USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1157 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 TYR OH : rot -143:sc= 0.153 USER MOD Set 1.2: A 101 THR OG1 : rot 78:sc= 0.588 USER MOD Set 1.3: A 110 HIS :FLIP no HD1:sc= -0.231 F(o=-5.2!,f=0.51) USER MOD Set 2.1: A 90 THR OG1 : rot -115:sc= 0.873 USER MOD Set 2.2: A 92 TYR OH : rot 180:sc= -0.857 USER MOD Set 3.1: A 76 TYR OH : rot -96:sc= 0.0672 USER MOD Set 3.2: A 78 SER OG : rot 146:sc= -0.44 USER MOD Set 4.1: A 40 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 48 LYS NZ :NH3+ 139:sc= -3.98! (180deg=-7.59!) USER MOD Set 5.1: A 31 LYS NZ :NH3+ -168:sc= -0.123 (180deg=-0.232) USER MOD Set 5.2: A 32 MET CE :methyl -122:sc= -3.37! (180deg=-5.59!) USER MOD Set 6.1: A 12 LYS NZ :NH3+ 158:sc= -0.0316 (180deg=-0.255) USER MOD Set 6.2: A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= -0.43 USER MOD Single : A 20 SER OG : rot 129:sc= -1.63 USER MOD Single : A 21 ASN :FLIP amide:sc= -0.12 F(o=-0.64,f=-0.12) USER MOD Single : A 22 THR OG1 : rot -73:sc= -0.196 USER MOD Single : A 29 LYS NZ :NH3+ 166:sc= -1.49 (180deg=-1.64) USER MOD Single : A 33 LYS NZ :NH3+ -168:sc= 0.133 (180deg=0.0253) USER MOD Single : A 34 MET CE :methyl -132:sc= -2.56 (180deg=-9.38!) USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= -0.169 USER MOD Single : A 51 TYR OH : rot 4:sc= 0.0545 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.373 X(o=-0.37,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot -69:sc= -0.589! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= -0.0791 USER MOD Single : A 82 LYS NZ :NH3+ 163:sc=-0.000981 (180deg=-0.251) USER MOD Single : A 83 LYS NZ :NH3+ -108:sc= -2.66! (180deg=-5.19!) USER MOD Single : A 84 LYS NZ :NH3+ -156:sc= -0.15 (180deg=-0.968) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 114:sc= 0.57 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.166) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl -168:sc= -3.8! (180deg=-4.02!) USER MOD Single : A 112 MET CE :methyl -143:sc= -0.083 (180deg=-1.16) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -159:sc= 0.901 USER MOD Single : A 118 SER OG : rot 180:sc= -0.465 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 93:sc= 0.0314 USER MOD Single : A 131 LYS NZ :NH3+ 154:sc= -0.158 (180deg=-0.933) USER MOD Single : A 137 ASN : amide:sc= -0.457 X(o=-0.46,f=0) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot -140:sc= -2.43 USER MOD Single : A 142 MET CE :methyl -157:sc= -0.156 (180deg=-0.607) USER MOD Single : A 145 MET CE :methyl -110:sc= -0.643 (180deg=-1.92) USER MOD Single : A 149 GLN : amide:sc= -0.174 X(o=-0.17,f=-0.11) USER MOD Single : A 153 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ASP A 5 1.715 19.400 -14.425 1.00 12.13 N ATOM 65 CA ASP A 5 0.685 18.972 -13.487 1.00 64.24 C ATOM 66 C ASP A 5 1.304 18.197 -12.328 1.00 74.15 C ATOM 67 O ASP A 5 1.134 18.558 -11.164 1.00 75.14 O ATOM 68 CB ASP A 5 -0.340 18.089 -14.201 1.00 44.42 C ATOM 69 CG ASP A 5 -1.573 17.906 -13.324 1.00 54.35 C ATOM 70 OD1 ASP A 5 -1.861 18.802 -12.546 1.00 34.12 O ATOM 71 OD2 ASP A 5 -2.213 16.874 -13.442 1.00 23.10 O ATOM 0 HA ASP A 5 0.189 19.859 -13.094 1.00 64.24 H new ATOM 0 HB2 ASP A 5 -0.624 18.542 -15.151 1.00 44.42 H new ATOM 0 HB3 ASP A 5 0.101 17.119 -14.430 1.00 44.42 H new ATOM 76 N ARG A 6 2.025 17.129 -12.656 1.00 72.11 N ATOM 77 CA ARG A 6 2.666 16.309 -11.635 1.00 74.44 C ATOM 78 C ARG A 6 3.733 17.108 -10.894 1.00 63.31 C ATOM 79 O ARG A 6 3.821 17.056 -9.668 1.00 63.00 O ATOM 80 CB ARG A 6 3.305 15.074 -12.283 1.00 35.30 C ATOM 81 CG ARG A 6 4.060 14.245 -11.223 1.00 33.35 C ATOM 82 CD ARG A 6 5.570 14.506 -11.319 1.00 43.55 C ATOM 83 NE ARG A 6 6.047 14.224 -12.670 1.00 43.41 N ATOM 84 CZ ARG A 6 7.161 14.778 -13.136 1.00 65.30 C ATOM 85 NH1 ARG A 6 7.851 15.590 -12.383 1.00 62.40 N ATOM 86 NH2 ARG A 6 7.566 14.509 -14.348 1.00 53.32 N ATOM 0 H ARG A 6 2.179 16.813 -13.614 1.00 72.11 H new ATOM 0 HA ARG A 6 1.906 15.993 -10.920 1.00 74.44 H new ATOM 0 HB2 ARG A 6 2.535 14.462 -12.753 1.00 35.30 H new ATOM 0 HB3 ARG A 6 3.992 15.382 -13.071 1.00 35.30 H new ATOM 0 HG2 ARG A 6 3.702 14.504 -10.226 1.00 33.35 H new ATOM 0 HG3 ARG A 6 3.857 13.184 -11.369 1.00 33.35 H new ATOM 0 HD2 ARG A 6 5.784 15.543 -11.059 1.00 43.55 H new ATOM 0 HD3 ARG A 6 6.101 13.881 -10.601 1.00 43.55 H new ATOM 0 HE ARG A 6 5.515 13.590 -13.267 1.00 43.41 H new ATOM 0 HH11 ARG A 6 7.535 15.800 -11.436 1.00 62.40 H new ATOM 0 HH12 ARG A 6 8.706 16.015 -12.741 1.00 62.40 H new ATOM 0 HH21 ARG A 6 7.027 13.874 -14.937 1.00 53.32 H new ATOM 0 HH22 ARG A 6 8.421 14.934 -14.706 1.00 53.32 H new ATOM 100 N SER A 7 4.541 17.845 -11.649 1.00 2.24 N ATOM 101 CA SER A 7 5.605 18.651 -11.059 1.00 61.12 C ATOM 102 C SER A 7 5.042 19.646 -10.048 1.00 10.10 C ATOM 103 O SER A 7 5.702 19.991 -9.068 1.00 42.32 O ATOM 104 CB SER A 7 6.350 19.409 -12.157 1.00 32.41 C ATOM 105 OG SER A 7 5.490 20.396 -12.713 1.00 35.12 O ATOM 0 H SER A 7 4.481 17.901 -12.666 1.00 2.24 H new ATOM 0 HA SER A 7 6.292 17.981 -10.541 1.00 61.12 H new ATOM 0 HB2 SER A 7 7.245 19.878 -11.748 1.00 32.41 H new ATOM 0 HB3 SER A 7 6.679 18.718 -12.933 1.00 32.41 H new ATOM 0 HG SER A 7 5.965 20.885 -13.417 1.00 35.12 H new ATOM 111 N GLU A 8 3.825 20.114 -10.301 1.00 20.30 N ATOM 112 CA GLU A 8 3.188 21.083 -9.415 1.00 45.32 C ATOM 113 C GLU A 8 2.857 20.471 -8.054 1.00 21.01 C ATOM 114 O GLU A 8 3.116 21.080 -7.016 1.00 44.11 O ATOM 115 CB GLU A 8 1.903 21.610 -10.060 1.00 42.43 C ATOM 116 CG GLU A 8 2.253 22.507 -11.250 1.00 71.54 C ATOM 117 CD GLU A 8 2.861 21.674 -12.373 1.00 53.24 C ATOM 118 OE1 GLU A 8 2.572 20.490 -12.428 1.00 14.30 O ATOM 119 OE2 GLU A 8 3.607 22.231 -13.160 1.00 4.21 O ATOM 0 H GLU A 8 3.262 19.841 -11.107 1.00 20.30 H new ATOM 0 HA GLU A 8 3.891 21.901 -9.258 1.00 45.32 H new ATOM 0 HB2 GLU A 8 1.282 20.777 -10.390 1.00 42.43 H new ATOM 0 HB3 GLU A 8 1.321 22.171 -9.329 1.00 42.43 H new ATOM 0 HG2 GLU A 8 1.358 23.016 -11.608 1.00 71.54 H new ATOM 0 HG3 GLU A 8 2.956 23.280 -10.939 1.00 71.54 H new ATOM 126 N ILE A 9 2.271 19.275 -8.060 1.00 62.31 N ATOM 127 CA ILE A 9 1.897 18.613 -6.808 1.00 1.13 C ATOM 128 C ILE A 9 3.051 17.788 -6.256 1.00 11.35 C ATOM 129 O ILE A 9 3.151 17.571 -5.049 1.00 31.44 O ATOM 130 CB ILE A 9 0.676 17.708 -7.044 1.00 73.05 C ATOM 131 CG1 ILE A 9 -0.040 17.402 -5.695 1.00 1.41 C ATOM 132 CG2 ILE A 9 1.104 16.417 -7.762 1.00 51.20 C ATOM 133 CD1 ILE A 9 0.341 16.032 -5.146 1.00 53.30 C ATOM 0 H ILE A 9 2.047 18.749 -8.905 1.00 62.31 H new ATOM 0 HA ILE A 9 1.648 19.382 -6.076 1.00 1.13 H new ATOM 0 HB ILE A 9 -0.035 18.228 -7.686 1.00 73.05 H new ATOM 0 HG12 ILE A 9 0.217 18.170 -4.965 1.00 1.41 H new ATOM 0 HG13 ILE A 9 -1.120 17.448 -5.839 1.00 1.41 H new ATOM 0 HG21 ILE A 9 0.231 15.784 -7.924 1.00 51.20 H new ATOM 0 HG22 ILE A 9 1.554 16.667 -8.723 1.00 51.20 H new ATOM 0 HG23 ILE A 9 1.830 15.884 -7.149 1.00 51.20 H new ATOM 0 HD11 ILE A 9 -0.181 15.859 -4.205 1.00 53.30 H new ATOM 0 HD12 ILE A 9 0.059 15.261 -5.864 1.00 53.30 H new ATOM 0 HD13 ILE A 9 1.417 15.994 -4.977 1.00 53.30 H new ATOM 145 N ALA A 10 3.922 17.339 -7.146 1.00 43.10 N ATOM 146 CA ALA A 10 5.056 16.551 -6.707 1.00 44.45 C ATOM 147 C ALA A 10 5.915 17.418 -5.809 1.00 11.22 C ATOM 148 O ALA A 10 6.029 18.624 -6.027 1.00 11.32 O ATOM 149 CB ALA A 10 5.846 15.989 -7.891 1.00 15.11 C ATOM 0 H ALA A 10 3.867 17.502 -8.151 1.00 43.10 H new ATOM 0 HA ALA A 10 4.708 15.684 -6.146 1.00 44.45 H new ATOM 0 HB1 ALA A 10 6.688 15.404 -7.522 1.00 15.11 H new ATOM 0 HB2 ALA A 10 5.197 15.352 -8.492 1.00 15.11 H new ATOM 0 HB3 ALA A 10 6.216 16.811 -8.504 1.00 15.11 H new ATOM 155 N GLY A 11 6.480 16.820 -4.766 1.00 54.35 N ATOM 156 CA GLY A 11 7.277 17.564 -3.802 1.00 52.34 C ATOM 157 C GLY A 11 6.601 17.470 -2.437 1.00 55.14 C ATOM 158 O GLY A 11 7.262 17.483 -1.399 1.00 11.24 O ATOM 0 H GLY A 11 6.400 15.823 -4.568 1.00 54.35 H new ATOM 0 HA2 GLY A 11 8.287 17.158 -3.753 1.00 52.34 H new ATOM 0 HA3 GLY A 11 7.367 18.606 -4.109 1.00 52.34 H new ATOM 162 N LYS A 12 5.268 17.363 -2.458 1.00 23.01 N ATOM 163 CA LYS A 12 4.493 17.251 -1.225 1.00 25.33 C ATOM 164 C LYS A 12 3.075 16.726 -1.497 1.00 33.35 C ATOM 165 O LYS A 12 2.261 17.421 -2.106 1.00 43.24 O ATOM 166 CB LYS A 12 4.402 18.618 -0.544 1.00 2.33 C ATOM 167 CG LYS A 12 3.938 18.447 0.912 1.00 62.41 C ATOM 168 CD LYS A 12 5.150 18.204 1.829 1.00 64.30 C ATOM 169 CE LYS A 12 5.740 19.544 2.279 1.00 72.11 C ATOM 170 NZ LYS A 12 4.844 20.164 3.296 1.00 44.32 N ATOM 0 H LYS A 12 4.709 17.352 -3.311 1.00 23.01 H new ATOM 0 HA LYS A 12 5.003 16.541 -0.574 1.00 25.33 H new ATOM 0 HB2 LYS A 12 5.373 19.112 -0.570 1.00 2.33 H new ATOM 0 HB3 LYS A 12 3.704 19.258 -1.085 1.00 2.33 H new ATOM 0 HG2 LYS A 12 3.399 19.337 1.237 1.00 62.41 H new ATOM 0 HG3 LYS A 12 3.244 17.610 0.985 1.00 62.41 H new ATOM 0 HD2 LYS A 12 4.848 17.619 2.698 1.00 64.30 H new ATOM 0 HD3 LYS A 12 5.906 17.623 1.301 1.00 64.30 H new ATOM 0 HE2 LYS A 12 6.735 19.393 2.699 1.00 72.11 H new ATOM 0 HE3 LYS A 12 5.852 20.210 1.423 1.00 72.11 H new ATOM 0 HZ1 LYS A 12 5.384 20.847 3.864 1.00 44.32 H new ATOM 0 HZ2 LYS A 12 4.062 20.654 2.817 1.00 44.32 H new ATOM 0 HZ3 LYS A 12 4.460 19.424 3.917 1.00 44.32 H new ATOM 184 N TRP A 13 2.771 15.516 -1.015 1.00 53.04 N ATOM 185 CA TRP A 13 1.436 14.925 -1.180 1.00 41.52 C ATOM 186 C TRP A 13 0.853 14.685 0.208 1.00 32.11 C ATOM 187 O TRP A 13 1.523 14.108 1.062 1.00 53.41 O ATOM 188 CB TRP A 13 1.568 13.569 -1.896 1.00 4.21 C ATOM 189 CG TRP A 13 1.927 13.762 -3.307 1.00 1.13 C ATOM 190 CD1 TRP A 13 3.052 14.348 -3.751 1.00 12.11 C ATOM 191 CD2 TRP A 13 1.176 13.349 -4.476 1.00 14.55 C ATOM 192 NE1 TRP A 13 3.039 14.310 -5.123 1.00 73.23 N ATOM 193 CE2 TRP A 13 1.918 13.694 -5.608 1.00 75.23 C ATOM 194 CE3 TRP A 13 -0.059 12.705 -4.663 1.00 54.34 C ATOM 195 CZ2 TRP A 13 1.481 13.422 -6.883 1.00 33.50 C ATOM 196 CZ3 TRP A 13 -0.518 12.426 -5.962 1.00 52.24 C ATOM 197 CH2 TRP A 13 0.257 12.781 -7.074 1.00 21.02 C ATOM 0 H TRP A 13 3.430 14.926 -0.507 1.00 53.04 H new ATOM 0 HA TRP A 13 0.797 15.589 -1.762 1.00 41.52 H new ATOM 0 HB2 TRP A 13 2.327 12.963 -1.402 1.00 4.21 H new ATOM 0 HB3 TRP A 13 0.628 13.022 -1.826 1.00 4.21 H new ATOM 0 HD1 TRP A 13 3.830 14.774 -3.136 1.00 12.11 H new ATOM 0 HE1 TRP A 13 3.778 14.695 -5.711 1.00 73.23 H new ATOM 0 HE3 TRP A 13 -0.656 12.424 -3.808 1.00 54.34 H new ATOM 0 HZ2 TRP A 13 2.084 13.704 -7.734 1.00 33.50 H new ATOM 0 HZ3 TRP A 13 -1.470 11.937 -6.103 1.00 52.24 H new ATOM 0 HH2 TRP A 13 -0.091 12.560 -8.072 1.00 21.02 H new ATOM 208 N TYR A 14 -0.366 15.158 0.459 1.00 74.13 N ATOM 209 CA TYR A 14 -0.969 15.010 1.789 1.00 14.30 C ATOM 210 C TYR A 14 -2.049 13.925 1.826 1.00 42.23 C ATOM 211 O TYR A 14 -2.944 13.903 0.987 1.00 21.41 O ATOM 212 CB TYR A 14 -1.626 16.342 2.184 1.00 53.01 C ATOM 213 CG TYR A 14 -0.678 17.230 2.954 1.00 12.22 C ATOM 214 CD1 TYR A 14 0.687 17.253 2.657 1.00 74.31 C ATOM 215 CD2 TYR A 14 -1.185 18.043 3.973 1.00 43.30 C ATOM 216 CE1 TYR A 14 1.544 18.091 3.381 1.00 32.41 C ATOM 217 CE2 TYR A 14 -0.333 18.878 4.696 1.00 54.42 C ATOM 218 CZ TYR A 14 1.034 18.904 4.400 1.00 13.21 C ATOM 219 OH TYR A 14 1.879 19.730 5.114 1.00 23.02 O ATOM 0 H TYR A 14 -0.950 15.639 -0.225 1.00 74.13 H new ATOM 0 HA TYR A 14 -0.174 14.725 2.478 1.00 14.30 H new ATOM 0 HB2 TYR A 14 -1.962 16.861 1.287 1.00 53.01 H new ATOM 0 HB3 TYR A 14 -2.511 16.145 2.789 1.00 53.01 H new ATOM 0 HD1 TYR A 14 1.080 16.626 1.871 1.00 74.31 H new ATOM 0 HD2 TYR A 14 -2.240 18.024 4.201 1.00 43.30 H new ATOM 0 HE1 TYR A 14 2.599 18.110 3.153 1.00 32.41 H new ATOM 0 HE2 TYR A 14 -0.728 19.503 5.483 1.00 54.42 H new ATOM 0 HH TYR A 14 1.363 20.227 5.783 1.00 23.02 H new ATOM 229 N VAL A 15 -1.979 13.067 2.846 1.00 41.03 N ATOM 230 CA VAL A 15 -2.980 12.016 3.050 1.00 72.21 C ATOM 231 C VAL A 15 -3.830 12.416 4.254 1.00 0.23 C ATOM 232 O VAL A 15 -3.357 12.351 5.389 1.00 51.34 O ATOM 233 CB VAL A 15 -2.289 10.674 3.336 1.00 3.21 C ATOM 234 CG1 VAL A 15 -3.310 9.664 3.870 1.00 33.22 C ATOM 235 CG2 VAL A 15 -1.664 10.128 2.052 1.00 50.42 C ATOM 0 H VAL A 15 -1.237 13.079 3.546 1.00 41.03 H new ATOM 0 HA VAL A 15 -3.596 11.903 2.158 1.00 72.21 H new ATOM 0 HB VAL A 15 -1.510 10.831 4.082 1.00 3.21 H new ATOM 0 HG11 VAL A 15 -2.813 8.715 4.070 1.00 33.22 H new ATOM 0 HG12 VAL A 15 -3.750 10.045 4.792 1.00 33.22 H new ATOM 0 HG13 VAL A 15 -4.094 9.513 3.128 1.00 33.22 H new ATOM 0 HG21 VAL A 15 -1.176 9.176 2.261 1.00 50.42 H new ATOM 0 HG22 VAL A 15 -2.442 9.980 1.303 1.00 50.42 H new ATOM 0 HG23 VAL A 15 -0.928 10.838 1.675 1.00 50.42 H new ATOM 245 N VAL A 16 -5.065 12.874 4.014 1.00 62.33 N ATOM 246 CA VAL A 16 -5.920 13.328 5.120 1.00 72.41 C ATOM 247 C VAL A 16 -7.184 12.505 5.285 1.00 31.20 C ATOM 248 O VAL A 16 -8.059 12.869 6.071 1.00 13.12 O ATOM 249 CB VAL A 16 -6.287 14.790 4.915 1.00 21.42 C ATOM 250 CG1 VAL A 16 -5.070 15.521 4.355 1.00 3.33 C ATOM 251 CG2 VAL A 16 -7.457 14.916 3.931 1.00 54.51 C ATOM 0 H VAL A 16 -5.488 12.940 3.088 1.00 62.33 H new ATOM 0 HA VAL A 16 -5.341 13.199 6.035 1.00 72.41 H new ATOM 0 HB VAL A 16 -6.588 15.226 5.868 1.00 21.42 H new ATOM 0 HG11 VAL A 16 -5.316 16.572 4.202 1.00 3.33 H new ATOM 0 HG12 VAL A 16 -4.242 15.441 5.059 1.00 3.33 H new ATOM 0 HG13 VAL A 16 -4.782 15.073 3.404 1.00 3.33 H new ATOM 0 HG21 VAL A 16 -7.707 15.968 3.796 1.00 54.51 H new ATOM 0 HG22 VAL A 16 -7.173 14.484 2.971 1.00 54.51 H new ATOM 0 HG23 VAL A 16 -8.323 14.385 4.326 1.00 54.51 H new ATOM 261 N ALA A 17 -7.264 11.373 4.621 1.00 34.34 N ATOM 262 CA ALA A 17 -8.423 10.520 4.820 1.00 60.14 C ATOM 263 C ALA A 17 -8.257 9.221 4.062 1.00 60.40 C ATOM 264 O ALA A 17 -7.823 9.216 2.913 1.00 31.13 O ATOM 265 CB ALA A 17 -9.677 11.256 4.336 1.00 12.25 C ATOM 0 H ALA A 17 -6.569 11.027 3.960 1.00 34.34 H new ATOM 0 HA ALA A 17 -8.522 10.288 5.880 1.00 60.14 H new ATOM 0 HB1 ALA A 17 -10.551 10.621 4.483 1.00 12.25 H new ATOM 0 HB2 ALA A 17 -9.799 12.178 4.904 1.00 12.25 H new ATOM 0 HB3 ALA A 17 -9.574 11.493 3.277 1.00 12.25 H new ATOM 271 N LEU A 18 -8.556 8.108 4.726 1.00 51.42 N ATOM 272 CA LEU A 18 -8.391 6.794 4.126 1.00 23.54 C ATOM 273 C LEU A 18 -9.647 5.951 4.280 1.00 60.12 C ATOM 274 O LEU A 18 -10.585 6.315 4.990 1.00 33.43 O ATOM 275 CB LEU A 18 -7.195 6.070 4.760 1.00 74.34 C ATOM 276 CG LEU A 18 -7.111 6.372 6.264 1.00 63.33 C ATOM 277 CD1 LEU A 18 -6.691 7.836 6.515 1.00 72.33 C ATOM 278 CD2 LEU A 18 -8.466 6.088 6.931 1.00 63.20 C ATOM 0 H LEU A 18 -8.914 8.093 5.681 1.00 51.42 H new ATOM 0 HA LEU A 18 -8.207 6.934 3.061 1.00 23.54 H new ATOM 0 HB2 LEU A 18 -7.290 4.995 4.605 1.00 74.34 H new ATOM 0 HB3 LEU A 18 -6.273 6.382 4.269 1.00 74.34 H new ATOM 0 HG LEU A 18 -6.352 5.724 6.701 1.00 63.33 H new ATOM 0 HD11 LEU A 18 -6.640 8.021 7.588 1.00 72.33 H new ATOM 0 HD12 LEU A 18 -5.713 8.016 6.069 1.00 72.33 H new ATOM 0 HD13 LEU A 18 -7.423 8.507 6.066 1.00 72.33 H new ATOM 0 HD21 LEU A 18 -8.399 6.304 7.997 1.00 63.20 H new ATOM 0 HD22 LEU A 18 -9.233 6.718 6.480 1.00 63.20 H new ATOM 0 HD23 LEU A 18 -8.729 5.040 6.789 1.00 63.20 H new ATOM 290 N ALA A 19 -9.641 4.814 3.603 1.00 2.54 N ATOM 291 CA ALA A 19 -10.763 3.887 3.647 1.00 10.24 C ATOM 292 C ALA A 19 -10.247 2.452 3.600 1.00 23.52 C ATOM 293 O ALA A 19 -9.294 2.149 2.883 1.00 62.10 O ATOM 294 CB ALA A 19 -11.707 4.156 2.468 1.00 30.45 C ATOM 0 H ALA A 19 -8.867 4.509 3.013 1.00 2.54 H new ATOM 0 HA ALA A 19 -11.315 4.031 4.576 1.00 10.24 H new ATOM 0 HB1 ALA A 19 -12.544 3.459 2.506 1.00 30.45 H new ATOM 0 HB2 ALA A 19 -12.082 5.178 2.528 1.00 30.45 H new ATOM 0 HB3 ALA A 19 -11.166 4.022 1.531 1.00 30.45 H new ATOM 300 N SER A 20 -10.874 1.579 4.373 1.00 42.23 N ATOM 301 CA SER A 20 -10.461 0.182 4.418 1.00 35.53 C ATOM 302 C SER A 20 -11.504 -0.660 5.126 1.00 31.33 C ATOM 303 O SER A 20 -12.518 -0.150 5.601 1.00 5.13 O ATOM 304 CB SER A 20 -9.123 0.057 5.142 1.00 13.14 C ATOM 305 OG SER A 20 -8.698 -1.299 5.107 1.00 70.33 O ATOM 0 H SER A 20 -11.665 1.809 4.974 1.00 42.23 H new ATOM 0 HA SER A 20 -10.354 -0.179 3.395 1.00 35.53 H new ATOM 0 HB2 SER A 20 -8.378 0.696 4.668 1.00 13.14 H new ATOM 0 HB3 SER A 20 -9.221 0.393 6.174 1.00 13.14 H new ATOM 0 HG SER A 20 -7.776 -1.345 4.777 1.00 70.33 H new ATOM 311 N ASN A 21 -11.235 -1.955 5.205 1.00 11.21 N ATOM 312 CA ASN A 21 -12.140 -2.883 5.872 1.00 44.23 C ATOM 313 C ASN A 21 -11.358 -3.775 6.834 1.00 1.34 C ATOM 314 O ASN A 21 -11.941 -4.435 7.694 1.00 4.14 O ATOM 315 CB ASN A 21 -12.888 -3.728 4.834 1.00 51.14 C ATOM 316 CG ASN A 21 -12.049 -4.927 4.407 1.00 72.55 C ATOM 317 OD1 ASN A 21 -12.062 -6.004 5.141 1.00 62.11 O flip ATOM 318 ND2 ASN A 21 -11.368 -4.880 3.382 1.00 13.24 N flip ATOM 0 H ASN A 21 -10.398 -2.388 4.816 1.00 11.21 H new ATOM 0 HA ASN A 21 -12.873 -2.316 6.446 1.00 44.23 H new ATOM 0 HB2 ASN A 21 -13.835 -4.071 5.251 1.00 51.14 H new ATOM 0 HB3 ASN A 21 -13.126 -3.116 3.964 1.00 51.14 H new ATOM 0 HD21 ASN A 21 -11.362 -4.034 2.812 1.00 13.24 H new ATOM 0 HD22 ASN A 21 -10.810 -5.687 3.103 1.00 13.24 H new ATOM 325 N THR A 22 -10.031 -3.767 6.703 1.00 43.11 N ATOM 326 CA THR A 22 -9.191 -4.557 7.592 1.00 32.01 C ATOM 327 C THR A 22 -9.049 -3.805 8.908 1.00 3.33 C ATOM 328 O THR A 22 -8.453 -2.729 8.962 1.00 0.11 O ATOM 329 CB THR A 22 -7.818 -4.805 6.960 1.00 31.34 C ATOM 330 OG1 THR A 22 -7.090 -5.720 7.767 1.00 44.33 O ATOM 331 CG2 THR A 22 -7.040 -3.494 6.851 1.00 72.41 C ATOM 0 H THR A 22 -9.524 -3.230 6.000 1.00 43.11 H new ATOM 0 HA THR A 22 -9.650 -5.530 7.769 1.00 32.01 H new ATOM 0 HB THR A 22 -7.955 -5.218 5.961 1.00 31.34 H new ATOM 0 HG1 THR A 22 -6.801 -5.273 8.590 1.00 44.33 H new ATOM 0 HG21 THR A 22 -6.066 -3.685 6.400 1.00 72.41 H new ATOM 0 HG22 THR A 22 -7.596 -2.792 6.230 1.00 72.41 H new ATOM 0 HG23 THR A 22 -6.902 -3.069 7.845 1.00 72.41 H new ATOM 339 N GLU A 23 -9.647 -4.352 9.954 1.00 2.14 N ATOM 340 CA GLU A 23 -9.635 -3.701 11.255 1.00 3.35 C ATOM 341 C GLU A 23 -8.238 -3.357 11.735 1.00 3.02 C ATOM 342 O GLU A 23 -8.032 -2.304 12.328 1.00 70.02 O ATOM 343 CB GLU A 23 -10.330 -4.589 12.290 1.00 0.31 C ATOM 344 CG GLU A 23 -11.806 -4.749 11.920 1.00 73.34 C ATOM 345 CD GLU A 23 -12.536 -3.422 12.098 1.00 53.24 C ATOM 346 OE1 GLU A 23 -11.990 -2.550 12.753 1.00 45.50 O ATOM 347 OE2 GLU A 23 -13.632 -3.297 11.576 1.00 14.20 O ATOM 0 H GLU A 23 -10.145 -5.242 9.929 1.00 2.14 H new ATOM 0 HA GLU A 23 -10.174 -2.761 11.139 1.00 3.35 H new ATOM 0 HB2 GLU A 23 -9.847 -5.565 12.330 1.00 0.31 H new ATOM 0 HB3 GLU A 23 -10.239 -4.148 13.282 1.00 0.31 H new ATOM 0 HG2 GLU A 23 -11.896 -5.087 10.888 1.00 73.34 H new ATOM 0 HG3 GLU A 23 -12.266 -5.513 12.547 1.00 73.34 H new ATOM 354 N PHE A 24 -7.284 -4.233 11.503 1.00 41.22 N ATOM 355 CA PHE A 24 -5.933 -3.968 11.967 1.00 22.23 C ATOM 356 C PHE A 24 -5.475 -2.569 11.545 1.00 35.01 C ATOM 357 O PHE A 24 -5.049 -1.769 12.381 1.00 51.53 O ATOM 358 CB PHE A 24 -4.966 -5.024 11.400 1.00 70.30 C ATOM 359 CG PHE A 24 -5.723 -6.297 11.092 1.00 23.03 C ATOM 360 CD1 PHE A 24 -6.666 -6.789 12.004 1.00 4.25 C ATOM 361 CD2 PHE A 24 -5.486 -6.981 9.894 1.00 14.33 C ATOM 362 CE1 PHE A 24 -7.369 -7.964 11.717 1.00 11.11 C ATOM 363 CE2 PHE A 24 -6.189 -8.157 9.608 1.00 14.24 C ATOM 364 CZ PHE A 24 -7.131 -8.648 10.518 1.00 5.12 C ATOM 0 H PHE A 24 -7.410 -5.116 11.008 1.00 41.22 H new ATOM 0 HA PHE A 24 -5.930 -4.019 13.056 1.00 22.23 H new ATOM 0 HB2 PHE A 24 -4.489 -4.646 10.496 1.00 70.30 H new ATOM 0 HB3 PHE A 24 -4.172 -5.227 12.119 1.00 70.30 H new ATOM 0 HD1 PHE A 24 -6.850 -6.261 12.928 1.00 4.25 H new ATOM 0 HD2 PHE A 24 -4.760 -6.601 9.190 1.00 14.33 H new ATOM 0 HE1 PHE A 24 -8.095 -8.344 12.420 1.00 11.11 H new ATOM 0 HE2 PHE A 24 -6.004 -8.685 8.684 1.00 14.24 H new ATOM 0 HZ PHE A 24 -7.675 -9.554 10.296 1.00 5.12 H new ATOM 374 N PHE A 25 -5.540 -2.289 10.250 1.00 0.32 N ATOM 375 CA PHE A 25 -5.099 -0.992 9.731 1.00 54.32 C ATOM 376 C PHE A 25 -6.110 0.116 10.011 1.00 63.11 C ATOM 377 O PHE A 25 -5.742 1.216 10.423 1.00 71.03 O ATOM 378 CB PHE A 25 -4.835 -1.094 8.225 1.00 52.15 C ATOM 379 CG PHE A 25 -4.006 -2.330 7.890 1.00 13.41 C ATOM 380 CD1 PHE A 25 -3.276 -3.028 8.879 1.00 62.14 C ATOM 381 CD2 PHE A 25 -3.972 -2.783 6.565 1.00 41.51 C ATOM 382 CE1 PHE A 25 -2.531 -4.160 8.530 1.00 52.35 C ATOM 383 CE2 PHE A 25 -3.225 -3.917 6.225 1.00 62.22 C ATOM 384 CZ PHE A 25 -2.506 -4.604 7.206 1.00 40.32 C ATOM 0 H PHE A 25 -5.890 -2.934 9.541 1.00 0.32 H new ATOM 0 HA PHE A 25 -4.177 -0.729 10.249 1.00 54.32 H new ATOM 0 HB2 PHE A 25 -5.783 -1.133 7.689 1.00 52.15 H new ATOM 0 HB3 PHE A 25 -4.313 -0.200 7.884 1.00 52.15 H new ATOM 0 HD1 PHE A 25 -3.293 -2.688 9.904 1.00 62.14 H new ATOM 0 HD2 PHE A 25 -4.525 -2.255 5.802 1.00 41.51 H new ATOM 0 HE1 PHE A 25 -1.974 -4.692 9.287 1.00 52.35 H new ATOM 0 HE2 PHE A 25 -3.205 -4.262 5.202 1.00 62.22 H new ATOM 0 HZ PHE A 25 -1.931 -5.479 6.941 1.00 40.32 H new ATOM 394 N LEU A 26 -7.382 -0.188 9.804 1.00 21.02 N ATOM 395 CA LEU A 26 -8.447 0.780 10.049 1.00 63.53 C ATOM 396 C LEU A 26 -8.434 1.170 11.524 1.00 11.03 C ATOM 397 O LEU A 26 -8.686 2.318 11.896 1.00 61.20 O ATOM 398 CB LEU A 26 -9.780 0.137 9.660 1.00 52.22 C ATOM 399 CG LEU A 26 -10.965 0.989 10.113 1.00 62.41 C ATOM 400 CD1 LEU A 26 -10.904 2.362 9.440 1.00 73.21 C ATOM 401 CD2 LEU A 26 -12.252 0.270 9.704 1.00 44.03 C ATOM 0 H LEU A 26 -7.705 -1.095 9.467 1.00 21.02 H new ATOM 0 HA LEU A 26 -8.302 1.682 9.455 1.00 63.53 H new ATOM 0 HB2 LEU A 26 -9.819 0.003 8.579 1.00 52.22 H new ATOM 0 HB3 LEU A 26 -9.851 -0.855 10.107 1.00 52.22 H new ATOM 0 HG LEU A 26 -10.937 1.129 11.194 1.00 62.41 H new ATOM 0 HD11 LEU A 26 -11.751 2.965 9.767 1.00 73.21 H new ATOM 0 HD12 LEU A 26 -9.975 2.861 9.716 1.00 73.21 H new ATOM 0 HD13 LEU A 26 -10.942 2.239 8.358 1.00 73.21 H new ATOM 0 HD21 LEU A 26 -13.114 0.860 10.017 1.00 44.03 H new ATOM 0 HD22 LEU A 26 -12.271 0.146 8.621 1.00 44.03 H new ATOM 0 HD23 LEU A 26 -12.289 -0.709 10.182 1.00 44.03 H new ATOM 413 N ARG A 27 -8.100 0.184 12.340 1.00 34.31 N ATOM 414 CA ARG A 27 -8.012 0.393 13.777 1.00 64.24 C ATOM 415 C ARG A 27 -6.982 1.481 14.067 1.00 42.00 C ATOM 416 O ARG A 27 -7.215 2.369 14.889 1.00 31.12 O ATOM 417 CB ARG A 27 -7.619 -0.903 14.496 1.00 2.41 C ATOM 418 CG ARG A 27 -7.300 -0.605 15.966 1.00 70.22 C ATOM 419 CD ARG A 27 -7.226 -1.916 16.751 1.00 70.01 C ATOM 420 NE ARG A 27 -6.070 -2.695 16.323 1.00 72.51 N ATOM 421 CZ ARG A 27 -4.834 -2.311 16.623 1.00 34.33 C ATOM 422 NH1 ARG A 27 -4.638 -1.220 17.311 1.00 31.40 N ATOM 423 NH2 ARG A 27 -3.814 -3.026 16.229 1.00 3.13 N ATOM 0 H ARG A 27 -7.886 -0.765 12.034 1.00 34.31 H new ATOM 0 HA ARG A 27 -8.990 0.703 14.146 1.00 64.24 H new ATOM 0 HB2 ARG A 27 -8.431 -1.627 14.430 1.00 2.41 H new ATOM 0 HB3 ARG A 27 -6.752 -1.351 14.010 1.00 2.41 H new ATOM 0 HG2 ARG A 27 -6.353 -0.070 16.042 1.00 70.22 H new ATOM 0 HG3 ARG A 27 -8.067 0.042 16.391 1.00 70.22 H new ATOM 0 HD2 ARG A 27 -7.157 -1.706 17.818 1.00 70.01 H new ATOM 0 HD3 ARG A 27 -8.139 -2.492 16.598 1.00 70.01 H new ATOM 0 HE ARG A 27 -6.213 -3.549 15.784 1.00 72.51 H new ATOM 0 HH11 ARG A 27 -5.434 -0.661 17.619 1.00 31.40 H new ATOM 0 HH12 ARG A 27 -3.689 -0.926 17.541 1.00 31.40 H new ATOM 0 HH21 ARG A 27 -3.967 -3.879 15.691 1.00 3.13 H new ATOM 0 HH22 ARG A 27 -2.865 -2.731 16.459 1.00 3.13 H new ATOM 437 N GLU A 28 -5.825 1.382 13.415 1.00 5.50 N ATOM 438 CA GLU A 28 -4.748 2.341 13.642 1.00 33.24 C ATOM 439 C GLU A 28 -4.895 3.638 12.833 1.00 71.42 C ATOM 440 O GLU A 28 -4.644 4.724 13.359 1.00 32.40 O ATOM 441 CB GLU A 28 -3.407 1.690 13.297 1.00 23.30 C ATOM 442 CG GLU A 28 -3.147 0.520 14.248 1.00 55.42 C ATOM 443 CD GLU A 28 -1.782 -0.094 13.957 1.00 64.12 C ATOM 444 OE1 GLU A 28 -1.184 0.283 12.963 1.00 61.43 O ATOM 445 OE2 GLU A 28 -1.354 -0.932 14.734 1.00 2.21 O ATOM 0 H GLU A 28 -5.611 0.655 12.732 1.00 5.50 H new ATOM 0 HA GLU A 28 -4.798 2.617 14.695 1.00 33.24 H new ATOM 0 HB2 GLU A 28 -3.416 1.338 12.265 1.00 23.30 H new ATOM 0 HB3 GLU A 28 -2.604 2.423 13.377 1.00 23.30 H new ATOM 0 HG2 GLU A 28 -3.187 0.864 15.281 1.00 55.42 H new ATOM 0 HG3 GLU A 28 -3.926 -0.233 14.133 1.00 55.42 H new ATOM 452 N LYS A 29 -5.285 3.573 11.563 1.00 54.40 N ATOM 453 CA LYS A 29 -5.394 4.801 10.792 1.00 72.22 C ATOM 454 C LYS A 29 -6.205 5.827 11.566 1.00 72.23 C ATOM 455 O LYS A 29 -5.988 7.033 11.450 1.00 31.44 O ATOM 456 CB LYS A 29 -6.032 4.509 9.426 1.00 44.31 C ATOM 457 CG LYS A 29 -4.975 3.862 8.486 1.00 41.12 C ATOM 458 CD LYS A 29 -5.554 2.643 7.736 1.00 62.35 C ATOM 459 CE LYS A 29 -6.269 3.081 6.457 1.00 13.32 C ATOM 460 NZ LYS A 29 -6.590 1.879 5.639 1.00 1.14 N ATOM 0 H LYS A 29 -5.522 2.716 11.063 1.00 54.40 H new ATOM 0 HA LYS A 29 -4.398 5.210 10.621 1.00 72.22 H new ATOM 0 HB2 LYS A 29 -6.884 3.840 9.547 1.00 44.31 H new ATOM 0 HB3 LYS A 29 -6.410 5.431 8.985 1.00 44.31 H new ATOM 0 HG2 LYS A 29 -4.626 4.602 7.765 1.00 41.12 H new ATOM 0 HG3 LYS A 29 -4.108 3.553 9.070 1.00 41.12 H new ATOM 0 HD2 LYS A 29 -4.752 1.948 7.489 1.00 62.35 H new ATOM 0 HD3 LYS A 29 -6.251 2.110 8.383 1.00 62.35 H new ATOM 0 HE2 LYS A 29 -7.182 3.622 6.704 1.00 13.32 H new ATOM 0 HE3 LYS A 29 -5.638 3.764 5.889 1.00 13.32 H new ATOM 0 HZ1 LYS A 29 -7.273 2.136 4.898 1.00 1.14 H new ATOM 0 HZ2 LYS A 29 -5.721 1.517 5.198 1.00 1.14 H new ATOM 0 HZ3 LYS A 29 -7.001 1.143 6.249 1.00 1.14 H new ATOM 474 N ASP A 30 -7.148 5.334 12.346 1.00 33.00 N ATOM 475 CA ASP A 30 -8.004 6.203 13.133 1.00 41.25 C ATOM 476 C ASP A 30 -7.214 6.985 14.187 1.00 2.31 C ATOM 477 O ASP A 30 -7.667 8.041 14.629 1.00 35.44 O ATOM 478 CB ASP A 30 -9.083 5.370 13.828 1.00 52.12 C ATOM 479 CG ASP A 30 -9.970 4.695 12.789 1.00 24.34 C ATOM 480 OD1 ASP A 30 -9.770 4.950 11.612 1.00 72.24 O ATOM 481 OD2 ASP A 30 -10.838 3.933 13.183 1.00 61.04 O ATOM 0 H ASP A 30 -7.341 4.338 12.452 1.00 33.00 H new ATOM 0 HA ASP A 30 -8.459 6.922 12.451 1.00 41.25 H new ATOM 0 HB2 ASP A 30 -8.619 4.618 14.466 1.00 52.12 H new ATOM 0 HB3 ASP A 30 -9.686 6.008 14.474 1.00 52.12 H new ATOM 486 N LYS A 31 -6.055 6.466 14.626 1.00 31.25 N ATOM 487 CA LYS A 31 -5.286 7.164 15.668 1.00 54.12 C ATOM 488 C LYS A 31 -4.198 8.094 15.126 1.00 54.22 C ATOM 489 O LYS A 31 -3.749 8.979 15.854 1.00 3.21 O ATOM 490 CB LYS A 31 -4.701 6.171 16.697 1.00 62.31 C ATOM 491 CG LYS A 31 -3.498 5.401 16.130 1.00 23.21 C ATOM 492 CD LYS A 31 -2.191 6.232 16.241 1.00 52.31 C ATOM 493 CE LYS A 31 -1.500 6.338 14.868 1.00 1.21 C ATOM 494 NZ LYS A 31 -0.564 5.191 14.704 1.00 41.14 N ATOM 0 H LYS A 31 -5.642 5.596 14.290 1.00 31.25 H new ATOM 0 HA LYS A 31 -6.005 7.810 16.171 1.00 54.12 H new ATOM 0 HB2 LYS A 31 -4.396 6.713 17.592 1.00 62.31 H new ATOM 0 HB3 LYS A 31 -5.474 5.465 17.000 1.00 62.31 H new ATOM 0 HG2 LYS A 31 -3.380 4.460 16.668 1.00 23.21 H new ATOM 0 HG3 LYS A 31 -3.684 5.150 15.086 1.00 23.21 H new ATOM 0 HD2 LYS A 31 -2.418 7.229 16.618 1.00 52.31 H new ATOM 0 HD3 LYS A 31 -1.516 5.766 16.959 1.00 52.31 H new ATOM 0 HE2 LYS A 31 -2.244 6.333 14.071 1.00 1.21 H new ATOM 0 HE3 LYS A 31 -0.957 7.280 14.792 1.00 1.21 H new ATOM 0 HZ1 LYS A 31 0.050 5.359 13.882 1.00 41.14 H new ATOM 0 HZ2 LYS A 31 0.020 5.095 15.559 1.00 41.14 H new ATOM 0 HZ3 LYS A 31 -1.108 4.317 14.556 1.00 41.14 H new ATOM 508 N MET A 32 -3.761 7.934 13.879 1.00 3.13 N ATOM 509 CA MET A 32 -2.716 8.833 13.363 1.00 21.14 C ATOM 510 C MET A 32 -3.300 10.167 12.935 1.00 15.43 C ATOM 511 O MET A 32 -4.514 10.361 12.899 1.00 32.15 O ATOM 512 CB MET A 32 -1.934 8.224 12.172 1.00 15.31 C ATOM 513 CG MET A 32 -2.866 7.475 11.207 1.00 0.23 C ATOM 514 SD MET A 32 -1.935 6.160 10.377 1.00 61.54 S ATOM 515 CE MET A 32 -1.888 5.000 11.764 1.00 4.52 C ATOM 0 H MET A 32 -4.093 7.224 13.226 1.00 3.13 H new ATOM 0 HA MET A 32 -2.020 8.980 14.189 1.00 21.14 H new ATOM 0 HB2 MET A 32 -1.414 9.017 11.634 1.00 15.31 H new ATOM 0 HB3 MET A 32 -1.173 7.540 12.547 1.00 15.31 H new ATOM 0 HG2 MET A 32 -3.709 7.051 11.753 1.00 0.23 H new ATOM 0 HG3 MET A 32 -3.278 8.166 10.471 1.00 0.23 H new ATOM 0 HE1 MET A 32 -0.852 4.770 12.011 1.00 4.52 H new ATOM 0 HE2 MET A 32 -2.376 5.448 12.630 1.00 4.52 H new ATOM 0 HE3 MET A 32 -2.408 4.082 11.489 1.00 4.52 H new ATOM 525 N LYS A 33 -2.398 11.077 12.598 1.00 23.10 N ATOM 526 CA LYS A 33 -2.764 12.413 12.142 1.00 64.13 C ATOM 527 C LYS A 33 -2.417 12.533 10.657 1.00 15.40 C ATOM 528 O LYS A 33 -1.880 11.591 10.073 1.00 72.35 O ATOM 529 CB LYS A 33 -2.001 13.472 12.943 1.00 2.42 C ATOM 530 CG LYS A 33 -1.942 13.067 14.420 1.00 12.41 C ATOM 531 CD LYS A 33 -3.362 12.953 14.983 1.00 21.25 C ATOM 532 CE LYS A 33 -3.309 12.959 16.512 1.00 3.31 C ATOM 533 NZ LYS A 33 -2.563 11.761 16.988 1.00 43.44 N ATOM 0 H LYS A 33 -1.392 10.912 12.632 1.00 23.10 H new ATOM 0 HA LYS A 33 -3.832 12.573 12.290 1.00 64.13 H new ATOM 0 HB2 LYS A 33 -0.992 13.583 12.547 1.00 2.42 H new ATOM 0 HB3 LYS A 33 -2.491 14.440 12.842 1.00 2.42 H new ATOM 0 HG2 LYS A 33 -1.422 12.115 14.525 1.00 12.41 H new ATOM 0 HG3 LYS A 33 -1.374 13.805 14.987 1.00 12.41 H new ATOM 0 HD2 LYS A 33 -3.973 13.782 14.627 1.00 21.25 H new ATOM 0 HD3 LYS A 33 -3.832 12.036 14.629 1.00 21.25 H new ATOM 0 HE2 LYS A 33 -2.822 13.868 16.866 1.00 3.31 H new ATOM 0 HE3 LYS A 33 -4.319 12.958 16.921 1.00 3.31 H new ATOM 0 HZ1 LYS A 33 -2.698 11.653 18.014 1.00 43.44 H new ATOM 0 HZ2 LYS A 33 -2.919 10.914 16.501 1.00 43.44 H new ATOM 0 HZ3 LYS A 33 -1.550 11.878 16.783 1.00 43.44 H new ATOM 547 N MET A 34 -2.710 13.669 10.038 1.00 63.34 N ATOM 548 CA MET A 34 -2.435 13.858 8.630 1.00 60.14 C ATOM 549 C MET A 34 -0.975 13.537 8.308 1.00 3.33 C ATOM 550 O MET A 34 -0.078 13.788 9.112 1.00 50.40 O ATOM 551 CB MET A 34 -2.725 15.333 8.364 1.00 71.44 C ATOM 552 CG MET A 34 -2.194 15.790 7.009 1.00 52.31 C ATOM 553 SD MET A 34 -2.644 17.534 6.752 1.00 32.54 S ATOM 554 CE MET A 34 -4.453 17.397 6.886 1.00 61.01 C ATOM 0 H MET A 34 -3.140 14.473 10.496 1.00 63.34 H new ATOM 0 HA MET A 34 -3.041 13.198 8.010 1.00 60.14 H new ATOM 0 HB2 MET A 34 -3.801 15.503 8.407 1.00 71.44 H new ATOM 0 HB3 MET A 34 -2.275 15.938 9.151 1.00 71.44 H new ATOM 0 HG2 MET A 34 -1.111 15.671 6.970 1.00 52.31 H new ATOM 0 HG3 MET A 34 -2.611 15.173 6.214 1.00 52.31 H new ATOM 0 HE1 MET A 34 -4.920 17.923 6.054 1.00 61.01 H new ATOM 0 HE2 MET A 34 -4.741 16.346 6.859 1.00 61.01 H new ATOM 0 HE3 MET A 34 -4.783 17.839 7.826 1.00 61.01 H new ATOM 564 N ALA A 35 -0.759 12.950 7.125 1.00 31.44 N ATOM 565 CA ALA A 35 0.580 12.554 6.688 1.00 13.12 C ATOM 566 C ALA A 35 0.987 13.299 5.420 1.00 2.12 C ATOM 567 O ALA A 35 0.155 13.919 4.756 1.00 15.31 O ATOM 568 CB ALA A 35 0.609 11.042 6.438 1.00 24.32 C ATOM 0 H ALA A 35 -1.498 12.739 6.454 1.00 31.44 H new ATOM 0 HA ALA A 35 1.291 12.811 7.473 1.00 13.12 H new ATOM 0 HB1 ALA A 35 1.606 10.746 6.112 1.00 24.32 H new ATOM 0 HB2 ALA A 35 0.357 10.516 7.359 1.00 24.32 H new ATOM 0 HB3 ALA A 35 -0.116 10.787 5.665 1.00 24.32 H new ATOM 574 N MET A 36 2.280 13.245 5.099 1.00 54.54 N ATOM 575 CA MET A 36 2.808 13.927 3.918 1.00 11.34 C ATOM 576 C MET A 36 3.679 12.972 3.092 1.00 63.31 C ATOM 577 O MET A 36 4.134 11.942 3.589 1.00 74.32 O ATOM 578 CB MET A 36 3.637 15.162 4.336 1.00 15.23 C ATOM 579 CG MET A 36 3.726 15.266 5.865 1.00 64.12 C ATOM 580 SD MET A 36 2.124 15.780 6.532 1.00 62.31 S ATOM 581 CE MET A 36 2.749 16.536 8.053 1.00 14.11 C ATOM 0 H MET A 36 2.980 12.737 5.640 1.00 54.54 H new ATOM 0 HA MET A 36 1.967 14.255 3.307 1.00 11.34 H new ATOM 0 HB2 MET A 36 4.639 15.093 3.913 1.00 15.23 H new ATOM 0 HB3 MET A 36 3.181 16.066 3.931 1.00 15.23 H new ATOM 0 HG2 MET A 36 4.016 14.305 6.289 1.00 64.12 H new ATOM 0 HG3 MET A 36 4.496 15.984 6.147 1.00 64.12 H new ATOM 0 HE1 MET A 36 1.914 16.929 8.634 1.00 14.11 H new ATOM 0 HE2 MET A 36 3.279 15.786 8.641 1.00 14.11 H new ATOM 0 HE3 MET A 36 3.431 17.349 7.802 1.00 14.11 H new ATOM 591 N ALA A 37 3.889 13.321 1.823 1.00 13.23 N ATOM 592 CA ALA A 37 4.694 12.482 0.936 1.00 53.14 C ATOM 593 C ALA A 37 5.248 13.275 -0.255 1.00 0.13 C ATOM 594 O ALA A 37 4.754 14.342 -0.582 1.00 62.44 O ATOM 595 CB ALA A 37 3.839 11.311 0.446 1.00 24.12 C ATOM 0 H ALA A 37 3.519 14.167 1.390 1.00 13.23 H new ATOM 0 HA ALA A 37 5.551 12.109 1.497 1.00 53.14 H new ATOM 0 HB1 ALA A 37 4.432 10.680 -0.216 1.00 24.12 H new ATOM 0 HB2 ALA A 37 3.502 10.724 1.300 1.00 24.12 H new ATOM 0 HB3 ALA A 37 2.974 11.694 -0.096 1.00 24.12 H new ATOM 601 N ARG A 38 6.273 12.726 -0.906 1.00 20.53 N ATOM 602 CA ARG A 38 6.888 13.378 -2.078 1.00 4.52 C ATOM 603 C ARG A 38 7.017 12.360 -3.210 1.00 71.21 C ATOM 604 O ARG A 38 7.473 11.245 -2.969 1.00 22.01 O ATOM 605 CB ARG A 38 8.271 13.924 -1.705 1.00 0.11 C ATOM 606 CG ARG A 38 9.039 14.311 -2.973 1.00 71.03 C ATOM 607 CD ARG A 38 10.211 15.224 -2.608 1.00 41.44 C ATOM 608 NE ARG A 38 11.176 14.502 -1.786 1.00 61.12 N ATOM 609 CZ ARG A 38 12.422 14.942 -1.643 1.00 43.41 C ATOM 610 NH1 ARG A 38 12.800 16.039 -2.241 1.00 1.43 N ATOM 611 NH2 ARG A 38 13.267 14.278 -0.903 1.00 55.23 N ATOM 0 H ARG A 38 6.699 11.835 -0.649 1.00 20.53 H new ATOM 0 HA ARG A 38 6.260 14.207 -2.405 1.00 4.52 H new ATOM 0 HB2 ARG A 38 8.165 14.792 -1.054 1.00 0.11 H new ATOM 0 HB3 ARG A 38 8.829 13.173 -1.146 1.00 0.11 H new ATOM 0 HG2 ARG A 38 9.406 13.416 -3.475 1.00 71.03 H new ATOM 0 HG3 ARG A 38 8.374 14.819 -3.672 1.00 71.03 H new ATOM 0 HD2 ARG A 38 10.695 15.587 -3.515 1.00 41.44 H new ATOM 0 HD3 ARG A 38 9.846 16.099 -2.069 1.00 41.44 H new ATOM 0 HE ARG A 38 10.890 13.645 -1.313 1.00 61.12 H new ATOM 0 HH11 ARG A 38 12.139 16.559 -2.818 1.00 1.43 H new ATOM 0 HH12 ARG A 38 13.756 16.376 -2.131 1.00 1.43 H new ATOM 0 HH21 ARG A 38 12.971 13.422 -0.435 1.00 55.23 H new ATOM 0 HH22 ARG A 38 14.223 14.615 -0.793 1.00 55.23 H new ATOM 625 N ILE A 39 6.606 12.720 -4.441 1.00 41.21 N ATOM 626 CA ILE A 39 6.658 11.803 -5.584 1.00 15.13 C ATOM 627 C ILE A 39 7.520 12.374 -6.706 1.00 22.01 C ATOM 628 O ILE A 39 7.549 13.583 -6.926 1.00 55.43 O ATOM 629 CB ILE A 39 5.232 11.543 -6.023 1.00 13.54 C ATOM 630 CG1 ILE A 39 5.106 10.378 -6.995 1.00 32.15 C ATOM 631 CG2 ILE A 39 4.665 12.741 -6.682 1.00 62.11 C ATOM 632 CD1 ILE A 39 3.609 10.052 -7.138 1.00 45.13 C ATOM 0 H ILE A 39 6.234 13.643 -4.664 1.00 41.21 H new ATOM 0 HA ILE A 39 7.127 10.860 -5.304 1.00 15.13 H new ATOM 0 HB ILE A 39 4.686 11.295 -5.112 1.00 13.54 H new ATOM 0 HG12 ILE A 39 5.535 10.638 -7.962 1.00 32.15 H new ATOM 0 HG13 ILE A 39 5.653 9.511 -6.626 1.00 32.15 H new ATOM 0 HG21 ILE A 39 3.640 12.536 -6.991 1.00 62.11 H new ATOM 0 HG22 ILE A 39 4.673 13.578 -5.984 1.00 62.11 H new ATOM 0 HG23 ILE A 39 5.264 12.993 -7.557 1.00 62.11 H new ATOM 0 HD11 ILE A 39 3.482 9.219 -7.830 1.00 45.13 H new ATOM 0 HD12 ILE A 39 3.201 9.780 -6.164 1.00 45.13 H new ATOM 0 HD13 ILE A 39 3.081 10.925 -7.521 1.00 45.13 H new ATOM 644 N SER A 40 8.232 11.490 -7.408 1.00 34.35 N ATOM 645 CA SER A 40 9.109 11.908 -8.505 1.00 73.31 C ATOM 646 C SER A 40 8.977 10.951 -9.687 1.00 1.44 C ATOM 647 O SER A 40 8.749 9.755 -9.507 1.00 55.15 O ATOM 648 CB SER A 40 10.566 11.935 -8.018 1.00 71.54 C ATOM 649 OG SER A 40 11.381 11.166 -8.894 1.00 50.44 O ATOM 0 H SER A 40 8.219 10.484 -7.238 1.00 34.35 H new ATOM 0 HA SER A 40 8.815 12.906 -8.830 1.00 73.31 H new ATOM 0 HB2 SER A 40 10.927 12.963 -7.979 1.00 71.54 H new ATOM 0 HB3 SER A 40 10.628 11.537 -7.005 1.00 71.54 H new ATOM 0 HG SER A 40 12.309 11.187 -8.580 1.00 50.44 H new ATOM 655 N PHE A 41 9.102 11.490 -10.899 1.00 70.11 N ATOM 656 CA PHE A 41 8.974 10.677 -12.107 1.00 63.21 C ATOM 657 C PHE A 41 10.317 10.106 -12.558 1.00 41.11 C ATOM 658 O PHE A 41 11.098 10.765 -13.244 1.00 5.24 O ATOM 659 CB PHE A 41 8.371 11.523 -13.237 1.00 33.00 C ATOM 660 CG PHE A 41 6.885 11.256 -13.360 1.00 72.23 C ATOM 661 CD1 PHE A 41 6.090 11.169 -12.211 1.00 0.12 C ATOM 662 CD2 PHE A 41 6.307 11.093 -14.625 1.00 31.51 C ATOM 663 CE1 PHE A 41 4.718 10.918 -12.328 1.00 20.32 C ATOM 664 CE2 PHE A 41 4.935 10.842 -14.741 1.00 11.21 C ATOM 665 CZ PHE A 41 4.140 10.754 -13.592 1.00 3.30 C ATOM 0 H PHE A 41 9.290 12.478 -11.070 1.00 70.11 H new ATOM 0 HA PHE A 41 8.318 9.839 -11.873 1.00 63.21 H new ATOM 0 HB2 PHE A 41 8.542 12.581 -13.039 1.00 33.00 H new ATOM 0 HB3 PHE A 41 8.868 11.291 -14.179 1.00 33.00 H new ATOM 0 HD1 PHE A 41 6.535 11.295 -11.235 1.00 0.12 H new ATOM 0 HD2 PHE A 41 6.920 11.161 -15.511 1.00 31.51 H new ATOM 0 HE1 PHE A 41 4.105 10.851 -11.442 1.00 20.32 H new ATOM 0 HE2 PHE A 41 4.490 10.716 -15.717 1.00 11.21 H new ATOM 0 HZ PHE A 41 3.081 10.560 -13.681 1.00 3.30 H new ATOM 675 N LEU A 42 10.533 8.855 -12.202 1.00 11.24 N ATOM 676 CA LEU A 42 11.743 8.148 -12.607 1.00 65.41 C ATOM 677 C LEU A 42 11.561 7.726 -14.058 1.00 73.33 C ATOM 678 O LEU A 42 12.500 7.685 -14.851 1.00 4.42 O ATOM 679 CB LEU A 42 11.969 6.903 -11.740 1.00 52.33 C ATOM 680 CG LEU A 42 12.573 7.272 -10.380 1.00 74.45 C ATOM 681 CD1 LEU A 42 12.667 5.998 -9.525 1.00 63.34 C ATOM 682 CD2 LEU A 42 13.975 7.882 -10.562 1.00 11.53 C ATOM 0 H LEU A 42 9.890 8.303 -11.634 1.00 11.24 H new ATOM 0 HA LEU A 42 12.608 8.800 -12.488 1.00 65.41 H new ATOM 0 HB2 LEU A 42 11.022 6.385 -11.591 1.00 52.33 H new ATOM 0 HB3 LEU A 42 12.633 6.211 -12.259 1.00 52.33 H new ATOM 0 HG LEU A 42 11.940 8.010 -9.888 1.00 74.45 H new ATOM 0 HD11 LEU A 42 13.095 6.243 -8.553 1.00 63.34 H new ATOM 0 HD12 LEU A 42 11.671 5.578 -9.387 1.00 63.34 H new ATOM 0 HD13 LEU A 42 13.302 5.268 -10.028 1.00 63.34 H new ATOM 0 HD21 LEU A 42 14.390 8.138 -9.587 1.00 11.53 H new ATOM 0 HD22 LEU A 42 14.625 7.159 -11.054 1.00 11.53 H new ATOM 0 HD23 LEU A 42 13.904 8.781 -11.174 1.00 11.53 H new ATOM 694 N GLY A 43 10.311 7.420 -14.366 1.00 34.45 N ATOM 695 CA GLY A 43 9.893 6.994 -15.694 1.00 75.32 C ATOM 696 C GLY A 43 8.413 6.618 -15.652 1.00 1.45 C ATOM 697 O GLY A 43 7.911 6.196 -14.614 1.00 23.42 O ATOM 0 H GLY A 43 9.547 7.461 -13.692 1.00 34.45 H new ATOM 0 HA2 GLY A 43 10.058 7.794 -16.415 1.00 75.32 H new ATOM 0 HA3 GLY A 43 10.489 6.142 -16.021 1.00 75.32 H new ATOM 701 N GLU A 44 7.709 6.777 -16.761 1.00 55.11 N ATOM 702 CA GLU A 44 6.288 6.442 -16.779 1.00 63.34 C ATOM 703 C GLU A 44 6.077 5.035 -16.230 1.00 45.43 C ATOM 704 O GLU A 44 5.032 4.733 -15.652 1.00 42.53 O ATOM 705 CB GLU A 44 5.740 6.530 -18.204 1.00 64.34 C ATOM 706 CG GLU A 44 5.828 7.976 -18.698 1.00 51.34 C ATOM 707 CD GLU A 44 7.274 8.332 -19.024 1.00 65.41 C ATOM 708 OE1 GLU A 44 8.058 7.421 -19.228 1.00 4.13 O ATOM 709 OE2 GLU A 44 7.577 9.514 -19.065 1.00 32.42 O ATOM 0 H GLU A 44 8.084 7.127 -17.643 1.00 55.11 H new ATOM 0 HA GLU A 44 5.753 7.155 -16.151 1.00 63.34 H new ATOM 0 HB2 GLU A 44 6.308 5.874 -18.864 1.00 64.34 H new ATOM 0 HB3 GLU A 44 4.705 6.189 -18.228 1.00 64.34 H new ATOM 0 HG2 GLU A 44 5.205 8.104 -19.583 1.00 51.34 H new ATOM 0 HG3 GLU A 44 5.442 8.653 -17.936 1.00 51.34 H new ATOM 716 N ASP A 45 7.081 4.180 -16.404 1.00 53.31 N ATOM 717 CA ASP A 45 7.008 2.806 -15.912 1.00 11.13 C ATOM 718 C ASP A 45 7.776 2.679 -14.600 1.00 10.04 C ATOM 719 O ASP A 45 8.088 1.575 -14.156 1.00 52.13 O ATOM 720 CB ASP A 45 7.604 1.847 -16.947 1.00 4.14 C ATOM 721 CG ASP A 45 7.124 2.224 -18.344 1.00 51.14 C ATOM 722 OD1 ASP A 45 6.017 2.725 -18.453 1.00 32.45 O ATOM 723 OD2 ASP A 45 7.871 2.006 -19.284 1.00 22.02 O ATOM 0 H ASP A 45 7.952 4.413 -16.880 1.00 53.31 H new ATOM 0 HA ASP A 45 5.962 2.550 -15.743 1.00 11.13 H new ATOM 0 HB2 ASP A 45 8.693 1.884 -16.905 1.00 4.14 H new ATOM 0 HB3 ASP A 45 7.311 0.823 -16.717 1.00 4.14 H new ATOM 728 N GLU A 46 8.088 3.821 -13.993 1.00 32.31 N ATOM 729 CA GLU A 46 8.832 3.829 -12.739 1.00 73.43 C ATOM 730 C GLU A 46 8.824 5.219 -12.100 1.00 34.51 C ATOM 731 O GLU A 46 9.192 6.205 -12.730 1.00 30.11 O ATOM 732 CB GLU A 46 10.280 3.404 -13.010 1.00 4.15 C ATOM 733 CG GLU A 46 11.030 3.216 -11.690 1.00 30.44 C ATOM 734 CD GLU A 46 12.519 3.023 -11.960 1.00 45.35 C ATOM 735 OE1 GLU A 46 12.900 3.060 -13.119 1.00 60.32 O ATOM 736 OE2 GLU A 46 13.256 2.839 -11.006 1.00 54.02 O ATOM 0 H GLU A 46 7.839 4.745 -14.346 1.00 32.31 H new ATOM 0 HA GLU A 46 8.355 3.132 -12.050 1.00 73.43 H new ATOM 0 HB2 GLU A 46 10.294 2.475 -13.580 1.00 4.15 H new ATOM 0 HB3 GLU A 46 10.781 4.158 -13.617 1.00 4.15 H new ATOM 0 HG2 GLU A 46 10.878 4.084 -11.049 1.00 30.44 H new ATOM 0 HG3 GLU A 46 10.634 2.352 -11.157 1.00 30.44 H new ATOM 743 N LEU A 47 8.413 5.292 -10.838 1.00 40.43 N ATOM 744 CA LEU A 47 8.383 6.567 -10.120 1.00 11.44 C ATOM 745 C LEU A 47 8.871 6.368 -8.686 1.00 10.44 C ATOM 746 O LEU A 47 8.691 5.310 -8.097 1.00 44.20 O ATOM 747 CB LEU A 47 6.981 7.207 -10.131 1.00 20.14 C ATOM 748 CG LEU A 47 5.889 6.142 -10.287 1.00 54.12 C ATOM 749 CD1 LEU A 47 4.546 6.762 -9.893 1.00 2.14 C ATOM 750 CD2 LEU A 47 5.826 5.630 -11.744 1.00 3.34 C ATOM 0 H LEU A 47 8.097 4.490 -10.292 1.00 40.43 H new ATOM 0 HA LEU A 47 9.052 7.255 -10.637 1.00 11.44 H new ATOM 0 HB2 LEU A 47 6.823 7.761 -9.206 1.00 20.14 H new ATOM 0 HB3 LEU A 47 6.912 7.925 -10.948 1.00 20.14 H new ATOM 0 HG LEU A 47 6.116 5.293 -9.642 1.00 54.12 H new ATOM 0 HD11 LEU A 47 3.757 6.018 -9.998 1.00 2.14 H new ATOM 0 HD12 LEU A 47 4.591 7.100 -8.858 1.00 2.14 H new ATOM 0 HD13 LEU A 47 4.333 7.611 -10.542 1.00 2.14 H new ATOM 0 HD21 LEU A 47 5.044 4.875 -11.831 1.00 3.34 H new ATOM 0 HD22 LEU A 47 5.604 6.462 -12.413 1.00 3.34 H new ATOM 0 HD23 LEU A 47 6.786 5.191 -12.017 1.00 3.34 H new ATOM 762 N LYS A 48 9.491 7.397 -8.131 1.00 13.43 N ATOM 763 CA LYS A 48 9.991 7.326 -6.760 1.00 71.43 C ATOM 764 C LYS A 48 9.060 8.104 -5.841 1.00 61.35 C ATOM 765 O LYS A 48 8.867 9.305 -6.035 1.00 11.03 O ATOM 766 CB LYS A 48 11.398 7.923 -6.688 1.00 32.54 C ATOM 767 CG LYS A 48 12.074 7.494 -5.384 1.00 70.50 C ATOM 768 CD LYS A 48 13.323 8.349 -5.149 1.00 65.55 C ATOM 769 CE LYS A 48 14.239 8.277 -6.373 1.00 70.34 C ATOM 770 NZ LYS A 48 13.738 9.207 -7.425 1.00 14.31 N ATOM 0 H LYS A 48 9.661 8.286 -8.601 1.00 13.43 H new ATOM 0 HA LYS A 48 10.029 6.283 -6.444 1.00 71.43 H new ATOM 0 HB2 LYS A 48 11.989 7.591 -7.542 1.00 32.54 H new ATOM 0 HB3 LYS A 48 11.345 9.010 -6.741 1.00 32.54 H new ATOM 0 HG2 LYS A 48 11.382 7.606 -4.549 1.00 70.50 H new ATOM 0 HG3 LYS A 48 12.346 6.440 -5.433 1.00 70.50 H new ATOM 0 HD2 LYS A 48 13.036 9.383 -4.958 1.00 65.55 H new ATOM 0 HD3 LYS A 48 13.854 7.997 -4.265 1.00 65.55 H new ATOM 0 HE2 LYS A 48 15.259 8.543 -6.093 1.00 70.34 H new ATOM 0 HE3 LYS A 48 14.269 7.258 -6.758 1.00 70.34 H new ATOM 0 HZ1 LYS A 48 14.542 9.695 -7.869 1.00 14.31 H new ATOM 0 HZ2 LYS A 48 13.219 8.667 -8.147 1.00 14.31 H new ATOM 0 HZ3 LYS A 48 13.103 9.909 -6.994 1.00 14.31 H new ATOM 784 N VAL A 49 8.487 7.435 -4.831 1.00 44.43 N ATOM 785 CA VAL A 49 7.591 8.128 -3.903 1.00 22.14 C ATOM 786 C VAL A 49 7.925 7.799 -2.451 1.00 40.03 C ATOM 787 O VAL A 49 8.312 6.683 -2.107 1.00 3.01 O ATOM 788 CB VAL A 49 6.093 7.916 -4.279 1.00 12.35 C ATOM 789 CG1 VAL A 49 5.428 6.732 -3.570 1.00 63.23 C ATOM 790 CG2 VAL A 49 5.287 9.165 -3.921 1.00 41.24 C ATOM 0 H VAL A 49 8.624 6.442 -4.640 1.00 44.43 H new ATOM 0 HA VAL A 49 7.760 9.200 -4.003 1.00 22.14 H new ATOM 0 HB VAL A 49 6.093 7.711 -5.349 1.00 12.35 H new ATOM 0 HG11 VAL A 49 4.388 6.655 -3.888 1.00 63.23 H new ATOM 0 HG12 VAL A 49 5.954 5.812 -3.826 1.00 63.23 H new ATOM 0 HG13 VAL A 49 5.468 6.885 -2.491 1.00 63.23 H new ATOM 0 HG21 VAL A 49 4.241 9.011 -4.186 1.00 41.24 H new ATOM 0 HG22 VAL A 49 5.366 9.355 -2.851 1.00 41.24 H new ATOM 0 HG23 VAL A 49 5.679 10.021 -4.471 1.00 41.24 H new ATOM 800 N SER A 50 7.802 8.838 -1.629 1.00 14.24 N ATOM 801 CA SER A 50 8.122 8.755 -0.203 1.00 60.14 C ATOM 802 C SER A 50 6.885 8.900 0.668 1.00 75.14 C ATOM 803 O SER A 50 5.949 9.620 0.322 1.00 13.45 O ATOM 804 CB SER A 50 9.109 9.862 0.157 1.00 14.31 C ATOM 805 OG SER A 50 10.371 9.581 -0.433 1.00 10.25 O ATOM 0 H SER A 50 7.479 9.758 -1.929 1.00 14.24 H new ATOM 0 HA SER A 50 8.554 7.772 -0.018 1.00 60.14 H new ATOM 0 HB2 SER A 50 8.737 10.824 -0.195 1.00 14.31 H new ATOM 0 HB3 SER A 50 9.210 9.936 1.240 1.00 14.31 H new ATOM 0 HG SER A 50 11.005 10.292 -0.204 1.00 10.25 H new ATOM 811 N TYR A 51 6.896 8.217 1.816 1.00 72.42 N ATOM 812 CA TYR A 51 5.780 8.278 2.752 1.00 41.53 C ATOM 813 C TYR A 51 6.229 8.945 4.050 1.00 53.10 C ATOM 814 O TYR A 51 7.234 8.544 4.636 1.00 44.43 O ATOM 815 CB TYR A 51 5.320 6.858 3.129 1.00 45.40 C ATOM 816 CG TYR A 51 4.845 6.054 1.930 1.00 72.31 C ATOM 817 CD1 TYR A 51 5.668 5.871 0.806 1.00 1.41 C ATOM 818 CD2 TYR A 51 3.576 5.454 1.962 1.00 4.41 C ATOM 819 CE1 TYR A 51 5.220 5.099 -0.272 1.00 60.03 C ATOM 820 CE2 TYR A 51 3.134 4.686 0.882 1.00 14.42 C ATOM 821 CZ TYR A 51 3.955 4.508 -0.233 1.00 62.13 C ATOM 822 OH TYR A 51 3.516 3.744 -1.292 1.00 32.04 O ATOM 0 H TYR A 51 7.665 7.618 2.115 1.00 72.42 H new ATOM 0 HA TYR A 51 4.975 8.836 2.273 1.00 41.53 H new ATOM 0 HB2 TYR A 51 6.143 6.331 3.611 1.00 45.40 H new ATOM 0 HB3 TYR A 51 4.513 6.924 3.859 1.00 45.40 H new ATOM 0 HD1 TYR A 51 6.647 6.326 0.774 1.00 1.41 H new ATOM 0 HD2 TYR A 51 2.940 5.587 2.824 1.00 4.41 H new ATOM 0 HE1 TYR A 51 5.854 4.960 -1.136 1.00 60.03 H new ATOM 0 HE2 TYR A 51 2.156 4.229 0.910 1.00 14.42 H new ATOM 0 HH TYR A 51 4.233 3.660 -1.954 1.00 32.04 H new ATOM 832 N ALA A 52 5.481 9.945 4.513 1.00 63.05 N ATOM 833 CA ALA A 52 5.820 10.627 5.764 1.00 54.43 C ATOM 834 C ALA A 52 4.613 10.617 6.694 1.00 70.23 C ATOM 835 O ALA A 52 3.620 11.297 6.436 1.00 70.14 O ATOM 836 CB ALA A 52 6.249 12.070 5.479 1.00 11.31 C ATOM 0 H ALA A 52 4.645 10.299 4.048 1.00 63.05 H new ATOM 0 HA ALA A 52 6.648 10.104 6.243 1.00 54.43 H new ATOM 0 HB1 ALA A 52 6.499 12.567 6.416 1.00 11.31 H new ATOM 0 HB2 ALA A 52 7.122 12.068 4.826 1.00 11.31 H new ATOM 0 HB3 ALA A 52 5.432 12.603 4.992 1.00 11.31 H new ATOM 842 N VAL A 53 4.692 9.832 7.771 1.00 13.22 N ATOM 843 CA VAL A 53 3.589 9.728 8.726 1.00 60.10 C ATOM 844 C VAL A 53 4.053 10.136 10.132 1.00 35.32 C ATOM 845 O VAL A 53 4.930 9.485 10.702 1.00 70.25 O ATOM 846 CB VAL A 53 3.093 8.277 8.761 1.00 51.24 C ATOM 847 CG1 VAL A 53 1.674 8.225 9.336 1.00 43.21 C ATOM 848 CG2 VAL A 53 3.092 7.707 7.339 1.00 12.32 C ATOM 0 H VAL A 53 5.505 9.262 8.002 1.00 13.22 H new ATOM 0 HA VAL A 53 2.786 10.396 8.413 1.00 60.10 H new ATOM 0 HB VAL A 53 3.755 7.685 9.393 1.00 51.24 H new ATOM 0 HG11 VAL A 53 1.328 7.192 9.358 1.00 43.21 H new ATOM 0 HG12 VAL A 53 1.677 8.628 10.349 1.00 43.21 H new ATOM 0 HG13 VAL A 53 1.006 8.818 8.711 1.00 43.21 H new ATOM 0 HG21 VAL A 53 2.740 6.676 7.361 1.00 12.32 H new ATOM 0 HG22 VAL A 53 2.432 8.303 6.709 1.00 12.32 H new ATOM 0 HG23 VAL A 53 4.104 7.737 6.934 1.00 12.32 H new ATOM 858 N PRO A 54 3.496 11.178 10.709 1.00 55.04 N ATOM 859 CA PRO A 54 3.886 11.632 12.072 1.00 52.13 C ATOM 860 C PRO A 54 3.142 10.864 13.161 1.00 61.54 C ATOM 861 O PRO A 54 1.987 10.479 12.981 1.00 33.05 O ATOM 862 CB PRO A 54 3.481 13.104 12.067 1.00 21.43 C ATOM 863 CG PRO A 54 2.268 13.153 11.195 1.00 13.30 C ATOM 864 CD PRO A 54 2.443 12.046 10.145 1.00 42.11 C ATOM 0 HA PRO A 54 4.942 11.470 12.286 1.00 52.13 H new ATOM 0 HB2 PRO A 54 3.261 13.459 13.074 1.00 21.43 H new ATOM 0 HB3 PRO A 54 4.279 13.734 11.674 1.00 21.43 H new ATOM 0 HG2 PRO A 54 1.362 12.993 11.780 1.00 13.30 H new ATOM 0 HG3 PRO A 54 2.172 14.129 10.718 1.00 13.30 H new ATOM 0 HD2 PRO A 54 1.515 11.496 9.987 1.00 42.11 H new ATOM 0 HD3 PRO A 54 2.739 12.456 9.179 1.00 42.11 H new ATOM 872 N LYS A 55 3.807 10.647 14.291 1.00 12.13 N ATOM 873 CA LYS A 55 3.189 9.928 15.401 1.00 51.21 C ATOM 874 C LYS A 55 3.815 10.361 16.730 1.00 61.43 C ATOM 875 O LYS A 55 5.025 10.569 16.809 1.00 73.41 O ATOM 876 CB LYS A 55 3.381 8.420 15.218 1.00 75.43 C ATOM 877 CG LYS A 55 2.618 7.947 13.977 1.00 52.15 C ATOM 878 CD LYS A 55 2.510 6.421 13.993 1.00 60.51 C ATOM 879 CE LYS A 55 3.907 5.806 14.122 1.00 64.12 C ATOM 880 NZ LYS A 55 3.858 4.374 13.713 1.00 12.03 N ATOM 0 H LYS A 55 4.764 10.955 14.462 1.00 12.13 H new ATOM 0 HA LYS A 55 2.124 10.161 15.415 1.00 51.21 H new ATOM 0 HB2 LYS A 55 4.441 8.189 15.114 1.00 75.43 H new ATOM 0 HB3 LYS A 55 3.024 7.889 16.100 1.00 75.43 H new ATOM 0 HG2 LYS A 55 1.623 8.392 13.958 1.00 52.15 H new ATOM 0 HG3 LYS A 55 3.132 8.276 13.074 1.00 52.15 H new ATOM 0 HD2 LYS A 55 1.883 6.100 14.824 1.00 60.51 H new ATOM 0 HD3 LYS A 55 2.031 6.071 13.079 1.00 60.51 H new ATOM 0 HE2 LYS A 55 4.615 6.350 13.497 1.00 64.12 H new ATOM 0 HE3 LYS A 55 4.260 5.890 15.150 1.00 64.12 H new ATOM 0 HZ1 LYS A 55 4.806 3.955 13.800 1.00 12.03 H new ATOM 0 HZ2 LYS A 55 3.195 3.860 14.327 1.00 12.03 H new ATOM 0 HZ3 LYS A 55 3.539 4.306 12.726 1.00 12.03 H new ATOM 894 N PRO A 56 3.026 10.496 17.773 1.00 11.11 N ATOM 895 CA PRO A 56 3.539 10.908 19.114 1.00 20.22 C ATOM 896 C PRO A 56 4.377 9.809 19.769 1.00 53.52 C ATOM 897 O PRO A 56 5.333 10.091 20.491 1.00 72.41 O ATOM 898 CB PRO A 56 2.264 11.188 19.919 1.00 42.05 C ATOM 899 CG PRO A 56 1.212 10.343 19.280 1.00 32.32 C ATOM 900 CD PRO A 56 1.568 10.275 17.795 1.00 23.11 C ATOM 0 HA PRO A 56 4.204 11.769 19.055 1.00 20.22 H new ATOM 0 HB2 PRO A 56 2.395 10.928 20.969 1.00 42.05 H new ATOM 0 HB3 PRO A 56 1.998 12.244 19.883 1.00 42.05 H new ATOM 0 HG2 PRO A 56 1.191 9.347 19.722 1.00 32.32 H new ATOM 0 HG3 PRO A 56 0.223 10.777 19.424 1.00 32.32 H new ATOM 0 HD2 PRO A 56 1.303 9.310 17.364 1.00 23.11 H new ATOM 0 HD3 PRO A 56 1.039 11.036 17.221 1.00 23.11 H new ATOM 908 N ASN A 57 4.006 8.558 19.513 1.00 34.52 N ATOM 909 CA ASN A 57 4.727 7.426 20.085 1.00 1.40 C ATOM 910 C ASN A 57 6.049 7.204 19.357 1.00 24.11 C ATOM 911 O ASN A 57 6.992 6.647 19.918 1.00 35.05 O ATOM 912 CB ASN A 57 3.872 6.161 19.990 1.00 44.12 C ATOM 913 CG ASN A 57 2.556 6.365 20.732 1.00 32.21 C ATOM 914 OD1 ASN A 57 1.496 5.977 20.238 1.00 55.25 O ATOM 915 ND2 ASN A 57 2.558 6.954 21.897 1.00 52.15 N ATOM 0 H ASN A 57 3.217 8.304 18.918 1.00 34.52 H new ATOM 0 HA ASN A 57 4.937 7.647 21.132 1.00 1.40 H new ATOM 0 HB2 ASN A 57 3.676 5.922 18.945 1.00 44.12 H new ATOM 0 HB3 ASN A 57 4.411 5.315 20.415 1.00 44.12 H new ATOM 0 HD21 ASN A 57 1.681 7.093 22.399 1.00 52.15 H new ATOM 0 HD22 ASN A 57 3.436 7.275 22.305 1.00 52.15 H new ATOM 922 N GLY A 58 6.111 7.641 18.102 1.00 2.53 N ATOM 923 CA GLY A 58 7.324 7.482 17.309 1.00 31.12 C ATOM 924 C GLY A 58 7.048 7.740 15.832 1.00 62.42 C ATOM 925 O GLY A 58 6.408 6.932 15.160 1.00 10.55 O ATOM 0 H GLY A 58 5.342 8.104 17.617 1.00 2.53 H new ATOM 0 HA2 GLY A 58 8.089 8.172 17.666 1.00 31.12 H new ATOM 0 HA3 GLY A 58 7.718 6.474 17.438 1.00 31.12 H new ATOM 929 N CYS A 59 7.537 8.871 15.334 1.00 51.21 N ATOM 930 CA CYS A 59 7.338 9.229 13.933 1.00 2.24 C ATOM 931 C CYS A 59 8.034 8.222 13.019 1.00 44.25 C ATOM 932 O CYS A 59 9.042 7.623 13.394 1.00 11.32 O ATOM 933 CB CYS A 59 7.891 10.632 13.674 1.00 5.11 C ATOM 934 SG CYS A 59 7.493 11.701 15.080 1.00 2.50 S ATOM 0 H CYS A 59 8.070 9.552 15.875 1.00 51.21 H new ATOM 0 HA CYS A 59 6.270 9.215 13.718 1.00 2.24 H new ATOM 0 HB2 CYS A 59 8.970 10.589 13.529 1.00 5.11 H new ATOM 0 HB3 CYS A 59 7.463 11.041 12.759 1.00 5.11 H new ATOM 939 N ARG A 60 7.488 8.041 11.818 1.00 15.55 N ATOM 940 CA ARG A 60 8.060 7.101 10.853 1.00 62.22 C ATOM 941 C ARG A 60 8.185 7.750 9.477 1.00 15.31 C ATOM 942 O ARG A 60 7.187 8.131 8.866 1.00 53.25 O ATOM 943 CB ARG A 60 7.175 5.858 10.751 1.00 21.43 C ATOM 944 CG ARG A 60 7.875 4.800 9.898 1.00 63.34 C ATOM 945 CD ARG A 60 6.988 3.557 9.796 1.00 62.30 C ATOM 946 NE ARG A 60 7.684 2.498 9.075 1.00 43.34 N ATOM 947 CZ ARG A 60 7.722 2.481 7.746 1.00 14.55 C ATOM 948 NH1 ARG A 60 7.129 3.422 7.063 1.00 45.05 N ATOM 949 NH2 ARG A 60 8.351 1.523 7.124 1.00 12.20 N ATOM 0 H ARG A 60 6.655 8.529 11.490 1.00 15.55 H new ATOM 0 HA ARG A 60 9.054 6.816 11.199 1.00 62.22 H new ATOM 0 HB2 ARG A 60 6.971 5.461 11.746 1.00 21.43 H new ATOM 0 HB3 ARG A 60 6.214 6.119 10.309 1.00 21.43 H new ATOM 0 HG2 ARG A 60 8.079 5.196 8.903 1.00 63.34 H new ATOM 0 HG3 ARG A 60 8.836 4.538 10.341 1.00 63.34 H new ATOM 0 HD2 ARG A 60 6.719 3.211 10.794 1.00 62.30 H new ATOM 0 HD3 ARG A 60 6.059 3.806 9.283 1.00 62.30 H new ATOM 0 HE ARG A 60 8.150 1.757 9.599 1.00 43.34 H new ATOM 0 HH11 ARG A 60 6.636 4.171 7.549 1.00 45.05 H new ATOM 0 HH12 ARG A 60 7.159 3.408 6.044 1.00 45.05 H new ATOM 0 HH21 ARG A 60 8.814 0.787 7.657 1.00 12.20 H new ATOM 0 HH22 ARG A 60 8.380 1.510 6.105 1.00 12.20 H new ATOM 963 N LYS A 61 9.421 7.866 8.994 1.00 3.20 N ATOM 964 CA LYS A 61 9.678 8.463 7.683 1.00 4.24 C ATOM 965 C LYS A 61 10.646 7.595 6.884 1.00 4.32 C ATOM 966 O LYS A 61 11.687 7.179 7.395 1.00 43.24 O ATOM 967 CB LYS A 61 10.266 9.866 7.855 1.00 10.22 C ATOM 968 CG LYS A 61 11.562 9.784 8.663 1.00 42.34 C ATOM 969 CD LYS A 61 11.994 11.193 9.078 1.00 30.40 C ATOM 970 CE LYS A 61 13.394 11.138 9.693 1.00 52.32 C ATOM 971 NZ LYS A 61 13.724 12.461 10.293 1.00 63.14 N ATOM 0 H LYS A 61 10.258 7.556 9.488 1.00 3.20 H new ATOM 0 HA LYS A 61 8.735 8.531 7.141 1.00 4.24 H new ATOM 0 HB2 LYS A 61 10.461 10.311 6.880 1.00 10.22 H new ATOM 0 HB3 LYS A 61 9.549 10.512 8.363 1.00 10.22 H new ATOM 0 HG2 LYS A 61 11.414 9.162 9.546 1.00 42.34 H new ATOM 0 HG3 LYS A 61 12.345 9.312 8.069 1.00 42.34 H new ATOM 0 HD2 LYS A 61 11.991 11.855 8.212 1.00 30.40 H new ATOM 0 HD3 LYS A 61 11.286 11.605 9.797 1.00 30.40 H new ATOM 0 HE2 LYS A 61 13.438 10.360 10.455 1.00 52.32 H new ATOM 0 HE3 LYS A 61 14.128 10.879 8.930 1.00 52.32 H new ATOM 0 HZ1 LYS A 61 14.675 12.425 10.711 1.00 63.14 H new ATOM 0 HZ2 LYS A 61 13.698 13.193 9.555 1.00 63.14 H new ATOM 0 HZ3 LYS A 61 13.029 12.690 11.032 1.00 63.14 H new ATOM 985 N TRP A 62 10.298 7.321 5.629 1.00 55.34 N ATOM 986 CA TRP A 62 11.151 6.497 4.778 1.00 74.55 C ATOM 987 C TRP A 62 10.835 6.733 3.302 1.00 43.13 C ATOM 988 O TRP A 62 9.938 7.504 2.960 1.00 12.21 O ATOM 989 CB TRP A 62 10.987 5.011 5.157 1.00 73.22 C ATOM 990 CG TRP A 62 10.030 4.320 4.235 1.00 3.41 C ATOM 991 CD1 TRP A 62 8.760 4.717 3.989 1.00 64.13 C ATOM 992 CD2 TRP A 62 10.249 3.121 3.440 1.00 54.25 C ATOM 993 NE1 TRP A 62 8.186 3.835 3.090 1.00 34.23 N ATOM 994 CE2 TRP A 62 9.066 2.834 2.722 1.00 25.41 C ATOM 995 CE3 TRP A 62 11.352 2.264 3.275 1.00 21.20 C ATOM 996 CZ2 TRP A 62 8.981 1.732 1.868 1.00 43.24 C ATOM 997 CZ3 TRP A 62 11.269 1.156 2.418 1.00 1.43 C ATOM 998 CH2 TRP A 62 10.086 0.891 1.715 1.00 54.30 C ATOM 0 H TRP A 62 9.442 7.653 5.184 1.00 55.34 H new ATOM 0 HA TRP A 62 12.191 6.780 4.937 1.00 74.55 H new ATOM 0 HB2 TRP A 62 11.956 4.514 5.119 1.00 73.22 H new ATOM 0 HB3 TRP A 62 10.629 4.932 6.183 1.00 73.22 H new ATOM 0 HD1 TRP A 62 8.275 5.579 4.422 1.00 64.13 H new ATOM 0 HE1 TRP A 62 7.231 3.914 2.742 1.00 34.23 H new ATOM 0 HE3 TRP A 62 12.269 2.460 3.811 1.00 21.20 H new ATOM 0 HZ2 TRP A 62 8.067 1.531 1.329 1.00 43.24 H new ATOM 0 HZ3 TRP A 62 12.122 0.504 2.300 1.00 1.43 H new ATOM 0 HH2 TRP A 62 10.029 0.038 1.056 1.00 54.30 H new ATOM 1009 N GLU A 63 11.591 6.065 2.437 1.00 70.22 N ATOM 1010 CA GLU A 63 11.412 6.197 0.991 1.00 32.22 C ATOM 1011 C GLU A 63 11.004 4.863 0.370 1.00 23.05 C ATOM 1012 O GLU A 63 11.220 3.801 0.956 1.00 21.10 O ATOM 1013 CB GLU A 63 12.716 6.682 0.354 1.00 54.11 C ATOM 1014 CG GLU A 63 12.480 7.010 -1.122 1.00 43.30 C ATOM 1015 CD GLU A 63 13.689 7.746 -1.691 1.00 12.33 C ATOM 1016 OE1 GLU A 63 14.743 7.138 -1.775 1.00 22.45 O ATOM 1017 OE2 GLU A 63 13.542 8.907 -2.034 1.00 75.32 O ATOM 0 H GLU A 63 12.336 5.424 2.711 1.00 70.22 H new ATOM 0 HA GLU A 63 10.619 6.922 0.806 1.00 32.22 H new ATOM 0 HB2 GLU A 63 13.081 7.565 0.878 1.00 54.11 H new ATOM 0 HB3 GLU A 63 13.485 5.915 0.447 1.00 54.11 H new ATOM 0 HG2 GLU A 63 12.305 6.092 -1.684 1.00 43.30 H new ATOM 0 HG3 GLU A 63 11.586 7.625 -1.228 1.00 43.30 H new ATOM 1024 N THR A 64 10.418 4.928 -0.824 1.00 2.50 N ATOM 1025 CA THR A 64 9.982 3.723 -1.530 1.00 63.24 C ATOM 1026 C THR A 64 10.056 3.930 -3.040 1.00 65.10 C ATOM 1027 O THR A 64 9.775 5.018 -3.542 1.00 2.44 O ATOM 1028 CB THR A 64 8.543 3.368 -1.133 1.00 71.13 C ATOM 1029 OG1 THR A 64 8.346 3.659 0.242 1.00 52.42 O ATOM 1030 CG2 THR A 64 8.291 1.878 -1.384 1.00 63.50 C ATOM 0 H THR A 64 10.234 5.799 -1.322 1.00 2.50 H new ATOM 0 HA THR A 64 10.646 2.905 -1.251 1.00 63.24 H new ATOM 0 HB THR A 64 7.847 3.956 -1.732 1.00 71.13 H new ATOM 0 HG1 THR A 64 8.861 3.028 0.787 1.00 52.42 H new ATOM 0 HG21 THR A 64 7.268 1.629 -1.101 1.00 63.50 H new ATOM 0 HG22 THR A 64 8.439 1.657 -2.441 1.00 63.50 H new ATOM 0 HG23 THR A 64 8.986 1.286 -0.789 1.00 63.50 H new ATOM 1038 N THR A 65 10.431 2.874 -3.760 1.00 34.42 N ATOM 1039 CA THR A 65 10.535 2.941 -5.218 1.00 15.15 C ATOM 1040 C THR A 65 9.414 2.136 -5.869 1.00 3.42 C ATOM 1041 O THR A 65 9.039 1.071 -5.379 1.00 62.32 O ATOM 1042 CB THR A 65 11.889 2.387 -5.668 1.00 45.40 C ATOM 1043 OG1 THR A 65 12.929 3.067 -4.981 1.00 52.35 O ATOM 1044 CG2 THR A 65 12.051 2.593 -7.175 1.00 73.41 C ATOM 0 H THR A 65 10.667 1.966 -3.361 1.00 34.42 H new ATOM 0 HA THR A 65 10.447 3.983 -5.525 1.00 15.15 H new ATOM 0 HB THR A 65 11.939 1.322 -5.442 1.00 45.40 H new ATOM 0 HG1 THR A 65 13.797 2.712 -5.267 1.00 52.35 H new ATOM 0 HG21 THR A 65 13.015 2.198 -7.495 1.00 73.41 H new ATOM 0 HG22 THR A 65 11.252 2.070 -7.702 1.00 73.41 H new ATOM 0 HG23 THR A 65 12.001 3.657 -7.404 1.00 73.41 H new ATOM 1052 N PHE A 66 8.873 2.662 -6.968 1.00 72.43 N ATOM 1053 CA PHE A 66 7.775 2.012 -7.690 1.00 45.13 C ATOM 1054 C PHE A 66 8.275 1.576 -9.068 1.00 64.34 C ATOM 1055 O PHE A 66 8.765 2.404 -9.835 1.00 15.01 O ATOM 1056 CB PHE A 66 6.652 3.042 -7.891 1.00 32.41 C ATOM 1057 CG PHE A 66 5.840 3.329 -6.633 1.00 4.43 C ATOM 1058 CD1 PHE A 66 6.141 2.751 -5.384 1.00 12.44 C ATOM 1059 CD2 PHE A 66 4.756 4.210 -6.741 1.00 72.30 C ATOM 1060 CE1 PHE A 66 5.354 3.058 -4.266 1.00 45.24 C ATOM 1061 CE2 PHE A 66 3.976 4.512 -5.623 1.00 23.34 C ATOM 1062 CZ PHE A 66 4.272 3.936 -4.388 1.00 24.24 C ATOM 0 H PHE A 66 9.179 3.543 -7.381 1.00 72.43 H new ATOM 0 HA PHE A 66 7.416 1.150 -7.129 1.00 45.13 H new ATOM 0 HB2 PHE A 66 7.088 3.974 -8.250 1.00 32.41 H new ATOM 0 HB3 PHE A 66 5.980 2.684 -8.671 1.00 32.41 H new ATOM 0 HD1 PHE A 66 6.976 2.073 -5.288 1.00 12.44 H new ATOM 0 HD2 PHE A 66 4.522 4.658 -7.695 1.00 72.30 H new ATOM 0 HE1 PHE A 66 5.583 2.616 -3.308 1.00 45.24 H new ATOM 0 HE2 PHE A 66 3.142 5.193 -5.715 1.00 23.34 H new ATOM 0 HZ PHE A 66 3.665 4.168 -3.525 1.00 24.24 H new ATOM 1187 N VAL A 75 -0.299 2.597 -13.512 1.00 55.32 N ATOM 1188 CA VAL A 75 -0.400 2.044 -12.165 1.00 2.32 C ATOM 1189 C VAL A 75 0.986 1.666 -11.680 1.00 1.22 C ATOM 1190 O VAL A 75 1.853 1.384 -12.493 1.00 63.33 O ATOM 1191 CB VAL A 75 -1.298 0.809 -12.154 1.00 64.11 C ATOM 1192 CG1 VAL A 75 -1.445 0.294 -10.713 1.00 32.41 C ATOM 1193 CG2 VAL A 75 -2.669 1.182 -12.728 1.00 24.21 C ATOM 0 HA VAL A 75 -0.837 2.795 -11.506 1.00 2.32 H new ATOM 0 HB VAL A 75 -0.856 0.021 -12.764 1.00 64.11 H new ATOM 0 HG11 VAL A 75 -2.086 -0.588 -10.705 1.00 32.41 H new ATOM 0 HG12 VAL A 75 -0.463 0.032 -10.318 1.00 32.41 H new ATOM 0 HG13 VAL A 75 -1.890 1.072 -10.092 1.00 32.41 H new ATOM 0 HG21 VAL A 75 -3.316 0.305 -12.723 1.00 24.21 H new ATOM 0 HG22 VAL A 75 -3.117 1.967 -12.119 1.00 24.21 H new ATOM 0 HG23 VAL A 75 -2.550 1.540 -13.751 1.00 24.21 H new ATOM 1203 N TYR A 76 1.208 1.690 -10.369 1.00 0.10 N ATOM 1204 CA TYR A 76 2.550 1.367 -9.841 1.00 1.14 C ATOM 1205 C TYR A 76 2.582 -0.006 -9.179 1.00 33.00 C ATOM 1206 O TYR A 76 1.635 -0.382 -8.503 1.00 22.34 O ATOM 1207 CB TYR A 76 2.975 2.433 -8.799 1.00 54.13 C ATOM 1208 CG TYR A 76 3.471 1.766 -7.514 1.00 60.11 C ATOM 1209 CD1 TYR A 76 4.589 0.918 -7.538 1.00 41.13 C ATOM 1210 CD2 TYR A 76 2.801 1.985 -6.305 1.00 43.42 C ATOM 1211 CE1 TYR A 76 5.025 0.298 -6.366 1.00 12.03 C ATOM 1212 CE2 TYR A 76 3.245 1.364 -5.130 1.00 70.24 C ATOM 1213 CZ TYR A 76 4.355 0.522 -5.161 1.00 20.12 C ATOM 1214 OH TYR A 76 4.787 -0.088 -4.003 1.00 14.42 O ATOM 0 H TYR A 76 0.508 1.921 -9.664 1.00 0.10 H new ATOM 0 HA TYR A 76 3.240 1.361 -10.685 1.00 1.14 H new ATOM 0 HB2 TYR A 76 3.762 3.062 -9.215 1.00 54.13 H new ATOM 0 HB3 TYR A 76 2.131 3.085 -8.574 1.00 54.13 H new ATOM 0 HD1 TYR A 76 5.114 0.745 -8.466 1.00 41.13 H new ATOM 0 HD2 TYR A 76 1.939 2.635 -6.278 1.00 43.42 H new ATOM 0 HE1 TYR A 76 5.883 -0.357 -6.391 1.00 12.03 H new ATOM 0 HE2 TYR A 76 2.726 1.538 -4.199 1.00 70.24 H new ATOM 0 HH TYR A 76 4.267 -0.904 -3.850 1.00 14.42 H new ATOM 1224 N TYR A 77 3.700 -0.755 -9.357 1.00 45.44 N ATOM 1225 CA TYR A 77 3.805 -2.064 -8.729 1.00 15.32 C ATOM 1226 C TYR A 77 5.232 -2.366 -8.242 1.00 5.31 C ATOM 1227 O TYR A 77 6.195 -2.279 -9.003 1.00 31.34 O ATOM 1228 CB TYR A 77 3.349 -3.150 -9.711 1.00 12.41 C ATOM 1229 CG TYR A 77 3.649 -4.519 -9.143 1.00 31.32 C ATOM 1230 CD1 TYR A 77 2.782 -5.097 -8.207 1.00 31.00 C ATOM 1231 CD2 TYR A 77 4.795 -5.211 -9.554 1.00 34.24 C ATOM 1232 CE1 TYR A 77 3.062 -6.364 -7.682 1.00 50.53 C ATOM 1233 CE2 TYR A 77 5.075 -6.477 -9.030 1.00 75.04 C ATOM 1234 CZ TYR A 77 4.208 -7.055 -8.093 1.00 51.15 C ATOM 1235 OH TYR A 77 4.485 -8.304 -7.576 1.00 14.13 O ATOM 0 H TYR A 77 4.507 -0.474 -9.913 1.00 45.44 H new ATOM 0 HA TYR A 77 3.157 -2.058 -7.853 1.00 15.32 H new ATOM 0 HB2 TYR A 77 2.280 -3.053 -9.903 1.00 12.41 H new ATOM 0 HB3 TYR A 77 3.857 -3.024 -10.667 1.00 12.41 H new ATOM 0 HD1 TYR A 77 1.897 -4.565 -7.890 1.00 31.00 H new ATOM 0 HD2 TYR A 77 5.463 -4.766 -10.277 1.00 34.24 H new ATOM 0 HE1 TYR A 77 2.394 -6.809 -6.960 1.00 50.53 H new ATOM 0 HE2 TYR A 77 5.959 -7.009 -9.347 1.00 75.04 H new ATOM 0 HH TYR A 77 5.317 -8.643 -7.968 1.00 14.13 H new ATOM 1245 N SER A 78 5.360 -2.729 -6.959 1.00 33.44 N ATOM 1246 CA SER A 78 6.670 -3.061 -6.388 1.00 51.31 C ATOM 1247 C SER A 78 6.747 -4.562 -6.118 1.00 44.42 C ATOM 1248 O SER A 78 6.197 -5.058 -5.135 1.00 55.11 O ATOM 1249 CB SER A 78 6.900 -2.292 -5.080 1.00 53.44 C ATOM 1250 OG SER A 78 7.739 -1.172 -5.335 1.00 70.33 O ATOM 0 H SER A 78 4.581 -2.800 -6.304 1.00 33.44 H new ATOM 0 HA SER A 78 7.443 -2.776 -7.102 1.00 51.31 H new ATOM 0 HB2 SER A 78 5.947 -1.961 -4.667 1.00 53.44 H new ATOM 0 HB3 SER A 78 7.360 -2.944 -4.337 1.00 53.44 H new ATOM 0 HG SER A 78 7.478 -0.428 -4.753 1.00 70.33 H new ATOM 1256 N GLU A 79 7.428 -5.270 -7.002 1.00 64.42 N ATOM 1257 CA GLU A 79 7.570 -6.713 -6.864 1.00 30.01 C ATOM 1258 C GLU A 79 8.039 -7.074 -5.455 1.00 2.23 C ATOM 1259 O GLU A 79 7.676 -8.121 -4.919 1.00 4.33 O ATOM 1260 CB GLU A 79 8.576 -7.237 -7.889 1.00 33.30 C ATOM 1261 CG GLU A 79 8.513 -8.765 -7.932 1.00 30.34 C ATOM 1262 CD GLU A 79 9.584 -9.305 -8.875 1.00 33.33 C ATOM 1263 OE1 GLU A 79 10.294 -8.500 -9.455 1.00 65.52 O ATOM 1264 OE2 GLU A 79 9.679 -10.514 -9.002 1.00 23.34 O ATOM 0 H GLU A 79 7.890 -4.874 -7.820 1.00 64.42 H new ATOM 0 HA GLU A 79 6.598 -7.174 -7.040 1.00 30.01 H new ATOM 0 HB2 GLU A 79 8.355 -6.826 -8.874 1.00 33.30 H new ATOM 0 HB3 GLU A 79 9.582 -6.911 -7.626 1.00 33.30 H new ATOM 0 HG2 GLU A 79 8.659 -9.172 -6.931 1.00 30.34 H new ATOM 0 HG3 GLU A 79 7.527 -9.087 -8.266 1.00 30.34 H new ATOM 1271 N GLU A 80 8.853 -6.203 -4.867 1.00 4.13 N ATOM 1272 CA GLU A 80 9.378 -6.438 -3.524 1.00 34.44 C ATOM 1273 C GLU A 80 8.382 -6.037 -2.431 1.00 22.20 C ATOM 1274 O GLU A 80 8.226 -6.747 -1.436 1.00 25.24 O ATOM 1275 CB GLU A 80 10.675 -5.651 -3.335 1.00 1.22 C ATOM 1276 CG GLU A 80 11.711 -6.118 -4.360 1.00 12.50 C ATOM 1277 CD GLU A 80 11.360 -5.579 -5.743 1.00 21.23 C ATOM 1278 OE1 GLU A 80 10.586 -4.638 -5.813 1.00 33.43 O ATOM 1279 OE2 GLU A 80 11.871 -6.116 -6.713 1.00 3.01 O ATOM 0 H GLU A 80 9.163 -5.331 -5.296 1.00 4.13 H new ATOM 0 HA GLU A 80 9.562 -7.508 -3.430 1.00 34.44 H new ATOM 0 HB2 GLU A 80 10.486 -4.584 -3.454 1.00 1.22 H new ATOM 0 HB3 GLU A 80 11.057 -5.796 -2.324 1.00 1.22 H new ATOM 0 HG2 GLU A 80 12.703 -5.774 -4.068 1.00 12.50 H new ATOM 0 HG3 GLU A 80 11.745 -7.207 -4.384 1.00 12.50 H new ATOM 1286 N ALA A 81 7.741 -4.880 -2.597 1.00 25.42 N ATOM 1287 CA ALA A 81 6.798 -4.379 -1.591 1.00 41.45 C ATOM 1288 C ALA A 81 5.371 -4.885 -1.817 1.00 51.33 C ATOM 1289 O ALA A 81 4.454 -4.471 -1.108 1.00 34.11 O ATOM 1290 CB ALA A 81 6.801 -2.845 -1.605 1.00 41.11 C ATOM 0 H ALA A 81 7.854 -4.275 -3.410 1.00 25.42 H new ATOM 0 HA ALA A 81 7.128 -4.756 -0.623 1.00 41.45 H new ATOM 0 HB1 ALA A 81 6.100 -2.473 -0.858 1.00 41.11 H new ATOM 0 HB2 ALA A 81 7.803 -2.481 -1.376 1.00 41.11 H new ATOM 0 HB3 ALA A 81 6.502 -2.490 -2.591 1.00 41.11 H new ATOM 1296 N LYS A 82 5.187 -5.777 -2.792 1.00 51.43 N ATOM 1297 CA LYS A 82 3.856 -6.330 -3.092 1.00 20.21 C ATOM 1298 C LYS A 82 2.754 -5.329 -2.752 1.00 61.12 C ATOM 1299 O LYS A 82 1.832 -5.621 -1.980 1.00 24.41 O ATOM 1300 CB LYS A 82 3.636 -7.628 -2.314 1.00 71.13 C ATOM 1301 CG LYS A 82 4.556 -8.718 -2.869 1.00 50.23 C ATOM 1302 CD LYS A 82 4.237 -10.051 -2.186 1.00 25.51 C ATOM 1303 CE LYS A 82 5.181 -11.132 -2.714 1.00 23.00 C ATOM 1304 NZ LYS A 82 6.557 -10.888 -2.195 1.00 51.05 N ATOM 0 H LYS A 82 5.935 -6.133 -3.387 1.00 51.43 H new ATOM 0 HA LYS A 82 3.812 -6.538 -4.161 1.00 20.21 H new ATOM 0 HB2 LYS A 82 3.841 -7.469 -1.255 1.00 71.13 H new ATOM 0 HB3 LYS A 82 2.595 -7.940 -2.394 1.00 71.13 H new ATOM 0 HG2 LYS A 82 4.422 -8.808 -3.947 1.00 50.23 H new ATOM 0 HG3 LYS A 82 5.599 -8.450 -2.699 1.00 50.23 H new ATOM 0 HD2 LYS A 82 4.346 -9.954 -1.106 1.00 25.51 H new ATOM 0 HD3 LYS A 82 3.201 -10.332 -2.378 1.00 25.51 H new ATOM 0 HE2 LYS A 82 4.833 -12.117 -2.403 1.00 23.00 H new ATOM 0 HE3 LYS A 82 5.186 -11.125 -3.804 1.00 23.00 H new ATOM 0 HZ1 LYS A 82 7.127 -11.751 -2.304 1.00 51.05 H new ATOM 0 HZ2 LYS A 82 6.997 -10.112 -2.730 1.00 51.05 H new ATOM 0 HZ3 LYS A 82 6.508 -10.630 -1.189 1.00 51.05 H new ATOM 1318 N LYS A 83 2.863 -4.156 -3.355 1.00 61.34 N ATOM 1319 CA LYS A 83 1.894 -3.086 -3.145 1.00 5.42 C ATOM 1320 C LYS A 83 1.838 -2.180 -4.368 1.00 43.43 C ATOM 1321 O LYS A 83 2.871 -1.744 -4.875 1.00 51.02 O ATOM 1322 CB LYS A 83 2.279 -2.263 -1.914 1.00 12.21 C ATOM 1323 CG LYS A 83 1.113 -1.352 -1.520 1.00 44.23 C ATOM 1324 CD LYS A 83 1.612 -0.259 -0.570 1.00 74.25 C ATOM 1325 CE LYS A 83 2.141 -0.895 0.718 1.00 0.32 C ATOM 1326 NZ LYS A 83 3.517 -1.418 0.485 1.00 40.13 N ATOM 0 H LYS A 83 3.617 -3.917 -3.999 1.00 61.34 H new ATOM 0 HA LYS A 83 0.912 -3.532 -2.986 1.00 5.42 H new ATOM 0 HB2 LYS A 83 2.532 -2.925 -1.086 1.00 12.21 H new ATOM 0 HB3 LYS A 83 3.165 -1.665 -2.126 1.00 12.21 H new ATOM 0 HG2 LYS A 83 0.674 -0.901 -2.410 1.00 44.23 H new ATOM 0 HG3 LYS A 83 0.329 -1.936 -1.038 1.00 44.23 H new ATOM 0 HD2 LYS A 83 2.400 0.321 -1.050 1.00 74.25 H new ATOM 0 HD3 LYS A 83 0.802 0.433 -0.339 1.00 74.25 H new ATOM 0 HE2 LYS A 83 2.151 -0.159 1.522 1.00 0.32 H new ATOM 0 HE3 LYS A 83 1.482 -1.703 1.034 1.00 0.32 H new ATOM 0 HZ1 LYS A 83 3.493 -2.457 0.458 1.00 40.13 H new ATOM 0 HZ2 LYS A 83 3.877 -1.056 -0.421 1.00 40.13 H new ATOM 0 HZ3 LYS A 83 4.142 -1.106 1.255 1.00 40.13 H new ATOM 1340 N LYS A 84 0.627 -1.918 -4.850 1.00 12.51 N ATOM 1341 CA LYS A 84 0.445 -1.079 -6.033 1.00 13.44 C ATOM 1342 C LYS A 84 -0.603 -0.007 -5.800 1.00 44.44 C ATOM 1343 O LYS A 84 -1.575 -0.215 -5.073 1.00 11.55 O ATOM 1344 CB LYS A 84 0.032 -1.946 -7.232 1.00 32.15 C ATOM 1345 CG LYS A 84 -1.045 -2.946 -6.810 1.00 61.44 C ATOM 1346 CD LYS A 84 -1.328 -3.906 -7.967 1.00 25.05 C ATOM 1347 CE LYS A 84 -2.316 -4.981 -7.509 1.00 75.31 C ATOM 1348 NZ LYS A 84 -1.736 -5.730 -6.358 1.00 64.50 N ATOM 0 H LYS A 84 -0.239 -2.271 -4.444 1.00 12.51 H new ATOM 0 HA LYS A 84 1.396 -0.588 -6.241 1.00 13.44 H new ATOM 0 HB2 LYS A 84 -0.343 -1.313 -8.036 1.00 32.15 H new ATOM 0 HB3 LYS A 84 0.900 -2.477 -7.623 1.00 32.15 H new ATOM 0 HG2 LYS A 84 -0.716 -3.503 -5.933 1.00 61.44 H new ATOM 0 HG3 LYS A 84 -1.957 -2.419 -6.529 1.00 61.44 H new ATOM 0 HD2 LYS A 84 -1.738 -3.358 -8.816 1.00 25.05 H new ATOM 0 HD3 LYS A 84 -0.401 -4.369 -8.304 1.00 25.05 H new ATOM 0 HE2 LYS A 84 -3.261 -4.522 -7.219 1.00 75.31 H new ATOM 0 HE3 LYS A 84 -2.533 -5.665 -8.330 1.00 75.31 H new ATOM 0 HZ1 LYS A 84 -2.171 -6.673 -6.303 1.00 64.50 H new ATOM 0 HZ2 LYS A 84 -0.709 -5.830 -6.491 1.00 64.50 H new ATOM 0 HZ3 LYS A 84 -1.922 -5.210 -5.477 1.00 64.50 H new ATOM 1362 N VAL A 85 -0.409 1.138 -6.456 1.00 1.33 N ATOM 1363 CA VAL A 85 -1.360 2.235 -6.348 1.00 51.31 C ATOM 1364 C VAL A 85 -1.672 2.791 -7.732 1.00 52.24 C ATOM 1365 O VAL A 85 -0.780 2.997 -8.556 1.00 71.10 O ATOM 1366 CB VAL A 85 -0.861 3.331 -5.368 1.00 52.31 C ATOM 1367 CG1 VAL A 85 -0.140 2.671 -4.188 1.00 41.50 C ATOM 1368 CG2 VAL A 85 0.080 4.391 -6.032 1.00 71.05 C ATOM 0 H VAL A 85 0.391 1.325 -7.061 1.00 1.33 H new ATOM 0 HA VAL A 85 -2.289 1.852 -5.924 1.00 51.31 H new ATOM 0 HB VAL A 85 -1.745 3.872 -5.032 1.00 52.31 H new ATOM 0 HG11 VAL A 85 0.211 3.440 -3.500 1.00 41.50 H new ATOM 0 HG12 VAL A 85 -0.828 2.005 -3.668 1.00 41.50 H new ATOM 0 HG13 VAL A 85 0.711 2.098 -4.556 1.00 41.50 H new ATOM 0 HG21 VAL A 85 0.387 5.123 -5.285 1.00 71.05 H new ATOM 0 HG22 VAL A 85 0.961 3.893 -6.436 1.00 71.05 H new ATOM 0 HG23 VAL A 85 -0.452 4.896 -6.838 1.00 71.05 H new ATOM 1378 N GLU A 86 -2.963 2.964 -7.999 1.00 5.11 N ATOM 1379 CA GLU A 86 -3.414 3.430 -9.308 1.00 3.32 C ATOM 1380 C GLU A 86 -4.181 4.733 -9.192 1.00 11.42 C ATOM 1381 O GLU A 86 -5.107 4.862 -8.392 1.00 54.22 O ATOM 1382 CB GLU A 86 -4.323 2.364 -9.940 1.00 11.43 C ATOM 1383 CG GLU A 86 -5.133 2.969 -11.097 1.00 22.21 C ATOM 1384 CD GLU A 86 -5.605 1.868 -12.042 1.00 63.34 C ATOM 1385 OE1 GLU A 86 -5.632 0.723 -11.620 1.00 62.21 O ATOM 1386 OE2 GLU A 86 -5.933 2.185 -13.173 1.00 63.21 O ATOM 0 H GLU A 86 -3.713 2.790 -7.330 1.00 5.11 H new ATOM 0 HA GLU A 86 -2.537 3.601 -9.932 1.00 3.32 H new ATOM 0 HB2 GLU A 86 -3.720 1.533 -10.305 1.00 11.43 H new ATOM 0 HB3 GLU A 86 -4.999 1.960 -9.186 1.00 11.43 H new ATOM 0 HG2 GLU A 86 -5.991 3.514 -10.704 1.00 22.21 H new ATOM 0 HG3 GLU A 86 -4.521 3.688 -11.642 1.00 22.21 H new ATOM 1393 N VAL A 87 -3.793 5.686 -10.022 1.00 0.33 N ATOM 1394 CA VAL A 87 -4.457 6.984 -10.035 1.00 31.11 C ATOM 1395 C VAL A 87 -5.958 6.796 -10.263 1.00 2.45 C ATOM 1396 O VAL A 87 -6.405 6.556 -11.385 1.00 14.23 O ATOM 1397 CB VAL A 87 -3.862 7.878 -11.133 1.00 63.04 C ATOM 1398 CG1 VAL A 87 -3.854 7.137 -12.480 1.00 51.21 C ATOM 1399 CG2 VAL A 87 -4.697 9.157 -11.259 1.00 34.51 C ATOM 0 H VAL A 87 -3.029 5.590 -10.691 1.00 0.33 H new ATOM 0 HA VAL A 87 -4.301 7.470 -9.072 1.00 31.11 H new ATOM 0 HB VAL A 87 -2.837 8.132 -10.864 1.00 63.04 H new ATOM 0 HG11 VAL A 87 -3.430 7.783 -13.248 1.00 51.21 H new ATOM 0 HG12 VAL A 87 -3.252 6.232 -12.394 1.00 51.21 H new ATOM 0 HG13 VAL A 87 -4.874 6.869 -12.754 1.00 51.21 H new ATOM 0 HG21 VAL A 87 -4.275 9.792 -12.038 1.00 34.51 H new ATOM 0 HG22 VAL A 87 -5.723 8.897 -11.519 1.00 34.51 H new ATOM 0 HG23 VAL A 87 -4.687 9.693 -10.310 1.00 34.51 H new ATOM 1409 N LEU A 88 -6.730 6.887 -9.181 1.00 41.20 N ATOM 1410 CA LEU A 88 -8.183 6.710 -9.253 1.00 43.03 C ATOM 1411 C LEU A 88 -8.887 8.059 -9.409 1.00 34.50 C ATOM 1412 O LEU A 88 -10.022 8.132 -9.875 1.00 31.10 O ATOM 1413 CB LEU A 88 -8.666 6.001 -7.971 1.00 35.44 C ATOM 1414 CG LEU A 88 -9.832 5.041 -8.266 1.00 11.52 C ATOM 1415 CD1 LEU A 88 -10.974 5.802 -8.941 1.00 53.12 C ATOM 1416 CD2 LEU A 88 -9.364 3.886 -9.175 1.00 21.43 C ATOM 0 H LEU A 88 -6.376 7.082 -8.245 1.00 41.20 H new ATOM 0 HA LEU A 88 -8.427 6.102 -10.124 1.00 43.03 H new ATOM 0 HB2 LEU A 88 -7.840 5.446 -7.527 1.00 35.44 H new ATOM 0 HB3 LEU A 88 -8.981 6.744 -7.239 1.00 35.44 H new ATOM 0 HG LEU A 88 -10.185 4.622 -7.324 1.00 11.52 H new ATOM 0 HD11 LEU A 88 -11.796 5.117 -9.147 1.00 53.12 H new ATOM 0 HD12 LEU A 88 -11.321 6.597 -8.281 1.00 53.12 H new ATOM 0 HD13 LEU A 88 -10.620 6.235 -9.876 1.00 53.12 H new ATOM 0 HD21 LEU A 88 -10.201 3.217 -9.373 1.00 21.43 H new ATOM 0 HD22 LEU A 88 -8.993 4.291 -10.116 1.00 21.43 H new ATOM 0 HD23 LEU A 88 -8.567 3.332 -8.679 1.00 21.43 H new ATOM 1428 N ASP A 89 -8.194 9.129 -9.045 1.00 52.04 N ATOM 1429 CA ASP A 89 -8.731 10.480 -9.161 1.00 22.30 C ATOM 1430 C ASP A 89 -7.686 11.452 -8.622 1.00 51.35 C ATOM 1431 O ASP A 89 -7.224 11.310 -7.491 1.00 43.23 O ATOM 1432 CB ASP A 89 -10.039 10.630 -8.364 1.00 5.43 C ATOM 1433 CG ASP A 89 -11.033 11.503 -9.129 1.00 21.30 C ATOM 1434 OD1 ASP A 89 -11.003 12.707 -8.939 1.00 41.13 O ATOM 1435 OD2 ASP A 89 -11.809 10.952 -9.893 1.00 2.35 O ATOM 0 H ASP A 89 -7.249 9.087 -8.663 1.00 52.04 H new ATOM 0 HA ASP A 89 -8.955 10.691 -10.207 1.00 22.30 H new ATOM 0 HB2 ASP A 89 -10.475 9.648 -8.180 1.00 5.43 H new ATOM 0 HB3 ASP A 89 -9.830 11.074 -7.390 1.00 5.43 H new ATOM 1440 N THR A 90 -7.292 12.415 -9.437 1.00 4.01 N ATOM 1441 CA THR A 90 -6.276 13.374 -9.020 1.00 50.20 C ATOM 1442 C THR A 90 -6.480 14.701 -9.761 1.00 53.34 C ATOM 1443 O THR A 90 -6.630 14.728 -10.982 1.00 62.12 O ATOM 1444 CB THR A 90 -4.885 12.746 -9.298 1.00 11.42 C ATOM 1445 OG1 THR A 90 -4.010 12.895 -8.180 1.00 65.02 O ATOM 1446 CG2 THR A 90 -4.227 13.378 -10.528 1.00 13.20 C ATOM 0 H THR A 90 -7.653 12.556 -10.381 1.00 4.01 H new ATOM 0 HA THR A 90 -6.351 13.595 -7.955 1.00 50.20 H new ATOM 0 HB THR A 90 -5.053 11.685 -9.481 1.00 11.42 H new ATOM 0 HG1 THR A 90 -3.257 13.471 -8.428 1.00 65.02 H new ATOM 0 HG21 THR A 90 -3.254 12.917 -10.697 1.00 13.20 H new ATOM 0 HG22 THR A 90 -4.860 13.220 -11.401 1.00 13.20 H new ATOM 0 HG23 THR A 90 -4.098 14.448 -10.362 1.00 13.20 H new ATOM 1454 N ASP A 91 -6.480 15.800 -9.011 1.00 20.02 N ATOM 1455 CA ASP A 91 -6.656 17.125 -9.614 1.00 42.32 C ATOM 1456 C ASP A 91 -5.668 18.106 -9.008 1.00 61.40 C ATOM 1457 O ASP A 91 -5.394 19.171 -9.562 1.00 3.42 O ATOM 1458 CB ASP A 91 -8.083 17.622 -9.378 1.00 65.05 C ATOM 1459 CG ASP A 91 -8.350 18.862 -10.222 1.00 11.04 C ATOM 1460 OD1 ASP A 91 -7.433 19.310 -10.890 1.00 44.42 O ATOM 1461 OD2 ASP A 91 -9.469 19.347 -10.189 1.00 64.23 O ATOM 0 H ASP A 91 -6.362 15.804 -7.998 1.00 20.02 H new ATOM 0 HA ASP A 91 -6.475 17.050 -10.686 1.00 42.32 H new ATOM 0 HB2 ASP A 91 -8.796 16.838 -9.633 1.00 65.05 H new ATOM 0 HB3 ASP A 91 -8.226 17.853 -8.322 1.00 65.05 H new ATOM 1466 N TYR A 92 -5.161 17.732 -7.851 1.00 72.23 N ATOM 1467 CA TYR A 92 -4.218 18.548 -7.107 1.00 13.20 C ATOM 1468 C TYR A 92 -4.758 19.964 -6.914 1.00 10.24 C ATOM 1469 O TYR A 92 -4.074 20.825 -6.361 1.00 24.32 O ATOM 1470 CB TYR A 92 -2.886 18.634 -7.856 1.00 41.21 C ATOM 1471 CG TYR A 92 -2.470 17.273 -8.376 1.00 42.22 C ATOM 1472 CD1 TYR A 92 -2.544 16.137 -7.553 1.00 52.12 C ATOM 1473 CD2 TYR A 92 -1.991 17.150 -9.687 1.00 15.23 C ATOM 1474 CE1 TYR A 92 -2.141 14.891 -8.043 1.00 45.31 C ATOM 1475 CE2 TYR A 92 -1.586 15.904 -10.174 1.00 44.32 C ATOM 1476 CZ TYR A 92 -1.660 14.775 -9.353 1.00 34.02 C ATOM 1477 OH TYR A 92 -1.260 13.548 -9.834 1.00 33.51 O ATOM 0 H TYR A 92 -5.392 16.849 -7.396 1.00 72.23 H new ATOM 0 HA TYR A 92 -4.071 18.080 -6.134 1.00 13.20 H new ATOM 0 HB2 TYR A 92 -2.976 19.333 -8.687 1.00 41.21 H new ATOM 0 HB3 TYR A 92 -2.115 19.025 -7.192 1.00 41.21 H new ATOM 0 HD1 TYR A 92 -2.912 16.226 -6.542 1.00 52.12 H new ATOM 0 HD2 TYR A 92 -1.935 18.021 -10.323 1.00 15.23 H new ATOM 0 HE1 TYR A 92 -2.201 14.017 -7.411 1.00 45.31 H new ATOM 0 HE2 TYR A 92 -1.216 15.813 -11.185 1.00 44.32 H new ATOM 0 HH TYR A 92 -0.954 13.644 -10.760 1.00 33.51 H new ATOM 1487 N LYS A 93 -5.981 20.204 -7.374 1.00 22.31 N ATOM 1488 CA LYS A 93 -6.584 21.524 -7.246 1.00 51.55 C ATOM 1489 C LYS A 93 -7.084 21.721 -5.828 1.00 42.14 C ATOM 1490 O LYS A 93 -7.005 22.815 -5.270 1.00 13.41 O ATOM 1491 CB LYS A 93 -7.746 21.672 -8.230 1.00 71.21 C ATOM 1492 CG LYS A 93 -8.255 23.115 -8.208 1.00 64.03 C ATOM 1493 CD LYS A 93 -9.214 23.339 -9.381 1.00 73.04 C ATOM 1494 CE LYS A 93 -10.467 22.478 -9.200 1.00 51.21 C ATOM 1495 NZ LYS A 93 -11.559 23.003 -10.068 1.00 51.31 N ATOM 0 H LYS A 93 -6.569 19.509 -7.834 1.00 22.31 H new ATOM 0 HA LYS A 93 -5.832 22.280 -7.473 1.00 51.55 H new ATOM 0 HB2 LYS A 93 -7.421 21.406 -9.236 1.00 71.21 H new ATOM 0 HB3 LYS A 93 -8.551 20.987 -7.964 1.00 71.21 H new ATOM 0 HG2 LYS A 93 -8.764 23.318 -7.265 1.00 64.03 H new ATOM 0 HG3 LYS A 93 -7.416 23.808 -8.273 1.00 64.03 H new ATOM 0 HD2 LYS A 93 -9.491 24.392 -9.440 1.00 73.04 H new ATOM 0 HD3 LYS A 93 -8.720 23.086 -10.319 1.00 73.04 H new ATOM 0 HE2 LYS A 93 -10.250 21.441 -9.458 1.00 51.21 H new ATOM 0 HE3 LYS A 93 -10.781 22.488 -8.156 1.00 51.21 H new ATOM 0 HZ1 LYS A 93 -12.411 22.419 -9.946 1.00 51.31 H new ATOM 0 HZ2 LYS A 93 -11.772 23.986 -9.802 1.00 51.31 H new ATOM 0 HZ3 LYS A 93 -11.257 22.971 -11.063 1.00 51.31 H new ATOM 1509 N SER A 94 -7.594 20.643 -5.252 1.00 73.00 N ATOM 1510 CA SER A 94 -8.105 20.681 -3.894 1.00 23.01 C ATOM 1511 C SER A 94 -8.042 19.294 -3.271 1.00 63.33 C ATOM 1512 O SER A 94 -8.044 19.158 -2.048 1.00 12.21 O ATOM 1513 CB SER A 94 -9.549 21.183 -3.892 1.00 22.22 C ATOM 1514 OG SER A 94 -10.294 20.472 -4.873 1.00 61.41 O ATOM 0 H SER A 94 -7.664 19.732 -5.705 1.00 73.00 H new ATOM 0 HA SER A 94 -7.489 21.362 -3.307 1.00 23.01 H new ATOM 0 HB2 SER A 94 -9.994 21.041 -2.907 1.00 22.22 H new ATOM 0 HB3 SER A 94 -9.575 22.252 -4.103 1.00 22.22 H new ATOM 0 HG SER A 94 -10.971 19.918 -4.431 1.00 61.41 H new ATOM 1520 N TYR A 95 -8.000 18.261 -4.113 1.00 21.41 N ATOM 1521 CA TYR A 95 -7.956 16.902 -3.600 1.00 74.45 C ATOM 1522 C TYR A 95 -7.663 15.873 -4.693 1.00 73.30 C ATOM 1523 O TYR A 95 -7.706 16.159 -5.901 1.00 21.12 O ATOM 1524 CB TYR A 95 -9.292 16.567 -2.945 1.00 12.22 C ATOM 1525 CG TYR A 95 -10.407 16.819 -3.931 1.00 4.10 C ATOM 1526 CD1 TYR A 95 -10.786 15.816 -4.831 1.00 4.13 C ATOM 1527 CD2 TYR A 95 -11.061 18.057 -3.947 1.00 42.22 C ATOM 1528 CE1 TYR A 95 -11.818 16.051 -5.748 1.00 30.41 C ATOM 1529 CE2 TYR A 95 -12.093 18.292 -4.863 1.00 41.31 C ATOM 1530 CZ TYR A 95 -12.471 17.289 -5.764 1.00 32.24 C ATOM 1531 OH TYR A 95 -13.487 17.520 -6.668 1.00 14.31 O ATOM 0 H TYR A 95 -7.996 18.340 -5.130 1.00 21.41 H new ATOM 0 HA TYR A 95 -7.144 16.853 -2.875 1.00 74.45 H new ATOM 0 HB2 TYR A 95 -9.302 15.525 -2.625 1.00 12.22 H new ATOM 0 HB3 TYR A 95 -9.436 17.176 -2.052 1.00 12.22 H new ATOM 0 HD1 TYR A 95 -10.282 14.861 -4.818 1.00 4.13 H new ATOM 0 HD2 TYR A 95 -10.769 18.831 -3.252 1.00 42.22 H new ATOM 0 HE1 TYR A 95 -12.110 15.277 -6.443 1.00 30.41 H new ATOM 0 HE2 TYR A 95 -12.598 19.247 -4.875 1.00 41.31 H new ATOM 0 HH TYR A 95 -13.834 18.428 -6.545 1.00 14.31 H new ATOM 1541 N ALA A 96 -7.371 14.661 -4.240 1.00 52.13 N ATOM 1542 CA ALA A 96 -7.090 13.550 -5.137 1.00 33.31 C ATOM 1543 C ALA A 96 -7.524 12.251 -4.470 1.00 51.34 C ATOM 1544 O ALA A 96 -7.332 12.072 -3.266 1.00 74.13 O ATOM 1545 CB ALA A 96 -5.598 13.494 -5.482 1.00 55.32 C ATOM 0 H ALA A 96 -7.323 14.422 -3.250 1.00 52.13 H new ATOM 0 HA ALA A 96 -7.645 13.691 -6.065 1.00 33.31 H new ATOM 0 HB1 ALA A 96 -5.411 12.656 -6.153 1.00 55.32 H new ATOM 0 HB2 ALA A 96 -5.302 14.423 -5.970 1.00 55.32 H new ATOM 0 HB3 ALA A 96 -5.018 13.363 -4.568 1.00 55.32 H new ATOM 1551 N VAL A 97 -8.108 11.348 -5.252 1.00 72.44 N ATOM 1552 CA VAL A 97 -8.565 10.058 -4.714 1.00 13.52 C ATOM 1553 C VAL A 97 -7.836 8.950 -5.440 1.00 72.53 C ATOM 1554 O VAL A 97 -7.758 8.958 -6.668 1.00 70.24 O ATOM 1555 CB VAL A 97 -10.083 9.896 -4.879 1.00 62.23 C ATOM 1556 CG1 VAL A 97 -10.603 8.869 -3.870 1.00 23.52 C ATOM 1557 CG2 VAL A 97 -10.772 11.241 -4.629 1.00 63.21 C ATOM 0 H VAL A 97 -8.277 11.477 -6.250 1.00 72.44 H new ATOM 0 HA VAL A 97 -8.346 10.014 -3.647 1.00 13.52 H new ATOM 0 HB VAL A 97 -10.300 9.556 -5.892 1.00 62.23 H new ATOM 0 HG11 VAL A 97 -11.681 8.756 -3.989 1.00 23.52 H new ATOM 0 HG12 VAL A 97 -10.116 7.910 -4.044 1.00 23.52 H new ATOM 0 HG13 VAL A 97 -10.383 9.210 -2.858 1.00 23.52 H new ATOM 0 HG21 VAL A 97 -11.849 11.125 -4.746 1.00 63.21 H new ATOM 0 HG22 VAL A 97 -10.552 11.580 -3.617 1.00 63.21 H new ATOM 0 HG23 VAL A 97 -10.406 11.976 -5.346 1.00 63.21 H new ATOM 1567 N ILE A 98 -7.244 8.031 -4.689 1.00 33.53 N ATOM 1568 CA ILE A 98 -6.457 6.967 -5.287 1.00 24.44 C ATOM 1569 C ILE A 98 -6.857 5.589 -4.768 1.00 43.24 C ATOM 1570 O ILE A 98 -7.269 5.436 -3.618 1.00 11.30 O ATOM 1571 CB ILE A 98 -5.012 7.247 -4.920 1.00 61.12 C ATOM 1572 CG1 ILE A 98 -4.091 6.181 -5.490 1.00 24.14 C ATOM 1573 CG2 ILE A 98 -4.868 7.259 -3.399 1.00 14.43 C ATOM 1574 CD1 ILE A 98 -2.640 6.606 -5.247 1.00 65.13 C ATOM 0 H ILE A 98 -7.295 8.002 -3.671 1.00 33.53 H new ATOM 0 HA ILE A 98 -6.618 6.952 -6.365 1.00 24.44 H new ATOM 0 HB ILE A 98 -4.734 8.215 -5.337 1.00 61.12 H new ATOM 0 HG12 ILE A 98 -4.288 5.219 -5.016 1.00 24.14 H new ATOM 0 HG13 ILE A 98 -4.274 6.054 -6.557 1.00 24.14 H new ATOM 0 HG21 ILE A 98 -3.830 7.460 -3.133 1.00 14.43 H new ATOM 0 HG22 ILE A 98 -5.507 8.036 -2.979 1.00 14.43 H new ATOM 0 HG23 ILE A 98 -5.164 6.290 -2.998 1.00 14.43 H new ATOM 0 HD11 ILE A 98 -1.967 5.850 -5.651 1.00 65.13 H new ATOM 0 HD12 ILE A 98 -2.453 7.560 -5.741 1.00 65.13 H new ATOM 0 HD13 ILE A 98 -2.466 6.711 -4.176 1.00 65.13 H new ATOM 1586 N TYR A 99 -6.721 4.588 -5.633 1.00 42.22 N ATOM 1587 CA TYR A 99 -7.055 3.214 -5.273 1.00 30.30 C ATOM 1588 C TYR A 99 -5.798 2.463 -4.848 1.00 44.43 C ATOM 1589 O TYR A 99 -4.955 2.119 -5.677 1.00 15.43 O ATOM 1590 CB TYR A 99 -7.693 2.506 -6.470 1.00 65.05 C ATOM 1591 CG TYR A 99 -8.090 1.102 -6.079 1.00 52.20 C ATOM 1592 CD1 TYR A 99 -9.324 0.869 -5.461 1.00 52.24 C ATOM 1593 CD2 TYR A 99 -7.223 0.033 -6.336 1.00 20.23 C ATOM 1594 CE1 TYR A 99 -9.692 -0.433 -5.103 1.00 13.24 C ATOM 1595 CE2 TYR A 99 -7.591 -1.268 -5.977 1.00 53.13 C ATOM 1596 CZ TYR A 99 -8.826 -1.502 -5.361 1.00 44.45 C ATOM 1597 OH TYR A 99 -9.191 -2.785 -5.008 1.00 54.12 O ATOM 0 H TYR A 99 -6.382 4.703 -6.588 1.00 42.22 H new ATOM 0 HA TYR A 99 -7.760 3.229 -4.442 1.00 30.30 H new ATOM 0 HB2 TYR A 99 -8.568 3.061 -6.809 1.00 65.05 H new ATOM 0 HB3 TYR A 99 -6.992 2.477 -7.304 1.00 65.05 H new ATOM 0 HD1 TYR A 99 -9.992 1.694 -5.260 1.00 52.24 H new ATOM 0 HD2 TYR A 99 -6.270 0.213 -6.811 1.00 20.23 H new ATOM 0 HE1 TYR A 99 -10.645 -0.613 -4.627 1.00 13.24 H new ATOM 0 HE2 TYR A 99 -6.922 -2.092 -6.175 1.00 53.13 H new ATOM 0 HH TYR A 99 -8.403 -3.274 -4.692 1.00 54.12 H new ATOM 1607 N ALA A 100 -5.679 2.219 -3.544 1.00 14.23 N ATOM 1608 CA ALA A 100 -4.519 1.513 -2.998 1.00 62.31 C ATOM 1609 C ALA A 100 -4.892 0.087 -2.613 1.00 51.33 C ATOM 1610 O ALA A 100 -5.926 -0.148 -1.989 1.00 2.34 O ATOM 1611 CB ALA A 100 -3.991 2.251 -1.766 1.00 51.00 C ATOM 0 H ALA A 100 -6.369 2.498 -2.847 1.00 14.23 H new ATOM 0 HA ALA A 100 -3.744 1.481 -3.764 1.00 62.31 H new ATOM 0 HB1 ALA A 100 -3.128 1.719 -1.366 1.00 51.00 H new ATOM 0 HB2 ALA A 100 -3.696 3.262 -2.046 1.00 51.00 H new ATOM 0 HB3 ALA A 100 -4.772 2.298 -1.007 1.00 51.00 H new ATOM 1617 N THR A 101 -4.040 -0.863 -2.990 1.00 10.21 N ATOM 1618 CA THR A 101 -4.287 -2.268 -2.681 1.00 62.12 C ATOM 1619 C THR A 101 -2.977 -2.984 -2.360 1.00 40.43 C ATOM 1620 O THR A 101 -2.009 -2.899 -3.114 1.00 73.41 O ATOM 1621 CB THR A 101 -4.967 -2.951 -3.872 1.00 65.14 C ATOM 1622 OG1 THR A 101 -5.167 -4.326 -3.581 1.00 33.41 O ATOM 1623 CG2 THR A 101 -4.084 -2.818 -5.111 1.00 51.42 C ATOM 0 H THR A 101 -3.178 -0.687 -3.506 1.00 10.21 H new ATOM 0 HA THR A 101 -4.940 -2.322 -1.810 1.00 62.12 H new ATOM 0 HB THR A 101 -5.930 -2.475 -4.059 1.00 65.14 H new ATOM 0 HG1 THR A 101 -5.945 -4.426 -2.993 1.00 33.41 H new ATOM 0 HG21 THR A 101 -4.569 -3.304 -5.957 1.00 51.42 H new ATOM 0 HG22 THR A 101 -3.931 -1.763 -5.337 1.00 51.42 H new ATOM 0 HG23 THR A 101 -3.120 -3.292 -4.924 1.00 51.42 H new ATOM 1631 N ARG A 102 -2.964 -3.697 -1.236 1.00 74.42 N ATOM 1632 CA ARG A 102 -1.781 -4.443 -0.809 1.00 0.04 C ATOM 1633 C ARG A 102 -2.132 -5.919 -0.709 1.00 11.11 C ATOM 1634 O ARG A 102 -3.139 -6.270 -0.097 1.00 62.44 O ATOM 1635 CB ARG A 102 -1.307 -3.936 0.555 1.00 52.14 C ATOM 1636 CG ARG A 102 0.033 -4.587 0.909 1.00 21.50 C ATOM 1637 CD ARG A 102 0.420 -4.213 2.341 1.00 61.15 C ATOM 1638 NE ARG A 102 -0.453 -4.889 3.293 1.00 50.41 N ATOM 1639 CZ ARG A 102 -0.270 -6.167 3.606 1.00 63.32 C ATOM 1640 NH1 ARG A 102 0.708 -6.838 3.062 1.00 34.10 N ATOM 1641 NH2 ARG A 102 -1.066 -6.750 4.459 1.00 0.53 N ATOM 0 H ARG A 102 -3.760 -3.774 -0.603 1.00 74.42 H new ATOM 0 HA ARG A 102 -0.982 -4.301 -1.537 1.00 0.04 H new ATOM 0 HB2 ARG A 102 -1.201 -2.851 0.534 1.00 52.14 H new ATOM 0 HB3 ARG A 102 -2.049 -4.169 1.319 1.00 52.14 H new ATOM 0 HG2 ARG A 102 -0.040 -5.670 0.812 1.00 21.50 H new ATOM 0 HG3 ARG A 102 0.805 -4.256 0.214 1.00 21.50 H new ATOM 0 HD2 ARG A 102 1.458 -4.489 2.529 1.00 61.15 H new ATOM 0 HD3 ARG A 102 0.348 -3.134 2.474 1.00 61.15 H new ATOM 0 HE ARG A 102 -1.218 -4.372 3.726 1.00 50.41 H new ATOM 0 HH11 ARG A 102 1.332 -6.381 2.397 1.00 34.10 H new ATOM 0 HH12 ARG A 102 0.849 -7.819 3.302 1.00 34.10 H new ATOM 0 HH21 ARG A 102 -1.829 -6.225 4.886 1.00 0.53 H new ATOM 0 HH22 ARG A 102 -0.925 -7.731 4.699 1.00 0.53 H new ATOM 1655 N VAL A 103 -1.333 -6.796 -1.325 1.00 33.24 N ATOM 1656 CA VAL A 103 -1.635 -8.227 -1.285 1.00 34.25 C ATOM 1657 C VAL A 103 -0.510 -9.000 -0.611 1.00 1.42 C ATOM 1658 O VAL A 103 0.622 -9.027 -1.096 1.00 43.00 O ATOM 1659 CB VAL A 103 -1.838 -8.743 -2.716 1.00 11.35 C ATOM 1660 CG1 VAL A 103 -0.562 -8.523 -3.539 1.00 12.02 C ATOM 1661 CG2 VAL A 103 -2.177 -10.238 -2.686 1.00 20.31 C ATOM 0 H VAL A 103 -0.492 -6.547 -1.845 1.00 33.24 H new ATOM 0 HA VAL A 103 -2.546 -8.377 -0.706 1.00 34.25 H new ATOM 0 HB VAL A 103 -2.660 -8.195 -3.176 1.00 11.35 H new ATOM 0 HG11 VAL A 103 -0.715 -8.892 -4.553 1.00 12.02 H new ATOM 0 HG12 VAL A 103 -0.329 -7.459 -3.571 1.00 12.02 H new ATOM 0 HG13 VAL A 103 0.266 -9.062 -3.078 1.00 12.02 H new ATOM 0 HG21 VAL A 103 -2.320 -10.599 -3.704 1.00 20.31 H new ATOM 0 HG22 VAL A 103 -1.360 -10.787 -2.218 1.00 20.31 H new ATOM 0 HG23 VAL A 103 -3.092 -10.392 -2.114 1.00 20.31 H new ATOM 1671 N LYS A 104 -0.833 -9.638 0.510 1.00 63.44 N ATOM 1672 CA LYS A 104 0.137 -10.426 1.253 1.00 12.14 C ATOM 1673 C LYS A 104 -0.037 -11.893 0.890 1.00 23.50 C ATOM 1674 O LYS A 104 -1.008 -12.260 0.228 1.00 0.51 O ATOM 1675 CB LYS A 104 -0.073 -10.226 2.760 1.00 34.44 C ATOM 1676 CG LYS A 104 1.185 -10.644 3.528 1.00 31.22 C ATOM 1677 CD LYS A 104 1.022 -10.283 5.007 1.00 15.11 C ATOM 1678 CE LYS A 104 2.365 -10.443 5.722 1.00 64.23 C ATOM 1679 NZ LYS A 104 2.764 -11.878 5.715 1.00 24.35 N ATOM 0 H LYS A 104 -1.765 -9.622 0.923 1.00 63.44 H new ATOM 0 HA LYS A 104 1.147 -10.105 0.998 1.00 12.14 H new ATOM 0 HB2 LYS A 104 -0.304 -9.181 2.967 1.00 34.44 H new ATOM 0 HB3 LYS A 104 -0.926 -10.814 3.097 1.00 34.44 H new ATOM 0 HG2 LYS A 104 1.351 -11.716 3.420 1.00 31.22 H new ATOM 0 HG3 LYS A 104 2.060 -10.143 3.114 1.00 31.22 H new ATOM 0 HD2 LYS A 104 0.666 -9.258 5.105 1.00 15.11 H new ATOM 0 HD3 LYS A 104 0.273 -10.926 5.469 1.00 15.11 H new ATOM 0 HE2 LYS A 104 3.127 -9.840 5.227 1.00 64.23 H new ATOM 0 HE3 LYS A 104 2.289 -10.081 6.747 1.00 64.23 H new ATOM 0 HZ1 LYS A 104 3.583 -12.014 6.341 1.00 24.35 H new ATOM 0 HZ2 LYS A 104 1.971 -12.461 6.051 1.00 24.35 H new ATOM 0 HZ3 LYS A 104 3.017 -12.163 4.747 1.00 24.35 H new ATOM 1693 N ASP A 105 0.900 -12.727 1.305 1.00 70.32 N ATOM 1694 CA ASP A 105 0.815 -14.142 0.989 1.00 14.22 C ATOM 1695 C ASP A 105 -0.496 -14.731 1.506 1.00 14.23 C ATOM 1696 O ASP A 105 -0.684 -14.903 2.710 1.00 31.32 O ATOM 1697 CB ASP A 105 1.994 -14.889 1.612 1.00 60.24 C ATOM 1698 CG ASP A 105 1.993 -16.343 1.151 1.00 75.41 C ATOM 1699 OD1 ASP A 105 2.502 -16.601 0.073 1.00 4.44 O ATOM 1700 OD2 ASP A 105 1.484 -17.176 1.882 1.00 33.33 O ATOM 0 H ASP A 105 1.716 -12.455 1.853 1.00 70.32 H new ATOM 0 HA ASP A 105 0.847 -14.254 -0.095 1.00 14.22 H new ATOM 0 HB2 ASP A 105 2.930 -14.409 1.327 1.00 60.24 H new ATOM 0 HB3 ASP A 105 1.930 -14.844 2.699 1.00 60.24 H new ATOM 1705 N GLY A 106 -1.381 -15.070 0.571 1.00 13.15 N ATOM 1706 CA GLY A 106 -2.662 -15.683 0.912 1.00 73.44 C ATOM 1707 C GLY A 106 -3.747 -14.658 1.249 1.00 33.33 C ATOM 1708 O GLY A 106 -4.890 -15.037 1.507 1.00 50.05 O ATOM 0 H GLY A 106 -1.234 -14.930 -0.429 1.00 13.15 H new ATOM 0 HA2 GLY A 106 -2.998 -16.297 0.077 1.00 73.44 H new ATOM 0 HA3 GLY A 106 -2.524 -16.350 1.763 1.00 73.44 H new ATOM 1712 N ARG A 107 -3.403 -13.370 1.266 1.00 61.34 N ATOM 1713 CA ARG A 107 -4.393 -12.338 1.600 1.00 32.10 C ATOM 1714 C ARG A 107 -4.337 -11.154 0.637 1.00 31.24 C ATOM 1715 O ARG A 107 -3.262 -10.724 0.219 1.00 53.22 O ATOM 1716 CB ARG A 107 -4.155 -11.838 3.026 1.00 43.32 C ATOM 1717 CG ARG A 107 -4.277 -13.009 4.003 1.00 74.41 C ATOM 1718 CD ARG A 107 -4.266 -12.480 5.438 1.00 21.00 C ATOM 1719 NE ARG A 107 -3.125 -11.592 5.640 1.00 72.23 N ATOM 1720 CZ ARG A 107 -2.957 -10.939 6.786 1.00 10.22 C ATOM 1721 NH1 ARG A 107 -3.819 -11.087 7.753 1.00 3.11 N ATOM 1722 NH2 ARG A 107 -1.930 -10.150 6.941 1.00 13.14 N ATOM 0 H ARG A 107 -2.468 -13.018 1.058 1.00 61.34 H new ATOM 0 HA ARG A 107 -5.380 -12.793 1.515 1.00 32.10 H new ATOM 0 HB2 ARG A 107 -3.166 -11.386 3.104 1.00 43.32 H new ATOM 0 HB3 ARG A 107 -4.880 -11.064 3.277 1.00 43.32 H new ATOM 0 HG2 ARG A 107 -5.199 -13.559 3.814 1.00 74.41 H new ATOM 0 HG3 ARG A 107 -3.453 -13.707 3.855 1.00 74.41 H new ATOM 0 HD2 ARG A 107 -5.193 -11.945 5.643 1.00 21.00 H new ATOM 0 HD3 ARG A 107 -4.217 -13.313 6.140 1.00 21.00 H new ATOM 0 HE ARG A 107 -2.445 -11.470 4.889 1.00 72.23 H new ATOM 0 HH11 ARG A 107 -4.622 -11.704 7.630 1.00 3.11 H new ATOM 0 HH12 ARG A 107 -3.690 -10.586 8.632 1.00 3.11 H new ATOM 0 HH21 ARG A 107 -1.257 -10.034 6.184 1.00 13.14 H new ATOM 0 HH22 ARG A 107 -1.800 -9.649 7.820 1.00 13.14 H new ATOM 1736 N THR A 108 -5.518 -10.623 0.311 1.00 44.21 N ATOM 1737 CA THR A 108 -5.640 -9.470 -0.585 1.00 51.51 C ATOM 1738 C THR A 108 -6.299 -8.314 0.160 1.00 31.44 C ATOM 1739 O THR A 108 -7.058 -8.537 1.104 1.00 64.10 O ATOM 1740 CB THR A 108 -6.486 -9.843 -1.806 1.00 3.05 C ATOM 1741 OG1 THR A 108 -5.892 -10.949 -2.471 1.00 63.31 O ATOM 1742 CG2 THR A 108 -6.559 -8.650 -2.761 1.00 74.04 C ATOM 0 H THR A 108 -6.410 -10.976 0.657 1.00 44.21 H new ATOM 0 HA THR A 108 -4.647 -9.170 -0.919 1.00 51.51 H new ATOM 0 HB THR A 108 -7.493 -10.110 -1.484 1.00 3.05 H new ATOM 0 HG1 THR A 108 -6.433 -11.190 -3.252 1.00 63.31 H new ATOM 0 HG21 THR A 108 -7.161 -8.916 -3.630 1.00 74.04 H new ATOM 0 HG22 THR A 108 -7.014 -7.802 -2.250 1.00 74.04 H new ATOM 0 HG23 THR A 108 -5.554 -8.381 -3.085 1.00 74.04 H new ATOM 1750 N LEU A 109 -6.004 -7.078 -0.245 1.00 32.24 N ATOM 1751 CA LEU A 109 -6.583 -5.918 0.432 1.00 43.31 C ATOM 1752 C LEU A 109 -6.794 -4.756 -0.510 1.00 74.01 C ATOM 1753 O LEU A 109 -6.023 -4.537 -1.442 1.00 63.20 O ATOM 1754 CB LEU A 109 -5.648 -5.455 1.543 1.00 62.54 C ATOM 1755 CG LEU A 109 -6.246 -4.268 2.309 1.00 51.30 C ATOM 1756 CD1 LEU A 109 -7.552 -4.688 3.000 1.00 75.30 C ATOM 1757 CD2 LEU A 109 -5.235 -3.810 3.363 1.00 33.50 C ATOM 0 H LEU A 109 -5.381 -6.857 -1.022 1.00 32.24 H new ATOM 0 HA LEU A 109 -7.549 -6.229 0.829 1.00 43.31 H new ATOM 0 HB2 LEU A 109 -5.460 -6.279 2.232 1.00 62.54 H new ATOM 0 HB3 LEU A 109 -4.686 -5.170 1.118 1.00 62.54 H new ATOM 0 HG LEU A 109 -6.463 -3.456 1.615 1.00 51.30 H new ATOM 0 HD11 LEU A 109 -7.967 -3.838 3.541 1.00 75.30 H new ATOM 0 HD12 LEU A 109 -8.268 -5.026 2.251 1.00 75.30 H new ATOM 0 HD13 LEU A 109 -7.349 -5.499 3.700 1.00 75.30 H new ATOM 0 HD21 LEU A 109 -5.645 -2.966 3.917 1.00 33.50 H new ATOM 0 HD22 LEU A 109 -5.029 -4.630 4.051 1.00 33.50 H new ATOM 0 HD23 LEU A 109 -4.310 -3.507 2.872 1.00 33.50 H new ATOM 1769 N HIS A 110 -7.831 -3.985 -0.218 1.00 5.55 N ATOM 1770 CA HIS A 110 -8.135 -2.802 -0.999 1.00 51.43 C ATOM 1771 C HIS A 110 -8.488 -1.652 -0.062 1.00 72.13 C ATOM 1772 O HIS A 110 -9.104 -1.868 0.981 1.00 42.32 O ATOM 1773 CB HIS A 110 -9.294 -3.076 -1.960 1.00 64.03 C ATOM 1774 CG HIS A 110 -9.089 -4.409 -2.625 1.00 42.45 C ATOM 1775 ND1 HIS A 110 -8.237 -4.817 -3.622 1.00 33.35 N flip ATOM 1776 CD2 HIS A 110 -9.824 -5.531 -2.273 1.00 54.02 C flip ATOM 1777 CE1 HIS A 110 -8.438 -6.169 -3.885 1.00 31.11 C flip ATOM 1778 NE2 HIS A 110 -9.405 -6.549 -3.045 1.00 22.10 N flip ATOM 0 H HIS A 110 -8.474 -4.160 0.554 1.00 5.55 H new ATOM 0 HA HIS A 110 -7.259 -2.531 -1.589 1.00 51.43 H new ATOM 0 HB2 HIS A 110 -10.239 -3.070 -1.418 1.00 64.03 H new ATOM 0 HB3 HIS A 110 -9.352 -2.288 -2.711 1.00 64.03 H new ATOM 0 HD2 HIS A 110 -10.593 -5.579 -1.516 1.00 54.02 H new ATOM 0 HE1 HIS A 110 -7.923 -6.780 -4.612 1.00 31.11 H new ATOM 0 HE2 HIS A 110 -9.780 -7.496 -2.995 1.00 22.10 H new ATOM 1786 N MET A 111 -8.106 -0.429 -0.428 1.00 32.11 N ATOM 1787 CA MET A 111 -8.404 0.730 0.406 1.00 23.14 C ATOM 1788 C MET A 111 -8.382 2.011 -0.432 1.00 31.31 C ATOM 1789 O MET A 111 -7.642 2.109 -1.411 1.00 64.53 O ATOM 1790 CB MET A 111 -7.383 0.830 1.556 1.00 62.50 C ATOM 1791 CG MET A 111 -6.051 0.207 1.128 1.00 65.01 C ATOM 1792 SD MET A 111 -4.854 0.360 2.477 1.00 35.14 S ATOM 1793 CE MET A 111 -4.166 1.963 1.996 1.00 3.04 C ATOM 0 H MET A 111 -7.596 -0.218 -1.286 1.00 32.11 H new ATOM 0 HA MET A 111 -9.402 0.609 0.828 1.00 23.14 H new ATOM 0 HB2 MET A 111 -7.234 1.874 1.831 1.00 62.50 H new ATOM 0 HB3 MET A 111 -7.766 0.319 2.439 1.00 62.50 H new ATOM 0 HG2 MET A 111 -6.194 -0.843 0.871 1.00 65.01 H new ATOM 0 HG3 MET A 111 -5.674 0.705 0.235 1.00 65.01 H new ATOM 0 HE1 MET A 111 -3.260 2.157 2.570 1.00 3.04 H new ATOM 0 HE2 MET A 111 -3.927 1.952 0.933 1.00 3.04 H new ATOM 0 HE3 MET A 111 -4.896 2.747 2.195 1.00 3.04 H new ATOM 1803 N MET A 112 -9.184 2.996 -0.030 1.00 43.15 N ATOM 1804 CA MET A 112 -9.238 4.278 -0.739 1.00 44.31 C ATOM 1805 C MET A 112 -8.586 5.364 0.111 1.00 65.34 C ATOM 1806 O MET A 112 -8.686 5.342 1.337 1.00 35.42 O ATOM 1807 CB MET A 112 -10.694 4.659 -1.030 1.00 33.34 C ATOM 1808 CG MET A 112 -10.732 5.855 -1.981 1.00 72.23 C ATOM 1809 SD MET A 112 -10.266 5.312 -3.644 1.00 71.13 S ATOM 1810 CE MET A 112 -11.933 4.955 -4.251 1.00 71.15 C ATOM 0 H MET A 112 -9.803 2.934 0.778 1.00 43.15 H new ATOM 0 HA MET A 112 -8.700 4.183 -1.682 1.00 44.31 H new ATOM 0 HB2 MET A 112 -11.220 3.813 -1.472 1.00 33.34 H new ATOM 0 HB3 MET A 112 -11.209 4.904 -0.101 1.00 33.34 H new ATOM 0 HG2 MET A 112 -11.731 6.292 -1.995 1.00 72.23 H new ATOM 0 HG3 MET A 112 -10.050 6.631 -1.635 1.00 72.23 H new ATOM 0 HE1 MET A 112 -11.906 4.075 -4.893 1.00 71.15 H new ATOM 0 HE2 MET A 112 -12.595 4.767 -3.406 1.00 71.15 H new ATOM 0 HE3 MET A 112 -12.303 5.808 -4.820 1.00 71.15 H new ATOM 1820 N ARG A 113 -7.908 6.312 -0.541 1.00 72.31 N ATOM 1821 CA ARG A 113 -7.238 7.394 0.185 1.00 74.31 C ATOM 1822 C ARG A 113 -7.568 8.757 -0.410 1.00 45.20 C ATOM 1823 O ARG A 113 -7.500 8.954 -1.624 1.00 50.24 O ATOM 1824 CB ARG A 113 -5.726 7.175 0.166 1.00 21.21 C ATOM 1825 CG ARG A 113 -5.375 5.956 1.023 1.00 30.34 C ATOM 1826 CD ARG A 113 -3.855 5.831 1.137 1.00 72.50 C ATOM 1827 NE ARG A 113 -3.504 4.840 2.147 1.00 40.45 N ATOM 1828 CZ ARG A 113 -3.529 5.139 3.442 1.00 21.02 C ATOM 1829 NH1 ARG A 113 -3.872 6.338 3.828 1.00 14.40 N ATOM 1830 NH2 ARG A 113 -3.210 4.235 4.328 1.00 74.45 N ATOM 0 H ARG A 113 -7.809 6.353 -1.555 1.00 72.31 H new ATOM 0 HA ARG A 113 -7.599 7.379 1.213 1.00 74.31 H new ATOM 0 HB2 ARG A 113 -5.383 7.024 -0.857 1.00 21.21 H new ATOM 0 HB3 ARG A 113 -5.215 8.059 0.546 1.00 21.21 H new ATOM 0 HG2 ARG A 113 -5.817 6.056 2.014 1.00 30.34 H new ATOM 0 HG3 ARG A 113 -5.792 5.053 0.577 1.00 30.34 H new ATOM 0 HD2 ARG A 113 -3.434 5.544 0.174 1.00 72.50 H new ATOM 0 HD3 ARG A 113 -3.422 6.797 1.399 1.00 72.50 H new ATOM 0 HE ARG A 113 -3.234 3.901 1.855 1.00 40.45 H new ATOM 0 HH11 ARG A 113 -4.121 7.045 3.136 1.00 14.40 H new ATOM 0 HH12 ARG A 113 -3.891 6.568 4.822 1.00 14.40 H new ATOM 0 HH21 ARG A 113 -2.941 3.298 4.027 1.00 74.45 H new ATOM 0 HH22 ARG A 113 -3.229 4.465 5.321 1.00 74.45 H new ATOM 1844 N LEU A 114 -7.924 9.698 0.467 1.00 61.04 N ATOM 1845 CA LEU A 114 -8.267 11.055 0.051 1.00 14.24 C ATOM 1846 C LEU A 114 -7.168 12.027 0.486 1.00 31.42 C ATOM 1847 O LEU A 114 -6.785 12.077 1.673 1.00 44.40 O ATOM 1848 CB LEU A 114 -9.639 11.445 0.654 1.00 14.30 C ATOM 1849 CG LEU A 114 -9.712 12.949 1.007 1.00 15.14 C ATOM 1850 CD1 LEU A 114 -9.621 13.791 -0.273 1.00 31.15 C ATOM 1851 CD2 LEU A 114 -11.041 13.250 1.717 1.00 4.03 C ATOM 0 H LEU A 114 -7.982 9.542 1.473 1.00 61.04 H new ATOM 0 HA LEU A 114 -8.343 11.103 -1.035 1.00 14.24 H new ATOM 0 HB2 LEU A 114 -10.429 11.201 -0.056 1.00 14.30 H new ATOM 0 HB3 LEU A 114 -9.822 10.853 1.551 1.00 14.30 H new ATOM 0 HG LEU A 114 -8.880 13.199 1.665 1.00 15.14 H new ATOM 0 HD11 LEU A 114 -9.673 14.849 -0.017 1.00 31.15 H new ATOM 0 HD12 LEU A 114 -8.677 13.586 -0.777 1.00 31.15 H new ATOM 0 HD13 LEU A 114 -10.449 13.537 -0.935 1.00 31.15 H new ATOM 0 HD21 LEU A 114 -11.089 14.310 1.964 1.00 4.03 H new ATOM 0 HD22 LEU A 114 -11.871 12.993 1.059 1.00 4.03 H new ATOM 0 HD23 LEU A 114 -11.106 12.661 2.632 1.00 4.03 H new ATOM 1863 N TYR A 115 -6.663 12.770 -0.505 1.00 63.52 N ATOM 1864 CA TYR A 115 -5.595 13.745 -0.303 1.00 21.22 C ATOM 1865 C TYR A 115 -6.136 15.171 -0.355 1.00 10.04 C ATOM 1866 O TYR A 115 -7.201 15.426 -0.920 1.00 23.43 O ATOM 1867 CB TYR A 115 -4.548 13.614 -1.412 1.00 1.41 C ATOM 1868 CG TYR A 115 -3.779 12.322 -1.282 1.00 3.33 C ATOM 1869 CD1 TYR A 115 -4.445 11.093 -1.374 1.00 32.21 C ATOM 1870 CD2 TYR A 115 -2.394 12.353 -1.074 1.00 4.12 C ATOM 1871 CE1 TYR A 115 -3.727 9.902 -1.254 1.00 64.53 C ATOM 1872 CE2 TYR A 115 -1.680 11.160 -0.958 1.00 25.53 C ATOM 1873 CZ TYR A 115 -2.347 9.936 -1.047 1.00 51.04 C ATOM 1874 OH TYR A 115 -1.646 8.761 -0.913 1.00 14.15 O ATOM 0 H TYR A 115 -6.987 12.709 -1.470 1.00 63.52 H new ATOM 0 HA TYR A 115 -5.157 13.547 0.675 1.00 21.22 H new ATOM 0 HB2 TYR A 115 -5.037 13.653 -2.385 1.00 1.41 H new ATOM 0 HB3 TYR A 115 -3.859 14.457 -1.367 1.00 1.41 H new ATOM 0 HD1 TYR A 115 -5.512 11.067 -1.538 1.00 32.21 H new ATOM 0 HD2 TYR A 115 -1.879 13.300 -1.003 1.00 4.12 H new ATOM 0 HE1 TYR A 115 -4.239 8.954 -1.321 1.00 64.53 H new ATOM 0 HE2 TYR A 115 -0.612 11.183 -0.799 1.00 25.53 H new ATOM 0 HH TYR A 115 -0.696 8.960 -0.776 1.00 14.15 H new ATOM 1884 N SER A 116 -5.353 16.099 0.196 1.00 74.05 N ATOM 1885 CA SER A 116 -5.698 17.520 0.188 1.00 63.32 C ATOM 1886 C SER A 116 -4.497 18.312 -0.307 1.00 70.03 C ATOM 1887 O SER A 116 -3.376 18.061 0.121 1.00 51.32 O ATOM 1888 CB SER A 116 -6.043 17.993 1.599 1.00 52.55 C ATOM 1889 OG SER A 116 -6.375 19.373 1.556 1.00 71.21 O ATOM 0 H SER A 116 -4.468 15.889 0.657 1.00 74.05 H new ATOM 0 HA SER A 116 -6.559 17.672 -0.462 1.00 63.32 H new ATOM 0 HB2 SER A 116 -6.879 17.417 1.995 1.00 52.55 H new ATOM 0 HB3 SER A 116 -5.198 17.830 2.268 1.00 52.55 H new ATOM 0 HG SER A 116 -6.265 19.764 2.448 1.00 71.21 H new ATOM 1895 N ARG A 117 -4.708 19.270 -1.198 1.00 11.35 N ATOM 1896 CA ARG A 117 -3.588 20.056 -1.695 1.00 33.24 C ATOM 1897 C ARG A 117 -3.119 21.030 -0.621 1.00 50.25 C ATOM 1898 O ARG A 117 -2.013 21.567 -0.691 1.00 21.22 O ATOM 1899 CB ARG A 117 -4.006 20.829 -2.947 1.00 50.51 C ATOM 1900 CG ARG A 117 -2.762 21.312 -3.708 1.00 33.11 C ATOM 1901 CD ARG A 117 -1.998 20.119 -4.306 1.00 64.31 C ATOM 1902 NE ARG A 117 -0.921 19.710 -3.411 1.00 40.24 N ATOM 1903 CZ ARG A 117 0.156 20.471 -3.239 1.00 21.21 C ATOM 1904 NH1 ARG A 117 0.263 21.604 -3.879 1.00 55.52 N ATOM 1905 NH2 ARG A 117 1.105 20.086 -2.432 1.00 15.21 N ATOM 0 H ARG A 117 -5.619 19.518 -1.584 1.00 11.35 H new ATOM 0 HA ARG A 117 -2.769 19.382 -1.949 1.00 33.24 H new ATOM 0 HB2 ARG A 117 -4.612 20.192 -3.592 1.00 50.51 H new ATOM 0 HB3 ARG A 117 -4.625 21.682 -2.668 1.00 50.51 H new ATOM 0 HG2 ARG A 117 -3.058 21.997 -4.503 1.00 33.11 H new ATOM 0 HG3 ARG A 117 -2.110 21.868 -3.035 1.00 33.11 H new ATOM 0 HD2 ARG A 117 -2.681 19.285 -4.469 1.00 64.31 H new ATOM 0 HD3 ARG A 117 -1.589 20.391 -5.279 1.00 64.31 H new ATOM 0 HE ARG A 117 -0.995 18.825 -2.909 1.00 40.24 H new ATOM 0 HH11 ARG A 117 -0.479 21.905 -4.511 1.00 55.52 H new ATOM 0 HH12 ARG A 117 1.089 22.188 -3.747 1.00 55.52 H new ATOM 0 HH21 ARG A 117 1.022 19.201 -1.932 1.00 15.21 H new ATOM 0 HH22 ARG A 117 1.931 20.670 -2.300 1.00 15.21 H new ATOM 1919 N SER A 118 -3.973 21.250 0.375 1.00 74.34 N ATOM 1920 CA SER A 118 -3.653 22.160 1.474 1.00 64.21 C ATOM 1921 C SER A 118 -4.066 21.538 2.812 1.00 53.13 C ATOM 1922 O SER A 118 -5.086 20.853 2.890 1.00 61.44 O ATOM 1923 CB SER A 118 -4.394 23.483 1.276 1.00 43.25 C ATOM 1924 OG SER A 118 -4.153 24.331 2.390 1.00 11.11 O ATOM 0 H SER A 118 -4.891 20.812 0.445 1.00 74.34 H new ATOM 0 HA SER A 118 -2.578 22.340 1.483 1.00 64.21 H new ATOM 0 HB2 SER A 118 -4.059 23.966 0.358 1.00 43.25 H new ATOM 0 HB3 SER A 118 -5.463 23.301 1.168 1.00 43.25 H new ATOM 0 HG SER A 118 -4.626 25.180 2.263 1.00 11.11 H new ATOM 1930 N PRO A 119 -3.305 21.758 3.860 1.00 0.43 N ATOM 1931 CA PRO A 119 -3.613 21.206 5.208 1.00 21.24 C ATOM 1932 C PRO A 119 -5.112 21.193 5.515 1.00 71.42 C ATOM 1933 O PRO A 119 -5.574 20.424 6.360 1.00 43.03 O ATOM 1934 CB PRO A 119 -2.871 22.156 6.148 1.00 31.21 C ATOM 1935 CG PRO A 119 -1.683 22.630 5.367 1.00 2.13 C ATOM 1936 CD PRO A 119 -2.064 22.555 3.880 1.00 63.14 C ATOM 0 HA PRO A 119 -3.309 20.164 5.303 1.00 21.24 H new ATOM 0 HB2 PRO A 119 -3.505 22.991 6.446 1.00 31.21 H new ATOM 0 HB3 PRO A 119 -2.564 21.647 7.062 1.00 31.21 H new ATOM 0 HG2 PRO A 119 -1.420 23.650 5.647 1.00 2.13 H new ATOM 0 HG3 PRO A 119 -0.812 22.008 5.574 1.00 2.13 H new ATOM 0 HD2 PRO A 119 -2.223 23.548 3.460 1.00 63.14 H new ATOM 0 HD3 PRO A 119 -1.278 22.082 3.292 1.00 63.14 H new ATOM 1944 N GLU A 120 -5.866 22.048 4.830 1.00 72.12 N ATOM 1945 CA GLU A 120 -7.302 22.128 5.039 1.00 62.41 C ATOM 1946 C GLU A 120 -8.026 21.100 4.184 1.00 62.33 C ATOM 1947 O GLU A 120 -7.466 20.555 3.235 1.00 4.55 O ATOM 1948 CB GLU A 120 -7.802 23.526 4.678 1.00 62.22 C ATOM 1949 CG GLU A 120 -6.992 24.573 5.445 1.00 22.25 C ATOM 1950 CD GLU A 120 -7.559 25.964 5.183 1.00 21.55 C ATOM 1951 OE1 GLU A 120 -8.411 26.082 4.318 1.00 20.31 O ATOM 1952 OE2 GLU A 120 -7.132 26.891 5.852 1.00 33.55 O ATOM 0 H GLU A 120 -5.504 22.693 4.127 1.00 72.12 H new ATOM 0 HA GLU A 120 -7.508 21.923 6.090 1.00 62.41 H new ATOM 0 HB2 GLU A 120 -7.707 23.692 3.605 1.00 62.22 H new ATOM 0 HB3 GLU A 120 -8.860 23.619 4.922 1.00 62.22 H new ATOM 0 HG2 GLU A 120 -7.019 24.355 6.513 1.00 22.25 H new ATOM 0 HG3 GLU A 120 -5.947 24.533 5.138 1.00 22.25 H new ATOM 1959 N VAL A 121 -9.278 20.849 4.533 1.00 43.13 N ATOM 1960 CA VAL A 121 -10.107 19.888 3.804 1.00 34.10 C ATOM 1961 C VAL A 121 -11.313 20.588 3.183 1.00 41.10 C ATOM 1962 O VAL A 121 -12.060 21.283 3.872 1.00 4.10 O ATOM 1963 CB VAL A 121 -10.588 18.791 4.754 1.00 43.22 C ATOM 1964 CG1 VAL A 121 -11.276 17.684 3.951 1.00 1.10 C ATOM 1965 CG2 VAL A 121 -9.389 18.205 5.504 1.00 13.23 C ATOM 0 H VAL A 121 -9.749 21.297 5.319 1.00 43.13 H new ATOM 0 HA VAL A 121 -9.507 19.445 3.009 1.00 34.10 H new ATOM 0 HB VAL A 121 -11.294 19.214 5.468 1.00 43.22 H new ATOM 0 HG11 VAL A 121 -11.619 16.902 4.629 1.00 1.10 H new ATOM 0 HG12 VAL A 121 -12.129 18.100 3.415 1.00 1.10 H new ATOM 0 HG13 VAL A 121 -10.570 17.261 3.236 1.00 1.10 H new ATOM 0 HG21 VAL A 121 -9.731 17.423 6.182 1.00 13.23 H new ATOM 0 HG22 VAL A 121 -8.683 17.783 4.789 1.00 13.23 H new ATOM 0 HG23 VAL A 121 -8.898 18.992 6.076 1.00 13.23 H new ATOM 1975 N SER A 122 -11.498 20.402 1.879 1.00 61.21 N ATOM 1976 CA SER A 122 -12.617 21.024 1.177 1.00 2.45 C ATOM 1977 C SER A 122 -13.871 20.146 1.283 1.00 21.04 C ATOM 1978 O SER A 122 -13.826 18.965 0.931 1.00 4.24 O ATOM 1979 CB SER A 122 -12.257 21.213 -0.297 1.00 24.24 C ATOM 1980 OG SER A 122 -13.374 21.765 -0.985 1.00 22.40 O ATOM 0 H SER A 122 -10.892 19.830 1.290 1.00 61.21 H new ATOM 0 HA SER A 122 -12.821 21.992 1.635 1.00 2.45 H new ATOM 0 HB2 SER A 122 -11.394 21.873 -0.391 1.00 24.24 H new ATOM 0 HB3 SER A 122 -11.977 20.257 -0.741 1.00 24.24 H new ATOM 0 HG SER A 122 -13.147 21.890 -1.930 1.00 22.40 H new ATOM 1986 N PRO A 123 -14.985 20.675 1.747 1.00 40.21 N ATOM 1987 CA PRO A 123 -16.245 19.887 1.875 1.00 41.25 C ATOM 1988 C PRO A 123 -16.486 18.981 0.667 1.00 75.13 C ATOM 1989 O PRO A 123 -17.088 17.915 0.791 1.00 61.11 O ATOM 1990 CB PRO A 123 -17.327 20.963 1.980 1.00 40.21 C ATOM 1991 CG PRO A 123 -16.649 22.130 2.623 1.00 12.51 C ATOM 1992 CD PRO A 123 -15.174 22.068 2.203 1.00 22.11 C ATOM 0 HA PRO A 123 -16.224 19.210 2.729 1.00 41.25 H new ATOM 0 HB2 PRO A 123 -17.719 21.226 0.998 1.00 40.21 H new ATOM 0 HB3 PRO A 123 -18.171 20.618 2.578 1.00 40.21 H new ATOM 0 HG2 PRO A 123 -17.104 23.067 2.302 1.00 12.51 H new ATOM 0 HG3 PRO A 123 -16.745 22.084 3.708 1.00 12.51 H new ATOM 0 HD2 PRO A 123 -14.956 22.780 1.407 1.00 22.11 H new ATOM 0 HD3 PRO A 123 -14.512 22.308 3.035 1.00 22.11 H new ATOM 2000 N ALA A 124 -16.010 19.414 -0.496 1.00 21.10 N ATOM 2001 CA ALA A 124 -16.178 18.632 -1.716 1.00 43.15 C ATOM 2002 C ALA A 124 -15.207 17.458 -1.734 1.00 72.30 C ATOM 2003 O ALA A 124 -15.530 16.377 -2.226 1.00 20.22 O ATOM 2004 CB ALA A 124 -15.936 19.517 -2.941 1.00 32.13 C ATOM 0 H ALA A 124 -15.509 20.294 -0.620 1.00 21.10 H new ATOM 0 HA ALA A 124 -17.197 18.247 -1.743 1.00 43.15 H new ATOM 0 HB1 ALA A 124 -16.063 18.926 -3.848 1.00 32.13 H new ATOM 0 HB2 ALA A 124 -16.650 20.341 -2.942 1.00 32.13 H new ATOM 0 HB3 ALA A 124 -14.922 19.916 -2.907 1.00 32.13 H new ATOM 2010 N ALA A 125 -14.016 17.680 -1.190 1.00 64.13 N ATOM 2011 CA ALA A 125 -12.996 16.639 -1.143 1.00 1.50 C ATOM 2012 C ALA A 125 -13.468 15.464 -0.294 1.00 25.33 C ATOM 2013 O ALA A 125 -13.249 14.308 -0.641 1.00 32.23 O ATOM 2014 CB ALA A 125 -11.710 17.206 -0.543 1.00 75.12 C ATOM 0 H ALA A 125 -13.733 18.569 -0.776 1.00 64.13 H new ATOM 0 HA ALA A 125 -12.810 16.291 -2.159 1.00 1.50 H new ATOM 0 HB1 ALA A 125 -10.950 16.426 -0.509 1.00 75.12 H new ATOM 0 HB2 ALA A 125 -11.355 18.032 -1.159 1.00 75.12 H new ATOM 0 HB3 ALA A 125 -11.907 17.565 0.467 1.00 75.12 H new ATOM 2020 N THR A 126 -14.127 15.782 0.809 1.00 20.14 N ATOM 2021 CA THR A 126 -14.645 14.757 1.707 1.00 3.30 C ATOM 2022 C THR A 126 -15.862 14.071 1.085 1.00 23.33 C ATOM 2023 O THR A 126 -16.127 12.896 1.336 1.00 43.03 O ATOM 2024 CB THR A 126 -15.022 15.384 3.064 1.00 22.42 C ATOM 2025 OG1 THR A 126 -14.277 16.581 3.245 1.00 2.41 O ATOM 2026 CG2 THR A 126 -14.702 14.412 4.211 1.00 4.03 C ATOM 0 H THR A 126 -14.317 16.739 1.105 1.00 20.14 H new ATOM 0 HA THR A 126 -13.869 14.008 1.868 1.00 3.30 H new ATOM 0 HB THR A 126 -16.090 15.599 3.071 1.00 22.42 H new ATOM 0 HG1 THR A 126 -14.799 17.344 2.919 1.00 2.41 H new ATOM 0 HG21 THR A 126 -14.974 14.870 5.162 1.00 4.03 H new ATOM 0 HG22 THR A 126 -15.269 13.491 4.076 1.00 4.03 H new ATOM 0 HG23 THR A 126 -13.636 14.185 4.209 1.00 4.03 H new ATOM 2034 N ALA A 127 -16.618 14.836 0.304 1.00 75.53 N ATOM 2035 CA ALA A 127 -17.835 14.338 -0.329 1.00 74.44 C ATOM 2036 C ALA A 127 -17.572 13.425 -1.524 1.00 64.32 C ATOM 2037 O ALA A 127 -18.118 12.325 -1.597 1.00 31.01 O ATOM 2038 CB ALA A 127 -18.643 15.524 -0.805 1.00 74.43 C ATOM 0 H ALA A 127 -16.407 15.811 0.093 1.00 75.53 H new ATOM 0 HA ALA A 127 -18.365 13.745 0.417 1.00 74.44 H new ATOM 0 HB1 ALA A 127 -19.558 15.173 -1.282 1.00 74.43 H new ATOM 0 HB2 ALA A 127 -18.897 16.156 0.046 1.00 74.43 H new ATOM 0 HB3 ALA A 127 -18.057 16.099 -1.523 1.00 74.43 H new ATOM 2044 N ILE A 128 -16.724 13.863 -2.452 1.00 41.33 N ATOM 2045 CA ILE A 128 -16.414 13.037 -3.600 1.00 21.54 C ATOM 2046 C ILE A 128 -15.805 11.755 -3.067 1.00 1.11 C ATOM 2047 O ILE A 128 -16.037 10.654 -3.567 1.00 31.32 O ATOM 2048 CB ILE A 128 -15.446 13.797 -4.523 1.00 42.31 C ATOM 2049 CG1 ILE A 128 -15.639 13.340 -5.966 1.00 14.43 C ATOM 2050 CG2 ILE A 128 -13.982 13.576 -4.109 1.00 32.51 C ATOM 2051 CD1 ILE A 128 -15.522 11.816 -6.061 1.00 15.02 C ATOM 0 H ILE A 128 -16.252 14.767 -2.428 1.00 41.33 H new ATOM 0 HA ILE A 128 -17.299 12.800 -4.190 1.00 21.54 H new ATOM 0 HB ILE A 128 -15.669 14.860 -4.436 1.00 42.31 H new ATOM 0 HG12 ILE A 128 -16.616 13.660 -6.328 1.00 14.43 H new ATOM 0 HG13 ILE A 128 -14.892 13.810 -6.606 1.00 14.43 H new ATOM 0 HG21 ILE A 128 -13.326 14.127 -4.783 1.00 32.51 H new ATOM 0 HG22 ILE A 128 -13.835 13.930 -3.089 1.00 32.51 H new ATOM 0 HG23 ILE A 128 -13.745 12.513 -4.162 1.00 32.51 H new ATOM 0 HD11 ILE A 128 -15.662 11.504 -7.096 1.00 15.02 H new ATOM 0 HD12 ILE A 128 -14.535 11.505 -5.718 1.00 15.02 H new ATOM 0 HD13 ILE A 128 -16.286 11.353 -5.436 1.00 15.02 H new ATOM 2063 N PHE A 129 -15.034 11.952 -2.020 1.00 33.53 N ATOM 2064 CA PHE A 129 -14.362 10.874 -1.334 1.00 40.20 C ATOM 2065 C PHE A 129 -15.376 9.898 -0.744 1.00 72.51 C ATOM 2066 O PHE A 129 -15.243 8.682 -0.892 1.00 34.40 O ATOM 2067 CB PHE A 129 -13.513 11.468 -0.221 1.00 21.32 C ATOM 2068 CG PHE A 129 -12.881 10.362 0.601 1.00 62.51 C ATOM 2069 CD1 PHE A 129 -12.183 9.316 -0.026 1.00 72.20 C ATOM 2070 CD2 PHE A 129 -13.000 10.380 1.995 1.00 24.04 C ATOM 2071 CE1 PHE A 129 -11.608 8.299 0.743 1.00 64.05 C ATOM 2072 CE2 PHE A 129 -12.423 9.363 2.761 1.00 20.40 C ATOM 2073 CZ PHE A 129 -11.727 8.322 2.136 1.00 62.13 C ATOM 0 H PHE A 129 -14.855 12.873 -1.619 1.00 33.53 H new ATOM 0 HA PHE A 129 -13.735 10.328 -2.039 1.00 40.20 H new ATOM 0 HB2 PHE A 129 -12.737 12.105 -0.646 1.00 21.32 H new ATOM 0 HB3 PHE A 129 -14.129 12.100 0.419 1.00 21.32 H new ATOM 0 HD1 PHE A 129 -12.090 9.297 -1.102 1.00 72.20 H new ATOM 0 HD2 PHE A 129 -13.538 11.181 2.480 1.00 24.04 H new ATOM 0 HE1 PHE A 129 -11.072 7.495 0.260 1.00 64.05 H new ATOM 0 HE2 PHE A 129 -12.514 9.381 3.837 1.00 20.40 H new ATOM 0 HZ PHE A 129 -11.282 7.537 2.729 1.00 62.13 H new ATOM 2083 N ARG A 130 -16.389 10.441 -0.078 1.00 74.34 N ATOM 2084 CA ARG A 130 -17.425 9.615 0.531 1.00 5.14 C ATOM 2085 C ARG A 130 -18.246 8.919 -0.547 1.00 41.10 C ATOM 2086 O ARG A 130 -18.692 7.786 -0.368 1.00 32.32 O ATOM 2087 CB ARG A 130 -18.341 10.482 1.397 1.00 61.03 C ATOM 2088 CG ARG A 130 -19.200 9.583 2.290 1.00 52.24 C ATOM 2089 CD ARG A 130 -20.112 10.449 3.159 1.00 72.22 C ATOM 2090 NE ARG A 130 -20.706 9.649 4.224 1.00 44.41 N ATOM 2091 CZ ARG A 130 -21.628 8.728 3.959 1.00 13.45 C ATOM 2092 NH1 ARG A 130 -22.016 8.529 2.729 1.00 74.51 N ATOM 2093 NH2 ARG A 130 -22.145 8.025 4.929 1.00 12.21 N ATOM 0 H ARG A 130 -16.515 11.445 0.054 1.00 74.34 H new ATOM 0 HA ARG A 130 -16.948 8.860 1.156 1.00 5.14 H new ATOM 0 HB2 ARG A 130 -17.746 11.159 2.010 1.00 61.03 H new ATOM 0 HB3 ARG A 130 -18.978 11.101 0.765 1.00 61.03 H new ATOM 0 HG2 ARG A 130 -19.798 8.908 1.677 1.00 52.24 H new ATOM 0 HG3 ARG A 130 -18.563 8.962 2.919 1.00 52.24 H new ATOM 0 HD2 ARG A 130 -19.541 11.272 3.589 1.00 72.22 H new ATOM 0 HD3 ARG A 130 -20.897 10.891 2.546 1.00 72.22 H new ATOM 0 HE ARG A 130 -20.409 9.798 5.188 1.00 44.41 H new ATOM 0 HH11 ARG A 130 -21.612 9.080 1.971 1.00 74.51 H new ATOM 0 HH12 ARG A 130 -22.723 7.823 2.525 1.00 74.51 H new ATOM 0 HH21 ARG A 130 -21.842 8.182 5.890 1.00 12.21 H new ATOM 0 HH22 ARG A 130 -22.852 7.319 4.726 1.00 12.21 H new ATOM 2107 N LYS A 131 -18.440 9.606 -1.667 1.00 3.50 N ATOM 2108 CA LYS A 131 -19.206 9.046 -2.773 1.00 22.51 C ATOM 2109 C LYS A 131 -18.584 7.733 -3.236 1.00 44.42 C ATOM 2110 O LYS A 131 -19.267 6.714 -3.340 1.00 4.42 O ATOM 2111 CB LYS A 131 -19.243 10.036 -3.938 1.00 0.54 C ATOM 2112 CG LYS A 131 -20.218 9.533 -5.004 1.00 42.04 C ATOM 2113 CD LYS A 131 -20.230 10.505 -6.186 1.00 73.24 C ATOM 2114 CE LYS A 131 -21.323 10.094 -7.174 1.00 74.53 C ATOM 2115 NZ LYS A 131 -22.648 10.135 -6.494 1.00 73.43 N ATOM 0 H LYS A 131 -18.080 10.546 -1.832 1.00 3.50 H new ATOM 0 HA LYS A 131 -20.223 8.855 -2.430 1.00 22.51 H new ATOM 0 HB2 LYS A 131 -19.551 11.020 -3.584 1.00 0.54 H new ATOM 0 HB3 LYS A 131 -18.247 10.149 -4.365 1.00 0.54 H new ATOM 0 HG2 LYS A 131 -19.924 8.539 -5.340 1.00 42.04 H new ATOM 0 HG3 LYS A 131 -21.219 9.444 -4.583 1.00 42.04 H new ATOM 0 HD2 LYS A 131 -20.407 11.521 -5.833 1.00 73.24 H new ATOM 0 HD3 LYS A 131 -19.259 10.504 -6.681 1.00 73.24 H new ATOM 0 HE2 LYS A 131 -21.322 10.765 -8.033 1.00 74.53 H new ATOM 0 HE3 LYS A 131 -21.127 9.091 -7.553 1.00 74.53 H new ATOM 0 HZ1 LYS A 131 -23.395 10.295 -7.199 1.00 73.43 H new ATOM 0 HZ2 LYS A 131 -22.818 9.231 -6.009 1.00 73.43 H new ATOM 0 HZ3 LYS A 131 -22.657 10.908 -5.798 1.00 73.43 H new ATOM 2129 N LEU A 132 -17.285 7.767 -3.513 1.00 3.13 N ATOM 2130 CA LEU A 132 -16.576 6.576 -3.966 1.00 63.42 C ATOM 2131 C LEU A 132 -16.650 5.476 -2.908 1.00 14.34 C ATOM 2132 O LEU A 132 -16.994 4.330 -3.207 1.00 43.11 O ATOM 2133 CB LEU A 132 -15.103 6.924 -4.238 1.00 73.01 C ATOM 2134 CG LEU A 132 -14.897 7.382 -5.696 1.00 61.30 C ATOM 2135 CD1 LEU A 132 -14.943 6.175 -6.646 1.00 61.11 C ATOM 2136 CD2 LEU A 132 -15.981 8.397 -6.092 1.00 71.13 C ATOM 0 H LEU A 132 -16.704 8.602 -3.432 1.00 3.13 H new ATOM 0 HA LEU A 132 -17.045 6.218 -4.882 1.00 63.42 H new ATOM 0 HB2 LEU A 132 -14.782 7.713 -3.558 1.00 73.01 H new ATOM 0 HB3 LEU A 132 -14.478 6.054 -4.036 1.00 73.01 H new ATOM 0 HG LEU A 132 -13.919 7.857 -5.774 1.00 61.30 H new ATOM 0 HD11 LEU A 132 -14.796 6.513 -7.672 1.00 61.11 H new ATOM 0 HD12 LEU A 132 -14.154 5.472 -6.379 1.00 61.11 H new ATOM 0 HD13 LEU A 132 -15.912 5.682 -6.562 1.00 61.11 H new ATOM 0 HD21 LEU A 132 -15.824 8.713 -7.123 1.00 71.13 H new ATOM 0 HD22 LEU A 132 -16.964 7.935 -5.999 1.00 71.13 H new ATOM 0 HD23 LEU A 132 -15.925 9.265 -5.435 1.00 71.13 H new ATOM 2148 N ALA A 133 -16.325 5.826 -1.670 1.00 1.25 N ATOM 2149 CA ALA A 133 -16.359 4.846 -0.596 1.00 21.11 C ATOM 2150 C ALA A 133 -17.760 4.263 -0.456 1.00 41.20 C ATOM 2151 O ALA A 133 -17.918 3.088 -0.129 1.00 20.44 O ATOM 2152 CB ALA A 133 -15.922 5.475 0.726 1.00 71.34 C ATOM 0 H ALA A 133 -16.040 6.764 -1.389 1.00 1.25 H new ATOM 0 HA ALA A 133 -15.664 4.045 -0.845 1.00 21.11 H new ATOM 0 HB1 ALA A 133 -15.955 4.724 1.515 1.00 71.34 H new ATOM 0 HB2 ALA A 133 -14.905 5.855 0.629 1.00 71.34 H new ATOM 0 HB3 ALA A 133 -16.594 6.296 0.978 1.00 71.34 H new ATOM 2158 N GLY A 134 -18.783 5.074 -0.726 1.00 71.52 N ATOM 2159 CA GLY A 134 -20.155 4.594 -0.633 1.00 64.23 C ATOM 2160 C GLY A 134 -20.427 3.557 -1.712 1.00 33.34 C ATOM 2161 O GLY A 134 -21.093 2.553 -1.466 1.00 0.31 O ATOM 0 H GLY A 134 -18.688 6.050 -1.006 1.00 71.52 H new ATOM 0 HA2 GLY A 134 -20.329 4.159 0.351 1.00 64.23 H new ATOM 0 HA3 GLY A 134 -20.847 5.429 -0.739 1.00 64.23 H new ATOM 2165 N GLU A 135 -19.896 3.800 -2.907 1.00 15.34 N ATOM 2166 CA GLU A 135 -20.082 2.863 -4.003 1.00 54.22 C ATOM 2167 C GLU A 135 -19.562 1.497 -3.585 1.00 2.21 C ATOM 2168 O GLU A 135 -20.027 0.465 -4.067 1.00 52.54 O ATOM 2169 CB GLU A 135 -19.340 3.345 -5.253 1.00 71.22 C ATOM 2170 CG GLU A 135 -20.048 4.574 -5.825 1.00 11.05 C ATOM 2171 CD GLU A 135 -19.322 5.058 -7.077 1.00 14.42 C ATOM 2172 OE1 GLU A 135 -18.240 4.559 -7.339 1.00 41.20 O ATOM 2173 OE2 GLU A 135 -19.859 5.919 -7.754 1.00 65.03 O ATOM 0 H GLU A 135 -19.342 4.625 -3.136 1.00 15.34 H new ATOM 0 HA GLU A 135 -21.144 2.796 -4.240 1.00 54.22 H new ATOM 0 HB2 GLU A 135 -18.308 3.590 -5.004 1.00 71.22 H new ATOM 0 HB3 GLU A 135 -19.308 2.551 -5.999 1.00 71.22 H new ATOM 0 HG2 GLU A 135 -21.082 4.329 -6.066 1.00 11.05 H new ATOM 0 HG3 GLU A 135 -20.074 5.369 -5.080 1.00 11.05 H new ATOM 2180 N ARG A 136 -18.603 1.504 -2.660 1.00 3.45 N ATOM 2181 CA ARG A 136 -18.029 0.263 -2.146 1.00 71.25 C ATOM 2182 C ARG A 136 -18.787 -0.172 -0.889 1.00 73.32 C ATOM 2183 O ARG A 136 -18.410 -1.140 -0.231 1.00 52.32 O ATOM 2184 CB ARG A 136 -16.545 0.471 -1.816 1.00 24.14 C ATOM 2185 CG ARG A 136 -15.689 0.254 -3.073 1.00 0.22 C ATOM 2186 CD ARG A 136 -16.153 1.187 -4.200 1.00 32.32 C ATOM 2187 NE ARG A 136 -17.175 0.529 -5.008 1.00 22.23 N ATOM 2188 CZ ARG A 136 -17.375 0.871 -6.278 1.00 42.14 C ATOM 2189 NH1 ARG A 136 -16.656 1.815 -6.821 1.00 24.34 N ATOM 2190 NH2 ARG A 136 -18.293 0.264 -6.980 1.00 63.21 N ATOM 0 H ARG A 136 -18.209 2.352 -2.253 1.00 3.45 H new ATOM 0 HA ARG A 136 -18.117 -0.514 -2.905 1.00 71.25 H new ATOM 0 HB2 ARG A 136 -16.388 1.478 -1.429 1.00 24.14 H new ATOM 0 HB3 ARG A 136 -16.238 -0.223 -1.033 1.00 24.14 H new ATOM 0 HG2 ARG A 136 -14.640 0.442 -2.844 1.00 0.22 H new ATOM 0 HG3 ARG A 136 -15.763 -0.784 -3.397 1.00 0.22 H new ATOM 0 HD2 ARG A 136 -16.551 2.110 -3.778 1.00 32.32 H new ATOM 0 HD3 ARG A 136 -15.305 1.463 -4.827 1.00 32.32 H new ATOM 0 HE ARG A 136 -17.746 -0.206 -4.591 1.00 22.23 H new ATOM 0 HH11 ARG A 136 -15.940 2.291 -6.272 1.00 24.34 H new ATOM 0 HH12 ARG A 136 -16.810 2.077 -7.795 1.00 24.34 H new ATOM 0 HH21 ARG A 136 -18.857 -0.472 -6.555 1.00 63.21 H new ATOM 0 HH22 ARG A 136 -18.447 0.526 -7.954 1.00 63.21 H new ATOM 2204 N ASN A 137 -19.860 0.559 -0.581 1.00 22.52 N ATOM 2205 CA ASN A 137 -20.697 0.265 0.582 1.00 3.30 C ATOM 2206 C ASN A 137 -19.906 0.369 1.880 1.00 5.22 C ATOM 2207 O ASN A 137 -20.083 -0.433 2.797 1.00 12.24 O ATOM 2208 CB ASN A 137 -21.238 -1.137 0.459 1.00 64.11 C ATOM 2209 CG ASN A 137 -21.978 -1.305 -0.865 1.00 0.44 C ATOM 2210 OD1 ASN A 137 -21.917 -2.369 -1.479 1.00 61.11 O ATOM 2211 ND2 ASN A 137 -22.677 -0.312 -1.342 1.00 12.45 N ATOM 0 H ASN A 137 -20.171 1.364 -1.125 1.00 22.52 H new ATOM 0 HA ASN A 137 -21.506 0.995 0.609 1.00 3.30 H new ATOM 0 HB2 ASN A 137 -20.421 -1.856 0.521 1.00 64.11 H new ATOM 0 HB3 ASN A 137 -21.912 -1.348 1.289 1.00 64.11 H new ATOM 0 HD21 ASN A 137 -23.175 -0.417 -2.226 1.00 12.45 H new ATOM 0 HD22 ASN A 137 -22.726 0.569 -0.831 1.00 12.45 H new ATOM 2218 N TYR A 138 -19.048 1.365 1.947 1.00 72.44 N ATOM 2219 CA TYR A 138 -18.229 1.590 3.141 1.00 4.12 C ATOM 2220 C TYR A 138 -18.999 2.411 4.174 1.00 53.42 C ATOM 2221 O TYR A 138 -19.466 3.512 3.882 1.00 42.35 O ATOM 2222 CB TYR A 138 -16.938 2.347 2.774 1.00 74.33 C ATOM 2223 CG TYR A 138 -15.848 1.375 2.384 1.00 64.33 C ATOM 2224 CD1 TYR A 138 -16.152 0.249 1.614 1.00 31.32 C ATOM 2225 CD2 TYR A 138 -14.534 1.603 2.802 1.00 34.13 C ATOM 2226 CE1 TYR A 138 -15.140 -0.652 1.261 1.00 51.43 C ATOM 2227 CE2 TYR A 138 -13.520 0.705 2.448 1.00 13.50 C ATOM 2228 CZ TYR A 138 -13.824 -0.424 1.678 1.00 11.22 C ATOM 2229 OH TYR A 138 -12.826 -1.311 1.331 1.00 72.41 O ATOM 0 H TYR A 138 -18.893 2.036 1.195 1.00 72.44 H new ATOM 0 HA TYR A 138 -17.978 0.616 3.561 1.00 4.12 H new ATOM 0 HB2 TYR A 138 -17.133 3.033 1.950 1.00 74.33 H new ATOM 0 HB3 TYR A 138 -16.610 2.950 3.620 1.00 74.33 H new ATOM 0 HD1 TYR A 138 -17.168 0.074 1.291 1.00 31.32 H new ATOM 0 HD2 TYR A 138 -14.301 2.473 3.399 1.00 34.13 H new ATOM 0 HE1 TYR A 138 -15.375 -1.523 0.667 1.00 51.43 H new ATOM 0 HE2 TYR A 138 -12.504 0.883 2.769 1.00 13.50 H new ATOM 0 HH TYR A 138 -11.972 -1.003 1.700 1.00 72.41 H new ATOM 2239 N THR A 139 -19.100 1.883 5.389 1.00 73.35 N ATOM 2240 CA THR A 139 -19.784 2.596 6.465 1.00 53.43 C ATOM 2241 C THR A 139 -18.818 3.611 7.080 1.00 45.45 C ATOM 2242 O THR A 139 -17.602 3.476 6.942 1.00 2.43 O ATOM 2243 CB THR A 139 -20.276 1.611 7.541 1.00 50.03 C ATOM 2244 OG1 THR A 139 -19.341 1.568 8.608 1.00 62.52 O ATOM 2245 CG2 THR A 139 -20.429 0.208 6.941 1.00 5.14 C ATOM 0 H THR A 139 -18.722 0.973 5.653 1.00 73.35 H new ATOM 0 HA THR A 139 -20.653 3.114 6.059 1.00 53.43 H new ATOM 0 HB THR A 139 -21.244 1.947 7.914 1.00 50.03 H new ATOM 0 HG1 THR A 139 -19.242 0.644 8.919 1.00 62.52 H new ATOM 0 HG21 THR A 139 -20.777 -0.481 7.711 1.00 5.14 H new ATOM 0 HG22 THR A 139 -21.152 0.238 6.126 1.00 5.14 H new ATOM 0 HG23 THR A 139 -19.466 -0.131 6.559 1.00 5.14 H new ATOM 2253 N ASP A 140 -19.354 4.650 7.710 1.00 53.52 N ATOM 2254 CA ASP A 140 -18.506 5.698 8.275 1.00 5.52 C ATOM 2255 C ASP A 140 -17.294 5.122 9.010 1.00 31.22 C ATOM 2256 O ASP A 140 -16.162 5.519 8.741 1.00 10.14 O ATOM 2257 CB ASP A 140 -19.324 6.555 9.242 1.00 20.31 C ATOM 2258 CG ASP A 140 -19.867 5.689 10.374 1.00 21.43 C ATOM 2259 OD1 ASP A 140 -20.022 4.499 10.160 1.00 1.43 O ATOM 2260 OD2 ASP A 140 -20.122 6.231 11.438 1.00 44.34 O ATOM 0 H ASP A 140 -20.356 4.791 7.842 1.00 53.52 H new ATOM 0 HA ASP A 140 -18.138 6.305 7.448 1.00 5.52 H new ATOM 0 HB2 ASP A 140 -18.703 7.353 9.649 1.00 20.31 H new ATOM 0 HB3 ASP A 140 -20.148 7.032 8.711 1.00 20.31 H new ATOM 2265 N GLU A 141 -17.516 4.211 9.952 1.00 53.42 N ATOM 2266 CA GLU A 141 -16.403 3.641 10.709 1.00 10.41 C ATOM 2267 C GLU A 141 -15.356 3.011 9.787 1.00 2.44 C ATOM 2268 O GLU A 141 -14.207 2.827 10.185 1.00 45.00 O ATOM 2269 CB GLU A 141 -16.922 2.589 11.693 1.00 15.24 C ATOM 2270 CG GLU A 141 -17.954 1.699 10.998 1.00 61.03 C ATOM 2271 CD GLU A 141 -18.334 0.535 11.905 1.00 21.14 C ATOM 2272 OE1 GLU A 141 -17.715 0.395 12.947 1.00 23.12 O ATOM 2273 OE2 GLU A 141 -19.239 -0.199 11.545 1.00 3.54 O ATOM 0 H GLU A 141 -18.437 3.856 10.208 1.00 53.42 H new ATOM 0 HA GLU A 141 -15.926 4.454 11.257 1.00 10.41 H new ATOM 0 HB2 GLU A 141 -16.095 1.983 12.063 1.00 15.24 H new ATOM 0 HB3 GLU A 141 -17.371 3.076 12.558 1.00 15.24 H new ATOM 0 HG2 GLU A 141 -18.841 2.282 10.750 1.00 61.03 H new ATOM 0 HG3 GLU A 141 -17.548 1.322 10.059 1.00 61.03 H new ATOM 2280 N MET A 142 -15.754 2.680 8.562 1.00 4.40 N ATOM 2281 CA MET A 142 -14.831 2.064 7.608 1.00 61.31 C ATOM 2282 C MET A 142 -13.913 3.105 6.992 1.00 43.01 C ATOM 2283 O MET A 142 -12.851 2.784 6.459 1.00 0.32 O ATOM 2284 CB MET A 142 -15.624 1.373 6.505 1.00 2.32 C ATOM 2285 CG MET A 142 -16.770 0.572 7.133 1.00 5.12 C ATOM 2286 SD MET A 142 -16.962 -1.000 6.263 1.00 3.23 S ATOM 2287 CE MET A 142 -15.578 -1.843 7.067 1.00 41.33 C ATOM 0 H MET A 142 -16.699 2.825 8.207 1.00 4.40 H new ATOM 0 HA MET A 142 -14.221 1.335 8.141 1.00 61.31 H new ATOM 0 HB2 MET A 142 -16.020 2.112 5.808 1.00 2.32 H new ATOM 0 HB3 MET A 142 -14.973 0.712 5.933 1.00 2.32 H new ATOM 0 HG2 MET A 142 -16.565 0.392 8.188 1.00 5.12 H new ATOM 0 HG3 MET A 142 -17.697 1.143 7.081 1.00 5.12 H new ATOM 0 HE1 MET A 142 -15.234 -2.662 6.435 1.00 41.33 H new ATOM 0 HE2 MET A 142 -14.762 -1.137 7.222 1.00 41.33 H new ATOM 0 HE3 MET A 142 -15.903 -2.239 8.029 1.00 41.33 H new ATOM 2297 N VAL A 143 -14.337 4.352 7.079 1.00 64.53 N ATOM 2298 CA VAL A 143 -13.563 5.469 6.540 1.00 14.22 C ATOM 2299 C VAL A 143 -13.306 6.490 7.649 1.00 14.35 C ATOM 2300 O VAL A 143 -14.242 6.973 8.287 1.00 2.04 O ATOM 2301 CB VAL A 143 -14.329 6.097 5.366 1.00 64.42 C ATOM 2302 CG1 VAL A 143 -15.425 7.031 5.884 1.00 63.32 C ATOM 2303 CG2 VAL A 143 -13.360 6.879 4.477 1.00 15.42 C ATOM 0 H VAL A 143 -15.216 4.624 7.519 1.00 64.53 H new ATOM 0 HA VAL A 143 -12.599 5.119 6.171 1.00 14.22 H new ATOM 0 HB VAL A 143 -14.793 5.301 4.783 1.00 64.42 H new ATOM 0 HG11 VAL A 143 -15.959 7.468 5.040 1.00 63.32 H new ATOM 0 HG12 VAL A 143 -16.123 6.466 6.502 1.00 63.32 H new ATOM 0 HG13 VAL A 143 -14.975 7.825 6.480 1.00 63.32 H new ATOM 0 HG21 VAL A 143 -13.907 7.323 3.645 1.00 15.42 H new ATOM 0 HG22 VAL A 143 -12.886 7.667 5.061 1.00 15.42 H new ATOM 0 HG23 VAL A 143 -12.596 6.204 4.090 1.00 15.42 H new ATOM 2313 N ALA A 144 -12.028 6.782 7.904 1.00 21.22 N ATOM 2314 CA ALA A 144 -11.653 7.712 8.975 1.00 22.10 C ATOM 2315 C ALA A 144 -10.905 8.938 8.442 1.00 31.53 C ATOM 2316 O ALA A 144 -9.831 8.812 7.854 1.00 10.11 O ATOM 2317 CB ALA A 144 -10.756 6.969 9.983 1.00 35.50 C ATOM 0 H ALA A 144 -11.239 6.392 7.388 1.00 21.22 H new ATOM 0 HA ALA A 144 -12.568 8.067 9.450 1.00 22.10 H new ATOM 0 HB1 ALA A 144 -10.469 7.649 10.785 1.00 35.50 H new ATOM 0 HB2 ALA A 144 -11.302 6.124 10.402 1.00 35.50 H new ATOM 0 HB3 ALA A 144 -9.861 6.608 9.476 1.00 35.50 H new ATOM 2323 N MET A 145 -11.473 10.127 8.668 1.00 34.32 N ATOM 2324 CA MET A 145 -10.841 11.364 8.221 1.00 63.14 C ATOM 2325 C MET A 145 -9.747 11.736 9.217 1.00 14.24 C ATOM 2326 O MET A 145 -9.859 11.419 10.402 1.00 64.15 O ATOM 2327 CB MET A 145 -11.883 12.499 8.126 1.00 23.12 C ATOM 2328 CG MET A 145 -13.305 11.929 7.900 1.00 13.52 C ATOM 2329 SD MET A 145 -14.050 12.707 6.447 1.00 53.13 S ATOM 2330 CE MET A 145 -13.224 11.699 5.186 1.00 63.10 C ATOM 0 H MET A 145 -12.361 10.255 9.153 1.00 34.32 H new ATOM 0 HA MET A 145 -10.410 11.219 7.231 1.00 63.14 H new ATOM 0 HB2 MET A 145 -11.866 13.091 9.041 1.00 23.12 H new ATOM 0 HB3 MET A 145 -11.622 13.170 7.308 1.00 23.12 H new ATOM 0 HG2 MET A 145 -13.256 10.849 7.761 1.00 13.52 H new ATOM 0 HG3 MET A 145 -13.924 12.110 8.779 1.00 13.52 H new ATOM 0 HE1 MET A 145 -12.499 12.311 4.649 1.00 63.10 H new ATOM 0 HE2 MET A 145 -12.711 10.865 5.665 1.00 63.10 H new ATOM 0 HE3 MET A 145 -13.965 11.314 4.485 1.00 63.10 H new ATOM 2340 N LEU A 146 -8.659 12.348 8.734 1.00 12.01 N ATOM 2341 CA LEU A 146 -7.538 12.672 9.598 1.00 23.41 C ATOM 2342 C LEU A 146 -7.255 14.191 9.677 1.00 21.43 C ATOM 2343 O LEU A 146 -7.230 14.875 8.655 1.00 31.13 O ATOM 2344 CB LEU A 146 -6.321 11.917 9.039 1.00 10.10 C ATOM 2345 CG LEU A 146 -5.511 11.320 10.176 1.00 33.14 C ATOM 2346 CD1 LEU A 146 -6.366 10.353 11.022 1.00 44.05 C ATOM 2347 CD2 LEU A 146 -4.316 10.566 9.616 1.00 0.12 C ATOM 0 H LEU A 146 -8.539 12.623 7.759 1.00 12.01 H new ATOM 0 HA LEU A 146 -7.766 12.371 10.620 1.00 23.41 H new ATOM 0 HB2 LEU A 146 -6.651 11.128 8.364 1.00 10.10 H new ATOM 0 HB3 LEU A 146 -5.699 12.596 8.456 1.00 10.10 H new ATOM 0 HG LEU A 146 -5.174 12.137 10.814 1.00 33.14 H new ATOM 0 HD11 LEU A 146 -5.759 9.941 11.828 1.00 44.05 H new ATOM 0 HD12 LEU A 146 -7.214 10.892 11.445 1.00 44.05 H new ATOM 0 HD13 LEU A 146 -6.730 9.542 10.391 1.00 44.05 H new ATOM 0 HD21 LEU A 146 -3.738 10.140 10.436 1.00 0.12 H new ATOM 0 HD22 LEU A 146 -4.664 9.766 8.963 1.00 0.12 H new ATOM 0 HD23 LEU A 146 -3.688 11.251 9.047 1.00 0.12 H new ATOM 2359 N PRO A 147 -7.036 14.718 10.877 1.00 74.32 N ATOM 2360 CA PRO A 147 -6.740 16.178 11.102 1.00 13.22 C ATOM 2361 C PRO A 147 -5.300 16.572 10.747 1.00 62.42 C ATOM 2362 O PRO A 147 -4.431 15.716 10.591 1.00 32.22 O ATOM 2363 CB PRO A 147 -6.970 16.336 12.606 1.00 50.41 C ATOM 2364 CG PRO A 147 -6.555 15.022 13.164 1.00 23.44 C ATOM 2365 CD PRO A 147 -7.056 13.989 12.168 1.00 75.41 C ATOM 0 HA PRO A 147 -7.359 16.816 10.471 1.00 13.22 H new ATOM 0 HB2 PRO A 147 -6.377 17.152 13.019 1.00 50.41 H new ATOM 0 HB3 PRO A 147 -8.014 16.555 12.831 1.00 50.41 H new ATOM 0 HG2 PRO A 147 -5.472 14.967 13.277 1.00 23.44 H new ATOM 0 HG3 PRO A 147 -6.988 14.859 14.151 1.00 23.44 H new ATOM 0 HD2 PRO A 147 -6.412 13.110 12.143 1.00 75.41 H new ATOM 0 HD3 PRO A 147 -8.059 13.643 12.418 1.00 75.41 H new ATOM 2373 N ARG A 148 -5.071 17.882 10.621 1.00 54.23 N ATOM 2374 CA ARG A 148 -3.749 18.416 10.276 1.00 1.22 C ATOM 2375 C ARG A 148 -2.742 18.276 11.414 1.00 0.43 C ATOM 2376 O ARG A 148 -1.545 18.472 11.201 1.00 13.04 O ATOM 2377 CB ARG A 148 -3.875 19.891 9.891 1.00 51.40 C ATOM 2378 CG ARG A 148 -4.331 20.704 11.105 1.00 43.21 C ATOM 2379 CD ARG A 148 -4.637 22.138 10.672 1.00 35.10 C ATOM 2380 NE ARG A 148 -4.867 22.981 11.841 1.00 62.22 N ATOM 2381 CZ ARG A 148 -6.064 23.049 12.416 1.00 1.20 C ATOM 2382 NH1 ARG A 148 -7.060 22.358 11.934 1.00 52.02 N ATOM 2383 NH2 ARG A 148 -6.243 23.809 13.462 1.00 12.35 N ATOM 0 H ARG A 148 -5.787 18.596 10.753 1.00 54.23 H new ATOM 0 HA ARG A 148 -3.376 17.830 9.436 1.00 1.22 H new ATOM 0 HB2 ARG A 148 -2.917 20.265 9.529 1.00 51.40 H new ATOM 0 HB3 ARG A 148 -4.590 20.004 9.076 1.00 51.40 H new ATOM 0 HG2 ARG A 148 -5.217 20.250 11.548 1.00 43.21 H new ATOM 0 HG3 ARG A 148 -3.555 20.702 11.870 1.00 43.21 H new ATOM 0 HD2 ARG A 148 -3.807 22.534 10.087 1.00 35.10 H new ATOM 0 HD3 ARG A 148 -5.516 22.151 10.027 1.00 35.10 H new ATOM 0 HE ARG A 148 -4.096 23.528 12.224 1.00 62.22 H new ATOM 0 HH11 ARG A 148 -6.921 21.765 11.116 1.00 52.02 H new ATOM 0 HH12 ARG A 148 -7.978 22.410 12.375 1.00 52.02 H new ATOM 0 HH21 ARG A 148 -5.465 24.351 13.838 1.00 12.35 H new ATOM 0 HH22 ARG A 148 -7.161 23.861 13.903 1.00 12.35 H new ATOM 2397 N GLN A 149 -3.211 17.944 12.614 1.00 64.01 N ATOM 2398 CA GLN A 149 -2.303 17.792 13.754 1.00 11.12 C ATOM 2399 C GLN A 149 -0.995 17.136 13.309 1.00 23.43 C ATOM 2400 O GLN A 149 -1.008 16.091 12.662 1.00 1.45 O ATOM 2401 CB GLN A 149 -2.963 16.940 14.839 1.00 63.41 C ATOM 2402 CG GLN A 149 -4.187 17.673 15.390 1.00 22.32 C ATOM 2403 CD GLN A 149 -3.745 18.885 16.205 1.00 72.30 C ATOM 2404 OE1 GLN A 149 -4.164 20.008 15.926 1.00 52.21 O ATOM 2405 NE2 GLN A 149 -2.919 18.721 17.201 1.00 51.13 N ATOM 0 H GLN A 149 -4.195 17.777 12.824 1.00 64.01 H new ATOM 0 HA GLN A 149 -2.083 18.781 14.157 1.00 11.12 H new ATOM 0 HB2 GLN A 149 -3.259 15.975 14.428 1.00 63.41 H new ATOM 0 HB3 GLN A 149 -2.253 16.741 15.642 1.00 63.41 H new ATOM 0 HG2 GLN A 149 -4.831 17.991 14.570 1.00 22.32 H new ATOM 0 HG3 GLN A 149 -4.775 16.999 16.014 1.00 22.32 H new ATOM 0 HE21 GLN A 149 -2.574 17.789 17.429 1.00 51.13 H new ATOM 0 HE22 GLN A 149 -2.618 19.525 17.752 1.00 51.13 H new ATOM 2414 N GLU A 150 0.132 17.766 13.632 1.00 42.02 N ATOM 2415 CA GLU A 150 1.437 17.235 13.230 1.00 71.13 C ATOM 2416 C GLU A 150 2.402 17.171 14.410 1.00 22.12 C ATOM 2417 O GLU A 150 2.498 18.109 15.202 1.00 71.23 O ATOM 2418 CB GLU A 150 2.036 18.121 12.136 1.00 34.32 C ATOM 2419 CG GLU A 150 2.283 19.526 12.691 1.00 13.13 C ATOM 2420 CD GLU A 150 2.638 20.479 11.556 1.00 52.33 C ATOM 2421 OE1 GLU A 150 2.794 20.009 10.441 1.00 3.52 O ATOM 2422 OE2 GLU A 150 2.748 21.665 11.818 1.00 32.34 O ATOM 0 H GLU A 150 0.171 18.635 14.165 1.00 42.02 H new ATOM 0 HA GLU A 150 1.287 16.222 12.855 1.00 71.13 H new ATOM 0 HB2 GLU A 150 2.971 17.691 11.777 1.00 34.32 H new ATOM 0 HB3 GLU A 150 1.360 18.170 11.283 1.00 34.32 H new ATOM 0 HG2 GLU A 150 1.394 19.882 13.211 1.00 13.13 H new ATOM 0 HG3 GLU A 150 3.091 19.500 13.422 1.00 13.13 H new ATOM 2429 N GLU A 151 3.132 16.062 14.499 1.00 4.03 N ATOM 2430 CA GLU A 151 4.118 15.871 15.559 1.00 52.44 C ATOM 2431 C GLU A 151 5.507 15.828 14.938 1.00 73.51 C ATOM 2432 O GLU A 151 6.500 16.192 15.568 1.00 3.50 O ATOM 2433 CB GLU A 151 3.844 14.562 16.304 1.00 72.13 C ATOM 2434 CG GLU A 151 2.471 14.635 16.978 1.00 41.50 C ATOM 2435 CD GLU A 151 2.481 15.696 18.072 1.00 14.22 C ATOM 2436 OE1 GLU A 151 3.562 16.088 18.481 1.00 41.41 O ATOM 2437 OE2 GLU A 151 1.408 16.104 18.486 1.00 62.43 O ATOM 0 H GLU A 151 3.059 15.280 13.848 1.00 4.03 H new ATOM 0 HA GLU A 151 4.054 16.696 16.269 1.00 52.44 H new ATOM 0 HB2 GLU A 151 3.876 13.723 15.609 1.00 72.13 H new ATOM 0 HB3 GLU A 151 4.619 14.387 17.051 1.00 72.13 H new ATOM 0 HG2 GLU A 151 1.706 14.871 16.238 1.00 41.50 H new ATOM 0 HG3 GLU A 151 2.214 13.665 17.404 1.00 41.50 H new ATOM 2444 N CYS A 152 5.553 15.384 13.684 1.00 54.01 N ATOM 2445 CA CYS A 152 6.805 15.289 12.942 1.00 34.43 C ATOM 2446 C CYS A 152 6.588 15.743 11.500 1.00 75.51 C ATOM 2447 O CYS A 152 5.454 15.804 11.025 1.00 62.32 O ATOM 2448 CB CYS A 152 7.311 13.845 12.959 1.00 0.24 C ATOM 2449 SG CYS A 152 8.162 13.523 14.523 1.00 44.10 S ATOM 0 H CYS A 152 4.732 15.083 13.159 1.00 54.01 H new ATOM 0 HA CYS A 152 7.548 15.933 13.412 1.00 34.43 H new ATOM 0 HB2 CYS A 152 6.476 13.154 12.838 1.00 0.24 H new ATOM 0 HB3 CYS A 152 7.989 13.676 12.122 1.00 0.24 H new ATOM 2454 N THR A 153 7.678 16.064 10.810 1.00 75.14 N ATOM 2455 CA THR A 153 7.592 16.518 9.423 1.00 22.23 C ATOM 2456 C THR A 153 8.890 16.216 8.681 1.00 50.03 C ATOM 2457 O THR A 153 9.929 15.985 9.302 1.00 31.11 O ATOM 2458 CB THR A 153 7.309 18.023 9.380 1.00 71.11 C ATOM 2459 OG1 THR A 153 8.280 18.707 10.158 1.00 5.13 O ATOM 2460 CG2 THR A 153 5.911 18.303 9.942 1.00 31.04 C ATOM 0 H THR A 153 8.626 16.019 11.184 1.00 75.14 H new ATOM 0 HA THR A 153 6.776 15.985 8.935 1.00 22.23 H new ATOM 0 HB THR A 153 7.357 18.371 8.348 1.00 71.11 H new ATOM 0 HG1 THR A 153 8.102 19.670 10.130 1.00 5.13 H new ATOM 0 HG21 THR A 153 5.714 19.375 9.910 1.00 31.04 H new ATOM 0 HG22 THR A 153 5.166 17.779 9.343 1.00 31.04 H new ATOM 0 HG23 THR A 153 5.857 17.955 10.974 1.00 31.04 H new ATOM 2468 N VAL A 154 8.831 16.226 7.351 1.00 43.53 N ATOM 2469 CA VAL A 154 9.996 15.963 6.544 1.00 13.03 C ATOM 2470 C VAL A 154 10.931 17.162 6.570 1.00 70.14 C ATOM 2471 O VAL A 154 10.523 18.278 6.893 1.00 41.12 O ATOM 2472 CB VAL A 154 9.569 15.674 5.102 1.00 11.05 C ATOM 2473 CG1 VAL A 154 8.355 14.744 5.096 1.00 73.42 C ATOM 2474 CG2 VAL A 154 9.213 16.987 4.390 1.00 75.21 C ATOM 0 H VAL A 154 7.982 16.415 6.819 1.00 43.53 H new ATOM 0 HA VAL A 154 10.519 15.096 6.948 1.00 13.03 H new ATOM 0 HB VAL A 154 10.395 15.192 4.578 1.00 11.05 H new ATOM 0 HG11 VAL A 154 8.056 14.542 4.067 1.00 73.42 H new ATOM 0 HG12 VAL A 154 8.612 13.807 5.590 1.00 73.42 H new ATOM 0 HG13 VAL A 154 7.530 15.219 5.627 1.00 73.42 H new ATOM 0 HG21 VAL A 154 8.910 16.774 3.365 1.00 75.21 H new ATOM 0 HG22 VAL A 154 8.393 17.476 4.917 1.00 75.21 H new ATOM 0 HG23 VAL A 154 10.083 17.644 4.383 1.00 75.21 H new ATOM 2484 N ASP A 155 12.177 16.922 6.216 1.00 53.10 N ATOM 2485 CA ASP A 155 13.170 17.988 6.185 1.00 33.15 C ATOM 2486 C ASP A 155 13.054 18.787 4.904 1.00 24.14 C ATOM 2487 O ASP A 155 12.402 18.379 3.943 1.00 1.22 O ATOM 2488 CB ASP A 155 14.586 17.434 6.302 1.00 73.41 C ATOM 2489 CG ASP A 155 15.611 18.549 6.114 1.00 20.14 C ATOM 2490 OD1 ASP A 155 15.437 19.595 6.719 1.00 21.31 O ATOM 2491 OD2 ASP A 155 16.555 18.341 5.370 1.00 61.10 O ATOM 0 H ASP A 155 12.530 16.004 5.946 1.00 53.10 H new ATOM 0 HA ASP A 155 12.975 18.636 7.040 1.00 33.15 H new ATOM 0 HB2 ASP A 155 14.721 16.968 7.278 1.00 73.41 H new ATOM 0 HB3 ASP A 155 14.743 16.657 5.553 1.00 73.41 H new