NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
601524 | 2n1l | 25565 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 H1 SER 4 HN SER 4 -16.632 0.152 -7.747 2 HA SER 4 HA SER 4 -14.812 0.910 -9.925 3 HB2 SER 4 HB2 SER 4 -16.851 2.316 -9.618 4 HB3 SER 4 HB1 SER 4 -16.320 2.685 -7.980 5 HG SER 4 HG SER 4 -15.453 3.687 -10.393 6 H ASP 5 HN ASP 5 -12.964 2.265 -9.283 7 HA ASP 5 HA ASP 5 -11.600 1.059 -7.055 8 HB2 ASP 5 HB2 ASP 5 -10.702 3.234 -8.960 9 HB3 ASP 5 HB1 ASP 5 -9.670 2.416 -7.794 10 H VAL 6 HN VAL 6 -13.330 1.984 -5.617 11 HA VAL 6 HA VAL 6 -13.075 4.785 -4.949 12 HB VAL 6 HB VAL 6 -14.686 2.635 -3.560 13 HG11 VAL 6 HG11 VAL 6 -14.944 5.637 -3.474 14 HG12 VAL 6 HG12 VAL 6 -14.367 4.601 -2.168 15 HG13 VAL 6 HG13 VAL 6 -16.042 4.489 -2.707 16 HG21 VAL 6 HG21 VAL 6 -16.599 3.453 -4.851 17 HG22 VAL 6 HG22 VAL 6 -15.334 2.804 -5.896 18 HG23 VAL 6 HG23 VAL 6 -15.532 4.549 -5.728 19 H PHE 7 HN PHE 7 -11.392 2.067 -4.256 20 HA PHE 7 HA PHE 7 -10.325 1.115 -2.495 21 HB2 PHE 7 HB2 PHE 7 -8.690 2.750 -1.360 22 HB3 PHE 7 HB1 PHE 7 -8.524 2.447 -3.079 23 HD1 PHE 7 HD2 PHE 7 -9.635 4.884 -0.555 24 HD2 PHE 7 HD1 PHE 7 -8.742 4.217 -4.657 25 HE1 PHE 7 HE2 PHE 7 -9.719 7.306 -0.963 26 HE2 PHE 7 HE1 PHE 7 -8.835 6.638 -5.074 27 HZ PHE 7 HZ PHE 7 -9.204 8.186 -3.243 28 H GLU 8 HN GLU 8 -12.216 0.599 -1.435 29 HA GLU 8 HA GLU 8 -13.676 0.384 0.256 30 HB2 GLU 8 HB2 GLU 8 -12.947 0.590 2.467 31 HB3 GLU 8 HB1 GLU 8 -11.498 0.202 1.559 32 HG2 GLU 8 HG2 GLU 8 -10.875 2.578 1.658 33 HG3 GLU 8 HG1 GLU 8 -12.341 2.875 2.592 34 H PHE 9 HN PHE 9 -15.007 1.591 1.982 35 HA PHE 9 HA PHE 9 -15.633 4.186 0.763 36 HB2 PHE 9 HB2 PHE 9 -17.456 2.402 2.384 37 HB3 PHE 9 HB1 PHE 9 -17.918 3.879 1.547 38 HD1 PHE 9 HD1 PHE 9 -17.819 3.934 -0.961 39 HD2 PHE 9 HD2 PHE 9 -17.399 0.334 1.267 40 HE1 PHE 9 HE1 PHE 9 -18.326 2.631 -2.982 41 HE2 PHE 9 HE2 PHE 9 -17.905 -0.977 -0.752 42 HZ PHE 9 HZ PHE 9 -18.369 0.169 -2.877 43 H GLU 10 HN GLU 10 -13.801 3.296 2.960 44 HA GLU 10 HA GLU 10 -13.124 3.840 5.063 45 HB2 GLU 10 HB2 GLU 10 -14.050 6.523 4.024 46 HB3 GLU 10 HB1 GLU 10 -12.947 6.280 5.375 47 HG2 GLU 10 HG2 GLU 10 -11.283 5.348 3.978 48 HG3 GLU 10 HG1 GLU 10 -12.400 5.212 2.625 49 H PHE 11 HN PHE 11 -15.126 2.543 5.680 50 HA PHE 11 HA PHE 11 -16.837 3.108 7.565 51 HB2 PHE 11 HB2 PHE 11 -17.414 5.277 6.300 52 HB3 PHE 11 HB1 PHE 11 -18.189 4.252 5.096 53 HD1 PHE 11 HD2 PHE 11 -18.234 5.035 8.737 54 HD2 PHE 11 HD1 PHE 11 -20.401 3.632 5.355 55 HE1 PHE 11 HE2 PHE 11 -20.302 5.032 10.069 56 HE2 PHE 11 HE1 PHE 11 -22.472 3.625 6.682 57 HZ PHE 11 HZ PHE 11 -22.418 4.347 9.053 58 H SER 12 HN SER 12 -15.711 1.076 6.392 59 HA SER 12 HA SER 12 -17.834 -0.580 5.326 60 HB2 SER 12 HB2 SER 12 -15.919 -1.426 3.698 61 HB3 SER 12 HB1 SER 12 -16.998 -0.108 3.243 62 HG SER 12 HG SER 12 -14.414 0.169 4.414 63 H GLU 13 HN GLU 13 -16.476 -0.162 7.751 64 HA GLU 13 HA GLU 13 -14.942 -0.906 9.208 65 HB2 GLU 13 HB2 GLU 13 -16.357 -3.451 8.490 66 HB3 GLU 13 HB1 GLU 13 -15.381 -3.243 9.927 67 HG2 GLU 13 HG2 GLU 13 -17.561 -2.983 10.680 68 HG3 GLU 13 HG1 GLU 13 -16.976 -1.331 10.505 69 H THR 14 HN THR 14 -12.999 -0.524 8.175 70 HA THR 14 HA THR 14 -11.775 -2.753 6.793 71 HB THR 14 HB THR 14 -11.210 -1.242 4.852 72 HG1 THR 14 HG1 THR 14 -11.697 0.803 5.271 73 HG21 THR 14 HG21 THR 14 -14.219 -1.551 5.118 74 HG22 THR 14 HG22 THR 14 -13.132 -2.934 4.865 75 HG23 THR 14 HG23 THR 14 -13.212 -1.652 3.658 76 HA PRO 15 HA PRO 15 -8.669 -0.828 9.250 77 HB2 PRO 15 HB2 PRO 15 -7.099 -3.121 9.126 78 HB3 PRO 15 HB1 PRO 15 -8.400 -2.813 10.267 79 HG2 PRO 15 HG2 PRO 15 -8.431 -4.821 8.331 80 HG3 PRO 15 HG1 PRO 15 -9.868 -4.152 9.138 81 HD2 PRO 15 HD2 PRO 15 -8.673 -3.381 6.493 82 HD3 PRO 15 HD1 PRO 15 -10.372 -3.696 6.905 83 H LEU 16 HN LEU 16 -7.439 0.754 8.367 84 HA LEU 16 HA LEU 16 -5.434 0.042 6.381 85 HB2 LEU 16 HB2 LEU 16 -6.210 2.696 7.543 86 HB3 LEU 16 HB1 LEU 16 -4.903 2.486 6.403 87 HG LEU 16 HG LEU 16 -6.687 3.256 5.113 88 HD11 LEU 16 HD11 LEU 16 -7.294 1.392 3.664 89 HD12 LEU 16 HD12 LEU 16 -6.747 0.252 4.894 90 HD13 LEU 16 HD13 LEU 16 -5.590 1.331 4.114 91 HD21 LEU 16 HD21 LEU 16 -8.447 3.026 6.764 92 HD22 LEU 16 HD22 LEU 16 -8.465 1.279 6.530 93 HD23 LEU 16 HD23 LEU 16 -8.957 2.350 5.218 94 H LEU 17 HN LEU 17 -4.376 -1.346 7.946 95 HA LEU 17 HA LEU 17 -2.987 -0.170 10.155 96 HB2 LEU 17 HB2 LEU 17 -2.616 -2.807 8.726 97 HB3 LEU 17 HB1 LEU 17 -1.750 -2.347 10.181 98 HG LEU 17 HG LEU 17 -4.745 -2.689 9.960 99 HD11 LEU 17 HD11 LEU 17 -3.654 -4.825 9.838 100 HD12 LEU 17 HD12 LEU 17 -4.360 -4.633 11.442 101 HD13 LEU 17 HD13 LEU 17 -2.624 -4.423 11.212 102 HD21 LEU 17 HD21 LEU 17 -2.994 -2.092 12.344 103 HD22 LEU 17 HD22 LEU 17 -4.718 -2.455 12.403 104 HD23 LEU 17 HD23 LEU 17 -4.153 -0.993 11.597 105 HA PRO 18 HA PRO 18 0.031 2.205 8.192 106 HB2 PRO 18 HB2 PRO 18 2.189 1.211 9.797 107 HB3 PRO 18 HB1 PRO 18 1.339 2.751 9.901 108 HG2 PRO 18 HG2 PRO 18 0.976 0.309 11.488 109 HG3 PRO 18 HG1 PRO 18 0.490 1.969 11.857 110 HD2 PRO 18 HD2 PRO 18 -1.280 0.010 11.223 111 HD3 PRO 18 HD1 PRO 18 -1.560 1.722 10.845 112 H SER 19 HN SER 19 0.438 1.606 6.245 113 HA SER 19 HA SER 19 1.757 -0.899 5.623 114 HB2 SER 19 HB2 SER 19 0.675 1.256 3.798 115 HB3 SER 19 HB1 SER 19 1.182 -0.359 3.306 116 HG SER 19 HG SER 19 -0.593 -0.548 5.312 117 H TYR 20 HN TYR 20 3.497 -0.821 3.916 118 HA TYR 20 HA TYR 20 5.465 1.119 4.857 119 HB2 TYR 20 HB2 TYR 20 5.819 -1.544 3.474 120 HB3 TYR 20 HB1 TYR 20 7.145 -0.469 3.914 121 HD1 TYR 20 HD2 TYR 20 7.407 0.133 6.394 122 HD2 TYR 20 HD1 TYR 20 4.963 -3.068 5.024 123 HE1 TYR 20 HE2 TYR 20 7.487 -0.880 8.632 124 HE2 TYR 20 HE1 TYR 20 5.037 -4.091 7.259 125 HH TYR 20 HH TYR 20 6.515 -4.061 9.244 126 H ASN 21 HN ASN 21 5.971 2.753 3.684 127 HA ASN 21 HA ASN 21 6.396 2.535 0.841 128 HB2 ASN 21 HB2 ASN 21 3.931 3.124 1.144 129 HB3 ASN 21 HB1 ASN 21 4.485 4.668 1.783 130 HD21 ASN 21 HD21 ASN 21 5.354 6.193 0.385 131 HD22 ASN 21 HD22 ASN 21 5.296 6.022 -1.334 132 H ILE 22 HN ILE 22 6.913 5.141 0.205 133 HA ILE 22 HA ILE 22 8.911 5.900 2.108 134 HB ILE 22 HB ILE 22 10.292 5.528 -0.405 135 HG12 ILE 22 HG12 ILE 22 10.661 3.073 -0.047 136 HG13 ILE 22 HG11 ILE 22 9.316 3.091 1.090 137 HG21 ILE 22 HG21 ILE 22 10.894 4.641 2.411 138 HG22 ILE 22 HG22 ILE 22 11.350 6.186 1.694 139 HG23 ILE 22 HG23 ILE 22 12.035 4.688 1.066 140 HD11 ILE 22 HD11 ILE 22 9.254 3.663 -1.842 141 HD12 ILE 22 HD12 ILE 22 7.942 4.042 -0.710 142 HD13 ILE 22 HD13 ILE 22 8.447 2.353 -0.954 143 H GLN 23 HN GLN 23 10.479 7.617 0.955 144 HA GLN 23 HA GLN 23 8.821 9.824 0.611 145 HB2 GLN 23 HB2 GLN 23 10.832 11.074 -0.004 146 HB3 GLN 23 HB1 GLN 23 11.134 10.033 1.376 147 HG2 GLN 23 HG2 GLN 23 11.868 9.247 -1.430 148 HG3 GLN 23 HG1 GLN 23 12.947 10.167 -0.385 149 HE21 GLN 23 HE21 GLN 23 13.142 7.444 -1.559 150 HE22 GLN 23 HE22 GLN 23 13.440 6.397 -0.215 151 H VAL 24 HN VAL 24 7.645 10.413 -0.938 152 HA VAL 24 HA VAL 24 7.795 9.179 -3.551 153 HB VAL 24 HB VAL 24 5.767 10.715 -2.033 154 HG11 VAL 24 HG11 VAL 24 5.287 9.654 -4.801 155 HG12 VAL 24 HG12 VAL 24 5.548 11.358 -4.430 156 HG13 VAL 24 HG13 VAL 24 4.128 10.518 -3.764 157 HG21 VAL 24 HG21 VAL 24 6.228 8.371 -1.519 158 HG22 VAL 24 HG22 VAL 24 5.718 7.941 -3.151 159 HG23 VAL 24 HG23 VAL 24 4.565 8.656 -2.022 160 H SER 25 HN SER 25 6.784 12.417 -2.603 161 HA SER 25 HA SER 25 8.944 13.692 -4.023 162 HB2 SER 25 HB2 SER 25 6.073 14.094 -4.930 163 HB3 SER 25 HB1 SER 25 7.467 15.000 -5.515 164 HG SER 25 HG SER 25 8.046 12.435 -5.781 165 H VAL 26 HN VAL 26 9.472 15.489 -2.870 166 HA VAL 26 HA VAL 26 7.717 16.075 -0.620 167 HB VAL 26 HB VAL 26 9.618 17.403 0.260 168 HG11 VAL 26 HG11 VAL 26 11.015 15.487 0.796 169 HG12 VAL 26 HG12 VAL 26 10.318 14.585 -0.548 170 HG13 VAL 26 HG13 VAL 26 9.311 15.036 0.825 171 HG21 VAL 26 HG21 VAL 26 11.054 16.375 -2.186 172 HG22 VAL 26 HG22 VAL 26 11.811 17.199 -0.825 173 HG23 VAL 26 HG23 VAL 26 10.655 18.057 -1.843 174 H ALA 27 HN ALA 27 8.383 17.407 -3.669 175 HA ALA 27 HA ALA 27 7.860 20.156 -2.991 176 HB1 ALA 27 HB1 ALA 27 7.686 20.491 -5.417 177 HB2 ALA 27 HB2 ALA 27 7.745 18.746 -5.662 178 HB3 ALA 27 HB3 ALA 27 9.143 19.591 -4.997 179 H GLN 28 HN GLN 28 6.126 17.398 -4.149 180 HA GLN 28 HA GLN 28 3.585 18.770 -4.342 181 HB2 GLN 28 HB2 GLN 28 4.695 16.094 -5.019 182 HB3 GLN 28 HB1 GLN 28 2.948 16.234 -4.800 183 HG2 GLN 28 HG2 GLN 28 3.511 16.429 -7.135 184 HG3 GLN 28 HG1 GLN 28 2.895 17.969 -6.545 185 HE21 GLN 28 HE21 GLN 28 4.247 19.735 -6.475 186 HE22 GLN 28 HE22 GLN 28 5.813 19.747 -7.210 187 H GLY 29 HN GLY 29 5.027 16.106 -2.540 188 HA2 GLY 29 HA2 GLY 29 4.329 16.231 -0.069 189 HA3 GLY 29 HA1 GLY 29 2.710 16.053 -0.751 190 HA PRO 30 HA PRO 30 5.201 11.989 -0.476 191 HB2 PRO 30 HB2 PRO 30 4.621 11.050 1.998 192 HB3 PRO 30 HB1 PRO 30 6.017 12.077 1.663 193 HG2 PRO 30 HG2 PRO 30 3.382 12.793 2.863 194 HG3 PRO 30 HG1 PRO 30 5.000 13.385 3.273 195 HD2 PRO 30 HD2 PRO 30 3.189 14.763 1.734 196 HD3 PRO 30 HD1 PRO 30 4.944 14.994 1.653 197 H ARG 31 HN ARG 31 4.078 10.545 -1.606 198 HA ARG 31 HA ARG 31 1.356 9.912 -0.901 199 HB2 ARG 31 HB2 ARG 31 3.047 9.211 -3.231 200 HB3 ARG 31 HB1 ARG 31 1.562 8.341 -2.915 201 HG2 ARG 31 HG2 ARG 31 0.746 9.971 -4.277 202 HG3 ARG 31 HG1 ARG 31 0.629 10.743 -2.708 203 HD2 ARG 31 HD2 ARG 31 2.732 11.884 -3.075 204 HD3 ARG 31 HD1 ARG 31 2.807 11.183 -4.696 205 HE ARG 31 HE ARG 31 1.173 12.639 -5.408 206 HH11 ARG 31 HH11 ARG 31 1.525 12.877 -1.931 207 HH12 ARG 31 HH12 ARG 31 0.615 14.345 -1.813 208 HH21 ARG 31 HH21 ARG 31 -0.012 14.580 -5.252 209 HH22 ARG 31 HH22 ARG 31 -0.260 15.316 -3.702 210 H ASN 32 HN ASN 32 0.890 7.407 -1.131 211 HA ASN 32 HA ASN 32 2.993 5.759 -0.006 212 HB2 ASN 32 HB2 ASN 32 0.876 6.924 1.612 213 HB3 ASN 32 HB1 ASN 32 0.829 5.170 1.656 214 HD21 ASN 32 HD21 ASN 32 3.875 6.829 1.196 215 HD22 ASN 32 HD22 ASN 32 4.489 6.531 2.788 216 H TRP 33 HN TRP 33 2.894 4.117 -1.426 217 HA TRP 33 HA TRP 33 0.242 3.076 -2.192 218 HB2 TRP 33 HB2 TRP 33 2.964 2.113 -3.144 219 HB3 TRP 33 HB1 TRP 33 1.395 1.779 -3.865 220 HD1 TRP 33 HD1 TRP 33 4.280 4.046 -4.222 221 HE1 TRP 33 HE1 TRP 33 3.711 6.014 -5.789 222 HE3 TRP 33 HE3 TRP 33 -0.795 3.466 -4.431 223 HZ2 TRP 33 HZ2 TRP 33 1.407 7.157 -6.952 224 HZ3 TRP 33 HZ3 TRP 33 -2.108 5.038 -5.792 225 HH2 TRP 33 HH2 TRP 33 -1.027 6.844 -7.025 226 H LEU 34 HN LEU 34 -0.529 1.301 -1.199 227 HA LEU 34 HA LEU 34 1.044 0.440 1.089 228 HB2 LEU 34 HB2 LEU 34 -1.765 -0.438 0.534 229 HB3 LEU 34 HB1 LEU 34 -0.971 -0.176 2.076 230 HG LEU 34 HG LEU 34 -1.759 2.038 0.186 231 HD11 LEU 34 HD11 LEU 34 -3.520 2.471 1.918 232 HD12 LEU 34 HD12 LEU 34 -3.141 0.888 2.598 233 HD13 LEU 34 HD13 LEU 34 -3.759 1.015 0.948 234 HD21 LEU 34 HD21 LEU 34 0.168 2.398 1.812 235 HD22 LEU 34 HD22 LEU 34 -1.028 2.230 3.096 236 HD23 LEU 34 HD23 LEU 34 -1.179 3.551 1.916 237 H LEU 35 HN LEU 35 2.368 -1.229 0.721 238 HA LEU 35 HA LEU 35 2.286 -3.155 -1.265 239 HB2 LEU 35 HB2 LEU 35 3.870 -2.600 0.889 240 HB3 LEU 35 HB1 LEU 35 3.119 -4.090 1.417 241 HG LEU 35 HG LEU 35 3.911 -5.120 -0.754 242 HD11 LEU 35 HD11 LEU 35 6.071 -3.686 -1.449 243 HD12 LEU 35 HD12 LEU 35 4.962 -2.383 -0.988 244 HD13 LEU 35 HD13 LEU 35 4.502 -3.539 -2.241 245 HD21 LEU 35 HD21 LEU 35 5.984 -4.087 1.177 246 HD22 LEU 35 HD22 LEU 35 6.193 -5.440 0.067 247 HD23 LEU 35 HD23 LEU 35 5.016 -5.546 1.376 248 H LEU 36 HN LEU 36 0.712 -4.330 -1.780 249 HA LEU 36 HA LEU 36 -1.363 -5.288 -0.175 250 HB2 LEU 36 HB2 LEU 36 -1.398 -5.100 -2.610 251 HB3 LEU 36 HB1 LEU 36 -0.225 -6.394 -2.708 252 HG LEU 36 HG LEU 36 -2.696 -6.874 -3.230 253 HD11 LEU 36 HD11 LEU 36 -0.978 -8.607 -3.036 254 HD12 LEU 36 HD12 LEU 36 -2.516 -9.133 -2.355 255 HD13 LEU 36 HD13 LEU 36 -1.206 -8.631 -1.287 256 HD21 LEU 36 HD21 LEU 36 -3.029 -7.483 -0.408 257 HD22 LEU 36 HD22 LEU 36 -4.199 -6.870 -1.575 258 HD23 LEU 36 HD23 LEU 36 -3.048 -5.766 -0.796 259 H SER 37 HN SER 37 1.823 -6.481 -0.881 260 HA SER 37 HA SER 37 1.576 -9.064 0.210 261 HB2 SER 37 HB2 SER 37 3.496 -8.293 -1.191 262 HB3 SER 37 HB1 SER 37 4.040 -7.298 0.158 263 HG SER 37 HG SER 37 4.069 -10.082 -0.148 264 H ASP 38 HN ASP 38 2.008 -5.901 1.622 265 HA ASP 38 HA ASP 38 2.676 -6.855 4.241 266 HB2 ASP 38 HB2 ASP 38 3.367 -4.611 3.519 267 HB3 ASP 38 HB1 ASP 38 1.677 -4.142 3.333 268 H VAL 39 HN VAL 39 -0.253 -5.311 2.862 269 HA VAL 39 HA VAL 39 -1.855 -5.700 5.110 270 HB VAL 39 HB VAL 39 -3.800 -5.515 3.507 271 HG11 VAL 39 HG11 VAL 39 -1.628 -3.407 3.484 272 HG12 VAL 39 HG12 VAL 39 -2.907 -3.579 4.688 273 HG13 VAL 39 HG13 VAL 39 -3.311 -3.129 3.031 274 HG21 VAL 39 HG21 VAL 39 -3.375 -4.958 1.257 275 HG22 VAL 39 HG22 VAL 39 -2.488 -6.446 1.611 276 HG23 VAL 39 HG23 VAL 39 -1.637 -4.911 1.533 277 H LEU 40 HN LEU 40 -1.346 -7.782 2.322 278 HA LEU 40 HA LEU 40 -3.410 -9.576 3.027 279 HB2 LEU 40 HB2 LEU 40 -1.355 -9.383 0.942 280 HB3 LEU 40 HB1 LEU 40 -1.811 -11.018 1.397 281 HG LEU 40 HG LEU 40 -3.112 -9.733 -0.493 282 HD11 LEU 40 HD11 LEU 40 -3.578 -12.013 0.189 283 HD12 LEU 40 HD12 LEU 40 -5.091 -11.111 0.085 284 HD13 LEU 40 HD13 LEU 40 -4.368 -11.441 1.657 285 HD21 LEU 40 HD21 LEU 40 -4.746 -9.075 1.918 286 HD22 LEU 40 HD22 LEU 40 -4.960 -8.518 0.261 287 HD23 LEU 40 HD23 LEU 40 -3.613 -7.910 1.234 288 H LYS 41 HN LYS 41 -0.007 -9.477 3.852 289 HA LYS 41 HA LYS 41 0.050 -12.013 5.120 290 HB2 LYS 41 HB2 LYS 41 1.729 -9.530 5.434 291 HB3 LYS 41 HB1 LYS 41 1.983 -10.946 6.446 292 HG2 LYS 41 HG2 LYS 41 2.102 -10.951 3.437 293 HG3 LYS 41 HG1 LYS 41 3.502 -10.819 4.500 294 HD2 LYS 41 HD2 LYS 41 1.568 -13.135 4.508 295 HD3 LYS 41 HD1 LYS 41 3.100 -13.119 3.636 296 HE2 LYS 41 HE2 LYS 41 4.267 -12.733 5.790 297 HE3 LYS 41 HE1 LYS 41 2.719 -12.887 6.619 298 HZ1 LYS 41 HZ1 LYS 41 4.055 -14.989 5.004 299 HZ2 LYS 41 HZ2 LYS 41 2.534 -15.142 5.722 300 HZ3 LYS 41 HZ3 LYS 41 3.908 -14.962 6.687 301 H LYS 42 HN LYS 42 -1.410 -9.053 5.919 302 HA LYS 42 HA LYS 42 -1.421 -9.367 8.777 303 HB2 LYS 42 HB2 LYS 42 -3.067 -7.607 6.959 304 HB3 LYS 42 HB1 LYS 42 -3.072 -7.520 8.707 305 HG2 LYS 42 HG2 LYS 42 -0.689 -6.933 8.678 306 HG3 LYS 42 HG1 LYS 42 -0.704 -7.019 6.916 307 HD2 LYS 42 HD2 LYS 42 -2.619 -5.277 7.101 308 HD3 LYS 42 HD1 LYS 42 -1.986 -5.011 8.726 309 HE2 LYS 42 HE2 LYS 42 -0.476 -4.727 6.130 310 HE3 LYS 42 HE1 LYS 42 -1.001 -3.424 7.195 311 HZ1 LYS 42 HZ1 LYS 42 1.377 -4.042 7.401 312 HZ2 LYS 42 HZ2 LYS 42 0.901 -5.546 8.020 313 HZ3 LYS 42 HZ3 LYS 42 0.518 -4.129 8.857 314 H LEU 43 HN LEU 43 -3.652 -9.849 6.126 315 HA LEU 43 HA LEU 43 -5.863 -10.831 7.589 316 HB2 LEU 43 HB2 LEU 43 -5.032 -11.684 4.836 317 HB3 LEU 43 HB1 LEU 43 -6.660 -11.693 5.498 318 HG LEU 43 HG LEU 43 -5.004 -9.310 4.802 319 HD11 LEU 43 HD11 LEU 43 -5.869 -10.549 2.856 320 HD12 LEU 43 HD12 LEU 43 -6.673 -8.988 3.014 321 HD13 LEU 43 HD13 LEU 43 -7.499 -10.461 3.521 322 HD21 LEU 43 HD21 LEU 43 -6.426 -8.819 6.713 323 HD22 LEU 43 HD22 LEU 43 -7.828 -9.460 5.857 324 HD23 LEU 43 HD23 LEU 43 -7.035 -7.995 5.278 325 H LYS 44 HN LYS 44 -3.040 -12.126 6.184 326 HA LYS 44 HA LYS 44 -1.872 -14.051 6.396 327 HB2 LYS 44 HB2 LYS 44 -3.800 -14.678 8.643 328 HB3 LYS 44 HB1 LYS 44 -2.350 -15.601 8.276 329 HG2 LYS 44 HG2 LYS 44 -0.972 -13.658 8.789 330 HG3 LYS 44 HG1 LYS 44 -2.424 -12.714 9.130 331 HD2 LYS 44 HD2 LYS 44 -1.559 -15.200 10.611 332 HD3 LYS 44 HD1 LYS 44 -1.358 -13.544 11.186 333 HE2 LYS 44 HE2 LYS 44 -3.793 -13.249 11.153 334 HE3 LYS 44 HE1 LYS 44 -3.983 -14.908 10.598 335 HZ1 LYS 44 HZ1 LYS 44 -2.784 -14.087 13.185 336 HZ2 LYS 44 HZ2 LYS 44 -2.982 -15.679 12.650 337 HZ3 LYS 44 HZ3 LYS 44 -4.337 -14.723 12.975 338 H MET 45 HN MET 45 -4.297 -13.763 4.721 339 HA MET 45 HA MET 45 -5.014 -16.599 4.459 340 HB2 MET 45 HB2 MET 45 -6.839 -14.198 4.190 341 HB3 MET 45 HB1 MET 45 -7.276 -15.837 3.722 342 HG2 MET 45 HG2 MET 45 -7.043 -16.611 5.990 343 HG3 MET 45 HG1 MET 45 -6.469 -15.028 6.504 344 HE1 MET 45 HE1 MET 45 -9.601 -12.815 6.447 345 HE2 MET 45 HE2 MET 45 -8.308 -12.904 5.252 346 HE3 MET 45 HE3 MET 45 -7.927 -12.997 6.971 347 H SER 46 HN SER 46 -6.456 -16.568 2.223 348 HA SER 46 HA SER 46 -4.458 -16.407 0.223 349 HB2 SER 46 HB2 SER 46 -6.191 -18.100 0.099 350 HB3 SER 46 HB1 SER 46 -7.449 -16.868 0.045 351 HG SER 46 HG SER 46 -6.351 -17.971 -1.996 352 H SER 47 HN SER 47 -4.446 -15.141 -1.669 353 HA SER 47 HA SER 47 -4.835 -12.396 -1.285 354 HB2 SER 47 HB2 SER 47 -4.491 -13.884 -3.894 355 HB3 SER 47 HB1 SER 47 -4.184 -12.170 -3.625 356 HG SER 47 HG SER 47 -2.332 -13.725 -3.525 357 H ARG 48 HN ARG 48 -6.983 -14.851 -2.276 358 HA ARG 48 HA ARG 48 -8.809 -13.134 -3.664 359 HB2 ARG 48 HB2 ARG 48 -8.623 -15.548 -4.135 360 HB3 ARG 48 HB1 ARG 48 -9.263 -15.879 -2.541 361 HG2 ARG 48 HG2 ARG 48 -10.973 -16.106 -4.274 362 HG3 ARG 48 HG1 ARG 48 -11.369 -14.831 -3.123 363 HD2 ARG 48 HD2 ARG 48 -11.839 -14.135 -5.417 364 HD3 ARG 48 HD1 ARG 48 -10.572 -13.147 -4.694 365 HE ARG 48 HE ARG 48 -9.374 -15.273 -6.072 366 HH11 ARG 48 HH11 ARG 48 -11.239 -12.398 -6.779 367 HH12 ARG 48 HH12 ARG 48 -10.478 -12.136 -8.316 368 HH21 ARG 48 HH21 ARG 48 -8.364 -14.915 -8.087 369 HH22 ARG 48 HH22 ARG 48 -8.834 -13.548 -9.049 370 H ILE 49 HN ILE 49 -8.218 -13.925 -0.366 371 HA ILE 49 HA ILE 49 -10.915 -13.549 0.530 372 HB ILE 49 HB ILE 49 -8.355 -13.404 2.156 373 HG12 ILE 49 HG12 ILE 49 -8.395 -15.568 1.201 374 HG13 ILE 49 HG11 ILE 49 -9.086 -15.763 2.802 375 HG21 ILE 49 HG21 ILE 49 -10.236 -12.388 3.308 376 HG22 ILE 49 HG22 ILE 49 -9.843 -13.939 4.051 377 HG23 ILE 49 HG23 ILE 49 -11.236 -13.804 2.980 378 HD11 ILE 49 HD11 ILE 49 -10.273 -16.218 0.203 379 HD12 ILE 49 HD12 ILE 49 -11.259 -15.236 1.279 380 HD13 ILE 49 HD13 ILE 49 -10.735 -16.839 1.793 381 H PHE 50 HN PHE 50 -8.054 -11.670 0.187 382 HA PHE 50 HA PHE 50 -8.814 -9.243 1.279 383 HB2 PHE 50 HB2 PHE 50 -6.587 -9.602 0.362 384 HB3 PHE 50 HB1 PHE 50 -7.250 -9.707 -1.266 385 HD1 PHE 50 HD2 PHE 50 -7.098 -7.377 1.642 386 HD2 PHE 50 HD1 PHE 50 -7.294 -7.823 -2.587 387 HE1 PHE 50 HE2 PHE 50 -6.842 -4.945 1.375 388 HE2 PHE 50 HE1 PHE 50 -7.037 -5.394 -2.859 389 HZ PHE 50 HZ PHE 50 -6.816 -3.949 -0.858 390 H ARG 51 HN ARG 51 -9.181 -10.091 -2.187 391 HA ARG 51 HA ARG 51 -10.783 -7.818 -2.700 392 HB2 ARG 51 HB2 ARG 51 -9.403 -9.168 -4.376 393 HB3 ARG 51 HB1 ARG 51 -10.770 -10.273 -4.436 394 HG2 ARG 51 HG2 ARG 51 -12.216 -8.563 -5.255 395 HG3 ARG 51 HG1 ARG 51 -10.993 -7.322 -4.986 396 HD2 ARG 51 HD2 ARG 51 -9.553 -8.473 -6.656 397 HD3 ARG 51 HD1 ARG 51 -10.889 -9.573 -6.990 398 HE ARG 51 HE ARG 51 -11.712 -6.867 -7.249 399 HH11 ARG 51 HH11 ARG 51 -9.884 -9.358 -8.902 400 HH12 ARG 51 HH12 ARG 51 -10.175 -8.695 -10.480 401 HH21 ARG 51 HH21 ARG 51 -12.082 -5.995 -9.324 402 HH22 ARG 51 HH22 ARG 51 -11.420 -6.790 -10.720 403 H SER 52 HN SER 52 -11.593 -11.106 -1.789 404 HA SER 52 HA SER 52 -14.366 -10.946 -2.315 405 HB2 SER 52 HB2 SER 52 -13.293 -13.078 -1.958 406 HB3 SER 52 HB1 SER 52 -12.824 -12.618 -0.324 407 HG SER 52 HG SER 52 -14.625 -13.769 -0.017 408 H ASN 53 HN ASN 53 -12.365 -9.828 0.292 409 HA ASN 53 HA ASN 53 -14.627 -9.245 2.035 410 HB2 ASN 53 HB2 ASN 53 -12.205 -10.082 2.671 411 HB3 ASN 53 HB1 ASN 53 -11.818 -8.371 2.583 412 HD21 ASN 53 HD21 ASN 53 -11.773 -10.149 4.843 413 HD22 ASN 53 HD22 ASN 53 -12.835 -9.479 6.023 414 H PHE 54 HN PHE 54 -12.025 -7.569 0.347 415 HA PHE 54 HA PHE 54 -13.550 -5.066 0.493 416 HB2 PHE 54 HB2 PHE 54 -10.563 -5.205 0.134 417 HB3 PHE 54 HB1 PHE 54 -11.537 -3.855 0.698 418 HD1 PHE 54 HD1 PHE 54 -12.629 -4.054 2.993 419 HD2 PHE 54 HD2 PHE 54 -9.557 -6.668 1.639 420 HE1 PHE 54 HE1 PHE 54 -12.150 -4.694 5.321 421 HE2 PHE 54 HE2 PHE 54 -9.073 -7.311 3.962 422 HZ PHE 54 HZ PHE 54 -10.371 -6.324 5.807 423 HA PRO 55 HA PRO 55 -13.028 -6.203 -4.024 424 HB2 PRO 55 HB2 PRO 55 -15.593 -5.773 -4.738 425 HB3 PRO 55 HB1 PRO 55 -15.046 -7.323 -4.093 426 HG2 PRO 55 HG2 PRO 55 -16.465 -5.087 -2.700 427 HG3 PRO 55 HG1 PRO 55 -16.749 -6.833 -2.588 428 HD2 PRO 55 HD2 PRO 55 -15.347 -5.446 -0.723 429 HD3 PRO 55 HD1 PRO 55 -15.019 -7.146 -1.105 430 H ASN 56 HN ASN 56 -13.679 -3.713 -2.061 431 HA ASN 56 HA ASN 56 -14.206 -1.625 -3.985 432 HB2 ASN 56 HB2 ASN 56 -13.671 -0.321 -1.680 433 HB3 ASN 56 HB1 ASN 56 -15.248 -1.015 -2.045 434 HD21 ASN 56 HD21 ASN 56 -12.243 -1.513 -0.279 435 HD22 ASN 56 HD22 ASN 56 -12.863 -2.714 0.804 436 H VAL 57 HN VAL 57 -11.561 -3.362 -3.349 437 HA VAL 57 HA VAL 57 -9.749 -1.112 -3.884 438 HB VAL 57 HB VAL 57 -9.044 -3.404 -2.035 439 HG11 VAL 57 HG11 VAL 57 -7.142 -1.948 -1.409 440 HG12 VAL 57 HG12 VAL 57 -7.645 -0.799 -2.649 441 HG13 VAL 57 HG13 VAL 57 -7.114 -2.416 -3.109 442 HG21 VAL 57 HG21 VAL 57 -9.844 -0.595 -1.286 443 HG22 VAL 57 HG22 VAL 57 -9.208 -1.811 -0.179 444 HG23 VAL 57 HG23 VAL 57 -10.764 -2.066 -0.968 445 H GLU 58 HN GLU 58 -7.750 -1.842 -4.965 446 HA GLU 58 HA GLU 58 -7.613 -4.454 -6.009 447 HB2 GLU 58 HB2 GLU 58 -8.729 -2.289 -7.517 448 HB3 GLU 58 HB1 GLU 58 -7.262 -2.917 -8.289 449 HG2 GLU 58 HG2 GLU 58 -8.058 -5.026 -8.410 450 HG3 GLU 58 HG1 GLU 58 -9.200 -4.740 -7.111 451 H ILE 59 HN ILE 59 -5.807 -4.719 -7.454 452 HA ILE 59 HA ILE 59 -3.581 -3.769 -5.816 453 HB ILE 59 HB ILE 59 -3.195 -6.022 -7.704 454 HG12 ILE 59 HG12 ILE 59 -5.407 -6.579 -6.870 455 HG13 ILE 59 HG11 ILE 59 -4.225 -7.622 -6.091 456 HG21 ILE 59 HG21 ILE 59 -2.404 -5.510 -4.845 457 HG22 ILE 59 HG22 ILE 59 -1.387 -5.323 -6.273 458 HG23 ILE 59 HG23 ILE 59 -1.938 -6.926 -5.785 459 HD11 ILE 59 HD11 ILE 59 -5.675 -5.263 -4.910 460 HD12 ILE 59 HD12 ILE 59 -4.298 -6.060 -4.128 461 HD13 ILE 59 HD13 ILE 59 -5.781 -6.966 -4.437 462 H VAL 60 HN VAL 60 -1.544 -3.374 -6.690 463 HA VAL 60 HA VAL 60 -1.254 -3.037 -9.574 464 HB VAL 60 HB VAL 60 -1.911 -0.816 -8.486 465 HG11 VAL 60 HG11 VAL 60 0.719 -1.321 -7.170 466 HG12 VAL 60 HG12 VAL 60 -0.805 -0.779 -6.451 467 HG13 VAL 60 HG13 VAL 60 0.144 0.328 -7.444 468 HG21 VAL 60 HG21 VAL 60 -0.336 0.484 -9.782 469 HG22 VAL 60 HG22 VAL 60 -0.812 -0.961 -10.676 470 HG23 VAL 60 HG23 VAL 60 0.757 -0.897 -9.875 471 H THR 61 HN THR 61 1.133 -2.633 -10.015 472 HA THR 61 HA THR 61 2.908 -3.509 -7.872 473 HB THR 61 HB THR 61 4.062 -4.846 -9.834 474 HG1 THR 61 HG1 THR 61 1.420 -4.537 -10.598 475 HG21 THR 61 HG21 THR 61 3.355 -6.822 -8.797 476 HG22 THR 61 HG22 THR 61 1.827 -6.083 -8.281 477 HG23 THR 61 HG23 THR 61 3.348 -5.582 -7.531 478 H ILE 62 HN ILE 62 4.613 -2.507 -7.749 479 HA ILE 62 HA ILE 62 5.744 -1.296 -10.122 480 HB ILE 62 HB ILE 62 7.217 -0.019 -8.561 481 HG12 ILE 62 HG12 ILE 62 6.373 0.005 -6.108 482 HG13 ILE 62 HG11 ILE 62 5.674 -1.564 -6.488 483 HG21 ILE 62 HG21 ILE 62 4.807 0.659 -9.251 484 HG22 ILE 62 HG22 ILE 62 5.640 1.568 -7.991 485 HG23 ILE 62 HG23 ILE 62 4.435 0.348 -7.545 486 HD11 ILE 62 HD11 ILE 62 7.830 -2.407 -7.054 487 HD12 ILE 62 HD12 ILE 62 7.809 -1.805 -5.388 488 HD13 ILE 62 HD13 ILE 62 8.556 -0.837 -6.689 489 H ALA 63 HN ALA 63 8.213 -1.728 -10.321 490 HA ALA 63 HA ALA 63 8.730 -4.516 -10.024 491 HB1 ALA 63 HB1 ALA 63 10.871 -4.121 -10.933 492 HB2 ALA 63 HB2 ALA 63 10.764 -2.394 -10.587 493 HB3 ALA 63 HB3 ALA 63 9.704 -3.125 -11.802 494 H GLU 64 HN GLU 64 10.092 -5.667 -8.599 495 HA GLU 64 HA GLU 64 10.251 -4.942 -5.976 496 HB2 GLU 64 HB2 GLU 64 11.652 -6.894 -7.664 497 HB3 GLU 64 HB1 GLU 64 12.471 -6.479 -6.164 498 HG2 GLU 64 HG2 GLU 64 10.501 -7.038 -4.919 499 HG3 GLU 64 HG1 GLU 64 9.633 -7.444 -6.388 500 H ALA 65 HN ALA 65 12.748 -4.569 -8.355 501 HA ALA 65 HA ALA 65 14.750 -3.327 -6.955 502 HB1 ALA 65 HB1 ALA 65 13.866 -2.724 -9.765 503 HB2 ALA 65 HB2 ALA 65 14.975 -4.000 -9.261 504 HB3 ALA 65 HB3 ALA 65 15.433 -2.308 -9.071 505 H GLU 66 HN GLU 66 11.708 -1.957 -7.978 506 HA GLU 66 HA GLU 66 12.372 0.802 -7.767 507 HB2 GLU 66 HB2 GLU 66 9.837 -0.755 -7.759 508 HB3 GLU 66 HB1 GLU 66 9.810 0.982 -7.541 509 HG2 GLU 66 HG2 GLU 66 10.886 -0.511 -9.911 510 HG3 GLU 66 HG1 GLU 66 9.305 0.265 -9.781 511 H PHE 67 HN PHE 67 10.282 -1.223 -5.714 512 HA PHE 67 HA PHE 67 9.936 0.705 -3.718 513 HB2 PHE 67 HB2 PHE 67 8.364 -1.091 -3.860 514 HB3 PHE 67 HB1 PHE 67 9.601 -2.304 -3.644 515 HD1 PHE 67 HD1 PHE 67 7.579 0.276 -1.989 516 HD2 PHE 67 HD2 PHE 67 10.373 -2.889 -1.457 517 HE1 PHE 67 HE1 PHE 67 7.132 0.293 0.429 518 HE2 PHE 67 HE2 PHE 67 9.931 -2.878 0.963 519 HZ PHE 67 HZ PHE 67 8.238 -1.309 1.896 520 H TYR 68 HN TYR 68 12.266 -1.924 -4.050 521 HA TYR 68 HA TYR 68 13.449 -1.728 -1.517 522 HB2 TYR 68 HB2 TYR 68 13.903 -3.625 -2.953 523 HB3 TYR 68 HB1 TYR 68 14.645 -2.581 -4.161 524 HD1 TYR 68 HD2 TYR 68 15.061 -3.965 -0.752 525 HD2 TYR 68 HD1 TYR 68 16.927 -1.952 -3.999 526 HE1 TYR 68 HE2 TYR 68 17.251 -4.303 0.307 527 HE2 TYR 68 HE1 TYR 68 19.122 -2.280 -2.946 528 HH TYR 68 HH TYR 68 20.126 -2.757 -0.886 529 H ARG 69 HN ARG 69 14.106 0.039 -4.517 530 HA ARG 69 HA ARG 69 16.550 1.159 -3.876 531 HB2 ARG 69 HB2 ARG 69 15.569 1.137 -6.096 532 HB3 ARG 69 HB1 ARG 69 14.280 2.202 -5.565 533 HG2 ARG 69 HG2 ARG 69 15.844 3.439 -6.811 534 HG3 ARG 69 HG1 ARG 69 15.964 3.952 -5.135 535 HD2 ARG 69 HD2 ARG 69 17.923 2.468 -4.876 536 HD3 ARG 69 HD1 ARG 69 17.821 2.069 -6.589 537 HE ARG 69 HE ARG 69 17.956 4.854 -6.334 538 HH11 ARG 69 HH11 ARG 69 19.974 2.031 -5.861 539 HH12 ARG 69 HH12 ARG 69 21.458 2.897 -6.098 540 HH21 ARG 69 HH21 ARG 69 19.905 5.988 -6.669 541 HH22 ARG 69 HH22 ARG 69 21.419 5.150 -6.554 542 H GLN 70 HN GLN 70 13.277 2.435 -3.279 543 HA GLN 70 HA GLN 70 14.196 4.898 -2.222 544 HB2 GLN 70 HB2 GLN 70 11.551 3.968 -1.366 545 HB3 GLN 70 HB1 GLN 70 12.019 5.449 -2.146 546 HG2 GLN 70 HG2 GLN 70 11.719 2.849 -3.583 547 HG3 GLN 70 HG1 GLN 70 10.436 4.036 -3.413 548 HE21 GLN 70 HE21 GLN 70 10.235 4.415 -5.585 549 HE22 GLN 70 HE22 GLN 70 11.425 5.267 -6.508 550 H VAL 71 HN VAL 71 13.070 1.864 -0.804 551 HA VAL 71 HA VAL 71 12.928 2.827 1.865 552 HB VAL 71 HB VAL 71 13.258 -0.044 1.029 553 HG11 VAL 71 HG11 VAL 71 11.934 1.251 3.413 554 HG12 VAL 71 HG12 VAL 71 13.452 0.351 3.423 555 HG13 VAL 71 HG13 VAL 71 11.936 -0.476 3.060 556 HG21 VAL 71 HG21 VAL 71 11.526 0.984 -0.298 557 HG22 VAL 71 HG22 VAL 71 10.780 1.632 1.165 558 HG23 VAL 71 HG23 VAL 71 10.817 -0.112 0.897 559 H SER 72 HN SER 72 15.235 0.806 0.129 560 HA SER 72 HA SER 72 17.066 0.388 2.195 561 HB2 SER 72 HB2 SER 72 17.111 -0.831 0.052 562 HB3 SER 72 HB1 SER 72 17.638 0.637 -0.769 563 HG SER 72 HG SER 72 19.210 0.005 1.379 564 H ALA 73 HN ALA 73 16.500 3.188 0.211 565 HA ALA 73 HA ALA 73 19.006 4.460 0.866 566 HB1 ALA 73 HB1 ALA 73 16.541 5.527 -0.510 567 HB2 ALA 73 HB2 ALA 73 17.993 4.898 -1.292 568 HB3 ALA 73 HB3 ALA 73 18.072 6.388 -0.350 569 H SER 74 HN SER 74 15.744 4.384 2.084 570 HA SER 74 HA SER 74 16.064 6.780 3.650 571 HB2 SER 74 HB2 SER 74 13.811 6.197 4.557 572 HB3 SER 74 HB1 SER 74 13.850 6.297 2.797 573 HG SER 74 HG SER 74 14.422 3.784 3.600 574 H LEU 75 HN LEU 75 16.942 3.586 3.936 575 HA LEU 75 HA LEU 75 16.669 3.361 6.792 576 HB2 LEU 75 HB2 LEU 75 17.980 1.616 4.724 577 HB3 LEU 75 HB1 LEU 75 17.969 1.230 6.435 578 HG LEU 75 HG LEU 75 15.628 1.357 4.547 579 HD11 LEU 75 HD11 LEU 75 16.807 -0.724 4.496 580 HD12 LEU 75 HD12 LEU 75 15.293 -0.958 5.373 581 HD13 LEU 75 HD13 LEU 75 16.811 -0.822 6.258 582 HD21 LEU 75 HD21 LEU 75 15.588 1.159 7.555 583 HD22 LEU 75 HD22 LEU 75 14.210 0.836 6.505 584 HD23 LEU 75 HD23 LEU 75 14.908 2.453 6.567 585 H LEU 76 HN LEU 76 18.274 5.547 5.711 586 HA LEU 76 HA LEU 76 20.905 4.977 6.820 587 HB2 LEU 76 HB2 LEU 76 20.647 6.451 4.830 588 HB3 LEU 76 HB1 LEU 76 19.721 7.572 5.809 589 HG LEU 76 HG LEU 76 21.721 7.923 7.240 590 HD11 LEU 76 HD11 LEU 76 23.090 6.226 5.160 591 HD12 LEU 76 HD12 LEU 76 22.855 5.815 6.858 592 HD13 LEU 76 HD13 LEU 76 23.904 7.161 6.415 593 HD21 LEU 76 HD21 LEU 76 21.218 9.466 5.431 594 HD22 LEU 76 HD22 LEU 76 22.107 8.450 4.296 595 HD23 LEU 76 HD23 LEU 76 22.960 9.265 5.606 596 H PHE 77 HN PHE 77 17.967 6.772 7.472 597 HA PHE 77 HA PHE 77 18.817 7.543 10.132 598 HB2 PHE 77 HB2 PHE 77 17.441 9.131 8.987 599 HB3 PHE 77 HB1 PHE 77 16.250 7.903 8.579 600 HD1 PHE 77 HD1 PHE 77 17.737 9.736 11.445 601 HD2 PHE 77 HD2 PHE 77 14.419 7.525 9.959 602 HE1 PHE 77 HE1 PHE 77 16.446 10.321 13.457 603 HE2 PHE 77 HE2 PHE 77 13.127 8.105 11.968 604 HZ PHE 77 HZ PHE 77 14.140 9.506 13.720 605 H SER 78 HN SER 78 16.143 5.623 8.776 606 HA SER 78 HA SER 78 15.716 4.363 11.354 607 HB2 SER 78 HB2 SER 78 13.805 3.259 10.031 608 HB3 SER 78 HB1 SER 78 13.708 5.003 10.282 609 HG SER 78 HG SER 78 13.288 4.305 8.092 610 H SER 79 HN SER 79 15.114 1.902 11.114 611 HA SER 79 HA SER 79 17.056 0.570 9.372 612 HB2 SER 79 HB2 SER 79 18.040 0.792 11.647 613 HB3 SER 79 HB1 SER 79 16.658 -0.086 12.304 614 HG SER 79 HG SER 79 17.859 -1.767 11.923 615 H SER 80 HN SER 80 16.121 -0.971 8.228 616 HA SER 80 HA SER 80 13.945 -2.526 9.389 617 HB2 SER 80 HB2 SER 80 12.878 -0.676 8.111 618 HB3 SER 80 HB1 SER 80 13.736 -1.207 6.668 619 HG SER 80 HG SER 80 11.804 -2.185 6.520 620 H LYS 81 HN LYS 81 15.218 -4.304 9.474 621 HA LYS 81 HA LYS 81 16.783 -5.126 7.229 622 HB2 LYS 81 HB2 LYS 81 16.369 -6.243 9.946 623 HB3 LYS 81 HB1 LYS 81 17.088 -7.243 8.687 624 HG2 LYS 81 HG2 LYS 81 18.107 -4.609 9.729 625 HG3 LYS 81 HG1 LYS 81 18.853 -6.196 9.914 626 HD2 LYS 81 HD2 LYS 81 20.096 -5.518 8.140 627 HD3 LYS 81 HD1 LYS 81 18.692 -6.065 7.219 628 HE2 LYS 81 HE2 LYS 81 17.876 -3.843 6.958 629 HE3 LYS 81 HE1 LYS 81 18.975 -3.225 8.194 630 HZ1 LYS 81 HZ1 LYS 81 19.693 -2.667 5.955 631 HZ2 LYS 81 HZ2 LYS 81 19.788 -4.306 5.553 632 HZ3 LYS 81 HZ3 LYS 81 20.825 -3.662 6.719 633 H ASP 82 HN ASP 82 13.579 -5.453 8.016 634 HA ASP 82 HA ASP 82 12.893 -7.892 6.845 635 HB2 ASP 82 HB2 ASP 82 11.423 -5.266 6.789 636 HB3 ASP 82 HB1 ASP 82 10.711 -6.823 6.398 637 H LEU 83 HN LEU 83 14.464 -5.336 5.570 638 HA LEU 83 HA LEU 83 13.568 -5.247 2.901 639 HB2 LEU 83 HB2 LEU 83 15.907 -4.243 4.434 640 HB3 LEU 83 HB1 LEU 83 16.068 -4.344 2.684 641 HG LEU 83 HG LEU 83 15.224 -2.134 3.807 642 HD11 LEU 83 HD11 LEU 83 15.446 -2.391 1.436 643 HD12 LEU 83 HD12 LEU 83 13.877 -1.666 1.781 644 HD13 LEU 83 HD13 LEU 83 13.983 -3.375 1.361 645 HD21 LEU 83 HD21 LEU 83 12.879 -1.933 4.101 646 HD22 LEU 83 HD22 LEU 83 13.356 -3.370 5.014 647 HD23 LEU 83 HD23 LEU 83 12.583 -3.539 3.434 648 H GLU 84 HN GLU 84 15.418 -7.545 4.612 649 HA GLU 84 HA GLU 84 16.965 -8.790 2.716 650 HB2 GLU 84 HB2 GLU 84 15.111 -9.989 4.765 651 HB3 GLU 84 HB1 GLU 84 16.275 -10.922 3.850 652 HG2 GLU 84 HG2 GLU 84 18.076 -9.520 4.804 653 HG3 GLU 84 HG1 GLU 84 16.865 -8.701 5.785 654 H ALA 85 HN ALA 85 13.493 -8.742 2.986 655 HA ALA 85 HA ALA 85 12.862 -10.808 1.236 656 HB1 ALA 85 HB1 ALA 85 11.386 -9.637 2.911 657 HB2 ALA 85 HB2 ALA 85 10.649 -10.020 1.356 658 HB3 ALA 85 HB3 ALA 85 11.176 -8.370 1.701 659 H PHE 86 HN PHE 86 13.538 -7.410 0.659 660 HA PHE 86 HA PHE 86 12.732 -7.689 -2.146 661 HB2 PHE 86 HB2 PHE 86 13.543 -5.135 -0.762 662 HB3 PHE 86 HB1 PHE 86 12.584 -5.321 -2.229 663 HD1 PHE 86 HD2 PHE 86 10.232 -5.969 -2.103 664 HD2 PHE 86 HD1 PHE 86 12.579 -5.439 1.395 665 HE1 PHE 86 HE2 PHE 86 8.185 -5.947 -0.735 666 HE2 PHE 86 HE1 PHE 86 10.553 -5.424 2.775 667 HZ PHE 86 HZ PHE 86 8.341 -5.673 1.709 668 H ASN 87 HN ASN 87 14.158 -7.206 -3.839 669 HA ASN 87 HA ASN 87 16.961 -6.755 -3.228 670 HB2 ASN 87 HB2 ASN 87 16.427 -9.245 -2.938 671 HB3 ASN 87 HB1 ASN 87 16.150 -9.280 -4.674 672 HD21 ASN 87 HD21 ASN 87 18.107 -10.691 -3.085 673 HD22 ASN 87 HD22 ASN 87 19.653 -10.254 -3.719 674 HA PRO 88 HA PRO 88 16.285 -4.865 -7.221 675 HB2 PRO 88 HB2 PRO 88 18.682 -3.697 -7.529 676 HB3 PRO 88 HB1 PRO 88 17.514 -3.113 -6.335 677 HG2 PRO 88 HG2 PRO 88 19.906 -4.872 -5.941 678 HG3 PRO 88 HG1 PRO 88 19.354 -3.502 -4.960 679 HD2 PRO 88 HD2 PRO 88 18.875 -6.117 -4.315 680 HD3 PRO 88 HD1 PRO 88 17.818 -4.777 -3.827 681 H GLU 89 HN GLU 89 18.284 -7.491 -6.616 682 HA GLU 89 HA GLU 89 19.124 -7.716 -9.400 683 HB2 GLU 89 HB2 GLU 89 20.458 -9.540 -8.757 684 HB3 GLU 89 HB1 GLU 89 20.590 -8.381 -7.443 685 HG2 GLU 89 HG2 GLU 89 19.105 -9.619 -6.082 686 HG3 GLU 89 HG1 GLU 89 18.673 -10.657 -7.438 687 H SER 90 HN SER 90 16.365 -7.643 -8.512 688 HA SER 90 HA SER 90 15.315 -9.851 -9.993 689 HB2 SER 90 HB2 SER 90 13.942 -10.681 -7.976 690 HB3 SER 90 HB1 SER 90 15.625 -11.195 -8.089 691 HG SER 90 HG SER 90 14.857 -8.891 -6.633 692 H LYS 91 HN LYS 91 13.293 -9.538 -10.629 693 HA LYS 91 HA LYS 91 11.852 -7.228 -9.534 694 HB2 LYS 91 HB2 LYS 91 12.292 -7.950 -12.430 695 HB3 LYS 91 HB1 LYS 91 10.998 -6.879 -11.909 696 HG2 LYS 91 HG2 LYS 91 12.632 -5.340 -10.969 697 HG3 LYS 91 HG1 LYS 91 13.939 -6.422 -11.451 698 HD2 LYS 91 HD2 LYS 91 13.596 -4.512 -13.006 699 HD3 LYS 91 HD1 LYS 91 13.430 -6.088 -13.778 700 HE2 LYS 91 HE2 LYS 91 11.040 -5.916 -13.759 701 HE3 LYS 91 HE1 LYS 91 11.099 -4.458 -12.777 702 HZ1 LYS 91 HZ1 LYS 91 10.688 -3.970 -15.112 703 HZ2 LYS 91 HZ2 LYS 91 12.149 -4.702 -15.544 704 HZ3 LYS 91 HZ3 LYS 91 12.152 -3.296 -14.602 705 H GLU 92 HN GLU 92 11.294 -9.540 -8.447 706 HA GLU 92 HA GLU 92 9.403 -11.057 -10.022 707 HB2 GLU 92 HB2 GLU 92 10.230 -11.324 -7.131 708 HB3 GLU 92 HB1 GLU 92 9.168 -12.445 -7.970 709 HG2 GLU 92 HG2 GLU 92 10.942 -13.052 -9.490 710 HG3 GLU 92 HG1 GLU 92 12.007 -11.852 -8.763 711 H LEU 93 HN LEU 93 9.008 -8.387 -9.452 712 HA LEU 93 HA LEU 93 7.716 -6.763 -8.591 713 HB2 LEU 93 HB2 LEU 93 5.689 -8.796 -9.429 714 HB3 LEU 93 HB1 LEU 93 5.310 -7.130 -9.026 715 HG LEU 93 HG LEU 93 6.906 -8.161 -11.357 716 HD11 LEU 93 HD11 LEU 93 5.215 -6.529 -12.452 717 HD12 LEU 93 HD12 LEU 93 4.331 -6.716 -10.926 718 HD13 LEU 93 HD13 LEU 93 4.686 -8.127 -11.930 719 HD21 LEU 93 HD21 LEU 93 8.243 -6.339 -10.624 720 HD22 LEU 93 HD22 LEU 93 6.825 -5.371 -10.217 721 HD23 LEU 93 HD23 LEU 93 7.222 -5.691 -11.908 722 H LEU 94 HN LEU 94 6.177 -5.976 -7.200 723 HA LEU 94 HA LEU 94 6.087 -7.384 -4.620 724 HB2 LEU 94 HB2 LEU 94 5.166 -4.566 -5.054 725 HB3 LEU 94 HB1 LEU 94 5.759 -5.297 -3.589 726 HG LEU 94 HG LEU 94 7.185 -3.509 -4.628 727 HD11 LEU 94 HD11 LEU 94 8.660 -4.304 -3.295 728 HD12 LEU 94 HD12 LEU 94 9.229 -5.298 -4.624 729 HD13 LEU 94 HD13 LEU 94 8.061 -5.962 -3.499 730 HD21 LEU 94 HD21 LEU 94 7.982 -5.562 -6.469 731 HD22 LEU 94 HD22 LEU 94 8.622 -3.950 -6.367 732 HD23 LEU 94 HD23 LEU 94 6.958 -4.229 -6.903 733 H ASP 95 HN ASP 95 3.924 -5.727 -3.757 734 HA ASP 95 HA ASP 95 2.021 -5.525 -5.826 735 HB2 ASP 95 HB2 ASP 95 1.316 -7.200 -3.369 736 HB3 ASP 95 HB1 ASP 95 0.138 -6.408 -4.414 737 H LEU 96 HN LEU 96 0.584 -3.909 -5.401 738 HA LEU 96 HA LEU 96 0.790 -2.614 -2.784 739 HB2 LEU 96 HB2 LEU 96 1.203 -1.226 -5.426 740 HB3 LEU 96 HB1 LEU 96 1.059 -0.417 -3.865 741 HG LEU 96 HG LEU 96 3.208 -2.468 -4.260 742 HD11 LEU 96 HD11 LEU 96 3.400 0.407 -5.087 743 HD12 LEU 96 HD12 LEU 96 3.250 -0.966 -6.184 744 HD13 LEU 96 HD13 LEU 96 4.685 -0.811 -5.167 745 HD21 LEU 96 HD21 LEU 96 4.338 -1.127 -2.616 746 HD22 LEU 96 HD22 LEU 96 2.703 -1.472 -2.043 747 HD23 LEU 96 HD23 LEU 96 3.090 0.115 -2.716 748 H VAL 97 HN VAL 97 -0.981 -1.305 -2.292 749 HA VAL 97 HA VAL 97 -3.172 -1.312 -4.222 750 HB VAL 97 HB VAL 97 -4.832 -1.721 -2.486 751 HG11 VAL 97 HG11 VAL 97 -4.417 -4.095 -2.086 752 HG12 VAL 97 HG12 VAL 97 -2.743 -3.876 -2.590 753 HG13 VAL 97 HG13 VAL 97 -4.048 -3.630 -3.747 754 HG21 VAL 97 HG21 VAL 97 -4.211 -2.447 -0.260 755 HG22 VAL 97 HG22 VAL 97 -3.587 -0.828 -0.621 756 HG23 VAL 97 HG23 VAL 97 -2.500 -2.232 -0.648 757 H GLU 98 HN GLU 98 -4.535 0.393 -4.065 758 HA GLU 98 HA GLU 98 -3.112 2.806 -3.458 759 HB2 GLU 98 HB2 GLU 98 -4.463 2.512 -5.526 760 HB3 GLU 98 HB1 GLU 98 -5.918 2.428 -4.546 761 HG2 GLU 98 HG2 GLU 98 -5.704 4.696 -3.885 762 HG3 GLU 98 HG1 GLU 98 -4.080 4.804 -4.568 763 H PHE 99 HN PHE 99 -3.159 3.945 -1.930 764 HA PHE 99 HA PHE 99 -4.457 3.337 0.465 765 HB2 PHE 99 HB2 PHE 99 -3.206 5.156 1.277 766 HB3 PHE 99 HB1 PHE 99 -2.216 4.258 0.185 767 HD1 PHE 99 HD1 PHE 99 -3.837 5.762 -2.239 768 HD2 PHE 99 HD2 PHE 99 -1.535 6.853 1.151 769 HE1 PHE 99 HE1 PHE 99 -3.190 7.848 -3.374 770 HE2 PHE 99 HE2 PHE 99 -0.885 8.964 0.031 771 HZ PHE 99 HZ PHE 99 -1.714 9.457 -2.235 772 H THR 100 HN THR 100 -5.632 5.042 1.763 773 HA THR 100 HA THR 100 -7.996 5.575 0.145 774 HB THR 100 HB THR 100 -9.259 5.600 2.182 775 HG1 THR 100 HG1 THR 100 -7.965 5.243 4.204 776 HG21 THR 100 HG21 THR 100 -8.778 3.389 3.061 777 HG22 THR 100 HG22 THR 100 -7.145 3.453 2.394 778 HG23 THR 100 HG23 THR 100 -8.540 3.393 1.312 779 H ASN 101 HN ASN 101 -9.395 7.519 1.094 780 HA ASN 101 HA ASN 101 -7.956 9.894 0.543 781 HB2 ASN 101 HB2 ASN 101 -10.672 9.549 1.836 782 HB3 ASN 101 HB1 ASN 101 -10.002 11.090 1.312 783 HD21 ASN 101 HD21 ASN 101 -11.621 8.234 0.391 784 HD22 ASN 101 HD22 ASN 101 -11.770 8.593 -1.302 785 H GLU 102 HN GLU 102 -9.196 8.479 3.553 786 HA GLU 102 HA GLU 102 -8.237 10.175 5.495 787 HB2 GLU 102 HB2 GLU 102 -9.384 7.987 5.919 788 HB3 GLU 102 HB1 GLU 102 -7.881 7.172 5.463 789 HG2 GLU 102 HG2 GLU 102 -6.723 8.105 7.349 790 HG3 GLU 102 HG1 GLU 102 -8.119 9.101 7.763 791 H ILE 103 HN ILE 103 -6.491 7.705 3.767 792 HA ILE 103 HA ILE 103 -4.092 8.049 5.263 793 HB ILE 103 HB ILE 103 -4.802 6.467 2.811 794 HG12 ILE 103 HG12 ILE 103 -5.913 6.123 5.097 795 HG13 ILE 103 HG11 ILE 103 -5.269 4.708 4.308 796 HG21 ILE 103 HG21 ILE 103 -2.311 6.322 4.496 797 HG22 ILE 103 HG22 ILE 103 -2.424 6.879 2.824 798 HG23 ILE 103 HG23 ILE 103 -2.758 5.187 3.218 799 HD11 ILE 103 HD11 ILE 103 -4.719 4.622 6.630 800 HD12 ILE 103 HD12 ILE 103 -4.068 6.259 6.587 801 HD13 ILE 103 HD13 ILE 103 -3.228 4.954 5.745 802 H GLN 104 HN GLN 104 -5.041 8.769 1.923 803 HA GLN 104 HA GLN 104 -2.723 10.097 1.106 804 HB2 GLN 104 HB2 GLN 104 -4.510 9.495 -0.440 805 HB3 GLN 104 HB1 GLN 104 -5.614 10.600 0.363 806 HG2 GLN 104 HG2 GLN 104 -4.211 12.486 -0.345 807 HG3 GLN 104 HG1 GLN 104 -3.152 11.358 -1.192 808 HE21 GLN 104 HE21 GLN 104 -3.872 10.380 -3.079 809 HE22 GLN 104 HE22 GLN 104 -5.253 10.950 -3.945 810 H THR 105 HN THR 105 -5.411 11.213 3.068 811 HA THR 105 HA THR 105 -4.420 13.908 3.219 812 HB THR 105 HB THR 105 -6.495 12.483 4.883 813 HG1 THR 105 HG1 THR 105 -7.417 12.592 2.947 814 HG21 THR 105 HG21 THR 105 -5.878 15.417 4.575 815 HG22 THR 105 HG22 THR 105 -5.639 14.441 6.026 816 HG23 THR 105 HG23 THR 105 -7.270 14.749 5.430 817 H LEU 106 HN LEU 106 -4.474 11.058 5.272 818 HA LEU 106 HA LEU 106 -3.338 11.955 7.583 819 HB2 LEU 106 HB2 LEU 106 -4.162 9.584 6.613 820 HB3 LEU 106 HB1 LEU 106 -2.434 9.334 6.488 821 HG LEU 106 HG LEU 106 -3.370 8.413 8.556 822 HD11 LEU 106 HD11 LEU 106 -1.785 9.419 10.114 823 HD12 LEU 106 HD12 LEU 106 -1.569 10.788 9.028 824 HD13 LEU 106 HD13 LEU 106 -1.040 9.180 8.536 825 HD21 LEU 106 HD21 LEU 106 -5.076 10.356 8.531 826 HD22 LEU 106 HD22 LEU 106 -3.863 11.186 9.500 827 HD23 LEU 106 HD23 LEU 106 -4.555 9.659 10.063 828 H LEU 107 HN LEU 107 -1.682 10.146 5.048 829 HA LEU 107 HA LEU 107 0.912 10.937 5.969 830 HB2 LEU 107 HB2 LEU 107 1.320 8.874 5.287 831 HB3 LEU 107 HB1 LEU 107 -0.257 8.764 4.563 832 HG LEU 107 HG LEU 107 1.540 8.059 3.078 833 HD11 LEU 107 HD11 LEU 107 0.904 9.371 1.079 834 HD12 LEU 107 HD12 LEU 107 0.058 10.500 2.142 835 HD13 LEU 107 HD13 LEU 107 -0.472 8.816 2.048 836 HD21 LEU 107 HD21 LEU 107 2.502 10.901 3.213 837 HD22 LEU 107 HD22 LEU 107 3.092 9.665 2.102 838 HD23 LEU 107 HD23 LEU 107 3.330 9.475 3.839 839 H GLY 108 HN GLY 108 -1.126 11.634 3.156 840 HA2 GLY 108 HA2 GLY 108 0.875 12.951 1.652 841 HA3 GLY 108 HA1 GLY 108 -0.857 13.114 1.420 842 H SER 109 HN SER 109 -1.676 14.286 3.754 843 HA SER 109 HA SER 109 -0.563 16.946 3.416 844 HB2 SER 109 HB2 SER 109 -2.895 16.035 5.116 845 HB3 SER 109 HB1 SER 109 -2.465 17.706 4.747 846 HG SER 109 HG SER 109 -2.995 15.820 2.712 847 H SER 110 HN SER 110 0.370 14.412 5.089 848 HA SER 110 HA SER 110 1.275 13.872 7.088 849 HB2 SER 110 HB2 SER 110 2.978 15.554 7.907 850 HB3 SER 110 HB1 SER 110 3.146 15.068 6.222 851 HG SER 110 HG SER 110 1.517 17.221 6.465 852 H VAL 111 HN VAL 111 -0.826 13.803 8.081 853 HA VAL 111 HA VAL 111 -1.085 15.799 10.196 854 HB VAL 111 HB VAL 111 -3.309 14.646 8.663 855 HG11 VAL 111 HG11 VAL 111 -4.807 15.940 10.091 856 HG12 VAL 111 HG12 VAL 111 -3.419 16.471 11.041 857 HG13 VAL 111 HG13 VAL 111 -3.884 14.771 11.033 858 HG21 VAL 111 HG21 VAL 111 -2.209 16.472 7.527 859 HG22 VAL 111 HG22 VAL 111 -2.374 17.462 8.976 860 HG23 VAL 111 HG23 VAL 111 -3.811 16.965 8.078 861 H GLU 112 HN GLU 112 -1.041 14.973 12.137 862 HA GLU 112 HA GLU 112 -2.241 12.478 12.800 863 HB2 GLU 112 HB2 GLU 112 -0.264 11.518 11.891 864 HB3 GLU 112 HB1 GLU 112 0.755 12.754 12.621 865 HG2 GLU 112 HG2 GLU 112 0.048 11.888 14.831 866 HG3 GLU 112 HG1 GLU 112 -0.694 10.521 13.998 867 H TRP 113 HN TRP 113 -3.334 13.753 14.281 868 HA TRP 113 HA TRP 113 -1.702 14.749 16.524 869 HB2 TRP 113 HB2 TRP 113 -4.328 15.957 15.637 870 HB3 TRP 113 HB1 TRP 113 -3.189 16.607 16.812 871 HD1 TRP 113 HD1 TRP 113 -4.217 17.115 13.372 872 HE1 TRP 113 HE1 TRP 113 -2.434 18.382 12.016 873 HE3 TRP 113 HE3 TRP 113 -0.259 16.619 16.572 874 HZ2 TRP 113 HZ2 TRP 113 0.289 19.071 12.267 875 HZ3 TRP 113 HZ3 TRP 113 1.900 17.606 15.933 876 HH2 TRP 113 HH2 TRP 113 2.168 18.805 13.826 877 H LEU 114 HN LEU 114 -2.902 12.184 16.062 878 HA LEU 114 HA LEU 114 -4.224 11.653 18.479 879 HB2 LEU 114 HB2 LEU 114 -6.467 11.424 17.894 880 HB3 LEU 114 HB1 LEU 114 -6.020 12.891 17.052 881 HG LEU 114 HG LEU 114 -6.379 10.147 15.841 882 HD11 LEU 114 HD11 LEU 114 -8.460 11.243 16.344 883 HD12 LEU 114 HD12 LEU 114 -8.196 11.234 14.601 884 HD13 LEU 114 HD13 LEU 114 -7.921 12.708 15.527 885 HD21 LEU 114 HD21 LEU 114 -4.584 11.157 14.634 886 HD22 LEU 114 HD22 LEU 114 -5.445 12.701 14.544 887 HD23 LEU 114 HD23 LEU 114 -6.053 11.298 13.656 888 H HIS 115 HN HIS 115 -5.534 9.306 17.887 889 HA HIS 115 HA HIS 115 -3.623 7.611 16.597 890 HB2 HIS 115 HB2 HIS 115 -6.535 7.107 17.277 891 HB3 HIS 115 HB1 HIS 115 -5.396 5.878 16.740 892 HD1 HIS 115 HD1 HIS 115 -6.679 7.491 19.731 893 HD2 HIS 115 HD2 HIS 115 -3.204 5.481 18.652 894 HE1 HIS 115 HE1 HIS 115 -5.553 6.874 21.894 895 HE2 HIS 115 HE2 HIS 115 -3.368 5.830 21.208 896 HA PRO 116 HA PRO 116 -4.308 9.654 12.758 897 HB2 PRO 116 HB2 PRO 116 -3.479 7.515 11.178 898 HB3 PRO 116 HB1 PRO 116 -2.488 8.829 11.799 899 HG2 PRO 116 HG2 PRO 116 -2.926 6.110 12.954 900 HG3 PRO 116 HG1 PRO 116 -1.427 7.057 12.840 901 HD2 PRO 116 HD2 PRO 116 -2.656 6.984 15.146 902 HD3 PRO 116 HD1 PRO 116 -2.139 8.570 14.510 903 H SER 117 HN SER 117 -6.085 10.059 11.828 904 HA SER 117 HA SER 117 -7.728 8.086 10.540 905 HB2 SER 117 HB2 SER 117 -8.750 9.589 12.971 906 HB3 SER 117 HB1 SER 117 -9.766 8.653 11.871 907 HG SER 117 HG SER 117 -7.615 7.243 12.806 908 H ASP 118 HN ASP 118 -6.472 9.943 9.271 909 HA ASP 118 HA ASP 118 -6.540 11.727 7.867 910 HB2 ASP 118 HB2 ASP 118 -8.879 10.909 7.375 911 HB3 ASP 118 HB1 ASP 118 -9.481 11.952 8.654
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