.554 105 HB ILE 14 HB ILE 14 -3.893 -33.004 -1.573 106 1HG1 ILE 14 HG12 ILE 14 -2.135 -32.301 -3.111 107 2HG1 ILE 14 HG11 ILE 14 -3.197 -33.453 -3.911 108 1HG2 ILE 14 HG21 ILE 14 -6.252 -32.596 -2.018 109 2HG2 ILE 14 HG22 ILE 14 -5.568 -33.653 -3.254 110 3HG2 ILE 14 HG23 ILE 14 -5.861 -31.950 -3.612 111 1HD1 ILE 14 HD11 ILE 14 -3.215 -30.463 -4.279 112 2HD1 ILE 14 HD12 ILE 14 -4.320 -31.597 -5.057 113 3HD1 ILE 14 HD13 ILE 14 -2.595 -31.664 -5.413 114 H TYR 15 HN TYR 15 -6.340 -29.698 -1.844 115 HA TYR 15 HA TYR 15 -7.079 -30.469 0.904 116 1HB TYR 15 HB2 TYR 15 -7.545 -27.813 -0.482 117 2HB TYR 15 HB1 TYR 15 -8.312 -28.276 1.032 118 HD1 TYR 15 HD1 TYR 15 -7.035 -28.359 3.107 119 HD2 TYR 15 HD2 TYR 15 -5.158 -27.264 -0.557 120 HE1 TYR 15 HE1 TYR 15 -5.108 -27.491 4.359 121 HE2 TYR 15 HE2 TYR 15 -3.224 -26.395 0.691 122 HH TYR 15 HH TYR 15 -2.735 -27.020 3.998 123 HA PRO 16 HA PRO 16 -8.664 -30.561 2.138 124 1HB PRO 16 HB2 PRO 16 -10.675 -32.501 2.755 125 2HB PRO 16 HB1 PRO 16 -10.734 -30.760 3.032 126 1HG PRO 16 HG2 PRO 16 -12.345 -32.140 1.241 127 2HG PRO 16 HG1 PRO 16 -12.025 -30.397 1.189 128 1HD PRO 16 HD2 PRO 16 -10.757 -32.608 -0.395 129 2HD PRO 16 HD1 PRO 16 -11.232 -30.974 -0.916 130 H CYS 17 HN CYS 17 -7.424 -31.899 3.384 131 HA CYS 17 HA CYS 17 -7.170 -34.733 2.771 132 1HB CYS 17 HB2 CYS 17 -5.598 -33.674 1.194 133 2HB CYS 17 HB1 CYS 17 -4.828 -32.817 2.523 134 HG CYS 17 HG CYS 17 -2.977 -34.655 2.198 135 H LEU 18 HN LEU 18 -5.694 -35.804 4.341 136 HA LEU 18 HA LEU 18 -6.350 -34.974 6.987 137 1HB LEU 18 HB2 LEU 18 -4.509 -37.137 5.955 138 2HB LEU 18 HB1 LEU 18 -4.896 -36.915 7.653 139 HG LEU 18 HG LEU 18 -6.998 -37.444 5.549 140 1HD1 LEU 18 HD11 LEU 18 -5.456 -39.329 5.591 141 2HD1 LEU 18 HD12 LEU 18 -7.001 -39.770 6.318 142 3HD1 LEU 18 HD13 LEU 18 -5.607 -39.433 7.346 143 1HD2 LEU 18 HD21 LEU 18 -7.041 -37.670 8.561 144 2HD2 LEU 18 HD22 LEU 18 -8.371 -38.072 7.474 145 3HD2 LEU 18 HD23 LEU 18 -7.811 -36.406 7.601 146 H TRP 19 HN TRP 19 -5.440 -33.148 7.695 147 HA TRP 19 HA TRP 19 -2.598 -32.626 7.342 148 1HB TRP 19 HB2 TRP 19 -4.377 -30.823 7.181 149 2HB TRP 19 HB1 TRP 19 -4.621 -31.002 8.914 150 HD1 TRP 19 HD1 TRP 19 -2.623 -30.132 10.528 151 HE1 TRP 19 HE1 TRP 19 -0.748 -28.418 10.125 152 HE3 TRP 19 HE3 TRP 19 -2.809 -29.900 5.421 153 HZ2 TRP 19 HZ2 TRP 19 0.487 -27.134 7.942 154 HZ3 TRP 19 HZ3 TRP 19 -1.248 -28.399 4.252 155 HH2 TRP 19 HH2 TRP 19 0.366 -27.043 5.489 156 H ASP 20 HN ASP 20 -1.117 -32.536 9.068 157 HA ASP 20 HA ASP 20 -1.938 -34.184 11.365 158 1HB ASP 20 HB2 ASP 20 -0.252 -35.212 9.889 159 2HB ASP 20 HB1 ASP 20 0.819 -33.840 10.157 160 H TYR 21 HN TYR 21 -1.697 -33.487 13.364 161 HA TYR 21 HA TYR 21 -0.302 -30.939 13.874 162 1HB TYR 21 HB2 TYR 21 -2.816 -31.975 15.229 163 2HB TYR 21 HB1 TYR 21 -1.982 -30.478 15.622 164 HD1 TYR 21 HD1 TYR 21 -2.244 -28.507 14.241 165 HD2 TYR 21 HD2 TYR 21 -4.136 -32.169 13.159 166 HE1 TYR 21 HE1 TYR 21 -3.658 -27.297 12.632 167 HE2 TYR 21 HE2 TYR 21 -5.550 -30.968 11.546 168 HH TYR 21 HH TYR 21 -6.397 -28.673 11.198 169 H ARG 22 HN ARG 22 1.231 -31.052 15.424 170 HA ARG 22 HA ARG 22 1.482 -33.512 16.995 171 1HB ARG 22 HB2 ARG 22 3.499 -32.704 15.878 172 2HB ARG 22 HB1 ARG 22 3.344 -31.143 16.666 173 1HG ARG 22 HG2 ARG 22 5.070 -32.436 17.744 174 2HG ARG 22 HG1 ARG 22 3.712 -32.222 18.850 175 1HD ARG 22 HD2 ARG 22 2.932 -34.473 18.370 176 2HD ARG 22 HD1 ARG 22 4.218 -34.691 17.182 177 HE ARG 22 HE ARG 22 4.637 -34.411 20.093 178 1HH1 ARG 22 HH11 ARG 22 5.647 -35.580 16.954 179 2HH1 ARG 22 HH12 ARG 22 6.995 -36.481 17.579 180 1HH2 ARG 22 HH21 ARG 22 6.399 -35.602 20.931 181 2HH2 ARG 22 HH22 ARG 22 7.425 -36.489 19.845 182 H VAL 23 HN VAL 23 0.381 -33.558 18.837 183 HA VAL 23 HA VAL 23 -0.006 -31.048 20.349 184 HB VAL 23 HB VAL 23 -1.690 -33.569 20.430 185 1HG1 VAL 23 HG11 VAL 23 -2.145 -30.858 21.689 186 2HG1 VAL 23 HG12 VAL 23 -1.736 -32.348 22.541 187 3HG1 VAL 23 HG13 VAL 23 -3.285 -32.205 21.709 188 1HG2 VAL 23 HG21 VAL 23 -2.261 -30.914 19.098 189 2HG2 VAL 23 HG22 VAL 23 -3.391 -32.262 19.232 190 3HG2 VAL 23 HG23 VAL 23 -1.918 -32.439 18.278 191 H ILE 24 HN ILE 24 1.215 -30.907 22.136 192 HA ILE 24 HA ILE 24 1.987 -33.405 23.516 193 HB ILE 24 HB ILE 24 3.335 -30.692 23.643 194 1HG1 ILE 24 HG12 ILE 24 4.215 -33.252 22.265 195 2HG1 ILE 24 HG11 ILE 24 3.628 -31.805 21.453 196 1HG2 ILE 24 HG21 ILE 24 5.115 -31.872 24.869 197 2HG2 ILE 24 HG22 ILE 24 4.154 -33.351 24.831 198 3HG2 ILE 24 HG23 ILE 24 3.574 -31.945 25.725 199 1HD1 ILE 24 HD11 ILE 24 6.138 -32.006 23.104 200 2HD1 ILE 24 HD12 ILE 24 5.551 -30.555 22.292 201 3HD1 ILE 24 HD13 ILE 24 6.046 -31.957 21.344 202 H MET 25 HN MET 25 0.653 -33.784 25.177 203 HA MET 25 HA MET 25 -0.193 -31.504 26.862 204 1HB MET 25 HB2 MET 25 -1.683 -34.113 26.419 205 2HB MET 25 HB1 MET 25 -2.209 -32.783 27.440 206 1HG MET 25 HG2 MET 25 -2.069 -31.401 25.234 207 2HG MET 25 HG1 MET 25 -2.160 -32.982 24.465 208 1HE MET 25 HE1 MET 25 -4.063 -34.585 26.516 209 2HE MET 25 HE2 MET 25 -4.243 -34.651 24.762 210 3HE MET 25 HE3 MET 25 -5.640 -34.289 25.779 211 H THR 26 HN THR 26 -0.198 -31.807 29.116 212 HA THR 26 HA THR 26 1.706 -33.790 30.071 213 HB THR 26 HB THR 26 1.309 -32.581 32.295 214 HG1 THR 26 HG1 THR 26 -0.569 -31.504 32.060 215 1HG2 THR 26 HG21 THR 26 3.255 -32.098 30.890 216 2HG2 THR 26 HG22 THR 26 2.646 -30.622 31.638 217 3HG2 THR 26 HG23 THR 26 2.300 -30.957 29.942 218 H THR 27 HN THR 27 -0.566 -35.007 29.118 219 HA THR 27 HA THR 27 -1.593 -36.422 31.394 220 HB THR 27 HB THR 27 -3.085 -34.453 31.451 221 HG1 THR 27 HG1 THR 27 -4.496 -35.919 32.017 222 1HG2 THR 27 HG21 THR 27 -4.608 -33.995 29.573 223 2HG2 THR 27 HG22 THR 27 -3.808 -35.238 28.617 224 3HG2 THR 27 HG23 THR 27 -2.924 -33.788 29.096 225 H LYS 28 HN LYS 28 -2.824 -38.305 30.743 226 HA LYS 28 HA LYS 28 -2.637 -38.939 27.871 227 1HB LYS 28 HB2 LYS 28 -2.970 -40.750 30.273 228 2HB LYS 28 HB1 LYS 28 -3.149 -41.306 28.614 229 1HG LYS 28 HG2 LYS 28 -0.765 -40.378 28.267 230 2HG LYS 28 HG1 LYS 28 -0.674 -40.373 30.030 231 1HD LYS 28 HD2 LYS 28 0.249 -42.451 29.208 232 2HD LYS 28 HD1 LYS 28 -1.281 -42.791 30.022 233 1HE LYS 28 HE2 LYS 28 -2.406 -42.815 27.807 234 2HE LYS 28 HE1 LYS 28 -0.838 -42.576 27.038 235 1HZ LYS 28 HZ1 LYS 28 -1.678 -44.918 28.658 236 2HZ LYS 28 HZ2 LYS 28 -0.113 -44.681 28.066 237 3HZ LYS 28 HZ3 LYS 28 -1.400 -44.889 26.989 238 H ASP 29 HN ASP 29 -4.746 -37.659 30.002 239 HA ASP 29 HA ASP 29 -7.113 -39.151 29.274 240 1HB ASP 29 HB2 ASP 29 -6.832 -38.074 31.531 241 2HB ASP 29 HB1 ASP 29 -6.946 -36.503 30.744 242 H THR 30 HN THR 30 -6.847 -38.873 26.979 243 HA THR 30 HA THR 30 -7.363 -36.215 25.933 244 HB THR 30 HB THR 30 -5.835 -37.519 24.615 245 HG1 THR 30 HG1 THR 30 -7.089 -37.611 22.594 246 1HG2 THR 30 HG21 THR 30 -8.006 -39.609 24.350 247 2HG2 THR 30 HG22 THR 30 -6.523 -39.776 25.290 248 3HG2 THR 30 HG23 THR 30 -6.442 -39.633 23.533 249 H SER 31 HN SER 31 -9.348 -35.562 26.393 250 HA SER 31 HA SER 31 -11.612 -37.197 25.461 251 1HB SER 31 HB2 SER 31 -11.605 -35.471 27.962 252 2HB SER 31 HB1 SER 31 -12.928 -36.486 27.386 253 HG SER 31 HG SER 31 -10.629 -37.163 28.761 254 H THR 32 HN THR 32 -10.918 -33.934 26.732 255 HA THR 32 HA THR 32 -12.834 -32.580 25.207 256 HB THR 32 HB THR 32 -10.214 -31.449 26.239 257 HG1 THR 32 HG1 THR 32 -12.717 -31.922 27.536 258 1HG2 THR 32 HG21 THR 32 -11.452 -29.923 24.757 259 2HG2 THR 32 HG22 THR 32 -11.478 -29.347 26.423 260 3HG2 THR 32 HG23 THR 32 -12.902 -30.134 25.742 261 H LEU 33 HN LEU 33 -9.488 -33.433 24.535 262 HA LEU 33 HA LEU 33 -9.003 -32.001 22.214 263 1HB LEU 33 HB2 LEU 33 -7.283 -33.312 23.334 264 2HB LEU 33 HB1 LEU 33 -8.126 -34.801 22.951 265 HG LEU 33 HG LEU 33 -7.688 -34.429 20.547 266 1HD1 LEU 33 HD11 LEU 33 -6.125 -32.684 19.835 267 2HD1 LEU 33 HD12 LEU 33 -6.101 -32.033 21.475 268 3HD1 LEU 33 HD13 LEU 33 -7.592 -31.995 20.532 269 1HD2 LEU 33 HD21 LEU 33 -5.275 -34.872 20.607 270 2HD2 LEU 33 HD22 LEU 33 -6.136 -35.783 21.847 271 3HD2 LEU 33 HD23 LEU 33 -5.220 -34.341 22.289 272 H LYS 34 HN LYS 34 -10.542 -35.201 22.551 273 HA LYS 34 HA LYS 34 -11.006 -35.514 19.757 274 1HB LYS 34 HB2 LYS 34 -12.219 -36.897 22.156 275 2HB LYS 34 HB1 LYS 34 -12.577 -37.347 20.494 276 1HG LYS 34 HG2 LYS 34 -10.224 -37.901 20.125 277 2HG LYS 34 HG1 LYS 34 -9.847 -37.425 21.783 278 1HD LYS 34 HD2 LYS 34 -11.747 -39.646 20.994 279 2HD LYS 34 HD1 LYS 34 -10.081 -39.877 21.530 280 1HE LYS 34 HE2 LYS 34 -10.592 -38.965 23.693 281 2HE LYS 34 HE1 LYS 34 -12.212 -38.510 23.174 282 1HZ LYS 34 HZ1 LYS 34 -12.701 -40.880 22.876 283 2HZ LYS 34 HZ2 LYS 34 -12.306 -40.502 24.475 284 3HZ LYS 34 HZ3 LYS 34 -11.172 -41.276 23.486 285 H GLU 35 HN GLU 35 -12.885 -34.201 22.430 286 HA GLU 35 HA GLU 35 -15.409 -34.096 21.276 287 1HB GLU 35 HB2 GLU 35 -14.107 -32.133 23.179 288 2HB GLU 35 HB1 GLU 35 -15.821 -32.137 22.785 289 1HG GLU 35 HG2 GLU 35 -14.317 -34.393 24.105 290 2HG GLU 35 HG1 GLU 35 -15.360 -33.231 24.922 291 H LEU 36 HN LEU 36 -12.813 -31.653 21.117 292 HA LEU 36 HA LEU 36 -14.297 -29.843 19.520 293 1HB LEU 36 HB2 LEU 36 -12.278 -28.601 19.264 294 2HB LEU 36 HB1 LEU 36 -12.312 -29.228 20.898 295 HG LEU 36 HG LEU 36 -10.831 -31.159 19.778 296 1HD1 LEU 36 HD11 LEU 36 -10.882 -30.289 17.531 297 2HD1 LEU 36 HD12 LEU 36 -9.244 -30.166 18.170 298 3HD1 LEU 36 HD13 LEU 36 -10.266 -28.730 18.078 299 1HD2 LEU 36 HD21 LEU 36 -8.842 -29.971 20.571 300 2HD2 LEU 36 HD22 LEU 36 -10.184 -29.826 21.706 301 3HD2 LEU 36 HD23 LEU 36 -9.770 -28.472 20.654 302 H LEU 37 HN LEU 37 -12.268 -32.592 18.784 303 HA LEU 37 HA LEU 37 -12.071 -32.114 15.979 304 1HB LEU 37 HB2 LEU 37 -11.834 -34.706 17.528 305 2HB LEU 37 HB1 LEU 37 -11.367 -34.482 15.851 306 HG LEU 37 HG LEU 37 -10.095 -33.069 18.207 307 1HD1 LEU 37 HD11 LEU 37 -9.071 -35.370 16.538 308 2HD1 LEU 37 HD12 LEU 37 -9.595 -35.458 18.221 309 3HD1 LEU 37 HD13 LEU 37 -8.168 -34.517 17.792 310 1HD2 LEU 37 HD21 LEU 37 -9.995 -31.755 16.148 311 2HD2 LEU 37 HD22 LEU 37 -9.306 -33.135 15.292 312 3HD2 LEU 37 HD23 LEU 37 -8.400 -32.362 16.593 313 H GLU 38 HN GLU 38 -14.387 -33.700 18.067 314 HA GLU 38 HA GLU 38 -15.779 -35.057 15.977 315 1HB GLU 38 HB2 GLU 38 -16.434 -34.544 18.873 316 2HB GLU 38 HB1 GLU 38 -17.530 -35.404 17.797 317 1HG GLU 38 HG2 GLU 38 -14.685 -36.237 18.352 318 2HG GLU 38 HG1 GLU 38 -16.098 -36.882 19.185 319 H THR 39 HN THR 39 -16.032 -31.879 17.390 320 HA THR 39 HA THR 39 -18.679 -31.296 16.644 321 HB THR 39 HB THR 39 -18.043 -28.909 16.744 322 HG1 THR 39 HG1 THR 39 -15.445 -30.014 16.710 323 1HG2 THR 39 HG21 THR 39 -17.296 -28.869 19.082 324 2HG2 THR 39 HG22 THR 39 -16.846 -30.570 18.969 325 3HG2 THR 39 HG23 THR 39 -18.539 -30.094 18.829 326 H TYR 40 HN TYR 40 -15.930 -31.805 14.692 327 HA TYR 40 HA TYR 40 -16.971 -30.275 12.431 328 1HB TYR 40 HB2 TYR 40 -14.460 -31.951 12.701 329 2HB TYR 40 HB1 TYR 40 -14.900 -31.019 11.276 330 HD1 TYR 40 HD1 TYR 40 -14.854 -28.533 11.350 331 HD2 TYR 40 HD2 TYR 40 -13.529 -30.890 14.638 332 HE1 TYR 40 HE1 TYR 40 -13.705 -26.566 12.291 333 HE2 TYR 40 HE2 TYR 40 -12.380 -28.931 15.586 334 HH TYR 40 HH TYR 40 -12.751 -25.735 14.166 335 H GLN 41 HN GLN 41 -17.207 -33.408 13.715 336 HA GLN 41 HA GLN 41 -18.102 -35.362 12.997 337 1HB GLN 41 HB2 GLN 41 -19.400 -33.444 11.061 338 2HB GLN 41 HB1 GLN 41 -19.784 -35.159 11.074 339 1HG GLN 41 HG2 GLN 41 -20.151 -33.248 13.379 340 2HG GLN 41 HG1 GLN 41 -21.424 -33.871 12.330 341 1HE2 GLN 41 HE21 GLN 41 -19.270 -34.580 14.947 342 2HE2 GLN 41 HE22 GLN 41 -19.953 -36.104 15.382 343 H ARG 42 HN ARG 42 -15.498 -34.700 12.016 344 HA ARG 42 HA ARG 42 -15.513 -36.197 9.473 345 1HB ARG 42 HB2 ARG 42 -13.631 -34.896 8.684 346 2HB ARG 42 HB1 ARG 42 -14.928 -33.798 9.136 347 1HG ARG 42 HG2 ARG 42 -13.770 -33.422 11.311 348 2HG ARG 42 HG1 ARG 42 -12.429 -34.402 10.712 349 1HD ARG 42 HD2 ARG 42 -11.870 -32.108 10.357 350 2HD ARG 42 HD1 ARG 42 -12.236 -32.818 8.785 351 HE ARG 42 HE ARG 42 -14.589 -31.683 9.769 352 1HH1 ARG 42 HH11 ARG 42 -11.435 -30.675 8.662 353 2HH1 ARG 42 HH12 ARG 42 -11.966 -29.097 8.179 354 1HH2 ARG 42 HH21 ARG 42 -15.299 -29.594 9.127 355 2HH2 ARG 42 HH22 ARG 42 -14.152 -28.479 8.447 356 HA PRO 43 HA PRO 43 -12.973 -39.112 11.542 357 1HB PRO 43 HB2 PRO 43 -11.397 -40.059 9.532 358 2HB PRO 43 HB1 PRO 43 -13.118 -40.439 9.664 359 1HG PRO 43 HG2 PRO 43 -11.766 -38.368 7.965 360 2HG PRO 43 HG1 PRO 43 -13.053 -39.508 7.525 361 1HD PRO 43 HD2 PRO 43 -13.569 -36.924 8.123 362 2HD PRO 43 HD1 PRO 43 -14.703 -38.229 8.533 363 H PHE 44 HN PHE 44 -11.033 -39.329 12.576 364 HA PHE 44 HA PHE 44 -8.727 -37.793 11.678 365 1HB PHE 44 HB2 PHE 44 -8.338 -36.797 13.878 366 2HB PHE 44 HB1 PHE 44 -9.894 -36.281 13.242 367 HD1 PHE 44 HD1 PHE 44 -8.193 -38.262 15.806 368 HD2 PHE 44 HD2 PHE 44 -11.971 -37.003 14.286 369 HE1 PHE 44 HE1 PHE 44 -9.271 -39.005 17.879 370 HE2 PHE 44 HE2 PHE 44 -13.056 -37.749 16.365 371 HZ PHE 44 HZ PHE 44 -11.706 -38.752 18.168 372 H LYS 45 HN LYS 45 -6.765 -38.636 12.381 373 HA LYS 45 HA LYS 45 -6.946 -41.368 13.434 374 1HB LYS 45 HB2 LYS 45 -5.862 -40.899 11.177 375 2HB LYS 45 HB1 LYS 45 -4.565 -40.105 12.055 376 1HG LYS 45 HG2 LYS 45 -5.329 -42.925 12.725 377 2HG LYS 45 HG1 LYS 45 -4.318 -42.590 11.325 378 1HD LYS 45 HD2 LYS 45 -3.690 -41.717 14.149 379 2HD LYS 45 HD1 LYS 45 -3.026 -43.153 13.368 380 1HE LYS 45 HE2 LYS 45 -2.660 -40.302 12.432 381 2HE LYS 45 HE1 LYS 45 -1.457 -41.270 13.282 382 1HZ LYS 45 HZ1 LYS 45 -1.053 -41.253 10.905 383 2HZ LYS 45 HZ2 LYS 45 -2.594 -41.887 10.607 384 3HZ LYS 45 HZ3 LYS 45 -1.443 -42.816 11.424 385 H LEU 46 HN LEU 46 -6.797 -41.343 15.549 386 HA LEU 46 HA LEU 46 -4.973 -39.492 16.917 387 1HB LEU 46 HB2 LEU 46 -7.325 -39.552 17.651 388 2HB LEU 46 HB1 LEU 46 -7.184 -41.267 17.984 389 HG LEU 46 HG LEU 46 -5.447 -40.703 19.725 390 1HD1 LEU 46 HD11 LEU 46 -5.361 -38.405 20.560 391 2HD1 LEU 46 HD12 LEU 46 -6.399 -37.880 19.234 392 3HD1 LEU 46 HD13 LEU 46 -4.786 -38.511 18.896 393 1HD2 LEU 46 HD21 LEU 46 -7.081 -39.989 21.397 394 2HD2 LEU 46 HD22 LEU 46 -7.761 -41.212 20.325 395 3HD2 LEU 46 HD23 LEU 46 -8.197 -39.516 20.115 396 H GLU 47 HN GLU 47 -3.065 -40.226 17.600 397 HA GLU 47 HA GLU 47 -2.783 -42.974 18.542 398 1HB GLU 47 HB2 GLU 47 -1.364 -41.833 16.163 399 2HB GLU 47 HB1 GLU 47 -0.478 -42.927 17.216 400 1HG GLU 47 HG2 GLU 47 -3.085 -43.563 15.835 401 2HG GLU 47 HG1 GLU 47 -1.485 -44.081 15.302 402 H PHE 48 HN PHE 48 -0.897 -43.313 19.837 403 HA PHE 48 HA PHE 48 -0.017 -40.874 21.193 404 1HB PHE 48 HB2 PHE 48 -0.917 -42.703 22.567 405 2HB PHE 48 HB1 PHE 48 0.302 -43.800 21.931 406 HD1 PHE 48 HD1 PHE 48 2.428 -43.947 22.935 407 HD2 PHE 48 HD2 PHE 48 -0.170 -40.727 23.950 408 HE1 PHE 48 HE1 PHE 48 3.936 -43.313 24.770 409 HE2 PHE 48 HE2 PHE 48 1.336 -40.091 25.786 410 HZ PHE 48 HZ PHE 48 3.390 -41.385 26.198 411 H LYS 49 HN LYS 49 1.833 -39.971 20.554 412 HA LYS 49 HA LYS 49 3.714 -41.266 18.851 413 1HB LYS 49 HB2 LYS 49 3.885 -38.680 20.416 414 2HB LYS 49 HB1 LYS 49 5.110 -39.212 19.278 415 1HG LYS 49 HG2 LYS 49 2.233 -38.702 18.543 416 2HG LYS 49 HG1 LYS 49 3.528 -37.513 18.388 417 1HD LYS 49 HD2 LYS 49 4.738 -39.172 16.924 418 2HD LYS 49 HD1 LYS 49 3.273 -40.157 16.950 419 1HE LYS 49 HE2 LYS 49 2.015 -38.252 16.006 420 2HE LYS 49 HE1 LYS 49 3.514 -37.329 15.918 421 1HZ LYS 49 HZ1 LYS 49 4.400 -39.009 14.413 422 2HZ LYS 49 HZ2 LYS 49 2.987 -38.321 13.797 423 3HZ LYS 49 HZ3 LYS 49 2.945 -39.866 14.482 424 H ASN 50 HN ASN 50 4.586 -39.648 21.855 425 HA ASN 50 HA ASN 50 5.788 -41.966 23.061 426 1HB ASN 50 HB2 ASN 50 7.477 -39.854 21.722 427 2HB ASN 50 HB1 ASN 50 8.070 -40.654 23.170 428 1HD2 ASN 50 HD21 ASN 50 7.405 -40.977 19.793 429 2HD2 ASN 50 HD22 ASN 50 8.116 -42.542 19.595 430 H THR 51 HN THR 51 7.117 -41.129 25.059 431 HA THR 51 HA THR 51 5.918 -38.663 26.126 432 HB THR 51 HB THR 51 4.703 -40.603 27.082 433 HG1 THR 51 HG1 THR 51 5.156 -38.642 28.322 434 1HG2 THR 51 HG21 THR 51 5.832 -42.127 28.631 435 2HG2 THR 51 HG22 THR 51 7.382 -41.377 28.254 436 3HG2 THR 51 HG23 THR 51 6.507 -42.268 27.008 437 H SER 52 HN SER 52 7.229 -37.489 27.518 438 HA SER 52 HA SER 52 10.005 -37.657 27.064 439 1HB SER 52 HB2 SER 52 8.499 -36.081 29.170 440 2HB SER 52 HB1 SER 52 10.152 -35.776 28.632 441 HG SER 52 HG SER 52 9.408 -35.153 26.660 442 H LYS 53 HN LYS 53 11.498 -37.404 29.173 443 HA LYS 53 HA LYS 53 11.859 -40.047 29.991 444 1HB LYS 53 HB2 LYS 53 13.015 -37.524 31.197 445 2HB LYS 53 HB1 LYS 53 13.610 -39.152 31.501 446 1HG LYS 53 HG2 LYS 53 13.605 -37.707 28.852 447 2HG LYS 53 HG1 LYS 53 15.008 -38.050 29.867 448 1HD LYS 53 HD2 LYS 53 14.663 -40.452 29.548 449 2HD LYS 53 HD1 LYS 53 13.234 -40.129 28.565 450 1HE LYS 53 HE2 LYS 53 15.132 -40.627 27.142 451 2HE LYS 53 HE1 LYS 53 14.646 -38.947 26.932 452 1HZ LYS 53 HZ1 LYS 53 17.054 -39.202 27.077 453 2HZ LYS 53 HZ2 LYS 53 16.907 -39.871 28.623 454 3HZ LYS 53 HZ3 LYS 53 16.461 -38.266 28.353 455 H ASN 54 HN ASN 54 10.657 -37.293 31.927 456 HA ASN 54 HA ASN 54 10.065 -39.073 34.148 457 1HB ASN 54 HB2 ASN 54 9.733 -36.087 33.785 458 2HB ASN 54 HB1 ASN 54 9.172 -36.942 35.218 459 1HD2 ASN 54 HD21 ASN 54 10.562 -35.836 36.578 460 2HD2 ASN 54 HD22 ASN 54 12.268 -36.122 36.593 461 H ALA 55 HN ALA 55 8.617 -38.726 31.349 462 HA ALA 55 HA ALA 55 6.555 -39.142 30.514 463 1HB ALA 55 HB1 ALA 55 6.688 -41.093 31.989 464 2HB ALA 55 HB2 ALA 55 5.031 -40.504 31.855 465 3HB ALA 55 HB3 ALA 55 5.977 -40.153 33.302 466 H LYS 56 HN LYS 56 7.145 -36.570 32.042 467 HA LYS 56 HA LYS 56 4.614 -35.695 33.070 468 1HB LYS 56 HB2 LYS 56 6.649 -34.669 33.900 469 2HB LYS 56 HB1 LYS 56 7.110 -34.171 32.279 470 1HG LYS 56 HG2 LYS 56 6.266 -32.292 33.582 471 2HG LYS 56 HG1 LYS 56 5.226 -32.622 32.197 472 1HD LYS 56 HD2 LYS 56 3.858 -32.155 34.137 473 2HD LYS 56 HD1 LYS 56 3.680 -33.853 33.697 474 1HE LYS 56 HE2 LYS 56 5.310 -34.446 35.463 475 2HE LYS 56 HE1 LYS 56 5.400 -32.746 35.925 476 1HZ LYS 56 HZ1 LYS 56 2.979 -34.463 36.027 477 2HZ LYS 56 HZ2 LYS 56 3.022 -32.819 36.422 478 3HZ LYS 56 HZ3 LYS 56 3.884 -33.934 37.354 479 H PHE 57 HN PHE 57 6.220 -35.656 29.977 480 HA PHE 57 HA PHE 57 3.975 -34.124 28.829 481 1HB PHE 57 HB2 PHE 57 6.766 -34.472 27.691 482 2HB PHE 57 HB1 PHE 57 5.482 -33.470 27.022 483 HD1 PHE 57 HD1 PHE 57 8.234 -33.620 29.319 484 HD2 PHE 57 HD2 PHE 57 4.663 -31.495 28.381 485 HE1 PHE 57 HE1 PHE 57 9.016 -31.719 30.667 486 HE2 PHE 57 HE2 PHE 57 5.443 -29.589 29.728 487 HZ PHE 57 HZ PHE 57 7.621 -29.701 30.872 488 H TYR 58 HN TYR 58 2.645 -35.206 27.562 489 HA TYR 58 HA TYR 58 3.527 -37.747 26.352 490 1HB TYR 58 HB2 TYR 58 0.715 -36.858 27.073 491 2HB TYR 58 HB1 TYR 58 1.146 -38.398 26.343 492 HD1 TYR 58 HD1 TYR 58 2.396 -40.097 27.688 493 HD2 TYR 58 HD2 TYR 58 0.925 -36.497 29.425 494 HE1 TYR 58 HE1 TYR 58 2.618 -41.091 29.928 495 HE2 TYR 58 HE2 TYR 58 1.145 -37.479 31.664 496 HH TYR 58 HH TYR 58 2.829 -40.409 32.248 497 H SER 59 HN SER 59 3.779 -37.663 24.220 498 HA SER 59 HA SER 59 2.608 -35.471 22.692 499 1HB SER 59 HB2 SER 59 4.633 -37.600 21.950 500 2HB SER 59 HB1 SER 59 4.074 -36.334 20.857 501 HG SER 59 HG SER 59 5.352 -35.884 23.363 502 H PHE 60 HN PHE 60 0.741 -35.728 21.674 503 HA PHE 60 HA PHE 60 -0.106 -38.420 20.839 504 1HB PHE 60 HB2 PHE 60 -1.711 -35.939 21.486 505 2HB PHE 60 HB1 PHE 60 -2.407 -37.347 20.689 506 HD1 PHE 60 HD1 PHE 60 -1.335 -35.921 23.840 507 HD2 PHE 60 HD2 PHE 60 -2.483 -39.531 21.884 508 HE1 PHE 60 HE1 PHE 60 -1.744 -36.978 26.024 509 HE2 PHE 60 HE2 PHE 60 -2.893 -40.588 24.066 510 HZ PHE 60 HZ PHE 60 -2.525 -39.312 26.137 511 H ASN 61 HN ASN 61 -1.377 -38.511 18.853 512 HA ASN 61 HA ASN 61 -0.306 -36.715 16.771 513 1HB ASN 61 HB2 ASN 61 0.500 -39.064 16.606 514 2HB ASN 61 HB1 ASN 61 -1.169 -39.619 16.524 515 1HD2 ASN 61 HD21 ASN 61 -2.452 -38.901 14.672 516 2HD2 ASN 61 HD22 ASN 61 -1.657 -38.578 13.169 517 H VAL 62 HN VAL 62 -1.828 -35.451 15.879 518 HA VAL 62 HA VAL 62 -4.577 -36.522 15.658 519 HB VAL 62 HB VAL 62 -3.743 -33.614 15.932 520 1HG1 VAL 62 HG11 VAL 62 -5.672 -33.847 14.456 521 2HG1 VAL 62 HG12 VAL 62 -6.152 -33.126 15.992 522 3HG1 VAL 62 HG13 VAL 62 -6.502 -34.824 15.668 523 1HG2 VAL 62 HG21 VAL 62 -5.243 -35.409 17.852 524 2HG2 VAL 62 HG22 VAL 62 -4.930 -33.688 18.082 525 3HG2 VAL 62 HG23 VAL 62 -3.587 -34.831 18.049 526 H SER 63 HN SER 63 -5.036 -37.010 13.611 527 HA SER 63 HA SER 63 -4.010 -35.261 11.472 528 1HB SER 63 HB2 SER 63 -4.294 -38.277 11.277 529 2HB SER 63 HB1 SER 63 -3.638 -37.197 10.046 530 HG SER 63 HG SER 63 -2.130 -36.635 11.979 531 H MET 64 HN MET 64 -5.765 -34.222 10.703 532 HA MET 64 HA MET 64 -8.219 -35.773 10.213 533 1HB MET 64 HB2 MET 64 -9.615 -34.045 11.211 534 2HB MET 64 HB1 MET 64 -8.474 -34.654 12.402 535 1HG MET 64 HG2 MET 64 -7.035 -32.676 11.951 536 2HG MET 64 HG1 MET 64 -8.303 -32.049 10.899 537 1HE MET 64 HE1 MET 64 -10.890 -33.122 12.623 538 2HE MET 64 HE2 MET 64 -10.821 -31.554 11.819 539 3HE MET 64 HE3 MET 64 -11.257 -31.652 13.525 540 H GLU 65 HN GLU 65 -9.573 -34.932 8.593 541 HA GLU 65 HA GLU 65 -8.229 -33.723 6.432 542 1HB GLU 65 HB2 GLU 65 -11.203 -34.073 6.879 543 2HB GLU 65 HB1 GLU 65 -10.451 -33.653 5.345 544 1HG GLU 65 HG2 GLU 65 -9.235 -35.805 5.394 545 2HG GLU 65 HG1 GLU 65 -10.094 -36.225 6.876 546 H VAL 66 HN VAL 66 -7.815 -31.650 6.025 547 HA VAL 66 HA VAL 66 -9.575 -29.591 7.203 548 HB VAL 66 HB VAL 66 -7.703 -27.993 6.916 549 1HG1 VAL 66 HG11 VAL 66 -7.010 -30.425 8.575 550 2HG1 VAL 66 HG12 VAL 66 -8.039 -29.081 9.074 551 3HG1 VAL 66 HG13 VAL 66 -6.322 -28.812 8.775 552 1HG2 VAL 66 HG21 VAL 66 -6.091 -30.438 6.148 553 2HG2 VAL 66 HG22 VAL 66 -5.429 -28.835 6.469 554 3HG2 VAL 66 HG23 VAL 66 -6.503 -29.084 5.094 555 H SER 67 HN SER 67 -10.661 -28.299 5.851 556 HA SER 67 HA SER 67 -10.729 -28.940 3.060 557 1HB SER 67 HB2 SER 67 -12.145 -26.666 4.480 558 2HB SER 67 HB1 SER 67 -12.591 -27.405 2.941 559 HG SER 67 HG SER 67 -12.629 -28.637 5.505 560 H ASN 68 HN ASN 68 -9.368 -26.423 5.046 561 HA ASN 68 HA ASN 68 -7.517 -25.641 3.069 562 1HB ASN 68 HB2 ASN 68 -8.219 -23.323 2.690 563 2HB ASN 68 HB1 ASN 68 -9.456 -24.436 2.123 564 1HD2 ASN 68 HD21 ASN 68 -11.424 -24.522 3.183 565 2HD2 ASN 68 HD22 ASN 68 -11.917 -23.325 4.329 566 H GLU 69 HN GLU 69 -6.597 -23.299 3.893 567 HA GLU 69 HA GLU 69 -5.253 -24.013 6.250 568 1HB GLU 69 HB2 GLU 69 -4.302 -22.541 4.500 569 2HB GLU 69 HB1 GLU 69 -5.418 -21.269 4.982 570 1HG GLU 69 HG2 GLU 69 -4.391 -21.254 7.227 571 2HG GLU 69 HG1 GLU 69 -3.239 -22.474 6.687 572 H SER 70 HN SER 70 -8.125 -22.049 5.776 573 HA SER 70 HA SER 70 -8.116 -20.615 8.168 574 1HB SER 70 HB2 SER 70 -10.537 -21.703 6.705 575 2HB SER 70 HB1 SER 70 -10.528 -20.365 7.857 576 HG SER 70 HG SER 70 -10.470 -19.688 5.639 577 H GLU 71 HN GLU 71 -9.221 -23.914 7.495 578 HA GLU 71 HA GLU 71 -10.192 -24.317 10.169 579 1HB GLU 71 HB2 GLU 71 -9.592 -26.355 8.009 580 2HB GLU 71 HB1 GLU 71 -10.446 -26.679 9.515 581 1HG GLU 71 HG2 GLU 71 -12.127 -24.929 8.778 582 2HG GLU 71 HG1 GLU 71 -11.343 -24.984 7.202 583 H ARG 72 HN ARG 72 -7.183 -24.876 8.450 584 HA ARG 72 HA ARG 72 -5.824 -26.424 10.340 585 1HB ARG 72 HB2 ARG 72 -4.924 -25.888 8.101 586 2HB ARG 72 HB1 ARG 72 -4.741 -24.208 8.565 587 1HG ARG 72 HG2 ARG 72 -3.290 -26.384 10.048 588 2HG ARG 72 HG1 ARG 72 -2.661 -25.736 8.536 589 1HD ARG 72 HD2 ARG 72 -2.846 -23.432 9.632 590 2HD ARG 72 HD1 ARG 72 -3.094 -24.294 11.149 591 HE ARG 72 HE ARG 72 -0.746 -25.133 9.708 592 1HH1 ARG 72 HH11 ARG 72 -1.984 -22.831 12.060 593 2HH1 ARG 72 HH12 ARG 72 -0.417 -22.465 12.698 594 1HH2 ARG 72 HH21 ARG 72 1.300 -24.639 10.549 595 2HH2 ARG 72 HH22 ARG 72 1.450 -23.508 11.859 596 H ASN 73 HN ASN 73 -6.338 -22.944 10.121 597 HA ASN 73 HA ASN 73 -4.862 -22.269 12.460 598 1HB ASN 73 HB2 ASN 73 -6.920 -20.783 10.821 599 2HB ASN 73 HB1 ASN 73 -6.217 -20.090 12.279 600 1HD2 ASN 73 HD21 ASN 73 -5.644 -21.005 8.980 601 2HD2 ASN 73 HD22 ASN 73 -4.109 -20.232 8.828 602 H GLU 74 HN GLU 74 -8.308 -22.784 11.801 603 HA GLU 74 HA GLU 74 -9.249 -22.018 14.332 604 1HB GLU 74 HB2 GLU 74 -10.749 -22.222 12.425 605 2HB GLU 74 HB1 GLU 74 -10.450 -23.954 12.338 606 1HG GLU 74 HG2 GLU 74 -11.535 -24.309 14.451 607 2HG GLU 74 HG1 GLU 74 -11.705 -22.575 14.704 608 H ILE 75 HN ILE 75 -8.677 -25.290 13.051 609 HA ILE 75 HA ILE 75 -9.278 -26.706 15.379 610 HB ILE 75 HB ILE 75 -7.350 -27.457 13.164 611 1HG1 ILE 75 HG12 ILE 75 -10.259 -28.242 13.509 612 2HG1 ILE 75 HG11 ILE 75 -9.738 -26.886 12.517 613 1HG2 ILE 75 HG21 ILE 75 -7.743 -29.783 13.870 614 2HG2 ILE 75 HG22 ILE 75 -8.717 -29.203 15.222 615 3HG2 ILE 75 HG23 ILE 75 -6.994 -28.832 15.153 616 1HD1 ILE 75 HD11 ILE 75 -8.991 -29.769 12.091 617 2HD1 ILE 75 HD12 ILE 75 -8.475 -28.407 11.096 618 3HD1 ILE 75 HD13 ILE 75 -10.180 -28.848 11.171 619 H PHE 76 HN PHE 76 -6.206 -25.382 14.217 620 HA PHE 76 HA PHE 76 -4.469 -26.276 16.183 621 1HB PHE 76 HB2 PHE 76 -3.698 -25.059 14.221 622 2HB PHE 76 HB1 PHE 76 -4.545 -23.609 14.741 623 HD1 PHE 76 HD1 PHE 76 -3.526 -22.068 16.213 624 HD2 PHE 76 HD2 PHE 76 -1.727 -25.875 15.552 625 HE1 PHE 76 HE1 PHE 76 -1.494 -21.305 17.367 626 HE2 PHE 76 HE2 PHE 76 0.307 -25.112 16.707 627 HZ PHE 76 HZ PHE 76 0.426 -22.826 17.615 628 H GLN 77 HN GLN 77 -6.593 -23.447 16.196 629 HA GLN 77 HA GLN 77 -5.824 -22.490 18.759 630 1HB GLN 77 HB2 GLN 77 -8.304 -22.002 17.103 631 2HB GLN 77 HB1 GLN 77 -7.912 -21.118 18.573 632 1HG GLN 77 HG2 GLN 77 -5.917 -20.215 17.550 633 2HG GLN 77 HG1 GLN 77 -6.191 -21.179 16.100 634 1HE2 GLN 77 HE21 GLN 77 -7.821 -20.591 14.678 635 2HE2 GLN 77 HE22 GLN 77 -8.569 -19.033 14.717 636 H LYS 78 HN LYS 78 -8.414 -24.607 17.616 637 HA LYS 78 HA LYS 78 -9.895 -24.811 19.990 638 1HB LYS 78 HB2 LYS 78 -9.460 -26.902 17.838 639 2HB LYS 78 HB1 LYS 78 -10.717 -26.963 19.064 640 1HG LYS 78 HG2 LYS 78 -10.461 -24.802 16.979 641 2HG LYS 78 HG1 LYS 78 -11.516 -26.210 16.849 642 1HD LYS 78 HD2 LYS 78 -12.767 -25.500 18.802 643 2HD LYS 78 HD1 LYS 78 -11.660 -24.148 19.057 644 1HE LYS 78 HE2 LYS 78 -13.699 -23.373 17.997 645 2HE LYS 78 HE1 LYS 78 -12.338 -23.203 16.892 646 1HZ LYS 78 HZ1 LYS 78 -13.065 -25.350 15.880 647 2HZ LYS 78 HZ2 LYS 78 -14.152 -24.072 15.673 648 3HZ LYS 78 HZ3 LYS 78 -14.466 -25.268 16.826 649 H ILE 79 HN ILE 79 -7.127 -26.636 18.791 650 HA ILE 79 HA ILE 79 -6.985 -28.567 20.841 651 HB ILE 79 HB ILE 79 -4.776 -27.437 19.099 652 1HG1 ILE 79 HG12 ILE 79 -6.416 -29.979 18.831 653 2HG1 ILE 79 HG11 ILE 79 -6.623 -28.524 17.863 654 1HG2 ILE 79 HG21 ILE 79 -4.764 -29.941 20.796 655 2HG2 ILE 79 HG22 ILE 79 -3.822 -28.479 21.091 656 3HG2 ILE 79 HG23 ILE 79 -3.502 -29.461 19.663 657 1HD1 ILE 79 HD11 ILE 79 -4.190 -30.295 17.909 658 2HD1 ILE 79 HD12 ILE 79 -4.365 -28.820 16.957 659 3HD1 ILE 79 HD13 ILE 79 -5.406 -30.206 16.635 660 H SER 80 HN SER 80 -5.927 -25.261 20.665 661 HA SER 80 HA SER 80 -4.176 -25.420 22.941 662 1HB SER 80 HB2 SER 80 -3.748 -23.830 21.145 663 2HB SER 80 HB1 SER 80 -5.301 -23.051 21.432 664 HG SER 80 HG SER 80 -3.971 -23.105 23.736 665 H GLN 81 HN GLN 81 -7.533 -25.255 22.574 666 HA GLN 81 HA GLN 81 -8.087 -23.599 24.877 667 1HB GLN 81 HB2 GLN 81 -9.906 -25.334 23.192 668 2HB GLN 81 HB1 GLN 81 -10.452 -24.256 24.472 669 1HG GLN 81 HG2 GLN 81 -9.533 -22.342 23.239 670 2HG GLN 81 HG1 GLN 81 -9.030 -23.429 21.945 671 1HE2 GLN 81 HE21 GLN 81 -11.433 -25.084 22.166 672 2HE2 GLN 81 HE22 GLN 81 -12.718 -24.158 21.478 673 H LEU 82 HN LEU 82 -7.044 -26.726 24.523 674 HA LEU 82 HA LEU 82 -8.585 -28.021 26.551 675 1HB LEU 82 HB2 LEU 82 -5.788 -28.811 25.755 676 2HB LEU 82 HB1 LEU 82 -7.083 -29.837 26.336 677 HG LEU 82 HG LEU 82 -7.109 -28.445 23.656 678 1HD1 LEU 82 HD11 LEU 82 -6.615 -30.640 22.693 679 2HD1 LEU 82 HD12 LEU 82 -6.387 -31.297 24.316 680 3HD1 LEU 82 HD13 LEU 82 -5.299 -30.046 23.706 681 1HD2 LEU 82 HD21 LEU 82 -8.933 -30.001 23.155 682 2HD2 LEU 82 HD22 LEU 82 -9.324 -28.925 24.495 683 3HD2 LEU 82 HD23 LEU 82 -8.870 -30.601 24.814 684 H ASP 83 HN ASP 83 -5.607 -26.192 26.458 685 HA ASP 83 HA ASP 83 -4.278 -25.249 28.024 686 1HB ASP 83 HB2 ASP 83 -6.253 -24.542 29.251 687 2HB ASP 83 HB1 ASP 83 -6.397 -26.130 30.000 688 H LYS 84 HN LYS 84 -5.450 -28.474 28.700 689 HA LYS 84 HA LYS 84 -3.387 -29.439 30.319 690 1HB LYS 84 HB2 LYS 84 -4.752 -31.060 28.157 691 2HB LYS 84 HB1 LYS 84 -4.134 -31.624 29.706 692 1HG LYS 84 HG2 LYS 84 -5.906 -30.518 30.890 693 2HG LYS 84 HG1 LYS 84 -6.459 -29.724 29.417 694 1HD LYS 84 HD2 LYS 84 -7.956 -31.449 29.505 695 2HD LYS 84 HD1 LYS 84 -6.686 -32.216 28.559 696 1HE LYS 84 HE2 LYS 84 -7.444 -33.741 30.273 697 2HE LYS 84 HE1 LYS 84 -5.798 -33.229 30.636 698 1HZ LYS 84 HZ1 LYS 84 -6.639 -31.690 32.260 699 2HZ LYS 84 HZ2 LYS 84 -7.232 -33.235 32.595 700 3HZ LYS 84 HZ3 LYS 84 -8.239 -32.081 31.874 701 H VAL 85 HN VAL 85 -3.483 -28.556 27.015 702 HA VAL 85 HA VAL 85 -1.105 -29.991 26.218 703 HB VAL 85 HB VAL 85 -2.889 -29.629 24.584 704 1HG1 VAL 85 HG11 VAL 85 -2.304 -26.681 24.891 705 2HG1 VAL 85 HG12 VAL 85 -3.775 -27.513 25.396 706 3HG1 VAL 85 HG13 VAL 85 -3.373 -27.398 23.683 707 1HG2 VAL 85 HG21 VAL 85 -1.536 -28.760 22.730 708 2HG2 VAL 85 HG22 VAL 85 -0.607 -29.853 23.757 709 3HG2 VAL 85 HG23 VAL 85 -0.372 -28.109 23.885 710 H VAL 86 HN VAL 86 0.923 -29.245 26.315 711 HA VAL 86 HA VAL 86 1.352 -26.511 27.298 712 HB VAL 86 HB VAL 86 3.622 -27.256 27.897 713 1HG1 VAL 86 HG11 VAL 86 1.819 -27.453 29.534 714 2HG1 VAL 86 HG12 VAL 86 2.992 -28.755 29.729 715 3HG1 VAL 86 HG13 VAL 86 1.445 -29.073 28.944 716 1HG2 VAL 86 HG21 VAL 86 2.726 -29.968 26.899 717 2HG2 VAL 86 HG22 VAL 86 4.236 -29.627 27.745 718 3HG2 VAL 86 HG23 VAL 86 3.945 -28.938 26.148 719 H GLN 87 HN GLN 87 1.634 -28.383 24.459 720 HA GLN 87 HA GLN 87 2.889 -26.150 23.097 721 1HB GLN 87 HB2 GLN 87 4.797 -27.550 23.872 722 2HB GLN 87 HB1 GLN 87 4.138 -28.909 22.972 723 1HG GLN 87 HG2 GLN 87 5.986 -27.768 21.805 724 2HG GLN 87 HG1 GLN 87 4.482 -27.769 20.887 725 1HE2 GLN 87 HE21 GLN 87 6.714 -25.820 22.726 726 2HE2 GLN 87 HE22 GLN 87 6.136 -24.289 22.172 727 H THR 88 HN THR 88 1.996 -25.851 21.184 728 HA THR 88 HA THR 88 0.394 -28.025 19.984 729 HB THR 88 HB THR 88 -1.058 -26.174 19.069 730 HG1 THR 88 HG1 THR 88 0.563 -24.500 19.429 731 1HG2 THR 88 HG21 THR 88 -2.271 -25.750 21.167 732 2HG2 THR 88 HG22 THR 88 -0.884 -26.336 22.086 733 3HG2 THR 88 HG23 THR 88 -1.779 -27.438 21.039 734 H LEU 89 HN LEU 89 1.346 -28.699 18.134 735 HA LEU 89 HA LEU 89 2.648 -26.675 16.425 736 1HB LEU 89 HB2 LEU 89 3.066 -29.670 16.461 737 2HB LEU 89 HB1 LEU 89 3.831 -28.559 15.344 738 HG LEU 89 HG LEU 89 4.859 -27.438 17.410 739 1HD1 LEU 89 HD11 LEU 89 3.435 -28.422 19.110 740 2HD1 LEU 89 HD12 LEU 89 5.117 -28.872 19.384 741 3HD1 LEU 89 HD13 LEU 89 3.996 -30.038 18.679 742 1HD2 LEU 89 HD21 LEU 89 6.148 -28.792 15.844 743 2HD2 LEU 89 HD22 LEU 89 5.676 -30.258 16.704 744 3HD2 LEU 89 HD23 LEU 89 6.692 -29.056 17.501 745 H GLY 90 HN GLY 90 1.376 -26.015 14.848 746 1HA GLY 90 HA2 GLY 90 -0.631 -27.821 13.685 747 2HA GLY 90 HA1 GLY 90 -0.544 -26.078 13.460 748 H SER 91 HN SER 91 2.506 -27.245 13.228 749 HA SER 91 HA SER 91 2.430 -28.221 10.509 750 1HB SER 91 HB2 SER 91 2.455 -25.700 10.307 751 2HB SER 91 HB1 SER 91 4.003 -25.701 11.149 752 HG SER 91 HG SER 91 3.407 -26.926 8.658 Start of MODEL 3 1 1H GLN 1 HT1 GLN 1 9.365 -4.650 -17.767 2 2H GLN 1 HT2 GLN 1 9.594 -6.308 -17.522 3 3H GLN 1 HT3 GLN 1 9.417 -5.276 -16.196 4 HA GLN 1 HA GLN 1 7.177 -4.809 -16.736 5 1HB GLN 1 HB2 GLN 1 6.086 -6.019 -18.649 6 2HB GLN 1 HB1 GLN 1 7.248 -4.794 -19.124 7 1HG GLN 1 HG2 GLN 1 7.609 -6.601 -20.574 8 2HG GLN 1 HG1 GLN 1 8.927 -6.668 -19.408 9 1HE2 GLN 1 HE21 GLN 1 5.949 -8.160 -20.466 10 2HE2 GLN 1 HE22 GLN 1 6.190 -9.667 -19.653 11 H GLY 2 HN GLY 2 9.105 -7.105 -15.680 12 1HA GLY 2 HA2 GLY 2 7.008 -8.507 -14.328 13 2HA GLY 2 HA1 GLY 2 7.801 -9.508 -15.537 14 H HIS 3 HN HIS 3 7.731 -9.157 -12.420 15 HA HIS 3 HA HIS 3 10.549 -9.879 -12.097 16 1HB HIS 3 HB2 HIS 3 10.636 -8.576 -9.954 17 2HB HIS 3 HB1 HIS 3 10.536 -7.577 -11.397 18 HD1 HIS 3 HD1 HIS 3 8.780 -5.821 -11.389 19 HD2 HIS 3 HD2 HIS 3 8.020 -8.800 -8.585 20 HE1 HIS 3 HE1 HIS 3 6.785 -5.029 -10.081 21 HE2 HIS 3 HE2 HIS 3 6.275 -6.894 -8.471 22 H MET 4 HN MET 4 10.964 -11.144 -10.196 23 HA MET 4 HA MET 4 8.568 -12.528 -9.157 24 1HB MET 4 HB2 MET 4 11.198 -13.779 -10.013 25 2HB MET 4 HB1 MET 4 9.887 -14.641 -9.219 26 1HG MET 4 HG2 MET 4 8.432 -14.220 -11.122 27 2HG MET 4 HG1 MET 4 9.713 -13.301 -11.912 28 1HE MET 4 HE1 MET 4 12.006 -14.359 -12.713 29 2HE MET 4 HE2 MET 4 12.396 -16.074 -12.595 30 3HE MET 4 HE3 MET 4 12.297 -15.094 -11.133 31 HA PRO 5 HA PRO 5 10.210 -12.005 -5.025 32 1HB PRO 5 HB2 PRO 5 9.748 -14.953 -4.744 33 2HB PRO 5 HB1 PRO 5 9.246 -13.629 -3.681 34 1HG PRO 5 HG2 PRO 5 7.480 -14.798 -5.289 35 2HG PRO 5 HG1 PRO 5 7.453 -13.041 -5.046 36 1HD PRO 5 HD2 PRO 5 8.461 -14.618 -7.381 37 2HD PRO 5 HD1 PRO 5 7.613 -13.058 -7.357 38 H SER 6 HN SER 6 12.344 -11.596 -5.406 39 HA SER 6 HA SER 6 14.228 -13.419 -6.427 40 1HB SER 6 HB2 SER 6 15.888 -11.703 -5.506 41 2HB SER 6 HB1 SER 6 14.682 -11.090 -6.637 42 HG SER 6 HG SER 6 14.994 -10.599 -3.926 43 H ASP 7 HN ASP 7 12.965 -12.936 -3.266 44 HA ASP 7 HA ASP 7 15.095 -14.551 -2.042 45 1HB ASP 7 HB2 ASP 7 14.222 -13.738 0.109 46 2HB ASP 7 HB1 ASP 7 14.632 -12.398 -0.957 47 H SER 8 HN SER 8 14.013 -15.808 -0.030 48 HA SER 8 HA SER 8 12.612 -17.966 -1.195 49 1HB SER 8 HB2 SER 8 14.149 -18.210 0.736 50 2HB SER 8 HB1 SER 8 13.007 -17.328 1.748 51 HG SER 8 HG SER 8 11.931 -19.104 2.005 52 H LYS 9 HN LYS 9 10.501 -18.467 -1.272 53 HA LYS 9 HA LYS 9 8.566 -16.446 -0.415 54 1HB LYS 9 HB2 LYS 9 8.419 -17.157 -2.732 55 2HB LYS 9 HB1 LYS 9 8.333 -18.845 -2.249 56 1HG LYS 9 HG2 LYS 9 6.161 -18.363 -1.132 57 2HG LYS 9 HG1 LYS 9 6.246 -16.720 -1.770 58 1HD LYS 9 HD2 LYS 9 4.832 -18.143 -3.174 59 2HD LYS 9 HD1 LYS 9 6.260 -17.599 -4.057 60 1HE LYS 9 HE2 LYS 9 7.340 -19.769 -3.610 61 2HE LYS 9 HE1 LYS 9 5.894 -20.306 -2.756 62 1HZ LYS 9 HZ1 LYS 9 4.644 -20.159 -4.777 63 2HZ LYS 9 HZ2 LYS 9 6.018 -21.099 -5.067 64 3HZ LYS 9 HZ3 LYS 9 5.956 -19.499 -5.611 65 H LYS 10 HN LYS 10 7.135 -16.780 1.208 66 HA LYS 10 HA LYS 10 7.318 -18.927 2.999 67 1HB LYS 10 HB2 LYS 10 4.988 -17.055 2.514 68 2HB LYS 10 HB1 LYS 10 5.142 -18.135 3.895 69 1HG LYS 10 HG2 LYS 10 7.331 -16.917 4.398 70 2HG LYS 10 HG1 LYS 10 6.792 -15.711 3.226 71 1HD LYS 10 HD2 LYS 10 6.191 -15.030 5.490 72 2HD LYS 10 HD1 LYS 10 4.737 -15.364 4.545 73 1HE LYS 10 HE2 LYS 10 4.569 -17.577 5.577 74 2HE LYS 10 HE1 LYS 10 6.038 -17.269 6.498 75 1HZ LYS 10 HZ1 LYS 10 3.508 -15.729 6.741 76 2HZ LYS 10 HZ2 LYS 10 4.913 -15.467 7.641 77 3HZ LYS 10 HZ3 LYS 10 4.049 -16.906 7.827 78 HA PRO 11 HA PRO 11 5.501 -22.251 0.709 79 1HB PRO 11 HB2 PRO 11 4.644 -23.240 3.390 80 2HB PRO 11 HB1 PRO 11 5.588 -24.055 2.136 81 1HG PRO 11 HG2 PRO 11 6.774 -23.126 4.334 82 2HG PRO 11 HG1 PRO 11 7.566 -22.998 2.751 83 1HD PRO 11 HD2 PRO 11 6.151 -20.890 4.340 84 2HD PRO 11 HD1 PRO 11 7.630 -20.765 3.365 85 H THR 12 HN THR 12 3.630 -22.183 -0.350 86 HA THR 12 HA THR 12 1.277 -20.967 0.740 87 HB THR 12 HB THR 12 1.566 -22.588 -1.808 88 HG1 THR 12 HG1 THR 12 1.687 -19.753 -1.493 89 1HG2 THR 12 HG21 THR 12 -0.500 -20.528 -0.988 90 2HG2 THR 12 HG22 THR 12 -0.771 -22.267 -1.112 91 3HG2 THR 12 HG23 THR 12 -0.407 -21.326 -2.559 92 H ILE 13 HN ILE 13 0.079 -21.991 2.224 93 HA ILE 13 HA ILE 13 -0.062 -24.917 2.242 94 HB ILE 13 HB ILE 13 -1.201 -22.965 4.264 95 1HG1 ILE 13 HG12 ILE 13 1.247 -22.761 4.152 96 2HG1 ILE 13 HG11 ILE 13 0.756 -23.525 5.659 97 1HG2 ILE 13 HG21 ILE 13 -0.731 -25.948 4.418 98 2HG2 ILE 13 HG22 ILE 13 -2.296 -25.142 4.304 99 3HG2 ILE 13 HG23 ILE 13 -1.298 -24.931 5.743 100 1HD1 ILE 13 HD11 ILE 13 1.870 -24.916 3.232 101 2HD1 ILE 13 HD12 ILE 13 1.337 -25.716 4.712 102 3HD1 ILE 13 HD13 ILE 13 2.711 -24.610 4.751 103 H ILE 14 HN ILE 14 -1.599 -25.772 1.009 104 HA ILE 14 HA ILE 14 -4.024 -24.280 0.373 105 HB ILE 14 HB ILE 14 -3.082 -26.972 -0.653 106 1HG1 ILE 14 HG12 ILE 14 -2.878 -24.223 -1.930 107 2HG1 ILE 14 HG11 ILE 14 -1.535 -25.138 -1.253 108 1HG2 ILE 14 HG21 ILE 14 -5.501 -26.685 -0.857 109 2HG2 ILE 14 HG22 ILE 14 -4.732 -26.641 -2.442 110 3HG2 ILE 14 HG23 ILE 14 -5.262 -25.142 -1.677 111 1HD1 ILE 14 HD11 ILE 14 -1.879 -26.874 -2.941 112 2HD1 ILE 14 HD12 ILE 14 -1.555 -25.298 -3.661 113 3HD1 ILE 14 HD13 ILE 14 -3.201 -25.932 -3.631 114 H TYR 15 HN TYR 15 -5.985 -24.726 1.180 115 HA TYR 15 HA TYR 15 -6.317 -27.100 2.904 116 1HB TYR 15 HB2 TYR 15 -7.677 -24.386 3.022 117 2HB TYR 15 HB1 TYR 15 -8.130 -25.761 4.021 118 HD1 TYR 15 HD1 TYR 15 -7.049 -26.131 6.077 119 HD2 TYR 15 HD2 TYR 15 -5.262 -23.503 3.243 120 HE1 TYR 15 HE1 TYR 15 -5.378 -25.468 7.751 121 HE2 TYR 15 HE2 TYR 15 -3.584 -22.842 4.912 122 HH TYR 15 HH TYR 15 -3.035 -24.526 7.750 123 HA PRO 16 HA PRO 16 -8.201 -27.940 3.947 124 1HB PRO 16 HB2 PRO 16 -9.582 -30.392 3.310 125 2HB PRO 16 HB1 PRO 16 -10.162 -29.036 4.276 126 1HG PRO 16 HG2 PRO 16 -11.199 -29.751 1.827 127 2HG PRO 16 HG1 PRO 16 -11.311 -28.124 2.525 128 1HD PRO 16 HD2 PRO 16 -9.393 -29.181 0.471 129 2HD PRO 16 HD1 PRO 16 -10.233 -27.614 0.530 130 H CYS 17 HN CYS 17 -6.847 -29.449 4.904 131 HA CYS 17 HA CYS 17 -5.712 -31.636 3.389 132 1HB CYS 17 HB2 CYS 17 -3.367 -30.830 3.683 133 2HB CYS 17 HB1 CYS 17 -4.306 -29.821 2.587 134 HG CYS 17 HG CYS 17 -3.700 -27.636 3.763 135 H LEU 18 HN LEU 18 -4.301 -32.978 4.711 136 HA LEU 18 HA LEU 18 -5.190 -33.255 7.397 137 1HB LEU 18 HB2 LEU 18 -2.908 -34.517 5.868 138 2HB LEU 18 HB1 LEU 18 -3.313 -34.961 7.515 139 HG LEU 18 HG LEU 18 -5.306 -35.180 5.260 140 1HD1 LEU 18 HD11 LEU 18 -3.369 -36.540 4.673 141 2HD1 LEU 18 HD12 LEU 18 -4.736 -37.558 5.125 142 3HD1 LEU 18 HD13 LEU 18 -3.410 -37.309 6.261 143 1HD2 LEU 18 HD21 LEU 18 -6.232 -35.172 7.519 144 2HD2 LEU 18 HD22 LEU 18 -5.140 -36.478 7.985 145 3HD2 LEU 18 HD23 LEU 18 -6.396 -36.765 6.779 146 H TRP 19 HN TRP 19 -4.698 -31.615 8.772 147 HA TRP 19 HA TRP 19 -1.949 -30.611 8.866 148 1HB TRP 19 HB2 TRP 19 -3.946 -29.034 8.966 149 2HB TRP 19 HB1 TRP 19 -4.276 -29.681 10.572 150 HD1 TRP 19 HD1 TRP 19 -2.810 -28.771 12.567 151 HE1 TRP 19 HE1 TRP 19 -0.937 -27.013 12.748 152 HE3 TRP 19 HE3 TRP 19 -1.934 -27.991 7.584 153 HZ2 TRP 19 HZ2 TRP 19 0.689 -25.497 11.011 154 HZ3 TRP 19 HZ3 TRP 19 -0.201 -26.371 6.931 155 HH2 TRP 19 HH2 TRP 19 1.082 -25.149 8.611 156 H ASP 20 HN ASP 20 -0.698 -30.694 10.777 157 HA ASP 20 HA ASP 20 -1.284 -33.100 12.359 158 1HB ASP 20 HB2 ASP 20 0.842 -32.974 11.016 159 2HB ASP 20 HB1 ASP 20 1.363 -31.655 12.059 160 H TYR 21 HN TYR 21 -2.010 -32.823 14.337 161 HA TYR 21 HA TYR 21 -1.328 -30.398 15.855 162 1HB TYR 21 HB2 TYR 21 -3.534 -32.439 16.279 163 2HB TYR 21 HB1 TYR 21 -3.217 -31.074 17.344 164 HD1 TYR 21 HD1 TYR 21 -3.841 -28.823 16.704 165 HD2 TYR 21 HD2 TYR 21 -4.504 -32.093 14.056 166 HE1 TYR 21 HE1 TYR 21 -5.334 -27.417 15.348 167 HE2 TYR 21 HE2 TYR 21 -5.992 -30.694 12.693 168 HH TYR 21 HH TYR 21 -7.410 -28.674 13.021 169 H ARG 22 HN ARG 22 -0.498 -30.574 17.940 170 HA ARG 22 HA ARG 22 0.434 -33.252 18.752 171 1HB ARG 22 HB2 ARG 22 2.200 -31.653 17.763 172 2HB ARG 22 HB1 ARG 22 1.998 -30.712 19.233 173 1HG ARG 22 HG2 ARG 22 3.915 -32.180 19.411 174 2HG ARG 22 HG1 ARG 22 2.666 -32.659 20.565 175 1HD ARG 22 HD2 ARG 22 3.768 -34.554 19.323 176 2HD ARG 22 HD1 ARG 22 2.009 -34.509 19.218 177 HE ARG 22 HE ARG 22 2.224 -33.640 16.972 178 1HH1 ARG 22 HH11 ARG 22 5.181 -34.878 18.375 179 2HH1 ARG 22 HH12 ARG 22 5.921 -35.197 16.838 180 1HH2 ARG 22 HH21 ARG 22 3.198 -34.031 14.949 181 2HH2 ARG 22 HH22 ARG 22 4.804 -34.695 14.888 182 H VAL 23 HN VAL 23 -0.516 -33.793 20.595 183 HA VAL 23 HA VAL 23 -1.370 -31.654 22.450 184 HB VAL 23 HB VAL 23 -2.651 -34.375 22.087 185 1HG1 VAL 23 HG11 VAL 23 -2.978 -33.460 24.310 186 2HG1 VAL 23 HG12 VAL 23 -4.493 -33.407 23.409 187 3HG1 VAL 23 HG13 VAL 23 -3.546 -31.935 23.629 188 1HG2 VAL 23 HG21 VAL 23 -2.969 -33.076 20.063 189 2HG2 VAL 23 HG22 VAL 23 -3.531 -31.694 21.001 190 3HG2 VAL 23 HG23 VAL 23 -4.487 -33.174 20.953 191 H ILE 24 HN ILE 24 -0.020 -31.638 24.165 192 HA ILE 24 HA ILE 24 1.037 -34.193 25.166 193 HB ILE 24 HB ILE 24 1.893 -31.359 25.815 194 1HG1 ILE 24 HG12 ILE 24 3.268 -33.514 24.175 195 2HG1 ILE 24 HG11 ILE 24 2.471 -32.090 23.513 196 1HG2 ILE 24 HG21 ILE 24 3.087 -33.999 26.683 197 2HG2 ILE 24 HG22 ILE 24 2.249 -32.844 27.718 198 3HG2 ILE 24 HG23 ILE 24 3.792 -32.410 26.984 199 1HD1 ILE 24 HD11 ILE 24 4.899 -32.093 25.297 200 2HD1 ILE 24 HD12 ILE 24 4.100 -30.661 24.648 201 3HD1 ILE 24 HD13 ILE 24 4.877 -31.807 23.557 202 H MET 25 HN MET 25 -0.275 -35.105 26.600 203 HA MET 25 HA MET 25 -1.562 -33.413 28.653 204 1HB MET 25 HB2 MET 25 -2.381 -36.158 27.658 205 2HB MET 25 HB1 MET 25 -3.170 -35.280 28.961 206 1HG MET 25 HG2 MET 25 -3.572 -33.435 27.242 207 2HG MET 25 HG1 MET 25 -3.133 -34.636 26.030 208 1HE MET 25 HE1 MET 25 -4.492 -36.900 25.635 209 2HE MET 25 HE2 MET 25 -5.923 -37.355 26.559 210 3HE MET 25 HE3 MET 25 -4.344 -37.329 27.341 211 H THR 26 HN THR 26 -2.031 -34.837 30.709 212 HA THR 26 HA THR 26 0.544 -36.037 31.503 213 HB THR 26 HB THR 26 -0.358 -35.626 33.856 214 HG1 THR 26 HG1 THR 26 -1.987 -33.597 33.143 215 1HG2 THR 26 HG21 THR 26 0.217 -33.231 33.820 216 2HG2 THR 26 HG22 THR 26 0.098 -33.235 32.061 217 3HG2 THR 26 HG23 THR 26 1.349 -34.186 32.861 218 H THR 27 HN THR 27 -2.038 -37.237 30.212 219 HA THR 27 HA THR 27 -2.129 -39.607 31.928 220 HB THR 27 HB THR 27 -4.063 -38.257 32.632 221 HG1 THR 27 HG1 THR 27 -5.564 -39.890 32.402 222 1HG2 THR 27 HG21 THR 27 -5.893 -37.776 31.060 223 2HG2 THR 27 HG22 THR 27 -4.920 -38.410 29.733 224 3HG2 THR 27 HG23 THR 27 -4.407 -36.954 30.587 225 H LYS 28 HN LYS 28 -2.974 -41.494 30.820 226 HA LYS 28 HA LYS 28 -2.389 -41.485 27.969 227 1HB LYS 28 HB2 LYS 28 -3.295 -43.802 29.705 228 2HB LYS 28 HB1 LYS 28 -2.589 -43.905 28.096 229 1HG LYS 28 HG2 LYS 28 -0.487 -42.931 29.040 230 2HG LYS 28 HG1 LYS 28 -1.216 -43.057 30.643 231 1HD LYS 28 HD2 LYS 28 -1.518 -45.512 30.222 232 2HD LYS 28 HD1 LYS 28 -0.592 -45.312 28.735 233 1HE LYS 28 HE2 LYS 28 0.843 -46.140 30.500 234 2HE LYS 28 HE1 LYS 28 1.323 -44.504 30.054 235 1HZ LYS 28 HZ1 LYS 28 0.262 -43.645 32.001 236 2HZ LYS 28 HZ2 LYS 28 1.266 -44.920 32.479 237 3HZ LYS 28 HZ3 LYS 28 -0.405 -45.153 32.380 238 H ASP 29 HN ASP 29 -5.010 -40.809 29.857 239 HA ASP 29 HA ASP 29 -7.053 -42.213 28.413 240 1HB ASP 29 HB2 ASP 29 -7.478 -41.677 30.740 241 2HB ASP 29 HB1 ASP 29 -7.215 -39.963 30.441 242 H THR 30 HN THR 30 -6.456 -41.556 26.291 243 HA THR 30 HA THR 30 -7.156 -38.809 25.616 244 HB THR 30 HB THR 30 -5.181 -39.542 24.488 245 HG1 THR 30 HG1 THR 30 -6.395 -39.843 22.202 246 1HG2 THR 30 HG21 THR 30 -5.473 -41.966 24.690 247 2HG2 THR 30 HG22 THR 30 -5.096 -41.512 23.028 248 3HG2 THR 30 HG23 THR 30 -6.751 -41.922 23.475 249 H SER 31 HN SER 31 -9.297 -38.579 25.678 250 HA SER 31 HA SER 31 -10.975 -40.219 23.955 251 1HB SER 31 HB2 SER 31 -10.985 -41.311 26.217 252 2HB SER 31 HB1 SER 31 -11.631 -39.816 26.890 253 HG SER 31 HG SER 31 -12.935 -41.818 25.693 254 H THR 32 HN THR 32 -11.043 -37.661 26.436 255 HA THR 32 HA THR 32 -13.168 -36.179 25.373 256 HB THR 32 HB THR 32 -10.786 -35.054 26.878 257 HG1 THR 32 HG1 THR 32 -13.149 -35.907 28.160 258 1HG2 THR 32 HG21 THR 32 -12.427 -33.435 27.740 259 2HG2 THR 32 HG22 THR 32 -13.686 -34.180 26.756 260 3HG2 THR 32 HG23 THR 32 -12.329 -33.362 25.980 261 H LEU 33 HN LEU 33 -9.758 -36.291 24.619 262 HA LEU 33 HA LEU 33 -9.528 -34.097 22.905 263 1HB LEU 33 HB2 LEU 33 -7.612 -35.399 23.703 264 2HB LEU 33 HB1 LEU 33 -8.158 -36.794 22.792 265 HG LEU 33 HG LEU 33 -7.750 -35.585 20.683 266 1HD1 LEU 33 HD11 LEU 33 -6.685 -33.380 22.452 267 2HD1 LEU 33 HD12 LEU 33 -8.144 -33.308 21.462 268 3HD1 LEU 33 HD13 LEU 33 -6.564 -33.446 20.693 269 1HD2 LEU 33 HD21 LEU 33 -5.980 -36.983 21.620 270 2HD2 LEU 33 HD22 LEU 33 -5.377 -35.616 22.556 271 3HD2 LEU 33 HD23 LEU 33 -5.297 -35.583 20.794 272 H LYS 34 HN LYS 34 -10.551 -37.435 22.272 273 HA LYS 34 HA LYS 34 -10.921 -37.062 19.470 274 1HB LYS 34 HB2 LYS 34 -12.022 -39.181 21.335 275 2HB LYS 34 HB1 LYS 34 -12.131 -39.236 19.580 276 1HG LYS 34 HG2 LYS 34 -9.697 -39.325 19.415 277 2HG LYS 34 HG1 LYS 34 -9.566 -39.225 21.172 278 1HD LYS 34 HD2 LYS 34 -10.904 -41.452 19.619 279 2HD LYS 34 HD1 LYS 34 -9.316 -41.535 20.386 280 1HE LYS 34 HE2 LYS 34 -10.351 -41.180 22.574 281 2HE LYS 34 HE1 LYS 34 -11.940 -41.082 21.819 282 1HZ LYS 34 HZ1 LYS 34 -11.629 -43.375 21.052 283 2HZ LYS 34 HZ2 LYS 34 -11.602 -43.252 22.737 284 3HZ LYS 34 HZ3 LYS 34 -10.156 -43.453 21.883 285 H GLU 35 HN GLU 35 -12.951 -36.720 22.308 286 HA GLU 35 HA GLU 35 -15.489 -36.681 21.238 287 1HB GLU 35 HB2 GLU 35 -14.297 -35.017 23.464 288 2HB GLU 35 HB1 GLU 35 -16.011 -34.991 23.078 289 1HG GLU 35 HG2 GLU 35 -14.451 -37.431 23.912 290 2HG GLU 35 HG1 GLU 35 -15.485 -36.466 24.964 291 H LEU 36 HN LEU 36 -13.212 -33.948 21.451 292 HA LEU 36 HA LEU 36 -15.012 -32.082 20.269 293 1HB LEU 36 HB2 LEU 36 -13.250 -30.512 20.358 294 2HB LEU 36 HB1 LEU 36 -13.069 -31.520 21.777 295 HG LEU 36 HG LEU 36 -11.402 -32.806 20.049 296 1HD1 LEU 36 HD11 LEU 36 -11.224 -29.878 19.338 297 2HD1 LEU 36 HD12 LEU 36 -11.688 -31.198 18.263 298 3HD1 LEU 36 HD13 LEU 36 -10.045 -31.116 18.895 299 1HD2 LEU 36 HD21 LEU 36 -10.693 -30.482 21.841 300 2HD2 LEU 36 HD22 LEU 36 -9.562 -31.688 21.225 301 3HD2 LEU 36 HD23 LEU 36 -10.850 -32.171 22.329 302 H LEU 37 HN LEU 37 -12.648 -34.319 19.038 303 HA LEU 37 HA LEU 37 -12.454 -33.207 16.411 304 1HB LEU 37 HB2 LEU 37 -11.861 -36.017 17.367 305 2HB LEU 37 HB1 LEU 37 -11.348 -35.327 15.838 306 HG LEU 37 HG LEU 37 -10.460 -34.329 18.554 307 1HD1 LEU 37 HD11 LEU 37 -8.307 -35.367 18.035 308 2HD1 LEU 37 HD12 LEU 37 -8.989 -36.051 16.559 309 3HD1 LEU 37 HD13 LEU 37 -9.596 -36.566 18.132 310 1HD2 LEU 37 HD21 LEU 37 -9.489 -33.644 15.777 311 2HD2 LEU 37 HD22 LEU 37 -8.796 -33.058 17.289 312 3HD2 LEU 37 HD23 LEU 37 -10.434 -32.595 16.834 313 H GLU 38 HN GLU 38 -14.448 -35.670 17.939 314 HA GLU 38 HA GLU 38 -15.515 -36.768 15.560 315 1HB GLU 38 HB2 GLU 38 -16.528 -36.853 18.408 316 2HB GLU 38 HB1 GLU 38 -17.234 -37.774 17.085 317 1HG GLU 38 HG2 GLU 38 -15.077 -38.917 16.753 318 2HG GLU 38 HG1 GLU 38 -14.411 -38.024 18.118 319 H THR 39 HN THR 39 -16.315 -33.927 17.368 320 HA THR 39 HA THR 39 -19.014 -33.637 16.635 321 HB THR 39 HB THR 39 -18.767 -31.248 17.094 322 HG1 THR 39 HG1 THR 39 -16.075 -31.389 17.737 323 1HG2 THR 39 HG21 THR 39 -17.907 -31.372 19.389 324 2HG2 THR 39 HG22 THR 39 -17.175 -32.936 19.033 325 3HG2 THR 39 HG23 THR 39 -18.930 -32.759 19.014 326 H TYR 40 HN TYR 40 -16.043 -33.035 14.911 327 HA TYR 40 HA TYR 40 -17.280 -31.648 12.702 328 1HB TYR 40 HB2 TYR 40 -14.530 -32.905 12.960 329 2HB TYR 40 HB1 TYR 40 -15.053 -31.877 11.630 330 HD1 TYR 40 HD1 TYR 40 -15.053 -29.498 11.840 331 HD2 TYR 40 HD2 TYR 40 -14.275 -31.933 15.249 332 HE1 TYR 40 HE1 TYR 40 -14.328 -27.511 13.092 333 HE2 TYR 40 HE2 TYR 40 -13.546 -29.950 16.506 334 HH TYR 40 HH TYR 40 -13.866 -26.711 15.160 335 H GLN 41 HN GLN 41 -16.751 -34.897 13.662 336 HA GLN 41 HA GLN 41 -17.117 -36.927 12.730 337 1HB GLN 41 HB2 GLN 41 -18.969 -35.258 11.016 338 2HB GLN 41 HB1 GLN 41 -18.917 -37.015 10.949 339 1HG GLN 41 HG2 GLN 41 -19.531 -35.410 13.426 340 2HG GLN 41 HG1 GLN 41 -20.740 -36.134 12.366 341 1HE2 GLN 41 HE21 GLN 41 -20.041 -36.603 15.220 342 2HE2 GLN 41 HE22 GLN 41 -19.775 -38.307 15.341 343 H ARG 42 HN ARG 42 -15.010 -35.093 11.612 344 HA ARG 42 HA ARG 42 -14.700 -36.194 8.911 345 1HB ARG 42 HB2 ARG 42 -12.992 -34.546 8.563 346 2HB ARG 42 HB1 ARG 42 -14.360 -33.732 9.307 347 1HG ARG 42 HG2 ARG 42 -13.251 -33.629 11.419 348 2HG ARG 42 HG1 ARG 42 -11.954 -34.684 10.852 349 1HD ARG 42 HD2 ARG 42 -11.020 -32.545 10.749 350 2HD ARG 42 HD1 ARG 42 -11.502 -32.875 9.089 351 HE ARG 42 HE ARG 42 -12.722 -30.958 10.930 352 1HH1 ARG 42 HH11 ARG 42 -12.778 -32.454 7.753 353 2HH1 ARG 42 HH12 ARG 42 -13.682 -31.159 7.037 354 1HH2 ARG 42 HH21 ARG 42 -13.833 -29.230 9.957 355 2HH2 ARG 42 HH22 ARG 42 -14.301 -29.342 8.290 356 HA PRO 43 HA PRO 43 -11.773 -39.247 10.160 357 1HB PRO 43 HB2 PRO 43 -9.886 -39.114 8.169 358 2HB PRO 43 HB1 PRO 43 -11.466 -39.879 7.975 359 1HG PRO 43 HG2 PRO 43 -10.577 -37.135 7.160 360 2HG PRO 43 HG1 PRO 43 -11.560 -38.307 6.259 361 1HD PRO 43 HD2 PRO 43 -12.676 -36.225 7.547 362 2HD PRO 43 HD1 PRO 43 -13.485 -37.803 7.458 363 H PHE 44 HN PHE 44 -10.099 -39.374 11.527 364 HA PHE 44 HA PHE 44 -7.896 -37.481 11.415 365 1HB PHE 44 HB2 PHE 44 -8.074 -36.857 13.782 366 2HB PHE 44 HB1 PHE 44 -9.506 -36.353 12.895 367 HD1 PHE 44 HD1 PHE 44 -8.192 -38.586 15.481 368 HD2 PHE 44 HD2 PHE 44 -11.665 -37.415 13.304 369 HE1 PHE 44 HE1 PHE 44 -9.610 -39.735 17.129 370 HE2 PHE 44 HE2 PHE 44 -13.088 -38.568 14.951 371 HZ PHE 44 HZ PHE 44 -12.060 -39.728 16.864 372 H LYS 45 HN LYS 45 -6.041 -38.195 12.551 373 HA LYS 45 HA LYS 45 -6.038 -41.090 13.095 374 1HB LYS 45 HB2 LYS 45 -4.521 -40.298 11.303 375 2HB LYS 45 HB1 LYS 45 -3.733 -39.228 12.453 376 1HG LYS 45 HG2 LYS 45 -3.080 -41.244 13.780 377 2HG LYS 45 HG1 LYS 45 -3.725 -42.244 12.478 378 1HD LYS 45 HD2 LYS 45 -1.341 -42.044 12.189 379 2HD LYS 45 HD1 LYS 45 -2.140 -41.130 10.908 380 1HE LYS 45 HE2 LYS 45 -1.750 -39.049 12.148 381 2HE LYS 45 HE1 LYS 45 -0.980 -39.959 13.446 382 1HZ LYS 45 HZ1 LYS 45 0.689 -39.015 12.037 383 2HZ LYS 45 HZ2 LYS 45 -0.011 -39.691 10.656 384 3HZ LYS 45 HZ3 LYS 45 0.698 -40.692 11.817 385 H LEU 46 HN LEU 46 -6.087 -41.597 15.203 386 HA LEU 46 HA LEU 46 -4.973 -39.789 17.202 387 1HB LEU 46 HB2 LEU 46 -7.162 -41.168 17.427 388 2HB LEU 46 HB1 LEU 46 -6.114 -42.538 17.722 389 HG LEU 46 HG LEU 46 -7.013 -41.532 19.801 390 1HD1 LEU 46 HD11 LEU 46 -4.931 -41.421 21.054 391 2HD1 LEU 46 HD12 LEU 46 -4.020 -41.246 19.555 392 3HD1 LEU 46 HD13 LEU 46 -4.890 -42.744 19.888 393 1HD2 LEU 46 HD21 LEU 46 -6.216 -39.353 20.560 394 2HD2 LEU 46 HD22 LEU 46 -7.129 -39.208 19.059 395 3HD2 LEU 46 HD23 LEU 46 -5.368 -39.120 19.030 396 H GLU 47 HN GLU 47 -2.862 -39.866 17.573 397 HA GLU 47 HA GLU 47 -1.441 -42.434 17.313 398 1HB GLU 47 HB2 GLU 47 -1.200 -40.125 15.639 399 2HB GLU 47 HB1 GLU 47 0.298 -40.296 16.537 400 1HG GLU 47 HG2 GLU 47 -0.899 -42.652 15.134 401 2HG GLU 47 HG1 GLU 47 0.032 -41.455 14.238 402 H PHE 48 HN PHE 48 0.547 -42.578 18.465 403 HA PHE 48 HA PHE 48 0.822 -40.679 20.712 404 1HB PHE 48 HB2 PHE 48 -0.184 -42.748 21.534 405 2HB PHE 48 HB1 PHE 48 1.074 -43.703 20.760 406 HD1 PHE 48 HD1 PHE 48 3.036 -44.238 21.914 407 HD2 PHE 48 HD2 PHE 48 0.521 -41.134 23.393 408 HE1 PHE 48 HE1 PHE 48 4.380 -44.132 23.970 409 HE2 PHE 48 HE2 PHE 48 1.865 -41.025 25.452 410 HZ PHE 48 HZ PHE 48 3.794 -42.528 25.739 411 H LYS 49 HN LYS 49 2.713 -39.661 20.557 412 HA LYS 49 HA LYS 49 4.746 -40.671 18.753 413 1HB LYS 49 HB2 LYS 49 4.609 -38.099 20.336 414 2HB LYS 49 HB1 LYS 49 5.860 -38.492 19.168 415 1HG LYS 49 HG2 LYS 49 2.928 -38.255 18.493 416 2HG LYS 49 HG1 LYS 49 4.094 -36.944 18.334 417 1HD LYS 49 HD2 LYS 49 4.112 -37.756 16.182 418 2HD LYS 49 HD1 LYS 49 5.407 -38.726 16.880 419 1HE LYS 49 HE2 LYS 49 3.827 -40.575 17.223 420 2HE LYS 49 HE1 LYS 49 2.531 -39.597 16.544 421 1HZ LYS 49 HZ1 LYS 49 3.693 -39.559 14.437 422 2HZ LYS 49 HZ2 LYS 49 3.452 -41.157 14.936 423 3HZ LYS 49 HZ3 LYS 49 4.978 -40.448 15.087 424 H ASN 50 HN ASN 50 4.863 -39.391 22.093 425 HA ASN 50 HA ASN 50 6.759 -41.396 22.916 426 1HB ASN 50 HB2 ASN 50 8.286 -39.969 21.679 427 2HB ASN 50 HB1 ASN 50 7.657 -38.532 22.476 428 1HD2 ASN 50 HD21 ASN 50 9.611 -41.406 22.872 429 2HD2 ASN 50 HD22 ASN 50 10.418 -40.887 24.311 430 H THR 51 HN THR 51 7.328 -41.194 25.178 431 HA THR 51 HA THR 51 5.556 -39.400 26.709 432 HB THR 51 HB THR 51 4.733 -41.672 26.942 433 HG1 THR 51 HG1 THR 51 5.046 -41.899 29.262 434 1HG2 THR 51 HG21 THR 51 6.781 -42.891 26.357 435 2HG2 THR 51 HG22 THR 51 6.105 -43.472 27.879 436 3HG2 THR 51 HG23 THR 51 7.509 -42.406 27.890 437 H SER 52 HN SER 52 6.416 -38.481 28.558 438 HA SER 52 HA SER 52 9.082 -37.703 28.502 439 1HB SER 52 HB2 SER 52 7.505 -36.331 29.659 440 2HB SER 52 HB1 SER 52 7.026 -37.652 30.721 441 HG SER 52 HG SER 52 9.034 -35.862 31.009 442 H LYS 53 HN LYS 53 10.794 -38.088 30.037 443 HA LYS 53 HA LYS 53 11.467 -40.752 30.516 444 1HB LYS 53 HB2 LYS 53 12.425 -38.288 32.006 445 2HB LYS 53 HB1 LYS 53 13.229 -39.852 31.999 446 1HG LYS 53 HG2 LYS 53 12.773 -38.205 29.517 447 2HG LYS 53 HG1 LYS 53 14.232 -38.105 30.501 448 1HD LYS 53 HD2 LYS 53 13.270 -40.725 29.364 449 2HD LYS 53 HD1 LYS 53 14.272 -39.622 28.421 450 1HE LYS 53 HE2 LYS 53 15.689 -41.269 29.459 451 2HE LYS 53 HE1 LYS 53 15.985 -39.708 30.216 452 1HZ LYS 53 HZ1 LYS 53 14.241 -41.828 31.348 453 2HZ LYS 53 HZ2 LYS 53 14.672 -40.371 32.096 454 3HZ LYS 53 HZ3 LYS 53 15.845 -41.553 31.807 455 H ASN 54 HN ASN 54 9.674 -38.446 32.416 456 HA ASN 54 HA ASN 54 9.646 -40.087 34.814 457 1HB ASN 54 HB2 ASN 54 8.083 -37.566 34.184 458 2HB ASN 54 HB1 ASN 54 8.276 -38.303 35.771 459 1HD2 ASN 54 HD21 ASN 54 8.960 -35.630 34.871 460 2HD2 ASN 54 HD22 ASN 54 10.652 -35.439 35.164 461 H ALA 55 HN ALA 55 8.013 -40.121 31.924 462 HA ALA 55 HA ALA 55 6.081 -41.008 31.135 463 1HB ALA 55 HB1 ALA 55 6.843 -43.007 32.314 464 2HB ALA 55 HB2 ALA 55 5.086 -42.873 32.391 465 3HB ALA 55 HB3 ALA 55 6.066 -42.446 33.794 466 H LYS 56 HN LYS 56 6.102 -38.588 32.996 467 HA LYS 56 HA LYS 56 3.423 -38.599 34.118 468 1HB LYS 56 HB2 LYS 56 5.272 -37.510 35.337 469 2HB LYS 56 HB1 LYS 56 5.516 -36.410 33.990 470 1HG LYS 56 HG2 LYS 56 4.317 -35.268 35.728 471 2HG LYS 56 HG1 LYS 56 3.238 -35.508 34.354 472 1HD LYS 56 HD2 LYS 56 2.056 -35.976 36.421 473 2HD LYS 56 HD1 LYS 56 2.250 -37.467 35.498 474 1HE LYS 56 HE2 LYS 56 4.133 -38.112 36.917 475 2HE LYS 56 HE1 LYS 56 3.992 -36.599 37.812 476 1HZ LYS 56 HZ1 LYS 56 2.961 -38.475 38.969 477 2HZ LYS 56 HZ2 LYS 56 1.895 -38.700 37.680 478 3HZ LYS 56 HZ3 LYS 56 1.825 -37.281 38.591 479 H PHE 57 HN PHE 57 5.156 -37.322 31.364 480 HA PHE 57 HA PHE 57 2.705 -35.985 30.408 481 1HB PHE 57 HB2 PHE 57 5.580 -35.399 29.628 482 2HB PHE 57 HB1 PHE 57 4.154 -34.530 29.068 483 HD1 PHE 57 HD1 PHE 57 6.591 -34.888 31.713 484 HD2 PHE 57 HD2 PHE 57 2.845 -33.145 30.679 485 HE1 PHE 57 HE1 PHE 57 6.789 -33.342 33.615 486 HE2 PHE 57 HE2 PHE 57 3.041 -31.596 32.580 487 HZ PHE 57 HZ PHE 57 5.014 -31.692 34.052 488 H TYR 58 HN TYR 58 1.894 -36.553 28.466 489 HA TYR 58 HA TYR 58 3.326 -38.607 26.907 490 1HB TYR 58 HB2 TYR 58 0.329 -38.374 27.324 491 2HB TYR 58 HB1 TYR 58 1.151 -39.610 26.377 492 HD1 TYR 58 HD1 TYR 58 2.068 -41.551 27.428 493 HD2 TYR 58 HD2 TYR 58 0.612 -38.334 29.810 494 HE1 TYR 58 HE1 TYR 58 2.217 -42.969 29.431 495 HE2 TYR 58 HE2 TYR 58 0.765 -39.742 31.814 496 HH TYR 58 HH TYR 58 2.465 -42.610 31.930 497 H SER 59 HN SER 59 3.717 -38.033 24.873 498 HA SER 59 HA SER 59 2.441 -35.661 23.759 499 1HB SER 59 HB2 SER 59 4.679 -37.371 22.632 500 2HB SER 59 HB1 SER 59 4.163 -35.795 22.029 501 HG SER 59 HG SER 59 4.882 -35.982 24.719 502 H PHE 60 HN PHE 60 0.575 -35.978 22.749 503 HA PHE 60 HA PHE 60 0.157 -38.427 21.179 504 1HB PHE 60 HB2 PHE 60 -1.837 -36.384 22.205 505 2HB PHE 60 HB1 PHE 60 -2.252 -37.772 21.205 506 HD1 PHE 60 HD1 PHE 60 -1.811 -36.584 24.531 507 HD2 PHE 60 HD2 PHE 60 -1.658 -40.102 22.129 508 HE1 PHE 60 HE1 PHE 60 -2.060 -37.972 26.546 509 HE2 PHE 60 HE2 PHE 60 -1.906 -41.491 24.142 510 HZ PHE 60 HZ PHE 60 -2.108 -40.430 26.354 511 H ASN 61 HN ASN 61 -0.890 -38.208 19.116 512 HA ASN 61 HA ASN 61 -0.281 -35.687 17.715 513 1HB ASN 61 HB2 ASN 61 1.539 -37.418 17.440 514 2HB ASN 61 HB1 ASN 61 0.356 -38.474 16.690 515 1HD2 ASN 61 HD21 ASN 61 -0.970 -36.477 15.086 516 2HD2 ASN 61 HD22 ASN 61 0.152 -35.962 13.886 517 H VAL 62 HN VAL 62 -1.947 -35.022 16.493 518 HA VAL 62 HA VAL 62 -3.914 -37.022 15.567 519 HB VAL 62 HB VAL 62 -4.572 -34.265 16.649 520 1HG1 VAL 62 HG11 VAL 62 -6.016 -34.852 14.774 521 2HG1 VAL 62 HG12 VAL 62 -6.923 -34.901 16.286 522 3HG1 VAL 62 HG13 VAL 62 -6.394 -36.403 15.525 523 1HG2 VAL 62 HG21 VAL 62 -4.066 -35.854 18.434 524 2HG2 VAL 62 HG22 VAL 62 -5.221 -37.004 17.757 525 3HG2 VAL 62 HG23 VAL 62 -5.787 -35.468 18.414 526 H SER 63 HN SER 63 -3.925 -37.038 13.415 527 HA SER 63 HA SER 63 -3.458 -34.502 11.979 528 1HB SER 63 HB2 SER 63 -2.902 -36.026 10.018 529 2HB SER 63 HB1 SER 63 -1.767 -36.091 11.365 530 HG SER 63 HG SER 63 -3.448 -38.029 10.379 531 H MET 64 HN MET 64 -5.169 -33.641 10.983 532 HA MET 64 HA MET 64 -7.378 -35.342 10.083 533 1HB MET 64 HB2 MET 64 -9.051 -33.977 11.255 534 2HB MET 64 HB1 MET 64 -7.950 -34.732 12.398 535 1HG MET 64 HG2 MET 64 -6.672 -32.559 12.430 536 2HG MET 64 HG1 MET 64 -8.009 -31.855 11.523 537 1HE MET 64 HE1 MET 64 -10.524 -31.755 12.473 538 2HE MET 64 HE2 MET 64 -10.977 -32.284 14.093 539 3HE MET 64 HE3 MET 64 -10.502 -33.471 12.878 540 H GLU 65 HN GLU 65 -8.601 -34.433 8.419 541 HA GLU 65 HA GLU 65 -7.314 -32.389 6.889 542 1HB GLU 65 HB2 GLU 65 -10.032 -33.667 6.498 543 2HB GLU 65 HB1 GLU 65 -9.214 -32.622 5.343 544 1HG GLU 65 HG2 GLU 65 -7.387 -34.271 5.188 545 2HG GLU 65 HG1 GLU 65 -8.281 -35.329 6.279 546 H VAL 66 HN VAL 66 -7.394 -30.350 7.520 547 HA VAL 66 HA VAL 66 -9.732 -29.316 8.931 548 HB VAL 66 HB VAL 66 -8.338 -27.244 9.218 549 1HG1 VAL 66 HG11 VAL 66 -7.089 -29.832 10.162 550 2HG1 VAL 66 HG12 VAL 66 -8.421 -28.979 10.942 551 3HG1 VAL 66 HG13 VAL 66 -6.822 -28.238 10.871 552 1HG2 VAL 66 HG21 VAL 66 -6.904 -27.497 7.243 553 2HG2 VAL 66 HG22 VAL 66 -6.167 -28.932 7.953 554 3HG2 VAL 66 HG23 VAL 66 -5.942 -27.357 8.713 555 H SER 67 HN SER 67 -11.235 -28.070 8.032 556 HA SER 67 HA SER 67 -11.483 -27.895 5.244 557 1HB SER 67 HB2 SER 67 -13.430 -27.943 6.705 558 2HB SER 67 HB1 SER 67 -12.963 -26.407 7.433 559 HG SER 67 HG SER 67 -13.969 -26.925 4.853 560 H ASN 68 HN ASN 68 -10.259 -25.615 7.605 561 HA ASN 68 HA ASN 68 -9.129 -23.923 5.585 562 1HB ASN 68 HB2 ASN 68 -10.357 -21.868 6.243 563 2HB ASN 68 HB1 ASN 68 -11.423 -23.070 5.521 564 1HD2 ASN 68 HD21 ASN 68 -13.009 -24.019 6.762 565 2HD2 ASN 68 HD22 ASN 68 -13.406 -23.477 8.357 566 H GLU 69 HN GLU 69 -8.555 -21.684 6.964 567 HA GLU 69 HA GLU 69 -6.554 -22.640 8.766 568 1HB GLU 69 HB2 GLU 69 -6.154 -20.735 7.266 569 2HB GLU 69 HB1 GLU 69 -7.386 -19.803 8.105 570 1HG GLU 69 HG2 GLU 69 -6.048 -19.855 10.149 571 2HG GLU 69 HG1 GLU 69 -4.821 -20.816 9.326 572 H SER 70 HN SER 70 -9.637 -20.919 9.173 573 HA SER 70 HA SER 70 -9.344 -20.301 11.893 574 1HB SER 70 HB2 SER 70 -11.897 -20.939 10.386 575 2HB SER 70 HB1 SER 70 -11.794 -20.098 11.936 576 HG SER 70 HG SER 70 -11.944 -18.786 9.923 577 H GLU 71 HN GLU 71 -10.327 -23.261 10.270 578 HA GLU 71 HA GLU 71 -11.243 -24.786 12.402 579 1HB GLU 71 HB2 GLU 71 -9.511 -25.623 10.051 580 2HB GLU 71 HB1 GLU 71 -10.278 -26.761 11.146 581 1HG GLU 71 HG2 GLU 71 -11.913 -24.748 9.648 582 2HG GLU 71 HG1 GLU 71 -11.377 -26.235 8.871 583 H ARG 72 HN ARG 72 -7.871 -24.486 11.240 584 HA ARG 72 HA ARG 72 -6.798 -26.226 13.179 585 1HB ARG 72 HB2 ARG 72 -4.608 -25.481 12.463 586 2HB ARG 72 HB1 ARG 72 -5.642 -25.711 11.063 587 1HG ARG 72 HG2 ARG 72 -5.894 -23.373 10.752 588 2HG ARG 72 HG1 ARG 72 -5.173 -23.020 12.323 589 1HD ARG 72 HD2 ARG 72 -3.741 -24.270 9.974 590 2HD ARG 72 HD1 ARG 72 -3.619 -22.580 10.471 591 HE ARG 72 HE ARG 72 -2.945 -24.540 12.500 592 1HH1 ARG 72 HH11 ARG 72 -1.758 -22.405 9.992 593 2HH1 ARG 72 HH12 ARG 72 -0.134 -22.398 10.599 594 1HH2 ARG 72 HH21 ARG 72 -0.811 -24.514 13.297 595 2HH2 ARG 72 HH22 ARG 72 0.407 -23.603 12.472 596 H ASN 73 HN ASN 73 -7.858 -23.024 13.480 597 HA ASN 73 HA ASN 73 -6.194 -22.524 15.840 598 1HB ASN 73 HB2 ASN 73 -8.131 -20.751 14.333 599 2HB ASN 73 HB1 ASN 73 -7.349 -20.273 15.837 600 1HD2 ASN 73 HD21 ASN 73 -6.939 -20.817 12.443 601 2HD2 ASN 73 HD22 ASN 73 -5.341 -20.171 12.325 602 H GLU 74 HN GLU 74 -9.575 -22.985 14.899 603 HA GLU 74 HA GLU 74 -10.636 -22.491 17.488 604 1HB GLU 74 HB2 GLU 74 -12.735 -23.134 16.609 605 2HB GLU 74 HB1 GLU 74 -11.889 -22.358 15.285 606 1HG GLU 74 HG2 GLU 74 -11.365 -24.551 14.340 607 2HG GLU 74 HG1 GLU 74 -12.253 -25.319 15.660 608 H ILE 75 HN ILE 75 -9.871 -25.432 15.690 609 HA ILE 75 HA ILE 75 -10.620 -27.321 17.621 610 HB ILE 75 HB ILE 75 -8.429 -27.490 15.529 611 1HG1 ILE 75 HG12 ILE 75 -11.273 -28.514 15.375 612 2HG1 ILE 75 HG11 ILE 75 -10.785 -26.944 14.749 613 1HG2 ILE 75 HG21 ILE 75 -8.159 -29.226 17.226 614 2HG2 ILE 75 HG22 ILE 75 -8.694 -29.927 15.699 615 3HG2 ILE 75 HG23 ILE 75 -9.844 -29.708 17.018 616 1HD1 ILE 75 HD11 ILE 75 -9.750 -29.614 13.831 617 2HD1 ILE 75 HD12 ILE 75 -9.249 -28.039 13.211 618 3HD1 ILE 75 HD13 ILE 75 -10.910 -28.586 12.988 619 H PHE 76 HN PHE 76 -7.635 -25.557 17.071 620 HA PHE 76 HA PHE 76 -5.934 -26.764 18.896 621 1HB PHE 76 HB2 PHE 76 -5.166 -25.115 17.279 622 2HB PHE 76 HB1 PHE 76 -6.126 -23.859 18.050 623 HD1 PHE 76 HD1 PHE 76 -5.222 -22.563 19.782 624 HD2 PHE 76 HD2 PHE 76 -3.258 -26.157 18.601 625 HE1 PHE 76 HE1 PHE 76 -3.294 -21.969 21.186 626 HE2 PHE 76 HE2 PHE 76 -1.330 -25.563 20.008 627 HZ PHE 76 HZ PHE 76 -1.346 -23.468 21.303 628 H GLN 77 HN GLN 77 -8.393 -24.281 19.395 629 HA GLN 77 HA GLN 77 -7.744 -23.810 22.143 630 1HB GLN 77 HB2 GLN 77 -10.263 -23.178 20.582 631 2HB GLN 77 HB1 GLN 77 -9.895 -22.574 22.193 632 1HG GLN 77 HG2 GLN 77 -7.942 -21.394 21.309 633 2HG GLN 77 HG1 GLN 77 -8.306 -22.003 19.695 634 1HE2 GLN 77 HE21 GLN 77 -9.279 -19.829 22.224 635 2HE2 GLN 77 HE22 GLN 77 -10.372 -18.887 21.272 636 H LYS 78 HN LYS 78 -10.071 -25.825 20.420 637 HA LYS 78 HA LYS 78 -11.545 -26.676 22.674 638 1HB LYS 78 HB2 LYS 78 -11.096 -28.284 20.150 639 2HB LYS 78 HB1 LYS 78 -12.458 -28.394 21.257 640 1HG LYS 78 HG2 LYS 78 -12.982 -25.986 20.615 641 2HG LYS 78 HG1 LYS 78 -11.799 -26.193 19.328 642 1HD LYS 78 HD2 LYS 78 -13.084 -28.011 18.374 643 2HD LYS 78 HD1 LYS 78 -14.237 -27.930 19.710 644 1HE LYS 78 HE2 LYS 78 -14.878 -25.668 19.035 645 2HE LYS 78 HE1 LYS 78 -13.705 -25.714 17.719 646 1HZ LYS 78 HZ1 LYS 78 -16.064 -27.497 17.999 647 2HZ LYS 78 HZ2 LYS 78 -14.942 -27.541 16.737 648 3HZ LYS 78 HZ3 LYS 78 -15.933 -26.189 16.937 649 H ILE 79 HN ILE 79 -8.528 -27.689 21.283 650 HA ILE 79 HA ILE 79 -8.244 -30.188 22.546 651 HB ILE 79 HB ILE 79 -6.139 -28.239 21.580 652 1HG1 ILE 79 HG12 ILE 79 -7.213 -30.795 20.352 653 2HG1 ILE 79 HG11 ILE 79 -7.653 -29.169 19.845 654 1HG2 ILE 79 HG21 ILE 79 -4.552 -30.107 21.674 655 2HG2 ILE 79 HG22 ILE 79 -5.785 -31.117 22.431 656 3HG2 ILE 79 HG23 ILE 79 -5.164 -29.697 23.276 657 1HD1 ILE 79 HD11 ILE 79 -4.907 -30.393 19.679 658 2HD1 ILE 79 HD12 ILE 79 -5.337 -28.754 19.186 659 3HD1 ILE 79 HD13 ILE 79 -6.026 -30.139 18.340 660 H SER 80 HN SER 80 -7.732 -26.920 23.727 661 HA SER 80 HA SER 80 -6.321 -27.881 26.075 662 1HB SER 80 HB2 SER 80 -6.321 -25.475 26.756 663 2HB SER 80 HB1 SER 80 -5.567 -25.786 25.196 664 HG SER 80 HG SER 80 -8.213 -25.270 24.914 665 H GLN 81 HN GLN 81 -9.379 -28.225 25.290 666 HA GLN 81 HA GLN 81 -10.599 -27.310 27.780 667 1HB GLN 81 HB2 GLN 81 -11.737 -28.719 25.358 668 2HB GLN 81 HB1 GLN 81 -12.686 -28.309 26.781 669 1HG GLN 81 HG2 GLN 81 -12.257 -25.942 26.408 670 2HG GLN 81 HG1 GLN 81 -11.248 -26.332 25.016 671 1HE2 GLN 81 HE21 GLN 81 -12.975 -28.455 24.063 672 2HE2 GLN 81 HE22 GLN 81 -14.373 -27.690 23.390 673 H LEU 82 HN LEU 82 -8.721 -29.868 27.021 674 HA LEU 82 HA LEU 82 -10.275 -32.024 28.128 675 1HB LEU 82 HB2 LEU 82 -7.276 -32.106 27.937 676 2HB LEU 82 HB1 LEU 82 -8.434 -33.404 27.736 677 HG LEU 82 HG LEU 82 -7.982 -31.163 25.769 678 1HD1 LEU 82 HD11 LEU 82 -7.023 -32.894 24.326 679 2HD1 LEU 82 HD12 LEU 82 -7.173 -34.063 25.639 680 3HD1 LEU 82 HD13 LEU 82 -6.097 -32.675 25.810 681 1HD2 LEU 82 HD21 LEU 82 -10.281 -31.913 25.735 682 2HD2 LEU 82 HD22 LEU 82 -9.757 -33.591 25.596 683 3HD2 LEU 82 HD23 LEU 82 -9.440 -32.456 24.283 684 H ASP 83 HN ASP 83 -8.260 -29.549 29.354 685 HA ASP 83 HA ASP 83 -7.661 -28.895 31.435 686 1HB ASP 83 HB2 ASP 83 -9.907 -29.705 32.155 687 2HB ASP 83 HB1 ASP 83 -9.203 -31.286 32.478 688 H LYS 84 HN LYS 84 -7.387 -32.348 30.818 689 HA LYS 84 HA LYS 84 -5.163 -32.802 32.553 690 1HB LYS 84 HB2 LYS 84 -6.330 -34.408 30.271 691 2HB LYS 84 HB1 LYS 84 -5.064 -34.994 31.341 692 1HG LYS 84 HG2 LYS 84 -6.501 -35.448 33.012 693 2HG LYS 84 HG1 LYS 84 -7.455 -33.991 32.729 694 1HD LYS 84 HD2 LYS 84 -8.742 -35.009 31.056 695 2HD LYS 84 HD1 LYS 84 -7.584 -36.319 30.828 696 1HE LYS 84 HE2 LYS 84 -8.174 -37.246 33.004 697 2HE LYS 84 HE1 LYS 84 -9.247 -35.884 33.319 698 1HZ LYS 84 HZ1 LYS 84 -10.697 -36.594 31.587 699 2HZ LYS 84 HZ2 LYS 84 -10.393 -37.933 32.577 700 3HZ LYS 84 HZ3 LYS 84 -9.620 -37.797 31.079 701 H VAL 85 HN VAL 85 -5.395 -31.200 29.647 702 HA VAL 85 HA VAL 85 -2.834 -32.062 28.565 703 HB VAL 85 HB VAL 85 -4.638 -31.670 26.979 704 1HG1 VAL 85 HG11 VAL 85 -5.907 -30.008 28.246 705 2HG1 VAL 85 HG12 VAL 85 -5.590 -29.456 26.603 706 3HG1 VAL 85 HG13 VAL 85 -4.648 -28.808 27.946 707 1HG2 VAL 85 HG21 VAL 85 -3.497 -30.155 25.428 708 2HG2 VAL 85 HG22 VAL 85 -2.353 -31.234 26.226 709 3HG2 VAL 85 HG23 VAL 85 -2.491 -29.553 26.745 710 H VAL 86 HN VAL 86 -0.965 -30.958 28.760 711 HA VAL 86 HA VAL 86 -1.024 -28.507 30.390 712 HB VAL 86 HB VAL 86 1.353 -28.978 30.900 713 1HG1 VAL 86 HG11 VAL 86 -0.393 -29.748 32.420 714 2HG1 VAL 86 HG12 VAL 86 0.951 -30.890 32.388 715 3HG1 VAL 86 HG13 VAL 86 -0.537 -31.255 31.514 716 1HG2 VAL 86 HG21 VAL 86 1.944 -30.225 28.883 717 2HG2 VAL 86 HG22 VAL 86 0.881 -31.546 29.371 718 3HG2 VAL 86 HG23 VAL 86 2.314 -31.166 30.328 719 H GLN 87 HN GLN 87 -0.039 -29.798 27.306 720 HA GLN 87 HA GLN 87 0.768 -27.109 26.483 721 1HB GLN 87 HB2 GLN 87 2.839 -28.314 27.146 722 2HB GLN 87 HB1 GLN 87 2.471 -29.561 25.964 723 1HG GLN 87 HG2 GLN 87 4.152 -28.007 25.133 724 2HG GLN 87 HG1 GLN 87 2.685 -27.945 24.157 725 1HE2 GLN 87 HE21 GLN 87 3.184 -25.887 23.387 726 2HE2 GLN 87 HE22 GLN 87 3.059 -24.475 24.376 727 H THR 88 HN THR 88 -0.393 -26.610 24.795 728 HA THR 88 HA THR 88 -1.268 -28.700 22.920 729 HB THR 88 HB THR 88 -2.875 -26.913 22.122 730 HG1 THR 88 HG1 THR 88 -2.480 -25.533 24.526 731 1HG2 THR 88 HG21 THR 88 -4.399 -27.129 24.032 732 2HG2 THR 88 HG22 THR 88 -3.058 -27.662 25.048 733 3HG2 THR 88 HG23 THR 88 -3.590 -28.662 23.695 734 H LEU 89 HN LEU 89 -0.351 -28.798 20.948 735 HA LEU 89 HA LEU 89 1.015 -26.392 19.909 736 1HB LEU 89 HB2 LEU 89 1.831 -29.260 19.395 737 2HB LEU 89 HB1 LEU 89 2.627 -27.826 18.783 738 HG LEU 89 HG LEU 89 3.070 -27.244 21.262 739 1HD1 LEU 89 HD11 LEU 89 3.213 -29.169 22.769 740 2HD1 LEU 89 HD12 LEU 89 2.455 -30.189 21.544 741 3HD1 LEU 89 HD13 LEU 89 1.551 -28.857 22.268 742 1HD2 LEU 89 HD21 LEU 89 4.811 -27.909 19.692 743 2HD2 LEU 89 HD22 LEU 89 4.444 -29.610 19.981 744 3HD2 LEU 89 HD23 LEU 89 5.099 -28.615 21.282 745 H GLY 90 HN GLY 90 0.122 -25.637 18.113 746 1HA GLY 90 HA2 GLY 90 -1.326 -27.515 16.335 747 2HA GLY 90 HA1 GLY 90 -1.730 -25.811 16.523 748 H SER 91 HN SER 91 1.577 -26.631 16.482 749 HA SER 91 HA SER 91 3.304 -26.173 15.126 750 1HB SER 91 HB2 SER 91 2.133 -27.826 13.653 751 2HB SER 91 HB1 SER 91 1.306 -26.486 12.871 752 HG SER 91 HG SER 91 4.120 -26.536 13.023 Start of MODEL 4 1 1H GLN 1 HT1 GLN 1 23.363 -20.055 -7.127 2 2H GLN 1 HT2 GLN 1 24.661 -19.004 -7.381 3 3H GLN 1 HT3 GLN 1 23.232 -18.432 -6.676 4 HA GLN 1 HA GLN 1 25.135 -20.374 -5.505 5 1HB GLN 1 HB2 GLN 1 24.371 -17.559 -4.669 6 2HB GLN 1 HB1 GLN 1 25.443 -18.625 -3.771 7 1HG GLN 1 HG2 GLN 1 27.033 -18.604 -5.625 8 2HG GLN 1 HG1 GLN 1 25.952 -17.558 -6.545 9 1HE2 GLN 1 HE21 GLN 1 28.120 -17.761 -3.832 10 2HE2 GLN 1 HE22 GLN 1 28.302 -16.060 -3.591 11 H GLY 2 HN GLY 2 22.454 -18.242 -4.500 12 1HA GLY 2 HA2 GLY 2 21.037 -20.544 -3.376 13 2HA GLY 2 HA1 GLY 2 21.523 -19.266 -2.265 14 H HIS 3 HN HIS 3 18.983 -19.547 -2.171 15 HA HIS 3 HA HIS 3 17.906 -17.310 -3.724 16 1HB HIS 3 HB2 HIS 3 17.251 -19.320 -4.972 17 2HB HIS 3 HB1 HIS 3 16.559 -20.018 -3.511 18 HD1 HIS 3 HD1 HIS 3 14.100 -19.944 -3.704 19 HD2 HIS 3 HD2 HIS 3 15.864 -16.518 -5.265 20 HE1 HIS 3 HE1 HIS 3 12.194 -18.482 -4.455 21 HE2 HIS 3 HE2 HIS 3 13.292 -16.491 -5.534 22 H MET 4 HN MET 4 17.068 -15.910 -2.355 23 HA MET 4 HA MET 4 16.756 -16.302 0.382 24 1HB MET 4 HB2 MET 4 15.410 -14.264 -1.414 25 2HB MET 4 HB1 MET 4 15.445 -14.175 0.342 26 1HG MET 4 HG2 MET 4 17.893 -14.027 0.279 27 2HG MET 4 HG1 MET 4 17.846 -14.096 -1.481 28 1HE MET 4 HE1 MET 4 16.004 -10.741 -2.361 29 2HE MET 4 HE2 MET 4 15.243 -12.309 -2.100 30 3HE MET 4 HE3 MET 4 16.753 -12.201 -3.005 31 HA PRO 5 HA PRO 5 13.090 -18.678 0.805 32 1HB PRO 5 HB2 PRO 5 12.553 -17.230 3.330 33 2HB PRO 5 HB1 PRO 5 12.895 -18.942 3.067 34 1HG PRO 5 HG2 PRO 5 14.705 -17.318 4.200 35 2HG PRO 5 HG1 PRO 5 15.193 -18.627 3.103 36 1HD PRO 5 HD2 PRO 5 14.933 -15.686 2.545 37 2HD PRO 5 HD1 PRO 5 16.206 -16.820 2.041 38 H SER 6 HN SER 6 10.923 -18.590 0.438 39 HA SER 6 HA SER 6 9.706 -16.097 -0.291 40 1HB SER 6 HB2 SER 6 9.189 -18.235 -1.458 41 2HB SER 6 HB1 SER 6 8.453 -18.852 0.020 42 HG SER 6 HG SER 6 6.756 -17.600 -0.280 43 H ASP 7 HN ASP 7 9.434 -14.745 1.413 44 HA ASP 7 HA ASP 7 8.534 -15.789 3.986 45 1HB ASP 7 HB2 ASP 7 9.238 -13.684 4.907 46 2HB ASP 7 HB1 ASP 7 10.494 -14.228 3.801 47 H SER 8 HN SER 8 7.540 -13.385 1.569 48 HA SER 8 HA SER 8 5.252 -12.535 3.063 49 1HB SER 8 HB2 SER 8 6.405 -11.059 1.446 50 2HB SER 8 HB1 SER 8 5.910 -12.121 0.130 51 HG SER 8 HG SER 8 4.166 -10.708 1.878 52 H LYS 9 HN LYS 9 5.724 -14.570 0.186 53 HA LYS 9 HA LYS 9 2.991 -15.132 -0.234 54 1HB LYS 9 HB2 LYS 9 5.344 -16.871 -1.011 55 2HB LYS 9 HB1 LYS 9 3.746 -16.868 -1.742 56 1HG LYS 9 HG2 LYS 9 5.692 -14.567 -1.818 57 2HG LYS 9 HG1 LYS 9 5.429 -15.725 -3.123 58 1HD LYS 9 HD2 LYS 9 3.302 -13.911 -1.973 59 2HD LYS 9 HD1 LYS 9 4.218 -13.573 -3.441 60 1HE LYS 9 HE2 LYS 9 3.337 -15.684 -4.416 61 2HE LYS 9 HE1 LYS 9 2.348 -15.900 -2.972 62 1HZ LYS 9 HZ1 LYS 9 1.257 -13.784 -3.479 63 2HZ LYS 9 HZ2 LYS 9 1.064 -14.903 -4.731 64 3HZ LYS 9 HZ3 LYS 9 2.177 -13.641 -4.891 65 H LYS 10 HN LYS 10 1.853 -15.892 1.455 66 HA LYS 10 HA LYS 10 2.811 -17.827 3.315 67 1HB LYS 10 HB2 LYS 10 0.002 -16.879 2.697 68 2HB LYS 10 HB1 LYS 10 0.415 -17.931 4.041 69 1HG LYS 10 HG2 LYS 10 1.491 -15.135 3.672 70 2HG LYS 10 HG1 LYS 10 0.103 -15.553 4.673 71 1HD LYS 10 HD2 LYS 10 1.682 -15.622 6.309 72 2HD LYS 10 HD1 LYS 10 1.902 -17.264 5.709 73 1HE LYS 10 HE2 LYS 10 4.058 -16.195 5.980 74 2HE LYS 10 HE1 LYS 10 3.743 -16.460 4.266 75 1HZ LYS 10 HZ1 LYS 10 3.279 -13.884 5.669 76 2HZ LYS 10 HZ2 LYS 10 3.166 -14.166 4.006 77 3HZ LYS 10 HZ3 LYS 10 4.671 -14.247 4.776 78 HA PRO 11 HA PRO 11 2.034 -21.623 1.127 79 1HB PRO 11 HB2 PRO 11 1.255 -23.231 3.218 80 2HB PRO 11 HB1 PRO 11 2.937 -22.818 2.871 81 1HG PRO 11 HG2 PRO 11 1.059 -21.590 4.859 82 2HG PRO 11 HG1 PRO 11 2.766 -22.030 5.057 83 1HD PRO 11 HD2 PRO 11 2.020 -19.487 4.620 84 2HD PRO 11 HD1 PRO 11 3.514 -20.142 3.917 85 H THR 12 HN THR 12 0.315 -22.040 -0.100 86 HA THR 12 HA THR 12 -2.364 -21.393 0.916 87 HB THR 12 HB THR 12 -1.489 -21.912 -1.944 88 HG1 THR 12 HG1 THR 12 -0.557 -20.012 -0.874 89 1HG2 THR 12 HG21 THR 12 -4.015 -20.669 -0.819 90 2HG2 THR 12 HG22 THR 12 -3.895 -22.266 -1.560 91 3HG2 THR 12 HG23 THR 12 -3.612 -20.821 -2.531 92 H ILE 13 HN ILE 13 -3.435 -23.053 1.739 93 HA ILE 13 HA ILE 13 -2.788 -25.788 0.935 94 HB ILE 13 HB ILE 13 -4.586 -24.822 3.177 95 1HG1 ILE 13 HG12 ILE 13 -2.287 -24.075 3.549 96 2HG1 ILE 13 HG11 ILE 13 -2.690 -25.369 4.672 97 1HG2 ILE 13 HG21 ILE 13 -4.330 -27.112 4.052 98 2HG2 ILE 13 HG22 ILE 13 -3.417 -27.552 2.612 99 3HG2 ILE 13 HG23 ILE 13 -5.112 -27.090 2.474 100 1HD1 ILE 13 HD11 ILE 13 -1.476 -26.955 3.278 101 2HD1 ILE 13 HD12 ILE 13 -0.448 -25.624 3.806 102 3HD1 ILE 13 HD13 ILE 13 -1.068 -25.655 2.156 103 H ILE 14 HN ILE 14 -4.240 -27.187 0.038 104 HA ILE 14 HA ILE 14 -6.655 -26.022 -1.122 105 HB ILE 14 HB ILE 14 -5.366 -28.725 -1.587 106 1HG1 ILE 14 HG12 ILE 14 -5.340 -26.218 -3.301 107 2HG1 ILE 14 HG11 ILE 14 -3.982 -26.820 -2.358 108 1HG2 ILE 14 HG21 ILE 14 -6.859 -28.883 -3.536 109 2HG2 ILE 14 HG22 ILE 14 -7.630 -27.368 -3.061 110 3HG2 ILE 14 HG23 ILE 14 -7.764 -28.790 -2.023 111 1HD1 ILE 14 HD11 ILE 14 -3.712 -27.378 -4.688 112 2HD1 ILE 14 HD12 ILE 14 -5.272 -28.200 -4.702 113 3HD1 ILE 14 HD13 ILE 14 -3.942 -28.847 -3.739 114 H TYR 15 HN TYR 15 -8.406 -26.112 0.116 115 HA TYR 15 HA TYR 15 -8.771 -28.292 2.041 116 1HB TYR 15 HB2 TYR 15 -10.263 -25.678 1.668 117 2HB TYR 15 HB1 TYR 15 -10.617 -26.861 2.919 118 HD1 TYR 15 HD1 TYR 15 -9.403 -26.864 4.964 119 HD2 TYR 15 HD2 TYR 15 -8.007 -24.510 1.699 120 HE1 TYR 15 HE1 TYR 15 -7.800 -25.747 6.458 121 HE2 TYR 15 HE2 TYR 15 -6.395 -23.398 3.190 122 HH TYR 15 HH TYR 15 -5.681 -24.517 6.313 123 HA PRO 16 HA PRO 16 -10.587 -29.107 3.208 124 1HB PRO 16 HB2 PRO 16 -11.635 -31.791 2.810 125 2HB PRO 16 HB1 PRO 16 -12.334 -30.460 3.734 126 1HG PRO 16 HG2 PRO 16 -13.429 -31.412 1.423 127 2HG PRO 16 HG1 PRO 16 -13.612 -29.734 1.969 128 1HD PRO 16 HD2 PRO 16 -11.721 -30.866 -0.074 129 2HD PRO 16 HD1 PRO 16 -12.685 -29.373 -0.138 130 H CYS 17 HN CYS 17 -9.251 -30.607 4.409 131 HA CYS 17 HA CYS 17 -7.652 -32.569 3.059 132 1HB CYS 17 HB2 CYS 17 -6.573 -30.528 2.201 133 2HB CYS 17 HB1 CYS 17 -6.352 -29.937 3.844 134 HG CYS 17 HG CYS 17 -4.496 -31.858 4.572 135 H LEU 18 HN LEU 18 -6.104 -33.580 4.504 136 HA LEU 18 HA LEU 18 -6.978 -33.676 7.236 137 1HB LEU 18 HB2 LEU 18 -4.639 -34.951 5.800 138 2HB LEU 18 HB1 LEU 18 -5.032 -35.258 7.482 139 HG LEU 18 HG LEU 18 -6.952 -35.814 5.220 140 1HD1 LEU 18 HD11 LEU 18 -4.963 -37.167 4.894 141 2HD1 LEU 18 HD12 LEU 18 -6.308 -38.168 5.436 142 3HD1 LEU 18 HD13 LEU 18 -5.034 -37.715 6.569 143 1HD2 LEU 18 HD21 LEU 18 -7.981 -35.542 7.418 144 2HD2 LEU 18 HD22 LEU 18 -6.881 -36.743 8.094 145 3HD2 LEU 18 HD23 LEU 18 -8.073 -37.220 6.883 146 H TRP 19 HN TRP 19 -6.482 -32.078 8.580 147 HA TRP 19 HA TRP 19 -3.966 -30.623 8.272 148 1HB TRP 19 HB2 TRP 19 -6.303 -29.533 8.685 149 2HB TRP 19 HB1 TRP 19 -6.052 -30.008 10.362 150 HD1 TRP 19 HD1 TRP 19 -4.206 -28.656 11.752 151 HE1 TRP 19 HE1 TRP 19 -2.951 -26.455 11.289 152 HE3 TRP 19 HE3 TRP 19 -5.302 -28.127 6.784 153 HZ2 TRP 19 HZ2 TRP 19 -2.489 -24.732 9.101 154 HZ3 TRP 19 HZ3 TRP 19 -4.411 -26.178 5.583 155 HH2 TRP 19 HH2 TRP 19 -3.033 -24.515 6.716 156 H ASP 20 HN ASP 20 -2.385 -30.578 9.853 157 HA ASP 20 HA ASP 20 -2.526 -32.813 11.758 158 1HB ASP 20 HB2 ASP 20 -0.726 -32.838 9.997 159 2HB ASP 20 HB1 ASP 20 -0.044 -31.399 10.749 160 H TYR 21 HN TYR 21 -2.353 -32.481 13.868 161 HA TYR 21 HA TYR 21 -1.718 -29.779 14.864 162 1HB TYR 21 HB2 TYR 21 -3.789 -31.703 15.980 163 2HB TYR 21 HB1 TYR 21 -3.386 -30.126 16.647 164 HD1 TYR 21 HD1 TYR 21 -4.187 -28.083 15.593 165 HD2 TYR 21 HD2 TYR 21 -5.120 -31.897 13.938 166 HE1 TYR 21 HE1 TYR 21 -5.928 -27.051 14.200 167 HE2 TYR 21 HE2 TYR 21 -6.858 -30.869 12.540 168 HH TYR 21 HH TYR 21 -7.111 -27.541 12.079 169 H ARG 22 HN ARG 22 -0.427 -29.701 16.692 170 HA ARG 22 HA ARG 22 0.581 -32.296 17.670 171 1HB ARG 22 HB2 ARG 22 2.197 -30.622 16.549 172 2HB ARG 22 HB1 ARG 22 2.009 -29.655 18.007 173 1HG ARG 22 HG2 ARG 22 3.998 -30.984 18.203 174 2HG ARG 22 HG1 ARG 22 2.794 -31.592 19.343 175 1HD ARG 22 HD2 ARG 22 3.826 -33.476 18.280 176 2HD ARG 22 HD1 ARG 22 2.180 -33.339 17.660 177 HE ARG 22 HE ARG 22 4.649 -32.649 16.208 178 1HH1 ARG 22 HH11 ARG 22 1.184 -33.240 16.139 179 2HH1 ARG 22 HH12 ARG 22 1.121 -33.340 14.408 180 1HH2 ARG 22 HH21 ARG 22 4.530 -32.791 13.928 181 2HH2 ARG 22 HH22 ARG 22 2.998 -33.105 13.169 182 H VAL 23 HN VAL 23 -0.305 -32.837 19.529 183 HA VAL 23 HA VAL 23 -1.265 -30.735 21.357 184 HB VAL 23 HB VAL 23 -2.028 -33.668 21.283 185 1HG1 VAL 23 HG11 VAL 23 -2.348 -32.672 23.470 186 2HG1 VAL 23 HG12 VAL 23 -3.912 -32.961 22.709 187 3HG1 VAL 23 HG13 VAL 23 -3.242 -31.330 22.760 188 1HG2 VAL 23 HG21 VAL 23 -2.744 -32.570 19.228 189 2HG2 VAL 23 HG22 VAL 23 -3.509 -31.282 20.161 190 3HG2 VAL 23 HG23 VAL 23 -4.136 -32.929 20.251 191 H ILE 24 HN ILE 24 0.310 -30.300 22.821 192 HA ILE 24 HA ILE 24 1.872 -32.520 23.939 193 HB ILE 24 HB ILE 24 2.243 -29.530 24.270 194 1HG1 ILE 24 HG12 ILE 24 3.770 -31.579 22.632 195 2HG1 ILE 24 HG11 ILE 24 2.733 -30.309 21.994 196 1HG2 ILE 24 HG21 ILE 24 3.041 -30.754 26.231 197 2HG2 ILE 24 HG22 ILE 24 4.396 -30.105 25.309 198 3HG2 ILE 24 HG23 ILE 24 3.993 -31.819 25.195 199 1HD1 ILE 24 HD11 ILE 24 5.317 -29.912 23.483 200 2HD1 ILE 24 HD12 ILE 24 4.270 -28.625 22.886 201 3HD1 ILE 24 HD13 ILE 24 5.059 -29.717 21.750 202 H MET 25 HN MET 25 0.942 -33.499 25.571 203 HA MET 25 HA MET 25 -0.529 -31.926 27.601 204 1HB MET 25 HB2 MET 25 -0.946 -34.811 26.742 205 2HB MET 25 HB1 MET 25 -1.847 -33.986 28.010 206 1HG MET 25 HG2 MET 25 -2.922 -32.569 26.468 207 2HG MET 25 HG1 MET 25 -1.806 -32.991 25.174 208 1HE MET 25 HE1 MET 25 -3.607 -35.384 27.743 209 2HE MET 25 HE2 MET 25 -5.018 -35.885 26.815 210 3HE MET 25 HE3 MET 25 -4.870 -34.214 27.360 211 H THR 26 HN THR 26 -0.098 -32.370 29.782 212 HA THR 26 HA THR 26 2.426 -33.682 30.301 213 HB THR 26 HB THR 26 1.894 -33.040 32.724 214 HG1 THR 26 HG1 THR 26 -0.374 -32.771 32.445 215 1HG2 THR 26 HG21 THR 26 2.054 -30.855 30.637 216 2HG2 THR 26 HG22 THR 26 3.417 -31.723 31.343 217 3HG2 THR 26 HG23 THR 26 2.431 -30.663 32.349 218 H THR 27 HN THR 27 -0.697 -34.716 29.983 219 HA THR 27 HA THR 27 -0.247 -37.065 31.705 220 HB THR 27 HB THR 27 -2.349 -35.718 32.186 221 HG1 THR 27 HG1 THR 27 -3.167 -37.567 32.800 222 1HG2 THR 27 HG21 THR 27 -3.220 -36.802 29.498 223 2HG2 THR 27 HG22 THR 27 -2.898 -35.107 29.862 224 3HG2 THR 27 HG23 THR 27 -4.236 -35.938 30.653 225 H LYS 28 HN LYS 28 -0.805 -39.126 30.777 226 HA LYS 28 HA LYS 28 -0.474 -39.191 27.861 227 1HB LYS 28 HB2 LYS 28 1.026 -40.563 29.386 228 2HB LYS 28 HB1 LYS 28 -0.391 -41.522 29.795 229 1HG LYS 28 HG2 LYS 28 -0.632 -41.994 27.320 230 2HG LYS 28 HG1 LYS 28 0.960 -41.266 27.114 231 1HD LYS 28 HD2 LYS 28 1.119 -43.702 27.267 232 2HD LYS 28 HD1 LYS 28 1.925 -42.931 28.635 233 1HE LYS 28 HE2 LYS 28 0.547 -44.911 29.263 234 2HE LYS 28 HE1 LYS 28 0.071 -43.427 30.087 235 1HZ LYS 28 HZ1 LYS 28 -1.758 -43.179 28.560 236 2HZ LYS 28 HZ2 LYS 28 -1.831 -44.709 29.271 237 3HZ LYS 28 HZ3 LYS 28 -1.274 -44.542 27.684 238 H ASP 29 HN ASP 29 -2.916 -38.967 29.972 239 HA ASP 29 HA ASP 29 -4.683 -41.017 28.990 240 1HB ASP 29 HB2 ASP 29 -5.008 -40.288 31.272 241 2HB ASP 29 HB1 ASP 29 -5.166 -38.608 30.765 242 H THR 30 HN THR 30 -4.538 -40.568 26.742 243 HA THR 30 HA THR 30 -5.802 -38.117 25.840 244 HB THR 30 HB THR 30 -3.925 -38.830 24.517 245 HG1 THR 30 HG1 THR 30 -4.887 -38.633 22.567 246 1HG2 THR 30 HG21 THR 30 -5.393 -41.433 24.037 247 2HG2 THR 30 HG22 THR 30 -3.943 -41.228 25.019 248 3HG2 THR 30 HG23 THR 30 -3.876 -40.947 23.279 249 H SER 31 HN SER 31 -7.900 -38.151 26.322 250 HA SER 31 HA SER 31 -9.575 -40.275 25.179 251 1HB SER 31 HB2 SER 31 -10.983 -40.148 27.287 252 2HB SER 31 HB1 SER 31 -9.390 -40.872 27.511 253 HG SER 31 HG SER 31 -8.983 -39.361 28.906 254 H THR 32 HN THR 32 -9.936 -37.314 27.105 255 HA THR 32 HA THR 32 -12.189 -36.255 25.938 256 HB THR 32 HB THR 32 -9.941 -34.414 26.715 257 HG1 THR 32 HG1 THR 32 -11.393 -35.395 28.843 258 1HG2 THR 32 HG21 THR 32 -12.139 -33.466 26.142 259 2HG2 THR 32 HG22 THR 32 -11.760 -33.205 27.845 260 3HG2 THR 32 HG23 THR 32 -12.898 -34.469 27.379 261 H LEU 33 HN LEU 33 -8.891 -36.236 24.812 262 HA LEU 33 HA LEU 33 -9.055 -34.296 22.790 263 1HB LEU 33 HB2 LEU 33 -6.948 -35.196 23.690 264 2HB LEU 33 HB1 LEU 33 -7.306 -36.758 22.980 265 HG LEU 33 HG LEU 33 -7.121 -35.787 20.725 266 1HD1 LEU 33 HD11 LEU 33 -6.365 -33.238 22.160 267 2HD1 LEU 33 HD12 LEU 33 -7.833 -33.506 21.219 268 3HD1 LEU 33 HD13 LEU 33 -6.262 -33.513 20.420 269 1HD2 LEU 33 HD21 LEU 33 -5.149 -36.777 21.744 270 2HD2 LEU 33 HD22 LEU 33 -4.747 -35.243 22.516 271 3HD2 LEU 33 HD23 LEU 33 -4.691 -35.388 20.759 272 H LYS 34 HN LYS 34 -9.714 -37.772 22.802 273 HA LYS 34 HA LYS 34 -10.190 -38.007 20.002 274 1HB LYS 34 HB2 LYS 34 -11.245 -39.751 22.250 275 2HB LYS 34 HB1 LYS 34 -11.179 -40.180 20.546 276 1HG LYS 34 HG2 LYS 34 -8.742 -40.155 20.614 277 2HG LYS 34 HG1 LYS 34 -8.785 -39.669 22.312 278 1HD LYS 34 HD2 LYS 34 -10.013 -41.768 22.836 279 2HD LYS 34 HD1 LYS 34 -9.838 -42.254 21.149 280 1HE LYS 34 HE2 LYS 34 -7.518 -41.658 22.984 281 2HE LYS 34 HE1 LYS 34 -8.171 -43.272 22.712 282 1HZ LYS 34 HZ1 LYS 34 -7.001 -41.506 20.637 283 2HZ LYS 34 HZ2 LYS 34 -7.645 -43.041 20.362 284 3HZ LYS 34 HZ3 LYS 34 -6.260 -42.864 21.317 285 H GLU 35 HN GLU 35 -12.197 -37.443 22.832 286 HA GLU 35 HA GLU 35 -14.733 -37.807 21.826 287 1HB GLU 35 HB2 GLU 35 -13.877 -35.653 23.782 288 2HB GLU 35 HB1 GLU 35 -15.505 -36.290 23.593 289 1HG GLU 35 HG2 GLU 35 -13.129 -37.918 24.481 290 2HG GLU 35 HG1 GLU 35 -14.285 -37.162 25.572 291 H LEU 36 HN LEU 36 -12.845 -34.774 21.822 292 HA LEU 36 HA LEU 36 -14.865 -33.213 20.624 293 1HB LEU 36 HB2 LEU 36 -13.241 -31.488 20.413 294 2HB LEU 36 HB1 LEU 36 -12.919 -32.328 21.915 295 HG LEU 36 HG LEU 36 -11.190 -33.650 20.340 296 1HD1 LEU 36 HD11 LEU 36 -10.087 -32.080 18.804 297 2HD1 LEU 36 HD12 LEU 36 -11.388 -30.920 19.073 298 3HD1 LEU 36 HD13 LEU 36 -11.732 -32.469 18.303 299 1HD2 LEU 36 HD21 LEU 36 -10.622 -32.510 22.416 300 2HD2 LEU 36 HD22 LEU 36 -10.661 -30.953 21.589 301 3HD2 LEU 36 HD23 LEU 36 -9.437 -32.149 21.160 302 H LEU 37 HN LEU 37 -12.348 -35.238 19.287 303 HA LEU 37 HA LEU 37 -12.514 -34.269 16.614 304 1HB LEU 37 HB2 LEU 37 -11.572 -36.953 17.648 305 2HB LEU 37 HB1 LEU 37 -11.284 -36.329 16.033 306 HG LEU 37 HG LEU 37 -10.239 -35.041 18.564 307 1HD1 LEU 37 HD11 LEU 37 -9.213 -37.228 18.243 308 2HD1 LEU 37 HD12 LEU 37 -8.056 -35.937 17.922 309 3HD1 LEU 37 HD13 LEU 37 -8.801 -36.806 16.580 310 1HD2 LEU 37 HD21 LEU 37 -10.538 -33.476 16.716 311 2HD2 LEU 37 HD22 LEU 37 -9.606 -34.531 15.652 312 3HD2 LEU 37 HD23 LEU 37 -8.826 -33.755 17.032 313 H GLU 38 HN GLU 38 -14.077 -36.858 18.408 314 HA GLU 38 HA GLU 38 -15.302 -38.099 16.168 315 1HB GLU 38 HB2 GLU 38 -15.969 -38.274 19.111 316 2HB GLU 38 HB1 GLU 38 -16.635 -39.325 17.866 317 1HG GLU 38 HG2 GLU 38 -14.282 -40.011 17.321 318 2HG GLU 38 HG1 GLU 38 -13.763 -39.115 18.746 319 H THR 39 HN THR 39 -16.143 -35.294 17.989 320 HA THR 39 HA THR 39 -18.943 -35.332 17.664 321 HB THR 39 HB THR 39 -18.917 -32.920 18.046 322 HG1 THR 39 HG1 THR 39 -16.159 -33.198 17.453 323 1HG2 THR 39 HG21 THR 39 -16.868 -34.347 19.753 324 2HG2 THR 39 HG22 THR 39 -18.615 -34.380 19.988 325 3HG2 THR 39 HG23 THR 39 -17.728 -32.871 20.192 326 H TYR 40 HN TYR 40 -16.373 -34.657 15.444 327 HA TYR 40 HA TYR 40 -18.038 -33.311 13.499 328 1HB TYR 40 HB2 TYR 40 -15.223 -34.417 13.249 329 2HB TYR 40 HB1 TYR 40 -16.024 -33.392 12.064 330 HD1 TYR 40 HD1 TYR 40 -15.889 -31.035 12.249 331 HD2 TYR 40 HD2 TYR 40 -14.826 -33.457 15.577 332 HE1 TYR 40 HE1 TYR 40 -15.053 -29.043 13.422 333 HE2 TYR 40 HE2 TYR 40 -13.985 -31.474 16.766 334 HH TYR 40 HH TYR 40 -14.462 -28.240 15.482 335 H GLN 41 HN GLN 41 -17.738 -36.459 14.472 336 HA GLN 41 HA GLN 41 -18.432 -38.467 13.670 337 1HB GLN 41 HB2 GLN 41 -19.910 -36.690 11.711 338 2HB GLN 41 HB1 GLN 41 -20.196 -38.415 11.890 339 1HG GLN 41 HG2 GLN 41 -20.557 -36.379 14.083 340 2HG GLN 41 HG1 GLN 41 -21.853 -37.001 13.064 341 1HE2 GLN 41 HE21 GLN 41 -19.644 -37.713 15.648 342 2HE2 GLN 41 HE22 GLN 41 -20.395 -39.184 16.160 343 H ARG 42 HN ARG 42 -15.935 -37.370 12.661 344 HA ARG 42 HA ARG 42 -15.779 -38.791 10.085 345 1HB ARG 42 HB2 ARG 42 -14.207 -37.127 9.256 346 2HB ARG 42 HB1 ARG 42 -15.715 -36.348 9.718 347 1HG ARG 42 HG2 ARG 42 -14.682 -35.635 11.834 348 2HG ARG 42 HG1 ARG 42 -13.165 -36.383 11.330 349 1HD ARG 42 HD2 ARG 42 -13.092 -33.999 10.902 350 2HD ARG 42 HD1 ARG 42 -13.096 -34.879 9.376 351 HE ARG 42 HE ARG 42 -15.337 -33.337 10.510 352 1HH1 ARG 42 HH11 ARG 42 -13.965 -35.119 7.805 353 2HH1 ARG 42 HH12 ARG 42 -15.074 -34.447 6.651 354 1HH2 ARG 42 HH21 ARG 42 -16.806 -32.488 8.965 355 2HH2 ARG 42 HH22 ARG 42 -16.677 -32.978 7.300 356 HA PRO 43 HA PRO 43 -12.370 -40.996 11.863 357 1HB PRO 43 HB2 PRO 43 -10.778 -41.433 9.697 358 2HB PRO 43 HB1 PRO 43 -12.310 -42.279 9.947 359 1HG PRO 43 HG2 PRO 43 -11.728 -39.892 8.225 360 2HG PRO 43 HG1 PRO 43 -12.697 -41.332 7.851 361 1HD PRO 43 HD2 PRO 43 -13.823 -38.983 8.594 362 2HD PRO 43 HD1 PRO 43 -14.537 -40.553 9.018 363 H PHE 44 HN PHE 44 -10.164 -40.821 12.467 364 HA PHE 44 HA PHE 44 -8.644 -38.489 11.657 365 1HB PHE 44 HB2 PHE 44 -8.377 -37.644 13.966 366 2HB PHE 44 HB1 PHE 44 -10.050 -37.549 13.429 367 HD1 PHE 44 HD1 PHE 44 -7.710 -39.205 15.710 368 HD2 PHE 44 HD2 PHE 44 -11.765 -38.950 14.426 369 HE1 PHE 44 HE1 PHE 44 -8.417 -40.448 17.707 370 HE2 PHE 44 HE2 PHE 44 -12.477 -40.192 16.426 371 HZ PHE 44 HZ PHE 44 -10.804 -40.944 18.071 372 H LYS 45 HN LYS 45 -6.448 -38.598 12.317 373 HA LYS 45 HA LYS 45 -5.580 -41.285 13.158 374 1HB LYS 45 HB2 LYS 45 -4.778 -40.519 10.929 375 2HB LYS 45 HB1 LYS 45 -4.013 -39.135 11.697 376 1HG LYS 45 HG2 LYS 45 -2.618 -40.737 13.026 377 2HG LYS 45 HG1 LYS 45 -3.301 -42.045 12.060 378 1HD LYS 45 HD2 LYS 45 -1.148 -41.422 11.151 379 2HD LYS 45 HD1 LYS 45 -2.412 -40.946 10.016 380 1HE LYS 45 HE2 LYS 45 -2.286 -38.643 10.832 381 2HE LYS 45 HE1 LYS 45 -1.047 -39.112 11.994 382 1HZ LYS 45 HZ1 LYS 45 -0.110 -38.076 10.015 383 2HZ LYS 45 HZ2 LYS 45 -0.776 -39.287 9.040 384 3HZ LYS 45 HZ3 LYS 45 0.419 -39.674 10.171 385 H LEU 46 HN LEU 46 -5.286 -41.271 15.313 386 HA LEU 46 HA LEU 46 -3.866 -38.979 16.513 387 1HB LEU 46 HB2 LEU 46 -6.237 -39.828 17.327 388 2HB LEU 46 HB1 LEU 46 -5.296 -41.054 18.154 389 HG LEU 46 HG LEU 46 -4.992 -38.063 18.547 390 1HD1 LEU 46 HD11 LEU 46 -6.022 -38.439 20.731 391 2HD1 LEU 46 HD12 LEU 46 -6.284 -40.135 20.319 392 3HD1 LEU 46 HD13 LEU 46 -7.117 -38.868 19.416 393 1HD2 LEU 46 HD21 LEU 46 -2.896 -39.249 18.950 394 2HD2 LEU 46 HD22 LEU 46 -3.722 -40.363 20.041 395 3HD2 LEU 46 HD23 LEU 46 -3.585 -38.656 20.462 396 H GLU 47 HN GLU 47 -1.779 -39.398 16.537 397 HA GLU 47 HA GLU 47 -0.841 -42.104 17.269 398 1HB GLU 47 HB2 GLU 47 0.426 -40.100 15.379 399 2HB GLU 47 HB1 GLU 47 1.169 -41.614 15.874 400 1HG GLU 47 HG2 GLU 47 -1.423 -41.370 14.350 401 2HG GLU 47 HG1 GLU 47 0.149 -41.720 13.635 402 H PHE 48 HN PHE 48 1.127 -42.193 18.498 403 HA PHE 48 HA PHE 48 1.524 -39.826 20.186 404 1HB PHE 48 HB2 PHE 48 1.073 -41.926 21.350 405 2HB PHE 48 HB1 PHE 48 2.415 -42.706 20.527 406 HD1 PHE 48 HD1 PHE 48 4.544 -42.709 21.505 407 HD2 PHE 48 HD2 PHE 48 1.618 -39.924 22.865 408 HE1 PHE 48 HE1 PHE 48 6.033 -42.046 23.348 409 HE2 PHE 48 HE2 PHE 48 3.105 -39.262 24.707 410 HZ PHE 48 HZ PHE 48 5.310 -40.324 24.950 411 H LYS 49 HN LYS 49 3.155 -38.503 19.722 412 HA LYS 49 HA LYS 49 5.139 -39.208 17.760 413 1HB LYS 49 HB2 LYS 49 4.593 -36.715 19.367 414 2HB LYS 49 HB1 LYS 49 6.024 -36.855 18.357 415 1HG LYS 49 HG2 LYS 49 3.205 -37.172 17.335 416 2HG LYS 49 HG1 LYS 49 4.110 -35.657 17.301 417 1HD LYS 49 HD2 LYS 49 5.859 -36.776 15.937 418 2HD LYS 49 HD1 LYS 49 4.871 -38.238 15.915 419 1HE LYS 49 HE2 LYS 49 3.084 -37.019 14.771 420 2HE LYS 49 HE1 LYS 49 4.048 -35.545 14.819 421 1HZ LYS 49 HZ1 LYS 49 4.167 -36.653 12.668 422 2HZ LYS 49 HZ2 LYS 49 4.806 -38.039 13.399 423 3HZ LYS 49 HZ3 LYS 49 5.687 -36.596 13.408 424 H ASN 50 HN ASN 50 5.746 -37.609 20.872 425 HA ASN 50 HA ASN 50 7.825 -39.540 21.543 426 1HB ASN 50 HB2 ASN 50 8.409 -36.600 21.049 427 2HB ASN 50 HB1 ASN 50 9.522 -37.713 21.833 428 1HD2 ASN 50 HD21 ASN 50 10.556 -39.289 20.597 429 2HD2 ASN 50 HD22 ASN 50 10.623 -39.199 18.873 430 H THR 51 HN THR 51 8.974 -38.657 23.631 431 HA THR 51 HA THR 51 7.152 -37.114 25.323 432 HB THR 51 HB THR 51 6.572 -39.446 25.796 433 HG1 THR 51 HG1 THR 51 6.360 -38.558 27.701 434 1HG2 THR 51 HG21 THR 51 9.477 -39.812 26.544 435 2HG2 THR 51 HG22 THR 51 8.687 -40.507 25.129 436 3HG2 THR 51 HG23 THR 51 8.195 -41.005 26.748 437 H SER 52 HN SER 52 8.181 -36.002 26.978 438 HA SER 52 HA SER 52 10.880 -35.285 26.443 439 1HB SER 52 HB2 SER 52 9.247 -33.651 27.251 440 2HB SER 52 HB1 SER 52 9.077 -34.543 28.762 441 HG SER 52 HG SER 52 10.666 -32.614 28.459 442 H LYS 53 HN LYS 53 12.400 -35.031 28.445 443 HA LYS 53 HA LYS 53 13.500 -37.516 28.954 444 1HB LYS 53 HB2 LYS 53 14.747 -35.410 29.129 445 2HB LYS 53 HB1 LYS 53 13.829 -34.968 30.560 446 1HG LYS 53 HG2 LYS 53 15.929 -35.748 31.317 447 2HG LYS 53 HG1 LYS 53 14.762 -37.019 31.678 448 1HD LYS 53 HD2 LYS 53 16.546 -38.218 30.800 449 2HD LYS 53 HD1 LYS 53 15.506 -38.016 29.391 450 1HE LYS 53 HE2 LYS 53 17.923 -36.328 30.073 451 2HE LYS 53 HE1 LYS 53 17.863 -37.596 28.852 452 1HZ LYS 53 HZ1 LYS 53 16.364 -35.030 28.818 453 2HZ LYS 53 HZ2 LYS 53 16.157 -36.272 27.688 454 3HZ LYS 53 HZ3 LYS 53 17.643 -35.477 27.804 455 H ASN 54 HN ASN 54 11.624 -35.512 31.233 456 HA ASN 54 HA ASN 54 11.535 -37.722 33.150 457 1HB ASN 54 HB2 ASN 54 12.050 -35.347 33.854 458 2HB ASN 54 HB1 ASN 54 10.399 -34.918 33.423 459 1HD2 ASN 54 HD21 ASN 54 8.714 -35.548 34.769 460 2HD2 ASN 54 HD22 ASN 54 8.975 -36.210 36.342 461 H ALA 55 HN ALA 55 10.000 -37.350 30.478 462 HA ALA 55 HA ALA 55 7.988 -37.906 29.586 463 1HB ALA 55 HB1 ALA 55 7.467 -39.154 32.291 464 2HB ALA 55 HB2 ALA 55 8.283 -39.937 30.937 465 3HB ALA 55 HB3 ALA 55 6.582 -39.487 30.802 466 H LYS 56 HN LYS 56 8.367 -35.425 31.360 467 HA LYS 56 HA LYS 56 5.898 -34.835 32.601 468 1HB LYS 56 HB2 LYS 56 8.024 -33.638 33.081 469 2HB LYS 56 HB1 LYS 56 7.957 -32.908 31.483 470 1HG LYS 56 HG2 LYS 56 5.820 -31.818 32.113 471 2HG LYS 56 HG1 LYS 56 5.991 -32.488 33.735 472 1HD LYS 56 HD2 LYS 56 7.919 -30.584 32.393 473 2HD LYS 56 HD1 LYS 56 6.745 -30.157 33.637 474 1HE LYS 56 HE2 LYS 56 9.041 -32.094 33.985 475 2HE LYS 56 HE1 LYS 56 9.017 -30.424 34.549 476 1HZ LYS 56 HZ1 LYS 56 7.093 -31.006 35.941 477 2HZ LYS 56 HZ2 LYS 56 8.477 -31.882 36.348 478 3HZ LYS 56 HZ3 LYS 56 7.243 -32.621 35.463 479 H PHE 57 HN PHE 57 7.099 -34.432 29.338 480 HA PHE 57 HA PHE 57 4.479 -33.340 28.540 481 1HB PHE 57 HB2 PHE 57 7.172 -32.852 27.236 482 2HB PHE 57 HB1 PHE 57 5.629 -32.232 26.660 483 HD1 PHE 57 HD1 PHE 57 8.448 -31.584 28.718 484 HD2 PHE 57 HD2 PHE 57 4.295 -30.729 28.291 485 HE1 PHE 57 HE1 PHE 57 8.711 -29.596 30.140 486 HE2 PHE 57 HE2 PHE 57 4.558 -28.738 29.712 487 HZ PHE 57 HZ PHE 57 6.767 -28.170 30.636 488 H TYR 58 HN TYR 58 3.353 -34.951 27.690 489 HA TYR 58 HA TYR 58 4.612 -36.885 25.895 490 1HB TYR 58 HB2 TYR 58 1.760 -36.649 26.908 491 2HB TYR 58 HB1 TYR 58 2.326 -37.909 25.820 492 HD1 TYR 58 HD1 TYR 58 4.153 -39.487 26.660 493 HD2 TYR 58 HD2 TYR 58 1.964 -36.902 29.244 494 HE1 TYR 58 HE1 TYR 58 4.784 -40.883 28.584 495 HE2 TYR 58 HE2 TYR 58 2.596 -38.288 31.174 496 HH TYR 58 HH TYR 58 5.003 -40.709 31.006 497 H SER 59 HN SER 59 4.745 -36.440 23.792 498 HA SER 59 HA SER 59 3.156 -34.257 22.679 499 1HB SER 59 HB2 SER 59 5.456 -35.818 21.462 500 2HB SER 59 HB1 SER 59 4.720 -34.361 20.793 501 HG SER 59 HG SER 59 5.688 -34.275 23.417 502 H PHE 60 HN PHE 60 1.248 -34.784 21.852 503 HA PHE 60 HA PHE 60 0.891 -37.397 20.552 504 1HB PHE 60 HB2 PHE 60 -1.140 -35.438 21.667 505 2HB PHE 60 HB1 PHE 60 -1.562 -36.912 20.803 506 HD1 PHE 60 HD1 PHE 60 -0.803 -35.492 23.988 507 HD2 PHE 60 HD2 PHE 60 -0.706 -39.127 21.763 508 HE1 PHE 60 HE1 PHE 60 -0.701 -36.774 26.085 509 HE2 PHE 60 HE2 PHE 60 -0.601 -40.411 23.855 510 HZ PHE 60 HZ PHE 60 -0.602 -39.235 26.022 511 H ASN 61 HN ASN 61 -0.312 -37.493 18.585 512 HA ASN 61 HA ASN 61 -0.095 -35.063 16.917 513 1HB ASN 61 HB2 ASN 61 1.614 -36.772 16.333 514 2HB ASN 61 HB1 ASN 61 0.329 -37.946 16.062 515 1HD2 ASN 61 HD21 ASN 61 -1.104 -37.614 14.276 516 2HD2 ASN 61 HD22 ASN 61 -0.623 -36.642 12.928 517 H VAL 62 HN VAL 62 -2.011 -34.405 16.177 518 HA VAL 62 HA VAL 62 -4.136 -36.419 15.771 519 HB VAL 62 HB VAL 62 -4.454 -33.512 16.578 520 1HG1 VAL 62 HG11 VAL 62 -6.867 -34.003 16.681 521 2HG1 VAL 62 HG12 VAL 62 -6.562 -35.610 16.021 522 3HG1 VAL 62 HG13 VAL 62 -6.230 -34.178 15.045 523 1HG2 VAL 62 HG21 VAL 62 -5.058 -36.059 18.094 524 2HG2 VAL 62 HG22 VAL 62 -5.420 -34.424 18.648 525 3HG2 VAL 62 HG23 VAL 62 -3.746 -34.930 18.433 526 H SER 63 HN SER 63 -4.535 -36.717 13.690 527 HA SER 63 HA SER 63 -4.348 -34.411 11.855 528 1HB SER 63 HB2 SER 63 -3.959 -37.321 11.093 529 2HB SER 63 HB1 SER 63 -3.616 -35.895 10.111 530 HG SER 63 HG SER 63 -2.012 -35.345 11.727 531 H MET 64 HN MET 64 -6.357 -33.779 11.303 532 HA MET 64 HA MET 64 -8.380 -35.842 10.757 533 1HB MET 64 HB2 MET 64 -10.094 -34.657 11.990 534 2HB MET 64 HB1 MET 64 -8.750 -35.016 13.064 535 1HG MET 64 HG2 MET 64 -7.967 -32.727 12.905 536 2HG MET 64 HG1 MET 64 -9.241 -32.350 11.745 537 1HE MET 64 HE1 MET 64 -12.455 -32.817 13.989 538 2HE MET 64 HE2 MET 64 -11.663 -34.039 12.994 539 3HE MET 64 HE3 MET 64 -11.866 -32.397 12.381 540 H GLU 65 HN GLU 65 -10.249 -34.995 9.568 541 HA GLU 65 HA GLU 65 -9.351 -33.438 7.335 542 1HB GLU 65 HB2 GLU 65 -12.174 -34.360 7.902 543 2HB GLU 65 HB1 GLU 65 -11.460 -33.989 6.339 544 1HG GLU 65 HG2 GLU 65 -10.044 -35.941 6.476 545 2HG GLU 65 HG1 GLU 65 -10.625 -36.285 8.106 546 H VAL 66 HN VAL 66 -9.420 -31.279 7.214 547 HA VAL 66 HA VAL 66 -11.479 -29.826 8.747 548 HB VAL 66 HB VAL 66 -10.091 -27.797 8.417 549 1HG1 VAL 66 HG11 VAL 66 -9.864 -29.095 10.467 550 2HG1 VAL 66 HG12 VAL 66 -8.312 -28.401 10.000 551 3HG1 VAL 66 HG13 VAL 66 -8.635 -30.110 9.711 552 1HG2 VAL 66 HG21 VAL 66 -8.937 -28.433 6.357 553 2HG2 VAL 66 HG22 VAL 66 -8.062 -29.699 7.219 554 3HG2 VAL 66 HG23 VAL 66 -7.776 -28.003 7.613 555 H SER 67 HN SER 67 -12.964 -28.608 7.709 556 HA SER 67 HA SER 67 -13.414 -29.123 4.936 557 1HB SER 67 HB2 SER 67 -15.263 -28.921 6.557 558 2HB SER 67 HB1 SER 67 -14.843 -27.231 6.830 559 HG SER 67 HG SER 67 -16.545 -27.429 5.342 560 H ASN 68 HN ASN 68 -12.760 -26.165 6.790 561 HA ASN 68 HA ASN 68 -11.197 -25.080 4.609 562 1HB ASN 68 HB2 ASN 68 -12.435 -22.956 4.505 563 2HB ASN 68 HB1 ASN 68 -13.463 -24.303 4.032 564 1HD2 ASN 68 HD21 ASN 68 -15.163 -24.906 5.355 565 2HD2 ASN 68 HD22 ASN 68 -15.737 -23.913 6.644 566 H GLU 69 HN GLU 69 -11.130 -22.405 5.739 567 HA GLU 69 HA GLU 69 -9.068 -22.963 7.630 568 1HB GLU 69 HB2 GLU 69 -8.894 -21.126 6.008 569 2HB GLU 69 HB1 GLU 69 -10.236 -20.302 6.790 570 1HG GLU 69 HG2 GLU 69 -8.968 -19.880 8.744 571 2HG GLU 69 HG1 GLU 69 -7.701 -21.001 8.251 572 H SER 70 HN SER 70 -12.427 -22.273 7.940 573 HA SER 70 HA SER 70 -12.456 -21.095 10.496 574 1HB SER 70 HB2 SER 70 -14.565 -22.894 9.258 575 2HB SER 70 HB1 SER 70 -14.810 -21.740 10.574 576 HG SER 70 HG SER 70 -14.809 -21.316 7.901 577 H GLU 71 HN GLU 71 -12.512 -24.481 9.458 578 HA GLU 71 HA GLU 71 -12.929 -25.622 12.000 579 1HB GLU 71 HB2 GLU 71 -11.734 -26.724 9.456 580 2HB GLU 71 HB1 GLU 71 -11.891 -27.702 10.907 581 1HG GLU 71 HG2 GLU 71 -13.726 -28.133 9.397 582 2HG GLU 71 HG1 GLU 71 -14.317 -27.372 10.871 583 H ARG 72 HN ARG 72 -9.917 -24.992 10.190 584 HA ARG 72 HA ARG 72 -8.213 -26.325 11.978 585 1HB ARG 72 HB2 ARG 72 -6.361 -25.149 10.893 586 2HB ARG 72 HB1 ARG 72 -7.508 -25.757 9.712 587 1HG ARG 72 HG2 ARG 72 -7.184 -23.696 8.833 588 2HG ARG 72 HG1 ARG 72 -8.488 -23.300 9.947 589 1HD ARG 72 HD2 ARG 72 -6.851 -21.614 10.228 590 2HD ARG 72 HD1 ARG 72 -6.695 -22.673 11.628 591 HE ARG 72 HE ARG 72 -4.633 -23.424 10.830 592 1HH1 ARG 72 HH11 ARG 72 -6.111 -21.169 8.578 593 2HH1 ARG 72 HH12 ARG 72 -4.670 -20.961 7.644 594 1HH2 ARG 72 HH21 ARG 72 -2.732 -23.127 9.620 595 2HH2 ARG 72 HH22 ARG 72 -2.743 -22.069 8.239 596 H ASN 73 HN ASN 73 -9.847 -23.359 12.368 597 HA ASN 73 HA ASN 73 -8.026 -22.462 14.474 598 1HB ASN 73 HB2 ASN 73 -10.464 -21.199 13.214 599 2HB ASN 73 HB1 ASN 73 -9.733 -20.553 14.680 600 1HD2 ASN 73 HD21 ASN 73 -9.451 -20.886 11.260 601 2HD2 ASN 73 HD22 ASN 73 -8.055 -19.882 11.069 602 H GLU 74 HN GLU 74 -11.395 -23.587 14.090 603 HA GLU 74 HA GLU 74 -12.081 -23.242 16.814 604 1HB GLU 74 HB2 GLU 74 -14.078 -24.450 16.364 605 2HB GLU 74 HB1 GLU 74 -13.719 -23.535 14.910 606 1HG GLU 74 HG2 GLU 74 -12.985 -25.480 13.765 607 2HG GLU 74 HG1 GLU 74 -13.008 -26.437 15.245 608 H ILE 75 HN ILE 75 -10.855 -26.011 14.999 609 HA ILE 75 HA ILE 75 -11.044 -27.920 17.059 610 HB ILE 75 HB ILE 75 -9.126 -27.835 14.715 611 1HG1 ILE 75 HG12 ILE 75 -11.782 -29.277 14.936 612 2HG1 ILE 75 HG11 ILE 75 -11.610 -27.684 14.211 613 1HG2 ILE 75 HG21 ILE 75 -8.397 -29.436 16.410 614 2HG2 ILE 75 HG22 ILE 75 -9.000 -30.278 14.983 615 3HG2 ILE 75 HG23 ILE 75 -10.003 -30.169 16.430 616 1HD1 ILE 75 HD11 ILE 75 -11.697 -29.419 12.532 617 2HD1 ILE 75 HD12 ILE 75 -10.290 -30.207 13.248 618 3HD1 ILE 75 HD13 ILE 75 -10.132 -28.608 12.520 619 H PHE 76 HN PHE 76 -8.543 -25.630 16.150 620 HA PHE 76 HA PHE 76 -6.483 -26.442 17.851 621 1HB PHE 76 HB2 PHE 76 -6.152 -24.758 16.119 622 2HB PHE 76 HB1 PHE 76 -7.271 -23.664 16.921 623 HD1 PHE 76 HD1 PHE 76 -6.489 -22.124 18.499 624 HD2 PHE 76 HD2 PHE 76 -4.010 -25.398 17.363 625 HE1 PHE 76 HE1 PHE 76 -4.612 -21.133 19.741 626 HE2 PHE 76 HE2 PHE 76 -2.134 -24.407 18.603 627 HZ PHE 76 HZ PHE 76 -2.431 -22.274 19.794 628 H GLN 77 HN GLN 77 -9.354 -24.497 18.430 629 HA GLN 77 HA GLN 77 -8.666 -23.808 21.131 630 1HB GLN 77 HB2 GLN 77 -11.328 -23.708 19.697 631 2HB GLN 77 HB1 GLN 77 -11.003 -23.002 21.274 632 1HG GLN 77 HG2 GLN 77 -9.314 -21.526 20.224 633 2HG GLN 77 HG1 GLN 77 -9.761 -22.187 18.651 634 1HE2 GLN 77 HE21 GLN 77 -10.767 -20.192 21.318 635 2HE2 GLN 77 HE22 GLN 77 -12.103 -19.442 20.512 636 H LYS 78 HN LYS 78 -10.660 -26.269 19.569 637 HA LYS 78 HA LYS 78 -11.977 -27.330 21.781 638 1HB LYS 78 HB2 LYS 78 -10.900 -28.875 19.405 639 2HB LYS 78 HB1 LYS 78 -12.165 -29.415 20.498 640 1HG LYS 78 HG2 LYS 78 -12.345 -27.035 18.658 641 2HG LYS 78 HG1 LYS 78 -13.046 -28.623 18.353 642 1HD LYS 78 HD2 LYS 78 -14.460 -28.377 20.345 643 2HD LYS 78 HD1 LYS 78 -13.755 -26.787 20.651 644 1HE LYS 78 HE2 LYS 78 -15.929 -26.595 19.546 645 2HE LYS 78 HE1 LYS 78 -14.637 -25.978 18.517 646 1HZ LYS 78 HZ1 LYS 78 -16.120 -27.302 17.213 647 2HZ LYS 78 HZ2 LYS 78 -15.993 -28.610 18.277 648 3HZ LYS 78 HZ3 LYS 78 -14.657 -28.139 17.351 649 H ILE 79 HN ILE 79 -8.768 -27.981 20.510 650 HA ILE 79 HA ILE 79 -8.086 -30.156 22.150 651 HB ILE 79 HB ILE 79 -6.266 -28.075 20.913 652 1HG1 ILE 79 HG12 ILE 79 -7.109 -30.812 19.908 653 2HG1 ILE 79 HG11 ILE 79 -7.702 -29.277 19.287 654 1HG2 ILE 79 HG21 ILE 79 -4.494 -29.761 21.116 655 2HG2 ILE 79 HG22 ILE 79 -5.608 -30.831 21.968 656 3HG2 ILE 79 HG23 ILE 79 -5.127 -29.297 22.696 657 1HD1 ILE 79 HD11 ILE 79 -5.446 -28.713 18.535 658 2HD1 ILE 79 HD12 ILE 79 -6.016 -30.225 17.827 659 3HD1 ILE 79 HD13 ILE 79 -4.856 -30.257 19.155 660 H SER 80 HN SER 80 -8.113 -26.724 22.775 661 HA SER 80 HA SER 80 -6.436 -26.864 25.112 662 1HB SER 80 HB2 SER 80 -6.623 -24.838 23.669 663 2HB SER 80 HB1 SER 80 -8.283 -24.638 24.223 664 HG SER 80 HG SER 80 -7.301 -24.606 26.415 665 H GLN 81 HN GLN 81 -9.745 -27.431 24.437 666 HA GLN 81 HA GLN 81 -10.874 -26.570 26.910 667 1HB GLN 81 HB2 GLN 81 -11.944 -28.523 24.857 668 2HB GLN 81 HB1 GLN 81 -12.875 -27.833 26.180 669 1HG GLN 81 HG2 GLN 81 -12.559 -25.597 25.238 670 2HG GLN 81 HG1 GLN 81 -11.623 -26.287 23.915 671 1HE2 GLN 81 HE21 GLN 81 -13.370 -28.638 23.698 672 2HE2 GLN 81 HE22 GLN 81 -14.819 -28.078 22.942 673 H LEU 82 HN LEU 82 -8.827 -29.106 26.287 674 HA LEU 82 HA LEU 82 -10.115 -31.121 27.905 675 1HB LEU 82 HB2 LEU 82 -7.203 -31.254 27.200 676 2HB LEU 82 HB1 LEU 82 -8.383 -32.544 27.318 677 HG LEU 82 HG LEU 82 -8.207 -30.524 25.082 678 1HD1 LEU 82 HD11 LEU 82 -6.391 -32.137 25.021 679 2HD1 LEU 82 HD12 LEU 82 -7.526 -32.412 23.702 680 3HD1 LEU 82 HD13 LEU 82 -7.549 -33.466 25.116 681 1HD2 LEU 82 HD21 LEU 82 -10.067 -32.871 25.432 682 2HD2 LEU 82 HD22 LEU 82 -9.923 -31.878 23.982 683 3HD2 LEU 82 HD23 LEU 82 -10.509 -31.163 25.482 684 H ASP 83 HN ASP 83 -8.045 -28.451 28.453 685 HA ASP 83 HA ASP 83 -7.030 -27.583 30.293 686 1HB ASP 83 HB2 ASP 83 -8.958 -28.192 31.622 687 2HB ASP 83 HB1 ASP 83 -8.413 -29.861 31.735 688 H LYS 84 HN LYS 84 -6.754 -31.054 29.914 689 HA LYS 84 HA LYS 84 -4.419 -31.544 31.346 690 1HB LYS 84 HB2 LYS 84 -5.506 -32.942 28.889 691 2HB LYS 84 HB1 LYS 84 -4.312 -33.611 29.997 692 1HG LYS 84 HG2 LYS 84 -5.876 -33.847 31.727 693 2HG LYS 84 HG1 LYS 84 -7.026 -32.749 30.959 694 1HD LYS 84 HD2 LYS 84 -7.448 -34.381 29.203 695 2HD LYS 84 HD1 LYS 84 -6.243 -35.467 29.891 696 1HE LYS 84 HE2 LYS 84 -7.573 -35.741 31.896 697 2HE LYS 84 HE1 LYS 84 -8.731 -34.535 31.333 698 1HZ LYS 84 HZ1 LYS 84 -9.551 -36.774 30.996 699 2HZ LYS 84 HZ2 LYS 84 -8.206 -37.166 30.050 700 3HZ LYS 84 HZ3 LYS 84 -9.317 -36.012 29.506 701 H VAL 85 HN VAL 85 -4.887 -30.199 28.163 702 HA VAL 85 HA VAL 85 -2.200 -30.699 27.264 703 HB VAL 85 HB VAL 85 -4.079 -30.543 25.667 704 1HG1 VAL 85 HG11 VAL 85 -4.138 -27.617 26.414 705 2HG1 VAL 85 HG12 VAL 85 -5.394 -28.808 26.754 706 3HG1 VAL 85 HG13 VAL 85 -5.034 -28.357 25.088 707 1HG2 VAL 85 HG21 VAL 85 -2.952 -29.141 23.994 708 2HG2 VAL 85 HG22 VAL 85 -1.804 -30.148 24.877 709 3HG2 VAL 85 HG23 VAL 85 -1.952 -28.433 25.263 710 H VAL 86 HN VAL 86 -0.470 -29.368 27.361 711 HA VAL 86 HA VAL 86 -0.798 -26.846 28.844 712 HB VAL 86 HB VAL 86 1.642 -26.979 29.277 713 1HG1 VAL 86 HG11 VAL 86 0.058 -27.853 30.915 714 2HG1 VAL 86 HG12 VAL 86 1.536 -28.816 30.903 715 3HG1 VAL 86 HG13 VAL 86 0.078 -29.428 30.119 716 1HG2 VAL 86 HG21 VAL 86 2.853 -29.065 28.800 717 2HG2 VAL 86 HG22 VAL 86 2.310 -28.282 27.316 718 3HG2 VAL 86 HG23 VAL 86 1.443 -29.686 27.939 719 H GLN 87 HN GLN 87 0.310 -28.219 25.833 720 HA GLN 87 HA GLN 87 0.698 -25.505 24.786 721 1HB GLN 87 HB2 GLN 87 2.932 -26.478 25.397 722 2HB GLN 87 HB1 GLN 87 2.637 -27.771 24.243 723 1HG GLN 87 HG2 GLN 87 2.500 -26.099 22.436 724 2HG GLN 87 HG1 GLN 87 2.860 -24.831 23.606 725 1HE2 GLN 87 HE21 GLN 87 4.343 -25.589 21.235 726 2HE2 GLN 87 HE22 GLN 87 5.929 -26.025 21.761 727 H THR 88 HN THR 88 -0.702 -25.297 23.191 728 HA THR 88 HA THR 88 -1.466 -27.638 21.585 729 HB THR 88 HB THR 88 -3.339 -26.092 20.800 730 HG1 THR 88 HG1 THR 88 -3.602 -24.175 21.782 731 1HG2 THR 88 HG21 THR 88 -4.679 -26.393 22.830 732 2HG2 THR 88 HG22 THR 88 -3.215 -26.716 23.758 733 3HG2 THR 88 HG23 THR 88 -3.718 -27.833 22.490 734 H LEU 89 HN LEU 89 -0.592 -27.844 19.618 735 HA LEU 89 HA LEU 89 0.249 -25.398 18.195 736 1HB LEU 89 HB2 LEU 89 1.320 -28.212 17.886 737 2HB LEU 89 HB1 LEU 89 1.791 -26.841 16.903 738 HG LEU 89 HG LEU 89 2.588 -25.757 19.093 739 1HD1 LEU 89 HD11 LEU 89 3.217 -27.309 20.876 740 2HD1 LEU 89 HD12 LEU 89 2.394 -28.621 20.031 741 3HD1 LEU 89 HD13 LEU 89 1.470 -27.253 20.652 742 1HD2 LEU 89 HD21 LEU 89 4.083 -26.599 17.350 743 2HD2 LEU 89 HD22 LEU 89 4.008 -28.212 18.060 744 3HD2 LEU 89 HD23 LEU 89 4.741 -26.884 18.960 745 H GLY 90 HN GLY 90 -1.084 -24.874 16.633 746 1HA GLY 90 HA2 GLY 90 -2.016 -26.880 14.742 747 2HA GLY 90 HA1 GLY 90 -3.269 -26.018 15.634 748 H SER 91 HN SER 91 -0.314 -25.390 13.778 749 HA SER 91 HA SER 91 -1.099 -22.702 13.138 750 1HB SER 91 HB2 SER 91 1.272 -23.375 13.456 751 2HB SER 91 HB1 SER 91 1.163 -24.401 12.028 752 HG SER 91 HG SER 91 0.680 -22.480 10.827 Start of MODEL 5 1 1H GLN 1 HT1 GLN 1 2.113 -10.976 -5.140 2 2H GLN 1 HT2 GLN 1 1.037 -10.346 -6.279 3 3H GLN 1 HT3 GLN 1 0.672 -10.253 -4.632 4 HA GLN 1 HA GLN 1 1.402 -8.125 -5.499 5 1HB GLN 1 HB2 GLN 1 1.843 -8.725 -3.141 6 2HB GLN 1 HB1 GLN 1 3.379 -9.435 -3.609 7 1HG GLN 1 HG2 GLN 1 3.790 -7.286 -2.652 8 2HG GLN 1 HG1 GLN 1 4.133 -7.200 -4.378 9 1HE2 GLN 1 HE21 GLN 1 3.482 -5.087 -2.459 10 2HE2 GLN 1 HE22 GLN 1 2.085 -4.283 -3.081 11 H GLY 2 HN GLY 2 2.146 -7.737 -7.521 12 1HA GLY 2 HA2 GLY 2 3.623 -7.477 -9.254 13 2HA GLY 2 HA1 GLY 2 4.894 -7.567 -8.043 14 H HIS 3 HN HIS 3 6.317 -9.127 -8.397 15 HA HIS 3 HA HIS 3 5.665 -11.381 -10.117 16 1HB HIS 3 HB2 HIS 3 8.251 -10.639 -8.710 17 2HB HIS 3 HB1 HIS 3 8.065 -11.977 -9.840 18 HD1 HIS 3 HD1 HIS 3 8.431 -11.452 -12.259 19 HD2 HIS 3 HD2 HIS 3 7.821 -8.034 -9.972 20 HE1 HIS 3 HE1 HIS 3 8.854 -9.516 -13.806 21 HE2 HIS 3 HE2 HIS 3 8.371 -7.464 -12.430 22 H MET 4 HN MET 4 5.746 -13.558 -9.451 23 HA MET 4 HA MET 4 4.564 -14.043 -6.937 24 1HB MET 4 HB2 MET 4 5.863 -16.017 -8.832 25 2HB MET 4 HB1 MET 4 4.792 -16.434 -7.501 26 1HG MET 4 HG2 MET 4 2.987 -15.150 -8.601 27 2HG MET 4 HG1 MET 4 4.069 -14.849 -9.959 28 1HE MET 4 HE1 MET 4 2.435 -18.996 -8.761 29 2HE MET 4 HE2 MET 4 2.010 -17.484 -7.958 30 3HE MET 4 HE3 MET 4 3.636 -18.147 -7.788 31 HA PRO 5 HA PRO 5 8.420 -14.041 -4.610 32 1HB PRO 5 HB2 PRO 5 7.300 -14.411 -2.155 33 2HB PRO 5 HB1 PRO 5 7.305 -12.848 -2.981 34 1HG PRO 5 HG2 PRO 5 5.117 -14.890 -2.800 35 2HG PRO 5 HG1 PRO 5 5.017 -13.125 -2.643 36 1HD PRO 5 HD2 PRO 5 4.348 -14.429 -4.928 37 2HD PRO 5 HD1 PRO 5 5.038 -12.794 -4.931 38 H SER 6 HN SER 6 9.269 -15.953 -5.421 39 HA SER 6 HA SER 6 8.257 -18.532 -5.003 40 1HB SER 6 HB2 SER 6 10.618 -19.244 -5.640 41 2HB SER 6 HB1 SER 6 9.803 -18.181 -6.788 42 HG SER 6 HG SER 6 11.523 -17.200 -4.756 43 H ASP 7 HN ASP 7 7.911 -19.362 -3.055 44 HA ASP 7 HA ASP 7 8.233 -20.200 -0.981 45 1HB ASP 7 HB2 ASP 7 11.121 -20.061 -1.870 46 2HB ASP 7 HB1 ASP 7 10.632 -20.764 -0.332 47 H SER 8 HN SER 8 8.348 -17.231 -1.557 48 HA SER 8 HA SER 8 9.404 -16.381 1.063 49 1HB SER 8 HB2 SER 8 10.467 -15.282 -0.925 50 2HB SER 8 HB1 SER 8 8.884 -14.663 -1.390 51 HG SER 8 HG SER 8 10.610 -13.834 0.603 52 H LYS 9 HN LYS 9 8.054 -14.989 2.316 53 HA LYS 9 HA LYS 9 6.089 -14.505 3.342 54 1HB LYS 9 HB2 LYS 9 5.900 -13.001 1.342 55 2HB LYS 9 HB1 LYS 9 5.002 -14.267 0.518 56 1HG LYS 9 HG2 LYS 9 3.252 -14.133 2.242 57 2HG LYS 9 HG1 LYS 9 4.152 -12.845 3.042 58 1HD LYS 9 HD2 LYS 9 3.061 -12.725 0.224 59 2HD LYS 9 HD1 LYS 9 2.308 -11.989 1.639 60 1HE LYS 9 HE2 LYS 9 4.392 -10.646 1.960 61 2HE LYS 9 HE1 LYS 9 4.992 -11.299 0.435 62 1HZ LYS 9 HZ1 LYS 9 3.068 -10.321 -0.677 63 2HZ LYS 9 HZ2 LYS 9 3.981 -9.139 0.115 64 3HZ LYS 9 HZ3 LYS 9 2.531 -9.676 0.789 65 H LYS 10 HN LYS 10 6.712 -17.146 3.158 66 HA LYS 10 HA LYS 10 5.870 -19.213 3.545 67 1HB LYS 10 HB2 LYS 10 3.178 -17.881 3.179 68 2HB LYS 10 HB1 LYS 10 3.368 -19.582 3.560 69 1HG LYS 10 HG2 LYS 10 4.421 -17.363 5.307 70 2HG LYS 10 HG1 LYS 10 2.824 -18.081 5.493 71 1HD LYS 10 HD2 LYS 10 3.969 -19.369 6.992 72 2HD LYS 10 HD1 LYS 10 4.244 -20.334 5.543 73 1HE LYS 10 HE2 LYS 10 6.315 -20.085 6.762 74 2HE LYS 10 HE1 LYS 10 6.423 -19.197 5.244 75 1HZ LYS 10 HZ1 LYS 10 5.819 -17.997 7.894 76 2HZ LYS 10 HZ2 LYS 10 5.977 -17.156 6.438 77 3HZ LYS 10 HZ3 LYS 10 7.317 -17.933 7.111 78 HA PRO 11 HA PRO 11 5.834 -20.655 -0.720 79 1HB PRO 11 HB2 PRO 11 5.526 -23.296 0.610 80 2HB PRO 11 HB1 PRO 11 6.753 -22.753 -0.539 81 1HG PRO 11 HG2 PRO 11 7.346 -23.086 2.044 82 2HG PRO 11 HG1 PRO 11 8.046 -21.752 1.106 83 1HD PRO 11 HD2 PRO 11 5.777 -21.704 3.071 84 2HD PRO 11 HD1 PRO 11 7.105 -20.542 2.852 85 H THR 12 HN THR 12 4.330 -22.040 -2.030 86 HA THR 12 HA THR 12 1.646 -21.332 -1.491 87 HB THR 12 HB THR 12 2.635 -23.417 -3.457 88 HG1 THR 12 HG1 THR 12 3.330 -20.952 -3.439 89 1HG2 THR 12 HG21 THR 12 0.209 -23.479 -3.089 90 2HG2 THR 12 HG22 THR 12 0.587 -22.864 -4.698 91 3HG2 THR 12 HG23 THR 12 0.107 -21.748 -3.418 92 H ILE 13 HN ILE 13 0.547 -22.184 0.151 93 HA ILE 13 HA ILE 13 0.803 -25.047 0.774 94 HB ILE 13 HB ILE 13 -0.561 -22.865 2.387 95 1HG1 ILE 13 HG12 ILE 13 1.868 -22.492 2.287 96 2HG1 ILE 13 HG11 ILE 13 1.385 -23.003 3.900 97 1HG2 ILE 13 HG21 ILE 13 -0.553 -24.524 4.209 98 2HG2 ILE 13 HG22 ILE 13 0.110 -25.725 3.100 99 3HG2 ILE 13 HG23 ILE 13 -1.501 -25.061 2.823 100 1HD1 ILE 13 HD11 ILE 13 2.663 -24.742 1.799 101 2HD1 ILE 13 HD12 ILE 13 2.168 -25.269 3.407 102 3HD1 ILE 13 HD13 ILE 13 3.452 -24.073 3.227 103 H ILE 14 HN ILE 14 -0.725 -26.380 0.040 104 HA ILE 14 HA ILE 14 -3.153 -25.223 -1.116 105 HB ILE 14 HB ILE 14 -1.958 -27.987 -1.421 106 1HG1 ILE 14 HG12 ILE 14 -0.608 -26.239 -2.499 107 2HG1 ILE 14 HG11 ILE 14 -1.391 -27.253 -3.705 108 1HG2 ILE 14 HG21 ILE 14 -3.602 -28.290 -3.230 109 2HG2 ILE 14 HG22 ILE 14 -4.334 -26.742 -2.806 110 3HG2 ILE 14 HG23 ILE 14 -4.370 -28.079 -1.656 111 1HD1 ILE 14 HD11 ILE 14 -3.092 -25.521 -4.043 112 2HD1 ILE 14 HD12 ILE 14 -1.462 -24.926 -4.360 113 3HD1 ILE 14 HD13 ILE 14 -2.277 -24.503 -2.855 114 H TYR 15 HN TYR 15 -4.921 -25.217 0.065 115 HA TYR 15 HA TYR 15 -5.425 -27.349 2.026 116 1HB TYR 15 HB2 TYR 15 -6.651 -24.609 1.623 117 2HB TYR 15 HB1 TYR 15 -7.361 -25.809 2.695 118 HD1 TYR 15 HD1 TYR 15 -6.478 -26.188 4.872 119 HD2 TYR 15 HD2 TYR 15 -4.360 -23.693 2.141 120 HE1 TYR 15 HE1 TYR 15 -5.021 -25.433 6.699 121 HE2 TYR 15 HE2 TYR 15 -2.894 -22.941 3.970 122 HH TYR 15 HH TYR 15 -3.019 -22.752 6.477 123 HA PRO 16 HA PRO 16 -7.316 -28.121 3.082 124 1HB PRO 16 HB2 PRO 16 -8.402 -30.774 2.635 125 2HB PRO 16 HB1 PRO 16 -9.136 -29.413 3.484 126 1HG PRO 16 HG2 PRO 16 -10.063 -30.395 1.102 127 2HG PRO 16 HG1 PRO 16 -10.295 -28.720 1.637 128 1HD PRO 16 HD2 PRO 16 -8.273 -29.837 -0.280 129 2HD PRO 16 HD1 PRO 16 -9.220 -28.336 -0.387 130 H CYS 17 HN CYS 17 -6.216 -29.830 4.351 131 HA CYS 17 HA CYS 17 -4.598 -31.777 2.996 132 1HB CYS 17 HB2 CYS 17 -3.288 -29.731 2.544 133 2HB CYS 17 HB1 CYS 17 -3.230 -29.387 4.270 134 HG CYS 17 HG CYS 17 -1.365 -31.475 2.443 135 H LEU 18 HN LEU 18 -3.548 -33.198 4.436 136 HA LEU 18 HA LEU 18 -4.703 -33.434 7.044 137 1HB LEU 18 HB2 LEU 18 -2.447 -34.908 5.672 138 2HB LEU 18 HB1 LEU 18 -3.028 -35.318 7.275 139 HG LEU 18 HG LEU 18 -4.818 -35.335 4.847 140 1HD1 LEU 18 HD11 LEU 18 -3.282 -37.643 6.044 141 2HD1 LEU 18 HD12 LEU 18 -3.004 -36.913 4.463 142 3HD1 LEU 18 HD13 LEU 18 -4.513 -37.765 4.785 143 1HD2 LEU 18 HD21 LEU 18 -5.965 -35.189 6.996 144 2HD2 LEU 18 HD22 LEU 18 -5.080 -36.599 7.580 145 3HD2 LEU 18 HD23 LEU 18 -6.230 -36.766 6.252 146 H TRP 19 HN TRP 19 -4.164 -31.892 8.469 147 HA TRP 19 HA TRP 19 -1.394 -30.998 8.704 148 1HB TRP 19 HB2 TRP 19 -3.482 -29.450 8.743 149 2HB TRP 19 HB1 TRP 19 -3.696 -30.016 10.396 150 HD1 TRP 19 HD1 TRP 19 -1.773 -29.285 12.191 151 HE1 TRP 19 HE1 TRP 19 -0.136 -27.296 12.186 152 HE3 TRP 19 HE3 TRP 19 -2.104 -27.952 7.254 153 HZ2 TRP 19 HZ2 TRP 19 0.880 -25.422 10.345 154 HZ3 TRP 19 HZ3 TRP 19 -0.764 -26.051 6.458 155 HH2 TRP 19 HH2 TRP 19 0.696 -24.811 7.974 156 H ASP 20 HN ASP 20 -0.074 -31.581 10.338 157 HA ASP 20 HA ASP 20 -1.088 -33.603 12.210 158 1HB ASP 20 HB2 ASP 20 1.330 -34.153 12.575 159 2HB ASP 20 HB1 ASP 20 0.780 -34.391 10.922 160 H TYR 21 HN TYR 21 -1.013 -33.381 14.356 161 HA TYR 21 HA TYR 21 0.099 -30.895 15.498 162 1HB TYR 21 HB2 TYR 21 -2.438 -32.312 16.381 163 2HB TYR 21 HB1 TYR 21 -1.773 -30.844 17.081 164 HD1 TYR 21 HD1 TYR 21 -2.092 -28.691 15.990 165 HD2 TYR 21 HD2 TYR 21 -3.566 -32.270 14.205 166 HE1 TYR 21 HE1 TYR 21 -3.487 -27.354 14.467 167 HE2 TYR 21 HE2 TYR 21 -4.956 -30.940 12.678 168 HH TYR 21 HH TYR 21 -5.982 -28.683 12.625 169 H ARG 22 HN ARG 22 1.801 -31.490 16.744 170 HA ARG 22 HA ARG 22 1.874 -34.000 18.175 171 1HB ARG 22 HB2 ARG 22 3.980 -33.057 17.430 172 2HB ARG 22 HB1 ARG 22 3.652 -31.544 18.263 173 1HG ARG 22 HG2 ARG 22 5.270 -32.753 19.536 174 2HG ARG 22 HG1 ARG 22 3.750 -32.784 20.428 175 1HD ARG 22 HD2 ARG 22 4.801 -34.962 20.516 176 2HD ARG 22 HD1 ARG 22 3.319 -35.056 19.565 177 HE ARG 22 HE ARG 22 4.774 -34.974 17.559 178 1HH1 ARG 22 HH11 ARG 22 6.198 -35.974 20.611 179 2HH1 ARG 22 HH12 ARG 22 7.435 -36.922 19.847 180 1HH2 ARG 22 HH21 ARG 22 6.418 -36.195 16.583 181 2HH2 ARG 22 HH22 ARG 22 7.567 -37.040 17.575 182 H VAL 23 HN VAL 23 0.573 -34.278 19.878 183 HA VAL 23 HA VAL 23 -0.087 -31.952 21.575 184 HB VAL 23 HB VAL 23 -1.658 -34.521 21.215 185 1HG1 VAL 23 HG11 VAL 23 -1.955 -33.543 23.435 186 2HG1 VAL 23 HG12 VAL 23 -3.424 -33.371 22.475 187 3HG1 VAL 23 HG13 VAL 23 -2.357 -31.987 22.707 188 1HG2 VAL 23 HG21 VAL 23 -1.713 -33.148 19.192 189 2HG2 VAL 23 HG22 VAL 23 -2.213 -31.747 20.142 190 3HG2 VAL 23 HG23 VAL 23 -3.284 -33.142 19.995 191 H ILE 24 HN ILE 24 1.338 -31.989 23.228 192 HA ILE 24 HA ILE 24 1.901 -34.542 24.568 193 HB ILE 24 HB ILE 24 3.227 -31.847 24.989 194 1HG1 ILE 24 HG12 ILE 24 4.212 -34.268 23.443 195 2HG1 ILE 24 HG11 ILE 24 3.632 -32.771 22.722 196 1HG2 ILE 24 HG21 ILE 24 4.001 -34.604 25.971 197 2HG2 ILE 24 HG22 ILE 24 3.360 -33.289 26.956 198 3HG2 ILE 24 HG23 ILE 24 4.943 -33.128 26.198 199 1HD1 ILE 24 HD11 ILE 24 6.055 -32.871 22.727 200 2HD1 ILE 24 HD12 ILE 24 6.058 -33.052 24.482 201 3HD1 ILE 24 HD13 ILE 24 5.477 -31.555 23.748 202 H MET 25 HN MET 25 0.522 -35.039 26.144 203 HA MET 25 HA MET 25 -0.380 -32.888 27.960 204 1HB MET 25 HB2 MET 25 -1.945 -35.344 27.105 205 2HB MET 25 HB1 MET 25 -2.464 -34.189 28.325 206 1HG MET 25 HG2 MET 25 -2.209 -32.445 26.420 207 2HG MET 25 HG1 MET 25 -2.276 -33.851 25.361 208 1HE MET 25 HE1 MET 25 -5.841 -35.300 26.153 209 2HE MET 25 HE2 MET 25 -4.302 -35.797 26.862 210 3HE MET 25 HE3 MET 25 -4.405 -35.447 25.137 211 H THR 26 HN THR 26 -0.859 -33.599 30.153 212 HA THR 26 HA THR 26 1.040 -35.634 31.052 213 HB THR 26 HB THR 26 0.389 -34.688 33.357 214 HG1 THR 26 HG1 THR 26 -1.378 -33.479 33.107 215 1HG2 THR 26 HG21 THR 26 2.502 -34.140 32.228 216 2HG2 THR 26 HG22 THR 26 1.866 -32.749 33.106 217 3HG2 THR 26 HG23 THR 26 1.698 -32.837 31.353 218 H THR 27 HN THR 27 -1.485 -36.339 29.742 219 HA THR 27 HA THR 27 -2.427 -38.256 31.709 220 HB THR 27 HB THR 27 -3.978 -36.322 31.988 221 HG1 THR 27 HG1 THR 27 -5.908 -37.559 31.650 222 1HG2 THR 27 HG21 THR 27 -4.661 -36.827 29.084 223 2HG2 THR 27 HG22 THR 27 -3.857 -35.395 29.728 224 3HG2 THR 27 HG23 THR 27 -5.526 -35.743 30.172 225 H LYS 28 HN LYS 28 -3.087 -40.162 30.753 226 HA LYS 28 HA LYS 28 -2.816 -40.400 27.862 227 1HB LYS 28 HB2 LYS 28 -3.413 -42.488 29.975 228 2HB LYS 28 HB1 LYS 28 -3.181 -42.828 28.265 229 1HG LYS 28 HG2 LYS 28 -0.882 -41.948 28.429 230 2HG LYS 28 HG1 LYS 28 -1.124 -41.699 30.159 231 1HD LYS 28 HD2 LYS 28 -1.262 -44.354 28.713 232 2HD LYS 28 HD1 LYS 28 0.083 -43.788 29.705 233 1HE LYS 28 HE2 LYS 28 -1.398 -43.719 31.663 234 2HE LYS 28 HE1 LYS 28 -2.736 -44.296 30.669 235 1HZ LYS 28 HZ1 LYS 28 -1.756 -46.107 31.894 236 2HZ LYS 28 HZ2 LYS 28 -0.225 -45.771 31.253 237 3HZ LYS 28 HZ3 LYS 28 -1.461 -46.326 30.241 238 H ASP 29 HN ASP 29 -5.192 -39.684 30.085 239 HA ASP 29 HA ASP 29 -7.396 -41.023 28.798 240 1HB ASP 29 HB2 ASP 29 -7.462 -40.673 31.215 241 2HB ASP 29 HB1 ASP 29 -7.339 -38.932 30.990 242 H THR 30 HN THR 30 -6.995 -40.182 26.699 243 HA THR 30 HA THR 30 -7.555 -37.368 26.254 244 HB THR 30 HB THR 30 -5.772 -38.254 24.913 245 HG1 THR 30 HG1 THR 30 -6.679 -37.886 22.781 246 1HG2 THR 30 HG21 THR 30 -6.360 -40.631 24.966 247 2HG2 THR 30 HG22 THR 30 -6.068 -40.086 23.315 248 3HG2 THR 30 HG23 THR 30 -7.720 -40.327 23.882 249 H SER 31 HN SER 31 -9.631 -36.850 26.407 250 HA SER 31 HA SER 31 -11.600 -38.439 24.892 251 1HB SER 31 HB2 SER 31 -13.278 -37.646 26.611 252 2HB SER 31 HB1 SER 31 -12.060 -38.757 27.241 253 HG SER 31 HG SER 31 -11.949 -37.186 28.687 254 H THR 32 HN THR 32 -11.418 -35.279 26.513 255 HA THR 32 HA THR 32 -13.057 -33.848 24.817 256 HB THR 32 HB THR 32 -10.621 -32.772 26.268 257 HG1 THR 32 HG1 THR 32 -11.732 -33.501 27.936 258 1HG2 THR 32 HG21 THR 32 -11.634 -31.163 24.691 259 2HG2 THR 32 HG22 THR 32 -11.880 -30.669 26.365 260 3HG2 THR 32 HG23 THR 32 -13.204 -31.402 25.459 261 H LEU 33 HN LEU 33 -9.660 -34.652 24.458 262 HA LEU 33 HA LEU 33 -8.970 -32.932 22.363 263 1HB LEU 33 HB2 LEU 33 -7.325 -34.250 23.605 264 2HB LEU 33 HB1 LEU 33 -7.990 -35.733 22.948 265 HG LEU 33 HG LEU 33 -7.270 -35.057 20.684 266 1HD1 LEU 33 HD11 LEU 33 -7.366 -32.638 20.949 267 2HD1 LEU 33 HD12 LEU 33 -5.772 -33.144 20.392 268 3HD1 LEU 33 HD13 LEU 33 -6.012 -32.692 22.080 269 1HD2 LEU 33 HD21 LEU 33 -4.865 -35.361 21.020 270 2HD2 LEU 33 HD22 LEU 33 -5.796 -36.448 22.049 271 3HD2 LEU 33 HD23 LEU 33 -5.052 -35.005 22.738 272 H LYS 34 HN LYS 34 -10.449 -36.151 22.321 273 HA LYS 34 HA LYS 34 -10.563 -36.300 19.454 274 1HB LYS 34 HB2 LYS 34 -12.106 -37.912 21.500 275 2HB LYS 34 HB1 LYS 34 -11.871 -38.323 19.806 276 1HG LYS 34 HG2 LYS 34 -9.461 -38.572 20.202 277 2HG LYS 34 HG1 LYS 34 -9.704 -38.168 21.902 278 1HD LYS 34 HD2 LYS 34 -10.848 -40.558 20.443 279 2HD LYS 34 HD1 LYS 34 -9.533 -40.581 21.620 280 1HE LYS 34 HE2 LYS 34 -11.050 -39.813 23.362 281 2HE LYS 34 HE1 LYS 34 -12.368 -39.705 22.195 282 1HZ LYS 34 HZ1 LYS 34 -10.997 -42.155 23.143 283 2HZ LYS 34 HZ2 LYS 34 -12.052 -42.136 21.820 284 3HZ LYS 34 HZ3 LYS 34 -12.621 -41.728 23.359 285 H GLU 35 HN GLU 35 -12.791 -35.504 22.060 286 HA GLU 35 HA GLU 35 -15.174 -35.351 20.641 287 1HB GLU 35 HB2 GLU 35 -14.312 -33.661 23.003 288 2HB GLU 35 HB1 GLU 35 -15.966 -33.863 22.446 289 1HG GLU 35 HG2 GLU 35 -14.194 -36.045 23.538 290 2HG GLU 35 HG1 GLU 35 -15.492 -35.233 24.409 291 H LEU 36 HN LEU 36 -12.761 -32.793 21.248 292 HA LEU 36 HA LEU 36 -14.207 -30.729 19.989 293 1HB LEU 36 HB2 LEU 36 -12.214 -29.417 20.098 294 2HB LEU 36 HB1 LEU 36 -12.302 -30.386 21.552 295 HG LEU 36 HG LEU 36 -10.705 -32.002 20.180 296 1HD1 LEU 36 HD11 LEU 36 -10.731 -30.757 18.101 297 2HD1 LEU 36 HD12 LEU 36 -9.112 -30.750 18.798 298 3HD1 LEU 36 HD13 LEU 36 -10.134 -29.318 18.928 299 1HD2 LEU 36 HD21 LEU 36 -8.781 -30.895 21.212 300 2HD2 LEU 36 HD22 LEU 36 -10.153 -30.977 22.316 301 3HD2 LEU 36 HD23 LEU 36 -9.764 -29.460 21.505 302 H LEU 37 HN LEU 37 -12.053 -33.189 18.751 303 HA LEU 37 HA LEU 37 -11.735 -32.096 16.143 304 1HB LEU 37 HB2 LEU 37 -11.560 -34.974 17.071 305 2HB LEU 37 HB1 LEU 37 -10.999 -34.374 15.521 306 HG LEU 37 HG LEU 37 -9.883 -33.523 18.200 307 1HD1 LEU 37 HD11 LEU 37 -8.749 -35.427 16.153 308 2HD1 LEU 37 HD12 LEU 37 -9.354 -35.853 17.754 309 3HD1 LEU 37 HD13 LEU 37 -7.914 -34.848 17.594 310 1HD2 LEU 37 HD21 LEU 37 -9.670 -31.796 16.489 311 2HD2 LEU 37 HD22 LEU 37 -8.922 -32.960 15.395 312 3HD2 LEU 37 HD23 LEU 37 -8.098 -32.494 16.884 313 H GLU 38 HN GLU 38 -14.029 -34.322 17.626 314 HA GLU 38 HA GLU 38 -15.361 -35.017 15.217 315 1HB GLU 38 HB2 GLU 38 -16.216 -35.258 18.105 316 2HB GLU 38 HB1 GLU 38 -17.167 -35.868 16.756 317 1HG GLU 38 HG2 GLU 38 -15.199 -37.275 16.109 318 2HG GLU 38 HG1 GLU 38 -14.421 -36.768 17.608 319 H THR 39 HN THR 39 -15.585 -32.221 17.254 320 HA THR 39 HA THR 39 -18.264 -31.517 16.680 321 HB THR 39 HB THR 39 -17.750 -29.263 17.373 322 HG1 THR 39 HG1 THR 39 -15.042 -30.045 16.997 323 1HG2 THR 39 HG21 THR 39 -16.718 -29.667 19.564 324 2HG2 THR 39 HG22 THR 39 -16.159 -31.244 19.009 325 3HG2 THR 39 HG23 THR 39 -17.887 -30.925 19.159 326 H TYR 40 HN TYR 40 -15.451 -31.520 14.728 327 HA TYR 40 HA TYR 40 -16.606 -29.721 12.732 328 1HB TYR 40 HB2 TYR 40 -14.017 -31.305 12.630 329 2HB TYR 40 HB1 TYR 40 -14.507 -30.035 11.513 330 HD1 TYR 40 HD1 TYR 40 -14.438 -27.667 12.207 331 HD2 TYR 40 HD2 TYR 40 -13.177 -30.774 14.836 332 HE1 TYR 40 HE1 TYR 40 -13.343 -25.999 13.657 333 HE2 TYR 40 HE2 TYR 40 -12.085 -29.117 16.285 334 HH TYR 40 HH TYR 40 -12.577 -25.724 15.879 335 H GLN 41 HN GLN 41 -16.824 -32.905 13.618 336 HA GLN 41 HA GLN 41 -17.815 -34.737 12.771 337 1HB GLN 41 HB2 GLN 41 -18.727 -32.788 10.657 338 2HB GLN 41 HB1 GLN 41 -19.224 -34.473 10.677 339 1HG GLN 41 HG2 GLN 41 -19.750 -32.452 12.855 340 2HG GLN 41 HG1 GLN 41 -20.916 -33.018 11.660 341 1HE2 GLN 41 HE21 GLN 41 -19.236 -33.759 14.590 342 2HE2 GLN 41 HE22 GLN 41 -20.095 -35.207 14.968 343 H ARG 42 HN ARG 42 -15.213 -33.348 11.322 344 HA ARG 42 HA ARG 42 -15.037 -35.168 9.062 345 1HB ARG 42 HB2 ARG 42 -13.034 -33.974 8.451 346 2HB ARG 42 HB1 ARG 42 -14.274 -32.798 8.865 347 1HG ARG 42 HG2 ARG 42 -13.240 -32.400 11.011 348 2HG ARG 42 HG1 ARG 42 -12.063 -33.683 10.716 349 1HD ARG 42 HD2 ARG 42 -10.931 -31.672 10.242 350 2HD ARG 42 HD1 ARG 42 -11.337 -32.364 8.675 351 HE ARG 42 HE ARG 42 -12.540 -29.994 9.919 352 1HH1 ARG 42 HH11 ARG 42 -12.343 -32.134 7.139 353 2HH1 ARG 42 HH12 ARG 42 -13.032 -30.971 6.049 354 1HH2 ARG 42 HH21 ARG 42 -13.391 -28.467 8.477 355 2HH2 ARG 42 HH22 ARG 42 -13.659 -28.898 6.818 356 HA PRO 43 HA PRO 43 -12.770 -38.306 11.158 357 1HB PRO 43 HB2 PRO 43 -11.108 -39.224 9.207 358 2HB PRO 43 HB1 PRO 43 -12.849 -39.529 9.207 359 1HG PRO 43 HG2 PRO 43 -11.295 -37.440 7.713 360 2HG PRO 43 HG1 PRO 43 -12.597 -38.495 7.129 361 1HD PRO 43 HD2 PRO 43 -13.041 -35.925 7.827 362 2HD PRO 43 HD1 PRO 43 -14.256 -37.194 8.093 363 H PHE 44 HN PHE 44 -10.720 -38.944 11.977 364 HA PHE 44 HA PHE 44 -8.396 -37.273 11.542 365 1HB PHE 44 HB2 PHE 44 -8.164 -36.622 13.902 366 2HB PHE 44 HB1 PHE 44 -9.651 -35.972 13.220 367 HD1 PHE 44 HD1 PHE 44 -8.210 -38.275 15.658 368 HD2 PHE 44 HD2 PHE 44 -11.831 -36.881 13.894 369 HE1 PHE 44 HE1 PHE 44 -9.493 -39.296 17.493 370 HE2 PHE 44 HE2 PHE 44 -13.118 -37.901 15.726 371 HZ PHE 44 HZ PHE 44 -11.950 -39.109 17.530 372 H LYS 45 HN LYS 45 -6.490 -38.135 12.650 373 HA LYS 45 HA LYS 45 -6.795 -40.973 13.402 374 1HB LYS 45 HB2 LYS 45 -5.578 -40.646 11.269 375 2HB LYS 45 HB1 LYS 45 -4.402 -39.640 12.105 376 1HG LYS 45 HG2 LYS 45 -3.702 -41.535 13.460 377 2HG LYS 45 HG1 LYS 45 -4.931 -42.553 12.707 378 1HD LYS 45 HD2 LYS 45 -2.763 -42.995 11.710 379 2HD LYS 45 HD1 LYS 45 -3.825 -42.238 10.523 380 1HE LYS 45 HE2 LYS 45 -2.743 -40.066 10.974 381 2HE LYS 45 HE1 LYS 45 -1.661 -40.859 12.120 382 1HZ LYS 45 HZ1 LYS 45 -0.620 -40.570 9.962 383 2HZ LYS 45 HZ2 LYS 45 -1.846 -41.457 9.216 384 3HZ LYS 45 HZ3 LYS 45 -0.802 -42.213 10.314 385 H LEU 46 HN LEU 46 -6.636 -41.153 15.521 386 HA LEU 46 HA LEU 46 -4.980 -39.360 17.103 387 1HB LEU 46 HB2 LEU 46 -7.215 -40.013 17.911 388 2HB LEU 46 HB1 LEU 46 -6.729 -41.697 17.912 389 HG LEU 46 HG LEU 46 -5.009 -41.145 19.651 390 1HD1 LEU 46 HD11 LEU 46 -5.200 -39.032 20.866 391 2HD1 LEU 46 HD12 LEU 46 -6.416 -38.474 19.717 392 3HD1 LEU 46 HD13 LEU 46 -4.760 -38.763 19.179 393 1HD2 LEU 46 HD21 LEU 46 -7.150 -42.120 20.280 394 2HD2 LEU 46 HD22 LEU 46 -7.877 -40.514 20.360 395 3HD2 LEU 46 HD23 LEU 46 -6.610 -40.967 21.501 396 H GLU 47 HN GLU 47 -2.912 -39.783 17.443 397 HA GLU 47 HA GLU 47 -1.956 -42.582 17.394 398 1HB GLU 47 HB2 GLU 47 -0.580 -40.044 16.478 399 2HB GLU 47 HB1 GLU 47 0.224 -41.599 16.609 400 1HG GLU 47 HG2 GLU 47 -2.180 -41.153 14.856 401 2HG GLU 47 HG1 GLU 47 -0.527 -40.897 14.304 402 H PHE 48 HN PHE 48 -1.223 -43.239 19.362 403 HA PHE 48 HA PHE 48 0.018 -41.229 21.123 404 1HB PHE 48 HB2 PHE 48 -1.707 -42.636 22.184 405 2HB PHE 48 HB1 PHE 48 -0.809 -44.085 21.737 406 HD1 PHE 48 HD1 PHE 48 0.229 -45.070 23.554 407 HD2 PHE 48 HD2 PHE 48 0.067 -40.816 23.342 408 HE1 PHE 48 HE1 PHE 48 1.509 -44.915 25.650 409 HE2 PHE 48 HE2 PHE 48 1.346 -40.661 25.435 410 HZ PHE 48 HZ PHE 48 2.068 -42.710 26.593 411 H LYS 49 HN LYS 49 2.130 -40.998 20.786 412 HA LYS 49 HA LYS 49 3.555 -43.067 19.332 413 1HB LYS 49 HB2 LYS 49 4.402 -40.272 20.125 414 2HB LYS 49 HB1 LYS 49 5.348 -41.364 19.121 415 1HG LYS 49 HG2 LYS 49 2.655 -40.176 18.456 416 2HG LYS 49 HG1 LYS 49 4.208 -39.766 17.725 417 1HD LYS 49 HD2 LYS 49 4.380 -42.104 16.890 418 2HD LYS 49 HD1 LYS 49 2.768 -42.419 17.536 419 1HE LYS 49 HE2 LYS 49 1.876 -40.626 16.074 420 2HE LYS 49 HE1 LYS 49 3.487 -40.421 15.386 421 1HZ LYS 49 HZ1 LYS 49 1.723 -42.799 15.182 422 2HZ LYS 49 HZ2 LYS 49 3.355 -42.829 14.754 423 3HZ LYS 49 HZ3 LYS 49 2.286 -41.813 13.927 424 H ASN 50 HN ASN 50 4.449 -41.057 22.173 425 HA ASN 50 HA ASN 50 5.702 -43.379 23.403 426 1HB ASN 50 HB2 ASN 50 7.459 -42.593 21.896 427 2HB ASN 50 HB1 ASN 50 7.310 -40.959 22.532 428 1HD2 ASN 50 HD21 ASN 50 8.227 -40.462 24.512 429 2HD2 ASN 50 HD22 ASN 50 9.309 -41.525 25.337 430 H THR 51 HN THR 51 5.893 -43.229 25.573 431 HA THR 51 HA THR 51 4.984 -40.756 26.876 432 HB THR 51 HB THR 51 3.788 -42.821 27.507 433 HG1 THR 51 HG1 THR 51 4.440 -41.055 29.087 434 1HG2 THR 51 HG21 THR 51 5.592 -44.439 27.146 435 2HG2 THR 51 HG22 THR 51 4.924 -44.590 28.770 436 3HG2 THR 51 HG23 THR 51 6.469 -43.777 28.527 437 H SER 52 HN SER 52 6.265 -39.748 28.448 438 HA SER 52 HA SER 52 9.019 -39.732 28.076 439 1HB SER 52 HB2 SER 52 7.464 -38.842 30.520 440 2HB SER 52 HB1 SER 52 9.110 -38.354 30.111 441 HG SER 52 HG SER 52 8.085 -37.612 28.050 442 H LYS 53 HN LYS 53 10.720 -40.275 29.611 443 HA LYS 53 HA LYS 53 10.799 -42.994 30.136 444 1HB LYS 53 HB2 LYS 53 12.759 -41.472 29.859 445 2HB LYS 53 HB1 LYS 53 12.476 -40.865 31.484 446 1HG LYS 53 HG2 LYS 53 12.884 -43.101 32.396 447 2HG LYS 53 HG1 LYS 53 13.157 -43.717 30.765 448 1HD LYS 53 HD2 LYS 53 14.795 -41.592 32.160 449 2HD LYS 53 HD1 LYS 53 15.276 -43.270 31.908 450 1HE LYS 53 HE2 LYS 53 14.710 -41.260 29.722 451 2HE LYS 53 HE1 LYS 53 16.311 -41.737 30.281 452 1HZ LYS 53 HZ1 LYS 53 14.312 -43.532 29.012 453 2HZ LYS 53 HZ2 LYS 53 15.835 -44.000 29.567 454 3HZ LYS 53 HZ3 LYS 53 15.706 -42.917 28.276 455 H ASN 54 HN ASN 54 10.008 -40.327 32.326 456 HA ASN 54 HA ASN 54 9.521 -42.234 34.514 457 1HB ASN 54 HB2 ASN 54 10.900 -40.120 34.872 458 2HB ASN 54 HB1 ASN 54 9.407 -39.210 34.669 459 1HD2 ASN 54 HD21 ASN 54 9.397 -38.406 36.747 460 2HD2 ASN 54 HD22 ASN 54 9.112 -39.389 38.138 461 H ALA 55 HN ALA 55 7.834 -41.535 32.026 462 HA ALA 55 HA ALA 55 5.647 -41.535 31.453 463 1HB ALA 55 HB1 ALA 55 5.172 -42.297 34.337 464 2HB ALA 55 HB2 ALA 55 5.561 -43.418 33.031 465 3HB ALA 55 HB3 ALA 55 4.047 -42.514 32.995 466 H LYS 56 HN LYS 56 6.916 -39.083 32.821 467 HA LYS 56 HA LYS 56 4.838 -37.696 34.160 468 1HB LYS 56 HB2 LYS 56 7.106 -36.992 34.506 469 2HB LYS 56 HB1 LYS 56 7.352 -36.734 32.787 470 1HG LYS 56 HG2 LYS 56 7.128 -34.622 33.979 471 2HG LYS 56 HG1 LYS 56 5.817 -34.843 32.822 472 1HD LYS 56 HD2 LYS 56 4.950 -33.925 34.895 473 2HD LYS 56 HD1 LYS 56 4.338 -35.563 34.666 474 1HE LYS 56 HE2 LYS 56 6.013 -36.413 36.231 475 2HE LYS 56 HE1 LYS 56 6.662 -34.787 36.434 476 1HZ LYS 56 HZ1 LYS 56 3.875 -35.555 37.098 477 2HZ LYS 56 HZ2 LYS 56 4.633 -34.086 37.441 478 3HZ LYS 56 HZ3 LYS 56 5.132 -35.497 38.224 479 H PHE 57 HN PHE 57 6.021 -37.518 30.798 480 HA PHE 57 HA PHE 57 3.539 -36.083 30.098 481 1HB PHE 57 HB2 PHE 57 6.188 -36.070 28.620 482 2HB PHE 57 HB1 PHE 57 4.748 -35.170 28.162 483 HD1 PHE 57 HD1 PHE 57 7.813 -35.028 29.893 484 HD2 PHE 57 HD2 PHE 57 3.829 -33.519 29.977 485 HE1 PHE 57 HE1 PHE 57 8.564 -33.131 31.268 486 HE2 PHE 57 HE2 PHE 57 4.575 -31.619 31.353 487 HZ PHE 57 HZ PHE 57 6.945 -31.423 31.999 488 H TYR 58 HN TYR 58 2.465 -36.665 28.196 489 HA TYR 58 HA TYR 58 3.184 -39.285 27.057 490 1HB TYR 58 HB2 TYR 58 0.378 -38.250 27.575 491 2HB TYR 58 HB1 TYR 58 0.807 -39.829 26.924 492 HD1 TYR 58 HD1 TYR 58 2.059 -41.459 28.426 493 HD2 TYR 58 HD2 TYR 58 0.274 -37.892 29.914 494 HE1 TYR 58 HE1 TYR 58 2.143 -42.372 30.709 495 HE2 TYR 58 HE2 TYR 58 0.354 -38.797 32.197 496 HH TYR 58 HH TYR 58 2.166 -41.543 33.027 497 H SER 59 HN SER 59 3.641 -39.107 24.966 498 HA SER 59 HA SER 59 2.988 -36.622 23.597 499 1HB SER 59 HB2 SER 59 4.767 -38.902 22.687 500 2HB SER 59 HB1 SER 59 4.675 -37.287 21.982 501 HG SER 59 HG SER 59 5.592 -37.977 24.579 502 H PHE 60 HN PHE 60 1.131 -36.552 22.573 503 HA PHE 60 HA PHE 60 0.192 -38.881 21.040 504 1HB PHE 60 HB2 PHE 60 -1.283 -36.380 21.919 505 2HB PHE 60 HB1 PHE 60 -1.979 -37.653 20.925 506 HD1 PHE 60 HD1 PHE 60 -0.887 -36.714 24.292 507 HD2 PHE 60 HD2 PHE 60 -2.577 -39.800 21.885 508 HE1 PHE 60 HE1 PHE 60 -1.595 -37.909 26.321 509 HE2 PHE 60 HE2 PHE 60 -3.285 -40.997 23.914 510 HZ PHE 60 HZ PHE 60 -2.796 -40.051 26.132 511 H ASN 61 HN ASN 61 -0.839 -38.357 18.954 512 HA ASN 61 HA ASN 61 0.118 -35.945 17.616 513 1HB ASN 61 HB2 ASN 61 1.843 -37.541 17.046 514 2HB ASN 61 HB1 ASN 61 0.648 -38.772 16.654 515 1HD2 ASN 61 HD21 ASN 61 -0.608 -38.524 14.744 516 2HD2 ASN 61 HD22 ASN 61 -0.063 -37.528 13.440 517 H VAL 62 HN VAL 62 -1.566 -35.057 16.649 518 HA VAL 62 HA VAL 62 -3.819 -36.766 15.821 519 HB VAL 62 HB VAL 62 -3.754 -33.777 16.344 520 1HG1 VAL 62 HG11 VAL 62 -5.363 -34.332 14.594 521 2HG1 VAL 62 HG12 VAL 62 -6.199 -33.867 16.076 522 3HG1 VAL 62 HG13 VAL 62 -6.085 -35.569 15.624 523 1HG2 VAL 62 HG21 VAL 62 -5.009 -36.017 17.944 524 2HG2 VAL 62 HG22 VAL 62 -5.163 -34.294 18.291 525 3HG2 VAL 62 HG23 VAL 62 -3.587 -35.078 18.403 526 H SER 63 HN SER 63 -3.881 -37.192 13.722 527 HA SER 63 HA SER 63 -2.945 -35.137 11.821 528 1HB SER 63 HB2 SER 63 -3.089 -38.145 11.435 529 2HB SER 63 HB1 SER 63 -2.536 -36.981 10.231 530 HG SER 63 HG SER 63 -0.694 -36.742 11.275 531 H MET 64 HN MET 64 -4.625 -34.081 11.001 532 HA MET 64 HA MET 64 -6.996 -35.563 10.127 533 1HB MET 64 HB2 MET 64 -8.525 -34.031 11.238 534 2HB MET 64 HB1 MET 64 -7.473 -34.776 12.434 535 1HG MET 64 HG2 MET 64 -6.085 -32.743 12.456 536 2HG MET 64 HG1 MET 64 -7.180 -32.000 11.293 537 1HE MET 64 HE1 MET 64 -10.004 -33.167 12.402 538 2HE MET 64 HE2 MET 64 -9.777 -31.509 11.842 539 3HE MET 64 HE3 MET 64 -10.506 -31.820 13.419 540 H GLU 65 HN GLU 65 -8.342 -34.315 8.660 541 HA GLU 65 HA GLU 65 -6.799 -32.635 6.914 542 1HB GLU 65 HB2 GLU 65 -9.740 -33.362 6.893 543 2HB GLU 65 HB1 GLU 65 -8.933 -32.449 5.626 544 1HG GLU 65 HG2 GLU 65 -7.491 -34.365 5.157 545 2HG GLU 65 HG1 GLU 65 -8.291 -35.280 6.435 546 H VAL 66 HN VAL 66 -6.826 -30.452 6.752 547 HA VAL 66 HA VAL 66 -8.919 -28.969 8.210 548 HB VAL 66 HB VAL 66 -7.306 -27.067 8.384 549 1HG1 VAL 66 HG11 VAL 66 -6.430 -29.644 9.703 550 2HG1 VAL 66 HG12 VAL 66 -7.659 -28.526 10.295 551 3HG1 VAL 66 HG13 VAL 66 -5.970 -28.023 10.226 552 1HG2 VAL 66 HG21 VAL 66 -5.794 -27.665 6.559 553 2HG2 VAL 66 HG22 VAL 66 -5.273 -29.102 7.438 554 3HG2 VAL 66 HG23 VAL 66 -4.900 -27.498 8.070 555 H SER 67 HN SER 67 -10.165 -27.699 6.975 556 HA SER 67 HA SER 67 -9.758 -27.821 4.114 557 1HB SER 67 HB2 SER 67 -11.996 -28.207 5.113 558 2HB SER 67 HB1 SER 67 -12.006 -26.550 5.710 559 HG SER 67 HG SER 67 -12.964 -27.280 3.478 560 H ASN 68 HN ASN 68 -9.503 -25.441 6.678 561 HA ASN 68 HA ASN 68 -8.257 -23.605 4.803 562 1HB ASN 68 HB2 ASN 68 -9.657 -21.693 5.423 563 2HB ASN 68 HB1 ASN 68 -10.629 -22.966 4.692 564 1HD2 ASN 68 HD21 ASN 68 -12.115 -24.049 5.923 565 2HD2 ASN 68 HD22 ASN 68 -12.598 -23.527 7.499 566 H GLU 69 HN GLU 69 -7.736 -21.506 6.043 567 HA GLU 69 HA GLU 69 -5.714 -22.104 7.895 568 1HB GLU 69 HB2 GLU 69 -5.622 -20.169 6.431 569 2HB GLU 69 HB1 GLU 69 -7.093 -19.512 7.127 570 1HG GLU 69 HG2 GLU 69 -5.322 -18.235 7.994 571 2HG GLU 69 HG1 GLU 69 -5.843 -19.294 9.301 572 H SER 70 HN SER 70 -8.966 -20.743 8.369 573 HA SER 70 HA SER 70 -8.666 -19.934 11.024 574 1HB SER 70 HB2 SER 70 -11.216 -20.894 9.693 575 2HB SER 70 HB1 SER 70 -11.096 -19.833 11.099 576 HG SER 70 HG SER 70 -11.247 -18.371 9.556 577 H GLU 71 HN GLU 71 -9.670 -23.047 9.669 578 HA GLU 71 HA GLU 71 -10.487 -24.206 12.107 579 1HB GLU 71 HB2 GLU 71 -9.512 -25.525 9.569 580 2HB GLU 71 HB1 GLU 71 -10.230 -26.387 10.925 581 1HG GLU 71 HG2 GLU 71 -12.284 -25.003 10.622 582 2HG GLU 71 HG1 GLU 71 -11.556 -24.345 9.158 583 H ARG 72 HN ARG 72 -7.387 -24.471 10.332 584 HA ARG 72 HA ARG 72 -6.256 -26.396 12.009 585 1HB ARG 72 HB2 ARG 72 -4.137 -25.880 11.027 586 2HB ARG 72 HB1 ARG 72 -5.348 -25.700 9.776 587 1HG ARG 72 HG2 ARG 72 -5.180 -23.356 9.805 588 2HG ARG 72 HG1 ARG 72 -4.310 -23.354 11.341 589 1HD ARG 72 HD2 ARG 72 -2.410 -24.479 10.239 590 2HD ARG 72 HD1 ARG 72 -3.280 -24.415 8.705 591 HE ARG 72 HE ARG 72 -3.200 -21.944 8.956 592 1HH1 ARG 72 HH11 ARG 72 -0.807 -23.922 10.577 593 2HH1 ARG 72 HH12 ARG 72 0.375 -22.657 10.629 594 1HH2 ARG 72 HH21 ARG 72 -1.662 -20.293 9.033 595 2HH2 ARG 72 HH22 ARG 72 -0.102 -20.596 9.742 596 H ASN 73 HN ASN 73 -6.402 -22.908 12.345 597 HA ASN 73 HA ASN 73 -4.614 -22.859 14.615 598 1HB ASN 73 HB2 ASN 73 -6.400 -20.700 13.456 599 2HB ASN 73 HB1 ASN 73 -5.211 -20.452 14.733 600 1HD2 ASN 73 HD21 ASN 73 -5.385 -19.269 12.061 601 2HD2 ASN 73 HD22 ASN 73 -3.889 -19.646 11.282 602 H GLU 74 HN GLU 74 -8.093 -22.740 14.047 603 HA GLU 74 HA GLU 74 -8.904 -22.182 16.684 604 1HB GLU 74 HB2 GLU 74 -10.504 -21.967 14.908 605 2HB GLU 74 HB1 GLU 74 -10.291 -23.646 14.428 606 1HG GLU 74 HG2 GLU 74 -11.394 -24.437 16.378 607 2HG GLU 74 HG1 GLU 74 -11.401 -22.833 17.106 608 H ILE 75 HN ILE 75 -8.434 -25.240 14.978 609 HA ILE 75 HA ILE 75 -9.128 -26.997 17.034 610 HB ILE 75 HB ILE 75 -7.117 -27.389 14.799 611 1HG1 ILE 75 HG12 ILE 75 -10.029 -28.219 14.919 612 2HG1 ILE 75 HG11 ILE 75 -9.473 -26.739 14.150 613 1HG2 ILE 75 HG21 ILE 75 -7.522 -29.800 15.109 614 2HG2 ILE 75 HG22 ILE 75 -8.529 -29.442 16.513 615 3HG2 ILE 75 HG23 ILE 75 -6.807 -29.064 16.544 616 1HD1 ILE 75 HD11 ILE 75 -9.859 -28.465 12.515 617 2HD1 ILE 75 HD12 ILE 75 -8.733 -29.541 13.347 618 3HD1 ILE 75 HD13 ILE 75 -8.143 -28.062 12.586 619 H PHE 76 HN PHE 76 -6.036 -25.494 16.198 620 HA PHE 76 HA PHE 76 -4.392 -26.714 18.092 621 1HB PHE 76 HB2 PHE 76 -3.559 -25.261 16.281 622 2HB PHE 76 HB1 PHE 76 -4.293 -23.863 17.054 623 HD1 PHE 76 HD1 PHE 76 -3.228 -22.761 18.892 624 HD2 PHE 76 HD2 PHE 76 -1.601 -26.369 17.308 625 HE1 PHE 76 HE1 PHE 76 -1.154 -22.377 20.155 626 HE2 PHE 76 HE2 PHE 76 0.476 -25.989 18.573 627 HZ PHE 76 HZ PHE 76 0.702 -23.992 19.998 628 H GLN 77 HN GLN 77 -6.442 -23.838 18.347 629 HA GLN 77 HA GLN 77 -5.818 -23.199 21.034 630 1HB GLN 77 HB2 GLN 77 -8.308 -22.592 19.420 631 2HB GLN 77 HB1 GLN 77 -7.901 -21.846 20.960 632 1HG GLN 77 HG2 GLN 77 -5.918 -20.837 19.977 633 2HG GLN 77 HG1 GLN 77 -6.260 -21.630 18.440 634 1HE2 GLN 77 HE21 GLN 77 -7.181 -19.086 20.622 635 2HE2 GLN 77 HE22 GLN 77 -8.220 -18.244 19.524 636 H LYS 78 HN LYS 78 -8.387 -25.139 19.562 637 HA LYS 78 HA LYS 78 -9.895 -25.756 21.818 638 1HB LYS 78 HB2 LYS 78 -9.294 -27.451 19.381 639 2HB LYS 78 HB1 LYS 78 -10.530 -27.839 20.566 640 1HG LYS 78 HG2 LYS 78 -10.504 -25.286 18.968 641 2HG LYS 78 HG1 LYS 78 -11.353 -26.749 18.467 642 1HD LYS 78 HD2 LYS 78 -12.679 -26.677 20.539 643 2HD LYS 78 HD1 LYS 78 -11.838 -25.203 21.020 644 1HE LYS 78 HE2 LYS 78 -12.758 -24.002 19.144 645 2HE LYS 78 HE1 LYS 78 -13.465 -25.480 18.491 646 1HZ LYS 78 HZ1 LYS 78 -15.077 -24.066 19.667 647 2HZ LYS 78 HZ2 LYS 78 -14.204 -24.280 21.103 648 3HZ LYS 78 HZ3 LYS 78 -14.939 -25.605 20.357 649 H ILE 79 HN ILE 79 -7.056 -27.373 20.476 650 HA ILE 79 HA ILE 79 -6.928 -29.508 22.309 651 HB ILE 79 HB ILE 79 -4.675 -28.201 20.756 652 1HG1 ILE 79 HG12 ILE 79 -6.349 -30.652 20.109 653 2HG1 ILE 79 HG11 ILE 79 -6.527 -29.075 19.349 654 1HG2 ILE 79 HG21 ILE 79 -3.467 -30.320 21.075 655 2HG2 ILE 79 HG22 ILE 79 -4.774 -30.907 22.104 656 3HG2 ILE 79 HG23 ILE 79 -3.804 -29.524 22.612 657 1HD1 ILE 79 HD11 ILE 79 -4.267 -29.260 18.440 658 2HD1 ILE 79 HD12 ILE 79 -5.299 -30.595 17.924 659 3HD1 ILE 79 HD13 ILE 79 -4.101 -30.848 19.193 660 H SER 80 HN SER 80 -5.913 -26.193 22.509 661 HA SER 80 HA SER 80 -4.198 -26.535 24.785 662 1HB SER 80 HB2 SER 80 -3.968 -24.692 23.108 663 2HB SER 80 HB1 SER 80 -5.463 -23.996 23.732 664 HG SER 80 HG SER 80 -3.531 -23.088 24.651 665 H GLN 81 HN GLN 81 -7.567 -26.396 24.337 666 HA GLN 81 HA GLN 81 -8.177 -25.077 26.848 667 1HB GLN 81 HB2 GLN 81 -9.988 -26.327 24.770 668 2HB GLN 81 HB1 GLN 81 -10.542 -25.435 26.182 669 1HG GLN 81 HG2 GLN 81 -9.416 -23.425 25.358 670 2HG GLN 81 HG1 GLN 81 -8.860 -24.316 23.943 671 1HE2 GLN 81 HE21 GLN 81 -11.386 -25.799 23.692 672 2HE2 GLN 81 HE22 GLN 81 -12.530 -24.671 23.054 673 H LEU 82 HN LEU 82 -7.193 -28.137 26.185 674 HA LEU 82 HA LEU 82 -9.170 -29.651 27.609 675 1HB LEU 82 HB2 LEU 82 -6.358 -30.646 27.254 676 2HB LEU 82 HB1 LEU 82 -7.864 -31.539 27.235 677 HG LEU 82 HG LEU 82 -6.882 -29.710 25.046 678 1HD1 LEU 82 HD11 LEU 82 -7.126 -32.713 25.128 679 2HD1 LEU 82 HD12 LEU 82 -5.627 -31.782 25.138 680 3HD1 LEU 82 HD13 LEU 82 -6.673 -31.749 23.720 681 1HD2 LEU 82 HD21 LEU 82 -9.298 -29.628 25.200 682 2HD2 LEU 82 HD22 LEU 82 -9.380 -31.392 25.178 683 3HD2 LEU 82 HD23 LEU 82 -8.800 -30.515 23.761 684 H ASP 83 HN ASP 83 -6.574 -27.671 28.562 685 HA ASP 83 HA ASP 83 -5.782 -27.043 30.601 686 1HB ASP 83 HB2 ASP 83 -7.929 -27.196 31.619 687 2HB ASP 83 HB1 ASP 83 -7.907 -28.955 31.585 688 H LYS 84 HN LYS 84 -5.890 -30.374 29.728 689 HA LYS 84 HA LYS 84 -3.909 -31.224 31.662 690 1HB LYS 84 HB2 LYS 84 -5.341 -32.693 29.447 691 2HB LYS 84 HB1 LYS 84 -4.307 -33.443 30.660 692 1HG LYS 84 HG2 LYS 84 -5.835 -33.175 32.343 693 2HG LYS 84 HG1 LYS 84 -6.575 -31.758 31.595 694 1HD LYS 84 HD2 LYS 84 -7.682 -33.131 29.962 695 2HD LYS 84 HD1 LYS 84 -6.846 -34.569 30.538 696 1HE LYS 84 HE2 LYS 84 -8.838 -32.907 32.082 697 2HE LYS 84 HE1 LYS 84 -9.113 -34.498 31.391 698 1HZ LYS 84 HZ1 LYS 84 -8.672 -34.573 33.778 699 2HZ LYS 84 HZ2 LYS 84 -7.142 -33.907 33.524 700 3HZ LYS 84 HZ3 LYS 84 -7.510 -35.432 32.899 701 H VAL 85 HN VAL 85 -3.770 -29.670 28.767 702 HA VAL 85 HA VAL 85 -1.557 -31.168 27.608 703 HB VAL 85 HB VAL 85 -3.309 -30.303 26.114 704 1HG1 VAL 85 HG11 VAL 85 -3.524 -27.899 25.690 705 2HG1 VAL 85 HG12 VAL 85 -2.383 -27.564 26.990 706 3HG1 VAL 85 HG13 VAL 85 -3.942 -28.305 27.353 707 1HG2 VAL 85 HG21 VAL 85 -1.850 -29.247 24.444 708 2HG2 VAL 85 HG22 VAL 85 -1.061 -30.619 25.220 709 3HG2 VAL 85 HG23 VAL 85 -0.627 -28.975 25.686 710 H VAL 86 HN VAL 86 0.527 -30.331 27.326 711 HA VAL 86 HA VAL 86 1.162 -27.924 28.919 712 HB VAL 86 HB VAL 86 3.324 -28.933 29.499 713 1HG1 VAL 86 HG11 VAL 86 2.510 -30.625 31.082 714 2HG1 VAL 86 HG12 VAL 86 0.970 -30.689 30.221 715 3HG1 VAL 86 HG13 VAL 86 1.460 -29.208 31.046 716 1HG2 VAL 86 HG21 VAL 86 3.760 -31.313 29.057 717 2HG2 VAL 86 HG22 VAL 86 3.624 -30.388 27.563 718 3HG2 VAL 86 HG23 VAL 86 2.284 -31.403 28.095 719 H GLN 87 HN GLN 87 1.524 -29.596 25.917 720 HA GLN 87 HA GLN 87 2.898 -27.369 24.723 721 1HB GLN 87 HB2 GLN 87 4.793 -28.536 25.756 722 2HB GLN 87 HB1 GLN 87 4.320 -30.035 24.973 723 1HG GLN 87 HG2 GLN 87 6.219 -28.963 23.862 724 2HG GLN 87 HG1 GLN 87 4.821 -29.108 22.800 725 1HE2 GLN 87 HE21 GLN 87 6.827 -26.921 24.618 726 2HE2 GLN 87 HE22 GLN 87 6.279 -25.469 23.856 727 H THR 88 HN THR 88 2.522 -27.261 22.565 728 HA THR 88 HA THR 88 1.546 -29.621 21.132 729 HB THR 88 HB THR 88 -0.247 -28.097 20.078 730 HG1 THR 88 HG1 THR 88 0.784 -26.238 21.378 731 1HG2 THR 88 HG21 THR 88 -0.555 -28.938 22.965 732 2HG2 THR 88 HG22 THR 88 -0.818 -29.961 21.553 733 3HG2 THR 88 HG23 THR 88 -1.876 -28.583 21.852 734 H LEU 89 HN LEU 89 2.817 -29.804 19.404 735 HA LEU 89 HA LEU 89 3.866 -27.368 18.116 736 1HB LEU 89 HB2 LEU 89 4.801 -30.241 17.878 737 2HB LEU 89 HB1 LEU 89 5.494 -28.886 17.011 738 HG LEU 89 HG LEU 89 6.063 -27.892 19.296 739 1HD1 LEU 89 HD11 LEU 89 4.587 -29.263 20.661 740 2HD1 LEU 89 HD12 LEU 89 6.267 -29.469 21.153 741 3HD1 LEU 89 HD13 LEU 89 5.472 -30.713 20.188 742 1HD2 LEU 89 HD21 LEU 89 7.737 -28.880 17.815 743 2HD2 LEU 89 HD22 LEU 89 7.393 -30.478 18.478 744 3HD2 LEU 89 HD23 LEU 89 8.098 -29.228 19.505 745 H GLY 90 HN GLY 90 2.771 -26.725 16.366 746 1HA GLY 90 HA2 GLY 90 2.016 -28.648 14.322 747 2HA GLY 90 HA1 GLY 90 0.670 -27.828 15.103 748 H SER 91 HN SER 91 3.835 -26.463 14.375 749 HA SER 91 HA SER 91 2.534 -24.352 12.837 750 1HB SER 91 HB2 SER 91 5.335 -24.528 13.986 751 2HB SER 91 HB1 SER 91 4.617 -23.116 13.222 752 HG SER 91 HG SER 91 2.913 -23.439 14.936 Start of MODEL 6 1 1H GLN 1 HT1 GLN 1 21.546 -7.083 -2.104 2 2H GLN 1 HT2 GLN 1 21.391 -5.588 -2.882 3 3H GLN 1 HT3 GLN 1 20.843 -6.996 -3.637 4 HA GLN 1 HA GLN 1 19.147 -7.301 -2.001 5 1HB GLN 1 HB2 GLN 1 20.235 -4.723 -0.833 6 2HB GLN 1 HB1 GLN 1 18.738 -5.498 -0.329 7 1HG GLN 1 HG2 GLN 1 20.007 -7.465 0.405 8 2HG GLN 1 HG1 GLN 1 21.505 -6.676 -0.090 9 1HE2 GLN 1 HE21 GLN 1 22.362 -6.720 1.986 10 2HE2 GLN 1 HE22 GLN 1 21.766 -5.711 3.261 11 H GLY 2 HN GLY 2 17.114 -6.566 -2.536 12 1HA GLY 2 HA2 GLY 2 15.854 -4.468 -3.241 13 2HA GLY 2 HA1 GLY 2 17.036 -4.390 -4.542 14 H HIS 3 HN HIS 3 16.318 -5.162 -6.414 15 HA HIS 3 HA HIS 3 13.950 -6.691 -6.680 16 1HB HIS 3 HB2 HIS 3 16.200 -6.168 -8.643 17 2HB HIS 3 HB1 HIS 3 14.694 -6.975 -9.068 18 HD1 HIS 3 HD1 HIS 3 16.131 -3.615 -8.300 19 HD2 HIS 3 HD2 HIS 3 12.440 -5.302 -9.209 20 HE1 HIS 3 HE1 HIS 3 14.612 -1.682 -8.831 21 HE2 HIS 3 HE2 HIS 3 12.343 -2.720 -9.180 22 H MET 4 HN MET 4 13.619 -8.823 -6.579 23 HA MET 4 HA MET 4 15.960 -10.545 -6.109 24 1HB MET 4 HB2 MET 4 13.062 -10.829 -5.284 25 2HB MET 4 HB1 MET 4 14.276 -12.076 -5.029 26 1HG MET 4 HG2 MET 4 15.507 -10.675 -3.538 27 2HG MET 4 HG1 MET 4 14.501 -9.282 -3.930 28 1HE MET 4 HE1 MET 4 12.809 -12.969 -1.712 29 2HE MET 4 HE2 MET 4 14.447 -12.916 -2.366 30 3HE MET 4 HE3 MET 4 13.061 -12.910 -3.456 31 HA PRO 5 HA PRO 5 14.949 -12.303 -10.209 32 1HB PRO 5 HB2 PRO 5 17.299 -13.953 -9.397 33 2HB PRO 5 HB1 PRO 5 16.992 -13.102 -10.916 34 1HG PRO 5 HG2 PRO 5 18.758 -12.152 -9.160 35 2HG PRO 5 HG1 PRO 5 17.695 -11.056 -10.065 36 1HD PRO 5 HD2 PRO 5 17.492 -11.976 -7.220 37 2HD PRO 5 HD1 PRO 5 17.171 -10.372 -7.913 38 H SER 6 HN SER 6 15.554 -13.823 -7.115 39 HA SER 6 HA SER 6 13.737 -16.025 -7.851 40 1HB SER 6 HB2 SER 6 14.785 -17.228 -5.888 41 2HB SER 6 HB1 SER 6 15.887 -16.922 -7.230 42 HG SER 6 HG SER 6 15.670 -15.407 -4.834 43 H ASP 7 HN ASP 7 11.844 -14.939 -7.408 44 HA ASP 7 HA ASP 7 11.352 -13.373 -5.114 45 1HB ASP 7 HB2 ASP 7 8.920 -13.701 -5.726 46 2HB ASP 7 HB1 ASP 7 9.936 -13.059 -7.012 47 H SER 8 HN SER 8 10.117 -13.812 -3.264 48 HA SER 8 HA SER 8 10.299 -16.589 -2.344 49 1HB SER 8 HB2 SER 8 9.835 -15.522 -0.081 50 2HB SER 8 HB1 SER 8 11.348 -15.036 -0.848 51 HG SER 8 HG SER 8 9.035 -13.510 -1.311 52 H LYS 9 HN LYS 9 8.538 -17.817 -2.049 53 HA LYS 9 HA LYS 9 5.883 -16.537 -2.204 54 1HB LYS 9 HB2 LYS 9 5.136 -18.455 -3.590 55 2HB LYS 9 HB1 LYS 9 6.383 -17.494 -4.374 56 1HG LYS 9 HG2 LYS 9 8.056 -19.203 -3.540 57 2HG LYS 9 HG1 LYS 9 6.673 -20.202 -3.087 58 1HD LYS 9 HD2 LYS 9 7.537 -20.854 -5.278 59 2HD LYS 9 HD1 LYS 9 5.907 -20.196 -5.423 60 1HE LYS 9 HE2 LYS 9 6.781 -18.080 -6.200 61 2HE LYS 9 HE1 LYS 9 8.435 -18.614 -5.908 62 1HZ LYS 9 HZ1 LYS 9 7.804 -18.736 -8.250 63 2HZ LYS 9 HZ2 LYS 9 6.578 -19.841 -7.875 64 3HZ LYS 9 HZ3 LYS 9 8.195 -20.259 -7.630 65 H LYS 10 HN LYS 10 4.149 -18.300 -1.644 66 HA LYS 10 HA LYS 10 5.039 -19.685 0.807 67 1HB LYS 10 HB2 LYS 10 2.332 -18.469 0.180 68 2HB LYS 10 HB1 LYS 10 2.726 -19.353 1.646 69 1HG LYS 10 HG2 LYS 10 4.351 -16.946 0.940 70 2HG LYS 10 HG1 LYS 10 2.725 -16.719 1.578 71 1HD LYS 10 HD2 LYS 10 4.262 -16.614 3.414 72 2HD LYS 10 HD1 LYS 10 3.367 -18.124 3.545 73 1HE LYS 10 HE2 LYS 10 5.258 -19.358 2.656 74 2HE LYS 10 HE1 LYS 10 6.142 -17.857 2.379 75 1HZ LYS 10 HZ1 LYS 10 6.839 -19.010 4.410 76 2HZ LYS 10 HZ2 LYS 10 5.278 -18.844 5.047 77 3HZ LYS 10 HZ3 LYS 10 6.215 -17.473 4.739 78 HA PRO 11 HA PRO 11 3.879 -23.440 -1.338 79 1HB PRO 11 HB2 PRO 11 3.557 -24.508 1.422 80 2HB PRO 11 HB1 PRO 11 4.552 -25.110 0.091 81 1HG PRO 11 HG2 PRO 11 5.660 -23.861 2.178 82 2HG PRO 11 HG1 PRO 11 6.278 -23.620 0.533 83 1HD PRO 11 HD2 PRO 11 4.537 -21.826 2.189 84 2HD PRO 11 HD1 PRO 11 5.876 -21.405 1.100 85 H THR 12 HN THR 12 1.943 -24.115 -2.052 86 HA THR 12 HA THR 12 -0.461 -23.092 -0.853 87 HB THR 12 HB THR 12 -0.121 -24.956 -3.220 88 HG1 THR 12 HG1 THR 12 0.833 -22.967 -3.653 89 1HG2 THR 12 HG21 THR 12 -2.393 -24.237 -3.835 90 2HG2 THR 12 HG22 THR 12 -2.504 -23.308 -2.340 91 3HG2 THR 12 HG23 THR 12 -2.384 -25.067 -2.279 92 H ILE 13 HN ILE 13 -1.257 -24.046 0.896 93 HA ILE 13 HA ILE 13 -1.001 -26.913 1.318 94 HB ILE 13 HB ILE 13 -2.318 -24.802 3.052 95 1HG1 ILE 13 HG12 ILE 13 0.108 -24.426 2.783 96 2HG1 ILE 13 HG11 ILE 13 -0.281 -24.926 4.426 97 1HG2 ILE 13 HG21 ILE 13 -1.580 -27.666 3.677 98 2HG2 ILE 13 HG22 ILE 13 -3.213 -27.022 3.501 99 3HG2 ILE 13 HG23 ILE 13 -2.196 -26.489 4.839 100 1HD1 ILE 13 HD11 ILE 13 0.877 -26.676 2.265 101 2HD1 ILE 13 HD12 ILE 13 0.465 -27.201 3.898 102 3HD1 ILE 13 HD13 ILE 13 1.738 -26.007 3.650 103 H ILE 14 HN ILE 14 -2.588 -28.349 0.965 104 HA ILE 14 HA ILE 14 -4.874 -27.468 -0.545 105 HB ILE 14 HB ILE 14 -3.888 -30.219 0.234 106 1HG1 ILE 14 HG12 ILE 14 -3.628 -30.448 -2.262 107 2HG1 ILE 14 HG11 ILE 14 -4.060 -28.750 -2.418 108 1HG2 ILE 14 HG21 ILE 14 -6.314 -30.324 0.213 109 2HG2 ILE 14 HG22 ILE 14 -5.663 -31.158 -1.198 110 3HG2 ILE 14 HG23 ILE 14 -6.360 -29.546 -1.369 111 1HD1 ILE 14 HD11 ILE 14 -2.083 -28.124 -1.148 112 2HD1 ILE 14 HD12 ILE 14 -1.657 -29.099 -2.554 113 3HD1 ILE 14 HD13 ILE 14 -1.664 -29.825 -0.946 114 H TYR 15 HN TYR 15 -6.890 -27.240 0.133 115 HA TYR 15 HA TYR 15 -7.745 -28.490 2.654 116 1HB TYR 15 HB2 TYR 15 -8.232 -25.638 1.753 117 2HB TYR 15 HB1 TYR 15 -9.200 -26.418 2.996 118 HD1 TYR 15 HD1 TYR 15 -8.188 -27.008 5.172 119 HD2 TYR 15 HD2 TYR 15 -5.987 -24.852 2.231 120 HE1 TYR 15 HE1 TYR 15 -6.573 -26.323 6.891 121 HE2 TYR 15 HE2 TYR 15 -4.365 -24.161 3.948 122 HH TYR 15 HH TYR 15 -4.113 -25.594 6.933 123 HA PRO 16 HA PRO 16 -9.424 -29.291 3.597 124 1HB PRO 16 HB2 PRO 16 -10.783 -31.801 2.972 125 2HB PRO 16 HB1 PRO 16 -11.270 -30.522 4.087 126 1HG PRO 16 HG2 PRO 16 -12.599 -31.039 1.775 127 2HG PRO 16 HG1 PRO 16 -12.506 -29.418 2.490 128 1HD PRO 16 HD2 PRO 16 -10.898 -30.588 0.235 129 2HD PRO 16 HD1 PRO 16 -11.652 -28.982 0.364 130 H CYS 17 HN CYS 17 -8.113 -30.829 4.610 131 HA CYS 17 HA CYS 17 -7.074 -33.155 3.372 132 1HB CYS 17 HB2 CYS 17 -5.771 -31.454 2.093 133 2HB CYS 17 HB1 CYS 17 -5.126 -30.839 3.611 134 HG CYS 17 HG CYS 17 -4.485 -33.856 2.142 135 H LEU 18 HN LEU 18 -5.005 -33.853 4.777 136 HA LEU 18 HA LEU 18 -5.989 -33.791 7.509 137 1HB LEU 18 HB2 LEU 18 -3.711 -35.342 6.262 138 2HB LEU 18 HB1 LEU 18 -4.317 -35.563 7.894 139 HG LEU 18 HG LEU 18 -5.976 -36.017 5.408 140 1HD1 LEU 18 HD11 LEU 18 -4.135 -37.610 5.472 141 2HD1 LEU 18 HD12 LEU 18 -5.669 -38.408 5.819 142 3HD1 LEU 18 HD13 LEU 18 -4.549 -38.042 7.132 143 1HD2 LEU 18 HD21 LEU 18 -7.492 -37.184 6.944 144 2HD2 LEU 18 HD22 LEU 18 -7.295 -35.488 7.385 145 3HD2 LEU 18 HD23 LEU 18 -6.454 -36.741 8.301 146 H TRP 19 HN TRP 19 -5.056 -32.780 9.172 147 HA TRP 19 HA TRP 19 -2.415 -31.508 8.785 148 1HB TRP 19 HB2 TRP 19 -4.311 -29.864 8.696 149 2HB TRP 19 HB1 TRP 19 -4.755 -30.342 10.330 150 HD1 TRP 19 HD1 TRP 19 -2.958 -29.689 12.305 151 HE1 TRP 19 HE1 TRP 19 -1.294 -27.735 12.449 152 HE3 TRP 19 HE3 TRP 19 -2.846 -28.355 7.367 153 HZ2 TRP 19 HZ2 TRP 19 -0.098 -25.867 10.705 154 HZ3 TRP 19 HZ3 TRP 19 -1.419 -26.467 6.689 155 HH2 TRP 19 HH2 TRP 19 -0.074 -25.247 8.325 156 H ASP 20 HN ASP 20 -0.950 -31.957 10.354 157 HA ASP 20 HA ASP 20 -1.782 -33.718 12.524 158 1HB ASP 20 HB2 ASP 20 0.947 -32.888 11.516 159 2HB ASP 20 HB1 ASP 20 0.716 -33.891 12.943 160 H TYR 21 HN TYR 21 -2.292 -32.944 14.412 161 HA TYR 21 HA TYR 21 -1.241 -30.392 15.389 162 1HB TYR 21 HB2 TYR 21 -3.467 -32.173 16.446 163 2HB TYR 21 HB1 TYR 21 -2.998 -30.622 17.137 164 HD1 TYR 21 HD1 TYR 21 -3.632 -28.543 16.066 165 HD2 TYR 21 HD2 TYR 21 -4.669 -32.280 14.312 166 HE1 TYR 21 HE1 TYR 21 -5.223 -27.398 14.580 167 HE2 TYR 21 HE2 TYR 21 -6.258 -31.145 12.822 168 HH TYR 21 HH TYR 21 -7.581 -29.020 12.835 169 H ARG 22 HN ARG 22 -0.073 -30.268 17.331 170 HA ARG 22 HA ARG 22 0.872 -32.860 18.384 171 1HB ARG 22 HB2 ARG 22 2.558 -31.277 17.341 172 2HB ARG 22 HB1 ARG 22 2.244 -30.181 18.678 173 1HG ARG 22 HG2 ARG 22 4.263 -31.502 19.046 174 2HG ARG 22 HG1 ARG 22 3.036 -31.852 20.265 175 1HD ARG 22 HD2 ARG 22 4.255 -33.859 19.315 176 2HD ARG 22 HD1 ARG 22 2.494 -33.932 19.260 177 HE ARG 22 HE ARG 22 2.650 -33.333 16.887 178 1HH1 ARG 22 HH11 ARG 22 5.532 -34.597 18.428 179 2HH1 ARG 22 HH12 ARG 22 6.237 -35.126 16.933 180 1HH2 ARG 22 HH21 ARG 22 3.568 -34.038 14.941 181 2HH2 ARG 22 HH22 ARG 22 5.127 -34.808 14.958 182 H VAL 23 HN VAL 23 -0.015 -33.413 20.242 183 HA VAL 23 HA VAL 23 -1.060 -31.304 22.026 184 HB VAL 23 HB VAL 23 -2.006 -34.177 21.858 185 1HG1 VAL 23 HG11 VAL 23 -3.960 -33.345 23.093 186 2HG1 VAL 23 HG12 VAL 23 -3.229 -31.741 23.162 187 3HG1 VAL 23 HG13 VAL 23 -2.463 -33.095 23.992 188 1HG2 VAL 23 HG21 VAL 23 -2.457 -33.104 19.725 189 2HG2 VAL 23 HG22 VAL 23 -3.199 -31.729 20.544 190 3HG2 VAL 23 HG23 VAL 23 -3.961 -33.318 20.621 191 H ILE 24 HN ILE 24 0.388 -31.028 23.647 192 HA ILE 24 HA ILE 24 1.701 -33.384 24.810 193 HB ILE 24 HB ILE 24 2.227 -30.440 25.318 194 1HG1 ILE 24 HG12 ILE 24 3.779 -32.492 23.706 195 2HG1 ILE 24 HG11 ILE 24 2.868 -31.137 23.047 196 1HG2 ILE 24 HG21 ILE 24 2.776 -31.804 27.267 197 2HG2 ILE 24 HG22 ILE 24 4.246 -31.212 26.494 198 3HG2 ILE 24 HG23 ILE 24 3.739 -32.886 26.259 199 1HD1 ILE 24 HD11 ILE 24 5.231 -30.658 23.038 200 2HD1 ILE 24 HD12 ILE 24 5.330 -30.966 24.771 201 3HD1 ILE 24 HD13 ILE 24 4.407 -29.587 24.173 202 H MET 25 HN MET 25 0.469 -34.353 26.272 203 HA MET 25 HA MET 25 -1.123 -32.728 28.153 204 1HB MET 25 HB2 MET 25 -1.427 -35.667 27.461 205 2HB MET 25 HB1 MET 25 -2.496 -34.725 28.488 206 1HG MET 25 HG2 MET 25 -3.269 -33.434 26.643 207 2HG MET 25 HG1 MET 25 -2.031 -34.101 25.581 208 1HE MET 25 HE1 MET 25 -5.370 -34.858 27.548 209 2HE MET 25 HE2 MET 25 -4.245 -36.042 28.215 210 3HE MET 25 HE3 MET 25 -5.587 -36.574 27.202 211 H THR 26 HN THR 26 -1.367 -33.814 30.362 212 HA THR 26 HA THR 26 1.275 -34.718 31.286 213 HB THR 26 HB THR 26 0.286 -34.234 33.585 214 HG1 THR 26 HG1 THR 26 -1.546 -32.567 33.195 215 1HG2 THR 26 HG21 THR 26 1.822 -32.672 32.477 216 2HG2 THR 26 HG22 THR 26 0.586 -31.804 33.389 217 3HG2 THR 26 HG23 THR 26 0.464 -31.926 31.633 218 H THR 27 HN THR 27 -1.117 -36.247 30.014 219 HA THR 27 HA THR 27 -0.991 -38.563 31.765 220 HB THR 27 HB THR 27 -2.958 -37.219 32.578 221 HG1 THR 27 HG1 THR 27 -4.420 -39.016 32.469 222 1HG2 THR 27 HG21 THR 27 -4.074 -37.797 29.829 223 2HG2 THR 27 HG22 THR 27 -3.592 -36.210 30.431 224 3HG2 THR 27 HG23 THR 27 -4.948 -37.061 31.172 225 H LYS 28 HN LYS 28 -1.933 -40.495 30.676 226 HA LYS 28 HA LYS 28 -1.853 -40.238 27.754 227 1HB LYS 28 HB2 LYS 28 -1.742 -42.707 29.501 228 2HB LYS 28 HB1 LYS 28 -1.769 -42.737 27.743 229 1HG LYS 28 HG2 LYS 28 0.335 -41.301 27.845 230 2HG LYS 28 HG1 LYS 28 0.399 -41.719 29.559 231 1HD LYS 28 HD2 LYS 28 0.432 -43.660 27.238 232 2HD LYS 28 HD1 LYS 28 1.810 -43.221 28.248 233 1HE LYS 28 HE2 LYS 28 0.693 -44.196 30.198 234 2HE LYS 28 HE1 LYS 28 -0.700 -44.612 29.200 235 1HZ LYS 28 HZ1 LYS 28 2.053 -45.663 28.843 236 2HZ LYS 28 HZ2 LYS 28 0.716 -46.064 27.891 237 3HZ LYS 28 HZ3 LYS 28 0.755 -46.508 29.522 238 H ASP 29 HN ASP 29 -4.073 -39.913 30.036 239 HA ASP 29 HA ASP 29 -6.180 -41.561 28.964 240 1HB ASP 29 HB2 ASP 29 -6.264 -41.032 31.334 241 2HB ASP 29 HB1 ASP 29 -6.231 -39.305 30.990 242 H THR 30 HN THR 30 -5.949 -40.864 26.770 243 HA THR 30 HA THR 30 -6.972 -38.180 26.226 244 HB THR 30 HB THR 30 -5.010 -38.670 24.945 245 HG1 THR 30 HG1 THR 30 -5.871 -38.454 22.827 246 1HG2 THR 30 HG21 THR 30 -5.034 -41.114 25.046 247 2HG2 THR 30 HG22 THR 30 -4.847 -40.558 23.383 248 3HG2 THR 30 HG23 THR 30 -6.409 -41.157 23.941 249 H SER 31 HN SER 31 -9.113 -38.230 26.500 250 HA SER 31 HA SER 31 -10.648 -40.141 24.870 251 1HB SER 31 HB2 SER 31 -10.801 -40.666 27.310 252 2HB SER 31 HB1 SER 31 -11.474 -39.059 27.582 253 HG SER 31 HG SER 31 -13.292 -40.072 27.247 254 H THR 32 HN THR 32 -11.225 -37.156 26.766 255 HA THR 32 HA THR 32 -13.191 -36.012 25.226 256 HB THR 32 HB THR 32 -10.947 -34.391 26.454 257 HG1 THR 32 HG1 THR 32 -13.209 -35.277 27.908 258 1HG2 THR 32 HG21 THR 32 -12.771 -32.817 26.979 259 2HG2 THR 32 HG22 THR 32 -13.925 -33.893 26.190 260 3HG2 THR 32 HG23 THR 32 -12.655 -33.113 25.244 261 H LEU 33 HN LEU 33 -9.720 -36.021 24.719 262 HA LEU 33 HA LEU 33 -9.488 -34.150 22.669 263 1HB LEU 33 HB2 LEU 33 -7.581 -35.123 23.877 264 2HB LEU 33 HB1 LEU 33 -7.890 -36.677 23.127 265 HG LEU 33 HG LEU 33 -7.334 -35.732 20.919 266 1HD1 LEU 33 HD11 LEU 33 -8.015 -33.424 21.295 267 2HD1 LEU 33 HD12 LEU 33 -6.343 -33.500 20.742 268 3HD1 LEU 33 HD13 LEU 33 -6.695 -33.206 22.446 269 1HD2 LEU 33 HD21 LEU 33 -5.207 -35.251 23.015 270 2HD2 LEU 33 HD22 LEU 33 -4.925 -35.458 21.285 271 3HD2 LEU 33 HD23 LEU 33 -5.572 -36.793 22.239 272 H LYS 34 HN LYS 34 -10.204 -37.624 22.526 273 HA LYS 34 HA LYS 34 -10.304 -37.686 19.659 274 1HB LYS 34 HB2 LYS 34 -11.338 -39.681 21.688 275 2HB LYS 34 HB1 LYS 34 -11.200 -39.967 19.957 276 1HG LYS 34 HG2 LYS 34 -8.760 -39.680 20.116 277 2HG LYS 34 HG1 LYS 34 -8.916 -39.442 21.858 278 1HD LYS 34 HD2 LYS 34 -9.676 -41.935 20.322 279 2HD LYS 34 HD1 LYS 34 -8.256 -41.741 21.352 280 1HE LYS 34 HE2 LYS 34 -9.700 -41.419 23.299 281 2HE LYS 34 HE1 LYS 34 -11.128 -41.559 22.277 282 1HZ LYS 34 HZ1 LYS 34 -9.116 -43.693 22.740 283 2HZ LYS 34 HZ2 LYS 34 -10.487 -43.826 21.756 284 3HZ LYS 34 HZ3 LYS 34 -10.661 -43.619 23.426 285 H GLU 35 HN GLU 35 -12.644 -37.348 22.267 286 HA GLU 35 HA GLU 35 -14.979 -37.828 20.779 287 1HB GLU 35 HB2 GLU 35 -14.676 -36.044 23.206 288 2HB GLU 35 HB1 GLU 35 -16.181 -36.726 22.602 289 1HG GLU 35 HG2 GLU 35 -15.243 -38.997 23.021 290 2HG GLU 35 HG1 GLU 35 -13.848 -38.229 23.774 291 H LEU 36 HN LEU 36 -13.256 -34.794 21.494 292 HA LEU 36 HA LEU 36 -15.098 -33.088 20.225 293 1HB LEU 36 HB2 LEU 36 -13.408 -31.388 20.296 294 2HB LEU 36 HB1 LEU 36 -13.332 -32.316 21.778 295 HG LEU 36 HG LEU 36 -11.425 -33.616 20.453 296 1HD1 LEU 36 HD11 LEU 36 -11.352 -30.879 19.193 297 2HD1 LEU 36 HD12 LEU 36 -11.657 -32.406 18.366 298 3HD1 LEU 36 HD13 LEU 36 -10.079 -32.096 19.088 299 1HD2 LEU 36 HD21 LEU 36 -11.142 -32.495 22.598 300 2HD2 LEU 36 HD22 LEU 36 -11.018 -30.936 21.781 301 3HD2 LEU 36 HD23 LEU 36 -9.777 -32.164 21.532 302 H LEU 37 HN LEU 37 -12.507 -35.070 18.988 303 HA LEU 37 HA LEU 37 -12.442 -33.978 16.356 304 1HB LEU 37 HB2 LEU 37 -11.727 -36.772 17.280 305 2HB LEU 37 HB1 LEU 37 -11.259 -36.043 15.755 306 HG LEU 37 HG LEU 37 -10.388 -35.000 18.456 307 1HD1 LEU 37 HD11 LEU 37 -8.863 -36.735 16.514 308 2HD1 LEU 37 HD12 LEU 37 -9.493 -37.241 18.081 309 3HD1 LEU 37 HD13 LEU 37 -8.225 -36.020 17.996 310 1HD2 LEU 37 HD21 LEU 37 -8.733 -33.745 17.153 311 2HD2 LEU 37 HD22 LEU 37 -10.380 -33.309 16.702 312 3HD2 LEU 37 HD23 LEU 37 -9.433 -34.372 15.659 313 H GLU 38 HN GLU 38 -14.180 -36.633 17.898 314 HA GLU 38 HA GLU 38 -15.373 -37.752 15.627 315 1HB GLU 38 HB2 GLU 38 -16.372 -37.696 18.485 316 2HB GLU 38 HB1 GLU 38 -17.028 -38.720 17.216 317 1HG GLU 38 HG2 GLU 38 -14.796 -39.784 16.985 318 2HG GLU 38 HG1 GLU 38 -14.241 -38.826 18.358 319 H THR 39 HN THR 39 -16.288 -34.957 17.544 320 HA THR 39 HA THR 39 -18.975 -34.752 16.789 321 HB THR 39 HB THR 39 -18.878 -32.396 17.406 322 HG1 THR 39 HG1 THR 39 -16.088 -32.794 17.135 323 1HG2 THR 39 HG21 THR 39 -17.137 -34.082 19.215 324 2HG2 THR 39 HG22 THR 39 -18.900 -34.035 19.229 325 3HG2 THR 39 HG23 THR 39 -17.977 -32.601 19.680 326 H TYR 40 HN TYR 40 -16.069 -33.981 15.010 327 HA TYR 40 HA TYR 40 -17.423 -32.376 13.018 328 1HB TYR 40 HB2 TYR 40 -14.630 -33.560 13.039 329 2HB TYR 40 HB1 TYR 40 -15.244 -32.459 11.812 330 HD1 TYR 40 HD1 TYR 40 -15.401 -30.079 12.242 331 HD2 TYR 40 HD2 TYR 40 -14.207 -32.766 15.316 332 HE1 TYR 40 HE1 TYR 40 -14.654 -28.168 13.612 333 HE2 TYR 40 HE2 TYR 40 -13.459 -30.871 16.698 334 HH TYR 40 HH TYR 40 -14.105 -27.553 15.727 335 H GLN 41 HN GLN 41 -17.332 -35.615 13.669 336 HA GLN 41 HA GLN 41 -18.040 -37.477 12.596 337 1HB GLN 41 HB2 GLN 41 -19.178 -35.427 10.682 338 2HB GLN 41 HB1 GLN 41 -19.553 -37.144 10.616 339 1HG GLN 41 HG2 GLN 41 -20.128 -35.314 12.944 340 2HG GLN 41 HG1 GLN 41 -21.302 -35.857 11.745 341 1HE2 GLN 41 HE21 GLN 41 -19.385 -36.764 14.498 342 2HE2 GLN 41 HE22 GLN 41 -20.173 -38.269 14.808 343 H ARG 42 HN ARG 42 -15.414 -36.225 11.883 344 HA ARG 42 HA ARG 42 -15.008 -37.539 9.272 345 1HB ARG 42 HB2 ARG 42 -13.294 -35.873 8.772 346 2HB ARG 42 HB1 ARG 42 -14.831 -35.085 9.108 347 1HG ARG 42 HG2 ARG 42 -13.994 -34.713 11.462 348 2HG ARG 42 HG1 ARG 42 -12.412 -35.251 10.892 349 1HD ARG 42 HD2 ARG 42 -12.448 -32.865 10.807 350 2HD ARG 42 HD1 ARG 42 -12.517 -33.462 9.150 351 HE ARG 42 HE ARG 42 -15.103 -32.932 10.306 352 1HH1 ARG 42 HH11 ARG 42 -12.399 -31.554 8.568 353 2HH1 ARG 42 HH12 ARG 42 -13.326 -30.245 7.905 354 1HH2 ARG 42 HH21 ARG 42 -16.324 -31.169 9.445 355 2HH2 ARG 42 HH22 ARG 42 -15.532 -30.015 8.425 356 HA PRO 43 HA PRO 43 -12.120 -40.187 11.245 357 1HB PRO 43 HB2 PRO 43 -10.205 -40.503 9.309 358 2HB PRO 43 HB1 PRO 43 -11.793 -41.277 9.252 359 1HG PRO 43 HG2 PRO 43 -10.858 -38.775 7.889 360 2HG PRO 43 HG1 PRO 43 -11.825 -40.110 7.233 361 1HD PRO 43 HD2 PRO 43 -12.961 -37.802 8.019 362 2HD PRO 43 HD1 PRO 43 -13.776 -39.364 8.249 363 H PHE 44 HN PHE 44 -10.214 -40.218 12.396 364 HA PHE 44 HA PHE 44 -8.327 -38.002 12.055 365 1HB PHE 44 HB2 PHE 44 -8.260 -37.582 14.471 366 2HB PHE 44 HB1 PHE 44 -9.874 -37.301 13.834 367 HD1 PHE 44 HD1 PHE 44 -7.809 -39.441 15.976 368 HD2 PHE 44 HD2 PHE 44 -11.731 -38.749 14.451 369 HE1 PHE 44 HE1 PHE 44 -8.740 -40.937 17.693 370 HE2 PHE 44 HE2 PHE 44 -12.662 -40.248 16.168 371 HZ PHE 44 HZ PHE 44 -11.166 -41.340 17.793 372 H LYS 45 HN LYS 45 -6.300 -38.376 13.238 373 HA LYS 45 HA LYS 45 -5.645 -41.247 13.434 374 1HB LYS 45 HB2 LYS 45 -4.677 -40.152 11.448 375 2HB LYS 45 HB1 LYS 45 -3.939 -38.935 12.465 376 1HG LYS 45 HG2 LYS 45 -3.251 -41.835 12.782 377 2HG LYS 45 HG1 LYS 45 -2.492 -40.848 11.536 378 1HD LYS 45 HD2 LYS 45 -2.398 -40.408 14.520 379 2HD LYS 45 HD1 LYS 45 -1.069 -40.909 13.478 380 1HE LYS 45 HE2 LYS 45 -2.481 -38.238 13.426 381 2HE LYS 45 HE1 LYS 45 -0.870 -38.553 14.059 382 1HZ LYS 45 HZ1 LYS 45 -1.714 -38.829 11.225 383 2HZ LYS 45 HZ2 LYS 45 -0.167 -39.174 11.816 384 3HZ LYS 45 HZ3 LYS 45 -0.758 -37.589 11.861 385 H LEU 46 HN LEU 46 -5.294 -41.776 15.489 386 HA LEU 46 HA LEU 46 -4.282 -39.745 17.367 387 1HB LEU 46 HB2 LEU 46 -6.479 -40.996 17.772 388 2HB LEU 46 HB1 LEU 46 -5.512 -42.429 18.035 389 HG LEU 46 HG LEU 46 -6.276 -41.324 20.131 390 1HD1 LEU 46 HD11 LEU 46 -4.166 -41.414 21.327 391 2HD1 LEU 46 HD12 LEU 46 -3.276 -41.336 19.807 392 3HD1 LEU 46 HD13 LEU 46 -4.282 -42.739 20.170 393 1HD2 LEU 46 HD21 LEU 46 -6.188 -39.007 19.374 394 2HD2 LEU 46 HD22 LEU 46 -4.427 -39.088 19.299 395 3HD2 LEU 46 HD23 LEU 46 -5.252 -39.234 20.851 396 H GLU 47 HN GLU 47 -2.102 -39.819 17.402 397 HA GLU 47 HA GLU 47 -0.820 -42.459 17.723 398 1HB GLU 47 HB2 GLU 47 -0.061 -40.127 16.039 399 2HB GLU 47 HB1 GLU 47 1.255 -40.950 16.866 400 1HG GLU 47 HG2 GLU 47 -0.730 -42.235 14.997 401 2HG GLU 47 HG1 GLU 47 0.937 -41.806 14.610 402 H PHE 48 HN PHE 48 0.291 -42.776 19.524 403 HA PHE 48 HA PHE 48 0.969 -40.492 21.232 404 1HB PHE 48 HB2 PHE 48 -0.108 -42.347 22.380 405 2HB PHE 48 HB1 PHE 48 1.073 -43.482 21.734 406 HD1 PHE 48 HD1 PHE 48 2.630 -44.218 23.268 407 HD2 PHE 48 HD2 PHE 48 1.154 -40.235 23.599 408 HE1 PHE 48 HE1 PHE 48 4.050 -43.853 25.241 409 HE2 PHE 48 HE2 PHE 48 2.572 -39.872 25.573 410 HZ PHE 48 HZ PHE 48 4.022 -41.682 26.397 411 H LYS 49 HN LYS 49 2.915 -39.607 21.006 412 HA LYS 49 HA LYS 49 4.933 -40.855 19.392 413 1HB LYS 49 HB2 LYS 49 4.870 -38.260 20.943 414 2HB LYS 49 HB1 LYS 49 6.272 -38.787 20.018 415 1HG LYS 49 HG2 LYS 49 3.514 -38.267 18.904 416 2HG LYS 49 HG1 LYS 49 4.917 -37.202 18.756 417 1HD LYS 49 HD2 LYS 49 6.116 -38.966 17.528 418 2HD LYS 49 HD1 LYS 49 4.706 -40.017 17.663 419 1HE LYS 49 HE2 LYS 49 3.392 -38.408 16.358 420 2HE LYS 49 HE1 LYS 49 4.810 -37.365 16.225 421 1HZ LYS 49 HZ1 LYS 49 4.606 -38.657 14.242 422 2HZ LYS 49 HZ2 LYS 49 4.507 -40.103 15.114 423 3HZ LYS 49 HZ3 LYS 49 5.954 -39.222 15.098 424 H ASN 50 HN ASN 50 5.236 -39.465 22.659 425 HA ASN 50 HA ASN 50 6.258 -41.778 23.880 426 1HB ASN 50 HB2 ASN 50 8.643 -41.162 24.095 427 2HB ASN 50 HB1 ASN 50 8.203 -41.470 22.420 428 1HD2 ASN 50 HD21 ASN 50 8.220 -39.791 20.950 429 2HD2 ASN 50 HD22 ASN 50 8.930 -38.251 21.295 430 H THR 51 HN THR 51 7.209 -41.313 26.009 431 HA THR 51 HA THR 51 6.012 -38.920 27.191 432 HB THR 51 HB THR 51 5.524 -41.042 28.308 433 HG1 THR 51 HG1 THR 51 7.354 -39.640 29.970 434 1HG2 THR 51 HG21 THR 51 7.281 -42.336 29.426 435 2HG2 THR 51 HG22 THR 51 8.509 -41.268 28.747 436 3HG2 THR 51 HG23 THR 51 7.542 -42.289 27.682 437 H SER 52 HN SER 52 7.198 -37.373 28.273 438 HA SER 52 HA SER 52 9.909 -36.950 27.614 439 1HB SER 52 HB2 SER 52 8.367 -35.117 28.250 440 2HB SER 52 HB1 SER 52 8.289 -35.756 29.891 441 HG SER 52 HG SER 52 10.119 -34.130 28.798 442 H LYS 53 HN LYS 53 11.683 -36.780 29.290 443 HA LYS 53 HA LYS 53 12.040 -39.353 30.424 444 1HB LYS 53 HB2 LYS 53 13.884 -37.942 29.537 445 2HB LYS 53 HB1 LYS 53 13.678 -36.851 30.899 446 1HG LYS 53 HG2 LYS 53 14.343 -38.569 32.448 447 2HG LYS 53 HG1 LYS 53 14.388 -39.770 31.159 448 1HD LYS 53 HD2 LYS 53 16.144 -37.312 31.199 449 2HD LYS 53 HD1 LYS 53 16.628 -38.858 31.893 450 1HE LYS 53 HE2 LYS 53 17.573 -38.737 29.710 451 2HE LYS 53 HE1 LYS 53 16.247 -39.892 29.636 452 1HZ LYS 53 HZ1 LYS 53 16.101 -37.059 28.753 453 2HZ LYS 53 HZ2 LYS 53 14.864 -38.201 28.625 454 3HZ LYS 53 HZ3 LYS 53 16.283 -38.389 27.729 455 H ASN 54 HN ASN 54 11.043 -36.260 31.719 456 HA ASN 54 HA ASN 54 11.122 -37.076 34.469 457 1HB ASN 54 HB2 ASN 54 9.779 -35.010 34.874 458 2HB ASN 54 HB1 ASN 54 11.253 -34.716 33.961 459 1HD2 ASN 54 HD21 ASN 54 10.538 -32.838 33.039 460 2HD2 ASN 54 HD22 ASN 54 9.294 -32.784 31.841 461 H ALA 55 HN ALA 55 9.086 -37.799 31.894 462 HA ALA 55 HA ALA 55 7.240 -39.088 31.679 463 1HB ALA 55 HB1 ALA 55 7.618 -39.641 34.624 464 2HB ALA 55 HB2 ALA 55 8.319 -40.560 33.292 465 3HB ALA 55 HB3 ALA 55 6.572 -40.548 33.530 466 H LYS 56 HN LYS 56 7.206 -36.218 32.970 467 HA LYS 56 HA LYS 56 4.547 -36.198 34.142 468 1HB LYS 56 HB2 LYS 56 6.235 -34.767 35.141 469 2HB LYS 56 HB1 LYS 56 6.557 -34.000 33.598 470 1HG LYS 56 HG2 LYS 56 5.299 -32.437 34.799 471 2HG LYS 56 HG1 LYS 56 4.150 -33.157 33.677 472 1HD LYS 56 HD2 LYS 56 4.434 -34.169 36.501 473 2HD LYS 56 HD1 LYS 56 3.421 -32.778 36.125 474 1HE LYS 56 HE2 LYS 56 2.128 -34.170 34.554 475 2HE LYS 56 HE1 LYS 56 3.123 -35.559 34.984 476 1HZ LYS 56 HZ1 LYS 56 2.343 -35.356 37.268 477 2HZ LYS 56 HZ2 LYS 56 1.051 -35.574 36.199 478 3HZ LYS 56 HZ3 LYS 56 1.372 -34.040 36.833 479 H PHE 57 HN PHE 57 6.082 -35.583 31.099 480 HA PHE 57 HA PHE 57 3.568 -34.469 30.026 481 1HB PHE 57 HB2 PHE 57 6.382 -33.928 29.037 482 2HB PHE 57 HB1 PHE 57 4.899 -33.205 28.418 483 HD1 PHE 57 HD1 PHE 57 7.562 -32.890 30.765 484 HD2 PHE 57 HD2 PHE 57 3.500 -31.805 30.066 485 HE1 PHE 57 HE1 PHE 57 7.767 -31.071 32.407 486 HE2 PHE 57 HE2 PHE 57 3.704 -29.982 31.705 487 HZ PHE 57 HZ PHE 57 5.838 -29.613 32.878 488 H TYR 58 HN TYR 58 2.571 -35.815 28.719 489 HA TYR 58 HA TYR 58 4.086 -37.812 27.185 490 1HB TYR 58 HB2 TYR 58 1.144 -37.650 27.913 491 2HB TYR 58 HB1 TYR 58 1.832 -38.885 26.864 492 HD1 TYR 58 HD1 TYR 58 3.256 -40.645 27.779 493 HD2 TYR 58 HD2 TYR 58 1.543 -37.694 30.327 494 HE1 TYR 58 HE1 TYR 58 3.784 -42.035 29.734 495 HE2 TYR 58 HE2 TYR 58 2.069 -39.080 32.290 496 HH TYR 58 HH TYR 58 4.127 -41.825 32.113 497 H SER 59 HN SER 59 4.297 -37.557 25.039 498 HA SER 59 HA SER 59 2.968 -35.263 23.806 499 1HB SER 59 HB2 SER 59 5.431 -35.420 23.661 500 2HB SER 59 HB1 SER 59 5.278 -36.948 22.796 501 HG SER 59 HG SER 59 5.564 -35.177 21.375 502 H PHE 60 HN PHE 60 1.203 -35.575 22.670 503 HA PHE 60 HA PHE 60 0.847 -38.072 21.139 504 1HB PHE 60 HB2 PHE 60 -1.202 -36.091 22.179 505 2HB PHE 60 HB1 PHE 60 -1.586 -37.404 21.073 506 HD1 PHE 60 HD1 PHE 60 -0.940 -36.477 24.511 507 HD2 PHE 60 HD2 PHE 60 -1.378 -39.757 21.824 508 HE1 PHE 60 HE1 PHE 60 -1.299 -37.991 26.415 509 HE2 PHE 60 HE2 PHE 60 -1.732 -41.269 23.729 510 HZ PHE 60 HZ PHE 60 -1.694 -40.390 26.020 511 H ASN 61 HN ASN 61 0.022 -37.888 18.995 512 HA ASN 61 HA ASN 61 0.034 -35.197 17.815 513 1HB ASN 61 HB2 ASN 61 2.193 -36.269 17.256 514 2HB ASN 61 HB1 ASN 61 1.331 -37.639 16.559 515 1HD2 ASN 61 HD21 ASN 61 0.497 -37.467 14.523 516 2HD2 ASN 61 HD22 ASN 61 0.714 -36.085 13.508 517 H VAL 62 HN VAL 62 -1.784 -34.807 16.781 518 HA VAL 62 HA VAL 62 -3.531 -37.072 16.036 519 HB VAL 62 HB VAL 62 -4.293 -34.431 17.319 520 1HG1 VAL 62 HG11 VAL 62 -5.956 -35.005 15.663 521 2HG1 VAL 62 HG12 VAL 62 -6.613 -35.287 17.276 522 3HG1 VAL 62 HG13 VAL 62 -6.072 -36.650 16.294 523 1HG2 VAL 62 HG21 VAL 62 -5.137 -35.839 19.156 524 2HG2 VAL 62 HG22 VAL 62 -3.403 -36.051 18.911 525 3HG2 VAL 62 HG23 VAL 62 -4.531 -37.275 18.328 526 H SER 63 HN SER 63 -3.921 -37.068 13.878 527 HA SER 63 HA SER 63 -4.029 -34.446 12.527 528 1HB SER 63 HB2 SER 63 -3.412 -35.616 10.439 529 2HB SER 63 HB1 SER 63 -2.186 -35.816 11.686 530 HG SER 63 HG SER 63 -4.076 -37.690 10.752 531 H MET 64 HN MET 64 -5.842 -33.895 11.489 532 HA MET 64 HA MET 64 -7.843 -35.937 10.867 533 1HB MET 64 HB2 MET 64 -9.643 -34.718 11.930 534 2HB MET 64 HB1 MET 64 -8.404 -35.052 13.131 535 1HG MET 64 HG2 MET 64 -7.567 -32.751 12.882 536 2HG MET 64 HG1 MET 64 -8.846 -32.427 11.714 537 1HE MET 64 HE1 MET 64 -11.477 -32.559 12.363 538 2HE MET 64 HE2 MET 64 -12.049 -32.882 13.998 539 3HE MET 64 HE3 MET 64 -11.238 -34.153 13.080 540 H GLU 65 HN GLU 65 -9.592 -35.019 9.486 541 HA GLU 65 HA GLU 65 -8.462 -33.488 7.369 542 1HB GLU 65 HB2 GLU 65 -11.391 -34.099 7.815 543 2HB GLU 65 HB1 GLU 65 -10.616 -33.651 6.301 544 1HG GLU 65 HG2 GLU 65 -9.348 -35.767 6.359 545 2HG GLU 65 HG1 GLU 65 -10.207 -36.214 7.834 546 H VAL 66 HN VAL 66 -8.131 -31.369 7.501 547 HA VAL 66 HA VAL 66 -10.091 -29.677 8.882 548 HB VAL 66 HB VAL 66 -8.445 -27.827 8.505 549 1HG1 VAL 66 HG11 VAL 66 -6.831 -28.593 10.192 550 2HG1 VAL 66 HG12 VAL 66 -7.373 -30.255 9.954 551 3HG1 VAL 66 HG13 VAL 66 -8.481 -29.051 10.614 552 1HG2 VAL 66 HG21 VAL 66 -7.307 -28.720 6.528 553 2HG2 VAL 66 HG22 VAL 66 -6.653 -30.047 7.489 554 3HG2 VAL 66 HG23 VAL 66 -6.152 -28.388 7.818 555 H SER 67 HN SER 67 -11.569 -28.582 7.760 556 HA SER 67 HA SER 67 -11.773 -28.981 4.930 557 1HB SER 67 HB2 SER 67 -13.460 -27.213 6.727 558 2HB SER 67 HB1 SER 67 -13.897 -27.814 5.125 559 HG SER 67 HG SER 67 -14.181 -29.810 5.919 560 H ASN 68 HN ASN 68 -10.900 -26.356 7.060 561 HA ASN 68 HA ASN 68 -9.645 -24.855 4.999 562 1HB ASN 68 HB2 ASN 68 -11.129 -22.843 5.200 563 2HB ASN 68 HB1 ASN 68 -11.890 -24.214 4.407 564 1HD2 ASN 68 HD21 ASN 68 -12.022 -22.033 7.007 565 2HD2 ASN 68 HD22 ASN 68 -13.453 -22.648 7.756 566 H GLU 69 HN GLU 69 -9.265 -22.475 6.021 567 HA GLU 69 HA GLU 69 -7.424 -22.972 8.069 568 1HB GLU 69 HB2 GLU 69 -7.219 -21.098 6.502 569 2HB GLU 69 HB1 GLU 69 -8.638 -20.336 7.206 570 1HG GLU 69 HG2 GLU 69 -7.456 -20.075 9.329 571 2HG GLU 69 HG1 GLU 69 -6.036 -20.857 8.639 572 H SER 70 HN SER 70 -10.655 -21.524 8.211 573 HA SER 70 HA SER 70 -10.681 -20.809 10.902 574 1HB SER 70 HB2 SER 70 -13.052 -21.794 9.292 575 2HB SER 70 HB1 SER 70 -13.091 -20.718 10.692 576 HG SER 70 HG SER 70 -11.433 -19.619 8.975 577 H GLU 71 HN GLU 71 -11.298 -23.939 9.384 578 HA GLU 71 HA GLU 71 -12.364 -25.241 11.650 579 1HB GLU 71 HB2 GLU 71 -10.834 -26.420 9.317 580 2HB GLU 71 HB1 GLU 71 -11.742 -27.351 10.500 581 1HG GLU 71 HG2 GLU 71 -12.869 -25.339 8.573 582 2HG GLU 71 HG1 GLU 71 -12.998 -27.089 8.447 583 H ARG 72 HN ARG 72 -9.033 -25.104 10.367 584 HA ARG 72 HA ARG 72 -7.911 -26.821 12.285 585 1HB ARG 72 HB2 ARG 72 -5.798 -26.197 11.480 586 2HB ARG 72 HB1 ARG 72 -6.852 -25.947 10.094 587 1HG ARG 72 HG2 ARG 72 -6.933 -23.545 10.611 588 2HG ARG 72 HG1 ARG 72 -5.847 -23.811 11.971 589 1HD ARG 72 HD2 ARG 72 -4.172 -24.721 10.330 590 2HD ARG 72 HD1 ARG 72 -5.249 -24.181 9.037 591 HE ARG 72 HE ARG 72 -4.348 -22.246 11.047 592 1HH1 ARG 72 HH11 ARG 72 -4.239 -23.370 7.715 593 2HH1 ARG 72 HH12 ARG 72 -3.523 -21.905 7.131 594 1HH2 ARG 72 HH21 ARG 72 -3.439 -20.335 10.272 595 2HH2 ARG 72 HH22 ARG 72 -3.082 -20.165 8.581 596 H ASN 73 HN ASN 73 -8.654 -23.411 12.356 597 HA ASN 73 HA ASN 73 -7.250 -22.726 14.721 598 1HB ASN 73 HB2 ASN 73 -9.804 -21.511 13.619 599 2HB ASN 73 HB1 ASN 73 -8.760 -20.782 14.832 600 1HD2 ASN 73 HD21 ASN 73 -9.596 -19.761 12.261 601 2HD2 ASN 73 HD22 ASN 73 -8.151 -19.455 11.360 602 H GLU 74 HN GLU 74 -10.687 -23.459 14.159 603 HA GLU 74 HA GLU 74 -11.546 -23.410 16.799 604 1HB GLU 74 HB2 GLU 74 -13.154 -23.430 15.010 605 2HB GLU 74 HB1 GLU 74 -12.575 -24.989 14.431 606 1HG GLU 74 HG2 GLU 74 -13.406 -26.085 16.406 607 2HG GLU 74 HG1 GLU 74 -13.886 -24.544 17.107 608 H ILE 75 HN ILE 75 -10.495 -26.197 14.874 609 HA ILE 75 HA ILE 75 -10.837 -28.190 16.789 610 HB ILE 75 HB ILE 75 -8.764 -28.034 14.581 611 1HG1 ILE 75 HG12 ILE 75 -11.450 -29.439 14.574 612 2HG1 ILE 75 HG11 ILE 75 -11.219 -27.810 13.953 613 1HG2 ILE 75 HG21 ILE 75 -8.162 -29.728 16.236 614 2HG2 ILE 75 HG22 ILE 75 -8.688 -30.488 14.734 615 3HG2 ILE 75 HG23 ILE 75 -9.776 -30.434 16.122 616 1HD1 ILE 75 HD11 ILE 75 -11.228 -29.414 12.162 617 2HD1 ILE 75 HD12 ILE 75 -9.906 -30.308 12.916 618 3HD1 ILE 75 HD13 ILE 75 -9.635 -28.674 12.307 619 H PHE 76 HN PHE 76 -8.049 -26.122 16.113 620 HA PHE 76 HA PHE 76 -6.247 -27.172 17.974 621 1HB PHE 76 HB2 PHE 76 -5.618 -25.563 16.221 622 2HB PHE 76 HB1 PHE 76 -6.566 -24.311 17.012 623 HD1 PHE 76 HD1 PHE 76 -5.679 -23.052 18.811 624 HD2 PHE 76 HD2 PHE 76 -3.558 -26.436 17.324 625 HE1 PHE 76 HE1 PHE 76 -3.703 -22.379 20.107 626 HE2 PHE 76 HE2 PHE 76 -1.579 -25.767 18.620 627 HZ PHE 76 HZ PHE 76 -1.648 -23.736 20.014 628 H GLN 77 HN GLN 77 -8.771 -24.720 18.317 629 HA GLN 77 HA GLN 77 -8.193 -24.017 21.009 630 1HB GLN 77 HB2 GLN 77 -10.823 -23.798 19.519 631 2HB GLN 77 HB1 GLN 77 -10.386 -22.928 20.985 632 1HG GLN 77 HG2 GLN 77 -8.665 -21.709 19.794 633 2HG GLN 77 HG1 GLN 77 -8.980 -22.641 18.333 634 1HE2 GLN 77 HE21 GLN 77 -10.080 -20.084 20.390 635 2HE2 GLN 77 HE22 GLN 77 -11.303 -19.481 19.330 636 H LYS 78 HN LYS 78 -10.342 -26.389 19.513 637 HA LYS 78 HA LYS 78 -11.761 -27.234 21.775 638 1HB LYS 78 HB2 LYS 78 -10.875 -28.863 19.375 639 2HB LYS 78 HB1 LYS 78 -12.099 -29.361 20.533 640 1HG LYS 78 HG2 LYS 78 -12.324 -26.887 18.829 641 2HG LYS 78 HG1 LYS 78 -12.965 -28.463 18.364 642 1HD LYS 78 HD2 LYS 78 -14.362 -28.460 20.412 643 2HD LYS 78 HD1 LYS 78 -13.761 -26.843 20.792 644 1HE LYS 78 HE2 LYS 78 -15.958 -26.753 19.705 645 2HE LYS 78 HE1 LYS 78 -14.718 -25.983 18.717 646 1HZ LYS 78 HZ1 LYS 78 -15.943 -28.657 18.312 647 2HZ LYS 78 HZ2 LYS 78 -14.578 -28.129 17.471 648 3HZ LYS 78 HZ3 LYS 78 -16.046 -27.308 17.290 649 H ILE 79 HN ILE 79 -8.637 -28.204 20.487 650 HA ILE 79 HA ILE 79 -8.191 -30.491 22.031 651 HB ILE 79 HB ILE 79 -6.203 -28.568 20.802 652 1HG1 ILE 79 HG12 ILE 79 -7.252 -31.253 19.854 653 2HG1 ILE 79 HG11 ILE 79 -7.731 -29.687 19.212 654 1HG2 ILE 79 HG21 ILE 79 -5.116 -29.834 22.585 655 2HG2 ILE 79 HG22 ILE 79 -4.544 -30.363 21.005 656 3HG2 ILE 79 HG23 ILE 79 -5.710 -31.344 21.891 657 1HD1 ILE 79 HD11 ILE 79 -4.972 -30.883 19.078 658 2HD1 ILE 79 HD12 ILE 79 -5.445 -29.308 18.438 659 3HD1 ILE 79 HD13 ILE 79 -6.136 -30.781 17.757 660 H SER 80 HN SER 80 -7.760 -27.104 22.853 661 HA SER 80 HA SER 80 -6.060 -27.692 25.112 662 1HB SER 80 HB2 SER 80 -6.196 -25.277 25.578 663 2HB SER 80 HB1 SER 80 -5.766 -25.597 23.899 664 HG SER 80 HG SER 80 -8.282 -25.436 23.730 665 H GLN 81 HN GLN 81 -9.354 -27.949 24.610 666 HA GLN 81 HA GLN 81 -10.279 -26.874 27.117 667 1HB GLN 81 HB2 GLN 81 -11.672 -28.572 25.037 668 2HB GLN 81 HB1 GLN 81 -12.465 -27.860 26.436 669 1HG GLN 81 HG2 GLN 81 -11.945 -25.626 25.616 670 2HG GLN 81 HG1 GLN 81 -11.101 -26.318 24.231 671 1HE2 GLN 81 HE21 GLN 81 -13.053 -28.462 23.884 672 2HE2 GLN 81 HE22 GLN 81 -14.460 -27.728 23.201 673 H LEU 82 HN LEU 82 -8.433 -29.466 26.703 674 HA LEU 82 HA LEU 82 -9.956 -31.440 28.182 675 1HB LEU 82 HB2 LEU 82 -6.986 -31.660 27.810 676 2HB LEU 82 HB1 LEU 82 -8.204 -32.917 27.829 677 HG LEU 82 HG LEU 82 -7.782 -30.958 25.574 678 1HD1 LEU 82 HD11 LEU 82 -6.911 -32.875 24.332 679 2HD1 LEU 82 HD12 LEU 82 -7.046 -33.876 25.779 680 3HD1 LEU 82 HD13 LEU 82 -5.927 -32.512 25.749 681 1HD2 LEU 82 HD21 LEU 82 -10.097 -31.663 25.736 682 2HD2 LEU 82 HD22 LEU 82 -9.600 -33.355 25.790 683 3HD2 LEU 82 HD23 LEU 82 -9.327 -32.400 24.331 684 H ASP 83 HN ASP 83 -7.748 -28.886 28.842 685 HA ASP 83 HA ASP 83 -6.880 -27.986 30.728 686 1HB ASP 83 HB2 ASP 83 -9.049 -28.409 31.809 687 2HB ASP 83 HB1 ASP 83 -8.526 -30.036 32.232 688 H LYS 84 HN LYS 84 -6.895 -31.511 30.663 689 HA LYS 84 HA LYS 84 -4.487 -31.815 32.170 690 1HB LYS 84 HB2 LYS 84 -4.608 -34.191 31.323 691 2HB LYS 84 HB1 LYS 84 -6.032 -33.636 32.197 692 1HG LYS 84 HG2 LYS 84 -7.088 -33.159 29.955 693 2HG LYS 84 HG1 LYS 84 -5.708 -33.979 29.225 694 1HD LYS 84 HD2 LYS 84 -7.644 -35.476 29.457 695 2HD LYS 84 HD1 LYS 84 -6.265 -36.024 30.401 696 1HE LYS 84 HE2 LYS 84 -7.308 -34.934 32.407 697 2HE LYS 84 HE1 LYS 84 -8.732 -34.615 31.418 698 1HZ LYS 84 HZ1 LYS 84 -9.031 -36.979 31.115 699 2HZ LYS 84 HZ2 LYS 84 -8.947 -36.629 32.770 700 3HZ LYS 84 HZ3 LYS 84 -7.618 -37.311 31.983 701 H VAL 85 HN VAL 85 -4.817 -30.362 29.349 702 HA VAL 85 HA VAL 85 -2.313 -31.402 28.209 703 HB VAL 85 HB VAL 85 -4.151 -31.440 26.604 704 1HG1 VAL 85 HG11 VAL 85 -5.573 -29.718 27.594 705 2HG1 VAL 85 HG12 VAL 85 -5.292 -29.398 25.882 706 3HG1 VAL 85 HG13 VAL 85 -4.423 -28.472 27.107 707 1HG2 VAL 85 HG21 VAL 85 -2.202 -29.209 26.001 708 2HG2 VAL 85 HG22 VAL 85 -3.157 -30.091 24.809 709 3HG2 VAL 85 HG23 VAL 85 -1.924 -30.933 25.746 710 H VAL 86 HN VAL 86 -0.542 -30.090 28.206 711 HA VAL 86 HA VAL 86 -0.848 -27.504 29.568 712 HB VAL 86 HB VAL 86 1.602 -27.619 29.955 713 1HG1 VAL 86 HG11 VAL 86 0.056 -30.041 30.898 714 2HG1 VAL 86 HG12 VAL 86 0.054 -28.444 31.650 715 3HG1 VAL 86 HG13 VAL 86 1.530 -29.409 31.634 716 1HG2 VAL 86 HG21 VAL 86 2.238 -28.980 28.022 717 2HG2 VAL 86 HG22 VAL 86 1.391 -30.368 28.706 718 3HG2 VAL 86 HG23 VAL 86 2.811 -29.712 29.521 719 H GLN 87 HN GLN 87 0.356 -28.928 26.578 720 HA GLN 87 HA GLN 87 0.680 -26.226 25.488 721 1HB GLN 87 HB2 GLN 87 2.917 -27.005 26.287 722 2HB GLN 87 HB1 GLN 87 2.801 -28.369 25.181 723 1HG GLN 87 HG2 GLN 87 2.718 -26.827 23.282 724 2HG GLN 87 HG1 GLN 87 2.822 -25.459 24.387 725 1HE2 GLN 87 HE21 GLN 87 4.779 -25.045 25.447 726 2HE2 GLN 87 HE22 GLN 87 6.276 -25.701 24.877 727 H THR 88 HN THR 88 -0.059 -26.021 23.490 728 HA THR 88 HA THR 88 -0.656 -28.441 21.909 729 HB THR 88 HB THR 88 -2.602 -27.118 20.977 730 HG1 THR 88 HG1 THR 88 -1.778 -25.051 21.768 731 1HG2 THR 88 HG21 THR 88 -2.962 -28.857 22.669 732 2HG2 THR 88 HG22 THR 88 -4.082 -27.515 22.898 733 3HG2 THR 88 HG23 THR 88 -2.677 -27.678 23.951 734 H LEU 89 HN LEU 89 0.578 -28.473 20.130 735 HA LEU 89 HA LEU 89 1.491 -25.918 18.969 736 1HB LEU 89 HB2 LEU 89 2.653 -28.680 18.531 737 2HB LEU 89 HB1 LEU 89 3.299 -27.170 17.922 738 HG LEU 89 HG LEU 89 3.610 -26.495 20.381 739 1HD1 LEU 89 HD11 LEU 89 3.859 -28.353 21.968 740 2HD1 LEU 89 HD12 LEU 89 3.217 -29.465 20.759 741 3HD1 LEU 89 HD13 LEU 89 2.197 -28.180 21.408 742 1HD2 LEU 89 HD21 LEU 89 5.748 -27.670 20.536 743 2HD2 LEU 89 HD22 LEU 89 5.464 -27.075 18.900 744 3HD2 LEU 89 HD23 LEU 89 5.236 -28.786 19.267 745 H GLY 90 HN GLY 90 1.232 -25.516 16.781 746 1HA GLY 90 HA2 GLY 90 -0.961 -26.827 15.483 747 2HA GLY 90 HA1 GLY 90 0.032 -25.541 14.812 748 H SER 91 HN SER 91 2.532 -26.989 15.226 749 HA SER 91 HA SER 91 2.269 -29.314 13.484 750 1HB SER 91 HB2 SER 91 4.154 -26.973 13.088 751 2HB SER 91 HB1 SER 91 4.234 -28.487 12.206 752 HG SER 91 HG SER 91 1.847 -27.900 11.797 Start of MODEL 7 1 1H GLN 1 HT1 GLN 1 7.337 0.126 -10.185 2 2H GLN 1 HT2 GLN 1 8.953 0.037 -10.671 3 3H GLN 1 HT3 GLN 1 8.573 0.181 -9.033 4 HA GLN 1 HA GLN 1 7.515 -1.976 -9.053 5 1HB GLN 1 HB2 GLN 1 8.463 -1.988 -11.933 6 2HB GLN 1 HB1 GLN 1 7.984 -3.441 -11.070 7 1HG GLN 1 HG2 GLN 1 6.156 -2.733 -12.424 8 2HG GLN 1 HG1 GLN 1 5.732 -2.450 -10.738 9 1HE2 GLN 1 HE21 GLN 1 6.535 -0.993 -13.782 10 2HE2 GLN 1 HE22 GLN 1 6.043 0.617 -13.374 11 H GLY 2 HN GLY 2 8.753 -3.704 -8.319 12 1HA GLY 2 HA2 GLY 2 11.439 -4.195 -8.970 13 2HA GLY 2 HA1 GLY 2 11.398 -3.142 -7.560 14 H HIS 3 HN HIS 3 12.275 -5.964 -7.878 15 HA HIS 3 HA HIS 3 10.340 -7.449 -6.280 16 1HB HIS 3 HB2 HIS 3 13.073 -8.270 -7.315 17 2HB HIS 3 HB1 HIS 3 11.926 -9.333 -6.507 18 HD1 HIS 3 HD1 HIS 3 9.899 -10.157 -7.880 19 HD2 HIS 3 HD2 HIS 3 12.460 -7.652 -9.992 20 HE1 HIS 3 HE1 HIS 3 9.233 -10.388 -10.295 21 HE2 HIS 3 HE2 HIS 3 10.876 -8.957 -11.563 22 H MET 4 HN MET 4 10.869 -8.345 -4.215 23 HA MET 4 HA MET 4 12.623 -6.586 -2.660 24 1HB MET 4 HB2 MET 4 10.622 -8.669 -1.726 25 2HB MET 4 HB1 MET 4 11.504 -7.560 -0.687 26 1HG MET 4 HG2 MET 4 10.383 -5.692 -2.029 27 2HG MET 4 HG1 MET 4 9.309 -6.948 -2.638 28 1HE MET 4 HE1 MET 4 7.827 -8.260 0.842 29 2HE MET 4 HE2 MET 4 9.379 -8.779 0.186 30 3HE MET 4 HE3 MET 4 7.983 -8.616 -0.880 31 HA PRO 5 HA PRO 5 16.017 -9.316 -1.826 32 1HB PRO 5 HB2 PRO 5 14.955 -9.564 0.975 33 2HB PRO 5 HB1 PRO 5 16.613 -9.282 0.426 34 1HG PRO 5 HG2 PRO 5 15.135 -7.263 1.333 35 2HG PRO 5 HG1 PRO 5 16.210 -7.040 -0.061 36 1HD PRO 5 HD2 PRO 5 13.242 -7.248 0.025 37 2HD PRO 5 HD1 PRO 5 14.281 -6.375 -1.118 38 H SER 6 HN SER 6 12.863 -10.347 -0.576 39 HA SER 6 HA SER 6 13.448 -13.034 -1.600 40 1HB SER 6 HB2 SER 6 13.718 -13.022 0.891 41 2HB SER 6 HB1 SER 6 12.029 -12.537 1.033 42 HG SER 6 HG SER 6 12.942 -14.904 -0.262 43 H ASP 7 HN ASP 7 12.160 -13.043 -3.321 44 HA ASP 7 HA ASP 7 9.313 -12.335 -3.031 45 1HB ASP 7 HB2 ASP 7 11.238 -12.344 -5.289 46 2HB ASP 7 HB1 ASP 7 9.651 -12.988 -5.689 47 H SER 8 HN SER 8 10.821 -14.755 -2.053 48 HA SER 8 HA SER 8 10.227 -17.016 -3.599 49 1HB SER 8 HB2 SER 8 10.579 -16.850 -0.593 50 2HB SER 8 HB1 SER 8 10.793 -18.286 -1.597 51 HG SER 8 HG SER 8 12.772 -17.145 -1.049 52 H LYS 9 HN LYS 9 8.569 -18.496 -3.541 53 HA LYS 9 HA LYS 9 6.002 -17.459 -2.656 54 1HB LYS 9 HB2 LYS 9 6.681 -19.946 -4.253 55 2HB LYS 9 HB1 LYS 9 5.060 -19.315 -3.983 56 1HG LYS 9 HG2 LYS 9 7.244 -17.790 -5.399 57 2HG LYS 9 HG1 LYS 9 6.040 -18.779 -6.221 58 1HD LYS 9 HD2 LYS 9 5.074 -16.692 -4.318 59 2HD LYS 9 HD1 LYS 9 5.717 -16.161 -5.871 60 1HE LYS 9 HE2 LYS 9 3.264 -16.479 -5.899 61 2HE LYS 9 HE1 LYS 9 4.101 -17.507 -7.057 62 1HZ LYS 9 HZ1 LYS 9 3.180 -18.411 -4.383 63 2HZ LYS 9 HZ2 LYS 9 3.829 -19.375 -5.613 64 3HZ LYS 9 HZ3 LYS 9 2.319 -18.643 -5.819 65 H LYS 10 HN LYS 10 4.543 -18.616 -1.354 66 HA LYS 10 HA LYS 10 5.865 -20.186 0.726 67 1HB LYS 10 HB2 LYS 10 3.163 -18.824 0.588 68 2HB LYS 10 HB1 LYS 10 3.697 -19.788 1.962 69 1HG LYS 10 HG2 LYS 10 5.082 -17.320 0.916 70 2HG LYS 10 HG1 LYS 10 4.026 -17.384 2.331 71 1HD LYS 10 HD2 LYS 10 5.551 -18.712 3.548 72 2HD LYS 10 HD1 LYS 10 6.461 -19.145 2.100 73 1HE LYS 10 HE2 LYS 10 7.255 -16.858 1.895 74 2HE LYS 10 HE1 LYS 10 6.320 -16.387 3.316 75 1HZ LYS 10 HZ1 LYS 10 7.657 -17.839 4.667 76 2HZ LYS 10 HZ2 LYS 10 8.678 -16.801 3.807 77 3HZ LYS 10 HZ3 LYS 10 8.496 -18.405 3.313 78 HA PRO 11 HA PRO 11 3.817 -24.006 -0.390 79 1HB PRO 11 HB2 PRO 11 3.267 -24.679 2.404 80 2HB PRO 11 HB1 PRO 11 4.434 -25.404 1.296 81 1HG PRO 11 HG2 PRO 11 5.166 -23.891 3.433 82 2HG PRO 11 HG1 PRO 11 6.130 -24.000 1.949 83 1HD PRO 11 HD2 PRO 11 4.255 -21.832 2.841 84 2HD PRO 11 HD1 PRO 11 5.837 -21.700 2.038 85 H THR 12 HN THR 12 1.877 -23.648 -1.322 86 HA THR 12 HA THR 12 -0.364 -22.554 0.110 87 HB THR 12 HB THR 12 -0.407 -23.831 -2.636 88 HG1 THR 12 HG1 THR 12 0.568 -21.318 -1.782 89 1HG2 THR 12 HG21 THR 12 -2.099 -21.650 -1.384 90 2HG2 THR 12 HG22 THR 12 -2.602 -23.320 -1.649 91 3HG2 THR 12 HG23 THR 12 -2.264 -22.272 -3.026 92 H ILE 13 HN ILE 13 -1.419 -23.796 1.518 93 HA ILE 13 HA ILE 13 -1.474 -26.677 1.269 94 HB ILE 13 HB ILE 13 -2.863 -24.885 3.283 95 1HG1 ILE 13 HG12 ILE 13 -0.373 -24.667 3.276 96 2HG1 ILE 13 HG11 ILE 13 -0.997 -25.356 4.774 97 1HG2 ILE 13 HG21 ILE 13 -3.897 -27.084 3.152 98 2HG2 ILE 13 HG22 ILE 13 -3.002 -26.925 4.663 99 3HG2 ILE 13 HG23 ILE 13 -2.323 -27.861 3.331 100 1HD1 ILE 13 HD11 ILE 13 1.021 -26.487 4.044 101 2HD1 ILE 13 HD12 ILE 13 0.255 -26.890 2.507 102 3HD1 ILE 13 HD13 ILE 13 -0.361 -27.583 4.008 103 H ILE 14 HN ILE 14 -2.844 -27.584 -0.108 104 HA ILE 14 HA ILE 14 -5.266 -26.204 -0.931 105 HB ILE 14 HB ILE 14 -4.082 -28.828 -1.875 106 1HG1 ILE 14 HG12 ILE 14 -4.046 -26.061 -3.117 107 2HG1 ILE 14 HG11 ILE 14 -2.670 -26.875 -2.382 108 1HG2 ILE 14 HG21 ILE 14 -5.639 -28.639 -3.768 109 2HG2 ILE 14 HG22 ILE 14 -6.354 -27.203 -3.036 110 3HG2 ILE 14 HG23 ILE 14 -6.499 -28.767 -2.235 111 1HD1 ILE 14 HD11 ILE 14 -4.138 -27.744 -4.862 112 2HD1 ILE 14 HD12 ILE 14 -2.790 -28.603 -4.116 113 3HD1 ILE 14 HD13 ILE 14 -2.546 -26.991 -4.787 114 H TYR 15 HN TYR 15 -6.888 -26.365 0.464 115 HA TYR 15 HA TYR 15 -7.395 -28.770 1.993 116 1HB TYR 15 HB2 TYR 15 -8.911 -26.148 1.785 117 2HB TYR 15 HB1 TYR 15 -9.316 -27.452 2.898 118 HD1 TYR 15 HD1 TYR 15 -8.241 -27.620 4.994 119 HD2 TYR 15 HD2 TYR 15 -6.609 -25.033 2.028 120 HE1 TYR 15 HE1 TYR 15 -6.679 -26.703 6.653 121 HE2 TYR 15 HE2 TYR 15 -5.039 -24.116 3.688 122 HH TYR 15 HH TYR 15 -4.411 -25.563 6.619 123 HA PRO 16 HA PRO 16 -9.334 -29.641 2.986 124 1HB PRO 16 HB2 PRO 16 -10.306 -32.307 2.413 125 2HB PRO 16 HB1 PRO 16 -11.127 -30.997 3.264 126 1HG PRO 16 HG2 PRO 16 -11.896 -31.951 0.808 127 2HG PRO 16 HG1 PRO 16 -12.244 -30.315 1.392 128 1HD PRO 16 HD2 PRO 16 -10.093 -31.241 -0.485 129 2HD PRO 16 HD1 PRO 16 -11.101 -29.777 -0.556 130 H CYS 17 HN CYS 17 -8.058 -31.080 4.232 131 HA CYS 17 HA CYS 17 -6.434 -33.122 3.067 132 1HB CYS 17 HB2 CYS 17 -5.216 -31.192 2.175 133 2HB CYS 17 HB1 CYS 17 -5.119 -30.479 3.781 134 HG CYS 17 HG CYS 17 -3.272 -32.155 4.795 135 H LEU 18 HN LEU 18 -5.084 -34.163 4.651 136 HA LEU 18 HA LEU 18 -6.086 -34.071 7.328 137 1HB LEU 18 HB2 LEU 18 -3.686 -35.488 6.145 138 2HB LEU 18 HB1 LEU 18 -4.305 -35.756 7.765 139 HG LEU 18 HG LEU 18 -5.920 -36.270 5.259 140 1HD1 LEU 18 HD11 LEU 18 -5.442 -38.642 5.610 141 2HD1 LEU 18 HD12 LEU 18 -4.342 -38.231 6.927 142 3HD1 LEU 18 HD13 LEU 18 -3.973 -37.728 5.276 143 1HD2 LEU 18 HD21 LEU 18 -7.352 -37.563 6.763 144 2HD2 LEU 18 HD22 LEU 18 -7.247 -35.880 7.278 145 3HD2 LEU 18 HD23 LEU 18 -6.329 -37.123 8.132 146 H TRP 19 HN TRP 19 -5.108 -33.257 9.155 147 HA TRP 19 HA TRP 19 -2.618 -31.723 8.815 148 1HB TRP 19 HB2 TRP 19 -4.758 -30.298 8.843 149 2HB TRP 19 HB1 TRP 19 -4.938 -30.783 10.524 150 HD1 TRP 19 HD1 TRP 19 -2.878 -29.971 12.213 151 HE1 TRP 19 HE1 TRP 19 -1.465 -27.822 12.129 152 HE3 TRP 19 HE3 TRP 19 -3.760 -28.607 7.366 153 HZ2 TRP 19 HZ2 TRP 19 -0.816 -25.814 10.262 154 HZ3 TRP 19 HZ3 TRP 19 -2.704 -26.558 6.508 155 HH2 TRP 19 HH2 TRP 19 -1.262 -25.190 7.928 156 H ASP 20 HN ASP 20 -1.185 -31.915 10.485 157 HA ASP 20 HA ASP 20 -1.844 -33.886 12.563 158 1HB ASP 20 HB2 ASP 20 0.820 -32.847 11.553 159 2HB ASP 20 HB1 ASP 20 0.655 -33.947 12.917 160 H TYR 21 HN TYR 21 -2.033 -33.328 14.624 161 HA TYR 21 HA TYR 21 -1.165 -30.638 15.477 162 1HB TYR 21 HB2 TYR 21 -3.467 -32.292 16.568 163 2HB TYR 21 HB1 TYR 21 -3.000 -30.686 17.114 164 HD1 TYR 21 HD1 TYR 21 -3.641 -28.719 15.872 165 HD2 TYR 21 HD2 TYR 21 -4.533 -32.601 14.365 166 HE1 TYR 21 HE1 TYR 21 -5.172 -27.724 14.224 167 HE2 TYR 21 HE2 TYR 21 -6.060 -31.615 12.715 168 HH TYR 21 HH TYR 21 -7.392 -29.561 12.445 169 H ARG 22 HN ARG 22 0.517 -30.719 16.827 170 HA ARG 22 HA ARG 22 1.143 -33.132 18.313 171 1HB ARG 22 HB2 ARG 22 2.971 -31.832 17.334 172 2HB ARG 22 HB1 ARG 22 2.482 -30.413 18.248 173 1HG ARG 22 HG2 ARG 22 4.416 -31.443 19.271 174 2HG ARG 22 HG1 ARG 22 3.022 -31.579 20.342 175 1HD ARG 22 HD2 ARG 22 2.692 -33.897 19.645 176 2HD ARG 22 HD1 ARG 22 4.043 -33.764 18.518 177 HE ARG 22 HE ARG 22 4.200 -33.910 21.436 178 1HH1 ARG 22 HH11 ARG 22 5.851 -33.659 18.358 179 2HH1 ARG 22 HH12 ARG 22 7.399 -34.088 19.015 180 1HH2 ARG 22 HH21 ARG 22 6.239 -34.486 22.298 181 2HH2 ARG 22 HH22 ARG 22 7.623 -34.547 21.249 182 H VAL 23 HN VAL 23 0.019 -33.547 20.094 183 HA VAL 23 HA VAL 23 -0.767 -31.304 21.855 184 HB VAL 23 HB VAL 23 -2.141 -33.994 21.610 185 1HG1 VAL 23 HG11 VAL 23 -3.940 -32.916 22.899 186 2HG1 VAL 23 HG12 VAL 23 -2.955 -31.460 23.041 187 3HG1 VAL 23 HG13 VAL 23 -2.422 -32.963 23.795 188 1HG2 VAL 23 HG21 VAL 23 -2.423 -32.765 19.531 189 2HG2 VAL 23 HG22 VAL 23 -2.945 -31.333 20.419 190 3HG2 VAL 23 HG23 VAL 23 -3.940 -32.788 20.429 191 H ILE 24 HN ILE 24 0.545 -31.256 23.575 192 HA ILE 24 HA ILE 24 1.473 -33.811 24.726 193 HB ILE 24 HB ILE 24 2.615 -31.031 25.130 194 1HG1 ILE 24 HG12 ILE 24 3.677 -33.379 23.524 195 2HG1 ILE 24 HG11 ILE 24 3.005 -31.898 22.851 196 1HG2 ILE 24 HG21 ILE 24 2.942 -32.447 27.088 197 2HG2 ILE 24 HG22 ILE 24 4.474 -32.195 26.253 198 3HG2 ILE 24 HG23 ILE 24 3.614 -33.725 26.074 199 1HD1 ILE 24 HD11 ILE 24 5.419 -31.884 22.750 200 2HD1 ILE 24 HD12 ILE 24 5.517 -32.120 24.495 201 3HD1 ILE 24 HD13 ILE 24 4.842 -30.625 23.842 202 H MET 25 HN MET 25 0.266 -34.459 26.375 203 HA MET 25 HA MET 25 -0.824 -32.432 28.231 204 1HB MET 25 HB2 MET 25 -1.983 -35.157 27.576 205 2HB MET 25 HB1 MET 25 -2.639 -34.021 28.746 206 1HG MET 25 HG2 MET 25 -2.846 -32.395 26.784 207 2HG MET 25 HG1 MET 25 -2.579 -33.801 25.754 208 1HE MET 25 HE1 MET 25 -4.214 -35.952 25.758 209 2HE MET 25 HE2 MET 25 -5.659 -36.064 26.765 210 3HE MET 25 HE3 MET 25 -4.061 -36.085 27.509 211 H THR 26 HN THR 26 -1.101 -33.214 30.474 212 HA THR 26 HA THR 26 1.252 -34.733 31.304 213 HB THR 26 HB THR 26 0.482 -33.973 33.621 214 HG1 THR 26 HG1 THR 26 -1.156 -32.513 33.725 215 1HG2 THR 26 HG21 THR 26 1.290 -31.672 33.303 216 2HG2 THR 26 HG22 THR 26 1.096 -31.844 31.559 217 3HG2 THR 26 HG23 THR 26 2.284 -32.827 32.415 218 H THR 27 HN THR 27 -1.459 -35.836 30.213 219 HA THR 27 HA THR 27 -1.675 -37.973 32.190 220 HB THR 27 HB THR 27 -3.437 -36.387 32.844 221 HG1 THR 27 HG1 THR 27 -4.344 -38.249 33.296 222 1HG2 THR 27 HG21 THR 27 -4.508 -36.793 30.042 223 2HG2 THR 27 HG22 THR 27 -3.815 -35.300 30.680 224 3HG2 THR 27 HG23 THR 27 -5.326 -35.926 31.342 225 H LYS 28 HN LYS 28 -2.517 -39.904 31.387 226 HA LYS 28 HA LYS 28 -2.342 -40.305 28.529 227 1HB LYS 28 HB2 LYS 28 -2.974 -42.162 30.837 228 2HB LYS 28 HB1 LYS 28 -2.924 -42.689 29.161 229 1HG LYS 28 HG2 LYS 28 -0.587 -41.384 30.538 230 2HG LYS 28 HG1 LYS 28 -0.854 -43.127 30.532 231 1HD LYS 28 HD2 LYS 28 -0.738 -41.541 27.969 232 2HD LYS 28 HD1 LYS 28 0.725 -42.137 28.752 233 1HE LYS 28 HE2 LYS 28 0.071 -43.718 27.065 234 2HE LYS 28 HE1 LYS 28 -0.216 -44.441 28.644 235 1HZ LYS 28 HZ1 LYS 28 -2.292 -43.203 26.912 236 2HZ LYS 28 HZ2 LYS 28 -2.564 -43.928 28.417 237 3HZ LYS 28 HZ3 LYS 28 -2.035 -44.859 27.112 238 H ASP 29 HN ASP 29 -4.719 -39.278 30.642 239 HA ASP 29 HA ASP 29 -6.968 -40.646 29.493 240 1HB ASP 29 HB2 ASP 29 -7.063 -39.885 31.825 241 2HB ASP 29 HB1 ASP 29 -6.868 -38.213 31.305 242 H THR 30 HN THR 30 -6.436 -40.138 27.268 243 HA THR 30 HA THR 30 -6.991 -37.416 26.445 244 HB THR 30 HB THR 30 -5.290 -38.492 25.152 245 HG1 THR 30 HG1 THR 30 -6.615 -38.683 23.027 246 1HG2 THR 30 HG21 THR 30 -5.855 -40.836 25.582 247 2HG2 THR 30 HG22 THR 30 -5.653 -40.543 23.855 248 3HG2 THR 30 HG23 THR 30 -7.272 -40.696 24.539 249 H SER 31 HN SER 31 -9.059 -36.938 26.828 250 HA SER 31 HA SER 31 -11.135 -38.591 25.551 251 1HB SER 31 HB2 SER 31 -12.611 -37.936 27.516 252 2HB SER 31 HB1 SER 31 -11.303 -39.055 27.906 253 HG SER 31 HG SER 31 -10.590 -37.626 29.263 254 H THR 32 HN THR 32 -10.948 -35.514 27.323 255 HA THR 32 HA THR 32 -12.729 -33.999 25.908 256 HB THR 32 HB THR 32 -10.077 -32.898 26.870 257 HG1 THR 32 HG1 THR 32 -12.129 -32.938 28.706 258 1HG2 THR 32 HG21 THR 32 -11.435 -30.944 27.489 259 2HG2 THR 32 HG22 THR 32 -12.883 -31.748 26.882 260 3HG2 THR 32 HG23 THR 32 -11.591 -31.299 25.767 261 H LEU 33 HN LEU 33 -9.401 -34.756 25.094 262 HA LEU 33 HA LEU 33 -9.023 -33.020 22.930 263 1HB LEU 33 HB2 LEU 33 -7.180 -34.203 23.988 264 2HB LEU 33 HB1 LEU 33 -7.846 -35.748 23.493 265 HG LEU 33 HG LEU 33 -7.428 -35.169 21.128 266 1HD1 LEU 33 HD11 LEU 33 -6.077 -33.213 20.559 267 2HD1 LEU 33 HD12 LEU 33 -6.135 -32.678 22.239 268 3HD1 LEU 33 HD13 LEU 33 -7.616 -32.746 21.282 269 1HD2 LEU 33 HD21 LEU 33 -5.001 -34.917 22.909 270 2HD2 LEU 33 HD22 LEU 33 -4.982 -35.338 21.196 271 3HD2 LEU 33 HD23 LEU 33 -5.741 -36.422 22.361 272 H LYS 34 HN LYS 34 -10.197 -36.380 23.025 273 HA LYS 34 HA LYS 34 -10.489 -36.513 20.177 274 1HB LYS 34 HB2 LYS 34 -11.575 -38.377 22.301 275 2HB LYS 34 HB1 LYS 34 -11.507 -38.707 20.573 276 1HG LYS 34 HG2 LYS 34 -8.984 -38.412 20.764 277 2HG LYS 34 HG1 LYS 34 -9.217 -38.468 22.513 278 1HD LYS 34 HD2 LYS 34 -9.972 -40.619 20.526 279 2HD LYS 34 HD1 LYS 34 -8.626 -40.671 21.665 280 1HE LYS 34 HE2 LYS 34 -10.133 -40.728 23.537 281 2HE LYS 34 HE1 LYS 34 -11.522 -40.447 22.486 282 1HZ LYS 34 HZ1 LYS 34 -11.056 -42.583 21.412 283 2HZ LYS 34 HZ2 LYS 34 -11.384 -42.759 23.060 284 3HZ LYS 34 HZ3 LYS 34 -9.792 -42.860 22.502 285 H GLU 35 HN GLU 35 -12.559 -35.725 22.875 286 HA GLU 35 HA GLU 35 -15.075 -36.002 21.727 287 1HB GLU 35 HB2 GLU 35 -14.040 -34.013 23.755 288 2HB GLU 35 HB1 GLU 35 -15.738 -34.118 23.309 289 1HG GLU 35 HG2 GLU 35 -14.097 -36.338 24.519 290 2HG GLU 35 HG1 GLU 35 -15.257 -35.323 25.377 291 H LEU 36 HN LEU 36 -12.948 -33.143 21.722 292 HA LEU 36 HA LEU 36 -14.686 -31.489 20.247 293 1HB LEU 36 HB2 LEU 36 -12.879 -29.963 20.052 294 2HB LEU 36 HB1 LEU 36 -12.718 -30.736 21.614 295 HG LEU 36 HG LEU 36 -11.099 -32.332 20.129 296 1HD1 LEU 36 HD11 LEU 36 -10.829 -29.579 18.926 297 2HD1 LEU 36 HD12 LEU 36 -11.378 -31.034 18.094 298 3HD1 LEU 36 HD13 LEU 36 -9.719 -30.927 18.679 299 1HD2 LEU 36 HD21 LEU 36 -10.302 -29.745 21.466 300 2HD2 LEU 36 HD22 LEU 36 -9.225 -31.092 21.095 301 3HD2 LEU 36 HD23 LEU 36 -10.528 -31.302 22.264 302 H LEU 37 HN LEU 37 -12.375 -33.915 19.294 303 HA LEU 37 HA LEU 37 -12.290 -33.250 16.513 304 1HB LEU 37 HB2 LEU 37 -11.724 -35.908 17.844 305 2HB LEU 37 HB1 LEU 37 -11.210 -35.419 16.240 306 HG LEU 37 HG LEU 37 -10.269 -34.125 18.809 307 1HD1 LEU 37 HD11 LEU 37 -8.862 -36.109 17.022 308 2HD1 LEU 37 HD12 LEU 37 -9.471 -36.421 18.648 309 3HD1 LEU 37 HD13 LEU 37 -8.152 -35.276 18.407 310 1HD2 LEU 37 HD21 LEU 37 -10.222 -32.614 16.889 311 2HD2 LEU 37 HD22 LEU 37 -9.311 -33.806 15.961 312 3HD2 LEU 37 HD23 LEU 37 -8.590 -33.059 17.388 313 H GLU 38 HN GLU 38 -14.121 -35.536 18.487 314 HA GLU 38 HA GLU 38 -15.360 -36.904 16.346 315 1HB GLU 38 HB2 GLU 38 -16.061 -36.711 19.280 316 2HB GLU 38 HB1 GLU 38 -16.895 -37.771 18.151 317 1HG GLU 38 HG2 GLU 38 -14.834 -38.972 17.704 318 2HG GLU 38 HG1 GLU 38 -13.941 -37.875 18.755 319 H THR 39 HN THR 39 -16.117 -33.917 17.940 320 HA THR 39 HA THR 39 -18.878 -33.808 17.340 321 HB THR 39 HB THR 39 -18.683 -31.351 17.632 322 HG1 THR 39 HG1 THR 39 -15.907 -31.816 18.071 323 1HG2 THR 39 HG21 THR 39 -17.925 -31.378 19.966 324 2HG2 THR 39 HG22 THR 39 -17.177 -32.954 19.711 325 3HG2 THR 39 HG23 THR 39 -18.930 -32.782 19.609 326 H TYR 40 HN TYR 40 -16.110 -33.530 15.337 327 HA TYR 40 HA TYR 40 -17.469 -32.122 13.192 328 1HB TYR 40 HB2 TYR 40 -14.763 -33.478 13.338 329 2HB TYR 40 HB1 TYR 40 -15.367 -32.654 11.904 330 HD1 TYR 40 HD1 TYR 40 -15.359 -30.259 11.755 331 HD2 TYR 40 HD2 TYR 40 -14.241 -32.177 15.388 332 HE1 TYR 40 HE1 TYR 40 -14.494 -28.124 12.607 333 HE2 TYR 40 HE2 TYR 40 -13.365 -30.038 16.254 334 HH TYR 40 HH TYR 40 -13.868 -27.035 14.524 335 H GLN 41 HN GLN 41 -17.401 -35.247 14.377 336 HA GLN 41 HA GLN 41 -18.226 -37.237 13.688 337 1HB GLN 41 HB2 GLN 41 -19.497 -35.534 11.532 338 2HB GLN 41 HB1 GLN 41 -19.905 -37.217 11.836 339 1HG GLN 41 HG2 GLN 41 -20.197 -35.013 13.873 340 2HG GLN 41 HG1 GLN 41 -21.493 -35.567 12.817 341 1HE2 GLN 41 HE21 GLN 41 -19.479 -36.363 15.548 342 2HE2 GLN 41 HE22 GLN 41 -20.406 -37.721 16.085 343 H ARG 42 HN ARG 42 -15.751 -35.891 12.342 344 HA ARG 42 HA ARG 42 -15.539 -37.631 9.984 345 1HB ARG 42 HB2 ARG 42 -13.678 -36.286 9.289 346 2HB ARG 42 HB1 ARG 42 -14.957 -35.183 9.780 347 1HG ARG 42 HG2 ARG 42 -13.843 -34.651 11.811 348 2HG ARG 42 HG1 ARG 42 -12.689 -35.968 11.602 349 1HD ARG 42 HD2 ARG 42 -11.515 -34.014 11.016 350 2HD ARG 42 HD1 ARG 42 -11.931 -34.780 9.487 351 HE ARG 42 HE ARG 42 -12.971 -32.276 10.548 352 1HH1 ARG 42 HH11 ARG 42 -13.211 -34.738 8.052 353 2HH1 ARG 42 HH12 ARG 42 -14.036 -33.690 6.940 354 1HH2 ARG 42 HH21 ARG 42 -13.988 -30.892 9.065 355 2HH2 ARG 42 HH22 ARG 42 -14.475 -31.511 7.514 356 HA PRO 43 HA PRO 43 -12.786 -40.374 12.146 357 1HB PRO 43 HB2 PRO 43 -11.203 -41.286 10.147 358 2HB PRO 43 HB1 PRO 43 -12.908 -41.736 10.278 359 1HG PRO 43 HG2 PRO 43 -11.629 -39.649 8.543 360 2HG PRO 43 HG1 PRO 43 -12.877 -40.839 8.124 361 1HD PRO 43 HD2 PRO 43 -13.449 -38.241 8.705 362 2HD PRO 43 HD1 PRO 43 -14.571 -39.573 9.045 363 H PHE 44 HN PHE 44 -10.808 -40.372 13.163 364 HA PHE 44 HA PHE 44 -8.702 -38.599 12.182 365 1HB PHE 44 HB2 PHE 44 -8.402 -37.546 14.383 366 2HB PHE 44 HB1 PHE 44 -9.997 -37.200 13.729 367 HD1 PHE 44 HD1 PHE 44 -8.129 -38.961 16.342 368 HD2 PHE 44 HD2 PHE 44 -11.997 -38.126 14.759 369 HE1 PHE 44 HE1 PHE 44 -9.156 -39.792 18.414 370 HE2 PHE 44 HE2 PHE 44 -13.024 -38.958 16.832 371 HZ PHE 44 HZ PHE 44 -11.606 -39.792 18.661 372 H LYS 45 HN LYS 45 -6.645 -39.082 12.993 373 HA LYS 45 HA LYS 45 -6.389 -41.805 14.068 374 1HB LYS 45 HB2 LYS 45 -5.311 -41.400 11.894 375 2HB LYS 45 HB1 LYS 45 -4.391 -40.070 12.586 376 1HG LYS 45 HG2 LYS 45 -3.308 -41.699 14.131 377 2HG LYS 45 HG1 LYS 45 -4.147 -42.997 13.279 378 1HD LYS 45 HD2 LYS 45 -1.840 -42.716 12.475 379 2HD LYS 45 HD1 LYS 45 -3.020 -42.394 11.203 380 1HE LYS 45 HE2 LYS 45 -2.732 -40.022 11.454 381 2HE LYS 45 HE1 LYS 45 -1.728 -40.244 12.884 382 1HZ LYS 45 HZ1 LYS 45 -0.398 -39.749 10.944 383 2HZ LYS 45 HZ2 LYS 45 -1.024 -41.089 10.127 384 3HZ LYS 45 HZ3 LYS 45 -0.063 -41.311 11.497 385 H LEU 46 HN LEU 46 -6.191 -41.778 16.214 386 HA LEU 46 HA LEU 46 -4.731 -39.626 17.558 387 1HB LEU 46 HB2 LEU 46 -6.997 -40.612 18.325 388 2HB LEU 46 HB1 LEU 46 -6.077 -41.999 18.862 389 HG LEU 46 HG LEU 46 -6.627 -40.425 20.693 390 1HD1 LEU 46 HD11 LEU 46 -3.664 -40.604 20.151 391 2HD1 LEU 46 HD12 LEU 46 -4.655 -41.852 20.906 392 3HD1 LEU 46 HD13 LEU 46 -4.426 -40.302 21.713 393 1HD2 LEU 46 HD21 LEU 46 -4.828 -38.495 19.226 394 2HD2 LEU 46 HD22 LEU 46 -5.522 -38.255 20.830 395 3HD2 LEU 46 HD23 LEU 46 -6.576 -38.345 19.420 396 H GLU 47 HN GLU 47 -2.621 -39.864 18.035 397 HA GLU 47 HA GLU 47 -1.511 -42.600 18.193 398 1HB GLU 47 HB2 GLU 47 -0.190 -40.132 17.040 399 2HB GLU 47 HB1 GLU 47 0.584 -41.697 17.239 400 1HG GLU 47 HG2 GLU 47 -1.002 -42.680 15.654 401 2HG GLU 47 HG1 GLU 47 -1.763 -41.099 15.447 402 H PHE 48 HN PHE 48 -0.264 -43.053 19.924 403 HA PHE 48 HA PHE 48 0.647 -40.864 21.655 404 1HB PHE 48 HB2 PHE 48 -0.410 -42.750 22.806 405 2HB PHE 48 HB1 PHE 48 0.706 -43.877 22.042 406 HD1 PHE 48 HD1 PHE 48 2.817 -44.330 23.008 407 HD2 PHE 48 HD2 PHE 48 0.499 -41.054 24.440 408 HE1 PHE 48 HE1 PHE 48 4.369 -44.061 24.900 409 HE2 PHE 48 HE2 PHE 48 2.048 -40.785 26.330 410 HZ PHE 48 HZ PHE 48 3.987 -42.283 26.561 411 H LYS 49 HN LYS 49 2.518 -39.990 21.000 412 HA LYS 49 HA LYS 49 4.311 -41.435 19.265 413 1HB LYS 49 HB2 LYS 49 4.556 -38.671 20.473 414 2HB LYS 49 HB1 LYS 49 5.614 -39.330 19.236 415 1HG LYS 49 HG2 LYS 49 2.649 -39.007 18.820 416 2HG LYS 49 HG1 LYS 49 3.802 -37.721 18.481 417 1HD LYS 49 HD2 LYS 49 3.574 -38.705 16.399 418 2HD LYS 49 HD1 LYS 49 4.997 -39.532 17.022 419 1HE LYS 49 HE2 LYS 49 3.626 -41.456 17.635 420 2HE LYS 49 HE1 LYS 49 2.177 -40.615 17.097 421 1HZ LYS 49 HZ1 LYS 49 2.973 -42.189 15.446 422 2HZ LYS 49 HZ2 LYS 49 4.462 -41.391 15.368 423 3HZ LYS 49 HZ3 LYS 49 3.056 -40.608 14.850 424 H ASN 50 HN ASN 50 4.879 -39.691 22.333 425 HA ASN 50 HA ASN 50 6.460 -41.814 23.423 426 1HB ASN 50 HB2 ASN 50 8.053 -40.892 21.753 427 2HB ASN 50 HB1 ASN 50 7.908 -39.307 22.502 428 1HD2 ASN 50 HD21 ASN 50 10.089 -39.197 22.975 429 2HD2 ASN 50 HD22 ASN 50 10.834 -40.165 24.200 430 H THR 51 HN THR 51 7.364 -41.222 25.536 431 HA THR 51 HA THR 51 5.970 -38.937 26.781 432 HB THR 51 HB THR 51 5.003 -41.065 27.549 433 HG1 THR 51 HG1 THR 51 5.288 -39.271 29.038 434 1HG2 THR 51 HG21 THR 51 6.946 -42.528 27.212 435 2HG2 THR 51 HG22 THR 51 6.323 -42.662 28.856 436 3HG2 THR 51 HG23 THR 51 7.784 -41.726 28.541 437 H SER 52 HN SER 52 7.141 -37.730 28.287 438 HA SER 52 HA SER 52 9.894 -37.449 27.973 439 1HB SER 52 HB2 SER 52 8.290 -36.720 30.442 440 2HB SER 52 HB1 SER 52 9.800 -35.984 29.904 441 HG SER 52 HG SER 52 8.553 -35.432 27.931 442 H LYS 53 HN LYS 53 11.597 -37.823 29.638 443 HA LYS 53 HA LYS 53 11.696 -40.566 30.358 444 1HB LYS 53 HB2 LYS 53 13.491 -38.228 31.048 445 2HB LYS 53 HB1 LYS 53 13.823 -39.869 31.582 446 1HG LYS 53 HG2 LYS 53 15.140 -39.408 29.632 447 2HG LYS 53 HG1 LYS 53 13.903 -40.591 29.212 448 1HD LYS 53 HD2 LYS 53 12.538 -38.765 28.235 449 2HD LYS 53 HD1 LYS 53 13.837 -37.627 28.601 450 1HE LYS 53 HE2 LYS 53 14.094 -40.044 26.801 451 2HE LYS 53 HE1 LYS 53 13.847 -38.390 26.244 452 1HZ LYS 53 HZ1 LYS 53 16.183 -39.344 27.808 453 2HZ LYS 53 HZ2 LYS 53 15.950 -37.771 27.235 454 3HZ LYS 53 HZ3 LYS 53 16.170 -39.043 26.146 455 H ASN 54 HN ASN 54 10.762 -37.670 32.035 456 HA ASN 54 HA ASN 54 10.654 -38.806 34.660 457 1HB ASN 54 HB2 ASN 54 9.287 -36.374 33.470 458 2HB ASN 54 HB1 ASN 54 9.193 -36.816 35.172 459 1HD2 ASN 54 HD21 ASN 54 10.166 -34.884 35.797 460 2HD2 ASN 54 HD22 ASN 54 11.857 -34.595 35.574 461 H ALA 55 HN ALA 55 8.803 -39.262 31.893 462 HA ALA 55 HA ALA 55 6.864 -40.320 31.401 463 1HB ALA 55 HB1 ALA 55 6.101 -42.063 32.895 464 2HB ALA 55 HB2 ALA 55 7.019 -41.367 34.231 465 3HB ALA 55 HB3 ALA 55 7.864 -42.060 32.848 466 H LYS 56 HN LYS 56 6.864 -37.639 32.802 467 HA LYS 56 HA LYS 56 4.232 -37.665 34.090 468 1HB LYS 56 HB2 LYS 56 6.103 -36.538 35.246 469 2HB LYS 56 HB1 LYS 56 6.279 -35.442 33.884 470 1HG LYS 56 HG2 LYS 56 4.084 -34.502 34.306 471 2HG LYS 56 HG1 LYS 56 3.811 -35.663 35.609 472 1HD LYS 56 HD2 LYS 56 5.964 -33.534 35.555 473 2HD LYS 56 HD1 LYS 56 4.465 -33.462 36.484 474 1HE LYS 56 HE2 LYS 56 5.152 -35.437 37.757 475 2HE LYS 56 HE1 LYS 56 6.638 -35.539 36.812 476 1HZ LYS 56 HZ1 LYS 56 7.257 -33.346 37.671 477 2HZ LYS 56 HZ2 LYS 56 7.061 -34.477 38.913 478 3HZ LYS 56 HZ3 LYS 56 5.863 -33.320 38.626 479 H PHE 57 HN PHE 57 5.862 -36.574 31.218 480 HA PHE 57 HA PHE 57 3.409 -35.212 30.311 481 1HB PHE 57 HB2 PHE 57 6.237 -34.808 29.292 482 2HB PHE 57 HB1 PHE 57 4.811 -33.895 28.812 483 HD1 PHE 57 HD1 PHE 57 7.397 -34.329 31.334 484 HD2 PHE 57 HD2 PHE 57 3.782 -32.284 30.373 485 HE1 PHE 57 HE1 PHE 57 7.840 -32.707 33.127 486 HE2 PHE 57 HE2 PHE 57 4.226 -30.659 32.166 487 HZ PHE 57 HZ PHE 57 6.256 -30.869 33.544 488 H TYR 58 HN TYR 58 2.461 -35.891 28.454 489 HA TYR 58 HA TYR 58 3.700 -38.172 27.052 490 1HB TYR 58 HB2 TYR 58 0.751 -37.776 27.645 491 2HB TYR 58 HB1 TYR 58 1.472 -39.155 26.821 492 HD1 TYR 58 HD1 TYR 58 3.053 -40.657 28.131 493 HD2 TYR 58 HD2 TYR 58 0.607 -37.722 30.012 494 HE1 TYR 58 HE1 TYR 58 3.356 -41.794 30.290 495 HE2 TYR 58 HE2 TYR 58 0.903 -38.854 32.174 496 HH TYR 58 HH TYR 58 3.262 -41.152 32.733 497 H SER 59 HN SER 59 4.030 -37.805 24.966 498 HA SER 59 HA SER 59 2.756 -35.517 23.682 499 1HB SER 59 HB2 SER 59 5.061 -37.289 22.830 500 2HB SER 59 HB1 SER 59 4.437 -35.945 21.874 501 HG SER 59 HG SER 59 6.064 -35.927 24.079 502 H PHE 60 HN PHE 60 0.895 -35.874 22.708 503 HA PHE 60 HA PHE 60 0.454 -38.378 21.226 504 1HB PHE 60 HB2 PHE 60 -1.530 -36.251 22.100 505 2HB PHE 60 HB1 PHE 60 -1.938 -37.723 21.227 506 HD1 PHE 60 HD1 PHE 60 -1.141 -36.269 24.460 507 HD2 PHE 60 HD2 PHE 60 -1.773 -39.917 22.348 508 HE1 PHE 60 HE1 PHE 60 -1.442 -37.452 26.596 509 HE2 PHE 60 HE2 PHE 60 -2.072 -41.101 24.483 510 HZ PHE 60 HZ PHE 60 -1.908 -39.869 26.610 511 H ASN 61 HN ASN 61 -0.379 -38.253 19.078 512 HA ASN 61 HA ASN 61 -0.129 -35.627 17.755 513 1HB ASN 61 HB2 ASN 61 1.821 -37.033 17.159 514 2HB ASN 61 HB1 ASN 61 0.734 -38.299 16.597 515 1HD2 ASN 61 HD21 ASN 61 -0.286 -38.075 14.609 516 2HD2 ASN 61 HD22 ASN 61 0.115 -36.818 13.487 517 H VAL 62 HN VAL 62 -1.967 -35.033 16.847 518 HA VAL 62 HA VAL 62 -4.005 -37.084 16.270 519 HB VAL 62 HB VAL 62 -4.353 -34.107 16.722 520 1HG1 VAL 62 HG11 VAL 62 -6.034 -34.986 15.188 521 2HG1 VAL 62 HG12 VAL 62 -6.764 -34.591 16.744 522 3HG1 VAL 62 HG13 VAL 62 -6.426 -36.273 16.330 523 1HG2 VAL 62 HG21 VAL 62 -5.041 -36.440 18.517 524 2HG2 VAL 62 HG22 VAL 62 -5.432 -34.749 18.833 525 3HG2 VAL 62 HG23 VAL 62 -3.747 -35.270 18.781 526 H SER 63 HN SER 63 -4.233 -37.565 14.177 527 HA SER 63 HA SER 63 -3.760 -35.447 12.175 528 1HB SER 63 HB2 SER 63 -3.787 -38.444 11.723 529 2HB SER 63 HB1 SER 63 -3.308 -37.201 10.568 530 HG SER 63 HG SER 63 -1.531 -36.729 11.864 531 H MET 64 HN MET 64 -5.658 -34.519 11.686 532 HA MET 64 HA MET 64 -7.943 -36.279 11.064 533 1HB MET 64 HB2 MET 64 -9.496 -34.765 12.125 534 2HB MET 64 HB1 MET 64 -8.267 -35.212 13.301 535 1HG MET 64 HG2 MET 64 -7.126 -33.078 12.912 536 2HG MET 64 HG1 MET 64 -8.369 -32.630 11.746 537 1HE MET 64 HE1 MET 64 -11.547 -32.407 14.075 538 2HE MET 64 HE2 MET 64 -10.987 -33.838 13.208 539 3HE MET 64 HE3 MET 64 -10.949 -32.260 12.422 540 H GLU 65 HN GLU 65 -9.561 -35.201 9.668 541 HA GLU 65 HA GLU 65 -8.276 -33.825 7.499 542 1HB GLU 65 HB2 GLU 65 -11.241 -34.267 7.887 543 2HB GLU 65 HB1 GLU 65 -10.396 -33.969 6.376 544 1HG GLU 65 HG2 GLU 65 -9.374 -36.134 6.447 545 2HG GLU 65 HG1 GLU 65 -10.016 -36.431 8.067 546 H VAL 66 HN VAL 66 -8.630 -31.726 6.816 547 HA VAL 66 HA VAL 66 -10.571 -30.088 8.287 548 HB VAL 66 HB VAL 66 -9.016 -28.111 8.044 549 1HG1 VAL 66 HG11 VAL 66 -7.659 -28.663 10.018 550 2HG1 VAL 66 HG12 VAL 66 -8.054 -30.370 9.812 551 3HG1 VAL 66 HG13 VAL 66 -9.326 -29.210 10.201 552 1HG2 VAL 66 HG21 VAL 66 -6.616 -28.536 7.774 553 2HG2 VAL 66 HG22 VAL 66 -7.514 -29.041 6.342 554 3HG2 VAL 66 HG23 VAL 66 -6.944 -30.247 7.496 555 H SER 67 HN SER 67 -11.944 -29.091 6.952 556 HA SER 67 HA SER 67 -11.594 -29.475 4.090 557 1HB SER 67 HB2 SER 67 -13.748 -30.013 5.271 558 2HB SER 67 HB1 SER 67 -13.957 -28.293 5.582 559 HG SER 67 HG SER 67 -13.511 -28.445 3.019 560 H ASN 68 HN ASN 68 -11.279 -26.991 6.426 561 HA ASN 68 HA ASN 68 -10.528 -25.097 4.340 562 1HB ASN 68 HB2 ASN 68 -11.846 -23.274 5.335 563 2HB ASN 68 HB1 ASN 68 -12.894 -24.576 4.782 564 1HD2 ASN 68 HD21 ASN 68 -14.015 -25.790 6.282 565 2HD2 ASN 68 HD22 ASN 68 -14.127 -25.353 7.950 566 H GLU 69 HN GLU 69 -9.856 -22.947 5.644 567 HA GLU 69 HA GLU 69 -7.594 -23.842 7.197 568 1HB GLU 69 HB2 GLU 69 -7.404 -22.054 5.477 569 2HB GLU 69 HB1 GLU 69 -8.417 -21.016 6.473 570 1HG GLU 69 HG2 GLU 69 -6.752 -20.998 8.224 571 2HG GLU 69 HG1 GLU 69 -5.760 -22.150 7.335 572 H SER 70 HN SER 70 -10.663 -22.277 7.823 573 HA SER 70 HA SER 70 -10.121 -21.247 10.373 574 1HB SER 70 HB2 SER 70 -12.761 -22.317 9.327 575 2HB SER 70 HB1 SER 70 -12.549 -21.223 10.695 576 HG SER 70 HG SER 70 -12.976 -20.478 8.297 577 H GLU 71 HN GLU 71 -11.206 -24.459 9.320 578 HA GLU 71 HA GLU 71 -11.681 -25.576 11.827 579 1HB GLU 71 HB2 GLU 71 -10.840 -26.802 9.209 580 2HB GLU 71 HB1 GLU 71 -10.999 -27.793 10.653 581 1HG GLU 71 HG2 GLU 71 -13.350 -27.010 10.867 582 2HG GLU 71 HG1 GLU 71 -13.164 -26.165 9.331 583 H ARG 72 HN ARG 72 -8.645 -25.682 9.924 584 HA ARG 72 HA ARG 72 -7.270 -27.165 11.890 585 1HB ARG 72 HB2 ARG 72 -5.206 -26.623 10.648 586 2HB ARG 72 HB1 ARG 72 -6.488 -27.241 9.628 587 1HG ARG 72 HG2 ARG 72 -5.657 -25.564 8.318 588 2HG ARG 72 HG1 ARG 72 -6.948 -24.707 9.159 589 1HD ARG 72 HD2 ARG 72 -5.463 -23.524 10.500 590 2HD ARG 72 HD1 ARG 72 -4.175 -24.713 10.297 591 HE ARG 72 HE ARG 72 -4.623 -23.654 7.786 592 1HH1 ARG 72 HH11 ARG 72 -3.753 -22.320 10.908 593 2HH1 ARG 72 HH12 ARG 72 -2.719 -21.098 10.236 594 1HH2 ARG 72 HH21 ARG 72 -3.239 -22.049 6.907 595 2HH2 ARG 72 HH22 ARG 72 -2.405 -20.964 7.974 596 H ASN 73 HN ASN 73 -8.143 -23.904 11.856 597 HA ASN 73 HA ASN 73 -6.087 -23.156 13.805 598 1HB ASN 73 HB2 ASN 73 -8.250 -21.563 12.417 599 2HB ASN 73 HB1 ASN 73 -7.242 -20.896 13.698 600 1HD2 ASN 73 HD21 ASN 73 -7.489 -20.156 10.872 601 2HD2 ASN 73 HD22 ASN 73 -5.888 -20.243 10.231 602 H GLU 74 HN GLU 74 -9.583 -23.677 13.566 603 HA GLU 74 HA GLU 74 -10.145 -22.732 16.198 604 1HB GLU 74 HB2 GLU 74 -12.390 -23.496 15.845 605 2HB GLU 74 HB1 GLU 74 -11.819 -22.795 14.341 606 1HG GLU 74 HG2 GLU 74 -11.415 -25.038 13.461 607 2HG GLU 74 HG1 GLU 74 -12.030 -25.729 14.960 608 H ILE 75 HN ILE 75 -9.725 -25.929 14.762 609 HA ILE 75 HA ILE 75 -10.283 -27.522 16.972 610 HB ILE 75 HB ILE 75 -8.291 -27.966 14.733 611 1HG1 ILE 75 HG12 ILE 75 -11.068 -29.129 15.014 612 2HG1 ILE 75 HG11 ILE 75 -10.787 -27.577 14.234 613 1HG2 ILE 75 HG21 ILE 75 -8.453 -30.358 15.263 614 2HG2 ILE 75 HG22 ILE 75 -9.457 -29.980 16.663 615 3HG2 ILE 75 HG23 ILE 75 -7.778 -29.442 16.612 616 1HD1 ILE 75 HD11 ILE 75 -10.986 -29.373 12.624 617 2HD1 ILE 75 HD12 ILE 75 -9.621 -30.209 13.367 618 3HD1 ILE 75 HD13 ILE 75 -9.381 -28.648 12.578 619 H PHE 76 HN PHE 76 -7.251 -26.006 15.966 620 HA PHE 76 HA PHE 76 -5.539 -26.973 17.928 621 1HB PHE 76 HB2 PHE 76 -4.783 -25.680 15.982 622 2HB PHE 76 HB1 PHE 76 -5.578 -24.241 16.607 623 HD1 PHE 76 HD1 PHE 76 -4.573 -22.919 18.341 624 HD2 PHE 76 HD2 PHE 76 -2.749 -26.553 17.060 625 HE1 PHE 76 HE1 PHE 76 -2.512 -22.302 19.533 626 HE2 PHE 76 HE2 PHE 76 -0.687 -25.938 18.253 627 HZ PHE 76 HZ PHE 76 -0.569 -23.814 19.493 628 H GLN 77 HN GLN 77 -7.858 -24.328 18.029 629 HA GLN 77 HA GLN 77 -7.045 -23.322 20.583 630 1HB GLN 77 HB2 GLN 77 -9.529 -22.882 18.909 631 2HB GLN 77 HB1 GLN 77 -9.221 -22.045 20.427 632 1HG GLN 77 HG2 GLN 77 -7.315 -20.937 19.528 633 2HG GLN 77 HG1 GLN 77 -7.335 -21.944 18.082 634 1HE2 GLN 77 HE21 GLN 77 -8.749 -21.478 16.444 635 2HE2 GLN 77 HE22 GLN 77 -9.670 -20.018 16.374 636 H LYS 78 HN LYS 78 -9.502 -25.563 19.415 637 HA LYS 78 HA LYS 78 -10.862 -25.882 21.884 638 1HB LYS 78 HB2 LYS 78 -10.672 -27.945 19.673 639 2HB LYS 78 HB1 LYS 78 -11.952 -27.775 20.870 640 1HG LYS 78 HG2 LYS 78 -12.428 -25.507 19.843 641 2HG LYS 78 HG1 LYS 78 -11.333 -25.974 18.547 642 1HD LYS 78 HD2 LYS 78 -12.740 -27.886 18.004 643 2HD LYS 78 HD1 LYS 78 -13.837 -27.472 19.325 644 1HE LYS 78 HE2 LYS 78 -14.398 -25.372 18.251 645 2HE LYS 78 HE1 LYS 78 -13.213 -25.669 16.980 646 1HZ LYS 78 HZ1 LYS 78 -14.515 -27.617 16.322 647 2HZ LYS 78 HZ2 LYS 78 -15.402 -26.186 16.194 648 3HZ LYS 78 HZ3 LYS 78 -15.679 -27.240 17.487 649 H ILE 79 HN ILE 79 -8.104 -27.443 20.401 650 HA ILE 79 HA ILE 79 -7.702 -29.526 22.247 651 HB ILE 79 HB ILE 79 -5.686 -28.011 20.566 652 1HG1 ILE 79 HG12 ILE 79 -7.021 -30.702 20.130 653 2HG1 ILE 79 HG11 ILE 79 -7.439 -29.214 19.290 654 1HG2 ILE 79 HG21 ILE 79 -5.333 -30.629 22.037 655 2HG2 ILE 79 HG22 ILE 79 -4.566 -29.095 22.450 656 3HG2 ILE 79 HG23 ILE 79 -4.167 -29.897 20.933 657 1HD1 ILE 79 HD11 ILE 79 -4.809 -30.667 19.134 658 2HD1 ILE 79 HD12 ILE 79 -5.195 -29.155 18.311 659 3HD1 ILE 79 HD13 ILE 79 -6.068 -30.631 17.899 660 H SER 80 HN SER 80 -7.039 -26.119 22.403 661 HA SER 80 HA SER 80 -5.228 -26.300 24.642 662 1HB SER 80 HB2 SER 80 -6.694 -23.894 23.533 663 2HB SER 80 HB1 SER 80 -5.303 -23.864 24.619 664 HG SER 80 HG SER 80 -5.146 -25.182 22.127 665 H GLN 81 HN GLN 81 -8.452 -26.873 24.438 666 HA GLN 81 HA GLN 81 -9.222 -25.387 26.846 667 1HB GLN 81 HB2 GLN 81 -10.884 -26.965 24.869 668 2HB GLN 81 HB1 GLN 81 -11.532 -26.107 26.262 669 1HG GLN 81 HG2 GLN 81 -10.792 -23.990 25.345 670 2HG GLN 81 HG1 GLN 81 -10.031 -24.818 23.988 671 1HE2 GLN 81 HE21 GLN 81 -12.220 -26.735 23.696 672 2HE2 GLN 81 HE22 GLN 81 -13.526 -25.863 22.975 673 H LEU 82 HN LEU 82 -7.807 -28.289 26.310 674 HA LEU 82 HA LEU 82 -9.546 -30.028 27.791 675 1HB LEU 82 HB2 LEU 82 -6.645 -30.690 27.593 676 2HB LEU 82 HB1 LEU 82 -8.048 -31.720 27.401 677 HG LEU 82 HG LEU 82 -7.004 -29.760 25.362 678 1HD1 LEU 82 HD11 LEU 82 -6.471 -31.743 24.044 679 2HD1 LEU 82 HD12 LEU 82 -6.999 -32.771 25.378 680 3HD1 LEU 82 HD13 LEU 82 -5.594 -31.721 25.574 681 1HD2 LEU 82 HD21 LEU 82 -8.690 -30.705 23.857 682 2HD2 LEU 82 HD22 LEU 82 -9.417 -29.883 25.236 683 3HD2 LEU 82 HD23 LEU 82 -9.350 -31.647 25.196 684 H ASP 83 HN ASP 83 -7.096 -27.759 28.595 685 HA ASP 83 HA ASP 83 -6.263 -26.976 30.550 686 1HB ASP 83 HB2 ASP 83 -8.488 -27.186 31.527 687 2HB ASP 83 HB1 ASP 83 -8.213 -28.894 31.853 688 H LYS 84 HN LYS 84 -6.571 -30.458 30.298 689 HA LYS 84 HA LYS 84 -4.371 -31.169 31.943 690 1HB LYS 84 HB2 LYS 84 -5.720 -32.651 29.670 691 2HB LYS 84 HB1 LYS 84 -4.617 -33.372 30.836 692 1HG LYS 84 HG2 LYS 84 -6.156 -33.261 32.566 693 2HG LYS 84 HG1 LYS 84 -7.093 -31.982 31.789 694 1HD LYS 84 HD2 LYS 84 -8.024 -33.498 30.211 695 2HD LYS 84 HD1 LYS 84 -6.897 -34.773 30.664 696 1HE LYS 84 HE2 LYS 84 -7.946 -34.981 32.839 697 2HE LYS 84 HE1 LYS 84 -8.994 -33.604 32.501 698 1HZ LYS 84 HZ1 LYS 84 -10.074 -35.795 32.218 699 2HZ LYS 84 HZ2 LYS 84 -9.026 -36.131 30.938 700 3HZ LYS 84 HZ3 LYS 84 -10.119 -34.841 30.826 701 H VAL 85 HN VAL 85 -4.571 -29.767 28.875 702 HA VAL 85 HA VAL 85 -2.131 -30.929 27.817 703 HB VAL 85 HB VAL 85 -3.980 -30.498 26.280 704 1HG1 VAL 85 HG11 VAL 85 -3.614 -27.579 26.968 705 2HG1 VAL 85 HG12 VAL 85 -4.999 -28.585 27.395 706 3HG1 VAL 85 HG13 VAL 85 -4.667 -28.215 25.703 707 1HG2 VAL 85 HG21 VAL 85 -1.708 -30.424 25.399 708 2HG2 VAL 85 HG22 VAL 85 -1.611 -28.698 25.750 709 3HG2 VAL 85 HG23 VAL 85 -2.748 -29.289 24.537 710 H VAL 86 HN VAL 86 -0.167 -29.939 27.728 711 HA VAL 86 HA VAL 86 0.058 -27.317 29.070 712 HB VAL 86 HB VAL 86 2.321 -27.999 29.786 713 1HG1 VAL 86 HG11 VAL 86 0.146 -29.923 30.628 714 2HG1 VAL 86 HG12 VAL 86 0.431 -28.317 31.300 715 3HG1 VAL 86 HG13 VAL 86 1.632 -29.591 31.519 716 1HG2 VAL 86 HG21 VAL 86 1.589 -30.692 28.617 717 2HG2 VAL 86 HG22 VAL 86 3.015 -30.357 29.600 718 3HG2 VAL 86 HG23 VAL 86 2.836 -29.600 28.017 719 H GLN 87 HN GLN 87 0.519 -28.945 26.135 720 HA GLN 87 HA GLN 87 1.836 -26.647 24.992 721 1HB GLN 87 HB2 GLN 87 3.762 -27.929 25.830 722 2HB GLN 87 HB1 GLN 87 3.216 -29.344 24.942 723 1HG GLN 87 HG2 GLN 87 5.009 -28.321 23.738 724 2HG GLN 87 HG1 GLN 87 3.518 -28.090 22.830 725 1HE2 GLN 87 HE21 GLN 87 5.986 -26.600 22.659 726 2HE2 GLN 87 HE22 GLN 87 5.596 -24.954 23.016 727 H THR 88 HN THR 88 1.335 -26.371 22.891 728 HA THR 88 HA THR 88 0.179 -28.600 21.362 729 HB THR 88 HB THR 88 -1.600 -27.032 20.510 730 HG1 THR 88 HG1 THR 88 -0.450 -25.108 21.339 731 1HG2 THR 88 HG21 THR 88 -3.082 -27.257 22.446 732 2HG2 THR 88 HG22 THR 88 -1.692 -27.594 23.480 733 3HG2 THR 88 HG23 THR 88 -2.136 -28.727 22.203 734 H LEU 89 HN LEU 89 1.228 -28.733 19.465 735 HA LEU 89 HA LEU 89 2.168 -26.234 18.192 736 1HB LEU 89 HB2 LEU 89 3.321 -29.021 17.911 737 2HB LEU 89 HB1 LEU 89 3.837 -27.625 16.988 738 HG LEU 89 HG LEU 89 4.449 -26.561 19.248 739 1HD1 LEU 89 HD11 LEU 89 4.241 -29.440 20.131 740 2HD1 LEU 89 HD12 LEU 89 3.235 -28.105 20.693 741 3HD1 LEU 89 HD13 LEU 89 4.959 -28.122 21.058 742 1HD2 LEU 89 HD21 LEU 89 5.983 -28.977 18.277 743 2HD2 LEU 89 HD22 LEU 89 6.625 -27.679 19.283 744 3HD2 LEU 89 HD23 LEU 89 6.105 -27.338 17.634 745 H GLY 90 HN GLY 90 1.533 -25.838 16.118 746 1HA GLY 90 HA2 GLY 90 -0.488 -27.670 15.010 747 2HA GLY 90 HA1 GLY 90 -0.288 -25.974 14.594 748 H SER 91 HN SER 91 2.747 -27.133 14.656 749 HA SER 91 HA SER 91 2.711 -27.793 11.785 750 1HB SER 91 HB2 SER 91 3.809 -25.606 12.458 751 2HB SER 91 HB1 SER 91 5.018 -26.557 13.317 752 HG SER 91 HG SER 91 4.452 -26.566 10.531 Start of MODEL 8 1 1H GLN 1 HT1 GLN 1 -10.290 -14.284 3.447 2 2H GLN 1 HT2 GLN 1 -10.133 -12.903 2.489 3 3H GLN 1 HT3 GLN 1 -8.774 -13.842 2.844 4 HA GLN 1 HA GLN 1 -9.610 -15.664 1.574 5 1HB GLN 1 HB2 GLN 1 -11.954 -13.842 0.950 6 2HB GLN 1 HB1 GLN 1 -11.677 -15.434 0.257 7 1HG GLN 1 HG2 GLN 1 -12.333 -14.777 3.119 8 2HG GLN 1 HG1 GLN 1 -13.344 -15.624 1.951 9 1HE2 GLN 1 HE21 GLN 1 -12.837 -17.760 1.395 10 2HE2 GLN 1 HE22 GLN 1 -11.810 -18.737 2.385 11 H GLY 2 HN GLY 2 -9.186 -15.823 -0.689 12 1HA GLY 2 HA2 GLY 2 -9.185 -14.152 -2.725 13 2HA GLY 2 HA1 GLY 2 -7.877 -13.447 -1.784 14 H HIS 3 HN HIS 3 -7.371 -14.322 -4.304 15 HA HIS 3 HA HIS 3 -5.970 -16.879 -3.953 16 1HB HIS 3 HB2 HIS 3 -5.677 -16.846 -6.418 17 2HB HIS 3 HB1 HIS 3 -7.366 -16.810 -5.937 18 HD1 HIS 3 HD1 HIS 3 -8.605 -14.461 -6.225 19 HD2 HIS 3 HD2 HIS 3 -4.872 -14.766 -8.028 20 HE1 HIS 3 HE1 HIS 3 -8.496 -12.574 -7.880 21 HE2 HIS 3 HE2 HIS 3 -6.300 -12.885 -9.071 22 H MET 4 HN MET 4 -4.213 -16.307 -2.786 23 HA MET 4 HA MET 4 -2.637 -13.975 -3.450 24 1HB MET 4 HB2 MET 4 -2.180 -16.160 -1.400 25 2HB MET 4 HB1 MET 4 -1.231 -14.685 -1.534 26 1HG MET 4 HG2 MET 4 -3.184 -13.347 -0.995 27 2HG MET 4 HG1 MET 4 -4.184 -14.797 -0.935 28 1HE MET 4 HE1 MET 4 -1.238 -12.816 0.739 29 2HE MET 4 HE2 MET 4 -0.489 -14.383 0.426 30 3HE MET 4 HE3 MET 4 -0.808 -13.873 2.083 31 HA PRO 5 HA PRO 5 0.039 -16.215 -6.227 32 1HB PRO 5 HB2 PRO 5 1.983 -14.341 -6.511 33 2HB PRO 5 HB1 PRO 5 0.392 -14.180 -7.264 34 1HG PRO 5 HG2 PRO 5 1.433 -12.925 -4.749 35 2HG PRO 5 HG1 PRO 5 0.459 -12.198 -6.043 36 1HD PRO 5 HD2 PRO 5 -0.608 -13.061 -3.685 37 2HD PRO 5 HD1 PRO 5 -1.512 -13.057 -5.213 38 H SER 6 HN SER 6 1.039 -17.926 -5.313 39 HA SER 6 HA SER 6 2.607 -17.928 -2.998 40 1HB SER 6 HB2 SER 6 2.739 -19.853 -5.341 41 2HB SER 6 HB1 SER 6 3.328 -20.167 -3.707 42 HG SER 6 HG SER 6 0.748 -20.185 -4.702 43 H ASP 7 HN ASP 7 4.582 -17.172 -2.622 44 HA ASP 7 HA ASP 7 6.094 -15.940 -4.724 45 1HB ASP 7 HB2 ASP 7 5.903 -14.966 -2.442 46 2HB ASP 7 HB1 ASP 7 6.821 -16.328 -1.805 47 H SER 8 HN SER 8 8.498 -16.321 -4.884 48 HA SER 8 HA SER 8 8.977 -19.020 -5.624 49 1HB SER 8 HB2 SER 8 9.981 -17.039 -6.758 50 2HB SER 8 HB1 SER 8 10.968 -16.751 -5.328 51 HG SER 8 HG SER 8 11.861 -18.881 -5.675 52 H LYS 9 HN LYS 9 9.675 -17.131 -2.768 53 HA LYS 9 HA LYS 9 11.506 -19.134 -1.703 54 1HB LYS 9 HB2 LYS 9 10.465 -16.659 -0.303 55 2HB LYS 9 HB1 LYS 9 11.896 -17.599 0.101 56 1HG LYS 9 HG2 LYS 9 11.513 -15.915 -2.375 57 2HG LYS 9 HG1 LYS 9 12.496 -15.496 -0.974 58 1HD LYS 9 HD2 LYS 9 13.033 -18.017 -2.525 59 2HD LYS 9 HD1 LYS 9 13.644 -16.465 -3.093 60 1HE LYS 9 HE2 LYS 9 15.343 -17.612 -1.794 61 2HE LYS 9 HE1 LYS 9 14.821 -16.152 -0.959 62 1HZ LYS 9 HZ1 LYS 9 13.861 -18.889 -0.330 63 2HZ LYS 9 HZ2 LYS 9 13.496 -17.474 0.519 64 3HZ LYS 9 HZ3 LYS 9 15.073 -18.074 0.517 65 H LYS 10 HN LYS 10 11.075 -20.367 0.141 66 HA LYS 10 HA LYS 10 9.864 -21.738 1.463 67 1HB LYS 10 HB2 LYS 10 8.199 -19.294 1.490 68 2HB LYS 10 HB1 LYS 10 7.322 -20.773 1.838 69 1HG LYS 10 HG2 LYS 10 7.916 -20.132 3.946 70 2HG LYS 10 HG1 LYS 10 9.269 -21.185 3.547 71 1HD LYS 10 HD2 LYS 10 9.360 -18.198 3.133 72 2HD LYS 10 HD1 LYS 10 9.807 -18.952 4.661 73 1HE LYS 10 HE2 LYS 10 11.522 -20.281 3.449 74 2HE LYS 10 HE1 LYS 10 11.111 -19.405 1.973 75 1HZ LYS 10 HZ1 LYS 10 13.043 -18.453 3.071 76 2HZ LYS 10 HZ2 LYS 10 12.144 -18.180 4.474 77 3HZ LYS 10 HZ3 LYS 10 11.765 -17.347 3.053 78 HA PRO 11 HA PRO 11 7.945 -24.164 -1.756 79 1HB PRO 11 HB2 PRO 11 7.134 -25.921 0.496 80 2HB PRO 11 HB1 PRO 11 8.083 -26.306 -0.944 81 1HG PRO 11 HG2 PRO 11 9.226 -26.108 1.474 82 2HG PRO 11 HG1 PRO 11 10.064 -25.579 0.003 83 1HD PRO 11 HD2 PRO 11 8.702 -23.941 2.105 84 2HD PRO 11 HD1 PRO 11 10.197 -23.607 1.205 85 H THR 12 HN THR 12 5.889 -24.329 -2.569 86 HA THR 12 HA THR 12 3.790 -22.901 -1.287 87 HB THR 12 HB THR 12 3.629 -24.744 -3.690 88 HG1 THR 12 HG1 THR 12 4.590 -22.154 -3.327 89 1HG2 THR 12 HG21 THR 12 1.646 -23.417 -4.283 90 2HG2 THR 12 HG22 THR 12 1.807 -22.501 -2.785 91 3HG2 THR 12 HG23 THR 12 1.430 -24.223 -2.729 92 H ILE 13 HN ILE 13 2.767 -23.686 0.424 93 HA ILE 13 HA ILE 13 2.624 -26.526 0.940 94 HB ILE 13 HB ILE 13 1.507 -24.205 2.537 95 1HG1 ILE 13 HG12 ILE 13 3.974 -24.117 2.258 96 2HG1 ILE 13 HG11 ILE 13 3.509 -24.421 3.930 97 1HG2 ILE 13 HG21 ILE 13 1.438 -25.800 4.409 98 2HG2 ILE 13 HG22 ILE 13 1.955 -27.090 3.323 99 3HG2 ILE 13 HG23 ILE 13 0.395 -26.305 3.081 100 1HD1 ILE 13 HD11 ILE 13 4.481 -26.483 1.957 101 2HD1 ILE 13 HD12 ILE 13 4.021 -26.795 3.631 102 3HD1 ILE 13 HD13 ILE 13 5.414 -25.775 3.277 103 H ILE 14 HN ILE 14 0.758 -27.759 1.011 104 HA ILE 14 HA ILE 14 -1.303 -26.769 -0.814 105 HB ILE 14 HB ILE 14 -0.710 -29.594 0.101 106 1HG1 ILE 14 HG12 ILE 14 1.116 -28.659 -1.243 107 2HG1 ILE 14 HG11 ILE 14 0.258 -29.903 -2.145 108 1HG2 ILE 14 HG21 ILE 14 -2.168 -30.283 -1.757 109 2HG2 ILE 14 HG22 ILE 14 -2.563 -28.592 -2.063 110 3HG2 ILE 14 HG23 ILE 14 -3.037 -29.347 -0.542 111 1HD1 ILE 14 HD11 ILE 14 -0.076 -26.928 -2.487 112 2HD1 ILE 14 HD12 ILE 14 -0.930 -28.175 -3.397 113 3HD1 ILE 14 HD13 ILE 14 0.819 -28.008 -3.556 114 H TYR 15 HN TYR 15 -3.245 -26.237 -0.124 115 HA TYR 15 HA TYR 15 -4.394 -27.597 2.217 116 1HB TYR 15 HB2 TYR 15 -4.525 -24.629 1.601 117 2HB TYR 15 HB1 TYR 15 -5.548 -25.427 2.791 118 HD1 TYR 15 HD1 TYR 15 -4.458 -26.516 4.796 119 HD2 TYR 15 HD2 TYR 15 -2.313 -23.948 2.160 120 HE1 TYR 15 HE1 TYR 15 -2.731 -26.198 6.515 121 HE2 TYR 15 HE2 TYR 15 -0.582 -23.628 3.875 122 HH TYR 15 HH TYR 15 -0.306 -25.581 6.593 123 HA PRO 16 HA PRO 16 -6.414 -27.753 3.183 124 1HB PRO 16 HB2 PRO 16 -8.267 -29.924 2.506 125 2HB PRO 16 HB1 PRO 16 -8.520 -28.529 3.559 126 1HG PRO 16 HG2 PRO 16 -9.770 -28.782 1.177 127 2HG PRO 16 HG1 PRO 16 -9.303 -27.204 1.842 128 1HD PRO 16 HD2 PRO 16 -7.906 -28.868 -0.241 129 2HD PRO 16 HD1 PRO 16 -8.236 -27.119 -0.235 130 H CYS 17 HN CYS 17 -5.534 -29.454 4.378 131 HA CYS 17 HA CYS 17 -4.784 -31.956 3.181 132 1HB CYS 17 HB2 CYS 17 -3.029 -30.534 2.225 133 2HB CYS 17 HB1 CYS 17 -2.617 -29.934 3.827 134 HG CYS 17 HG CYS 17 -1.480 -32.227 4.750 135 H LEU 18 HN LEU 18 -3.681 -33.361 4.718 136 HA LEU 18 HA LEU 18 -4.663 -33.092 7.379 137 1HB LEU 18 HB2 LEU 18 -2.680 -35.012 6.146 138 2HB LEU 18 HB1 LEU 18 -3.271 -35.149 7.792 139 HG LEU 18 HG LEU 18 -5.115 -35.186 5.404 140 1HD1 LEU 18 HD11 LEU 18 -3.863 -37.544 6.817 141 2HD1 LEU 18 HD12 LEU 18 -3.530 -37.027 5.163 142 3HD1 LEU 18 HD13 LEU 18 -5.131 -37.629 5.593 143 1HD2 LEU 18 HD21 LEU 18 -6.655 -36.264 6.981 144 2HD2 LEU 18 HD22 LEU 18 -6.165 -34.668 7.544 145 3HD2 LEU 18 HD23 LEU 18 -5.451 -36.112 8.262 146 H TRP 19 HN TRP 19 -3.845 -31.529 8.647 147 HA TRP 19 HA TRP 19 -0.965 -31.030 8.703 148 1HB TRP 19 HB2 TRP 19 -2.662 -29.136 8.731 149 2HB TRP 19 HB1 TRP 19 -3.097 -29.651 10.358 150 HD1 TRP 19 HD1 TRP 19 -1.493 -28.927 12.325 151 HE1 TRP 19 HE1 TRP 19 0.588 -27.417 12.459 152 HE3 TRP 19 HE3 TRP 19 -0.520 -28.438 7.327 153 HZ2 TRP 19 HZ2 TRP 19 2.401 -26.190 10.687 154 HZ3 TRP 19 HZ3 TRP 19 1.411 -27.079 6.631 155 HH2 TRP 19 HH2 TRP 19 2.842 -25.977 8.279 156 H ASP 20 HN ASP 20 0.262 -31.222 10.643 157 HA ASP 20 HA ASP 20 -0.715 -33.461 12.283 158 1HB ASP 20 HB2 ASP 20 1.372 -33.710 10.855 159 2HB ASP 20 HB1 ASP 20 2.157 -32.565 11.938 160 H TYR 21 HN TYR 21 -0.726 -33.381 14.468 161 HA TYR 21 HA TYR 21 0.243 -30.952 15.821 162 1HB TYR 21 HB2 TYR 21 -2.432 -32.293 16.332 163 2HB TYR 21 HB1 TYR 21 -1.785 -30.917 17.214 164 HD1 TYR 21 HD1 TYR 21 -1.664 -28.696 16.134 165 HD2 TYR 21 HD2 TYR 21 -3.471 -32.023 14.179 166 HE1 TYR 21 HE1 TYR 21 -2.772 -27.166 14.560 167 HE2 TYR 21 HE2 TYR 21 -4.576 -30.501 12.601 168 HH TYR 21 HH TYR 21 -5.305 -28.101 12.575 169 H ARG 22 HN ARG 22 1.870 -31.774 17.023 170 HA ARG 22 HA ARG 22 1.657 -34.356 18.317 171 1HB ARG 22 HB2 ARG 22 3.806 -33.565 17.378 172 2HB ARG 22 HB1 ARG 22 3.806 -32.225 18.514 173 1HG ARG 22 HG2 ARG 22 5.297 -34.029 19.220 174 2HG ARG 22 HG1 ARG 22 3.995 -33.764 20.381 175 1HD ARG 22 HD2 ARG 22 4.455 -36.163 19.951 176 2HD ARG 22 HD1 ARG 22 2.801 -35.691 19.569 177 HE ARG 22 HE ARG 22 3.485 -35.669 17.199 178 1HH1 ARG 22 HH11 ARG 22 5.539 -37.374 19.458 179 2HH1 ARG 22 HH12 ARG 22 6.075 -38.541 18.291 180 1HH2 ARG 22 HH21 ARG 22 4.206 -37.183 15.645 181 2HH2 ARG 22 HH22 ARG 22 5.322 -38.428 16.117 182 H VAL 23 HN VAL 23 0.503 -34.558 20.123 183 HA VAL 23 HA VAL 23 0.139 -32.197 21.861 184 HB VAL 23 HB VAL 23 -1.653 -34.631 21.644 185 1HG1 VAL 23 HG11 VAL 23 -3.289 -33.227 22.835 186 2HG1 VAL 23 HG12 VAL 23 -2.079 -31.952 22.978 187 3HG1 VAL 23 HG13 VAL 23 -1.829 -33.499 23.789 188 1HG2 VAL 23 HG21 VAL 23 -1.964 -31.914 20.356 189 2HG2 VAL 23 HG22 VAL 23 -3.191 -33.181 20.371 190 3HG2 VAL 23 HG23 VAL 23 -1.665 -33.441 19.526 191 H ILE 24 HN ILE 24 1.255 -32.285 23.715 192 HA ILE 24 HA ILE 24 1.784 -34.924 24.933 193 HB ILE 24 HB ILE 24 3.244 -32.311 25.405 194 1HG1 ILE 24 HG12 ILE 24 4.098 -34.781 23.859 195 2HG1 ILE 24 HG11 ILE 24 3.663 -33.229 23.151 196 1HG2 ILE 24 HG21 ILE 24 3.838 -35.104 26.402 197 2HG2 ILE 24 HG22 ILE 24 3.263 -33.750 27.374 198 3HG2 ILE 24 HG23 ILE 24 4.865 -33.690 26.642 199 1HD1 ILE 24 HD11 ILE 24 5.579 -32.197 24.284 200 2HD1 ILE 24 HD12 ILE 24 6.057 -33.500 23.198 201 3HD1 ILE 24 HD13 ILE 24 6.023 -33.773 24.939 202 H MET 25 HN MET 25 0.362 -35.382 26.490 203 HA MET 25 HA MET 25 -0.485 -33.207 28.304 204 1HB MET 25 HB2 MET 25 -2.088 -35.652 27.500 205 2HB MET 25 HB1 MET 25 -2.596 -34.439 28.667 206 1HG MET 25 HG2 MET 25 -2.252 -32.787 26.674 207 2HG MET 25 HG1 MET 25 -2.401 -34.245 25.696 208 1HE MET 25 HE1 MET 25 -4.494 -35.977 27.415 209 2HE MET 25 HE2 MET 25 -4.591 -35.788 25.664 210 3HE MET 25 HE3 MET 25 -6.011 -35.478 26.664 211 H THR 26 HN THR 26 -1.099 -33.968 30.493 212 HA THR 26 HA THR 26 0.874 -35.921 31.446 213 HB THR 26 HB THR 26 0.214 -34.931 33.720 214 HG1 THR 26 HG1 THR 26 -0.605 -32.573 32.922 215 1HG2 THR 26 HG21 THR 26 2.296 -34.320 32.586 216 2HG2 THR 26 HG22 THR 26 1.593 -32.920 33.396 217 3HG2 THR 26 HG23 THR 26 1.439 -33.096 31.648 218 H THR 27 HN THR 27 -1.818 -36.536 30.207 219 HA THR 27 HA THR 27 -2.750 -38.398 32.242 220 HB THR 27 HB THR 27 -4.141 -36.394 32.620 221 HG1 THR 27 HG1 THR 27 -5.828 -37.659 32.878 222 1HG2 THR 27 HG21 THR 27 -3.992 -35.415 30.368 223 2HG2 THR 27 HG22 THR 27 -5.671 -35.589 30.877 224 3HG2 THR 27 HG23 THR 27 -4.978 -36.730 29.728 225 H LYS 28 HN LYS 28 -3.982 -40.121 31.379 226 HA LYS 28 HA LYS 28 -3.626 -40.590 28.522 227 1HB LYS 28 HB2 LYS 28 -4.743 -42.386 30.693 228 2HB LYS 28 HB1 LYS 28 -4.432 -42.870 29.030 229 1HG LYS 28 HG2 LYS 28 -2.031 -42.411 29.371 230 2HG LYS 28 HG1 LYS 28 -2.369 -42.003 31.055 231 1HD LYS 28 HD2 LYS 28 -2.877 -44.681 29.746 232 2HD LYS 28 HD1 LYS 28 -1.535 -44.303 30.827 233 1HE LYS 28 HE2 LYS 28 -3.126 -43.848 32.637 234 2HE LYS 28 HE1 LYS 28 -4.469 -44.211 31.552 235 1HZ LYS 28 HZ1 LYS 28 -2.341 -46.130 32.327 236 2HZ LYS 28 HZ2 LYS 28 -3.685 -46.468 31.357 237 3HZ LYS 28 HZ3 LYS 28 -3.896 -46.085 32.992 238 H ASP 29 HN ASP 29 -5.911 -39.282 30.586 239 HA ASP 29 HA ASP 29 -8.286 -40.245 29.287 240 1HB ASP 29 HB2 ASP 29 -8.339 -39.579 31.660 241 2HB ASP 29 HB1 ASP 29 -7.906 -37.932 31.216 242 H THR 30 HN THR 30 -7.628 -39.738 27.122 243 HA THR 30 HA THR 30 -7.679 -36.897 26.453 244 HB THR 30 HB THR 30 -5.856 -38.084 25.429 245 HG1 THR 30 HG1 THR 30 -6.340 -37.632 23.223 246 1HG2 THR 30 HG21 THR 30 -6.768 -40.362 25.468 247 2HG2 THR 30 HG22 THR 30 -6.168 -39.941 23.864 248 3HG2 THR 30 HG23 THR 30 -7.902 -39.935 24.185 249 H SER 31 HN SER 31 -9.721 -36.235 26.484 250 HA SER 31 HA SER 31 -11.656 -37.604 24.731 251 1HB SER 31 HB2 SER 31 -12.386 -37.904 27.018 252 2HB SER 31 HB1 SER 31 -12.140 -36.196 27.374 253 HG SER 31 HG SER 31 -14.243 -37.463 26.119 254 H THR 32 HN THR 32 -11.286 -34.485 26.408 255 HA THR 32 HA THR 32 -12.682 -32.873 24.695 256 HB THR 32 HB THR 32 -10.140 -32.024 26.106 257 HG1 THR 32 HG1 THR 32 -12.722 -32.670 27.084 258 1HG2 THR 32 HG21 THR 32 -11.329 -29.882 26.371 259 2HG2 THR 32 HG22 THR 32 -12.706 -30.532 25.481 260 3HG2 THR 32 HG23 THR 32 -11.157 -30.304 24.668 261 H LEU 33 HN LEU 33 -9.416 -34.088 24.333 262 HA LEU 33 HA LEU 33 -8.490 -32.453 22.260 263 1HB LEU 33 HB2 LEU 33 -7.041 -33.986 23.501 264 2HB LEU 33 HB1 LEU 33 -7.895 -35.365 22.835 265 HG LEU 33 HG LEU 33 -7.073 -34.794 20.582 266 1HD1 LEU 33 HD11 LEU 33 -6.875 -32.379 20.851 267 2HD1 LEU 33 HD12 LEU 33 -5.361 -33.083 20.283 268 3HD1 LEU 33 HD13 LEU 33 -5.531 -32.604 21.973 269 1HD2 LEU 33 HD21 LEU 33 -4.878 -35.003 22.649 270 2HD2 LEU 33 HD22 LEU 33 -4.733 -35.401 20.935 271 3HD2 LEU 33 HD23 LEU 33 -5.799 -36.348 21.973 272 H LYS 34 HN LYS 34 -10.375 -35.454 22.186 273 HA LYS 34 HA LYS 34 -10.485 -35.605 19.325 274 1HB LYS 34 HB2 LYS 34 -12.359 -36.917 21.309 275 2HB LYS 34 HB1 LYS 34 -12.067 -37.405 19.645 276 1HG LYS 34 HG2 LYS 34 -9.756 -38.001 20.246 277 2HG LYS 34 HG1 LYS 34 -10.093 -37.553 21.918 278 1HD LYS 34 HD2 LYS 34 -11.472 -39.743 20.352 279 2HD LYS 34 HD1 LYS 34 -10.246 -39.978 21.595 280 1HE LYS 34 HE2 LYS 34 -12.306 -40.400 22.661 281 2HE LYS 34 HE1 LYS 34 -11.836 -38.787 23.186 282 1HZ LYS 34 HZ1 LYS 34 -14.224 -39.076 22.531 283 2HZ LYS 34 HZ2 LYS 34 -13.710 -39.262 20.934 284 3HZ LYS 34 HZ3 LYS 34 -13.426 -37.808 21.753 285 H GLU 35 HN GLU 35 -12.608 -34.446 21.890 286 HA GLU 35 HA GLU 35 -14.947 -34.121 20.435 287 1HB GLU 35 HB2 GLU 35 -14.081 -32.286 22.676 288 2HB GLU 35 HB1 GLU 35 -15.723 -32.686 22.192 289 1HG GLU 35 HG2 GLU 35 -13.727 -34.402 23.632 290 2HG GLU 35 HG1 GLU 35 -15.325 -33.892 24.164 291 H LEU 36 HN LEU 36 -12.302 -31.795 20.963 292 HA LEU 36 HA LEU 36 -13.527 -29.648 19.604 293 1HB LEU 36 HB2 LEU 36 -11.412 -28.546 19.666 294 2HB LEU 36 HB1 LEU 36 -11.594 -29.437 21.164 295 HG LEU 36 HG LEU 36 -10.189 -31.269 19.809 296 1HD1 LEU 36 HD11 LEU 36 -8.452 -30.208 18.448 297 2HD1 LEU 36 HD12 LEU 36 -9.293 -28.663 18.581 298 3HD1 LEU 36 HD13 LEU 36 -10.053 -30.012 17.737 299 1HD2 LEU 36 HD21 LEU 36 -8.992 -28.855 21.168 300 2HD2 LEU 36 HD22 LEU 36 -8.167 -30.386 20.876 301 3HD2 LEU 36 HD23 LEU 36 -9.557 -30.327 21.958 302 H LEU 37 HN LEU 37 -11.633 -32.373 18.495 303 HA LEU 37 HA LEU 37 -11.242 -31.438 15.823 304 1HB LEU 37 HB2 LEU 37 -11.305 -34.284 16.860 305 2HB LEU 37 HB1 LEU 37 -10.623 -33.758 15.331 306 HG LEU 37 HG LEU 37 -9.570 -32.891 18.031 307 1HD1 LEU 37 HD11 LEU 37 -9.297 -35.298 17.771 308 2HD1 LEU 37 HD12 LEU 37 -7.743 -34.473 17.660 309 3HD1 LEU 37 HD13 LEU 37 -8.538 -35.057 16.197 310 1HD2 LEU 37 HD21 LEU 37 -9.066 -31.341 16.210 311 2HD2 LEU 37 HD22 LEU 37 -8.387 -32.665 15.261 312 3HD2 LEU 37 HD23 LEU 37 -7.612 -32.169 16.766 313 H GLU 38 HN GLU 38 -13.632 -33.424 17.466 314 HA GLU 38 HA GLU 38 -15.054 -34.223 15.147 315 1HB GLU 38 HB2 GLU 38 -15.839 -34.215 18.067 316 2HB GLU 38 HB1 GLU 38 -16.805 -34.944 16.790 317 1HG GLU 38 HG2 GLU 38 -14.951 -36.464 16.263 318 2HG GLU 38 HG1 GLU 38 -14.000 -35.743 17.560 319 H THR 39 HN THR 39 -15.167 -31.327 17.077 320 HA THR 39 HA THR 39 -17.814 -30.531 16.496 321 HB THR 39 HB THR 39 -17.106 -28.225 16.981 322 HG1 THR 39 HG1 THR 39 -14.471 -29.114 17.449 323 1HG2 THR 39 HG21 THR 39 -17.576 -29.704 18.870 324 2HG2 THR 39 HG22 THR 39 -16.286 -28.570 19.271 325 3HG2 THR 39 HG23 THR 39 -15.898 -30.244 18.878 326 H TYR 40 HN TYR 40 -14.838 -30.353 14.661 327 HA TYR 40 HA TYR 40 -15.852 -28.626 12.609 328 1HB TYR 40 HB2 TYR 40 -13.490 -30.527 12.586 329 2HB TYR 40 HB1 TYR 40 -13.839 -29.341 11.335 330 HD1 TYR 40 HD1 TYR 40 -13.438 -26.958 11.730 331 HD2 TYR 40 HD2 TYR 40 -12.624 -29.848 14.741 332 HE1 TYR 40 HE1 TYR 40 -12.114 -25.290 12.959 333 HE2 TYR 40 HE2 TYR 40 -11.307 -28.189 15.991 334 HH TYR 40 HH TYR 40 -11.269 -24.833 15.102 335 H GLN 41 HN GLN 41 -16.439 -31.813 13.438 336 HA GLN 41 HA GLN 41 -17.600 -33.514 12.511 337 1HB GLN 41 HB2 GLN 41 -18.474 -31.459 10.461 338 2HB GLN 41 HB1 GLN 41 -19.288 -32.974 10.835 339 1HG GLN 41 HG2 GLN 41 -18.984 -30.590 12.658 340 2HG GLN 41 HG1 GLN 41 -20.460 -31.132 11.861 341 1HE2 GLN 41 HE21 GLN 41 -19.825 -30.760 14.718 342 2HE2 GLN 41 HE22 GLN 41 -20.152 -32.282 15.470 343 H ARG 42 HN ARG 42 -14.854 -32.754 11.492 344 HA ARG 42 HA ARG 42 -14.944 -34.127 8.882 345 1HB ARG 42 HB2 ARG 42 -12.947 -32.958 8.250 346 2HB ARG 42 HB1 ARG 42 -14.068 -31.763 8.886 347 1HG ARG 42 HG2 ARG 42 -12.847 -31.890 11.067 348 2HG ARG 42 HG1 ARG 42 -11.658 -32.926 10.275 349 1HD ARG 42 HD2 ARG 42 -10.790 -30.708 10.254 350 2HD ARG 42 HD1 ARG 42 -11.299 -31.083 8.608 351 HE ARG 42 HE ARG 42 -13.467 -29.856 9.714 352 1HH1 ARG 42 HH11 ARG 42 -10.100 -28.959 9.312 353 2HH1 ARG 42 HH12 ARG 42 -10.439 -27.252 9.282 354 1HH2 ARG 42 HH21 ARG 42 -13.886 -27.599 9.622 355 2HH2 ARG 42 HH22 ARG 42 -12.558 -26.489 9.454 356 HA PRO 43 HA PRO 43 -12.847 -37.558 10.652 357 1HB PRO 43 HB2 PRO 43 -11.174 -38.314 8.607 358 2HB PRO 43 HB1 PRO 43 -12.908 -38.647 8.635 359 1HG PRO 43 HG2 PRO 43 -11.425 -36.447 7.238 360 2HG PRO 43 HG1 PRO 43 -12.757 -37.456 6.639 361 1HD PRO 43 HD2 PRO 43 -13.171 -34.947 7.513 362 2HD PRO 43 HD1 PRO 43 -14.365 -36.233 7.786 363 H PHE 44 HN PHE 44 -11.131 -37.899 11.954 364 HA PHE 44 HA PHE 44 -8.650 -36.394 11.462 365 1HB PHE 44 HB2 PHE 44 -8.437 -35.856 13.826 366 2HB PHE 44 HB1 PHE 44 -9.958 -35.222 13.213 367 HD1 PHE 44 HD1 PHE 44 -8.391 -37.660 15.450 368 HD2 PHE 44 HD2 PHE 44 -12.089 -36.173 13.935 369 HE1 PHE 44 HE1 PHE 44 -9.592 -38.804 17.266 370 HE2 PHE 44 HE2 PHE 44 -13.290 -37.319 15.751 371 HZ PHE 44 HZ PHE 44 -12.043 -38.633 17.420 372 H LYS 45 HN LYS 45 -6.773 -37.321 12.345 373 HA LYS 45 HA LYS 45 -6.955 -40.217 12.834 374 1HB LYS 45 HB2 LYS 45 -5.645 -39.908 10.918 375 2HB LYS 45 HB1 LYS 45 -4.894 -38.451 11.540 376 1HG LYS 45 HG2 LYS 45 -3.493 -39.728 13.010 377 2HG LYS 45 HG1 LYS 45 -4.336 -41.222 12.583 378 1HD LYS 45 HD2 LYS 45 -3.424 -41.274 10.433 379 2HD LYS 45 HD1 LYS 45 -3.033 -39.553 10.449 380 1HE LYS 45 HE2 LYS 45 -1.694 -41.553 12.256 381 2HE LYS 45 HE1 LYS 45 -1.082 -41.150 10.653 382 1HZ LYS 45 HZ1 LYS 45 -1.501 -39.200 12.852 383 2HZ LYS 45 HZ2 LYS 45 -0.847 -38.856 11.333 384 3HZ LYS 45 HZ3 LYS 45 -0.007 -39.854 12.409 385 H LEU 46 HN LEU 46 -6.960 -40.616 14.943 386 HA LEU 46 HA LEU 46 -5.425 -38.939 16.791 387 1HB LEU 46 HB2 LEU 46 -7.785 -39.429 17.314 388 2HB LEU 46 HB1 LEU 46 -7.429 -41.146 17.317 389 HG LEU 46 HG LEU 46 -5.866 -40.757 19.242 390 1HD1 LEU 46 HD11 LEU 46 -6.059 -38.677 20.507 391 2HD1 LEU 46 HD12 LEU 46 -7.105 -38.002 19.256 392 3HD1 LEU 46 HD13 LEU 46 -5.421 -38.385 18.888 393 1HD2 LEU 46 HD21 LEU 46 -7.640 -40.531 20.916 394 2HD2 LEU 46 HD22 LEU 46 -8.113 -41.611 19.607 395 3HD2 LEU 46 HD23 LEU 46 -8.750 -39.967 19.665 396 H GLU 47 HN GLU 47 -3.552 -39.589 17.637 397 HA GLU 47 HA GLU 47 -2.775 -42.430 17.416 398 1HB GLU 47 HB2 GLU 47 -1.134 -39.951 16.847 399 2HB GLU 47 HB1 GLU 47 -0.420 -41.541 17.071 400 1HG GLU 47 HG2 GLU 47 -2.467 -40.908 14.955 401 2HG GLU 47 HG1 GLU 47 -0.724 -40.844 14.696 402 H PHE 48 HN PHE 48 -2.187 -43.320 19.297 403 HA PHE 48 HA PHE 48 -1.012 -41.585 21.381 404 1HB PHE 48 HB2 PHE 48 -2.962 -42.795 22.233 405 2HB PHE 48 HB1 PHE 48 -2.303 -44.323 21.656 406 HD1 PHE 48 HD1 PHE 48 -1.011 -45.641 23.097 407 HD2 PHE 48 HD2 PHE 48 -1.527 -41.497 23.962 408 HE1 PHE 48 HE1 PHE 48 0.152 -45.940 25.248 409 HE2 PHE 48 HE2 PHE 48 -0.372 -41.800 26.111 410 HZ PHE 48 HZ PHE 48 0.468 -44.021 26.755 411 H LYS 49 HN LYS 49 1.142 -41.624 21.229 412 HA LYS 49 HA LYS 49 2.420 -43.782 19.796 413 1HB LYS 49 HB2 LYS 49 3.535 -41.238 20.999 414 2HB LYS 49 HB1 LYS 49 4.492 -42.400 20.086 415 1HG LYS 49 HG2 LYS 49 2.173 -40.757 19.072 416 2HG LYS 49 HG1 LYS 49 3.874 -40.605 18.618 417 1HD LYS 49 HD2 LYS 49 3.807 -42.861 17.636 418 2HD LYS 49 HD1 LYS 49 2.108 -43.007 18.086 419 1HE LYS 49 HE2 LYS 49 1.588 -41.079 16.628 420 2HE LYS 49 HE1 LYS 49 3.285 -41.012 16.147 421 1HZ LYS 49 HZ1 LYS 49 2.095 -42.205 14.490 422 2HZ LYS 49 HZ2 LYS 49 1.359 -43.213 15.626 423 3HZ LYS 49 HZ3 LYS 49 3.019 -43.339 15.337 424 H ASN 50 HN ASN 50 3.160 -42.264 22.965 425 HA ASN 50 HA ASN 50 3.195 -44.680 24.403 426 1HB ASN 50 HB2 ASN 50 5.210 -45.015 22.846 427 2HB ASN 50 HB1 ASN 50 5.996 -43.721 23.741 428 1HD2 ASN 50 HD21 ASN 50 6.691 -44.110 25.846 429 2HD2 ASN 50 HD22 ASN 50 6.776 -45.702 26.514 430 H THR 51 HN THR 51 4.148 -44.391 26.592 431 HA THR 51 HA THR 51 3.805 -41.676 27.551 432 HB THR 51 HB THR 51 2.870 -43.563 28.840 433 HG1 THR 51 HG1 THR 51 3.753 -41.564 29.880 434 1HG2 THR 51 HG21 THR 51 4.364 -45.070 30.090 435 2HG2 THR 51 HG22 THR 51 5.754 -44.364 29.266 436 3HG2 THR 51 HG23 THR 51 4.546 -45.263 28.346 437 H SER 52 HN SER 52 5.403 -40.411 28.508 438 HA SER 52 HA SER 52 8.057 -40.695 27.586 439 1HB SER 52 HB2 SER 52 7.035 -38.966 29.862 440 2HB SER 52 HB1 SER 52 8.532 -38.734 28.957 441 HG SER 52 HG SER 52 6.772 -38.798 27.107 442 H LYS 53 HN LYS 53 9.984 -40.792 29.040 443 HA LYS 53 HA LYS 53 10.062 -43.161 30.522 444 1HB LYS 53 HB2 LYS 53 11.972 -41.740 29.445 445 2HB LYS 53 HB1 LYS 53 12.002 -40.892 30.980 446 1HG LYS 53 HG2 LYS 53 12.381 -43.872 30.708 447 2HG LYS 53 HG1 LYS 53 13.705 -42.710 30.716 448 1HD LYS 53 HD2 LYS 53 13.036 -41.974 32.965 449 2HD LYS 53 HD1 LYS 53 11.719 -43.148 32.954 450 1HE LYS 53 HE2 LYS 53 13.364 -44.970 32.744 451 2HE LYS 53 HE1 LYS 53 14.670 -43.785 32.798 452 1HZ LYS 53 HZ1 LYS 53 13.826 -43.120 35.015 453 2HZ LYS 53 HZ2 LYS 53 14.403 -44.706 34.956 454 3HZ LYS 53 HZ3 LYS 53 12.737 -44.414 34.961 455 H ASN 54 HN ASN 54 9.485 -39.832 31.486 456 HA ASN 54 HA ASN 54 9.628 -40.275 34.298 457 1HB ASN 54 HB2 ASN 54 9.843 -38.035 33.137 458 2HB ASN 54 HB1 ASN 54 8.099 -38.070 32.893 459 1HD2 ASN 54 HD21 ASN 54 7.697 -36.284 34.164 460 2HD2 ASN 54 HD22 ASN 54 7.881 -36.290 35.883 461 H ALA 55 HN ALA 55 7.290 -41.042 31.959 462 HA ALA 55 HA ALA 55 5.326 -42.155 32.053 463 1HB ALA 55 HB1 ALA 55 6.233 -43.359 33.990 464 2HB ALA 55 HB2 ALA 55 4.492 -43.103 34.122 465 3HB ALA 55 HB3 ALA 55 5.604 -42.103 35.058 466 H LYS 56 HN LYS 56 5.607 -39.443 34.297 467 HA LYS 56 HA LYS 56 2.934 -38.784 34.615 468 1HB LYS 56 HB2 LYS 56 4.700 -37.770 35.945 469 2HB LYS 56 HB1 LYS 56 5.377 -36.999 34.523 470 1HG LYS 56 HG2 LYS 56 4.265 -35.292 35.669 471 2HG LYS 56 HG1 LYS 56 3.183 -35.717 34.347 472 1HD LYS 56 HD2 LYS 56 2.856 -36.911 37.096 473 2HD LYS 56 HD1 LYS 56 2.173 -35.338 36.691 474 1HE LYS 56 HE2 LYS 56 0.934 -36.422 34.819 475 2HE LYS 56 HE1 LYS 56 1.540 -37.982 35.370 476 1HZ LYS 56 HZ1 LYS 56 0.431 -37.614 37.489 477 2HZ LYS 56 HZ2 LYS 56 -0.670 -37.575 36.207 478 3HZ LYS 56 HZ3 LYS 56 -0.171 -36.131 36.936 479 H PHE 57 HN PHE 57 4.893 -38.500 31.805 480 HA PHE 57 HA PHE 57 2.908 -36.721 30.542 481 1HB PHE 57 HB2 PHE 57 5.805 -37.152 29.755 482 2HB PHE 57 HB1 PHE 57 4.670 -36.073 28.952 483 HD1 PHE 57 HD1 PHE 57 6.924 -36.505 31.759 484 HD2 PHE 57 HD2 PHE 57 3.860 -34.038 30.121 485 HE1 PHE 57 HE1 PHE 57 7.574 -34.687 33.282 486 HE2 PHE 57 HE2 PHE 57 4.510 -32.220 31.644 487 HZ PHE 57 HZ PHE 57 6.368 -32.542 33.224 488 H TYR 58 HN TYR 58 2.028 -37.296 28.599 489 HA TYR 58 HA TYR 58 2.734 -39.932 27.488 490 1HB TYR 58 HB2 TYR 58 -0.072 -38.819 27.820 491 2HB TYR 58 HB1 TYR 58 0.348 -40.362 27.080 492 HD1 TYR 58 HD1 TYR 58 1.132 -42.236 28.470 493 HD2 TYR 58 HD2 TYR 58 -0.072 -38.545 30.224 494 HE1 TYR 58 HE1 TYR 58 1.004 -43.327 30.668 495 HE2 TYR 58 HE2 TYR 58 -0.203 -39.630 32.427 496 HH TYR 58 HH TYR 58 1.122 -42.679 33.054 497 H SER 59 HN SER 59 3.012 -39.946 25.325 498 HA SER 59 HA SER 59 2.747 -37.388 23.945 499 1HB SER 59 HB2 SER 59 4.112 -39.949 23.066 500 2HB SER 59 HB1 SER 59 4.215 -38.385 22.254 501 HG SER 59 HG SER 59 4.850 -37.967 24.773 502 H PHE 60 HN PHE 60 0.859 -37.034 23.025 503 HA PHE 60 HA PHE 60 -0.454 -39.167 21.471 504 1HB PHE 60 HB2 PHE 60 -1.559 -36.473 22.338 505 2HB PHE 60 HB1 PHE 60 -2.449 -37.730 21.490 506 HD1 PHE 60 HD1 PHE 60 -1.199 -36.572 24.700 507 HD2 PHE 60 HD2 PHE 60 -3.087 -39.806 22.661 508 HE1 PHE 60 HE1 PHE 60 -1.916 -37.512 26.854 509 HE2 PHE 60 HE2 PHE 60 -3.801 -40.748 24.817 510 HZ PHE 60 HZ PHE 60 -3.216 -39.602 26.916 511 H ASN 61 HN ASN 61 -1.384 -38.421 19.372 512 HA ASN 61 HA ASN 61 -0.178 -36.055 18.197 513 1HB ASN 61 HB2 ASN 61 1.482 -37.935 17.866 514 2HB ASN 61 HB1 ASN 61 0.263 -38.761 16.899 515 1HD2 ASN 61 HD21 ASN 61 -0.326 -37.875 14.886 516 2HD2 ASN 61 HD22 ASN 61 0.678 -36.725 14.079 517 H VAL 62 HN VAL 62 -1.472 -35.176 16.671 518 HA VAL 62 HA VAL 62 -3.831 -36.724 15.807 519 HB VAL 62 HB VAL 62 -3.724 -33.772 16.499 520 1HG1 VAL 62 HG11 VAL 62 -6.046 -35.463 15.553 521 2HG1 VAL 62 HG12 VAL 62 -5.236 -34.195 14.630 522 3HG1 VAL 62 HG13 VAL 62 -6.147 -33.782 16.083 523 1HG2 VAL 62 HG21 VAL 62 -5.256 -34.352 18.331 524 2HG2 VAL 62 HG22 VAL 62 -3.713 -35.191 18.491 525 3HG2 VAL 62 HG23 VAL 62 -5.130 -36.057 17.897 526 H SER 63 HN SER 63 -4.367 -36.591 13.674 527 HA SER 63 HA SER 63 -3.002 -34.589 12.005 528 1HB SER 63 HB2 SER 63 -3.410 -37.479 11.175 529 2HB SER 63 HB1 SER 63 -2.505 -36.234 10.312 530 HG SER 63 HG SER 63 -1.166 -36.180 12.321 531 H MET 64 HN MET 64 -4.645 -33.321 11.329 532 HA MET 64 HA MET 64 -7.117 -34.632 10.385 533 1HB MET 64 HB2 MET 64 -8.502 -32.976 11.454 534 2HB MET 64 HB1 MET 64 -7.454 -33.686 12.675 535 1HG MET 64 HG2 MET 64 -5.978 -31.735 12.539 536 2HG MET 64 HG1 MET 64 -7.041 -31.022 11.325 537 1HE MET 64 HE1 MET 64 -9.901 -31.890 12.438 538 2HE MET 64 HE2 MET 64 -9.596 -30.246 11.874 539 3HE MET 64 HE3 MET 64 -10.342 -30.513 13.450 540 H GLU 65 HN GLU 65 -8.354 -33.378 8.866 541 HA GLU 65 HA GLU 65 -6.689 -32.012 6.983 542 1HB GLU 65 HB2 GLU 65 -9.699 -32.349 7.016 543 2HB GLU 65 HB1 GLU 65 -8.746 -31.787 5.647 544 1HG GLU 65 HG2 GLU 65 -7.576 -33.976 5.628 545 2HG GLU 65 HG1 GLU 65 -8.655 -34.523 6.911 546 H VAL 66 HN VAL 66 -6.143 -29.948 7.101 547 HA VAL 66 HA VAL 66 -8.010 -28.020 8.317 548 HB VAL 66 HB VAL 66 -6.077 -26.473 8.444 549 1HG1 VAL 66 HG11 VAL 66 -6.652 -27.873 10.361 550 2HG1 VAL 66 HG12 VAL 66 -4.910 -27.614 10.273 551 3HG1 VAL 66 HG13 VAL 66 -5.600 -29.153 9.757 552 1HG2 VAL 66 HG21 VAL 66 -4.459 -28.840 7.479 553 2HG2 VAL 66 HG22 VAL 66 -3.801 -27.314 8.070 554 3HG2 VAL 66 HG23 VAL 66 -4.748 -27.348 6.584 555 H SER 67 HN SER 67 -9.010 -26.591 7.048 556 HA SER 67 HA SER 67 -8.899 -26.850 4.240 557 1HB SER 67 HB2 SER 67 -10.184 -24.629 5.849 558 2HB SER 67 HB1 SER 67 -10.587 -25.110 4.198 559 HG SER 67 HG SER 67 -11.803 -26.624 4.976 560 H ASN 68 HN ASN 68 -7.339 -24.677 6.484 561 HA ASN 68 HA ASN 68 -5.538 -23.715 4.502 562 1HB ASN 68 HB2 ASN 68 -6.161 -21.318 4.606 563 2HB ASN 68 HB1 ASN 68 -7.426 -22.298 3.876 564 1HD2 ASN 68 HD21 ASN 68 -9.046 -20.847 4.318 565 2HD2 ASN 68 HD22 ASN 68 -9.624 -20.529 5.916 566 H GLU 69 HN GLU 69 -4.429 -21.586 5.556 567 HA GLU 69 HA GLU 69 -2.994 -22.479 7.776 568 1HB GLU 69 HB2 GLU 69 -2.157 -20.786 6.201 569 2HB GLU 69 HB1 GLU 69 -3.369 -19.646 6.769 570 1HG GLU 69 HG2 GLU 69 -2.327 -19.774 9.034 571 2HG GLU 69 HG1 GLU 69 -1.045 -20.758 8.332 572 H SER 70 HN SER 70 -5.790 -20.310 7.577 573 HA SER 70 HA SER 70 -5.823 -19.377 10.205 574 1HB SER 70 HB2 SER 70 -8.246 -19.972 8.481 575 2HB SER 70 HB1 SER 70 -8.149 -18.811 9.808 576 HG SER 70 HG SER 70 -6.244 -18.053 8.289 577 H GLU 71 HN GLU 71 -7.221 -22.297 8.789 578 HA GLU 71 HA GLU 71 -8.523 -23.310 11.058 579 1HB GLU 71 HB2 GLU 71 -7.205 -24.796 8.764 580 2HB GLU 71 HB1 GLU 71 -8.306 -25.522 9.925 581 1HG GLU 71 HG2 GLU 71 -9.101 -23.217 8.165 582 2HG GLU 71 HG1 GLU 71 -9.256 -24.898 7.664 583 H ARG 72 HN ARG 72 -5.264 -24.066 9.778 584 HA ARG 72 HA ARG 72 -4.583 -25.954 11.714 585 1HB ARG 72 HB2 ARG 72 -2.432 -25.937 10.834 586 2HB ARG 72 HB1 ARG 72 -3.366 -25.290 9.492 587 1HG ARG 72 HG2 ARG 72 -2.712 -23.010 10.159 588 2HG ARG 72 HG1 ARG 72 -1.747 -23.685 11.471 589 1HD ARG 72 HD2 ARG 72 -0.497 -24.992 9.674 590 2HD ARG 72 HD1 ARG 72 -1.303 -23.945 8.501 591 HE ARG 72 HE ARG 72 0.182 -22.674 10.674 592 1HH1 ARG 72 HH11 ARG 72 0.039 -23.496 7.263 593 2HH1 ARG 72 HH12 ARG 72 1.334 -22.428 6.837 594 1HH2 ARG 72 HH21 ARG 72 1.869 -21.285 10.111 595 2HH2 ARG 72 HH22 ARG 72 2.385 -21.164 8.457 596 H ASN 73 HN ASN 73 -4.387 -22.464 11.770 597 HA ASN 73 HA ASN 73 -2.783 -22.306 14.139 598 1HB ASN 73 HB2 ASN 73 -4.420 -20.256 12.632 599 2HB ASN 73 HB1 ASN 73 -3.512 -19.865 14.089 600 1HD2 ASN 73 HD21 ASN 73 -3.218 -18.887 11.350 601 2HD2 ASN 73 HD22 ASN 73 -1.579 -19.214 10.910 602 H GLU 74 HN GLU 74 -6.264 -22.155 13.446 603 HA GLU 74 HA GLU 74 -6.935 -21.318 16.098 604 1HB GLU 74 HB2 GLU 74 -9.179 -21.401 15.460 605 2HB GLU 74 HB1 GLU 74 -8.349 -21.021 13.962 606 1HG GLU 74 HG2 GLU 74 -8.642 -23.217 13.132 607 2HG GLU 74 HG1 GLU 74 -9.188 -23.807 14.703 608 H ILE 75 HN ILE 75 -6.868 -24.403 14.409 609 HA ILE 75 HA ILE 75 -8.036 -25.974 16.438 610 HB ILE 75 HB ILE 75 -6.099 -26.787 14.257 611 1HG1 ILE 75 HG12 ILE 75 -9.125 -26.954 14.280 612 2HG1 ILE 75 HG11 ILE 75 -8.234 -25.624 13.553 613 1HG2 ILE 75 HG21 ILE 75 -7.999 -28.484 15.889 614 2HG2 ILE 75 HG22 ILE 75 -6.238 -28.485 16.013 615 3HG2 ILE 75 HG23 ILE 75 -7.017 -29.046 14.534 616 1HD1 ILE 75 HD11 ILE 75 -7.185 -27.175 12.003 617 2HD1 ILE 75 HD12 ILE 75 -8.944 -27.211 11.889 618 3HD1 ILE 75 HD13 ILE 75 -8.089 -28.508 12.726 619 H PHE 76 HN PHE 76 -4.682 -25.154 15.683 620 HA PHE 76 HA PHE 76 -3.315 -26.659 17.554 621 1HB PHE 76 HB2 PHE 76 -2.181 -25.284 15.888 622 2HB PHE 76 HB1 PHE 76 -2.798 -23.815 16.633 623 HD1 PHE 76 HD1 PHE 76 -1.707 -22.831 18.508 624 HD2 PHE 76 HD2 PHE 76 -0.456 -26.637 17.055 625 HE1 PHE 76 HE1 PHE 76 0.311 -22.699 19.908 626 HE2 PHE 76 HE2 PHE 76 1.560 -26.508 18.454 627 HZ PHE 76 HZ PHE 76 1.946 -24.540 19.882 628 H GLN 77 HN GLN 77 -5.038 -23.616 17.953 629 HA GLN 77 HA GLN 77 -4.293 -23.230 20.686 630 1HB GLN 77 HB2 GLN 77 -6.470 -21.981 18.997 631 2HB GLN 77 HB1 GLN 77 -6.045 -21.446 20.620 632 1HG GLN 77 HG2 GLN 77 -3.868 -20.769 19.916 633 2HG GLN 77 HG1 GLN 77 -4.086 -21.516 18.333 634 1HE2 GLN 77 HE21 GLN 77 -5.342 -20.492 16.800 635 2HE2 GLN 77 HE22 GLN 77 -5.825 -18.840 16.945 636 H LYS 78 HN LYS 78 -7.117 -24.578 19.021 637 HA LYS 78 HA LYS 78 -8.850 -24.936 21.169 638 1HB LYS 78 HB2 LYS 78 -8.419 -26.941 18.935 639 2HB LYS 78 HB1 LYS 78 -9.872 -26.743 19.902 640 1HG LYS 78 HG2 LYS 78 -8.789 -24.653 18.026 641 2HG LYS 78 HG1 LYS 78 -10.017 -25.838 17.590 642 1HD LYS 78 HD2 LYS 78 -11.523 -24.938 19.272 643 2HD LYS 78 HD1 LYS 78 -10.280 -23.801 19.810 644 1HE LYS 78 HE2 LYS 78 -10.311 -22.687 17.657 645 2HE LYS 78 HE1 LYS 78 -11.444 -23.878 17.020 646 1HZ LYS 78 HZ1 LYS 78 -13.112 -23.097 18.543 647 2HZ LYS 78 HZ2 LYS 78 -12.515 -21.784 17.661 648 3HZ LYS 78 HZ3 LYS 78 -12.026 -22.021 19.263 649 H ILE 79 HN ILE 79 -6.177 -26.916 20.041 650 HA ILE 79 HA ILE 79 -6.517 -29.088 21.818 651 HB ILE 79 HB ILE 79 -4.037 -28.146 20.360 652 1HG1 ILE 79 HG12 ILE 79 -6.088 -30.268 19.654 653 2HG1 ILE 79 HG11 ILE 79 -5.934 -28.695 18.879 654 1HG2 ILE 79 HG21 ILE 79 -3.183 -30.425 20.691 655 2HG2 ILE 79 HG22 ILE 79 -4.593 -30.808 21.679 656 3HG2 ILE 79 HG23 ILE 79 -3.435 -29.596 22.225 657 1HD1 ILE 79 HD11 ILE 79 -3.889 -30.904 18.828 658 2HD1 ILE 79 HD12 ILE 79 -3.718 -29.323 18.063 659 3HD1 ILE 79 HD13 ILE 79 -4.967 -30.440 17.511 660 H SER 80 HN SER 80 -4.961 -25.991 22.145 661 HA SER 80 HA SER 80 -3.415 -26.682 24.460 662 1HB SER 80 HB2 SER 80 -2.787 -24.846 22.915 663 2HB SER 80 HB1 SER 80 -4.224 -23.957 23.409 664 HG SER 80 HG SER 80 -1.821 -24.335 24.725 665 H GLN 81 HN GLN 81 -6.698 -25.935 23.907 666 HA GLN 81 HA GLN 81 -7.189 -24.543 26.387 667 1HB GLN 81 HB2 GLN 81 -9.104 -25.611 24.303 668 2HB GLN 81 HB1 GLN 81 -9.558 -24.586 25.658 669 1HG GLN 81 HG2 GLN 81 -8.210 -22.772 24.783 670 2HG GLN 81 HG1 GLN 81 -7.639 -23.799 23.470 671 1HE2 GLN 81 HE21 GLN 81 -10.266 -25.030 23.070 672 2HE2 GLN 81 HE22 GLN 81 -11.242 -23.842 22.284 673 H LEU 82 HN LEU 82 -6.586 -27.729 25.908 674 HA LEU 82 HA LEU 82 -8.829 -28.910 27.260 675 1HB LEU 82 HB2 LEU 82 -6.181 -30.303 27.184 676 2HB LEU 82 HB1 LEU 82 -7.793 -30.963 27.022 677 HG LEU 82 HG LEU 82 -6.315 -29.400 24.911 678 1HD1 LEU 82 HD11 LEU 82 -6.269 -31.510 23.682 679 2HD1 LEU 82 HD12 LEU 82 -7.019 -32.329 25.054 680 3HD1 LEU 82 HD13 LEU 82 -5.406 -31.630 25.216 681 1HD2 LEU 82 HD21 LEU 82 -9.035 -30.696 24.806 682 2HD2 LEU 82 HD22 LEU 82 -8.183 -29.974 23.441 683 3HD2 LEU 82 HD23 LEU 82 -8.699 -28.963 24.790 684 H ASP 83 HN ASP 83 -5.983 -27.315 28.265 685 HA ASP 83 HA ASP 83 -5.175 -26.726 30.305 686 1HB ASP 83 HB2 ASP 83 -7.451 -26.497 31.129 687 2HB ASP 83 HB1 ASP 83 -7.573 -28.233 31.383 688 H LYS 84 HN LYS 84 -6.039 -30.089 29.823 689 HA LYS 84 HA LYS 84 -4.222 -31.125 31.793 690 1HB LYS 84 HB2 LYS 84 -5.399 -32.732 29.528 691 2HB LYS 84 HB1 LYS 84 -5.012 -33.254 31.164 692 1HG LYS 84 HG2 LYS 84 -6.871 -31.926 32.037 693 2HG LYS 84 HG1 LYS 84 -7.250 -31.378 30.405 694 1HD LYS 84 HD2 LYS 84 -8.758 -33.096 30.638 695 2HD LYS 84 HD1 LYS 84 -7.409 -33.955 29.903 696 1HE LYS 84 HE2 LYS 84 -6.679 -34.740 32.092 697 2HE LYS 84 HE1 LYS 84 -7.968 -33.829 32.871 698 1HZ LYS 84 HZ1 LYS 84 -8.500 -36.189 32.628 699 2HZ LYS 84 HZ2 LYS 84 -8.395 -36.053 30.945 700 3HZ LYS 84 HZ3 LYS 84 -9.591 -35.214 31.789 701 H VAL 85 HN VAL 85 -3.819 -29.835 28.745 702 HA VAL 85 HA VAL 85 -1.590 -31.534 27.946 703 HB VAL 85 HB VAL 85 -3.171 -30.808 26.212 704 1HG1 VAL 85 HG11 VAL 85 -2.256 -28.000 26.853 705 2HG1 VAL 85 HG12 VAL 85 -3.858 -28.669 27.163 706 3HG1 VAL 85 HG13 VAL 85 -3.295 -28.462 25.504 707 1HG2 VAL 85 HG21 VAL 85 -1.549 -29.970 24.572 708 2HG2 VAL 85 HG22 VAL 85 -0.860 -31.254 25.564 709 3HG2 VAL 85 HG23 VAL 85 -0.430 -29.572 25.876 710 H VAL 86 HN VAL 86 0.541 -30.901 27.973 711 HA VAL 86 HA VAL 86 1.117 -28.413 29.440 712 HB VAL 86 HB VAL 86 3.330 -29.395 29.946 713 1HG1 VAL 86 HG11 VAL 86 1.492 -29.656 31.530 714 2HG1 VAL 86 HG12 VAL 86 2.547 -31.068 31.558 715 3HG1 VAL 86 HG13 VAL 86 0.993 -31.145 30.726 716 1HG2 VAL 86 HG21 VAL 86 3.745 -31.781 29.503 717 2HG2 VAL 86 HG22 VAL 86 3.577 -30.861 28.008 718 3HG2 VAL 86 HG23 VAL 86 2.246 -31.869 28.578 719 H GLN 87 HN GLN 87 1.735 -30.108 26.443 720 HA GLN 87 HA GLN 87 2.962 -27.704 25.359 721 1HB GLN 87 HB2 GLN 87 4.867 -29.000 26.260 722 2HB GLN 87 HB1 GLN 87 4.395 -30.373 25.268 723 1HG GLN 87 HG2 GLN 87 4.819 -29.080 23.246 724 2HG GLN 87 HG1 GLN 87 5.242 -27.673 24.220 725 1HE2 GLN 87 HE21 GLN 87 7.298 -27.568 23.321 726 2HE2 GLN 87 HE22 GLN 87 8.542 -28.698 23.731 727 H THR 88 HN THR 88 2.361 -27.354 23.335 728 HA THR 88 HA THR 88 1.247 -29.586 21.751 729 HB THR 88 HB THR 88 -0.183 -27.807 20.636 730 HG1 THR 88 HG1 THR 88 1.140 -26.039 21.540 731 1HG2 THR 88 HG21 THR 88 -1.862 -27.737 22.427 732 2HG2 THR 88 HG22 THR 88 -0.645 -28.255 23.594 733 3HG2 THR 88 HG23 THR 88 -1.140 -29.341 22.294 734 H LEU 89 HN LEU 89 2.555 -30.035 20.084 735 HA LEU 89 HA LEU 89 4.145 -27.868 18.879 736 1HB LEU 89 HB2 LEU 89 4.513 -30.860 18.574 737 2HB LEU 89 HB1 LEU 89 5.558 -29.616 17.920 738 HG LEU 89 HG LEU 89 6.001 -28.933 20.356 739 1HD1 LEU 89 HD11 LEU 89 5.713 -30.703 22.025 740 2HD1 LEU 89 HD12 LEU 89 4.824 -31.669 20.846 741 3HD1 LEU 89 HD13 LEU 89 4.163 -30.131 21.405 742 1HD2 LEU 89 HD21 LEU 89 6.954 -31.625 19.367 743 2HD2 LEU 89 HD22 LEU 89 7.730 -30.649 20.615 744 3HD2 LEU 89 HD23 LEU 89 7.652 -30.057 18.956 745 H GLY 90 HN GLY 90 3.066 -26.980 17.224 746 1HA GLY 90 HA2 GLY 90 1.921 -28.791 15.184 747 2HA GLY 90 HA1 GLY 90 1.006 -27.405 15.767 748 H SER 91 HN SER 91 4.455 -27.663 15.058 749 HA SER 91 HA SER 91 4.198 -25.985 12.703 750 1HB SER 91 HB2 SER 91 4.295 -24.371 14.589 751 2HB SER 91 HB1 SER 91 5.810 -25.095 15.123 752 HG SER 91 HG SER 91 6.814 -24.341 13.303 Start of MODEL 9 1 1H GLN 1 HT1 GLN 1 0.988 -6.146 -1.178 2 2H GLN 1 HT2 GLN 1 2.296 -5.223 -0.639 3 3H GLN 1 HT3 GLN 1 1.051 -5.620 0.429 4 HA GLN 1 HA GLN 1 2.937 -6.987 0.877 5 1HB GLN 1 HB2 GLN 1 0.652 -8.445 -0.479 6 2HB GLN 1 HB1 GLN 1 1.906 -9.263 0.441 7 1HG GLN 1 HG2 GLN 1 -0.067 -8.990 1.797 8 2HG GLN 1 HG1 GLN 1 1.242 -8.005 2.447 9 1HE2 GLN 1 HE21 GLN 1 -1.857 -7.983 0.886 10 2HE2 GLN 1 HE22 GLN 1 -2.176 -6.292 1.088 11 H GLY 2 HN GLY 2 1.743 -8.370 -2.189 12 1HA GLY 2 HA2 GLY 2 2.854 -9.097 -4.054 13 2HA GLY 2 HA1 GLY 2 3.967 -7.767 -3.774 14 H HIS 3 HN HIS 3 6.004 -8.249 -3.256 15 HA HIS 3 HA HIS 3 6.727 -11.049 -2.857 16 1HB HIS 3 HB2 HIS 3 8.018 -9.790 -4.503 17 2HB HIS 3 HB1 HIS 3 8.430 -8.576 -3.297 18 HD1 HIS 3 HD1 HIS 3 10.456 -9.032 -1.840 19 HD2 HIS 3 HD2 HIS 3 9.328 -12.320 -4.119 20 HE1 HIS 3 HE1 HIS 3 12.321 -10.696 -1.595 21 HE2 HIS 3 HE2 HIS 3 11.703 -12.587 -3.138 22 H MET 4 HN MET 4 6.682 -11.770 -0.832 23 HA MET 4 HA MET 4 6.858 -10.162 1.489 24 1HB MET 4 HB2 MET 4 7.297 -13.147 1.151 25 2HB MET 4 HB1 MET 4 7.098 -12.330 2.696 26 1HG MET 4 HG2 MET 4 5.044 -12.504 0.496 27 2HG MET 4 HG1 MET 4 5.036 -13.408 2.009 28 1HE MET 4 HE1 MET 4 2.042 -10.911 2.459 29 2HE MET 4 HE2 MET 4 2.541 -12.601 2.514 30 3HE MET 4 HE3 MET 4 2.545 -11.729 0.980 31 HA PRO 5 HA PRO 5 11.220 -9.540 2.244 32 1HB PRO 5 HB2 PRO 5 10.735 -10.872 4.886 33 2HB PRO 5 HB1 PRO 5 11.537 -9.335 4.535 34 1HG PRO 5 HG2 PRO 5 9.057 -9.363 5.502 35 2HG PRO 5 HG1 PRO 5 9.523 -8.200 4.245 36 1HD PRO 5 HD2 PRO 5 7.893 -10.698 4.010 37 2HD PRO 5 HD1 PRO 5 7.730 -9.155 3.144 38 H SER 6 HN SER 6 9.893 -12.631 3.377 39 HA SER 6 HA SER 6 12.287 -14.119 2.919 40 1HB SER 6 HB2 SER 6 9.418 -15.071 3.200 41 2HB SER 6 HB1 SER 6 10.855 -16.089 3.295 42 HG SER 6 HG SER 6 10.944 -15.589 5.312 43 H ASP 7 HN ASP 7 13.049 -14.087 0.856 44 HA ASP 7 HA ASP 7 11.484 -14.010 -1.476 45 1HB ASP 7 HB2 ASP 7 13.908 -13.451 -1.412 46 2HB ASP 7 HB1 ASP 7 14.275 -15.158 -1.177 47 H SER 8 HN SER 8 12.644 -16.652 0.501 48 HA SER 8 HA SER 8 11.821 -18.779 -1.175 49 1HB SER 8 HB2 SER 8 12.015 -18.745 1.853 50 2HB SER 8 HB1 SER 8 12.053 -20.168 0.809 51 HG SER 8 HG SER 8 14.029 -19.512 0.006 52 H LYS 9 HN LYS 9 9.788 -18.722 -1.929 53 HA LYS 9 HA LYS 9 7.551 -17.647 -0.591 54 1HB LYS 9 HB2 LYS 9 7.572 -19.675 -2.847 55 2HB LYS 9 HB1 LYS 9 6.245 -18.601 -2.417 56 1HG LYS 9 HG2 LYS 9 7.474 -16.675 -3.128 57 2HG LYS 9 HG1 LYS 9 8.946 -17.622 -3.337 58 1HD LYS 9 HD2 LYS 9 8.013 -17.231 -5.506 59 2HD LYS 9 HD1 LYS 9 7.769 -18.931 -5.115 60 1HE LYS 9 HE2 LYS 9 5.774 -18.008 -6.148 61 2HE LYS 9 HE1 LYS 9 5.445 -18.434 -4.468 62 1HZ LYS 9 HZ1 LYS 9 5.452 -16.200 -3.835 63 2HZ LYS 9 HZ2 LYS 9 4.589 -16.211 -5.289 64 3HZ LYS 9 HZ3 LYS 9 6.195 -15.686 -5.265 65 H LYS 10 HN LYS 10 6.019 -18.569 0.710 66 HA LYS 10 HA LYS 10 6.612 -20.965 2.091 67 1HB LYS 10 HB2 LYS 10 4.322 -19.048 2.038 68 2HB LYS 10 HB1 LYS 10 4.025 -20.637 2.719 69 1HG LYS 10 HG2 LYS 10 4.586 -18.944 4.415 70 2HG LYS 10 HG1 LYS 10 5.705 -20.304 4.404 71 1HD LYS 10 HD2 LYS 10 6.438 -17.909 2.785 72 2HD LYS 10 HD1 LYS 10 6.518 -17.758 4.539 73 1HE LYS 10 HE2 LYS 10 7.943 -19.838 2.868 74 2HE LYS 10 HE1 LYS 10 8.680 -18.425 3.621 75 1HZ LYS 10 HZ1 LYS 10 9.049 -20.412 4.936 76 2HZ LYS 10 HZ2 LYS 10 7.387 -20.681 5.063 77 3HZ LYS 10 HZ3 LYS 10 8.080 -19.319 5.793 78 HA PRO 11 HA PRO 11 5.317 -23.927 -0.979 79 1HB PRO 11 HB2 PRO 11 4.871 -25.617 1.446 80 2HB PRO 11 HB1 PRO 11 5.793 -25.974 -0.019 81 1HG PRO 11 HG2 PRO 11 7.034 -25.354 2.258 82 2HG PRO 11 HG1 PRO 11 7.648 -24.779 0.696 83 1HD PRO 11 HD2 PRO 11 6.157 -23.287 2.816 84 2HD PRO 11 HD1 PRO 11 7.450 -22.726 1.736 85 H THR 12 HN THR 12 3.361 -23.457 -1.822 86 HA THR 12 HA THR 12 0.989 -23.085 -0.348 87 HB THR 12 HB THR 12 1.258 -23.851 -3.272 88 HG1 THR 12 HG1 THR 12 2.389 -21.957 -2.937 89 1HG2 THR 12 HG21 THR 12 -0.926 -22.743 -3.529 90 2HG2 THR 12 HG22 THR 12 -0.993 -22.469 -1.788 91 3HG2 THR 12 HG23 THR 12 -1.034 -24.114 -2.424 92 H ILE 13 HN ILE 13 0.091 -24.611 0.836 93 HA ILE 13 HA ILE 13 0.449 -27.419 0.256 94 HB ILE 13 HB ILE 13 -1.062 -26.039 2.492 95 1HG1 ILE 13 HG12 ILE 13 1.387 -25.601 2.478 96 2HG1 ILE 13 HG11 ILE 13 0.888 -26.548 3.877 97 1HG2 ILE 13 HG21 ILE 13 -0.996 -28.226 3.630 98 2HG2 ILE 13 HG22 ILE 13 -0.293 -28.946 2.182 99 3HG2 ILE 13 HG23 ILE 13 -1.928 -28.286 2.133 100 1HD1 ILE 13 HD11 ILE 13 2.178 -27.637 1.384 101 2HD1 ILE 13 HD12 ILE 13 1.711 -28.574 2.804 102 3HD1 ILE 13 HD13 ILE 13 2.978 -27.354 2.929 103 H ILE 14 HN ILE 14 -1.030 -28.773 -0.582 104 HA ILE 14 HA ILE 14 -3.359 -27.642 -1.840 105 HB ILE 14 HB ILE 14 -2.299 -30.477 -1.777 106 1HG1 ILE 14 HG12 ILE 14 -0.847 -28.914 -2.968 107 2HG1 ILE 14 HG11 ILE 14 -1.631 -30.000 -4.110 108 1HG2 ILE 14 HG21 ILE 14 -3.864 -30.932 -3.627 109 2HG2 ILE 14 HG22 ILE 14 -4.577 -29.335 -3.397 110 3HG2 ILE 14 HG23 ILE 14 -4.697 -30.545 -2.120 111 1HD1 ILE 14 HD11 ILE 14 -1.560 -27.731 -4.961 112 2HD1 ILE 14 HD12 ILE 14 -2.430 -27.150 -3.541 113 3HD1 ILE 14 HD13 ILE 14 -3.226 -28.236 -4.681 114 H TYR 15 HN TYR 15 -5.311 -27.544 -0.996 115 HA TYR 15 HA TYR 15 -6.023 -29.327 1.241 116 1HB TYR 15 HB2 TYR 15 -6.965 -26.542 0.527 117 2HB TYR 15 HB1 TYR 15 -7.825 -27.558 1.677 118 HD1 TYR 15 HD1 TYR 15 -7.129 -27.675 3.931 119 HD2 TYR 15 HD2 TYR 15 -4.527 -25.938 1.039 120 HE1 TYR 15 HE1 TYR 15 -5.647 -26.906 5.734 121 HE2 TYR 15 HE2 TYR 15 -3.037 -25.167 2.840 122 HH TYR 15 HH TYR 15 -3.108 -24.672 5.207 123 HA PRO 16 HA PRO 16 -7.858 -29.950 2.254 124 1HB PRO 16 HB2 PRO 16 -9.140 -32.283 2.532 125 2HB PRO 16 HB1 PRO 16 -10.018 -30.779 2.220 126 1HG PRO 16 HG2 PRO 16 -9.294 -32.981 0.324 127 2HG PRO 16 HG1 PRO 16 -10.804 -32.059 0.443 128 1HD PRO 16 HD2 PRO 16 -8.776 -31.548 -1.381 129 2HD PRO 16 HD1 PRO 16 -10.003 -30.371 -0.875 130 H CYS 17 HN CYS 17 -6.894 -31.591 3.662 131 HA CYS 17 HA CYS 17 -5.317 -33.714 2.527 132 1HB CYS 17 HB2 CYS 17 -3.989 -31.645 1.977 133 2HB CYS 17 HB1 CYS 17 -3.855 -31.327 3.701 134 HG CYS 17 HG CYS 17 -1.864 -32.902 4.181 135 H LEU 18 HN LEU 18 -4.305 -35.004 4.158 136 HA LEU 18 HA LEU 18 -5.587 -34.868 6.743 137 1HB LEU 18 HB2 LEU 18 -3.564 -36.766 5.546 138 2HB LEU 18 HB1 LEU 18 -4.176 -36.927 7.183 139 HG LEU 18 HG LEU 18 -5.971 -36.943 4.754 140 1HD1 LEU 18 HD11 LEU 18 -4.404 -38.807 4.590 141 2HD1 LEU 18 HD12 LEU 18 -6.031 -39.375 4.960 142 3HD1 LEU 18 HD13 LEU 18 -4.811 -39.307 6.233 143 1HD2 LEU 18 HD21 LEU 18 -7.067 -36.383 6.863 144 2HD2 LEU 18 HD22 LEU 18 -6.402 -37.837 7.608 145 3HD2 LEU 18 HD23 LEU 18 -7.572 -37.974 6.296 146 H TRP 19 HN TRP 19 -4.864 -33.313 8.051 147 HA TRP 19 HA TRP 19 -2.019 -32.672 8.165 148 1HB TRP 19 HB2 TRP 19 -3.853 -30.899 8.066 149 2HB TRP 19 HB1 TRP 19 -4.261 -31.355 9.716 150 HD1 TRP 19 HD1 TRP 19 -2.388 -30.784 11.630 151 HE1 TRP 19 HE1 TRP 19 -0.557 -28.979 11.691 152 HE3 TRP 19 HE3 TRP 19 -2.236 -29.604 6.654 153 HZ2 TRP 19 HZ2 TRP 19 0.773 -27.278 9.878 154 HZ3 TRP 19 HZ3 TRP 19 -0.656 -27.874 5.903 155 HH2 TRP 19 HH2 TRP 19 0.817 -26.736 7.482 156 H ASP 20 HN ASP 20 -0.757 -32.946 9.966 157 HA ASP 20 HA ASP 20 -1.820 -34.750 12.035 158 1HB ASP 20 HB2 ASP 20 0.555 -35.317 12.481 159 2HB ASP 20 HB1 ASP 20 0.088 -35.654 10.817 160 H TYR 21 HN TYR 21 -2.012 -34.082 14.057 161 HA TYR 21 HA TYR 21 -0.778 -31.523 14.853 162 1HB TYR 21 HB2 TYR 21 -3.352 -32.808 15.819 163 2HB TYR 21 HB1 TYR 21 -2.650 -31.345 16.498 164 HD1 TYR 21 HD1 TYR 21 -2.625 -29.248 15.177 165 HD2 TYR 21 HD2 TYR 21 -4.559 -32.758 13.728 166 HE1 TYR 21 HE1 TYR 21 -3.843 -27.891 13.527 167 HE2 TYR 21 HE2 TYR 21 -5.778 -31.407 12.074 168 HH TYR 21 HH TYR 21 -6.502 -29.054 11.797 169 H ARG 22 HN ARG 22 0.910 -31.863 16.137 170 HA ARG 22 HA ARG 22 1.129 -34.212 17.823 171 1HB ARG 22 HB2 ARG 22 3.091 -33.222 16.652 172 2HB ARG 22 HB1 ARG 22 2.911 -31.769 17.617 173 1HG ARG 22 HG2 ARG 22 4.674 -33.015 18.574 174 2HG ARG 22 HG1 ARG 22 3.294 -33.189 19.657 175 1HD ARG 22 HD2 ARG 22 2.864 -35.400 18.893 176 2HD ARG 22 HD1 ARG 22 3.978 -35.219 17.535 177 HE ARG 22 HE ARG 22 5.104 -34.991 20.218 178 1HH1 ARG 22 HH11 ARG 22 4.588 -36.981 17.389 179 2HH1 ARG 22 HH12 ARG 22 5.906 -38.052 17.744 180 1HH2 ARG 22 HH21 ARG 22 6.858 -36.401 20.688 181 2HH2 ARG 22 HH22 ARG 22 7.196 -37.724 19.615 182 H VAL 23 HN VAL 23 0.018 -34.270 19.669 183 HA VAL 23 HA VAL 23 -0.563 -31.747 21.088 184 HB VAL 23 HB VAL 23 -2.038 -34.388 21.292 185 1HG1 VAL 23 HG11 VAL 23 -2.234 -33.022 23.301 186 2HG1 VAL 23 HG12 VAL 23 -3.770 -33.071 22.436 187 3HG1 VAL 23 HG13 VAL 23 -2.745 -31.639 22.332 188 1HG2 VAL 23 HG21 VAL 23 -2.784 -31.902 19.741 189 2HG2 VAL 23 HG22 VAL 23 -3.809 -33.320 19.962 190 3HG2 VAL 23 HG23 VAL 23 -2.302 -33.455 19.056 191 H ILE 24 HN ILE 24 0.957 -31.500 22.656 192 HA ILE 24 HA ILE 24 1.769 -33.850 24.230 193 HB ILE 24 HB ILE 24 2.991 -31.075 24.175 194 1HG1 ILE 24 HG12 ILE 24 3.952 -33.661 22.904 195 2HG1 ILE 24 HG11 ILE 24 3.273 -32.288 22.036 196 1HG2 ILE 24 HG21 ILE 24 3.973 -33.628 25.464 197 2HG2 ILE 24 HG22 ILE 24 3.347 -32.212 26.308 198 3HG2 ILE 24 HG23 ILE 24 4.856 -32.103 25.402 199 1HD1 ILE 24 HD11 ILE 24 5.839 -32.295 23.611 200 2HD1 ILE 24 HD12 ILE 24 5.158 -30.910 22.753 201 3HD1 ILE 24 HD13 ILE 24 5.684 -32.333 21.854 202 H MET 25 HN MET 25 0.368 -34.186 25.851 203 HA MET 25 HA MET 25 -0.481 -31.870 27.484 204 1HB MET 25 HB2 MET 25 -1.895 -34.533 27.155 205 2HB MET 25 HB1 MET 25 -2.443 -33.199 28.159 206 1HG MET 25 HG2 MET 25 -2.456 -31.835 25.980 207 2HG MET 25 HG1 MET 25 -2.378 -33.397 25.170 208 1HE MET 25 HE1 MET 25 -4.125 -35.220 27.194 209 2HE MET 25 HE2 MET 25 -4.267 -35.292 25.437 210 3HE MET 25 HE3 MET 25 -5.711 -35.092 26.431 211 H THR 26 HN THR 26 -0.780 -32.317 29.800 212 HA THR 26 HA THR 26 1.368 -33.992 30.831 213 HB THR 26 HB THR 26 0.654 -32.980 33.055 214 HG1 THR 26 HG1 THR 26 -1.266 -32.087 32.947 215 1HG2 THR 26 HG21 THR 26 1.440 -31.066 30.847 216 2HG2 THR 26 HG22 THR 26 2.543 -32.081 31.778 217 3HG2 THR 26 HG23 THR 26 1.650 -30.786 32.576 218 H THR 27 HN THR 27 -1.727 -34.540 29.959 219 HA THR 27 HA THR 27 -2.038 -36.710 31.922 220 HB THR 27 HB THR 27 -3.686 -34.889 32.420 221 HG1 THR 27 HG1 THR 27 -4.991 -36.464 32.968 222 1HG2 THR 27 HG21 THR 27 -4.785 -35.545 29.678 223 2HG2 THR 27 HG22 THR 27 -3.976 -34.042 30.123 224 3HG2 THR 27 HG23 THR 27 -5.519 -34.465 30.863 225 H LYS 28 HN LYS 28 -3.031 -38.593 31.115 226 HA LYS 28 HA LYS 28 -3.026 -38.860 28.200 227 1HB LYS 28 HB2 LYS 28 -3.250 -40.950 30.379 228 2HB LYS 28 HB1 LYS 28 -3.207 -41.296 28.652 229 1HG LYS 28 HG2 LYS 28 -0.967 -40.333 28.505 230 2HG LYS 28 HG1 LYS 28 -1.004 -39.960 30.229 231 1HD LYS 28 HD2 LYS 28 -1.121 -42.717 28.996 232 2HD LYS 28 HD1 LYS 28 0.272 -41.995 29.803 233 1HE LYS 28 HE2 LYS 28 -1.078 -41.841 31.884 234 2HE LYS 28 HE1 LYS 28 -2.390 -42.681 31.057 235 1HZ LYS 28 HZ1 LYS 28 0.306 -43.734 31.692 236 2HZ LYS 28 HZ2 LYS 28 -0.783 -44.522 30.668 237 3HZ LYS 28 HZ3 LYS 28 -1.182 -44.278 32.292 238 H ASP 29 HN ASP 29 -5.101 -37.789 30.368 239 HA ASP 29 HA ASP 29 -7.497 -39.195 29.659 240 1HB ASP 29 HB2 ASP 29 -7.402 -38.048 31.806 241 2HB ASP 29 HB1 ASP 29 -7.061 -36.514 31.014 242 H THR 30 HN THR 30 -7.039 -39.103 27.335 243 HA THR 30 HA THR 30 -7.517 -36.531 26.087 244 HB THR 30 HB THR 30 -5.882 -37.890 24.982 245 HG1 THR 30 HG1 THR 30 -6.816 -37.988 22.900 246 1HG2 THR 30 HG21 THR 30 -7.987 -40.045 24.718 247 2HG2 THR 30 HG22 THR 30 -6.589 -40.094 25.793 248 3HG2 THR 30 HG23 THR 30 -6.357 -40.095 24.046 249 H SER 31 HN SER 31 -9.523 -35.907 26.434 250 HA SER 31 HA SER 31 -11.723 -37.549 25.396 251 1HB SER 31 HB2 SER 31 -13.090 -36.774 27.377 252 2HB SER 31 HB1 SER 31 -11.785 -37.884 27.797 253 HG SER 31 HG SER 31 -10.962 -36.378 29.009 254 H THR 32 HN THR 32 -11.125 -34.415 26.953 255 HA THR 32 HA THR 32 -12.823 -32.795 25.521 256 HB THR 32 HB THR 32 -10.045 -31.846 26.214 257 HG1 THR 32 HG1 THR 32 -11.626 -31.705 28.378 258 1HG2 THR 32 HG21 THR 32 -12.799 -30.647 26.610 259 2HG2 THR 32 HG22 THR 32 -11.664 -30.226 25.327 260 3HG2 THR 32 HG23 THR 32 -11.267 -29.867 27.007 261 H LEU 33 HN LEU 33 -9.656 -34.031 24.673 262 HA LEU 33 HA LEU 33 -9.148 -32.488 22.380 263 1HB LEU 33 HB2 LEU 33 -7.422 -33.770 23.567 264 2HB LEU 33 HB1 LEU 33 -8.196 -35.270 23.093 265 HG LEU 33 HG LEU 33 -7.687 -34.787 20.727 266 1HD1 LEU 33 HD11 LEU 33 -7.691 -32.357 20.803 267 2HD1 LEU 33 HD12 LEU 33 -6.169 -32.955 20.146 268 3HD1 LEU 33 HD13 LEU 33 -6.240 -32.366 21.808 269 1HD2 LEU 33 HD21 LEU 33 -5.287 -34.667 22.557 270 2HD2 LEU 33 HD22 LEU 33 -5.262 -35.132 20.856 271 3HD2 LEU 33 HD23 LEU 33 -6.125 -36.126 22.028 272 H LYS 34 HN LYS 34 -10.823 -35.586 22.820 273 HA LYS 34 HA LYS 34 -11.101 -36.079 20.017 274 1HB LYS 34 HB2 LYS 34 -12.556 -37.269 22.390 275 2HB LYS 34 HB1 LYS 34 -12.728 -37.835 20.732 276 1HG LYS 34 HG2 LYS 34 -10.309 -38.358 20.693 277 2HG LYS 34 HG1 LYS 34 -10.203 -37.875 22.387 278 1HD LYS 34 HD2 LYS 34 -11.935 -40.104 21.297 279 2HD LYS 34 HD1 LYS 34 -10.395 -40.319 22.130 280 1HE LYS 34 HE2 LYS 34 -11.318 -39.367 24.158 281 2HE LYS 34 HE1 LYS 34 -12.834 -39.006 23.335 282 1HZ LYS 34 HZ1 LYS 34 -13.027 -41.006 24.651 283 2HZ LYS 34 HZ2 LYS 34 -11.729 -41.715 23.833 284 3HZ LYS 34 HZ3 LYS 34 -13.166 -41.385 23.008 285 H GLU 35 HN GLU 35 -13.191 -34.720 22.526 286 HA GLU 35 HA GLU 35 -15.580 -34.502 21.161 287 1HB GLU 35 HB2 GLU 35 -14.312 -32.676 23.205 288 2HB GLU 35 HB1 GLU 35 -15.937 -32.406 22.592 289 1HG GLU 35 HG2 GLU 35 -15.023 -34.916 23.988 290 2HG GLU 35 HG1 GLU 35 -15.883 -33.583 24.759 291 H LEU 36 HN LEU 36 -12.880 -32.169 21.172 292 HA LEU 36 HA LEU 36 -14.185 -30.281 19.521 293 1HB LEU 36 HB2 LEU 36 -12.085 -29.149 19.367 294 2HB LEU 36 HB1 LEU 36 -12.252 -29.771 20.996 295 HG LEU 36 HG LEU 36 -10.824 -31.784 19.964 296 1HD1 LEU 36 HD11 LEU 36 -10.708 -30.886 17.711 297 2HD1 LEU 36 HD12 LEU 36 -9.104 -30.956 18.440 298 3HD1 LEU 36 HD13 LEU 36 -9.951 -29.414 18.319 299 1HD2 LEU 36 HD21 LEU 36 -8.813 -30.713 20.866 300 2HD2 LEU 36 HD22 LEU 36 -10.205 -30.482 21.923 301 3HD2 LEU 36 HD23 LEU 36 -9.654 -29.162 20.892 302 H LEU 37 HN LEU 37 -12.263 -33.117 18.837 303 HA LEU 37 HA LEU 37 -11.794 -32.541 16.077 304 1HB LEU 37 HB2 LEU 37 -11.731 -35.175 17.570 305 2HB LEU 37 HB1 LEU 37 -11.136 -34.930 15.938 306 HG LEU 37 HG LEU 37 -10.014 -33.527 18.371 307 1HD1 LEU 37 HD11 LEU 37 -9.634 -35.928 18.536 308 2HD1 LEU 37 HD12 LEU 37 -8.131 -35.072 18.202 309 3HD1 LEU 37 HD13 LEU 37 -8.953 -35.946 16.909 310 1HD2 LEU 37 HD21 LEU 37 -8.150 -32.975 16.883 311 2HD2 LEU 37 HD22 LEU 37 -9.669 -32.312 16.283 312 3HD2 LEU 37 HD23 LEU 37 -8.985 -33.759 15.542 313 H GLU 38 HN GLU 38 -14.231 -34.340 17.873 314 HA GLU 38 HA GLU 38 -15.388 -35.600 15.601 315 1HB GLU 38 HB2 GLU 38 -16.529 -35.184 18.374 316 2HB GLU 38 HB1 GLU 38 -17.208 -36.247 17.147 317 1HG GLU 38 HG2 GLU 38 -15.041 -37.506 17.162 318 2HG GLU 38 HG1 GLU 38 -14.554 -36.528 18.542 319 H THR 39 HN THR 39 -15.798 -32.457 16.995 320 HA THR 39 HA THR 39 -18.456 -31.911 16.304 321 HB THR 39 HB THR 39 -17.808 -29.511 16.278 322 HG1 THR 39 HG1 THR 39 -15.215 -29.986 17.079 323 1HG2 THR 39 HG21 THR 39 -18.292 -30.601 18.418 324 2HG2 THR 39 HG22 THR 39 -17.028 -29.384 18.603 325 3HG2 THR 39 HG23 THR 39 -16.603 -31.095 18.557 326 H TYR 40 HN TYR 40 -15.553 -31.958 14.361 327 HA TYR 40 HA TYR 40 -16.726 -30.619 12.096 328 1HB TYR 40 HB2 TYR 40 -14.162 -32.235 12.254 329 2HB TYR 40 HB1 TYR 40 -14.612 -31.113 10.971 330 HD1 TYR 40 HD1 TYR 40 -14.524 -28.685 11.349 331 HD2 TYR 40 HD2 TYR 40 -13.404 -31.422 14.414 332 HE1 TYR 40 HE1 TYR 40 -13.494 -26.842 12.619 333 HE2 TYR 40 HE2 TYR 40 -12.371 -29.590 15.685 334 HH TYR 40 HH TYR 40 -12.735 -26.244 14.677 335 H GLN 41 HN GLN 41 -17.093 -33.642 13.390 336 HA GLN 41 HA GLN 41 -18.068 -35.573 12.722 337 1HB GLN 41 HB2 GLN 41 -19.094 -33.761 10.526 338 2HB GLN 41 HB1 GLN 41 -19.678 -35.395 10.800 339 1HG GLN 41 HG2 GLN 41 -19.853 -33.126 12.783 340 2HG GLN 41 HG1 GLN 41 -21.163 -33.681 11.747 341 1HE2 GLN 41 HE21 GLN 41 -19.268 -34.340 14.561 342 2HE2 GLN 41 HE22 GLN 41 -20.213 -35.652 15.160 343 H ARG 42 HN ARG 42 -15.370 -34.852 11.651 344 HA ARG 42 HA ARG 42 -15.349 -36.566 9.249 345 1HB ARG 42 HB2 ARG 42 -13.277 -35.494 8.597 346 2HB ARG 42 HB1 ARG 42 -14.500 -34.265 8.883 347 1HG ARG 42 HG2 ARG 42 -13.509 -33.665 10.982 348 2HG ARG 42 HG1 ARG 42 -12.400 -35.035 10.906 349 1HD ARG 42 HD2 ARG 42 -11.184 -33.073 10.296 350 2HD ARG 42 HD1 ARG 42 -11.412 -34.042 8.843 351 HE ARG 42 HE ARG 42 -12.652 -31.466 9.461 352 1HH1 ARG 42 HH11 ARG 42 -12.383 -34.169 7.230 353 2HH1 ARG 42 HH12 ARG 42 -12.984 -33.262 5.881 354 1HH2 ARG 42 HH21 ARG 42 -13.412 -30.278 7.668 355 2HH2 ARG 42 HH22 ARG 42 -13.582 -31.072 6.130 356 HA PRO 43 HA PRO 43 -13.038 -39.626 11.439 357 1HB PRO 43 HB2 PRO 43 -11.312 -40.544 9.537 358 2HB PRO 43 HB1 PRO 43 -13.041 -40.906 9.524 359 1HG PRO 43 HG2 PRO 43 -11.537 -38.816 7.985 360 2HG PRO 43 HG1 PRO 43 -12.799 -39.929 7.419 361 1HD PRO 43 HD2 PRO 43 -13.337 -37.358 8.031 362 2HD PRO 43 HD1 PRO 43 -14.508 -38.659 8.331 363 H PHE 44 HN PHE 44 -11.246 -39.825 12.696 364 HA PHE 44 HA PHE 44 -8.787 -38.427 12.000 365 1HB PHE 44 HB2 PHE 44 -8.616 -37.297 14.170 366 2HB PHE 44 HB1 PHE 44 -10.045 -36.753 13.303 367 HD1 PHE 44 HD1 PHE 44 -8.803 -38.581 16.217 368 HD2 PHE 44 HD2 PHE 44 -12.282 -37.350 14.083 369 HE1 PHE 44 HE1 PHE 44 -10.189 -39.120 18.175 370 HE2 PHE 44 HE2 PHE 44 -13.672 -37.888 16.041 371 HZ PHE 44 HZ PHE 44 -12.627 -38.775 18.092 372 H LYS 45 HN LYS 45 -6.963 -39.159 13.248 373 HA LYS 45 HA LYS 45 -7.428 -41.762 14.563 374 1HB LYS 45 HB2 LYS 45 -6.169 -41.873 12.402 375 2HB LYS 45 HB1 LYS 45 -4.935 -40.844 13.109 376 1HG LYS 45 HG2 LYS 45 -4.369 -42.524 14.729 377 2HG LYS 45 HG1 LYS 45 -5.713 -43.542 14.202 378 1HD LYS 45 HD2 LYS 45 -4.667 -43.774 11.991 379 2HD LYS 45 HD1 LYS 45 -3.325 -42.754 12.517 380 1HE LYS 45 HE2 LYS 45 -2.646 -44.387 14.145 381 2HE LYS 45 HE1 LYS 45 -4.084 -45.359 13.840 382 1HZ LYS 45 HZ1 LYS 45 -2.136 -46.272 12.742 383 2HZ LYS 45 HZ2 LYS 45 -1.915 -44.836 11.877 384 3HZ LYS 45 HZ3 LYS 45 -3.290 -45.784 11.606 385 H LEU 46 HN LEU 46 -6.969 -41.825 16.642 386 HA LEU 46 HA LEU 46 -5.388 -39.654 17.855 387 1HB LEU 46 HB2 LEU 46 -7.688 -39.932 18.671 388 2HB LEU 46 HB1 LEU 46 -7.360 -41.609 19.063 389 HG LEU 46 HG LEU 46 -5.665 -40.817 20.738 390 1HD1 LEU 46 HD11 LEU 46 -5.208 -38.617 19.801 391 2HD1 LEU 46 HD12 LEU 46 -5.761 -38.483 21.470 392 3HD1 LEU 46 HD13 LEU 46 -6.863 -38.113 20.144 393 1HD2 LEU 46 HD21 LEU 46 -7.332 -40.146 22.404 394 2HD2 LEU 46 HD22 LEU 46 -7.905 -41.493 21.422 395 3HD2 LEU 46 HD23 LEU 46 -8.505 -39.861 21.119 396 H GLU 47 HN GLU 47 -3.323 -40.174 18.321 397 HA GLU 47 HA GLU 47 -2.707 -42.974 19.053 398 1HB GLU 47 HB2 GLU 47 -0.935 -41.103 17.469 399 2HB GLU 47 HB1 GLU 47 -0.578 -42.770 17.894 400 1HG GLU 47 HG2 GLU 47 -2.439 -43.521 16.491 401 2HG GLU 47 HG1 GLU 47 -2.772 -41.843 16.052 402 H PHE 48 HN PHE 48 -1.202 -43.313 20.647 403 HA PHE 48 HA PHE 48 -0.040 -40.956 21.981 404 1HB PHE 48 HB2 PHE 48 -1.275 -42.449 23.480 405 2HB PHE 48 HB1 PHE 48 -0.344 -43.831 22.915 406 HD1 PHE 48 HD1 PHE 48 1.665 -44.426 23.976 407 HD2 PHE 48 HD2 PHE 48 -0.034 -40.587 24.710 408 HE1 PHE 48 HE1 PHE 48 3.306 -44.042 25.768 409 HE2 PHE 48 HE2 PHE 48 1.607 -40.203 26.502 410 HZ PHE 48 HZ PHE 48 3.279 -41.930 27.032 411 H LYS 49 HN LYS 49 1.943 -40.470 21.203 412 HA LYS 49 HA LYS 49 3.451 -42.462 19.734 413 1HB LYS 49 HB2 LYS 49 4.083 -39.556 20.301 414 2HB LYS 49 HB1 LYS 49 4.985 -40.595 19.210 415 1HG LYS 49 HG2 LYS 49 2.063 -39.965 18.821 416 2HG LYS 49 HG1 LYS 49 3.354 -38.968 18.159 417 1HD LYS 49 HD2 LYS 49 2.860 -40.346 16.365 418 2HD LYS 49 HD1 LYS 49 4.196 -41.215 17.114 419 1HE LYS 49 HE2 LYS 49 2.679 -42.775 18.143 420 2HE LYS 49 HE1 LYS 49 1.285 -41.822 17.639 421 1HZ LYS 49 HZ1 LYS 49 1.571 -43.720 16.203 422 2HZ LYS 49 HZ2 LYS 49 3.156 -43.263 15.835 423 3HZ LYS 49 HZ3 LYS 49 1.861 -42.304 15.325 424 H ASN 50 HN ASN 50 4.471 -40.123 22.233 425 HA ASN 50 HA ASN 50 6.110 -42.188 23.508 426 1HB ASN 50 HB2 ASN 50 7.264 -39.549 22.535 427 2HB ASN 50 HB1 ASN 50 8.129 -40.780 23.447 428 1HD2 ASN 50 HD21 ASN 50 8.772 -42.678 22.397 429 2HD2 ASN 50 HD22 ASN 50 8.795 -42.811 20.675 430 H THR 51 HN THR 51 7.309 -41.101 25.447 431 HA THR 51 HA THR 51 5.904 -38.816 26.570 432 HB THR 51 HB THR 51 4.616 -40.747 27.427 433 HG1 THR 51 HG1 THR 51 5.076 -38.833 28.750 434 1HG2 THR 51 HG21 THR 51 6.388 -42.449 27.374 435 2HG2 THR 51 HG22 THR 51 5.647 -42.349 28.971 436 3HG2 THR 51 HG23 THR 51 7.227 -41.619 28.685 437 H SER 52 HN SER 52 7.137 -37.665 28.022 438 HA SER 52 HA SER 52 9.928 -37.815 27.814 439 1HB SER 52 HB2 SER 52 8.714 -35.737 28.343 440 2HB SER 52 HB1 SER 52 8.246 -36.402 29.907 441 HG SER 52 HG SER 52 10.873 -35.810 29.001 442 H LYS 53 HN LYS 53 11.484 -38.134 29.570 443 HA LYS 53 HA LYS 53 11.189 -40.673 30.756 444 1HB LYS 53 HB2 LYS 53 13.223 -38.479 31.134 445 2HB LYS 53 HB1 LYS 53 13.300 -39.971 32.060 446 1HG LYS 53 HG2 LYS 53 14.788 -40.116 30.171 447 2HG LYS 53 HG1 LYS 53 13.454 -41.249 29.952 448 1HD LYS 53 HD2 LYS 53 12.352 -39.632 28.450 449 2HD LYS 53 HD1 LYS 53 13.714 -38.530 28.655 450 1HE LYS 53 HE2 LYS 53 13.865 -41.308 27.479 451 2HE LYS 53 HE1 LYS 53 13.845 -39.809 26.555 452 1HZ LYS 53 HZ1 LYS 53 16.086 -40.629 26.808 453 2HZ LYS 53 HZ2 LYS 53 15.937 -40.633 28.490 454 3HZ LYS 53 HZ3 LYS 53 15.919 -39.170 27.648 455 H ASN 54 HN ASN 54 10.526 -37.458 31.934 456 HA ASN 54 HA ASN 54 10.149 -38.380 34.679 457 1HB ASN 54 HB2 ASN 54 9.782 -36.070 35.252 458 2HB ASN 54 HB1 ASN 54 11.167 -36.134 34.170 459 1HD2 ASN 54 HD21 ASN 54 9.556 -33.862 34.716 460 2HD2 ASN 54 HD22 ASN 54 8.840 -33.377 33.221 461 H ALA 55 HN ALA 55 8.419 -38.477 31.895 462 HA ALA 55 HA ALA 55 6.295 -38.999 31.349 463 1HB ALA 55 HB1 ALA 55 4.886 -40.082 33.032 464 2HB ALA 55 HB2 ALA 55 6.000 -39.563 34.300 465 3HB ALA 55 HB3 ALA 55 6.538 -40.704 33.065 466 H LYS 56 HN LYS 56 7.024 -36.210 32.518 467 HA LYS 56 HA LYS 56 4.479 -35.183 33.392 468 1HB LYS 56 HB2 LYS 56 6.545 -34.060 34.084 469 2HB LYS 56 HB1 LYS 56 6.959 -33.742 32.404 470 1HG LYS 56 HG2 LYS 56 4.867 -32.369 32.233 471 2HG LYS 56 HG1 LYS 56 4.669 -32.565 33.974 472 1HD LYS 56 HD2 LYS 56 7.075 -31.323 32.628 473 2HD LYS 56 HD1 LYS 56 5.742 -30.420 33.346 474 1HE LYS 56 HE2 LYS 56 6.264 -31.422 35.535 475 2HE LYS 56 HE1 LYS 56 7.613 -32.293 34.805 476 1HZ LYS 56 HZ1 LYS 56 7.356 -29.337 34.842 477 2HZ LYS 56 HZ2 LYS 56 8.688 -30.231 34.304 478 3HZ LYS 56 HZ3 LYS 56 8.275 -30.232 35.944 479 H PHE 57 HN PHE 57 6.119 -35.672 30.386 480 HA PHE 57 HA PHE 57 4.052 -34.148 28.940 481 1HB PHE 57 HB2 PHE 57 6.853 -34.854 28.013 482 2HB PHE 57 HB1 PHE 57 5.683 -33.876 27.134 483 HD1 PHE 57 HD1 PHE 57 8.329 -33.864 29.549 484 HD2 PHE 57 HD2 PHE 57 4.937 -31.674 28.182 485 HE1 PHE 57 HE1 PHE 57 9.203 -31.839 30.631 486 HE2 PHE 57 HE2 PHE 57 5.812 -29.645 29.263 487 HZ PHE 57 HZ PHE 57 7.947 -29.726 30.488 488 H TYR 58 HN TYR 58 2.574 -35.448 28.094 489 HA TYR 58 HA TYR 58 3.389 -38.049 26.980 490 1HB TYR 58 HB2 TYR 58 0.622 -36.996 27.644 491 2HB TYR 58 HB1 TYR 58 0.978 -38.597 27.005 492 HD1 TYR 58 HD1 TYR 58 2.634 -40.043 28.448 493 HD2 TYR 58 HD2 TYR 58 0.444 -36.713 29.945 494 HE1 TYR 58 HE1 TYR 58 2.901 -40.903 30.737 495 HE2 TYR 58 HE2 TYR 58 0.709 -37.565 32.236 496 HH TYR 58 HH TYR 58 2.905 -39.829 33.124 497 H SER 59 HN SER 59 3.756 -38.043 24.872 498 HA SER 59 HA SER 59 2.770 -35.852 23.229 499 1HB SER 59 HB2 SER 59 4.734 -38.072 22.595 500 2HB SER 59 HB1 SER 59 4.363 -36.699 21.551 501 HG SER 59 HG SER 59 5.419 -36.495 24.185 502 H PHE 60 HN PHE 60 0.856 -36.094 22.348 503 HA PHE 60 HA PHE 60 0.022 -38.709 21.295 504 1HB PHE 60 HB2 PHE 60 -1.575 -36.204 21.914 505 2HB PHE 60 HB1 PHE 60 -2.248 -37.624 21.122 506 HD1 PHE 60 HD1 PHE 60 -1.335 -36.114 24.269 507 HD2 PHE 60 HD2 PHE 60 -2.345 -39.790 22.365 508 HE1 PHE 60 HE1 PHE 60 -1.847 -37.113 26.459 509 HE2 PHE 60 HE2 PHE 60 -2.853 -40.789 24.552 510 HZ PHE 60 HZ PHE 60 -2.603 -39.450 26.601 511 H ASN 61 HN ASN 61 -1.091 -38.694 19.208 512 HA ASN 61 HA ASN 61 -0.318 -36.501 17.411 513 1HB ASN 61 HB2 ASN 61 1.394 -38.247 17.148 514 2HB ASN 61 HB1 ASN 61 0.143 -39.452 16.863 515 1HD2 ASN 61 HD21 ASN 61 -0.903 -39.511 14.875 516 2HD2 ASN 61 HD22 ASN 61 -0.324 -38.632 13.502 517 H VAL 62 HN VAL 62 -2.051 -35.816 16.356 518 HA VAL 62 HA VAL 62 -4.288 -37.691 15.908 519 HB VAL 62 HB VAL 62 -4.388 -34.682 16.258 520 1HG1 VAL 62 HG11 VAL 62 -6.834 -34.953 16.181 521 2HG1 VAL 62 HG12 VAL 62 -6.627 -36.661 15.796 522 3HG1 VAL 62 HG13 VAL 62 -6.070 -35.427 14.665 523 1HG2 VAL 62 HG21 VAL 62 -5.370 -36.899 18.067 524 2HG2 VAL 62 HG22 VAL 62 -5.621 -35.173 18.329 525 3HG2 VAL 62 HG23 VAL 62 -3.989 -35.842 18.369 526 H SER 63 HN SER 63 -4.491 -38.249 13.838 527 HA SER 63 HA SER 63 -3.678 -36.327 11.756 528 1HB SER 63 HB2 SER 63 -3.620 -38.301 10.238 529 2HB SER 63 HB1 SER 63 -2.518 -38.468 11.601 530 HG SER 63 HG SER 63 -4.879 -39.842 11.037 531 H MET 64 HN MET 64 -5.337 -35.163 11.017 532 HA MET 64 HA MET 64 -7.854 -36.532 10.377 533 1HB MET 64 HB2 MET 64 -9.212 -34.825 11.410 534 2HB MET 64 HB1 MET 64 -8.108 -35.458 12.621 535 1HG MET 64 HG2 MET 64 -6.644 -33.496 12.259 536 2HG MET 64 HG1 MET 64 -7.842 -32.847 11.138 537 1HE MET 64 HE1 MET 64 -10.401 -32.310 11.922 538 2HE MET 64 HE2 MET 64 -10.932 -32.409 13.600 539 3HE MET 64 HE3 MET 64 -10.536 -33.881 12.711 540 H GLU 65 HN GLU 65 -9.237 -35.202 8.946 541 HA GLU 65 HA GLU 65 -7.647 -34.066 6.837 542 1HB GLU 65 HB2 GLU 65 -10.660 -34.107 7.083 543 2HB GLU 65 HB1 GLU 65 -9.725 -33.875 5.614 544 1HG GLU 65 HG2 GLU 65 -8.939 -36.159 5.714 545 2HG GLU 65 HG1 GLU 65 -9.775 -36.405 7.250 546 H VAL 66 HN VAL 66 -7.606 -31.948 6.143 547 HA VAL 66 HA VAL 66 -9.355 -30.008 7.497 548 HB VAL 66 HB VAL 66 -7.533 -28.286 7.257 549 1HG1 VAL 66 HG11 VAL 66 -6.888 -30.621 9.065 550 2HG1 VAL 66 HG12 VAL 66 -8.015 -29.312 9.423 551 3HG1 VAL 66 HG13 VAL 66 -6.292 -28.971 9.256 552 1HG2 VAL 66 HG21 VAL 66 -6.152 -29.413 5.588 553 2HG2 VAL 66 HG22 VAL 66 -5.779 -30.696 6.740 554 3HG2 VAL 66 HG23 VAL 66 -5.207 -29.052 7.032 555 H SER 67 HN SER 67 -10.550 -28.885 6.087 556 HA SER 67 HA SER 67 -10.091 -29.302 3.242 557 1HB SER 67 HB2 SER 67 -12.358 -29.651 4.192 558 2HB SER 67 HB1 SER 67 -12.412 -27.954 4.662 559 HG SER 67 HG SER 67 -11.969 -28.757 1.981 560 H ASN 68 HN ASN 68 -9.914 -26.782 5.645 561 HA ASN 68 HA ASN 68 -8.420 -25.156 3.787 562 1HB ASN 68 HB2 ASN 68 -9.698 -23.107 4.074 563 2HB ASN 68 HB1 ASN 68 -10.701 -24.347 3.354 564 1HD2 ASN 68 HD21 ASN 68 -11.344 -25.764 5.757 565 2HD2 ASN 68 HD22 ASN 68 -12.373 -24.742 6.692 566 H GLU 69 HN GLU 69 -7.713 -23.053 4.955 567 HA GLU 69 HA GLU 69 -6.181 -23.982 7.156 568 1HB GLU 69 HB2 GLU 69 -5.271 -22.307 5.639 569 2HB GLU 69 HB1 GLU 69 -6.528 -21.166 6.102 570 1HG GLU 69 HG2 GLU 69 -5.654 -21.076 8.367 571 2HG GLU 69 HG1 GLU 69 -4.435 -22.282 7.968 572 H SER 70 HN SER 70 -9.204 -22.251 6.944 573 HA SER 70 HA SER 70 -9.379 -21.097 9.448 574 1HB SER 70 HB2 SER 70 -11.116 -20.860 7.701 575 2HB SER 70 HB1 SER 70 -11.604 -22.533 7.966 576 HG SER 70 HG SER 70 -12.820 -21.817 9.509 577 H GLU 71 HN GLU 71 -9.889 -24.468 8.516 578 HA GLU 71 HA GLU 71 -10.553 -25.356 11.166 579 1HB GLU 71 HB2 GLU 71 -9.673 -26.897 8.711 580 2HB GLU 71 HB1 GLU 71 -10.272 -27.629 10.195 581 1HG GLU 71 HG2 GLU 71 -12.444 -26.775 9.864 582 2HG GLU 71 HG1 GLU 71 -11.899 -25.661 8.609 583 H ARG 72 HN ARG 72 -7.667 -25.349 9.124 584 HA ARG 72 HA ARG 72 -5.974 -26.874 10.731 585 1HB ARG 72 HB2 ARG 72 -5.613 -26.006 8.342 586 2HB ARG 72 HB1 ARG 72 -5.071 -24.507 9.074 587 1HG ARG 72 HG2 ARG 72 -3.796 -27.138 9.774 588 2HG ARG 72 HG1 ARG 72 -3.311 -26.231 8.344 589 1HD ARG 72 HD2 ARG 72 -3.224 -25.231 11.195 590 2HD ARG 72 HD1 ARG 72 -1.841 -25.768 10.243 591 HE ARG 72 HE ARG 72 -3.154 -23.726 8.840 592 1HH1 ARG 72 HH11 ARG 72 -1.211 -24.186 11.709 593 2HH1 ARG 72 HH12 ARG 72 -0.630 -22.548 11.732 594 1HH2 ARG 72 HH21 ARG 72 -2.356 -21.567 8.847 595 2HH2 ARG 72 HH22 ARG 72 -1.277 -21.072 10.112 596 H ASN 73 HN ASN 73 -6.859 -23.482 10.906 597 HA ASN 73 HA ASN 73 -5.060 -22.901 13.095 598 1HB ASN 73 HB2 ASN 73 -7.298 -21.290 11.831 599 2HB ASN 73 HB1 ASN 73 -6.309 -20.705 13.162 600 1HD2 ASN 73 HD21 ASN 73 -6.615 -19.578 10.531 601 2HD2 ASN 73 HD22 ASN 73 -5.041 -19.551 9.819 602 H GLU 74 HN GLU 74 -8.587 -23.132 12.657 603 HA GLU 74 HA GLU 74 -9.361 -22.569 15.253 604 1HB GLU 74 HB2 GLU 74 -10.976 -22.629 13.463 605 2HB GLU 74 HB1 GLU 74 -10.689 -24.343 13.195 606 1HG GLU 74 HG2 GLU 74 -11.720 -24.929 15.250 607 2HG GLU 74 HG1 GLU 74 -11.786 -23.248 15.774 608 H ILE 75 HN ILE 75 -8.769 -25.773 13.822 609 HA ILE 75 HA ILE 75 -9.299 -27.291 16.117 610 HB ILE 75 HB ILE 75 -7.393 -27.920 13.844 611 1HG1 ILE 75 HG12 ILE 75 -10.272 -28.774 14.256 612 2HG1 ILE 75 HG11 ILE 75 -9.778 -27.448 13.211 613 1HG2 ILE 75 HG21 ILE 75 -7.682 -30.275 14.499 614 2HG2 ILE 75 HG22 ILE 75 -8.636 -29.765 15.892 615 3HG2 ILE 75 HG23 ILE 75 -6.932 -29.327 15.782 616 1HD1 ILE 75 HD11 ILE 75 -9.030 -30.339 12.875 617 2HD1 ILE 75 HD12 ILE 75 -8.525 -29.012 11.827 618 3HD1 ILE 75 HD13 ILE 75 -10.230 -29.446 11.941 619 H PHE 76 HN PHE 76 -6.289 -25.883 14.903 620 HA PHE 76 HA PHE 76 -4.525 -26.839 16.845 621 1HB PHE 76 HB2 PHE 76 -3.770 -25.726 14.805 622 2HB PHE 76 HB1 PHE 76 -4.500 -24.214 15.329 623 HD1 PHE 76 HD1 PHE 76 -3.225 -22.663 16.513 624 HD2 PHE 76 HD2 PHE 76 -1.920 -26.713 16.306 625 HE1 PHE 76 HE1 PHE 76 -1.110 -22.034 17.596 626 HE2 PHE 76 HE2 PHE 76 0.197 -26.088 17.388 627 HZ PHE 76 HZ PHE 76 0.605 -23.749 18.034 628 H GLN 77 HN GLN 77 -6.747 -24.123 16.871 629 HA GLN 77 HA GLN 77 -5.890 -23.078 19.404 630 1HB GLN 77 HB2 GLN 77 -8.414 -22.611 17.800 631 2HB GLN 77 HB1 GLN 77 -7.967 -21.707 19.241 632 1HG GLN 77 HG2 GLN 77 -5.961 -20.880 18.106 633 2HG GLN 77 HG1 GLN 77 -6.402 -21.792 16.664 634 1HE2 GLN 77 HE21 GLN 77 -7.230 -19.092 18.707 635 2HE2 GLN 77 HE22 GLN 77 -8.243 -18.281 17.565 636 H LYS 78 HN LYS 78 -8.454 -25.234 18.286 637 HA LYS 78 HA LYS 78 -9.940 -25.486 20.639 638 1HB LYS 78 HB2 LYS 78 -9.341 -27.579 18.531 639 2HB LYS 78 HB1 LYS 78 -10.580 -27.735 19.765 640 1HG LYS 78 HG2 LYS 78 -10.547 -25.555 17.688 641 2HG LYS 78 HG1 LYS 78 -11.409 -27.081 17.508 642 1HD LYS 78 HD2 LYS 78 -12.657 -26.532 19.611 643 2HD LYS 78 HD1 LYS 78 -11.890 -24.942 19.585 644 1HE LYS 78 HE2 LYS 78 -14.138 -24.880 18.599 645 2HE LYS 78 HE1 LYS 78 -12.896 -24.475 17.412 646 1HZ LYS 78 HZ1 LYS 78 -13.019 -26.771 16.595 647 2HZ LYS 78 HZ2 LYS 78 -14.507 -25.980 16.463 648 3HZ LYS 78 HZ3 LYS 78 -14.257 -27.103 17.701 649 H ILE 79 HN ILE 79 -7.063 -27.166 19.519 650 HA ILE 79 HA ILE 79 -6.946 -29.127 21.540 651 HB ILE 79 HB ILE 79 -4.683 -28.000 19.868 652 1HG1 ILE 79 HG12 ILE 79 -6.412 -30.457 19.427 653 2HG1 ILE 79 HG11 ILE 79 -6.569 -28.942 18.546 654 1HG2 ILE 79 HG21 ILE 79 -4.851 -30.590 21.423 655 2HG2 ILE 79 HG22 ILE 79 -3.848 -29.197 21.827 656 3HG2 ILE 79 HG23 ILE 79 -3.529 -30.113 20.355 657 1HD1 ILE 79 HD11 ILE 79 -4.161 -30.747 18.523 658 2HD1 ILE 79 HD12 ILE 79 -4.335 -29.237 17.626 659 3HD1 ILE 79 HD13 ILE 79 -5.376 -30.610 17.251 660 H SER 80 HN SER 80 -5.849 -25.797 21.473 661 HA SER 80 HA SER 80 -4.196 -26.116 23.819 662 1HB SER 80 HB2 SER 80 -3.957 -23.645 23.680 663 2HB SER 80 HB1 SER 80 -3.538 -24.474 22.182 664 HG SER 80 HG SER 80 -6.174 -23.785 22.292 665 H GLN 81 HN GLN 81 -7.513 -25.658 23.244 666 HA GLN 81 HA GLN 81 -8.087 -24.057 25.573 667 1HB GLN 81 HB2 GLN 81 -9.911 -25.572 23.688 668 2HB GLN 81 HB1 GLN 81 -10.469 -24.510 24.976 669 1HG GLN 81 HG2 GLN 81 -9.393 -22.609 23.909 670 2HG GLN 81 HG1 GLN 81 -8.756 -23.658 22.645 671 1HE2 GLN 81 HE21 GLN 81 -11.211 -25.241 22.498 672 2HE2 GLN 81 HE22 GLN 81 -12.367 -24.256 21.675 673 H LEU 82 HN LEU 82 -7.103 -27.153 25.358 674 HA LEU 82 HA LEU 82 -9.036 -28.436 27.063 675 1HB LEU 82 HB2 LEU 82 -6.253 -29.497 26.668 676 2HB LEU 82 HB1 LEU 82 -7.755 -30.375 26.876 677 HG LEU 82 HG LEU 82 -6.957 -28.855 24.393 678 1HD1 LEU 82 HD11 LEU 82 -6.752 -31.064 23.357 679 2HD1 LEU 82 HD12 LEU 82 -7.057 -31.821 24.923 680 3HD1 LEU 82 HD13 LEU 82 -5.607 -30.843 24.682 681 1HD2 LEU 82 HD21 LEU 82 -8.916 -29.876 23.366 682 2HD2 LEU 82 HD22 LEU 82 -9.367 -28.849 24.724 683 3HD2 LEU 82 HD23 LEU 82 -9.358 -30.604 24.911 684 H ASP 83 HN ASP 83 -6.160 -26.569 27.490 685 HA ASP 83 HA ASP 83 -5.075 -25.749 29.311 686 1HB ASP 83 HB2 ASP 83 -7.201 -25.359 30.392 687 2HB ASP 83 HB1 ASP 83 -7.338 -27.052 30.845 688 H LYS 84 HN LYS 84 -6.003 -29.108 29.385 689 HA LYS 84 HA LYS 84 -4.022 -30.127 31.098 690 1HB LYS 84 HB2 LYS 84 -5.385 -31.455 28.738 691 2HB LYS 84 HB1 LYS 84 -4.591 -32.280 30.074 692 1HG LYS 84 HG2 LYS 84 -6.285 -31.723 31.587 693 2HG LYS 84 HG1 LYS 84 -6.907 -30.432 30.557 694 1HD LYS 84 HD2 LYS 84 -7.748 -32.051 28.964 695 2HD LYS 84 HD1 LYS 84 -7.028 -33.374 29.876 696 1HE LYS 84 HE2 LYS 84 -8.502 -32.935 31.751 697 2HE LYS 84 HE1 LYS 84 -9.160 -31.515 30.938 698 1HZ LYS 84 HZ1 LYS 84 -10.627 -33.430 30.755 699 2HZ LYS 84 HZ2 LYS 84 -9.416 -34.316 29.976 700 3HZ LYS 84 HZ3 LYS 84 -10.077 -32.945 29.232 701 H VAL 85 HN VAL 85 -3.904 -28.907 27.909 702 HA VAL 85 HA VAL 85 -1.558 -30.423 27.105 703 HB VAL 85 HB VAL 85 -3.349 -29.953 25.468 704 1HG1 VAL 85 HG11 VAL 85 -3.646 -27.694 24.568 705 2HG1 VAL 85 HG12 VAL 85 -2.528 -27.064 25.778 706 3HG1 VAL 85 HG13 VAL 85 -4.064 -27.772 26.280 707 1HG2 VAL 85 HG21 VAL 85 -1.076 -30.358 24.673 708 2HG2 VAL 85 HG22 VAL 85 -0.717 -28.633 24.783 709 3HG2 VAL 85 HG23 VAL 85 -1.916 -29.214 23.626 710 H VAL 86 HN VAL 86 0.490 -29.592 26.869 711 HA VAL 86 HA VAL 86 0.944 -26.898 27.986 712 HB VAL 86 HB VAL 86 3.240 -27.664 28.528 713 1HG1 VAL 86 HG11 VAL 86 1.042 -29.371 29.708 714 2HG1 VAL 86 HG12 VAL 86 1.487 -27.745 30.224 715 3HG1 VAL 86 HG13 VAL 86 2.624 -29.075 30.433 716 1HG2 VAL 86 HG21 VAL 86 3.776 -30.062 28.455 717 2HG2 VAL 86 HG22 VAL 86 3.468 -29.424 26.840 718 3HG2 VAL 86 HG23 VAL 86 2.235 -30.382 27.659 719 H GLN 87 HN GLN 87 1.438 -28.949 25.223 720 HA GLN 87 HA GLN 87 2.491 -26.669 23.756 721 1HB GLN 87 HB2 GLN 87 4.518 -27.816 24.585 722 2HB GLN 87 HB1 GLN 87 3.974 -29.312 23.838 723 1HG GLN 87 HG2 GLN 87 5.686 -28.204 22.494 724 2HG GLN 87 HG1 GLN 87 4.152 -28.306 21.628 725 1HE2 GLN 87 HE21 GLN 87 6.435 -26.198 23.180 726 2HE2 GLN 87 HE22 GLN 87 5.775 -24.713 22.590 727 H THR 88 HN THR 88 1.850 -26.626 21.681 728 HA THR 88 HA THR 88 0.549 -29.016 20.536 729 HB THR 88 HB THR 88 -1.127 -27.468 19.476 730 HG1 THR 88 HG1 THR 88 0.053 -25.606 21.292 731 1HG2 THR 88 HG21 THR 88 -1.725 -28.760 21.479 732 2HG2 THR 88 HG22 THR 88 -2.526 -27.188 21.468 733 3HG2 THR 88 HG23 THR 88 -1.121 -27.457 22.503 734 H LEU 89 HN LEU 89 1.343 -29.524 18.576 735 HA LEU 89 HA LEU 89 2.812 -27.443 17.092 736 1HB LEU 89 HB2 LEU 89 3.129 -30.446 17.012 737 2HB LEU 89 HB1 LEU 89 3.939 -29.346 15.919 738 HG LEU 89 HG LEU 89 5.521 -29.975 17.582 739 1HD1 LEU 89 HD11 LEU 89 4.498 -27.218 18.255 740 2HD1 LEU 89 HD12 LEU 89 5.597 -27.629 16.938 741 3HD1 LEU 89 HD13 LEU 89 6.107 -27.847 18.611 742 1HD2 LEU 89 HD21 LEU 89 5.165 -29.691 19.982 743 2HD2 LEU 89 HD22 LEU 89 3.982 -30.799 19.288 744 3HD2 LEU 89 HD23 LEU 89 3.515 -29.144 19.681 745 H GLY 90 HN GLY 90 1.492 -26.576 15.670 746 1HA GLY 90 HA2 GLY 90 0.437 -28.219 13.523 747 2HA GLY 90 HA1 GLY 90 -0.784 -27.375 14.474 748 H SER 91 HN SER 91 2.282 -25.907 14.186 749 HA SER 91 HA SER 91 1.623 -24.275 11.897 750 1HB SER 91 HB2 SER 91 2.071 -23.177 14.689 751 2HB SER 91 HB1 SER 91 2.047 -22.214 13.227 752 HG SER 91 HG SER 91 -0.142 -23.858 13.606 Start of MODEL 10 1 1H GLN 1 HT1 GLN 1 -5.172 -0.335 -7.695 2 2H GLN 1 HT2 GLN 1 -5.726 -0.508 -6.112 3 3H GLN 1 HT3 GLN 1 -6.298 -1.537 -7.324 4 HA GLN 1 HA GLN 1 -3.534 -1.415 -6.277 5 1HB GLN 1 HB2 GLN 1 -5.697 -3.531 -6.079 6 2HB GLN 1 HB1 GLN 1 -4.029 -3.768 -5.572 7 1HG GLN 1 HG2 GLN 1 -4.250 -2.102 -3.855 8 2HG GLN 1 HG1 GLN 1 -5.859 -1.663 -4.429 9 1HE2 GLN 1 HE21 GLN 1 -7.595 -3.011 -3.978 10 2HE2 GLN 1 HE22 GLN 1 -7.506 -4.277 -2.805 11 H GLY 2 HN GLY 2 -2.003 -2.143 -7.610 12 1HA GLY 2 HA2 GLY 2 -2.791 -3.094 -10.259 13 2HA GLY 2 HA1 GLY 2 -1.185 -2.574 -9.764 14 H HIS 3 HN HIS 3 -0.317 -4.450 -10.775 15 HA HIS 3 HA HIS 3 -0.973 -7.016 -9.501 16 1HB HIS 3 HB2 HIS 3 -1.007 -6.975 -11.965 17 2HB HIS 3 HB1 HIS 3 0.676 -6.456 -11.982 18 HD1 HIS 3 HD1 HIS 3 2.465 -8.259 -11.673 19 HD2 HIS 3 HD2 HIS 3 -1.412 -9.681 -11.173 20 HE1 HIS 3 HE1 HIS 3 2.668 -10.763 -11.573 21 HE2 HIS 3 HE2 HIS 3 0.295 -11.595 -11.486 22 H MET 4 HN MET 4 0.216 -7.486 -7.781 23 HA MET 4 HA MET 4 2.984 -6.557 -7.590 24 1HB MET 4 HB2 MET 4 2.858 -7.426 -5.256 25 2HB MET 4 HB1 MET 4 1.648 -6.201 -5.609 26 1HG MET 4 HG2 MET 4 -0.074 -7.857 -5.786 27 2HG MET 4 HG1 MET 4 1.100 -9.164 -5.669 28 1HE MET 4 HE1 MET 4 3.047 -8.272 -3.385 29 2HE MET 4 HE2 MET 4 2.329 -9.880 -3.495 30 3HE MET 4 HE3 MET 4 2.263 -8.985 -1.976 31 HA PRO 5 HA PRO 5 4.568 -10.530 -8.850 32 1HB PRO 5 HB2 PRO 5 7.084 -10.327 -7.806 33 2HB PRO 5 HB1 PRO 5 6.577 -9.479 -9.272 34 1HG PRO 5 HG2 PRO 5 6.777 -8.448 -6.464 35 2HG PRO 5 HG1 PRO 5 7.280 -7.672 -7.979 36 1HD PRO 5 HD2 PRO 5 4.963 -7.038 -6.733 37 2HD PRO 5 HD1 PRO 5 5.124 -7.006 -8.502 38 H SER 6 HN SER 6 4.945 -12.565 -7.971 39 HA SER 6 HA SER 6 4.017 -12.892 -5.259 40 1HB SER 6 HB2 SER 6 3.207 -14.372 -7.072 41 2HB SER 6 HB1 SER 6 4.844 -14.992 -7.287 42 HG SER 6 HG SER 6 3.311 -15.165 -4.895 43 H ASP 7 HN ASP 7 5.559 -12.335 -3.796 44 HA ASP 7 HA ASP 7 8.265 -13.311 -3.967 45 1HB ASP 7 HB2 ASP 7 7.751 -11.187 -2.805 46 2HB ASP 7 HB1 ASP 7 6.788 -12.066 -1.623 47 H SER 8 HN SER 8 8.224 -15.501 -4.074 48 HA SER 8 HA SER 8 6.394 -17.093 -2.564 49 1HB SER 8 HB2 SER 8 8.791 -17.973 -4.195 50 2HB SER 8 HB1 SER 8 7.435 -18.981 -3.690 51 HG SER 8 HG SER 8 6.196 -17.174 -4.896 52 H LYS 9 HN LYS 9 6.642 -17.919 -0.609 53 HA LYS 9 HA LYS 9 9.279 -18.686 0.363 54 1HB LYS 9 HB2 LYS 9 8.974 -17.581 2.529 55 2HB LYS 9 HB1 LYS 9 8.995 -16.402 1.225 56 1HG LYS 9 HG2 LYS 9 6.518 -16.318 1.314 57 2HG LYS 9 HG1 LYS 9 6.562 -17.416 2.696 58 1HD LYS 9 HD2 LYS 9 6.354 -15.171 3.527 59 2HD LYS 9 HD1 LYS 9 7.981 -15.746 3.897 60 1HE LYS 9 HE2 LYS 9 8.744 -14.577 1.791 61 2HE LYS 9 HE1 LYS 9 7.143 -13.846 1.707 62 1HZ LYS 9 HZ1 LYS 9 9.175 -13.499 3.839 63 2HZ LYS 9 HZ2 LYS 9 7.577 -12.966 3.988 64 3HZ LYS 9 HZ3 LYS 9 8.574 -12.321 2.786 65 H LYS 10 HN LYS 10 9.217 -20.450 1.696 66 HA LYS 10 HA LYS 10 8.452 -22.385 2.578 67 1HB LYS 10 HB2 LYS 10 5.920 -20.774 2.950 68 2HB LYS 10 HB1 LYS 10 6.061 -22.449 3.465 69 1HG LYS 10 HG2 LYS 10 7.722 -20.126 4.434 70 2HG LYS 10 HG1 LYS 10 6.463 -20.978 5.336 71 1HD LYS 10 HD2 LYS 10 7.779 -23.021 5.310 72 2HD LYS 10 HD1 LYS 10 9.004 -22.250 4.300 73 1HE LYS 10 HE2 LYS 10 9.831 -22.254 6.518 74 2HE LYS 10 HE1 LYS 10 9.358 -20.601 6.147 75 1HZ LYS 10 HZ1 LYS 10 7.762 -22.549 7.727 76 2HZ LYS 10 HZ2 LYS 10 7.297 -20.964 7.369 77 3HZ LYS 10 HZ3 LYS 10 8.638 -21.248 8.358 78 HA PRO 11 HA PRO 11 6.858 -24.486 -1.003 79 1HB PRO 11 HB2 PRO 11 6.218 -26.899 0.118 80 2HB PRO 11 HB1 PRO 11 7.874 -26.406 -0.248 81 1HG PRO 11 HG2 PRO 11 6.407 -26.314 2.367 82 2HG PRO 11 HG1 PRO 11 8.070 -26.840 2.036 83 1HD PRO 11 HD2 PRO 11 7.519 -24.397 3.046 84 2HD PRO 11 HD1 PRO 11 8.869 -24.664 1.922 85 H THR 12 HN THR 12 4.916 -24.485 -1.980 86 HA THR 12 HA THR 12 2.610 -23.598 -0.610 87 HB THR 12 HB THR 12 2.692 -24.835 -3.376 88 HG1 THR 12 HG1 THR 12 3.161 -22.742 -4.114 89 1HG2 THR 12 HG21 THR 12 0.844 -22.775 -2.139 90 2HG2 THR 12 HG22 THR 12 0.434 -24.458 -2.472 91 3HG2 THR 12 HG23 THR 12 0.776 -23.355 -3.805 92 H ILE 13 HN ILE 13 1.493 -24.812 0.737 93 HA ILE 13 HA ILE 13 1.531 -27.691 0.620 94 HB ILE 13 HB ILE 13 0.024 -25.834 2.481 95 1HG1 ILE 13 HG12 ILE 13 2.491 -25.541 2.546 96 2HG1 ILE 13 HG11 ILE 13 1.852 -26.190 4.057 97 1HG2 ILE 13 HG21 ILE 13 -0.966 -28.053 2.450 98 2HG2 ILE 13 HG22 ILE 13 -0.122 -27.787 3.975 99 3HG2 ILE 13 HG23 ILE 13 0.614 -28.790 2.724 100 1HD1 ILE 13 HD11 ILE 13 3.230 -27.762 1.886 101 2HD1 ILE 13 HD12 ILE 13 2.590 -28.428 3.389 102 3HD1 ILE 13 HD13 ILE 13 3.926 -27.280 3.431 103 H ILE 14 HN ILE 14 -0.077 -29.025 -0.018 104 HA ILE 14 HA ILE 14 -2.199 -27.861 -1.624 105 HB ILE 14 HB ILE 14 -1.456 -30.769 -1.200 106 1HG1 ILE 14 HG12 ILE 14 0.366 -29.513 -2.260 107 2HG1 ILE 14 HG11 ILE 14 -0.379 -30.610 -3.417 108 1HG2 ILE 14 HG21 ILE 14 -3.767 -30.534 -1.916 109 2HG2 ILE 14 HG22 ILE 14 -2.790 -31.187 -3.230 110 3HG2 ILE 14 HG23 ILE 14 -3.272 -29.491 -3.250 111 1HD1 ILE 14 HD11 ILE 14 -0.895 -27.649 -3.225 112 2HD1 ILE 14 HD12 ILE 14 -1.604 -28.753 -4.403 113 3HD1 ILE 14 HD13 ILE 14 0.133 -28.450 -4.414 114 H TYR 15 HN TYR 15 -3.874 -27.163 -0.440 115 HA TYR 15 HA TYR 15 -4.935 -28.822 1.726 116 1HB TYR 15 HB2 TYR 15 -5.529 -25.987 0.848 117 2HB TYR 15 HB1 TYR 15 -6.472 -26.821 2.079 118 HD1 TYR 15 HD1 TYR 15 -5.577 -27.198 4.289 119 HD2 TYR 15 HD2 TYR 15 -3.189 -25.335 1.297 120 HE1 TYR 15 HE1 TYR 15 -3.971 -26.502 6.011 121 HE2 TYR 15 HE2 TYR 15 -1.577 -24.637 3.015 122 HH TYR 15 HH TYR 15 -1.571 -25.888 6.148 123 HA PRO 16 HA PRO 16 -6.653 -29.279 2.739 124 1HB PRO 16 HB2 PRO 16 -8.326 -31.326 3.144 125 2HB PRO 16 HB1 PRO 16 -8.913 -29.679 2.891 126 1HG PRO 16 HG2 PRO 16 -8.838 -31.979 0.984 127 2HG PRO 16 HG1 PRO 16 -10.076 -30.726 1.182 128 1HD PRO 16 HD2 PRO 16 -8.072 -30.745 -0.769 129 2HD PRO 16 HD1 PRO 16 -9.031 -29.334 -0.288 130 H CYS 17 HN CYS 17 -5.764 -30.918 4.072 131 HA CYS 17 HA CYS 17 -4.863 -33.426 3.013 132 1HB CYS 17 HB2 CYS 17 -2.433 -32.945 3.212 133 2HB CYS 17 HB1 CYS 17 -3.196 -31.992 1.944 134 HG CYS 17 HG CYS 17 -3.367 -30.172 4.606 135 H LEU 18 HN LEU 18 -3.721 -34.690 4.616 136 HA LEU 18 HA LEU 18 -4.722 -34.270 7.259 137 1HB LEU 18 HB2 LEU 18 -2.782 -36.301 6.138 138 2HB LEU 18 HB1 LEU 18 -3.397 -36.338 7.780 139 HG LEU 18 HG LEU 18 -5.183 -36.480 5.350 140 1HD1 LEU 18 HD11 LEU 18 -4.087 -38.756 7.007 141 2HD1 LEU 18 HD12 LEU 18 -3.667 -38.397 5.331 142 3HD1 LEU 18 HD13 LEU 18 -5.308 -38.893 5.740 143 1HD2 LEU 18 HD21 LEU 18 -6.271 -35.734 7.407 144 2HD2 LEU 18 HD22 LEU 18 -5.666 -37.160 8.252 145 3HD2 LEU 18 HD23 LEU 18 -6.828 -37.339 6.937 146 H TRP 19 HN TRP 19 -3.868 -32.760 8.523 147 HA TRP 19 HA TRP 19 -0.993 -32.238 8.505 148 1HB TRP 19 HB2 TRP 19 -2.779 -30.390 8.587 149 2HB TRP 19 HB1 TRP 19 -3.072 -30.888 10.249 150 HD1 TRP 19 HD1 TRP 19 -0.989 -30.517 12.004 151 HE1 TRP 19 HE1 TRP 19 0.907 -28.773 11.987 152 HE3 TRP 19 HE3 TRP 19 -1.293 -29.029 7.120 153 HZ2 TRP 19 HZ2 TRP 19 2.107 -27.002 10.152 154 HZ3 TRP 19 HZ3 TRP 19 0.267 -27.303 6.315 155 HH2 TRP 19 HH2 TRP 19 1.929 -26.312 7.800 156 H ASP 20 HN ASP 20 0.357 -32.857 10.140 157 HA ASP 20 HA ASP 20 -0.749 -34.800 12.034 158 1HB ASP 20 HB2 ASP 20 1.162 -35.419 10.518 159 2HB ASP 20 HB1 ASP 20 2.157 -34.241 11.367 160 H TYR 21 HN TYR 21 -1.144 -34.188 14.028 161 HA TYR 21 HA TYR 21 0.333 -31.937 15.228 162 1HB TYR 21 HB2 TYR 21 -2.398 -33.073 15.915 163 2HB TYR 21 HB1 TYR 21 -1.603 -31.771 16.793 164 HD1 TYR 21 HD1 TYR 21 -1.346 -29.543 15.754 165 HD2 TYR 21 HD2 TYR 21 -3.475 -32.670 13.790 166 HE1 TYR 21 HE1 TYR 21 -2.365 -27.895 14.240 167 HE2 TYR 21 HE2 TYR 21 -4.495 -31.026 12.273 168 HH TYR 21 HH TYR 21 -5.010 -28.589 12.270 169 H ARG 22 HN ARG 22 1.198 -32.169 17.284 170 HA ARG 22 HA ARG 22 1.343 -34.941 18.295 171 1HB ARG 22 HB2 ARG 22 3.467 -33.900 17.310 172 2HB ARG 22 HB1 ARG 22 3.460 -32.817 18.695 173 1HG ARG 22 HG2 ARG 22 4.972 -34.706 19.028 174 2HG ARG 22 HG1 ARG 22 3.660 -34.711 20.208 175 1HD ARG 22 HD2 ARG 22 4.256 -36.952 19.165 176 2HD ARG 22 HD1 ARG 22 2.555 -36.496 19.127 177 HE ARG 22 HE ARG 22 2.669 -36.243 16.821 178 1HH1 ARG 22 HH11 ARG 22 5.836 -37.001 18.114 179 2HH1 ARG 22 HH12 ARG 22 6.517 -37.365 16.561 180 1HH2 ARG 22 HH21 ARG 22 3.544 -36.728 14.787 181 2HH2 ARG 22 HH22 ARG 22 5.213 -37.207 14.662 182 H VAL 23 HN VAL 23 0.265 -35.171 20.131 183 HA VAL 23 HA VAL 23 -0.216 -32.789 21.808 184 HB VAL 23 HB VAL 23 -1.913 -35.293 21.649 185 1HG1 VAL 23 HG11 VAL 23 -2.460 -32.577 22.855 186 2HG1 VAL 23 HG12 VAL 23 -2.160 -34.074 23.738 187 3HG1 VAL 23 HG13 VAL 23 -3.616 -33.904 22.756 188 1HG2 VAL 23 HG21 VAL 23 -3.487 -33.966 20.289 189 2HG2 VAL 23 HG22 VAL 23 -1.937 -34.198 19.478 190 3HG2 VAL 23 HG23 VAL 23 -2.312 -32.650 20.235 191 H ILE 24 HN ILE 24 1.284 -32.887 23.426 192 HA ILE 24 HA ILE 24 1.821 -35.447 24.736 193 HB ILE 24 HB ILE 24 3.073 -32.725 25.189 194 1HG1 ILE 24 HG12 ILE 24 4.148 -35.203 23.801 195 2HG1 ILE 24 HG11 ILE 24 3.622 -33.729 22.996 196 1HG2 ILE 24 HG21 ILE 24 3.128 -34.051 27.234 197 2HG2 ILE 24 HG22 ILE 24 4.745 -33.926 26.544 198 3HG2 ILE 24 HG23 ILE 24 3.820 -35.415 26.356 199 1HD1 ILE 24 HD11 ILE 24 5.952 -33.985 24.886 200 2HD1 ILE 24 HD12 ILE 24 5.417 -32.494 24.109 201 3HD1 ILE 24 HD13 ILE 24 6.029 -33.827 23.131 202 H MET 25 HN MET 25 0.313 -36.022 26.130 203 HA MET 25 HA MET 25 -0.907 -34.005 27.908 204 1HB MET 25 HB2 MET 25 -1.905 -36.751 27.078 205 2HB MET 25 HB1 MET 25 -2.733 -35.676 28.197 206 1HG MET 25 HG2 MET 25 -3.125 -34.069 26.464 207 2HG MET 25 HG1 MET 25 -2.117 -34.973 25.335 208 1HE MET 25 HE1 MET 25 -4.679 -36.537 27.887 209 2HE MET 25 HE2 MET 25 -6.149 -36.587 26.920 210 3HE MET 25 HE3 MET 25 -5.475 -35.034 27.419 211 H THR 26 HN THR 26 -1.171 -34.516 30.132 212 HA THR 26 HA THR 26 0.842 -36.351 31.193 213 HB THR 26 HB THR 26 0.032 -35.291 33.420 214 HG1 THR 26 HG1 THR 26 -1.221 -33.528 33.284 215 1HG2 THR 26 HG21 THR 26 1.442 -33.299 33.067 216 2HG2 THR 26 HG22 THR 26 1.410 -33.594 31.328 217 3HG2 THR 26 HG23 THR 26 2.185 -34.756 32.406 218 H THR 27 HN THR 27 -1.809 -37.145 29.956 219 HA THR 27 HA THR 27 -2.476 -39.164 31.910 220 HB THR 27 HB THR 27 -3.970 -37.256 32.550 221 HG1 THR 27 HG1 THR 27 -5.638 -38.602 32.861 222 1HG2 THR 27 HG21 THR 27 -5.159 -37.664 29.801 223 2HG2 THR 27 HG22 THR 27 -4.247 -36.248 30.330 224 3HG2 THR 27 HG23 THR 27 -5.805 -36.621 31.069 225 H LYS 28 HN LYS 28 -3.363 -40.990 30.954 226 HA LYS 28 HA LYS 28 -3.545 -41.011 28.044 227 1HB LYS 28 HB2 LYS 28 -3.721 -43.204 30.119 228 2HB LYS 28 HB1 LYS 28 -3.992 -43.486 28.403 229 1HG LYS 28 HG2 LYS 28 -1.725 -42.748 27.903 230 2HG LYS 28 HG1 LYS 28 -1.447 -42.403 29.609 231 1HD LYS 28 HD2 LYS 28 -2.242 -45.154 28.678 232 2HD LYS 28 HD1 LYS 28 -0.560 -44.627 28.648 233 1HE LYS 28 HE2 LYS 28 -1.052 -45.876 30.688 234 2HE LYS 28 HE1 LYS 28 -0.636 -44.204 31.054 235 1HZ LYS 28 HZ1 LYS 28 -3.415 -45.240 30.906 236 2HZ LYS 28 HZ2 LYS 28 -2.936 -43.701 31.416 237 3HZ LYS 28 HZ3 LYS 28 -2.538 -45.058 32.338 238 H ASP 29 HN ASP 29 -5.523 -40.200 30.524 239 HA ASP 29 HA ASP 29 -8.001 -41.286 29.550 240 1HB ASP 29 HB2 ASP 29 -7.781 -40.691 31.918 241 2HB ASP 29 HB1 ASP 29 -7.447 -39.016 31.494 242 H THR 30 HN THR 30 -7.502 -40.656 27.310 243 HA THR 30 HA THR 30 -7.733 -37.838 26.665 244 HB THR 30 HB THR 30 -6.136 -39.110 25.359 245 HG1 THR 30 HG1 THR 30 -6.747 -38.315 23.416 246 1HG2 THR 30 HG21 THR 30 -7.155 -41.334 25.502 247 2HG2 THR 30 HG22 THR 30 -6.818 -40.900 23.826 248 3HG2 THR 30 HG23 THR 30 -8.467 -40.809 24.446 249 H SER 31 HN SER 31 -9.571 -36.862 26.176 250 HA SER 31 HA SER 31 -11.878 -38.367 25.211 251 1HB SER 31 HB2 SER 31 -13.300 -37.218 26.987 252 2HB SER 31 HB1 SER 31 -12.219 -38.478 27.587 253 HG SER 31 HG SER 31 -12.222 -36.463 28.805 254 H THR 32 HN THR 32 -11.352 -35.150 26.616 255 HA THR 32 HA THR 32 -12.905 -33.659 24.913 256 HB THR 32 HB THR 32 -10.300 -32.543 25.927 257 HG1 THR 32 HG1 THR 32 -12.541 -32.963 27.627 258 1HG2 THR 32 HG21 THR 32 -13.137 -31.485 25.912 259 2HG2 THR 32 HG22 THR 32 -11.857 -31.025 24.790 260 3HG2 THR 32 HG23 THR 32 -11.721 -30.615 26.498 261 H LEU 33 HN LEU 33 -9.651 -34.844 24.441 262 HA LEU 33 HA LEU 33 -8.788 -33.269 22.314 263 1HB LEU 33 HB2 LEU 33 -7.328 -34.785 23.571 264 2HB LEU 33 HB1 LEU 33 -8.180 -36.171 22.917 265 HG LEU 33 HG LEU 33 -7.370 -35.599 20.652 266 1HD1 LEU 33 HD11 LEU 33 -7.152 -33.186 20.919 267 2HD1 LEU 33 HD12 LEU 33 -5.640 -33.897 20.360 268 3HD1 LEU 33 HD13 LEU 33 -5.816 -33.418 22.049 269 1HD2 LEU 33 HD21 LEU 33 -5.176 -35.831 22.720 270 2HD2 LEU 33 HD22 LEU 33 -5.030 -36.220 21.005 271 3HD2 LEU 33 HD23 LEU 33 -6.103 -37.167 22.034 272 H LYS 34 HN LYS 34 -10.633 -36.307 22.291 273 HA LYS 34 HA LYS 34 -10.722 -36.444 19.427 274 1HB LYS 34 HB2 LYS 34 -12.277 -37.944 21.548 275 2HB LYS 34 HB1 LYS 34 -12.364 -38.291 19.825 276 1HG LYS 34 HG2 LYS 34 -9.958 -38.816 19.824 277 2HG LYS 34 HG1 LYS 34 -9.903 -38.510 21.562 278 1HD LYS 34 HD2 LYS 34 -11.628 -40.608 20.230 279 2HD LYS 34 HD1 LYS 34 -10.071 -40.924 20.995 280 1HE LYS 34 HE2 LYS 34 -10.948 -40.179 23.141 281 2HE LYS 34 HE1 LYS 34 -12.495 -39.780 22.391 282 1HZ LYS 34 HZ1 LYS 34 -12.567 -41.916 23.516 283 2HZ LYS 34 HZ2 LYS 34 -11.309 -42.498 22.552 284 3HZ LYS 34 HZ3 LYS 34 -12.799 -42.108 21.854 285 H GLU 35 HN GLU 35 -12.903 -35.369 21.979 286 HA GLU 35 HA GLU 35 -15.242 -35.114 20.477 287 1HB GLU 35 HB2 GLU 35 -14.363 -33.422 22.831 288 2HB GLU 35 HB1 GLU 35 -16.010 -33.567 22.230 289 1HG GLU 35 HG2 GLU 35 -14.343 -35.746 23.480 290 2HG GLU 35 HG1 GLU 35 -15.735 -34.932 24.194 291 H LEU 36 HN LEU 36 -12.624 -32.765 21.025 292 HA LEU 36 HA LEU 36 -13.904 -30.617 19.703 293 1HB LEU 36 HB2 LEU 36 -11.807 -29.469 19.791 294 2HB LEU 36 HB1 LEU 36 -12.011 -30.359 21.285 295 HG LEU 36 HG LEU 36 -10.536 -32.167 20.007 296 1HD1 LEU 36 HD11 LEU 36 -8.799 -31.100 18.642 297 2HD1 LEU 36 HD12 LEU 36 -9.692 -29.580 18.707 298 3HD1 LEU 36 HD13 LEU 36 -10.392 -30.980 17.898 299 1HD2 LEU 36 HD21 LEU 36 -9.960 -31.137 22.132 300 2HD2 LEU 36 HD22 LEU 36 -9.407 -29.685 21.295 301 3HD2 LEU 36 HD23 LEU 36 -8.553 -31.213 21.071 302 H LEU 37 HN LEU 37 -11.967 -33.291 18.573 303 HA LEU 37 HA LEU 37 -11.484 -32.279 15.943 304 1HB LEU 37 HB2 LEU 37 -11.519 -35.142 16.935 305 2HB LEU 37 HB1 LEU 37 -10.825 -34.589 15.421 306 HG LEU 37 HG LEU 37 -9.833 -33.721 18.145 307 1HD1 LEU 37 HD11 LEU 37 -7.955 -35.240 17.779 308 2HD1 LEU 37 HD12 LEU 37 -8.709 -35.824 16.294 309 3HD1 LEU 37 HD13 LEU 37 -9.484 -36.119 17.851 310 1HD2 LEU 37 HD21 LEU 37 -8.614 -33.431 15.399 311 2HD2 LEU 37 HD22 LEU 37 -7.889 -32.912 16.919 312 3HD2 LEU 37 HD23 LEU 37 -9.361 -32.138 16.337 313 H GLU 38 HN GLU 38 -13.917 -34.328 17.426 314 HA GLU 38 HA GLU 38 -15.267 -35.174 15.126 315 1HB GLU 38 HB2 GLU 38 -16.162 -34.807 17.984 316 2HB GLU 38 HB1 GLU 38 -17.219 -35.474 16.748 317 1HG GLU 38 HG2 GLU 38 -14.535 -36.634 17.473 318 2HG GLU 38 HG1 GLU 38 -16.064 -37.169 18.166 319 H THR 39 HN THR 39 -15.384 -32.133 16.825 320 HA THR 39 HA THR 39 -17.908 -31.227 15.995 321 HB THR 39 HB THR 39 -17.164 -28.977 16.506 322 HG1 THR 39 HG1 THR 39 -14.574 -30.130 16.316 323 1HG2 THR 39 HG21 THR 39 -17.603 -30.443 18.422 324 2HG2 THR 39 HG22 THR 39 -16.319 -29.292 18.792 325 3HG2 THR 39 HG23 THR 39 -15.917 -30.967 18.415 326 H TYR 40 HN TYR 40 -14.921 -31.517 14.265 327 HA TYR 40 HA TYR 40 -15.696 -29.698 12.141 328 1HB TYR 40 HB2 TYR 40 -13.346 -31.611 12.323 329 2HB TYR 40 HB1 TYR 40 -13.578 -30.390 11.074 330 HD1 TYR 40 HD1 TYR 40 -13.334 -27.989 11.615 331 HD2 TYR 40 HD2 TYR 40 -12.587 -30.999 14.530 332 HE1 TYR 40 HE1 TYR 40 -12.191 -26.333 13.032 333 HE2 TYR 40 HE2 TYR 40 -11.446 -29.351 15.952 334 HH TYR 40 HH TYR 40 -11.423 -25.929 15.111 335 H GLN 41 HN GLN 41 -16.434 -32.820 13.009 336 HA GLN 41 HA GLN 41 -17.530 -34.536 12.029 337 1HB GLN 41 HB2 GLN 41 -18.262 -32.377 10.037 338 2HB GLN 41 HB1 GLN 41 -19.040 -33.953 10.135 339 1HG GLN 41 HG2 GLN 41 -19.007 -31.864 12.312 340 2HG GLN 41 HG1 GLN 41 -20.360 -32.223 11.240 341 1HE2 GLN 41 HE21 GLN 41 -20.131 -32.375 14.178 342 2HE2 GLN 41 HE22 GLN 41 -20.548 -34.000 14.601 343 H ARG 42 HN ARG 42 -14.741 -34.012 11.272 344 HA ARG 42 HA ARG 42 -14.687 -35.476 8.711 345 1HB ARG 42 HB2 ARG 42 -12.564 -34.461 8.200 346 2HB ARG 42 HB1 ARG 42 -13.693 -33.174 8.602 347 1HG ARG 42 HG2 ARG 42 -12.707 -32.858 10.746 348 2HG ARG 42 HG1 ARG 42 -11.738 -34.324 10.586 349 1HD ARG 42 HD2 ARG 42 -10.280 -32.498 10.181 350 2HD ARG 42 HD1 ARG 42 -10.608 -33.237 8.617 351 HE ARG 42 HE ARG 42 -11.575 -30.642 9.573 352 1HH1 ARG 42 HH11 ARG 42 -11.478 -33.022 6.980 353 2HH1 ARG 42 HH12 ARG 42 -11.875 -31.859 5.753 354 1HH2 ARG 42 HH21 ARG 42 -12.042 -29.120 7.922 355 2HH2 ARG 42 HH22 ARG 42 -12.191 -29.671 6.280 356 HA PRO 43 HA PRO 43 -12.640 -38.732 10.934 357 1HB PRO 43 HB2 PRO 43 -11.118 -39.860 8.991 358 2HB PRO 43 HB1 PRO 43 -12.881 -40.004 9.018 359 1HG PRO 43 HG2 PRO 43 -11.160 -38.129 7.427 360 2HG PRO 43 HG1 PRO 43 -12.568 -39.075 6.901 361 1HD PRO 43 HD2 PRO 43 -12.727 -36.436 7.529 362 2HD PRO 43 HD1 PRO 43 -14.072 -37.565 7.791 363 H PHE 44 HN PHE 44 -10.654 -39.327 11.888 364 HA PHE 44 HA PHE 44 -8.235 -37.898 11.133 365 1HB PHE 44 HB2 PHE 44 -7.779 -37.083 13.396 366 2HB PHE 44 HB1 PHE 44 -9.268 -36.387 12.772 367 HD1 PHE 44 HD1 PHE 44 -7.819 -38.695 15.236 368 HD2 PHE 44 HD2 PHE 44 -11.407 -36.920 13.768 369 HE1 PHE 44 HE1 PHE 44 -9.006 -39.420 17.265 370 HE2 PHE 44 HE2 PHE 44 -12.595 -37.646 15.795 371 HZ PHE 44 HZ PHE 44 -11.397 -38.896 17.547 372 H LYS 45 HN LYS 45 -6.328 -38.776 12.079 373 HA LYS 45 HA LYS 45 -6.600 -41.598 12.828 374 1HB LYS 45 HB2 LYS 45 -5.231 -41.172 10.854 375 2HB LYS 45 HB1 LYS 45 -4.250 -40.016 11.739 376 1HG LYS 45 HG2 LYS 45 -4.379 -42.833 12.718 377 2HG LYS 45 HG1 LYS 45 -3.417 -42.473 11.288 378 1HD LYS 45 HD2 LYS 45 -2.868 -40.543 13.378 379 2HD LYS 45 HD1 LYS 45 -2.655 -42.183 13.987 380 1HE LYS 45 HE2 LYS 45 -0.563 -41.299 13.083 381 2HE LYS 45 HE1 LYS 45 -1.125 -42.681 12.143 382 1HZ LYS 45 HZ1 LYS 45 -1.499 -39.834 11.375 383 2HZ LYS 45 HZ2 LYS 45 -1.958 -41.181 10.461 384 3HZ LYS 45 HZ3 LYS 45 -0.322 -40.866 10.742 385 H LEU 46 HN LEU 46 -6.449 -42.057 14.915 386 HA LEU 46 HA LEU 46 -4.912 -40.266 16.689 387 1HB LEU 46 HB2 LEU 46 -7.300 -40.444 17.222 388 2HB LEU 46 HB1 LEU 46 -7.161 -42.189 17.320 389 HG LEU 46 HG LEU 46 -5.601 -41.900 19.262 390 1HD1 LEU 46 HD11 LEU 46 -5.530 -39.734 20.399 391 2HD1 LEU 46 HD12 LEU 46 -6.439 -39.003 19.076 392 3HD1 LEU 46 HD13 LEU 46 -4.819 -39.641 18.788 393 1HD2 LEU 46 HD21 LEU 46 -7.350 -41.349 20.876 394 2HD2 LEU 46 HD22 LEU 46 -7.967 -42.400 19.603 395 3HD2 LEU 46 HD23 LEU 46 -8.345 -40.676 19.583 396 H GLU 47 HN GLU 47 -3.018 -41.036 17.365 397 HA GLU 47 HA GLU 47 -2.707 -43.910 17.871 398 1HB GLU 47 HB2 GLU 47 -1.117 -42.241 15.957 399 2HB GLU 47 HB1 GLU 47 -0.278 -43.487 16.869 400 1HG GLU 47 HG2 GLU 47 -2.691 -43.970 15.128 401 2HG GLU 47 HG1 GLU 47 -1.017 -44.221 14.630 402 H PHE 48 HN PHE 48 -1.022 -44.440 19.334 403 HA PHE 48 HA PHE 48 -0.139 -42.204 21.035 404 1HB PHE 48 HB2 PHE 48 -1.356 -43.948 22.232 405 2HB PHE 48 HB1 PHE 48 -0.292 -45.187 21.576 406 HD1 PHE 48 HD1 PHE 48 1.552 -45.881 22.816 407 HD2 PHE 48 HD2 PHE 48 -0.219 -42.102 23.676 408 HE1 PHE 48 HE1 PHE 48 3.026 -45.635 24.769 409 HE2 PHE 48 HE2 PHE 48 1.254 -41.854 25.629 410 HZ PHE 48 HZ PHE 48 2.879 -43.621 26.178 411 H LYS 49 HN LYS 49 1.953 -41.627 21.044 412 HA LYS 49 HA LYS 49 3.816 -43.020 19.323 413 1HB LYS 49 HB2 LYS 49 3.967 -40.474 20.938 414 2HB LYS 49 HB1 LYS 49 5.389 -41.145 20.153 415 1HG LYS 49 HG2 LYS 49 2.842 -40.388 18.722 416 2HG LYS 49 HG1 LYS 49 4.276 -39.363 18.844 417 1HD LYS 49 HD2 LYS 49 5.598 -41.134 17.722 418 2HD LYS 49 HD1 LYS 49 4.129 -42.095 17.548 419 1HE LYS 49 HE2 LYS 49 3.140 -40.360 16.151 420 2HE LYS 49 HE1 LYS 49 4.569 -39.349 16.364 421 1HZ LYS 49 HZ1 LYS 49 5.883 -41.048 15.253 422 2HZ LYS 49 HZ2 LYS 49 4.628 -40.508 14.257 423 3HZ LYS 49 HZ3 LYS 49 4.503 -42.006 15.035 424 H ASN 50 HN ASN 50 4.381 -41.728 22.584 425 HA ASN 50 HA ASN 50 5.106 -44.179 23.786 426 1HB ASN 50 HB2 ASN 50 6.989 -44.047 22.177 427 2HB ASN 50 HB1 ASN 50 7.424 -42.468 22.819 428 1HD2 ASN 50 HD21 ASN 50 7.353 -45.897 23.436 429 2HD2 ASN 50 HD22 ASN 50 8.453 -45.875 24.770 430 H THR 51 HN THR 51 5.786 -43.877 25.981 431 HA THR 51 HA THR 51 5.079 -41.237 27.018 432 HB THR 51 HB THR 51 4.038 -43.286 28.010 433 HG1 THR 51 HG1 THR 51 4.422 -41.247 29.188 434 1HG2 THR 51 HG21 THR 51 5.343 -44.677 29.541 435 2HG2 THR 51 HG22 THR 51 6.810 -43.801 29.107 436 3HG2 THR 51 HG23 THR 51 5.985 -44.789 27.902 437 H SER 52 HN SER 52 6.487 -39.911 28.085 438 HA SER 52 HA SER 52 9.222 -40.106 27.436 439 1HB SER 52 HB2 SER 52 7.932 -38.311 29.512 440 2HB SER 52 HB1 SER 52 9.483 -38.050 28.711 441 HG SER 52 HG SER 52 8.004 -38.237 26.711 442 H LYS 53 HN LYS 53 9.929 -42.079 28.243 443 HA LYS 53 HA LYS 53 10.672 -43.634 29.727 444 1HB LYS 53 HB2 LYS 53 12.630 -42.806 30.996 445 2HB LYS 53 HB1 LYS 53 12.611 -42.314 29.313 446 1HG LYS 53 HG2 LYS 53 11.914 -40.076 29.937 447 2HG LYS 53 HG1 LYS 53 11.803 -40.558 31.630 448 1HD LYS 53 HD2 LYS 53 13.875 -39.387 31.316 449 2HD LYS 53 HD1 LYS 53 14.243 -41.092 31.575 450 1HE LYS 53 HE2 LYS 53 15.632 -40.266 29.795 451 2HE LYS 53 HE1 LYS 53 14.440 -41.367 29.107 452 1HZ LYS 53 HZ1 LYS 53 14.296 -38.398 29.067 453 2HZ LYS 53 HZ2 LYS 53 13.126 -39.441 28.426 454 3HZ LYS 53 HZ3 LYS 53 14.680 -39.395 27.755 455 H ASN 54 HN ASN 54 10.377 -40.843 31.957 456 HA ASN 54 HA ASN 54 9.952 -42.481 34.231 457 1HB ASN 54 HB2 ASN 54 10.916 -40.177 34.288 458 2HB ASN 54 HB1 ASN 54 9.333 -39.531 33.873 459 1HD2 ASN 54 HD21 ASN 54 9.209 -38.329 35.763 460 2HD2 ASN 54 HD22 ASN 54 8.948 -39.058 37.308 461 H ALA 55 HN ALA 55 7.917 -41.607 31.716 462 HA ALA 55 HA ALA 55 5.765 -42.146 31.248 463 1HB ALA 55 HB1 ALA 55 5.625 -43.294 34.035 464 2HB ALA 55 HB2 ALA 55 6.110 -44.174 32.587 465 3HB ALA 55 HB3 ALA 55 4.464 -43.561 32.734 466 H LYS 56 HN LYS 56 6.721 -39.729 32.927 467 HA LYS 56 HA LYS 56 4.354 -38.832 34.284 468 1HB LYS 56 HB2 LYS 56 6.580 -38.068 34.981 469 2HB LYS 56 HB1 LYS 56 6.838 -37.328 33.408 470 1HG LYS 56 HG2 LYS 56 6.280 -35.646 35.058 471 2HG LYS 56 HG1 LYS 56 5.004 -35.758 33.844 472 1HD LYS 56 HD2 LYS 56 3.685 -37.163 35.402 473 2HD LYS 56 HD1 LYS 56 4.951 -36.970 36.617 474 1HE LYS 56 HE2 LYS 56 3.317 -34.737 35.396 475 2HE LYS 56 HE1 LYS 56 3.081 -35.427 37.001 476 1HZ LYS 56 HZ1 LYS 56 4.334 -33.367 37.090 477 2HZ LYS 56 HZ2 LYS 56 5.524 -34.014 36.078 478 3HZ LYS 56 HZ3 LYS 56 5.284 -34.662 37.617 479 H PHE 57 HN PHE 57 5.633 -38.613 31.062 480 HA PHE 57 HA PHE 57 3.335 -36.946 30.260 481 1HB PHE 57 HB2 PHE 57 6.115 -36.895 29.043 482 2HB PHE 57 HB1 PHE 57 4.735 -35.949 28.496 483 HD1 PHE 57 HD1 PHE 57 7.573 -36.027 30.638 484 HD2 PHE 57 HD2 PHE 57 3.701 -34.308 30.191 485 HE1 PHE 57 HE1 PHE 57 8.195 -34.226 32.190 486 HE2 PHE 57 HE2 PHE 57 4.320 -32.504 31.744 487 HZ PHE 57 HZ PHE 57 6.570 -32.462 32.748 488 H TYR 58 HN TYR 58 2.175 -37.654 28.551 489 HA TYR 58 HA TYR 58 3.083 -40.108 27.184 490 1HB TYR 58 HB2 TYR 58 0.209 -39.256 27.660 491 2HB TYR 58 HB1 TYR 58 0.770 -40.799 27.021 492 HD1 TYR 58 HD1 TYR 58 1.915 -42.423 28.545 493 HD2 TYR 58 HD2 TYR 58 0.125 -38.846 30.011 494 HE1 TYR 58 HE1 TYR 58 1.951 -43.340 30.828 495 HE2 TYR 58 HE2 TYR 58 0.158 -39.756 32.290 496 HH TYR 58 HH TYR 58 1.960 -42.437 33.177 497 H SER 59 HN SER 59 3.590 -39.727 25.119 498 HA SER 59 HA SER 59 2.620 -37.308 23.822 499 1HB SER 59 HB2 SER 59 5.045 -37.950 23.768 500 2HB SER 59 HB1 SER 59 4.611 -39.349 22.790 501 HG SER 59 HG SER 59 5.135 -36.917 21.957 502 H PHE 60 HN PHE 60 0.775 -37.399 22.759 503 HA PHE 60 HA PHE 60 0.005 -39.855 21.333 504 1HB PHE 60 HB2 PHE 60 -1.639 -37.445 22.169 505 2HB PHE 60 HB1 PHE 60 -2.256 -38.776 21.197 506 HD1 PHE 60 HD1 PHE 60 -1.536 -37.603 24.524 507 HD2 PHE 60 HD2 PHE 60 -2.349 -41.078 22.194 508 HE1 PHE 60 HE1 PHE 60 -2.134 -38.833 26.568 509 HE2 PHE 60 HE2 PHE 60 -2.946 -42.310 24.237 510 HZ PHE 60 HZ PHE 60 -2.839 -41.190 26.425 511 H ASN 61 HN ASN 61 -0.984 -39.552 19.200 512 HA ASN 61 HA ASN 61 0.071 -37.220 17.747 513 1HB ASN 61 HB2 ASN 61 1.569 -39.207 17.457 514 2HB ASN 61 HB1 ASN 61 0.208 -40.088 16.769 515 1HD2 ASN 61 HD21 ASN 61 -0.602 -39.440 14.736 516 2HD2 ASN 61 HD22 ASN 61 0.347 -38.482 13.655 517 H VAL 62 HN VAL 62 -1.496 -36.239 16.646 518 HA VAL 62 HA VAL 62 -3.845 -37.818 15.790 519 HB VAL 62 HB VAL 62 -3.789 -34.929 16.708 520 1HG1 VAL 62 HG11 VAL 62 -6.106 -36.613 15.742 521 2HG1 VAL 62 HG12 VAL 62 -5.394 -35.230 14.909 522 3HG1 VAL 62 HG13 VAL 62 -6.236 -34.999 16.441 523 1HG2 VAL 62 HG21 VAL 62 -3.616 -36.488 18.578 524 2HG2 VAL 62 HG22 VAL 62 -5.034 -37.365 18.000 525 3HG2 VAL 62 HG23 VAL 62 -5.194 -35.703 18.569 526 H SER 63 HN SER 63 -3.937 -37.950 13.648 527 HA SER 63 HA SER 63 -2.872 -35.728 12.020 528 1HB SER 63 HB2 SER 63 -3.372 -38.571 11.095 529 2HB SER 63 HB1 SER 63 -2.439 -37.320 10.276 530 HG SER 63 HG SER 63 -0.959 -37.418 12.075 531 H MET 64 HN MET 64 -4.547 -34.424 11.452 532 HA MET 64 HA MET 64 -7.013 -35.711 10.471 533 1HB MET 64 HB2 MET 64 -8.396 -34.067 11.555 534 2HB MET 64 HB1 MET 64 -7.364 -34.806 12.769 535 1HG MET 64 HG2 MET 64 -5.892 -32.861 12.714 536 2HG MET 64 HG1 MET 64 -6.906 -32.122 11.477 537 1HE MET 64 HE1 MET 64 -9.825 -33.118 12.609 538 2HE MET 64 HE2 MET 64 -9.520 -31.524 11.915 539 3HE MET 64 HE3 MET 64 -10.286 -31.668 13.496 540 H GLU 65 HN GLU 65 -8.250 -34.402 8.989 541 HA GLU 65 HA GLU 65 -6.579 -33.159 7.050 542 1HB GLU 65 HB2 GLU 65 -9.594 -33.018 7.170 543 2HB GLU 65 HB1 GLU 65 -8.572 -32.846 5.754 544 1HG GLU 65 HG2 GLU 65 -7.986 -35.183 5.840 545 2HG GLU 65 HG1 GLU 65 -8.880 -35.382 7.349 546 H VAL 66 HN VAL 66 -6.269 -31.050 6.586 547 HA VAL 66 HA VAL 66 -8.022 -29.050 7.848 548 HB VAL 66 HB VAL 66 -6.093 -27.441 7.774 549 1HG1 VAL 66 HG11 VAL 66 -5.685 -29.872 9.525 550 2HG1 VAL 66 HG12 VAL 66 -6.747 -28.506 9.872 551 3HG1 VAL 66 HG13 VAL 66 -5.000 -28.269 9.807 552 1HG2 VAL 66 HG21 VAL 66 -3.805 -28.332 7.635 553 2HG2 VAL 66 HG22 VAL 66 -4.693 -28.600 6.134 554 3HG2 VAL 66 HG23 VAL 66 -4.451 -29.932 7.265 555 H SER 67 HN SER 67 -9.056 -27.811 6.397 556 HA SER 67 HA SER 67 -8.363 -28.167 3.575 557 1HB SER 67 HB2 SER 67 -10.703 -28.634 4.368 558 2HB SER 67 HB1 SER 67 -10.864 -26.920 4.752 559 HG SER 67 HG SER 67 -10.191 -26.657 2.416 560 H ASN 68 HN ASN 68 -8.005 -25.936 6.065 561 HA ASN 68 HA ASN 68 -6.726 -24.117 4.258 562 1HB ASN 68 HB2 ASN 68 -7.995 -22.112 4.927 563 2HB ASN 68 HB1 ASN 68 -9.026 -23.274 4.102 564 1HD2 ASN 68 HD21 ASN 68 -10.533 -24.468 5.331 565 2HD2 ASN 68 HD22 ASN 68 -11.064 -23.918 6.877 566 H GLU 69 HN GLU 69 -6.133 -22.033 5.735 567 HA GLU 69 HA GLU 69 -4.343 -23.216 7.655 568 1HB GLU 69 HB2 GLU 69 -3.628 -21.447 6.075 569 2HB GLU 69 HB1 GLU 69 -4.691 -20.307 6.891 570 1HG GLU 69 HG2 GLU 69 -3.397 -20.450 8.905 571 2HG GLU 69 HG1 GLU 69 -2.421 -21.759 8.241 572 H SER 70 HN SER 70 -7.264 -21.290 7.775 573 HA SER 70 HA SER 70 -7.105 -20.382 10.421 574 1HB SER 70 HB2 SER 70 -8.821 -19.591 8.817 575 2HB SER 70 HB1 SER 70 -9.604 -21.168 8.882 576 HG SER 70 HG SER 70 -10.439 -20.695 10.771 577 H GLU 71 HN GLU 71 -8.417 -23.405 9.086 578 HA GLU 71 HA GLU 71 -9.218 -24.560 11.519 579 1HB GLU 71 HB2 GLU 71 -8.262 -25.878 8.966 580 2HB GLU 71 HB1 GLU 71 -8.986 -26.747 10.314 581 1HG GLU 71 HG2 GLU 71 -11.052 -25.453 10.028 582 2HG GLU 71 HG1 GLU 71 -10.325 -24.610 8.661 583 H ARG 72 HN ARG 72 -6.125 -24.631 9.799 584 HA ARG 72 HA ARG 72 -4.726 -26.441 11.371 585 1HB ARG 72 HB2 ARG 72 -3.734 -25.633 9.351 586 2HB ARG 72 HB1 ARG 72 -3.819 -23.963 9.897 587 1HG ARG 72 HG2 ARG 72 -2.161 -24.535 11.679 588 2HG ARG 72 HG1 ARG 72 -1.999 -26.131 10.943 589 1HD ARG 72 HD2 ARG 72 -1.151 -25.183 8.913 590 2HD ARG 72 HD1 ARG 72 -1.526 -23.547 9.456 591 HE ARG 72 HE ARG 72 0.318 -24.993 11.153 592 1HH1 ARG 72 HH11 ARG 72 0.013 -22.884 8.373 593 2HH1 ARG 72 HH12 ARG 72 1.599 -22.207 8.555 594 1HH2 ARG 72 HH21 ARG 72 2.404 -24.145 11.371 595 2HH2 ARG 72 HH22 ARG 72 2.980 -22.943 10.263 596 H ASN 73 HN ASN 73 -4.980 -22.909 11.774 597 HA ASN 73 HA ASN 73 -3.448 -22.885 14.187 598 1HB ASN 73 HB2 ASN 73 -5.178 -20.797 12.851 599 2HB ASN 73 HB1 ASN 73 -4.334 -20.499 14.367 600 1HD2 ASN 73 HD21 ASN 73 -4.029 -20.852 10.943 601 2HD2 ASN 73 HD22 ASN 73 -2.355 -20.427 10.842 602 H GLU 74 HN GLU 74 -6.870 -23.033 13.437 603 HA GLU 74 HA GLU 74 -7.836 -22.413 16.023 604 1HB GLU 74 HB2 GLU 74 -9.299 -22.229 14.111 605 2HB GLU 74 HB1 GLU 74 -9.103 -23.937 13.735 606 1HG GLU 74 HG2 GLU 74 -10.289 -24.570 15.727 607 2HG GLU 74 HG1 GLU 74 -10.376 -22.891 16.256 608 H ILE 75 HN ILE 75 -7.392 -25.526 14.370 609 HA ILE 75 HA ILE 75 -8.275 -27.189 16.431 610 HB ILE 75 HB ILE 75 -6.219 -27.751 14.277 611 1HG1 ILE 75 HG12 ILE 75 -9.165 -28.459 14.363 612 2HG1 ILE 75 HG11 ILE 75 -8.532 -27.032 13.552 613 1HG2 ILE 75 HG21 ILE 75 -6.020 -29.380 16.088 614 2HG2 ILE 75 HG22 ILE 75 -6.710 -30.128 14.648 615 3HG2 ILE 75 HG23 ILE 75 -7.753 -29.702 16.005 616 1HD1 ILE 75 HD11 ILE 75 -7.880 -29.888 12.874 617 2HD1 ILE 75 HD12 ILE 75 -7.232 -28.461 12.064 618 3HD1 ILE 75 HD13 ILE 75 -8.959 -28.814 11.983 619 H PHE 76 HN PHE 76 -5.044 -25.946 15.709 620 HA PHE 76 HA PHE 76 -3.564 -27.276 17.643 621 1HB PHE 76 HB2 PHE 76 -2.560 -25.869 15.898 622 2HB PHE 76 HB1 PHE 76 -3.239 -24.429 16.647 623 HD1 PHE 76 HD1 PHE 76 -2.127 -23.339 18.431 624 HD2 PHE 76 HD2 PHE 76 -0.799 -27.175 17.125 625 HE1 PHE 76 HE1 PHE 76 -0.102 -23.103 19.803 626 HE2 PHE 76 HE2 PHE 76 1.229 -26.938 18.497 627 HZ PHE 76 HZ PHE 76 1.579 -24.903 19.837 628 H GLN 77 HN GLN 77 -5.535 -24.362 17.902 629 HA GLN 77 HA GLN 77 -4.893 -23.786 20.621 630 1HB GLN 77 HB2 GLN 77 -7.283 -22.944 18.958 631 2HB GLN 77 HB1 GLN 77 -6.825 -22.243 20.505 632 1HG GLN 77 HG2 GLN 77 -4.797 -21.356 19.577 633 2HG GLN 77 HG1 GLN 77 -5.070 -22.206 18.058 634 1HE2 GLN 77 HE21 GLN 77 -5.024 -20.318 16.857 635 2HE2 GLN 77 HE22 GLN 77 -6.310 -19.160 16.895 636 H LYS 78 HN LYS 78 -7.555 -25.484 19.014 637 HA LYS 78 HA LYS 78 -9.226 -25.950 21.192 638 1HB LYS 78 HB2 LYS 78 -8.684 -27.803 18.855 639 2HB LYS 78 HB1 LYS 78 -10.073 -27.896 19.926 640 1HG LYS 78 HG2 LYS 78 -9.434 -25.586 18.097 641 2HG LYS 78 HG1 LYS 78 -10.602 -26.868 17.765 642 1HD LYS 78 HD2 LYS 78 -11.846 -26.187 19.813 643 2HD LYS 78 HD1 LYS 78 -10.726 -24.833 19.995 644 1HE LYS 78 HE2 LYS 78 -12.775 -24.110 18.892 645 2HE LYS 78 HE1 LYS 78 -11.402 -23.984 17.795 646 1HZ LYS 78 HZ1 LYS 78 -12.086 -26.137 16.833 647 2HZ LYS 78 HZ2 LYS 78 -13.255 -24.931 16.636 648 3HZ LYS 78 HZ3 LYS 78 -13.462 -26.125 17.820 649 H ILE 79 HN ILE 79 -6.462 -27.790 20.017 650 HA ILE 79 HA ILE 79 -6.632 -29.991 21.749 651 HB ILE 79 HB ILE 79 -4.189 -28.754 20.452 652 1HG1 ILE 79 HG12 ILE 79 -5.932 -31.088 19.592 653 2HG1 ILE 79 HG11 ILE 79 -5.940 -29.487 18.861 654 1HG2 ILE 79 HG21 ILE 79 -3.099 -30.915 20.802 655 2HG2 ILE 79 HG22 ILE 79 -4.519 -31.502 21.665 656 3HG2 ILE 79 HG23 ILE 79 -3.561 -30.184 22.339 657 1HD1 ILE 79 HD11 ILE 79 -4.685 -31.060 17.513 658 2HD1 ILE 79 HD12 ILE 79 -3.622 -31.411 18.874 659 3HD1 ILE 79 HD13 ILE 79 -3.622 -29.804 18.147 660 H SER 80 HN SER 80 -5.445 -26.766 22.244 661 HA SER 80 HA SER 80 -3.898 -27.432 24.595 662 1HB SER 80 HB2 SER 80 -3.243 -25.637 22.993 663 2HB SER 80 HB1 SER 80 -4.665 -24.719 23.485 664 HG SER 80 HG SER 80 -3.446 -25.337 25.713 665 H GLN 81 HN GLN 81 -7.149 -27.181 24.091 666 HA GLN 81 HA GLN 81 -7.769 -25.617 26.480 667 1HB GLN 81 HB2 GLN 81 -9.609 -26.880 24.436 668 2HB GLN 81 HB1 GLN 81 -10.105 -25.798 25.732 669 1HG GLN 81 HG2 GLN 81 -8.834 -23.985 24.740 670 2HG GLN 81 HG1 GLN 81 -8.246 -25.063 23.476 671 1HE2 GLN 81 HE21 GLN 81 -10.854 -26.412 23.223 672 2HE2 GLN 81 HE22 GLN 81 -11.869 -25.303 22.373 673 H LEU 82 HN LEU 82 -6.922 -28.743 26.021 674 HA LEU 82 HA LEU 82 -9.083 -30.082 27.374 675 1HB LEU 82 HB2 LEU 82 -6.385 -31.363 27.255 676 2HB LEU 82 HB1 LEU 82 -7.972 -32.062 27.014 677 HG LEU 82 HG LEU 82 -6.501 -30.339 25.023 678 1HD1 LEU 82 HD11 LEU 82 -7.051 -33.304 25.016 679 2HD1 LEU 82 HD12 LEU 82 -5.484 -32.536 25.270 680 3HD1 LEU 82 HD13 LEU 82 -6.295 -32.386 23.711 681 1HD2 LEU 82 HD21 LEU 82 -8.291 -30.922 23.476 682 2HD2 LEU 82 HD22 LEU 82 -8.914 -30.041 24.869 683 3HD2 LEU 82 HD23 LEU 82 -9.131 -31.789 24.762 684 H ASP 83 HN ASP 83 -6.296 -28.355 28.372 685 HA ASP 83 HA ASP 83 -5.316 -27.932 30.380 686 1HB ASP 83 HB2 ASP 83 -7.461 -27.759 31.461 687 2HB ASP 83 HB1 ASP 83 -7.656 -29.508 31.485 688 H LYS 84 HN LYS 84 -6.356 -31.259 29.919 689 HA LYS 84 HA LYS 84 -4.461 -32.621 31.419 690 1HB LYS 84 HB2 LYS 84 -5.685 -33.439 28.773 691 2HB LYS 84 HB1 LYS 84 -4.943 -34.521 29.943 692 1HG LYS 84 HG2 LYS 84 -6.681 -34.069 31.549 693 2HG LYS 84 HG1 LYS 84 -7.387 -32.842 30.489 694 1HD LYS 84 HD2 LYS 84 -7.948 -34.527 28.846 695 2HD LYS 84 HD1 LYS 84 -7.119 -35.765 29.779 696 1HE LYS 84 HE2 LYS 84 -8.729 -35.384 31.632 697 2HE LYS 84 HE1 LYS 84 -9.595 -34.242 30.606 698 1HZ LYS 84 HZ1 LYS 84 -10.621 -36.426 30.594 699 2HZ LYS 84 HZ2 LYS 84 -9.198 -37.131 30.028 700 3HZ LYS 84 HZ3 LYS 84 -10.049 -36.039 29.053 701 H VAL 85 HN VAL 85 -4.162 -31.015 28.356 702 HA VAL 85 HA VAL 85 -1.683 -32.332 27.642 703 HB VAL 85 HB VAL 85 -3.291 -31.696 25.888 704 1HG1 VAL 85 HG11 VAL 85 -4.191 -29.669 26.900 705 2HG1 VAL 85 HG12 VAL 85 -3.614 -29.355 25.264 706 3HG1 VAL 85 HG13 VAL 85 -2.650 -28.845 26.650 707 1HG2 VAL 85 HG21 VAL 85 -1.704 -30.654 24.336 708 2HG2 VAL 85 HG22 VAL 85 -0.931 -31.912 25.302 709 3HG2 VAL 85 HG23 VAL 85 -0.665 -30.212 25.692 710 H VAL 86 HN VAL 86 0.344 -31.463 27.783 711 HA VAL 86 HA VAL 86 0.593 -28.900 29.228 712 HB VAL 86 HB VAL 86 2.824 -29.708 29.970 713 1HG1 VAL 86 HG11 VAL 86 0.506 -31.502 30.703 714 2HG1 VAL 86 HG12 VAL 86 0.892 -29.944 31.435 715 3HG1 VAL 86 HG13 VAL 86 1.992 -31.310 31.637 716 1HG2 VAL 86 HG21 VAL 86 3.288 -31.295 28.172 717 2HG2 VAL 86 HG22 VAL 86 1.961 -32.325 28.714 718 3HG2 VAL 86 HG23 VAL 86 3.380 -32.099 29.740 719 H GLN 87 HN GLN 87 1.516 -30.710 26.413 720 HA GLN 87 HA GLN 87 2.888 -28.353 25.356 721 1HB GLN 87 HB2 GLN 87 4.698 -29.698 26.242 722 2HB GLN 87 HB1 GLN 87 4.075 -31.138 25.450 723 1HG GLN 87 HG2 GLN 87 6.028 -30.223 24.300 724 2HG GLN 87 HG1 GLN 87 4.595 -30.213 23.278 725 1HE2 GLN 87 HE21 GLN 87 5.436 -28.625 21.947 726 2HE2 GLN 87 HE22 GLN 87 5.573 -26.974 22.437 727 H THR 88 HN THR 88 2.088 -27.879 23.450 728 HA THR 88 HA THR 88 0.840 -29.993 21.816 729 HB THR 88 HB THR 88 -0.399 -28.021 20.756 730 HG1 THR 88 HG1 THR 88 -0.521 -26.213 22.398 731 1HG2 THR 88 HG21 THR 88 -1.511 -29.535 22.331 732 2HG2 THR 88 HG22 THR 88 -2.062 -27.874 22.562 733 3HG2 THR 88 HG23 THR 88 -0.903 -28.583 23.686 734 H LEU 89 HN LEU 89 1.792 -30.436 19.912 735 HA LEU 89 HA LEU 89 3.492 -28.368 18.673 736 1HB LEU 89 HB2 LEU 89 3.940 -31.352 18.481 737 2HB LEU 89 HB1 LEU 89 4.922 -30.102 17.746 738 HG LEU 89 HG LEU 89 5.310 -29.324 20.220 739 1HD1 LEU 89 HD11 LEU 89 3.694 -30.797 21.265 740 2HD1 LEU 89 HD12 LEU 89 5.322 -31.195 21.811 741 3HD1 LEU 89 HD13 LEU 89 4.523 -32.213 20.612 742 1HD2 LEU 89 HD21 LEU 89 7.048 -30.145 18.720 743 2HD2 LEU 89 HD22 LEU 89 6.605 -31.811 19.096 744 3HD2 LEU 89 HD23 LEU 89 7.277 -30.771 20.354 745 H GLY 90 HN GLY 90 3.752 -28.680 16.315 746 1HA GLY 90 HA2 GLY 90 2.398 -30.124 14.529 747 2HA GLY 90 HA1 GLY 90 1.123 -29.068 15.129 748 H SER 91 HN SER 91 3.091 -26.920 15.631 749 HA SER 91 HA SER 91 4.197 -26.224 13.068 750 1HB SER 91 HB2 SER 91 1.871 -24.769 14.336 751 2HB SER 91 HB1 SER 91 2.945 -24.005 13.180 752 HG SER 91 HG SER 91 2.093 -26.422 12.297 Start of MODEL 11 1 1H GLN 1 HT1 GLN 1 11.549 -2.302 -15.959 2 2H GLN 1 HT2 GLN 1 10.570 -2.719 -17.272 3 3H GLN 1 HT3 GLN 1 12.247 -2.614 -17.469 4 HA GLN 1 HA GLN 1 10.808 -4.579 -15.792 5 1HB GLN 1 HB2 GLN 1 10.552 -5.091 -18.151 6 2HB GLN 1 HB1 GLN 1 12.274 -4.864 -18.428 7 1HG GLN 1 HG2 GLN 1 12.763 -6.805 -17.020 8 2HG GLN 1 HG1 GLN 1 11.040 -7.031 -16.730 9 1HE2 GLN 1 HE21 GLN 1 13.016 -8.813 -17.952 10 2HE2 GLN 1 HE22 GLN 1 12.404 -9.192 -19.526 11 H GLY 2 HN GLY 2 11.993 -5.575 -14.294 12 1HA GLY 2 HA2 GLY 2 14.904 -5.716 -14.544 13 2HA GLY 2 HA1 GLY 2 14.263 -4.860 -13.144 14 H HIS 3 HN HIS 3 14.150 -6.063 -11.379 15 HA HIS 3 HA HIS 3 13.153 -8.806 -11.566 16 1HB HIS 3 HB2 HIS 3 15.606 -9.025 -11.565 17 2HB HIS 3 HB1 HIS 3 15.701 -8.059 -10.095 18 HD1 HIS 3 HD1 HIS 3 14.891 -11.478 -11.340 19 HD2 HIS 3 HD2 HIS 3 14.927 -9.414 -7.729 20 HE1 HIS 3 HE1 HIS 3 14.682 -13.234 -9.555 21 HE2 HIS 3 HE2 HIS 3 14.895 -11.978 -7.384 22 H MET 4 HN MET 4 11.262 -8.299 -10.540 23 HA MET 4 HA MET 4 11.158 -6.776 -8.129 24 1HB MET 4 HB2 MET 4 8.809 -7.488 -8.000 25 2HB MET 4 HB1 MET 4 9.214 -6.892 -9.601 26 1HG MET 4 HG2 MET 4 9.391 -9.200 -10.410 27 2HG MET 4 HG1 MET 4 8.963 -9.788 -8.803 28 1HE MET 4 HE1 MET 4 5.279 -8.432 -8.439 29 2HE MET 4 HE2 MET 4 6.742 -7.577 -7.957 30 3HE MET 4 HE3 MET 4 6.591 -9.307 -7.649 31 HA PRO 5 HA PRO 5 12.599 -10.160 -5.568 32 1HB PRO 5 HB2 PRO 5 12.587 -8.819 -3.212 33 2HB PRO 5 HB1 PRO 5 13.829 -8.563 -4.443 34 1HG PRO 5 HG2 PRO 5 11.392 -6.923 -3.843 35 2HG PRO 5 HG1 PRO 5 13.044 -6.382 -4.199 36 1HD PRO 5 HD2 PRO 5 11.053 -6.391 -6.057 37 2HD PRO 5 HD1 PRO 5 12.763 -6.616 -6.476 38 H SER 6 HN SER 6 11.578 -11.727 -4.438 39 HA SER 6 HA SER 6 8.742 -11.636 -4.168 40 1HB SER 6 HB2 SER 6 9.098 -13.933 -3.147 41 2HB SER 6 HB1 SER 6 9.761 -13.723 -4.769 42 HG SER 6 HG SER 6 11.233 -13.488 -2.346 43 H ASP 7 HN ASP 7 7.523 -11.188 -2.425 44 HA ASP 7 HA ASP 7 8.642 -10.079 -0.051 45 1HB ASP 7 HB2 ASP 7 5.804 -11.079 -0.439 46 2HB ASP 7 HB1 ASP 7 6.358 -9.886 0.731 47 H SER 8 HN SER 8 7.831 -10.942 2.160 48 HA SER 8 HA SER 8 8.609 -13.728 2.405 49 1HB SER 8 HB2 SER 8 8.356 -13.261 4.871 50 2HB SER 8 HB1 SER 8 9.505 -12.203 4.052 51 HG SER 8 HG SER 8 8.297 -10.554 4.529 52 H LYS 9 HN LYS 9 6.427 -13.649 0.909 53 HA LYS 9 HA LYS 9 3.941 -13.603 2.243 54 1HB LYS 9 HB2 LYS 9 3.187 -14.844 0.088 55 2HB LYS 9 HB1 LYS 9 3.769 -13.194 -0.034 56 1HG LYS 9 HG2 LYS 9 4.745 -14.340 -1.836 57 2HG LYS 9 HG1 LYS 9 6.031 -14.164 -0.646 58 1HD LYS 9 HD2 LYS 9 6.161 -16.382 -1.516 59 2HD LYS 9 HD1 LYS 9 5.521 -16.502 0.122 60 1HE LYS 9 HE2 LYS 9 3.231 -16.639 -0.832 61 2HE LYS 9 HE1 LYS 9 3.937 -16.630 -2.448 62 1HZ LYS 9 HZ1 LYS 9 5.186 -18.661 -1.777 63 2HZ LYS 9 HZ2 LYS 9 3.511 -18.868 -1.858 64 3HZ LYS 9 HZ3 LYS 9 4.268 -18.702 -0.356 65 H LYS 10 HN LYS 10 2.454 -15.393 2.482 66 HA LYS 10 HA LYS 10 3.615 -17.457 4.050 67 1HB LYS 10 HB2 LYS 10 0.774 -17.217 3.026 68 2HB LYS 10 HB1 LYS 10 1.311 -18.242 4.348 69 1HG LYS 10 HG2 LYS 10 1.734 -15.284 4.502 70 2HG LYS 10 HG1 LYS 10 0.140 -15.957 4.828 71 1HD LYS 10 HD2 LYS 10 1.328 -15.673 6.910 72 2HD LYS 10 HD1 LYS 10 1.141 -17.393 6.584 73 1HE LYS 10 HE2 LYS 10 3.444 -17.552 5.864 74 2HE LYS 10 HE1 LYS 10 3.645 -15.806 6.001 75 1HZ LYS 10 HZ1 LYS 10 4.571 -17.038 7.890 76 2HZ LYS 10 HZ2 LYS 10 3.027 -17.614 8.275 77 3HZ LYS 10 HZ3 LYS 10 3.359 -15.957 8.360 78 HA PRO 11 HA PRO 11 4.085 -20.667 0.963 79 1HB PRO 11 HB2 PRO 11 3.805 -22.871 2.544 80 2HB PRO 11 HB1 PRO 11 5.269 -21.879 2.539 81 1HG PRO 11 HG2 PRO 11 2.966 -21.843 4.461 82 2HG PRO 11 HG1 PRO 11 4.705 -21.780 4.801 83 1HD PRO 11 HD2 PRO 11 3.157 -19.564 4.810 84 2HD PRO 11 HD1 PRO 11 4.854 -19.526 4.287 85 H THR 12 HN THR 12 2.816 -22.229 -0.158 86 HA THR 12 HA THR 12 0.028 -21.673 -0.159 87 HB THR 12 HB THR 12 1.540 -23.891 -1.573 88 HG1 THR 12 HG1 THR 12 2.073 -21.554 -1.989 89 1HG2 THR 12 HG21 THR 12 -1.191 -22.712 -2.137 90 2HG2 THR 12 HG22 THR 12 -0.878 -24.322 -1.487 91 3HG2 THR 12 HG23 THR 12 -0.364 -23.917 -3.124 92 H ILE 13 HN ILE 13 -1.274 -22.368 1.407 93 HA ILE 13 HA ILE 13 -0.964 -25.120 2.423 94 HB ILE 13 HB ILE 13 -2.544 -22.870 3.702 95 1HG1 ILE 13 HG12 ILE 13 -0.134 -22.328 3.685 96 2HG1 ILE 13 HG11 ILE 13 -0.701 -22.668 5.316 97 1HG2 ILE 13 HG21 ILE 13 -2.532 -24.334 5.679 98 2HG2 ILE 13 HG22 ILE 13 -1.681 -25.571 4.752 99 3HG2 ILE 13 HG23 ILE 13 -3.320 -25.102 4.300 100 1HD1 ILE 13 HD11 ILE 13 1.492 -23.643 4.870 101 2HD1 ILE 13 HD12 ILE 13 0.802 -24.597 3.557 102 3HD1 ILE 13 HD13 ILE 13 0.288 -24.881 5.222 103 H ILE 14 HN ILE 14 -2.278 -26.490 1.434 104 HA ILE 14 HA ILE 14 -4.552 -25.514 -0.079 105 HB ILE 14 HB ILE 14 -3.418 -28.316 0.136 106 1HG1 ILE 14 HG12 ILE 14 -3.018 -26.208 -2.010 107 2HG1 ILE 14 HG11 ILE 14 -1.817 -26.682 -0.814 108 1HG2 ILE 14 HG21 ILE 14 -4.691 -28.772 -1.917 109 2HG2 ILE 14 HG22 ILE 14 -5.391 -27.156 -1.841 110 3HG2 ILE 14 HG23 ILE 14 -5.751 -28.334 -0.578 111 1HD1 ILE 14 HD11 ILE 14 -2.967 -28.455 -2.961 112 2HD1 ILE 14 HD12 ILE 14 -1.765 -28.934 -1.763 113 3HD1 ILE 14 HD13 ILE 14 -1.371 -27.706 -2.966 114 H TYR 15 HN TYR 15 -6.655 -25.953 0.292 115 HA TYR 15 HA TYR 15 -7.391 -27.832 2.430 116 1HB TYR 15 HB2 TYR 15 -8.503 -25.034 2.029 117 2HB TYR 15 HB1 TYR 15 -9.249 -26.245 3.067 118 HD1 TYR 15 HD1 TYR 15 -8.207 -26.893 5.180 119 HD2 TYR 15 HD2 TYR 15 -6.429 -23.923 2.698 120 HE1 TYR 15 HE1 TYR 15 -6.765 -26.204 7.045 121 HE2 TYR 15 HE2 TYR 15 -4.985 -23.227 4.565 122 HH TYR 15 HH TYR 15 -4.545 -25.084 7.325 123 HA PRO 16 HA PRO 16 -9.063 -29.035 3.079 124 1HB PRO 16 HB2 PRO 16 -9.807 -31.568 2.521 125 2HB PRO 16 HB1 PRO 16 -10.978 -30.268 2.729 126 1HG PRO 16 HG2 PRO 16 -9.893 -31.449 0.197 127 2HG PRO 16 HG1 PRO 16 -11.567 -31.021 0.600 128 1HD PRO 16 HD2 PRO 16 -9.952 -29.428 -0.907 129 2HD PRO 16 HD1 PRO 16 -11.245 -28.789 0.127 130 H CYS 17 HN CYS 17 -7.663 -30.518 4.047 131 HA CYS 17 HA CYS 17 -5.893 -32.244 2.655 132 1HB CYS 17 HB2 CYS 17 -4.841 -30.164 1.906 133 2HB CYS 17 HB1 CYS 17 -4.749 -29.584 3.564 134 HG CYS 17 HG CYS 17 -2.726 -31.137 4.380 135 H LEU 18 HN LEU 18 -4.268 -33.179 4.120 136 HA LEU 18 HA LEU 18 -5.278 -33.512 6.792 137 1HB LEU 18 HB2 LEU 18 -2.835 -34.558 5.358 138 2HB LEU 18 HB1 LEU 18 -3.179 -34.941 7.035 139 HG LEU 18 HG LEU 18 -5.105 -35.576 4.793 140 1HD1 LEU 18 HD11 LEU 18 -2.986 -37.360 5.999 141 2HD1 LEU 18 HD12 LEU 18 -3.006 -36.728 4.350 142 3HD1 LEU 18 HD13 LEU 18 -4.247 -37.866 4.871 143 1HD2 LEU 18 HD21 LEU 18 -6.030 -37.156 6.421 144 2HD2 LEU 18 HD22 LEU 18 -6.076 -35.505 7.034 145 3HD2 LEU 18 HD23 LEU 18 -4.846 -36.625 7.618 146 H TRP 19 HN TRP 19 -4.508 -32.648 8.671 147 HA TRP 19 HA TRP 19 -2.111 -30.938 8.491 148 1HB TRP 19 HB2 TRP 19 -4.305 -29.696 8.823 149 2HB TRP 19 HB1 TRP 19 -4.421 -30.477 10.398 150 HD1 TRP 19 HD1 TRP 19 -2.793 -29.602 12.322 151 HE1 TRP 19 HE1 TRP 19 -1.305 -27.515 12.534 152 HE3 TRP 19 HE3 TRP 19 -2.820 -28.068 7.435 153 HZ2 TRP 19 HZ2 TRP 19 -0.280 -25.490 10.864 154 HZ3 TRP 19 HZ3 TRP 19 -1.554 -26.047 6.833 155 HH2 TRP 19 HH2 TRP 19 -0.313 -24.786 8.511 156 H ASP 20 HN ASP 20 -0.596 -31.142 10.065 157 HA ASP 20 HA ASP 20 -0.777 -33.557 11.708 158 1HB ASP 20 HB2 ASP 20 1.169 -33.266 10.213 159 2HB ASP 20 HB1 ASP 20 1.588 -31.772 11.041 160 H TYR 21 HN TYR 21 -1.323 -33.395 13.781 161 HA TYR 21 HA TYR 21 -0.822 -30.875 15.237 162 1HB TYR 21 HB2 TYR 21 -2.892 -33.037 15.735 163 2HB TYR 21 HB1 TYR 21 -2.617 -31.664 16.799 164 HD1 TYR 21 HD1 TYR 21 -3.395 -29.446 16.199 165 HD2 TYR 21 HD2 TYR 21 -3.970 -32.733 13.548 166 HE1 TYR 21 HE1 TYR 21 -5.020 -28.121 14.916 167 HE2 TYR 21 HE2 TYR 21 -5.594 -31.410 12.260 168 HH TYR 21 HH TYR 21 -6.052 -28.021 12.801 169 H ARG 22 HN ARG 22 0.323 -30.910 17.110 170 HA ARG 22 HA ARG 22 1.431 -33.504 17.987 171 1HB ARG 22 HB2 ARG 22 2.973 -31.640 17.088 172 2HB ARG 22 HB1 ARG 22 2.616 -30.788 18.581 173 1HG ARG 22 HG2 ARG 22 4.737 -32.006 18.694 174 2HG ARG 22 HG1 ARG 22 3.575 -32.605 19.881 175 1HD ARG 22 HD2 ARG 22 4.925 -34.329 18.523 176 2HD ARG 22 HD1 ARG 22 3.185 -34.575 18.686 177 HE ARG 22 HE ARG 22 3.948 -33.096 16.325 178 1HH1 ARG 22 HH11 ARG 22 3.514 -36.303 17.655 179 2HH1 ARG 22 HH12 ARG 22 3.103 -37.015 16.129 180 1HH2 ARG 22 HH21 ARG 22 3.363 -34.031 14.322 181 2HH2 ARG 22 HH22 ARG 22 3.009 -35.729 14.239 182 H VAL 23 HN VAL 23 0.438 -34.225 19.763 183 HA VAL 23 HA VAL 23 -0.654 -32.264 21.686 184 HB VAL 23 HB VAL 23 -1.638 -35.090 21.218 185 1HG1 VAL 23 HG11 VAL 23 -2.824 -32.786 22.773 186 2HG1 VAL 23 HG12 VAL 23 -2.112 -34.250 23.452 187 3HG1 VAL 23 HG13 VAL 23 -3.598 -34.351 22.509 188 1HG2 VAL 23 HG21 VAL 23 -3.561 -34.052 20.066 189 2HG2 VAL 23 HG22 VAL 23 -2.042 -33.789 19.212 190 3HG2 VAL 23 HG23 VAL 23 -2.754 -32.488 20.164 191 H ILE 24 HN ILE 24 0.712 -32.148 23.374 192 HA ILE 24 HA ILE 24 1.963 -34.616 24.382 193 HB ILE 24 HB ILE 24 2.618 -31.733 25.051 194 1HG1 ILE 24 HG12 ILE 24 4.084 -33.726 23.291 195 2HG1 ILE 24 HG11 ILE 24 3.179 -32.330 22.717 196 1HG2 ILE 24 HG21 ILE 24 3.145 -33.251 26.893 197 2HG2 ILE 24 HG22 ILE 24 4.625 -32.664 26.133 198 3HG2 ILE 24 HG23 ILE 24 4.045 -34.295 25.791 199 1HD1 ILE 24 HD11 ILE 24 5.553 -31.892 22.686 200 2HD1 ILE 24 HD12 ILE 24 5.670 -32.258 24.407 201 3HD1 ILE 24 HD13 ILE 24 4.755 -30.850 23.864 202 H MET 25 HN MET 25 0.846 -35.595 25.936 203 HA MET 25 HA MET 25 -0.744 -33.958 27.818 204 1HB MET 25 HB2 MET 25 -1.255 -36.806 26.910 205 2HB MET 25 HB1 MET 25 -2.253 -35.889 28.032 206 1HG MET 25 HG2 MET 25 -2.832 -34.319 26.273 207 2HG MET 25 HG1 MET 25 -1.775 -35.165 25.145 208 1HE MET 25 HE1 MET 25 -4.142 -36.829 27.853 209 2HE MET 25 HE2 MET 25 -5.628 -36.998 26.914 210 3HE MET 25 HE3 MET 25 -5.025 -35.396 27.324 211 H THR 26 HN THR 26 -1.083 -34.992 29.966 212 HA THR 26 HA THR 26 1.421 -36.169 30.937 213 HB THR 26 HB THR 26 0.310 -35.642 33.222 214 HG1 THR 26 HG1 THR 26 -1.116 -33.615 31.978 215 1HG2 THR 26 HG21 THR 26 2.199 -34.373 32.334 216 2HG2 THR 26 HG22 THR 26 1.041 -33.297 33.118 217 3HG2 THR 26 HG23 THR 26 1.099 -33.396 31.357 218 H THR 27 HN THR 27 -1.054 -37.533 29.614 219 HA THR 27 HA THR 27 -0.912 -39.910 31.235 220 HB THR 27 HB THR 27 -2.752 -38.703 32.370 221 HG1 THR 27 HG1 THR 27 -3.916 -40.510 32.498 222 1HG2 THR 27 HG21 THR 27 -4.860 -38.277 31.188 223 2HG2 THR 27 HG22 THR 27 -4.118 -38.793 29.673 224 3HG2 THR 27 HG23 THR 27 -3.536 -37.341 30.490 225 H LYS 28 HN LYS 28 -1.935 -41.746 30.168 226 HA LYS 28 HA LYS 28 -2.100 -41.401 27.261 227 1HB LYS 28 HB2 LYS 28 -1.908 -43.925 28.924 228 2HB LYS 28 HB1 LYS 28 -1.962 -43.872 27.164 229 1HG LYS 28 HG2 LYS 28 0.142 -42.483 27.246 230 2HG LYS 28 HG1 LYS 28 0.220 -42.842 28.973 231 1HD LYS 28 HD2 LYS 28 1.634 -44.390 27.760 232 2HD LYS 28 HD1 LYS 28 0.255 -45.263 28.434 233 1HE LYS 28 HE2 LYS 28 -0.867 -45.113 26.229 234 2HE LYS 28 HE1 LYS 28 0.569 -44.324 25.577 235 1HZ LYS 28 HZ1 LYS 28 1.842 -46.322 26.109 236 2HZ LYS 28 HZ2 LYS 28 0.566 -46.666 25.056 237 3HZ LYS 28 HZ3 LYS 28 0.443 -47.072 26.689 238 H ASP 29 HN ASP 29 -4.068 -41.532 29.939 239 HA ASP 29 HA ASP 29 -6.330 -42.838 28.711 240 1HB ASP 29 HB2 ASP 29 -6.180 -42.965 31.114 241 2HB ASP 29 HB1 ASP 29 -6.030 -41.216 31.255 242 H THR 30 HN THR 30 -6.336 -41.633 26.768 243 HA THR 30 HA THR 30 -7.275 -38.864 27.050 244 HB THR 30 HB THR 30 -5.139 -38.984 25.896 245 HG1 THR 30 HG1 THR 30 -5.724 -37.710 24.209 246 1HG2 THR 30 HG21 THR 30 -6.516 -40.758 23.871 247 2HG2 THR 30 HG22 THR 30 -5.261 -41.261 25.003 248 3HG2 THR 30 HG23 THR 30 -4.885 -40.101 23.728 249 H SER 31 HN SER 31 -9.426 -38.943 27.024 250 HA SER 31 HA SER 31 -10.767 -40.479 24.893 251 1HB SER 31 HB2 SER 31 -11.915 -39.478 27.519 252 2HB SER 31 HB1 SER 31 -12.749 -40.482 26.328 253 HG SER 31 HG SER 31 -11.781 -41.627 28.160 254 H THR 32 HN THR 32 -10.896 -37.441 26.717 255 HA THR 32 HA THR 32 -12.857 -36.102 25.305 256 HB THR 32 HB THR 32 -10.385 -34.764 26.427 257 HG1 THR 32 HG1 THR 32 -12.656 -35.257 28.014 258 1HG2 THR 32 HG21 THR 32 -11.972 -33.286 25.272 259 2HG2 THR 32 HG22 THR 32 -11.964 -32.971 27.008 260 3HG2 THR 32 HG23 THR 32 -13.282 -33.893 26.285 261 H LEU 33 HN LEU 33 -9.445 -36.514 24.571 262 HA LEU 33 HA LEU 33 -9.157 -34.624 22.528 263 1HB LEU 33 HB2 LEU 33 -7.279 -35.791 23.602 264 2HB LEU 33 HB1 LEU 33 -7.783 -37.297 22.864 265 HG LEU 33 HG LEU 33 -7.274 -36.385 20.634 266 1HD1 LEU 33 HD11 LEU 33 -7.712 -34.028 21.058 267 2HD1 LEU 33 HD12 LEU 33 -6.089 -34.254 20.409 268 3HD1 LEU 33 HD13 LEU 33 -6.315 -33.944 22.132 269 1HD2 LEU 33 HD21 LEU 33 -4.831 -36.335 20.864 270 2HD2 LEU 33 HD22 LEU 33 -5.549 -37.618 21.838 271 3HD2 LEU 33 HD23 LEU 33 -4.999 -36.129 22.611 272 H LYS 34 HN LYS 34 -10.070 -38.052 22.379 273 HA LYS 34 HA LYS 34 -10.421 -38.141 19.570 274 1HB LYS 34 HB2 LYS 34 -11.686 -39.868 21.714 275 2HB LYS 34 HB1 LYS 34 -11.640 -40.241 19.996 276 1HG LYS 34 HG2 LYS 34 -9.224 -40.425 20.063 277 2HG LYS 34 HG1 LYS 34 -9.210 -39.950 21.763 278 1HD LYS 34 HD2 LYS 34 -10.490 -42.440 20.616 279 2HD LYS 34 HD1 LYS 34 -8.980 -42.375 21.528 280 1HE LYS 34 HE2 LYS 34 -10.251 -41.466 23.464 281 2HE LYS 34 HE1 LYS 34 -11.740 -41.682 22.544 282 1HZ LYS 34 HZ1 LYS 34 -9.863 -43.840 23.334 283 2HZ LYS 34 HZ2 LYS 34 -11.284 -44.056 22.447 284 3HZ LYS 34 HZ3 LYS 34 -11.360 -43.523 24.053 285 H GLU 35 HN GLU 35 -12.623 -37.595 22.280 286 HA GLU 35 HA GLU 35 -15.046 -37.651 20.947 287 1HB GLU 35 HB2 GLU 35 -14.220 -36.000 23.341 288 2HB GLU 35 HB1 GLU 35 -15.884 -36.184 22.798 289 1HG GLU 35 HG2 GLU 35 -15.670 -38.635 23.126 290 2HG GLU 35 HG1 GLU 35 -14.059 -38.367 23.791 291 H LEU 36 HN LEU 36 -12.907 -34.845 21.481 292 HA LEU 36 HA LEU 36 -14.670 -32.994 20.255 293 1HB LEU 36 HB2 LEU 36 -12.877 -31.404 20.355 294 2HB LEU 36 HB1 LEU 36 -12.885 -32.340 21.832 295 HG LEU 36 HG LEU 36 -11.044 -33.754 20.504 296 1HD1 LEU 36 HD11 LEU 36 -10.744 -30.981 19.351 297 2HD1 LEU 36 HD12 LEU 36 -11.164 -32.440 18.454 298 3HD1 LEU 36 HD13 LEU 36 -9.577 -32.296 19.207 299 1HD2 LEU 36 HD21 LEU 36 -10.497 -31.150 21.927 300 2HD2 LEU 36 HD22 LEU 36 -9.328 -32.443 21.654 301 3HD2 LEU 36 HD23 LEU 36 -10.729 -32.726 22.685 302 H LEU 37 HN LEU 37 -12.130 -35.076 19.021 303 HA LEU 37 HA LEU 37 -11.995 -33.932 16.415 304 1HB LEU 37 HB2 LEU 37 -11.318 -36.736 17.339 305 2HB LEU 37 HB1 LEU 37 -10.869 -36.047 15.789 306 HG LEU 37 HG LEU 37 -9.921 -35.007 18.469 307 1HD1 LEU 37 HD11 LEU 37 -8.466 -36.706 16.442 308 2HD1 LEU 37 HD12 LEU 37 -9.025 -37.232 18.030 309 3HD1 LEU 37 HD13 LEU 37 -7.766 -36.004 17.901 310 1HD2 LEU 37 HD21 LEU 37 -9.980 -33.281 16.754 311 2HD2 LEU 37 HD22 LEU 37 -9.067 -34.319 15.656 312 3HD2 LEU 37 HD23 LEU 37 -8.317 -33.722 17.137 313 H GLU 38 HN GLU 38 -13.920 -36.465 17.902 314 HA GLU 38 HA GLU 38 -14.980 -37.516 15.482 315 1HB GLU 38 HB2 GLU 38 -15.892 -37.814 18.351 316 2HB GLU 38 HB1 GLU 38 -16.564 -38.722 17.001 317 1HG GLU 38 HG2 GLU 38 -14.349 -39.692 16.561 318 2HG GLU 38 HG1 GLU 38 -13.694 -38.801 17.933 319 H THR 39 HN THR 39 -15.875 -34.806 17.453 320 HA THR 39 HA THR 39 -18.625 -34.693 16.812 321 HB THR 39 HB THR 39 -18.545 -32.303 17.419 322 HG1 THR 39 HG1 THR 39 -15.767 -32.577 17.912 323 1HG2 THR 39 HG21 THR 39 -16.930 -34.048 19.288 324 2HG2 THR 39 HG22 THR 39 -18.691 -33.973 19.207 325 3HG2 THR 39 HG23 THR 39 -17.771 -32.561 19.729 326 H TYR 40 HN TYR 40 -15.800 -33.957 14.971 327 HA TYR 40 HA TYR 40 -17.177 -32.299 13.039 328 1HB TYR 40 HB2 TYR 40 -14.403 -33.518 12.932 329 2HB TYR 40 HB1 TYR 40 -15.034 -32.296 11.829 330 HD1 TYR 40 HD1 TYR 40 -15.666 -30.022 12.782 331 HD2 TYR 40 HD2 TYR 40 -13.424 -32.893 14.985 332 HE1 TYR 40 HE1 TYR 40 -14.926 -28.255 14.321 333 HE2 TYR 40 HE2 TYR 40 -12.680 -31.135 16.534 334 HH TYR 40 HH TYR 40 -14.105 -28.035 16.602 335 H GLN 41 HN GLN 41 -16.984 -35.583 13.636 336 HA GLN 41 HA GLN 41 -17.773 -37.413 12.550 337 1HB GLN 41 HB2 GLN 41 -18.947 -35.336 10.685 338 2HB GLN 41 HB1 GLN 41 -19.365 -37.044 10.663 339 1HG GLN 41 HG2 GLN 41 -19.767 -35.223 13.031 340 2HG GLN 41 HG1 GLN 41 -21.010 -35.605 11.841 341 1HE2 GLN 41 HE21 GLN 41 -19.122 -36.799 14.498 342 2HE2 GLN 41 HE22 GLN 41 -20.038 -38.238 14.764 343 H ARG 42 HN ARG 42 -15.168 -36.129 11.772 344 HA ARG 42 HA ARG 42 -14.847 -37.415 9.135 345 1HB ARG 42 HB2 ARG 42 -13.067 -35.825 8.641 346 2HB ARG 42 HB1 ARG 42 -14.548 -34.961 9.025 347 1HG ARG 42 HG2 ARG 42 -13.732 -34.345 11.174 348 2HG ARG 42 HG1 ARG 42 -12.353 -35.436 11.033 349 1HD ARG 42 HD2 ARG 42 -11.514 -33.269 10.625 350 2HD ARG 42 HD1 ARG 42 -11.605 -34.059 9.056 351 HE ARG 42 HE ARG 42 -13.410 -31.946 10.038 352 1HH1 ARG 42 HH11 ARG 42 -12.248 -33.920 7.383 353 2HH1 ARG 42 HH12 ARG 42 -12.785 -32.814 6.161 354 1HH2 ARG 42 HH21 ARG 42 -14.098 -30.475 8.434 355 2HH2 ARG 42 HH22 ARG 42 -13.857 -30.860 6.758 356 HA PRO 43 HA PRO 43 -11.920 -40.130 11.006 357 1HB PRO 43 HB2 PRO 43 -10.129 -40.573 9.017 358 2HB PRO 43 HB1 PRO 43 -11.785 -41.192 8.961 359 1HG PRO 43 HG2 PRO 43 -10.637 -38.743 7.659 360 2HG PRO 43 HG1 PRO 43 -11.711 -39.974 6.967 361 1HD PRO 43 HD2 PRO 43 -12.632 -37.592 7.858 362 2HD PRO 43 HD1 PRO 43 -13.592 -39.080 7.970 363 H PHE 44 HN PHE 44 -9.798 -40.361 11.842 364 HA PHE 44 HA PHE 44 -7.825 -38.287 11.476 365 1HB PHE 44 HB2 PHE 44 -7.755 -37.649 13.873 366 2HB PHE 44 HB1 PHE 44 -9.276 -37.195 13.115 367 HD1 PHE 44 HD1 PHE 44 -7.676 -39.353 15.600 368 HD2 PHE 44 HD2 PHE 44 -11.355 -38.338 13.699 369 HE1 PHE 44 HE1 PHE 44 -8.915 -40.535 17.366 370 HE2 PHE 44 HE2 PHE 44 -12.594 -39.521 15.464 371 HZ PHE 44 HZ PHE 44 -11.375 -40.617 17.303 372 H LYS 45 HN LYS 45 -5.916 -38.736 13.020 373 HA LYS 45 HA LYS 45 -5.658 -41.643 13.473 374 1HB LYS 45 HB2 LYS 45 -4.086 -40.790 11.784 375 2HB LYS 45 HB1 LYS 45 -3.494 -39.592 12.929 376 1HG LYS 45 HG2 LYS 45 -2.849 -41.559 14.420 377 2HG LYS 45 HG1 LYS 45 -3.141 -42.577 13.011 378 1HD LYS 45 HD2 LYS 45 -1.153 -40.305 13.195 379 2HD LYS 45 HD1 LYS 45 -0.773 -42.026 13.222 380 1HE LYS 45 HE2 LYS 45 -1.956 -40.469 10.922 381 2HE LYS 45 HE1 LYS 45 -0.326 -41.134 11.032 382 1HZ LYS 45 HZ1 LYS 45 -2.843 -42.712 10.952 383 2HZ LYS 45 HZ2 LYS 45 -1.289 -43.355 11.097 384 3HZ LYS 45 HZ3 LYS 45 -1.735 -42.539 9.687 385 H LEU 46 HN LEU 46 -5.003 -42.358 15.436 386 HA LEU 46 HA LEU 46 -4.037 -40.396 17.412 387 1HB LEU 46 HB2 LEU 46 -6.342 -41.169 17.958 388 2HB LEU 46 HB1 LEU 46 -5.765 -42.824 17.967 389 HG LEU 46 HG LEU 46 -4.246 -42.228 19.870 390 1HD1 LEU 46 HD11 LEU 46 -4.083 -39.826 19.466 391 2HD1 LEU 46 HD12 LEU 46 -4.652 -40.159 21.102 392 3HD1 LEU 46 HD13 LEU 46 -5.791 -39.633 19.861 393 1HD2 LEU 46 HD21 LEU 46 -7.193 -41.746 20.341 394 2HD2 LEU 46 HD22 LEU 46 -6.007 -42.193 21.569 395 3HD2 LEU 46 HD23 LEU 46 -6.396 -43.319 20.269 396 H GLU 47 HN GLU 47 -1.904 -40.808 17.526 397 HA GLU 47 HA GLU 47 -1.007 -43.584 17.822 398 1HB GLU 47 HB2 GLU 47 -0.628 -41.948 15.457 399 2HB GLU 47 HB1 GLU 47 0.928 -42.361 16.151 400 1HG GLU 47 HG2 GLU 47 -1.230 -44.311 15.356 401 2HG GLU 47 HG1 GLU 47 0.248 -43.970 14.459 402 H PHE 48 HN PHE 48 0.202 -43.713 19.562 403 HA PHE 48 HA PHE 48 1.420 -41.438 20.810 404 1HB PHE 48 HB2 PHE 48 0.578 -43.243 22.194 405 2HB PHE 48 HB1 PHE 48 1.597 -44.416 21.368 406 HD1 PHE 48 HD1 PHE 48 3.731 -44.907 22.184 407 HD2 PHE 48 HD2 PHE 48 1.737 -41.392 23.533 408 HE1 PHE 48 HE1 PHE 48 5.485 -44.565 23.872 409 HE2 PHE 48 HE2 PHE 48 3.490 -41.046 25.223 410 HZ PHE 48 HZ PHE 48 5.366 -42.634 25.396 411 H LYS 49 HN LYS 49 3.413 -40.641 20.461 412 HA LYS 49 HA LYS 49 5.178 -42.042 18.609 413 1HB LYS 49 HB2 LYS 49 5.222 -39.247 19.759 414 2HB LYS 49 HB1 LYS 49 6.512 -39.883 18.748 415 1HG LYS 49 HG2 LYS 49 3.622 -39.626 17.907 416 2HG LYS 49 HG1 LYS 49 4.906 -38.484 17.501 417 1HD LYS 49 HD2 LYS 49 6.123 -40.344 16.359 418 2HD LYS 49 HD1 LYS 49 4.741 -41.394 16.678 419 1HE LYS 49 HE2 LYS 49 3.307 -39.924 15.351 420 2HE LYS 49 HE1 LYS 49 4.665 -38.840 15.058 421 1HZ LYS 49 HZ1 LYS 49 5.784 -40.683 13.908 422 2HZ LYS 49 HZ2 LYS 49 4.327 -40.255 13.170 423 3HZ LYS 49 HZ3 LYS 49 4.412 -41.651 14.124 424 H ASN 50 HN ASN 50 5.917 -40.130 21.538 425 HA ASN 50 HA ASN 50 7.338 -42.347 22.734 426 1HB ASN 50 HB2 ASN 50 9.003 -41.491 21.115 427 2HB ASN 50 HB1 ASN 50 8.869 -39.887 21.830 428 1HD2 ASN 50 HD21 ASN 50 11.022 -39.797 22.418 429 2HD2 ASN 50 HD22 ASN 50 11.687 -40.761 23.690 430 H THR 51 HN THR 51 7.840 -42.018 24.897 431 HA THR 51 HA THR 51 6.385 -39.862 26.194 432 HB THR 51 HB THR 51 6.197 -42.203 27.038 433 HG1 THR 51 HG1 THR 51 5.983 -40.257 28.417 434 1HG2 THR 51 HG21 THR 51 9.070 -41.823 27.906 435 2HG2 THR 51 HG22 THR 51 8.515 -42.929 26.650 436 3HG2 THR 51 HG23 THR 51 8.029 -43.184 28.326 437 H SER 52 HN SER 52 7.323 -38.349 27.564 438 HA SER 52 HA SER 52 9.798 -37.278 26.847 439 1HB SER 52 HB2 SER 52 7.977 -35.968 27.880 440 2HB SER 52 HB1 SER 52 8.210 -36.839 29.395 441 HG SER 52 HG SER 52 9.910 -34.971 28.128 442 H LYS 53 HN LYS 53 11.526 -36.782 28.560 443 HA LYS 53 HA LYS 53 12.960 -39.115 29.027 444 1HB LYS 53 HB2 LYS 53 13.307 -36.472 30.463 445 2HB LYS 53 HB1 LYS 53 14.531 -37.719 30.259 446 1HG LYS 53 HG2 LYS 53 13.249 -36.197 27.991 447 2HG LYS 53 HG1 LYS 53 14.795 -35.781 28.727 448 1HD LYS 53 HD2 LYS 53 14.411 -38.563 27.701 449 2HD LYS 53 HD1 LYS 53 14.650 -37.267 26.533 450 1HE LYS 53 HE2 LYS 53 16.770 -38.326 27.087 451 2HE LYS 53 HE1 LYS 53 16.748 -36.653 27.635 452 1HZ LYS 53 HZ1 LYS 53 16.293 -39.036 29.353 453 2HZ LYS 53 HZ2 LYS 53 16.310 -37.426 29.878 454 3HZ LYS 53 HZ3 LYS 53 17.722 -38.134 29.275 455 H ASN 54 HN ASN 54 11.106 -37.163 31.358 456 HA ASN 54 HA ASN 54 11.647 -39.012 33.518 457 1HB ASN 54 HB2 ASN 54 11.475 -36.558 33.897 458 2HB ASN 54 HB1 ASN 54 9.777 -36.626 33.452 459 1HD2 ASN 54 HD21 ASN 54 8.296 -37.407 34.918 460 2HD2 ASN 54 HD22 ASN 54 8.687 -37.772 36.556 461 H ALA 55 HN ALA 55 9.683 -39.201 30.941 462 HA ALA 55 HA ALA 55 7.978 -40.561 30.342 463 1HB ALA 55 HB1 ALA 55 9.249 -42.245 31.599 464 2HB ALA 55 HB2 ALA 55 7.512 -42.532 31.687 465 3HB ALA 55 HB3 ALA 55 8.358 -41.818 33.061 466 H LYS 56 HN LYS 56 7.581 -38.156 32.377 467 HA LYS 56 HA LYS 56 4.933 -38.775 33.393 468 1HB LYS 56 HB2 LYS 56 6.405 -37.456 34.803 469 2HB LYS 56 HB1 LYS 56 6.614 -36.259 33.534 470 1HG LYS 56 HG2 LYS 56 5.084 -35.539 35.350 471 2HG LYS 56 HG1 LYS 56 4.338 -35.527 33.752 472 1HD LYS 56 HD2 LYS 56 2.819 -36.437 35.447 473 2HD LYS 56 HD1 LYS 56 3.230 -37.648 34.233 474 1HE LYS 56 HE2 LYS 56 4.913 -38.584 35.791 475 2HE LYS 56 HE1 LYS 56 4.405 -37.410 37.007 476 1HZ LYS 56 HZ1 LYS 56 3.333 -39.517 37.373 477 2HZ LYS 56 HZ2 LYS 56 2.708 -39.527 35.802 478 3HZ LYS 56 HZ3 LYS 56 2.174 -38.373 36.918 479 H PHE 57 HN PHE 57 6.341 -37.297 30.634 480 HA PHE 57 HA PHE 57 3.707 -36.255 29.813 481 1HB PHE 57 HB2 PHE 57 6.432 -35.433 28.765 482 2HB PHE 57 HB1 PHE 57 4.883 -34.719 28.328 483 HD1 PHE 57 HD1 PHE 57 7.600 -34.727 30.694 484 HD2 PHE 57 HD2 PHE 57 3.579 -33.464 30.067 485 HE1 PHE 57 HE1 PHE 57 7.815 -33.130 32.549 486 HE2 PHE 57 HE2 PHE 57 3.792 -31.863 31.922 487 HZ PHE 57 HZ PHE 57 5.910 -31.695 33.165 488 H TYR 58 HN TYR 58 2.972 -36.746 27.741 489 HA TYR 58 HA TYR 58 4.361 -38.962 26.385 490 1HB TYR 58 HB2 TYR 58 1.373 -38.810 26.904 491 2HB TYR 58 HB1 TYR 58 2.239 -40.134 26.127 492 HD1 TYR 58 HD1 TYR 58 3.769 -41.575 27.488 493 HD2 TYR 58 HD2 TYR 58 1.274 -38.628 29.288 494 HE1 TYR 58 HE1 TYR 58 4.112 -42.626 29.684 495 HE2 TYR 58 HE2 TYR 58 1.612 -39.678 31.486 496 HH TYR 58 HH TYR 58 4.037 -41.841 32.134 497 H SER 59 HN SER 59 4.766 -38.424 24.356 498 HA SER 59 HA SER 59 3.357 -36.205 23.119 499 1HB SER 59 HB2 SER 59 5.832 -36.370 22.966 500 2HB SER 59 HB1 SER 59 5.665 -37.881 22.073 501 HG SER 59 HG SER 59 5.932 -35.787 20.871 502 H PHE 60 HN PHE 60 1.517 -36.610 22.109 503 HA PHE 60 HA PHE 60 1.141 -39.172 20.719 504 1HB PHE 60 HB2 PHE 60 -0.897 -37.113 21.622 505 2HB PHE 60 HB1 PHE 60 -1.282 -38.589 20.740 506 HD1 PHE 60 HD1 PHE 60 -0.779 -37.128 23.954 507 HD2 PHE 60 HD2 PHE 60 -0.659 -40.817 21.826 508 HE1 PHE 60 HE1 PHE 60 -0.950 -38.357 26.075 509 HE2 PHE 60 HE2 PHE 60 -0.827 -42.048 23.947 510 HZ PHE 60 HZ PHE 60 -0.968 -40.818 26.074 511 H ASN 61 HN ASN 61 0.094 -39.138 18.674 512 HA ASN 61 HA ASN 61 0.641 -36.702 17.103 513 1HB ASN 61 HB2 ASN 61 2.135 -38.621 16.560 514 2HB ASN 61 HB1 ASN 61 0.717 -39.594 16.180 515 1HD2 ASN 61 HD21 ASN 61 -0.509 -39.072 14.324 516 2HD2 ASN 61 HD22 ASN 61 0.168 -38.129 13.042 517 H VAL 62 HN VAL 62 -1.148 -35.779 16.358 518 HA VAL 62 HA VAL 62 -3.473 -37.487 15.731 519 HB VAL 62 HB VAL 62 -3.510 -34.644 16.793 520 1HG1 VAL 62 HG11 VAL 62 -5.807 -36.434 15.977 521 2HG1 VAL 62 HG12 VAL 62 -5.277 -34.972 15.145 522 3HG1 VAL 62 HG13 VAL 62 -5.962 -34.864 16.766 523 1HG2 VAL 62 HG21 VAL 62 -3.046 -36.308 18.528 524 2HG2 VAL 62 HG22 VAL 62 -4.474 -37.224 18.045 525 3HG2 VAL 62 HG23 VAL 62 -4.652 -35.611 18.738 526 H SER 63 HN SER 63 -3.832 -37.537 13.633 527 HA SER 63 HA SER 63 -3.309 -35.121 12.036 528 1HB SER 63 HB2 SER 63 -2.652 -36.668 10.158 529 2HB SER 63 HB1 SER 63 -1.536 -36.672 11.522 530 HG SER 63 HG SER 63 -3.260 -38.658 10.620 531 H MET 64 HN MET 64 -5.047 -34.429 11.004 532 HA MET 64 HA MET 64 -7.121 -36.292 10.146 533 1HB MET 64 HB2 MET 64 -8.913 -35.080 11.261 534 2HB MET 64 HB1 MET 64 -7.754 -35.642 12.456 535 1HG MET 64 HG2 MET 64 -6.736 -33.351 12.417 536 2HG MET 64 HG1 MET 64 -8.091 -32.840 11.410 537 1HE MET 64 HE1 MET 64 -10.393 -34.770 12.808 538 2HE MET 64 HE2 MET 64 -10.671 -33.124 12.235 539 3HE MET 64 HE3 MET 64 -11.112 -33.570 13.883 540 H GLU 65 HN GLU 65 -8.679 -35.253 8.711 541 HA GLU 65 HA GLU 65 -7.388 -33.342 6.987 542 1HB GLU 65 HB2 GLU 65 -10.161 -34.555 6.858 543 2HB GLU 65 HB1 GLU 65 -9.419 -33.586 5.592 544 1HG GLU 65 HG2 GLU 65 -7.683 -35.278 5.301 545 2HG GLU 65 HG1 GLU 65 -8.404 -36.245 6.588 546 H VAL 66 HN VAL 66 -7.981 -31.245 6.626 547 HA VAL 66 HA VAL 66 -10.250 -30.165 8.164 548 HB VAL 66 HB VAL 66 -8.984 -27.960 8.180 549 1HG1 VAL 66 HG11 VAL 66 -9.202 -29.321 10.196 550 2HG1 VAL 66 HG12 VAL 66 -7.621 -28.541 10.141 551 3HG1 VAL 66 HG13 VAL 66 -7.774 -30.252 9.739 552 1HG2 VAL 66 HG21 VAL 66 -7.325 -28.498 6.453 553 2HG2 VAL 66 HG22 VAL 66 -6.633 -29.741 7.497 554 3HG2 VAL 66 HG23 VAL 66 -6.541 -28.041 7.965 555 H SER 67 HN SER 67 -11.749 -29.206 6.940 556 HA SER 67 HA SER 67 -11.355 -29.200 4.072 557 1HB SER 67 HB2 SER 67 -13.811 -28.532 5.719 558 2HB SER 67 HB1 SER 67 -13.773 -28.763 3.970 559 HG SER 67 HG SER 67 -12.746 -30.916 4.685 560 H ASN 68 HN ASN 68 -11.543 -26.923 6.681 561 HA ASN 68 HA ASN 68 -10.766 -24.802 4.819 562 1HB ASN 68 HB2 ASN 68 -12.266 -23.178 5.928 563 2HB ASN 68 HB1 ASN 68 -13.167 -24.462 5.129 564 1HD2 ASN 68 HD21 ASN 68 -14.306 -25.919 6.347 565 2HD2 ASN 68 HD22 ASN 68 -14.614 -25.703 8.035 566 H GLU 69 HN GLU 69 -10.304 -22.756 6.310 567 HA GLU 69 HA GLU 69 -8.080 -23.634 7.925 568 1HB GLU 69 HB2 GLU 69 -7.762 -21.742 6.435 569 2HB GLU 69 HB1 GLU 69 -9.065 -20.858 7.222 570 1HG GLU 69 HG2 GLU 69 -7.794 -20.680 9.252 571 2HG GLU 69 HG1 GLU 69 -6.532 -21.720 8.602 572 H SER 70 HN SER 70 -11.250 -22.238 8.453 573 HA SER 70 HA SER 70 -10.957 -21.350 11.084 574 1HB SER 70 HB2 SER 70 -13.450 -22.631 9.917 575 2HB SER 70 HB1 SER 70 -13.369 -21.457 11.231 576 HG SER 70 HG SER 70 -12.316 -20.070 9.541 577 H GLU 71 HN GLU 71 -11.626 -24.573 9.793 578 HA GLU 71 HA GLU 71 -12.042 -25.863 12.277 579 1HB GLU 71 HB2 GLU 71 -11.091 -26.975 9.629 580 2HB GLU 71 HB1 GLU 71 -11.510 -27.967 11.021 581 1HG GLU 71 HG2 GLU 71 -13.799 -27.023 10.952 582 2HG GLU 71 HG1 GLU 71 -13.359 -26.150 9.484 583 H ARG 72 HN ARG 72 -9.130 -25.237 10.367 584 HA ARG 72 HA ARG 72 -7.324 -26.890 11.689 585 1HB ARG 72 HB2 ARG 72 -6.820 -25.575 9.630 586 2HB ARG 72 HB1 ARG 72 -6.761 -24.115 10.609 587 1HG ARG 72 HG2 ARG 72 -4.921 -25.296 11.947 588 2HG ARG 72 HG1 ARG 72 -4.864 -26.448 10.612 589 1HD ARG 72 HD2 ARG 72 -3.186 -24.786 10.226 590 2HD ARG 72 HD1 ARG 72 -4.487 -24.518 9.063 591 HE ARG 72 HE ARG 72 -4.402 -22.966 11.565 592 1HH1 ARG 72 HH11 ARG 72 -4.299 -23.057 8.053 593 2HH1 ARG 72 HH12 ARG 72 -4.433 -21.335 7.887 594 1HH2 ARG 72 HH21 ARG 72 -4.577 -20.724 11.343 595 2HH2 ARG 72 HH22 ARG 72 -4.569 -20.002 9.767 596 H ASN 73 HN ASN 73 -8.143 -23.511 12.367 597 HA ASN 73 HA ASN 73 -6.611 -23.315 14.763 598 1HB ASN 73 HB2 ASN 73 -8.872 -21.643 13.629 599 2HB ASN 73 HB1 ASN 73 -8.034 -21.234 15.122 600 1HD2 ASN 73 HD21 ASN 73 -7.476 -19.259 14.081 601 2HD2 ASN 73 HD22 ASN 73 -6.133 -19.197 12.997 602 H GLU 74 HN GLU 74 -10.006 -23.909 14.041 603 HA GLU 74 HA GLU 74 -11.165 -23.819 16.537 604 1HB GLU 74 HB2 GLU 74 -12.428 -24.074 14.463 605 2HB GLU 74 HB1 GLU 74 -11.761 -25.680 14.222 606 1HG GLU 74 HG2 GLU 74 -13.971 -25.950 14.999 607 2HG GLU 74 HG1 GLU 74 -12.901 -26.386 16.328 608 H ILE 75 HN ILE 75 -9.968 -26.737 14.918 609 HA ILE 75 HA ILE 75 -10.403 -28.518 17.033 610 HB ILE 75 HB ILE 75 -8.391 -28.719 14.774 611 1HG1 ILE 75 HG12 ILE 75 -11.223 -29.791 14.922 612 2HG1 ILE 75 HG11 ILE 75 -10.785 -28.295 14.106 613 1HG2 ILE 75 HG21 ILE 75 -9.607 -30.876 16.514 614 2HG2 ILE 75 HG22 ILE 75 -7.926 -30.342 16.537 615 3HG2 ILE 75 HG23 ILE 75 -8.570 -31.155 15.111 616 1HD1 ILE 75 HD11 ILE 75 -9.838 -31.058 13.386 617 2HD1 ILE 75 HD12 ILE 75 -9.359 -29.565 12.578 618 3HD1 ILE 75 HD13 ILE 75 -11.041 -30.094 12.527 619 H PHE 76 HN PHE 76 -7.620 -26.558 16.150 620 HA PHE 76 HA PHE 76 -5.706 -27.646 17.879 621 1HB PHE 76 HB2 PHE 76 -5.079 -26.089 16.117 622 2HB PHE 76 HB1 PHE 76 -6.027 -24.807 16.862 623 HD1 PHE 76 HD1 PHE 76 -5.029 -23.343 18.383 624 HD2 PHE 76 HD2 PHE 76 -3.105 -27.035 17.470 625 HE1 PHE 76 HE1 PHE 76 -3.049 -22.626 19.655 626 HE2 PHE 76 HE2 PHE 76 -1.126 -26.318 18.741 627 HZ PHE 76 HZ PHE 76 -1.095 -24.112 19.835 628 H GLN 77 HN GLN 77 -8.043 -25.032 18.380 629 HA GLN 77 HA GLN 77 -7.288 -24.372 21.019 630 1HB GLN 77 HB2 GLN 77 -10.020 -24.122 19.731 631 2HB GLN 77 HB1 GLN 77 -9.468 -23.260 21.162 632 1HG GLN 77 HG2 GLN 77 -7.823 -22.058 19.839 633 2HG GLN 77 HG1 GLN 77 -8.281 -22.972 18.404 634 1HE2 GLN 77 HE21 GLN 77 -9.191 -20.444 20.605 635 2HE2 GLN 77 HE22 GLN 77 -10.483 -19.801 19.651 636 H LYS 78 HN LYS 78 -9.692 -26.601 19.709 637 HA LYS 78 HA LYS 78 -10.897 -27.398 22.112 638 1HB LYS 78 HB2 LYS 78 -10.546 -28.864 19.487 639 2HB LYS 78 HB1 LYS 78 -11.579 -29.432 20.794 640 1HG LYS 78 HG2 LYS 78 -11.918 -26.752 19.458 641 2HG LYS 78 HG1 LYS 78 -12.750 -28.218 18.935 642 1HD LYS 78 HD2 LYS 78 -13.745 -28.429 21.188 643 2HD LYS 78 HD1 LYS 78 -12.939 -26.935 21.671 644 1HE LYS 78 HE2 LYS 78 -14.958 -27.174 19.436 645 2HE LYS 78 HE1 LYS 78 -15.316 -26.601 21.064 646 1HZ LYS 78 HZ1 LYS 78 -13.878 -24.739 20.739 647 2HZ LYS 78 HZ2 LYS 78 -14.944 -24.808 19.427 648 3HZ LYS 78 HZ3 LYS 78 -13.347 -25.323 19.246 649 H ILE 79 HN ILE 79 -8.131 -28.731 20.351 650 HA ILE 79 HA ILE 79 -7.711 -31.029 21.888 651 HB ILE 79 HB ILE 79 -5.749 -29.335 20.330 652 1HG1 ILE 79 HG12 ILE 79 -7.119 -31.968 19.687 653 2HG1 ILE 79 HG11 ILE 79 -7.533 -30.399 19.005 654 1HG2 ILE 79 HG21 ILE 79 -5.305 -32.076 21.517 655 2HG2 ILE 79 HG22 ILE 79 -4.520 -30.581 22.024 656 3HG2 ILE 79 HG23 ILE 79 -4.205 -31.240 20.421 657 1HD1 ILE 79 HD11 ILE 79 -4.934 -31.869 18.618 658 2HD1 ILE 79 HD12 ILE 79 -5.327 -30.284 17.951 659 3HD1 ILE 79 HD13 ILE 79 -6.236 -31.705 17.439 660 H SER 80 HN SER 80 -6.914 -27.700 22.529 661 HA SER 80 HA SER 80 -5.033 -28.354 24.639 662 1HB SER 80 HB2 SER 80 -4.703 -26.399 23.134 663 2HB SER 80 HB1 SER 80 -6.147 -25.660 23.817 664 HG SER 80 HG SER 80 -4.945 -25.994 25.919 665 H GLN 81 HN GLN 81 -8.222 -28.710 24.597 666 HA GLN 81 HA GLN 81 -8.749 -27.362 27.161 667 1HB GLN 81 HB2 GLN 81 -10.707 -28.606 25.218 668 2HB GLN 81 HB1 GLN 81 -11.128 -27.740 26.690 669 1HG GLN 81 HG2 GLN 81 -10.023 -25.716 25.723 670 2HG GLN 81 HG1 GLN 81 -9.836 -26.609 24.216 671 1HE2 GLN 81 HE21 GLN 81 -12.441 -27.989 24.638 672 2HE2 GLN 81 HE22 GLN 81 -13.643 -26.814 24.240 673 H LEU 82 HN LEU 82 -7.524 -30.232 26.373 674 HA LEU 82 HA LEU 82 -9.315 -32.050 27.681 675 1HB LEU 82 HB2 LEU 82 -6.391 -32.684 27.509 676 2HB LEU 82 HB1 LEU 82 -7.779 -33.723 27.275 677 HG LEU 82 HG LEU 82 -6.818 -31.648 25.306 678 1HD1 LEU 82 HD11 LEU 82 -6.627 -34.658 25.218 679 2HD1 LEU 82 HD12 LEU 82 -5.288 -33.533 25.457 680 3HD1 LEU 82 HD13 LEU 82 -6.161 -33.551 23.925 681 1HD2 LEU 82 HD21 LEU 82 -9.221 -31.924 25.192 682 2HD2 LEU 82 HD22 LEU 82 -9.041 -33.676 25.099 683 3HD2 LEU 82 HD23 LEU 82 -8.457 -32.656 23.782 684 H ASP 83 HN ASP 83 -7.054 -29.768 28.772 685 HA ASP 83 HA ASP 83 -6.228 -29.173 30.799 686 1HB ASP 83 HB2 ASP 83 -8.410 -29.726 31.789 687 2HB ASP 83 HB1 ASP 83 -7.943 -31.420 31.902 688 H LYS 84 HN LYS 84 -6.381 -32.647 30.273 689 HA LYS 84 HA LYS 84 -4.083 -33.429 31.670 690 1HB LYS 84 HB2 LYS 84 -5.267 -34.651 29.165 691 2HB LYS 84 HB1 LYS 84 -4.225 -35.463 30.327 692 1HG LYS 84 HG2 LYS 84 -5.919 -35.425 31.999 693 2HG LYS 84 HG1 LYS 84 -6.931 -34.345 31.036 694 1HD LYS 84 HD2 LYS 84 -7.335 -36.058 29.414 695 2HD LYS 84 HD1 LYS 84 -6.142 -37.115 30.148 696 1HE LYS 84 HE2 LYS 84 -7.572 -37.127 32.224 697 2HE LYS 84 HE1 LYS 84 -8.801 -36.266 31.298 698 1HZ LYS 84 HZ1 LYS 84 -8.879 -38.129 29.754 699 2HZ LYS 84 HZ2 LYS 84 -9.223 -38.639 31.326 700 3HZ LYS 84 HZ3 LYS 84 -7.707 -38.955 30.653 701 H VAL 85 HN VAL 85 -4.528 -31.878 28.617 702 HA VAL 85 HA VAL 85 -1.914 -32.556 27.584 703 HB VAL 85 HB VAL 85 -3.799 -32.310 26.030 704 1HG1 VAL 85 HG11 VAL 85 -3.828 -29.404 26.852 705 2HG1 VAL 85 HG12 VAL 85 -5.073 -30.601 27.212 706 3HG1 VAL 85 HG13 VAL 85 -4.772 -30.116 25.543 707 1HG2 VAL 85 HG21 VAL 85 -2.704 -30.873 24.374 708 2HG2 VAL 85 HG22 VAL 85 -1.539 -31.903 25.206 709 3HG2 VAL 85 HG23 VAL 85 -1.674 -30.198 25.638 710 H VAL 86 HN VAL 86 -0.111 -31.404 27.856 711 HA VAL 86 HA VAL 86 -0.305 -28.877 29.350 712 HB VAL 86 HB VAL 86 2.048 -29.254 29.978 713 1HG1 VAL 86 HG11 VAL 86 1.670 -31.153 31.488 714 2HG1 VAL 86 HG12 VAL 86 0.234 -31.599 30.565 715 3HG1 VAL 86 HG13 VAL 86 0.278 -30.070 31.442 716 1HG2 VAL 86 HG21 VAL 86 1.757 -31.872 28.485 717 2HG2 VAL 86 HG22 VAL 86 3.130 -31.409 29.492 718 3HG2 VAL 86 HG23 VAL 86 2.781 -30.514 28.012 719 H GLN 87 HN GLN 87 0.478 -30.126 26.272 720 HA GLN 87 HA GLN 87 1.266 -27.490 25.381 721 1HB GLN 87 HB2 GLN 87 3.400 -28.562 26.123 722 2HB GLN 87 HB1 GLN 87 3.136 -29.830 24.931 723 1HG GLN 87 HG2 GLN 87 4.711 -28.134 24.139 724 2HG GLN 87 HG1 GLN 87 3.266 -28.212 23.133 725 1HE2 GLN 87 HE21 GLN 87 5.026 -26.341 25.480 726 2HE2 GLN 87 HE22 GLN 87 4.163 -24.861 25.245 727 H THR 88 HN THR 88 0.649 -27.095 23.351 728 HA THR 88 HA THR 88 -0.168 -29.339 21.625 729 HB THR 88 HB THR 88 -2.090 -27.867 20.853 730 HG1 THR 88 HG1 THR 88 -1.452 -25.886 21.709 731 1HG2 THR 88 HG21 THR 88 -3.565 -28.446 22.724 732 2HG2 THR 88 HG22 THR 88 -2.159 -28.767 23.741 733 3HG2 THR 88 HG23 THR 88 -2.482 -29.782 22.333 734 H LEU 89 HN LEU 89 1.202 -29.232 19.945 735 HA LEU 89 HA LEU 89 1.879 -26.593 18.827 736 1HB LEU 89 HB2 LEU 89 3.156 -29.278 18.254 737 2HB LEU 89 HB1 LEU 89 3.665 -27.741 17.591 738 HG LEU 89 HG LEU 89 5.223 -28.247 19.275 739 1HD1 LEU 89 HD11 LEU 89 4.936 -26.494 20.942 740 2HD1 LEU 89 HD12 LEU 89 3.233 -26.347 20.509 741 3HD1 LEU 89 HD13 LEU 89 4.481 -25.931 19.333 742 1HD2 LEU 89 HD21 LEU 89 2.929 -28.855 21.143 743 2HD2 LEU 89 HD22 LEU 89 4.643 -28.889 21.559 744 3HD2 LEU 89 HD23 LEU 89 3.998 -30.037 20.386 745 H GLY 90 HN GLY 90 0.611 -25.969 17.216 746 1HA GLY 90 HA2 GLY 90 -0.836 -27.938 15.613 747 2HA GLY 90 HA1 GLY 90 -1.079 -26.197 15.605 748 H SER 91 HN SER 91 2.082 -27.614 15.358 749 HA SER 91 HA SER 91 2.336 -27.791 12.577 750 1HB SER 91 HB2 SER 91 1.995 -25.283 12.793 751 2HB SER 91 HB1 SER 91 3.504 -25.220 13.701 752 HG SER 91 HG SER 91 4.614 -25.536 11.914 Start of MODEL 12 1 1H GLN 1 HT1 GLN 1 4.993 -6.542 3.627 2 2H GLN 1 HT2 GLN 1 6.144 -5.821 4.629 3 3H GLN 1 HT3 GLN 1 6.626 -6.961 3.477 4 HA GLN 1 HA GLN 1 5.467 -4.296 2.928 5 1HB GLN 1 HB2 GLN 1 8.273 -5.380 2.552 6 2HB GLN 1 HB1 GLN 1 7.714 -3.833 1.927 7 1HG GLN 1 HG2 GLN 1 7.820 -4.607 4.842 8 2HG GLN 1 HG1 GLN 1 8.992 -3.588 4.006 9 1HE2 GLN 1 HE21 GLN 1 7.256 -3.004 6.295 10 2HE2 GLN 1 HE22 GLN 1 6.330 -1.613 5.840 11 H GLY 2 HN GLY 2 3.929 -4.954 1.494 12 1HA GLY 2 HA2 GLY 2 3.152 -5.423 -0.626 13 2HA GLY 2 HA1 GLY 2 4.807 -5.732 -1.132 14 H HIS 3 HN HIS 3 2.222 -7.220 -1.537 15 HA HIS 3 HA HIS 3 3.263 -9.846 -0.698 16 1HB HIS 3 HB2 HIS 3 0.397 -8.898 -0.727 17 2HB HIS 3 HB1 HIS 3 0.824 -10.606 -0.722 18 HD1 HIS 3 HD1 HIS 3 0.465 -7.679 1.492 19 HD2 HIS 3 HD2 HIS 3 2.144 -11.478 1.675 20 HE1 HIS 3 HE1 HIS 3 0.844 -8.135 3.937 21 HE2 HIS 3 HE2 HIS 3 1.647 -10.520 4.023 22 H MET 4 HN MET 4 4.167 -10.558 -2.481 23 HA MET 4 HA MET 4 3.119 -9.997 -5.106 24 1HB MET 4 HB2 MET 4 5.457 -11.675 -4.154 25 2HB MET 4 HB1 MET 4 5.067 -11.406 -5.847 26 1HG MET 4 HG2 MET 4 6.851 -9.933 -5.150 27 2HG MET 4 HG1 MET 4 5.409 -9.000 -5.544 28 1HE MET 4 HE1 MET 4 7.734 -10.348 -2.678 29 2HE MET 4 HE2 MET 4 6.182 -11.080 -2.271 30 3HE MET 4 HE3 MET 4 6.865 -9.827 -1.237 31 HA PRO 5 HA PRO 5 0.650 -13.600 -5.854 32 1HB PRO 5 HB2 PRO 5 1.670 -14.520 -8.264 33 2HB PRO 5 HB1 PRO 5 0.502 -13.205 -8.103 34 1HG PRO 5 HG2 PRO 5 3.477 -13.067 -8.438 35 2HG PRO 5 HG1 PRO 5 2.215 -12.075 -9.197 36 1HD PRO 5 HD2 PRO 5 3.643 -11.141 -7.140 37 2HD PRO 5 HD1 PRO 5 1.910 -10.780 -7.282 38 H SER 6 HN SER 6 0.748 -15.978 -6.181 39 HA SER 6 HA SER 6 2.820 -17.055 -4.532 40 1HB SER 6 HB2 SER 6 1.558 -19.223 -4.909 41 2HB SER 6 HB1 SER 6 0.620 -17.914 -4.194 42 HG SER 6 HG SER 6 -0.136 -19.258 -6.188 43 H ASP 7 HN ASP 7 4.722 -16.826 -5.687 44 HA ASP 7 HA ASP 7 5.067 -18.436 -8.110 45 1HB ASP 7 HB2 ASP 7 6.750 -16.389 -6.684 46 2HB ASP 7 HB1 ASP 7 7.543 -17.565 -7.726 47 H SER 8 HN SER 8 7.555 -19.467 -7.851 48 HA SER 8 HA SER 8 7.185 -21.615 -5.997 49 1HB SER 8 HB2 SER 8 9.618 -20.926 -7.675 50 2HB SER 8 HB1 SER 8 9.286 -22.479 -6.903 51 HG SER 8 HG SER 8 8.679 -22.517 -9.095 52 H LYS 9 HN LYS 9 7.003 -20.001 -4.196 53 HA LYS 9 HA LYS 9 9.573 -19.802 -2.795 54 1HB LYS 9 HB2 LYS 9 7.524 -17.566 -2.975 55 2HB LYS 9 HB1 LYS 9 8.910 -17.566 -1.898 56 1HG LYS 9 HG2 LYS 9 9.320 -17.812 -4.856 57 2HG LYS 9 HG1 LYS 9 8.978 -16.240 -4.140 58 1HD LYS 9 HD2 LYS 9 11.344 -16.423 -4.287 59 2HD LYS 9 HD1 LYS 9 10.933 -16.636 -2.587 60 1HE LYS 9 HE2 LYS 9 11.209 -19.036 -2.788 61 2HE LYS 9 HE1 LYS 9 11.485 -18.889 -4.524 62 1HZ LYS 9 HZ1 LYS 9 13.476 -17.569 -4.015 63 2HZ LYS 9 HZ2 LYS 9 13.568 -19.136 -3.394 64 3HZ LYS 9 HZ3 LYS 9 13.231 -17.838 -2.366 65 H LYS 10 HN LYS 10 9.412 -20.395 -0.691 66 HA LYS 10 HA LYS 10 8.569 -21.190 1.258 67 1HB LYS 10 HB2 LYS 10 6.023 -19.848 0.316 68 2HB LYS 10 HB1 LYS 10 6.166 -20.668 1.865 69 1HG LYS 10 HG2 LYS 10 7.813 -18.309 0.968 70 2HG LYS 10 HG1 LYS 10 6.450 -18.259 2.090 71 1HD LYS 10 HD2 LYS 10 7.635 -19.602 3.694 72 2HD LYS 10 HD1 LYS 10 8.943 -19.904 2.548 73 1HE LYS 10 HE2 LYS 10 9.601 -18.231 4.171 74 2HE LYS 10 HE1 LYS 10 9.496 -17.526 2.559 75 1HZ LYS 10 HZ1 LYS 10 8.506 -16.066 4.190 76 2HZ LYS 10 HZ2 LYS 10 7.457 -17.286 4.709 77 3HZ LYS 10 HZ3 LYS 10 7.304 -16.647 3.152 78 HA PRO 11 HA PRO 11 6.915 -25.206 0.179 79 1HB PRO 11 HB2 PRO 11 5.679 -25.856 2.567 80 2HB PRO 11 HB1 PRO 11 7.408 -26.044 2.257 81 1HG PRO 11 HG2 PRO 11 5.966 -23.834 3.674 82 2HG PRO 11 HG1 PRO 11 7.497 -24.624 4.096 83 1HD PRO 11 HD2 PRO 11 7.440 -22.211 2.915 84 2HD PRO 11 HD1 PRO 11 8.704 -23.399 2.530 85 H THR 12 HN THR 12 5.329 -24.922 -1.299 86 HA THR 12 HA THR 12 2.997 -23.377 -0.880 87 HB THR 12 HB THR 12 3.508 -25.456 -3.027 88 HG1 THR 12 HG1 THR 12 4.849 -23.272 -2.559 89 1HG2 THR 12 HG21 THR 12 1.621 -23.086 -2.964 90 2HG2 THR 12 HG22 THR 12 1.149 -24.784 -2.887 91 3HG2 THR 12 HG23 THR 12 1.898 -24.142 -4.349 92 H ILE 13 HN ILE 13 1.243 -23.891 0.221 93 HA ILE 13 HA ILE 13 0.609 -26.727 0.720 94 HB ILE 13 HB ILE 13 -0.322 -24.262 2.226 95 1HG1 ILE 13 HG12 ILE 13 2.081 -24.779 2.570 96 2HG1 ILE 13 HG11 ILE 13 1.136 -25.015 4.036 97 1HG2 ILE 13 HG21 ILE 13 -1.229 -25.858 3.866 98 2HG2 ILE 13 HG22 ILE 13 -0.781 -27.193 2.803 99 3HG2 ILE 13 HG23 ILE 13 -1.995 -26.021 2.287 100 1HD1 ILE 13 HD11 ILE 13 1.129 -27.423 3.638 101 2HD1 ILE 13 HD12 ILE 13 2.766 -26.779 3.753 102 3HD1 ILE 13 HD13 ILE 13 2.087 -27.183 2.176 103 H ILE 14 HN ILE 14 -1.030 -27.547 -0.399 104 HA ILE 14 HA ILE 14 -3.143 -25.739 -1.401 105 HB ILE 14 HB ILE 14 -2.237 -28.375 -2.596 106 1HG1 ILE 14 HG12 ILE 14 -1.826 -25.544 -3.611 107 2HG1 ILE 14 HG11 ILE 14 -0.576 -26.566 -2.908 108 1HG2 ILE 14 HG21 ILE 14 -4.262 -26.359 -3.585 109 2HG2 ILE 14 HG22 ILE 14 -4.612 -27.970 -2.958 110 3HG2 ILE 14 HG23 ILE 14 -3.724 -27.788 -4.469 111 1HD1 ILE 14 HD11 ILE 14 -2.079 -27.114 -5.462 112 2HD1 ILE 14 HD12 ILE 14 -0.829 -28.142 -4.757 113 3HD1 ILE 14 HD13 ILE 14 -0.422 -26.524 -5.327 114 H TYR 15 HN TYR 15 -4.815 -25.929 -0.052 115 HA TYR 15 HA TYR 15 -5.423 -28.322 1.403 116 1HB TYR 15 HB2 TYR 15 -6.856 -25.681 1.061 117 2HB TYR 15 HB1 TYR 15 -7.528 -26.999 2.015 118 HD1 TYR 15 HD1 TYR 15 -6.870 -27.318 4.246 119 HD2 TYR 15 HD2 TYR 15 -4.565 -24.750 1.751 120 HE1 TYR 15 HE1 TYR 15 -5.581 -26.580 6.203 121 HE2 TYR 15 HE2 TYR 15 -3.266 -24.013 3.706 122 HH TYR 15 HH TYR 15 -3.256 -25.601 6.619 123 HA PRO 16 HA PRO 16 -7.402 -29.117 2.341 124 1HB PRO 16 HB2 PRO 16 -8.525 -31.553 2.406 125 2HB PRO 16 HB1 PRO 16 -9.485 -30.098 2.125 126 1HG PRO 16 HG2 PRO 16 -8.485 -32.119 0.156 127 2HG PRO 16 HG1 PRO 16 -10.063 -31.314 0.228 128 1HD PRO 16 HD2 PRO 16 -7.996 -30.551 -1.440 129 2HD PRO 16 HD1 PRO 16 -9.306 -29.478 -0.912 130 H CYS 17 HN CYS 17 -6.392 -30.717 3.759 131 HA CYS 17 HA CYS 17 -4.579 -32.656 2.600 132 1HB CYS 17 HB2 CYS 17 -3.529 -30.186 4.006 133 2HB CYS 17 HB1 CYS 17 -2.566 -31.627 3.709 134 HG CYS 17 HG CYS 17 -4.029 -30.021 1.087 135 H LEU 18 HN LEU 18 -3.881 -34.183 4.068 136 HA LEU 18 HA LEU 18 -5.039 -34.274 6.694 137 1HB LEU 18 HB2 LEU 18 -2.958 -35.965 5.295 138 2HB LEU 18 HB1 LEU 18 -3.519 -36.296 6.924 139 HG LEU 18 HG LEU 18 -5.394 -36.182 4.562 140 1HD1 LEU 18 HD11 LEU 18 -3.738 -37.912 4.126 141 2HD1 LEU 18 HD12 LEU 18 -5.299 -38.629 4.519 142 3HD1 LEU 18 HD13 LEU 18 -4.011 -38.603 5.725 143 1HD2 LEU 18 HD21 LEU 18 -6.421 -35.916 6.762 144 2HD2 LEU 18 HD22 LEU 18 -5.639 -37.396 7.319 145 3HD2 LEU 18 HD23 LEU 18 -6.861 -37.468 6.048 146 H TRP 19 HN TRP 19 -4.321 -32.807 8.133 147 HA TRP 19 HA TRP 19 -1.476 -32.079 8.158 148 1HB TRP 19 HB2 TRP 19 -3.478 -30.386 8.080 149 2HB TRP 19 HB1 TRP 19 -3.595 -30.710 9.807 150 HD1 TRP 19 HD1 TRP 19 -1.552 -29.845 11.355 151 HE1 TRP 19 HE1 TRP 19 0.240 -28.040 10.959 152 HE3 TRP 19 HE3 TRP 19 -2.059 -29.305 6.294 153 HZ2 TRP 19 HZ2 TRP 19 1.298 -26.578 8.771 154 HZ3 TRP 19 HZ3 TRP 19 -0.623 -27.686 5.125 155 HH2 TRP 19 HH2 TRP 19 1.019 -26.350 6.339 156 H ASP 20 HN ASP 20 -0.223 -32.214 10.038 157 HA ASP 20 HA ASP 20 -1.283 -34.048 12.083 158 1HB ASP 20 HB2 ASP 20 0.964 -34.715 12.563 159 2HB ASP 20 HB1 ASP 20 0.783 -34.736 10.814 160 H TYR 21 HN TYR 21 -1.244 -33.556 14.200 161 HA TYR 21 HA TYR 21 -0.203 -30.935 15.046 162 1HB TYR 21 HB2 TYR 21 -2.794 -32.248 15.936 163 2HB TYR 21 HB1 TYR 21 -2.130 -30.762 16.600 164 HD1 TYR 21 HD1 TYR 21 -2.521 -28.663 15.530 165 HD2 TYR 21 HD2 TYR 21 -3.587 -32.281 13.542 166 HE1 TYR 21 HE1 TYR 21 -3.756 -27.367 13.840 167 HE2 TYR 21 HE2 TYR 21 -4.813 -30.992 11.848 168 HH TYR 21 HH TYR 21 -5.911 -28.779 11.658 169 H ARG 22 HN ARG 22 1.393 -31.292 16.461 170 HA ARG 22 HA ARG 22 1.597 -33.789 17.903 171 1HB ARG 22 HB2 ARG 22 3.601 -32.661 17.007 172 2HB ARG 22 HB1 ARG 22 3.304 -31.289 18.064 173 1HG ARG 22 HG2 ARG 22 5.065 -32.738 18.932 174 2HG ARG 22 HG1 ARG 22 3.680 -32.681 20.022 175 1HD ARG 22 HD2 ARG 22 4.643 -34.964 19.707 176 2HD ARG 22 HD1 ARG 22 2.933 -34.840 19.296 177 HE ARG 22 HE ARG 22 3.681 -34.704 16.923 178 1HH1 ARG 22 HH11 ARG 22 5.824 -36.134 19.297 179 2HH1 ARG 22 HH12 ARG 22 6.571 -37.209 18.156 180 1HH2 ARG 22 HH21 ARG 22 4.670 -36.100 15.423 181 2HH2 ARG 22 HH22 ARG 22 5.915 -37.190 15.955 182 H VAL 23 HN VAL 23 0.411 -34.131 19.648 183 HA VAL 23 HA VAL 23 -0.289 -31.860 21.403 184 HB VAL 23 HB VAL 23 -1.759 -34.492 21.099 185 1HG1 VAL 23 HG11 VAL 23 -2.546 -31.937 22.508 186 2HG1 VAL 23 HG12 VAL 23 -2.081 -33.453 23.279 187 3HG1 VAL 23 HG13 VAL 23 -3.563 -33.367 22.326 188 1HG2 VAL 23 HG21 VAL 23 -1.906 -33.229 19.022 189 2HG2 VAL 23 HG22 VAL 23 -2.424 -31.794 19.908 190 3HG2 VAL 23 HG23 VAL 23 -3.462 -33.219 19.856 191 H ILE 24 HN ILE 24 1.098 -31.871 23.091 192 HA ILE 24 HA ILE 24 1.880 -34.438 24.292 193 HB ILE 24 HB ILE 24 2.982 -31.660 24.796 194 1HG1 ILE 24 HG12 ILE 24 4.118 -34.010 23.249 195 2HG1 ILE 24 HG11 ILE 24 3.515 -32.511 22.551 196 1HG2 ILE 24 HG21 ILE 24 3.929 -34.351 25.807 197 2HG2 ILE 24 HG22 ILE 24 3.188 -33.076 26.774 198 3HG2 ILE 24 HG23 ILE 24 4.768 -32.816 26.037 199 1HD1 ILE 24 HD11 ILE 24 5.914 -32.795 24.347 200 2HD1 ILE 24 HD12 ILE 24 5.307 -31.281 23.677 201 3HD1 ILE 24 HD13 ILE 24 5.932 -32.533 22.604 202 H MET 25 HN MET 25 0.571 -35.144 25.822 203 HA MET 25 HA MET 25 -0.790 -33.201 27.593 204 1HB MET 25 HB2 MET 25 -1.697 -35.992 26.816 205 2HB MET 25 HB1 MET 25 -2.587 -34.854 27.818 206 1HG MET 25 HG2 MET 25 -2.907 -33.375 25.954 207 2HG MET 25 HG1 MET 25 -1.866 -34.363 24.935 208 1HE MET 25 HE1 MET 25 -4.655 -35.543 27.506 209 2HE MET 25 HE2 MET 25 -6.044 -35.659 26.426 210 3HE MET 25 HE3 MET 25 -5.321 -34.089 26.763 211 H THR 26 HN THR 26 -0.956 -33.722 29.819 212 HA THR 26 HA THR 26 1.188 -35.421 30.814 213 HB THR 26 HB THR 26 0.431 -34.503 33.063 214 HG1 THR 26 HG1 THR 26 -1.593 -33.778 32.806 215 1HG2 THR 26 HG21 THR 26 1.221 -32.503 30.938 216 2HG2 THR 26 HG22 THR 26 2.321 -33.527 31.859 217 3HG2 THR 26 HG23 THR 26 1.392 -32.271 32.678 218 H THR 27 HN THR 27 -0.988 -36.769 29.541 219 HA THR 27 HA THR 27 -1.809 -38.570 31.641 220 HB THR 27 HB THR 27 -3.578 -36.848 31.787 221 HG1 THR 27 HG1 THR 27 -4.904 -38.456 32.122 222 1HG2 THR 27 HG21 THR 27 -3.469 -35.986 29.503 223 2HG2 THR 27 HG22 THR 27 -5.109 -36.508 29.885 224 3HG2 THR 27 HG23 THR 27 -4.077 -37.520 28.879 225 H LYS 28 HN LYS 28 -2.637 -40.546 30.810 226 HA LYS 28 HA LYS 28 -2.167 -41.008 27.960 227 1HB LYS 28 HB2 LYS 28 -2.737 -42.871 30.271 228 2HB LYS 28 HB1 LYS 28 -2.693 -43.415 28.600 229 1HG LYS 28 HG2 LYS 28 -0.371 -42.702 28.408 230 2HG LYS 28 HG1 LYS 28 -0.406 -42.111 30.069 231 1HD LYS 28 HD2 LYS 28 0.662 -44.323 29.883 232 2HD LYS 28 HD1 LYS 28 -0.780 -44.359 30.899 233 1HE LYS 28 HE2 LYS 28 -2.075 -45.249 28.994 234 2HE LYS 28 HE1 LYS 28 -0.607 -45.247 28.014 235 1HZ LYS 28 HZ1 LYS 28 0.378 -46.832 29.537 236 2HZ LYS 28 HZ2 LYS 28 -1.081 -47.434 28.935 237 3HZ LYS 28 HZ3 LYS 28 -1.010 -46.811 30.504 238 H ASP 29 HN ASP 29 -4.677 -40.106 29.975 239 HA ASP 29 HA ASP 29 -6.767 -41.467 28.479 240 1HB ASP 29 HB2 ASP 29 -7.121 -41.200 30.881 241 2HB ASP 29 HB1 ASP 29 -6.950 -39.452 30.737 242 H THR 30 HN THR 30 -6.225 -40.549 26.434 243 HA THR 30 HA THR 30 -6.838 -37.745 26.066 244 HB THR 30 HB THR 30 -5.154 -38.622 24.587 245 HG1 THR 30 HG1 THR 30 -5.963 -37.786 22.763 246 1HG2 THR 30 HG21 THR 30 -5.591 -40.410 22.960 247 2HG2 THR 30 HG22 THR 30 -7.190 -40.658 23.661 248 3HG2 THR 30 HG23 THR 30 -5.745 -40.992 24.617 249 H SER 31 HN SER 31 -8.905 -37.344 26.559 250 HA SER 31 HA SER 31 -10.992 -39.052 25.382 251 1HB SER 31 HB2 SER 31 -12.405 -37.903 27.264 252 2HB SER 31 HB1 SER 31 -11.287 -39.197 27.699 253 HG SER 31 HG SER 31 -10.189 -37.830 28.850 254 H THR 32 HN THR 32 -11.065 -35.751 26.677 255 HA THR 32 HA THR 32 -12.960 -34.733 24.972 256 HB THR 32 HB THR 32 -10.660 -33.086 26.041 257 HG1 THR 32 HG1 THR 32 -12.985 -34.046 27.399 258 1HG2 THR 32 HG21 THR 32 -12.385 -31.344 26.267 259 2HG2 THR 32 HG22 THR 32 -13.592 -32.448 25.608 260 3HG2 THR 32 HG23 THR 32 -12.258 -31.893 24.594 261 H LEU 33 HN LEU 33 -9.536 -35.143 24.409 262 HA LEU 33 HA LEU 33 -9.181 -33.490 22.184 263 1HB LEU 33 HB2 LEU 33 -7.320 -34.526 23.394 264 2HB LEU 33 HB1 LEU 33 -7.831 -36.114 22.856 265 HG LEU 33 HG LEU 33 -7.308 -35.518 20.530 266 1HD1 LEU 33 HD11 LEU 33 -7.767 -33.126 20.628 267 2HD1 LEU 33 HD12 LEU 33 -6.145 -33.428 20.007 268 3HD1 LEU 33 HD13 LEU 33 -6.365 -32.885 21.671 269 1HD2 LEU 33 HD21 LEU 33 -5.570 -36.557 21.887 270 2HD2 LEU 33 HD22 LEU 33 -5.038 -34.971 22.449 271 3HD2 LEU 33 HD23 LEU 33 -4.865 -35.410 20.749 272 H LYS 34 HN LYS 34 -9.960 -36.983 22.297 273 HA LYS 34 HA LYS 34 -10.314 -37.214 19.493 274 1HB LYS 34 HB2 LYS 34 -11.329 -38.948 21.759 275 2HB LYS 34 HB1 LYS 34 -11.494 -39.365 20.058 276 1HG LYS 34 HG2 LYS 34 -9.015 -39.312 19.859 277 2HG LYS 34 HG1 LYS 34 -8.922 -39.036 21.599 278 1HD LYS 34 HD2 LYS 34 -10.148 -41.450 20.246 279 2HD LYS 34 HD1 LYS 34 -8.583 -41.403 21.059 280 1HE LYS 34 HE2 LYS 34 -9.703 -40.876 23.176 281 2HE LYS 34 HE1 LYS 34 -11.265 -40.909 22.362 282 1HZ LYS 34 HZ1 LYS 34 -10.809 -42.971 23.532 283 2HZ LYS 34 HZ2 LYS 34 -9.408 -43.212 22.620 284 3HZ LYS 34 HZ3 LYS 34 -10.923 -43.241 21.867 285 H GLU 35 HN GLU 35 -12.503 -36.489 22.166 286 HA GLU 35 HA GLU 35 -14.953 -36.781 20.870 287 1HB GLU 35 HB2 GLU 35 -14.325 -34.632 22.911 288 2HB GLU 35 HB1 GLU 35 -15.898 -35.327 22.558 289 1HG GLU 35 HG2 GLU 35 -13.569 -36.728 23.852 290 2HG GLU 35 HG1 GLU 35 -15.030 -36.168 24.654 291 H LEU 36 HN LEU 36 -12.906 -33.864 21.138 292 HA LEU 36 HA LEU 36 -14.663 -32.197 19.670 293 1HB LEU 36 HB2 LEU 36 -12.907 -30.548 19.707 294 2HB LEU 36 HB1 LEU 36 -12.986 -31.344 21.263 295 HG LEU 36 HG LEU 36 -11.037 -32.823 20.240 296 1HD1 LEU 36 HD11 LEU 36 -10.762 -30.250 18.694 297 2HD1 LEU 36 HD12 LEU 36 -11.063 -31.850 18.018 298 3HD1 LEU 36 HD13 LEU 36 -9.533 -31.508 18.824 299 1HD2 LEU 36 HD21 LEU 36 -9.413 -31.302 21.260 300 2HD2 LEU 36 HD22 LEU 36 -10.856 -31.479 22.257 301 3HD2 LEU 36 HD23 LEU 36 -10.629 -30.023 21.287 302 H LEU 37 HN LEU 37 -12.052 -34.327 18.721 303 HA LEU 37 HA LEU 37 -11.686 -33.355 16.090 304 1HB LEU 37 HB2 LEU 37 -11.260 -36.133 17.211 305 2HB LEU 37 HB1 LEU 37 -10.692 -35.598 15.640 306 HG LEU 37 HG LEU 37 -9.805 -34.425 18.283 307 1HD1 LEU 37 HD11 LEU 37 -8.369 -36.341 16.444 308 2HD1 LEU 37 HD12 LEU 37 -9.021 -36.718 18.039 309 3HD1 LEU 37 HD13 LEU 37 -7.687 -35.577 17.882 310 1HD2 LEU 37 HD21 LEU 37 -8.789 -33.975 15.477 311 2HD2 LEU 37 HD22 LEU 37 -8.073 -33.319 16.949 312 3HD2 LEU 37 HD23 LEU 37 -9.689 -32.818 16.457 313 H GLU 38 HN GLU 38 -13.839 -35.784 17.468 314 HA GLU 38 HA GLU 38 -14.790 -36.818 15.008 315 1HB GLU 38 HB2 GLU 38 -16.073 -36.887 17.747 316 2HB GLU 38 HB1 GLU 38 -16.546 -37.882 16.375 317 1HG GLU 38 HG2 GLU 38 -14.344 -38.941 16.377 318 2HG GLU 38 HG1 GLU 38 -13.857 -37.934 17.736 319 H THR 39 HN THR 39 -15.661 -33.986 16.834 320 HA THR 39 HA THR 39 -18.335 -33.727 15.959 321 HB THR 39 HB THR 39 -18.237 -31.399 16.655 322 HG1 THR 39 HG1 THR 39 -15.440 -31.836 16.548 323 1HG2 THR 39 HG21 THR 39 -18.408 -33.086 18.422 324 2HG2 THR 39 HG22 THR 39 -17.490 -31.687 18.976 325 3HG2 THR 39 HG23 THR 39 -16.649 -33.169 18.524 326 H TYR 40 HN TYR 40 -15.373 -33.258 14.293 327 HA TYR 40 HA TYR 40 -16.436 -31.422 12.321 328 1HB TYR 40 HB2 TYR 40 -13.830 -32.963 12.434 329 2HB TYR 40 HB1 TYR 40 -14.245 -31.812 11.167 330 HD1 TYR 40 HD1 TYR 40 -14.284 -29.419 11.618 331 HD2 TYR 40 HD2 TYR 40 -13.277 -32.197 14.682 332 HE1 TYR 40 HE1 TYR 40 -13.407 -27.578 12.990 333 HE2 TYR 40 HE2 TYR 40 -12.395 -30.363 16.067 334 HH TYR 40 HH TYR 40 -12.904 -27.042 15.239 335 H GLN 41 HN GLN 41 -16.804 -34.666 12.885 336 HA GLN 41 HA GLN 41 -17.734 -36.376 11.726 337 1HB GLN 41 HB2 GLN 41 -18.413 -34.225 9.701 338 2HB GLN 41 HB1 GLN 41 -19.117 -35.837 9.752 339 1HG GLN 41 HG2 GLN 41 -19.390 -33.715 11.878 340 2HG GLN 41 HG1 GLN 41 -20.622 -34.174 10.704 341 1HE2 GLN 41 HE21 GLN 41 -18.929 -35.099 13.594 342 2HE2 GLN 41 HE22 GLN 41 -19.978 -36.395 14.038 343 H ARG 42 HN ARG 42 -14.925 -35.327 11.136 344 HA ARG 42 HA ARG 42 -14.508 -36.761 8.590 345 1HB ARG 42 HB2 ARG 42 -12.552 -35.414 8.208 346 2HB ARG 42 HB1 ARG 42 -13.887 -34.330 8.570 347 1HG ARG 42 HG2 ARG 42 -13.068 -33.952 10.791 348 2HG ARG 42 HG1 ARG 42 -11.836 -35.200 10.599 349 1HD ARG 42 HD2 ARG 42 -10.717 -33.140 10.317 350 2HD ARG 42 HD1 ARG 42 -10.897 -33.817 8.704 351 HE ARG 42 HE ARG 42 -12.271 -31.480 9.801 352 1HH1 ARG 42 HH11 ARG 42 -11.886 -33.678 7.088 353 2HH1 ARG 42 HH12 ARG 42 -12.451 -32.530 5.920 354 1HH2 ARG 42 HH21 ARG 42 -13.013 -29.975 8.259 355 2HH2 ARG 42 HH22 ARG 42 -13.151 -30.453 6.595 356 HA PRO 43 HA PRO 43 -12.070 -39.719 10.836 357 1HB PRO 43 HB2 PRO 43 -10.174 -40.396 8.996 358 2HB PRO 43 HB1 PRO 43 -11.857 -40.925 8.885 359 1HG PRO 43 HG2 PRO 43 -10.495 -38.648 7.485 360 2HG PRO 43 HG1 PRO 43 -11.622 -39.851 6.827 361 1HD PRO 43 HD2 PRO 43 -12.415 -37.355 7.503 362 2HD PRO 43 HD1 PRO 43 -13.481 -38.763 7.681 363 H PHE 44 HN PHE 44 -10.259 -39.852 12.092 364 HA PHE 44 HA PHE 44 -8.073 -37.946 11.667 365 1HB PHE 44 HB2 PHE 44 -8.039 -37.324 14.035 366 2HB PHE 44 HB1 PHE 44 -9.593 -36.910 13.323 367 HD1 PHE 44 HD1 PHE 44 -7.869 -38.903 15.818 368 HD2 PHE 44 HD2 PHE 44 -11.601 -38.281 13.852 369 HE1 PHE 44 HE1 PHE 44 -9.015 -40.154 17.600 370 HE2 PHE 44 HE2 PHE 44 -12.748 -39.531 15.635 371 HZ PHE 44 HZ PHE 44 -11.456 -40.467 17.511 372 H LYS 45 HN LYS 45 -6.241 -38.520 13.300 373 HA LYS 45 HA LYS 45 -6.128 -41.423 13.752 374 1HB LYS 45 HB2 LYS 45 -5.005 -40.917 11.600 375 2HB LYS 45 HB1 LYS 45 -3.942 -39.791 12.428 376 1HG LYS 45 HG2 LYS 45 -2.806 -41.879 12.015 377 2HG LYS 45 HG1 LYS 45 -3.029 -41.643 13.751 378 1HD LYS 45 HD2 LYS 45 -4.928 -43.171 13.742 379 2HD LYS 45 HD1 LYS 45 -4.795 -43.358 11.990 380 1HE LYS 45 HE2 LYS 45 -2.625 -44.384 12.225 381 2HE LYS 45 HE1 LYS 45 -2.637 -44.089 13.962 382 1HZ LYS 45 HZ1 LYS 45 -4.507 -45.597 14.179 383 2HZ LYS 45 HZ2 LYS 45 -3.204 -46.378 13.435 384 3HZ LYS 45 HZ3 LYS 45 -4.522 -45.867 12.509 385 H LEU 46 HN LEU 46 -5.566 -41.841 15.768 386 HA LEU 46 HA LEU 46 -4.119 -39.793 17.331 387 1HB LEU 46 HB2 LEU 46 -6.533 -40.573 17.930 388 2HB LEU 46 HB1 LEU 46 -5.769 -42.046 18.485 389 HG LEU 46 HG LEU 46 -6.240 -40.538 20.345 390 1HD1 LEU 46 HD11 LEU 46 -4.287 -41.985 20.542 391 2HD1 LEU 46 HD12 LEU 46 -4.054 -40.464 21.400 392 3HD1 LEU 46 HD13 LEU 46 -3.272 -40.724 19.840 393 1HD2 LEU 46 HD21 LEU 46 -5.107 -38.383 20.565 394 2HD2 LEU 46 HD22 LEU 46 -6.171 -38.420 19.160 395 3HD2 LEU 46 HD23 LEU 46 -4.425 -38.572 18.949 396 H GLU 47 HN GLU 47 -2.010 -40.336 17.352 397 HA GLU 47 HA GLU 47 -1.287 -43.167 17.791 398 1HB GLU 47 HB2 GLU 47 0.031 -41.048 16.100 399 2HB GLU 47 HB1 GLU 47 0.925 -42.455 16.657 400 1HG GLU 47 HG2 GLU 47 -1.595 -42.564 15.007 401 2HG GLU 47 HG1 GLU 47 0.044 -42.696 14.367 402 H PHE 48 HN PHE 48 -0.198 -43.616 19.581 403 HA PHE 48 HA PHE 48 0.902 -41.501 21.240 404 1HB PHE 48 HB2 PHE 48 -0.279 -43.350 22.316 405 2HB PHE 48 HB1 PHE 48 0.816 -44.516 21.584 406 HD1 PHE 48 HD1 PHE 48 2.689 -45.234 22.775 407 HD2 PHE 48 HD2 PHE 48 0.798 -41.577 23.882 408 HE1 PHE 48 HE1 PHE 48 4.154 -45.071 24.743 409 HE2 PHE 48 HE2 PHE 48 2.263 -41.416 25.850 410 HZ PHE 48 HZ PHE 48 3.938 -43.164 26.283 411 H LYS 49 HN LYS 49 2.839 -40.699 20.675 412 HA LYS 49 HA LYS 49 4.607 -42.275 18.988 413 1HB LYS 49 HB2 LYS 49 4.636 -39.378 19.837 414 2HB LYS 49 HB1 LYS 49 5.909 -40.102 18.864 415 1HG LYS 49 HG2 LYS 49 2.996 -39.975 18.085 416 2HG LYS 49 HG1 LYS 49 4.253 -38.872 17.518 417 1HD LYS 49 HD2 LYS 49 5.457 -40.788 16.522 418 2HD LYS 49 HD1 LYS 49 4.162 -41.864 17.052 419 1HE LYS 49 HE2 LYS 49 2.571 -40.659 15.643 420 2HE LYS 49 HE1 LYS 49 3.839 -39.539 15.149 421 1HZ LYS 49 HZ1 LYS 49 3.791 -42.457 14.596 422 2HZ LYS 49 HZ2 LYS 49 5.022 -41.390 14.137 423 3HZ LYS 49 HZ3 LYS 49 3.474 -41.228 13.476 424 H ASN 50 HN ASN 50 4.905 -40.494 22.086 425 HA ASN 50 HA ASN 50 7.012 -42.290 22.941 426 1HB ASN 50 HB2 ASN 50 8.188 -40.645 21.466 427 2HB ASN 50 HB1 ASN 50 7.636 -39.350 22.520 428 1HD2 ASN 50 HD21 ASN 50 8.828 -42.558 23.454 429 2HD2 ASN 50 HD22 ASN 50 10.207 -41.972 24.321 430 H THR 51 HN THR 51 7.778 -41.768 25.137 431 HA THR 51 HA THR 51 5.913 -40.095 26.686 432 HB THR 51 HB THR 51 5.400 -42.522 27.013 433 HG1 THR 51 HG1 THR 51 5.338 -42.367 29.268 434 1HG2 THR 51 HG21 THR 51 6.955 -43.935 28.258 435 2HG2 THR 51 HG22 THR 51 8.158 -42.646 28.247 436 3HG2 THR 51 HG23 THR 51 7.679 -43.419 26.733 437 H SER 52 HN SER 52 6.818 -38.982 28.404 438 HA SER 52 HA SER 52 9.500 -38.166 28.188 439 1HB SER 52 HB2 SER 52 7.922 -36.649 29.151 440 2HB SER 52 HB1 SER 52 7.422 -37.826 30.363 441 HG SER 52 HG SER 52 9.446 -36.029 30.439 442 H LYS 53 HN LYS 53 11.220 -38.390 29.784 443 HA LYS 53 HA LYS 53 11.694 -41.006 30.738 444 1HB LYS 53 HB2 LYS 53 12.923 -38.399 31.693 445 2HB LYS 53 HB1 LYS 53 13.567 -40.008 32.001 446 1HG LYS 53 HG2 LYS 53 13.906 -40.316 29.582 447 2HG LYS 53 HG1 LYS 53 13.306 -38.680 29.302 448 1HD LYS 53 HD2 LYS 53 15.756 -39.427 30.917 449 2HD LYS 53 HD1 LYS 53 15.757 -38.745 29.290 450 1HE LYS 53 HE2 LYS 53 14.653 -36.717 30.163 451 2HE LYS 53 HE1 LYS 53 14.712 -37.400 31.788 452 1HZ LYS 53 HZ1 LYS 53 17.118 -37.409 31.669 453 2HZ LYS 53 HZ2 LYS 53 16.526 -35.852 31.391 454 3HZ LYS 53 HZ3 LYS 53 17.075 -36.787 30.096 455 H ASN 54 HN ASN 54 10.253 -38.153 32.132 456 HA ASN 54 HA ASN 54 9.951 -39.244 34.785 457 1HB ASN 54 HB2 ASN 54 8.707 -36.814 33.458 458 2HB ASN 54 HB1 ASN 54 8.539 -37.215 35.163 459 1HD2 ASN 54 HD21 ASN 54 9.719 -34.861 33.870 460 2HD2 ASN 54 HD22 ASN 54 11.337 -34.761 34.473 461 H ALA 55 HN ALA 55 8.441 -39.740 31.856 462 HA ALA 55 HA ALA 55 6.522 -40.710 31.141 463 1HB ALA 55 HB1 ALA 55 7.246 -42.521 32.590 464 2HB ALA 55 HB2 ALA 55 5.488 -42.373 32.640 465 3HB ALA 55 HB3 ALA 55 6.464 -41.757 33.974 466 H LYS 56 HN LYS 56 6.497 -38.061 32.670 467 HA LYS 56 HA LYS 56 3.719 -37.956 33.569 468 1HB LYS 56 HB2 LYS 56 5.445 -36.932 34.990 469 2HB LYS 56 HB1 LYS 56 5.924 -35.877 33.668 470 1HG LYS 56 HG2 LYS 56 3.810 -34.721 33.749 471 2HG LYS 56 HG1 LYS 56 3.186 -35.869 34.937 472 1HD LYS 56 HD2 LYS 56 5.529 -34.005 35.379 473 2HD LYS 56 HD1 LYS 56 3.888 -33.728 35.961 474 1HE LYS 56 HE2 LYS 56 4.029 -35.814 37.280 475 2HE LYS 56 HE1 LYS 56 5.690 -36.031 36.732 476 1HZ LYS 56 HZ1 LYS 56 4.695 -33.731 38.323 477 2HZ LYS 56 HZ2 LYS 56 6.292 -33.974 37.826 478 3HZ LYS 56 HZ3 LYS 56 5.585 -35.034 38.934 479 H PHE 57 HN PHE 57 5.749 -37.025 30.932 480 HA PHE 57 HA PHE 57 3.538 -35.513 29.699 481 1HB PHE 57 HB2 PHE 57 6.508 -35.345 29.091 482 2HB PHE 57 HB1 PHE 57 5.242 -34.386 28.330 483 HD1 PHE 57 HD1 PHE 57 7.214 -34.889 31.381 484 HD2 PHE 57 HD2 PHE 57 4.210 -32.532 29.492 485 HE1 PHE 57 HE1 PHE 57 7.458 -33.179 33.130 486 HE2 PHE 57 HE2 PHE 57 4.453 -30.819 31.240 487 HZ PHE 57 HZ PHE 57 6.078 -31.141 33.061 488 H TYR 58 HN TYR 58 2.526 -36.592 28.153 489 HA TYR 58 HA TYR 58 3.937 -38.748 26.717 490 1HB TYR 58 HB2 TYR 58 0.949 -38.352 27.067 491 2HB TYR 58 HB1 TYR 58 1.737 -39.732 26.312 492 HD1 TYR 58 HD1 TYR 58 2.993 -41.359 27.710 493 HD2 TYR 58 HD2 TYR 58 0.768 -38.174 29.454 494 HE1 TYR 58 HE1 TYR 58 3.058 -42.507 29.883 495 HE2 TYR 58 HE2 TYR 58 0.830 -39.314 31.630 496 HH TYR 58 HH TYR 58 2.894 -41.832 32.335 497 H SER 59 HN SER 59 4.311 -38.475 24.603 498 HA SER 59 HA SER 59 3.165 -36.166 23.236 499 1HB SER 59 HB2 SER 59 5.337 -38.117 22.432 500 2HB SER 59 HB1 SER 59 4.800 -36.763 21.439 501 HG SER 59 HG SER 59 5.798 -36.504 24.082 502 H PHE 60 HN PHE 60 1.249 -36.466 22.330 503 HA PHE 60 HA PHE 60 0.715 -38.954 20.852 504 1HB PHE 60 HB2 PHE 60 -1.226 -36.767 21.669 505 2HB PHE 60 HB1 PHE 60 -1.647 -38.283 20.884 506 HD1 PHE 60 HD1 PHE 60 -1.169 -36.609 23.989 507 HD2 PHE 60 HD2 PHE 60 -1.156 -40.456 22.159 508 HE1 PHE 60 HE1 PHE 60 -1.471 -37.656 26.191 509 HE2 PHE 60 HE2 PHE 60 -1.452 -41.509 24.369 510 HZ PHE 60 HZ PHE 60 -1.614 -40.107 26.385 511 H ASN 61 HN ASN 61 -0.022 -38.812 18.696 512 HA ASN 61 HA ASN 61 0.432 -36.220 17.357 513 1HB ASN 61 HB2 ASN 61 2.199 -37.722 16.688 514 2HB ASN 61 HB1 ASN 61 1.053 -39.023 16.381 515 1HD2 ASN 61 HD21 ASN 61 -0.163 -38.999 14.490 516 2HD2 ASN 61 HD22 ASN 61 0.220 -37.964 13.159 517 H VAL 62 HN VAL 62 -1.361 -35.417 16.531 518 HA VAL 62 HA VAL 62 -3.572 -37.234 15.828 519 HB VAL 62 HB VAL 62 -3.648 -34.252 16.392 520 1HG1 VAL 62 HG11 VAL 62 -5.903 -36.194 15.841 521 2HG1 VAL 62 HG12 VAL 62 -5.351 -34.904 14.772 522 3HG1 VAL 62 HG13 VAL 62 -6.096 -34.507 16.320 523 1HG2 VAL 62 HG21 VAL 62 -3.225 -35.575 18.414 524 2HG2 VAL 62 HG22 VAL 62 -4.640 -36.570 18.066 525 3HG2 VAL 62 HG23 VAL 62 -4.836 -34.859 18.449 526 H SER 63 HN SER 63 -3.778 -37.622 13.717 527 HA SER 63 HA SER 63 -3.082 -35.460 11.832 528 1HB SER 63 HB2 SER 63 -2.888 -38.455 11.401 529 2HB SER 63 HB1 SER 63 -2.533 -37.222 10.188 530 HG SER 63 HG SER 63 -1.175 -36.611 12.379 531 H MET 64 HN MET 64 -4.806 -34.585 10.969 532 HA MET 64 HA MET 64 -7.099 -36.248 10.212 533 1HB MET 64 HB2 MET 64 -8.688 -34.717 11.262 534 2HB MET 64 HB1 MET 64 -7.594 -35.372 12.473 535 1HG MET 64 HG2 MET 64 -6.268 -33.273 12.330 536 2HG MET 64 HG1 MET 64 -7.494 -32.623 11.244 537 1HE MET 64 HE1 MET 64 -10.067 -32.329 11.973 538 2HE MET 64 HE2 MET 64 -10.650 -32.578 13.619 539 3HE MET 64 HE3 MET 64 -10.153 -33.959 12.640 540 H GLU 65 HN GLU 65 -8.639 -34.974 8.832 541 HA GLU 65 HA GLU 65 -7.176 -33.605 6.791 542 1HB GLU 65 HB2 GLU 65 -10.181 -33.763 7.084 543 2HB GLU 65 HB1 GLU 65 -9.271 -33.444 5.617 544 1HG GLU 65 HG2 GLU 65 -8.400 -35.719 5.651 545 2HG GLU 65 HG1 GLU 65 -9.296 -36.042 7.140 546 H VAL 66 HN VAL 66 -7.304 -31.461 6.179 547 HA VAL 66 HA VAL 66 -9.120 -29.690 7.652 548 HB VAL 66 HB VAL 66 -7.366 -27.860 7.492 549 1HG1 VAL 66 HG11 VAL 66 -7.887 -28.940 9.621 550 2HG1 VAL 66 HG12 VAL 66 -6.170 -28.554 9.522 551 3HG1 VAL 66 HG13 VAL 66 -6.716 -30.213 9.277 552 1HG2 VAL 66 HG21 VAL 66 -5.891 -28.918 5.851 553 2HG2 VAL 66 HG22 VAL 66 -5.505 -30.197 7.004 554 3HG2 VAL 66 HG23 VAL 66 -5.011 -28.535 7.329 555 H SER 67 HN SER 67 -10.353 -28.553 6.300 556 HA SER 67 HA SER 67 -9.861 -28.824 3.438 557 1HB SER 67 HB2 SER 67 -12.095 -29.377 4.328 558 2HB SER 67 HB1 SER 67 -12.265 -27.732 4.935 559 HG SER 67 HG SER 67 -12.748 -28.705 2.463 560 H ASN 68 HN ASN 68 -10.065 -26.361 5.931 561 HA ASN 68 HA ASN 68 -8.925 -24.446 4.006 562 1HB ASN 68 HB2 ASN 68 -10.172 -22.614 5.075 563 2HB ASN 68 HB1 ASN 68 -11.259 -23.803 4.367 564 1HD2 ASN 68 HD21 ASN 68 -12.521 -25.047 5.688 565 2HD2 ASN 68 HD22 ASN 68 -12.740 -24.720 7.370 566 H GLU 69 HN GLU 69 -8.106 -22.479 5.322 567 HA GLU 69 HA GLU 69 -5.974 -23.577 6.927 568 1HB GLU 69 HB2 GLU 69 -5.556 -21.869 5.201 569 2HB GLU 69 HB1 GLU 69 -6.556 -20.726 6.085 570 1HG GLU 69 HG2 GLU 69 -4.966 -20.793 7.957 571 2HG GLU 69 HG1 GLU 69 -3.961 -21.924 7.049 572 H SER 70 HN SER 70 -8.923 -21.828 7.448 573 HA SER 70 HA SER 70 -8.371 -20.770 10.005 574 1HB SER 70 HB2 SER 70 -10.279 -20.048 8.571 575 2HB SER 70 HB1 SER 70 -11.069 -21.593 8.885 576 HG SER 70 HG SER 70 -10.232 -20.055 11.075 577 H GLU 71 HN GLU 71 -9.696 -23.885 8.941 578 HA GLU 71 HA GLU 71 -10.407 -24.924 11.433 579 1HB GLU 71 HB2 GLU 71 -9.395 -26.326 8.952 580 2HB GLU 71 HB1 GLU 71 -9.966 -27.188 10.374 581 1HG GLU 71 HG2 GLU 71 -12.162 -26.120 10.130 582 2HG GLU 71 HG1 GLU 71 -11.587 -25.286 8.687 583 H ARG 72 HN ARG 72 -7.279 -24.833 9.806 584 HA ARG 72 HA ARG 72 -5.850 -26.472 11.571 585 1HB ARG 72 HB2 ARG 72 -4.865 -25.875 9.475 586 2HB ARG 72 HB1 ARG 72 -4.964 -24.159 9.840 587 1HG ARG 72 HG2 ARG 72 -3.204 -24.276 11.399 588 2HG ARG 72 HG1 ARG 72 -3.285 -26.036 11.483 589 1HD ARG 72 HD2 ARG 72 -1.343 -25.141 10.188 590 2HD ARG 72 HD1 ARG 72 -2.367 -26.261 9.294 591 HE ARG 72 HE ARG 72 -3.411 -24.044 8.423 592 1HH1 ARG 72 HH11 ARG 72 -0.024 -24.535 9.155 593 2HH1 ARG 72 HH12 ARG 72 0.530 -23.513 7.863 594 1HH2 ARG 72 HH21 ARG 72 -2.666 -22.699 6.713 595 2HH2 ARG 72 HH22 ARG 72 -0.962 -22.466 6.497 596 H ASN 73 HN ASN 73 -6.946 -23.197 11.897 597 HA ASN 73 HA ASN 73 -5.340 -22.695 14.274 598 1HB ASN 73 HB2 ASN 73 -7.464 -21.055 12.861 599 2HB ASN 73 HB1 ASN 73 -6.666 -20.535 14.342 600 1HD2 ASN 73 HD21 ASN 73 -6.245 -21.194 10.938 601 2HD2 ASN 73 HD22 ASN 73 -4.747 -20.351 10.764 602 H GLU 74 HN GLU 74 -8.727 -23.225 13.406 603 HA GLU 74 HA GLU 74 -9.875 -22.892 15.929 604 1HB GLU 74 HB2 GLU 74 -11.228 -22.942 13.917 605 2HB GLU 74 HB1 GLU 74 -10.756 -24.606 13.591 606 1HG GLU 74 HG2 GLU 74 -11.937 -25.365 15.562 607 2HG GLU 74 HG1 GLU 74 -12.350 -23.702 15.987 608 H ILE 75 HN ILE 75 -8.998 -25.926 14.284 609 HA ILE 75 HA ILE 75 -9.588 -27.679 16.367 610 HB ILE 75 HB ILE 75 -7.437 -27.978 14.250 611 1HG1 ILE 75 HG12 ILE 75 -10.317 -28.928 14.232 612 2HG1 ILE 75 HG11 ILE 75 -9.726 -27.512 13.371 613 1HG2 ILE 75 HG21 ILE 75 -7.692 -30.396 14.605 614 2HG2 ILE 75 HG22 ILE 75 -8.826 -30.085 15.919 615 3HG2 ILE 75 HG23 ILE 75 -7.142 -29.585 16.071 616 1HD1 ILE 75 HD11 ILE 75 -9.972 -29.396 11.884 617 2HD1 ILE 75 HD12 ILE 75 -8.885 -30.356 12.887 618 3HD1 ILE 75 HD13 ILE 75 -8.274 -28.942 12.029 619 H PHE 76 HN PHE 76 -6.618 -25.944 15.600 620 HA PHE 76 HA PHE 76 -4.893 -27.011 17.497 621 1HB PHE 76 HB2 PHE 76 -4.130 -25.523 15.726 622 2HB PHE 76 HB1 PHE 76 -5.066 -24.192 16.395 623 HD1 PHE 76 HD1 PHE 76 -4.046 -22.696 17.856 624 HD2 PHE 76 HD2 PHE 76 -2.295 -26.536 17.257 625 HE1 PHE 76 HE1 PHE 76 -2.095 -22.017 19.192 626 HE2 PHE 76 HE2 PHE 76 -0.348 -25.855 18.590 627 HZ PHE 76 HZ PHE 76 -0.245 -23.598 19.560 628 H GLN 77 HN GLN 77 -7.211 -24.351 17.780 629 HA GLN 77 HA GLN 77 -6.594 -23.710 20.482 630 1HB GLN 77 HB2 GLN 77 -9.082 -23.169 18.850 631 2HB GLN 77 HB1 GLN 77 -8.761 -22.477 20.436 632 1HG GLN 77 HG2 GLN 77 -6.751 -21.378 19.536 633 2HG GLN 77 HG1 GLN 77 -7.115 -22.042 17.945 634 1HE2 GLN 77 HE21 GLN 77 -9.560 -20.870 20.157 635 2HE2 GLN 77 HE22 GLN 77 -10.010 -19.488 19.229 636 H LYS 78 HN LYS 78 -9.026 -25.785 18.958 637 HA LYS 78 HA LYS 78 -10.514 -26.485 21.217 638 1HB LYS 78 HB2 LYS 78 -9.824 -28.209 18.818 639 2HB LYS 78 HB1 LYS 78 -11.101 -28.553 19.976 640 1HG LYS 78 HG2 LYS 78 -10.997 -26.115 18.204 641 2HG LYS 78 HG1 LYS 78 -11.922 -27.576 17.860 642 1HD LYS 78 HD2 LYS 78 -13.222 -27.234 19.919 643 2HD LYS 78 HD1 LYS 78 -12.299 -25.767 20.258 644 1HE LYS 78 HE2 LYS 78 -13.127 -24.778 18.157 645 2HE LYS 78 HE1 LYS 78 -14.064 -26.239 17.850 646 1HZ LYS 78 HZ1 LYS 78 -14.431 -24.360 20.118 647 2HZ LYS 78 HZ2 LYS 78 -15.284 -25.806 19.920 648 3HZ LYS 78 HZ3 LYS 78 -15.464 -24.557 18.795 649 H ILE 79 HN ILE 79 -7.540 -27.840 19.905 650 HA ILE 79 HA ILE 79 -7.248 -30.001 21.685 651 HB ILE 79 HB ILE 79 -5.128 -28.430 20.196 652 1HG1 ILE 79 HG12 ILE 79 -6.498 -31.055 19.525 653 2HG1 ILE 79 HG11 ILE 79 -6.834 -29.509 18.756 654 1HG2 ILE 79 HG21 ILE 79 -3.674 -30.375 20.531 655 2HG2 ILE 79 HG22 ILE 79 -4.917 -31.137 21.524 656 3HG2 ILE 79 HG23 ILE 79 -4.142 -29.649 22.069 657 1HD1 ILE 79 HD11 ILE 79 -4.219 -30.998 18.652 658 2HD1 ILE 79 HD12 ILE 79 -4.559 -29.450 17.876 659 3HD1 ILE 79 HD13 ILE 79 -5.419 -30.902 17.364 660 H SER 80 HN SER 80 -6.541 -26.603 22.010 661 HA SER 80 HA SER 80 -4.837 -26.895 24.310 662 1HB SER 80 HB2 SER 80 -4.659 -24.998 22.718 663 2HB SER 80 HB1 SER 80 -6.243 -24.433 23.244 664 HG SER 80 HG SER 80 -4.367 -24.886 25.244 665 H GLN 81 HN GLN 81 -8.228 -26.797 23.759 666 HA GLN 81 HA GLN 81 -9.036 -25.590 26.214 667 1HB GLN 81 HB2 GLN 81 -10.595 -27.354 24.303 668 2HB GLN 81 HB1 GLN 81 -11.294 -26.406 25.613 669 1HG GLN 81 HG2 GLN 81 -10.522 -24.347 24.538 670 2HG GLN 81 HG1 GLN 81 -9.820 -25.294 23.230 671 1HE2 GLN 81 HE21 GLN 81 -12.060 -27.201 23.211 672 2HE2 GLN 81 HE22 GLN 81 -13.373 -26.366 22.462 673 H LEU 82 HN LEU 82 -7.723 -28.607 25.573 674 HA LEU 82 HA LEU 82 -9.293 -30.286 27.231 675 1HB LEU 82 HB2 LEU 82 -6.362 -30.726 26.697 676 2HB LEU 82 HB1 LEU 82 -7.618 -31.922 26.943 677 HG LEU 82 HG LEU 82 -7.360 -30.152 24.510 678 1HD1 LEU 82 HD11 LEU 82 -5.561 -31.779 24.626 679 2HD1 LEU 82 HD12 LEU 82 -6.693 -32.182 23.336 680 3HD1 LEU 82 HD13 LEU 82 -6.731 -33.080 24.854 681 1HD2 LEU 82 HD21 LEU 82 -9.081 -31.594 23.541 682 2HD2 LEU 82 HD22 LEU 82 -9.672 -30.727 24.957 683 3HD2 LEU 82 HD23 LEU 82 -9.244 -32.435 25.083 684 H ASP 83 HN ASP 83 -6.567 -28.182 27.845 685 HA ASP 83 HA ASP 83 -5.495 -27.488 29.719 686 1HB ASP 83 HB2 ASP 83 -7.697 -27.347 30.822 687 2HB ASP 83 HB1 ASP 83 -7.584 -29.046 31.270 688 H LYS 84 HN LYS 84 -6.389 -30.889 29.679 689 HA LYS 84 HA LYS 84 -4.363 -31.991 31.226 690 1HB LYS 84 HB2 LYS 84 -5.328 -33.287 28.674 691 2HB LYS 84 HB1 LYS 84 -4.851 -34.059 30.179 692 1HG LYS 84 HG2 LYS 84 -6.879 -33.262 31.264 693 2HG LYS 84 HG1 LYS 84 -7.341 -32.397 29.798 694 1HD LYS 84 HD2 LYS 84 -8.573 -34.301 29.508 695 2HD LYS 84 HD1 LYS 84 -7.083 -34.801 28.713 696 1HE LYS 84 HE2 LYS 84 -7.731 -36.603 30.115 697 2HE LYS 84 HE1 LYS 84 -6.383 -35.810 30.926 698 1HZ LYS 84 HZ1 LYS 84 -7.950 -34.669 32.356 699 2HZ LYS 84 HZ2 LYS 84 -8.166 -36.342 32.464 700 3HZ LYS 84 HZ3 LYS 84 -9.252 -35.407 31.565 701 H VAL 85 HN VAL 85 -4.302 -30.611 28.059 702 HA VAL 85 HA VAL 85 -1.718 -31.696 27.331 703 HB VAL 85 HB VAL 85 -3.419 -31.322 25.597 704 1HG1 VAL 85 HG11 VAL 85 -4.028 -29.048 24.896 705 2HG1 VAL 85 HG12 VAL 85 -3.132 -28.389 26.263 706 3HG1 VAL 85 HG13 VAL 85 -4.557 -29.391 26.544 707 1HG2 VAL 85 HG21 VAL 85 -1.010 -29.524 25.272 708 2HG2 VAL 85 HG22 VAL 85 -2.016 -30.149 23.964 709 3HG2 VAL 85 HG23 VAL 85 -1.065 -31.258 24.950 710 H VAL 86 HN VAL 86 0.217 -30.615 27.365 711 HA VAL 86 HA VAL 86 0.236 -28.008 28.749 712 HB VAL 86 HB VAL 86 2.580 -28.538 29.388 713 1HG1 VAL 86 HG11 VAL 86 0.535 -30.593 30.242 714 2HG1 VAL 86 HG12 VAL 86 0.751 -28.989 30.940 715 3HG1 VAL 86 HG13 VAL 86 2.023 -30.200 31.105 716 1HG2 VAL 86 HG21 VAL 86 3.410 -30.838 29.141 717 2HG2 VAL 86 HG22 VAL 86 3.134 -30.080 27.572 718 3HG2 VAL 86 HG23 VAL 86 1.976 -31.255 28.200 719 H GLN 87 HN GLN 87 1.172 -29.670 25.852 720 HA GLN 87 HA GLN 87 2.160 -27.140 24.767 721 1HB GLN 87 HB2 GLN 87 4.164 -28.373 25.500 722 2HB GLN 87 HB1 GLN 87 3.678 -29.753 24.524 723 1HG GLN 87 HG2 GLN 87 3.998 -28.522 22.497 724 2HG GLN 87 HG1 GLN 87 4.258 -27.021 23.382 725 1HE2 GLN 87 HE21 GLN 87 6.224 -26.698 24.445 726 2HE2 GLN 87 HE22 GLN 87 7.622 -27.653 24.105 727 H THR 88 HN THR 88 1.052 -26.715 23.024 728 HA THR 88 HA THR 88 -0.019 -28.913 21.369 729 HB THR 88 HB THR 88 -1.668 -27.183 20.564 730 HG1 THR 88 HG1 THR 88 -0.124 -25.456 21.563 731 1HG2 THR 88 HG21 THR 88 -1.681 -27.688 23.549 732 2HG2 THR 88 HG22 THR 88 -2.294 -28.790 22.315 733 3HG2 THR 88 HG23 THR 88 -3.076 -27.230 22.571 734 H LEU 89 HN LEU 89 0.948 -29.146 19.420 735 HA LEU 89 HA LEU 89 2.306 -26.805 18.250 736 1HB LEU 89 HB2 LEU 89 2.717 -29.759 17.764 737 2HB LEU 89 HB1 LEU 89 3.451 -28.507 16.782 738 HG LEU 89 HG LEU 89 4.542 -27.646 18.921 739 1HD1 LEU 89 HD11 LEU 89 3.123 -28.770 20.539 740 2HD1 LEU 89 HD12 LEU 89 4.802 -29.265 20.744 741 3HD1 LEU 89 HD13 LEU 89 3.657 -30.343 19.947 742 1HD2 LEU 89 HD21 LEU 89 5.758 -28.880 17.193 743 2HD2 LEU 89 HD22 LEU 89 5.291 -30.405 17.949 744 3HD2 LEU 89 HD23 LEU 89 6.346 -29.281 18.808 745 H GLY 90 HN GLY 90 1.437 -25.866 16.572 746 1HA GLY 90 HA2 GLY 90 -0.120 -27.404 14.622 747 2HA GLY 90 HA1 GLY 90 -0.887 -26.014 15.385 748 H SER 91 HN SER 91 1.842 -27.039 13.422 749 HA SER 91 HA SER 91 3.071 -24.622 12.920 750 1HB SER 91 HB2 SER 91 2.777 -26.985 11.044 751 2HB SER 91 HB1 SER 91 3.995 -25.717 10.921 752 HG SER 91 HG SER 91 4.757 -26.375 12.990 Start of MODEL 13 1 1H GLN 1 HT1 GLN 1 -1.690 -11.626 -16.490 2 2H GLN 1 HT2 GLN 1 -0.833 -12.978 -15.962 3 3H GLN 1 HT3 GLN 1 -1.012 -12.686 -17.620 4 HA GLN 1 HA GLN 1 1.198 -12.111 -16.905 5 1HB GLN 1 HB2 GLN 1 1.212 -9.737 -17.685 6 2HB GLN 1 HB1 GLN 1 0.291 -10.811 -18.730 7 1HG GLN 1 HG2 GLN 1 -1.791 -10.015 -17.688 8 2HG GLN 1 HG1 GLN 1 -0.851 -8.911 -16.685 9 1HE2 GLN 1 HE21 GLN 1 -2.931 -8.362 -18.653 10 2HE2 GLN 1 HE22 GLN 1 -2.225 -7.297 -19.817 11 H GLY 2 HN GLY 2 2.308 -11.864 -15.068 12 1HA GLY 2 HA2 GLY 2 1.707 -9.682 -13.260 13 2HA GLY 2 HA1 GLY 2 1.383 -11.277 -12.597 14 H HIS 3 HN HIS 3 3.527 -8.942 -12.451 15 HA HIS 3 HA HIS 3 5.860 -10.736 -12.231 16 1HB HIS 3 HB2 HIS 3 6.229 -8.936 -13.843 17 2HB HIS 3 HB1 HIS 3 5.727 -7.734 -12.664 18 HD1 HIS 3 HD1 HIS 3 8.636 -9.805 -13.709 19 HD2 HIS 3 HD2 HIS 3 7.659 -7.123 -10.688 20 HE1 HIS 3 HE1 HIS 3 10.819 -9.168 -12.638 21 HE2 HIS 3 HE2 HIS 3 10.215 -7.409 -10.938 22 H MET 4 HN MET 4 5.434 -11.460 -10.158 23 HA MET 4 HA MET 4 5.187 -9.450 -8.029 24 1HB MET 4 HB2 MET 4 4.657 -12.433 -7.956 25 2HB MET 4 HB1 MET 4 4.444 -11.334 -6.602 26 1HG MET 4 HG2 MET 4 2.305 -11.767 -7.536 27 2HG MET 4 HG1 MET 4 2.739 -10.110 -7.951 28 1HE MET 4 HE1 MET 4 2.869 -13.659 -10.907 29 2HE MET 4 HE2 MET 4 2.293 -13.782 -9.243 30 3HE MET 4 HE3 MET 4 4.002 -13.487 -9.566 31 HA PRO 5 HA PRO 5 9.580 -10.268 -7.239 32 1HB PRO 5 HB2 PRO 5 8.885 -8.571 -4.881 33 2HB PRO 5 HB1 PRO 5 10.220 -8.410 -6.029 34 1HG PRO 5 HG2 PRO 5 8.136 -6.761 -6.155 35 2HG PRO 5 HG1 PRO 5 8.883 -7.382 -7.640 36 1HD PRO 5 HD2 PRO 5 6.347 -8.245 -6.288 37 2HD PRO 5 HD1 PRO 5 6.689 -8.040 -8.021 38 H SER 6 HN SER 6 10.080 -12.183 -6.382 39 HA SER 6 HA SER 6 8.514 -13.251 -4.156 40 1HB SER 6 HB2 SER 6 9.819 -15.382 -4.776 41 2HB SER 6 HB1 SER 6 8.663 -14.776 -5.961 42 HG SER 6 HG SER 6 11.418 -14.092 -6.024 43 H ASP 7 HN ASP 7 10.756 -11.188 -3.986 44 HA ASP 7 HA ASP 7 13.052 -12.229 -2.817 45 1HB ASP 7 HB2 ASP 7 11.633 -9.599 -2.308 46 2HB ASP 7 HB1 ASP 7 13.237 -9.976 -1.690 47 H SER 8 HN SER 8 9.950 -11.415 -1.350 48 HA SER 8 HA SER 8 10.842 -12.686 1.162 49 1HB SER 8 HB2 SER 8 8.822 -10.451 0.780 50 2HB SER 8 HB1 SER 8 9.252 -11.189 2.325 51 HG SER 8 HG SER 8 10.371 -9.168 1.737 52 H LYS 9 HN LYS 9 9.739 -14.007 -1.130 53 HA LYS 9 HA LYS 9 7.026 -14.497 -1.172 54 1HB LYS 9 HB2 LYS 9 8.579 -15.353 -2.856 55 2HB LYS 9 HB1 LYS 9 9.291 -16.442 -1.677 56 1HG LYS 9 HG2 LYS 9 7.001 -17.517 -1.475 57 2HG LYS 9 HG1 LYS 9 6.538 -16.571 -2.891 58 1HD LYS 9 HD2 LYS 9 7.222 -18.807 -3.567 59 2HD LYS 9 HD1 LYS 9 8.378 -17.616 -4.168 60 1HE LYS 9 HE2 LYS 9 9.916 -18.147 -2.369 61 2HE LYS 9 HE1 LYS 9 8.746 -19.254 -1.655 62 1HZ LYS 9 HZ1 LYS 9 8.905 -20.628 -3.648 63 2HZ LYS 9 HZ2 LYS 9 10.411 -20.452 -2.896 64 3HZ LYS 9 HZ3 LYS 9 10.059 -19.576 -4.298 65 H LYS 10 HN LYS 10 5.612 -15.486 0.127 66 HA LYS 10 HA LYS 10 6.577 -17.093 2.384 67 1HB LYS 10 HB2 LYS 10 4.204 -15.408 1.884 68 2HB LYS 10 HB1 LYS 10 3.850 -16.918 2.704 69 1HG LYS 10 HG2 LYS 10 4.197 -15.031 4.250 70 2HG LYS 10 HG1 LYS 10 5.325 -16.354 4.520 71 1HD LYS 10 HD2 LYS 10 6.215 -14.144 2.730 72 2HD LYS 10 HD1 LYS 10 6.087 -13.786 4.451 73 1HE LYS 10 HE2 LYS 10 7.583 -15.659 4.959 74 2HE LYS 10 HE1 LYS 10 7.695 -16.046 3.244 75 1HZ LYS 10 HZ1 LYS 10 9.605 -14.816 3.801 76 2HZ LYS 10 HZ2 LYS 10 8.719 -13.633 4.619 77 3HZ LYS 10 HZ3 LYS 10 8.610 -13.759 2.935 78 HA PRO 11 HA PRO 11 5.582 -20.822 0.258 79 1HB PRO 11 HB2 PRO 11 5.255 -22.510 2.379 80 2HB PRO 11 HB1 PRO 11 6.834 -21.932 1.837 81 1HG PRO 11 HG2 PRO 11 5.126 -20.934 4.091 82 2HG PRO 11 HG1 PRO 11 6.878 -21.217 4.053 83 1HD PRO 11 HD2 PRO 11 5.809 -18.745 3.787 84 2HD PRO 11 HD1 PRO 11 7.304 -19.225 2.955 85 H THR 12 HN THR 12 3.730 -21.292 -0.719 86 HA THR 12 HA THR 12 1.164 -20.731 0.369 87 HB THR 12 HB THR 12 1.899 -22.422 -2.042 88 HG1 THR 12 HG1 THR 12 2.604 -20.258 -2.235 89 1HG2 THR 12 HG21 THR 12 -0.401 -21.977 -2.798 90 2HG2 THR 12 HG22 THR 12 -0.738 -21.143 -1.281 91 3HG2 THR 12 HG23 THR 12 -0.389 -22.872 -1.279 92 H ILE 13 HN ILE 13 0.152 -21.899 1.862 93 HA ILE 13 HA ILE 13 0.908 -24.692 2.298 94 HB ILE 13 HB ILE 13 -0.902 -22.933 3.977 95 1HG1 ILE 13 HG12 ILE 13 1.396 -22.027 3.867 96 2HG1 ILE 13 HG11 ILE 13 1.024 -22.645 5.475 97 1HG2 ILE 13 HG21 ILE 13 -0.510 -24.617 5.731 98 2HG2 ILE 13 HG22 ILE 13 0.428 -25.581 4.590 99 3HG2 ILE 13 HG23 ILE 13 -1.294 -25.319 4.316 100 1HD1 ILE 13 HD11 ILE 13 3.270 -23.243 4.845 101 2HD1 ILE 13 HD12 ILE 13 2.688 -24.014 3.369 102 3HD1 ILE 13 HD13 ILE 13 2.277 -24.697 4.944 103 H ILE 14 HN ILE 14 -0.445 -26.369 1.937 104 HA ILE 14 HA ILE 14 -2.638 -25.912 0.144 105 HB ILE 14 HB ILE 14 -1.674 -28.514 1.358 106 1HG1 ILE 14 HG12 ILE 14 0.109 -27.418 0.085 107 2HG1 ILE 14 HG11 ILE 14 -0.477 -28.832 -0.783 108 1HG2 ILE 14 HG21 ILE 14 -2.825 -29.568 -0.556 109 2HG2 ILE 14 HG22 ILE 14 -3.458 -27.989 -1.026 110 3HG2 ILE 14 HG23 ILE 14 -3.939 -28.712 0.510 111 1HD1 ILE 14 HD11 ILE 14 -1.789 -27.383 -2.248 112 2HD1 ILE 14 HD12 ILE 14 -0.072 -26.984 -2.288 113 3HD1 ILE 14 HD13 ILE 14 -1.192 -25.971 -1.378 114 H TYR 15 HN TYR 15 -4.673 -25.609 0.684 115 HA TYR 15 HA TYR 15 -5.807 -27.043 2.979 116 1HB TYR 15 HB2 TYR 15 -6.211 -24.114 2.317 117 2HB TYR 15 HB1 TYR 15 -7.292 -25.015 3.373 118 HD1 TYR 15 HD1 TYR 15 -6.373 -25.990 5.517 119 HD2 TYR 15 HD2 TYR 15 -4.160 -23.230 3.145 120 HE1 TYR 15 HE1 TYR 15 -4.927 -25.499 7.442 121 HE2 TYR 15 HE2 TYR 15 -2.710 -22.736 5.068 122 HH TYR 15 HH TYR 15 -2.649 -22.891 7.421 123 HA PRO 16 HA PRO 16 -7.565 -27.876 3.662 124 1HB PRO 16 HB2 PRO 16 -8.882 -30.198 3.329 125 2HB PRO 16 HB1 PRO 16 -9.729 -28.652 3.427 126 1HG PRO 16 HG2 PRO 16 -9.018 -30.272 1.009 127 2HG PRO 16 HG1 PRO 16 -10.529 -29.419 1.376 128 1HD PRO 16 HD2 PRO 16 -8.572 -28.418 -0.269 129 2HD PRO 16 HD1 PRO 16 -9.711 -27.403 0.637 130 H CYS 17 HN CYS 17 -6.585 -29.735 4.680 131 HA CYS 17 HA CYS 17 -5.221 -31.753 3.200 132 1HB CYS 17 HB2 CYS 17 -3.749 -29.817 2.682 133 2HB CYS 17 HB1 CYS 17 -3.502 -29.559 4.405 134 HG CYS 17 HG CYS 17 -1.175 -30.709 3.733 135 H LEU 18 HN LEU 18 -3.822 -33.084 4.651 136 HA LEU 18 HA LEU 18 -5.048 -33.360 7.262 137 1HB LEU 18 HB2 LEU 18 -2.933 -34.968 5.817 138 2HB LEU 18 HB1 LEU 18 -3.551 -35.377 7.409 139 HG LEU 18 HG LEU 18 -5.307 -35.178 4.958 140 1HD1 LEU 18 HD11 LEU 18 -3.650 -36.934 4.601 141 2HD1 LEU 18 HD12 LEU 18 -5.244 -37.630 4.888 142 3HD1 LEU 18 HD13 LEU 18 -4.036 -37.637 6.173 143 1HD2 LEU 18 HD21 LEU 18 -6.884 -36.466 6.327 144 2HD2 LEU 18 HD22 LEU 18 -6.475 -34.928 7.086 145 3HD2 LEU 18 HD23 LEU 18 -5.749 -36.424 7.676 146 H TRP 19 HN TRP 19 -4.355 -32.016 8.789 147 HA TRP 19 HA TRP 19 -1.530 -31.243 8.915 148 1HB TRP 19 HB2 TRP 19 -3.417 -29.532 9.026 149 2HB TRP 19 HB1 TRP 19 -3.810 -30.187 10.611 150 HD1 TRP 19 HD1 TRP 19 -1.967 -29.773 12.583 151 HE1 TRP 19 HE1 TRP 19 -0.182 -27.945 12.858 152 HE3 TRP 19 HE3 TRP 19 -1.847 -28.026 7.774 153 HZ2 TRP 19 HZ2 TRP 19 1.096 -26.003 11.256 154 HZ3 TRP 19 HZ3 TRP 19 -0.319 -26.174 7.231 155 HH2 TRP 19 HH2 TRP 19 1.122 -25.184 8.938 156 H ASP 20 HN ASP 20 -0.242 -31.649 10.705 157 HA ASP 20 HA ASP 20 -1.174 -33.809 12.464 158 1HB ASP 20 HB2 ASP 20 1.598 -32.810 11.769 159 2HB ASP 20 HB1 ASP 20 1.305 -33.961 13.068 160 H TYR 21 HN TYR 21 -1.325 -33.606 14.619 161 HA TYR 21 HA TYR 21 -0.489 -31.068 15.874 162 1HB TYR 21 HB2 TYR 21 -2.961 -32.715 16.498 163 2HB TYR 21 HB1 TYR 21 -2.437 -31.292 17.391 164 HD1 TYR 21 HD1 TYR 21 -2.711 -29.057 16.456 165 HD2 TYR 21 HD2 TYR 21 -3.956 -32.501 14.278 166 HE1 TYR 21 HE1 TYR 21 -4.011 -27.624 14.935 167 HE2 TYR 21 HE2 TYR 21 -5.253 -31.074 12.757 168 HH TYR 21 HH TYR 21 -6.321 -28.849 12.801 169 H ARG 22 HN ARG 22 1.058 -31.407 17.328 170 HA ARG 22 HA ARG 22 1.504 -34.032 18.481 171 1HB ARG 22 HB2 ARG 22 3.406 -32.610 17.817 172 2HB ARG 22 HB1 ARG 22 2.894 -31.381 18.960 173 1HG ARG 22 HG2 ARG 22 4.715 -32.546 19.937 174 2HG ARG 22 HG1 ARG 22 3.258 -33.045 20.796 175 1HD ARG 22 HD2 ARG 22 3.203 -35.135 19.625 176 2HD ARG 22 HD1 ARG 22 4.490 -34.618 18.534 177 HE ARG 22 HE ARG 22 5.068 -34.790 21.401 178 1HH1 ARG 22 HH11 ARG 22 5.495 -36.098 18.178 179 2HH1 ARG 22 HH12 ARG 22 6.887 -37.043 18.616 180 1HH2 ARG 22 HH21 ARG 22 6.898 -36.025 21.975 181 2HH2 ARG 22 HH22 ARG 22 7.689 -36.998 20.770 182 H VAL 23 HN VAL 23 0.225 -34.651 20.102 183 HA VAL 23 HA VAL 23 -0.780 -32.629 22.005 184 HB VAL 23 HB VAL 23 -1.932 -35.379 21.455 185 1HG1 VAL 23 HG11 VAL 23 -3.066 -33.012 22.957 186 2HG1 VAL 23 HG12 VAL 23 -2.466 -34.509 23.672 187 3HG1 VAL 23 HG13 VAL 23 -3.903 -34.534 22.650 188 1HG2 VAL 23 HG21 VAL 23 -2.846 -32.702 20.384 189 2HG2 VAL 23 HG22 VAL 23 -3.699 -34.234 20.190 190 3HG2 VAL 23 HG23 VAL 23 -2.116 -34.008 19.447 191 H ILE 24 HN ILE 24 0.585 -32.621 23.709 192 HA ILE 24 HA ILE 24 1.606 -35.187 24.723 193 HB ILE 24 HB ILE 24 2.488 -32.372 25.421 194 1HG1 ILE 24 HG12 ILE 24 3.791 -34.440 23.616 195 2HG1 ILE 24 HG11 ILE 24 2.977 -32.976 23.070 196 1HG2 ILE 24 HG21 ILE 24 4.426 -33.486 26.465 197 2HG2 ILE 24 HG22 ILE 24 3.702 -35.056 26.116 198 3HG2 ILE 24 HG23 ILE 24 2.909 -33.948 27.235 199 1HD1 ILE 24 HD11 ILE 24 5.477 -33.097 24.743 200 2HD1 ILE 24 HD12 ILE 24 4.656 -31.625 24.224 201 3HD1 ILE 24 HD13 ILE 24 5.375 -32.701 23.027 202 H MET 25 HN MET 25 0.127 -36.041 26.072 203 HA MET 25 HA MET 25 -1.028 -34.307 28.170 204 1HB MET 25 HB2 MET 25 -2.134 -36.899 27.043 205 2HB MET 25 HB1 MET 25 -2.859 -35.967 28.348 206 1HG MET 25 HG2 MET 25 -2.894 -34.039 26.611 207 2HG MET 25 HG1 MET 25 -2.698 -35.330 25.430 208 1HE MET 25 HE1 MET 25 -4.512 -37.247 25.009 209 2HE MET 25 HE2 MET 25 -5.951 -37.452 26.012 210 3HE MET 25 HE3 MET 25 -4.347 -37.717 26.700 211 H THR 26 HN THR 26 -1.309 -35.255 30.284 212 HA THR 26 HA THR 26 0.883 -37.070 30.985 213 HB THR 26 HB THR 26 0.189 -36.409 33.362 214 HG1 THR 26 HG1 THR 26 -1.533 -35.203 33.548 215 1HG2 THR 26 HG21 THR 26 1.287 -34.215 33.224 216 2HG2 THR 26 HG22 THR 26 1.084 -34.223 31.474 217 3HG2 THR 26 HG23 THR 26 2.130 -35.417 32.243 218 H THR 27 HN THR 27 -1.444 -38.113 29.636 219 HA THR 27 HA THR 27 -2.243 -40.152 31.532 220 HB THR 27 HB THR 27 -3.941 -38.399 31.925 221 HG1 THR 27 HG1 THR 27 -5.241 -40.044 32.158 222 1HG2 THR 27 HG21 THR 27 -5.495 -37.753 30.140 223 2HG2 THR 27 HG22 THR 27 -4.580 -38.715 28.983 224 3HG2 THR 27 HG23 THR 27 -3.843 -37.298 29.732 225 H LYS 28 HN LYS 28 -3.179 -41.985 30.500 226 HA LYS 28 HA LYS 28 -2.648 -42.185 27.628 227 1HB LYS 28 HB2 LYS 28 -3.319 -44.265 29.729 228 2HB LYS 28 HB1 LYS 28 -3.133 -44.636 28.020 229 1HG LYS 28 HG2 LYS 28 -0.955 -43.342 29.647 230 2HG LYS 28 HG1 LYS 28 -1.134 -45.089 29.507 231 1HD LYS 28 HD2 LYS 28 -0.986 -43.381 27.040 232 2HD LYS 28 HD1 LYS 28 0.484 -43.827 27.900 233 1HE LYS 28 HE2 LYS 28 0.079 -45.395 26.097 234 2HE LYS 28 HE1 LYS 28 -0.103 -46.206 27.649 235 1HZ LYS 28 HZ1 LYS 28 -1.835 -46.849 26.113 236 2HZ LYS 28 HZ2 LYS 28 -2.324 -45.246 25.918 237 3HZ LYS 28 HZ3 LYS 28 -2.508 -46.015 27.415 238 H ASP 29 HN ASP 29 -5.155 -41.419 29.687 239 HA ASP 29 HA ASP 29 -7.277 -42.717 28.212 240 1HB ASP 29 HB2 ASP 29 -7.533 -42.390 30.638 241 2HB ASP 29 HB1 ASP 29 -7.423 -40.644 30.422 242 H THR 30 HN THR 30 -6.894 -41.868 26.151 243 HA THR 30 HA THR 30 -7.378 -39.019 25.780 244 HB THR 30 HB THR 30 -5.588 -39.849 24.426 245 HG1 THR 30 HG1 THR 30 -6.702 -39.643 22.229 246 1HG2 THR 30 HG21 THR 30 -6.138 -42.237 24.433 247 2HG2 THR 30 HG22 THR 30 -5.838 -41.662 22.794 248 3HG2 THR 30 HG23 THR 30 -7.492 -41.939 23.341 249 H SER 31 HN SER 31 -9.482 -38.621 26.103 250 HA SER 31 HA SER 31 -11.444 -40.107 24.479 251 1HB SER 31 HB2 SER 31 -13.062 -39.577 26.393 252 2HB SER 31 HB1 SER 31 -11.827 -40.789 26.735 253 HG SER 31 HG SER 31 -11.052 -39.539 28.234 254 H THR 32 HN THR 32 -11.294 -37.166 26.477 255 HA THR 32 HA THR 32 -13.064 -35.577 25.093 256 HB THR 32 HB THR 32 -10.520 -34.516 26.350 257 HG1 THR 32 HG1 THR 32 -11.632 -34.675 28.341 258 1HG2 THR 32 HG21 THR 32 -11.962 -32.640 27.017 259 2HG2 THR 32 HG22 THR 32 -13.343 -33.412 26.239 260 3HG2 THR 32 HG23 THR 32 -11.985 -32.849 25.266 261 H LEU 33 HN LEU 33 -9.681 -36.224 24.419 262 HA LEU 33 HA LEU 33 -9.160 -34.283 22.487 263 1HB LEU 33 HB2 LEU 33 -7.418 -35.671 23.495 264 2HB LEU 33 HB1 LEU 33 -8.085 -37.100 22.731 265 HG LEU 33 HG LEU 33 -7.503 -36.182 20.511 266 1HD1 LEU 33 HD11 LEU 33 -6.050 -34.217 20.340 267 2HD1 LEU 33 HD12 LEU 33 -6.229 -33.934 22.073 268 3HD1 LEU 33 HD13 LEU 33 -7.629 -33.809 21.007 269 1HD2 LEU 33 HD21 LEU 33 -5.075 -36.456 20.695 270 2HD2 LEU 33 HD22 LEU 33 -5.936 -37.669 21.641 271 3HD2 LEU 33 HD23 LEU 33 -5.187 -36.291 22.449 272 H LYS 34 HN LYS 34 -10.251 -37.654 22.036 273 HA LYS 34 HA LYS 34 -10.502 -37.458 19.229 274 1HB LYS 34 HB2 LYS 34 -11.838 -39.360 21.167 275 2HB LYS 34 HB1 LYS 34 -11.845 -39.545 19.418 276 1HG LYS 34 HG2 LYS 34 -9.399 -39.742 19.428 277 2HG LYS 34 HG1 LYS 34 -9.397 -39.573 21.186 278 1HD LYS 34 HD2 LYS 34 -10.721 -41.794 19.612 279 2HD LYS 34 HD1 LYS 34 -9.216 -41.922 20.524 280 1HE LYS 34 HE2 LYS 34 -10.449 -41.377 22.587 281 2HE LYS 34 HE1 LYS 34 -11.946 -41.316 21.661 282 1HZ LYS 34 HZ1 LYS 34 -10.210 -43.696 22.032 283 2HZ LYS 34 HZ2 LYS 34 -11.599 -43.653 21.072 284 3HZ LYS 34 HZ3 LYS 34 -11.723 -43.437 22.742 285 H GLU 35 HN GLU 35 -12.777 -36.953 21.883 286 HA GLU 35 HA GLU 35 -15.148 -36.809 20.450 287 1HB GLU 35 HB2 GLU 35 -14.309 -35.307 22.939 288 2HB GLU 35 HB1 GLU 35 -15.948 -35.284 22.299 289 1HG GLU 35 HG2 GLU 35 -14.441 -37.693 23.308 290 2HG GLU 35 HG1 GLU 35 -15.782 -36.873 24.106 291 H LEU 36 HN LEU 36 -12.855 -34.171 21.187 292 HA LEU 36 HA LEU 36 -14.375 -32.157 19.910 293 1HB LEU 36 HB2 LEU 36 -12.581 -30.711 20.298 294 2HB LEU 36 HB1 LEU 36 -12.453 -31.882 21.589 295 HG LEU 36 HG LEU 36 -10.754 -33.026 19.855 296 1HD1 LEU 36 HD11 LEU 36 -10.560 -30.080 19.210 297 2HD1 LEU 36 HD12 LEU 36 -11.052 -31.364 18.101 298 3HD1 LEU 36 HD13 LEU 36 -9.404 -31.324 18.726 299 1HD2 LEU 36 HD21 LEU 36 -10.242 -32.402 22.158 300 2HD2 LEU 36 HD22 LEU 36 -10.051 -30.718 21.670 301 3HD2 LEU 36 HD23 LEU 36 -8.932 -31.943 21.070 302 H LEU 37 HN LEU 37 -11.998 -34.455 18.751 303 HA LEU 37 HA LEU 37 -11.608 -33.304 16.176 304 1HB LEU 37 HB2 LEU 37 -11.356 -36.210 16.996 305 2HB LEU 37 HB1 LEU 37 -10.661 -35.474 15.563 306 HG LEU 37 HG LEU 37 -9.885 -34.788 18.404 307 1HD1 LEU 37 HD11 LEU 37 -8.446 -36.479 16.361 308 2HD1 LEU 37 HD12 LEU 37 -9.217 -37.057 17.838 309 3HD1 LEU 37 HD13 LEU 37 -7.814 -35.996 17.936 310 1HD2 LEU 37 HD21 LEU 37 -8.023 -33.587 17.379 311 2HD2 LEU 37 HD22 LEU 37 -9.570 -32.925 16.853 312 3HD2 LEU 37 HD23 LEU 37 -8.647 -33.972 15.773 313 H GLU 38 HN GLU 38 -13.841 -35.674 17.503 314 HA GLU 38 HA GLU 38 -14.896 -36.483 14.974 315 1HB GLU 38 HB2 GLU 38 -15.887 -36.990 17.787 316 2HB GLU 38 HB1 GLU 38 -16.535 -37.759 16.340 317 1HG GLU 38 HG2 GLU 38 -14.283 -38.700 15.889 318 2HG GLU 38 HG1 GLU 38 -13.728 -38.018 17.414 319 H THR 39 HN THR 39 -15.657 -33.904 17.163 320 HA THR 39 HA THR 39 -18.357 -33.514 16.451 321 HB THR 39 HB THR 39 -18.041 -31.139 17.154 322 HG1 THR 39 HG1 THR 39 -15.350 -31.935 17.058 323 1HG2 THR 39 HG21 THR 39 -18.577 -32.857 18.815 324 2HG2 THR 39 HG22 THR 39 -17.516 -31.624 19.498 325 3HG2 THR 39 HG23 THR 39 -16.859 -33.192 19.031 326 H TYR 40 HN TYR 40 -15.385 -32.718 14.808 327 HA TYR 40 HA TYR 40 -16.579 -30.994 12.848 328 1HB TYR 40 HB2 TYR 40 -13.932 -32.479 12.824 329 2HB TYR 40 HB1 TYR 40 -14.416 -31.272 11.635 330 HD1 TYR 40 HD1 TYR 40 -14.351 -28.910 12.166 331 HD2 TYR 40 HD2 TYR 40 -13.429 -31.812 15.142 332 HE1 TYR 40 HE1 TYR 40 -13.456 -27.133 13.617 333 HE2 TYR 40 HE2 TYR 40 -12.535 -30.043 16.595 334 HH TYR 40 HH TYR 40 -13.006 -26.709 15.925 335 H GLN 41 HN GLN 41 -16.674 -34.275 13.426 336 HA GLN 41 HA GLN 41 -17.569 -36.048 12.357 337 1HB GLN 41 HB2 GLN 41 -18.693 -33.973 10.459 338 2HB GLN 41 HB1 GLN 41 -19.274 -35.624 10.654 339 1HG GLN 41 HG2 GLN 41 -19.366 -33.427 12.720 340 2HG GLN 41 HG1 GLN 41 -20.730 -34.084 11.818 341 1HE2 GLN 41 HE21 GLN 41 -20.187 -33.955 14.729 342 2HE2 GLN 41 HE22 GLN 41 -20.309 -35.583 15.294 343 H ARG 42 HN ARG 42 -14.926 -35.056 11.617 344 HA ARG 42 HA ARG 42 -14.728 -36.180 8.896 345 1HB ARG 42 HB2 ARG 42 -12.729 -34.887 8.555 346 2HB ARG 42 HB1 ARG 42 -13.985 -33.798 9.124 347 1HG ARG 42 HG2 ARG 42 -13.011 -33.637 11.274 348 2HG ARG 42 HG1 ARG 42 -11.935 -35.002 10.970 349 1HD ARG 42 HD2 ARG 42 -10.587 -33.082 10.772 350 2HD ARG 42 HD1 ARG 42 -10.901 -33.608 9.123 351 HE ARG 42 HE ARG 42 -11.875 -31.191 10.424 352 1HH1 ARG 42 HH11 ARG 42 -12.086 -33.282 7.604 353 2HH1 ARG 42 HH12 ARG 42 -12.602 -32.002 6.553 354 1HH2 ARG 42 HH21 ARG 42 -12.501 -29.506 9.009 355 2HH2 ARG 42 HH22 ARG 42 -12.835 -29.873 7.347 356 HA PRO 43 HA PRO 43 -12.183 -39.442 10.590 357 1HB PRO 43 HB2 PRO 43 -10.472 -39.934 8.538 358 2HB PRO 43 HB1 PRO 43 -12.177 -40.395 8.482 359 1HG PRO 43 HG2 PRO 43 -10.826 -37.999 7.284 360 2HG PRO 43 HG1 PRO 43 -12.036 -39.078 6.562 361 1HD PRO 43 HD2 PRO 43 -12.683 -36.662 7.609 362 2HD PRO 43 HD1 PRO 43 -13.795 -38.046 7.655 363 H PHE 44 HN PHE 44 -10.069 -39.885 11.404 364 HA PHE 44 HA PHE 44 -7.961 -37.937 11.035 365 1HB PHE 44 HB2 PHE 44 -7.718 -37.444 13.445 366 2HB PHE 44 HB1 PHE 44 -9.256 -36.870 12.814 367 HD1 PHE 44 HD1 PHE 44 -7.626 -39.271 15.054 368 HD2 PHE 44 HD2 PHE 44 -11.355 -37.907 13.500 369 HE1 PHE 44 HE1 PHE 44 -8.811 -40.482 16.836 370 HE2 PHE 44 HE2 PHE 44 -12.540 -39.120 15.282 371 HZ PHE 44 HZ PHE 44 -11.269 -40.408 16.951 372 H LYS 45 HN LYS 45 -5.974 -38.582 12.159 373 HA LYS 45 HA LYS 45 -5.804 -41.503 12.539 374 1HB LYS 45 HB2 LYS 45 -4.610 -40.660 10.534 375 2HB LYS 45 HB1 LYS 45 -3.668 -39.587 11.558 376 1HG LYS 45 HG2 LYS 45 -2.703 -41.549 12.698 377 2HG LYS 45 HG1 LYS 45 -3.624 -42.605 11.624 378 1HD LYS 45 HD2 LYS 45 -1.336 -42.383 10.819 379 2HD LYS 45 HD1 LYS 45 -2.453 -41.624 9.682 380 1HE LYS 45 HE2 LYS 45 -1.934 -39.427 10.696 381 2HE LYS 45 HE1 LYS 45 -0.764 -40.213 11.754 382 1HZ LYS 45 HZ1 LYS 45 0.270 -39.184 9.817 383 2HZ LYS 45 HZ2 LYS 45 -0.632 -40.178 8.787 384 3HZ LYS 45 HZ3 LYS 45 0.514 -40.858 9.830 385 H LEU 46 HN LEU 46 -5.879 -41.765 14.701 386 HA LEU 46 HA LEU 46 -4.418 -39.964 16.477 387 1HB LEU 46 HB2 LEU 46 -6.691 -40.653 17.106 388 2HB LEU 46 HB1 LEU 46 -6.206 -42.339 17.066 389 HG LEU 46 HG LEU 46 -4.605 -41.856 18.940 390 1HD1 LEU 46 HD11 LEU 46 -4.896 -39.808 20.236 391 2HD1 LEU 46 HD12 LEU 46 -6.049 -39.207 19.044 392 3HD1 LEU 46 HD13 LEU 46 -4.361 -39.449 18.594 393 1HD2 LEU 46 HD21 LEU 46 -6.322 -41.795 20.682 394 2HD2 LEU 46 HD22 LEU 46 -6.780 -42.876 19.366 395 3HD2 LEU 46 HD23 LEU 46 -7.518 -41.279 19.491 396 H GLU 47 HN GLU 47 -2.376 -40.386 17.025 397 HA GLU 47 HA GLU 47 -1.452 -43.195 17.033 398 1HB GLU 47 HB2 GLU 47 0.214 -40.791 16.247 399 2HB GLU 47 HB1 GLU 47 0.689 -42.482 16.166 400 1HG GLU 47 HG2 GLU 47 -1.013 -42.861 14.435 401 2HG GLU 47 HG1 GLU 47 -1.436 -41.148 14.499 402 H PHE 48 HN PHE 48 -0.291 -43.823 18.798 403 HA PHE 48 HA PHE 48 0.595 -41.736 20.686 404 1HB PHE 48 HB2 PHE 48 -0.896 -43.371 21.732 405 2HB PHE 48 HB1 PHE 48 0.112 -44.696 21.158 406 HD1 PHE 48 HD1 PHE 48 1.393 -45.680 22.805 407 HD2 PHE 48 HD2 PHE 48 0.657 -41.488 23.014 408 HE1 PHE 48 HE1 PHE 48 2.732 -45.547 24.863 409 HE2 PHE 48 HE2 PHE 48 1.994 -41.354 25.071 410 HZ PHE 48 HZ PHE 48 3.035 -43.385 25.999 411 H LYS 49 HN LYS 49 2.646 -41.202 20.310 412 HA LYS 49 HA LYS 49 4.352 -42.897 18.749 413 1HB LYS 49 HB2 LYS 49 4.921 -40.265 20.137 414 2HB LYS 49 HB1 LYS 49 6.015 -41.067 19.015 415 1HG LYS 49 HG2 LYS 49 3.264 -40.000 18.377 416 2HG LYS 49 HG1 LYS 49 4.805 -39.289 17.891 417 1HD LYS 49 HD2 LYS 49 5.311 -41.237 16.526 418 2HD LYS 49 HD1 LYS 49 3.838 -42.038 17.076 419 1HE LYS 49 HE2 LYS 49 2.511 -40.216 16.035 420 2HE LYS 49 HE1 LYS 49 4.007 -39.523 15.409 421 1HZ LYS 49 HZ1 LYS 49 2.766 -40.946 13.808 422 2HZ LYS 49 HZ2 LYS 49 3.101 -42.281 14.796 423 3HZ LYS 49 HZ3 LYS 49 4.366 -41.432 14.069 424 H ASN 50 HN ASN 50 4.934 -41.404 21.945 425 HA ASN 50 HA ASN 50 5.766 -43.810 23.184 426 1HB ASN 50 HB2 ASN 50 7.680 -43.363 21.537 427 2HB ASN 50 HB1 ASN 50 8.059 -41.940 22.497 428 1HD2 ASN 50 HD21 ASN 50 9.658 -44.325 21.961 429 2HD2 ASN 50 HD22 ASN 50 10.058 -44.988 23.511 430 H THR 51 HN THR 51 6.486 -43.432 25.383 431 HA THR 51 HA THR 51 5.471 -40.928 26.468 432 HB THR 51 HB THR 51 4.809 -43.081 27.514 433 HG1 THR 51 HG1 THR 51 5.067 -41.023 28.718 434 1HG2 THR 51 HG21 THR 51 7.717 -43.270 28.328 435 2HG2 THR 51 HG22 THR 51 6.897 -44.330 27.183 436 3HG2 THR 51 HG23 THR 51 6.419 -44.329 28.880 437 H SER 52 HN SER 52 6.719 -39.500 27.700 438 HA SER 52 HA SER 52 9.413 -39.206 26.875 439 1HB SER 52 HB2 SER 52 7.906 -37.740 29.061 440 2HB SER 52 HB1 SER 52 9.416 -37.218 28.311 441 HG SER 52 HG SER 52 8.112 -37.386 26.265 442 H LYS 53 HN LYS 53 10.383 -41.145 27.532 443 HA LYS 53 HA LYS 53 11.642 -42.504 28.815 444 1HB LYS 53 HB2 LYS 53 12.289 -39.859 30.130 445 2HB LYS 53 HB1 LYS 53 13.228 -41.334 30.334 446 1HG LYS 53 HG2 LYS 53 13.594 -41.354 27.860 447 2HG LYS 53 HG1 LYS 53 12.818 -39.774 27.787 448 1HD LYS 53 HD2 LYS 53 15.275 -40.392 29.437 449 2HD LYS 53 HD1 LYS 53 15.317 -39.701 27.816 450 1HE LYS 53 HE2 LYS 53 15.531 -37.861 29.255 451 2HE LYS 53 HE1 LYS 53 13.846 -37.834 28.750 452 1HZ LYS 53 HZ1 LYS 53 14.118 -37.424 31.128 453 2HZ LYS 53 HZ2 LYS 53 14.838 -38.943 31.322 454 3HZ LYS 53 HZ3 LYS 53 13.222 -38.827 30.849 455 H ASN 54 HN ASN 54 10.833 -40.268 31.467 456 HA ASN 54 HA ASN 54 10.508 -42.547 33.230 457 1HB ASN 54 HB2 ASN 54 11.776 -40.506 33.892 458 2HB ASN 54 HB1 ASN 54 10.281 -39.582 33.825 459 1HD2 ASN 54 HD21 ASN 54 10.460 -39.018 35.987 460 2HD2 ASN 54 HD22 ASN 54 10.147 -40.138 37.265 461 H ALA 55 HN ALA 55 8.480 -41.899 31.108 462 HA ALA 55 HA ALA 55 6.239 -42.020 30.800 463 1HB ALA 55 HB1 ALA 55 6.451 -43.981 32.252 464 2HB ALA 55 HB2 ALA 55 4.909 -43.161 32.504 465 3HB ALA 55 HB3 ALA 55 6.219 -42.959 33.669 466 H LYS 56 HN LYS 56 7.531 -39.584 31.997 467 HA LYS 56 HA LYS 56 5.711 -38.381 33.819 468 1HB LYS 56 HB2 LYS 56 8.140 -37.761 33.530 469 2HB LYS 56 HB1 LYS 56 7.704 -36.984 32.014 470 1HG LYS 56 HG2 LYS 56 7.876 -35.319 33.742 471 2HG LYS 56 HG1 LYS 56 6.186 -35.477 33.258 472 1HD LYS 56 HD2 LYS 56 6.329 -35.321 35.674 473 2HD LYS 56 HD1 LYS 56 5.787 -36.938 35.219 474 1HE LYS 56 HE2 LYS 56 8.138 -37.731 35.477 475 2HE LYS 56 HE1 LYS 56 8.575 -36.127 36.064 476 1HZ LYS 56 HZ1 LYS 56 6.880 -36.461 37.841 477 2HZ LYS 56 HZ2 LYS 56 8.201 -37.513 37.934 478 3HZ LYS 56 HZ3 LYS 56 6.724 -38.067 37.334 479 H PHE 57 HN PHE 57 6.149 -38.238 30.332 480 HA PHE 57 HA PHE 57 3.499 -36.987 30.069 481 1HB PHE 57 HB2 PHE 57 5.946 -36.257 28.427 482 2HB PHE 57 HB1 PHE 57 4.323 -35.615 28.200 483 HD1 PHE 57 HD1 PHE 57 7.447 -34.962 29.604 484 HD2 PHE 57 HD2 PHE 57 3.287 -34.532 30.412 485 HE1 PHE 57 HE1 PHE 57 7.941 -33.148 31.187 486 HE2 PHE 57 HE2 PHE 57 3.783 -32.714 31.992 487 HZ PHE 57 HZ PHE 57 6.109 -32.020 32.381 488 H TYR 58 HN TYR 58 2.363 -37.568 28.175 489 HA TYR 58 HA TYR 58 3.460 -39.906 26.746 490 1HB TYR 58 HB2 TYR 58 0.564 -39.313 27.439 491 2HB TYR 58 HB1 TYR 58 1.136 -40.711 26.530 492 HD1 TYR 58 HD1 TYR 58 2.672 -42.367 27.690 493 HD2 TYR 58 HD2 TYR 58 0.559 -39.340 29.815 494 HE1 TYR 58 HE1 TYR 58 3.040 -43.589 29.788 495 HE2 TYR 58 HE2 TYR 58 0.923 -40.560 31.920 496 HH TYR 58 HH TYR 58 3.168 -42.982 32.269 497 H SER 59 HN SER 59 3.923 -39.455 24.716 498 HA SER 59 HA SER 59 2.910 -37.019 23.510 499 1HB SER 59 HB2 SER 59 4.968 -38.991 22.479 500 2HB SER 59 HB1 SER 59 4.649 -37.380 21.836 501 HG SER 59 HG SER 59 6.099 -38.143 24.042 502 H PHE 60 HN PHE 60 1.030 -37.134 22.502 503 HA PHE 60 HA PHE 60 0.439 -39.419 20.744 504 1HB PHE 60 HB2 PHE 60 -1.379 -37.226 21.798 505 2HB PHE 60 HB1 PHE 60 -1.882 -38.504 20.698 506 HD1 PHE 60 HD1 PHE 60 -1.160 -37.619 24.143 507 HD2 PHE 60 HD2 PHE 60 -1.993 -40.846 21.487 508 HE1 PHE 60 HE1 PHE 60 -1.718 -39.053 26.060 509 HE2 PHE 60 HE2 PHE 60 -2.551 -42.282 23.405 510 HZ PHE 60 HZ PHE 60 -2.414 -41.386 25.695 511 H ASN 61 HN ASN 61 -0.399 -38.945 18.620 512 HA ASN 61 HA ASN 61 0.164 -36.254 17.582 513 1HB ASN 61 HB2 ASN 61 2.103 -37.742 17.047 514 2HB ASN 61 HB1 ASN 61 1.006 -38.822 16.194 515 1HD2 ASN 61 HD21 ASN 61 0.136 -38.173 14.204 516 2HD2 ASN 61 HD22 ASN 61 0.786 -36.840 13.311 517 H VAL 62 HN VAL 62 -1.576 -35.510 16.580 518 HA VAL 62 HA VAL 62 -3.577 -37.433 15.581 519 HB VAL 62 HB VAL 62 -3.986 -34.604 16.592 520 1HG1 VAL 62 HG11 VAL 62 -6.388 -35.040 16.303 521 2HG1 VAL 62 HG12 VAL 62 -6.016 -36.602 15.574 522 3HG1 VAL 62 HG13 VAL 62 -5.525 -35.112 14.766 523 1HG2 VAL 62 HG21 VAL 62 -3.561 -36.194 18.398 524 2HG2 VAL 62 HG22 VAL 62 -4.827 -37.256 17.781 525 3HG2 VAL 62 HG23 VAL 62 -5.246 -35.665 18.416 526 H SER 63 HN SER 63 -3.660 -37.535 13.436 527 HA SER 63 HA SER 63 -3.032 -35.126 11.857 528 1HB SER 63 HB2 SER 63 -3.253 -37.975 10.850 529 2HB SER 63 HB1 SER 63 -2.552 -36.587 10.013 530 HG SER 63 HG SER 63 -0.942 -36.538 11.664 531 H MET 64 HN MET 64 -4.840 -34.007 11.413 532 HA MET 64 HA MET 64 -7.186 -35.486 10.427 533 1HB MET 64 HB2 MET 64 -8.716 -34.136 11.713 534 2HB MET 64 HB1 MET 64 -7.562 -34.868 12.818 535 1HG MET 64 HG2 MET 64 -6.307 -32.745 12.875 536 2HG MET 64 HG1 MET 64 -7.521 -32.022 11.819 537 1HE MET 64 HE1 MET 64 -10.171 -33.427 12.969 538 2HE MET 64 HE2 MET 64 -10.121 -31.708 12.581 539 3HE MET 64 HE3 MET 64 -10.716 -32.239 14.154 540 H GLU 65 HN GLU 65 -8.661 -34.124 9.185 541 HA GLU 65 HA GLU 65 -7.214 -32.516 7.321 542 1HB GLU 65 HB2 GLU 65 -10.214 -32.758 7.556 543 2HB GLU 65 HB1 GLU 65 -9.282 -32.335 6.128 544 1HG GLU 65 HG2 GLU 65 -8.421 -34.575 5.964 545 2HG GLU 65 HG1 GLU 65 -9.194 -35.022 7.487 546 H VAL 66 HN VAL 66 -7.282 -30.326 7.002 547 HA VAL 66 HA VAL 66 -9.088 -28.700 8.658 548 HB VAL 66 HB VAL 66 -7.303 -26.941 8.801 549 1HG1 VAL 66 HG11 VAL 66 -7.779 -28.373 10.713 550 2HG1 VAL 66 HG12 VAL 66 -6.058 -28.004 10.635 551 3HG1 VAL 66 HG13 VAL 66 -6.644 -29.583 10.114 552 1HG2 VAL 66 HG21 VAL 66 -4.956 -27.592 8.454 553 2HG2 VAL 66 HG22 VAL 66 -5.878 -27.696 6.955 554 3HG2 VAL 66 HG23 VAL 66 -5.480 -29.165 7.849 555 H SER 67 HN SER 67 -10.266 -27.337 7.457 556 HA SER 67 HA SER 67 -9.869 -27.311 4.596 557 1HB SER 67 HB2 SER 67 -12.130 -27.521 5.559 558 2HB SER 67 HB1 SER 67 -11.967 -25.928 6.292 559 HG SER 67 HG SER 67 -12.708 -25.187 4.487 560 H ASN 68 HN ASN 68 -9.175 -25.236 7.258 561 HA ASN 68 HA ASN 68 -7.681 -23.444 5.609 562 1HB ASN 68 HB2 ASN 68 -8.909 -21.376 6.312 563 2HB ASN 68 HB1 ASN 68 -9.822 -22.402 5.215 564 1HD2 ASN 68 HD21 ASN 68 -11.783 -21.555 5.866 565 2HD2 ASN 68 HD22 ASN 68 -12.490 -21.916 7.404 566 H GLU 69 HN GLU 69 -6.948 -21.501 7.090 567 HA GLU 69 HA GLU 69 -5.509 -22.696 9.215 568 1HB GLU 69 HB2 GLU 69 -4.711 -20.742 7.879 569 2HB GLU 69 HB1 GLU 69 -5.906 -19.738 8.693 570 1HG GLU 69 HG2 GLU 69 -4.828 -20.174 10.840 571 2HG GLU 69 HG1 GLU 69 -3.650 -21.218 10.047 572 H SER 70 HN SER 70 -8.491 -20.887 9.059 573 HA SER 70 HA SER 70 -8.821 -20.199 11.736 574 1HB SER 70 HB2 SER 70 -10.303 -19.441 9.877 575 2HB SER 70 HB1 SER 70 -10.999 -21.058 9.805 576 HG SER 70 HG SER 70 -11.623 -20.746 12.034 577 H GLU 71 HN GLU 71 -9.578 -23.223 10.040 578 HA GLU 71 HA GLU 71 -10.774 -24.493 12.275 579 1HB GLU 71 HB2 GLU 71 -9.705 -25.503 9.652 580 2HB GLU 71 HB1 GLU 71 -10.203 -26.636 10.904 581 1HG GLU 71 HG2 GLU 71 -12.437 -25.624 10.928 582 2HG GLU 71 HG1 GLU 71 -11.936 -24.504 9.666 583 H ARG 72 HN ARG 72 -7.450 -24.669 10.937 584 HA ARG 72 HA ARG 72 -6.547 -26.622 12.739 585 1HB ARG 72 HB2 ARG 72 -4.298 -26.018 12.158 586 2HB ARG 72 HB1 ARG 72 -5.285 -25.905 10.706 587 1HG ARG 72 HG2 ARG 72 -5.301 -23.525 10.809 588 2HG ARG 72 HG1 ARG 72 -4.564 -23.527 12.410 589 1HD ARG 72 HD2 ARG 72 -3.263 -24.482 9.856 590 2HD ARG 72 HD1 ARG 72 -2.936 -22.954 10.673 591 HE ARG 72 HE ARG 72 -1.915 -25.545 11.357 592 1HH1 ARG 72 HH11 ARG 72 -2.760 -22.413 12.714 593 2HH1 ARG 72 HH12 ARG 72 -1.608 -22.534 14.004 594 1HH2 ARG 72 HH21 ARG 72 -0.400 -25.673 13.079 595 2HH2 ARG 72 HH22 ARG 72 -0.296 -24.366 14.217 596 H ASN 73 HN ASN 73 -6.803 -23.128 13.059 597 HA ASN 73 HA ASN 73 -5.397 -22.980 15.548 598 1HB ASN 73 HB2 ASN 73 -7.343 -21.027 14.284 599 2HB ASN 73 HB1 ASN 73 -6.345 -20.685 15.693 600 1HD2 ASN 73 HD21 ASN 73 -6.388 -19.294 13.181 601 2HD2 ASN 73 HD22 ASN 73 -4.795 -19.413 12.519 602 H GLU 74 HN GLU 74 -8.808 -23.111 14.615 603 HA GLU 74 HA GLU 74 -9.981 -22.893 17.136 604 1HB GLU 74 HB2 GLU 74 -11.283 -22.796 15.080 605 2HB GLU 74 HB1 GLU 74 -10.871 -24.462 14.700 606 1HG GLU 74 HG2 GLU 74 -12.149 -25.252 16.584 607 2HG GLU 74 HG1 GLU 74 -12.486 -23.598 17.093 608 H ILE 75 HN ILE 75 -9.096 -25.811 15.338 609 HA ILE 75 HA ILE 75 -9.712 -27.721 17.276 610 HB ILE 75 HB ILE 75 -7.550 -27.827 15.147 611 1HG1 ILE 75 HG12 ILE 75 -10.372 -28.908 14.985 612 2HG1 ILE 75 HG11 ILE 75 -9.940 -27.303 14.413 613 1HG2 ILE 75 HG21 ILE 75 -8.939 -30.078 16.615 614 2HG2 ILE 75 HG22 ILE 75 -7.260 -29.581 16.827 615 3HG2 ILE 75 HG23 ILE 75 -7.788 -30.265 15.290 616 1HD1 ILE 75 HD11 ILE 75 -8.849 -29.908 13.385 617 2HD1 ILE 75 HD12 ILE 75 -8.377 -28.302 12.823 618 3HD1 ILE 75 HD13 ILE 75 -10.032 -28.868 12.590 619 H PHE 76 HN PHE 76 -6.671 -26.016 16.605 620 HA PHE 76 HA PHE 76 -4.983 -27.252 18.413 621 1HB PHE 76 HB2 PHE 76 -4.157 -25.655 16.784 622 2HB PHE 76 HB1 PHE 76 -5.070 -24.353 17.535 623 HD1 PHE 76 HD1 PHE 76 -4.142 -23.081 19.287 624 HD2 PHE 76 HD2 PHE 76 -2.255 -26.710 18.086 625 HE1 PHE 76 HE1 PHE 76 -2.198 -22.533 20.688 626 HE2 PHE 76 HE2 PHE 76 -0.309 -26.161 19.488 627 HZ PHE 76 HZ PHE 76 -0.279 -24.072 20.790 628 H GLN 77 HN GLN 77 -7.352 -24.699 18.975 629 HA GLN 77 HA GLN 77 -6.510 -24.130 21.644 630 1HB GLN 77 HB2 GLN 77 -9.110 -23.519 20.213 631 2HB GLN 77 HB1 GLN 77 -8.653 -22.865 21.782 632 1HG GLN 77 HG2 GLN 77 -6.803 -21.671 20.810 633 2HG GLN 77 HG1 GLN 77 -7.079 -22.432 19.246 634 1HE2 GLN 77 HE21 GLN 77 -8.810 -21.757 17.986 635 2HE2 GLN 77 HE22 GLN 77 -9.648 -20.275 18.278 636 H LYS 78 HN LYS 78 -9.039 -26.128 20.189 637 HA LYS 78 HA LYS 78 -10.332 -26.830 22.600 638 1HB LYS 78 HB2 LYS 78 -10.233 -28.447 20.043 639 2HB LYS 78 HB1 LYS 78 -11.433 -28.579 21.324 640 1HG LYS 78 HG2 LYS 78 -11.900 -26.076 20.798 641 2HG LYS 78 HG1 LYS 78 -11.070 -26.424 19.285 642 1HD LYS 78 HD2 LYS 78 -12.662 -28.147 18.731 643 2HD LYS 78 HD1 LYS 78 -13.436 -27.998 20.309 644 1HE LYS 78 HE2 LYS 78 -14.038 -25.650 19.725 645 2HE LYS 78 HE1 LYS 78 -13.385 -25.927 18.111 646 1HZ LYS 78 HZ1 LYS 78 -15.810 -26.210 18.238 647 2HZ LYS 78 HZ2 LYS 78 -15.595 -27.495 19.317 648 3HZ LYS 78 HZ3 LYS 78 -15.023 -27.620 17.734 649 H ILE 79 HN ILE 79 -7.671 -28.277 20.809 650 HA ILE 79 HA ILE 79 -7.428 -30.668 22.248 651 HB ILE 79 HB ILE 79 -5.265 -29.049 20.876 652 1HG1 ILE 79 HG12 ILE 79 -6.875 -31.435 19.924 653 2HG1 ILE 79 HG11 ILE 79 -7.106 -29.774 19.393 654 1HG2 ILE 79 HG21 ILE 79 -3.961 -31.125 20.827 655 2HG2 ILE 79 HG22 ILE 79 -5.204 -31.929 21.786 656 3HG2 ILE 79 HG23 ILE 79 -4.279 -30.596 22.479 657 1HD1 ILE 79 HD11 ILE 79 -4.863 -29.781 18.416 658 2HD1 ILE 79 HD12 ILE 79 -5.880 -31.055 17.746 659 3HD1 ILE 79 HD13 ILE 79 -4.645 -31.452 18.941 660 H SER 80 HN SER 80 -6.432 -27.410 23.039 661 HA SER 80 HA SER 80 -4.807 -28.264 25.280 662 1HB SER 80 HB2 SER 80 -4.266 -26.238 23.932 663 2HB SER 80 HB1 SER 80 -5.733 -25.477 24.543 664 HG SER 80 HG SER 80 -3.627 -26.451 26.191 665 H GLN 81 HN GLN 81 -8.106 -27.638 24.691 666 HA GLN 81 HA GLN 81 -8.773 -26.682 27.329 667 1HB GLN 81 HB2 GLN 81 -10.491 -27.545 24.992 668 2HB GLN 81 HB1 GLN 81 -11.139 -26.931 26.511 669 1HG GLN 81 HG2 GLN 81 -9.969 -24.814 26.160 670 2HG GLN 81 HG1 GLN 81 -9.311 -25.425 24.644 671 1HE2 GLN 81 HE21 GLN 81 -11.789 -26.798 23.912 672 2HE2 GLN 81 HE22 GLN 81 -12.892 -25.560 23.430 673 H LEU 82 HN LEU 82 -7.749 -29.606 26.492 674 HA LEU 82 HA LEU 82 -9.755 -31.274 27.711 675 1HB LEU 82 HB2 LEU 82 -6.885 -32.099 27.373 676 2HB LEU 82 HB1 LEU 82 -8.330 -33.087 27.294 677 HG LEU 82 HG LEU 82 -7.413 -31.107 25.207 678 1HD1 LEU 82 HD11 LEU 82 -7.073 -33.078 23.802 679 2HD1 LEU 82 HD12 LEU 82 -7.503 -34.120 25.159 680 3HD1 LEU 82 HD13 LEU 82 -6.055 -33.115 25.243 681 1HD2 LEU 82 HD21 LEU 82 -9.260 -31.946 23.843 682 2HD2 LEU 82 HD22 LEU 82 -9.838 -31.159 25.309 683 3HD2 LEU 82 HD23 LEU 82 -9.824 -32.920 25.201 684 H ASP 83 HN ASP 83 -7.067 -29.414 28.765 685 HA ASP 83 HA ASP 83 -6.186 -28.922 30.795 686 1HB ASP 83 HB2 ASP 83 -8.449 -29.019 31.744 687 2HB ASP 83 HB1 ASP 83 -8.307 -30.762 31.940 688 H LYS 84 HN LYS 84 -6.828 -32.315 30.152 689 HA LYS 84 HA LYS 84 -4.833 -33.415 31.836 690 1HB LYS 84 HB2 LYS 84 -5.801 -34.698 29.279 691 2HB LYS 84 HB1 LYS 84 -5.303 -35.482 30.774 692 1HG LYS 84 HG2 LYS 84 -7.309 -34.677 31.891 693 2HG LYS 84 HG1 LYS 84 -7.793 -33.812 30.434 694 1HD LYS 84 HD2 LYS 84 -9.050 -35.710 30.199 695 2HD LYS 84 HD1 LYS 84 -7.596 -36.204 29.338 696 1HE LYS 84 HE2 LYS 84 -6.802 -37.411 31.284 697 2HE LYS 84 HE1 LYS 84 -8.161 -36.826 32.242 698 1HZ LYS 84 HZ1 LYS 84 -8.589 -39.057 31.517 699 2HZ LYS 84 HZ2 LYS 84 -8.317 -38.651 29.901 700 3HZ LYS 84 HZ3 LYS 84 -9.653 -38.017 30.719 701 H VAL 85 HN VAL 85 -4.641 -31.629 29.001 702 HA VAL 85 HA VAL 85 -2.124 -32.805 28.095 703 HB VAL 85 HB VAL 85 -3.802 -32.317 26.386 704 1HG1 VAL 85 HG11 VAL 85 -3.550 -29.436 27.254 705 2HG1 VAL 85 HG12 VAL 85 -4.961 -30.473 27.470 706 3HG1 VAL 85 HG13 VAL 85 -4.443 -30.013 25.848 707 1HG2 VAL 85 HG21 VAL 85 -1.439 -32.178 25.770 708 2HG2 VAL 85 HG22 VAL 85 -1.421 -30.464 26.188 709 3HG2 VAL 85 HG23 VAL 85 -2.407 -31.035 24.840 710 H VAL 86 HN VAL 86 -0.189 -31.823 28.320 711 HA VAL 86 HA VAL 86 -0.114 -29.402 29.981 712 HB VAL 86 HB VAL 86 2.241 -29.977 30.421 713 1HG1 VAL 86 HG11 VAL 86 0.507 -30.817 31.918 714 2HG1 VAL 86 HG12 VAL 86 1.835 -31.970 31.791 715 3HG1 VAL 86 HG13 VAL 86 0.327 -32.260 30.923 716 1HG2 VAL 86 HG21 VAL 86 1.695 -32.432 28.736 717 2HG2 VAL 86 HG22 VAL 86 3.154 -32.134 29.679 718 3HG2 VAL 86 HG23 VAL 86 2.766 -31.096 28.309 719 H GLN 87 HN GLN 87 0.708 -30.607 26.825 720 HA GLN 87 HA GLN 87 1.547 -27.956 25.998 721 1HB GLN 87 HB2 GLN 87 3.628 -29.025 26.825 722 2HB GLN 87 HB1 GLN 87 3.388 -30.346 25.688 723 1HG GLN 87 HG2 GLN 87 3.639 -28.819 23.819 724 2HG GLN 87 HG1 GLN 87 3.796 -27.458 24.927 725 1HE2 GLN 87 HE21 GLN 87 5.825 -26.920 24.141 726 2HE2 GLN 87 HE22 GLN 87 7.236 -27.860 24.482 727 H THR 88 HN THR 88 0.784 -27.530 24.049 728 HA THR 88 HA THR 88 0.074 -29.753 22.239 729 HB THR 88 HB THR 88 -1.697 -28.179 21.345 730 HG1 THR 88 HG1 THR 88 -0.826 -26.243 22.250 731 1HG2 THR 88 HG21 THR 88 -2.295 -30.001 22.875 732 2HG2 THR 88 HG22 THR 88 -3.294 -28.575 23.163 733 3HG2 THR 88 HG23 THR 88 -1.963 -28.955 24.256 734 H LEU 89 HN LEU 89 1.358 -29.761 20.486 735 HA LEU 89 HA LEU 89 2.422 -27.191 19.506 736 1HB LEU 89 HB2 LEU 89 3.443 -29.990 18.967 737 2HB LEU 89 HB1 LEU 89 4.117 -28.521 18.297 738 HG LEU 89 HG LEU 89 5.564 -29.163 20.046 739 1HD1 LEU 89 HD11 LEU 89 3.756 -27.016 21.150 740 2HD1 LEU 89 HD12 LEU 89 5.086 -26.778 20.015 741 3HD1 LEU 89 HD13 LEU 89 5.417 -27.339 21.654 742 1HD2 LEU 89 HD21 LEU 89 3.169 -29.432 21.864 743 2HD2 LEU 89 HD22 LEU 89 4.856 -29.683 22.312 744 3HD2 LEU 89 HD23 LEU 89 4.083 -30.765 21.155 745 H GLY 90 HN GLY 90 1.012 -26.432 18.069 746 1HA GLY 90 HA2 GLY 90 -0.075 -28.235 16.004 747 2HA GLY 90 HA1 GLY 90 -0.658 -26.616 16.370 748 H SER 91 HN SER 91 2.270 -25.836 16.557 749 HA SER 91 HA SER 91 3.158 -25.978 13.803 750 1HB SER 91 HB2 SER 91 3.597 -23.419 14.057 751 2HB SER 91 HB1 SER 91 1.981 -23.956 13.615 752 HG SER 91 HG SER 91 2.834 -23.389 16.269 Start of MODEL 14 1 1H GLN 1 HT1 GLN 1 2.755 -15.851 17.580 2 2H GLN 1 HT2 GLN 1 1.676 -15.646 18.863 3 3H GLN 1 HT3 GLN 1 2.441 -14.304 18.179 4 HA GLN 1 HA GLN 1 0.555 -16.077 16.765 5 1HB GLN 1 HB2 GLN 1 -1.022 -14.145 16.915 6 2HB GLN 1 HB1 GLN 1 -0.655 -14.879 18.467 7 1HG GLN 1 HG2 GLN 1 -0.592 -12.624 18.949 8 2HG GLN 1 HG1 GLN 1 1.109 -13.003 18.693 9 1HE2 GLN 1 HE21 GLN 1 1.643 -10.898 18.187 10 2HE2 GLN 1 HE22 GLN 1 1.169 -10.143 16.706 11 H GLY 2 HN GLY 2 -0.477 -14.135 15.104 12 1HA GLY 2 HA2 GLY 2 0.019 -12.749 13.299 13 2HA GLY 2 HA1 GLY 2 1.720 -12.812 13.738 14 H HIS 3 HN HIS 3 0.827 -13.047 11.094 15 HA HIS 3 HA HIS 3 0.634 -15.802 10.334 16 1HB HIS 3 HB2 HIS 3 -0.334 -13.983 8.950 17 2HB HIS 3 HB1 HIS 3 1.290 -13.390 8.615 18 HD1 HIS 3 HD1 HIS 3 2.595 -14.546 6.762 19 HD2 HIS 3 HD2 HIS 3 -0.958 -16.485 7.706 20 HE1 HIS 3 HE1 HIS 3 2.286 -16.296 4.986 21 HE2 HIS 3 HE2 HIS 3 0.043 -17.328 5.478 22 H MET 4 HN MET 4 2.298 -17.101 10.706 23 HA MET 4 HA MET 4 4.948 -16.500 11.067 24 1HB MET 4 HB2 MET 4 5.428 -18.868 10.549 25 2HB MET 4 HB1 MET 4 4.024 -18.694 11.593 26 1HG MET 4 HG2 MET 4 2.548 -19.027 9.665 27 2HG MET 4 HG1 MET 4 3.956 -19.198 8.619 28 1HE MET 4 HE1 MET 4 1.961 -20.752 11.641 29 2HE MET 4 HE2 MET 4 3.587 -20.570 12.296 30 3HE MET 4 HE3 MET 4 2.932 -22.179 12.000 31 HA PRO 5 HA PRO 5 6.316 -15.221 7.009 32 1HB PRO 5 HB2 PRO 5 9.042 -15.683 8.060 33 2HB PRO 5 HB1 PRO 5 8.302 -14.190 7.473 34 1HG PRO 5 HG2 PRO 5 8.800 -14.577 10.086 35 2HG PRO 5 HG1 PRO 5 7.372 -13.681 9.531 36 1HD PRO 5 HD2 PRO 5 7.572 -16.522 10.488 37 2HD PRO 5 HD1 PRO 5 6.336 -15.296 10.850 38 H SER 6 HN SER 6 5.648 -17.016 5.828 39 HA SER 6 HA SER 6 7.186 -19.451 5.789 40 1HB SER 6 HB2 SER 6 5.022 -18.501 3.885 41 2HB SER 6 HB1 SER 6 5.622 -20.155 4.049 42 HG SER 6 HG SER 6 4.935 -19.828 6.371 43 H ASP 7 HN ASP 7 8.040 -20.280 3.663 44 HA ASP 7 HA ASP 7 9.998 -18.482 2.646 45 1HB ASP 7 HB2 ASP 7 9.153 -21.231 1.679 46 2HB ASP 7 HB1 ASP 7 10.572 -20.362 1.105 47 H SER 8 HN SER 8 10.219 -17.668 0.522 48 HA SER 8 HA SER 8 7.836 -16.870 -0.801 49 1HB SER 8 HB2 SER 8 9.943 -15.563 -0.910 50 2HB SER 8 HB1 SER 8 10.694 -16.865 -1.829 51 HG SER 8 HG SER 8 9.698 -14.963 -2.985 52 H LYS 9 HN LYS 9 6.758 -17.800 -2.469 53 HA LYS 9 HA LYS 9 5.960 -19.445 -3.797 54 1HB LYS 9 HB2 LYS 9 7.964 -19.193 -5.153 55 2HB LYS 9 HB1 LYS 9 8.881 -20.214 -4.055 56 1HG LYS 9 HG2 LYS 9 8.321 -21.477 -6.020 57 2HG LYS 9 HG1 LYS 9 7.419 -22.118 -4.649 58 1HD LYS 9 HD2 LYS 9 5.822 -22.059 -6.344 59 2HD LYS 9 HD1 LYS 9 5.509 -20.567 -5.460 60 1HE LYS 9 HE2 LYS 9 7.142 -20.791 -7.993 61 2HE LYS 9 HE1 LYS 9 5.465 -20.260 -7.911 62 1HZ LYS 9 HZ1 LYS 9 6.917 -18.374 -8.046 63 2HZ LYS 9 HZ2 LYS 9 7.810 -18.889 -6.706 64 3HZ LYS 9 HZ3 LYS 9 6.203 -18.397 -6.513 65 H LYS 10 HN LYS 10 4.747 -20.528 -2.353 66 HA LYS 10 HA LYS 10 5.998 -22.624 -0.717 67 1HB LYS 10 HB2 LYS 10 3.286 -21.295 -0.478 68 2HB LYS 10 HB1 LYS 10 3.824 -22.629 0.530 69 1HG LYS 10 HG2 LYS 10 4.740 -21.187 1.951 70 2HG LYS 10 HG1 LYS 10 5.825 -20.621 0.681 71 1HD LYS 10 HD2 LYS 10 3.020 -19.580 1.135 72 2HD LYS 10 HD1 LYS 10 4.489 -18.805 1.736 73 1HE LYS 10 HE2 LYS 10 5.262 -18.379 -0.484 74 2HE LYS 10 HE1 LYS 10 3.998 -19.391 -1.181 75 1HZ LYS 10 HZ1 LYS 10 3.489 -16.878 0.320 76 2HZ LYS 10 HZ2 LYS 10 2.351 -17.813 -0.513 77 3HZ LYS 10 HZ3 LYS 10 3.554 -16.990 -1.366 78 HA PRO 11 HA PRO 11 4.437 -25.758 -3.422 79 1HB PRO 11 HB2 PRO 11 3.979 -27.738 -1.529 80 2HB PRO 11 HB1 PRO 11 5.548 -27.391 -2.264 81 1HG PRO 11 HG2 PRO 11 4.453 -26.498 0.379 82 2HG PRO 11 HG1 PRO 11 6.088 -27.057 -0.029 83 1HD PRO 11 HD2 PRO 11 5.552 -24.451 0.277 84 2HD PRO 11 HD1 PRO 11 6.686 -25.011 -0.971 85 H THR 12 HN THR 12 2.482 -26.238 -4.211 86 HA THR 12 HA THR 12 0.128 -25.185 -3.025 87 HB THR 12 HB THR 12 0.366 -27.108 -5.361 88 HG1 THR 12 HG1 THR 12 1.540 -25.253 -5.824 89 1HG2 THR 12 HG21 THR 12 -1.917 -26.942 -4.467 90 2HG2 THR 12 HG22 THR 12 -1.800 -26.174 -6.050 91 3HG2 THR 12 HG23 THR 12 -1.843 -25.183 -4.592 92 H ILE 13 HN ILE 13 -0.784 -26.095 -1.301 93 HA ILE 13 HA ILE 13 -0.526 -28.933 -0.780 94 HB ILE 13 HB ILE 13 -2.017 -26.820 0.799 95 1HG1 ILE 13 HG12 ILE 13 0.418 -26.356 0.590 96 2HG1 ILE 13 HG11 ILE 13 -0.046 -26.738 2.248 97 1HG2 ILE 13 HG21 ILE 13 -1.154 -29.618 1.561 98 2HG2 ILE 13 HG22 ILE 13 -2.809 -29.073 1.287 99 3HG2 ILE 13 HG23 ILE 13 -1.887 -28.441 2.651 100 1HD1 ILE 13 HD11 ILE 13 1.295 -28.603 0.296 101 2HD1 ILE 13 HD12 ILE 13 0.819 -29.013 1.946 102 3HD1 ILE 13 HD13 ILE 13 2.055 -27.787 1.664 103 H ILE 14 HN ILE 14 -1.898 -30.362 -1.573 104 HA ILE 14 HA ILE 14 -4.325 -29.518 -2.886 105 HB ILE 14 HB ILE 14 -3.223 -32.315 -2.500 106 1HG1 ILE 14 HG12 ILE 14 -1.656 -30.905 -3.754 107 2HG1 ILE 14 HG11 ILE 14 -2.394 -32.097 -4.819 108 1HG2 ILE 14 HG21 ILE 14 -5.607 -32.337 -2.987 109 2HG2 ILE 14 HG22 ILE 14 -4.693 -32.925 -4.376 110 3HG2 ILE 14 HG23 ILE 14 -5.353 -31.288 -4.383 111 1HD1 ILE 14 HD11 ILE 14 -2.239 -29.963 -5.927 112 2HD1 ILE 14 HD12 ILE 14 -3.122 -29.183 -4.618 113 3HD1 ILE 14 HD13 ILE 14 -3.933 -30.364 -5.646 114 H TYR 15 HN TYR 15 -6.105 -29.171 -1.750 115 HA TYR 15 HA TYR 15 -6.732 -30.866 0.567 116 1HB TYR 15 HB2 TYR 15 -7.879 -28.210 -0.344 117 2HB TYR 15 HB1 TYR 15 -8.514 -29.135 1.012 118 HD1 TYR 15 HD1 TYR 15 -7.413 -29.124 3.137 119 HD2 TYR 15 HD2 TYR 15 -5.597 -27.204 -0.203 120 HE1 TYR 15 HE1 TYR 15 -5.798 -28.041 4.643 121 HE2 TYR 15 HE2 TYR 15 -3.984 -26.113 1.297 122 HH TYR 15 HH TYR 15 -3.507 -27.064 4.490 123 HA PRO 16 HA PRO 16 -8.485 -31.493 1.705 124 1HB PRO 16 HB2 PRO 16 -9.664 -33.856 2.173 125 2HB PRO 16 HB1 PRO 16 -10.603 -32.392 1.867 126 1HG PRO 16 HG2 PRO 16 -9.935 -34.638 0.001 127 2HG PRO 16 HG1 PRO 16 -11.472 -33.774 0.205 128 1HD PRO 16 HD2 PRO 16 -9.648 -33.249 -1.796 129 2HD PRO 16 HD1 PRO 16 -10.832 -32.074 -1.191 130 H CYS 17 HN CYS 17 -7.292 -32.879 3.106 131 HA CYS 17 HA CYS 17 -5.857 -35.160 2.146 132 1HB CYS 17 HB2 CYS 17 -3.585 -34.101 2.370 133 2HB CYS 17 HB1 CYS 17 -4.512 -33.531 0.988 134 HG CYS 17 HG CYS 17 -4.315 -31.045 1.548 135 H LEU 18 HN LEU 18 -4.322 -35.971 3.782 136 HA LEU 18 HA LEU 18 -5.352 -35.570 6.456 137 1HB LEU 18 HB2 LEU 18 -3.213 -37.383 5.321 138 2HB LEU 18 HB1 LEU 18 -3.627 -37.338 7.026 139 HG LEU 18 HG LEU 18 -5.630 -37.998 4.867 140 1HD1 LEU 18 HD11 LEU 18 -3.986 -39.894 6.552 141 2HD1 LEU 18 HD12 LEU 18 -3.852 -39.663 4.808 142 3HD1 LEU 18 HD13 LEU 18 -5.323 -40.351 5.495 143 1HD2 LEU 18 HD21 LEU 18 -6.905 -38.939 6.741 144 2HD2 LEU 18 HD22 LEU 18 -6.598 -37.218 6.956 145 3HD2 LEU 18 HD23 LEU 18 -5.653 -38.400 7.861 146 H TRP 19 HN TRP 19 -4.703 -33.697 7.359 147 HA TRP 19 HA TRP 19 -1.904 -32.874 7.110 148 1HB TRP 19 HB2 TRP 19 -3.814 -31.210 6.841 149 2HB TRP 19 HB1 TRP 19 -4.112 -31.394 8.568 150 HD1 TRP 19 HD1 TRP 19 -2.321 -30.309 10.248 151 HE1 TRP 19 HE1 TRP 19 -0.469 -28.558 9.905 152 HE3 TRP 19 HE3 TRP 19 -2.103 -30.336 5.136 153 HZ2 TRP 19 HZ2 TRP 19 0.897 -27.341 7.762 154 HZ3 TRP 19 HZ3 TRP 19 -0.493 -28.846 4.018 155 HH2 TRP 19 HH2 TRP 19 0.974 -27.380 5.307 156 H ASP 20 HN ASP 20 -0.504 -32.778 8.830 157 HA ASP 20 HA ASP 20 -1.268 -34.411 11.141 158 1HB ASP 20 HB2 ASP 20 1.127 -34.716 11.503 159 2HB ASP 20 HB1 ASP 20 0.707 -35.118 9.844 160 H TYR 21 HN TYR 21 -1.254 -33.674 13.173 161 HA TYR 21 HA TYR 21 -0.382 -30.902 13.669 162 1HB TYR 21 HB2 TYR 21 -2.776 -32.349 14.841 163 2HB TYR 21 HB1 TYR 21 -2.208 -30.766 15.362 164 HD1 TYR 21 HD1 TYR 21 -2.478 -28.801 13.900 165 HD2 TYR 21 HD2 TYR 21 -3.986 -32.618 12.757 166 HE1 TYR 21 HE1 TYR 21 -3.859 -27.731 12.169 167 HE2 TYR 21 HE2 TYR 21 -5.369 -31.556 11.023 168 HH TYR 21 HH TYR 21 -6.351 -29.362 10.530 169 H ARG 22 HN ARG 22 1.304 -30.882 14.949 170 HA ARG 22 HA ARG 22 1.978 -33.138 16.644 171 1HB ARG 22 HB2 ARG 22 3.772 -32.120 15.399 172 2HB ARG 22 HB1 ARG 22 3.370 -30.527 16.018 173 1HG ARG 22 HG2 ARG 22 5.349 -31.313 17.111 174 2HG ARG 22 HG1 ARG 22 4.033 -31.280 18.284 175 1HD ARG 22 HD2 ARG 22 3.765 -33.667 18.130 176 2HD ARG 22 HD1 ARG 22 4.926 -33.755 16.802 177 HE ARG 22 HE ARG 22 5.927 -32.634 19.287 178 1HH1 ARG 22 HH11 ARG 22 5.625 -35.483 17.282 179 2HH1 ARG 22 HH12 ARG 22 6.947 -36.313 18.037 180 1HH2 ARG 22 HH21 ARG 22 7.666 -33.695 20.267 181 2HH2 ARG 22 HH22 ARG 22 8.115 -35.291 19.751 182 H VAL 23 HN VAL 23 1.085 -33.302 18.577 183 HA VAL 23 HA VAL 23 0.556 -30.852 20.146 184 HB VAL 23 HB VAL 23 -0.988 -33.455 20.316 185 1HG1 VAL 23 HG11 VAL 23 -1.537 -30.725 21.491 186 2HG1 VAL 23 HG12 VAL 23 -1.012 -32.158 22.375 187 3HG1 VAL 23 HG13 VAL 23 -2.602 -32.128 21.612 188 1HG2 VAL 23 HG21 VAL 23 -1.739 -30.905 18.880 189 2HG2 VAL 23 HG22 VAL 23 -2.823 -32.266 19.166 190 3HG2 VAL 23 HG23 VAL 23 -1.403 -32.470 18.140 191 H ILE 24 HN ILE 24 1.296 -30.832 22.241 192 HA ILE 24 HA ILE 24 2.155 -33.391 23.423 193 HB ILE 24 HB ILE 24 3.711 -30.794 23.640 194 1HG1 ILE 24 HG12 ILE 24 4.415 -33.425 22.298 195 2HG1 ILE 24 HG11 ILE 24 4.082 -31.901 21.483 196 1HG2 ILE 24 HG21 ILE 24 4.260 -33.497 24.885 197 2HG2 ILE 24 HG22 ILE 24 3.728 -32.047 25.738 198 3HG2 ILE 24 HG23 ILE 24 5.316 -32.085 24.975 199 1HD1 ILE 24 HD11 ILE 24 6.074 -30.926 22.512 200 2HD1 ILE 24 HD12 ILE 24 6.456 -32.354 21.550 201 3HD1 ILE 24 HD13 ILE 24 6.409 -32.464 23.308 202 H MET 25 HN MET 25 1.112 -33.742 25.264 203 HA MET 25 HA MET 25 0.297 -31.431 26.910 204 1HB MET 25 HB2 MET 25 -1.320 -33.942 26.374 205 2HB MET 25 HB1 MET 25 -1.743 -32.717 27.560 206 1HG MET 25 HG2 MET 25 -1.813 -31.064 25.656 207 2HG MET 25 HG1 MET 25 -1.679 -32.444 24.567 208 1HE MET 25 HE1 MET 25 -4.972 -34.434 25.433 209 2HE MET 25 HE2 MET 25 -3.379 -34.655 26.160 210 3HE MET 25 HE3 MET 25 -3.527 -34.397 24.421 211 H THR 26 HN THR 26 -0.045 -32.008 29.203 212 HA THR 26 HA THR 26 2.092 -33.802 30.060 213 HB THR 26 HB THR 26 1.580 -32.733 32.332 214 HG1 THR 26 HG1 THR 26 0.515 -30.535 31.787 215 1HG2 THR 26 HG21 THR 26 2.458 -30.949 30.049 216 2HG2 THR 26 HG22 THR 26 3.492 -32.055 30.954 217 3HG2 THR 26 HG23 THR 26 2.776 -30.659 31.760 218 H THR 27 HN THR 27 -0.851 -34.489 29.225 219 HA THR 27 HA THR 27 -1.292 -36.408 31.399 220 HB THR 27 HB THR 27 -2.907 -34.571 31.726 221 HG1 THR 27 HG1 THR 27 -4.315 -36.045 32.250 222 1HG2 THR 27 HG21 THR 27 -3.036 -33.764 29.405 223 2HG2 THR 27 HG22 THR 27 -4.637 -34.098 30.063 224 3HG2 THR 27 HG23 THR 27 -3.890 -35.237 28.943 225 H LYS 28 HN LYS 28 -1.880 -38.426 30.716 226 HA LYS 28 HA LYS 28 -1.780 -39.010 27.880 227 1HB LYS 28 HB2 LYS 28 -2.165 -40.766 30.315 228 2HB LYS 28 HB1 LYS 28 -2.143 -41.386 28.669 229 1HG LYS 28 HG2 LYS 28 0.141 -40.584 28.382 230 2HG LYS 28 HG1 LYS 28 0.125 -39.926 30.019 231 1HD LYS 28 HD2 LYS 28 -0.242 -42.848 29.326 232 2HD LYS 28 HD1 LYS 28 1.275 -42.121 29.858 233 1HE LYS 28 HE2 LYS 28 0.252 -41.492 31.981 234 2HE LYS 28 HE1 LYS 28 -1.293 -42.158 31.450 235 1HZ LYS 28 HZ1 LYS 28 -0.259 -44.344 31.333 236 2HZ LYS 28 HZ2 LYS 28 -0.132 -43.695 32.886 237 3HZ LYS 28 HZ3 LYS 28 1.214 -43.700 31.863 238 H ASP 29 HN ASP 29 -4.149 -38.226 30.170 239 HA ASP 29 HA ASP 29 -6.293 -39.699 28.856 240 1HB ASP 29 HB2 ASP 29 -6.371 -39.568 31.288 241 2HB ASP 29 HB1 ASP 29 -6.325 -37.808 31.226 242 H THR 30 HN THR 30 -6.517 -38.817 26.860 243 HA THR 30 HA THR 30 -6.861 -35.909 26.648 244 HB THR 30 HB THR 30 -5.101 -36.708 25.230 245 HG1 THR 30 HG1 THR 30 -6.107 -36.234 23.105 246 1HG2 THR 30 HG21 THR 30 -7.082 -38.661 24.043 247 2HG2 THR 30 HG22 THR 30 -5.720 -39.074 25.086 248 3HG2 THR 30 HG23 THR 30 -5.431 -38.396 23.484 249 H SER 31 HN SER 31 -8.971 -35.521 27.054 250 HA SER 31 HA SER 31 -10.996 -37.014 25.530 251 1HB SER 31 HB2 SER 31 -11.409 -35.084 27.836 252 2HB SER 31 HB1 SER 31 -12.623 -36.136 27.109 253 HG SER 31 HG SER 31 -10.694 -37.738 27.781 254 H THR 32 HN THR 32 -10.373 -33.666 26.592 255 HA THR 32 HA THR 32 -12.117 -32.310 24.976 256 HB THR 32 HB THR 32 -9.339 -31.290 25.615 257 HG1 THR 32 HG1 THR 32 -11.637 -31.264 27.315 258 1HG2 THR 32 HG21 THR 32 -10.471 -29.124 25.798 259 2HG2 THR 32 HG22 THR 32 -12.017 -29.886 25.417 260 3HG2 THR 32 HG23 THR 32 -10.736 -29.830 24.204 261 H LEU 33 HN LEU 33 -8.836 -33.373 24.177 262 HA LEU 33 HA LEU 33 -8.590 -32.051 21.716 263 1HB LEU 33 HB2 LEU 33 -6.720 -33.054 22.997 264 2HB LEU 33 HB1 LEU 33 -7.310 -34.649 22.583 265 HG LEU 33 HG LEU 33 -6.552 -32.724 20.394 266 1HD1 LEU 33 HD11 LEU 33 -4.271 -33.606 20.434 267 2HD1 LEU 33 HD12 LEU 33 -4.638 -34.511 21.903 268 3HD1 LEU 33 HD13 LEU 33 -4.647 -32.747 21.928 269 1HD2 LEU 33 HD21 LEU 33 -7.682 -34.779 19.741 270 2HD2 LEU 33 HD22 LEU 33 -6.500 -35.739 20.628 271 3HD2 LEU 33 HD23 LEU 33 -6.002 -34.816 19.211 272 H LYS 34 HN LYS 34 -9.967 -35.199 22.552 273 HA LYS 34 HA LYS 34 -10.420 -35.946 19.817 274 1HB LYS 34 HB2 LYS 34 -11.599 -37.070 22.372 275 2HB LYS 34 HB1 LYS 34 -11.804 -37.774 20.773 276 1HG LYS 34 HG2 LYS 34 -9.282 -37.963 20.673 277 2HG LYS 34 HG1 LYS 34 -9.273 -37.546 22.386 278 1HD LYS 34 HD2 LYS 34 -10.788 -39.885 21.212 279 2HD LYS 34 HD1 LYS 34 -9.176 -40.005 21.909 280 1HE LYS 34 HE2 LYS 34 -10.697 -40.702 23.591 281 2HE LYS 34 HE1 LYS 34 -10.151 -39.094 24.050 282 1HZ LYS 34 HZ1 LYS 34 -12.539 -39.391 24.353 283 2HZ LYS 34 HZ2 LYS 34 -12.731 -39.702 22.704 284 3HZ LYS 34 HZ3 LYS 34 -12.215 -38.180 23.222 285 H GLU 35 HN GLU 35 -12.293 -34.424 22.377 286 HA GLU 35 HA GLU 35 -14.843 -34.569 21.257 287 1HB GLU 35 HB2 GLU 35 -13.679 -32.370 22.987 288 2HB GLU 35 HB1 GLU 35 -15.393 -32.618 22.682 289 1HG GLU 35 HG2 GLU 35 -13.532 -34.487 24.143 290 2HG GLU 35 HG1 GLU 35 -14.801 -33.490 24.851 291 H LEU 36 HN LEU 36 -12.356 -32.054 20.888 292 HA LEU 36 HA LEU 36 -13.916 -30.359 19.252 293 1HB LEU 36 HB2 LEU 36 -11.867 -29.159 18.792 294 2HB LEU 36 HB1 LEU 36 -11.940 -29.592 20.486 295 HG LEU 36 HG LEU 36 -10.461 -31.648 19.676 296 1HD1 LEU 36 HD11 LEU 36 -8.868 -30.984 17.938 297 2HD1 LEU 36 HD12 LEU 36 -9.806 -29.521 17.639 298 3HD1 LEU 36 HD13 LEU 36 -10.510 -31.103 17.307 299 1HD2 LEU 36 HD21 LEU 36 -8.461 -30.380 20.279 300 2HD2 LEU 36 HD22 LEU 36 -9.804 -30.032 21.369 301 3HD2 LEU 36 HD23 LEU 36 -9.365 -28.872 20.114 302 H LEU 37 HN LEU 37 -11.902 -33.130 18.545 303 HA LEU 37 HA LEU 37 -11.881 -32.764 15.706 304 1HB LEU 37 HB2 LEU 37 -11.412 -35.244 17.380 305 2HB LEU 37 HB1 LEU 37 -11.107 -35.126 15.655 306 HG LEU 37 HG LEU 37 -9.692 -33.490 17.771 307 1HD1 LEU 37 HD11 LEU 37 -7.749 -34.891 17.305 308 2HD1 LEU 37 HD12 LEU 37 -8.715 -35.881 16.211 309 3HD1 LEU 37 HD13 LEU 37 -9.092 -35.845 17.934 310 1HD2 LEU 37 HD21 LEU 37 -9.815 -32.339 15.627 311 2HD2 LEU 37 HD22 LEU 37 -9.171 -33.762 14.808 312 3HD2 LEU 37 HD23 LEU 37 -8.168 -32.874 15.955 313 H GLU 38 HN GLU 38 -13.868 -34.544 18.003 314 HA GLU 38 HA GLU 38 -15.429 -36.003 16.188 315 1HB GLU 38 HB2 GLU 38 -16.056 -35.000 18.972 316 2HB GLU 38 HB1 GLU 38 -17.104 -36.089 18.077 317 1HG GLU 38 HG2 GLU 38 -14.247 -36.688 18.815 318 2HG GLU 38 HG1 GLU 38 -15.652 -37.217 19.734 319 H THR 39 HN THR 39 -15.634 -32.652 17.234 320 HA THR 39 HA THR 39 -18.338 -32.237 16.477 321 HB THR 39 HB THR 39 -17.652 -29.758 16.408 322 HG1 THR 39 HG1 THR 39 -15.262 -30.644 16.318 323 1HG2 THR 39 HG21 THR 39 -17.202 -31.344 18.942 324 2HG2 THR 39 HG22 THR 39 -18.760 -30.787 18.329 325 3HG2 THR 39 HG23 THR 39 -17.551 -29.616 18.852 326 H TYR 40 HN TYR 40 -15.580 -32.718 14.576 327 HA TYR 40 HA TYR 40 -16.675 -31.282 12.275 328 1HB TYR 40 HB2 TYR 40 -14.181 -32.995 12.473 329 2HB TYR 40 HB1 TYR 40 -14.642 -31.996 11.098 330 HD1 TYR 40 HD1 TYR 40 -15.030 -29.421 11.706 331 HD2 TYR 40 HD2 TYR 40 -12.669 -32.130 13.981 332 HE1 TYR 40 HE1 TYR 40 -13.810 -27.524 12.689 333 HE2 TYR 40 HE2 TYR 40 -11.443 -30.244 14.972 334 HH TYR 40 HH TYR 40 -10.928 -27.897 14.437 335 H GLN 41 HN GLN 41 -16.992 -34.254 13.766 336 HA GLN 41 HA GLN 41 -17.928 -36.245 13.231 337 1HB GLN 41 HB2 GLN 41 -19.248 -34.537 11.110 338 2HB GLN 41 HB1 GLN 41 -19.759 -36.165 11.535 339 1HG GLN 41 HG2 GLN 41 -19.779 -33.749 13.337 340 2HG GLN 41 HG1 GLN 41 -21.180 -34.538 12.613 341 1HE2 GLN 41 HE21 GLN 41 -20.544 -34.059 15.421 342 2HE2 GLN 41 HE22 GLN 41 -20.546 -35.611 16.186 343 H ARG 42 HN ARG 42 -15.364 -35.831 12.141 344 HA ARG 42 HA ARG 42 -15.527 -37.535 9.745 345 1HB ARG 42 HB2 ARG 42 -13.684 -36.347 8.723 346 2HB ARG 42 HB1 ARG 42 -14.947 -35.191 9.122 347 1HG ARG 42 HG2 ARG 42 -13.672 -34.585 11.171 348 2HG ARG 42 HG1 ARG 42 -12.375 -35.653 10.627 349 1HD ARG 42 HD2 ARG 42 -11.830 -33.399 9.998 350 2HD ARG 42 HD1 ARG 42 -12.220 -34.311 8.539 351 HE ARG 42 HE ARG 42 -14.565 -33.080 9.395 352 1HH1 ARG 42 HH11 ARG 42 -11.422 -32.136 8.171 353 2HH1 ARG 42 HH12 ARG 42 -11.993 -30.632 7.514 354 1HH2 ARG 42 HH21 ARG 42 -15.322 -31.124 8.490 355 2HH2 ARG 42 HH22 ARG 42 -14.206 -30.061 7.686 356 HA PRO 43 HA PRO 43 -12.672 -40.166 11.896 357 1HB PRO 43 HB2 PRO 43 -11.194 -41.181 9.839 358 2HB PRO 43 HB1 PRO 43 -12.859 -41.678 10.167 359 1HG PRO 43 HG2 PRO 43 -11.836 -39.691 8.165 360 2HG PRO 43 HG1 PRO 43 -13.064 -40.956 7.956 361 1HD PRO 43 HD2 PRO 43 -13.726 -38.371 8.359 362 2HD PRO 43 HD1 PRO 43 -14.713 -39.702 8.997 363 H PHE 44 HN PHE 44 -10.510 -40.309 12.605 364 HA PHE 44 HA PHE 44 -8.464 -38.626 11.458 365 1HB PHE 44 HB2 PHE 44 -8.044 -37.317 13.500 366 2HB PHE 44 HB1 PHE 44 -9.644 -36.984 12.851 367 HD1 PHE 44 HD1 PHE 44 -7.783 -38.628 15.574 368 HD2 PHE 44 HD2 PHE 44 -11.624 -37.533 14.087 369 HE1 PHE 44 HE1 PHE 44 -8.773 -39.130 17.766 370 HE2 PHE 44 HE2 PHE 44 -12.615 -38.032 16.280 371 HZ PHE 44 HZ PHE 44 -11.192 -38.833 18.126 372 H LYS 45 HN LYS 45 -6.400 -39.117 12.235 373 HA LYS 45 HA LYS 45 -6.206 -41.740 13.517 374 1HB LYS 45 HB2 LYS 45 -5.088 -41.273 11.305 375 2HB LYS 45 HB1 LYS 45 -4.055 -40.118 12.128 376 1HG LYS 45 HG2 LYS 45 -3.169 -41.940 13.527 377 2HG LYS 45 HG1 LYS 45 -4.172 -43.087 12.630 378 1HD LYS 45 HD2 LYS 45 -3.032 -42.415 10.544 379 2HD LYS 45 HD1 LYS 45 -2.003 -41.325 11.472 380 1HE LYS 45 HE2 LYS 45 -0.776 -43.327 11.054 381 2HE LYS 45 HE1 LYS 45 -1.203 -43.298 12.762 382 1HZ LYS 45 HZ1 LYS 45 -3.038 -44.811 12.275 383 2HZ LYS 45 HZ2 LYS 45 -1.554 -45.481 11.829 384 3HZ LYS 45 HZ3 LYS 45 -2.587 -44.856 10.646 385 H LEU 46 HN LEU 46 -6.238 -41.459 15.701 386 HA LEU 46 HA LEU 46 -4.781 -39.273 16.942 387 1HB LEU 46 HB2 LEU 46 -6.978 -39.975 17.824 388 2HB LEU 46 HB1 LEU 46 -6.329 -41.567 18.172 389 HG LEU 46 HG LEU 46 -4.754 -40.542 19.802 390 1HD1 LEU 46 HD11 LEU 46 -6.294 -38.009 19.231 391 2HD1 LEU 46 HD12 LEU 46 -4.596 -38.309 18.857 392 3HD1 LEU 46 HD13 LEU 46 -5.128 -38.231 20.536 393 1HD2 LEU 46 HD21 LEU 46 -6.430 -40.068 21.530 394 2HD2 LEU 46 HD22 LEU 46 -6.862 -41.486 20.575 395 3HD2 LEU 46 HD23 LEU 46 -7.678 -39.948 20.288 396 H GLU 47 HN GLU 47 -2.655 -39.495 17.013 397 HA GLU 47 HA GLU 47 -1.487 -42.162 17.453 398 1HB GLU 47 HB2 GLU 47 -0.503 -39.706 16.012 399 2HB GLU 47 HB1 GLU 47 0.601 -40.983 16.501 400 1HG GLU 47 HG2 GLU 47 -1.817 -41.501 14.790 401 2HG GLU 47 HG1 GLU 47 -0.247 -41.056 14.123 402 H PHE 48 HN PHE 48 -0.149 -42.529 19.108 403 HA PHE 48 HA PHE 48 0.885 -40.237 20.653 404 1HB PHE 48 HB2 PHE 48 -0.384 -41.758 22.070 405 2HB PHE 48 HB1 PHE 48 0.493 -43.146 21.440 406 HD1 PHE 48 HD1 PHE 48 2.422 -43.904 22.509 407 HD2 PHE 48 HD2 PHE 48 0.959 -39.997 23.375 408 HE1 PHE 48 HE1 PHE 48 4.060 -43.699 24.329 409 HE2 PHE 48 HE2 PHE 48 2.599 -39.791 25.196 410 HZ PHE 48 HZ PHE 48 4.148 -41.643 25.675 411 H LYS 49 HN LYS 49 2.859 -39.723 19.888 412 HA LYS 49 HA LYS 49 4.300 -41.685 18.311 413 1HB LYS 49 HB2 LYS 49 4.880 -38.761 18.847 414 2HB LYS 49 HB1 LYS 49 5.798 -39.780 17.745 415 1HG LYS 49 HG2 LYS 49 2.882 -39.044 17.477 416 2HG LYS 49 HG1 LYS 49 4.219 -38.385 16.533 417 1HD LYS 49 HD2 LYS 49 4.669 -40.660 15.647 418 2HD LYS 49 HD1 LYS 49 3.271 -41.259 16.543 419 1HE LYS 49 HE2 LYS 49 1.838 -39.673 15.276 420 2HE LYS 49 HE1 LYS 49 3.247 -39.202 14.328 421 1HZ LYS 49 HZ1 LYS 49 3.416 -41.441 13.489 422 2HZ LYS 49 HZ2 LYS 49 1.856 -40.857 13.206 423 3HZ LYS 49 HZ3 LYS 49 2.133 -41.953 14.464 424 H ASN 50 HN ASN 50 4.865 -39.784 21.265 425 HA ASN 50 HA ASN 50 6.620 -41.720 22.365 426 1HB ASN 50 HB2 ASN 50 8.136 -40.801 20.617 427 2HB ASN 50 HB1 ASN 50 7.948 -39.198 21.317 428 1HD2 ASN 50 HD21 ASN 50 10.098 -38.945 21.798 429 2HD2 ASN 50 HD22 ASN 50 10.906 -39.852 23.029 430 H THR 51 HN THR 51 7.597 -40.956 24.405 431 HA THR 51 HA THR 51 6.308 -38.558 25.531 432 HB THR 51 HB THR 51 5.180 -40.468 26.515 433 HG1 THR 51 HG1 THR 51 7.108 -39.463 28.361 434 1HG2 THR 51 HG21 THR 51 6.379 -42.197 27.775 435 2HG2 THR 51 HG22 THR 51 7.919 -41.476 27.308 436 3HG2 THR 51 HG23 THR 51 6.873 -42.193 26.080 437 H SER 52 HN SER 52 7.603 -37.335 26.928 438 HA SER 52 HA SER 52 10.365 -37.322 26.523 439 1HB SER 52 HB2 SER 52 10.413 -35.797 28.530 440 2HB SER 52 HB1 SER 52 9.233 -35.332 27.306 441 HG SER 52 HG SER 52 8.690 -35.558 29.751 442 H LYS 53 HN LYS 53 12.090 -37.786 28.081 443 HA LYS 53 HA LYS 53 11.917 -40.459 28.943 444 1HB LYS 53 HB2 LYS 53 13.998 -39.285 28.200 445 2HB LYS 53 HB1 LYS 53 14.013 -38.427 29.735 446 1HG LYS 53 HG2 LYS 53 14.341 -40.473 30.949 447 2HG LYS 53 HG1 LYS 53 14.121 -41.431 29.482 448 1HD LYS 53 HD2 LYS 53 16.370 -39.475 30.004 449 2HD LYS 53 HD1 LYS 53 16.493 -41.233 30.071 450 1HE LYS 53 HE2 LYS 53 15.912 -41.360 27.686 451 2HE LYS 53 HE1 LYS 53 15.791 -39.603 27.622 452 1HZ LYS 53 HZ1 LYS 53 18.121 -39.422 28.114 453 2HZ LYS 53 HZ2 LYS 53 17.923 -40.456 26.793 454 3HZ LYS 53 HZ3 LYS 53 18.260 -41.096 28.318 455 H ASN 54 HN ASN 54 11.445 -37.427 30.638 456 HA ASN 54 HA ASN 54 11.372 -38.656 33.246 457 1HB ASN 54 HB2 ASN 54 10.558 -36.468 34.049 458 2HB ASN 54 HB1 ASN 54 12.016 -36.313 33.081 459 1HD2 ASN 54 HD21 ASN 54 11.574 -34.142 32.699 460 2HD2 ASN 54 HD22 ASN 54 10.348 -33.634 31.592 461 H ALA 55 HN ALA 55 9.274 -38.537 30.643 462 HA ALA 55 HA ALA 55 7.215 -39.390 30.272 463 1HB ALA 55 HB1 ALA 55 6.317 -41.026 31.837 464 2HB ALA 55 HB2 ALA 55 7.460 -40.495 33.071 465 3HB ALA 55 HB3 ALA 55 8.048 -41.271 31.602 466 H LYS 56 HN LYS 56 7.543 -36.712 31.519 467 HA LYS 56 HA LYS 56 4.920 -36.444 32.818 468 1HB LYS 56 HB2 LYS 56 6.821 -35.411 33.990 469 2HB LYS 56 HB1 LYS 56 7.185 -34.451 32.566 470 1HG LYS 56 HG2 LYS 56 6.074 -32.933 33.899 471 2HG LYS 56 HG1 LYS 56 4.773 -33.520 32.869 472 1HD LYS 56 HD2 LYS 56 5.338 -34.652 35.612 473 2HD LYS 56 HD1 LYS 56 4.255 -33.290 35.350 474 1HE LYS 56 HE2 LYS 56 3.925 -36.070 34.208 475 2HE LYS 56 HE1 LYS 56 3.016 -35.385 35.549 476 1HZ LYS 56 HZ1 LYS 56 1.723 -35.256 33.551 477 2HZ LYS 56 HZ2 LYS 56 2.965 -34.453 32.729 478 3HZ LYS 56 HZ3 LYS 56 2.167 -33.686 34.010 479 H PHE 57 HN PHE 57 6.604 -35.849 29.877 480 HA PHE 57 HA PHE 57 4.374 -34.186 28.881 481 1HB PHE 57 HB2 PHE 57 7.253 -34.211 27.924 482 2HB PHE 57 HB1 PHE 57 5.961 -33.200 27.281 483 HD1 PHE 57 HD1 PHE 57 8.364 -33.656 29.972 484 HD2 PHE 57 HD2 PHE 57 5.044 -31.349 28.627 485 HE1 PHE 57 HE1 PHE 57 8.895 -31.924 31.636 486 HE2 PHE 57 HE2 PHE 57 5.573 -29.617 30.290 487 HZ PHE 57 HZ PHE 57 7.500 -29.902 31.796 488 H TYR 58 HN TYR 58 3.102 -35.280 27.561 489 HA TYR 58 HA TYR 58 4.159 -37.634 26.148 490 1HB TYR 58 HB2 TYR 58 1.264 -36.929 26.696 491 2HB TYR 58 HB1 TYR 58 1.901 -38.478 26.149 492 HD1 TYR 58 HD1 TYR 58 3.398 -39.799 27.743 493 HD2 TYR 58 HD2 TYR 58 1.102 -36.436 28.995 494 HE1 TYR 58 HE1 TYR 58 3.630 -40.516 30.085 495 HE2 TYR 58 HE2 TYR 58 1.325 -37.148 31.335 496 HH TYR 58 HH TYR 58 3.532 -39.528 32.338 497 H SER 59 HN SER 59 4.378 -37.550 24.011 498 HA SER 59 HA SER 59 3.372 -35.204 22.582 499 1HB SER 59 HB2 SER 59 5.324 -37.323 21.638 500 2HB SER 59 HB1 SER 59 4.999 -35.766 20.871 501 HG SER 59 HG SER 59 5.684 -35.482 23.484 502 H PHE 60 HN PHE 60 1.464 -35.411 21.671 503 HA PHE 60 HA PHE 60 0.671 -37.959 20.430 504 1HB PHE 60 HB2 PHE 60 -1.040 -35.538 21.094 505 2HB PHE 60 HB1 PHE 60 -1.617 -37.087 20.489 506 HD1 PHE 60 HD1 PHE 60 -0.577 -35.206 23.405 507 HD2 PHE 60 HD2 PHE 60 -1.519 -39.099 21.950 508 HE1 PHE 60 HE1 PHE 60 -0.845 -36.002 25.716 509 HE2 PHE 60 HE2 PHE 60 -1.788 -39.898 24.263 510 HZ PHE 60 HZ PHE 60 -1.453 -38.347 26.148 511 H ASN 61 HN ASN 61 -0.528 -37.736 18.356 512 HA ASN 61 HA ASN 61 0.074 -35.346 16.796 513 1HB ASN 61 HB2 ASN 61 2.021 -36.790 16.397 514 2HB ASN 61 HB1 ASN 61 0.960 -38.122 15.952 515 1HD2 ASN 61 HD21 ASN 61 -0.129 -38.049 13.961 516 2HD2 ASN 61 HD22 ASN 61 0.364 -36.982 12.695 517 H VAL 62 HN VAL 62 -1.688 -34.803 15.733 518 HA VAL 62 HA VAL 62 -3.769 -36.833 15.277 519 HB VAL 62 HB VAL 62 -3.975 -33.807 15.188 520 1HG1 VAL 62 HG11 VAL 62 -5.613 -34.879 13.729 521 2HG1 VAL 62 HG12 VAL 62 -6.406 -34.182 15.142 522 3HG1 VAL 62 HG13 VAL 62 -6.133 -35.922 15.052 523 1HG2 VAL 62 HG21 VAL 62 -5.208 -34.024 17.307 524 2HG2 VAL 62 HG22 VAL 62 -3.545 -34.596 17.451 525 3HG2 VAL 62 HG23 VAL 62 -4.870 -35.754 17.322 526 H SER 63 HN SER 63 -3.858 -37.660 13.281 527 HA SER 63 HA SER 63 -3.170 -35.913 10.998 528 1HB SER 63 HB2 SER 63 -3.214 -38.951 11.050 529 2HB SER 63 HB1 SER 63 -2.627 -37.922 9.743 530 HG SER 63 HG SER 63 -0.790 -37.733 10.741 531 H MET 64 HN MET 64 -5.032 -35.073 10.230 532 HA MET 64 HA MET 64 -7.365 -36.852 9.957 533 1HB MET 64 HB2 MET 64 -8.862 -35.169 10.859 534 2HB MET 64 HB1 MET 64 -7.623 -35.541 12.046 535 1HG MET 64 HG2 MET 64 -6.407 -33.496 11.363 536 2HG MET 64 HG1 MET 64 -7.733 -33.111 10.267 537 1HE MET 64 HE1 MET 64 -10.703 -32.630 12.847 538 2HE MET 64 HE2 MET 64 -10.236 -34.112 12.009 539 3HE MET 64 HE3 MET 64 -10.255 -32.576 11.141 540 H GLU 65 HN GLU 65 -8.883 -36.228 8.384 541 HA GLU 65 HA GLU 65 -7.747 -34.983 6.086 542 1HB GLU 65 HB2 GLU 65 -10.622 -35.804 6.575 543 2HB GLU 65 HB1 GLU 65 -9.891 -35.441 5.015 544 1HG GLU 65 HG2 GLU 65 -8.386 -37.356 5.277 545 2HG GLU 65 HG1 GLU 65 -9.126 -37.723 6.831 546 H VAL 66 HN VAL 66 -7.579 -32.881 5.818 547 HA VAL 66 HA VAL 66 -9.654 -31.103 6.904 548 HB VAL 66 HB VAL 66 -8.021 -29.251 6.471 549 1HG1 VAL 66 HG11 VAL 66 -8.246 -30.221 8.702 550 2HG1 VAL 66 HG12 VAL 66 -6.573 -29.753 8.391 551 3HG1 VAL 66 HG13 VAL 66 -7.045 -31.452 8.303 552 1HG2 VAL 66 HG21 VAL 66 -6.670 -30.326 4.740 553 2HG2 VAL 66 HG22 VAL 66 -6.090 -31.513 5.908 554 3HG2 VAL 66 HG23 VAL 66 -5.659 -29.812 6.089 555 H SER 67 HN SER 67 -10.995 -30.119 5.555 556 HA SER 67 HA SER 67 -10.866 -30.777 2.740 557 1HB SER 67 HB2 SER 67 -12.969 -31.003 4.086 558 2HB SER 67 HB1 SER 67 -12.999 -29.250 4.268 559 HG SER 67 HG SER 67 -14.266 -30.277 2.484 560 H ASN 68 HN ASN 68 -10.249 -28.082 4.813 561 HA ASN 68 HA ASN 68 -9.181 -26.587 2.588 562 1HB ASN 68 HB2 ASN 68 -10.438 -24.529 3.012 563 2HB ASN 68 HB1 ASN 68 -11.532 -25.834 2.571 564 1HD2 ASN 68 HD21 ASN 68 -12.992 -26.585 4.057 565 2HD2 ASN 68 HD22 ASN 68 -13.279 -25.813 5.577 566 H GLU 69 HN GLU 69 -8.539 -24.267 3.620 567 HA GLU 69 HA GLU 69 -6.592 -25.017 5.631 568 1HB GLU 69 HB2 GLU 69 -5.882 -23.706 3.700 569 2HB GLU 69 HB1 GLU 69 -7.027 -22.437 4.108 570 1HG GLU 69 HG2 GLU 69 -5.788 -22.048 6.216 571 2HG GLU 69 HG1 GLU 69 -4.603 -23.251 5.705 572 H SER 70 HN SER 70 -9.538 -23.144 5.439 573 HA SER 70 HA SER 70 -9.180 -21.570 7.761 574 1HB SER 70 HB2 SER 70 -10.922 -21.138 6.010 575 2HB SER 70 HB1 SER 70 -11.810 -22.543 6.597 576 HG SER 70 HG SER 70 -11.078 -20.581 8.453 577 H GLU 71 HN GLU 71 -10.328 -24.844 7.221 578 HA GLU 71 HA GLU 71 -11.153 -25.364 9.894 579 1HB GLU 71 HB2 GLU 71 -10.136 -27.286 7.783 580 2HB GLU 71 HB1 GLU 71 -10.923 -27.754 9.284 581 1HG GLU 71 HG2 GLU 71 -12.965 -26.613 8.565 582 2HG GLU 71 HG1 GLU 71 -12.167 -26.151 7.067 583 H ARG 72 HN ARG 72 -8.113 -25.840 8.132 584 HA ARG 72 HA ARG 72 -6.638 -27.161 10.076 585 1HB ARG 72 HB2 ARG 72 -5.775 -26.896 7.833 586 2HB ARG 72 HB1 ARG 72 -5.742 -25.146 8.002 587 1HG ARG 72 HG2 ARG 72 -4.043 -25.450 9.832 588 2HG ARG 72 HG1 ARG 72 -3.982 -27.159 9.394 589 1HD ARG 72 HD2 ARG 72 -3.243 -26.594 7.156 590 2HD ARG 72 HD1 ARG 72 -3.409 -24.871 7.504 591 HE ARG 72 HE ARG 72 -1.557 -26.498 9.099 592 1HH1 ARG 72 HH11 ARG 72 -2.073 -23.925 6.772 593 2HH1 ARG 72 HH12 ARG 72 -0.453 -23.322 6.892 594 1HH2 ARG 72 HH21 ARG 72 0.561 -25.704 9.263 595 2HH2 ARG 72 HH22 ARG 72 1.051 -24.328 8.323 596 H ASN 73 HN ASN 73 -6.813 -23.657 9.480 597 HA ASN 73 HA ASN 73 -5.209 -22.847 11.631 598 1HB ASN 73 HB2 ASN 73 -7.498 -21.364 10.303 599 2HB ASN 73 HB1 ASN 73 -6.295 -20.628 11.358 600 1HD2 ASN 73 HD21 ASN 73 -6.921 -20.029 8.583 601 2HD2 ASN 73 HD22 ASN 73 -5.453 -20.250 7.699 602 H GLU 74 HN GLU 74 -8.616 -23.617 11.425 603 HA GLU 74 HA GLU 74 -9.370 -22.652 13.987 604 1HB GLU 74 HB2 GLU 74 -11.026 -23.012 12.252 605 2HB GLU 74 HB1 GLU 74 -10.628 -24.724 12.171 606 1HG GLU 74 HG2 GLU 74 -11.560 -25.126 14.321 607 2HG GLU 74 HG1 GLU 74 -11.745 -23.397 14.632 608 H ILE 75 HN ILE 75 -8.484 -25.853 12.771 609 HA ILE 75 HA ILE 75 -8.913 -27.284 15.148 610 HB ILE 75 HB ILE 75 -7.051 -27.905 12.839 611 1HG1 ILE 75 HG12 ILE 75 -9.832 -28.988 13.357 612 2HG1 ILE 75 HG11 ILE 75 -9.540 -27.563 12.370 613 1HG2 ILE 75 HG21 ILE 75 -8.126 -29.743 14.990 614 2HG2 ILE 75 HG22 ILE 75 -6.451 -29.220 14.810 615 3HG2 ILE 75 HG23 ILE 75 -7.190 -30.246 13.582 616 1HD1 ILE 75 HD11 ILE 75 -9.841 -29.476 10.968 617 2HD1 ILE 75 HD12 ILE 75 -8.570 -30.355 11.819 618 3HD1 ILE 75 HD13 ILE 75 -8.166 -28.933 10.854 619 H PHE 76 HN PHE 76 -6.067 -25.628 13.859 620 HA PHE 76 HA PHE 76 -4.195 -26.379 15.801 621 1HB PHE 76 HB2 PHE 76 -3.544 -25.183 13.771 622 2HB PHE 76 HB1 PHE 76 -4.460 -23.768 14.278 623 HD1 PHE 76 HD1 PHE 76 -3.428 -22.086 15.545 624 HD2 PHE 76 HD2 PHE 76 -1.587 -25.920 15.253 625 HE1 PHE 76 HE1 PHE 76 -1.429 -21.209 16.678 626 HE2 PHE 76 HE2 PHE 76 0.414 -25.045 16.386 627 HZ PHE 76 HZ PHE 76 0.494 -22.689 17.101 628 H GLN 77 HN GLN 77 -6.502 -23.694 15.729 629 HA GLN 77 HA GLN 77 -5.843 -22.567 18.229 630 1HB GLN 77 HB2 GLN 77 -8.442 -22.525 16.680 631 2HB GLN 77 HB1 GLN 77 -8.107 -21.514 18.080 632 1HG GLN 77 HG2 GLN 77 -6.342 -20.374 16.909 633 2HG GLN 77 HG1 GLN 77 -6.487 -21.470 15.536 634 1HE2 GLN 77 HE21 GLN 77 -8.221 -21.247 14.127 635 2HE2 GLN 77 HE22 GLN 77 -9.197 -19.820 14.081 636 H LYS 78 HN LYS 78 -8.230 -24.994 17.262 637 HA LYS 78 HA LYS 78 -9.580 -25.388 19.650 638 1HB LYS 78 HB2 LYS 78 -8.768 -27.444 17.575 639 2HB LYS 78 HB1 LYS 78 -9.957 -27.725 18.835 640 1HG LYS 78 HG2 LYS 78 -10.233 -25.582 16.739 641 2HG LYS 78 HG1 LYS 78 -10.880 -27.213 16.566 642 1HD LYS 78 HD2 LYS 78 -12.193 -26.852 18.654 643 2HD LYS 78 HD1 LYS 78 -11.619 -25.181 18.677 644 1HE LYS 78 HE2 LYS 78 -12.680 -24.764 16.522 645 2HE LYS 78 HE1 LYS 78 -13.198 -26.447 16.430 646 1HZ LYS 78 HZ1 LYS 78 -14.555 -26.099 18.394 647 2HZ LYS 78 HZ2 LYS 78 -14.990 -25.014 17.175 648 3HZ LYS 78 HZ3 LYS 78 -14.059 -24.484 18.486 649 H ILE 79 HN ILE 79 -6.597 -26.887 18.492 650 HA ILE 79 HA ILE 79 -6.168 -28.604 20.693 651 HB ILE 79 HB ILE 79 -4.163 -27.427 18.752 652 1HG1 ILE 79 HG12 ILE 79 -5.561 -30.121 18.747 653 2HG1 ILE 79 HG11 ILE 79 -5.987 -28.762 17.714 654 1HG2 ILE 79 HG21 ILE 79 -2.690 -29.271 19.397 655 2HG2 ILE 79 HG22 ILE 79 -3.866 -29.802 20.599 656 3HG2 ILE 79 HG23 ILE 79 -3.060 -28.244 20.782 657 1HD1 ILE 79 HD11 ILE 79 -4.669 -30.398 16.512 658 2HD1 ILE 79 HD12 ILE 79 -3.368 -30.247 17.691 659 3HD1 ILE 79 HD13 ILE 79 -3.785 -28.880 16.657 660 H SER 80 HN SER 80 -5.463 -25.242 20.157 661 HA SER 80 HA SER 80 -3.613 -25.008 22.356 662 1HB SER 80 HB2 SER 80 -3.560 -23.609 20.255 663 2HB SER 80 HB1 SER 80 -5.013 -22.799 20.831 664 HG SER 80 HG SER 80 -3.886 -21.826 22.392 665 H GLN 81 HN GLN 81 -6.953 -25.244 22.119 666 HA GLN 81 HA GLN 81 -7.589 -23.380 24.258 667 1HB GLN 81 HB2 GLN 81 -9.343 -25.271 22.672 668 2HB GLN 81 HB1 GLN 81 -9.935 -24.154 23.896 669 1HG GLN 81 HG2 GLN 81 -9.145 -22.266 22.566 670 2HG GLN 81 HG1 GLN 81 -8.530 -23.376 21.347 671 1HE2 GLN 81 HE21 GLN 81 -10.849 -25.186 21.654 672 2HE2 GLN 81 HE22 GLN 81 -12.158 -24.392 20.847 673 H LEU 82 HN LEU 82 -6.506 -26.570 24.149 674 HA LEU 82 HA LEU 82 -8.250 -27.729 26.094 675 1HB LEU 82 HB2 LEU 82 -5.484 -28.819 25.827 676 2HB LEU 82 HB1 LEU 82 -7.017 -29.653 25.935 677 HG LEU 82 HG LEU 82 -5.992 -28.244 23.472 678 1HD1 LEU 82 HD11 LEU 82 -6.222 -31.191 24.063 679 2HD1 LEU 82 HD12 LEU 82 -4.723 -30.264 23.971 680 3HD1 LEU 82 HD13 LEU 82 -5.720 -30.470 22.532 681 1HD2 LEU 82 HD21 LEU 82 -7.885 -29.283 22.335 682 2HD2 LEU 82 HD22 LEU 82 -8.419 -28.183 23.604 683 3HD2 LEU 82 HD23 LEU 82 -8.462 -29.928 23.873 684 H ASP 83 HN ASP 83 -5.436 -25.738 26.272 685 HA ASP 83 HA ASP 83 -4.330 -24.749 27.988 686 1HB ASP 83 HB2 ASP 83 -6.418 -24.345 29.121 687 2HB ASP 83 HB1 ASP 83 -6.506 -26.013 29.674 688 H LYS 84 HN LYS 84 -5.137 -28.131 28.368 689 HA LYS 84 HA LYS 84 -3.035 -28.896 30.093 690 1HB LYS 84 HB2 LYS 84 -4.546 -30.524 28.031 691 2HB LYS 84 HB1 LYS 84 -3.615 -31.173 29.376 692 1HG LYS 84 HG2 LYS 84 -5.162 -30.363 30.970 693 2HG LYS 84 HG1 LYS 84 -5.962 -29.335 29.780 694 1HD LYS 84 HD2 LYS 84 -6.894 -31.227 28.658 695 2HD LYS 84 HD1 LYS 84 -5.919 -32.343 29.600 696 1HE LYS 84 HE2 LYS 84 -7.117 -31.606 31.644 697 2HE LYS 84 HE1 LYS 84 -8.123 -30.559 30.649 698 1HZ LYS 84 HZ1 LYS 84 -9.247 -32.621 31.160 699 2HZ LYS 84 HZ2 LYS 84 -7.992 -33.520 30.472 700 3HZ LYS 84 HZ3 LYS 84 -8.952 -32.527 29.497 701 H VAL 85 HN VAL 85 -2.995 -27.862 26.899 702 HA VAL 85 HA VAL 85 -0.845 -29.564 25.976 703 HB VAL 85 HB VAL 85 -2.647 -28.847 24.443 704 1HG1 VAL 85 HG11 VAL 85 -2.716 -26.551 23.587 705 2HG1 VAL 85 HG12 VAL 85 -1.470 -26.082 24.745 706 3HG1 VAL 85 HG13 VAL 85 -3.052 -26.610 25.318 707 1HG2 VAL 85 HG21 VAL 85 0.085 -27.837 23.642 708 2HG2 VAL 85 HG22 VAL 85 -1.223 -28.278 22.544 709 3HG2 VAL 85 HG23 VAL 85 -0.464 -29.511 23.551 710 H VAL 86 HN VAL 86 1.267 -28.959 25.653 711 HA VAL 86 HA VAL 86 2.090 -26.336 26.741 712 HB VAL 86 HB VAL 86 4.152 -27.364 27.540 713 1HG1 VAL 86 HG11 VAL 86 1.718 -28.897 28.464 714 2HG1 VAL 86 HG12 VAL 86 2.251 -27.328 29.066 715 3HG1 VAL 86 HG13 VAL 86 3.243 -28.760 29.340 716 1HG2 VAL 86 HG21 VAL 86 4.484 -29.803 27.474 717 2HG2 VAL 86 HG22 VAL 86 4.426 -29.108 25.856 718 3HG2 VAL 86 HG23 VAL 86 3.027 -29.969 26.495 719 H GLN 87 HN GLN 87 1.847 -28.088 23.967 720 HA GLN 87 HA GLN 87 3.685 -26.399 22.538 721 1HB GLN 87 HB2 GLN 87 5.192 -28.193 23.329 722 2HB GLN 87 HB1 GLN 87 4.149 -29.394 22.582 723 1HG GLN 87 HG2 GLN 87 6.116 -28.975 21.226 724 2HG GLN 87 HG1 GLN 87 4.649 -28.489 20.383 725 1HE2 GLN 87 HE21 GLN 87 7.560 -27.409 21.924 726 2HE2 GLN 87 HE22 GLN 87 7.503 -25.777 21.357 727 H THR 88 HN THR 88 2.825 -25.953 20.600 728 HA THR 88 HA THR 88 0.859 -27.810 19.423 729 HB THR 88 HB THR 88 -0.457 -25.702 18.755 730 HG1 THR 88 HG1 THR 88 -0.108 -23.871 20.002 731 1HG2 THR 88 HG21 THR 88 -1.283 -27.291 20.430 732 2HG2 THR 88 HG22 THR 88 -1.695 -25.632 20.866 733 3HG2 THR 88 HG23 THR 88 -0.365 -26.454 21.684 734 H LEU 89 HN LEU 89 1.728 -28.390 17.502 735 HA LEU 89 HA LEU 89 2.743 -26.228 15.754 736 1HB LEU 89 HB2 LEU 89 3.596 -29.133 15.776 737 2HB LEU 89 HB1 LEU 89 4.074 -27.964 14.564 738 HG LEU 89 HG LEU 89 5.158 -26.640 16.459 739 1HD1 LEU 89 HD11 LEU 89 4.027 -27.695 18.334 740 2HD1 LEU 89 HD12 LEU 89 5.771 -27.913 18.460 741 3HD1 LEU 89 HD13 LEU 89 4.752 -29.247 17.921 742 1HD2 LEU 89 HD21 LEU 89 6.444 -27.934 14.832 743 2HD2 LEU 89 HD22 LEU 89 6.240 -29.386 15.812 744 3HD2 LEU 89 HD23 LEU 89 7.173 -28.025 16.434 745 H GLY 90 HN GLY 90 1.250 -25.774 14.291 746 1HA GLY 90 HA2 GLY 90 -0.342 -27.973 13.111 747 2HA GLY 90 HA1 GLY 90 -0.809 -26.277 13.121 748 H SER 91 HN SER 91 2.446 -26.547 12.548 749 HA SER 91 HA SER 91 2.077 -26.310 9.645 750 1HB SER 91 HB2 SER 91 4.313 -24.967 9.927 751 2HB SER 91 HB1 SER 91 2.783 -24.192 10.329 752 HG SER 91 HG SER 91 4.787 -25.200 12.037 Start of MODEL 15 1 1H GLN 1 HT1 GLN 1 5.889 -1.122 -0.709 2 2H GLN 1 HT2 GLN 1 6.973 -0.265 0.265 3 3H GLN 1 HT3 GLN 1 6.750 -1.922 0.505 4 HA GLN 1 HA GLN 1 7.677 -2.400 -1.660 5 1HB GLN 1 HB2 GLN 1 8.265 0.578 -1.738 6 2HB GLN 1 HB1 GLN 1 8.831 -0.608 -2.904 7 1HG GLN 1 HG2 GLN 1 7.026 0.465 -3.936 8 2HG GLN 1 HG1 GLN 1 6.390 -1.089 -3.399 9 1HE2 GLN 1 HE21 GLN 1 6.374 2.341 -2.908 10 2HE2 GLN 1 HE22 GLN 1 4.970 2.403 -1.905 11 H GLY 2 HN GLY 2 10.143 -2.268 -2.059 12 1HA GLY 2 HA2 GLY 2 12.032 -1.169 -0.455 13 2HA GLY 2 HA1 GLY 2 11.458 -2.526 0.505 14 H HIS 3 HN HIS 3 11.627 -4.666 -0.407 15 HA HIS 3 HA HIS 3 13.492 -4.969 -2.641 16 1HB HIS 3 HB2 HIS 3 14.906 -6.552 -1.365 17 2HB HIS 3 HB1 HIS 3 14.959 -4.928 -0.693 18 HD1 HIS 3 HD1 HIS 3 14.898 -8.241 0.430 19 HD2 HIS 3 HD2 HIS 3 12.815 -4.819 1.536 20 HE1 HIS 3 HE1 HIS 3 14.084 -8.670 2.769 21 HE2 HIS 3 HE2 HIS 3 12.946 -6.532 3.465 22 H MET 4 HN MET 4 13.338 -6.968 -3.702 23 HA MET 4 HA MET 4 10.722 -8.155 -3.441 24 1HB MET 4 HB2 MET 4 11.247 -9.341 -5.506 25 2HB MET 4 HB1 MET 4 11.636 -7.636 -5.665 26 1HG MET 4 HG2 MET 4 14.005 -8.137 -5.330 27 2HG MET 4 HG1 MET 4 13.620 -9.847 -5.154 28 1HE MET 4 HE1 MET 4 13.118 -7.451 -9.075 29 2HE MET 4 HE2 MET 4 13.778 -6.779 -7.584 30 3HE MET 4 HE3 MET 4 12.070 -7.213 -7.676 31 HA PRO 5 HA PRO 5 12.299 -11.560 -0.953 32 1HB PRO 5 HB2 PRO 5 9.921 -12.813 -0.592 33 2HB PRO 5 HB1 PRO 5 10.362 -11.352 0.299 34 1HG PRO 5 HG2 PRO 5 8.616 -11.643 -2.118 35 2HG PRO 5 HG1 PRO 5 8.370 -10.642 -0.674 36 1HD PRO 5 HD2 PRO 5 9.326 -9.646 -3.027 37 2HD PRO 5 HD1 PRO 5 9.751 -8.968 -1.443 38 H SER 6 HN SER 6 13.525 -12.674 -2.436 39 HA SER 6 HA SER 6 12.663 -13.649 -4.899 40 1HB SER 6 HB2 SER 6 15.036 -13.283 -4.311 41 2HB SER 6 HB1 SER 6 14.972 -14.657 -3.210 42 HG SER 6 HG SER 6 14.825 -16.029 -4.897 43 H ASP 7 HN ASP 7 10.776 -14.802 -4.742 44 HA ASP 7 HA ASP 7 9.455 -16.641 -4.618 45 1HB ASP 7 HB2 ASP 7 11.427 -17.505 -5.948 46 2HB ASP 7 HB1 ASP 7 12.054 -18.192 -4.454 47 H SER 8 HN SER 8 10.059 -15.327 -2.159 48 HA SER 8 HA SER 8 10.554 -17.293 -0.122 49 1HB SER 8 HB2 SER 8 9.443 -14.484 0.132 50 2HB SER 8 HB1 SER 8 10.084 -15.473 1.447 51 HG SER 8 HG SER 8 11.935 -15.414 -0.430 52 H LYS 9 HN LYS 9 8.091 -17.261 -2.080 53 HA LYS 9 HA LYS 9 5.792 -17.242 -0.397 54 1HB LYS 9 HB2 LYS 9 6.237 -18.520 -3.110 55 2HB LYS 9 HB1 LYS 9 4.673 -18.309 -2.335 56 1HG LYS 9 HG2 LYS 9 4.835 -15.918 -2.510 57 2HG LYS 9 HG1 LYS 9 6.500 -16.027 -3.084 58 1HD LYS 9 HD2 LYS 9 4.940 -15.604 -4.932 59 2HD LYS 9 HD1 LYS 9 5.747 -17.163 -5.112 60 1HE LYS 9 HE2 LYS 9 3.728 -18.249 -4.121 61 2HE LYS 9 HE1 LYS 9 2.931 -16.675 -4.129 62 1HZ LYS 9 HZ1 LYS 9 3.966 -18.085 -6.529 63 2HZ LYS 9 HZ2 LYS 9 3.151 -16.605 -6.523 64 3HZ LYS 9 HZ3 LYS 9 2.346 -18.013 -6.060 65 H LYS 10 HN LYS 10 4.836 -18.900 0.703 66 HA LYS 10 HA LYS 10 6.320 -21.386 0.985 67 1HB LYS 10 HB2 LYS 10 3.792 -20.454 2.376 68 2HB LYS 10 HB1 LYS 10 4.712 -21.900 2.778 69 1HG LYS 10 HG2 LYS 10 6.688 -20.313 3.170 70 2HG LYS 10 HG1 LYS 10 5.484 -19.023 3.156 71 1HD LYS 10 HD2 LYS 10 5.922 -19.710 5.438 72 2HD LYS 10 HD1 LYS 10 4.279 -20.174 4.989 73 1HE LYS 10 HE2 LYS 10 4.976 -22.461 4.625 74 2HE LYS 10 HE1 LYS 10 6.663 -22.028 4.900 75 1HZ LYS 10 HZ1 LYS 10 4.495 -21.853 6.924 76 2HZ LYS 10 HZ2 LYS 10 6.125 -21.482 7.181 77 3HZ LYS 10 HZ3 LYS 10 5.664 -23.073 6.841 78 HA PRO 11 HA PRO 11 4.064 -23.698 -1.947 79 1HB PRO 11 HB2 PRO 11 3.829 -26.136 -0.680 80 2HB PRO 11 HB1 PRO 11 5.295 -25.569 -1.485 81 1HG PRO 11 HG2 PRO 11 4.587 -25.498 1.425 82 2HG PRO 11 HG1 PRO 11 6.130 -25.921 0.658 83 1HD PRO 11 HD2 PRO 11 5.744 -23.511 1.770 84 2HD PRO 11 HD1 PRO 11 6.697 -23.695 0.282 85 H THR 12 HN THR 12 2.013 -23.925 -2.519 86 HA THR 12 HA THR 12 -0.149 -23.396 -0.798 87 HB THR 12 HB THR 12 -0.089 -24.582 -3.586 88 HG1 THR 12 HG1 THR 12 0.234 -22.556 -4.085 89 1HG2 THR 12 HG21 THR 12 -2.478 -23.988 -3.713 90 2HG2 THR 12 HG22 THR 12 -2.452 -23.543 -2.007 91 3HG2 THR 12 HG23 THR 12 -2.179 -25.217 -2.485 92 H ILE 13 HN ILE 13 -0.925 -24.692 0.691 93 HA ILE 13 HA ILE 13 -0.312 -27.513 0.708 94 HB ILE 13 HB ILE 13 -1.903 -25.843 2.672 95 1HG1 ILE 13 HG12 ILE 13 0.469 -25.131 2.368 96 2HG1 ILE 13 HG11 ILE 13 0.137 -25.738 3.991 97 1HG2 ILE 13 HG21 ILE 13 -1.492 -27.693 4.249 98 2HG2 ILE 13 HG22 ILE 13 -0.760 -28.628 2.945 99 3HG2 ILE 13 HG23 ILE 13 -2.469 -28.196 2.870 100 1HD1 ILE 13 HD11 ILE 13 1.501 -27.253 1.772 101 2HD1 ILE 13 HD12 ILE 13 1.179 -27.869 3.395 102 3HD1 ILE 13 HD13 ILE 13 2.283 -26.513 3.167 103 H ILE 14 HN ILE 14 -1.745 -29.180 0.517 104 HA ILE 14 HA ILE 14 -4.014 -28.670 -1.160 105 HB ILE 14 HB ILE 14 -2.798 -31.217 -0.074 106 1HG1 ILE 14 HG12 ILE 14 -2.351 -31.622 -2.522 107 2HG1 ILE 14 HG11 ILE 14 -2.942 -29.998 -2.849 108 1HG2 ILE 14 HG21 ILE 14 -4.349 -32.469 -1.521 109 2HG2 ILE 14 HG22 ILE 14 -5.212 -30.972 -1.874 110 3HG2 ILE 14 HG23 ILE 14 -5.185 -31.608 -0.229 111 1HD1 ILE 14 HD11 ILE 14 -0.545 -30.699 -1.165 112 2HD1 ILE 14 HD12 ILE 14 -1.126 -29.069 -1.509 113 3HD1 ILE 14 HD13 ILE 14 -0.517 -30.083 -2.817 114 H TYR 15 HN TYR 15 -6.043 -28.408 -0.553 115 HA TYR 15 HA TYR 15 -7.007 -29.684 1.918 116 1HB TYR 15 HB2 TYR 15 -7.579 -26.864 0.969 117 2HB TYR 15 HB1 TYR 15 -8.539 -27.679 2.198 118 HD1 TYR 15 HD1 TYR 15 -7.515 -28.253 4.389 119 HD2 TYR 15 HD2 TYR 15 -5.432 -25.913 1.503 120 HE1 TYR 15 HE1 TYR 15 -5.970 -27.486 6.136 121 HE2 TYR 15 HE2 TYR 15 -3.878 -25.141 3.245 122 HH TYR 15 HH TYR 15 -3.615 -26.601 6.251 123 HA PRO 16 HA PRO 16 -8.788 -30.230 2.856 124 1HB PRO 16 HB2 PRO 16 -10.312 -32.438 3.062 125 2HB PRO 16 HB1 PRO 16 -11.019 -30.827 2.906 126 1HG PRO 16 HG2 PRO 16 -10.668 -32.953 0.833 127 2HG PRO 16 HG1 PRO 16 -12.035 -31.856 1.090 128 1HD PRO 16 HD2 PRO 16 -10.067 -31.487 -0.814 129 2HD PRO 16 HD1 PRO 16 -11.075 -30.188 -0.148 130 H CYS 17 HN CYS 17 -7.905 -31.943 4.162 131 HA CYS 17 HA CYS 17 -6.838 -34.344 3.120 132 1HB CYS 17 HB2 CYS 17 -5.269 -32.844 1.961 133 2HB CYS 17 HB1 CYS 17 -4.848 -32.080 3.491 134 HG CYS 17 HG CYS 17 -3.302 -34.010 4.460 135 H LEU 18 HN LEU 18 -5.420 -35.422 4.716 136 HA LEU 18 HA LEU 18 -6.350 -35.071 7.385 137 1HB LEU 18 HB2 LEU 18 -4.119 -36.758 6.226 138 2HB LEU 18 HB1 LEU 18 -4.627 -36.834 7.905 139 HG LEU 18 HG LEU 18 -6.524 -37.384 5.622 140 1HD1 LEU 18 HD11 LEU 18 -4.855 -39.376 7.162 141 2HD1 LEU 18 HD12 LEU 18 -4.677 -38.966 5.455 142 3HD1 LEU 18 HD13 LEU 18 -6.141 -39.769 6.021 143 1HD2 LEU 18 HD21 LEU 18 -6.599 -38.096 8.558 144 2HD2 LEU 18 HD22 LEU 18 -7.814 -38.534 7.356 145 3HD2 LEU 18 HD23 LEU 18 -7.554 -36.840 7.767 146 H TRP 19 HN TRP 19 -5.731 -33.353 8.551 147 HA TRP 19 HA TRP 19 -2.992 -32.336 8.327 148 1HB TRP 19 HB2 TRP 19 -4.960 -30.759 8.330 149 2HB TRP 19 HB1 TRP 19 -5.276 -31.238 9.993 150 HD1 TRP 19 HD1 TRP 19 -3.730 -30.187 11.882 151 HE1 TRP 19 HE1 TRP 19 -1.966 -28.312 11.870 152 HE3 TRP 19 HE3 TRP 19 -3.096 -29.692 6.830 153 HZ2 TRP 19 HZ2 TRP 19 -0.503 -26.826 9.976 154 HZ3 TRP 19 HZ3 TRP 19 -1.492 -28.022 6.007 155 HH2 TRP 19 HH2 TRP 19 -0.222 -26.616 7.547 156 H ASP 20 HN ASP 20 -1.467 -32.792 9.797 157 HA ASP 20 HA ASP 20 -2.245 -34.431 12.098 158 1HB ASP 20 HB2 ASP 20 0.112 -35.119 12.196 159 2HB ASP 20 HB1 ASP 20 -0.584 -35.423 10.610 160 H TYR 21 HN TYR 21 -2.261 -33.648 14.042 161 HA TYR 21 HA TYR 21 -1.004 -31.071 14.651 162 1HB TYR 21 HB2 TYR 21 -3.086 -32.695 16.147 163 2HB TYR 21 HB1 TYR 21 -2.437 -31.154 16.696 164 HD1 TYR 21 HD1 TYR 21 -3.375 -29.132 15.964 165 HD2 TYR 21 HD2 TYR 21 -4.392 -32.745 13.952 166 HE1 TYR 21 HE1 TYR 21 -5.134 -27.945 14.728 167 HE2 TYR 21 HE2 TYR 21 -6.154 -31.561 12.708 168 HH TYR 21 HH TYR 21 -6.427 -28.116 12.771 169 H ARG 22 HN ARG 22 0.686 -30.937 16.031 170 HA ARG 22 HA ARG 22 1.622 -33.354 17.395 171 1HB ARG 22 HB2 ARG 22 3.333 -32.063 16.253 172 2HB ARG 22 HB1 ARG 22 2.839 -30.593 17.078 173 1HG ARG 22 HG2 ARG 22 4.855 -31.375 18.088 174 2HG ARG 22 HG1 ARG 22 3.540 -31.630 19.233 175 1HD ARG 22 HD2 ARG 22 3.431 -34.003 18.491 176 2HD ARG 22 HD1 ARG 22 4.842 -33.715 17.474 177 HE ARG 22 HE ARG 22 4.781 -34.016 20.349 178 1HH1 ARG 22 HH11 ARG 22 6.646 -32.863 17.611 179 2HH1 ARG 22 HH12 ARG 22 8.156 -32.944 18.461 180 1HH2 ARG 22 HH21 ARG 22 6.778 -34.157 21.435 181 2HH2 ARG 22 HH22 ARG 22 8.234 -33.688 20.610 182 H VAL 23 HN VAL 23 0.652 -33.749 19.283 183 HA VAL 23 HA VAL 23 -0.147 -31.470 20.985 184 HB VAL 23 HB VAL 23 -1.275 -34.286 21.012 185 1HG1 VAL 23 HG11 VAL 23 -1.479 -33.131 23.153 186 2HG1 VAL 23 HG12 VAL 23 -3.058 -33.319 22.387 187 3HG1 VAL 23 HG13 VAL 23 -2.242 -31.756 22.351 188 1HG2 VAL 23 HG21 VAL 23 -1.825 -33.196 18.897 189 2HG2 VAL 23 HG22 VAL 23 -2.445 -31.791 19.765 190 3HG2 VAL 23 HG23 VAL 23 -3.260 -33.348 19.913 191 H ILE 24 HN ILE 24 0.769 -31.301 22.960 192 HA ILE 24 HA ILE 24 2.249 -33.641 23.993 193 HB ILE 24 HB ILE 24 2.927 -30.722 24.447 194 1HG1 ILE 24 HG12 ILE 24 4.340 -32.829 22.774 195 2HG1 ILE 24 HG11 ILE 24 3.433 -31.460 22.141 196 1HG2 ILE 24 HG21 ILE 24 3.497 -32.120 26.365 197 2HG2 ILE 24 HG22 ILE 24 4.959 -31.598 25.529 198 3HG2 ILE 24 HG23 ILE 24 4.360 -33.243 25.310 199 1HD1 ILE 24 HD11 ILE 24 5.960 -31.307 23.772 200 2HD1 ILE 24 HD12 ILE 24 5.052 -29.929 23.146 201 3HD1 ILE 24 HD13 ILE 24 5.818 -31.062 22.032 202 H MET 25 HN MET 25 1.086 -34.512 25.544 203 HA MET 25 HA MET 25 -0.339 -32.772 27.463 204 1HB MET 25 HB2 MET 25 -1.026 -35.617 26.660 205 2HB MET 25 HB1 MET 25 -1.941 -34.602 27.766 206 1HG MET 25 HG2 MET 25 -2.459 -33.064 25.943 207 2HG MET 25 HG1 MET 25 -1.516 -34.057 24.834 208 1HE MET 25 HE1 MET 25 -4.749 -33.768 26.993 209 2HE MET 25 HE2 MET 25 -3.999 -35.194 27.710 210 3HE MET 25 HE3 MET 25 -5.490 -35.353 26.781 211 H THR 26 HN THR 26 -0.475 -33.638 29.681 212 HA THR 26 HA THR 26 2.039 -34.958 30.424 213 HB THR 26 HB THR 26 1.367 -34.248 32.763 214 HG1 THR 26 HG1 THR 26 -0.288 -32.293 32.219 215 1HG2 THR 26 HG21 THR 26 2.969 -32.948 31.441 216 2HG2 THR 26 HG22 THR 26 1.953 -31.888 32.418 217 3HG2 THR 26 HG23 THR 26 1.640 -32.060 30.691 218 H THR 27 HN THR 27 -0.601 -36.236 29.422 219 HA THR 27 HA THR 27 -0.782 -38.267 31.530 220 HB THR 27 HB THR 27 -2.653 -36.697 31.900 221 HG1 THR 27 HG1 THR 27 -3.387 -38.603 32.515 222 1HG2 THR 27 HG21 THR 27 -3.531 -37.487 29.114 223 2HG2 THR 27 HG22 THR 27 -2.924 -35.902 29.588 224 3HG2 THR 27 HG23 THR 27 -4.448 -36.492 30.247 225 H LYS 28 HN LYS 28 -1.592 -40.288 30.823 226 HA LYS 28 HA LYS 28 -1.374 -40.775 27.938 227 1HB LYS 28 HB2 LYS 28 -1.394 -42.629 30.329 228 2HB LYS 28 HB1 LYS 28 -1.458 -43.210 28.672 229 1HG LYS 28 HG2 LYS 28 0.773 -41.548 29.837 230 2HG LYS 28 HG1 LYS 28 0.806 -43.300 29.636 231 1HD LYS 28 HD2 LYS 28 0.559 -41.254 27.421 232 2HD LYS 28 HD1 LYS 28 2.000 -42.192 27.813 233 1HE LYS 28 HE2 LYS 28 -0.642 -43.306 26.853 234 2HE LYS 28 HE1 LYS 28 0.823 -43.135 25.888 235 1HZ LYS 28 HZ1 LYS 28 0.576 -45.386 26.665 236 2HZ LYS 28 HZ2 LYS 28 0.496 -44.877 28.274 237 3HZ LYS 28 HZ3 LYS 28 1.927 -44.688 27.397 238 H ASP 29 HN ASP 29 -3.685 -40.075 30.214 239 HA ASP 29 HA ASP 29 -5.772 -41.675 28.894 240 1HB ASP 29 HB2 ASP 29 -5.670 -41.903 31.349 241 2HB ASP 29 HB1 ASP 29 -5.879 -40.162 31.524 242 H THR 30 HN THR 30 -6.336 -40.525 27.127 243 HA THR 30 HA THR 30 -7.400 -37.839 27.635 244 HB THR 30 HB THR 30 -5.256 -37.559 26.513 245 HG1 THR 30 HG1 THR 30 -6.037 -36.308 24.769 246 1HG2 THR 30 HG21 THR 30 -4.855 -38.366 24.242 247 2HG2 THR 30 HG22 THR 30 -6.401 -39.213 24.253 248 3HG2 THR 30 HG23 THR 30 -5.111 -39.718 25.346 249 H SER 31 HN SER 31 -9.495 -38.325 27.647 250 HA SER 31 HA SER 31 -10.661 -39.882 25.457 251 1HB SER 31 HB2 SER 31 -11.319 -40.453 27.779 252 2HB SER 31 HB1 SER 31 -11.931 -38.818 28.004 253 HG SER 31 HG SER 31 -12.954 -40.091 25.787 254 H THR 32 HN THR 32 -10.838 -36.715 27.027 255 HA THR 32 HA THR 32 -12.873 -35.541 25.557 256 HB THR 32 HB THR 32 -10.386 -34.117 26.544 257 HG1 THR 32 HG1 THR 32 -12.731 -34.985 27.915 258 1HG2 THR 32 HG21 THR 32 -11.880 -32.728 25.171 259 2HG2 THR 32 HG22 THR 32 -11.910 -32.215 26.857 260 3HG2 THR 32 HG23 THR 32 -13.242 -33.167 26.202 261 H LEU 33 HN LEU 33 -9.555 -36.166 24.682 262 HA LEU 33 HA LEU 33 -9.292 -34.465 22.468 263 1HB LEU 33 HB2 LEU 33 -7.432 -35.683 23.547 264 2HB LEU 33 HB1 LEU 33 -8.064 -37.193 22.918 265 HG LEU 33 HG LEU 33 -7.605 -36.464 20.627 266 1HD1 LEU 33 HD11 LEU 33 -6.386 -34.389 20.185 267 2HD1 LEU 33 HD12 LEU 33 -6.497 -33.953 21.890 268 3HD1 LEU 33 HD13 LEU 33 -7.959 -34.064 20.909 269 1HD2 LEU 33 HD21 LEU 33 -5.855 -37.660 21.810 270 2HD2 LEU 33 HD22 LEU 33 -5.247 -36.152 22.495 271 3HD2 LEU 33 HD23 LEU 33 -5.140 -36.440 20.757 272 H LYS 34 HN LYS 34 -10.481 -37.810 22.713 273 HA LYS 34 HA LYS 34 -11.061 -38.011 19.912 274 1HB LYS 34 HB2 LYS 34 -11.951 -39.704 22.260 275 2HB LYS 34 HB1 LYS 34 -12.294 -40.090 20.578 276 1HG LYS 34 HG2 LYS 34 -9.876 -40.215 20.129 277 2HG LYS 34 HG1 LYS 34 -9.558 -39.880 21.830 278 1HD LYS 34 HD2 LYS 34 -11.070 -42.273 20.762 279 2HD LYS 34 HD1 LYS 34 -9.393 -42.281 21.310 280 1HE LYS 34 HE2 LYS 34 -10.170 -41.573 23.558 281 2HE LYS 34 HE1 LYS 34 -11.835 -41.689 22.989 282 1HZ LYS 34 HZ1 LYS 34 -9.870 -43.903 23.215 283 2HZ LYS 34 HZ2 LYS 34 -11.392 -44.058 22.492 284 3HZ LYS 34 HZ3 LYS 34 -11.272 -43.685 24.137 285 H GLU 35 HN GLU 35 -12.818 -37.070 22.791 286 HA GLU 35 HA GLU 35 -15.438 -37.143 21.861 287 1HB GLU 35 HB2 GLU 35 -14.174 -35.152 23.760 288 2HB GLU 35 HB1 GLU 35 -15.904 -35.385 23.553 289 1HG GLU 35 HG2 GLU 35 -13.982 -37.502 24.510 290 2HG GLU 35 HG1 GLU 35 -14.986 -36.501 25.556 291 H LEU 36 HN LEU 36 -13.058 -34.494 21.626 292 HA LEU 36 HA LEU 36 -14.815 -32.697 20.315 293 1HB LEU 36 HB2 LEU 36 -12.951 -31.280 19.977 294 2HB LEU 36 HB1 LEU 36 -12.693 -32.068 21.519 295 HG LEU 36 HG LEU 36 -11.239 -33.731 20.019 296 1HD1 LEU 36 HD11 LEU 36 -10.015 -32.509 18.280 297 2HD1 LEU 36 HD12 LEU 36 -11.105 -31.136 18.484 298 3HD1 LEU 36 HD13 LEU 36 -11.726 -32.675 17.889 299 1HD2 LEU 36 HD21 LEU 36 -10.283 -31.025 20.951 300 2HD2 LEU 36 HD22 LEU 36 -9.258 -32.418 20.604 301 3HD2 LEU 36 HD23 LEU 36 -10.411 -32.482 21.937 302 H LEU 37 HN LEU 37 -12.755 -35.275 19.198 303 HA LEU 37 HA LEU 37 -12.868 -34.586 16.419 304 1HB LEU 37 HB2 LEU 37 -12.239 -37.238 17.737 305 2HB LEU 37 HB1 LEU 37 -11.919 -36.827 16.061 306 HG LEU 37 HG LEU 37 -10.646 -35.424 18.421 307 1HD1 LEU 37 HD11 LEU 37 -9.941 -37.768 18.309 308 2HD1 LEU 37 HD12 LEU 37 -8.626 -36.666 17.903 309 3HD1 LEU 37 HD13 LEU 37 -9.467 -37.541 16.624 310 1HD2 LEU 37 HD21 LEU 37 -10.789 -34.058 16.390 311 2HD2 LEU 37 HD22 LEU 37 -9.989 -35.336 15.475 312 3HD2 LEU 37 HD23 LEU 37 -9.122 -34.497 16.762 313 H GLU 38 HN GLU 38 -14.747 -36.593 18.593 314 HA GLU 38 HA GLU 38 -16.260 -37.992 16.662 315 1HB GLU 38 HB2 GLU 38 -16.774 -37.359 19.570 316 2HB GLU 38 HB1 GLU 38 -17.863 -38.350 18.609 317 1HG GLU 38 HG2 GLU 38 -14.945 -38.992 18.978 318 2HG GLU 38 HG1 GLU 38 -16.208 -39.593 20.044 319 H THR 39 HN THR 39 -16.548 -34.767 17.954 320 HA THR 39 HA THR 39 -19.273 -34.303 17.400 321 HB THR 39 HB THR 39 -18.752 -31.919 17.423 322 HG1 THR 39 HG1 THR 39 -16.047 -32.154 17.816 323 1HG2 THR 39 HG21 THR 39 -17.621 -31.749 19.601 324 2HG2 THR 39 HG22 THR 39 -17.081 -33.422 19.453 325 3HG2 THR 39 HG23 THR 39 -18.802 -33.059 19.594 326 H TYR 40 HN TYR 40 -16.387 -34.172 15.411 327 HA TYR 40 HA TYR 40 -17.744 -33.083 13.108 328 1HB TYR 40 HB2 TYR 40 -14.980 -34.305 13.352 329 2HB TYR 40 HB1 TYR 40 -15.588 -33.407 11.964 330 HD1 TYR 40 HD1 TYR 40 -15.962 -30.955 12.136 331 HD2 TYR 40 HD2 TYR 40 -14.211 -33.169 15.325 332 HE1 TYR 40 HE1 TYR 40 -15.157 -28.862 13.144 333 HE2 TYR 40 HE2 TYR 40 -13.404 -31.080 16.341 334 HH TYR 40 HH TYR 40 -14.429 -27.972 15.209 335 H GLN 41 HN GLN 41 -16.959 -36.222 14.369 336 HA GLN 41 HA GLN 41 -17.354 -38.346 13.687 337 1HB GLN 41 HB2 GLN 41 -19.551 -36.887 12.226 338 2HB GLN 41 HB1 GLN 41 -19.383 -38.636 12.136 339 1HG GLN 41 HG2 GLN 41 -19.808 -37.020 14.645 340 2HG GLN 41 HG1 GLN 41 -21.019 -37.994 13.812 341 1HE2 GLN 41 HE21 GLN 41 -20.022 -38.200 16.550 342 2HE2 GLN 41 HE22 GLN 41 -19.414 -39.811 16.716 343 H ARG 42 HN ARG 42 -15.382 -36.823 12.221 344 HA ARG 42 HA ARG 42 -15.472 -38.239 9.636 345 1HB ARG 42 HB2 ARG 42 -13.859 -36.602 8.804 346 2HB ARG 42 HB1 ARG 42 -15.286 -35.789 9.427 347 1HG ARG 42 HG2 ARG 42 -14.025 -35.353 11.541 348 2HG ARG 42 HG1 ARG 42 -12.589 -36.008 10.751 349 1HD ARG 42 HD2 ARG 42 -12.553 -33.602 10.581 350 2HD ARG 42 HD1 ARG 42 -12.833 -34.287 8.980 351 HE ARG 42 HE ARG 42 -15.237 -33.583 10.418 352 1HH1 ARG 42 HH11 ARG 42 -12.780 -32.455 8.183 353 2HH1 ARG 42 HH12 ARG 42 -13.772 -31.180 7.549 354 1HH2 ARG 42 HH21 ARG 42 -16.523 -31.899 9.599 355 2HH2 ARG 42 HH22 ARG 42 -15.886 -30.845 8.377 356 HA PRO 43 HA PRO 43 -12.399 -41.053 10.953 357 1HB PRO 43 HB2 PRO 43 -10.688 -41.120 8.766 358 2HB PRO 43 HB1 PRO 43 -12.210 -42.009 8.883 359 1HG PRO 43 HG2 PRO 43 -11.642 -39.394 7.540 360 2HG PRO 43 HG1 PRO 43 -12.652 -40.745 6.986 361 1HD PRO 43 HD2 PRO 43 -13.749 -38.541 8.040 362 2HD PRO 43 HD1 PRO 43 -14.427 -40.148 8.374 363 H PHE 44 HN PHE 44 -10.586 -41.000 12.165 364 HA PHE 44 HA PHE 44 -8.566 -38.957 11.674 365 1HB PHE 44 HB2 PHE 44 -8.590 -38.171 14.001 366 2HB PHE 44 HB1 PHE 44 -10.123 -37.852 13.202 367 HD1 PHE 44 HD1 PHE 44 -8.425 -40.013 15.675 368 HD2 PHE 44 HD2 PHE 44 -12.163 -38.786 14.027 369 HE1 PHE 44 HE1 PHE 44 -9.603 -41.114 17.526 370 HE2 PHE 44 HE2 PHE 44 -13.343 -39.892 15.889 371 HZ PHE 44 HZ PHE 44 -12.060 -41.054 17.638 372 H LYS 45 HN LYS 45 -6.568 -39.381 12.614 373 HA LYS 45 HA LYS 45 -6.190 -42.145 13.565 374 1HB LYS 45 HB2 LYS 45 -5.125 -41.587 11.367 375 2HB LYS 45 HB1 LYS 45 -4.185 -40.339 12.175 376 1HG LYS 45 HG2 LYS 45 -3.229 -42.144 13.643 377 2HG LYS 45 HG1 LYS 45 -4.025 -43.318 12.597 378 1HD LYS 45 HD2 LYS 45 -1.744 -43.109 11.881 379 2HD LYS 45 HD1 LYS 45 -2.766 -42.342 10.663 380 1HE LYS 45 HE2 LYS 45 -2.218 -40.152 11.506 381 2HE LYS 45 HE1 LYS 45 -1.346 -40.849 12.872 382 1HZ LYS 45 HZ1 LYS 45 0.223 -41.824 11.270 383 2HZ LYS 45 HZ2 LYS 45 0.204 -40.136 11.212 384 3HZ LYS 45 HZ3 LYS 45 -0.579 -41.031 10.009 385 H LEU 46 HN LEU 46 -5.812 -42.213 15.694 386 HA LEU 46 HA LEU 46 -4.404 -39.954 16.968 387 1HB LEU 46 HB2 LEU 46 -6.770 -40.506 17.711 388 2HB LEU 46 HB1 LEU 46 -6.146 -42.020 18.330 389 HG LEU 46 HG LEU 46 -5.062 -39.366 19.281 390 1HD1 LEU 46 HD11 LEU 46 -6.607 -39.486 21.169 391 2HD1 LEU 46 HD12 LEU 46 -7.391 -40.891 20.447 392 3HD1 LEU 46 HD13 LEU 46 -7.473 -39.324 19.640 393 1HD2 LEU 46 HD21 LEU 46 -4.461 -40.657 21.280 394 2HD2 LEU 46 HD22 LEU 46 -3.720 -41.334 19.830 395 3HD2 LEU 46 HD23 LEU 46 -5.133 -42.113 20.543 396 H GLU 47 HN GLU 47 -2.320 -40.410 17.167 397 HA GLU 47 HA GLU 47 -1.507 -43.177 17.806 398 1HB GLU 47 HB2 GLU 47 -0.282 -41.248 15.823 399 2HB GLU 47 HB1 GLU 47 0.532 -42.705 16.378 400 1HG GLU 47 HG2 GLU 47 -2.170 -42.744 15.054 401 2HG GLU 47 HG1 GLU 47 -0.655 -42.855 14.160 402 H PHE 48 HN PHE 48 0.416 -43.418 18.992 403 HA PHE 48 HA PHE 48 1.165 -41.116 20.633 404 1HB PHE 48 HB2 PHE 48 0.682 -43.247 21.766 405 2HB PHE 48 HB1 PHE 48 1.927 -44.050 20.821 406 HD1 PHE 48 HD1 PHE 48 4.201 -43.985 21.489 407 HD2 PHE 48 HD2 PHE 48 1.337 -41.507 23.443 408 HE1 PHE 48 HE1 PHE 48 5.853 -43.452 23.229 409 HE2 PHE 48 HE2 PHE 48 2.989 -40.971 25.185 410 HZ PHE 48 HZ PHE 48 5.247 -41.948 25.079 411 H LYS 49 HN LYS 49 2.690 -39.840 19.763 412 HA LYS 49 HA LYS 49 4.462 -40.777 17.708 413 1HB LYS 49 HB2 LYS 49 4.110 -38.131 19.108 414 2HB LYS 49 HB1 LYS 49 5.450 -38.400 18.002 415 1HG LYS 49 HG2 LYS 49 2.528 -38.671 17.299 416 2HG LYS 49 HG1 LYS 49 3.552 -37.282 16.920 417 1HD LYS 49 HD2 LYS 49 5.004 -38.727 15.562 418 2HD LYS 49 HD1 LYS 49 3.983 -40.114 15.946 419 1HE LYS 49 HE2 LYS 49 2.078 -38.960 14.857 420 2HE LYS 49 HE1 LYS 49 3.167 -37.650 14.400 421 1HZ LYS 49 HZ1 LYS 49 3.543 -40.478 13.591 422 2HZ LYS 49 HZ2 LYS 49 4.404 -39.136 13.033 423 3HZ LYS 49 HZ3 LYS 49 2.772 -39.318 12.633 424 H ASN 50 HN ASN 50 5.062 -39.367 20.930 425 HA ASN 50 HA ASN 50 7.285 -41.073 21.481 426 1HB ASN 50 HB2 ASN 50 8.317 -39.604 19.758 427 2HB ASN 50 HB1 ASN 50 7.889 -38.191 20.715 428 1HD2 ASN 50 HD21 ASN 50 9.969 -37.497 20.995 429 2HD2 ASN 50 HD22 ASN 50 11.125 -38.331 21.971 430 H THR 51 HN THR 51 8.449 -40.251 23.508 431 HA THR 51 HA THR 51 6.928 -38.282 25.042 432 HB THR 51 HB THR 51 5.960 -40.450 25.708 433 HG1 THR 51 HG1 THR 51 6.351 -38.712 27.270 434 1HG2 THR 51 HG21 THR 51 8.767 -41.175 26.568 435 2HG2 THR 51 HG22 THR 51 7.875 -41.908 25.234 436 3HG2 THR 51 HG23 THR 51 7.312 -42.119 26.892 437 H SER 52 HN SER 52 8.163 -37.182 26.542 438 HA SER 52 HA SER 52 10.922 -36.972 26.184 439 1HB SER 52 HB2 SER 52 9.486 -35.226 27.233 440 2HB SER 52 HB1 SER 52 9.316 -36.249 28.659 441 HG SER 52 HG SER 52 11.436 -34.683 27.829 442 H LYS 53 HN LYS 53 12.682 -37.668 27.523 443 HA LYS 53 HA LYS 53 12.679 -40.371 28.129 444 1HB LYS 53 HB2 LYS 53 14.846 -40.005 29.198 445 2HB LYS 53 HB1 LYS 53 14.723 -39.087 27.705 446 1HG LYS 53 HG2 LYS 53 14.319 -37.044 28.945 447 2HG LYS 53 HG1 LYS 53 14.308 -37.939 30.466 448 1HD LYS 53 HD2 LYS 53 16.665 -38.621 30.019 449 2HD LYS 53 HD1 LYS 53 16.653 -37.591 28.587 450 1HE LYS 53 HE2 LYS 53 16.255 -35.629 29.975 451 2HE LYS 53 HE1 LYS 53 16.176 -36.641 31.417 452 1HZ LYS 53 HZ1 LYS 53 18.482 -37.257 31.073 453 2HZ LYS 53 HZ2 LYS 53 18.335 -35.577 31.180 454 3HZ LYS 53 HZ3 LYS 53 18.559 -36.309 29.671 455 H ASN 54 HN ASN 54 11.921 -37.653 30.195 456 HA ASN 54 HA ASN 54 12.010 -39.128 32.658 457 1HB ASN 54 HB2 ASN 54 12.439 -36.704 32.578 458 2HB ASN 54 HB1 ASN 54 10.792 -36.426 32.027 459 1HD2 ASN 54 HD21 ASN 54 12.794 -37.351 34.721 460 2HD2 ASN 54 HD22 ASN 54 11.598 -37.107 35.946 461 H ALA 55 HN ALA 55 9.767 -38.863 30.141 462 HA ALA 55 HA ALA 55 7.678 -39.651 29.786 463 1HB ALA 55 HB1 ALA 55 6.812 -41.423 31.220 464 2HB ALA 55 HB2 ALA 55 8.034 -41.052 32.438 465 3HB ALA 55 HB3 ALA 55 8.519 -41.685 30.864 466 H LYS 56 HN LYS 56 8.189 -37.151 31.346 467 HA LYS 56 HA LYS 56 5.732 -36.875 32.888 468 1HB LYS 56 HB2 LYS 56 7.707 -35.738 33.731 469 2HB LYS 56 HB1 LYS 56 7.923 -34.895 32.203 470 1HG LYS 56 HG2 LYS 56 5.890 -33.629 32.564 471 2HG LYS 56 HG1 LYS 56 5.552 -34.538 34.037 472 1HD LYS 56 HD2 LYS 56 8.022 -32.844 33.639 473 2HD LYS 56 HD1 LYS 56 6.544 -32.256 34.401 474 1HE LYS 56 HE2 LYS 56 8.134 -34.636 35.372 475 2HE LYS 56 HE1 LYS 56 8.298 -33.003 36.012 476 1HZ LYS 56 HZ1 LYS 56 5.802 -34.617 36.051 477 2HZ LYS 56 HZ2 LYS 56 5.985 -33.061 36.691 478 3HZ LYS 56 HZ3 LYS 56 6.827 -34.357 37.371 479 H PHE 57 HN PHE 57 7.083 -35.923 29.793 480 HA PHE 57 HA PHE 57 4.496 -34.734 29.023 481 1HB PHE 57 HB2 PHE 57 7.234 -34.223 27.825 482 2HB PHE 57 HB1 PHE 57 5.732 -33.444 27.340 483 HD1 PHE 57 HD1 PHE 57 8.560 -33.293 29.506 484 HD2 PHE 57 HD2 PHE 57 4.506 -32.043 29.105 485 HE1 PHE 57 HE1 PHE 57 8.943 -31.524 31.173 486 HE2 PHE 57 HE2 PHE 57 4.884 -30.273 30.771 487 HZ PHE 57 HZ PHE 57 7.104 -30.011 31.807 488 H TYR 58 HN TYR 58 3.345 -35.818 27.590 489 HA TYR 58 HA TYR 58 4.646 -37.897 25.951 490 1HB TYR 58 HB2 TYR 58 1.705 -37.715 26.660 491 2HB TYR 58 HB1 TYR 58 2.546 -39.075 25.925 492 HD1 TYR 58 HD1 TYR 58 4.215 -40.375 27.329 493 HD2 TYR 58 HD2 TYR 58 1.577 -37.483 29.008 494 HE1 TYR 58 HE1 TYR 58 4.576 -41.344 29.561 495 HE2 TYR 58 HE2 TYR 58 1.933 -38.444 31.238 496 HH TYR 58 HH TYR 58 4.415 -40.588 31.945 497 H SER 59 HN SER 59 4.556 -37.710 23.799 498 HA SER 59 HA SER 59 3.052 -35.480 22.642 499 1HB SER 59 HB2 SER 59 5.354 -37.109 21.527 500 2HB SER 59 HB1 SER 59 4.549 -35.790 20.676 501 HG SER 59 HG SER 59 6.364 -35.713 22.770 502 H PHE 60 HN PHE 60 1.128 -35.998 21.877 503 HA PHE 60 HA PHE 60 0.692 -38.633 20.641 504 1HB PHE 60 HB2 PHE 60 -1.310 -36.594 21.654 505 2HB PHE 60 HB1 PHE 60 -1.728 -38.128 20.899 506 HD1 PHE 60 HD1 PHE 60 -1.189 -36.486 23.964 507 HD2 PHE 60 HD2 PHE 60 -0.682 -40.253 22.035 508 HE1 PHE 60 HE1 PHE 60 -1.112 -37.597 26.156 509 HE2 PHE 60 HE2 PHE 60 -0.601 -41.368 24.227 510 HZ PHE 60 HZ PHE 60 -0.816 -40.041 26.291 511 H ASN 61 HN ASN 61 -0.851 -38.611 18.794 512 HA ASN 61 HA ASN 61 -0.371 -36.312 17.004 513 1HB ASN 61 HB2 ASN 61 1.045 -38.111 16.250 514 2HB ASN 61 HB1 ASN 61 -0.270 -39.274 16.371 515 1HD2 ASN 61 HD21 ASN 61 -1.929 -39.232 14.804 516 2HD2 ASN 61 HD22 ASN 61 -1.705 -38.452 13.277 517 H VAL 62 HN VAL 62 -2.163 -35.433 16.229 518 HA VAL 62 HA VAL 62 -4.587 -37.108 15.973 519 HB VAL 62 HB VAL 62 -4.417 -34.093 16.300 520 1HG1 VAL 62 HG11 VAL 62 -6.836 -35.901 16.130 521 2HG1 VAL 62 HG12 VAL 62 -6.307 -34.746 14.907 522 3HG1 VAL 62 HG13 VAL 62 -6.868 -34.171 16.476 523 1HG2 VAL 62 HG21 VAL 62 -5.370 -36.201 18.248 524 2HG2 VAL 62 HG22 VAL 62 -5.452 -34.457 18.496 525 3HG2 VAL 62 HG23 VAL 62 -3.885 -35.258 18.382 526 H SER 63 HN SER 63 -4.974 -37.617 13.896 527 HA SER 63 HA SER 63 -4.319 -35.616 11.827 528 1HB SER 63 HB2 SER 63 -4.058 -38.628 11.554 529 2HB SER 63 HB1 SER 63 -3.705 -37.434 10.301 530 HG SER 63 HG SER 63 -2.242 -36.581 12.135 531 H MET 64 HN MET 64 -6.222 -34.830 11.193 532 HA MET 64 HA MET 64 -8.354 -36.730 10.481 533 1HB MET 64 HB2 MET 64 -10.049 -35.284 11.499 534 2HB MET 64 HB1 MET 64 -8.899 -35.835 12.707 535 1HG MET 64 HG2 MET 64 -7.722 -33.644 12.481 536 2HG MET 64 HG1 MET 64 -9.036 -33.111 11.434 537 1HE MET 64 HE1 MET 64 -11.511 -34.623 12.886 538 2HE MET 64 HE2 MET 64 -11.611 -32.966 12.286 539 3HE MET 64 HE3 MET 64 -12.096 -33.338 13.941 540 H GLU 65 HN GLU 65 -9.798 -35.968 8.860 541 HA GLU 65 HA GLU 65 -8.528 -34.387 6.873 542 1HB GLU 65 HB2 GLU 65 -11.426 -35.254 7.002 543 2HB GLU 65 HB1 GLU 65 -10.567 -34.690 5.574 544 1HG GLU 65 HG2 GLU 65 -9.056 -36.656 5.779 545 2HG GLU 65 HG1 GLU 65 -10.070 -37.238 7.100 546 H VAL 66 HN VAL 66 -8.360 -32.258 6.930 547 HA VAL 66 HA VAL 66 -10.502 -30.664 8.154 548 HB VAL 66 HB VAL 66 -8.908 -28.765 8.051 549 1HG1 VAL 66 HG11 VAL 66 -7.383 -29.571 9.808 550 2HG1 VAL 66 HG12 VAL 66 -7.837 -31.233 9.429 551 3HG1 VAL 66 HG13 VAL 66 -9.041 -30.116 10.073 552 1HG2 VAL 66 HG21 VAL 66 -7.575 -29.456 6.122 553 2HG2 VAL 66 HG22 VAL 66 -6.941 -30.830 7.031 554 3HG2 VAL 66 HG23 VAL 66 -6.537 -29.183 7.522 555 H SER 67 HN SER 67 -11.850 -29.511 6.929 556 HA SER 67 HA SER 67 -12.056 -29.996 4.172 557 1HB SER 67 HB2 SER 67 -13.343 -27.705 5.677 558 2HB SER 67 HB1 SER 67 -13.954 -28.529 4.242 559 HG SER 67 HG SER 67 -15.046 -29.495 5.841 560 H ASN 68 HN ASN 68 -10.990 -27.158 5.979 561 HA ASN 68 HA ASN 68 -9.059 -26.453 4.014 562 1HB ASN 68 HB2 ASN 68 -10.003 -24.153 3.563 563 2HB ASN 68 HB1 ASN 68 -10.891 -25.471 2.811 564 1HD2 ASN 68 HD21 ASN 68 -10.980 -22.934 5.135 565 2HD2 ASN 68 HD22 ASN 68 -12.660 -23.050 5.514 566 H GLU 69 HN GLU 69 -8.668 -23.759 4.807 567 HA GLU 69 HA GLU 69 -7.079 -24.229 7.050 568 1HB GLU 69 HB2 GLU 69 -6.667 -22.414 5.442 569 2HB GLU 69 HB1 GLU 69 -8.091 -21.566 6.033 570 1HG GLU 69 HG2 GLU 69 -7.036 -21.410 8.260 571 2HG GLU 69 HG1 GLU 69 -5.593 -22.183 7.606 572 H SER 70 HN SER 70 -10.371 -23.077 6.831 573 HA SER 70 HA SER 70 -10.681 -21.897 9.326 574 1HB SER 70 HB2 SER 70 -12.330 -21.833 7.431 575 2HB SER 70 HB1 SER 70 -12.786 -23.486 7.834 576 HG SER 70 HG SER 70 -13.850 -22.799 9.530 577 H GLU 71 HN GLU 71 -11.159 -25.293 8.369 578 HA GLU 71 HA GLU 71 -12.039 -26.182 10.908 579 1HB GLU 71 HB2 GLU 71 -10.870 -27.672 8.550 580 2HB GLU 71 HB1 GLU 71 -11.427 -28.484 10.006 581 1HG GLU 71 HG2 GLU 71 -13.095 -28.535 8.214 582 2HG GLU 71 HG1 GLU 71 -13.678 -27.690 9.648 583 H ARG 72 HN ARG 72 -8.847 -26.360 9.318 584 HA ARG 72 HA ARG 72 -7.618 -27.749 11.438 585 1HB ARG 72 HB2 ARG 72 -5.458 -27.071 10.401 586 2HB ARG 72 HB1 ARG 72 -6.585 -27.817 9.283 587 1HG ARG 72 HG2 ARG 72 -5.731 -26.084 8.034 588 2HG ARG 72 HG1 ARG 72 -7.218 -25.380 8.664 589 1HD ARG 72 HD2 ARG 72 -5.420 -23.776 8.846 590 2HD ARG 72 HD1 ARG 72 -5.903 -24.297 10.460 591 HE ARG 72 HE ARG 72 -3.701 -25.778 9.329 592 1HH1 ARG 72 HH11 ARG 72 -4.618 -22.989 11.241 593 2HH1 ARG 72 HH12 ARG 72 -3.063 -22.852 12.002 594 1HH2 ARG 72 HH21 ARG 72 -1.663 -25.576 10.328 595 2HH2 ARG 72 HH22 ARG 72 -1.394 -24.315 11.481 596 H ASN 73 HN ASN 73 -8.596 -24.511 11.191 597 HA ASN 73 HA ASN 73 -6.820 -23.538 13.272 598 1HB ASN 73 HB2 ASN 73 -9.179 -22.289 11.844 599 2HB ASN 73 HB1 ASN 73 -8.332 -21.490 13.162 600 1HD2 ASN 73 HD21 ASN 73 -8.633 -20.658 10.415 601 2HD2 ASN 73 HD22 ASN 73 -7.032 -20.474 9.789 602 H GLU 74 HN GLU 74 -10.280 -24.345 12.928 603 HA GLU 74 HA GLU 74 -10.973 -23.611 15.567 604 1HB GLU 74 HB2 GLU 74 -13.093 -24.645 15.182 605 2HB GLU 74 HB1 GLU 74 -12.602 -23.883 13.679 606 1HG GLU 74 HG2 GLU 74 -12.017 -26.003 12.725 607 2HG GLU 74 HG1 GLU 74 -12.288 -26.819 14.264 608 H ILE 75 HN ILE 75 -10.093 -26.703 14.119 609 HA ILE 75 HA ILE 75 -10.590 -28.332 16.355 610 HB ILE 75 HB ILE 75 -8.611 -28.756 14.103 611 1HG1 ILE 75 HG12 ILE 75 -11.434 -29.824 14.343 612 2HG1 ILE 75 HG11 ILE 75 -11.050 -28.332 13.494 613 1HG2 ILE 75 HG21 ILE 75 -8.836 -31.153 14.631 614 2HG2 ILE 75 HG22 ILE 75 -9.849 -30.747 16.016 615 3HG2 ILE 75 HG23 ILE 75 -8.158 -30.246 15.983 616 1HD1 ILE 75 HD11 ILE 75 -11.281 -30.165 11.949 617 2HD1 ILE 75 HD12 ILE 75 -10.036 -31.077 12.802 618 3HD1 ILE 75 HD13 ILE 75 -9.617 -29.583 11.962 619 H PHE 76 HN PHE 76 -7.704 -26.601 15.283 620 HA PHE 76 HA PHE 76 -5.841 -27.544 17.112 621 1HB PHE 76 HB2 PHE 76 -5.251 -26.085 15.233 622 2HB PHE 76 HB1 PHE 76 -6.129 -24.750 15.969 623 HD1 PHE 76 HD1 PHE 76 -5.021 -23.271 17.403 624 HD2 PHE 76 HD2 PHE 76 -3.259 -27.054 16.540 625 HE1 PHE 76 HE1 PHE 76 -2.972 -22.579 18.570 626 HE2 PHE 76 HE2 PHE 76 -1.207 -26.364 17.708 627 HZ PHE 76 HZ PHE 76 -1.060 -24.126 18.724 628 H GLN 77 HN GLN 77 -8.314 -25.066 17.467 629 HA GLN 77 HA GLN 77 -7.517 -24.214 20.067 630 1HB GLN 77 HB2 GLN 77 -10.191 -23.947 18.668 631 2HB GLN 77 HB1 GLN 77 -9.716 -23.086 20.127 632 1HG GLN 77 HG2 GLN 77 -7.932 -21.959 18.893 633 2HG GLN 77 HG1 GLN 77 -8.388 -22.834 17.430 634 1HE2 GLN 77 HE21 GLN 77 -10.291 -22.267 16.360 635 2HE2 GLN 77 HE22 GLN 77 -11.125 -20.786 16.673 636 H LYS 78 HN LYS 78 -9.771 -26.638 18.837 637 HA LYS 78 HA LYS 78 -11.107 -27.251 21.237 638 1HB LYS 78 HB2 LYS 78 -10.419 -29.318 19.143 639 2HB LYS 78 HB1 LYS 78 -11.820 -29.274 20.198 640 1HG LYS 78 HG2 LYS 78 -11.289 -27.349 17.944 641 2HG LYS 78 HG1 LYS 78 -12.338 -28.759 17.850 642 1HD LYS 78 HD2 LYS 78 -13.783 -27.791 19.591 643 2HD LYS 78 HD1 LYS 78 -12.732 -26.371 19.668 644 1HE LYS 78 HE2 LYS 78 -13.215 -25.876 17.321 645 2HE LYS 78 HE1 LYS 78 -14.234 -27.309 17.215 646 1HZ LYS 78 HZ1 LYS 78 -15.702 -26.309 18.876 647 2HZ LYS 78 HZ2 LYS 78 -15.566 -25.349 17.494 648 3HZ LYS 78 HZ3 LYS 78 -14.737 -24.920 18.903 649 H ILE 79 HN ILE 79 -8.062 -28.328 19.882 650 HA ILE 79 HA ILE 79 -7.492 -30.491 21.571 651 HB ILE 79 HB ILE 79 -5.485 -28.594 20.320 652 1HG1 ILE 79 HG12 ILE 79 -7.063 -29.467 18.640 653 2HG1 ILE 79 HG11 ILE 79 -5.449 -30.123 18.405 654 1HG2 ILE 79 HG21 ILE 79 -4.472 -30.049 21.982 655 2HG2 ILE 79 HG22 ILE 79 -3.972 -30.544 20.366 656 3HG2 ILE 79 HG23 ILE 79 -5.204 -31.465 21.227 657 1HD1 ILE 79 HD11 ILE 79 -7.758 -31.553 19.704 658 2HD1 ILE 79 HD12 ILE 79 -6.143 -32.214 19.439 659 3HD1 ILE 79 HD13 ILE 79 -7.164 -31.802 18.061 660 H SER 80 HN SER 80 -7.219 -27.058 22.070 661 HA SER 80 HA SER 80 -5.454 -27.222 24.333 662 1HB SER 80 HB2 SER 80 -5.541 -25.241 22.862 663 2HB SER 80 HB1 SER 80 -7.202 -24.942 23.367 664 HG SER 80 HG SER 80 -6.228 -24.887 25.583 665 H GLN 81 HN GLN 81 -8.799 -27.682 23.860 666 HA GLN 81 HA GLN 81 -9.635 -26.622 26.423 667 1HB GLN 81 HB2 GLN 81 -11.193 -28.126 24.310 668 2HB GLN 81 HB1 GLN 81 -11.889 -27.352 25.728 669 1HG GLN 81 HG2 GLN 81 -11.080 -25.174 24.913 670 2HG GLN 81 HG1 GLN 81 -10.441 -25.967 23.474 671 1HE2 GLN 81 HE21 GLN 81 -12.711 -27.807 23.275 672 2HE2 GLN 81 HE22 GLN 81 -14.036 -26.868 22.690 673 H LEU 82 HN LEU 82 -7.998 -29.330 25.778 674 HA LEU 82 HA LEU 82 -9.627 -31.264 27.174 675 1HB LEU 82 HB2 LEU 82 -6.677 -31.642 26.806 676 2HB LEU 82 HB1 LEU 82 -7.964 -32.828 26.770 677 HG LEU 82 HG LEU 82 -7.373 -30.818 24.597 678 1HD1 LEU 82 HD11 LEU 82 -6.966 -33.805 24.659 679 2HD1 LEU 82 HD12 LEU 82 -5.699 -32.577 24.715 680 3HD1 LEU 82 HD13 LEU 82 -6.698 -32.746 23.273 681 1HD2 LEU 82 HD21 LEU 82 -9.061 -32.016 23.293 682 2HD2 LEU 82 HD22 LEU 82 -9.751 -31.268 24.732 683 3HD2 LEU 82 HD23 LEU 82 -9.447 -33.005 24.702 684 H ASP 83 HN ASP 83 -7.394 -28.816 28.021 685 HA ASP 83 HA ASP 83 -6.717 -27.991 30.027 686 1HB ASP 83 HB2 ASP 83 -8.872 -28.627 30.988 687 2HB ASP 83 HB1 ASP 83 -8.312 -30.278 31.218 688 H LYS 84 HN LYS 84 -6.304 -31.395 29.382 689 HA LYS 84 HA LYS 84 -4.145 -31.725 31.295 690 1HB LYS 84 HB2 LYS 84 -4.838 -33.789 29.233 691 2HB LYS 84 HB1 LYS 84 -4.363 -34.007 30.914 692 1HG LYS 84 HG2 LYS 84 -6.553 -33.243 31.651 693 2HG LYS 84 HG1 LYS 84 -7.025 -32.945 29.981 694 1HD LYS 84 HD2 LYS 84 -7.995 -35.002 30.458 695 2HD LYS 84 HD1 LYS 84 -6.517 -35.442 29.603 696 1HE LYS 84 HE2 LYS 84 -6.893 -36.851 31.592 697 2HE LYS 84 HE1 LYS 84 -5.400 -35.920 31.706 698 1HZ LYS 84 HZ1 LYS 84 -6.645 -35.898 33.782 699 2HZ LYS 84 HZ2 LYS 84 -7.974 -35.202 33.005 700 3HZ LYS 84 HZ3 LYS 84 -6.524 -34.338 33.138 701 H VAL 85 HN VAL 85 -4.200 -30.184 28.497 702 HA VAL 85 HA VAL 85 -1.759 -31.371 27.365 703 HB VAL 85 HB VAL 85 -3.610 -31.195 25.782 704 1HG1 VAL 85 HG11 VAL 85 -4.836 -29.345 26.789 705 2HG1 VAL 85 HG12 VAL 85 -4.515 -29.024 25.085 706 3HG1 VAL 85 HG13 VAL 85 -3.553 -28.223 26.328 707 1HG2 VAL 85 HG21 VAL 85 -1.343 -30.931 24.918 708 2HG2 VAL 85 HG22 VAL 85 -1.427 -29.189 25.187 709 3HG2 VAL 85 HG23 VAL 85 -2.482 -29.949 23.995 710 H VAL 86 HN VAL 86 0.123 -30.250 27.357 711 HA VAL 86 HA VAL 86 0.104 -27.636 28.689 712 HB VAL 86 HB VAL 86 2.539 -27.973 29.013 713 1HG1 VAL 86 HG11 VAL 86 0.795 -30.222 30.032 714 2HG1 VAL 86 HG12 VAL 86 0.967 -28.622 30.756 715 3HG1 VAL 86 HG13 VAL 86 2.343 -29.725 30.722 716 1HG2 VAL 86 HG21 VAL 86 3.000 -29.414 27.091 717 2HG2 VAL 86 HG22 VAL 86 2.036 -30.704 27.810 718 3HG2 VAL 86 HG23 VAL 86 3.532 -30.182 28.587 719 H GLN 87 HN GLN 87 1.006 -29.190 25.671 720 HA GLN 87 HA GLN 87 1.583 -26.545 24.539 721 1HB GLN 87 HB2 GLN 87 3.746 -27.599 25.208 722 2HB GLN 87 HB1 GLN 87 3.389 -28.945 24.134 723 1HG GLN 87 HG2 GLN 87 4.928 -27.437 23.063 724 2HG GLN 87 HG1 GLN 87 3.379 -27.390 22.224 725 1HE2 GLN 87 HE21 GLN 87 5.586 -25.655 24.260 726 2HE2 GLN 87 HE22 GLN 87 4.858 -24.099 24.080 727 H THR 88 HN THR 88 0.854 -26.266 22.513 728 HA THR 88 HA THR 88 -0.180 -28.598 21.025 729 HB THR 88 HB THR 88 -2.000 -26.994 20.204 730 HG1 THR 88 HG1 THR 88 -2.236 -25.089 21.201 731 1HG2 THR 88 HG21 THR 88 -2.006 -27.740 23.139 732 2HG2 THR 88 HG22 THR 88 -2.491 -28.787 21.805 733 3HG2 THR 88 HG23 THR 88 -3.429 -27.341 22.175 734 H LEU 89 HN LEU 89 0.788 -28.764 19.083 735 HA LEU 89 HA LEU 89 1.821 -26.306 17.814 736 1HB LEU 89 HB2 LEU 89 2.867 -29.129 17.512 737 2HB LEU 89 HB1 LEU 89 3.477 -27.723 16.663 738 HG LEU 89 HG LEU 89 4.039 -26.772 18.986 739 1HD1 LEU 89 HD11 LEU 89 4.435 -28.446 20.740 740 2HD1 LEU 89 HD12 LEU 89 3.649 -29.669 19.740 741 3HD1 LEU 89 HD13 LEU 89 2.725 -28.291 20.341 742 1HD2 LEU 89 HD21 LEU 89 6.167 -27.982 19.063 743 2HD2 LEU 89 HD22 LEU 89 5.728 -27.551 17.410 744 3HD2 LEU 89 HD23 LEU 89 5.512 -29.209 17.975 745 H GLY 90 HN GLY 90 1.011 -25.767 15.914 746 1HA GLY 90 HA2 GLY 90 0.124 -27.664 13.953 747 2HA GLY 90 HA1 GLY 90 -1.218 -26.836 14.736 748 H SER 91 HN SER 91 1.974 -25.988 13.424 749 HA SER 91 HA SER 91 1.269 -23.318 12.839 750 1HB SER 91 HB2 SER 91 3.578 -24.971 11.775 751 2HB SER 91 HB1 SER 91 3.467 -23.211 11.773 752 HG SER 91 HG SER 91 3.021 -23.974 14.252 Start of MODEL 16 1 1H GLN 1 HT1 GLN 1 12.979 -3.539 -9.594 2 2H GLN 1 HT2 GLN 1 14.597 -3.094 -9.406 3 3H GLN 1 HT3 GLN 1 14.140 -4.091 -10.689 4 HA GLN 1 HA GLN 1 13.305 -1.279 -10.311 5 1HB GLN 1 HB2 GLN 1 15.253 -2.521 -12.275 6 2HB GLN 1 HB1 GLN 1 14.703 -0.851 -12.323 7 1HG GLN 1 HG2 GLN 1 15.715 -0.456 -10.130 8 2HG GLN 1 HG1 GLN 1 16.272 -2.128 -10.090 9 1HE2 GLN 1 HE21 GLN 1 16.952 -2.198 -12.920 10 2HE2 GLN 1 HE22 GLN 1 18.393 -1.258 -13.091 11 H GLY 2 HN GLY 2 11.176 -1.384 -10.850 12 1HA GLY 2 HA2 GLY 2 9.333 -1.551 -12.218 13 2HA GLY 2 HA1 GLY 2 10.432 -1.850 -13.560 14 H HIS 3 HN HIS 3 10.276 -3.773 -10.637 15 HA HIS 3 HA HIS 3 9.731 -6.148 -12.254 16 1HB HIS 3 HB2 HIS 3 11.654 -6.223 -10.737 17 2HB HIS 3 HB1 HIS 3 10.614 -5.853 -9.367 18 HD1 HIS 3 HD1 HIS 3 11.502 -8.626 -11.733 19 HD2 HIS 3 HD2 HIS 3 9.219 -8.032 -8.313 20 HE1 HIS 3 HE1 HIS 3 10.876 -10.923 -10.934 21 HE2 HIS 3 HE2 HIS 3 9.330 -10.526 -8.988 22 H MET 4 HN MET 4 7.752 -6.937 -12.389 23 HA MET 4 HA MET 4 5.654 -6.088 -10.578 24 1HB MET 4 HB2 MET 4 5.601 -7.987 -12.945 25 2HB MET 4 HB1 MET 4 4.183 -7.453 -12.051 26 1HG MET 4 HG2 MET 4 6.038 -5.708 -13.664 27 2HG MET 4 HG1 MET 4 4.412 -6.215 -14.121 28 1HE MET 4 HE1 MET 4 5.422 -3.174 -14.105 29 2HE MET 4 HE2 MET 4 4.022 -2.367 -13.401 30 3HE MET 4 HE3 MET 4 3.797 -3.652 -14.589 31 HA PRO 5 HA PRO 5 5.657 -9.502 -7.732 32 1HB PRO 5 HB2 PRO 5 2.763 -9.848 -8.421 33 2HB PRO 5 HB1 PRO 5 3.531 -9.690 -6.836 34 1HG PRO 5 HG2 PRO 5 2.210 -7.638 -7.898 35 2HG PRO 5 HG1 PRO 5 3.730 -7.375 -7.017 36 1HD PRO 5 HD2 PRO 5 3.224 -7.369 -9.969 37 2HD PRO 5 HD1 PRO 5 4.314 -6.347 -9.008 38 H SER 6 HN SER 6 6.900 -10.980 -8.857 39 HA SER 6 HA SER 6 5.651 -12.657 -10.893 40 1HB SER 6 HB2 SER 6 8.003 -13.505 -11.199 41 2HB SER 6 HB1 SER 6 7.820 -11.773 -11.468 42 HG SER 6 HG SER 6 9.179 -13.136 -9.471 43 H ASP 7 HN ASP 7 7.391 -12.993 -7.809 44 HA ASP 7 HA ASP 7 6.361 -15.750 -7.589 45 1HB ASP 7 HB2 ASP 7 8.195 -16.217 -6.075 46 2HB ASP 7 HB1 ASP 7 8.837 -15.520 -7.556 47 H SER 8 HN SER 8 5.341 -16.416 -5.711 48 HA SER 8 HA SER 8 4.047 -14.293 -4.207 49 1HB SER 8 HB2 SER 8 3.632 -17.292 -4.036 50 2HB SER 8 HB1 SER 8 2.568 -16.042 -3.386 51 HG SER 8 HG SER 8 3.185 -15.939 -6.109 52 H LYS 9 HN LYS 9 4.045 -14.161 -1.925 53 HA LYS 9 HA LYS 9 6.519 -15.069 -0.676 54 1HB LYS 9 HB2 LYS 9 4.315 -13.380 0.530 55 2HB LYS 9 HB1 LYS 9 5.952 -13.570 1.135 56 1HG LYS 9 HG2 LYS 9 5.259 -12.260 -1.495 57 2HG LYS 9 HG1 LYS 9 5.495 -11.392 0.017 58 1HD LYS 9 HD2 LYS 9 7.574 -11.174 -0.959 59 2HD LYS 9 HD1 LYS 9 7.813 -12.608 0.037 60 1HE LYS 9 HE2 LYS 9 7.520 -14.047 -1.886 61 2HE LYS 9 HE1 LYS 9 7.095 -12.668 -2.898 62 1HZ LYS 9 HZ1 LYS 9 9.389 -13.391 -3.219 63 2HZ LYS 9 HZ2 LYS 9 9.732 -13.072 -1.593 64 3HZ LYS 9 HZ3 LYS 9 9.315 -11.805 -2.635 65 H LYS 10 HN LYS 10 6.583 -16.320 1.225 66 HA LYS 10 HA LYS 10 5.989 -17.905 2.729 67 1HB LYS 10 HB2 LYS 10 3.401 -16.480 2.348 68 2HB LYS 10 HB1 LYS 10 3.327 -18.071 3.095 69 1HG LYS 10 HG2 LYS 10 3.456 -16.288 4.758 70 2HG LYS 10 HG1 LYS 10 4.849 -17.364 4.842 71 1HD LYS 10 HD2 LYS 10 6.094 -15.672 3.431 72 2HD LYS 10 HD1 LYS 10 4.730 -14.580 3.680 73 1HE LYS 10 HE2 LYS 10 5.056 -14.758 6.114 74 2HE LYS 10 HE1 LYS 10 6.435 -15.820 5.836 75 1HZ LYS 10 HZ1 LYS 10 6.250 -13.022 4.868 76 2HZ LYS 10 HZ2 LYS 10 7.599 -14.040 4.764 77 3HZ LYS 10 HZ3 LYS 10 7.061 -13.497 6.272 78 HA PRO 11 HA PRO 11 5.036 -21.471 0.244 79 1HB PRO 11 HB2 PRO 11 4.680 -23.349 2.163 80 2HB PRO 11 HB1 PRO 11 6.269 -22.673 1.789 81 1HG PRO 11 HG2 PRO 11 4.391 -21.971 4.017 82 2HG PRO 11 HG1 PRO 11 6.149 -22.200 4.067 83 1HD PRO 11 HD2 PRO 11 4.972 -19.742 3.966 84 2HD PRO 11 HD1 PRO 11 6.574 -20.076 3.276 85 H THR 12 HN THR 12 3.260 -22.415 -0.637 86 HA THR 12 HA THR 12 0.656 -21.611 0.355 87 HB THR 12 HB THR 12 1.326 -23.258 -2.105 88 HG1 THR 12 HG1 THR 12 1.902 -20.734 -1.672 89 1HG2 THR 12 HG21 THR 12 -1.169 -21.715 -1.349 90 2HG2 THR 12 HG22 THR 12 -1.012 -23.471 -1.396 91 3HG2 THR 12 HG23 THR 12 -0.899 -22.534 -2.886 92 H ILE 13 HN ILE 13 -0.250 -22.810 1.892 93 HA ILE 13 HA ILE 13 0.422 -25.594 2.255 94 HB ILE 13 HB ILE 13 -1.591 -23.887 3.743 95 1HG1 ILE 13 HG12 ILE 13 0.710 -22.983 3.878 96 2HG1 ILE 13 HG11 ILE 13 0.163 -23.601 5.434 97 1HG2 ILE 13 HG21 ILE 13 -2.009 -26.280 4.009 98 2HG2 ILE 13 HG22 ILE 13 -1.404 -25.581 5.511 99 3HG2 ILE 13 HG23 ILE 13 -0.329 -26.534 4.486 100 1HD1 ILE 13 HD11 ILE 13 2.481 -24.177 4.998 101 2HD1 ILE 13 HD12 ILE 13 2.007 -25.023 3.525 102 3HD1 ILE 13 HD13 ILE 13 1.478 -25.624 5.096 103 H ILE 14 HN ILE 14 -0.945 -27.337 1.975 104 HA ILE 14 HA ILE 14 -2.906 -26.998 -0.122 105 HB ILE 14 HB ILE 14 -2.001 -29.541 1.255 106 1HG1 ILE 14 HG12 ILE 14 -0.094 -28.426 0.218 107 2HG1 ILE 14 HG11 ILE 14 -0.533 -29.850 -0.718 108 1HG2 ILE 14 HG21 ILE 14 -4.133 -29.805 0.114 109 2HG2 ILE 14 HG22 ILE 14 -2.864 -30.669 -0.753 110 3HG2 ILE 14 HG23 ILE 14 -3.450 -29.121 -1.362 111 1HD1 ILE 14 HD11 ILE 14 -1.205 -26.995 -1.409 112 2HD1 ILE 14 HD12 ILE 14 -1.669 -28.415 -2.346 113 3HD1 ILE 14 HD13 ILE 14 0.033 -27.995 -2.167 114 H TYR 15 HN TYR 15 -5.022 -26.821 0.192 115 HA TYR 15 HA TYR 15 -6.286 -28.226 2.432 116 1HB TYR 15 HB2 TYR 15 -6.745 -25.333 1.664 117 2HB TYR 15 HB1 TYR 15 -7.876 -26.252 2.651 118 HD1 TYR 15 HD1 TYR 15 -7.046 -27.214 4.852 119 HD2 TYR 15 HD2 TYR 15 -4.864 -24.289 2.656 120 HE1 TYR 15 HE1 TYR 15 -5.773 -26.651 6.875 121 HE2 TYR 15 HE2 TYR 15 -3.587 -23.719 4.682 122 HH TYR 15 HH TYR 15 -3.572 -25.665 7.441 123 HA PRO 16 HA PRO 16 -8.072 -28.998 3.035 124 1HB PRO 16 HB2 PRO 16 -9.447 -31.422 2.239 125 2HB PRO 16 HB1 PRO 16 -10.072 -30.055 3.161 126 1HG PRO 16 HG2 PRO 16 -10.904 -30.684 0.626 127 2HG PRO 16 HG1 PRO 16 -10.968 -29.048 1.310 128 1HD PRO 16 HD2 PRO 16 -8.933 -30.249 -0.545 129 2HD PRO 16 HD1 PRO 16 -9.676 -28.633 -0.581 130 H CYS 17 HN CYS 17 -6.813 -30.436 4.172 131 HA CYS 17 HA CYS 17 -5.621 -32.756 2.948 132 1HB CYS 17 HB2 CYS 17 -4.185 -30.968 2.032 133 2HB CYS 17 HB1 CYS 17 -3.854 -30.396 3.665 134 HG CYS 17 HG CYS 17 -1.662 -31.844 2.467 135 H LEU 18 HN LEU 18 -3.911 -33.676 4.510 136 HA LEU 18 HA LEU 18 -5.097 -33.781 7.142 137 1HB LEU 18 HB2 LEU 18 -2.697 -35.186 5.950 138 2HB LEU 18 HB1 LEU 18 -3.331 -35.499 7.557 139 HG LEU 18 HG LEU 18 -4.944 -35.885 5.031 140 1HD1 LEU 18 HD11 LEU 18 -4.515 -38.281 5.292 141 2HD1 LEU 18 HD12 LEU 18 -3.408 -37.941 6.621 142 3HD1 LEU 18 HD13 LEU 18 -3.027 -37.384 4.991 143 1HD2 LEU 18 HD21 LEU 18 -5.376 -36.824 7.870 144 2HD2 LEU 18 HD22 LEU 18 -6.400 -37.215 6.489 145 3HD2 LEU 18 HD23 LEU 18 -6.273 -35.548 7.049 146 H TRP 19 HN TRP 19 -4.518 -32.541 8.787 147 HA TRP 19 HA TRP 19 -1.864 -31.259 8.772 148 1HB TRP 19 HB2 TRP 19 -3.929 -29.785 8.892 149 2HB TRP 19 HB1 TRP 19 -4.246 -30.481 10.477 150 HD1 TRP 19 HD1 TRP 19 -2.658 -29.710 12.494 151 HE1 TRP 19 HE1 TRP 19 -1.042 -27.727 12.757 152 HE3 TRP 19 HE3 TRP 19 -2.254 -28.323 7.584 153 HZ2 TRP 19 HZ2 TRP 19 0.245 -25.837 11.111 154 HZ3 TRP 19 HZ3 TRP 19 -0.804 -26.415 7.019 155 HH2 TRP 19 HH2 TRP 19 0.416 -25.199 8.744 156 H ASP 20 HN ASP 20 -0.523 -31.471 10.550 157 HA ASP 20 HA ASP 20 -1.142 -33.796 12.244 158 1HB ASP 20 HB2 ASP 20 0.873 -33.842 10.727 159 2HB ASP 20 HB1 ASP 20 1.562 -32.541 11.691 160 H TYR 21 HN TYR 21 -1.700 -33.400 14.256 161 HA TYR 21 HA TYR 21 -0.748 -30.974 15.637 162 1HB TYR 21 HB2 TYR 21 -3.180 -32.699 16.214 163 2HB TYR 21 HB1 TYR 21 -2.699 -31.282 17.136 164 HD1 TYR 21 HD1 TYR 21 -2.993 -29.028 16.206 165 HD2 TYR 21 HD2 TYR 21 -4.262 -32.478 14.051 166 HE1 TYR 21 HE1 TYR 21 -4.362 -27.604 14.741 167 HE2 TYR 21 HE2 TYR 21 -5.629 -31.059 12.580 168 HH TYR 21 HH TYR 21 -6.728 -28.826 12.677 169 H ARG 22 HN ARG 22 0.693 -31.287 17.234 170 HA ARG 22 HA ARG 22 1.076 -34.001 18.291 171 1HB ARG 22 HB2 ARG 22 3.053 -32.822 17.378 172 2HB ARG 22 HB1 ARG 22 2.828 -31.541 18.558 173 1HG ARG 22 HG2 ARG 22 4.623 -33.077 19.191 174 2HG ARG 22 HG1 ARG 22 3.314 -33.078 20.372 175 1HD ARG 22 HD2 ARG 22 4.297 -35.343 19.745 176 2HD ARG 22 HD1 ARG 22 2.543 -35.195 19.673 177 HE ARG 22 HE ARG 22 2.624 -35.365 17.364 178 1HH1 ARG 22 HH11 ARG 22 5.875 -35.346 18.679 179 2HH1 ARG 22 HH12 ARG 22 6.601 -35.834 17.184 180 1HH2 ARG 22 HH21 ARG 22 3.570 -36.055 15.430 181 2HH2 ARG 22 HH22 ARG 22 5.296 -36.231 15.331 182 H VAL 23 HN VAL 23 0.048 -34.479 20.102 183 HA VAL 23 HA VAL 23 -0.704 -32.299 21.952 184 HB VAL 23 HB VAL 23 -2.060 -34.987 21.613 185 1HG1 VAL 23 HG11 VAL 23 -2.390 -34.023 23.820 186 2HG1 VAL 23 HG12 VAL 23 -3.889 -33.946 22.897 187 3HG1 VAL 23 HG13 VAL 23 -2.907 -32.496 23.103 188 1HG2 VAL 23 HG21 VAL 23 -2.319 -33.719 19.565 189 2HG2 VAL 23 HG22 VAL 23 -2.837 -32.299 20.471 190 3HG2 VAL 23 HG23 VAL 23 -3.849 -33.743 20.441 191 H ILE 24 HN ILE 24 0.447 -32.303 23.785 192 HA ILE 24 HA ILE 24 1.492 -34.869 24.802 193 HB ILE 24 HB ILE 24 2.395 -32.058 25.479 194 1HG1 ILE 24 HG12 ILE 24 3.706 -34.182 23.751 195 2HG1 ILE 24 HG11 ILE 24 2.960 -32.699 23.167 196 1HG2 ILE 24 HG21 ILE 24 2.732 -33.605 27.338 197 2HG2 ILE 24 HG22 ILE 24 4.278 -33.158 26.616 198 3HG2 ILE 24 HG23 ILE 24 3.565 -34.733 26.267 199 1HD1 ILE 24 HD11 ILE 24 5.357 -32.482 23.195 200 2HD1 ILE 24 HD12 ILE 24 5.407 -32.899 24.907 201 3HD1 ILE 24 HD13 ILE 24 4.646 -31.396 24.387 202 H MET 25 HN MET 25 0.378 -35.732 26.419 203 HA MET 25 HA MET 25 -1.004 -33.939 28.322 204 1HB MET 25 HB2 MET 25 -1.934 -36.660 27.354 205 2HB MET 25 HB1 MET 25 -2.725 -35.704 28.601 206 1HG MET 25 HG2 MET 25 -2.955 -33.890 26.816 207 2HG MET 25 HG1 MET 25 -2.532 -35.148 25.659 208 1HE MET 25 HE1 MET 25 -4.012 -37.321 25.223 209 2HE MET 25 HE2 MET 25 -5.493 -37.687 26.109 210 3HE MET 25 HE3 MET 25 -3.936 -37.732 26.938 211 H THR 26 HN THR 26 -1.438 -35.021 30.452 212 HA THR 26 HA THR 26 0.971 -36.453 31.324 213 HB THR 26 HB THR 26 0.047 -35.858 33.646 214 HG1 THR 26 HG1 THR 26 -1.422 -33.817 32.394 215 1HG2 THR 26 HG21 THR 26 1.913 -34.637 32.623 216 2HG2 THR 26 HG22 THR 26 0.863 -33.543 33.525 217 3HG2 THR 26 HG23 THR 26 0.772 -33.601 31.764 218 H THR 27 HN THR 27 -1.574 -37.569 29.992 219 HA THR 27 HA THR 27 -2.018 -39.744 31.919 220 HB THR 27 HB THR 27 -3.969 -38.182 32.030 221 HG1 THR 27 HG1 THR 27 -4.869 -40.047 32.455 222 1HG2 THR 27 HG21 THR 27 -4.359 -38.954 29.129 223 2HG2 THR 27 HG22 THR 27 -3.895 -37.354 29.715 224 3HG2 THR 27 HG23 THR 27 -5.482 -38.015 30.114 225 H LYS 28 HN LYS 28 -2.700 -41.732 30.946 226 HA LYS 28 HA LYS 28 -1.963 -42.056 28.136 227 1HB LYS 28 HB2 LYS 28 -2.911 -44.116 30.151 228 2HB LYS 28 HB1 LYS 28 -2.275 -44.457 28.549 229 1HG LYS 28 HG2 LYS 28 -0.098 -43.515 29.243 230 2HG LYS 28 HG1 LYS 28 -0.753 -43.267 30.865 231 1HD LYS 28 HD2 LYS 28 -0.465 -45.920 29.440 232 2HD LYS 28 HD1 LYS 28 0.543 -45.339 30.767 233 1HE LYS 28 HE2 LYS 28 -1.342 -45.379 32.280 234 2HE LYS 28 HE1 LYS 28 -2.439 -45.790 30.963 235 1HZ LYS 28 HZ1 LYS 28 -1.176 -47.882 30.694 236 2HZ LYS 28 HZ2 LYS 28 -1.946 -47.753 32.193 237 3HZ LYS 28 HZ3 LYS 28 -0.279 -47.495 32.075 238 H ASP 29 HN ASP 29 -4.659 -41.386 30.030 239 HA ASP 29 HA ASP 29 -6.632 -42.820 28.510 240 1HB ASP 29 HB2 ASP 29 -7.082 -42.415 30.862 241 2HB ASP 29 HB1 ASP 29 -6.893 -40.679 30.641 242 H THR 30 HN THR 30 -6.148 -42.064 26.416 243 HA THR 30 HA THR 30 -6.793 -39.279 25.882 244 HB THR 30 HB THR 30 -4.918 -40.047 24.627 245 HG1 THR 30 HG1 THR 30 -6.000 -40.076 22.386 246 1HG2 THR 30 HG21 THR 30 -5.291 -42.460 24.764 247 2HG2 THR 30 HG22 THR 30 -4.984 -41.964 23.100 248 3HG2 THR 30 HG23 THR 30 -6.629 -42.330 23.621 249 H SER 31 HN SER 31 -8.915 -38.992 26.130 250 HA SER 31 HA SER 31 -10.743 -40.616 24.484 251 1HB SER 31 HB2 SER 31 -11.390 -39.460 27.217 252 2HB SER 31 HB1 SER 31 -12.412 -40.521 26.244 253 HG SER 31 HG SER 31 -10.534 -41.189 28.018 254 H THR 32 HN THR 32 -10.814 -37.668 26.478 255 HA THR 32 HA THR 32 -12.669 -36.185 25.125 256 HB THR 32 HB THR 32 -10.160 -34.932 26.249 257 HG1 THR 32 HG1 THR 32 -12.088 -35.329 28.115 258 1HG2 THR 32 HG21 THR 32 -11.861 -33.415 25.316 259 2HG2 THR 32 HG22 THR 32 -11.739 -33.230 27.066 260 3HG2 THR 32 HG23 THR 32 -13.083 -34.133 26.366 261 H LEU 33 HN LEU 33 -9.266 -36.616 24.381 262 HA LEU 33 HA LEU 33 -8.924 -34.636 22.444 263 1HB LEU 33 HB2 LEU 33 -7.068 -35.844 23.468 264 2HB LEU 33 HB1 LEU 33 -7.596 -37.338 22.717 265 HG LEU 33 HG LEU 33 -7.071 -36.425 20.495 266 1HD1 LEU 33 HD11 LEU 33 -6.058 -34.002 21.991 267 2HD1 LEU 33 HD12 LEU 33 -7.481 -34.056 20.950 268 3HD1 LEU 33 HD13 LEU 33 -5.876 -34.306 20.263 269 1HD2 LEU 33 HD21 LEU 33 -4.627 -36.404 20.730 270 2HD2 LEU 33 HD22 LEU 33 -5.367 -37.686 21.687 271 3HD2 LEU 33 HD23 LEU 33 -4.799 -36.214 22.475 272 H LYS 34 HN LYS 34 -10.071 -37.975 22.151 273 HA LYS 34 HA LYS 34 -10.230 -37.885 19.285 274 1HB LYS 34 HB2 LYS 34 -11.431 -39.840 21.258 275 2HB LYS 34 HB1 LYS 34 -11.412 -40.053 19.512 276 1HG LYS 34 HG2 LYS 34 -8.941 -40.048 19.565 277 2HG LYS 34 HG1 LYS 34 -9.000 -39.923 21.324 278 1HD LYS 34 HD2 LYS 34 -10.138 -42.182 19.669 279 2HD LYS 34 HD1 LYS 34 -8.641 -42.239 20.598 280 1HE LYS 34 HE2 LYS 34 -9.909 -41.877 22.663 281 2HE LYS 34 HE1 LYS 34 -11.406 -41.813 21.733 282 1HZ LYS 34 HZ1 LYS 34 -11.099 -43.983 22.711 283 2HZ LYS 34 HZ2 LYS 34 -9.595 -44.155 21.959 284 3HZ LYS 34 HZ3 LYS 34 -11.003 -44.099 21.026 285 H GLU 35 HN GLU 35 -12.411 -37.317 21.963 286 HA GLU 35 HA GLU 35 -14.870 -37.444 20.671 287 1HB GLU 35 HB2 GLU 35 -14.088 -35.507 22.870 288 2HB GLU 35 HB1 GLU 35 -15.723 -36.005 22.458 289 1HG GLU 35 HG2 GLU 35 -13.550 -37.772 23.572 290 2HG GLU 35 HG1 GLU 35 -14.936 -37.135 24.454 291 H LEU 36 HN LEU 36 -12.743 -34.622 21.126 292 HA LEU 36 HA LEU 36 -14.395 -32.787 19.776 293 1HB LEU 36 HB2 LEU 36 -12.508 -31.287 19.783 294 2HB LEU 36 HB1 LEU 36 -12.589 -32.128 21.316 295 HG LEU 36 HG LEU 36 -10.828 -33.732 20.080 296 1HD1 LEU 36 HD11 LEU 36 -10.324 -31.040 18.823 297 2HD1 LEU 36 HD12 LEU 36 -10.838 -32.501 17.980 298 3HD1 LEU 36 HD13 LEU 36 -9.252 -32.439 18.746 299 1HD2 LEU 36 HD21 LEU 36 -10.483 -32.634 22.227 300 2HD2 LEU 36 HD22 LEU 36 -10.125 -31.114 21.407 301 3HD2 LEU 36 HD23 LEU 36 -9.048 -32.496 21.213 302 H LEU 37 HN LEU 37 -12.016 -35.076 18.641 303 HA LEU 37 HA LEU 37 -11.752 -34.045 16.002 304 1HB LEU 37 HB2 LEU 37 -11.336 -36.873 17.004 305 2HB LEU 37 HB1 LEU 37 -10.763 -36.236 15.473 306 HG LEU 37 HG LEU 37 -9.854 -35.250 18.185 307 1HD1 LEU 37 HD11 LEU 37 -9.128 -37.544 17.817 308 2HD1 LEU 37 HD12 LEU 37 -7.765 -36.429 17.731 309 3HD1 LEU 37 HD13 LEU 37 -8.456 -37.093 16.249 310 1HD2 LEU 37 HD21 LEU 37 -8.085 -34.125 16.919 311 2HD2 LEU 37 HD22 LEU 37 -9.685 -33.550 16.452 312 3HD2 LEU 37 HD23 LEU 37 -8.815 -34.677 15.411 313 H GLU 38 HN GLU 38 -13.844 -36.462 17.511 314 HA GLU 38 HA GLU 38 -14.971 -37.391 15.063 315 1HB GLU 38 HB2 GLU 38 -15.899 -37.745 17.919 316 2HB GLU 38 HB1 GLU 38 -16.602 -38.569 16.533 317 1HG GLU 38 HG2 GLU 38 -14.218 -39.430 16.091 318 2HG GLU 38 HG1 GLU 38 -13.881 -38.914 17.741 319 H THR 39 HN THR 39 -15.724 -34.735 17.165 320 HA THR 39 HA THR 39 -18.460 -34.462 16.522 321 HB THR 39 HB THR 39 -18.253 -32.109 17.257 322 HG1 THR 39 HG1 THR 39 -15.493 -32.643 17.692 323 1HG2 THR 39 HG21 THR 39 -16.802 -34.073 19.041 324 2HG2 THR 39 HG22 THR 39 -18.551 -33.862 18.939 325 3HG2 THR 39 HG23 THR 39 -17.540 -32.558 19.562 326 H TYR 40 HN TYR 40 -15.600 -33.772 14.717 327 HA TYR 40 HA TYR 40 -16.918 -32.028 12.812 328 1HB TYR 40 HB2 TYR 40 -14.196 -33.358 12.677 329 2HB TYR 40 HB1 TYR 40 -14.789 -32.128 11.566 330 HD1 TYR 40 HD1 TYR 40 -15.413 -29.828 12.600 331 HD2 TYR 40 HD2 TYR 40 -13.015 -32.733 14.581 332 HE1 TYR 40 HE1 TYR 40 -14.501 -28.070 14.056 333 HE2 TYR 40 HE2 TYR 40 -12.101 -30.985 16.055 334 HH TYR 40 HH TYR 40 -13.445 -27.836 16.211 335 H GLN 41 HN GLN 41 -16.850 -35.313 13.384 336 HA GLN 41 HA GLN 41 -17.552 -37.152 12.267 337 1HB GLN 41 HB2 GLN 41 -18.796 -35.070 10.454 338 2HB GLN 41 HB1 GLN 41 -19.154 -36.792 10.377 339 1HG GLN 41 HG2 GLN 41 -19.641 -34.995 12.750 340 2HG GLN 41 HG1 GLN 41 -20.865 -35.570 11.616 341 1HE2 GLN 41 HE21 GLN 41 -20.496 -35.963 14.541 342 2HE2 GLN 41 HE22 GLN 41 -20.541 -37.674 14.773 343 H ARG 42 HN ARG 42 -14.945 -36.127 11.672 344 HA ARG 42 HA ARG 42 -14.583 -37.214 8.952 345 1HB ARG 42 HB2 ARG 42 -12.704 -35.697 8.623 346 2HB ARG 42 HB1 ARG 42 -14.154 -34.777 9.002 347 1HG ARG 42 HG2 ARG 42 -13.373 -34.576 11.345 348 2HG ARG 42 HG1 ARG 42 -11.886 -35.410 10.889 349 1HD ARG 42 HD2 ARG 42 -11.520 -33.014 10.914 350 2HD ARG 42 HD1 ARG 42 -11.407 -33.620 9.261 351 HE ARG 42 HE ARG 42 -14.033 -32.810 9.630 352 1HH1 ARG 42 HH11 ARG 42 -10.864 -31.317 9.657 353 2HH1 ARG 42 HH12 ARG 42 -11.460 -29.771 9.140 354 1HH2 ARG 42 HH21 ARG 42 -14.799 -30.793 8.914 355 2HH2 ARG 42 HH22 ARG 42 -13.686 -29.471 8.721 356 HA PRO 43 HA PRO 43 -11.871 -40.175 10.803 357 1HB PRO 43 HB2 PRO 43 -10.036 -40.574 8.827 358 2HB PRO 43 HB1 PRO 43 -11.691 -41.190 8.747 359 1HG PRO 43 HG2 PRO 43 -10.525 -38.728 7.494 360 2HG PRO 43 HG1 PRO 43 -11.621 -39.932 6.787 361 1HD PRO 43 HD2 PRO 43 -12.501 -37.548 7.716 362 2HD PRO 43 HD1 PRO 43 -13.484 -39.024 7.819 363 H PHE 44 HN PHE 44 -9.871 -40.439 11.806 364 HA PHE 44 HA PHE 44 -7.797 -38.428 11.464 365 1HB PHE 44 HB2 PHE 44 -7.675 -37.923 13.878 366 2HB PHE 44 HB1 PHE 44 -9.216 -37.422 13.193 367 HD1 PHE 44 HD1 PHE 44 -7.547 -39.804 15.437 368 HD2 PHE 44 HD2 PHE 44 -11.279 -38.504 13.840 369 HE1 PHE 44 HE1 PHE 44 -8.733 -41.080 17.174 370 HE2 PHE 44 HE2 PHE 44 -12.466 -39.780 15.575 371 HZ PHE 44 HZ PHE 44 -11.195 -41.069 17.244 372 H LYS 45 HN LYS 45 -5.798 -39.050 12.583 373 HA LYS 45 HA LYS 45 -5.634 -41.960 13.040 374 1HB LYS 45 HB2 LYS 45 -4.477 -40.969 10.957 375 2HB LYS 45 HB1 LYS 45 -3.361 -40.216 12.076 376 1HG LYS 45 HG2 LYS 45 -3.816 -43.181 12.113 377 2HG LYS 45 HG1 LYS 45 -2.690 -42.438 10.981 378 1HD LYS 45 HD2 LYS 45 -2.569 -42.148 13.988 379 2HD LYS 45 HD1 LYS 45 -1.590 -43.267 13.038 380 1HE LYS 45 HE2 LYS 45 -1.572 -40.254 12.766 381 2HE LYS 45 HE1 LYS 45 -0.361 -41.210 13.619 382 1HZ LYS 45 HZ1 LYS 45 0.409 -40.658 11.424 383 2HZ LYS 45 HZ2 LYS 45 -0.965 -41.337 10.711 384 3HZ LYS 45 HZ3 LYS 45 0.146 -42.327 11.515 385 H LEU 46 HN LEU 46 -5.479 -42.275 15.163 386 HA LEU 46 HA LEU 46 -4.008 -40.374 16.836 387 1HB LEU 46 HB2 LEU 46 -6.239 -41.106 17.590 388 2HB LEU 46 HB1 LEU 46 -5.693 -42.773 17.588 389 HG LEU 46 HG LEU 46 -4.038 -42.193 19.367 390 1HD1 LEU 46 HD11 LEU 46 -4.281 -40.083 20.578 391 2HD1 LEU 46 HD12 LEU 46 -5.475 -39.539 19.399 392 3HD1 LEU 46 HD13 LEU 46 -3.805 -39.814 18.903 393 1HD2 LEU 46 HD21 LEU 46 -5.668 -42.052 21.185 394 2HD2 LEU 46 HD22 LEU 46 -6.193 -43.191 19.947 395 3HD2 LEU 46 HD23 LEU 46 -6.923 -41.587 20.036 396 H GLU 47 HN GLU 47 -2.092 -40.839 17.762 397 HA GLU 47 HA GLU 47 -1.048 -43.556 17.690 398 1HB GLU 47 HB2 GLU 47 -0.421 -41.674 15.663 399 2HB GLU 47 HB1 GLU 47 1.003 -41.776 16.686 400 1HG GLU 47 HG2 GLU 47 -0.390 -44.110 15.392 401 2HG GLU 47 HG1 GLU 47 1.075 -43.332 14.796 402 H PHE 48 HN PHE 48 0.806 -43.854 19.013 403 HA PHE 48 HA PHE 48 1.309 -41.673 20.937 404 1HB PHE 48 HB2 PHE 48 0.445 -43.758 21.941 405 2HB PHE 48 HB1 PHE 48 1.776 -44.660 21.226 406 HD1 PHE 48 HD1 PHE 48 3.829 -44.855 22.356 407 HD2 PHE 48 HD2 PHE 48 0.991 -41.949 23.639 408 HE1 PHE 48 HE1 PHE 48 5.185 -44.414 24.358 409 HE2 PHE 48 HE2 PHE 48 2.345 -41.508 25.641 410 HZ PHE 48 HZ PHE 48 4.445 -42.739 26.002 411 H LYS 49 HN LYS 49 3.374 -40.900 21.167 412 HA LYS 49 HA LYS 49 5.327 -41.913 19.209 413 1HB LYS 49 HB2 LYS 49 5.003 -39.189 20.476 414 2HB LYS 49 HB1 LYS 49 6.397 -39.638 19.502 415 1HG LYS 49 HG2 LYS 49 3.578 -39.816 18.462 416 2HG LYS 49 HG1 LYS 49 4.543 -38.346 18.345 417 1HD LYS 49 HD2 LYS 49 5.482 -39.128 16.474 418 2HD LYS 49 HD1 LYS 49 6.168 -40.468 17.386 419 1HE LYS 49 HE2 LYS 49 3.354 -40.547 16.307 420 2HE LYS 49 HE1 LYS 49 4.741 -41.028 15.334 421 1HZ LYS 49 HZ1 LYS 49 4.003 -42.241 17.941 422 2HZ LYS 49 HZ2 LYS 49 5.266 -42.728 16.934 423 3HZ LYS 49 HZ3 LYS 49 3.665 -42.910 16.430 424 H ASN 50 HN ASN 50 5.635 -40.118 22.294 425 HA ASN 50 HA ASN 50 7.432 -42.177 23.318 426 1HB ASN 50 HB2 ASN 50 8.301 -39.305 22.871 427 2HB ASN 50 HB1 ASN 50 9.180 -40.454 23.872 428 1HD2 ASN 50 HD21 ASN 50 10.304 -42.139 22.890 429 2HD2 ASN 50 HD22 ASN 50 10.659 -42.150 21.200 430 H THR 51 HN THR 51 8.116 -41.708 25.558 431 HA THR 51 HA THR 51 6.340 -39.857 26.997 432 HB THR 51 HB THR 51 5.556 -42.230 27.295 433 HG1 THR 51 HG1 THR 51 5.335 -40.536 28.936 434 1HG2 THR 51 HG21 THR 51 6.868 -43.741 28.707 435 2HG2 THR 51 HG22 THR 51 8.191 -42.577 28.741 436 3HG2 THR 51 HG23 THR 51 7.741 -43.355 27.224 437 H SER 52 HN SER 52 7.286 -38.851 28.789 438 HA SER 52 HA SER 52 10.057 -38.380 28.670 439 1HB SER 52 HB2 SER 52 8.344 -36.797 29.600 440 2HB SER 52 HB1 SER 52 8.214 -37.837 31.017 441 HG SER 52 HG SER 52 10.190 -36.045 30.295 442 H LYS 53 HN LYS 53 11.537 -38.676 30.616 443 HA LYS 53 HA LYS 53 12.073 -41.396 30.853 444 1HB LYS 53 HB2 LYS 53 13.085 -39.123 32.576 445 2HB LYS 53 HB1 LYS 53 13.773 -40.742 32.542 446 1HG LYS 53 HG2 LYS 53 13.681 -38.781 30.254 447 2HG LYS 53 HG1 LYS 53 15.104 -39.263 31.181 448 1HD LYS 53 HD2 LYS 53 14.882 -41.554 30.362 449 2HD LYS 53 HD1 LYS 53 13.419 -41.112 29.481 450 1HE LYS 53 HE2 LYS 53 14.752 -39.523 28.136 451 2HE LYS 53 HE1 LYS 53 16.205 -40.057 28.981 452 1HZ LYS 53 HZ1 LYS 53 14.438 -41.806 27.357 453 2HZ LYS 53 HZ2 LYS 53 15.884 -42.265 28.107 454 3HZ LYS 53 HZ3 LYS 53 15.908 -41.153 26.832 455 H ASN 54 HN ASN 54 10.465 -39.248 33.166 456 HA ASN 54 HA ASN 54 10.118 -41.454 35.054 457 1HB ASN 54 HB2 ASN 54 9.335 -38.527 35.236 458 2HB ASN 54 HB1 ASN 54 9.055 -39.712 36.507 459 1HD2 ASN 54 HD21 ASN 54 10.337 -38.582 37.962 460 2HD2 ASN 54 HD22 ASN 54 12.063 -38.552 37.841 461 H ALA 55 HN ALA 55 8.722 -40.822 32.303 462 HA ALA 55 HA ALA 55 6.730 -41.252 31.306 463 1HB ALA 55 HB1 ALA 55 5.334 -42.989 32.310 464 2HB ALA 55 HB2 ALA 55 6.206 -42.820 33.835 465 3HB ALA 55 HB3 ALA 55 7.043 -43.419 32.402 466 H LYS 56 HN LYS 56 6.993 -38.904 33.097 467 HA LYS 56 HA LYS 56 4.403 -38.511 34.296 468 1HB LYS 56 HB2 LYS 56 6.453 -37.498 35.250 469 2HB LYS 56 HB1 LYS 56 6.649 -36.538 33.793 470 1HG LYS 56 HG2 LYS 56 5.661 -34.987 35.129 471 2HG LYS 56 HG1 LYS 56 4.219 -35.701 34.417 472 1HD LYS 56 HD2 LYS 56 5.383 -36.420 37.118 473 2HD LYS 56 HD1 LYS 56 4.017 -35.343 36.855 474 1HE LYS 56 HE2 LYS 56 2.936 -37.306 37.369 475 2HE LYS 56 HE1 LYS 56 2.998 -37.418 35.613 476 1HZ LYS 56 HZ1 LYS 56 4.879 -38.726 37.501 477 2HZ LYS 56 HZ2 LYS 56 4.945 -38.845 35.824 478 3HZ LYS 56 HZ3 LYS 56 3.633 -39.496 36.660 479 H PHE 57 HN PHE 57 5.923 -37.817 31.250 480 HA PHE 57 HA PHE 57 3.505 -36.380 30.366 481 1HB PHE 57 HB2 PHE 57 6.353 -35.933 29.426 482 2HB PHE 57 HB1 PHE 57 4.928 -35.117 28.794 483 HD1 PHE 57 HD1 PHE 57 7.473 -35.100 31.322 484 HD2 PHE 57 HD2 PHE 57 3.584 -33.643 30.362 485 HE1 PHE 57 HE1 PHE 57 7.706 -33.351 33.036 486 HE2 PHE 57 HE2 PHE 57 3.817 -31.891 32.074 487 HZ PHE 57 HZ PHE 57 5.879 -31.744 33.413 488 H TYR 58 HN TYR 58 2.593 -37.018 28.479 489 HA TYR 58 HA TYR 58 3.846 -39.259 27.018 490 1HB TYR 58 HB2 TYR 58 0.877 -38.864 27.497 491 2HB TYR 58 HB1 TYR 58 1.642 -40.234 26.699 492 HD1 TYR 58 HD1 TYR 58 2.643 -42.021 27.992 493 HD2 TYR 58 HD2 TYR 58 1.047 -38.582 29.932 494 HE1 TYR 58 HE1 TYR 58 2.759 -43.189 30.155 495 HE2 TYR 58 HE2 TYR 58 1.158 -39.740 32.093 496 HH TYR 58 HH TYR 58 1.281 -41.905 33.018 497 H SER 59 HN SER 59 4.217 -38.773 24.946 498 HA SER 59 HA SER 59 2.879 -36.442 23.775 499 1HB SER 59 HB2 SER 59 5.306 -37.987 22.818 500 2HB SER 59 HB1 SER 59 4.687 -36.493 22.111 501 HG SER 59 HG SER 59 5.882 -36.893 24.644 502 H PHE 60 HN PHE 60 1.133 -36.820 22.608 503 HA PHE 60 HA PHE 60 0.867 -39.353 21.130 504 1HB PHE 60 HB2 PHE 60 -1.254 -37.339 21.943 505 2HB PHE 60 HB1 PHE 60 -1.557 -38.819 21.040 506 HD1 PHE 60 HD1 PHE 60 -1.158 -37.349 24.295 507 HD2 PHE 60 HD2 PHE 60 -1.087 -41.040 22.163 508 HE1 PHE 60 HE1 PHE 60 -1.459 -38.574 26.405 509 HE2 PHE 60 HE2 PHE 60 -1.385 -42.267 24.279 510 HZ PHE 60 HZ PHE 60 -1.572 -41.033 26.400 511 H ASN 61 HN ASN 61 0.363 -39.360 18.979 512 HA ASN 61 HA ASN 61 0.771 -36.849 17.498 513 1HB ASN 61 HB2 ASN 61 2.392 -38.691 17.056 514 2HB ASN 61 HB1 ASN 61 1.059 -39.722 16.553 515 1HD2 ASN 61 HD21 ASN 61 -0.117 -39.121 14.633 516 2HD2 ASN 61 HD22 ASN 61 0.658 -38.184 13.405 517 H VAL 62 HN VAL 62 -0.998 -36.000 16.546 518 HA VAL 62 HA VAL 62 -3.234 -37.802 15.837 519 HB VAL 62 HB VAL 62 -3.458 -34.968 16.896 520 1HG1 VAL 62 HG11 VAL 62 -5.620 -36.938 16.133 521 2HG1 VAL 62 HG12 VAL 62 -5.187 -35.477 15.244 522 3HG1 VAL 62 HG13 VAL 62 -5.879 -35.351 16.860 523 1HG2 VAL 62 HG21 VAL 62 -4.515 -35.981 18.861 524 2HG2 VAL 62 HG22 VAL 62 -2.864 -36.564 18.650 525 3HG2 VAL 62 HG23 VAL 62 -4.225 -37.589 18.195 526 H SER 63 HN SER 63 -3.525 -37.829 13.694 527 HA SER 63 HA SER 63 -3.039 -35.340 12.179 528 1HB SER 63 HB2 SER 63 -2.529 -36.843 10.227 529 2HB SER 63 HB1 SER 63 -1.373 -36.970 11.549 530 HG SER 63 HG SER 63 -2.480 -38.951 10.474 531 H MET 64 HN MET 64 -4.838 -34.487 11.349 532 HA MET 64 HA MET 64 -7.052 -36.256 10.557 533 1HB MET 64 HB2 MET 64 -8.696 -34.920 11.712 534 2HB MET 64 HB1 MET 64 -7.480 -35.424 12.877 535 1HG MET 64 HG2 MET 64 -6.418 -33.215 12.713 536 2HG MET 64 HG1 MET 64 -7.668 -32.709 11.576 537 1HE MET 64 HE1 MET 64 -10.207 -34.211 12.847 538 2HE MET 64 HE2 MET 64 -10.307 -32.544 12.280 539 3HE MET 64 HE3 MET 64 -10.878 -32.963 13.896 540 H GLU 65 HN GLU 65 -8.660 -35.125 9.206 541 HA GLU 65 HA GLU 65 -7.379 -33.531 7.218 542 1HB GLU 65 HB2 GLU 65 -10.289 -34.270 7.591 543 2HB GLU 65 HB1 GLU 65 -9.649 -33.429 6.185 544 1HG GLU 65 HG2 GLU 65 -8.156 -35.397 5.791 545 2HG GLU 65 HG1 GLU 65 -9.028 -36.236 7.077 546 H VAL 66 HN VAL 66 -7.574 -31.411 6.763 547 HA VAL 66 HA VAL 66 -9.438 -29.758 8.317 548 HB VAL 66 HB VAL 66 -7.715 -27.915 8.316 549 1HG1 VAL 66 HG11 VAL 66 -8.188 -29.198 10.342 550 2HG1 VAL 66 HG12 VAL 66 -6.484 -28.755 10.261 551 3HG1 VAL 66 HG13 VAL 66 -6.984 -30.401 9.874 552 1HG2 VAL 66 HG21 VAL 66 -5.350 -28.523 8.061 553 2HG2 VAL 66 HG22 VAL 66 -6.243 -28.792 6.566 554 3HG2 VAL 66 HG23 VAL 66 -5.818 -30.159 7.596 555 H SER 67 HN SER 67 -10.635 -28.481 7.069 556 HA SER 67 HA SER 67 -10.285 -28.631 4.202 557 1HB SER 67 HB2 SER 67 -12.509 -29.002 5.253 558 2HB SER 67 HB1 SER 67 -12.496 -27.336 5.826 559 HG SER 67 HG SER 67 -13.643 -27.776 3.791 560 H ASN 68 HN ASN 68 -9.860 -26.323 6.769 561 HA ASN 68 HA ASN 68 -8.719 -24.426 4.903 562 1HB ASN 68 HB2 ASN 68 -10.127 -22.538 5.647 563 2HB ASN 68 HB1 ASN 68 -11.071 -23.782 4.837 564 1HD2 ASN 68 HD21 ASN 68 -12.997 -23.239 5.778 565 2HD2 ASN 68 HD22 ASN 68 -13.331 -23.464 7.458 566 H GLU 69 HN GLU 69 -8.213 -22.309 6.297 567 HA GLU 69 HA GLU 69 -6.298 -23.194 8.238 568 1HB GLU 69 HB2 GLU 69 -5.835 -21.359 6.662 569 2HB GLU 69 HB1 GLU 69 -7.122 -20.405 7.384 570 1HG GLU 69 HG2 GLU 69 -5.881 -20.360 9.506 571 2HG GLU 69 HG1 GLU 69 -4.582 -21.283 8.749 572 H SER 70 HN SER 70 -9.483 -21.800 8.303 573 HA SER 70 HA SER 70 -9.543 -20.754 10.895 574 1HB SER 70 HB2 SER 70 -11.304 -20.414 9.138 575 2HB SER 70 HB1 SER 70 -11.852 -22.064 9.426 576 HG SER 70 HG SER 70 -12.666 -21.490 11.330 577 H GLU 71 HN GLU 71 -10.091 -24.042 9.701 578 HA GLU 71 HA GLU 71 -10.885 -25.096 12.236 579 1HB GLU 71 HB2 GLU 71 -9.900 -26.515 9.752 580 2HB GLU 71 HB1 GLU 71 -10.598 -27.314 11.157 581 1HG GLU 71 HG2 GLU 71 -12.691 -26.032 10.786 582 2HG GLU 71 HG1 GLU 71 -11.982 -25.369 9.315 583 H ARG 72 HN ARG 72 -7.833 -24.592 10.634 584 HA ARG 72 HA ARG 72 -6.159 -26.281 12.097 585 1HB ARG 72 HB2 ARG 72 -5.433 -24.882 10.157 586 2HB ARG 72 HB1 ARG 72 -5.548 -23.453 11.173 587 1HG ARG 72 HG2 ARG 72 -3.849 -24.667 12.699 588 2HG ARG 72 HG1 ARG 72 -3.563 -25.700 11.299 589 1HD ARG 72 HD2 ARG 72 -3.210 -22.705 11.458 590 2HD ARG 72 HD1 ARG 72 -1.935 -23.915 11.326 591 HE ARG 72 HE ARG 72 -3.599 -24.231 9.119 592 1HH1 ARG 72 HH11 ARG 72 -1.461 -21.783 10.434 593 2HH1 ARG 72 HH12 ARG 72 -1.089 -21.099 8.883 594 1HH2 ARG 72 HH21 ARG 72 -3.091 -23.338 7.074 595 2HH2 ARG 72 HH22 ARG 72 -2.003 -21.989 6.976 596 H ASN 73 HN ASN 73 -7.336 -23.033 12.795 597 HA ASN 73 HA ASN 73 -6.047 -22.849 15.361 598 1HB ASN 73 HB2 ASN 73 -8.244 -21.145 14.149 599 2HB ASN 73 HB1 ASN 73 -7.307 -20.741 15.585 600 1HD2 ASN 73 HD21 ASN 73 -7.588 -19.311 13.057 601 2HD2 ASN 73 HD22 ASN 73 -5.989 -19.133 12.425 602 H GLU 74 HN GLU 74 -9.253 -23.586 14.147 603 HA GLU 74 HA GLU 74 -10.741 -23.518 16.499 604 1HB GLU 74 HB2 GLU 74 -11.718 -23.737 14.250 605 2HB GLU 74 HB1 GLU 74 -11.046 -25.356 14.108 606 1HG GLU 74 HG2 GLU 74 -13.381 -25.508 14.626 607 2HG GLU 74 HG1 GLU 74 -12.445 -26.076 16.007 608 H ILE 75 HN ILE 75 -9.293 -26.349 14.931 609 HA ILE 75 HA ILE 75 -9.927 -28.183 16.965 610 HB ILE 75 HB ILE 75 -7.737 -28.339 14.877 611 1HG1 ILE 75 HG12 ILE 75 -10.568 -29.421 14.761 612 2HG1 ILE 75 HG11 ILE 75 -10.083 -27.891 14.044 613 1HG2 ILE 75 HG21 ILE 75 -9.098 -30.537 16.448 614 2HG2 ILE 75 HG22 ILE 75 -7.430 -29.997 16.647 615 3HG2 ILE 75 HG23 ILE 75 -7.932 -30.774 15.146 616 1HD1 ILE 75 HD11 ILE 75 -8.523 -29.090 12.588 617 2HD1 ILE 75 HD12 ILE 75 -10.196 -29.602 12.371 618 3HD1 ILE 75 HD13 ILE 75 -9.074 -30.617 13.280 619 H PHE 76 HN PHE 76 -7.105 -26.159 16.376 620 HA PHE 76 HA PHE 76 -5.355 -27.143 18.301 621 1HB PHE 76 HB2 PHE 76 -4.685 -25.446 16.680 622 2HB PHE 76 HB1 PHE 76 -5.804 -24.288 17.386 623 HD1 PHE 76 HD1 PHE 76 -5.039 -22.795 18.998 624 HD2 PHE 76 HD2 PHE 76 -2.824 -26.359 18.249 625 HE1 PHE 76 HE1 PHE 76 -3.253 -21.997 20.490 626 HE2 PHE 76 HE2 PHE 76 -1.038 -25.563 19.740 627 HZ PHE 76 HZ PHE 76 -1.251 -23.382 20.862 628 H GLN 77 HN GLN 77 -7.931 -24.728 18.613 629 HA GLN 77 HA GLN 77 -7.588 -24.178 21.358 630 1HB GLN 77 HB2 GLN 77 -10.076 -23.999 19.640 631 2HB GLN 77 HB1 GLN 77 -9.910 -23.299 21.246 632 1HG GLN 77 HG2 GLN 77 -8.208 -21.792 20.479 633 2HG GLN 77 HG1 GLN 77 -8.169 -22.569 18.898 634 1HE2 GLN 77 HE21 GLN 77 -9.838 -22.201 17.450 635 2HE2 GLN 77 HE22 GLN 77 -10.958 -20.897 17.636 636 H LYS 78 HN LYS 78 -9.640 -26.491 19.638 637 HA LYS 78 HA LYS 78 -11.044 -27.582 21.778 638 1HB LYS 78 HB2 LYS 78 -10.052 -28.834 19.209 639 2HB LYS 78 HB1 LYS 78 -11.110 -29.676 20.331 640 1HG LYS 78 HG2 LYS 78 -11.819 -27.032 19.072 641 2HG LYS 78 HG1 LYS 78 -12.230 -28.592 18.356 642 1HD LYS 78 HD2 LYS 78 -13.483 -29.190 20.387 643 2HD LYS 78 HD1 LYS 78 -13.081 -27.624 21.093 644 1HE LYS 78 HE2 LYS 78 -14.641 -28.004 18.534 645 2HE LYS 78 HE1 LYS 78 -15.366 -27.722 20.117 646 1HZ LYS 78 HZ1 LYS 78 -14.141 -25.607 20.208 647 2HZ LYS 78 HZ2 LYS 78 -15.232 -25.670 18.923 648 3HZ LYS 78 HZ3 LYS 78 -13.581 -25.867 18.634 649 H ILE 79 HN ILE 79 -7.863 -28.417 20.500 650 HA ILE 79 HA ILE 79 -7.406 -30.705 22.067 651 HB ILE 79 HB ILE 79 -5.434 -28.811 20.772 652 1HG1 ILE 79 HG12 ILE 79 -6.495 -31.514 19.887 653 2HG1 ILE 79 HG11 ILE 79 -6.996 -29.961 19.229 654 1HG2 ILE 79 HG21 ILE 79 -3.773 -30.590 20.995 655 2HG2 ILE 79 HG22 ILE 79 -4.936 -31.575 21.885 656 3HG2 ILE 79 HG23 ILE 79 -4.349 -30.064 22.578 657 1HD1 ILE 79 HD11 ILE 79 -5.425 -31.069 17.764 658 2HD1 ILE 79 HD12 ILE 79 -4.234 -31.144 19.064 659 3HD1 ILE 79 HD13 ILE 79 -4.729 -29.581 18.408 660 H SER 80 HN SER 80 -7.013 -27.301 22.810 661 HA SER 80 HA SER 80 -5.385 -27.872 25.141 662 1HB SER 80 HB2 SER 80 -5.483 -25.416 25.514 663 2HB SER 80 HB1 SER 80 -4.890 -25.857 23.915 664 HG SER 80 HG SER 80 -7.594 -25.542 23.937 665 H GLN 81 HN GLN 81 -8.537 -28.361 24.601 666 HA GLN 81 HA GLN 81 -9.477 -27.313 27.182 667 1HB GLN 81 HB2 GLN 81 -11.048 -28.580 24.921 668 2HB GLN 81 HB1 GLN 81 -11.730 -27.847 26.366 669 1HG GLN 81 HG2 GLN 81 -10.865 -25.670 25.687 670 2HG GLN 81 HG1 GLN 81 -10.140 -26.396 24.255 671 1HE2 GLN 81 HE21 GLN 81 -12.477 -28.183 23.875 672 2HE2 GLN 81 HE22 GLN 81 -13.717 -27.178 23.215 673 H LEU 82 HN LEU 82 -7.753 -29.825 26.560 674 HA LEU 82 HA LEU 82 -9.480 -32.017 27.328 675 1HB LEU 82 HB2 LEU 82 -6.469 -32.058 27.126 676 2HB LEU 82 HB1 LEU 82 -7.563 -33.425 27.068 677 HG LEU 82 HG LEU 82 -7.402 -31.263 24.964 678 1HD1 LEU 82 HD11 LEU 82 -6.322 -34.081 24.941 679 2HD1 LEU 82 HD12 LEU 82 -5.376 -32.590 24.972 680 3HD1 LEU 82 HD13 LEU 82 -6.357 -32.981 23.561 681 1HD2 LEU 82 HD21 LEU 82 -8.803 -32.776 23.642 682 2HD2 LEU 82 HD22 LEU 82 -9.614 -32.242 25.113 683 3HD2 LEU 82 HD23 LEU 82 -8.927 -33.864 25.026 684 H ASP 83 HN ASP 83 -7.455 -29.748 28.940 685 HA ASP 83 HA ASP 83 -6.903 -29.409 31.113 686 1HB ASP 83 HB2 ASP 83 -9.134 -30.109 31.774 687 2HB ASP 83 HB1 ASP 83 -8.679 -31.804 31.655 688 H LYS 84 HN LYS 84 -6.857 -32.848 30.277 689 HA LYS 84 HA LYS 84 -4.661 -33.625 31.827 690 1HB LYS 84 HB2 LYS 84 -5.646 -34.732 29.190 691 2HB LYS 84 HB1 LYS 84 -4.517 -35.546 30.264 692 1HG LYS 84 HG2 LYS 84 -6.168 -36.366 31.518 693 2HG LYS 84 HG1 LYS 84 -6.932 -34.784 31.674 694 1HD LYS 84 HD2 LYS 84 -8.064 -35.072 29.555 695 2HD LYS 84 HD1 LYS 84 -7.217 -36.590 29.264 696 1HE LYS 84 HE2 LYS 84 -9.000 -36.155 31.652 697 2HE LYS 84 HE1 LYS 84 -9.612 -36.737 30.110 698 1HZ LYS 84 HZ1 LYS 84 -7.481 -38.073 31.682 699 2HZ LYS 84 HZ2 LYS 84 -8.213 -38.661 30.273 700 3HZ LYS 84 HZ3 LYS 84 -9.112 -38.520 31.697 701 H VAL 85 HN VAL 85 -4.852 -31.822 28.908 702 HA VAL 85 HA VAL 85 -2.249 -32.507 27.895 703 HB VAL 85 HB VAL 85 -4.099 -31.941 26.375 704 1HG1 VAL 85 HG11 VAL 85 -3.866 -29.151 27.509 705 2HG1 VAL 85 HG12 VAL 85 -5.230 -30.251 27.712 706 3HG1 VAL 85 HG13 VAL 85 -4.841 -29.615 26.114 707 1HG2 VAL 85 HG21 VAL 85 -1.792 -29.997 26.207 708 2HG2 VAL 85 HG22 VAL 85 -2.858 -30.453 24.878 709 3HG2 VAL 85 HG23 VAL 85 -1.797 -31.658 25.610 710 H VAL 86 HN VAL 86 -0.390 -31.332 27.987 711 HA VAL 86 HA VAL 86 -0.393 -28.905 29.675 712 HB VAL 86 HB VAL 86 1.924 -29.470 30.319 713 1HG1 VAL 86 HG11 VAL 86 -0.075 -31.663 30.896 714 2HG1 VAL 86 HG12 VAL 86 0.091 -30.143 31.777 715 3HG1 VAL 86 HG13 VAL 86 1.389 -31.335 31.826 716 1HG2 VAL 86 HG21 VAL 86 2.820 -31.719 29.848 717 2HG2 VAL 86 HG22 VAL 86 2.580 -30.783 28.372 718 3HG2 VAL 86 HG23 VAL 86 1.431 -32.046 28.811 719 H GLN 87 HN GLN 87 0.497 -30.315 26.649 720 HA GLN 87 HA GLN 87 1.556 -27.736 25.767 721 1HB GLN 87 HB2 GLN 87 3.530 -29.072 26.383 722 2HB GLN 87 HB1 GLN 87 2.996 -30.365 25.319 723 1HG GLN 87 HG2 GLN 87 4.778 -29.019 24.319 724 2HG GLN 87 HG1 GLN 87 3.290 -28.946 23.382 725 1HE2 GLN 87 HE21 GLN 87 5.475 -27.187 25.429 726 2HE2 GLN 87 HE22 GLN 87 4.831 -25.616 25.107 727 H THR 88 HN THR 88 0.899 -27.181 23.783 728 HA THR 88 HA THR 88 -0.537 -29.192 22.168 729 HB THR 88 HB THR 88 -2.119 -27.257 21.573 730 HG1 THR 88 HG1 THR 88 -1.051 -26.202 24.008 731 1HG2 THR 88 HG21 THR 88 -2.165 -28.274 24.423 732 2HG2 THR 88 HG22 THR 88 -2.790 -29.139 23.018 733 3HG2 THR 88 HG23 THR 88 -3.539 -27.624 23.525 734 H LEU 89 HN LEU 89 0.672 -29.425 20.366 735 HA LEU 89 HA LEU 89 1.737 -27.001 19.063 736 1HB LEU 89 HB2 LEU 89 2.435 -29.907 18.557 737 2HB LEU 89 HB1 LEU 89 3.129 -28.537 17.715 738 HG LEU 89 HG LEU 89 4.755 -29.216 19.279 739 1HD1 LEU 89 HD11 LEU 89 4.965 -27.326 20.814 740 2HD1 LEU 89 HD12 LEU 89 3.285 -26.882 20.504 741 3HD1 LEU 89 HD13 LEU 89 4.474 -26.806 19.202 742 1HD2 LEU 89 HD21 LEU 89 3.360 -30.654 20.664 743 2HD2 LEU 89 HD22 LEU 89 2.607 -29.239 21.402 744 3HD2 LEU 89 HD23 LEU 89 4.322 -29.563 21.661 745 H GLY 90 HN GLY 90 0.231 -26.194 17.741 746 1HA GLY 90 HA2 GLY 90 -1.288 -28.070 16.017 747 2HA GLY 90 HA1 GLY 90 -1.911 -26.528 16.588 748 H SER 91 HN SER 91 1.236 -26.003 15.931 749 HA SER 91 HA SER 91 1.207 -25.756 13.088 750 1HB SER 91 HB2 SER 91 -0.295 -23.858 13.751 751 2HB SER 91 HB1 SER 91 1.022 -23.187 14.708 752 HG SER 91 HG SER 91 2.238 -23.144 12.684 Start of MODEL 17 1 1H GLN 1 HT1 GLN 1 -1.241 -3.371 -4.426 2 2H GLN 1 HT2 GLN 1 -2.498 -2.692 -3.526 3 3H GLN 1 HT3 GLN 1 -2.824 -3.420 -5.019 4 HA GLN 1 HA GLN 1 -1.883 -4.774 -2.561 5 1HB GLN 1 HB2 GLN 1 -4.511 -4.870 -4.070 6 2HB GLN 1 HB1 GLN 1 -4.082 -5.977 -2.775 7 1HG GLN 1 HG2 GLN 1 -4.322 -2.986 -2.493 8 2HG GLN 1 HG1 GLN 1 -5.558 -4.156 -2.036 9 1HE2 GLN 1 HE21 GLN 1 -3.605 -6.092 -1.015 10 2HE2 GLN 1 HE22 GLN 1 -3.042 -5.448 0.489 11 H GLY 2 HN GLY 2 -2.435 -7.265 -2.957 12 1HA GLY 2 HA2 GLY 2 -2.312 -9.120 -4.441 13 2HA GLY 2 HA1 GLY 2 -1.590 -8.076 -5.657 14 H HIS 3 HN HIS 3 -1.006 -9.692 -2.578 15 HA HIS 3 HA HIS 3 1.895 -9.428 -2.993 16 1HB HIS 3 HB2 HIS 3 2.143 -10.049 -0.634 17 2HB HIS 3 HB1 HIS 3 1.067 -8.668 -0.803 18 HD1 HIS 3 HD1 HIS 3 -1.398 -8.992 -0.112 19 HD2 HIS 3 HD2 HIS 3 0.941 -12.403 0.321 20 HE1 HIS 3 HE1 HIS 3 -2.773 -10.590 1.260 21 HE2 HIS 3 HE2 HIS 3 -1.379 -12.685 1.421 22 H MET 4 HN MET 4 3.199 -11.172 -3.248 23 HA MET 4 HA MET 4 1.861 -13.781 -3.614 24 1HB MET 4 HB2 MET 4 4.359 -12.693 -4.946 25 2HB MET 4 HB1 MET 4 3.685 -14.292 -5.218 26 1HG MET 4 HG2 MET 4 3.068 -12.896 -7.046 27 2HG MET 4 HG1 MET 4 1.621 -13.210 -6.092 28 1HE MET 4 HE1 MET 4 3.948 -9.218 -5.987 29 2HE MET 4 HE2 MET 4 4.398 -10.581 -7.010 30 3HE MET 4 HE3 MET 4 4.555 -10.704 -5.257 31 HA PRO 5 HA PRO 5 4.464 -15.742 -0.558 32 1HB PRO 5 HB2 PRO 5 5.188 -17.760 -2.634 33 2HB PRO 5 HB1 PRO 5 4.500 -18.000 -1.023 34 1HG PRO 5 HG2 PRO 5 2.983 -18.280 -3.195 35 2HG PRO 5 HG1 PRO 5 2.336 -17.509 -1.733 36 1HD PRO 5 HD2 PRO 5 3.293 -16.241 -4.279 37 2HD PRO 5 HD1 PRO 5 1.896 -15.821 -3.266 38 H SER 6 HN SER 6 6.741 -16.405 -0.153 39 HA SER 6 HA SER 6 8.493 -14.539 -1.517 40 1HB SER 6 HB2 SER 6 8.432 -14.755 0.985 41 2HB SER 6 HB1 SER 6 9.122 -16.369 0.818 42 HG SER 6 HG SER 6 10.544 -14.365 1.146 43 H ASP 7 HN ASP 7 10.956 -15.754 -1.288 44 HA ASP 7 HA ASP 7 11.084 -17.217 -3.698 45 1HB ASP 7 HB2 ASP 7 12.943 -15.835 -2.798 46 2HB ASP 7 HB1 ASP 7 13.176 -17.012 -1.510 47 H SER 8 HN SER 8 11.213 -18.210 -0.312 48 HA SER 8 HA SER 8 10.463 -20.924 -1.113 49 1HB SER 8 HB2 SER 8 12.092 -21.907 0.468 50 2HB SER 8 HB1 SER 8 12.899 -20.995 -0.808 51 HG SER 8 HG SER 8 12.804 -20.538 1.904 52 H LYS 9 HN LYS 9 10.498 -18.344 1.221 53 HA LYS 9 HA LYS 9 9.186 -19.741 3.327 54 1HB LYS 9 HB2 LYS 9 9.323 -16.766 2.761 55 2HB LYS 9 HB1 LYS 9 8.750 -17.486 4.261 56 1HG LYS 9 HG2 LYS 9 10.974 -18.465 4.632 57 2HG LYS 9 HG1 LYS 9 11.541 -17.718 3.137 58 1HD LYS 9 HD2 LYS 9 12.234 -16.363 5.016 59 2HD LYS 9 HD1 LYS 9 11.013 -15.489 4.091 60 1HE LYS 9 HE2 LYS 9 9.305 -16.112 5.716 61 2HE LYS 9 HE1 LYS 9 10.486 -17.063 6.617 62 1HZ LYS 9 HZ1 LYS 9 11.739 -14.996 6.991 63 2HZ LYS 9 HZ2 LYS 9 10.197 -14.952 7.675 64 3HZ LYS 9 HZ3 LYS 9 10.507 -14.121 6.235 65 H LYS 10 HN LYS 10 7.056 -19.876 3.857 66 HA LYS 10 HA LYS 10 4.830 -20.094 3.563 67 1HB LYS 10 HB2 LYS 10 5.142 -17.698 1.738 68 2HB LYS 10 HB1 LYS 10 3.598 -18.367 2.240 69 1HG LYS 10 HG2 LYS 10 5.569 -17.497 4.321 70 2HG LYS 10 HG1 LYS 10 4.625 -16.286 3.459 71 1HD LYS 10 HD2 LYS 10 3.488 -16.822 5.508 72 2HD LYS 10 HD1 LYS 10 2.548 -17.470 4.167 73 1HE LYS 10 HE2 LYS 10 3.395 -19.698 4.606 74 2HE LYS 10 HE1 LYS 10 4.455 -19.077 5.872 75 1HZ LYS 10 HZ1 LYS 10 1.488 -18.993 5.914 76 2HZ LYS 10 HZ2 LYS 10 2.509 -18.428 7.135 77 3HZ LYS 10 HZ3 LYS 10 2.453 -20.080 6.778 78 HA PRO 11 HA PRO 11 5.500 -22.483 -0.323 79 1HB PRO 11 HB2 PRO 11 4.744 -24.817 1.257 80 2HB PRO 11 HB1 PRO 11 6.264 -24.494 0.422 81 1HG PRO 11 HG2 PRO 11 6.041 -24.554 3.137 82 2HG PRO 11 HG1 PRO 11 7.241 -23.565 2.284 83 1HD PRO 11 HD2 PRO 11 4.603 -22.743 3.467 84 2HD PRO 11 HD1 PRO 11 6.173 -21.906 3.517 85 H THR 12 HN THR 12 3.926 -23.869 -1.472 86 HA THR 12 HA THR 12 1.196 -23.004 -0.898 87 HB THR 12 HB THR 12 2.254 -24.471 -3.334 88 HG1 THR 12 HG1 THR 12 2.016 -21.715 -2.700 89 1HG2 THR 12 HG21 THR 12 -0.175 -24.689 -3.023 90 2HG2 THR 12 HG22 THR 12 0.196 -23.662 -4.408 91 3HG2 THR 12 HG23 THR 12 -0.320 -22.937 -2.883 92 H ILE 13 HN ILE 13 0.071 -24.289 0.407 93 HA ILE 13 HA ILE 13 0.426 -27.209 0.271 94 HB ILE 13 HB ILE 13 -1.050 -25.566 2.353 95 1HG1 ILE 13 HG12 ILE 13 1.373 -25.115 2.405 96 2HG1 ILE 13 HG11 ILE 13 0.863 -26.010 3.832 97 1HG2 ILE 13 HG21 ILE 13 -1.018 -27.642 3.685 98 2HG2 ILE 13 HG22 ILE 13 -0.293 -28.492 2.320 99 3HG2 ILE 13 HG23 ILE 13 -1.922 -27.830 2.181 100 1HD1 ILE 13 HD11 ILE 13 2.216 -27.189 1.415 101 2HD1 ILE 13 HD12 ILE 13 1.740 -28.065 2.869 102 3HD1 ILE 13 HD13 ILE 13 2.986 -26.821 2.957 103 H ILE 14 HN ILE 14 -1.154 -28.481 -0.529 104 HA ILE 14 HA ILE 14 -3.522 -27.164 -1.631 105 HB ILE 14 HB ILE 14 -2.445 -29.955 -2.100 106 1HG1 ILE 14 HG12 ILE 14 -0.970 -28.237 -3.022 107 2HG1 ILE 14 HG11 ILE 14 -1.803 -29.075 -4.326 108 1HG2 ILE 14 HG21 ILE 14 -4.052 -30.059 -3.959 109 2HG2 ILE 14 HG22 ILE 14 -4.701 -28.490 -3.481 110 3HG2 ILE 14 HG23 ILE 14 -4.865 -29.877 -2.404 111 1HD1 ILE 14 HD11 ILE 14 -1.694 -26.701 -4.762 112 2HD1 ILE 14 HD12 ILE 14 -2.497 -26.359 -3.229 113 3HD1 ILE 14 HD13 ILE 14 -3.368 -27.198 -4.514 114 H TYR 15 HN TYR 15 -5.263 -27.125 -0.393 115 HA TYR 15 HA TYR 15 -5.742 -29.263 1.560 116 1HB TYR 15 HB2 TYR 15 -7.026 -26.532 1.230 117 2HB TYR 15 HB1 TYR 15 -7.431 -27.689 2.495 118 HD1 TYR 15 HD1 TYR 15 -6.066 -27.907 4.446 119 HD2 TYR 15 HD2 TYR 15 -4.758 -25.463 1.211 120 HE1 TYR 15 HE1 TYR 15 -4.293 -26.974 5.872 121 HE2 TYR 15 HE2 TYR 15 -2.982 -24.528 2.635 122 HH TYR 15 HH TYR 15 -2.098 -25.884 5.601 123 HA PRO 16 HA PRO 16 -7.542 -29.832 2.770 124 1HB PRO 16 HB2 PRO 16 -9.106 -32.249 2.666 125 2HB PRO 16 HB1 PRO 16 -9.541 -30.702 3.392 126 1HG PRO 16 HG2 PRO 16 -10.772 -31.781 1.171 127 2HG PRO 16 HG1 PRO 16 -10.754 -30.052 1.569 128 1HD PRO 16 HD2 PRO 16 -9.030 -31.572 -0.362 129 2HD PRO 16 HD1 PRO 16 -9.779 -29.968 -0.538 130 H CYS 17 HN CYS 17 -6.330 -31.386 3.959 131 HA CYS 17 HA CYS 17 -5.342 -33.791 2.724 132 1HB CYS 17 HB2 CYS 17 -3.922 -32.156 1.574 133 2HB CYS 17 HB1 CYS 17 -3.453 -31.449 3.116 134 HG CYS 17 HG CYS 17 -1.745 -33.328 3.884 135 H LEU 18 HN LEU 18 -3.936 -35.001 4.143 136 HA LEU 18 HA LEU 18 -4.701 -34.847 6.871 137 1HB LEU 18 HB2 LEU 18 -2.591 -36.466 5.442 138 2HB LEU 18 HB1 LEU 18 -2.926 -36.644 7.154 139 HG LEU 18 HG LEU 18 -5.034 -37.043 5.027 140 1HD1 LEU 18 HD11 LEU 18 -4.662 -39.447 5.290 141 2HD1 LEU 18 HD12 LEU 18 -3.286 -39.125 6.344 142 3HD1 LEU 18 HD13 LEU 18 -3.232 -38.639 4.649 143 1HD2 LEU 18 HD21 LEU 18 -6.208 -38.239 6.808 144 2HD2 LEU 18 HD22 LEU 18 -5.869 -36.575 7.281 145 3HD2 LEU 18 HD23 LEU 18 -4.888 -37.892 7.927 146 H TRP 19 HN TRP 19 -4.080 -33.120 8.004 147 HA TRP 19 HA TRP 19 -1.287 -32.237 7.939 148 1HB TRP 19 HB2 TRP 19 -3.231 -30.597 7.799 149 2HB TRP 19 HB1 TRP 19 -3.597 -31.003 9.471 150 HD1 TRP 19 HD1 TRP 19 -1.656 -30.315 11.313 151 HE1 TRP 19 HE1 TRP 19 0.007 -28.360 11.289 152 HE3 TRP 19 HE3 TRP 19 -1.875 -29.117 6.346 153 HZ2 TRP 19 HZ2 TRP 19 1.080 -26.532 9.421 154 HZ3 TRP 19 HZ3 TRP 19 -0.501 -27.249 5.523 155 HH2 TRP 19 HH2 TRP 19 0.944 -25.983 7.028 156 H ASP 20 HN ASP 20 0.029 -32.321 9.761 157 HA ASP 20 HA ASP 20 -0.776 -34.340 11.720 158 1HB ASP 20 HB2 ASP 20 1.926 -33.239 10.918 159 2HB ASP 20 HB1 ASP 20 1.706 -34.306 12.301 160 H TYR 21 HN TYR 21 -1.162 -33.908 13.760 161 HA TYR 21 HA TYR 21 -0.255 -31.357 14.929 162 1HB TYR 21 HB2 TYR 21 -2.861 -32.825 15.441 163 2HB TYR 21 HB1 TYR 21 -2.306 -31.426 16.354 164 HD1 TYR 21 HD1 TYR 21 -2.101 -29.204 15.185 165 HD2 TYR 21 HD2 TYR 21 -3.951 -32.571 13.339 166 HE1 TYR 21 HE1 TYR 21 -3.189 -27.713 13.562 167 HE2 TYR 21 HE2 TYR 21 -5.040 -31.083 11.712 168 HH TYR 21 HH TYR 21 -5.718 -28.700 11.564 169 H ARG 22 HN ARG 22 1.349 -31.864 16.282 170 HA ARG 22 HA ARG 22 1.384 -34.441 17.641 171 1HB ARG 22 HB2 ARG 22 3.432 -33.469 16.568 172 2HB ARG 22 HB1 ARG 22 3.404 -32.189 17.771 173 1HG ARG 22 HG2 ARG 22 5.018 -33.893 18.374 174 2HG ARG 22 HG1 ARG 22 3.699 -33.852 19.549 175 1HD ARG 22 HD2 ARG 22 4.380 -36.156 18.915 176 2HD ARG 22 HD1 ARG 22 2.690 -35.804 18.566 177 HE ARG 22 HE ARG 22 3.259 -35.633 16.233 178 1HH1 ARG 22 HH11 ARG 22 5.814 -36.893 18.267 179 2HH1 ARG 22 HH12 ARG 22 6.589 -37.757 16.971 180 1HH2 ARG 22 HH21 ARG 22 4.305 -36.736 14.516 181 2HH2 ARG 22 HH22 ARG 22 5.747 -37.646 14.845 182 H VAL 23 HN VAL 23 0.385 -34.661 19.527 183 HA VAL 23 HA VAL 23 -0.104 -32.266 21.180 184 HB VAL 23 HB VAL 23 -1.596 -34.904 21.237 185 1HG1 VAL 23 HG11 VAL 23 -2.275 -32.219 22.453 186 2HG1 VAL 23 HG12 VAL 23 -1.721 -33.643 23.332 187 3HG1 VAL 23 HG13 VAL 23 -3.284 -33.668 22.515 188 1HG2 VAL 23 HG21 VAL 23 -1.922 -33.848 19.074 189 2HG2 VAL 23 HG22 VAL 23 -2.350 -32.327 19.855 190 3HG2 VAL 23 HG23 VAL 23 -3.398 -33.733 20.033 191 H ILE 24 HN ILE 24 0.821 -32.160 23.164 192 HA ILE 24 HA ILE 24 1.841 -34.668 24.357 193 HB ILE 24 HB ILE 24 3.060 -31.904 24.629 194 1HG1 ILE 24 HG12 ILE 24 4.091 -34.352 23.155 195 2HG1 ILE 24 HG11 ILE 24 3.455 -32.895 22.400 196 1HG2 ILE 24 HG21 ILE 24 3.986 -34.570 25.718 197 2HG2 ILE 24 HG22 ILE 24 3.324 -33.233 26.659 198 3HG2 ILE 24 HG23 ILE 24 4.872 -33.048 25.837 199 1HD1 ILE 24 HD11 ILE 24 5.939 -33.070 24.094 200 2HD1 ILE 24 HD12 ILE 24 5.297 -31.603 23.355 201 3HD1 ILE 24 HD13 ILE 24 5.874 -32.923 22.337 202 H MET 25 HN MET 25 0.616 -35.193 26.034 203 HA MET 25 HA MET 25 -0.415 -33.043 27.783 204 1HB MET 25 HB2 MET 25 -1.732 -35.705 27.163 205 2HB MET 25 HB1 MET 25 -2.335 -34.509 28.302 206 1HG MET 25 HG2 MET 25 -2.412 -32.902 26.333 207 2HG MET 25 HG1 MET 25 -2.185 -34.319 25.312 208 1HE MET 25 HE1 MET 25 -3.814 -36.554 26.893 209 2HE MET 25 HE2 MET 25 -3.964 -36.328 25.151 210 3HE MET 25 HE3 MET 25 -5.411 -36.413 26.154 211 H THR 26 HN THR 26 -0.982 -33.960 30.024 212 HA THR 26 HA THR 26 1.332 -35.477 30.989 213 HB THR 26 HB THR 26 0.421 -34.761 33.264 214 HG1 THR 26 HG1 THR 26 -0.968 -32.652 32.293 215 1HG2 THR 26 HG21 THR 26 1.158 -32.592 31.287 216 2HG2 THR 26 HG22 THR 26 2.291 -33.587 32.204 217 3HG2 THR 26 HG23 THR 26 1.237 -32.449 33.043 218 H THR 27 HN THR 27 -1.137 -36.621 29.622 219 HA THR 27 HA THR 27 -1.660 -38.748 31.543 220 HB THR 27 HB THR 27 -3.455 -37.022 31.914 221 HG1 THR 27 HG1 THR 27 -4.751 -38.669 32.300 222 1HG2 THR 27 HG21 THR 27 -4.215 -37.713 29.073 223 2HG2 THR 27 HG22 THR 27 -3.622 -36.153 29.641 224 3HG2 THR 27 HG23 THR 27 -5.182 -36.759 30.196 225 H LYS 28 HN LYS 28 -2.672 -40.615 30.556 226 HA LYS 28 HA LYS 28 -2.250 -40.843 27.677 227 1HB LYS 28 HB2 LYS 28 -3.020 -42.867 29.789 228 2HB LYS 28 HB1 LYS 28 -2.981 -43.243 28.073 229 1HG LYS 28 HG2 LYS 28 -0.569 -42.627 28.049 230 2HG LYS 28 HG1 LYS 28 -0.652 -42.419 29.800 231 1HD LYS 28 HD2 LYS 28 0.230 -44.635 29.187 232 2HD LYS 28 HD1 LYS 28 -1.292 -44.761 30.071 233 1HE LYS 28 HE2 LYS 28 -2.487 -45.055 27.933 234 2HE LYS 28 HE1 LYS 28 -0.950 -44.967 27.074 235 1HZ LYS 28 HZ1 LYS 28 -1.687 -47.249 27.400 236 2HZ LYS 28 HZ2 LYS 28 -1.676 -47.035 29.077 237 3HZ LYS 28 HZ3 LYS 28 -0.229 -46.959 28.205 238 H ASP 29 HN ASP 29 -4.665 -39.912 29.777 239 HA ASP 29 HA ASP 29 -6.912 -41.101 28.431 240 1HB ASP 29 HB2 ASP 29 -7.109 -40.612 30.812 241 2HB ASP 29 HB1 ASP 29 -6.769 -38.907 30.523 242 H THR 30 HN THR 30 -6.520 -40.426 26.288 243 HA THR 30 HA THR 30 -6.917 -37.580 25.792 244 HB THR 30 HB THR 30 -5.187 -38.506 24.422 245 HG1 THR 30 HG1 THR 30 -6.416 -38.383 22.255 246 1HG2 THR 30 HG21 THR 30 -5.520 -40.363 22.862 247 2HG2 THR 30 HG22 THR 30 -7.167 -40.576 23.453 248 3HG2 THR 30 HG23 THR 30 -5.800 -40.880 24.525 249 H SER 31 HN SER 31 -8.988 -37.122 26.171 250 HA SER 31 HA SER 31 -11.045 -38.615 24.677 251 1HB SER 31 HB2 SER 31 -11.182 -39.050 27.127 252 2HB SER 31 HB1 SER 31 -11.358 -37.319 27.409 253 HG SER 31 HG SER 31 -13.408 -37.854 27.274 254 H THR 32 HN THR 32 -10.680 -35.579 26.496 255 HA THR 32 HA THR 32 -12.406 -33.947 25.146 256 HB THR 32 HB THR 32 -9.674 -33.020 26.070 257 HG1 THR 32 HG1 THR 32 -11.955 -33.395 27.739 258 1HG2 THR 32 HG21 THR 32 -11.112 -31.312 25.027 259 2HG2 THR 32 HG22 THR 32 -10.900 -31.000 26.749 260 3HG2 THR 32 HG23 THR 32 -12.404 -31.706 26.162 261 H LEU 33 HN LEU 33 -9.142 -34.884 24.251 262 HA LEU 33 HA LEU 33 -8.677 -33.149 22.119 263 1HB LEU 33 HB2 LEU 33 -6.953 -34.565 23.144 264 2HB LEU 33 HB1 LEU 33 -7.739 -35.999 22.514 265 HG LEU 33 HG LEU 33 -7.224 -35.288 20.216 266 1HD1 LEU 33 HD11 LEU 33 -5.816 -32.960 21.528 267 2HD1 LEU 33 HD12 LEU 33 -7.261 -32.877 20.518 268 3HD1 LEU 33 HD13 LEU 33 -5.725 -33.386 19.818 269 1HD2 LEU 33 HD21 LEU 33 -4.791 -35.612 20.310 270 2HD2 LEU 33 HD22 LEU 33 -5.639 -36.723 21.385 271 3HD2 LEU 33 HD23 LEU 33 -4.820 -35.309 22.049 272 H LYS 34 HN LYS 34 -10.112 -36.412 22.131 273 HA LYS 34 HA LYS 34 -10.586 -36.561 19.354 274 1HB LYS 34 HB2 LYS 34 -12.017 -37.932 21.645 275 2HB LYS 34 HB1 LYS 34 -12.228 -38.345 19.950 276 1HG LYS 34 HG2 LYS 34 -9.891 -39.017 19.800 277 2HG LYS 34 HG1 LYS 34 -9.639 -38.555 21.485 278 1HD LYS 34 HD2 LYS 34 -11.554 -40.690 20.521 279 2HD LYS 34 HD1 LYS 34 -9.968 -40.987 21.235 280 1HE LYS 34 HE2 LYS 34 -10.681 -39.966 23.316 281 2HE LYS 34 HE1 LYS 34 -12.242 -39.555 22.613 282 1HZ LYS 34 HZ1 LYS 34 -12.305 -41.542 24.026 283 2HZ LYS 34 HZ2 LYS 34 -11.241 -42.327 22.970 284 3HZ LYS 34 HZ3 LYS 34 -12.776 -41.870 22.434 285 H GLU 35 HN GLU 35 -12.594 -35.496 22.064 286 HA GLU 35 HA GLU 35 -15.039 -35.288 20.803 287 1HB GLU 35 HB2 GLU 35 -14.016 -33.380 22.920 288 2HB GLU 35 HB1 GLU 35 -15.697 -33.748 22.557 289 1HG GLU 35 HG2 GLU 35 -13.648 -35.551 23.823 290 2HG GLU 35 HG1 GLU 35 -15.114 -34.903 24.550 291 H LEU 36 HN LEU 36 -12.548 -32.750 21.114 292 HA LEU 36 HA LEU 36 -14.048 -30.789 19.730 293 1HB LEU 36 HB2 LEU 36 -12.084 -29.432 19.770 294 2HB LEU 36 HB1 LEU 36 -12.184 -30.288 21.293 295 HG LEU 36 HG LEU 36 -10.544 -31.972 20.025 296 1HD1 LEU 36 HD11 LEU 36 -9.994 -29.322 18.693 297 2HD1 LEU 36 HD12 LEU 36 -10.511 -30.813 17.906 298 3HD1 LEU 36 HD13 LEU 36 -8.919 -30.720 18.658 299 1HD2 LEU 36 HD21 LEU 36 -10.078 -30.862 22.146 300 2HD2 LEU 36 HD22 LEU 36 -9.657 -29.379 21.290 301 3HD2 LEU 36 HD23 LEU 36 -8.664 -30.824 21.091 302 H LEU 37 HN LEU 37 -11.862 -33.300 18.677 303 HA LEU 37 HA LEU 37 -11.468 -32.313 16.029 304 1HB LEU 37 HB2 LEU 37 -11.252 -35.131 17.109 305 2HB LEU 37 HB1 LEU 37 -10.664 -34.605 15.542 306 HG LEU 37 HG LEU 37 -9.643 -33.550 18.186 307 1HD1 LEU 37 HD11 LEU 37 -9.099 -35.908 17.956 308 2HD1 LEU 37 HD12 LEU 37 -7.654 -34.915 17.764 309 3HD1 LEU 37 HD13 LEU 37 -8.437 -35.617 16.347 310 1HD2 LEU 37 HD21 LEU 37 -8.575 -33.224 15.382 311 2HD2 LEU 37 HD22 LEU 37 -7.826 -32.616 16.856 312 3HD2 LEU 37 HD23 LEU 37 -9.383 -31.978 16.333 313 H GLU 38 HN GLU 38 -13.789 -34.493 17.543 314 HA GLU 38 HA GLU 38 -14.919 -35.409 15.094 315 1HB GLU 38 HB2 GLU 38 -16.041 -35.567 17.900 316 2HB GLU 38 HB1 GLU 38 -16.638 -36.461 16.506 317 1HG GLU 38 HG2 GLU 38 -14.312 -37.458 16.321 318 2HG GLU 38 HG1 GLU 38 -13.988 -36.758 17.902 319 H THR 39 HN THR 39 -15.429 -32.569 16.990 320 HA THR 39 HA THR 39 -18.104 -32.016 16.262 321 HB THR 39 HB THR 39 -17.629 -29.661 16.800 322 HG1 THR 39 HG1 THR 39 -14.978 -30.270 17.483 323 1HG2 THR 39 HG21 THR 39 -16.933 -29.960 19.133 324 2HG2 THR 39 HG22 THR 39 -16.357 -31.585 18.759 325 3HG2 THR 39 HG23 THR 39 -18.078 -31.211 18.644 326 H TYR 40 HN TYR 40 -15.085 -31.705 14.558 327 HA TYR 40 HA TYR 40 -16.092 -30.056 12.434 328 1HB TYR 40 HB2 TYR 40 -13.630 -31.822 12.582 329 2HB TYR 40 HB1 TYR 40 -13.984 -30.710 11.263 330 HD1 TYR 40 HD1 TYR 40 -13.721 -28.315 11.547 331 HD2 TYR 40 HD2 TYR 40 -12.982 -30.970 14.792 332 HE1 TYR 40 HE1 TYR 40 -12.619 -26.496 12.781 333 HE2 TYR 40 HE2 TYR 40 -11.877 -29.160 16.036 334 HH TYR 40 HH TYR 40 -11.875 -25.854 14.798 335 H GLN 41 HN GLN 41 -16.587 -33.229 13.318 336 HA GLN 41 HA GLN 41 -17.751 -34.939 12.410 337 1HB GLN 41 HB2 GLN 41 -18.404 -32.852 10.320 338 2HB GLN 41 HB1 GLN 41 -19.134 -34.451 10.356 339 1HG GLN 41 HG2 GLN 41 -19.339 -32.387 12.548 340 2HG GLN 41 HG1 GLN 41 -20.583 -32.740 11.348 341 1HE2 GLN 41 HE21 GLN 41 -19.005 -33.827 14.241 342 2HE2 GLN 41 HE22 GLN 41 -20.101 -35.119 14.591 343 H ARG 42 HN ARG 42 -14.906 -34.270 11.587 344 HA ARG 42 HA ARG 42 -14.808 -35.868 9.108 345 1HB ARG 42 HB2 ARG 42 -12.707 -34.803 8.579 346 2HB ARG 42 HB1 ARG 42 -13.904 -33.557 8.906 347 1HG ARG 42 HG2 ARG 42 -12.967 -33.147 11.084 348 2HG ARG 42 HG1 ARG 42 -11.858 -34.507 10.906 349 1HD ARG 42 HD2 ARG 42 -10.582 -32.567 10.464 350 2HD ARG 42 HD1 ARG 42 -10.896 -33.305 8.897 351 HE ARG 42 HE ARG 42 -11.880 -30.760 9.887 352 1HH1 ARG 42 HH11 ARG 42 -12.191 -33.224 7.394 353 2HH1 ARG 42 HH12 ARG 42 -12.974 -32.155 6.279 354 1HH2 ARG 42 HH21 ARG 42 -12.849 -29.362 8.393 355 2HH2 ARG 42 HH22 ARG 42 -13.349 -29.970 6.843 356 HA PRO 43 HA PRO 43 -12.589 -38.975 11.384 357 1HB PRO 43 HB2 PRO 43 -11.145 -40.155 9.428 358 2HB PRO 43 HB1 PRO 43 -12.905 -40.307 9.510 359 1HG PRO 43 HG2 PRO 43 -11.243 -38.481 7.805 360 2HG PRO 43 HG1 PRO 43 -12.660 -39.448 7.355 361 1HD PRO 43 HD2 PRO 43 -12.798 -36.783 7.920 362 2HD PRO 43 HD1 PRO 43 -14.143 -37.903 8.213 363 H PHE 44 HN PHE 44 -10.490 -39.522 12.189 364 HA PHE 44 HA PHE 44 -8.235 -37.890 11.352 365 1HB PHE 44 HB2 PHE 44 -7.780 -37.085 13.643 366 2HB PHE 44 HB1 PHE 44 -9.304 -36.467 13.020 367 HD1 PHE 44 HD1 PHE 44 -7.705 -38.565 15.529 368 HD2 PHE 44 HD2 PHE 44 -11.441 -37.291 13.923 369 HE1 PHE 44 HE1 PHE 44 -8.853 -39.409 17.531 370 HE2 PHE 44 HE2 PHE 44 -12.590 -38.136 15.927 371 HZ PHE 44 HZ PHE 44 -11.297 -39.197 17.735 372 H LYS 45 HN LYS 45 -6.233 -38.627 12.154 373 HA LYS 45 HA LYS 45 -6.217 -41.465 12.881 374 1HB LYS 45 HB2 LYS 45 -4.927 -40.886 10.907 375 2HB LYS 45 HB1 LYS 45 -4.082 -39.619 11.778 376 1HG LYS 45 HG2 LYS 45 -2.535 -41.349 11.630 377 2HG LYS 45 HG1 LYS 45 -3.159 -41.479 13.268 378 1HD LYS 45 HD2 LYS 45 -4.328 -43.110 11.024 379 2HD LYS 45 HD1 LYS 45 -2.868 -43.632 11.861 380 1HE LYS 45 HE2 LYS 45 -4.098 -43.572 13.998 381 2HE LYS 45 HE1 LYS 45 -5.559 -43.106 13.128 382 1HZ LYS 45 HZ1 LYS 45 -4.066 -45.655 12.837 383 2HZ LYS 45 HZ2 LYS 45 -5.379 -45.204 11.873 384 3HZ LYS 45 HZ3 LYS 45 -5.597 -45.449 13.531 385 H LEU 46 HN LEU 46 -6.263 -41.721 15.032 386 HA LEU 46 HA LEU 46 -4.666 -39.945 16.750 387 1HB LEU 46 HB2 LEU 46 -7.062 -40.226 17.305 388 2HB LEU 46 HB1 LEU 46 -6.814 -41.954 17.468 389 HG LEU 46 HG LEU 46 -5.226 -41.482 19.358 390 1HD1 LEU 46 HD11 LEU 46 -5.295 -39.285 20.422 391 2HD1 LEU 46 HD12 LEU 46 -6.297 -38.669 19.106 392 3HD1 LEU 46 HD13 LEU 46 -4.638 -39.185 18.789 393 1HD2 LEU 46 HD21 LEU 46 -8.057 -40.481 19.696 394 2HD2 LEU 46 HD22 LEU 46 -6.983 -40.994 20.998 395 3HD2 LEU 46 HD23 LEU 46 -7.521 -42.160 19.791 396 H GLU 47 HN GLU 47 -2.720 -40.667 17.342 397 HA GLU 47 HA GLU 47 -2.368 -43.524 17.939 398 1HB GLU 47 HB2 GLU 47 -0.621 -41.862 16.122 399 2HB GLU 47 HB1 GLU 47 -0.033 -43.322 16.904 400 1HG GLU 47 HG2 GLU 47 -1.860 -44.587 15.775 401 2HG GLU 47 HG1 GLU 47 -2.276 -43.111 14.903 402 H PHE 48 HN PHE 48 -1.114 -43.942 19.674 403 HA PHE 48 HA PHE 48 0.095 -41.747 21.148 404 1HB PHE 48 HB2 PHE 48 -1.078 -43.433 22.447 405 2HB PHE 48 HB1 PHE 48 -0.124 -44.720 21.718 406 HD1 PHE 48 HD1 PHE 48 1.756 -45.507 22.828 407 HD2 PHE 48 HD2 PHE 48 0.263 -41.629 23.782 408 HE1 PHE 48 HE1 PHE 48 3.390 -45.329 24.659 409 HE2 PHE 48 HE2 PHE 48 1.896 -41.451 25.612 410 HZ PHE 48 HZ PHE 48 3.461 -43.299 26.054 411 H LYS 49 HN LYS 49 2.148 -41.151 20.818 412 HA LYS 49 HA LYS 49 3.813 -42.747 19.053 413 1HB LYS 49 HB2 LYS 49 4.306 -40.032 20.298 414 2HB LYS 49 HB1 LYS 49 5.334 -40.798 19.099 415 1HG LYS 49 HG2 LYS 49 2.455 -40.016 18.640 416 2HG LYS 49 HG1 LYS 49 3.848 -39.041 18.182 417 1HD LYS 49 HD2 LYS 49 3.417 -40.108 16.190 418 2HD LYS 49 HD1 LYS 49 4.570 -41.231 16.903 419 1HE LYS 49 HE2 LYS 49 2.714 -42.647 17.665 420 2HE LYS 49 HE1 LYS 49 1.558 -41.513 16.973 421 1HZ LYS 49 HZ1 LYS 49 3.570 -43.099 15.478 422 2HZ LYS 49 HZ2 LYS 49 2.538 -41.958 14.788 423 3HZ LYS 49 HZ3 LYS 49 1.898 -43.357 15.489 424 H ASN 50 HN ASN 50 4.384 -41.120 22.184 425 HA ASN 50 HA ASN 50 5.562 -43.385 23.405 426 1HB ASN 50 HB2 ASN 50 7.369 -42.900 21.761 427 2HB ASN 50 HB1 ASN 50 7.520 -41.278 22.427 428 1HD2 ASN 50 HD21 ASN 50 9.660 -41.576 23.026 429 2HD2 ASN 50 HD22 ASN 50 10.122 -42.600 24.340 430 H THR 51 HN THR 51 6.360 -42.911 25.541 431 HA THR 51 HA THR 51 5.300 -40.462 26.695 432 HB THR 51 HB THR 51 4.958 -42.590 27.902 433 HG1 THR 51 HG1 THR 51 5.362 -40.458 29.000 434 1HG2 THR 51 HG21 THR 51 7.012 -43.753 27.260 435 2HG2 THR 51 HG22 THR 51 6.837 -43.709 29.014 436 3HG2 THR 51 HG23 THR 51 7.964 -42.615 28.213 437 H SER 52 HN SER 52 6.604 -38.935 27.773 438 HA SER 52 HA SER 52 8.958 -38.202 26.466 439 1HB SER 52 HB2 SER 52 7.441 -36.658 27.713 440 2HB SER 52 HB1 SER 52 8.040 -37.341 29.226 441 HG SER 52 HG SER 52 9.375 -35.737 27.329 442 H LYS 53 HN LYS 53 10.973 -37.589 27.959 443 HA LYS 53 HA LYS 53 12.284 -39.991 28.645 444 1HB LYS 53 HB2 LYS 53 13.058 -37.223 29.602 445 2HB LYS 53 HB1 LYS 53 14.115 -38.612 29.373 446 1HG LYS 53 HG2 LYS 53 13.483 -38.493 26.905 447 2HG LYS 53 HG1 LYS 53 12.792 -36.915 27.271 448 1HD LYS 53 HD2 LYS 53 15.003 -36.550 26.449 449 2HD LYS 53 HD1 LYS 53 15.037 -36.245 28.187 450 1HE LYS 53 HE2 LYS 53 16.986 -37.547 27.444 451 2HE LYS 53 HE1 LYS 53 15.987 -38.455 28.577 452 1HZ LYS 53 HZ1 LYS 53 15.041 -39.683 26.756 453 2HZ LYS 53 HZ2 LYS 53 16.725 -39.784 26.667 454 3HZ LYS 53 HZ3 LYS 53 15.888 -38.755 25.621 455 H ASN 54 HN ASN 54 10.194 -37.898 30.341 456 HA ASN 54 HA ASN 54 10.333 -39.684 32.682 457 1HB ASN 54 HB2 ASN 54 11.058 -37.358 33.244 458 2HB ASN 54 HB1 ASN 54 9.513 -36.753 32.660 459 1HD2 ASN 54 HD21 ASN 54 10.700 -36.504 35.288 460 2HD2 ASN 54 HD22 ASN 54 9.593 -37.221 36.407 461 H ALA 55 HN ALA 55 8.382 -40.555 33.294 462 HA ALA 55 HA ALA 55 6.371 -40.842 31.359 463 1HB ALA 55 HB1 ALA 55 6.856 -42.530 33.073 464 2HB ALA 55 HB2 ALA 55 5.148 -42.093 33.055 465 3HB ALA 55 HB3 ALA 55 6.208 -41.457 34.313 466 H LYS 56 HN LYS 56 6.928 -38.253 33.389 467 HA LYS 56 HA LYS 56 4.448 -37.354 34.212 468 1HB LYS 56 HB2 LYS 56 6.601 -36.305 34.816 469 2HB LYS 56 HB1 LYS 56 6.768 -35.701 33.173 470 1HG LYS 56 HG2 LYS 56 4.766 -34.319 33.473 471 2HG LYS 56 HG1 LYS 56 4.587 -34.931 35.118 472 1HD LYS 56 HD2 LYS 56 6.948 -33.355 34.068 473 2HD LYS 56 HD1 LYS 56 5.649 -32.710 35.073 474 1HE LYS 56 HE2 LYS 56 7.573 -34.901 35.875 475 2HE LYS 56 HE1 LYS 56 7.664 -33.216 36.387 476 1HZ LYS 56 HZ1 LYS 56 5.591 -33.446 37.541 477 2HZ LYS 56 HZ2 LYS 56 6.618 -34.692 38.040 478 3HZ LYS 56 HZ3 LYS 56 5.371 -35.014 36.951 479 H PHE 57 HN PHE 57 5.861 -37.331 30.996 480 HA PHE 57 HA PHE 57 3.431 -35.993 29.973 481 1HB PHE 57 HB2 PHE 57 6.214 -35.791 28.796 482 2HB PHE 57 HB1 PHE 57 4.769 -34.986 28.199 483 HD1 PHE 57 HD1 PHE 57 7.641 -34.643 30.216 484 HD2 PHE 57 HD2 PHE 57 3.573 -33.400 29.915 485 HE1 PHE 57 HE1 PHE 57 8.127 -32.704 31.651 486 HE2 PHE 57 HE2 PHE 57 4.059 -31.460 31.348 487 HZ PHE 57 HZ PHE 57 6.338 -31.110 32.217 488 H TYR 58 HN TYR 58 2.446 -36.860 28.231 489 HA TYR 58 HA TYR 58 3.653 -39.211 26.923 490 1HB TYR 58 HB2 TYR 58 0.720 -38.717 27.540 491 2HB TYR 58 HB1 TYR 58 1.344 -40.078 26.614 492 HD1 TYR 58 HD1 TYR 58 2.542 -41.901 27.727 493 HD2 TYR 58 HD2 TYR 58 0.970 -38.633 29.963 494 HE1 TYR 58 HE1 TYR 58 2.826 -43.189 29.801 495 HE2 TYR 58 HE2 TYR 58 1.252 -39.912 32.039 496 HH TYR 58 HH TYR 58 3.058 -42.819 32.186 497 H SER 59 HN SER 59 3.628 -39.203 24.714 498 HA SER 59 HA SER 59 2.661 -36.723 23.453 499 1HB SER 59 HB2 SER 59 4.798 -38.641 22.479 500 2HB SER 59 HB1 SER 59 4.389 -37.076 21.773 501 HG SER 59 HG SER 59 4.851 -36.537 24.250 502 H PHE 60 HN PHE 60 0.836 -36.938 22.385 503 HA PHE 60 HA PHE 60 0.248 -39.416 20.907 504 1HB PHE 60 HB2 PHE 60 -1.558 -37.121 21.731 505 2HB PHE 60 HB1 PHE 60 -2.072 -38.482 20.742 506 HD1 PHE 60 HD1 PHE 60 -1.602 -37.256 24.073 507 HD2 PHE 60 HD2 PHE 60 -1.949 -40.810 21.747 508 HE1 PHE 60 HE1 PHE 60 -2.173 -38.527 26.098 509 HE2 PHE 60 HE2 PHE 60 -2.517 -42.082 23.774 510 HZ PHE 60 HZ PHE 60 -2.631 -40.942 25.948 511 H ASN 61 HN ASN 61 -0.837 -39.070 18.793 512 HA ASN 61 HA ASN 61 -0.055 -36.589 17.436 513 1HB ASN 61 HB2 ASN 61 1.692 -38.201 16.876 514 2HB ASN 61 HB1 ASN 61 0.482 -39.390 16.399 515 1HD2 ASN 61 HD21 ASN 61 -0.581 -39.158 14.434 516 2HD2 ASN 61 HD22 ASN 61 -0.067 -38.031 13.225 517 H VAL 62 HN VAL 62 -1.657 -35.767 16.292 518 HA VAL 62 HA VAL 62 -3.864 -37.528 15.431 519 HB VAL 62 HB VAL 62 -3.997 -34.592 16.184 520 1HG1 VAL 62 HG11 VAL 62 -6.420 -34.802 15.820 521 2HG1 VAL 62 HG12 VAL 62 -6.189 -36.454 15.242 522 3HG1 VAL 62 HG13 VAL 62 -5.510 -35.099 14.339 523 1HG2 VAL 62 HG21 VAL 62 -3.818 -36.038 18.139 524 2HG2 VAL 62 HG22 VAL 62 -5.157 -37.026 17.555 525 3HG2 VAL 62 HG23 VAL 62 -5.438 -35.349 18.026 526 H SER 63 HN SER 63 -3.848 -37.796 13.308 527 HA SER 63 HA SER 63 -3.018 -35.544 11.586 528 1HB SER 63 HB2 SER 63 -2.890 -38.505 10.927 529 2HB SER 63 HB1 SER 63 -2.280 -37.178 9.938 530 HG SER 63 HG SER 63 -0.639 -36.859 11.334 531 H MET 64 HN MET 64 -4.843 -34.596 10.886 532 HA MET 64 HA MET 64 -6.986 -36.339 9.844 533 1HB MET 64 HB2 MET 64 -8.669 -34.711 10.600 534 2HB MET 64 HB1 MET 64 -7.780 -35.402 11.947 535 1HG MET 64 HG2 MET 64 -6.700 -33.424 12.433 536 2HG MET 64 HG1 MET 64 -6.890 -32.795 10.796 537 1HE MET 64 HE1 MET 64 -9.094 -34.063 13.825 538 2HE MET 64 HE2 MET 64 -10.019 -34.481 12.381 539 3HE MET 64 HE3 MET 64 -10.612 -33.236 13.480 540 H GLU 65 HN GLU 65 -8.314 -35.366 8.210 541 HA GLU 65 HA GLU 65 -6.766 -33.790 6.359 542 1HB GLU 65 HB2 GLU 65 -9.649 -34.675 6.126 543 2HB GLU 65 HB1 GLU 65 -8.606 -34.098 4.832 544 1HG GLU 65 HG2 GLU 65 -7.222 -36.055 4.999 545 2HG GLU 65 HG1 GLU 65 -8.111 -36.613 6.416 546 H VAL 66 HN VAL 66 -6.615 -31.680 6.678 547 HA VAL 66 HA VAL 66 -8.753 -30.230 8.030 548 HB VAL 66 HB VAL 66 -7.172 -28.294 7.991 549 1HG1 VAL 66 HG11 VAL 66 -6.064 -30.864 9.142 550 2HG1 VAL 66 HG12 VAL 66 -7.247 -29.802 9.908 551 3HG1 VAL 66 HG13 VAL 66 -5.600 -29.233 9.633 552 1HG2 VAL 66 HG21 VAL 66 -5.246 -30.292 6.774 553 2HG2 VAL 66 HG22 VAL 66 -4.831 -28.673 7.340 554 3HG2 VAL 66 HG23 VAL 66 -5.914 -28.875 5.964 555 H SER 67 HN SER 67 -10.145 -28.903 7.063 556 HA SER 67 HA SER 67 -10.589 -29.118 4.307 557 1HB SER 67 HB2 SER 67 -12.356 -28.642 5.992 558 2HB SER 67 HB1 SER 67 -11.696 -27.021 6.196 559 HG SER 67 HG SER 67 -13.466 -27.093 4.725 560 H ASN 68 HN ASN 68 -9.248 -26.409 6.213 561 HA ASN 68 HA ASN 68 -7.793 -25.497 3.898 562 1HB ASN 68 HB2 ASN 68 -8.761 -23.221 3.878 563 2HB ASN 68 HB1 ASN 68 -9.936 -24.452 3.434 564 1HD2 ASN 68 HD21 ASN 68 -11.705 -23.257 3.966 565 2HD2 ASN 68 HD22 ASN 68 -12.120 -22.837 5.594 566 H GLU 69 HN GLU 69 -6.931 -23.095 4.584 567 HA GLU 69 HA GLU 69 -4.965 -23.781 6.524 568 1HB GLU 69 HB2 GLU 69 -4.728 -22.346 4.410 569 2HB GLU 69 HB1 GLU 69 -5.450 -21.042 5.334 570 1HG GLU 69 HG2 GLU 69 -3.018 -22.439 6.373 571 2HG GLU 69 HG1 GLU 69 -2.863 -21.236 5.099 572 H SER 70 HN SER 70 -7.903 -21.913 6.574 573 HA SER 70 HA SER 70 -7.371 -20.470 8.983 574 1HB SER 70 HB2 SER 70 -9.002 -19.689 7.288 575 2HB SER 70 HB1 SER 70 -10.013 -21.092 7.625 576 HG SER 70 HG SER 70 -10.803 -19.379 8.796 577 H GLU 71 HN GLU 71 -9.236 -23.351 8.154 578 HA GLU 71 HA GLU 71 -10.199 -23.953 10.716 579 1HB GLU 71 HB2 GLU 71 -11.060 -24.953 8.601 580 2HB GLU 71 HB1 GLU 71 -9.571 -25.881 8.460 581 1HG GLU 71 HG2 GLU 71 -10.088 -26.979 10.605 582 2HG GLU 71 HG1 GLU 71 -11.609 -26.093 10.663 583 H ARG 72 HN ARG 72 -7.271 -24.915 8.994 584 HA ARG 72 HA ARG 72 -6.177 -26.700 10.820 585 1HB ARG 72 HB2 ARG 72 -5.184 -26.438 8.654 586 2HB ARG 72 HB1 ARG 72 -4.875 -24.732 8.923 587 1HG ARG 72 HG2 ARG 72 -3.553 -26.721 10.718 588 2HG ARG 72 HG1 ARG 72 -2.946 -26.521 9.074 589 1HD ARG 72 HD2 ARG 72 -2.612 -24.137 9.468 590 2HD ARG 72 HD1 ARG 72 -3.280 -24.295 11.092 591 HE ARG 72 HE ARG 72 -1.120 -26.062 10.840 592 1HH1 ARG 72 HH11 ARG 72 -1.753 -22.610 10.975 593 2HH1 ARG 72 HH12 ARG 72 -0.204 -22.236 11.670 594 1HH2 ARG 72 HH21 ARG 72 0.915 -25.542 11.757 595 2HH2 ARG 72 HH22 ARG 72 1.296 -23.884 12.110 596 H ASN 73 HN ASN 73 -5.893 -23.161 10.704 597 HA ASN 73 HA ASN 73 -4.201 -22.881 12.948 598 1HB ASN 73 HB2 ASN 73 -6.215 -20.936 11.780 599 2HB ASN 73 HB1 ASN 73 -5.008 -20.514 12.992 600 1HD2 ASN 73 HD21 ASN 73 -5.431 -19.559 10.239 601 2HD2 ASN 73 HD22 ASN 73 -3.938 -19.832 9.411 602 H GLU 74 HN GLU 74 -7.703 -22.987 12.604 603 HA GLU 74 HA GLU 74 -8.363 -22.301 15.254 604 1HB GLU 74 HB2 GLU 74 -10.059 -22.194 13.568 605 2HB GLU 74 HB1 GLU 74 -9.850 -23.893 13.160 606 1HG GLU 74 HG2 GLU 74 -10.781 -24.585 15.243 607 2HG GLU 74 HG1 GLU 74 -10.813 -22.927 15.843 608 H ILE 75 HN ILE 75 -7.995 -25.474 13.692 609 HA ILE 75 HA ILE 75 -8.699 -27.066 15.864 610 HB ILE 75 HB ILE 75 -6.731 -27.694 13.647 611 1HG1 ILE 75 HG12 ILE 75 -9.696 -28.292 13.905 612 2HG1 ILE 75 HG11 ILE 75 -9.001 -27.040 12.885 613 1HG2 ILE 75 HG21 ILE 75 -8.191 -29.572 15.517 614 2HG2 ILE 75 HG22 ILE 75 -6.456 -29.245 15.514 615 3HG2 ILE 75 HG23 ILE 75 -7.203 -30.056 14.138 616 1HD1 ILE 75 HD11 ILE 75 -9.609 -28.969 11.585 617 2HD1 ILE 75 HD12 ILE 75 -8.592 -30.003 12.589 618 3HD1 ILE 75 HD13 ILE 75 -7.859 -28.757 11.576 619 H PHE 76 HN PHE 76 -5.527 -25.763 14.945 620 HA PHE 76 HA PHE 76 -3.933 -26.955 16.882 621 1HB PHE 76 HB2 PHE 76 -2.949 -25.620 15.123 622 2HB PHE 76 HB1 PHE 76 -3.789 -24.176 15.677 623 HD1 PHE 76 HD1 PHE 76 -2.667 -22.681 17.054 624 HD2 PHE 76 HD2 PHE 76 -1.319 -26.718 16.853 625 HE1 PHE 76 HE1 PHE 76 -0.734 -22.103 18.460 626 HE2 PHE 76 HE2 PHE 76 0.614 -26.141 18.258 627 HZ PHE 76 HZ PHE 76 0.910 -23.835 19.064 628 H GLN 77 HN GLN 77 -5.939 -24.054 17.100 629 HA GLN 77 HA GLN 77 -5.227 -23.362 19.766 630 1HB GLN 77 HB2 GLN 77 -7.678 -22.652 18.132 631 2HB GLN 77 HB1 GLN 77 -7.219 -21.878 19.644 632 1HG GLN 77 HG2 GLN 77 -5.272 -20.921 18.666 633 2HG GLN 77 HG1 GLN 77 -5.451 -21.893 17.206 634 1HE2 GLN 77 HE21 GLN 77 -6.976 -21.316 15.681 635 2HE2 GLN 77 HE22 GLN 77 -7.759 -19.776 15.673 636 H LYS 78 HN LYS 78 -7.873 -25.213 18.334 637 HA LYS 78 HA LYS 78 -9.441 -25.617 20.613 638 1HB LYS 78 HB2 LYS 78 -9.008 -27.442 18.234 639 2HB LYS 78 HB1 LYS 78 -10.293 -27.633 19.417 640 1HG LYS 78 HG2 LYS 78 -9.951 -25.190 17.687 641 2HG LYS 78 HG1 LYS 78 -10.982 -26.560 17.277 642 1HD LYS 78 HD2 LYS 78 -12.260 -26.187 19.363 643 2HD LYS 78 HD1 LYS 78 -11.253 -24.776 19.704 644 1HE LYS 78 HE2 LYS 78 -13.382 -24.122 18.696 645 2HE LYS 78 HE1 LYS 78 -12.028 -23.716 17.642 646 1HZ LYS 78 HZ1 LYS 78 -13.925 -25.978 17.344 647 2HZ LYS 78 HZ2 LYS 78 -12.509 -25.832 16.437 648 3HZ LYS 78 HZ3 LYS 78 -13.721 -24.660 16.303 649 H ILE 79 HN ILE 79 -6.707 -27.442 19.338 650 HA ILE 79 HA ILE 79 -6.884 -29.651 21.070 651 HB ILE 79 HB ILE 79 -4.495 -28.544 19.581 652 1HG1 ILE 79 HG12 ILE 79 -6.376 -30.838 18.955 653 2HG1 ILE 79 HG11 ILE 79 -6.384 -29.268 18.163 654 1HG2 ILE 79 HG21 ILE 79 -3.453 -30.743 19.911 655 2HG2 ILE 79 HG22 ILE 79 -4.804 -31.226 20.938 656 3HG2 ILE 79 HG23 ILE 79 -3.732 -29.921 21.448 657 1HD1 ILE 79 HD11 ILE 79 -4.143 -31.279 18.074 658 2HD1 ILE 79 HD12 ILE 79 -4.154 -29.707 17.273 659 3HD1 ILE 79 HD13 ILE 79 -5.307 -30.952 16.789 660 H SER 80 HN SER 80 -5.452 -26.485 21.507 661 HA SER 80 HA SER 80 -3.997 -27.325 23.871 662 1HB SER 80 HB2 SER 80 -3.390 -24.896 24.018 663 2HB SER 80 HB1 SER 80 -2.938 -25.672 22.502 664 HG SER 80 HG SER 80 -5.444 -24.570 22.432 665 H GLN 81 HN GLN 81 -7.128 -27.084 23.482 666 HA GLN 81 HA GLN 81 -7.712 -25.459 25.859 667 1HB GLN 81 HB2 GLN 81 -9.571 -26.683 23.805 668 2HB GLN 81 HB1 GLN 81 -10.085 -25.703 25.173 669 1HG GLN 81 HG2 GLN 81 -8.866 -23.792 24.282 670 2HG GLN 81 HG1 GLN 81 -8.303 -24.768 22.928 671 1HE2 GLN 81 HE21 GLN 81 -10.869 -26.155 22.651 672 2HE2 GLN 81 HE22 GLN 81 -11.952 -25.018 21.930 673 H LEU 82 HN LEU 82 -6.653 -28.414 25.547 674 HA LEU 82 HA LEU 82 -8.674 -29.967 26.889 675 1HB LEU 82 HB2 LEU 82 -5.750 -30.710 26.796 676 2HB LEU 82 HB1 LEU 82 -7.148 -31.763 26.864 677 HG LEU 82 HG LEU 82 -6.355 -30.099 24.476 678 1HD1 LEU 82 HD11 LEU 82 -6.101 -33.068 24.941 679 2HD1 LEU 82 HD12 LEU 82 -4.778 -31.904 24.839 680 3HD1 LEU 82 HD13 LEU 82 -5.776 -32.228 23.422 681 1HD2 LEU 82 HD21 LEU 82 -8.543 -32.143 24.812 682 2HD2 LEU 82 HD22 LEU 82 -8.081 -31.369 23.295 683 3HD2 LEU 82 HD23 LEU 82 -8.753 -30.403 24.609 684 H ASP 83 HN ASP 83 -6.151 -27.847 27.813 685 HA ASP 83 HA ASP 83 -5.363 -27.062 29.770 686 1HB ASP 83 HB2 ASP 83 -7.764 -27.152 30.515 687 2HB ASP 83 HB1 ASP 83 -7.436 -28.741 31.199 688 H LYS 84 HN LYS 84 -6.070 -30.527 29.858 689 HA LYS 84 HA LYS 84 -3.904 -31.235 31.563 690 1HB LYS 84 HB2 LYS 84 -4.360 -33.546 30.784 691 2HB LYS 84 HB1 LYS 84 -5.820 -32.714 31.306 692 1HG LYS 84 HG2 LYS 84 -6.440 -32.291 28.990 693 2HG LYS 84 HG1 LYS 84 -4.944 -33.045 28.441 694 1HD LYS 84 HD2 LYS 84 -6.870 -34.553 28.223 695 2HD LYS 84 HD1 LYS 84 -5.648 -35.175 29.318 696 1HE LYS 84 HE2 LYS 84 -7.042 -34.229 31.215 697 2HE LYS 84 HE1 LYS 84 -8.305 -33.940 30.020 698 1HZ LYS 84 HZ1 LYS 84 -8.748 -36.006 31.059 699 2HZ LYS 84 HZ2 LYS 84 -7.168 -36.551 30.851 700 3HZ LYS 84 HZ3 LYS 84 -8.183 -36.379 29.511 701 H VAL 85 HN VAL 85 -3.929 -30.032 28.482 702 HA VAL 85 HA VAL 85 -1.627 -31.519 27.487 703 HB VAL 85 HB VAL 85 -3.430 -30.997 25.905 704 1HG1 VAL 85 HG11 VAL 85 -4.248 -28.925 26.899 705 2HG1 VAL 85 HG12 VAL 85 -3.877 -28.698 25.190 706 3HG1 VAL 85 HG13 VAL 85 -2.767 -28.095 26.419 707 1HG2 VAL 85 HG21 VAL 85 -0.890 -29.478 25.293 708 2HG2 VAL 85 HG22 VAL 85 -2.075 -30.031 24.108 709 3HG2 VAL 85 HG23 VAL 85 -1.152 -31.205 25.046 710 H VAL 86 HN VAL 86 0.419 -30.667 27.296 711 HA VAL 86 HA VAL 86 0.865 -28.077 28.639 712 HB VAL 86 HB VAL 86 3.126 -28.866 29.170 713 1HG1 VAL 86 HG11 VAL 86 0.979 -30.821 30.013 714 2HG1 VAL 86 HG12 VAL 86 1.328 -29.269 30.776 715 3HG1 VAL 86 HG13 VAL 86 2.523 -30.565 30.830 716 1HG2 VAL 86 HG21 VAL 86 2.274 -31.470 27.882 717 2HG2 VAL 86 HG22 VAL 86 3.774 -31.202 28.771 718 3HG2 VAL 86 HG23 VAL 86 3.484 -30.348 27.256 719 H GLN 87 HN GLN 87 1.316 -29.844 25.698 720 HA GLN 87 HA GLN 87 2.460 -27.495 24.433 721 1HB GLN 87 HB2 GLN 87 4.457 -28.678 25.217 722 2HB GLN 87 HB1 GLN 87 3.913 -30.156 24.433 723 1HG GLN 87 HG2 GLN 87 5.663 -29.032 23.145 724 2HG GLN 87 HG1 GLN 87 4.147 -29.121 22.248 725 1HE2 GLN 87 HE21 GLN 87 4.647 -27.393 20.916 726 2HE2 GLN 87 HE22 GLN 87 4.699 -25.762 21.482 727 H THR 88 HN THR 88 1.830 -27.283 22.372 728 HA THR 88 HA THR 88 0.647 -29.594 20.980 729 HB THR 88 HB THR 88 -0.984 -27.955 19.951 730 HG1 THR 88 HG1 THR 88 -1.257 -25.969 21.015 731 1HG2 THR 88 HG21 THR 88 -1.161 -28.316 22.951 732 2HG2 THR 88 HG22 THR 88 -1.697 -29.476 21.734 733 3HG2 THR 88 HG23 THR 88 -2.507 -27.916 21.883 734 H LEU 89 HN LEU 89 1.496 -29.914 19.001 735 HA LEU 89 HA LEU 89 2.963 -27.694 17.727 736 1HB LEU 89 HB2 LEU 89 3.393 -30.677 17.437 737 2HB LEU 89 HB1 LEU 89 4.211 -29.462 16.479 738 HG LEU 89 HG LEU 89 5.742 -30.186 18.136 739 1HD1 LEU 89 HD11 LEU 89 6.213 -28.154 19.389 740 2HD1 LEU 89 HD12 LEU 89 4.595 -27.547 19.040 741 3HD1 LEU 89 HD13 LEU 89 5.751 -27.786 17.729 742 1HD2 LEU 89 HD21 LEU 89 5.284 -30.177 20.528 743 2HD2 LEU 89 HD22 LEU 89 4.153 -31.227 19.674 744 3HD2 LEU 89 HD23 LEU 89 3.633 -29.634 20.226 745 H GLY 90 HN GLY 90 1.515 -26.803 16.368 746 1HA GLY 90 HA2 GLY 90 0.026 -28.563 14.528 747 2HA GLY 90 HA1 GLY 90 -0.320 -26.864 14.833 748 H SER 91 HN SER 91 2.883 -26.922 14.700 749 HA SER 91 HA SER 91 3.059 -26.671 11.783 750 1HB SER 91 HB2 SER 91 4.785 -24.846 12.363 751 2HB SER 91 HB1 SER 91 3.085 -24.437 12.564 752 HG SER 91 HG SER 91 4.898 -25.251 14.597 Start of MODEL 18 1 1H GLN 1 HT1 GLN 1 3.816 -8.671 15.889 2 2H GLN 1 HT2 GLN 1 2.286 -9.184 16.390 3 3H GLN 1 HT3 GLN 1 2.436 -7.857 15.355 4 HA GLN 1 HA GLN 1 3.174 -10.639 14.708 5 1HB GLN 1 HB2 GLN 1 1.256 -10.528 13.128 6 2HB GLN 1 HB1 GLN 1 0.771 -10.424 14.809 7 1HG GLN 1 HG2 GLN 1 -0.570 -8.855 13.756 8 2HG GLN 1 HG1 GLN 1 0.725 -7.883 14.449 9 1HE2 GLN 1 HE21 GLN 1 -0.663 -9.149 11.513 10 2HE2 GLN 1 HE22 GLN 1 0.207 -8.126 10.418 11 H GLY 2 HN GLY 2 2.983 -10.631 12.082 12 1HA GLY 2 HA2 GLY 2 3.513 -9.103 10.179 13 2HA GLY 2 HA1 GLY 2 4.812 -8.481 11.188 14 H HIS 3 HN HIS 3 4.921 -9.742 8.548 15 HA HIS 3 HA HIS 3 6.840 -11.883 9.227 16 1HB HIS 3 HB2 HIS 3 5.079 -11.725 6.757 17 2HB HIS 3 HB1 HIS 3 6.329 -12.929 7.035 18 HD1 HIS 3 HD1 HIS 3 3.087 -13.243 6.706 19 HD2 HIS 3 HD2 HIS 3 5.388 -13.744 10.128 20 HE1 HIS 3 HE1 HIS 3 1.764 -14.780 8.187 21 HE2 HIS 3 HE2 HIS 3 3.098 -14.937 10.316 22 H MET 4 HN MET 4 8.789 -11.821 8.123 23 HA MET 4 HA MET 4 9.410 -9.356 6.711 24 1HB MET 4 HB2 MET 4 11.159 -11.714 7.473 25 2HB MET 4 HB1 MET 4 11.740 -10.255 6.681 26 1HG MET 4 HG2 MET 4 10.990 -8.936 8.626 27 2HG MET 4 HG1 MET 4 10.508 -10.433 9.425 28 1HE MET 4 HE1 MET 4 12.857 -12.415 8.496 29 2HE MET 4 HE2 MET 4 12.224 -12.341 10.141 30 3HE MET 4 HE3 MET 4 13.962 -12.248 9.861 31 HA PRO 5 HA PRO 5 8.361 -10.902 2.703 32 1HB PRO 5 HB2 PRO 5 10.778 -9.335 1.877 33 2HB PRO 5 HB1 PRO 5 9.147 -9.331 1.193 34 1HG PRO 5 HG2 PRO 5 9.941 -7.344 2.768 35 2HG PRO 5 HG1 PRO 5 8.293 -7.991 2.896 36 1HD PRO 5 HD2 PRO 5 10.641 -8.404 4.701 37 2HD PRO 5 HD1 PRO 5 8.916 -8.282 5.102 38 H SER 6 HN SER 6 8.833 -13.060 2.809 39 HA SER 6 HA SER 6 11.524 -13.858 1.906 40 1HB SER 6 HB2 SER 6 9.658 -15.445 3.703 41 2HB SER 6 HB1 SER 6 11.269 -15.938 3.176 42 HG SER 6 HG SER 6 10.617 -13.699 4.803 43 H ASP 7 HN ASP 7 11.108 -13.997 -0.238 44 HA ASP 7 HA ASP 7 8.664 -15.128 -1.257 45 1HB ASP 7 HB2 ASP 7 11.184 -14.209 -2.670 46 2HB ASP 7 HB1 ASP 7 9.723 -14.751 -3.493 47 H SER 8 HN SER 8 8.343 -17.231 -1.215 48 HA SER 8 HA SER 8 10.205 -19.009 -2.519 49 1HB SER 8 HB2 SER 8 11.052 -18.996 -0.181 50 2HB SER 8 HB1 SER 8 9.457 -19.479 0.390 51 HG SER 8 HG SER 8 9.980 -21.456 -0.034 52 H LYS 9 HN LYS 9 9.096 -20.561 -3.579 53 HA LYS 9 HA LYS 9 6.312 -20.397 -3.817 54 1HB LYS 9 HB2 LYS 9 7.715 -21.252 -5.622 55 2HB LYS 9 HB1 LYS 9 8.203 -22.617 -4.634 56 1HG LYS 9 HG2 LYS 9 6.636 -23.541 -6.066 57 2HG LYS 9 HG1 LYS 9 5.697 -23.237 -4.608 58 1HD LYS 9 HD2 LYS 9 5.782 -21.303 -6.925 59 2HD LYS 9 HD1 LYS 9 4.616 -22.620 -6.833 60 1HE LYS 9 HE2 LYS 9 3.801 -21.697 -4.681 61 2HE LYS 9 HE1 LYS 9 4.918 -20.347 -4.867 62 1HZ LYS 9 HZ1 LYS 9 2.698 -21.024 -6.711 63 2HZ LYS 9 HZ2 LYS 9 3.782 -19.744 -6.918 64 3HZ LYS 9 HZ3 LYS 9 2.716 -19.747 -5.605 65 H LYS 10 HN LYS 10 5.090 -20.736 -2.054 66 HA LYS 10 HA LYS 10 5.497 -22.676 -0.071 67 1HB LYS 10 HB2 LYS 10 2.996 -21.226 -0.967 68 2HB LYS 10 HB1 LYS 10 3.040 -22.285 0.438 69 1HG LYS 10 HG2 LYS 10 4.694 -19.789 0.050 70 2HG LYS 10 HG1 LYS 10 3.279 -19.953 1.095 71 1HD LYS 10 HD2 LYS 10 4.416 -21.524 2.511 72 2HD LYS 10 HD1 LYS 10 5.777 -21.626 1.393 73 1HE LYS 10 HE2 LYS 10 6.385 -20.253 3.271 74 2HE LYS 10 HE1 LYS 10 6.275 -19.256 1.824 75 1HZ LYS 10 HZ1 LYS 10 4.108 -19.498 3.835 76 2HZ LYS 10 HZ2 LYS 10 4.178 -18.412 2.541 77 3HZ LYS 10 HZ3 LYS 10 5.255 -18.260 3.834 78 HA PRO 11 HA PRO 11 4.336 -26.410 -2.184 79 1HB PRO 11 HB2 PRO 11 3.710 -27.951 -0.006 80 2HB PRO 11 HB1 PRO 11 5.367 -27.593 -0.509 81 1HG PRO 11 HG2 PRO 11 3.714 -26.291 1.627 82 2HG PRO 11 HG1 PRO 11 5.421 -26.776 1.671 83 1HD PRO 11 HD2 PRO 11 4.672 -24.215 1.262 84 2HD PRO 11 HD1 PRO 11 6.113 -24.908 0.489 85 H THR 12 HN THR 12 2.495 -26.665 -3.258 86 HA THR 12 HA THR 12 -0.029 -25.770 -2.224 87 HB THR 12 HB THR 12 0.623 -27.294 -4.764 88 HG1 THR 12 HG1 THR 12 1.330 -24.922 -4.183 89 1HG2 THR 12 HG21 THR 12 -1.734 -27.553 -4.155 90 2HG2 THR 12 HG22 THR 12 -1.570 -26.495 -5.557 91 3HG2 THR 12 HG23 THR 12 -1.890 -25.806 -3.965 92 H ILE 13 HN ILE 13 -1.080 -26.929 -0.758 93 HA ILE 13 HA ILE 13 -0.794 -29.828 -0.644 94 HB ILE 13 HB ILE 13 -2.294 -27.950 1.203 95 1HG1 ILE 13 HG12 ILE 13 0.108 -27.485 1.236 96 2HG1 ILE 13 HG11 ILE 13 -0.372 -28.269 2.739 97 1HG2 ILE 13 HG21 ILE 13 -2.290 -29.840 2.781 98 2HG2 ILE 13 HG22 ILE 13 -1.558 -30.862 1.544 99 3HG2 ILE 13 HG23 ILE 13 -3.180 -30.212 1.305 100 1HD1 ILE 13 HD11 ILE 13 1.745 -29.134 1.938 101 2HD1 ILE 13 HD12 ILE 13 1.004 -29.591 0.405 102 3HD1 ILE 13 HD13 ILE 13 0.512 -30.393 1.897 103 H ILE 14 HN ILE 14 -2.397 -31.259 -1.066 104 HA ILE 14 HA ILE 14 -4.667 -30.255 -2.590 105 HB ILE 14 HB ILE 14 -3.825 -33.126 -2.110 106 1HG1 ILE 14 HG12 ILE 14 -2.032 -31.934 -3.255 107 2HG1 ILE 14 HG11 ILE 14 -2.841 -33.009 -4.388 108 1HG2 ILE 14 HG21 ILE 14 -5.685 -31.931 -4.176 109 2HG2 ILE 14 HG22 ILE 14 -6.169 -32.891 -2.777 110 3HG2 ILE 14 HG23 ILE 14 -5.219 -33.629 -4.067 111 1HD1 ILE 14 HD11 ILE 14 -3.201 -30.027 -4.181 112 2HD1 ILE 14 HD12 ILE 14 -4.097 -31.083 -5.273 113 3HD1 ILE 14 HD13 ILE 14 -2.351 -30.909 -5.449 114 H TYR 15 HN TYR 15 -6.253 -29.567 -1.257 115 HA TYR 15 HA TYR 15 -7.168 -31.264 0.947 116 1HB TYR 15 HB2 TYR 15 -8.021 -28.500 0.027 117 2HB TYR 15 HB1 TYR 15 -8.758 -29.357 1.374 118 HD1 TYR 15 HD1 TYR 15 -7.852 -29.161 3.533 119 HD2 TYR 15 HD2 TYR 15 -5.486 -27.984 0.192 120 HE1 TYR 15 HE1 TYR 15 -6.174 -28.213 5.060 121 HE2 TYR 15 HE2 TYR 15 -3.802 -27.044 1.720 122 HH TYR 15 HH TYR 15 -3.673 -26.164 4.003 123 HA PRO 16 HA PRO 16 -9.065 -31.620 2.057 124 1HB PRO 16 HB2 PRO 16 -10.670 -34.035 2.004 125 2HB PRO 16 HB1 PRO 16 -11.095 -32.449 2.648 126 1HG PRO 16 HG2 PRO 16 -12.277 -33.553 0.439 127 2HG PRO 16 HG1 PRO 16 -12.146 -31.806 0.715 128 1HD PRO 16 HD2 PRO 16 -10.437 -33.585 -1.001 129 2HD PRO 16 HD1 PRO 16 -11.085 -31.966 -1.352 130 H CYS 17 HN CYS 17 -7.962 -33.037 3.465 131 HA CYS 17 HA CYS 17 -6.998 -35.602 2.611 132 1HB CYS 17 HB2 CYS 17 -5.471 -34.185 1.318 133 2HB CYS 17 HB1 CYS 17 -5.037 -33.293 2.772 134 HG CYS 17 HG CYS 17 -3.670 -35.351 3.980 135 H LEU 18 HN LEU 18 -5.706 -36.652 4.240 136 HA LEU 18 HA LEU 18 -6.316 -35.895 6.942 137 1HB LEU 18 HB2 LEU 18 -4.489 -38.022 5.801 138 2HB LEU 18 HB1 LEU 18 -4.857 -37.852 7.509 139 HG LEU 18 HG LEU 18 -6.987 -38.352 5.426 140 1HD1 LEU 18 HD11 LEU 18 -6.928 -40.706 6.103 141 2HD1 LEU 18 HD12 LEU 18 -5.523 -40.384 7.118 142 3HD1 LEU 18 HD13 LEU 18 -5.405 -40.209 5.367 143 1HD2 LEU 18 HD21 LEU 18 -6.952 -38.676 8.431 144 2HD2 LEU 18 HD22 LEU 18 -8.299 -39.081 7.366 145 3HD2 LEU 18 HD23 LEU 18 -7.778 -37.405 7.528 146 H TRP 19 HN TRP 19 -5.190 -34.490 8.134 147 HA TRP 19 HA TRP 19 -2.368 -33.970 7.429 148 1HB TRP 19 HB2 TRP 19 -4.071 -32.081 7.055 149 2HB TRP 19 HB1 TRP 19 -4.197 -31.990 8.808 150 HD1 TRP 19 HD1 TRP 19 -2.179 -30.852 10.121 151 HE1 TRP 19 HE1 TRP 19 -0.108 -29.525 9.356 152 HE3 TRP 19 HE3 TRP 19 -2.354 -31.893 5.108 153 HZ2 TRP 19 HZ2 TRP 19 1.267 -29.002 6.941 154 HZ3 TRP 19 HZ3 TRP 19 -0.619 -30.942 3.649 155 HH2 TRP 19 HH2 TRP 19 1.150 -29.523 4.546 156 H ASP 20 HN ASP 20 -0.877 -33.764 9.126 157 HA ASP 20 HA ASP 20 -1.669 -35.158 11.565 158 1HB ASP 20 HB2 ASP 20 1.037 -34.431 10.425 159 2HB ASP 20 HB1 ASP 20 0.834 -35.146 12.020 160 H TYR 21 HN TYR 21 -1.875 -34.239 13.475 161 HA TYR 21 HA TYR 21 -0.855 -31.507 13.908 162 1HB TYR 21 HB2 TYR 21 -3.413 -32.773 14.944 163 2HB TYR 21 HB1 TYR 21 -2.786 -31.222 15.496 164 HD1 TYR 21 HD1 TYR 21 -3.027 -29.239 14.161 165 HD2 TYR 21 HD2 TYR 21 -4.253 -33.019 12.622 166 HE1 TYR 21 HE1 TYR 21 -4.190 -28.107 12.316 167 HE2 TYR 21 HE2 TYR 21 -5.418 -31.892 10.775 168 HH TYR 21 HH TYR 21 -4.934 -28.625 10.039 169 H ARG 22 HN ARG 22 0.765 -31.548 15.315 170 HA ARG 22 HA ARG 22 1.111 -33.818 17.101 171 1HB ARG 22 HB2 ARG 22 3.045 -32.930 15.844 172 2HB ARG 22 HB1 ARG 22 2.862 -31.384 16.659 173 1HG ARG 22 HG2 ARG 22 4.661 -32.637 17.665 174 2HG ARG 22 HG1 ARG 22 3.333 -32.482 18.815 175 1HD ARG 22 HD2 ARG 22 4.284 -34.742 18.833 176 2HD ARG 22 HD1 ARG 22 2.601 -34.751 18.305 177 HE ARG 22 HE ARG 22 3.342 -35.149 16.068 178 1HH1 ARG 22 HH11 ARG 22 5.901 -35.287 18.461 179 2HH1 ARG 22 HH12 ARG 22 6.962 -36.219 17.453 180 1HH2 ARG 22 HH21 ARG 22 4.736 -36.381 14.739 181 2HH2 ARG 22 HH22 ARG 22 6.296 -36.848 15.343 182 H VAL 23 HN VAL 23 0.128 -33.807 18.993 183 HA VAL 23 HA VAL 23 -0.346 -31.242 20.380 184 HB VAL 23 HB VAL 23 -1.885 -33.834 20.702 185 1HG1 VAL 23 HG11 VAL 23 -2.444 -31.048 21.731 186 2HG1 VAL 23 HG12 VAL 23 -1.951 -32.442 22.691 187 3HG1 VAL 23 HG13 VAL 23 -3.523 -32.432 21.893 188 1HG2 VAL 23 HG21 VAL 23 -2.634 -31.362 19.128 189 2HG2 VAL 23 HG22 VAL 23 -3.692 -32.735 19.445 190 3HG2 VAL 23 HG23 VAL 23 -2.245 -32.950 18.465 191 H ILE 24 HN ILE 24 1.130 -30.999 21.959 192 HA ILE 24 HA ILE 24 2.028 -33.372 23.452 193 HB ILE 24 HB ILE 24 3.201 -30.575 23.442 194 1HG1 ILE 24 HG12 ILE 24 4.162 -33.110 22.069 195 2HG1 ILE 24 HG11 ILE 24 3.459 -31.713 21.260 196 1HG2 ILE 24 HG21 ILE 24 3.626 -31.757 25.530 197 2HG2 ILE 24 HG22 ILE 24 5.113 -31.615 24.593 198 3HG2 ILE 24 HG23 ILE 24 4.242 -33.149 24.640 199 1HD1 ILE 24 HD11 ILE 24 6.056 -31.756 22.785 200 2HD1 ILE 24 HD12 ILE 24 5.354 -30.349 21.983 201 3HD1 ILE 24 HD13 ILE 24 5.868 -31.740 21.030 202 H MET 25 HN MET 25 0.886 -33.780 25.227 203 HA MET 25 HA MET 25 -0.034 -31.514 26.887 204 1HB MET 25 HB2 MET 25 -1.439 -34.167 26.443 205 2HB MET 25 HB1 MET 25 -1.952 -32.938 27.591 206 1HG MET 25 HG2 MET 25 -2.173 -31.363 25.638 207 2HG MET 25 HG1 MET 25 -1.925 -32.756 24.589 208 1HE MET 25 HE1 MET 25 -3.451 -35.080 26.166 209 2HE MET 25 HE2 MET 25 -3.631 -34.819 24.430 210 3HE MET 25 HE3 MET 25 -5.060 -34.971 25.454 211 H THR 26 HN THR 26 -0.332 -32.095 29.193 212 HA THR 26 HA THR 26 1.983 -33.633 30.094 213 HB THR 26 HB THR 26 1.341 -32.563 32.344 214 HG1 THR 26 HG1 THR 26 -0.729 -31.876 32.006 215 1HG2 THR 26 HG21 THR 26 3.197 -31.736 30.972 216 2HG2 THR 26 HG22 THR 26 2.335 -30.401 31.736 217 3HG2 THR 26 HG23 THR 26 2.072 -30.755 30.030 218 H THR 27 HN THR 27 -0.845 -34.696 29.284 219 HA THR 27 HA THR 27 -1.220 -36.385 31.668 220 HB THR 27 HB THR 27 -3.026 -34.670 31.566 221 HG1 THR 27 HG1 THR 27 -4.027 -36.304 32.468 222 1HG2 THR 27 HG21 THR 27 -3.666 -35.981 28.916 223 2HG2 THR 27 HG22 THR 27 -3.159 -34.310 29.171 224 3HG2 THR 27 HG23 THR 27 -4.724 -34.860 29.771 225 H LYS 28 HN LYS 28 -2.262 -38.420 31.231 226 HA LYS 28 HA LYS 28 -1.723 -39.490 28.557 227 1HB LYS 28 HB2 LYS 28 -2.258 -40.727 31.255 228 2HB LYS 28 HB1 LYS 28 -2.414 -41.683 29.788 229 1HG LYS 28 HG2 LYS 28 0.099 -40.182 30.511 230 2HG LYS 28 HG1 LYS 28 -0.208 -41.854 30.995 231 1HD LYS 28 HD2 LYS 28 -0.162 -40.840 28.141 232 2HD LYS 28 HD1 LYS 28 1.159 -41.699 28.937 233 1HE LYS 28 HE2 LYS 28 -0.298 -43.653 29.244 234 2HE LYS 28 HE1 LYS 28 -1.621 -42.792 28.459 235 1HZ LYS 28 HZ1 LYS 28 -0.390 -42.753 26.418 236 2HZ LYS 28 HZ2 LYS 28 -0.457 -44.345 26.982 237 3HZ LYS 28 HZ3 LYS 28 0.964 -43.451 27.159 238 H ASP 29 HN ASP 29 -4.233 -38.227 30.425 239 HA ASP 29 HA ASP 29 -6.357 -39.854 29.321 240 1HB ASP 29 HB2 ASP 29 -6.588 -39.010 31.610 241 2HB ASP 29 HB1 ASP 29 -6.467 -37.352 31.031 242 H THR 30 HN THR 30 -5.853 -39.427 27.089 243 HA THR 30 HA THR 30 -6.374 -36.784 26.075 244 HB THR 30 HB THR 30 -4.828 -38.109 24.807 245 HG1 THR 30 HG1 THR 30 -5.903 -38.064 22.742 246 1HG2 THR 30 HG21 THR 30 -7.030 -40.146 24.428 247 2HG2 THR 30 HG22 THR 30 -5.598 -40.352 25.436 248 3HG2 THR 30 HG23 THR 30 -5.431 -40.200 23.686 249 H SER 31 HN SER 31 -8.371 -36.096 26.482 250 HA SER 31 HA SER 31 -10.647 -37.777 25.653 251 1HB SER 31 HB2 SER 31 -11.898 -36.480 27.494 252 2HB SER 31 HB1 SER 31 -10.738 -37.701 28.023 253 HG SER 31 HG SER 31 -9.678 -36.183 28.998 254 H THR 32 HN THR 32 -10.304 -34.389 26.679 255 HA THR 32 HA THR 32 -12.165 -33.248 25.025 256 HB THR 32 HB THR 32 -9.537 -31.936 25.765 257 HG1 THR 32 HG1 THR 32 -11.906 -32.379 27.296 258 1HG2 THR 32 HG21 THR 32 -12.317 -30.798 25.356 259 2HG2 THR 32 HG22 THR 32 -10.954 -30.616 24.249 260 3HG2 THR 32 HG23 THR 32 -10.894 -29.882 25.853 261 H LEU 33 HN LEU 33 -8.838 -34.074 24.288 262 HA LEU 33 HA LEU 33 -8.505 -32.761 21.859 263 1HB LEU 33 HB2 LEU 33 -6.667 -33.822 23.057 264 2HB LEU 33 HB1 LEU 33 -7.371 -35.405 22.785 265 HG LEU 33 HG LEU 33 -6.985 -35.176 20.366 266 1HD1 LEU 33 HD11 LEU 33 -7.182 -32.747 20.186 267 2HD1 LEU 33 HD12 LEU 33 -5.671 -33.318 19.482 268 3HD1 LEU 33 HD13 LEU 33 -5.667 -32.549 21.069 269 1HD2 LEU 33 HD21 LEU 33 -4.538 -35.335 20.410 270 2HD2 LEU 33 HD22 LEU 33 -5.268 -36.227 21.745 271 3HD2 LEU 33 HD23 LEU 33 -4.521 -34.657 22.039 272 H LYS 34 HN LYS 34 -9.797 -36.015 22.515 273 HA LYS 34 HA LYS 34 -10.305 -36.533 19.737 274 1HB LYS 34 HB2 LYS 34 -11.230 -37.999 22.222 275 2HB LYS 34 HB1 LYS 34 -11.488 -38.563 20.575 276 1HG LYS 34 HG2 LYS 34 -8.982 -38.526 20.284 277 2HG LYS 34 HG1 LYS 34 -8.863 -38.236 22.019 278 1HD LYS 34 HD2 LYS 34 -10.201 -40.625 20.733 279 2HD LYS 34 HD1 LYS 34 -8.580 -40.619 21.424 280 1HE LYS 34 HE2 LYS 34 -9.526 -40.070 23.624 281 2HE LYS 34 HE1 LYS 34 -11.147 -40.089 22.928 282 1HZ LYS 34 HZ1 LYS 34 -10.625 -42.173 24.039 283 2HZ LYS 34 HZ2 LYS 34 -9.289 -42.405 23.027 284 3HZ LYS 34 HZ3 LYS 34 -10.851 -42.419 22.380 285 H GLU 35 HN GLU 35 -12.131 -35.289 22.452 286 HA GLU 35 HA GLU 35 -14.727 -35.620 21.476 287 1HB GLU 35 HB2 GLU 35 -13.626 -33.437 23.263 288 2HB GLU 35 HB1 GLU 35 -15.338 -33.751 23.005 289 1HG GLU 35 HG2 GLU 35 -15.025 -36.023 23.937 290 2HG GLU 35 HG1 GLU 35 -13.342 -35.623 24.274 291 H LEU 36 HN LEU 36 -12.430 -32.952 20.983 292 HA LEU 36 HA LEU 36 -14.252 -31.312 19.540 293 1HB LEU 36 HB2 LEU 36 -12.352 -29.935 18.982 294 2HB LEU 36 HB1 LEU 36 -12.242 -30.427 20.658 295 HG LEU 36 HG LEU 36 -10.681 -32.328 19.624 296 1HD1 LEU 36 HD11 LEU 36 -10.362 -30.055 17.666 297 2HD1 LEU 36 HD12 LEU 36 -10.966 -31.672 17.303 298 3HD1 LEU 36 HD13 LEU 36 -9.292 -31.451 17.809 299 1HD2 LEU 36 HD21 LEU 36 -9.785 -29.495 20.148 300 2HD2 LEU 36 HD22 LEU 36 -8.746 -30.921 20.143 301 3HD2 LEU 36 HD23 LEU 36 -10.016 -30.761 21.355 302 H LEU 37 HN LEU 37 -12.071 -33.887 18.639 303 HA LEU 37 HA LEU 37 -12.111 -33.488 15.835 304 1HB LEU 37 HB2 LEU 37 -11.813 -36.086 17.364 305 2HB LEU 37 HB1 LEU 37 -11.354 -35.816 15.692 306 HG LEU 37 HG LEU 37 -10.087 -34.428 18.063 307 1HD1 LEU 37 HD11 LEU 37 -9.049 -36.722 16.401 308 2HD1 LEU 37 HD12 LEU 37 -9.577 -36.810 18.081 309 3HD1 LEU 37 HD13 LEU 37 -8.154 -35.862 17.655 310 1HD2 LEU 37 HD21 LEU 37 -9.304 -34.483 15.147 311 2HD2 LEU 37 HD22 LEU 37 -8.395 -33.713 16.449 312 3HD2 LEU 37 HD23 LEU 37 -9.993 -33.109 16.014 313 H GLU 38 HN GLU 38 -14.154 -35.269 18.073 314 HA GLU 38 HA GLU 38 -15.733 -36.614 16.162 315 1HB GLU 38 HB2 GLU 38 -16.449 -35.846 19.003 316 2HB GLU 38 HB1 GLU 38 -17.275 -37.050 18.023 317 1HG GLU 38 HG2 GLU 38 -15.223 -38.393 17.956 318 2HG GLU 38 HG1 GLU 38 -14.416 -37.190 18.960 319 H THR 39 HN THR 39 -15.951 -33.383 17.538 320 HA THR 39 HA THR 39 -18.663 -32.912 16.898 321 HB THR 39 HB THR 39 -18.183 -30.515 17.150 322 HG1 THR 39 HG1 THR 39 -15.572 -31.385 16.758 323 1HG2 THR 39 HG21 THR 39 -18.511 -31.846 19.172 324 2HG2 THR 39 HG22 THR 39 -17.336 -30.562 19.457 325 3HG2 THR 39 HG23 THR 39 -16.788 -32.221 19.219 326 H TYR 40 HN TYR 40 -15.829 -32.984 14.919 327 HA TYR 40 HA TYR 40 -17.045 -31.511 12.737 328 1HB TYR 40 HB2 TYR 40 -14.490 -33.128 12.884 329 2HB TYR 40 HB1 TYR 40 -15.023 -32.255 11.452 330 HD1 TYR 40 HD1 TYR 40 -15.243 -29.724 11.584 331 HD2 TYR 40 HD2 TYR 40 -13.323 -32.025 14.603 332 HE1 TYR 40 HE1 TYR 40 -14.119 -27.692 12.408 333 HE2 TYR 40 HE2 TYR 40 -12.196 -30.001 15.440 334 HH TYR 40 HH TYR 40 -13.019 -26.822 14.222 335 H GLN 41 HN GLN 41 -17.295 -34.608 13.980 336 HA GLN 41 HA GLN 41 -18.351 -36.500 13.313 337 1HB GLN 41 HB2 GLN 41 -19.384 -34.686 11.116 338 2HB GLN 41 HB1 GLN 41 -19.988 -36.306 11.426 339 1HG GLN 41 HG2 GLN 41 -20.085 -34.039 13.410 340 2HG GLN 41 HG1 GLN 41 -21.415 -34.509 12.353 341 1HE2 GLN 41 HE21 GLN 41 -19.550 -35.350 15.160 342 2HE2 GLN 41 HE22 GLN 41 -20.589 -36.611 15.720 343 H ARG 42 HN ARG 42 -15.656 -35.785 12.271 344 HA ARG 42 HA ARG 42 -15.622 -37.506 9.874 345 1HB ARG 42 HB2 ARG 42 -13.716 -36.260 9.046 346 2HB ARG 42 HB1 ARG 42 -15.027 -35.139 9.390 347 1HG ARG 42 HG2 ARG 42 -13.924 -34.615 11.567 348 2HG ARG 42 HG1 ARG 42 -12.564 -35.620 11.063 349 1HD ARG 42 HD2 ARG 42 -12.035 -33.322 10.598 350 2HD ARG 42 HD1 ARG 42 -12.293 -34.156 9.065 351 HE ARG 42 HE ARG 42 -14.724 -33.034 9.803 352 1HH1 ARG 42 HH11 ARG 42 -11.518 -31.905 8.949 353 2HH1 ARG 42 HH12 ARG 42 -12.089 -30.404 8.288 354 1HH2 ARG 42 HH21 ARG 42 -15.471 -31.070 8.910 355 2HH2 ARG 42 HH22 ARG 42 -14.329 -29.928 8.264 356 HA PRO 43 HA PRO 43 -13.055 -40.244 12.215 357 1HB PRO 43 HB2 PRO 43 -11.627 -41.439 10.224 358 2HB PRO 43 HB1 PRO 43 -13.333 -41.787 10.531 359 1HG PRO 43 HG2 PRO 43 -12.111 -39.961 8.489 360 2HG PRO 43 HG1 PRO 43 -13.438 -41.125 8.298 361 1HD PRO 43 HD2 PRO 43 -13.881 -38.475 8.607 362 2HD PRO 43 HD1 PRO 43 -14.995 -39.698 9.252 363 H PHE 44 HN PHE 44 -10.836 -40.760 12.739 364 HA PHE 44 HA PHE 44 -8.713 -39.037 11.800 365 1HB PHE 44 HB2 PHE 44 -8.226 -38.095 14.038 366 2HB PHE 44 HB1 PHE 44 -9.798 -37.571 13.447 367 HD1 PHE 44 HD1 PHE 44 -8.035 -39.564 15.958 368 HD2 PHE 44 HD2 PHE 44 -11.856 -38.388 14.479 369 HE1 PHE 44 HE1 PHE 44 -9.086 -40.374 18.029 370 HE2 PHE 44 HE2 PHE 44 -12.906 -39.197 16.551 371 HZ PHE 44 HZ PHE 44 -11.523 -40.190 18.328 372 H LYS 45 HN LYS 45 -6.659 -39.535 13.115 373 HA LYS 45 HA LYS 45 -6.712 -42.281 14.200 374 1HB LYS 45 HB2 LYS 45 -5.655 -42.104 11.889 375 2HB LYS 45 HB1 LYS 45 -4.407 -41.110 12.620 376 1HG LYS 45 HG2 LYS 45 -3.743 -42.951 14.065 377 2HG LYS 45 HG1 LYS 45 -5.038 -43.951 13.410 378 1HD LYS 45 HD2 LYS 45 -3.212 -44.693 12.195 379 2HD LYS 45 HD1 LYS 45 -3.892 -43.482 11.112 380 1HE LYS 45 HE2 LYS 45 -1.605 -42.994 13.024 381 2HE LYS 45 HE1 LYS 45 -1.416 -43.383 11.319 382 1HZ LYS 45 HZ1 LYS 45 -1.242 -40.995 11.799 383 2HZ LYS 45 HZ2 LYS 45 -2.841 -40.989 12.346 384 3HZ LYS 45 HZ3 LYS 45 -2.507 -41.346 10.730 385 H LEU 46 HN LEU 46 -6.315 -42.124 16.309 386 HA LEU 46 HA LEU 46 -4.799 -39.878 17.384 387 1HB LEU 46 HB2 LEU 46 -7.005 -40.847 18.335 388 2HB LEU 46 HB1 LEU 46 -6.017 -42.147 18.965 389 HG LEU 46 HG LEU 46 -6.540 -40.412 20.653 390 1HD1 LEU 46 HD11 LEU 46 -4.498 -41.753 20.894 391 2HD1 LEU 46 HD12 LEU 46 -4.316 -40.133 21.563 392 3HD1 LEU 46 HD13 LEU 46 -3.595 -40.526 20.001 393 1HD2 LEU 46 HD21 LEU 46 -4.875 -38.588 18.917 394 2HD2 LEU 46 HD22 LEU 46 -5.509 -38.205 20.517 395 3HD2 LEU 46 HD23 LEU 46 -6.616 -38.473 19.173 396 H GLU 47 HN GLU 47 -2.693 -40.017 17.873 397 HA GLU 47 HA GLU 47 -1.474 -42.691 18.170 398 1HB GLU 47 HB2 GLU 47 -0.299 -40.267 16.796 399 2HB GLU 47 HB1 GLU 47 0.541 -41.788 17.062 400 1HG GLU 47 HG2 GLU 47 -1.094 -42.931 15.636 401 2HG GLU 47 HG1 GLU 47 -1.910 -41.391 15.355 402 H PHE 48 HN PHE 48 -0.028 -42.961 19.787 403 HA PHE 48 HA PHE 48 0.878 -40.586 21.288 404 1HB PHE 48 HB2 PHE 48 -0.268 -42.175 22.733 405 2HB PHE 48 HB1 PHE 48 0.707 -43.503 22.115 406 HD1 PHE 48 HD1 PHE 48 2.652 -44.130 23.235 407 HD2 PHE 48 HD2 PHE 48 1.000 -40.264 23.942 408 HE1 PHE 48 HE1 PHE 48 4.291 -43.758 25.030 409 HE2 PHE 48 HE2 PHE 48 2.639 -39.893 25.736 410 HZ PHE 48 HZ PHE 48 4.286 -41.639 26.284 411 H LYS 49 HN LYS 49 2.802 -39.940 20.524 412 HA LYS 49 HA LYS 49 4.411 -41.688 18.925 413 1HB LYS 49 HB2 LYS 49 4.851 -38.842 19.839 414 2HB LYS 49 HB1 LYS 49 5.928 -39.697 18.743 415 1HG LYS 49 HG2 LYS 49 3.014 -39.086 18.232 416 2HG LYS 49 HG1 LYS 49 4.390 -38.232 17.532 417 1HD LYS 49 HD2 LYS 49 5.110 -40.326 16.435 418 2HD LYS 49 HD1 LYS 49 3.709 -41.153 17.116 419 1HE LYS 49 HE2 LYS 49 2.215 -39.670 15.872 420 2HE LYS 49 HE1 LYS 49 3.602 -38.802 15.219 421 1HZ LYS 49 HZ1 LYS 49 2.740 -40.384 13.630 422 2HZ LYS 49 HZ2 LYS 49 2.941 -41.658 14.720 423 3HZ LYS 49 HZ3 LYS 49 4.295 -40.845 14.109 424 H ASN 50 HN ASN 50 5.199 -39.830 21.901 425 HA ASN 50 HA ASN 50 6.544 -42.055 23.079 426 1HB ASN 50 HB2 ASN 50 8.181 -41.363 21.280 427 2HB ASN 50 HB1 ASN 50 8.350 -39.819 22.107 428 1HD2 ASN 50 HD21 ASN 50 8.943 -43.257 22.299 429 2HD2 ASN 50 HD22 ASN 50 10.139 -43.181 23.544 430 H THR 51 HN THR 51 7.634 -41.435 25.145 431 HA THR 51 HA THR 51 6.227 -39.174 26.377 432 HB THR 51 HB THR 51 5.960 -41.400 27.442 433 HG1 THR 51 HG1 THR 51 6.064 -40.559 29.431 434 1HG2 THR 51 HG21 THR 51 8.159 -42.354 26.937 435 2HG2 THR 51 HG22 THR 51 7.827 -42.412 28.667 436 3HG2 THR 51 HG23 THR 51 8.921 -41.189 28.019 437 H SER 52 HN SER 52 7.310 -37.481 27.309 438 HA SER 52 HA SER 52 9.891 -36.935 26.218 439 1HB SER 52 HB2 SER 52 8.141 -35.203 26.454 440 2HB SER 52 HB1 SER 52 8.265 -35.324 28.206 441 HG SER 52 HG SER 52 10.585 -34.785 27.822 442 H LYS 53 HN LYS 53 11.122 -38.620 27.190 443 HA LYS 53 HA LYS 53 12.642 -39.476 28.634 444 1HB LYS 53 HB2 LYS 53 12.933 -36.537 29.277 445 2HB LYS 53 HB1 LYS 53 14.089 -37.778 29.745 446 1HG LYS 53 HG2 LYS 53 14.436 -38.311 27.351 447 2HG LYS 53 HG1 LYS 53 13.352 -36.984 26.928 448 1HD LYS 53 HD2 LYS 53 14.852 -35.389 28.005 449 2HD LYS 53 HD1 LYS 53 15.918 -36.704 28.504 450 1HE LYS 53 HE2 LYS 53 15.304 -35.878 25.663 451 2HE LYS 53 HE1 LYS 53 16.808 -35.580 26.534 452 1HZ LYS 53 HZ1 LYS 53 17.041 -38.032 26.730 453 2HZ LYS 53 HZ2 LYS 53 17.127 -37.462 25.146 454 3HZ LYS 53 HZ3 LYS 53 15.713 -38.208 25.699 455 H ASN 54 HN ASN 54 11.639 -36.813 30.752 456 HA ASN 54 HA ASN 54 11.631 -38.560 33.040 457 1HB ASN 54 HB2 ASN 54 10.788 -35.653 32.827 458 2HB ASN 54 HB1 ASN 54 11.091 -36.536 34.321 459 1HD2 ASN 54 HD21 ASN 54 12.359 -34.119 33.330 460 2HD2 ASN 54 HD22 ASN 54 14.047 -34.471 33.218 461 H ALA 55 HN ALA 55 9.474 -38.345 30.681 462 HA ALA 55 HA ALA 55 7.295 -38.905 30.419 463 1HB ALA 55 HB1 ALA 55 7.443 -39.730 33.323 464 2HB ALA 55 HB2 ALA 55 7.843 -40.750 31.942 465 3HB ALA 55 HB3 ALA 55 6.186 -40.192 32.173 466 H LYS 56 HN LYS 56 8.206 -36.263 31.560 467 HA LYS 56 HA LYS 56 6.041 -35.305 33.181 468 1HB LYS 56 HB2 LYS 56 8.335 -34.377 33.335 469 2HB LYS 56 HB1 LYS 56 8.195 -33.773 31.691 470 1HG LYS 56 HG2 LYS 56 7.865 -32.016 33.375 471 2HG LYS 56 HG1 LYS 56 6.445 -32.240 32.353 472 1HD LYS 56 HD2 LYS 56 5.830 -31.944 34.713 473 2HD LYS 56 HD1 LYS 56 5.355 -33.531 34.110 474 1HE LYS 56 HE2 LYS 56 6.278 -33.795 36.308 475 2HE LYS 56 HE1 LYS 56 7.405 -34.482 35.144 476 1HZ LYS 56 HZ1 LYS 56 8.785 -32.547 35.335 477 2HZ LYS 56 HZ2 LYS 56 8.480 -33.149 36.885 478 3HZ LYS 56 HZ3 LYS 56 7.661 -31.777 36.337 479 H PHE 57 HN PHE 57 6.899 -35.247 29.779 480 HA PHE 57 HA PHE 57 4.258 -34.075 29.165 481 1HB PHE 57 HB2 PHE 57 6.771 -33.808 27.485 482 2HB PHE 57 HB1 PHE 57 5.209 -33.067 27.163 483 HD1 PHE 57 HD1 PHE 57 8.372 -32.716 28.797 484 HD2 PHE 57 HD2 PHE 57 4.341 -31.339 28.819 485 HE1 PHE 57 HE1 PHE 57 9.062 -30.724 30.060 486 HE2 PHE 57 HE2 PHE 57 5.029 -29.345 30.082 487 HZ PHE 57 HZ PHE 57 7.389 -29.036 30.703 488 H TYR 58 HN TYR 58 3.140 -34.972 27.417 489 HA TYR 58 HA TYR 58 4.204 -37.514 26.362 490 1HB TYR 58 HB2 TYR 58 1.320 -36.873 27.052 491 2HB TYR 58 HB1 TYR 58 1.903 -38.388 26.372 492 HD1 TYR 58 HD1 TYR 58 3.378 -39.873 27.763 493 HD2 TYR 58 HD2 TYR 58 1.449 -36.444 29.394 494 HE1 TYR 58 HE1 TYR 58 3.755 -40.743 30.031 495 HE2 TYR 58 HE2 TYR 58 1.823 -37.307 31.663 496 HH TYR 58 HH TYR 58 3.942 -39.841 32.343 497 H SER 59 HN SER 59 4.329 -37.581 24.193 498 HA SER 59 HA SER 59 3.151 -35.368 22.691 499 1HB SER 59 HB2 SER 59 4.651 -36.159 20.847 500 2HB SER 59 HB1 SER 59 5.515 -35.712 22.317 501 HG SER 59 HG SER 59 5.991 -37.773 22.695 502 H PHE 60 HN PHE 60 1.180 -35.701 21.953 503 HA PHE 60 HA PHE 60 0.466 -38.319 20.813 504 1HB PHE 60 HB2 PHE 60 -1.292 -35.984 21.638 505 2HB PHE 60 HB1 PHE 60 -1.882 -37.463 20.891 506 HD1 PHE 60 HD1 PHE 60 -0.931 -35.858 23.965 507 HD2 PHE 60 HD2 PHE 60 -1.601 -39.642 22.124 508 HE1 PHE 60 HE1 PHE 60 -1.167 -36.895 26.183 509 HE2 PHE 60 HE2 PHE 60 -1.833 -40.682 24.341 510 HZ PHE 60 HZ PHE 60 -1.617 -39.308 26.374 511 H ASN 61 HN ASN 61 -0.674 -38.301 18.756 512 HA ASN 61 HA ASN 61 -0.351 -35.870 17.148 513 1HB ASN 61 HB2 ASN 61 1.612 -37.286 16.652 514 2HB ASN 61 HB1 ASN 61 0.543 -38.624 16.239 515 1HD2 ASN 61 HD21 ASN 61 -0.532 -38.610 14.267 516 2HD2 ASN 61 HD22 ASN 61 -0.179 -37.458 13.022 517 H VAL 62 HN VAL 62 -2.066 -35.454 15.927 518 HA VAL 62 HA VAL 62 -4.119 -37.556 15.636 519 HB VAL 62 HB VAL 62 -4.467 -34.548 15.841 520 1HG1 VAL 62 HG11 VAL 62 -6.888 -35.015 15.802 521 2HG1 VAL 62 HG12 VAL 62 -6.547 -36.715 15.480 522 3HG1 VAL 62 HG13 VAL 62 -6.097 -35.485 14.298 523 1HG2 VAL 62 HG21 VAL 62 -3.970 -35.586 17.997 524 2HG2 VAL 62 HG22 VAL 62 -5.271 -36.752 17.752 525 3HG2 VAL 62 HG23 VAL 62 -5.646 -35.038 17.941 526 H SER 63 HN SER 63 -4.201 -38.256 13.579 527 HA SER 63 HA SER 63 -3.798 -36.297 11.420 528 1HB SER 63 HB2 SER 63 -3.574 -38.267 9.931 529 2HB SER 63 HB1 SER 63 -2.400 -38.309 11.246 530 HG SER 63 HG SER 63 -4.844 -39.740 11.107 531 H MET 64 HN MET 64 -5.661 -35.340 10.916 532 HA MET 64 HA MET 64 -8.084 -37.006 10.656 533 1HB MET 64 HB2 MET 64 -9.441 -35.233 11.614 534 2HB MET 64 HB1 MET 64 -8.184 -35.688 12.757 535 1HG MET 64 HG2 MET 64 -6.872 -33.728 12.085 536 2HG MET 64 HG1 MET 64 -8.155 -33.262 10.967 537 1HE MET 64 HE1 MET 64 -10.749 -34.072 12.672 538 2HE MET 64 HE2 MET 64 -10.635 -32.550 11.789 539 3HE MET 64 HE3 MET 64 -11.116 -32.553 13.486 540 H GLU 65 HN GLU 65 -9.710 -36.076 9.222 541 HA GLU 65 HA GLU 65 -8.541 -35.088 6.821 542 1HB GLU 65 HB2 GLU 65 -11.458 -35.348 7.596 543 2HB GLU 65 HB1 GLU 65 -10.866 -35.007 5.974 544 1HG GLU 65 HG2 GLU 65 -9.686 -37.191 6.001 545 2HG GLU 65 HG1 GLU 65 -10.430 -37.528 7.567 546 H VAL 66 HN VAL 66 -8.382 -33.069 6.072 547 HA VAL 66 HA VAL 66 -10.034 -30.964 7.311 548 HB VAL 66 HB VAL 66 -8.217 -29.338 6.661 549 1HG1 VAL 66 HG11 VAL 66 -7.448 -31.473 8.661 550 2HG1 VAL 66 HG12 VAL 66 -8.482 -30.079 8.974 551 3HG1 VAL 66 HG13 VAL 66 -6.777 -29.842 8.588 552 1HG2 VAL 66 HG21 VAL 66 -7.054 -30.710 5.007 553 2HG2 VAL 66 HG22 VAL 66 -6.594 -31.862 6.261 554 3HG2 VAL 66 HG23 VAL 66 -5.947 -30.221 6.291 555 H SER 67 HN SER 67 -11.359 -29.971 5.947 556 HA SER 67 HA SER 67 -11.378 -30.751 3.161 557 1HB SER 67 HB2 SER 67 -13.457 -30.649 4.569 558 2HB SER 67 HB1 SER 67 -13.272 -28.899 4.645 559 HG SER 67 HG SER 67 -13.554 -28.809 2.410 560 H ASN 68 HN ASN 68 -10.400 -28.095 5.101 561 HA ASN 68 HA ASN 68 -9.226 -26.760 2.836 562 1HB ASN 68 HB2 ASN 68 -10.283 -24.566 3.298 563 2HB ASN 68 HB1 ASN 68 -11.456 -25.764 2.761 564 1HD2 ASN 68 HD21 ASN 68 -13.008 -26.470 4.154 565 2HD2 ASN 68 HD22 ASN 68 -13.317 -25.735 5.688 566 H GLU 69 HN GLU 69 -8.295 -24.537 3.782 567 HA GLU 69 HA GLU 69 -6.552 -25.487 5.899 568 1HB GLU 69 HB2 GLU 69 -5.632 -24.439 3.845 569 2HB GLU 69 HB1 GLU 69 -6.376 -22.916 4.318 570 1HG GLU 69 HG2 GLU 69 -4.936 -22.630 6.133 571 2HG GLU 69 HG1 GLU 69 -4.473 -24.330 6.155 572 H SER 70 HN SER 70 -9.267 -23.386 5.625 573 HA SER 70 HA SER 70 -8.799 -21.732 7.869 574 1HB SER 70 HB2 SER 70 -11.511 -22.757 6.979 575 2HB SER 70 HB1 SER 70 -11.154 -21.255 7.831 576 HG SER 70 HG SER 70 -11.291 -21.658 5.221 577 H GLU 71 HN GLU 71 -10.254 -24.933 7.476 578 HA GLU 71 HA GLU 71 -10.805 -25.399 10.218 579 1HB GLU 71 HB2 GLU 71 -10.211 -27.420 8.038 580 2HB GLU 71 HB1 GLU 71 -10.946 -27.774 9.595 581 1HG GLU 71 HG2 GLU 71 -12.861 -26.336 8.985 582 2HG GLU 71 HG1 GLU 71 -12.129 -26.085 7.401 583 H ARG 72 HN ARG 72 -7.983 -25.938 8.174 584 HA ARG 72 HA ARG 72 -6.401 -27.466 9.870 585 1HB ARG 72 HB2 ARG 72 -5.794 -26.937 7.543 586 2HB ARG 72 HB1 ARG 72 -5.527 -25.259 7.984 587 1HG ARG 72 HG2 ARG 72 -3.669 -25.964 9.455 588 2HG ARG 72 HG1 ARG 72 -3.921 -27.633 8.935 589 1HD ARG 72 HD2 ARG 72 -3.462 -26.973 6.615 590 2HD ARG 72 HD1 ARG 72 -3.207 -25.308 7.139 591 HE ARG 72 HE ARG 72 -1.492 -27.142 8.510 592 1HH1 ARG 72 HH11 ARG 72 -1.882 -25.359 5.502 593 2HH1 ARG 72 HH12 ARG 72 -0.190 -25.401 5.123 594 1HH2 ARG 72 HH21 ARG 72 0.738 -27.183 7.994 595 2HH2 ARG 72 HH22 ARG 72 1.295 -26.419 6.537 596 H ASN 73 HN ASN 73 -7.077 -24.027 9.890 597 HA ASN 73 HA ASN 73 -5.235 -23.488 12.065 598 1HB ASN 73 HB2 ASN 73 -7.293 -21.735 10.695 599 2HB ASN 73 HB1 ASN 73 -6.189 -21.178 11.949 600 1HD2 ASN 73 HD21 ASN 73 -6.482 -20.324 9.170 601 2HD2 ASN 73 HD22 ASN 73 -4.928 -20.536 8.443 602 H GLU 74 HN GLU 74 -8.741 -23.735 11.585 603 HA GLU 74 HA GLU 74 -9.571 -22.947 14.133 604 1HB GLU 74 HB2 GLU 74 -11.180 -23.149 12.349 605 2HB GLU 74 HB1 GLU 74 -10.841 -24.865 12.164 606 1HG GLU 74 HG2 GLU 74 -11.877 -25.383 14.244 607 2HG GLU 74 HG1 GLU 74 -11.998 -23.682 14.681 608 H ILE 75 HN ILE 75 -8.917 -26.208 12.905 609 HA ILE 75 HA ILE 75 -9.427 -27.633 15.248 610 HB ILE 75 HB ILE 75 -7.479 -28.282 13.017 611 1HG1 ILE 75 HG12 ILE 75 -10.319 -29.262 13.416 612 2HG1 ILE 75 HG11 ILE 75 -9.908 -27.886 12.399 613 1HG2 ILE 75 HG21 ILE 75 -7.703 -30.620 13.741 614 2HG2 ILE 75 HG22 ILE 75 -8.688 -30.099 15.109 615 3HG2 ILE 75 HG23 ILE 75 -6.995 -29.613 15.004 616 1HD1 ILE 75 HD11 ILE 75 -9.002 -30.729 12.006 617 2HD1 ILE 75 HD12 ILE 75 -8.533 -29.357 11.000 618 3HD1 ILE 75 HD13 ILE 75 -10.221 -29.866 11.067 619 H PHE 76 HN PHE 76 -6.468 -26.102 14.058 620 HA PHE 76 HA PHE 76 -4.685 -26.859 16.067 621 1HB PHE 76 HB2 PHE 76 -3.940 -25.701 14.057 622 2HB PHE 76 HB1 PHE 76 -4.868 -24.271 14.486 623 HD1 PHE 76 HD1 PHE 76 -4.020 -22.666 16.047 624 HD2 PHE 76 HD2 PHE 76 -1.893 -26.283 15.305 625 HE1 PHE 76 HE1 PHE 76 -2.057 -21.747 17.205 626 HE2 PHE 76 HE2 PHE 76 0.070 -25.367 16.465 627 HZ PHE 76 HZ PHE 76 -0.008 -23.097 17.417 628 H GLN 77 HN GLN 77 -7.013 -24.210 15.938 629 HA GLN 77 HA GLN 77 -6.363 -23.072 18.460 630 1HB GLN 77 HB2 GLN 77 -8.915 -22.915 16.838 631 2HB GLN 77 HB1 GLN 77 -8.534 -21.892 18.218 632 1HG GLN 77 HG2 GLN 77 -6.633 -20.950 17.025 633 2HG GLN 77 HG1 GLN 77 -6.954 -22.007 15.652 634 1HE2 GLN 77 HE21 GLN 77 -8.016 -19.206 17.424 635 2HE2 GLN 77 HE22 GLN 77 -9.122 -18.619 16.230 636 H LYS 78 HN LYS 78 -8.662 -25.528 17.395 637 HA LYS 78 HA LYS 78 -10.092 -25.894 19.778 638 1HB LYS 78 HB2 LYS 78 -9.302 -27.976 17.718 639 2HB LYS 78 HB1 LYS 78 -10.548 -28.183 18.939 640 1HG LYS 78 HG2 LYS 78 -10.633 -26.079 16.785 641 2HG LYS 78 HG1 LYS 78 -11.391 -27.665 16.655 642 1HD LYS 78 HD2 LYS 78 -12.746 -27.145 18.663 643 2HD LYS 78 HD1 LYS 78 -12.022 -25.535 18.708 644 1HE LYS 78 HE2 LYS 78 -12.965 -25.019 16.529 645 2HE LYS 78 HE1 LYS 78 -13.614 -26.654 16.396 646 1HZ LYS 78 HZ1 LYS 78 -14.393 -24.665 18.456 647 2HZ LYS 78 HZ2 LYS 78 -15.039 -26.216 18.276 648 3HZ LYS 78 HZ3 LYS 78 -15.292 -25.052 17.079 649 H ILE 79 HN ILE 79 -7.059 -27.254 18.628 650 HA ILE 79 HA ILE 79 -6.548 -29.069 20.708 651 HB ILE 79 HB ILE 79 -4.567 -27.551 18.988 652 1HG1 ILE 79 HG12 ILE 79 -5.720 -30.340 18.662 653 2HG1 ILE 79 HG11 ILE 79 -6.201 -28.932 17.724 654 1HG2 ILE 79 HG21 ILE 79 -2.973 -29.332 19.550 655 2HG2 ILE 79 HG22 ILE 79 -4.155 -30.040 20.651 656 3HG2 ILE 79 HG23 ILE 79 -3.484 -28.444 20.985 657 1HD1 ILE 79 HD11 ILE 79 -3.940 -28.769 16.815 658 2HD1 ILE 79 HD12 ILE 79 -4.683 -30.330 16.469 659 3HD1 ILE 79 HD13 ILE 79 -3.471 -30.193 17.743 660 H SER 80 HN SER 80 -6.159 -25.619 20.517 661 HA SER 80 HA SER 80 -4.415 -25.373 22.787 662 1HB SER 80 HB2 SER 80 -6.169 -23.290 21.464 663 2HB SER 80 HB1 SER 80 -4.820 -22.976 22.556 664 HG SER 80 HG SER 80 -4.402 -24.485 20.217 665 H GLN 81 HN GLN 81 -7.763 -25.893 22.384 666 HA GLN 81 HA GLN 81 -8.610 -24.388 24.709 667 1HB GLN 81 HB2 GLN 81 -10.153 -26.197 22.838 668 2HB GLN 81 HB1 GLN 81 -10.870 -25.225 24.120 669 1HG GLN 81 HG2 GLN 81 -10.053 -23.190 23.026 670 2HG GLN 81 HG1 GLN 81 -9.359 -24.168 21.737 671 1HE2 GLN 81 HE21 GLN 81 -11.592 -26.034 21.654 672 2HE2 GLN 81 HE22 GLN 81 -12.903 -25.184 20.915 673 H LEU 82 HN LEU 82 -7.096 -27.281 24.460 674 HA LEU 82 HA LEU 82 -8.766 -28.888 26.161 675 1HB LEU 82 HB2 LEU 82 -5.833 -29.439 25.901 676 2HB LEU 82 HB1 LEU 82 -7.177 -30.558 25.984 677 HG LEU 82 HG LEU 82 -6.419 -28.890 23.587 678 1HD1 LEU 82 HD11 LEU 82 -6.226 -31.862 24.042 679 2HD1 LEU 82 HD12 LEU 82 -4.877 -30.726 23.985 680 3HD1 LEU 82 HD13 LEU 82 -5.849 -31.012 22.541 681 1HD2 LEU 82 HD21 LEU 82 -8.149 -30.146 22.393 682 2HD2 LEU 82 HD22 LEU 82 -8.820 -29.156 23.687 683 3HD2 LEU 82 HD23 LEU 82 -8.643 -30.898 23.912 684 H ASP 83 HN ASP 83 -6.402 -26.449 26.641 685 HA ASP 83 HA ASP 83 -5.645 -25.364 28.488 686 1HB ASP 83 HB2 ASP 83 -7.892 -25.613 29.441 687 2HB ASP 83 HB1 ASP 83 -7.483 -27.220 30.029 688 H LYS 84 HN LYS 84 -5.616 -28.830 28.488 689 HA LYS 84 HA LYS 84 -3.435 -29.071 30.370 690 1HB LYS 84 HB2 LYS 84 -3.734 -31.501 29.935 691 2HB LYS 84 HB1 LYS 84 -5.208 -30.699 30.460 692 1HG LYS 84 HG2 LYS 84 -5.911 -30.554 28.070 693 2HG LYS 84 HG1 LYS 84 -4.496 -31.515 27.646 694 1HD LYS 84 HD2 LYS 84 -6.208 -33.091 27.775 695 2HD LYS 84 HD1 LYS 84 -5.402 -33.219 29.329 696 1HE LYS 84 HE2 LYS 84 -7.988 -31.781 28.750 697 2HE LYS 84 HE1 LYS 84 -7.785 -33.274 29.653 698 1HZ LYS 84 HZ1 LYS 84 -6.570 -32.041 31.343 699 2HZ LYS 84 HZ2 LYS 84 -8.128 -31.428 31.131 700 3HZ LYS 84 HZ3 LYS 84 -6.805 -30.602 30.486 701 H VAL 85 HN VAL 85 -3.521 -28.095 27.296 702 HA VAL 85 HA VAL 85 -1.357 -29.755 26.258 703 HB VAL 85 HB VAL 85 -3.227 -29.210 24.755 704 1HG1 VAL 85 HG11 VAL 85 -2.323 -26.340 25.029 705 2HG1 VAL 85 HG12 VAL 85 -3.836 -27.021 25.631 706 3HG1 VAL 85 HG13 VAL 85 -3.538 -26.936 23.895 707 1HG2 VAL 85 HG21 VAL 85 -1.022 -29.660 23.804 708 2HG2 VAL 85 HG22 VAL 85 -0.617 -27.947 23.903 709 3HG2 VAL 85 HG23 VAL 85 -1.903 -28.488 22.824 710 H VAL 86 HN VAL 86 0.711 -29.053 25.970 711 HA VAL 86 HA VAL 86 1.364 -26.394 27.070 712 HB VAL 86 HB VAL 86 3.586 -27.301 27.640 713 1HG1 VAL 86 HG11 VAL 86 1.292 -28.908 28.777 714 2HG1 VAL 86 HG12 VAL 86 1.815 -27.316 29.324 715 3HG1 VAL 86 HG13 VAL 86 2.880 -28.708 29.521 716 1HG2 VAL 86 HG21 VAL 86 3.740 -29.045 25.932 717 2HG2 VAL 86 HG22 VAL 86 2.449 -29.951 26.723 718 3HG2 VAL 86 HG23 VAL 86 3.995 -29.722 27.540 719 H GLN 87 HN GLN 87 1.453 -28.313 24.254 720 HA GLN 87 HA GLN 87 2.762 -26.183 22.813 721 1HB GLN 87 HB2 GLN 87 4.679 -27.542 23.603 722 2HB GLN 87 HB1 GLN 87 3.990 -28.956 22.818 723 1HG GLN 87 HG2 GLN 87 5.784 -27.988 21.489 724 2HG GLN 87 HG1 GLN 87 4.242 -27.901 20.643 725 1HE2 GLN 87 HE21 GLN 87 5.169 -25.742 23.252 726 2HE2 GLN 87 HE22 GLN 87 5.304 -24.322 22.279 727 H THR 88 HN THR 88 1.924 -25.989 20.837 728 HA THR 88 HA THR 88 0.275 -28.199 19.772 729 HB THR 88 HB THR 88 -1.195 -26.416 18.801 730 HG1 THR 88 HG1 THR 88 0.428 -24.722 18.946 731 1HG2 THR 88 HG21 THR 88 -0.911 -26.311 21.814 732 2HG2 THR 88 HG22 THR 88 -1.841 -27.502 20.906 733 3HG2 THR 88 HG23 THR 88 -2.329 -25.808 20.896 734 H LEU 89 HN LEU 89 1.018 -28.929 17.854 735 HA LEU 89 HA LEU 89 2.301 -26.994 16.023 736 1HB LEU 89 HB2 LEU 89 2.849 -29.965 16.229 737 2HB LEU 89 HB1 LEU 89 3.537 -28.890 15.028 738 HG LEU 89 HG LEU 89 4.569 -27.614 17.012 739 1HD1 LEU 89 HD11 LEU 89 4.965 -28.959 19.027 740 2HD1 LEU 89 HD12 LEU 89 3.870 -30.196 18.409 741 3HD1 LEU 89 HD13 LEU 89 3.256 -28.589 18.802 742 1HD2 LEU 89 HD21 LEU 89 5.865 -28.973 15.454 743 2HD2 LEU 89 HD22 LEU 89 5.499 -30.420 16.394 744 3HD2 LEU 89 HD23 LEU 89 6.482 -29.135 17.098 745 H GLY 90 HN GLY 90 0.846 -26.477 14.522 746 1HA GLY 90 HA2 GLY 90 -0.815 -28.647 13.362 747 2HA GLY 90 HA1 GLY 90 -1.352 -26.982 13.510 748 H SER 91 HN SER 91 1.794 -26.737 12.761 749 HA SER 91 HA SER 91 1.316 -25.989 10.053 750 1HB SER 91 HB2 SER 91 3.964 -26.323 11.497 751 2HB SER 91 HB1 SER 91 3.667 -25.384 10.036 752 HG SER 91 HG SER 91 2.414 -23.962 11.225 Start of MODEL 19 1 1H GLN 1 HT1 GLN 1 5.653 1.026 -7.245 2 2H GLN 1 HT2 GLN 1 4.774 2.026 -8.284 3 3H GLN 1 HT3 GLN 1 6.461 2.007 -8.359 4 HA GLN 1 HA GLN 1 5.488 0.786 -10.187 5 1HB GLN 1 HB2 GLN 1 6.922 -0.941 -8.148 6 2HB GLN 1 HB1 GLN 1 6.742 -1.337 -9.853 7 1HG GLN 1 HG2 GLN 1 8.233 1.026 -8.715 8 2HG GLN 1 HG1 GLN 1 8.944 -0.429 -9.414 9 1HE2 GLN 1 HE21 GLN 1 8.880 -0.723 -11.643 10 2HE2 GLN 1 HE22 GLN 1 8.534 0.571 -12.735 11 H GLY 2 HN GLY 2 3.628 -0.085 -10.805 12 1HA GLY 2 HA2 GLY 2 1.795 -1.213 -8.876 13 2HA GLY 2 HA1 GLY 2 1.507 -0.989 -10.595 14 H HIS 3 HN HIS 3 3.628 -2.931 -8.493 15 HA HIS 3 HA HIS 3 2.761 -5.349 -9.892 16 1HB HIS 3 HB2 HIS 3 4.801 -4.681 -11.074 17 2HB HIS 3 HB1 HIS 3 5.669 -4.547 -9.549 18 HD1 HIS 3 HD1 HIS 3 4.082 -7.170 -11.782 19 HD2 HIS 3 HD2 HIS 3 6.828 -6.881 -8.669 20 HE1 HIS 3 HE1 HIS 3 5.099 -9.461 -11.558 21 HE2 HIS 3 HE2 HIS 3 6.699 -9.283 -9.623 22 H MET 4 HN MET 4 2.298 -6.895 -8.466 23 HA MET 4 HA MET 4 2.637 -6.629 -5.697 24 1HB MET 4 HB2 MET 4 2.147 -9.116 -7.361 25 2HB MET 4 HB1 MET 4 2.032 -9.060 -5.607 26 1HG MET 4 HG2 MET 4 0.225 -7.436 -5.759 27 2HG MET 4 HG1 MET 4 0.353 -7.440 -7.516 28 1HE MET 4 HE1 MET 4 -2.367 -7.950 -5.875 29 2HE MET 4 HE2 MET 4 -3.059 -9.274 -6.812 30 3HE MET 4 HE3 MET 4 -2.284 -7.923 -7.640 31 HA PRO 5 HA PRO 5 6.991 -7.282 -5.299 32 1HB PRO 5 HB2 PRO 5 6.286 -8.227 -2.559 33 2HB PRO 5 HB1 PRO 5 7.417 -6.964 -3.061 34 1HG PRO 5 HG2 PRO 5 5.063 -6.311 -2.013 35 2HG PRO 5 HG1 PRO 5 5.726 -5.393 -3.380 36 1HD PRO 5 HD2 PRO 5 3.581 -7.491 -3.367 37 2HD PRO 5 HD1 PRO 5 3.661 -5.967 -4.279 38 H SER 6 HN SER 6 4.678 -9.803 -4.767 39 HA SER 6 HA SER 6 4.750 -12.029 -5.176 40 1HB SER 6 HB2 SER 6 7.491 -11.476 -6.357 41 2HB SER 6 HB1 SER 6 6.501 -12.908 -6.641 42 HG SER 6 HG SER 6 5.430 -10.370 -7.183 43 H ASP 7 HN ASP 7 5.622 -11.015 -2.631 44 HA ASP 7 HA ASP 7 7.829 -12.643 -1.741 45 1HB ASP 7 HB2 ASP 7 5.716 -11.176 -0.127 46 2HB ASP 7 HB1 ASP 7 7.152 -11.941 0.542 47 H SER 8 HN SER 8 7.405 -14.791 -2.144 48 HA SER 8 HA SER 8 5.237 -15.991 -0.581 49 1HB SER 8 HB2 SER 8 4.624 -17.449 -2.519 50 2HB SER 8 HB1 SER 8 4.263 -15.745 -2.786 51 HG SER 8 HG SER 8 5.815 -15.618 -4.263 52 H LYS 9 HN LYS 9 6.678 -16.884 0.837 53 HA LYS 9 HA LYS 9 8.426 -19.007 -0.247 54 1HB LYS 9 HB2 LYS 9 8.650 -17.701 2.480 55 2HB LYS 9 HB1 LYS 9 9.784 -18.818 1.741 56 1HG LYS 9 HG2 LYS 9 9.209 -16.009 0.823 57 2HG LYS 9 HG1 LYS 9 10.637 -16.547 1.704 58 1HD LYS 9 HD2 LYS 9 9.839 -17.550 -1.030 59 2HD LYS 9 HD1 LYS 9 10.989 -16.247 -0.753 60 1HE LYS 9 HE2 LYS 9 12.350 -18.115 -1.073 61 2HE LYS 9 HE1 LYS 9 12.273 -17.970 0.681 62 1HZ LYS 9 HZ1 LYS 9 10.713 -19.746 0.784 63 2HZ LYS 9 HZ2 LYS 9 11.981 -20.268 -0.203 64 3HZ LYS 9 HZ3 LYS 9 10.519 -19.779 -0.895 65 H LYS 10 HN LYS 10 8.771 -20.510 2.009 66 HA LYS 10 HA LYS 10 7.878 -22.030 3.438 67 1HB LYS 10 HB2 LYS 10 5.292 -20.476 3.144 68 2HB LYS 10 HB1 LYS 10 5.573 -21.761 4.306 69 1HG LYS 10 HG2 LYS 10 7.417 -19.418 4.337 70 2HG LYS 10 HG1 LYS 10 5.782 -19.204 4.956 71 1HD LYS 10 HD2 LYS 10 7.254 -19.762 6.783 72 2HD LYS 10 HD1 LYS 10 6.149 -21.105 6.502 73 1HE LYS 10 HE2 LYS 10 7.908 -22.310 5.305 74 2HE LYS 10 HE1 LYS 10 9.010 -20.952 5.539 75 1HZ LYS 10 HZ1 LYS 10 8.911 -21.298 7.911 76 2HZ LYS 10 HZ2 LYS 10 9.362 -22.743 7.153 77 3HZ LYS 10 HZ3 LYS 10 7.784 -22.545 7.724 78 HA PRO 11 HA PRO 11 6.500 -25.014 0.465 79 1HB PRO 11 HB2 PRO 11 5.805 -27.036 2.201 80 2HB PRO 11 HB1 PRO 11 7.466 -26.673 1.719 81 1HG PRO 11 HG2 PRO 11 5.996 -25.873 4.203 82 2HG PRO 11 HG1 PRO 11 7.667 -26.446 4.023 83 1HD PRO 11 HD2 PRO 11 7.089 -23.835 4.341 84 2HD PRO 11 HD1 PRO 11 8.435 -24.376 3.317 85 H THR 12 HN THR 12 4.639 -24.887 -0.587 86 HA THR 12 HA THR 12 2.193 -24.114 0.679 87 HB THR 12 HB THR 12 2.645 -25.078 -2.163 88 HG1 THR 12 HG1 THR 12 3.787 -23.078 -1.304 89 1HG2 THR 12 HG21 THR 12 0.564 -23.871 -2.665 90 2HG2 THR 12 HG22 THR 12 0.376 -23.475 -0.958 91 3HG2 THR 12 HG23 THR 12 0.287 -25.154 -1.488 92 H ILE 13 HN ILE 13 0.643 -25.387 1.467 93 HA ILE 13 HA ILE 13 0.838 -28.292 1.075 94 HB ILE 13 HB ILE 13 -0.750 -26.722 3.124 95 1HG1 ILE 13 HG12 ILE 13 1.704 -26.503 3.416 96 2HG1 ILE 13 HG11 ILE 13 0.966 -27.410 4.734 97 1HG2 ILE 13 HG21 ILE 13 -0.218 -29.692 2.897 98 2HG2 ILE 13 HG22 ILE 13 -1.768 -28.884 2.652 99 3HG2 ILE 13 HG23 ILE 13 -1.025 -28.901 4.251 100 1HD1 ILE 13 HD11 ILE 13 2.480 -28.568 2.404 101 2HD1 ILE 13 HD12 ILE 13 1.727 -29.496 3.703 102 3HD1 ILE 13 HD13 ILE 13 3.061 -28.402 4.060 103 H ILE 14 HN ILE 14 -0.760 -29.417 0.071 104 HA ILE 14 HA ILE 14 -2.710 -27.865 -1.403 105 HB ILE 14 HB ILE 14 -2.222 -30.851 -1.471 106 1HG1 ILE 14 HG12 ILE 14 -0.186 -29.652 -2.107 107 2HG1 ILE 14 HG11 ILE 14 -0.913 -30.393 -3.527 108 1HG2 ILE 14 HG21 ILE 14 -3.670 -29.040 -3.412 109 2HG2 ILE 14 HG22 ILE 14 -4.416 -30.222 -2.335 110 3HG2 ILE 14 HG23 ILE 14 -3.366 -30.761 -3.645 111 1HD1 ILE 14 HD11 ILE 14 -1.838 -28.236 -4.182 112 2HD1 ILE 14 HD12 ILE 14 -0.084 -28.167 -4.011 113 3HD1 ILE 14 HD13 ILE 14 -1.119 -27.491 -2.753 114 H TYR 15 HN TYR 15 -4.209 -27.206 0.106 115 HA TYR 15 HA TYR 15 -5.616 -29.066 1.787 116 1HB TYR 15 HB2 TYR 15 -6.178 -26.186 1.020 117 2HB TYR 15 HB1 TYR 15 -7.177 -27.103 2.141 118 HD1 TYR 15 HD1 TYR 15 -6.576 -27.282 4.423 119 HD2 TYR 15 HD2 TYR 15 -3.734 -25.771 1.629 120 HE1 TYR 15 HE1 TYR 15 -5.109 -26.614 6.277 121 HE2 TYR 15 HE2 TYR 15 -2.262 -25.104 3.482 122 HH TYR 15 HH TYR 15 -2.730 -26.164 6.674 123 HA PRO 16 HA PRO 16 -7.503 -29.633 2.564 124 1HB PRO 16 HB2 PRO 16 -9.080 -31.989 2.055 125 2HB PRO 16 HB1 PRO 16 -9.590 -30.474 2.801 126 1HG PRO 16 HG2 PRO 16 -10.471 -31.373 0.349 127 2HG PRO 16 HG1 PRO 16 -10.476 -29.675 0.856 128 1HD PRO 16 HD2 PRO 16 -8.510 -31.130 -0.878 129 2HD PRO 16 HD1 PRO 16 -9.173 -29.489 -1.055 130 H CYS 17 HN CYS 17 -6.313 -31.048 3.783 131 HA CYS 17 HA CYS 17 -5.296 -33.528 2.678 132 1HB CYS 17 HB2 CYS 17 -3.696 -31.920 1.746 133 2HB CYS 17 HB1 CYS 17 -3.427 -31.229 3.342 134 HG CYS 17 HG CYS 17 -1.890 -33.166 4.330 135 H LEU 18 HN LEU 18 -3.829 -34.605 4.298 136 HA LEU 18 HA LEU 18 -5.004 -34.449 6.926 137 1HB LEU 18 HB2 LEU 18 -2.744 -36.147 5.841 138 2HB LEU 18 HB1 LEU 18 -3.472 -36.341 7.427 139 HG LEU 18 HG LEU 18 -4.997 -36.651 4.832 140 1HD1 LEU 18 HD11 LEU 18 -3.794 -38.784 6.600 141 2HD1 LEU 18 HD12 LEU 18 -3.273 -38.356 4.969 142 3HD1 LEU 18 HD13 LEU 18 -4.866 -39.063 5.225 143 1HD2 LEU 18 HD21 LEU 18 -6.679 -37.728 6.251 144 2HD2 LEU 18 HD22 LEU 18 -6.388 -36.061 6.750 145 3HD2 LEU 18 HD23 LEU 18 -5.697 -37.393 7.678 146 H TRP 19 HN TRP 19 -4.037 -33.725 8.781 147 HA TRP 19 HA TRP 19 -1.342 -32.551 8.565 148 1HB TRP 19 HB2 TRP 19 -3.409 -30.917 8.545 149 2HB TRP 19 HB1 TRP 19 -3.470 -31.266 10.268 150 HD1 TRP 19 HD1 TRP 19 -1.221 -30.513 11.716 151 HE1 TRP 19 HE1 TRP 19 0.417 -28.562 11.306 152 HE3 TRP 19 HE3 TRP 19 -2.339 -29.534 6.823 153 HZ2 TRP 19 HZ2 TRP 19 1.122 -26.834 9.184 154 HZ3 TRP 19 HZ3 TRP 19 -1.143 -27.714 5.680 155 HH2 TRP 19 HH2 TRP 19 0.553 -26.392 6.836 156 H ASP 20 HN ASP 20 -0.031 -32.894 10.322 157 HA ASP 20 HA ASP 20 -1.056 -34.735 12.363 158 1HB ASP 20 HB2 ASP 20 1.760 -34.041 11.488 159 2HB ASP 20 HB1 ASP 20 1.419 -35.018 12.912 160 H TYR 21 HN TYR 21 -1.345 -34.122 14.395 161 HA TYR 21 HA TYR 21 -0.258 -31.534 15.304 162 1HB TYR 21 HB2 TYR 21 -2.836 -32.919 16.116 163 2HB TYR 21 HB1 TYR 21 -2.219 -31.440 16.844 164 HD1 TYR 21 HD1 TYR 21 -2.623 -29.328 15.838 165 HD2 TYR 21 HD2 TYR 21 -3.528 -32.890 13.685 166 HE1 TYR 21 HE1 TYR 21 -3.806 -27.997 14.145 167 HE2 TYR 21 HE2 TYR 21 -4.710 -31.566 11.984 168 HH TYR 21 HH TYR 21 -4.424 -28.225 11.744 169 H ARG 22 HN ARG 22 1.352 -31.852 16.712 170 HA ARG 22 HA ARG 22 1.624 -34.322 18.188 171 1HB ARG 22 HB2 ARG 22 3.613 -33.190 17.326 172 2HB ARG 22 HB1 ARG 22 3.228 -31.751 18.256 173 1HG ARG 22 HG2 ARG 22 5.012 -32.969 19.326 174 2HG ARG 22 HG1 ARG 22 3.570 -33.018 20.339 175 1HD ARG 22 HD2 ARG 22 4.687 -35.190 20.275 176 2HD ARG 22 HD1 ARG 22 3.083 -35.279 19.549 177 HE ARG 22 HE ARG 22 4.260 -35.151 17.351 178 1HH1 ARG 22 HH11 ARG 22 6.062 -36.222 20.163 179 2HH1 ARG 22 HH12 ARG 22 7.093 -37.283 19.253 180 1HH2 ARG 22 HH21 ARG 22 5.594 -36.567 16.164 181 2HH2 ARG 22 HH22 ARG 22 6.822 -37.481 16.980 182 H VAL 23 HN VAL 23 0.360 -34.662 19.907 183 HA VAL 23 HA VAL 23 -0.371 -32.373 21.626 184 HB VAL 23 HB VAL 23 -1.847 -35.001 21.293 185 1HG1 VAL 23 HG11 VAL 23 -2.173 -34.039 23.500 186 2HG1 VAL 23 HG12 VAL 23 -3.647 -33.870 22.549 187 3HG1 VAL 23 HG13 VAL 23 -2.590 -32.480 22.788 188 1HG2 VAL 23 HG21 VAL 23 -2.518 -32.265 20.186 189 2HG2 VAL 23 HG22 VAL 23 -3.540 -33.698 20.076 190 3HG2 VAL 23 HG23 VAL 23 -1.982 -33.662 19.251 191 H ILE 24 HN ILE 24 0.811 -32.341 23.425 192 HA ILE 24 HA ILE 24 1.744 -34.877 24.589 193 HB ILE 24 HB ILE 24 2.711 -32.065 25.182 194 1HG1 ILE 24 HG12 ILE 24 3.961 -34.189 23.411 195 2HG1 ILE 24 HG11 ILE 24 3.148 -32.739 22.830 196 1HG2 ILE 24 HG21 ILE 24 3.104 -33.642 27.005 197 2HG2 ILE 24 HG22 ILE 24 4.623 -33.199 26.228 198 3HG2 ILE 24 HG23 ILE 24 3.882 -34.762 25.886 199 1HD1 ILE 24 HD11 ILE 24 4.846 -31.362 23.936 200 2HD1 ILE 24 HD12 ILE 24 5.544 -32.469 22.754 201 3HD1 ILE 24 HD13 ILE 24 5.667 -32.828 24.476 202 H MET 25 HN MET 25 0.447 -35.628 26.133 203 HA MET 25 HA MET 25 -0.870 -33.722 27.977 204 1HB MET 25 HB2 MET 25 -1.927 -36.384 26.981 205 2HB MET 25 HB1 MET 25 -2.729 -35.343 28.147 206 1HG MET 25 HG2 MET 25 -3.057 -33.637 26.486 207 2HG MET 25 HG1 MET 25 -2.097 -34.536 25.314 208 1HE MET 25 HE1 MET 25 -5.407 -34.452 27.404 209 2HE MET 25 HE2 MET 25 -4.774 -36.044 27.827 210 3HE MET 25 HE3 MET 25 -6.233 -35.907 26.846 211 H THR 26 HN THR 26 -1.276 -34.563 30.149 212 HA THR 26 HA THR 26 0.867 -36.358 31.029 213 HB THR 26 HB THR 26 0.113 -35.549 33.346 214 HG1 THR 26 HG1 THR 26 -1.844 -34.632 33.009 215 1HG2 THR 26 HG21 THR 26 1.323 -33.421 33.128 216 2HG2 THR 26 HG22 THR 26 1.182 -33.516 31.373 217 3HG2 THR 26 HG23 THR 26 2.140 -34.713 32.247 218 H THR 27 HN THR 27 -1.903 -37.086 29.835 219 HA THR 27 HA THR 27 -2.423 -39.203 31.784 220 HB THR 27 HB THR 27 -4.160 -37.482 32.145 221 HG1 THR 27 HG1 THR 27 -5.899 -38.904 32.015 222 1HG2 THR 27 HG21 THR 27 -4.213 -36.509 29.892 223 2HG2 THR 27 HG22 THR 27 -5.823 -36.996 30.424 224 3HG2 THR 27 HG23 THR 27 -4.938 -37.992 29.268 225 H LYS 28 HN LYS 28 -2.615 -41.160 30.869 226 HA LYS 28 HA LYS 28 -2.037 -41.470 28.090 227 1HB LYS 28 HB2 LYS 28 -2.876 -43.531 30.142 228 2HB LYS 28 HB1 LYS 28 -2.236 -43.890 28.544 229 1HG LYS 28 HG2 LYS 28 -0.116 -42.856 29.140 230 2HG LYS 28 HG1 LYS 28 -0.751 -42.437 30.731 231 1HD LYS 28 HD2 LYS 28 -0.539 -45.269 29.698 232 2HD LYS 28 HD1 LYS 28 0.710 -44.484 30.663 233 1HE LYS 28 HE2 LYS 28 -0.595 -45.793 32.159 234 2HE LYS 28 HE1 LYS 28 -1.034 -44.111 32.442 235 1HZ LYS 28 HZ1 LYS 28 -2.953 -45.617 32.376 236 2HZ LYS 28 HZ2 LYS 28 -2.600 -46.009 30.772 237 3HZ LYS 28 HZ3 LYS 28 -3.043 -44.429 31.181 238 H ASP 29 HN ASP 29 -4.919 -41.150 29.899 239 HA ASP 29 HA ASP 29 -6.517 -42.423 27.788 240 1HB ASP 29 HB2 ASP 29 -7.018 -43.128 30.105 241 2HB ASP 29 HB1 ASP 29 -7.415 -41.461 30.519 242 H THR 30 HN THR 30 -6.129 -40.750 26.302 243 HA THR 30 HA THR 30 -7.334 -38.159 26.856 244 HB THR 30 HB THR 30 -5.219 -38.251 25.579 245 HG1 THR 30 HG1 THR 30 -5.852 -36.588 24.421 246 1HG2 THR 30 HG21 THR 30 -5.566 -40.368 24.380 247 2HG2 THR 30 HG22 THR 30 -5.180 -39.056 23.268 248 3HG2 THR 30 HG23 THR 30 -6.844 -39.619 23.422 249 H SER 31 HN SER 31 -9.400 -37.690 26.355 250 HA SER 31 HA SER 31 -10.794 -39.389 24.394 251 1HB SER 31 HB2 SER 31 -11.268 -40.084 26.800 252 2HB SER 31 HB1 SER 31 -12.060 -38.523 27.007 253 HG SER 31 HG SER 31 -12.835 -40.741 25.486 254 H THR 32 HN THR 32 -11.153 -36.479 26.429 255 HA THR 32 HA THR 32 -13.036 -35.098 24.968 256 HB THR 32 HB THR 32 -10.648 -33.782 26.289 257 HG1 THR 32 HG1 THR 32 -13.052 -34.459 27.635 258 1HG2 THR 32 HG21 THR 32 -12.258 -32.004 26.815 259 2HG2 THR 32 HG22 THR 32 -13.534 -32.903 25.995 260 3HG2 THR 32 HG23 THR 32 -12.169 -32.272 25.074 261 H LEU 33 HN LEU 33 -9.599 -35.446 24.415 262 HA LEU 33 HA LEU 33 -9.188 -33.569 22.385 263 1HB LEU 33 HB2 LEU 33 -7.370 -34.747 23.511 264 2HB LEU 33 HB1 LEU 33 -7.910 -36.271 22.838 265 HG LEU 33 HG LEU 33 -7.342 -35.451 20.568 266 1HD1 LEU 33 HD11 LEU 33 -6.214 -33.061 22.029 267 2HD1 LEU 33 HD12 LEU 33 -7.602 -33.057 20.939 268 3HD1 LEU 33 HD13 LEU 33 -5.993 -33.424 20.318 269 1HD2 LEU 33 HD21 LEU 33 -5.738 -36.797 21.790 270 2HD2 LEU 33 HD22 LEU 33 -5.102 -35.362 22.597 271 3HD2 LEU 33 HD23 LEU 33 -4.895 -35.563 20.855 272 H LYS 34 HN LYS 34 -10.258 -36.947 22.238 273 HA LYS 34 HA LYS 34 -10.441 -36.967 19.376 274 1HB LYS 34 HB2 LYS 34 -11.502 -38.891 21.461 275 2HB LYS 34 HB1 LYS 34 -11.586 -39.167 19.724 276 1HG LYS 34 HG2 LYS 34 -9.119 -39.079 19.619 277 2HG LYS 34 HG1 LYS 34 -9.073 -38.884 21.372 278 1HD LYS 34 HD2 LYS 34 -10.267 -41.256 19.918 279 2HD LYS 34 HD1 LYS 34 -8.660 -41.216 20.643 280 1HE LYS 34 HE2 LYS 34 -9.676 -40.814 22.846 281 2HE LYS 34 HE1 LYS 34 -11.278 -40.881 22.115 282 1HZ LYS 34 HZ1 LYS 34 -10.758 -42.986 23.105 283 2HZ LYS 34 HZ2 LYS 34 -9.301 -43.093 22.257 284 3HZ LYS 34 HZ3 LYS 34 -10.771 -43.180 21.427 285 H GLU 35 HN GLU 35 -12.593 -36.292 22.043 286 HA GLU 35 HA GLU 35 -15.055 -36.475 20.704 287 1HB GLU 35 HB2 GLU 35 -14.228 -34.751 23.050 288 2HB GLU 35 HB1 GLU 35 -15.891 -34.941 22.505 289 1HG GLU 35 HG2 GLU 35 -15.783 -37.335 22.971 290 2HG GLU 35 HG1 GLU 35 -14.105 -37.165 23.487 291 H LEU 36 HN LEU 36 -12.891 -33.678 21.180 292 HA LEU 36 HA LEU 36 -14.546 -31.848 19.787 293 1HB LEU 36 HB2 LEU 36 -12.606 -30.357 19.767 294 2HB LEU 36 HB1 LEU 36 -12.871 -31.063 21.346 295 HG LEU 36 HG LEU 36 -11.044 -32.796 20.520 296 1HD1 LEU 36 HD11 LEU 36 -10.387 -30.346 18.887 297 2HD1 LEU 36 HD12 LEU 36 -10.820 -31.939 18.265 298 3HD1 LEU 36 HD13 LEU 36 -9.314 -31.721 19.154 299 1HD2 LEU 36 HD21 LEU 36 -9.324 -31.419 21.589 300 2HD2 LEU 36 HD22 LEU 36 -10.839 -31.387 22.490 301 3HD2 LEU 36 HD23 LEU 36 -10.385 -30.012 21.484 302 H LEU 37 HN LEU 37 -12.092 -34.113 18.761 303 HA LEU 37 HA LEU 37 -11.890 -33.193 16.071 304 1HB LEU 37 HB2 LEU 37 -11.379 -35.948 17.221 305 2HB LEU 37 HB1 LEU 37 -10.878 -35.402 15.631 306 HG LEU 37 HG LEU 37 -9.904 -34.190 18.224 307 1HD1 LEU 37 HD11 LEU 37 -8.530 -36.171 16.408 308 2HD1 LEU 37 HD12 LEU 37 -9.151 -36.504 18.024 309 3HD1 LEU 37 HD13 LEU 37 -7.812 -35.378 17.811 310 1HD2 LEU 37 HD21 LEU 37 -8.962 -33.846 15.376 311 2HD2 LEU 37 HD22 LEU 37 -8.205 -33.143 16.806 312 3HD2 LEU 37 HD23 LEU 37 -9.831 -32.649 16.338 313 H GLU 38 HN GLU 38 -13.939 -35.464 17.782 314 HA GLU 38 HA GLU 38 -15.213 -36.630 15.554 315 1HB GLU 38 HB2 GLU 38 -16.010 -36.360 18.454 316 2HB GLU 38 HB1 GLU 38 -17.020 -37.193 17.282 317 1HG GLU 38 HG2 GLU 38 -14.150 -37.960 17.738 318 2HG GLU 38 HG1 GLU 38 -15.461 -38.607 18.719 319 H THR 39 HN THR 39 -15.778 -33.637 17.293 320 HA THR 39 HA THR 39 -18.447 -33.251 16.387 321 HB THR 39 HB THR 39 -18.095 -30.850 17.065 322 HG1 THR 39 HG1 THR 39 -15.852 -30.698 16.707 323 1HG2 THR 39 HG21 THR 39 -18.944 -32.522 18.652 324 2HG2 THR 39 HG22 THR 39 -17.921 -31.334 19.460 325 3HG2 THR 39 HG23 THR 39 -17.290 -32.939 19.097 326 H TYR 40 HN TYR 40 -15.392 -32.834 14.850 327 HA TYR 40 HA TYR 40 -16.340 -31.053 12.788 328 1HB TYR 40 HB2 TYR 40 -13.890 -32.843 12.896 329 2HB TYR 40 HB1 TYR 40 -14.224 -31.690 11.609 330 HD1 TYR 40 HD1 TYR 40 -14.400 -29.214 12.239 331 HD2 TYR 40 HD2 TYR 40 -12.777 -32.158 14.847 332 HE1 TYR 40 HE1 TYR 40 -13.272 -27.445 13.527 333 HE2 TYR 40 HE2 TYR 40 -11.647 -30.399 16.146 334 HH TYR 40 HH TYR 40 -12.317 -27.031 15.610 335 H GLN 41 HN GLN 41 -16.687 -34.313 13.526 336 HA GLN 41 HA GLN 41 -17.673 -36.085 12.541 337 1HB GLN 41 HB2 GLN 41 -18.812 -34.054 10.608 338 2HB GLN 41 HB1 GLN 41 -19.444 -35.662 10.930 339 1HG GLN 41 HG2 GLN 41 -19.400 -33.303 12.804 340 2HG GLN 41 HG1 GLN 41 -20.810 -34.066 12.070 341 1HE2 GLN 41 HE21 GLN 41 -20.162 -33.600 14.879 342 2HE2 GLN 41 HE22 GLN 41 -20.197 -35.149 15.646 343 H ARG 42 HN ARG 42 -15.043 -35.097 11.566 344 HA ARG 42 HA ARG 42 -15.018 -36.449 8.944 345 1HB ARG 42 HB2 ARG 42 -12.968 -35.228 8.440 346 2HB ARG 42 HB1 ARG 42 -14.245 -34.095 8.864 347 1HG ARG 42 HG2 ARG 42 -13.301 -33.775 11.060 348 2HG ARG 42 HG1 ARG 42 -12.091 -35.024 10.761 349 1HD ARG 42 HD2 ARG 42 -11.069 -32.868 10.478 350 2HD ARG 42 HD1 ARG 42 -11.190 -33.651 8.905 351 HE ARG 42 HE ARG 42 -12.922 -31.447 9.848 352 1HH1 ARG 42 HH11 ARG 42 -11.533 -33.321 7.234 353 2HH1 ARG 42 HH12 ARG 42 -12.005 -32.198 6.004 354 1HH2 ARG 42 HH21 ARG 42 -13.502 -29.946 8.242 355 2HH2 ARG 42 HH22 ARG 42 -13.133 -30.279 6.577 356 HA PRO 43 HA PRO 43 -12.623 -39.686 10.793 357 1HB PRO 43 HB2 PRO 43 -10.996 -40.429 8.728 358 2HB PRO 43 HB1 PRO 43 -12.714 -40.836 8.804 359 1HG PRO 43 HG2 PRO 43 -11.358 -38.618 7.310 360 2HG PRO 43 HG1 PRO 43 -12.653 -39.704 6.768 361 1HD PRO 43 HD2 PRO 43 -13.148 -37.176 7.597 362 2HD PRO 43 HD1 PRO 43 -14.296 -38.503 7.875 363 H PHE 44 HN PHE 44 -10.681 -40.062 11.820 364 HA PHE 44 HA PHE 44 -8.319 -38.538 11.158 365 1HB PHE 44 HB2 PHE 44 -8.082 -37.467 13.348 366 2HB PHE 44 HB1 PHE 44 -9.550 -36.919 12.548 367 HD1 PHE 44 HD1 PHE 44 -8.172 -38.773 15.374 368 HD2 PHE 44 HD2 PHE 44 -11.752 -37.601 13.380 369 HE1 PHE 44 HE1 PHE 44 -9.478 -39.383 17.363 370 HE2 PHE 44 HE2 PHE 44 -13.058 -38.210 15.372 371 HZ PHE 44 HZ PHE 44 -11.926 -39.101 17.366 372 H LYS 45 HN LYS 45 -6.457 -39.317 12.157 373 HA LYS 45 HA LYS 45 -6.707 -41.987 13.349 374 1HB LYS 45 HB2 LYS 45 -5.386 -41.932 11.308 375 2HB LYS 45 HB1 LYS 45 -4.399 -40.620 11.939 376 1HG LYS 45 HG2 LYS 45 -3.614 -42.174 13.737 377 2HG LYS 45 HG1 LYS 45 -4.484 -43.472 12.919 378 1HD LYS 45 HD2 LYS 45 -2.088 -43.450 12.343 379 2HD LYS 45 HD1 LYS 45 -3.111 -43.178 10.931 380 1HE LYS 45 HE2 LYS 45 -2.634 -40.833 10.943 381 2HE LYS 45 HE1 LYS 45 -1.833 -40.946 12.510 382 1HZ LYS 45 HZ1 LYS 45 -0.866 -42.258 10.033 383 2HZ LYS 45 HZ2 LYS 45 -0.073 -42.207 11.529 384 3HZ LYS 45 HZ3 LYS 45 -0.284 -40.787 10.633 385 H LEU 46 HN LEU 46 -6.424 -42.097 15.480 386 HA LEU 46 HA LEU 46 -4.790 -40.060 16.836 387 1HB LEU 46 HB2 LEU 46 -7.213 -40.674 17.546 388 2HB LEU 46 HB1 LEU 46 -6.510 -42.141 18.189 389 HG LEU 46 HG LEU 46 -6.877 -40.422 19.921 390 1HD1 LEU 46 HD11 LEU 46 -4.690 -40.500 20.981 391 2HD1 LEU 46 HD12 LEU 46 -3.948 -40.983 19.456 392 3HD1 LEU 46 HD13 LEU 46 -5.094 -42.055 20.257 393 1HD2 LEU 46 HD21 LEU 46 -4.846 -38.797 18.387 394 2HD2 LEU 46 HD22 LEU 46 -5.512 -38.395 19.971 395 3HD2 LEU 46 HD23 LEU 46 -6.564 -38.434 18.557 396 H GLU 47 HN GLU 47 -2.709 -40.646 16.969 397 HA GLU 47 HA GLU 47 -2.089 -43.456 17.626 398 1HB GLU 47 HB2 GLU 47 0.050 -43.131 16.333 399 2HB GLU 47 HB1 GLU 47 -1.412 -43.159 15.358 400 1HG GLU 47 HG2 GLU 47 -1.365 -40.749 15.138 401 2HG GLU 47 HG1 GLU 47 0.017 -40.649 16.227 402 H PHE 48 HN PHE 48 -0.968 -43.750 19.413 403 HA PHE 48 HA PHE 48 0.141 -41.510 20.878 404 1HB PHE 48 HB2 PHE 48 -1.047 -43.243 22.119 405 2HB PHE 48 HB1 PHE 48 0.028 -44.482 21.484 406 HD1 PHE 48 HD1 PHE 48 1.506 -45.304 23.041 407 HD2 PHE 48 HD2 PHE 48 0.446 -41.183 23.213 408 HE1 PHE 48 HE1 PHE 48 2.978 -45.008 24.991 409 HE2 PHE 48 HE2 PHE 48 1.914 -40.884 25.158 410 HZ PHE 48 HZ PHE 48 3.181 -42.794 26.052 411 H LYS 49 HN LYS 49 2.081 -40.762 20.317 412 HA LYS 49 HA LYS 49 3.897 -42.165 18.667 413 1HB LYS 49 HB2 LYS 49 4.408 -39.735 20.406 414 2HB LYS 49 HB1 LYS 49 5.434 -40.284 19.090 415 1HG LYS 49 HG2 LYS 49 2.567 -39.585 18.566 416 2HG LYS 49 HG1 LYS 49 3.774 -38.313 18.724 417 1HD LYS 49 HD2 LYS 49 3.531 -38.805 16.396 418 2HD LYS 49 HD1 LYS 49 5.093 -39.433 16.913 419 1HE LYS 49 HE2 LYS 49 4.219 -41.682 16.970 420 2HE LYS 49 HE1 LYS 49 2.590 -41.100 16.629 421 1HZ LYS 49 HZ1 LYS 49 3.252 -40.449 14.455 422 2HZ LYS 49 HZ2 LYS 49 3.792 -42.035 14.683 423 3HZ LYS 49 HZ3 LYS 49 4.886 -40.748 14.780 424 H ASN 50 HN ASN 50 4.450 -41.002 21.987 425 HA ASN 50 HA ASN 50 5.234 -43.436 23.099 426 1HB ASN 50 HB2 ASN 50 7.120 -43.227 21.444 427 2HB ASN 50 HB1 ASN 50 7.617 -41.748 22.260 428 1HD2 ASN 50 HD21 ASN 50 7.298 -45.227 22.569 429 2HD2 ASN 50 HD22 ASN 50 8.399 -45.393 23.897 430 H THR 51 HN THR 51 6.347 -43.102 25.228 431 HA THR 51 HA THR 51 5.423 -40.585 26.427 432 HB THR 51 HB THR 51 4.533 -42.620 27.452 433 HG1 THR 51 HG1 THR 51 5.306 -42.209 29.623 434 1HG2 THR 51 HG21 THR 51 5.992 -44.220 28.601 435 2HG2 THR 51 HG22 THR 51 7.411 -43.352 28.016 436 3HG2 THR 51 HG23 THR 51 6.344 -44.169 26.873 437 H SER 52 HN SER 52 6.815 -39.301 27.676 438 HA SER 52 HA SER 52 9.468 -39.033 26.969 439 1HB SER 52 HB2 SER 52 8.280 -38.333 29.672 440 2HB SER 52 HB1 SER 52 9.706 -37.604 28.929 441 HG SER 52 HG SER 52 8.404 -36.681 27.372 442 H LYS 53 HN LYS 53 11.456 -39.547 28.137 443 HA LYS 53 HA LYS 53 11.554 -42.275 28.855 444 1HB LYS 53 HB2 LYS 53 13.443 -40.872 27.872 445 2HB LYS 53 HB1 LYS 53 13.702 -40.239 29.491 446 1HG LYS 53 HG2 LYS 53 15.242 -42.078 28.941 447 2HG LYS 53 HG1 LYS 53 14.207 -42.461 30.321 448 1HD LYS 53 HD2 LYS 53 12.734 -43.768 28.867 449 2HD LYS 53 HD1 LYS 53 13.736 -43.368 27.473 450 1HE LYS 53 HE2 LYS 53 15.601 -44.588 28.416 451 2HE LYS 53 HE1 LYS 53 14.694 -44.892 29.899 452 1HZ LYS 53 HZ1 LYS 53 14.686 -46.807 28.408 453 2HZ LYS 53 HZ2 LYS 53 13.935 -45.886 27.201 454 3HZ LYS 53 HZ3 LYS 53 13.124 -46.208 28.649 455 H ASN 54 HN ASN 54 11.276 -39.342 30.724 456 HA ASN 54 HA ASN 54 11.570 -40.695 33.275 457 1HB ASN 54 HB2 ASN 54 12.317 -38.350 32.966 458 2HB ASN 54 HB1 ASN 54 10.655 -37.869 32.651 459 1HD2 ASN 54 HD21 ASN 54 10.750 -36.408 34.377 460 2HD2 ASN 54 HD22 ASN 54 10.648 -36.935 36.022 461 H ALA 55 HN ALA 55 9.218 -40.707 31.029 462 HA ALA 55 HA ALA 55 7.037 -41.309 30.958 463 1HB ALA 55 HB1 ALA 55 6.159 -42.658 32.792 464 2HB ALA 55 HB2 ALA 55 7.492 -42.144 33.827 465 3HB ALA 55 HB3 ALA 55 7.812 -43.132 32.401 466 H LYS 56 HN LYS 56 7.827 -38.590 31.942 467 HA LYS 56 HA LYS 56 5.748 -37.829 33.797 468 1HB LYS 56 HB2 LYS 56 7.919 -36.720 33.903 469 2HB LYS 56 HB1 LYS 56 7.740 -36.155 32.247 470 1HG LYS 56 HG2 LYS 56 5.845 -34.772 32.900 471 2HG LYS 56 HG1 LYS 56 5.965 -35.365 34.557 472 1HD LYS 56 HD2 LYS 56 8.144 -33.849 33.111 473 2HD LYS 56 HD1 LYS 56 6.984 -33.119 34.221 474 1HE LYS 56 HE2 LYS 56 8.961 -35.295 34.924 475 2HE LYS 56 HE1 LYS 56 9.135 -33.584 35.312 476 1HZ LYS 56 HZ1 LYS 56 7.076 -33.750 36.620 477 2HZ LYS 56 HZ2 LYS 56 8.295 -34.761 37.209 478 3HZ LYS 56 HZ3 LYS 56 7.019 -35.411 36.314 479 H PHE 57 HN PHE 57 6.426 -37.366 30.344 480 HA PHE 57 HA PHE 57 3.689 -36.316 30.007 481 1HB PHE 57 HB2 PHE 57 6.133 -35.688 28.328 482 2HB PHE 57 HB1 PHE 57 4.513 -35.053 28.068 483 HD1 PHE 57 HD1 PHE 57 7.582 -34.102 29.136 484 HD2 PHE 57 HD2 PHE 57 3.548 -34.076 30.504 485 HE1 PHE 57 HE1 PHE 57 8.094 -32.193 30.597 486 HE2 PHE 57 HE2 PHE 57 4.058 -32.163 31.966 487 HZ PHE 57 HZ PHE 57 6.332 -31.220 32.014 488 H TYR 58 HN TYR 58 2.424 -37.206 28.456 489 HA TYR 58 HA TYR 58 3.517 -39.511 26.980 490 1HB TYR 58 HB2 TYR 58 0.613 -38.893 27.606 491 2HB TYR 58 HB1 TYR 58 1.254 -40.387 26.925 492 HD1 TYR 58 HD1 TYR 58 2.763 -41.831 28.377 493 HD2 TYR 58 HD2 TYR 58 0.515 -38.573 29.952 494 HE1 TYR 58 HE1 TYR 58 3.041 -42.738 30.646 495 HE2 TYR 58 HE2 TYR 58 0.788 -39.477 32.220 496 HH TYR 58 HH TYR 58 3.006 -41.915 32.978 497 H SER 59 HN SER 59 3.850 -39.193 24.872 498 HA SER 59 HA SER 59 2.741 -36.791 23.631 499 1HB SER 59 HB2 SER 59 4.890 -38.683 22.629 500 2HB SER 59 HB1 SER 59 4.461 -37.124 21.921 501 HG SER 59 HG SER 59 5.056 -37.050 24.618 502 H PHE 60 HN PHE 60 0.861 -37.032 22.657 503 HA PHE 60 HA PHE 60 0.294 -39.425 21.041 504 1HB PHE 60 HB2 PHE 60 -1.600 -37.190 21.845 505 2HB PHE 60 HB1 PHE 60 -2.037 -38.706 21.066 506 HD1 PHE 60 HD1 PHE 60 -1.297 -37.040 24.200 507 HD2 PHE 60 HD2 PHE 60 -1.935 -40.829 22.355 508 HE1 PHE 60 HE1 PHE 60 -1.693 -38.047 26.404 509 HE2 PHE 60 HE2 PHE 60 -2.326 -41.839 24.565 510 HZ PHE 60 HZ PHE 60 -2.203 -40.446 26.591 511 H ASN 61 HN ASN 61 -0.845 -38.952 18.941 512 HA ASN 61 HA ASN 61 -0.215 -36.336 17.791 513 1HB ASN 61 HB2 ASN 61 1.684 -37.784 17.194 514 2HB ASN 61 HB1 ASN 61 0.575 -38.964 16.500 515 1HD2 ASN 61 HD21 ASN 61 -0.396 -38.529 14.520 516 2HD2 ASN 61 HD22 ASN 61 0.143 -37.252 13.489 517 H VAL 62 HN VAL 62 -1.889 -35.562 16.744 518 HA VAL 62 HA VAL 62 -4.080 -37.358 15.960 519 HB VAL 62 HB VAL 62 -4.038 -34.341 16.270 520 1HG1 VAL 62 HG11 VAL 62 -6.482 -34.475 16.010 521 2HG1 VAL 62 HG12 VAL 62 -6.344 -36.197 15.659 522 3HG1 VAL 62 HG13 VAL 62 -5.633 -35.013 14.562 523 1HG2 VAL 62 HG21 VAL 62 -3.868 -35.485 18.419 524 2HG2 VAL 62 HG22 VAL 62 -5.280 -36.467 18.024 525 3HG2 VAL 62 HG23 VAL 62 -5.451 -34.726 18.242 526 H SER 63 HN SER 63 -4.160 -37.915 13.877 527 HA SER 63 HA SER 63 -3.176 -36.001 11.854 528 1HB SER 63 HB2 SER 63 -3.584 -38.980 11.495 529 2HB SER 63 HB1 SER 63 -2.720 -37.876 10.426 530 HG SER 63 HG SER 63 -1.183 -37.592 12.094 531 H MET 64 HN MET 64 -4.899 -34.873 11.109 532 HA MET 64 HA MET 64 -7.339 -36.372 10.414 533 1HB MET 64 HB2 MET 64 -8.751 -34.632 11.372 534 2HB MET 64 HB1 MET 64 -7.706 -35.317 12.608 535 1HG MET 64 HG2 MET 64 -6.194 -33.369 12.346 536 2HG MET 64 HG1 MET 64 -7.348 -32.671 11.209 537 1HE MET 64 HE1 MET 64 -10.496 -32.171 13.531 538 2HE MET 64 HE2 MET 64 -10.126 -33.627 12.607 539 3HE MET 64 HE3 MET 64 -9.866 -32.037 11.889 540 H GLU 65 HN GLU 65 -8.745 -35.232 8.915 541 HA GLU 65 HA GLU 65 -7.279 -33.913 6.835 542 1HB GLU 65 HB2 GLU 65 -10.281 -34.218 7.123 543 2HB GLU 65 HB1 GLU 65 -9.409 -33.807 5.654 544 1HG GLU 65 HG2 GLU 65 -8.320 -36.043 5.746 545 2HG GLU 65 HG1 GLU 65 -9.356 -36.440 7.118 546 H VAL 66 HN VAL 66 -7.153 -31.766 6.404 547 HA VAL 66 HA VAL 66 -9.040 -29.956 7.758 548 HB VAL 66 HB VAL 66 -7.258 -28.195 7.731 549 1HG1 VAL 66 HG11 VAL 66 -6.624 -30.668 9.349 550 2HG1 VAL 66 HG12 VAL 66 -7.750 -29.385 9.793 551 3HG1 VAL 66 HG13 VAL 66 -6.023 -29.043 9.685 552 1HG2 VAL 66 HG21 VAL 66 -5.416 -30.503 7.054 553 2HG2 VAL 66 HG22 VAL 66 -4.903 -28.876 7.505 554 3HG2 VAL 66 HG23 VAL 66 -5.798 -29.133 6.008 555 H SER 67 HN SER 67 -10.196 -28.770 6.402 556 HA SER 67 HA SER 67 -9.636 -28.923 3.551 557 1HB SER 67 HB2 SER 67 -11.941 -29.342 4.414 558 2HB SER 67 HB1 SER 67 -11.998 -27.676 4.992 559 HG SER 67 HG SER 67 -12.853 -27.426 3.060 560 H ASN 68 HN ASN 68 -9.646 -26.648 6.179 561 HA ASN 68 HA ASN 68 -8.262 -24.748 4.438 562 1HB ASN 68 HB2 ASN 68 -9.507 -22.852 5.419 563 2HB ASN 68 HB1 ASN 68 -10.566 -23.943 4.532 564 1HD2 ASN 68 HD21 ASN 68 -12.065 -25.151 5.637 565 2HD2 ASN 68 HD22 ASN 68 -12.472 -24.863 7.292 566 H GLU 69 HN GLU 69 -7.548 -22.824 5.994 567 HA GLU 69 HA GLU 69 -5.776 -24.147 7.885 568 1HB GLU 69 HB2 GLU 69 -4.880 -22.530 6.229 569 2HB GLU 69 HB1 GLU 69 -5.838 -21.256 6.973 570 1HG GLU 69 HG2 GLU 69 -4.587 -21.502 9.049 571 2HG GLU 69 HG1 GLU 69 -3.657 -22.825 8.346 572 H SER 70 HN SER 70 -8.575 -22.099 7.886 573 HA SER 70 HA SER 70 -8.407 -21.003 10.461 574 1HB SER 70 HB2 SER 70 -10.086 -20.327 8.739 575 2HB SER 70 HB1 SER 70 -10.925 -21.857 8.989 576 HG SER 70 HG SER 70 -11.339 -21.227 11.129 577 H GLU 71 HN GLU 71 -9.583 -24.132 9.304 578 HA GLU 71 HA GLU 71 -10.406 -25.162 11.800 579 1HB GLU 71 HB2 GLU 71 -9.328 -26.624 9.374 580 2HB GLU 71 HB1 GLU 71 -10.127 -27.393 10.739 581 1HG GLU 71 HG2 GLU 71 -12.181 -26.187 10.245 582 2HG GLU 71 HG1 GLU 71 -11.385 -25.359 8.908 583 H ARG 72 HN ARG 72 -7.324 -25.333 10.054 584 HA ARG 72 HA ARG 72 -5.866 -26.896 11.816 585 1HB ARG 72 HB2 ARG 72 -4.929 -26.388 9.694 586 2HB ARG 72 HB1 ARG 72 -5.065 -24.660 9.951 587 1HG ARG 72 HG2 ARG 72 -3.256 -26.236 11.735 588 2HG ARG 72 HG1 ARG 72 -2.741 -25.889 10.085 589 1HD ARG 72 HD2 ARG 72 -3.215 -23.459 10.549 590 2HD ARG 72 HD1 ARG 72 -3.469 -23.899 12.237 591 HE ARG 72 HE ARG 72 -0.979 -24.899 11.504 592 1HH1 ARG 72 HH11 ARG 72 -2.530 -21.769 11.878 593 2HH1 ARG 72 HH12 ARG 72 -1.041 -20.931 12.181 594 1HH2 ARG 72 HH21 ARG 72 0.961 -23.807 11.895 595 2HH2 ARG 72 HH22 ARG 72 0.956 -22.094 12.188 596 H ASN 73 HN ASN 73 -6.585 -23.454 11.952 597 HA ASN 73 HA ASN 73 -4.933 -22.918 14.231 598 1HB ASN 73 HB2 ASN 73 -7.257 -21.346 13.073 599 2HB ASN 73 HB1 ASN 73 -6.166 -20.758 14.323 600 1HD2 ASN 73 HD21 ASN 73 -6.691 -19.636 11.721 601 2HD2 ASN 73 HD22 ASN 73 -5.177 -19.599 10.885 602 H GLU 74 HN GLU 74 -8.401 -23.444 13.730 603 HA GLU 74 HA GLU 74 -9.238 -23.012 16.365 604 1HB GLU 74 HB2 GLU 74 -10.861 -23.012 14.610 605 2HB GLU 74 HB1 GLU 74 -10.435 -24.650 14.129 606 1HG GLU 74 HG2 GLU 74 -11.400 -25.566 16.109 607 2HG GLU 74 HG1 GLU 74 -11.639 -23.964 16.804 608 H ILE 75 HN ILE 75 -8.440 -26.045 14.709 609 HA ILE 75 HA ILE 75 -8.988 -27.834 16.763 610 HB ILE 75 HB ILE 75 -6.855 -28.040 14.618 611 1HG1 ILE 75 HG12 ILE 75 -9.644 -29.219 14.611 612 2HG1 ILE 75 HG11 ILE 75 -9.280 -27.648 13.908 613 1HG2 ILE 75 HG21 ILE 75 -8.135 -30.213 16.290 614 2HG2 ILE 75 HG22 ILE 75 -6.468 -29.650 16.419 615 3HG2 ILE 75 HG23 ILE 75 -7.011 -30.470 14.955 616 1HD1 ILE 75 HD11 ILE 75 -9.351 -29.364 12.215 617 2HD1 ILE 75 HD12 ILE 75 -8.101 -30.281 13.060 618 3HD1 ILE 75 HD13 ILE 75 -7.722 -28.704 12.362 619 H PHE 76 HN PHE 76 -5.996 -26.087 16.010 620 HA PHE 76 HA PHE 76 -4.328 -27.120 17.982 621 1HB PHE 76 HB2 PHE 76 -3.468 -25.670 16.237 622 2HB PHE 76 HB1 PHE 76 -4.462 -24.331 16.800 623 HD1 PHE 76 HD1 PHE 76 -3.549 -22.763 18.251 624 HD2 PHE 76 HD2 PHE 76 -1.719 -26.599 17.927 625 HE1 PHE 76 HE1 PHE 76 -1.699 -21.999 19.681 626 HE2 PHE 76 HE2 PHE 76 0.132 -25.837 19.356 627 HZ PHE 76 HZ PHE 76 0.142 -23.536 20.236 628 H GLN 77 HN GLN 77 -6.718 -24.541 18.145 629 HA GLN 77 HA GLN 77 -6.196 -23.786 20.849 630 1HB GLN 77 HB2 GLN 77 -8.687 -23.387 19.171 631 2HB GLN 77 HB1 GLN 77 -8.322 -22.551 20.675 632 1HG GLN 77 HG2 GLN 77 -6.430 -21.449 19.656 633 2HG GLN 77 HG1 GLN 77 -6.658 -22.365 18.169 634 1HE2 GLN 77 HE21 GLN 77 -9.576 -22.125 18.262 635 2HE2 GLN 77 HE22 GLN 77 -9.934 -20.498 17.815 636 H LYS 78 HN LYS 78 -8.516 -25.930 19.282 637 HA LYS 78 HA LYS 78 -10.139 -26.611 21.433 638 1HB LYS 78 HB2 LYS 78 -9.249 -28.276 19.063 639 2HB LYS 78 HB1 LYS 78 -10.521 -28.764 20.172 640 1HG LYS 78 HG2 LYS 78 -10.645 -26.188 18.623 641 2HG LYS 78 HG1 LYS 78 -11.233 -27.719 17.970 642 1HD LYS 78 HD2 LYS 78 -12.745 -27.930 19.924 643 2HD LYS 78 HD1 LYS 78 -12.199 -26.349 20.490 644 1HE LYS 78 HE2 LYS 78 -13.095 -25.277 18.526 645 2HE LYS 78 HE1 LYS 78 -13.491 -26.837 17.803 646 1HZ LYS 78 HZ1 LYS 78 -14.703 -25.731 20.281 647 2HZ LYS 78 HZ2 LYS 78 -15.091 -27.213 19.564 648 3HZ LYS 78 HZ3 LYS 78 -15.435 -25.769 18.757 649 H ILE 79 HN ILE 79 -7.079 -28.000 20.363 650 HA ILE 79 HA ILE 79 -6.957 -30.197 22.095 651 HB ILE 79 HB ILE 79 -4.661 -28.589 20.943 652 1HG1 ILE 79 HG12 ILE 79 -5.987 -31.119 19.911 653 2HG1 ILE 79 HG11 ILE 79 -6.237 -29.508 19.250 654 1HG2 ILE 79 HG21 ILE 79 -3.325 -30.632 21.264 655 2HG2 ILE 79 HG22 ILE 79 -4.690 -31.388 22.086 656 3HG2 ILE 79 HG23 ILE 79 -3.905 -29.976 22.795 657 1HD1 ILE 79 HD11 ILE 79 -3.639 -31.027 19.281 658 2HD1 ILE 79 HD12 ILE 79 -3.870 -29.400 18.639 659 3HD1 ILE 79 HD13 ILE 79 -4.690 -30.769 17.888 660 H SER 80 HN SER 80 -6.283 -26.826 22.656 661 HA SER 80 HA SER 80 -4.751 -27.195 25.045 662 1HB SER 80 HB2 SER 80 -4.536 -25.178 23.659 663 2HB SER 80 HB1 SER 80 -6.217 -24.761 23.996 664 HG SER 80 HG SER 80 -4.269 -23.893 25.342 665 H GLN 81 HN GLN 81 -8.126 -26.993 24.262 666 HA GLN 81 HA GLN 81 -9.063 -26.031 26.770 667 1HB GLN 81 HB2 GLN 81 -10.547 -27.478 24.567 668 2HB GLN 81 HB1 GLN 81 -11.298 -26.616 25.904 669 1HG GLN 81 HG2 GLN 81 -10.354 -24.520 25.116 670 2HG GLN 81 HG1 GLN 81 -9.524 -25.362 23.811 671 1HE2 GLN 81 HE21 GLN 81 -11.792 -27.143 23.304 672 2HE2 GLN 81 HE22 GLN 81 -12.978 -26.185 22.490 673 H LEU 82 HN LEU 82 -7.597 -28.875 26.241 674 HA LEU 82 HA LEU 82 -9.434 -30.637 27.620 675 1HB LEU 82 HB2 LEU 82 -6.528 -31.245 27.134 676 2HB LEU 82 HB1 LEU 82 -7.878 -32.355 27.244 677 HG LEU 82 HG LEU 82 -7.385 -30.446 24.956 678 1HD1 LEU 82 HD11 LEU 82 -6.990 -33.431 25.123 679 2HD1 LEU 82 HD12 LEU 82 -5.721 -32.209 25.011 680 3HD1 LEU 82 HD13 LEU 82 -6.836 -32.447 23.666 681 1HD2 LEU 82 HD21 LEU 82 -9.173 -31.689 23.828 682 2HD2 LEU 82 HD22 LEU 82 -9.749 -30.862 25.273 683 3HD2 LEU 82 HD23 LEU 82 -9.464 -32.602 25.309 684 H ASP 83 HN ASP 83 -6.816 -28.525 28.409 685 HA ASP 83 HA ASP 83 -5.819 -27.899 30.350 686 1HB ASP 83 HB2 ASP 83 -7.951 -27.885 31.462 687 2HB ASP 83 HB1 ASP 83 -7.952 -29.637 31.609 688 H LYS 84 HN LYS 84 -6.405 -31.321 29.946 689 HA LYS 84 HA LYS 84 -4.332 -32.313 31.577 690 1HB LYS 84 HB2 LYS 84 -5.716 -33.549 29.195 691 2HB LYS 84 HB1 LYS 84 -4.748 -34.420 30.380 692 1HG LYS 84 HG2 LYS 84 -6.379 -34.393 31.944 693 2HG LYS 84 HG1 LYS 84 -6.955 -32.792 31.474 694 1HD LYS 84 HD2 LYS 84 -8.054 -33.757 29.512 695 2HD LYS 84 HD1 LYS 84 -7.472 -35.358 29.967 696 1HE LYS 84 HE2 LYS 84 -9.778 -35.051 30.658 697 2HE LYS 84 HE1 LYS 84 -8.736 -35.221 32.063 698 1HZ LYS 84 HZ1 LYS 84 -8.750 -32.760 32.232 699 2HZ LYS 84 HZ2 LYS 84 -10.269 -33.457 32.458 700 3HZ LYS 84 HZ3 LYS 84 -9.899 -32.705 30.991 701 H VAL 85 HN VAL 85 -4.228 -30.647 28.670 702 HA VAL 85 HA VAL 85 -1.869 -31.971 27.596 703 HB VAL 85 HB VAL 85 -3.611 -31.234 26.037 704 1HG1 VAL 85 HG11 VAL 85 -2.971 -28.431 26.965 705 2HG1 VAL 85 HG12 VAL 85 -4.469 -29.312 27.267 706 3HG1 VAL 85 HG13 VAL 85 -4.032 -28.855 25.621 707 1HG2 VAL 85 HG21 VAL 85 -1.044 -29.670 25.733 708 2HG2 VAL 85 HG22 VAL 85 -2.191 -30.022 24.439 709 3HG2 VAL 85 HG23 VAL 85 -1.316 -31.337 25.225 710 H VAL 86 HN VAL 86 0.176 -31.247 27.864 711 HA VAL 86 HA VAL 86 0.572 -28.772 29.400 712 HB VAL 86 HB VAL 86 2.868 -29.572 29.798 713 1HG1 VAL 86 HG11 VAL 86 1.100 -30.156 31.385 714 2HG1 VAL 86 HG12 VAL 86 2.309 -31.436 31.284 715 3HG1 VAL 86 HG13 VAL 86 0.754 -31.626 30.472 716 1HG2 VAL 86 HG21 VAL 86 3.194 -30.835 27.732 717 2HG2 VAL 86 HG22 VAL 86 2.008 -32.029 28.258 718 3HG2 VAL 86 HG23 VAL 86 3.524 -31.844 29.139 719 H GLN 87 HN GLN 87 1.078 -30.197 26.298 720 HA GLN 87 HA GLN 87 1.806 -27.658 25.179 721 1HB GLN 87 HB2 GLN 87 4.028 -28.447 25.938 722 2HB GLN 87 HB1 GLN 87 3.810 -29.932 25.020 723 1HG GLN 87 HG2 GLN 87 5.254 -28.398 23.823 724 2HG GLN 87 HG1 GLN 87 3.748 -28.641 22.940 725 1HE2 GLN 87 HE21 GLN 87 3.874 -26.720 21.812 726 2HE2 GLN 87 HE22 GLN 87 3.683 -25.174 22.564 727 H THR 88 HN THR 88 1.325 -27.562 23.023 728 HA THR 88 HA THR 88 0.764 -30.031 21.575 729 HB THR 88 HB THR 88 -1.424 -29.483 22.405 730 HG1 THR 88 HG1 THR 88 -2.391 -28.724 20.263 731 1HG2 THR 88 HG21 THR 88 -1.050 -27.151 23.029 732 2HG2 THR 88 HG22 THR 88 -2.493 -27.304 22.026 733 3HG2 THR 88 HG23 THR 88 -0.995 -26.691 21.326 734 H LEU 89 HN LEU 89 1.179 -29.883 19.413 735 HA LEU 89 HA LEU 89 2.149 -27.288 18.407 736 1HB LEU 89 HB2 LEU 89 3.275 -30.047 17.867 737 2HB LEU 89 HB1 LEU 89 3.728 -28.615 16.967 738 HG LEU 89 HG LEU 89 5.467 -28.992 18.519 739 1HD1 LEU 89 HD11 LEU 89 4.822 -26.655 18.326 740 2HD1 LEU 89 HD12 LEU 89 5.425 -27.008 19.945 741 3HD1 LEU 89 HD13 LEU 89 3.691 -26.837 19.669 742 1HD2 LEU 89 HD21 LEU 89 3.399 -29.200 20.711 743 2HD2 LEU 89 HD22 LEU 89 5.148 -29.284 20.919 744 3HD2 LEU 89 HD23 LEU 89 4.307 -30.540 20.012 745 H GLY 90 HN GLY 90 0.581 -26.611 17.115 746 1HA GLY 90 HA2 GLY 90 -0.506 -28.482 15.088 747 2HA GLY 90 HA1 GLY 90 -1.401 -27.119 15.751 748 H SER 91 HN SER 91 1.954 -27.276 14.728 749 HA SER 91 HA SER 91 1.837 -24.779 13.406 750 1HB SER 91 HB2 SER 91 3.969 -26.933 13.253 751 2HB SER 91 HB1 SER 91 4.171 -25.228 12.851 752 HG SER 91 HG SER 91 3.139 -25.480 15.329 Start of MODEL 20 1 1H GLN 1 HT1 GLN 1 6.233 -8.240 0.799 2 2H GLN 1 HT2 GLN 1 6.149 -9.765 1.527 3 3H GLN 1 HT3 GLN 1 6.600 -8.418 2.443 4 HA GLN 1 HA GLN 1 4.339 -9.054 2.927 5 1HB GLN 1 HB2 GLN 1 4.465 -6.484 1.323 6 2HB GLN 1 HB1 GLN 1 3.278 -6.876 2.559 7 1HG GLN 1 HG2 GLN 1 4.959 -6.827 4.274 8 2HG GLN 1 HG1 GLN 1 6.236 -6.632 3.074 9 1HE2 GLN 1 HE21 GLN 1 3.636 -5.069 4.772 10 2HE2 GLN 1 HE22 GLN 1 4.059 -3.451 4.332 11 H GLY 2 HN GLY 2 3.780 -7.300 -0.096 12 1HA GLY 2 HA2 GLY 2 1.799 -9.203 -0.959 13 2HA GLY 2 HA1 GLY 2 2.350 -7.787 -1.847 14 H HIS 3 HN HIS 3 5.116 -8.438 -1.736 15 HA HIS 3 HA HIS 3 5.288 -10.941 -3.278 16 1HB HIS 3 HB2 HIS 3 6.684 -8.309 -3.844 17 2HB HIS 3 HB1 HIS 3 7.142 -9.835 -4.588 18 HD1 HIS 3 HD1 HIS 3 5.626 -7.006 -5.663 19 HD2 HIS 3 HD2 HIS 3 4.304 -10.947 -5.597 20 HE1 HIS 3 HE1 HIS 3 3.856 -7.156 -7.440 21 HE2 HIS 3 HE2 HIS 3 3.168 -9.579 -7.471 22 H MET 4 HN MET 4 7.191 -12.110 -3.006 23 HA MET 4 HA MET 4 9.094 -11.150 -0.975 24 1HB MET 4 HB2 MET 4 9.256 -13.370 -0.008 25 2HB MET 4 HB1 MET 4 7.572 -12.870 0.021 26 1HG MET 4 HG2 MET 4 7.055 -14.293 -1.846 27 2HG MET 4 HG1 MET 4 8.758 -14.686 -2.071 28 1HE MET 4 HE1 MET 4 6.252 -16.063 1.562 29 2HE MET 4 HE2 MET 4 5.597 -15.125 0.219 30 3HE MET 4 HE3 MET 4 6.754 -14.387 1.328 31 HA PRO 5 HA PRO 5 12.251 -12.249 -3.908 32 1HB PRO 5 HB2 PRO 5 14.049 -13.700 -2.402 33 2HB PRO 5 HB1 PRO 5 13.941 -11.936 -2.391 34 1HG PRO 5 HG2 PRO 5 12.774 -13.916 -0.465 35 2HG PRO 5 HG1 PRO 5 13.589 -12.376 -0.131 36 1HD PRO 5 HD2 PRO 5 10.917 -12.577 -0.055 37 2HD PRO 5 HD1 PRO 5 11.710 -11.117 -0.683 38 H SER 6 HN SER 6 13.591 -14.254 -4.671 39 HA SER 6 HA SER 6 11.810 -16.301 -5.421 40 1HB SER 6 HB2 SER 6 13.928 -17.449 -6.238 41 2HB SER 6 HB1 SER 6 13.662 -15.821 -6.860 42 HG SER 6 HG SER 6 15.093 -15.910 -4.506 43 H ASP 7 HN ASP 7 10.911 -17.068 -3.492 44 HA ASP 7 HA ASP 7 12.536 -19.059 -2.088 45 1HB ASP 7 HB2 ASP 7 11.133 -16.715 -0.832 46 2HB ASP 7 HB1 ASP 7 11.194 -18.238 0.047 47 H SER 8 HN SER 8 11.261 -20.639 -0.960 48 HA SER 8 HA SER 8 8.559 -20.971 -2.090 49 1HB SER 8 HB2 SER 8 10.447 -23.065 -0.957 50 2HB SER 8 HB1 SER 8 8.885 -23.378 -1.717 51 HG SER 8 HG SER 8 11.333 -22.707 -2.866 52 H LYS 9 HN LYS 9 9.414 -19.377 0.236 53 HA LYS 9 HA LYS 9 8.787 -20.696 2.665 54 1HB LYS 9 HB2 LYS 9 10.103 -18.486 2.210 55 2HB LYS 9 HB1 LYS 9 8.524 -17.721 2.239 56 1HG LYS 9 HG2 LYS 9 9.529 -17.499 4.399 57 2HG LYS 9 HG1 LYS 9 8.181 -18.631 4.527 58 1HD LYS 9 HD2 LYS 9 10.122 -19.442 5.772 59 2HD LYS 9 HD1 LYS 9 9.747 -20.513 4.421 60 1HE LYS 9 HE2 LYS 9 11.523 -19.405 3.096 61 2HE LYS 9 HE1 LYS 9 11.927 -18.422 4.504 62 1HZ LYS 9 HZ1 LYS 9 12.070 -21.387 4.377 63 2HZ LYS 9 HZ2 LYS 9 12.488 -20.434 5.707 64 3HZ LYS 9 HZ3 LYS 9 13.393 -20.336 4.283 65 H LYS 10 HN LYS 10 6.882 -20.775 3.830 66 HA LYS 10 HA LYS 10 4.660 -21.065 4.122 67 1HB LYS 10 HB2 LYS 10 4.749 -18.359 2.831 68 2HB LYS 10 HB1 LYS 10 3.190 -19.122 3.113 69 1HG LYS 10 HG2 LYS 10 3.753 -17.629 4.940 70 2HG LYS 10 HG1 LYS 10 3.700 -19.301 5.501 71 1HD LYS 10 HD2 LYS 10 6.241 -19.310 5.124 72 2HD LYS 10 HD1 LYS 10 6.106 -17.554 5.023 73 1HE LYS 10 HE2 LYS 10 5.117 -17.497 7.258 74 2HE LYS 10 HE1 LYS 10 5.209 -19.257 7.345 75 1HZ LYS 10 HZ1 LYS 10 7.614 -19.108 7.212 76 2HZ LYS 10 HZ2 LYS 10 7.043 -18.206 8.525 77 3HZ LYS 10 HZ3 LYS 10 7.533 -17.420 7.110 78 HA PRO 11 HA PRO 11 4.284 -22.980 -0.087 79 1HB PRO 11 HB2 PRO 11 3.666 -25.474 0.835 80 2HB PRO 11 HB1 PRO 11 5.327 -24.899 0.644 81 1HG PRO 11 HG2 PRO 11 3.637 -25.016 3.119 82 2HG PRO 11 HG1 PRO 11 5.339 -25.473 2.906 83 1HD PRO 11 HD2 PRO 11 4.612 -23.111 4.001 84 2HD PRO 11 HD1 PRO 11 6.071 -23.276 3.001 85 H THR 12 HN THR 12 2.435 -23.057 -1.210 86 HA THR 12 HA THR 12 -0.048 -22.411 -0.001 87 HB THR 12 HB THR 12 0.510 -23.387 -2.819 88 HG1 THR 12 HG1 THR 12 0.971 -21.334 -3.296 89 1HG2 THR 12 HG21 THR 12 -1.857 -21.866 -1.698 90 2HG2 THR 12 HG22 THR 12 -1.869 -23.547 -2.231 91 3HG2 THR 12 HG23 THR 12 -1.595 -22.253 -3.398 92 H ILE 13 HN ILE 13 -1.169 -23.803 1.170 93 HA ILE 13 HA ILE 13 -0.965 -26.670 0.743 94 HB ILE 13 HB ILE 13 -2.575 -25.138 2.801 95 1HG1 ILE 13 HG12 ILE 13 -0.142 -24.704 2.984 96 2HG1 ILE 13 HG11 ILE 13 -0.749 -25.621 4.360 97 1HG2 ILE 13 HG21 ILE 13 -3.421 -27.399 2.455 98 2HG2 ILE 13 HG22 ILE 13 -2.628 -27.275 4.025 99 3HG2 ILE 13 HG23 ILE 13 -1.801 -28.060 2.680 100 1HD1 ILE 13 HD11 ILE 13 0.765 -26.743 2.007 101 2HD1 ILE 13 HD12 ILE 13 0.147 -27.676 3.369 102 3HD1 ILE 13 HD13 ILE 13 1.402 -26.467 3.629 103 H ILE 14 HN ILE 14 -2.417 -27.868 -0.316 104 HA ILE 14 HA ILE 14 -4.808 -26.589 -1.397 105 HB ILE 14 HB ILE 14 -3.660 -29.345 -1.926 106 1HG1 ILE 14 HG12 ILE 14 -2.182 -27.564 -2.735 107 2HG1 ILE 14 HG11 ILE 14 -2.940 -28.390 -4.091 108 1HG2 ILE 14 HG21 ILE 14 -5.892 -27.869 -3.332 109 2HG2 ILE 14 HG22 ILE 14 -6.062 -29.305 -2.322 110 3HG2 ILE 14 HG23 ILE 14 -5.193 -29.403 -3.853 111 1HD1 ILE 14 HD11 ILE 14 -3.758 -25.719 -2.964 112 2HD1 ILE 14 HD12 ILE 14 -4.533 -26.545 -4.316 113 3HD1 ILE 14 HD13 ILE 14 -2.862 -25.998 -4.458 114 H TYR 15 HN TYR 15 -6.784 -26.899 -0.598 115 HA TYR 15 HA TYR 15 -7.162 -28.972 1.467 116 1HB TYR 15 HB2 TYR 15 -8.504 -26.274 1.116 117 2HB TYR 15 HB1 TYR 15 -9.012 -27.475 2.299 118 HD1 TYR 15 HD1 TYR 15 -7.810 -27.777 4.348 119 HD2 TYR 15 HD2 TYR 15 -6.265 -25.173 1.351 120 HE1 TYR 15 HE1 TYR 15 -6.180 -26.893 5.960 121 HE2 TYR 15 HE2 TYR 15 -4.624 -24.291 2.962 122 HH TYR 15 HH TYR 15 -3.947 -25.769 5.902 123 HA PRO 16 HA PRO 16 -8.872 -29.726 2.591 124 1HB PRO 16 HB2 PRO 16 -10.172 -32.077 2.825 125 2HB PRO 16 HB1 PRO 16 -11.015 -30.528 2.829 126 1HG PRO 16 HG2 PRO 16 -10.742 -32.535 0.637 127 2HG PRO 16 HG1 PRO 16 -12.129 -31.515 1.056 128 1HD PRO 16 HD2 PRO 16 -10.330 -30.998 -0.998 129 2HD PRO 16 HD1 PRO 16 -11.385 -29.790 -0.240 130 H CYS 17 HN CYS 17 -7.637 -31.272 3.732 131 HA CYS 17 HA CYS 17 -6.442 -33.535 2.463 132 1HB CYS 17 HB2 CYS 17 -5.189 -31.663 1.367 133 2HB CYS 17 HB1 CYS 17 -4.637 -31.146 2.956 134 HG CYS 17 HG CYS 17 -3.291 -33.318 0.943 135 H LEU 18 HN LEU 18 -4.581 -34.371 3.894 136 HA LEU 18 HA LEU 18 -5.591 -34.473 6.593 137 1HB LEU 18 HB2 LEU 18 -3.273 -35.829 5.211 138 2HB LEU 18 HB1 LEU 18 -3.670 -36.096 6.899 139 HG LEU 18 HG LEU 18 -5.619 -36.637 4.657 140 1HD1 LEU 18 HD11 LEU 18 -5.017 -38.997 4.867 141 2HD1 LEU 18 HD12 LEU 18 -3.743 -38.578 6.013 142 3HD1 LEU 18 HD13 LEU 18 -3.640 -38.032 4.338 143 1HD2 LEU 18 HD21 LEU 18 -6.621 -36.331 6.862 144 2HD2 LEU 18 HD22 LEU 18 -5.531 -37.540 7.541 145 3HD2 LEU 18 HD23 LEU 18 -6.742 -38.014 6.348 146 H TRP 19 HN TRP 19 -5.117 -32.795 7.900 147 HA TRP 19 HA TRP 19 -2.392 -31.714 7.882 148 1HB TRP 19 HB2 TRP 19 -4.440 -30.178 7.994 149 2HB TRP 19 HB1 TRP 19 -4.655 -30.752 9.647 150 HD1 TRP 19 HD1 TRP 19 -2.844 -29.949 11.473 151 HE1 TRP 19 HE1 TRP 19 -1.099 -28.056 11.461 152 HE3 TRP 19 HE3 TRP 19 -2.867 -28.849 6.477 153 HZ2 TRP 19 HZ2 TRP 19 0.099 -26.324 9.587 154 HZ3 TRP 19 HZ3 TRP 19 -1.392 -27.061 5.657 155 HH2 TRP 19 HH2 TRP 19 0.060 -25.822 7.182 156 H ASP 20 HN ASP 20 -1.112 -31.699 9.776 157 HA ASP 20 HA ASP 20 -1.724 -33.967 11.563 158 1HB ASP 20 HB2 ASP 20 0.029 -34.490 9.947 159 2HB ASP 20 HB1 ASP 20 0.929 -33.057 10.424 160 H TYR 21 HN TYR 21 -1.950 -33.429 13.606 161 HA TYR 21 HA TYR 21 -0.770 -30.936 14.634 162 1HB TYR 21 HB2 TYR 21 -3.143 -32.534 15.649 163 2HB TYR 21 HB1 TYR 21 -2.524 -31.063 16.387 164 HD1 TYR 21 HD1 TYR 21 -3.117 -28.916 15.533 165 HD2 TYR 21 HD2 TYR 21 -4.228 -32.429 13.392 166 HE1 TYR 21 HE1 TYR 21 -4.615 -27.577 14.121 167 HE2 TYR 21 HE2 TYR 21 -5.728 -31.094 11.974 168 HH TYR 21 HH TYR 21 -5.734 -27.622 12.068 169 H ARG 22 HN ARG 22 0.734 -31.051 16.174 170 HA ARG 22 HA ARG 22 1.352 -33.627 17.434 171 1HB ARG 22 HB2 ARG 22 3.179 -32.249 16.416 172 2HB ARG 22 HB1 ARG 22 2.835 -30.982 17.582 173 1HG ARG 22 HG2 ARG 22 4.738 -32.171 18.360 174 2HG ARG 22 HG1 ARG 22 3.384 -32.611 19.405 175 1HD ARG 22 HD2 ARG 22 4.793 -34.550 18.762 176 2HD ARG 22 HD1 ARG 22 3.113 -34.715 18.248 177 HE ARG 22 HE ARG 22 3.898 -33.973 16.004 178 1HH1 ARG 22 HH11 ARG 22 6.174 -35.467 18.222 179 2HH1 ARG 22 HH12 ARG 22 7.217 -36.034 16.958 180 1HH2 ARG 22 HH21 ARG 22 5.262 -34.715 14.353 181 2HH2 ARG 22 HH22 ARG 22 6.693 -35.615 14.754 182 H VAL 23 HN VAL 23 0.232 -34.038 19.249 183 HA VAL 23 HA VAL 23 -0.604 -31.772 20.944 184 HB VAL 23 HB VAL 23 -1.759 -34.574 20.901 185 1HG1 VAL 23 HG11 VAL 23 -2.777 -32.016 22.149 186 2HG1 VAL 23 HG12 VAL 23 -2.106 -33.402 23.010 187 3HG1 VAL 23 HG13 VAL 23 -3.628 -33.560 22.133 188 1HG2 VAL 23 HG21 VAL 23 -2.809 -32.075 19.559 189 2HG2 VAL 23 HG22 VAL 23 -3.645 -33.627 19.644 190 3HG2 VAL 23 HG23 VAL 23 -2.135 -33.487 18.742 191 H ILE 24 HN ILE 24 0.999 -31.516 22.440 192 HA ILE 24 HA ILE 24 2.064 -33.881 23.802 193 HB ILE 24 HB ILE 24 2.885 -30.978 24.107 194 1HG1 ILE 24 HG12 ILE 24 4.172 -33.219 22.510 195 2HG1 ILE 24 HG11 ILE 24 3.337 -31.824 21.836 196 1HG2 ILE 24 HG21 ILE 24 4.871 -31.879 25.228 197 2HG2 ILE 24 HG22 ILE 24 4.231 -33.513 25.063 198 3HG2 ILE 24 HG23 ILE 24 3.396 -32.338 26.079 199 1HD1 ILE 24 HD11 ILE 24 5.746 -31.567 21.705 200 2HD1 ILE 24 HD12 ILE 24 5.874 -31.745 23.454 201 3HD1 ILE 24 HD13 ILE 24 5.040 -30.350 22.769 202 H MET 25 HN MET 25 1.071 -34.578 25.553 203 HA MET 25 HA MET 25 -0.412 -32.668 27.255 204 1HB MET 25 HB2 MET 25 -1.081 -35.576 26.682 205 2HB MET 25 HB1 MET 25 -1.992 -34.506 27.741 206 1HG MET 25 HG2 MET 25 -2.680 -33.154 25.893 207 2HG MET 25 HG1 MET 25 -1.601 -34.012 24.796 208 1HE MET 25 HE1 MET 25 -4.887 -34.258 26.962 209 2HE MET 25 HE2 MET 25 -3.894 -35.564 27.610 210 3HE MET 25 HE3 MET 25 -5.352 -35.938 26.691 211 H THR 26 HN THR 26 -0.486 -33.186 29.525 212 HA THR 26 HA THR 26 1.906 -34.585 30.462 213 HB THR 26 HB THR 26 1.134 -33.616 32.718 214 HG1 THR 26 HG1 THR 26 -0.294 -31.649 31.395 215 1HG2 THR 26 HG21 THR 26 2.025 -31.391 32.205 216 2HG2 THR 26 HG22 THR 26 1.809 -31.692 30.481 217 3HG2 THR 26 HG23 THR 26 2.973 -32.645 31.403 218 H THR 27 HN THR 27 -0.464 -36.006 29.401 219 HA THR 27 HA THR 27 -0.711 -37.962 31.508 220 HB THR 27 HB THR 27 -2.589 -36.438 32.053 221 HG1 THR 27 HG1 THR 27 -3.197 -38.434 32.595 222 1HG2 THR 27 HG21 THR 27 -4.478 -36.211 30.505 223 2HG2 THR 27 HG22 THR 27 -3.587 -37.111 29.278 224 3HG2 THR 27 HG23 THR 27 -3.004 -35.534 29.811 225 H LYS 28 HN LYS 28 -1.598 -39.968 30.735 226 HA LYS 28 HA LYS 28 -1.534 -40.235 27.809 227 1HB LYS 28 HB2 LYS 28 -1.268 -42.334 29.978 228 2HB LYS 28 HB1 LYS 28 -1.304 -42.686 28.254 229 1HG LYS 28 HG2 LYS 28 0.712 -41.192 28.013 230 2HG LYS 28 HG1 LYS 28 0.795 -41.148 29.774 231 1HD LYS 28 HD2 LYS 28 0.937 -43.645 28.073 232 2HD LYS 28 HD1 LYS 28 2.319 -42.824 28.798 233 1HE LYS 28 HE2 LYS 28 1.344 -43.239 31.036 234 2HE LYS 28 HE1 LYS 28 0.029 -44.133 30.272 235 1HZ LYS 28 HZ1 LYS 28 2.915 -44.836 30.209 236 2HZ LYS 28 HZ2 LYS 28 1.712 -45.656 29.352 237 3HZ LYS 28 HZ3 LYS 28 1.694 -45.657 31.043 238 H ASP 29 HN ASP 29 -3.709 -39.534 30.014 239 HA ASP 29 HA ASP 29 -5.830 -41.357 29.250 240 1HB ASP 29 HB2 ASP 29 -5.770 -40.435 31.539 241 2HB ASP 29 HB1 ASP 29 -5.906 -38.804 30.894 242 H THR 30 HN THR 30 -5.973 -41.074 27.029 243 HA THR 30 HA THR 30 -6.643 -38.373 26.090 244 HB THR 30 HB THR 30 -4.703 -39.260 24.962 245 HG1 THR 30 HG1 THR 30 -5.392 -38.578 23.074 246 1HG2 THR 30 HG21 THR 30 -5.085 -41.659 25.276 247 2HG2 THR 30 HG22 THR 30 -4.780 -41.285 23.581 248 3HG2 THR 30 HG23 THR 30 -6.425 -41.606 24.128 249 H SER 31 HN SER 31 -8.769 -38.195 26.355 250 HA SER 31 HA SER 31 -10.453 -39.864 24.631 251 1HB SER 31 HB2 SER 31 -10.792 -40.698 26.928 252 2HB SER 31 HB1 SER 31 -11.154 -39.065 27.479 253 HG SER 31 HG SER 31 -13.108 -39.917 27.111 254 H THR 32 HN THR 32 -10.469 -37.018 26.770 255 HA THR 32 HA THR 32 -12.354 -35.433 25.596 256 HB THR 32 HB THR 32 -9.697 -34.289 26.474 257 HG1 THR 32 HG1 THR 32 -11.766 -35.403 28.105 258 1HG2 THR 32 HG21 THR 32 -11.413 -32.703 25.700 259 2HG2 THR 32 HG22 THR 32 -11.109 -32.520 27.427 260 3HG2 THR 32 HG23 THR 32 -12.555 -33.364 26.872 261 H LEU 33 HN LEU 33 -9.064 -36.024 24.524 262 HA LEU 33 HA LEU 33 -8.827 -34.043 22.557 263 1HB LEU 33 HB2 LEU 33 -6.926 -35.299 23.444 264 2HB LEU 33 HB1 LEU 33 -7.548 -36.778 22.738 265 HG LEU 33 HG LEU 33 -7.168 -35.881 20.481 266 1HD1 LEU 33 HD11 LEU 33 -5.933 -33.793 20.161 267 2HD1 LEU 33 HD12 LEU 33 -6.011 -33.475 21.894 268 3HD1 LEU 33 HD13 LEU 33 -7.491 -33.508 20.935 269 1HD2 LEU 33 HD21 LEU 33 -4.713 -35.907 20.528 270 2HD2 LEU 33 HD22 LEU 33 -5.401 -37.173 21.544 271 3HD2 LEU 33 HD23 LEU 33 -4.747 -35.710 22.282 272 H LYS 34 HN LYS 34 -9.994 -37.385 22.369 273 HA LYS 34 HA LYS 34 -10.361 -37.349 19.535 274 1HB LYS 34 HB2 LYS 34 -11.416 -39.222 21.665 275 2HB LYS 34 HB1 LYS 34 -11.601 -39.487 19.935 276 1HG LYS 34 HG2 LYS 34 -9.199 -39.645 19.663 277 2HG LYS 34 HG1 LYS 34 -8.955 -39.270 21.371 278 1HD LYS 34 HD2 LYS 34 -10.457 -41.685 20.337 279 2HD LYS 34 HD1 LYS 34 -8.769 -41.698 20.852 280 1HE LYS 34 HE2 LYS 34 -9.431 -41.020 23.097 281 2HE LYS 34 HE1 LYS 34 -11.119 -40.942 22.595 282 1HZ LYS 34 HZ1 LYS 34 -10.652 -42.996 23.755 283 2HZ LYS 34 HZ2 LYS 34 -9.437 -43.390 22.649 284 3HZ LYS 34 HZ3 LYS 34 -11.048 -43.321 22.144 285 H GLU 35 HN GLU 35 -12.427 -36.792 22.329 286 HA GLU 35 HA GLU 35 -14.937 -36.934 21.180 287 1HB GLU 35 HB2 GLU 35 -14.020 -34.979 23.307 288 2HB GLU 35 HB1 GLU 35 -15.691 -35.407 22.965 289 1HG GLU 35 HG2 GLU 35 -13.561 -37.281 23.981 290 2HG GLU 35 HG1 GLU 35 -14.846 -36.555 24.943 291 H LEU 36 HN LEU 36 -12.823 -34.072 21.418 292 HA LEU 36 HA LEU 36 -14.638 -32.324 20.131 293 1HB LEU 36 HB2 LEU 36 -12.853 -30.721 20.075 294 2HB LEU 36 HB1 LEU 36 -12.811 -31.568 21.609 295 HG LEU 36 HG LEU 36 -11.015 -33.060 20.286 296 1HD1 LEU 36 HD11 LEU 36 -9.578 -31.646 18.899 297 2HD1 LEU 36 HD12 LEU 36 -10.754 -30.338 19.013 298 3HD1 LEU 36 HD13 LEU 36 -11.183 -31.838 18.192 299 1HD2 LEU 36 HD21 LEU 36 -10.431 -30.407 21.599 300 2HD2 LEU 36 HD22 LEU 36 -9.263 -31.701 21.329 301 3HD2 LEU 36 HD23 LEU 36 -10.627 -31.958 22.415 302 H LEU 37 HN LEU 37 -12.178 -34.499 18.937 303 HA LEU 37 HA LEU 37 -12.002 -33.445 16.302 304 1HB LEU 37 HB2 LEU 37 -11.473 -36.259 17.291 305 2HB LEU 37 HB1 LEU 37 -10.979 -35.620 15.734 306 HG LEU 37 HG LEU 37 -9.997 -34.590 18.402 307 1HD1 LEU 37 HD11 LEU 37 -9.199 -36.855 18.006 308 2HD1 LEU 37 HD12 LEU 37 -7.884 -35.694 17.842 309 3HD1 LEU 37 HD13 LEU 37 -8.627 -36.391 16.402 310 1HD2 LEU 37 HD21 LEU 37 -9.067 -33.984 15.593 311 2HD2 LEU 37 HD22 LEU 37 -8.334 -33.384 17.080 312 3HD2 LEU 37 HD23 LEU 37 -9.969 -32.890 16.643 313 H GLU 38 HN GLU 38 -14.042 -35.853 17.853 314 HA GLU 38 HA GLU 38 -15.179 -36.854 15.438 315 1HB GLU 38 HB2 GLU 38 -16.152 -37.117 18.292 316 2HB GLU 38 HB1 GLU 38 -16.766 -38.032 16.919 317 1HG GLU 38 HG2 GLU 38 -14.444 -38.926 16.593 318 2HG GLU 38 HG1 GLU 38 -14.007 -38.161 18.118 319 H THR 39 HN THR 39 -15.853 -34.084 17.378 320 HA THR 39 HA THR 39 -18.613 -33.784 16.894 321 HB THR 39 HB THR 39 -18.345 -31.425 17.423 322 HG1 THR 39 HG1 THR 39 -15.613 -31.457 17.753 323 1HG2 THR 39 HG21 THR 39 -17.202 -31.584 19.587 324 2HG2 THR 39 HG22 THR 39 -16.471 -33.110 19.095 325 3HG2 THR 39 HG23 THR 39 -18.219 -32.996 19.303 326 H TYR 40 HN TYR 40 -15.837 -33.254 14.891 327 HA TYR 40 HA TYR 40 -17.166 -31.621 12.925 328 1HB TYR 40 HB2 TYR 40 -14.530 -33.115 12.817 329 2HB TYR 40 HB1 TYR 40 -15.084 -31.955 11.613 330 HD1 TYR 40 HD1 TYR 40 -14.850 -29.613 11.972 331 HD2 TYR 40 HD2 TYR 40 -14.000 -32.331 15.135 332 HE1 TYR 40 HE1 TYR 40 -13.876 -27.780 13.280 333 HE2 TYR 40 HE2 TYR 40 -13.021 -30.502 16.451 334 HH TYR 40 HH TYR 40 -13.390 -27.205 15.531 335 H GLN 41 HN GLN 41 -17.250 -34.872 13.681 336 HA GLN 41 HA GLN 41 -18.055 -36.741 12.690 337 1HB GLN 41 HB2 GLN 41 -19.215 -34.731 10.743 338 2HB GLN 41 HB1 GLN 41 -19.629 -36.439 10.758 339 1HG GLN 41 HG2 GLN 41 -20.093 -34.505 13.026 340 2HG GLN 41 HG1 GLN 41 -21.314 -35.064 11.882 341 1HE2 GLN 41 HE21 GLN 41 -19.351 -35.907 14.622 342 2HE2 GLN 41 HE22 GLN 41 -20.168 -37.380 15.010 343 H ARG 42 HN ARG 42 -15.470 -35.389 11.784 344 HA ARG 42 HA ARG 42 -15.149 -36.726 9.179 345 1HB ARG 42 HB2 ARG 42 -13.276 -35.258 8.760 346 2HB ARG 42 HB1 ARG 42 -14.648 -34.276 9.253 347 1HG ARG 42 HG2 ARG 42 -13.715 -34.055 11.493 348 2HG ARG 42 HG1 ARG 42 -12.359 -35.089 11.043 349 1HD ARG 42 HD2 ARG 42 -11.575 -32.856 10.905 350 2HD ARG 42 HD1 ARG 42 -11.808 -33.407 9.248 351 HE ARG 42 HE ARG 42 -13.554 -31.523 10.700 352 1HH1 ARG 42 HH11 ARG 42 -12.411 -32.907 7.696 353 2HH1 ARG 42 HH12 ARG 42 -13.273 -31.771 6.706 354 1HH2 ARG 42 HH21 ARG 42 -14.603 -29.964 9.387 355 2HH2 ARG 42 HH22 ARG 42 -14.492 -30.104 7.659 356 HA PRO 43 HA PRO 43 -12.528 -39.755 11.067 357 1HB PRO 43 HB2 PRO 43 -10.831 -40.341 9.019 358 2HB PRO 43 HB1 PRO 43 -12.520 -40.859 9.041 359 1HG PRO 43 HG2 PRO 43 -11.282 -38.507 7.650 360 2HG PRO 43 HG1 PRO 43 -12.462 -39.678 7.027 361 1HD PRO 43 HD2 PRO 43 -13.201 -37.234 7.899 362 2HD PRO 43 HD1 PRO 43 -14.237 -38.660 8.116 363 H PHE 44 HN PHE 44 -10.383 -40.157 11.817 364 HA PHE 44 HA PHE 44 -8.281 -38.254 11.320 365 1HB PHE 44 HB2 PHE 44 -8.036 -37.507 13.653 366 2HB PHE 44 HB1 PHE 44 -9.583 -37.004 12.984 367 HD1 PHE 44 HD1 PHE 44 -7.911 -39.128 15.445 368 HD2 PHE 44 HD2 PHE 44 -11.671 -37.994 13.786 369 HE1 PHE 44 HE1 PHE 44 -9.063 -40.158 17.355 370 HE2 PHE 44 HE2 PHE 44 -12.825 -39.024 15.698 371 HZ PHE 44 HZ PHE 44 -11.523 -40.108 17.486 372 H LYS 45 HN LYS 45 -6.275 -38.938 12.146 373 HA LYS 45 HA LYS 45 -6.209 -41.762 12.981 374 1HB LYS 45 HB2 LYS 45 -5.254 -41.247 10.732 375 2HB LYS 45 HB1 LYS 45 -4.094 -40.172 11.491 376 1HG LYS 45 HG2 LYS 45 -4.230 -43.044 12.328 377 2HG LYS 45 HG1 LYS 45 -3.416 -42.604 10.829 378 1HD LYS 45 HD2 LYS 45 -2.759 -41.462 13.551 379 2HD LYS 45 HD1 LYS 45 -1.878 -42.772 12.768 380 1HE LYS 45 HE2 LYS 45 -2.173 -39.955 11.716 381 2HE LYS 45 HE1 LYS 45 -0.733 -40.632 12.475 382 1HZ LYS 45 HZ1 LYS 45 -0.519 -40.659 10.088 383 2HZ LYS 45 HZ2 LYS 45 -1.953 -41.540 9.925 384 3HZ LYS 45 HZ3 LYS 45 -0.605 -42.249 10.664 385 H LEU 46 HN LEU 46 -5.776 -41.959 15.061 386 HA LEU 46 HA LEU 46 -4.130 -39.938 16.433 387 1HB LEU 46 HB2 LEU 46 -6.404 -40.285 17.325 388 2HB LEU 46 HB1 LEU 46 -6.058 -41.990 17.549 389 HG LEU 46 HG LEU 46 -4.234 -41.310 19.168 390 1HD1 LEU 46 HD11 LEU 46 -5.573 -38.615 18.955 391 2HD1 LEU 46 HD12 LEU 46 -3.935 -39.007 18.426 392 3HD1 LEU 46 HD13 LEU 46 -4.350 -39.075 20.140 393 1HD2 LEU 46 HD21 LEU 46 -7.065 -40.522 19.858 394 2HD2 LEU 46 HD22 LEU 46 -5.783 -40.885 21.014 395 3HD2 LEU 46 HD23 LEU 46 -6.386 -42.148 19.940 396 H GLU 47 HN GLU 47 -2.133 -40.488 17.001 397 HA GLU 47 HA GLU 47 -1.501 -43.258 17.731 398 1HB GLU 47 HB2 GLU 47 -0.132 -41.650 15.576 399 2HB GLU 47 HB1 GLU 47 0.743 -42.891 16.460 400 1HG GLU 47 HG2 GLU 47 -1.793 -43.375 14.905 401 2HG GLU 47 HG1 GLU 47 -0.165 -43.650 14.286 402 H PHE 48 HN PHE 48 0.033 -43.429 19.333 403 HA PHE 48 HA PHE 48 0.871 -40.961 20.633 404 1HB PHE 48 HB2 PHE 48 -0.006 -42.785 22.027 405 2HB PHE 48 HB1 PHE 48 1.253 -43.864 21.434 406 HD1 PHE 48 HD1 PHE 48 2.950 -44.261 22.943 407 HD2 PHE 48 HD2 PHE 48 1.088 -40.429 22.915 408 HE1 PHE 48 HE1 PHE 48 4.420 -43.536 24.777 409 HE2 PHE 48 HE2 PHE 48 2.557 -39.702 24.746 410 HZ PHE 48 HZ PHE 48 4.224 -41.252 25.683 411 H LYS 49 HN LYS 49 2.660 -40.008 19.895 412 HA LYS 49 HA LYS 49 4.517 -41.388 18.222 413 1HB LYS 49 HB2 LYS 49 4.376 -38.574 19.282 414 2HB LYS 49 HB1 LYS 49 5.787 -39.137 18.394 415 1HG LYS 49 HG2 LYS 49 2.955 -39.116 17.357 416 2HG LYS 49 HG1 LYS 49 4.215 -37.949 16.946 417 1HD LYS 49 HD2 LYS 49 5.561 -39.751 15.967 418 2HD LYS 49 HD1 LYS 49 4.317 -40.924 16.395 419 1HE LYS 49 HE2 LYS 49 4.106 -40.372 14.062 420 2HE LYS 49 HE1 LYS 49 2.727 -39.710 14.932 421 1HZ LYS 49 HZ1 LYS 49 3.777 -38.214 13.236 422 2HZ LYS 49 HZ2 LYS 49 5.121 -38.100 14.252 423 3HZ LYS 49 HZ3 LYS 49 3.613 -37.544 14.778 424 H ASN 50 HN ASN 50 5.078 -39.611 21.286 425 HA ASN 50 HA ASN 50 6.906 -41.574 22.256 426 1HB ASN 50 HB2 ASN 50 8.445 -40.825 20.625 427 2HB ASN 50 HB1 ASN 50 7.990 -39.139 20.844 428 1HD2 ASN 50 HD21 ASN 50 9.790 -41.820 22.185 429 2HD2 ASN 50 HD22 ASN 50 10.772 -40.872 23.247 430 H THR 51 HN THR 51 7.322 -41.301 24.391 431 HA THR 51 HA THR 51 6.431 -38.826 25.680 432 HB THR 51 HB THR 51 5.659 -40.848 26.779 433 HG1 THR 51 HG1 THR 51 7.778 -39.924 28.416 434 1HG2 THR 51 HG21 THR 51 7.208 -42.480 27.761 435 2HG2 THR 51 HG22 THR 51 8.570 -41.626 27.038 436 3HG2 THR 51 HG23 THR 51 7.376 -42.414 26.006 437 H SER 52 HN SER 52 7.835 -37.337 26.422 438 HA SER 52 HA SER 52 10.551 -37.331 25.776 439 1HB SER 52 HB2 SER 52 9.186 -35.821 28.029 440 2HB SER 52 HB1 SER 52 10.714 -35.387 27.255 441 HG SER 52 HG SER 52 8.963 -35.642 25.314 442 H LYS 53 HN LYS 53 12.417 -37.411 27.255 443 HA LYS 53 HA LYS 53 12.554 -39.858 28.594 444 1HB LYS 53 HB2 LYS 53 14.757 -39.152 29.375 445 2HB LYS 53 HB1 LYS 53 14.529 -38.697 27.692 446 1HG LYS 53 HG2 LYS 53 14.073 -36.401 28.347 447 2HG LYS 53 HG1 LYS 53 14.224 -36.842 30.050 448 1HD LYS 53 HD2 LYS 53 16.576 -37.533 29.604 449 2HD LYS 53 HD1 LYS 53 16.400 -36.932 27.953 450 1HE LYS 53 HE2 LYS 53 17.501 -35.286 29.387 451 2HE LYS 53 HE1 LYS 53 15.946 -34.690 28.809 452 1HZ LYS 53 HZ1 LYS 53 14.963 -35.230 30.928 453 2HZ LYS 53 HZ2 LYS 53 16.307 -34.235 31.171 454 3HZ LYS 53 HZ3 LYS 53 16.418 -35.891 31.483 455 H ASN 54 HN ASN 54 11.741 -36.678 29.775 456 HA ASN 54 HA ASN 54 11.969 -37.190 32.556 457 1HB ASN 54 HB2 ASN 54 10.266 -35.170 31.064 458 2HB ASN 54 HB1 ASN 54 10.516 -35.171 32.805 459 1HD2 ASN 54 HD21 ASN 54 11.412 -33.099 32.712 460 2HD2 ASN 54 HD22 ASN 54 13.014 -32.824 32.119 461 H ALA 55 HN ALA 55 9.695 -38.155 30.215 462 HA ALA 55 HA ALA 55 7.768 -39.339 30.242 463 1HB ALA 55 HB1 ALA 55 8.959 -40.792 31.819 464 2HB ALA 55 HB2 ALA 55 7.236 -40.715 32.182 465 3HB ALA 55 HB3 ALA 55 8.386 -39.804 33.163 466 H LYS 56 HN LYS 56 8.034 -36.438 31.321 467 HA LYS 56 HA LYS 56 5.468 -36.151 32.684 468 1HB LYS 56 HB2 LYS 56 7.281 -34.825 33.575 469 2HB LYS 56 HB1 LYS 56 7.658 -34.180 31.985 470 1HG LYS 56 HG2 LYS 56 6.540 -32.495 33.283 471 2HG LYS 56 HG1 LYS 56 5.484 -33.006 31.969 472 1HD LYS 56 HD2 LYS 56 4.177 -32.770 33.981 473 2HD LYS 56 HD1 LYS 56 4.283 -34.483 33.572 474 1HE LYS 56 HE2 LYS 56 6.003 -34.809 35.252 475 2HE LYS 56 HE1 LYS 56 6.026 -33.082 35.606 476 1HZ LYS 56 HZ1 LYS 56 3.737 -33.251 36.371 477 2HZ LYS 56 HZ2 LYS 56 4.738 -34.300 37.242 478 3HZ LYS 56 HZ3 LYS 56 3.724 -34.906 36.035 479 H PHE 57 HN PHE 57 6.926 -35.741 29.563 480 HA PHE 57 HA PHE 57 4.519 -34.363 28.564 481 1HB PHE 57 HB2 PHE 57 7.310 -34.355 27.378 482 2HB PHE 57 HB1 PHE 57 5.924 -33.448 26.782 483 HD1 PHE 57 HD1 PHE 57 8.613 -33.564 29.217 484 HD2 PHE 57 HD2 PHE 57 5.027 -31.548 28.102 485 HE1 PHE 57 HE1 PHE 57 9.219 -31.679 30.676 486 HE2 PHE 57 HE2 PHE 57 5.633 -29.659 29.558 487 HZ PHE 57 HZ PHE 57 7.730 -29.724 30.848 488 H TYR 58 HN TYR 58 3.222 -35.854 27.724 489 HA TYR 58 HA TYR 58 4.326 -38.083 26.170 490 1HB TYR 58 HB2 TYR 58 1.476 -37.584 27.084 491 2HB TYR 58 HB1 TYR 58 2.091 -39.060 26.347 492 HD1 TYR 58 HD1 TYR 58 3.866 -40.390 27.622 493 HD2 TYR 58 HD2 TYR 58 1.577 -37.279 29.418 494 HE1 TYR 58 HE1 TYR 58 4.406 -41.283 29.849 495 HE2 TYR 58 HE2 TYR 58 2.112 -38.164 31.646 496 HH TYR 58 HH TYR 58 4.530 -40.473 32.183 497 H SER 59 HN SER 59 4.420 -37.882 24.017 498 HA SER 59 HA SER 59 2.940 -35.704 22.743 499 1HB SER 59 HB2 SER 59 5.151 -37.449 21.625 500 2HB SER 59 HB1 SER 59 4.486 -35.996 20.878 501 HG SER 59 HG SER 59 5.242 -35.416 23.374 502 H PHE 60 HN PHE 60 1.043 -36.165 21.903 503 HA PHE 60 HA PHE 60 0.562 -38.768 20.626 504 1HB PHE 60 HB2 PHE 60 -1.366 -36.595 21.506 505 2HB PHE 60 HB1 PHE 60 -1.844 -38.067 20.666 506 HD1 PHE 60 HD1 PHE 60 -0.765 -36.627 23.840 507 HD2 PHE 60 HD2 PHE 60 -1.740 -40.233 21.790 508 HE1 PHE 60 HE1 PHE 60 -0.970 -37.797 25.994 509 HE2 PHE 60 HE2 PHE 60 -1.942 -41.404 23.942 510 HZ PHE 60 HZ PHE 60 -1.558 -40.188 26.044 511 H ASN 61 HN ASN 61 -0.793 -38.640 18.618 512 HA ASN 61 HA ASN 61 -0.028 -36.339 16.941 513 1HB ASN 61 HB2 ASN 61 1.521 -38.323 16.651 514 2HB ASN 61 HB1 ASN 61 0.137 -39.236 16.061 515 1HD2 ASN 61 HD21 ASN 61 -0.866 -38.542 14.082 516 2HD2 ASN 61 HD22 ASN 61 0.038 -37.624 12.926 517 H VAL 62 HN VAL 62 -1.755 -35.534 15.911 518 HA VAL 62 HA VAL 62 -4.002 -37.358 15.291 519 HB VAL 62 HB VAL 62 -4.146 -34.383 15.868 520 1HG1 VAL 62 HG11 VAL 62 -6.587 -34.684 15.744 521 2HG1 VAL 62 HG12 VAL 62 -6.349 -36.360 15.250 522 3HG1 VAL 62 HG13 VAL 62 -5.799 -35.048 14.208 523 1HG2 VAL 62 HG21 VAL 62 -5.120 -36.727 17.511 524 2HG2 VAL 62 HG22 VAL 62 -5.390 -35.025 17.884 525 3HG2 VAL 62 HG23 VAL 62 -3.753 -35.681 17.899 526 H SER 63 HN SER 63 -4.107 -37.737 13.179 527 HA SER 63 HA SER 63 -3.417 -35.563 11.302 528 1HB SER 63 HB2 SER 63 -3.278 -38.546 10.760 529 2HB SER 63 HB1 SER 63 -2.722 -37.249 9.700 530 HG SER 63 HG SER 63 -1.289 -36.690 11.557 531 H MET 64 HN MET 64 -5.271 -34.693 10.572 532 HA MET 64 HA MET 64 -7.524 -36.480 9.939 533 1HB MET 64 HB2 MET 64 -9.091 -34.988 11.090 534 2HB MET 64 HB1 MET 64 -7.897 -35.629 12.208 535 1HG MET 64 HG2 MET 64 -6.625 -33.460 11.887 536 2HG MET 64 HG1 MET 64 -8.066 -32.849 11.074 537 1HE MET 64 HE1 MET 64 -10.714 -33.250 14.026 538 2HE MET 64 HE2 MET 64 -10.303 -34.444 12.793 539 3HE MET 64 HE3 MET 64 -10.512 -32.750 12.348 540 H GLU 65 HN GLU 65 -9.006 -35.671 8.422 541 HA GLU 65 HA GLU 65 -7.864 -33.962 6.430 542 1HB GLU 65 HB2 GLU 65 -10.665 -35.098 6.647 543 2HB GLU 65 HB1 GLU 65 -9.989 -34.314 5.224 544 1HG GLU 65 HG2 GLU 65 -8.285 -36.098 5.104 545 2HG GLU 65 HG1 GLU 65 -9.068 -36.899 6.464 546 H VAL 66 HN VAL 66 -7.872 -31.812 6.568 547 HA VAL 66 HA VAL 66 -10.038 -30.471 8.024 548 HB VAL 66 HB VAL 66 -8.613 -28.414 7.796 549 1HG1 VAL 66 HG11 VAL 66 -8.568 -29.745 9.840 550 2HG1 VAL 66 HG12 VAL 66 -6.969 -29.089 9.496 551 3HG1 VAL 66 HG13 VAL 66 -7.317 -30.785 9.155 552 1HG2 VAL 66 HG21 VAL 66 -6.554 -30.360 6.731 553 2HG2 VAL 66 HG22 VAL 66 -6.258 -28.674 7.152 554 3HG2 VAL 66 HG23 VAL 66 -7.332 -29.071 5.812 555 H SER 67 HN SER 67 -11.612 -29.446 6.970 556 HA SER 67 HA SER 67 -11.937 -29.784 4.193 557 1HB SER 67 HB2 SER 67 -13.448 -27.885 6.012 558 2HB SER 67 HB1 SER 67 -14.002 -28.531 4.466 559 HG SER 67 HG SER 67 -14.410 -30.428 5.366 560 H ASN 68 HN ASN 68 -10.916 -27.029 6.141 561 HA ASN 68 HA ASN 68 -9.712 -25.734 3.898 562 1HB ASN 68 HB2 ASN 68 -11.094 -23.712 3.892 563 2HB ASN 68 HB1 ASN 68 -12.074 -25.120 3.506 564 1HD2 ASN 68 HD21 ASN 68 -13.039 -22.649 4.429 565 2HD2 ASN 68 HD22 ASN 68 -13.797 -22.900 5.959 566 H GLU 69 HN GLU 69 -9.345 -23.249 4.728 567 HA GLU 69 HA GLU 69 -7.344 -23.434 6.648 568 1HB GLU 69 HB2 GLU 69 -7.565 -21.636 4.947 569 2HB GLU 69 HB1 GLU 69 -8.928 -20.978 5.839 570 1HG GLU 69 HG2 GLU 69 -6.941 -19.691 6.288 571 2HG GLU 69 HG1 GLU 69 -7.453 -20.534 7.750 572 H SER 70 HN SER 70 -10.697 -22.354 6.973 573 HA SER 70 HA SER 70 -10.690 -21.422 9.571 574 1HB SER 70 HB2 SER 70 -12.924 -22.954 8.210 575 2HB SER 70 HB1 SER 70 -13.098 -21.833 9.561 576 HG SER 70 HG SER 70 -12.323 -20.171 8.182 577 H GLU 71 HN GLU 71 -11.387 -24.758 8.478 578 HA GLU 71 HA GLU 71 -11.817 -25.873 11.010 579 1HB GLU 71 HB2 GLU 71 -10.653 -27.239 8.568 580 2HB GLU 71 HB1 GLU 71 -11.354 -28.052 9.959 581 1HG GLU 71 HG2 GLU 71 -12.832 -26.236 8.063 582 2HG GLU 71 HG1 GLU 71 -12.861 -27.994 8.026 583 H ARG 72 HN ARG 72 -8.849 -25.475 9.127 584 HA ARG 72 HA ARG 72 -7.189 -27.112 10.683 585 1HB ARG 72 HB2 ARG 72 -6.660 -26.319 8.389 586 2HB ARG 72 HB1 ARG 72 -6.382 -24.705 9.025 587 1HG ARG 72 HG2 ARG 72 -4.817 -26.873 10.295 588 2HG ARG 72 HG1 ARG 72 -4.434 -26.533 8.610 589 1HD ARG 72 HD2 ARG 72 -4.479 -24.468 10.817 590 2HD ARG 72 HD1 ARG 72 -3.026 -25.270 10.216 591 HE ARG 72 HE ARG 72 -4.750 -23.559 8.527 592 1HH1 ARG 72 HH11 ARG 72 -1.555 -24.543 9.618 593 2HH1 ARG 72 HH12 ARG 72 -0.734 -23.549 8.452 594 1HH2 ARG 72 HH21 ARG 72 -3.655 -22.275 7.019 595 2HH2 ARG 72 HH22 ARG 72 -1.915 -22.275 6.986 596 H ASN 73 HN ASN 73 -8.186 -23.787 11.110 597 HA ASN 73 HA ASN 73 -6.280 -23.351 13.277 598 1HB ASN 73 HB2 ASN 73 -8.429 -21.580 12.083 599 2HB ASN 73 HB1 ASN 73 -7.436 -21.107 13.459 600 1HD2 ASN 73 HD21 ASN 73 -7.499 -21.703 10.044 601 2HD2 ASN 73 HD22 ASN 73 -5.948 -21.033 9.690 602 H GLU 74 HN GLU 74 -9.762 -23.743 12.822 603 HA GLU 74 HA GLU 74 -10.612 -23.232 15.427 604 1HB GLU 74 HB2 GLU 74 -12.221 -23.384 13.644 605 2HB GLU 74 HB1 GLU 74 -11.772 -25.052 13.305 606 1HG GLU 74 HG2 GLU 74 -12.678 -25.779 15.415 607 2HG GLU 74 HG1 GLU 74 -13.028 -24.114 15.881 608 H ILE 75 HN ILE 75 -9.834 -26.350 13.913 609 HA ILE 75 HA ILE 75 -10.336 -28.011 16.088 610 HB ILE 75 HB ILE 75 -8.260 -28.373 13.909 611 1HG1 ILE 75 HG12 ILE 75 -11.103 -29.419 14.047 612 2HG1 ILE 75 HG11 ILE 75 -10.631 -27.983 13.147 613 1HG2 ILE 75 HG21 ILE 75 -7.860 -29.888 15.782 614 2HG2 ILE 75 HG22 ILE 75 -8.457 -30.776 14.381 615 3HG2 ILE 75 HG23 ILE 75 -9.541 -30.423 15.727 616 1HD1 ILE 75 HD11 ILE 75 -9.654 -30.782 12.645 617 2HD1 ILE 75 HD12 ILE 75 -9.189 -29.343 11.735 618 3HD1 ILE 75 HD13 ILE 75 -10.860 -29.907 11.703 619 H PHE 76 HN PHE 76 -7.422 -26.244 15.192 620 HA PHE 76 HA PHE 76 -5.644 -27.310 17.071 621 1HB PHE 76 HB2 PHE 76 -4.925 -25.883 15.199 622 2HB PHE 76 HB1 PHE 76 -5.740 -24.502 15.924 623 HD1 PHE 76 HD1 PHE 76 -4.680 -23.203 17.604 624 HD2 PHE 76 HD2 PHE 76 -2.941 -26.885 16.350 625 HE1 PHE 76 HE1 PHE 76 -2.625 -22.650 18.837 626 HE2 PHE 76 HE2 PHE 76 -0.885 -26.335 17.584 627 HZ PHE 76 HZ PHE 76 -0.727 -24.218 18.830 628 H GLN 77 HN GLN 77 -7.722 -24.433 17.280 629 HA GLN 77 HA GLN 77 -7.101 -23.680 19.912 630 1HB GLN 77 HB2 GLN 77 -9.697 -23.344 18.391 631 2HB GLN 77 HB1 GLN 77 -9.282 -22.495 19.875 632 1HG GLN 77 HG2 GLN 77 -7.462 -21.359 18.761 633 2HG GLN 77 HG1 GLN 77 -7.763 -22.272 17.280 634 1HE2 GLN 77 HE21 GLN 77 -7.826 -19.366 17.832 635 2HE2 GLN 77 HE22 GLN 77 -9.394 -18.832 17.331 636 H LYS 78 HN LYS 78 -9.371 -26.022 18.634 637 HA LYS 78 HA LYS 78 -10.789 -26.483 21.060 638 1HB LYS 78 HB2 LYS 78 -10.509 -28.118 18.529 639 2HB LYS 78 HB1 LYS 78 -11.570 -28.565 19.857 640 1HG LYS 78 HG2 LYS 78 -11.776 -25.950 18.373 641 2HG LYS 78 HG1 LYS 78 -12.683 -27.399 17.939 642 1HD LYS 78 HD2 LYS 78 -13.619 -27.413 20.270 643 2HD LYS 78 HD1 LYS 78 -12.831 -25.859 20.540 644 1HE LYS 78 HE2 LYS 78 -14.873 -26.401 18.379 645 2HE LYS 78 HE1 LYS 78 -15.236 -25.669 19.941 646 1HZ LYS 78 HZ1 LYS 78 -13.819 -23.821 19.398 647 2HZ LYS 78 HZ2 LYS 78 -14.951 -24.030 18.162 648 3HZ LYS 78 HZ3 LYS 78 -13.355 -24.538 17.940 649 H ILE 79 HN ILE 79 -7.976 -27.934 19.529 650 HA ILE 79 HA ILE 79 -7.785 -30.220 21.176 651 HB ILE 79 HB ILE 79 -5.682 -28.771 19.555 652 1HG1 ILE 79 HG12 ILE 79 -7.212 -31.343 19.054 653 2HG1 ILE 79 HG11 ILE 79 -7.514 -29.800 18.265 654 1HG2 ILE 79 HG21 ILE 79 -4.278 -30.775 19.801 655 2HG2 ILE 79 HG22 ILE 79 -5.448 -31.450 20.935 656 3HG2 ILE 79 HG23 ILE 79 -4.567 -29.980 21.349 657 1HD1 ILE 79 HD11 ILE 79 -5.002 -31.443 18.031 658 2HD1 ILE 79 HD12 ILE 79 -5.299 -29.893 17.239 659 3HD1 ILE 79 HD13 ILE 79 -6.278 -31.301 16.822 660 H SER 80 HN SER 80 -6.745 -26.908 21.619 661 HA SER 80 HA SER 80 -5.026 -27.582 23.851 662 1HB SER 80 HB2 SER 80 -4.801 -25.058 23.999 663 2HB SER 80 HB1 SER 80 -4.265 -25.793 22.489 664 HG SER 80 HG SER 80 -6.101 -23.907 22.838 665 H GLN 81 HN GLN 81 -8.210 -27.709 23.681 666 HA GLN 81 HA GLN 81 -8.853 -26.159 26.073 667 1HB GLN 81 HB2 GLN 81 -10.595 -27.842 24.263 668 2HB GLN 81 HB1 GLN 81 -11.183 -26.940 25.652 669 1HG GLN 81 HG2 GLN 81 -10.496 -24.848 24.598 670 2HG GLN 81 HG1 GLN 81 -9.875 -25.744 23.211 671 1HE2 GLN 81 HE21 GLN 81 -12.067 -27.668 23.246 672 2HE2 GLN 81 HE22 GLN 81 -13.457 -26.842 22.638 673 H LEU 82 HN LEU 82 -7.517 -29.133 25.576 674 HA LEU 82 HA LEU 82 -9.200 -30.839 27.099 675 1HB LEU 82 HB2 LEU 82 -6.238 -31.333 26.948 676 2HB LEU 82 HB1 LEU 82 -7.559 -32.480 26.945 677 HG LEU 82 HG LEU 82 -6.884 -30.655 24.643 678 1HD1 LEU 82 HD11 LEU 82 -6.081 -32.677 23.521 679 2HD1 LEU 82 HD12 LEU 82 -6.336 -33.599 25.005 680 3HD1 LEU 82 HD13 LEU 82 -5.138 -32.305 24.963 681 1HD2 LEU 82 HD21 LEU 82 -8.850 -32.934 24.846 682 2HD2 LEU 82 HD22 LEU 82 -8.460 -32.033 23.381 683 3HD2 LEU 82 HD23 LEU 82 -9.248 -31.218 24.731 684 H ASP 83 HN ASP 83 -6.862 -28.474 28.008 685 HA ASP 83 HA ASP 83 -6.135 -27.686 30.010 686 1HB ASP 83 HB2 ASP 83 -8.338 -27.917 30.946 687 2HB ASP 83 HB1 ASP 83 -8.145 -29.656 31.128 688 H LYS 84 HN LYS 84 -6.342 -31.175 29.736 689 HA LYS 84 HA LYS 84 -4.095 -31.848 31.320 690 1HB LYS 84 HB2 LYS 84 -5.358 -33.312 28.990 691 2HB LYS 84 HB1 LYS 84 -4.274 -34.018 30.182 692 1HG LYS 84 HG2 LYS 84 -5.875 -33.955 31.868 693 2HG LYS 84 HG1 LYS 84 -6.842 -32.733 31.037 694 1HD LYS 84 HD2 LYS 84 -7.600 -34.312 29.420 695 2HD LYS 84 HD1 LYS 84 -6.449 -35.524 29.967 696 1HE LYS 84 HE2 LYS 84 -7.620 -35.656 32.123 697 2HE LYS 84 HE1 LYS 84 -8.761 -34.427 31.577 698 1HZ LYS 84 HZ1 LYS 84 -8.398 -37.129 30.396 699 2HZ LYS 84 HZ2 LYS 84 -9.464 -35.951 29.816 700 3HZ LYS 84 HZ3 LYS 84 -9.697 -36.617 31.349 701 H VAL 85 HN VAL 85 -4.467 -30.549 28.169 702 HA VAL 85 HA VAL 85 -1.990 -31.524 27.090 703 HB VAL 85 HB VAL 85 -3.868 -31.056 25.594 704 1HG1 VAL 85 HG11 VAL 85 -4.867 -29.188 26.830 705 2HG1 VAL 85 HG12 VAL 85 -4.615 -28.784 25.133 706 3HG1 VAL 85 HG13 VAL 85 -3.517 -28.154 26.360 707 1HG2 VAL 85 HG21 VAL 85 -1.532 -29.203 25.104 708 2HG2 VAL 85 HG22 VAL 85 -2.671 -29.775 23.885 709 3HG2 VAL 85 HG23 VAL 85 -1.600 -30.918 24.696 710 H VAL 86 HN VAL 86 -0.054 -30.507 27.016 711 HA VAL 86 HA VAL 86 0.198 -28.079 28.658 712 HB VAL 86 HB VAL 86 1.352 -30.086 29.518 713 1HG1 VAL 86 HG11 VAL 86 3.314 -30.986 28.365 714 2HG1 VAL 86 HG12 VAL 86 2.997 -29.924 26.993 715 3HG1 VAL 86 HG13 VAL 86 1.847 -31.195 27.410 716 1HG2 VAL 86 HG21 VAL 86 3.533 -29.056 29.914 717 2HG2 VAL 86 HG22 VAL 86 2.231 -27.873 30.052 718 3HG2 VAL 86 HG23 VAL 86 3.238 -27.911 28.604 719 H GLN 87 HN GLN 87 0.795 -29.410 25.495 720 HA GLN 87 HA GLN 87 1.488 -26.800 24.486 721 1HB GLN 87 HB2 GLN 87 3.673 -27.613 25.305 722 2HB GLN 87 HB1 GLN 87 3.516 -29.043 24.296 723 1HG GLN 87 HG2 GLN 87 5.021 -27.351 23.336 724 2HG GLN 87 HG1 GLN 87 3.646 -27.711 22.293 725 1HE2 GLN 87 HE21 GLN 87 2.188 -26.110 21.821 726 2HE2 GLN 87 HE22 GLN 87 2.393 -24.461 22.300 727 H THR 88 HN THR 88 0.450 -26.601 22.627 728 HA THR 88 HA THR 88 -0.064 -28.991 20.975 729 HB THR 88 HB THR 88 -1.848 -27.500 19.920 730 HG1 THR 88 HG1 THR 88 -1.184 -25.484 20.642 731 1HG2 THR 88 HG21 THR 88 -2.409 -29.263 21.546 732 2HG2 THR 88 HG22 THR 88 -3.465 -27.859 21.720 733 3HG2 THR 88 HG23 THR 88 -2.150 -28.121 22.866 734 H LEU 89 HN LEU 89 0.945 -29.125 19.050 735 HA LEU 89 HA LEU 89 2.046 -26.657 17.855 736 1HB LEU 89 HB2 LEU 89 3.067 -29.493 17.547 737 2HB LEU 89 HB1 LEU 89 3.722 -28.087 16.735 738 HG LEU 89 HG LEU 89 5.216 -28.581 18.490 739 1HD1 LEU 89 HD11 LEU 89 4.729 -26.204 18.271 740 2HD1 LEU 89 HD12 LEU 89 5.127 -26.628 19.935 741 3HD1 LEU 89 HD13 LEU 89 3.448 -26.346 19.476 742 1HD2 LEU 89 HD21 LEU 89 2.866 -28.711 20.380 743 2HD2 LEU 89 HD22 LEU 89 4.564 -28.885 20.824 744 3HD2 LEU 89 HD23 LEU 89 3.799 -30.084 19.782 745 H GLY 90 HN GLY 90 1.214 -26.093 15.943 746 1HA GLY 90 HA2 GLY 90 -0.610 -27.959 14.596 747 2HA GLY 90 HA1 GLY 90 -0.509 -26.224 14.325 748 H SER 91 HN SER 91 2.149 -25.855 13.849 749 HA SER 91 HA SER 91 2.927 -27.672 11.712 750 1HB SER 91 HB2 SER 91 3.453 -25.425 10.428 751 2HB SER 91 HB1 SER 91 1.845 -26.137 10.349 752 HG SER 91 HG SER 91 2.690 -24.064 12.101
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