USER MOD reduce.3.24.130724 H: found=0, std=0, add=1118, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1129 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 130 THR OG1 : rot 33:sc= 0.248 USER MOD Set 1.2: A 134 TYR OH : rot 2:sc= 1.49 USER MOD Set 2.1: A 86 SER OG : rot -161:sc= 1.14 USER MOD Set 2.2: A 139 GLN : amide:sc= 0.334 K(o=1.5,f=-2!) USER MOD Set 3.1: A 80 ASN : amide:sc= -0.438 K(o=0.4,f=-1.9!) USER MOD Set 3.2: A 85 HIS : no HD1:sc= 0.626 K(o=0.4,f=-6.5!) USER MOD Set 3.3: A 138 CYS SG : rot -138:sc= 0.233 USER MOD Set 3.4: A 143 HIS : no HD1:sc= -0.0209 K(o=0.4,f=-0.45) USER MOD Set 4.1: A 78 ASN : amide:sc= 2.16 K(o=4.5,f=-4.6!) USER MOD Set 4.2: A 112 SER OG : rot -99:sc= 2.31 USER MOD Set 5.1: A 71 THR OG1 : rot -46:sc= 1.32 USER MOD Set 5.2: A 128 HIS : no HE2:sc= 0.992 K(o=2.3,f=-5!) USER MOD Set 6.1: A 30 THR OG1 : rot 20:sc= 0.476 USER MOD Set 6.2: A 63 THR OG1 : rot 114:sc= 1.1 USER MOD Set 7.1: A 33 TYR OH : rot -9:sc= 0.642 USER MOD Set 7.2: A 57 HIS : no HE2:sc= -0.27 K(o=0.37,f=-6.5!) USER MOD Set 8.1: A 39 HIS : no HE2:sc= 1.37 K(o=2.3,f=-5.4!) USER MOD Set 8.2: A 75 THR OG1 : rot -176:sc= 0.917 USER MOD Set 9.1: A 27 SER OG : rot -130:sc= 0.923 USER MOD Set 9.2: A 32 THR OG1 : rot 122:sc= 1.16 USER MOD Set10.1: A 25 LYS NZ :NH3+ 147:sc= 0.702 (180deg=0) USER MOD Set10.2: A 34 SER OG : rot 7:sc= 1.12 USER MOD Set11.1: A 11 THR OG1 : rot -31:sc= 1.18 USER MOD Set11.2: A 14 GLN : amide:sc= 1.46 K(o=2.6,f=-4.5!) USER MOD Set12.1: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set12.2: A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot -32:sc= 0.381 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -164:sc= -0.0145 (180deg=-0.229) USER MOD Single : A 18 MET CE :methyl -178:sc= -0.0224 (180deg=-0.0473) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot -39:sc= 1.07 USER MOD Single : A 36 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.035) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.0707 USER MOD Single : A 53 SER OG : rot 180:sc= 0.0327 USER MOD Single : A 59 LYS NZ :NH3+ -146:sc= 0.395 (180deg=0.0497) USER MOD Single : A 60 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0821) USER MOD Single : A 61 ASN : amide:sc= -1.22 K(o=-1.2,f=-6.2!) USER MOD Single : A 79 THR OG1 : rot 149:sc= -0.104 USER MOD Single : A 81 LYS NZ :NH3+ -178:sc= 0.951 (180deg=0.936) USER MOD Single : A 90 THR OG1 : rot 137:sc= 1.49 USER MOD Single : A 91 LYS NZ :NH3+ -174:sc=-0.00948 (180deg=-0.086) USER MOD Single : A 92 LYS NZ :NH3+ -166:sc= 2.17 (180deg=1.9) USER MOD Single : A 96 TYR OH : rot 20:sc= 1.02 USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot -48:sc= 1.1 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0173) USER MOD Single : A 123 THR OG1 : rot -125:sc= 1.37 USER MOD Single : A 126 THR OG1 : rot -81:sc= 1.11 USER MOD Single : A 133 THR OG1 : rot 180:sc= -0.189 USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 TYR OH : rot -165:sc= 1.19 USER MOD Single : A 146 THR OG1 : rot 50:sc= 0.638 USER MOD Single : A 148 MET CE :methyl 155:sc= -1.03 (180deg=-2.27) USER MOD Single : A 151 LYS NZ :NH3+ 169:sc= -0.0107 (180deg=-0.152) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 54 N THR A 5 -3.991 -3.664 12.640 1.00 0.00 N ATOM 55 CA THR A 5 -5.444 -3.740 12.638 1.00 0.00 C ATOM 56 C THR A 5 -6.065 -2.336 12.722 1.00 0.00 C ATOM 57 O THR A 5 -7.211 -2.188 13.145 1.00 0.00 O ATOM 58 CB THR A 5 -5.854 -4.603 13.842 1.00 0.00 C ATOM 59 OG1 THR A 5 -5.195 -4.114 14.997 1.00 0.00 O ATOM 60 CG2 THR A 5 -5.450 -6.069 13.643 1.00 0.00 C ATOM 0 HA THR A 5 -5.806 -4.186 11.712 1.00 0.00 H new ATOM 0 HB THR A 5 -6.937 -4.549 13.949 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.319 -3.754 14.746 1.00 0.00 H new ATOM 0 HG21 THR A 5 -5.755 -6.652 14.512 1.00 0.00 H new ATOM 0 HG22 THR A 5 -5.939 -6.464 12.752 1.00 0.00 H new ATOM 0 HG23 THR A 5 -4.369 -6.135 13.523 1.00 0.00 H new ATOM 68 N THR A 6 -5.334 -1.288 12.319 1.00 0.00 N ATOM 69 CA THR A 6 -5.763 0.101 12.451 1.00 0.00 C ATOM 70 C THR A 6 -6.747 0.463 11.329 1.00 0.00 C ATOM 71 O THR A 6 -6.457 1.289 10.463 1.00 0.00 O ATOM 72 CB THR A 6 -4.518 1.004 12.503 1.00 0.00 C ATOM 73 OG1 THR A 6 -3.594 0.455 13.426 1.00 0.00 O ATOM 74 CG2 THR A 6 -4.906 2.408 12.973 1.00 0.00 C ATOM 0 H THR A 6 -4.416 -1.388 11.887 1.00 0.00 H new ATOM 0 HA THR A 6 -6.309 0.254 13.382 1.00 0.00 H new ATOM 0 HB THR A 6 -4.077 1.065 11.508 1.00 0.00 H new ATOM 0 HG1 THR A 6 -2.796 1.022 13.466 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.018 3.039 13.006 1.00 0.00 H new ATOM 0 HG22 THR A 6 -5.630 2.837 12.280 1.00 0.00 H new ATOM 0 HG23 THR A 6 -5.347 2.350 13.968 1.00 0.00 H new ATOM 82 N TRP A 7 -7.902 -0.206 11.346 1.00 0.00 N ATOM 83 CA TRP A 7 -8.946 -0.153 10.330 1.00 0.00 C ATOM 84 C TRP A 7 -9.887 1.019 10.601 1.00 0.00 C ATOM 85 O TRP A 7 -10.324 1.191 11.738 1.00 0.00 O ATOM 86 CB TRP A 7 -9.780 -1.445 10.402 1.00 0.00 C ATOM 87 CG TRP A 7 -9.167 -2.761 10.011 1.00 0.00 C ATOM 88 CD1 TRP A 7 -9.868 -3.915 9.920 1.00 0.00 C ATOM 89 CD2 TRP A 7 -7.798 -3.106 9.626 1.00 0.00 C ATOM 90 NE1 TRP A 7 -9.042 -4.937 9.508 1.00 0.00 N ATOM 91 CE2 TRP A 7 -7.749 -4.502 9.338 1.00 0.00 C ATOM 92 CE3 TRP A 7 -6.590 -2.394 9.463 1.00 0.00 C ATOM 93 CZ2 TRP A 7 -6.571 -5.149 8.943 1.00 0.00 C ATOM 94 CZ3 TRP A 7 -5.393 -3.045 9.145 1.00 0.00 C ATOM 95 CH2 TRP A 7 -5.398 -4.403 8.817 1.00 0.00 C ATOM 0 H TRP A 7 -8.144 -0.833 12.113 1.00 0.00 H new ATOM 0 HA TRP A 7 -8.477 -0.038 9.353 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -10.134 -1.545 11.428 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -10.659 -1.298 9.774 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -10.921 -4.019 10.138 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -9.351 -5.896 9.349 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -6.590 -1.321 9.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -6.570 -6.210 8.739 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -4.463 -2.496 9.153 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -4.493 -4.876 8.465 1.00 0.00 H new ATOM 106 N LYS A 8 -10.232 1.797 9.570 1.00 0.00 N ATOM 107 CA LYS A 8 -11.227 2.863 9.650 1.00 0.00 C ATOM 108 C LYS A 8 -11.889 2.987 8.276 1.00 0.00 C ATOM 109 O LYS A 8 -11.469 2.319 7.332 1.00 0.00 O ATOM 110 CB LYS A 8 -10.564 4.185 10.078 1.00 0.00 C ATOM 111 CG LYS A 8 -10.222 4.208 11.576 1.00 0.00 C ATOM 112 CD LYS A 8 -9.749 5.587 12.054 1.00 0.00 C ATOM 113 CE LYS A 8 -8.266 5.808 11.737 1.00 0.00 C ATOM 114 NZ LYS A 8 -7.818 7.141 12.176 1.00 0.00 N ATOM 0 H LYS A 8 -9.819 1.699 8.643 1.00 0.00 H new ATOM 0 HA LYS A 8 -11.982 2.630 10.400 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -9.654 4.337 9.498 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -11.232 5.015 9.847 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -11.100 3.911 12.150 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -9.444 3.471 11.778 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -10.345 6.364 11.576 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -9.911 5.677 13.128 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.668 5.041 12.229 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.101 5.701 10.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -6.810 7.261 11.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -8.373 7.872 11.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -7.954 7.232 13.203 1.00 0.00 H new ATOM 128 N GLU A 9 -12.937 3.808 8.145 1.00 0.00 N ATOM 129 CA GLU A 9 -13.520 4.115 6.848 1.00 0.00 C ATOM 130 C GLU A 9 -13.857 5.598 6.798 1.00 0.00 C ATOM 131 O GLU A 9 -14.136 6.207 7.828 1.00 0.00 O ATOM 132 CB GLU A 9 -14.764 3.290 6.484 1.00 0.00 C ATOM 133 CG GLU A 9 -14.710 1.809 6.898 1.00 0.00 C ATOM 134 CD GLU A 9 -14.979 1.603 8.381 1.00 0.00 C ATOM 135 OE1 GLU A 9 -14.140 1.052 9.085 1.00 0.00 O ATOM 136 OE2 GLU A 9 -16.179 2.052 8.835 1.00 0.00 O ATOM 0 H GLU A 9 -13.396 4.270 8.930 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.768 3.845 6.106 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -15.635 3.750 6.951 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -14.914 3.344 5.406 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -15.443 1.247 6.319 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -13.729 1.403 6.651 1.00 0.00 H new ATOM 144 N ALA A 10 -13.822 6.153 5.590 1.00 0.00 N ATOM 145 CA ALA A 10 -14.211 7.513 5.267 1.00 0.00 C ATOM 146 C ALA A 10 -15.237 7.419 4.138 1.00 0.00 C ATOM 147 O ALA A 10 -15.892 6.386 4.025 1.00 0.00 O ATOM 148 CB ALA A 10 -12.957 8.270 4.840 1.00 0.00 C ATOM 0 H ALA A 10 -13.504 5.635 4.771 1.00 0.00 H new ATOM 0 HA ALA A 10 -14.654 8.045 6.109 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -13.220 9.298 4.591 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -12.235 8.268 5.657 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -12.519 7.786 3.967 1.00 0.00 H new ATOM 154 N THR A 11 -15.371 8.439 3.285 1.00 0.00 N ATOM 155 CA THR A 11 -16.201 8.388 2.087 1.00 0.00 C ATOM 156 C THR A 11 -15.413 9.008 0.920 1.00 0.00 C ATOM 157 O THR A 11 -14.319 9.545 1.118 1.00 0.00 O ATOM 158 CB THR A 11 -17.574 9.053 2.315 1.00 0.00 C ATOM 159 OG1 THR A 11 -17.443 10.458 2.343 1.00 0.00 O ATOM 160 CG2 THR A 11 -18.251 8.621 3.620 1.00 0.00 C ATOM 0 H THR A 11 -14.898 9.334 3.413 1.00 0.00 H new ATOM 0 HA THR A 11 -16.429 7.352 1.836 1.00 0.00 H new ATOM 0 HB THR A 11 -18.197 8.728 1.482 1.00 0.00 H new ATOM 0 HG1 THR A 11 -16.561 10.697 2.697 1.00 0.00 H new ATOM 0 HG21 THR A 11 -19.212 9.127 3.716 1.00 0.00 H new ATOM 0 HG22 THR A 11 -18.408 7.542 3.609 1.00 0.00 H new ATOM 0 HG23 THR A 11 -17.615 8.886 4.465 1.00 0.00 H new ATOM 168 N LEU A 12 -15.966 8.938 -0.295 1.00 0.00 N ATOM 169 CA LEU A 12 -15.318 9.377 -1.532 1.00 0.00 C ATOM 170 C LEU A 12 -14.502 10.676 -1.397 1.00 0.00 C ATOM 171 O LEU A 12 -13.307 10.655 -1.693 1.00 0.00 O ATOM 172 CB LEU A 12 -16.356 9.428 -2.661 1.00 0.00 C ATOM 173 CG LEU A 12 -15.736 9.736 -4.037 1.00 0.00 C ATOM 174 CD1 LEU A 12 -16.435 8.902 -5.117 1.00 0.00 C ATOM 175 CD2 LEU A 12 -15.872 11.220 -4.399 1.00 0.00 C ATOM 0 H LEU A 12 -16.903 8.564 -0.448 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.560 8.635 -1.785 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -16.878 8.473 -2.710 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -17.102 10.187 -2.427 1.00 0.00 H new ATOM 0 HG LEU A 12 -14.676 9.486 -3.984 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -15.994 9.122 -6.089 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -16.312 7.842 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -17.497 9.148 -5.136 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -15.423 11.399 -5.376 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -16.927 11.492 -4.429 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -15.362 11.826 -3.649 1.00 0.00 H new ATOM 187 N PRO A 13 -15.075 11.811 -0.957 1.00 0.00 N ATOM 188 CA PRO A 13 -14.325 13.053 -0.826 1.00 0.00 C ATOM 189 C PRO A 13 -13.066 12.920 0.042 1.00 0.00 C ATOM 190 O PRO A 13 -12.053 13.561 -0.238 1.00 0.00 O ATOM 191 CB PRO A 13 -15.307 14.091 -0.268 1.00 0.00 C ATOM 192 CG PRO A 13 -16.449 13.254 0.307 1.00 0.00 C ATOM 193 CD PRO A 13 -16.471 12.037 -0.611 1.00 0.00 C ATOM 0 HA PRO A 13 -13.937 13.357 -1.798 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -14.840 14.709 0.499 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -15.661 14.765 -1.048 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -16.264 12.975 1.344 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -17.396 13.793 0.286 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -16.900 11.170 -0.109 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -17.074 12.222 -1.500 1.00 0.00 H new ATOM 201 N GLN A 14 -13.088 12.082 1.084 1.00 0.00 N ATOM 202 CA GLN A 14 -11.896 11.908 1.901 1.00 0.00 C ATOM 203 C GLN A 14 -10.784 11.219 1.117 1.00 0.00 C ATOM 204 O GLN A 14 -9.616 11.415 1.442 1.00 0.00 O ATOM 205 CB GLN A 14 -12.186 11.151 3.192 1.00 0.00 C ATOM 206 CG GLN A 14 -12.974 12.006 4.198 1.00 0.00 C ATOM 207 CD GLN A 14 -14.438 12.163 3.818 1.00 0.00 C ATOM 208 OE1 GLN A 14 -15.140 11.171 3.647 1.00 0.00 O ATOM 209 NE2 GLN A 14 -14.921 13.394 3.686 1.00 0.00 N ATOM 0 H GLN A 14 -13.896 11.530 1.371 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.558 12.907 2.176 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -12.751 10.248 2.963 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -11.247 10.833 3.644 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -12.907 11.551 5.186 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -12.514 12.992 4.269 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -14.313 14.199 3.835 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -15.900 13.534 3.436 1.00 0.00 H new ATOM 218 N VAL A 15 -11.110 10.424 0.093 1.00 0.00 N ATOM 219 CA VAL A 15 -10.067 9.850 -0.751 1.00 0.00 C ATOM 220 C VAL A 15 -9.270 10.991 -1.389 1.00 0.00 C ATOM 221 O VAL A 15 -8.040 10.991 -1.352 1.00 0.00 O ATOM 222 CB VAL A 15 -10.650 8.900 -1.810 1.00 0.00 C ATOM 223 CG1 VAL A 15 -9.523 8.161 -2.544 1.00 0.00 C ATOM 224 CG2 VAL A 15 -11.580 7.863 -1.174 1.00 0.00 C ATOM 0 H VAL A 15 -12.064 10.170 -0.164 1.00 0.00 H new ATOM 0 HA VAL A 15 -9.400 9.244 -0.138 1.00 0.00 H new ATOM 0 HB VAL A 15 -11.219 9.508 -2.513 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -9.952 7.492 -3.290 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.873 8.885 -3.036 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -8.942 7.580 -1.828 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -11.976 7.206 -1.948 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -11.023 7.272 -0.447 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -12.404 8.372 -0.673 1.00 0.00 H new ATOM 234 N LYS A 16 -9.977 11.986 -1.935 1.00 0.00 N ATOM 235 CA LYS A 16 -9.345 13.170 -2.497 1.00 0.00 C ATOM 236 C LYS A 16 -8.545 13.881 -1.403 1.00 0.00 C ATOM 237 O LYS A 16 -7.365 14.167 -1.595 1.00 0.00 O ATOM 238 CB LYS A 16 -10.377 14.108 -3.143 1.00 0.00 C ATOM 239 CG LYS A 16 -10.916 13.629 -4.495 1.00 0.00 C ATOM 240 CD LYS A 16 -11.827 12.400 -4.404 1.00 0.00 C ATOM 241 CE LYS A 16 -12.425 12.073 -5.774 1.00 0.00 C ATOM 242 NZ LYS A 16 -13.373 13.106 -6.233 1.00 0.00 N ATOM 0 H LYS A 16 -10.995 11.988 -1.997 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.664 12.865 -3.292 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -11.214 14.233 -2.457 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -9.923 15.090 -3.275 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -11.468 14.444 -4.963 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.075 13.397 -5.148 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.259 11.546 -4.035 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -12.626 12.585 -3.687 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -11.622 11.971 -6.503 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -12.935 11.111 -5.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -13.948 12.728 -7.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -13.995 13.381 -5.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -12.845 13.939 -6.565 1.00 0.00 H new ATOM 256 N ALA A 17 -9.166 14.130 -0.245 1.00 0.00 N ATOM 257 CA ALA A 17 -8.488 14.779 0.875 1.00 0.00 C ATOM 258 C ALA A 17 -7.159 14.089 1.209 1.00 0.00 C ATOM 259 O ALA A 17 -6.134 14.751 1.355 1.00 0.00 O ATOM 260 CB ALA A 17 -9.399 14.826 2.103 1.00 0.00 C ATOM 0 H ALA A 17 -10.140 13.890 -0.062 1.00 0.00 H new ATOM 0 HA ALA A 17 -8.259 15.801 0.574 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -8.876 15.313 2.926 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -10.302 15.387 1.865 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -9.669 13.811 2.395 1.00 0.00 H new ATOM 266 N MET A 18 -7.169 12.760 1.327 1.00 0.00 N ATOM 267 CA MET A 18 -5.966 11.988 1.593 1.00 0.00 C ATOM 268 C MET A 18 -4.966 12.140 0.444 1.00 0.00 C ATOM 269 O MET A 18 -3.811 12.484 0.690 1.00 0.00 O ATOM 270 CB MET A 18 -6.319 10.530 1.919 1.00 0.00 C ATOM 271 CG MET A 18 -6.901 10.460 3.342 1.00 0.00 C ATOM 272 SD MET A 18 -7.387 8.825 3.949 1.00 0.00 S ATOM 273 CE MET A 18 -8.837 8.540 2.922 1.00 0.00 C ATOM 0 H MET A 18 -8.013 12.194 1.240 1.00 0.00 H new ATOM 0 HA MET A 18 -5.469 12.381 2.480 1.00 0.00 H new ATOM 0 HB2 MET A 18 -7.041 10.148 1.198 1.00 0.00 H new ATOM 0 HB3 MET A 18 -5.431 9.902 1.844 1.00 0.00 H new ATOM 0 HG2 MET A 18 -6.163 10.872 4.031 1.00 0.00 H new ATOM 0 HG3 MET A 18 -7.774 11.111 3.384 1.00 0.00 H new ATOM 0 HE1 MET A 18 -9.290 7.585 3.188 1.00 0.00 H new ATOM 0 HE2 MET A 18 -9.559 9.341 3.082 1.00 0.00 H new ATOM 0 HE3 MET A 18 -8.542 8.522 1.873 1.00 0.00 H new ATOM 283 N LEU A 19 -5.396 11.935 -0.806 1.00 0.00 N ATOM 284 CA LEU A 19 -4.537 12.113 -1.976 1.00 0.00 C ATOM 285 C LEU A 19 -3.854 13.483 -1.979 1.00 0.00 C ATOM 286 O LEU A 19 -2.660 13.575 -2.263 1.00 0.00 O ATOM 287 CB LEU A 19 -5.322 11.883 -3.276 1.00 0.00 C ATOM 288 CG LEU A 19 -5.618 10.398 -3.543 1.00 0.00 C ATOM 289 CD1 LEU A 19 -6.731 10.280 -4.590 1.00 0.00 C ATOM 290 CD2 LEU A 19 -4.378 9.658 -4.065 1.00 0.00 C ATOM 0 H LEU A 19 -6.347 11.642 -1.032 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.750 11.361 -1.918 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.262 12.433 -3.229 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.756 12.291 -4.113 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.922 9.946 -2.599 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.942 9.228 -4.780 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.632 10.769 -4.220 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -6.412 10.759 -5.516 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.626 8.612 -4.242 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.047 10.115 -4.998 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.579 9.721 -3.326 1.00 0.00 H new ATOM 302 N GLU A 20 -4.572 14.551 -1.627 1.00 0.00 N ATOM 303 CA GLU A 20 -3.994 15.887 -1.543 1.00 0.00 C ATOM 304 C GLU A 20 -2.789 15.953 -0.589 1.00 0.00 C ATOM 305 O GLU A 20 -1.943 16.829 -0.751 1.00 0.00 O ATOM 306 CB GLU A 20 -5.080 16.900 -1.156 1.00 0.00 C ATOM 307 CG GLU A 20 -6.107 17.078 -2.286 1.00 0.00 C ATOM 308 CD GLU A 20 -7.369 17.764 -1.788 1.00 0.00 C ATOM 309 OE1 GLU A 20 -8.457 17.207 -1.906 1.00 0.00 O ATOM 310 OE2 GLU A 20 -7.195 18.986 -1.222 1.00 0.00 O ATOM 0 H GLU A 20 -5.564 14.512 -1.394 1.00 0.00 H new ATOM 0 HA GLU A 20 -3.606 16.145 -2.528 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -5.587 16.565 -0.251 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -4.619 17.861 -0.926 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -5.666 17.665 -3.091 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -6.362 16.104 -2.705 1.00 0.00 H new ATOM 318 N LYS A 21 -2.680 15.035 0.381 1.00 0.00 N ATOM 319 CA LYS A 21 -1.577 14.995 1.337 1.00 0.00 C ATOM 320 C LYS A 21 -0.535 13.931 0.961 1.00 0.00 C ATOM 321 O LYS A 21 0.304 13.571 1.783 1.00 0.00 O ATOM 322 CB LYS A 21 -2.151 14.723 2.733 1.00 0.00 C ATOM 323 CG LYS A 21 -3.154 15.807 3.155 1.00 0.00 C ATOM 324 CD LYS A 21 -3.696 15.564 4.571 1.00 0.00 C ATOM 325 CE LYS A 21 -4.567 14.305 4.631 1.00 0.00 C ATOM 326 NZ LYS A 21 -5.207 14.156 5.951 1.00 0.00 N ATOM 0 H LYS A 21 -3.366 14.293 0.521 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.062 15.956 1.325 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -2.642 13.750 2.742 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.338 14.677 3.458 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -2.672 16.784 3.113 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -3.983 15.830 2.448 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -2.864 15.465 5.268 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -4.280 16.427 4.891 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -5.333 14.353 3.857 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -3.956 13.427 4.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -5.790 13.294 5.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -4.475 14.086 6.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -5.809 14.983 6.140 1.00 0.00 H new ATOM 340 N ASP A 22 -0.601 13.381 -0.255 1.00 0.00 N ATOM 341 CA ASP A 22 0.256 12.281 -0.692 1.00 0.00 C ATOM 342 C ASP A 22 1.745 12.637 -0.798 1.00 0.00 C ATOM 343 O ASP A 22 2.603 11.872 -0.356 1.00 0.00 O ATOM 344 CB ASP A 22 -0.252 11.713 -2.024 1.00 0.00 C ATOM 345 CG ASP A 22 0.037 12.595 -3.243 1.00 0.00 C ATOM 346 OD1 ASP A 22 0.415 12.073 -4.287 1.00 0.00 O ATOM 347 OD2 ASP A 22 -0.143 13.935 -3.085 1.00 0.00 O ATOM 0 H ASP A 22 -1.259 13.692 -0.970 1.00 0.00 H new ATOM 0 HA ASP A 22 0.191 11.526 0.092 1.00 0.00 H new ATOM 0 HB2 ASP A 22 0.201 10.735 -2.184 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -1.328 11.557 -1.951 1.00 0.00 H new ATOM 353 N THR A 23 2.045 13.780 -1.414 1.00 0.00 N ATOM 354 CA THR A 23 3.389 14.223 -1.768 1.00 0.00 C ATOM 355 C THR A 23 3.993 13.245 -2.795 1.00 0.00 C ATOM 356 O THR A 23 3.279 12.791 -3.687 1.00 0.00 O ATOM 357 CB THR A 23 4.270 14.519 -0.533 1.00 0.00 C ATOM 358 OG1 THR A 23 4.847 13.351 0.000 1.00 0.00 O ATOM 359 CG2 THR A 23 3.509 15.240 0.585 1.00 0.00 C ATOM 0 H THR A 23 1.327 14.449 -1.691 1.00 0.00 H new ATOM 0 HA THR A 23 3.336 15.196 -2.257 1.00 0.00 H new ATOM 0 HB THR A 23 5.056 15.178 -0.903 1.00 0.00 H new ATOM 0 HG1 THR A 23 4.196 12.620 -0.033 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.180 15.420 1.425 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.131 16.192 0.212 1.00 0.00 H new ATOM 0 HG23 THR A 23 2.674 14.621 0.914 1.00 0.00 H new ATOM 367 N GLY A 24 5.279 12.899 -2.670 1.00 0.00 N ATOM 368 CA GLY A 24 5.970 12.026 -3.610 1.00 0.00 C ATOM 369 C GLY A 24 6.372 12.770 -4.883 1.00 0.00 C ATOM 370 O GLY A 24 5.551 13.017 -5.763 1.00 0.00 O ATOM 0 H GLY A 24 5.870 13.223 -1.904 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.859 11.611 -3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.325 11.186 -3.868 1.00 0.00 H new ATOM 374 N LYS A 25 7.657 13.094 -5.000 1.00 0.00 N ATOM 375 CA LYS A 25 8.236 13.688 -6.191 1.00 0.00 C ATOM 376 C LYS A 25 8.436 12.549 -7.192 1.00 0.00 C ATOM 377 O LYS A 25 9.114 11.572 -6.883 1.00 0.00 O ATOM 378 CB LYS A 25 9.573 14.341 -5.812 1.00 0.00 C ATOM 379 CG LYS A 25 9.371 15.533 -4.860 1.00 0.00 C ATOM 380 CD LYS A 25 10.522 15.673 -3.855 1.00 0.00 C ATOM 381 CE LYS A 25 11.882 15.875 -4.531 1.00 0.00 C ATOM 382 NZ LYS A 25 12.934 16.103 -3.523 1.00 0.00 N ATOM 0 H LYS A 25 8.334 12.946 -4.252 1.00 0.00 H new ATOM 0 HA LYS A 25 7.599 14.458 -6.627 1.00 0.00 H new ATOM 0 HB2 LYS A 25 10.218 13.601 -5.338 1.00 0.00 H new ATOM 0 HB3 LYS A 25 10.083 14.678 -6.715 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.286 16.450 -5.442 1.00 0.00 H new ATOM 0 HG3 LYS A 25 8.432 15.410 -4.320 1.00 0.00 H new ATOM 0 HD2 LYS A 25 10.321 16.517 -3.195 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.562 14.781 -3.229 1.00 0.00 H new ATOM 0 HE2 LYS A 25 12.129 14.999 -5.131 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.833 16.725 -5.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 13.831 15.699 -3.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 13.051 17.125 -3.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 12.663 15.646 -2.629 1.00 0.00 H new ATOM 396 N VAL A 26 7.809 12.632 -8.365 1.00 0.00 N ATOM 397 CA VAL A 26 7.910 11.584 -9.373 1.00 0.00 C ATOM 398 C VAL A 26 9.366 11.458 -9.840 1.00 0.00 C ATOM 399 O VAL A 26 10.120 12.432 -9.836 1.00 0.00 O ATOM 400 CB VAL A 26 6.937 11.881 -10.530 1.00 0.00 C ATOM 401 CG1 VAL A 26 7.009 10.800 -11.618 1.00 0.00 C ATOM 402 CG2 VAL A 26 5.496 11.954 -10.007 1.00 0.00 C ATOM 0 H VAL A 26 7.223 13.421 -8.639 1.00 0.00 H new ATOM 0 HA VAL A 26 7.622 10.621 -8.951 1.00 0.00 H new ATOM 0 HB VAL A 26 7.230 12.838 -10.962 1.00 0.00 H new ATOM 0 HG11 VAL A 26 6.310 11.042 -12.418 1.00 0.00 H new ATOM 0 HG12 VAL A 26 8.021 10.756 -12.021 1.00 0.00 H new ATOM 0 HG13 VAL A 26 6.748 9.833 -11.188 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.819 12.164 -10.835 1.00 0.00 H new ATOM 0 HG22 VAL A 26 5.226 11.002 -9.550 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.418 12.748 -9.264 1.00 0.00 H new ATOM 412 N SER A 27 9.791 10.251 -10.215 1.00 0.00 N ATOM 413 CA SER A 27 11.137 9.983 -10.698 1.00 0.00 C ATOM 414 C SER A 27 11.076 8.836 -11.706 1.00 0.00 C ATOM 415 O SER A 27 11.627 7.765 -11.476 1.00 0.00 O ATOM 416 CB SER A 27 12.050 9.671 -9.505 1.00 0.00 C ATOM 417 OG SER A 27 12.003 10.723 -8.553 1.00 0.00 O ATOM 0 H SER A 27 9.197 9.422 -10.190 1.00 0.00 H new ATOM 0 HA SER A 27 11.555 10.852 -11.206 1.00 0.00 H new ATOM 0 HB2 SER A 27 11.741 8.736 -9.038 1.00 0.00 H new ATOM 0 HB3 SER A 27 13.074 9.531 -9.850 1.00 0.00 H new ATOM 0 HG SER A 27 12.915 10.991 -8.317 1.00 0.00 H new ATOM 423 N GLY A 28 10.393 9.061 -12.831 1.00 0.00 N ATOM 424 CA GLY A 28 10.145 8.012 -13.808 1.00 0.00 C ATOM 425 C GLY A 28 9.166 7.010 -13.197 1.00 0.00 C ATOM 426 O GLY A 28 8.267 7.412 -12.461 1.00 0.00 O ATOM 0 H GLY A 28 10.002 9.968 -13.084 1.00 0.00 H new ATOM 0 HA2 GLY A 28 9.733 8.436 -14.724 1.00 0.00 H new ATOM 0 HA3 GLY A 28 11.077 7.516 -14.078 1.00 0.00 H new ATOM 430 N ASP A 29 9.349 5.706 -13.439 1.00 0.00 N ATOM 431 CA ASP A 29 8.528 4.671 -12.806 1.00 0.00 C ATOM 432 C ASP A 29 9.025 4.421 -11.378 1.00 0.00 C ATOM 433 O ASP A 29 9.398 3.307 -11.013 1.00 0.00 O ATOM 434 CB ASP A 29 8.545 3.388 -13.650 1.00 0.00 C ATOM 435 CG ASP A 29 7.697 2.280 -13.032 1.00 0.00 C ATOM 436 OD1 ASP A 29 8.052 1.113 -13.149 1.00 0.00 O ATOM 437 OD2 ASP A 29 6.566 2.668 -12.384 1.00 0.00 O ATOM 0 H ASP A 29 10.062 5.343 -14.072 1.00 0.00 H new ATOM 0 HA ASP A 29 7.493 5.008 -12.748 1.00 0.00 H new ATOM 0 HB2 ASP A 29 8.177 3.609 -14.652 1.00 0.00 H new ATOM 0 HB3 ASP A 29 9.572 3.040 -13.758 1.00 0.00 H new ATOM 443 N THR A 30 9.099 5.485 -10.581 1.00 0.00 N ATOM 444 CA THR A 30 9.529 5.488 -9.198 1.00 0.00 C ATOM 445 C THR A 30 8.997 6.799 -8.605 1.00 0.00 C ATOM 446 O THR A 30 8.883 7.790 -9.330 1.00 0.00 O ATOM 447 CB THR A 30 11.067 5.347 -9.139 1.00 0.00 C ATOM 448 OG1 THR A 30 11.498 4.051 -9.501 1.00 0.00 O ATOM 449 CG2 THR A 30 11.656 5.689 -7.775 1.00 0.00 C ATOM 0 H THR A 30 8.845 6.417 -10.908 1.00 0.00 H new ATOM 0 HA THR A 30 9.143 4.652 -8.615 1.00 0.00 H new ATOM 0 HB THR A 30 11.434 6.074 -9.864 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.795 3.605 -10.017 1.00 0.00 H new ATOM 0 HG21 THR A 30 12.739 5.568 -7.806 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.413 6.721 -7.522 1.00 0.00 H new ATOM 0 HG23 THR A 30 11.238 5.022 -7.021 1.00 0.00 H new ATOM 457 N VAL A 31 8.640 6.800 -7.318 1.00 0.00 N ATOM 458 CA VAL A 31 8.197 7.973 -6.572 1.00 0.00 C ATOM 459 C VAL A 31 9.211 8.181 -5.440 1.00 0.00 C ATOM 460 O VAL A 31 9.651 7.212 -4.821 1.00 0.00 O ATOM 461 CB VAL A 31 6.750 7.762 -6.080 1.00 0.00 C ATOM 462 CG1 VAL A 31 6.297 8.879 -5.133 1.00 0.00 C ATOM 463 CG2 VAL A 31 5.768 7.720 -7.266 1.00 0.00 C ATOM 0 H VAL A 31 8.653 5.953 -6.750 1.00 0.00 H new ATOM 0 HA VAL A 31 8.167 8.875 -7.183 1.00 0.00 H new ATOM 0 HB VAL A 31 6.745 6.812 -5.546 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.273 8.690 -4.811 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.952 8.906 -4.262 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.344 9.837 -5.651 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.754 7.570 -6.894 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.818 8.661 -7.814 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.035 6.899 -7.931 1.00 0.00 H new ATOM 473 N THR A 32 9.597 9.434 -5.190 1.00 0.00 N ATOM 474 CA THR A 32 10.649 9.809 -4.258 1.00 0.00 C ATOM 475 C THR A 32 10.076 10.720 -3.179 1.00 0.00 C ATOM 476 O THR A 32 9.570 11.798 -3.483 1.00 0.00 O ATOM 477 CB THR A 32 11.771 10.498 -5.051 1.00 0.00 C ATOM 478 OG1 THR A 32 12.268 9.597 -6.024 1.00 0.00 O ATOM 479 CG2 THR A 32 12.933 10.963 -4.167 1.00 0.00 C ATOM 0 H THR A 32 9.168 10.238 -5.649 1.00 0.00 H new ATOM 0 HA THR A 32 11.060 8.932 -3.759 1.00 0.00 H new ATOM 0 HB THR A 32 11.340 11.386 -5.512 1.00 0.00 H new ATOM 0 HG1 THR A 32 12.173 9.993 -6.915 1.00 0.00 H new ATOM 0 HG21 THR A 32 13.692 11.441 -4.786 1.00 0.00 H new ATOM 0 HG22 THR A 32 12.566 11.675 -3.428 1.00 0.00 H new ATOM 0 HG23 THR A 32 13.369 10.104 -3.657 1.00 0.00 H new ATOM 487 N TYR A 33 10.145 10.299 -1.916 1.00 0.00 N ATOM 488 CA TYR A 33 9.698 11.120 -0.804 1.00 0.00 C ATOM 489 C TYR A 33 10.774 12.113 -0.370 1.00 0.00 C ATOM 490 O TYR A 33 11.926 12.056 -0.797 1.00 0.00 O ATOM 491 CB TYR A 33 9.259 10.224 0.357 1.00 0.00 C ATOM 492 CG TYR A 33 7.786 9.892 0.290 1.00 0.00 C ATOM 493 CD1 TYR A 33 7.335 8.864 -0.557 1.00 0.00 C ATOM 494 CD2 TYR A 33 6.858 10.711 0.961 1.00 0.00 C ATOM 495 CE1 TYR A 33 5.956 8.647 -0.716 1.00 0.00 C ATOM 496 CE2 TYR A 33 5.485 10.445 0.856 1.00 0.00 C ATOM 497 CZ TYR A 33 5.036 9.440 -0.012 1.00 0.00 C ATOM 498 OH TYR A 33 3.706 9.237 -0.193 1.00 0.00 O ATOM 0 H TYR A 33 10.510 9.387 -1.642 1.00 0.00 H new ATOM 0 HA TYR A 33 8.842 11.710 -1.131 1.00 0.00 H new ATOM 0 HB2 TYR A 33 9.840 9.302 0.343 1.00 0.00 H new ATOM 0 HB3 TYR A 33 9.476 10.723 1.302 1.00 0.00 H new ATOM 0 HD1 TYR A 33 8.046 8.244 -1.083 1.00 0.00 H new ATOM 0 HD2 TYR A 33 7.203 11.543 1.556 1.00 0.00 H new ATOM 0 HE1 TYR A 33 5.604 7.871 -1.379 1.00 0.00 H new ATOM 0 HE2 TYR A 33 4.777 11.012 1.441 1.00 0.00 H new ATOM 0 HH TYR A 33 3.568 8.616 -0.939 1.00 0.00 H new ATOM 508 N SER A 34 10.376 13.048 0.491 1.00 0.00 N ATOM 509 CA SER A 34 11.218 14.031 1.145 1.00 0.00 C ATOM 510 C SER A 34 10.455 14.442 2.405 1.00 0.00 C ATOM 511 O SER A 34 9.227 14.351 2.419 1.00 0.00 O ATOM 512 CB SER A 34 11.462 15.223 0.209 1.00 0.00 C ATOM 513 OG SER A 34 12.210 14.829 -0.929 1.00 0.00 O ATOM 0 H SER A 34 9.397 13.139 0.763 1.00 0.00 H new ATOM 0 HA SER A 34 12.203 13.638 1.398 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.507 15.644 -0.106 1.00 0.00 H new ATOM 0 HB3 SER A 34 11.995 16.008 0.745 1.00 0.00 H new ATOM 0 HG SER A 34 12.318 13.855 -0.928 1.00 0.00 H new ATOM 519 N GLY A 35 11.161 14.865 3.456 1.00 0.00 N ATOM 520 CA GLY A 35 10.540 15.162 4.740 1.00 0.00 C ATOM 521 C GLY A 35 10.268 13.876 5.527 1.00 0.00 C ATOM 522 O GLY A 35 10.369 12.773 4.992 1.00 0.00 O ATOM 0 H GLY A 35 12.171 15.009 3.438 1.00 0.00 H new ATOM 0 HA2 GLY A 35 11.190 15.817 5.320 1.00 0.00 H new ATOM 0 HA3 GLY A 35 9.606 15.700 4.581 1.00 0.00 H new ATOM 526 N LYS A 36 9.953 14.017 6.819 1.00 0.00 N ATOM 527 CA LYS A 36 9.776 12.877 7.713 1.00 0.00 C ATOM 528 C LYS A 36 8.376 12.269 7.606 1.00 0.00 C ATOM 529 O LYS A 36 8.200 11.085 7.879 1.00 0.00 O ATOM 530 CB LYS A 36 10.084 13.272 9.161 1.00 0.00 C ATOM 531 CG LYS A 36 11.517 13.801 9.315 1.00 0.00 C ATOM 532 CD LYS A 36 11.929 13.931 10.789 1.00 0.00 C ATOM 533 CE LYS A 36 11.044 14.886 11.602 1.00 0.00 C ATOM 534 NZ LYS A 36 11.031 16.246 11.037 1.00 0.00 N ATOM 0 H LYS A 36 9.815 14.922 7.269 1.00 0.00 H new ATOM 0 HA LYS A 36 10.484 12.110 7.399 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.378 14.035 9.488 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.943 12.408 9.811 1.00 0.00 H new ATOM 0 HG2 LYS A 36 12.208 13.130 8.804 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.598 14.773 8.829 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.902 12.944 11.252 1.00 0.00 H new ATOM 0 HD3 LYS A 36 12.961 14.278 10.838 1.00 0.00 H new ATOM 0 HE2 LYS A 36 10.026 14.497 11.634 1.00 0.00 H new ATOM 0 HE3 LYS A 36 11.403 14.925 12.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.477 16.873 11.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 12.006 16.602 10.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.602 16.224 10.090 1.00 0.00 H new ATOM 548 N THR A 37 7.363 13.060 7.253 1.00 0.00 N ATOM 549 CA THR A 37 5.993 12.586 7.152 1.00 0.00 C ATOM 550 C THR A 37 5.790 11.897 5.814 1.00 0.00 C ATOM 551 O THR A 37 5.208 12.453 4.883 1.00 0.00 O ATOM 552 CB THR A 37 5.054 13.771 7.360 1.00 0.00 C ATOM 553 OG1 THR A 37 5.556 14.891 6.656 1.00 0.00 O ATOM 554 CG2 THR A 37 5.035 14.058 8.858 1.00 0.00 C ATOM 0 H THR A 37 7.475 14.049 7.030 1.00 0.00 H new ATOM 0 HA THR A 37 5.772 11.846 7.922 1.00 0.00 H new ATOM 0 HB THR A 37 4.049 13.558 6.995 1.00 0.00 H new ATOM 0 HG1 THR A 37 4.955 15.655 6.785 1.00 0.00 H new ATOM 0 HG21 THR A 37 4.374 14.901 9.059 1.00 0.00 H new ATOM 0 HG22 THR A 37 4.674 13.179 9.392 1.00 0.00 H new ATOM 0 HG23 THR A 37 6.043 14.299 9.195 1.00 0.00 H new ATOM 562 N VAL A 38 6.274 10.662 5.742 1.00 0.00 N ATOM 563 CA VAL A 38 6.187 9.843 4.546 1.00 0.00 C ATOM 564 C VAL A 38 4.780 9.246 4.490 1.00 0.00 C ATOM 565 O VAL A 38 4.540 8.085 4.814 1.00 0.00 O ATOM 566 CB VAL A 38 7.371 8.861 4.483 1.00 0.00 C ATOM 567 CG1 VAL A 38 7.245 7.854 3.333 1.00 0.00 C ATOM 568 CG2 VAL A 38 8.661 9.664 4.273 1.00 0.00 C ATOM 0 H VAL A 38 6.742 10.200 6.522 1.00 0.00 H new ATOM 0 HA VAL A 38 6.299 10.416 3.625 1.00 0.00 H new ATOM 0 HB VAL A 38 7.382 8.302 5.419 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.107 7.187 3.337 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.334 7.270 3.459 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.205 8.389 2.384 1.00 0.00 H new ATOM 0 HG21 VAL A 38 9.510 8.982 4.226 1.00 0.00 H new ATOM 0 HG22 VAL A 38 8.593 10.224 3.340 1.00 0.00 H new ATOM 0 HG23 VAL A 38 8.797 10.357 5.103 1.00 0.00 H new ATOM 578 N HIS A 39 3.829 10.104 4.120 1.00 0.00 N ATOM 579 CA HIS A 39 2.416 9.785 4.035 1.00 0.00 C ATOM 580 C HIS A 39 2.126 9.062 2.716 1.00 0.00 C ATOM 581 O HIS A 39 1.906 9.711 1.693 1.00 0.00 O ATOM 582 CB HIS A 39 1.618 11.087 4.174 1.00 0.00 C ATOM 583 CG HIS A 39 0.131 10.871 4.197 1.00 0.00 C ATOM 584 ND1 HIS A 39 -0.793 11.529 3.413 1.00 0.00 N ATOM 585 CD2 HIS A 39 -0.530 9.942 4.947 1.00 0.00 C ATOM 586 CE1 HIS A 39 -2.004 11.005 3.677 1.00 0.00 C ATOM 587 NE2 HIS A 39 -1.861 10.033 4.600 1.00 0.00 N ATOM 0 H HIS A 39 4.035 11.070 3.864 1.00 0.00 H new ATOM 0 HA HIS A 39 2.118 9.111 4.838 1.00 0.00 H new ATOM 0 HB2 HIS A 39 1.919 11.594 5.091 1.00 0.00 H new ATOM 0 HB3 HIS A 39 1.870 11.750 3.346 1.00 0.00 H new ATOM 0 HD1 HIS A 39 -0.594 12.279 2.751 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -0.096 9.268 5.670 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -2.935 11.312 3.225 1.00 0.00 H new ATOM 596 N VAL A 40 2.148 7.726 2.724 1.00 0.00 N ATOM 597 CA VAL A 40 1.965 6.919 1.522 1.00 0.00 C ATOM 598 C VAL A 40 0.477 6.649 1.316 1.00 0.00 C ATOM 599 O VAL A 40 -0.099 5.796 1.988 1.00 0.00 O ATOM 600 CB VAL A 40 2.799 5.626 1.587 1.00 0.00 C ATOM 601 CG1 VAL A 40 2.622 4.796 0.307 1.00 0.00 C ATOM 602 CG2 VAL A 40 4.286 5.947 1.768 1.00 0.00 C ATOM 0 H VAL A 40 2.294 7.175 3.570 1.00 0.00 H new ATOM 0 HA VAL A 40 2.330 7.469 0.655 1.00 0.00 H new ATOM 0 HB VAL A 40 2.444 5.051 2.443 1.00 0.00 H new ATOM 0 HG11 VAL A 40 3.221 3.888 0.377 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.572 4.530 0.188 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.948 5.380 -0.554 1.00 0.00 H new ATOM 0 HG21 VAL A 40 4.856 5.019 1.811 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.634 6.547 0.927 1.00 0.00 H new ATOM 0 HG23 VAL A 40 4.428 6.504 2.694 1.00 0.00 H new ATOM 612 N VAL A 41 -0.145 7.377 0.386 1.00 0.00 N ATOM 613 CA VAL A 41 -1.550 7.209 0.043 1.00 0.00 C ATOM 614 C VAL A 41 -1.674 6.063 -0.969 1.00 0.00 C ATOM 615 O VAL A 41 -1.602 6.266 -2.185 1.00 0.00 O ATOM 616 CB VAL A 41 -2.142 8.547 -0.423 1.00 0.00 C ATOM 617 CG1 VAL A 41 -3.647 8.418 -0.692 1.00 0.00 C ATOM 618 CG2 VAL A 41 -1.961 9.599 0.677 1.00 0.00 C ATOM 0 H VAL A 41 0.322 8.106 -0.153 1.00 0.00 H new ATOM 0 HA VAL A 41 -2.145 6.923 0.911 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.626 8.838 -1.338 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.042 9.379 -1.021 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -3.815 7.672 -1.469 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.155 8.111 0.222 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.381 10.548 0.345 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.473 9.271 1.582 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.899 9.726 0.887 1.00 0.00 H new ATOM 628 N ALA A 42 -1.814 4.848 -0.436 1.00 0.00 N ATOM 629 CA ALA A 42 -1.927 3.610 -1.188 1.00 0.00 C ATOM 630 C ALA A 42 -3.397 3.231 -1.364 1.00 0.00 C ATOM 631 O ALA A 42 -4.269 3.732 -0.659 1.00 0.00 O ATOM 632 CB ALA A 42 -1.160 2.506 -0.453 1.00 0.00 C ATOM 0 H ALA A 42 -1.853 4.700 0.573 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.496 3.741 -2.180 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.240 1.573 -1.012 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.111 2.788 -0.366 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -1.583 2.370 0.542 1.00 0.00 H new ATOM 638 N ALA A 43 -3.683 2.318 -2.288 1.00 0.00 N ATOM 639 CA ALA A 43 -5.020 1.828 -2.555 1.00 0.00 C ATOM 640 C ALA A 43 -4.929 0.486 -3.271 1.00 0.00 C ATOM 641 O ALA A 43 -3.855 0.071 -3.710 1.00 0.00 O ATOM 642 CB ALA A 43 -5.782 2.853 -3.404 1.00 0.00 C ATOM 0 H ALA A 43 -2.971 1.893 -2.882 1.00 0.00 H new ATOM 0 HA ALA A 43 -5.561 1.688 -1.619 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.788 2.484 -3.604 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.843 3.798 -2.865 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.257 3.006 -4.347 1.00 0.00 H new ATOM 648 N ALA A 44 -6.064 -0.202 -3.392 1.00 0.00 N ATOM 649 CA ALA A 44 -6.150 -1.464 -4.107 1.00 0.00 C ATOM 650 C ALA A 44 -7.458 -1.493 -4.886 1.00 0.00 C ATOM 651 O ALA A 44 -8.494 -1.156 -4.318 1.00 0.00 O ATOM 652 CB ALA A 44 -6.089 -2.631 -3.119 1.00 0.00 C ATOM 0 H ALA A 44 -6.951 0.106 -2.993 1.00 0.00 H new ATOM 0 HA ALA A 44 -5.312 -1.560 -4.797 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -6.154 -3.573 -3.664 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.148 -2.594 -2.570 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -6.921 -2.559 -2.419 1.00 0.00 H new ATOM 658 N VAL A 45 -7.370 -1.881 -6.165 1.00 0.00 N ATOM 659 CA VAL A 45 -8.471 -2.118 -7.095 1.00 0.00 C ATOM 660 C VAL A 45 -9.735 -1.313 -6.748 1.00 0.00 C ATOM 661 O VAL A 45 -10.744 -1.856 -6.290 1.00 0.00 O ATOM 662 CB VAL A 45 -8.729 -3.631 -7.190 1.00 0.00 C ATOM 663 CG1 VAL A 45 -9.646 -3.956 -8.375 1.00 0.00 C ATOM 664 CG2 VAL A 45 -7.434 -4.434 -7.357 1.00 0.00 C ATOM 0 H VAL A 45 -6.464 -2.048 -6.603 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.181 -1.751 -8.080 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.204 -3.915 -6.251 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -9.814 -5.032 -8.421 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.600 -3.445 -8.247 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -9.177 -3.622 -9.300 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.670 -5.496 -7.419 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -6.927 -4.121 -8.270 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.783 -4.257 -6.501 1.00 0.00 H new ATOM 674 N LEU A 46 -9.685 -0.004 -6.990 1.00 0.00 N ATOM 675 CA LEU A 46 -10.785 0.887 -6.657 1.00 0.00 C ATOM 676 C LEU A 46 -11.873 0.710 -7.722 1.00 0.00 C ATOM 677 O LEU A 46 -11.546 0.404 -8.870 1.00 0.00 O ATOM 678 CB LEU A 46 -10.276 2.337 -6.638 1.00 0.00 C ATOM 679 CG LEU A 46 -9.257 2.624 -5.525 1.00 0.00 C ATOM 680 CD1 LEU A 46 -8.663 4.020 -5.749 1.00 0.00 C ATOM 681 CD2 LEU A 46 -9.911 2.566 -4.139 1.00 0.00 C ATOM 0 H LEU A 46 -8.886 0.462 -7.419 1.00 0.00 H new ATOM 0 HA LEU A 46 -11.193 0.655 -5.673 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -9.820 2.565 -7.602 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -11.126 3.009 -6.521 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.477 1.863 -5.562 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -7.937 4.237 -4.965 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -8.169 4.054 -6.720 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -9.460 4.763 -5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -9.162 2.774 -3.374 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.706 3.310 -4.080 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -10.330 1.573 -3.976 1.00 0.00 H new ATOM 693 N PRO A 47 -13.159 0.870 -7.365 1.00 0.00 N ATOM 694 CA PRO A 47 -14.270 0.623 -8.272 1.00 0.00 C ATOM 695 C PRO A 47 -14.111 1.447 -9.552 1.00 0.00 C ATOM 696 O PRO A 47 -14.200 2.672 -9.517 1.00 0.00 O ATOM 697 CB PRO A 47 -15.540 0.972 -7.487 1.00 0.00 C ATOM 698 CG PRO A 47 -15.044 1.885 -6.365 1.00 0.00 C ATOM 699 CD PRO A 47 -13.649 1.337 -6.078 1.00 0.00 C ATOM 0 HA PRO A 47 -14.313 -0.414 -8.603 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -16.273 1.476 -8.117 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -16.022 0.078 -7.090 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -15.013 2.929 -6.677 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -15.688 1.834 -5.487 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -12.999 2.108 -5.664 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -13.685 0.526 -5.351 1.00 0.00 H new ATOM 748 N PHE A 51 -8.997 -5.672 -11.669 1.00 0.00 N ATOM 749 CA PHE A 51 -8.027 -6.356 -10.821 1.00 0.00 C ATOM 750 C PHE A 51 -6.674 -6.444 -11.539 1.00 0.00 C ATOM 751 O PHE A 51 -6.632 -6.350 -12.765 1.00 0.00 O ATOM 752 CB PHE A 51 -8.527 -7.780 -10.518 1.00 0.00 C ATOM 753 CG PHE A 51 -9.386 -7.911 -9.277 1.00 0.00 C ATOM 754 CD1 PHE A 51 -10.729 -7.491 -9.299 1.00 0.00 C ATOM 755 CD2 PHE A 51 -8.864 -8.529 -8.123 1.00 0.00 C ATOM 756 CE1 PHE A 51 -11.544 -7.683 -8.170 1.00 0.00 C ATOM 757 CE2 PHE A 51 -9.684 -8.732 -7.001 1.00 0.00 C ATOM 758 CZ PHE A 51 -11.022 -8.313 -7.027 1.00 0.00 C ATOM 0 HA PHE A 51 -7.910 -5.797 -9.893 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.098 -8.138 -11.375 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -7.663 -8.437 -10.414 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -11.133 -7.021 -10.183 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.832 -8.847 -8.101 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -12.570 -7.347 -8.181 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.284 -9.210 -6.119 1.00 0.00 H new ATOM 0 HZ PHE A 51 -11.654 -8.475 -6.166 1.00 0.00 H new ATOM 768 N PRO A 52 -5.576 -6.750 -10.824 1.00 0.00 N ATOM 769 CA PRO A 52 -5.475 -6.937 -9.375 1.00 0.00 C ATOM 770 C PRO A 52 -4.626 -5.861 -8.674 1.00 0.00 C ATOM 771 O PRO A 52 -4.620 -5.796 -7.451 1.00 0.00 O ATOM 772 CB PRO A 52 -4.741 -8.274 -9.256 1.00 0.00 C ATOM 773 CG PRO A 52 -3.714 -8.170 -10.385 1.00 0.00 C ATOM 774 CD PRO A 52 -4.445 -7.391 -11.479 1.00 0.00 C ATOM 0 HA PRO A 52 -6.459 -6.889 -8.908 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -4.267 -8.395 -8.282 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -5.412 -9.122 -9.391 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -2.813 -7.650 -10.059 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -3.404 -9.155 -10.735 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -3.788 -6.651 -11.937 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -4.780 -8.056 -12.275 1.00 0.00 H new ATOM 782 N SER A 53 -3.892 -5.049 -9.436 1.00 0.00 N ATOM 783 CA SER A 53 -2.876 -4.106 -8.992 1.00 0.00 C ATOM 784 C SER A 53 -3.180 -3.215 -7.774 1.00 0.00 C ATOM 785 O SER A 53 -4.280 -2.678 -7.622 1.00 0.00 O ATOM 786 CB SER A 53 -2.521 -3.230 -10.200 1.00 0.00 C ATOM 787 OG SER A 53 -3.698 -2.904 -10.915 1.00 0.00 O ATOM 0 H SER A 53 -4.003 -5.035 -10.450 1.00 0.00 H new ATOM 0 HA SER A 53 -2.058 -4.724 -8.621 1.00 0.00 H new ATOM 0 HB2 SER A 53 -2.022 -2.320 -9.867 1.00 0.00 H new ATOM 0 HB3 SER A 53 -1.823 -3.757 -10.851 1.00 0.00 H new ATOM 0 HG SER A 53 -3.468 -2.343 -11.685 1.00 0.00 H new ATOM 793 N PHE A 54 -2.130 -2.981 -6.970 1.00 0.00 N ATOM 794 CA PHE A 54 -2.122 -1.990 -5.904 1.00 0.00 C ATOM 795 C PHE A 54 -1.939 -0.668 -6.631 1.00 0.00 C ATOM 796 O PHE A 54 -1.016 -0.534 -7.442 1.00 0.00 O ATOM 797 CB PHE A 54 -0.890 -2.120 -4.990 1.00 0.00 C ATOM 798 CG PHE A 54 -0.933 -3.139 -3.874 1.00 0.00 C ATOM 799 CD1 PHE A 54 -1.957 -3.077 -2.912 1.00 0.00 C ATOM 800 CD2 PHE A 54 0.191 -3.954 -3.640 1.00 0.00 C ATOM 801 CE1 PHE A 54 -1.909 -3.905 -1.778 1.00 0.00 C ATOM 802 CE2 PHE A 54 0.259 -4.749 -2.487 1.00 0.00 C ATOM 803 CZ PHE A 54 -0.790 -4.722 -1.554 1.00 0.00 C ATOM 0 H PHE A 54 -1.250 -3.490 -7.052 1.00 0.00 H new ATOM 0 HA PHE A 54 -3.022 -2.093 -5.297 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -0.031 -2.352 -5.620 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.703 -1.144 -4.543 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.781 -2.392 -3.045 1.00 0.00 H new ATOM 0 HD2 PHE A 54 1.004 -3.967 -4.351 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -2.732 -3.913 -1.079 1.00 0.00 H new ATOM 0 HE2 PHE A 54 1.118 -5.382 -2.317 1.00 0.00 H new ATOM 0 HZ PHE A 54 -0.736 -5.330 -0.663 1.00 0.00 H new ATOM 813 N GLU A 55 -2.796 0.302 -6.338 1.00 0.00 N ATOM 814 CA GLU A 55 -2.695 1.618 -6.927 1.00 0.00 C ATOM 815 C GLU A 55 -2.124 2.535 -5.855 1.00 0.00 C ATOM 816 O GLU A 55 -2.563 2.453 -4.712 1.00 0.00 O ATOM 817 CB GLU A 55 -4.048 2.075 -7.467 1.00 0.00 C ATOM 818 CG GLU A 55 -4.960 0.931 -7.943 1.00 0.00 C ATOM 819 CD GLU A 55 -6.248 1.465 -8.551 1.00 0.00 C ATOM 820 OE1 GLU A 55 -7.324 0.966 -8.227 1.00 0.00 O ATOM 821 OE2 GLU A 55 -6.104 2.496 -9.422 1.00 0.00 O ATOM 0 H GLU A 55 -3.574 0.193 -5.688 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.032 1.628 -7.792 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -4.565 2.637 -6.689 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.881 2.761 -8.298 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.432 0.325 -8.679 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -5.196 0.278 -7.103 1.00 0.00 H new ATOM 829 N VAL A 56 -1.117 3.351 -6.167 1.00 0.00 N ATOM 830 CA VAL A 56 -0.475 4.169 -5.141 1.00 0.00 C ATOM 831 C VAL A 56 -0.198 5.532 -5.749 1.00 0.00 C ATOM 832 O VAL A 56 0.451 5.598 -6.788 1.00 0.00 O ATOM 833 CB VAL A 56 0.805 3.492 -4.626 1.00 0.00 C ATOM 834 CG1 VAL A 56 1.496 4.328 -3.541 1.00 0.00 C ATOM 835 CG2 VAL A 56 0.561 2.073 -4.092 1.00 0.00 C ATOM 0 H VAL A 56 -0.734 3.462 -7.106 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.125 4.285 -4.274 1.00 0.00 H new ATOM 0 HB VAL A 56 1.459 3.418 -5.495 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.396 3.814 -3.204 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.765 5.302 -3.949 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.818 4.462 -2.698 1.00 0.00 H new ATOM 0 HG21 VAL A 56 1.502 1.649 -3.743 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.148 2.112 -3.265 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.155 1.449 -4.888 1.00 0.00 H new ATOM 845 N HIS A 57 -0.717 6.586 -5.106 1.00 0.00 N ATOM 846 CA HIS A 57 -0.706 7.972 -5.561 1.00 0.00 C ATOM 847 C HIS A 57 0.263 8.279 -6.715 1.00 0.00 C ATOM 848 O HIS A 57 1.480 8.233 -6.549 1.00 0.00 O ATOM 849 CB HIS A 57 -0.485 8.897 -4.365 1.00 0.00 C ATOM 850 CG HIS A 57 0.900 8.832 -3.770 1.00 0.00 C ATOM 851 ND1 HIS A 57 1.878 9.797 -3.926 1.00 0.00 N ATOM 852 CD2 HIS A 57 1.346 7.915 -2.862 1.00 0.00 C ATOM 853 CE1 HIS A 57 2.894 9.474 -3.113 1.00 0.00 C ATOM 854 NE2 HIS A 57 2.598 8.334 -2.468 1.00 0.00 N ATOM 0 H HIS A 57 -1.181 6.483 -4.204 1.00 0.00 H new ATOM 0 HA HIS A 57 -1.686 8.157 -6.001 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -0.686 9.923 -4.673 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -1.211 8.649 -3.591 1.00 0.00 H new ATOM 0 HD1 HIS A 57 1.834 10.606 -4.546 1.00 0.00 H new ATOM 0 HD2 HIS A 57 0.821 7.035 -2.520 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.806 10.041 -2.995 1.00 0.00 H new ATOM 863 N ASP A 58 -0.300 8.578 -7.892 1.00 0.00 N ATOM 864 CA ASP A 58 0.383 8.903 -9.145 1.00 0.00 C ATOM 865 C ASP A 58 0.681 7.677 -10.011 1.00 0.00 C ATOM 866 O ASP A 58 0.765 7.811 -11.228 1.00 0.00 O ATOM 867 CB ASP A 58 1.638 9.770 -8.958 1.00 0.00 C ATOM 868 CG ASP A 58 2.147 10.268 -10.302 1.00 0.00 C ATOM 869 OD1 ASP A 58 3.190 9.816 -10.762 1.00 0.00 O ATOM 870 OD2 ASP A 58 1.389 11.214 -10.912 1.00 0.00 O ATOM 0 H ASP A 58 -1.314 8.600 -7.999 1.00 0.00 H new ATOM 0 HA ASP A 58 -0.339 9.511 -9.691 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.408 10.618 -8.313 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.416 9.191 -8.460 1.00 0.00 H new ATOM 876 N LYS A 59 0.852 6.502 -9.403 1.00 0.00 N ATOM 877 CA LYS A 59 1.276 5.285 -10.080 1.00 0.00 C ATOM 878 C LYS A 59 0.451 4.076 -9.609 1.00 0.00 C ATOM 879 O LYS A 59 -0.561 4.194 -8.915 1.00 0.00 O ATOM 880 CB LYS A 59 2.750 5.051 -9.714 1.00 0.00 C ATOM 881 CG LYS A 59 3.728 6.188 -10.038 1.00 0.00 C ATOM 882 CD LYS A 59 3.924 6.391 -11.543 1.00 0.00 C ATOM 883 CE LYS A 59 5.175 7.248 -11.761 1.00 0.00 C ATOM 884 NZ LYS A 59 5.407 7.526 -13.187 1.00 0.00 N ATOM 0 H LYS A 59 0.695 6.372 -8.404 1.00 0.00 H new ATOM 0 HA LYS A 59 1.136 5.394 -11.155 1.00 0.00 H new ATOM 0 HB2 LYS A 59 2.807 4.847 -8.645 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.090 4.152 -10.229 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.361 7.114 -9.596 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.692 5.975 -9.576 1.00 0.00 H new ATOM 0 HD2 LYS A 59 4.032 5.429 -12.044 1.00 0.00 H new ATOM 0 HD3 LYS A 59 3.051 6.879 -11.976 1.00 0.00 H new ATOM 0 HE2 LYS A 59 5.070 8.188 -11.220 1.00 0.00 H new ATOM 0 HE3 LYS A 59 6.043 6.736 -11.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 6.430 7.566 -13.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.981 6.771 -13.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 4.975 8.438 -13.438 1.00 0.00 H new ATOM 898 N LYS A 60 0.906 2.882 -9.992 1.00 0.00 N ATOM 899 CA LYS A 60 0.393 1.611 -9.532 1.00 0.00 C ATOM 900 C LYS A 60 1.617 0.744 -9.275 1.00 0.00 C ATOM 901 O LYS A 60 2.558 0.780 -10.067 1.00 0.00 O ATOM 902 CB LYS A 60 -0.521 0.970 -10.579 1.00 0.00 C ATOM 903 CG LYS A 60 -1.744 1.819 -10.938 1.00 0.00 C ATOM 904 CD LYS A 60 -2.607 1.065 -11.960 1.00 0.00 C ATOM 905 CE LYS A 60 -3.904 1.815 -12.278 1.00 0.00 C ATOM 906 NZ LYS A 60 -3.647 3.155 -12.833 1.00 0.00 N ATOM 0 H LYS A 60 1.672 2.781 -10.658 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.213 1.729 -8.634 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.056 0.781 -11.484 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.859 0.002 -10.208 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -2.327 2.034 -10.042 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -1.427 2.777 -11.350 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -2.038 0.919 -12.878 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -2.846 0.075 -11.573 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -4.493 1.235 -12.989 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -4.501 1.907 -11.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -4.542 3.573 -13.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -3.229 3.761 -12.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -2.989 3.078 -13.634 1.00 0.00 H new ATOM 920 N ASN A 61 1.636 0.042 -8.139 1.00 0.00 N ATOM 921 CA ASN A 61 2.766 -0.773 -7.699 1.00 0.00 C ATOM 922 C ASN A 61 4.114 -0.016 -7.776 1.00 0.00 C ATOM 923 O ASN A 61 5.110 -0.602 -8.202 1.00 0.00 O ATOM 924 CB ASN A 61 2.840 -2.043 -8.567 1.00 0.00 C ATOM 925 CG ASN A 61 1.688 -3.036 -8.440 1.00 0.00 C ATOM 926 OD1 ASN A 61 1.929 -4.230 -8.306 1.00 0.00 O ATOM 927 ND2 ASN A 61 0.421 -2.622 -8.539 1.00 0.00 N ATOM 0 H ASN A 61 0.850 0.025 -7.489 1.00 0.00 H new ATOM 0 HA ASN A 61 2.599 -1.027 -6.652 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.910 -1.737 -9.611 1.00 0.00 H new ATOM 0 HB3 ASN A 61 3.766 -2.565 -8.325 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.341 -3.299 -8.503 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.216 -1.629 -8.651 1.00 0.00 H new ATOM 934 N PRO A 62 4.205 1.277 -7.411 1.00 0.00 N ATOM 935 CA PRO A 62 5.417 2.039 -7.644 1.00 0.00 C ATOM 936 C PRO A 62 6.556 1.661 -6.709 1.00 0.00 C ATOM 937 O PRO A 62 6.369 1.139 -5.610 1.00 0.00 O ATOM 938 CB PRO A 62 5.057 3.500 -7.393 1.00 0.00 C ATOM 939 CG PRO A 62 3.935 3.389 -6.366 1.00 0.00 C ATOM 940 CD PRO A 62 3.192 2.134 -6.822 1.00 0.00 C ATOM 0 HA PRO A 62 5.765 1.841 -8.658 1.00 0.00 H new ATOM 0 HB2 PRO A 62 5.905 4.067 -7.009 1.00 0.00 H new ATOM 0 HB3 PRO A 62 4.726 3.999 -8.304 1.00 0.00 H new ATOM 0 HG2 PRO A 62 4.322 3.286 -5.352 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.290 4.268 -6.373 1.00 0.00 H new ATOM 0 HD2 PRO A 62 2.701 1.642 -5.983 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.415 2.379 -7.547 1.00 0.00 H new ATOM 948 N THR A 63 7.744 2.017 -7.172 1.00 0.00 N ATOM 949 CA THR A 63 9.012 1.936 -6.495 1.00 0.00 C ATOM 950 C THR A 63 9.086 3.162 -5.569 1.00 0.00 C ATOM 951 O THR A 63 8.965 4.284 -6.064 1.00 0.00 O ATOM 952 CB THR A 63 10.055 2.044 -7.620 1.00 0.00 C ATOM 953 OG1 THR A 63 9.534 1.548 -8.847 1.00 0.00 O ATOM 954 CG2 THR A 63 11.327 1.276 -7.322 1.00 0.00 C ATOM 0 H THR A 63 7.845 2.402 -8.111 1.00 0.00 H new ATOM 0 HA THR A 63 9.163 1.031 -5.907 1.00 0.00 H new ATOM 0 HB THR A 63 10.290 3.106 -7.695 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.451 2.284 -9.488 1.00 0.00 H new ATOM 0 HG21 THR A 63 12.024 1.390 -8.152 1.00 0.00 H new ATOM 0 HG22 THR A 63 11.781 1.664 -6.411 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.092 0.220 -7.189 1.00 0.00 H new ATOM 962 N LEU A 64 9.239 2.993 -4.252 1.00 0.00 N ATOM 963 CA LEU A 64 9.279 4.119 -3.314 1.00 0.00 C ATOM 964 C LEU A 64 10.706 4.406 -2.843 1.00 0.00 C ATOM 965 O LEU A 64 11.297 3.558 -2.181 1.00 0.00 O ATOM 966 CB LEU A 64 8.390 3.834 -2.091 1.00 0.00 C ATOM 967 CG LEU A 64 6.943 4.316 -2.260 1.00 0.00 C ATOM 968 CD1 LEU A 64 6.187 3.518 -3.324 1.00 0.00 C ATOM 969 CD2 LEU A 64 6.210 4.191 -0.920 1.00 0.00 C ATOM 0 H LEU A 64 9.338 2.080 -3.809 1.00 0.00 H new ATOM 0 HA LEU A 64 8.904 4.995 -3.844 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.387 2.762 -1.896 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.825 4.316 -1.215 1.00 0.00 H new ATOM 0 HG LEU A 64 6.976 5.355 -2.587 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.168 3.896 -3.407 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.692 3.622 -4.284 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.161 2.466 -3.040 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.181 4.532 -1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.213 3.149 -0.599 1.00 0.00 H new ATOM 0 HD23 LEU A 64 6.714 4.802 -0.171 1.00 0.00 H new ATOM 981 N GLU A 65 11.249 5.597 -3.127 1.00 0.00 N ATOM 982 CA GLU A 65 12.533 6.037 -2.581 1.00 0.00 C ATOM 983 C GLU A 65 12.219 6.831 -1.312 1.00 0.00 C ATOM 984 O GLU A 65 11.502 7.833 -1.377 1.00 0.00 O ATOM 985 CB GLU A 65 13.334 6.875 -3.587 1.00 0.00 C ATOM 986 CG GLU A 65 13.300 6.293 -5.001 1.00 0.00 C ATOM 987 CD GLU A 65 13.844 4.875 -5.055 1.00 0.00 C ATOM 988 OE1 GLU A 65 13.098 3.939 -5.320 1.00 0.00 O ATOM 989 OE2 GLU A 65 15.171 4.746 -4.793 1.00 0.00 O ATOM 0 H GLU A 65 10.808 6.281 -3.742 1.00 0.00 H new ATOM 0 HA GLU A 65 13.164 5.177 -2.357 1.00 0.00 H new ATOM 0 HB2 GLU A 65 12.936 7.890 -3.607 1.00 0.00 H new ATOM 0 HB3 GLU A 65 14.369 6.945 -3.252 1.00 0.00 H new ATOM 0 HG2 GLU A 65 12.274 6.300 -5.370 1.00 0.00 H new ATOM 0 HG3 GLU A 65 13.883 6.929 -5.667 1.00 0.00 H new ATOM 997 N ILE A 66 12.736 6.378 -0.169 1.00 0.00 N ATOM 998 CA ILE A 66 12.392 6.889 1.149 1.00 0.00 C ATOM 999 C ILE A 66 13.613 7.409 1.927 1.00 0.00 C ATOM 1000 O ILE A 66 14.670 6.775 1.909 1.00 0.00 O ATOM 1001 CB ILE A 66 11.719 5.724 1.901 1.00 0.00 C ATOM 1002 CG1 ILE A 66 10.351 5.428 1.253 1.00 0.00 C ATOM 1003 CG2 ILE A 66 11.572 6.003 3.408 1.00 0.00 C ATOM 1004 CD1 ILE A 66 9.480 4.462 2.062 1.00 0.00 C ATOM 0 H ILE A 66 13.424 5.625 -0.139 1.00 0.00 H new ATOM 0 HA ILE A 66 11.729 7.748 1.051 1.00 0.00 H new ATOM 0 HB ILE A 66 12.361 4.847 1.818 1.00 0.00 H new ATOM 0 HG12 ILE A 66 9.811 6.366 1.121 1.00 0.00 H new ATOM 0 HG13 ILE A 66 10.513 5.011 0.259 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.092 5.151 3.891 1.00 0.00 H new ATOM 0 HG22 ILE A 66 12.557 6.161 3.847 1.00 0.00 H new ATOM 0 HG23 ILE A 66 10.962 6.894 3.555 1.00 0.00 H new ATOM 0 HD11 ILE A 66 8.535 4.303 1.543 1.00 0.00 H new ATOM 0 HD12 ILE A 66 9.999 3.510 2.172 1.00 0.00 H new ATOM 0 HD13 ILE A 66 9.286 4.885 3.048 1.00 0.00 H new ATOM 1016 N PRO A 67 13.473 8.539 2.646 1.00 0.00 N ATOM 1017 CA PRO A 67 14.496 9.025 3.555 1.00 0.00 C ATOM 1018 C PRO A 67 14.459 8.177 4.840 1.00 0.00 C ATOM 1019 O PRO A 67 13.457 8.152 5.556 1.00 0.00 O ATOM 1020 CB PRO A 67 14.167 10.499 3.801 1.00 0.00 C ATOM 1021 CG PRO A 67 12.661 10.597 3.561 1.00 0.00 C ATOM 1022 CD PRO A 67 12.362 9.478 2.567 1.00 0.00 C ATOM 0 HA PRO A 67 15.508 8.941 3.159 1.00 0.00 H new ATOM 0 HB2 PRO A 67 14.428 10.801 4.815 1.00 0.00 H new ATOM 0 HB3 PRO A 67 14.721 11.148 3.123 1.00 0.00 H new ATOM 0 HG2 PRO A 67 12.102 10.466 4.487 1.00 0.00 H new ATOM 0 HG3 PRO A 67 12.385 11.571 3.157 1.00 0.00 H new ATOM 0 HD2 PRO A 67 11.421 8.985 2.811 1.00 0.00 H new ATOM 0 HD3 PRO A 67 12.262 9.875 1.557 1.00 0.00 H new ATOM 1030 N ALA A 68 15.543 7.451 5.113 1.00 0.00 N ATOM 1031 CA ALA A 68 15.690 6.561 6.259 1.00 0.00 C ATOM 1032 C ALA A 68 15.280 7.231 7.570 1.00 0.00 C ATOM 1033 O ALA A 68 15.580 8.402 7.797 1.00 0.00 O ATOM 1034 CB ALA A 68 17.140 6.073 6.342 1.00 0.00 C ATOM 0 H ALA A 68 16.372 7.469 4.519 1.00 0.00 H new ATOM 0 HA ALA A 68 15.020 5.714 6.113 1.00 0.00 H new ATOM 0 HB1 ALA A 68 17.252 5.408 7.198 1.00 0.00 H new ATOM 0 HB2 ALA A 68 17.396 5.535 5.429 1.00 0.00 H new ATOM 0 HB3 ALA A 68 17.806 6.928 6.458 1.00 0.00 H new ATOM 1040 N GLY A 69 14.592 6.486 8.439 1.00 0.00 N ATOM 1041 CA GLY A 69 14.167 6.991 9.734 1.00 0.00 C ATOM 1042 C GLY A 69 12.918 7.873 9.664 1.00 0.00 C ATOM 1043 O GLY A 69 12.361 8.204 10.709 1.00 0.00 O ATOM 0 H GLY A 69 14.318 5.520 8.260 1.00 0.00 H new ATOM 0 HA2 GLY A 69 13.971 6.149 10.397 1.00 0.00 H new ATOM 0 HA3 GLY A 69 14.982 7.563 10.178 1.00 0.00 H new ATOM 1047 N ALA A 70 12.455 8.264 8.470 1.00 0.00 N ATOM 1048 CA ALA A 70 11.209 9.003 8.344 1.00 0.00 C ATOM 1049 C ALA A 70 10.033 8.161 8.844 1.00 0.00 C ATOM 1050 O ALA A 70 10.099 6.935 8.871 1.00 0.00 O ATOM 1051 CB ALA A 70 11.015 9.386 6.883 1.00 0.00 C ATOM 0 H ALA A 70 12.928 8.078 7.586 1.00 0.00 H new ATOM 0 HA ALA A 70 11.253 9.905 8.954 1.00 0.00 H new ATOM 0 HB1 ALA A 70 10.084 9.941 6.773 1.00 0.00 H new ATOM 0 HB2 ALA A 70 11.849 10.007 6.556 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.974 8.484 6.273 1.00 0.00 H new ATOM 1057 N THR A 71 8.939 8.821 9.223 1.00 0.00 N ATOM 1058 CA THR A 71 7.723 8.143 9.628 1.00 0.00 C ATOM 1059 C THR A 71 6.929 7.795 8.370 1.00 0.00 C ATOM 1060 O THR A 71 6.266 8.653 7.787 1.00 0.00 O ATOM 1061 CB THR A 71 6.930 9.023 10.601 1.00 0.00 C ATOM 1062 OG1 THR A 71 7.760 9.379 11.690 1.00 0.00 O ATOM 1063 CG2 THR A 71 5.727 8.253 11.148 1.00 0.00 C ATOM 0 H THR A 71 8.878 9.839 9.256 1.00 0.00 H new ATOM 0 HA THR A 71 7.948 7.219 10.160 1.00 0.00 H new ATOM 0 HB THR A 71 6.588 9.912 10.071 1.00 0.00 H new ATOM 0 HG1 THR A 71 8.239 8.586 12.009 1.00 0.00 H new ATOM 0 HG21 THR A 71 5.172 8.888 11.838 1.00 0.00 H new ATOM 0 HG22 THR A 71 5.078 7.958 10.323 1.00 0.00 H new ATOM 0 HG23 THR A 71 6.073 7.363 11.673 1.00 0.00 H new ATOM 1071 N VAL A 72 7.007 6.529 7.962 1.00 0.00 N ATOM 1072 CA VAL A 72 6.242 5.984 6.860 1.00 0.00 C ATOM 1073 C VAL A 72 4.840 5.689 7.378 1.00 0.00 C ATOM 1074 O VAL A 72 4.631 4.678 8.041 1.00 0.00 O ATOM 1075 CB VAL A 72 6.943 4.739 6.289 1.00 0.00 C ATOM 1076 CG1 VAL A 72 6.145 4.186 5.103 1.00 0.00 C ATOM 1077 CG2 VAL A 72 8.334 5.119 5.777 1.00 0.00 C ATOM 0 H VAL A 72 7.620 5.844 8.404 1.00 0.00 H new ATOM 0 HA VAL A 72 6.170 6.692 6.035 1.00 0.00 H new ATOM 0 HB VAL A 72 7.015 3.992 7.080 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.648 3.305 4.705 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.143 3.913 5.434 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.075 4.946 4.325 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.827 4.235 5.373 1.00 0.00 H new ATOM 0 HG22 VAL A 72 8.240 5.871 4.994 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.927 5.522 6.598 1.00 0.00 H new ATOM 1087 N ASP A 73 3.894 6.587 7.099 1.00 0.00 N ATOM 1088 CA ASP A 73 2.485 6.412 7.418 1.00 0.00 C ATOM 1089 C ASP A 73 1.802 5.883 6.165 1.00 0.00 C ATOM 1090 O ASP A 73 1.455 6.657 5.271 1.00 0.00 O ATOM 1091 CB ASP A 73 1.860 7.737 7.877 1.00 0.00 C ATOM 1092 CG ASP A 73 2.241 8.097 9.303 1.00 0.00 C ATOM 1093 OD1 ASP A 73 2.105 7.267 10.197 1.00 0.00 O ATOM 1094 OD2 ASP A 73 2.712 9.357 9.498 1.00 0.00 O ATOM 0 H ASP A 73 4.095 7.473 6.635 1.00 0.00 H new ATOM 0 HA ASP A 73 2.361 5.708 8.241 1.00 0.00 H new ATOM 0 HB2 ASP A 73 2.177 8.536 7.207 1.00 0.00 H new ATOM 0 HB3 ASP A 73 0.775 7.669 7.800 1.00 0.00 H new ATOM 1100 N VAL A 74 1.619 4.565 6.091 1.00 0.00 N ATOM 1101 CA VAL A 74 0.932 3.941 4.977 1.00 0.00 C ATOM 1102 C VAL A 74 -0.566 4.102 5.209 1.00 0.00 C ATOM 1103 O VAL A 74 -1.130 3.466 6.100 1.00 0.00 O ATOM 1104 CB VAL A 74 1.347 2.474 4.819 1.00 0.00 C ATOM 1105 CG1 VAL A 74 0.694 1.866 3.568 1.00 0.00 C ATOM 1106 CG2 VAL A 74 2.868 2.321 4.721 1.00 0.00 C ATOM 0 H VAL A 74 1.944 3.909 6.801 1.00 0.00 H new ATOM 0 HA VAL A 74 1.205 4.424 4.039 1.00 0.00 H new ATOM 0 HB VAL A 74 1.006 1.944 5.708 1.00 0.00 H new ATOM 0 HG11 VAL A 74 0.998 0.824 3.469 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -0.391 1.920 3.661 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.011 2.422 2.686 1.00 0.00 H new ATOM 0 HG21 VAL A 74 3.121 1.267 4.610 1.00 0.00 H new ATOM 0 HG22 VAL A 74 3.235 2.875 3.857 1.00 0.00 H new ATOM 0 HG23 VAL A 74 3.332 2.712 5.626 1.00 0.00 H new ATOM 1116 N THR A 75 -1.178 4.975 4.410 1.00 0.00 N ATOM 1117 CA THR A 75 -2.603 5.232 4.362 1.00 0.00 C ATOM 1118 C THR A 75 -3.179 4.467 3.177 1.00 0.00 C ATOM 1119 O THR A 75 -3.117 4.942 2.045 1.00 0.00 O ATOM 1120 CB THR A 75 -2.833 6.742 4.215 1.00 0.00 C ATOM 1121 OG1 THR A 75 -2.220 7.401 5.301 1.00 0.00 O ATOM 1122 CG2 THR A 75 -4.319 7.109 4.202 1.00 0.00 C ATOM 0 H THR A 75 -0.658 5.549 3.746 1.00 0.00 H new ATOM 0 HA THR A 75 -3.098 4.901 5.275 1.00 0.00 H new ATOM 0 HB THR A 75 -2.403 7.050 3.262 1.00 0.00 H new ATOM 0 HG1 THR A 75 -2.418 8.360 5.256 1.00 0.00 H new ATOM 0 HG21 THR A 75 -4.426 8.189 4.096 1.00 0.00 H new ATOM 0 HG22 THR A 75 -4.809 6.612 3.365 1.00 0.00 H new ATOM 0 HG23 THR A 75 -4.781 6.788 5.136 1.00 0.00 H new ATOM 1130 N PHE A 76 -3.727 3.280 3.421 1.00 0.00 N ATOM 1131 CA PHE A 76 -4.439 2.552 2.385 1.00 0.00 C ATOM 1132 C PHE A 76 -5.835 3.110 2.216 1.00 0.00 C ATOM 1133 O PHE A 76 -6.449 3.469 3.211 1.00 0.00 O ATOM 1134 CB PHE A 76 -4.749 1.113 2.826 1.00 0.00 C ATOM 1135 CG PHE A 76 -3.781 0.003 2.496 1.00 0.00 C ATOM 1136 CD1 PHE A 76 -3.530 -0.203 1.123 1.00 0.00 C ATOM 1137 CD2 PHE A 76 -3.818 -1.120 3.346 1.00 0.00 C ATOM 1138 CE1 PHE A 76 -3.632 -1.490 0.574 1.00 0.00 C ATOM 1139 CE2 PHE A 76 -3.944 -2.409 2.801 1.00 0.00 C ATOM 1140 CZ PHE A 76 -3.908 -2.585 1.407 1.00 0.00 C ATOM 0 H PHE A 76 -3.690 2.807 4.324 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.807 2.618 1.500 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.874 1.124 3.909 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.713 0.842 2.397 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -3.259 0.632 0.493 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -3.750 -0.990 4.416 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.498 -1.638 -0.487 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.068 -3.262 3.451 1.00 0.00 H new ATOM 0 HZ PHE A 76 -4.092 -3.559 0.979 1.00 0.00 H new ATOM 1150 N ILE A 77 -6.349 3.054 0.990 1.00 0.00 N ATOM 1151 CA ILE A 77 -7.754 3.203 0.663 1.00 0.00 C ATOM 1152 C ILE A 77 -8.036 1.949 -0.167 1.00 0.00 C ATOM 1153 O ILE A 77 -7.997 1.980 -1.395 1.00 0.00 O ATOM 1154 CB ILE A 77 -8.119 4.519 -0.049 1.00 0.00 C ATOM 1155 CG1 ILE A 77 -8.003 5.718 0.909 1.00 0.00 C ATOM 1156 CG2 ILE A 77 -9.588 4.473 -0.498 1.00 0.00 C ATOM 1157 CD1 ILE A 77 -6.689 6.470 0.687 1.00 0.00 C ATOM 0 H ILE A 77 -5.768 2.897 0.166 1.00 0.00 H new ATOM 0 HA ILE A 77 -8.379 3.280 1.553 1.00 0.00 H new ATOM 0 HB ILE A 77 -7.436 4.631 -0.891 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -8.844 6.394 0.755 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -8.058 5.371 1.941 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -9.844 5.405 -1.002 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -9.733 3.638 -1.184 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -10.231 4.343 0.373 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -6.631 7.313 1.376 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.850 5.797 0.865 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -6.648 6.837 -0.339 1.00 0.00 H new ATOM 1169 N ASN A 78 -8.228 0.806 0.500 1.00 0.00 N ATOM 1170 CA ASN A 78 -8.655 -0.405 -0.182 1.00 0.00 C ATOM 1171 C ASN A 78 -10.154 -0.499 0.061 1.00 0.00 C ATOM 1172 O ASN A 78 -10.577 -0.817 1.164 1.00 0.00 O ATOM 1173 CB ASN A 78 -7.894 -1.685 0.228 1.00 0.00 C ATOM 1174 CG ASN A 78 -8.693 -2.895 -0.276 1.00 0.00 C ATOM 1175 OD1 ASN A 78 -9.312 -2.827 -1.333 1.00 0.00 O ATOM 1176 ND2 ASN A 78 -8.737 -4.000 0.456 1.00 0.00 N ATOM 0 H ASN A 78 -8.094 0.701 1.506 1.00 0.00 H new ATOM 0 HA ASN A 78 -8.419 -0.337 -1.244 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -6.891 -1.686 -0.200 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -7.778 -1.729 1.311 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -9.287 -4.799 0.141 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -8.220 -4.051 1.334 1.00 0.00 H new ATOM 1183 N THR A 79 -10.948 -0.183 -0.965 1.00 0.00 N ATOM 1184 CA THR A 79 -12.398 -0.338 -0.960 1.00 0.00 C ATOM 1185 C THR A 79 -12.762 -1.264 -2.127 1.00 0.00 C ATOM 1186 O THR A 79 -13.764 -1.080 -2.816 1.00 0.00 O ATOM 1187 CB THR A 79 -13.065 1.050 -0.982 1.00 0.00 C ATOM 1188 OG1 THR A 79 -12.524 1.808 0.082 1.00 0.00 O ATOM 1189 CG2 THR A 79 -14.586 1.020 -0.783 1.00 0.00 C ATOM 0 H THR A 79 -10.589 0.196 -1.841 1.00 0.00 H new ATOM 0 HA THR A 79 -12.776 -0.809 -0.052 1.00 0.00 H new ATOM 0 HB THR A 79 -12.872 1.473 -1.968 1.00 0.00 H new ATOM 0 HG1 THR A 79 -12.517 2.757 -0.163 1.00 0.00 H new ATOM 0 HG21 THR A 79 -14.977 2.037 -0.812 1.00 0.00 H new ATOM 0 HG22 THR A 79 -15.045 0.432 -1.578 1.00 0.00 H new ATOM 0 HG23 THR A 79 -14.818 0.569 0.182 1.00 0.00 H new ATOM 1197 N ASN A 80 -11.935 -2.290 -2.364 1.00 0.00 N ATOM 1198 CA ASN A 80 -12.216 -3.287 -3.382 1.00 0.00 C ATOM 1199 C ASN A 80 -13.253 -4.272 -2.845 1.00 0.00 C ATOM 1200 O ASN A 80 -12.922 -5.401 -2.492 1.00 0.00 O ATOM 1201 CB ASN A 80 -10.933 -3.994 -3.821 1.00 0.00 C ATOM 1202 CG ASN A 80 -11.235 -4.932 -4.981 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -10.939 -6.119 -4.926 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -11.806 -4.405 -6.057 1.00 0.00 N ATOM 0 H ASN A 80 -11.064 -2.444 -1.857 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.625 -2.800 -4.267 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.186 -3.259 -4.120 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.512 -4.555 -2.987 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -12.009 -4.992 -6.866 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -12.042 -3.413 -6.075 1.00 0.00 H new ATOM 1211 N LYS A 81 -14.495 -3.793 -2.764 1.00 0.00 N ATOM 1212 CA LYS A 81 -15.708 -4.452 -2.285 1.00 0.00 C ATOM 1213 C LYS A 81 -15.503 -5.901 -1.808 1.00 0.00 C ATOM 1214 O LYS A 81 -15.500 -6.824 -2.619 1.00 0.00 O ATOM 1215 CB LYS A 81 -16.781 -4.391 -3.386 1.00 0.00 C ATOM 1216 CG LYS A 81 -16.932 -2.987 -3.990 1.00 0.00 C ATOM 1217 CD LYS A 81 -18.250 -2.906 -4.773 1.00 0.00 C ATOM 1218 CE LYS A 81 -18.367 -1.605 -5.574 1.00 0.00 C ATOM 1219 NZ LYS A 81 -18.364 -0.417 -4.701 1.00 0.00 N ATOM 0 H LYS A 81 -14.695 -2.838 -3.062 1.00 0.00 H new ATOM 0 HA LYS A 81 -16.030 -3.907 -1.398 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -16.525 -5.096 -4.177 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -17.738 -4.709 -2.973 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -16.919 -2.236 -3.200 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -16.091 -2.771 -4.649 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -18.321 -3.756 -5.451 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -19.088 -2.981 -4.080 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -17.539 -1.538 -6.280 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -19.286 -1.622 -6.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -18.479 0.439 -5.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -19.148 -0.484 -4.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -17.462 -0.368 -4.185 1.00 0.00 H new ATOM 1233 N GLY A 82 -15.348 -6.119 -0.497 1.00 0.00 N ATOM 1234 CA GLY A 82 -15.235 -7.465 0.063 1.00 0.00 C ATOM 1235 C GLY A 82 -13.804 -8.017 0.081 1.00 0.00 C ATOM 1236 O GLY A 82 -13.432 -8.726 1.016 1.00 0.00 O ATOM 0 H GLY A 82 -15.298 -5.373 0.197 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -15.623 -7.457 1.082 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -15.867 -8.141 -0.513 1.00 0.00 H new ATOM 1240 N PHE A 83 -12.970 -7.690 -0.909 1.00 0.00 N ATOM 1241 CA PHE A 83 -11.599 -8.183 -0.973 1.00 0.00 C ATOM 1242 C PHE A 83 -10.691 -7.331 -0.088 1.00 0.00 C ATOM 1243 O PHE A 83 -10.068 -6.374 -0.549 1.00 0.00 O ATOM 1244 CB PHE A 83 -11.101 -8.191 -2.420 1.00 0.00 C ATOM 1245 CG PHE A 83 -11.864 -9.132 -3.333 1.00 0.00 C ATOM 1246 CD1 PHE A 83 -13.060 -8.707 -3.941 1.00 0.00 C ATOM 1247 CD2 PHE A 83 -11.397 -10.442 -3.547 1.00 0.00 C ATOM 1248 CE1 PHE A 83 -13.787 -9.589 -4.758 1.00 0.00 C ATOM 1249 CE2 PHE A 83 -12.114 -11.316 -4.383 1.00 0.00 C ATOM 1250 CZ PHE A 83 -13.309 -10.890 -4.988 1.00 0.00 C ATOM 0 H PHE A 83 -13.228 -7.079 -1.684 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.576 -9.208 -0.602 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -11.167 -7.180 -2.821 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -10.047 -8.469 -2.429 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -13.419 -7.701 -3.779 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -10.488 -10.776 -3.069 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -14.714 -9.267 -5.209 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -11.746 -12.316 -4.560 1.00 0.00 H new ATOM 0 HZ PHE A 83 -13.859 -11.562 -5.629 1.00 0.00 H new ATOM 1260 N GLY A 84 -10.581 -7.696 1.189 1.00 0.00 N ATOM 1261 CA GLY A 84 -9.687 -7.051 2.142 1.00 0.00 C ATOM 1262 C GLY A 84 -8.209 -7.308 1.828 1.00 0.00 C ATOM 1263 O GLY A 84 -7.520 -7.927 2.630 1.00 0.00 O ATOM 0 H GLY A 84 -11.121 -8.461 1.594 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.874 -5.977 2.141 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.910 -7.412 3.146 1.00 0.00 H new ATOM 1267 N HIS A 85 -7.703 -6.853 0.675 1.00 0.00 N ATOM 1268 CA HIS A 85 -6.296 -6.946 0.307 1.00 0.00 C ATOM 1269 C HIS A 85 -5.421 -6.396 1.434 1.00 0.00 C ATOM 1270 O HIS A 85 -5.546 -5.234 1.812 1.00 0.00 O ATOM 1271 CB HIS A 85 -6.011 -6.154 -0.976 1.00 0.00 C ATOM 1272 CG HIS A 85 -6.816 -6.561 -2.188 1.00 0.00 C ATOM 1273 ND1 HIS A 85 -6.484 -7.534 -3.137 1.00 0.00 N ATOM 1274 CD2 HIS A 85 -7.954 -5.925 -2.598 1.00 0.00 C ATOM 1275 CE1 HIS A 85 -7.427 -7.454 -4.086 1.00 0.00 C ATOM 1276 NE2 HIS A 85 -8.335 -6.518 -3.777 1.00 0.00 N ATOM 0 H HIS A 85 -8.276 -6.402 -0.038 1.00 0.00 H new ATOM 0 HA HIS A 85 -6.064 -7.997 0.135 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -6.195 -5.098 -0.778 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -4.952 -6.254 -1.215 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -8.456 -5.113 -2.093 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.452 -8.061 -4.979 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -9.165 -6.286 -4.323 1.00 0.00 H new ATOM 1284 N SER A 86 -4.533 -7.221 1.970 1.00 0.00 N ATOM 1285 CA SER A 86 -3.556 -6.814 2.958 1.00 0.00 C ATOM 1286 C SER A 86 -2.430 -6.031 2.276 1.00 0.00 C ATOM 1287 O SER A 86 -2.320 -6.062 1.051 1.00 0.00 O ATOM 1288 CB SER A 86 -3.040 -8.097 3.615 1.00 0.00 C ATOM 1289 OG SER A 86 -3.073 -9.207 2.726 1.00 0.00 O ATOM 0 H SER A 86 -4.474 -8.209 1.723 1.00 0.00 H new ATOM 0 HA SER A 86 -3.986 -6.156 3.714 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.018 -7.941 3.960 1.00 0.00 H new ATOM 0 HB3 SER A 86 -3.643 -8.320 4.495 1.00 0.00 H new ATOM 0 HG SER A 86 -3.039 -10.040 3.241 1.00 0.00 H new ATOM 1295 N PHE A 87 -1.606 -5.321 3.055 1.00 0.00 N ATOM 1296 CA PHE A 87 -0.398 -4.658 2.575 1.00 0.00 C ATOM 1297 C PHE A 87 0.709 -5.011 3.565 1.00 0.00 C ATOM 1298 O PHE A 87 0.711 -4.469 4.671 1.00 0.00 O ATOM 1299 CB PHE A 87 -0.575 -3.139 2.508 1.00 0.00 C ATOM 1300 CG PHE A 87 0.478 -2.392 1.708 1.00 0.00 C ATOM 1301 CD1 PHE A 87 1.742 -2.127 2.267 1.00 0.00 C ATOM 1302 CD2 PHE A 87 0.162 -1.876 0.436 1.00 0.00 C ATOM 1303 CE1 PHE A 87 2.656 -1.300 1.590 1.00 0.00 C ATOM 1304 CE2 PHE A 87 1.093 -1.085 -0.261 1.00 0.00 C ATOM 1305 CZ PHE A 87 2.330 -0.777 0.328 1.00 0.00 C ATOM 0 H PHE A 87 -1.767 -5.192 4.054 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.162 -4.990 1.564 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -1.553 -2.923 2.078 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -0.580 -2.746 3.525 1.00 0.00 H new ATOM 0 HD1 PHE A 87 2.011 -2.560 3.219 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -0.800 -2.089 -0.006 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.609 -1.067 2.041 1.00 0.00 H new ATOM 0 HE2 PHE A 87 0.857 -0.715 -1.248 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.030 -0.138 -0.189 1.00 0.00 H new ATOM 1315 N ASP A 88 1.607 -5.934 3.213 1.00 0.00 N ATOM 1316 CA ASP A 88 2.669 -6.400 4.097 1.00 0.00 C ATOM 1317 C ASP A 88 4.021 -6.081 3.489 1.00 0.00 C ATOM 1318 O ASP A 88 4.196 -6.272 2.289 1.00 0.00 O ATOM 1319 CB ASP A 88 2.547 -7.902 4.357 1.00 0.00 C ATOM 1320 CG ASP A 88 1.264 -8.276 5.071 1.00 0.00 C ATOM 1321 OD1 ASP A 88 0.799 -9.396 4.913 1.00 0.00 O ATOM 1322 OD2 ASP A 88 0.704 -7.318 5.850 1.00 0.00 O ATOM 0 H ASP A 88 1.614 -6.381 2.296 1.00 0.00 H new ATOM 0 HA ASP A 88 2.574 -5.884 5.052 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.597 -8.435 3.407 1.00 0.00 H new ATOM 0 HB3 ASP A 88 3.398 -8.232 4.953 1.00 0.00 H new ATOM 1328 N ILE A 89 4.951 -5.604 4.321 1.00 0.00 N ATOM 1329 CA ILE A 89 6.276 -5.142 3.947 1.00 0.00 C ATOM 1330 C ILE A 89 7.319 -6.137 4.468 1.00 0.00 C ATOM 1331 O ILE A 89 7.253 -6.587 5.614 1.00 0.00 O ATOM 1332 CB ILE A 89 6.524 -3.710 4.469 1.00 0.00 C ATOM 1333 CG1 ILE A 89 5.357 -2.780 4.082 1.00 0.00 C ATOM 1334 CG2 ILE A 89 7.851 -3.193 3.899 1.00 0.00 C ATOM 1335 CD1 ILE A 89 5.558 -1.327 4.527 1.00 0.00 C ATOM 0 H ILE A 89 4.784 -5.529 5.324 1.00 0.00 H new ATOM 0 HA ILE A 89 6.359 -5.096 2.861 1.00 0.00 H new ATOM 0 HB ILE A 89 6.584 -3.725 5.557 1.00 0.00 H new ATOM 0 HG12 ILE A 89 5.226 -2.805 3.000 1.00 0.00 H new ATOM 0 HG13 ILE A 89 4.437 -3.163 4.523 1.00 0.00 H new ATOM 0 HG21 ILE A 89 8.034 -2.182 4.263 1.00 0.00 H new ATOM 0 HG22 ILE A 89 8.663 -3.846 4.218 1.00 0.00 H new ATOM 0 HG23 ILE A 89 7.800 -3.183 2.810 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.698 -0.731 4.221 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.658 -1.289 5.612 1.00 0.00 H new ATOM 0 HD13 ILE A 89 6.460 -0.926 4.065 1.00 0.00 H new ATOM 1347 N THR A 90 8.285 -6.490 3.620 1.00 0.00 N ATOM 1348 CA THR A 90 9.364 -7.412 3.940 1.00 0.00 C ATOM 1349 C THR A 90 10.509 -7.153 2.966 1.00 0.00 C ATOM 1350 O THR A 90 10.578 -6.060 2.421 1.00 0.00 O ATOM 1351 CB THR A 90 8.832 -8.851 3.940 1.00 0.00 C ATOM 1352 OG1 THR A 90 9.871 -9.770 4.218 1.00 0.00 O ATOM 1353 CG2 THR A 90 8.146 -9.251 2.628 1.00 0.00 C ATOM 0 H THR A 90 8.336 -6.130 2.667 1.00 0.00 H new ATOM 0 HA THR A 90 9.759 -7.255 4.944 1.00 0.00 H new ATOM 0 HB THR A 90 8.077 -8.884 4.725 1.00 0.00 H new ATOM 0 HG1 THR A 90 9.550 -10.445 4.851 1.00 0.00 H new ATOM 0 HG21 THR A 90 7.795 -10.280 2.700 1.00 0.00 H new ATOM 0 HG22 THR A 90 7.298 -8.591 2.445 1.00 0.00 H new ATOM 0 HG23 THR A 90 8.856 -9.167 1.806 1.00 0.00 H new ATOM 1361 N LYS A 91 11.414 -8.107 2.746 1.00 0.00 N ATOM 1362 CA LYS A 91 12.553 -7.937 1.844 1.00 0.00 C ATOM 1363 C LYS A 91 12.682 -9.086 0.840 1.00 0.00 C ATOM 1364 O LYS A 91 13.661 -9.146 0.100 1.00 0.00 O ATOM 1365 CB LYS A 91 13.844 -7.802 2.668 1.00 0.00 C ATOM 1366 CG LYS A 91 13.772 -6.652 3.682 1.00 0.00 C ATOM 1367 CD LYS A 91 15.137 -6.339 4.310 1.00 0.00 C ATOM 1368 CE LYS A 91 15.740 -7.511 5.094 1.00 0.00 C ATOM 1369 NZ LYS A 91 14.835 -7.991 6.154 1.00 0.00 N ATOM 0 H LYS A 91 11.377 -9.024 3.191 1.00 0.00 H new ATOM 0 HA LYS A 91 12.384 -7.029 1.265 1.00 0.00 H new ATOM 0 HB2 LYS A 91 14.035 -8.737 3.195 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.686 -7.638 1.995 1.00 0.00 H new ATOM 0 HG2 LYS A 91 13.389 -5.759 3.188 1.00 0.00 H new ATOM 0 HG3 LYS A 91 13.063 -6.909 4.469 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.831 -6.046 3.522 1.00 0.00 H new ATOM 0 HD3 LYS A 91 15.032 -5.483 4.977 1.00 0.00 H new ATOM 0 HE2 LYS A 91 15.962 -8.329 4.409 1.00 0.00 H new ATOM 0 HE3 LYS A 91 16.686 -7.201 5.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 15.320 -8.713 6.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 14.562 -7.194 6.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 13.984 -8.404 5.723 1.00 0.00 H new ATOM 1383 N LYS A 92 11.711 -10.002 0.801 1.00 0.00 N ATOM 1384 CA LYS A 92 11.699 -11.064 -0.195 1.00 0.00 C ATOM 1385 C LYS A 92 11.460 -10.444 -1.580 1.00 0.00 C ATOM 1386 O LYS A 92 10.962 -9.323 -1.675 1.00 0.00 O ATOM 1387 CB LYS A 92 10.625 -12.102 0.166 1.00 0.00 C ATOM 1388 CG LYS A 92 10.777 -12.639 1.596 1.00 0.00 C ATOM 1389 CD LYS A 92 9.661 -13.637 1.927 1.00 0.00 C ATOM 1390 CE LYS A 92 9.926 -15.023 1.331 1.00 0.00 C ATOM 1391 NZ LYS A 92 8.881 -15.975 1.740 1.00 0.00 N ATOM 0 H LYS A 92 10.925 -10.025 1.450 1.00 0.00 H new ATOM 0 HA LYS A 92 12.658 -11.582 -0.215 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.639 -11.652 0.054 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.678 -12.933 -0.537 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.747 -13.123 1.706 1.00 0.00 H new ATOM 0 HG3 LYS A 92 10.752 -11.811 2.304 1.00 0.00 H new ATOM 0 HD2 LYS A 92 9.562 -13.722 3.009 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.712 -13.256 1.549 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.958 -14.956 0.244 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.901 -15.384 1.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.194 -16.945 1.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 8.705 -15.880 2.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 8.005 -15.774 1.217 1.00 0.00 H new ATOM 1405 N GLY A 93 11.797 -11.163 -2.654 1.00 0.00 N ATOM 1406 CA GLY A 93 11.608 -10.701 -4.026 1.00 0.00 C ATOM 1407 C GLY A 93 10.407 -11.391 -4.681 1.00 0.00 C ATOM 1408 O GLY A 93 9.986 -12.448 -4.212 1.00 0.00 O ATOM 0 H GLY A 93 12.213 -12.092 -2.591 1.00 0.00 H new ATOM 0 HA2 GLY A 93 11.459 -9.621 -4.032 1.00 0.00 H new ATOM 0 HA3 GLY A 93 12.508 -10.901 -4.608 1.00 0.00 H new ATOM 1412 N PRO A 94 9.846 -10.816 -5.757 1.00 0.00 N ATOM 1413 CA PRO A 94 8.778 -11.445 -6.520 1.00 0.00 C ATOM 1414 C PRO A 94 9.341 -12.612 -7.342 1.00 0.00 C ATOM 1415 O PRO A 94 10.540 -12.633 -7.623 1.00 0.00 O ATOM 1416 CB PRO A 94 8.247 -10.341 -7.443 1.00 0.00 C ATOM 1417 CG PRO A 94 9.478 -9.465 -7.679 1.00 0.00 C ATOM 1418 CD PRO A 94 10.230 -9.545 -6.350 1.00 0.00 C ATOM 0 HA PRO A 94 7.993 -11.852 -5.882 1.00 0.00 H new ATOM 0 HB2 PRO A 94 7.857 -10.748 -8.376 1.00 0.00 H new ATOM 0 HB3 PRO A 94 7.437 -9.781 -6.977 1.00 0.00 H new ATOM 0 HG2 PRO A 94 10.083 -9.837 -8.506 1.00 0.00 H new ATOM 0 HG3 PRO A 94 9.201 -8.439 -7.923 1.00 0.00 H new ATOM 0 HD2 PRO A 94 11.308 -9.495 -6.506 1.00 0.00 H new ATOM 0 HD3 PRO A 94 9.964 -8.713 -5.699 1.00 0.00 H new ATOM 1426 N PRO A 95 8.505 -13.568 -7.779 1.00 0.00 N ATOM 1427 CA PRO A 95 7.087 -13.697 -7.469 1.00 0.00 C ATOM 1428 C PRO A 95 6.942 -14.307 -6.071 1.00 0.00 C ATOM 1429 O PRO A 95 7.583 -15.307 -5.759 1.00 0.00 O ATOM 1430 CB PRO A 95 6.545 -14.635 -8.551 1.00 0.00 C ATOM 1431 CG PRO A 95 7.729 -15.551 -8.862 1.00 0.00 C ATOM 1432 CD PRO A 95 8.935 -14.629 -8.675 1.00 0.00 C ATOM 0 HA PRO A 95 6.548 -12.750 -7.462 1.00 0.00 H new ATOM 0 HB2 PRO A 95 5.684 -15.201 -8.196 1.00 0.00 H new ATOM 0 HB3 PRO A 95 6.222 -14.084 -9.434 1.00 0.00 H new ATOM 0 HG2 PRO A 95 7.766 -16.406 -8.187 1.00 0.00 H new ATOM 0 HG3 PRO A 95 7.677 -15.947 -9.876 1.00 0.00 H new ATOM 0 HD2 PRO A 95 9.779 -15.175 -8.254 1.00 0.00 H new ATOM 0 HD3 PRO A 95 9.264 -14.221 -9.631 1.00 0.00 H new ATOM 1440 N TYR A 96 6.062 -13.764 -5.227 1.00 0.00 N ATOM 1441 CA TYR A 96 5.952 -14.186 -3.825 1.00 0.00 C ATOM 1442 C TYR A 96 5.085 -15.438 -3.632 1.00 0.00 C ATOM 1443 O TYR A 96 4.450 -15.615 -2.595 1.00 0.00 O ATOM 1444 CB TYR A 96 5.399 -13.016 -3.037 1.00 0.00 C ATOM 1445 CG TYR A 96 6.274 -11.776 -3.065 1.00 0.00 C ATOM 1446 CD1 TYR A 96 7.256 -11.601 -2.075 1.00 0.00 C ATOM 1447 CD2 TYR A 96 6.107 -10.787 -4.057 1.00 0.00 C ATOM 1448 CE1 TYR A 96 8.063 -10.452 -2.087 1.00 0.00 C ATOM 1449 CE2 TYR A 96 6.978 -9.689 -4.116 1.00 0.00 C ATOM 1450 CZ TYR A 96 7.987 -9.551 -3.158 1.00 0.00 C ATOM 1451 OH TYR A 96 8.923 -8.580 -3.316 1.00 0.00 O ATOM 0 H TYR A 96 5.410 -13.025 -5.491 1.00 0.00 H new ATOM 0 HA TYR A 96 6.942 -14.469 -3.467 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.415 -12.761 -3.430 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.259 -13.324 -2.001 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.390 -12.348 -1.307 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.305 -10.876 -4.775 1.00 0.00 H new ATOM 0 HE1 TYR A 96 8.743 -10.262 -1.270 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.870 -8.953 -4.899 1.00 0.00 H new ATOM 0 HH TYR A 96 9.732 -8.822 -2.819 1.00 0.00 H new ATOM 1461 N ALA A 97 5.100 -16.307 -4.640 1.00 0.00 N ATOM 1462 CA ALA A 97 4.430 -17.598 -4.713 1.00 0.00 C ATOM 1463 C ALA A 97 2.909 -17.479 -4.821 1.00 0.00 C ATOM 1464 O ALA A 97 2.305 -16.473 -4.455 1.00 0.00 O ATOM 1465 CB ALA A 97 4.848 -18.512 -3.556 1.00 0.00 C ATOM 0 H ALA A 97 5.623 -16.108 -5.493 1.00 0.00 H new ATOM 0 HA ALA A 97 4.761 -18.063 -5.642 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.329 -19.467 -3.641 1.00 0.00 H new ATOM 0 HB2 ALA A 97 5.924 -18.679 -3.595 1.00 0.00 H new ATOM 0 HB3 ALA A 97 4.588 -18.041 -2.608 1.00 0.00 H new ATOM 1471 N VAL A 98 2.289 -18.524 -5.378 1.00 0.00 N ATOM 1472 CA VAL A 98 0.847 -18.596 -5.561 1.00 0.00 C ATOM 1473 C VAL A 98 0.166 -18.675 -4.196 1.00 0.00 C ATOM 1474 O VAL A 98 -0.802 -17.961 -3.951 1.00 0.00 O ATOM 1475 CB VAL A 98 0.491 -19.777 -6.477 1.00 0.00 C ATOM 1476 CG1 VAL A 98 -1.028 -19.927 -6.635 1.00 0.00 C ATOM 1477 CG2 VAL A 98 1.116 -19.590 -7.866 1.00 0.00 C ATOM 0 H VAL A 98 2.785 -19.349 -5.716 1.00 0.00 H new ATOM 0 HA VAL A 98 0.481 -17.696 -6.055 1.00 0.00 H new ATOM 0 HB VAL A 98 0.889 -20.677 -6.009 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -1.244 -20.772 -7.289 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -1.480 -20.099 -5.658 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.440 -19.017 -7.070 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.853 -20.436 -8.500 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.740 -18.670 -8.314 1.00 0.00 H new ATOM 0 HG23 VAL A 98 2.200 -19.530 -7.772 1.00 0.00 H new ATOM 1487 N MET A 99 0.671 -19.534 -3.306 1.00 0.00 N ATOM 1488 CA MET A 99 0.174 -19.590 -1.939 1.00 0.00 C ATOM 1489 C MET A 99 0.802 -18.424 -1.161 1.00 0.00 C ATOM 1490 O MET A 99 1.824 -17.904 -1.610 1.00 0.00 O ATOM 1491 CB MET A 99 0.539 -20.941 -1.306 1.00 0.00 C ATOM 1492 CG MET A 99 -0.105 -22.126 -2.037 1.00 0.00 C ATOM 1493 SD MET A 99 -1.917 -22.136 -2.054 1.00 0.00 S ATOM 1494 CE MET A 99 -2.212 -23.668 -2.962 1.00 0.00 C ATOM 0 H MET A 99 1.420 -20.195 -3.511 1.00 0.00 H new ATOM 0 HA MET A 99 -0.912 -19.500 -1.916 1.00 0.00 H new ATOM 0 HB2 MET A 99 1.622 -21.060 -1.312 1.00 0.00 H new ATOM 0 HB3 MET A 99 0.223 -20.947 -0.263 1.00 0.00 H new ATOM 0 HG2 MET A 99 0.251 -22.133 -3.067 1.00 0.00 H new ATOM 0 HG3 MET A 99 0.242 -23.049 -1.573 1.00 0.00 H new ATOM 0 HE1 MET A 99 -3.285 -23.830 -3.064 1.00 0.00 H new ATOM 0 HE2 MET A 99 -1.760 -23.597 -3.951 1.00 0.00 H new ATOM 0 HE3 MET A 99 -1.769 -24.503 -2.420 1.00 0.00 H new ATOM 1504 N PRO A 100 0.236 -17.991 -0.018 1.00 0.00 N ATOM 1505 CA PRO A 100 0.710 -16.817 0.712 1.00 0.00 C ATOM 1506 C PRO A 100 2.074 -17.010 1.397 1.00 0.00 C ATOM 1507 O PRO A 100 2.190 -16.822 2.607 1.00 0.00 O ATOM 1508 CB PRO A 100 -0.393 -16.500 1.739 1.00 0.00 C ATOM 1509 CG PRO A 100 -1.635 -17.163 1.156 1.00 0.00 C ATOM 1510 CD PRO A 100 -1.039 -18.424 0.536 1.00 0.00 C ATOM 0 HA PRO A 100 0.885 -15.996 0.016 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -0.150 -16.901 2.723 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -0.532 -15.425 1.858 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.376 -17.392 1.922 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -2.127 -16.534 0.414 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -0.902 -19.207 1.282 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -1.690 -18.832 -0.238 1.00 0.00 H new ATOM 1518 N VAL A 101 3.142 -17.325 0.660 1.00 0.00 N ATOM 1519 CA VAL A 101 4.474 -17.487 1.232 1.00 0.00 C ATOM 1520 C VAL A 101 5.117 -16.100 1.381 1.00 0.00 C ATOM 1521 O VAL A 101 6.201 -15.835 0.867 1.00 0.00 O ATOM 1522 CB VAL A 101 5.311 -18.477 0.394 1.00 0.00 C ATOM 1523 CG1 VAL A 101 6.555 -18.935 1.172 1.00 0.00 C ATOM 1524 CG2 VAL A 101 4.511 -19.742 0.042 1.00 0.00 C ATOM 0 H VAL A 101 3.104 -17.474 -0.348 1.00 0.00 H new ATOM 0 HA VAL A 101 4.417 -17.929 2.227 1.00 0.00 H new ATOM 0 HB VAL A 101 5.592 -17.945 -0.515 1.00 0.00 H new ATOM 0 HG11 VAL A 101 7.129 -19.632 0.562 1.00 0.00 H new ATOM 0 HG12 VAL A 101 7.172 -18.070 1.413 1.00 0.00 H new ATOM 0 HG13 VAL A 101 6.246 -19.429 2.094 1.00 0.00 H new ATOM 0 HG21 VAL A 101 5.134 -20.414 -0.548 1.00 0.00 H new ATOM 0 HG22 VAL A 101 4.203 -20.244 0.959 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.628 -19.466 -0.535 1.00 0.00 H new ATOM 1534 N ILE A 102 4.430 -15.200 2.093 1.00 0.00 N ATOM 1535 CA ILE A 102 4.893 -13.836 2.310 1.00 0.00 C ATOM 1536 C ILE A 102 5.923 -13.780 3.439 1.00 0.00 C ATOM 1537 O ILE A 102 6.874 -13.005 3.389 1.00 0.00 O ATOM 1538 CB ILE A 102 3.720 -12.865 2.553 1.00 0.00 C ATOM 1539 CG1 ILE A 102 3.031 -12.901 3.932 1.00 0.00 C ATOM 1540 CG2 ILE A 102 2.691 -12.901 1.414 1.00 0.00 C ATOM 1541 CD1 ILE A 102 2.138 -14.112 4.208 1.00 0.00 C ATOM 0 H ILE A 102 3.533 -15.404 2.535 1.00 0.00 H new ATOM 0 HA ILE A 102 5.388 -13.506 1.397 1.00 0.00 H new ATOM 0 HB ILE A 102 4.228 -11.901 2.560 1.00 0.00 H new ATOM 0 HG12 ILE A 102 3.802 -12.861 4.702 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.428 -11.999 4.038 1.00 0.00 H new ATOM 0 HG21 ILE A 102 1.884 -12.201 1.630 1.00 0.00 H new ATOM 0 HG22 ILE A 102 3.174 -12.620 0.478 1.00 0.00 H new ATOM 0 HG23 ILE A 102 2.283 -13.908 1.324 1.00 0.00 H new ATOM 0 HD11 ILE A 102 1.709 -14.027 5.206 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.337 -14.149 3.470 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.732 -15.024 4.144 1.00 0.00 H new ATOM 1553 N ASP A 103 5.688 -14.579 4.482 1.00 0.00 N ATOM 1554 CA ASP A 103 6.484 -14.596 5.704 1.00 0.00 C ATOM 1555 C ASP A 103 7.971 -14.840 5.413 1.00 0.00 C ATOM 1556 O ASP A 103 8.288 -15.602 4.501 1.00 0.00 O ATOM 1557 CB ASP A 103 5.957 -15.671 6.665 1.00 0.00 C ATOM 1558 CG ASP A 103 4.626 -15.273 7.278 1.00 0.00 C ATOM 1559 OD1 ASP A 103 4.608 -14.564 8.277 1.00 0.00 O ATOM 1560 OD2 ASP A 103 3.521 -15.738 6.644 1.00 0.00 O ATOM 0 H ASP A 103 4.918 -15.248 4.497 1.00 0.00 H new ATOM 0 HA ASP A 103 6.392 -13.614 6.169 1.00 0.00 H new ATOM 0 HB2 ASP A 103 5.844 -16.614 6.130 1.00 0.00 H new ATOM 0 HB3 ASP A 103 6.686 -15.840 7.457 1.00 0.00 H new ATOM 1566 N PRO A 104 8.891 -14.267 6.210 1.00 0.00 N ATOM 1567 CA PRO A 104 8.633 -13.394 7.350 1.00 0.00 C ATOM 1568 C PRO A 104 8.188 -12.002 6.890 1.00 0.00 C ATOM 1569 O PRO A 104 8.575 -11.552 5.815 1.00 0.00 O ATOM 1570 CB PRO A 104 9.963 -13.322 8.106 1.00 0.00 C ATOM 1571 CG PRO A 104 11.000 -13.504 6.997 1.00 0.00 C ATOM 1572 CD PRO A 104 10.317 -14.500 6.061 1.00 0.00 C ATOM 0 HA PRO A 104 7.827 -13.775 7.978 1.00 0.00 H new ATOM 0 HB2 PRO A 104 10.084 -12.368 8.619 1.00 0.00 H new ATOM 0 HB3 PRO A 104 10.040 -14.103 8.862 1.00 0.00 H new ATOM 0 HG2 PRO A 104 11.224 -12.563 6.494 1.00 0.00 H new ATOM 0 HG3 PRO A 104 11.943 -13.892 7.383 1.00 0.00 H new ATOM 0 HD2 PRO A 104 10.633 -14.347 5.029 1.00 0.00 H new ATOM 0 HD3 PRO A 104 10.576 -15.526 6.325 1.00 0.00 H new ATOM 1580 N ILE A 105 7.371 -11.332 7.707 1.00 0.00 N ATOM 1581 CA ILE A 105 6.921 -9.965 7.482 1.00 0.00 C ATOM 1582 C ILE A 105 7.594 -9.062 8.508 1.00 0.00 C ATOM 1583 O ILE A 105 7.805 -9.480 9.644 1.00 0.00 O ATOM 1584 CB ILE A 105 5.384 -9.894 7.551 1.00 0.00 C ATOM 1585 CG1 ILE A 105 4.733 -10.621 6.361 1.00 0.00 C ATOM 1586 CG2 ILE A 105 4.851 -8.455 7.630 1.00 0.00 C ATOM 1587 CD1 ILE A 105 5.261 -10.173 4.991 1.00 0.00 C ATOM 0 H ILE A 105 6.997 -11.740 8.564 1.00 0.00 H new ATOM 0 HA ILE A 105 7.203 -9.623 6.486 1.00 0.00 H new ATOM 0 HB ILE A 105 5.109 -10.399 8.477 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.897 -11.693 6.469 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.656 -10.459 6.395 1.00 0.00 H new ATOM 0 HG21 ILE A 105 3.762 -8.472 7.676 1.00 0.00 H new ATOM 0 HG22 ILE A 105 5.244 -7.970 8.523 1.00 0.00 H new ATOM 0 HG23 ILE A 105 5.168 -7.901 6.747 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.753 -10.732 4.205 1.00 0.00 H new ATOM 0 HD12 ILE A 105 5.072 -9.108 4.859 1.00 0.00 H new ATOM 0 HD13 ILE A 105 6.333 -10.361 4.935 1.00 0.00 H new ATOM 1599 N VAL A 106 7.944 -7.839 8.095 1.00 0.00 N ATOM 1600 CA VAL A 106 8.479 -6.828 8.989 1.00 0.00 C ATOM 1601 C VAL A 106 7.271 -6.027 9.483 1.00 0.00 C ATOM 1602 O VAL A 106 6.693 -6.354 10.515 1.00 0.00 O ATOM 1603 CB VAL A 106 9.555 -5.993 8.260 1.00 0.00 C ATOM 1604 CG1 VAL A 106 10.113 -4.873 9.151 1.00 0.00 C ATOM 1605 CG2 VAL A 106 10.726 -6.892 7.836 1.00 0.00 C ATOM 0 H VAL A 106 7.861 -7.530 7.127 1.00 0.00 H new ATOM 0 HA VAL A 106 8.999 -7.242 9.853 1.00 0.00 H new ATOM 0 HB VAL A 106 9.073 -5.548 7.389 1.00 0.00 H new ATOM 0 HG11 VAL A 106 10.866 -4.311 8.599 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.304 -4.204 9.445 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.565 -5.308 10.042 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.478 -6.292 7.323 1.00 0.00 H new ATOM 0 HG22 VAL A 106 11.169 -7.353 8.719 1.00 0.00 H new ATOM 0 HG23 VAL A 106 10.363 -7.670 7.165 1.00 0.00 H new ATOM 1615 N ALA A 107 6.905 -4.970 8.759 1.00 0.00 N ATOM 1616 CA ALA A 107 5.694 -4.197 9.015 1.00 0.00 C ATOM 1617 C ALA A 107 4.588 -4.734 8.117 1.00 0.00 C ATOM 1618 O ALA A 107 4.893 -5.292 7.068 1.00 0.00 O ATOM 1619 CB ALA A 107 5.966 -2.709 8.776 1.00 0.00 C ATOM 0 H ALA A 107 7.449 -4.624 7.969 1.00 0.00 H new ATOM 0 HA ALA A 107 5.377 -4.298 10.053 1.00 0.00 H new ATOM 0 HB1 ALA A 107 5.058 -2.138 8.969 1.00 0.00 H new ATOM 0 HB2 ALA A 107 6.756 -2.371 9.446 1.00 0.00 H new ATOM 0 HB3 ALA A 107 6.277 -2.557 7.742 1.00 0.00 H new ATOM 1625 N GLY A 108 3.312 -4.553 8.457 1.00 0.00 N ATOM 1626 CA GLY A 108 2.272 -4.964 7.534 1.00 0.00 C ATOM 1627 C GLY A 108 0.879 -4.799 8.107 1.00 0.00 C ATOM 1628 O GLY A 108 0.731 -4.476 9.282 1.00 0.00 O ATOM 0 H GLY A 108 2.988 -4.140 9.332 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.354 -4.380 6.618 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.426 -6.008 7.261 1.00 0.00 H new ATOM 1632 N THR A 109 -0.130 -5.030 7.267 1.00 0.00 N ATOM 1633 CA THR A 109 -1.539 -4.994 7.615 1.00 0.00 C ATOM 1634 C THR A 109 -2.183 -6.327 7.274 1.00 0.00 C ATOM 1635 O THR A 109 -1.902 -6.907 6.223 1.00 0.00 O ATOM 1636 CB THR A 109 -2.227 -3.885 6.809 1.00 0.00 C ATOM 1637 OG1 THR A 109 -1.820 -3.925 5.455 1.00 0.00 O ATOM 1638 CG2 THR A 109 -1.868 -2.524 7.389 1.00 0.00 C ATOM 0 H THR A 109 0.026 -5.256 6.285 1.00 0.00 H new ATOM 0 HA THR A 109 -1.645 -4.801 8.682 1.00 0.00 H new ATOM 0 HB THR A 109 -3.304 -4.043 6.865 1.00 0.00 H new ATOM 0 HG1 THR A 109 -0.844 -3.995 5.409 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.360 -1.741 6.812 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.198 -2.472 8.426 1.00 0.00 H new ATOM 0 HG23 THR A 109 -0.788 -2.383 7.345 1.00 0.00 H new ATOM 1646 N GLY A 110 -3.026 -6.826 8.177 1.00 0.00 N ATOM 1647 CA GLY A 110 -3.853 -7.979 7.894 1.00 0.00 C ATOM 1648 C GLY A 110 -4.963 -7.545 6.918 1.00 0.00 C ATOM 1649 O GLY A 110 -4.866 -6.487 6.294 1.00 0.00 O ATOM 0 H GLY A 110 -3.148 -6.441 9.114 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.254 -8.779 7.458 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -4.287 -8.371 8.814 1.00 0.00 H new ATOM 1653 N PHE A 111 -6.023 -8.338 6.757 1.00 0.00 N ATOM 1654 CA PHE A 111 -7.046 -8.043 5.754 1.00 0.00 C ATOM 1655 C PHE A 111 -7.845 -6.774 6.092 1.00 0.00 C ATOM 1656 O PHE A 111 -8.502 -6.711 7.131 1.00 0.00 O ATOM 1657 CB PHE A 111 -7.944 -9.265 5.541 1.00 0.00 C ATOM 1658 CG PHE A 111 -7.167 -10.552 5.318 1.00 0.00 C ATOM 1659 CD1 PHE A 111 -6.373 -10.701 4.164 1.00 0.00 C ATOM 1660 CD2 PHE A 111 -7.138 -11.550 6.312 1.00 0.00 C ATOM 1661 CE1 PHE A 111 -5.571 -11.842 3.997 1.00 0.00 C ATOM 1662 CE2 PHE A 111 -6.322 -12.683 6.152 1.00 0.00 C ATOM 1663 CZ PHE A 111 -5.535 -12.827 4.996 1.00 0.00 C ATOM 0 H PHE A 111 -6.195 -9.182 7.303 1.00 0.00 H new ATOM 0 HA PHE A 111 -6.545 -7.829 4.810 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -8.592 -9.386 6.409 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -8.591 -9.086 4.682 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -6.381 -9.934 3.404 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -7.744 -11.444 7.199 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -4.982 -11.961 3.100 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -6.299 -13.444 6.918 1.00 0.00 H new ATOM 0 HZ PHE A 111 -4.903 -13.695 4.877 1.00 0.00 H new ATOM 1673 N SER A 112 -7.777 -5.769 5.213 1.00 0.00 N ATOM 1674 CA SER A 112 -8.343 -4.434 5.384 1.00 0.00 C ATOM 1675 C SER A 112 -9.880 -4.412 5.342 1.00 0.00 C ATOM 1676 O SER A 112 -10.494 -5.349 4.830 1.00 0.00 O ATOM 1677 CB SER A 112 -7.748 -3.553 4.274 1.00 0.00 C ATOM 1678 OG SER A 112 -7.696 -4.274 3.058 1.00 0.00 O ATOM 0 H SER A 112 -7.300 -5.874 4.318 1.00 0.00 H new ATOM 0 HA SER A 112 -8.086 -4.060 6.375 1.00 0.00 H new ATOM 0 HB2 SER A 112 -8.353 -2.655 4.148 1.00 0.00 H new ATOM 0 HB3 SER A 112 -6.747 -3.226 4.555 1.00 0.00 H new ATOM 0 HG SER A 112 -6.789 -4.618 2.920 1.00 0.00 H new ATOM 1684 N PRO A 113 -10.518 -3.345 5.862 1.00 0.00 N ATOM 1685 CA PRO A 113 -11.960 -3.158 5.767 1.00 0.00 C ATOM 1686 C PRO A 113 -12.289 -2.744 4.330 1.00 0.00 C ATOM 1687 O PRO A 113 -11.505 -2.023 3.720 1.00 0.00 O ATOM 1688 CB PRO A 113 -12.281 -2.033 6.756 1.00 0.00 C ATOM 1689 CG PRO A 113 -11.025 -1.163 6.698 1.00 0.00 C ATOM 1690 CD PRO A 113 -9.906 -2.189 6.507 1.00 0.00 C ATOM 0 HA PRO A 113 -12.537 -4.053 6.000 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -13.172 -1.478 6.462 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -12.462 -2.416 7.760 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -11.065 -0.451 5.874 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -10.891 -0.585 7.613 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -9.104 -1.780 5.893 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -9.465 -2.466 7.464 1.00 0.00 H new ATOM 1698 N VAL A 114 -13.435 -3.176 3.788 1.00 0.00 N ATOM 1699 CA VAL A 114 -13.772 -2.954 2.381 1.00 0.00 C ATOM 1700 C VAL A 114 -15.280 -2.770 2.151 1.00 0.00 C ATOM 1701 O VAL A 114 -15.956 -3.711 1.725 1.00 0.00 O ATOM 1702 CB VAL A 114 -13.213 -4.107 1.525 1.00 0.00 C ATOM 1703 CG1 VAL A 114 -11.780 -3.840 1.077 1.00 0.00 C ATOM 1704 CG2 VAL A 114 -13.261 -5.459 2.248 1.00 0.00 C ATOM 0 H VAL A 114 -14.148 -3.685 4.310 1.00 0.00 H new ATOM 0 HA VAL A 114 -13.306 -2.018 2.074 1.00 0.00 H new ATOM 0 HB VAL A 114 -13.863 -4.157 0.652 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -11.425 -4.677 0.476 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -11.749 -2.927 0.482 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -11.141 -3.724 1.952 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -12.855 -6.234 1.598 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -12.669 -5.404 3.161 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -14.294 -5.701 2.499 1.00 0.00 H new ATOM 1714 N PRO A 115 -15.812 -1.561 2.411 1.00 0.00 N ATOM 1715 CA PRO A 115 -17.182 -1.176 2.102 1.00 0.00 C ATOM 1716 C PRO A 115 -17.541 -1.409 0.632 1.00 0.00 C ATOM 1717 O PRO A 115 -16.655 -1.575 -0.208 1.00 0.00 O ATOM 1718 CB PRO A 115 -17.267 0.317 2.426 1.00 0.00 C ATOM 1719 CG PRO A 115 -16.233 0.487 3.534 1.00 0.00 C ATOM 1720 CD PRO A 115 -15.131 -0.476 3.096 1.00 0.00 C ATOM 0 HA PRO A 115 -17.883 -1.778 2.680 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -17.033 0.932 1.557 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -18.265 0.602 2.758 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -15.873 1.514 3.602 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -16.637 0.226 4.512 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -14.418 0.018 2.436 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -14.569 -0.845 3.954 1.00 0.00 H new ATOM 1728 N LYS A 116 -18.844 -1.389 0.320 1.00 0.00 N ATOM 1729 CA LYS A 116 -19.348 -1.715 -1.012 1.00 0.00 C ATOM 1730 C LYS A 116 -20.110 -0.582 -1.699 1.00 0.00 C ATOM 1731 O LYS A 116 -20.540 -0.738 -2.839 1.00 0.00 O ATOM 1732 CB LYS A 116 -20.166 -3.012 -0.950 1.00 0.00 C ATOM 1733 CG LYS A 116 -19.350 -4.142 -0.307 1.00 0.00 C ATOM 1734 CD LYS A 116 -20.007 -5.505 -0.553 1.00 0.00 C ATOM 1735 CE LYS A 116 -19.136 -6.620 0.037 1.00 0.00 C ATOM 1736 NZ LYS A 116 -19.716 -7.949 -0.222 1.00 0.00 N ATOM 0 H LYS A 116 -19.575 -1.145 0.988 1.00 0.00 H new ATOM 0 HA LYS A 116 -18.477 -1.866 -1.650 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -21.078 -2.845 -0.377 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -20.470 -3.304 -1.955 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -18.339 -4.143 -0.715 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -19.261 -3.966 0.765 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -20.998 -5.528 -0.099 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -20.142 -5.665 -1.623 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -18.136 -6.568 -0.392 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -19.030 -6.471 1.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -19.103 -8.681 0.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -20.661 -8.005 0.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -19.794 -8.100 -1.248 1.00 0.00 H new ATOM 1750 N ASP A 117 -20.239 0.564 -1.034 1.00 0.00 N ATOM 1751 CA ASP A 117 -20.861 1.776 -1.559 1.00 0.00 C ATOM 1752 C ASP A 117 -20.706 2.900 -0.534 1.00 0.00 C ATOM 1753 O ASP A 117 -20.717 2.625 0.663 1.00 0.00 O ATOM 1754 CB ASP A 117 -22.351 1.548 -1.861 1.00 0.00 C ATOM 1755 CG ASP A 117 -23.049 2.822 -2.318 1.00 0.00 C ATOM 1756 OD1 ASP A 117 -24.188 3.057 -1.937 1.00 0.00 O ATOM 1757 OD2 ASP A 117 -22.332 3.646 -3.129 1.00 0.00 O ATOM 0 H ASP A 117 -19.900 0.677 -0.079 1.00 0.00 H new ATOM 0 HA ASP A 117 -20.367 2.048 -2.492 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -22.450 0.785 -2.633 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -22.846 1.165 -0.969 1.00 0.00 H new ATOM 1763 N GLY A 118 -20.588 4.145 -1.011 1.00 0.00 N ATOM 1764 CA GLY A 118 -20.489 5.373 -0.225 1.00 0.00 C ATOM 1765 C GLY A 118 -19.206 5.467 0.597 1.00 0.00 C ATOM 1766 O GLY A 118 -18.411 6.387 0.402 1.00 0.00 O ATOM 0 H GLY A 118 -20.558 4.329 -2.014 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -20.545 6.230 -0.896 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -21.346 5.436 0.445 1.00 0.00 H new ATOM 1770 N LYS A 119 -19.028 4.540 1.540 1.00 0.00 N ATOM 1771 CA LYS A 119 -17.892 4.531 2.433 1.00 0.00 C ATOM 1772 C LYS A 119 -16.668 3.966 1.716 1.00 0.00 C ATOM 1773 O LYS A 119 -16.782 3.254 0.720 1.00 0.00 O ATOM 1774 CB LYS A 119 -18.206 3.740 3.708 1.00 0.00 C ATOM 1775 CG LYS A 119 -19.300 4.403 4.550 1.00 0.00 C ATOM 1776 CD LYS A 119 -19.513 3.600 5.840 1.00 0.00 C ATOM 1777 CE LYS A 119 -20.503 4.288 6.788 1.00 0.00 C ATOM 1778 NZ LYS A 119 -21.850 4.395 6.200 1.00 0.00 N ATOM 0 H LYS A 119 -19.680 3.772 1.698 1.00 0.00 H new ATOM 0 HA LYS A 119 -17.671 5.556 2.731 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -18.519 2.731 3.439 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -17.299 3.644 4.305 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -19.017 5.428 4.790 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -20.230 4.453 3.983 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -19.881 2.605 5.591 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -18.557 3.468 6.347 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -20.559 3.728 7.722 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -20.135 5.284 7.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -22.499 4.820 6.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -21.811 4.993 5.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -22.192 3.448 5.941 1.00 0.00 H new ATOM 1792 N PHE A 120 -15.498 4.329 2.236 1.00 0.00 N ATOM 1793 CA PHE A 120 -14.179 4.042 1.704 1.00 0.00 C ATOM 1794 C PHE A 120 -13.343 3.458 2.821 1.00 0.00 C ATOM 1795 O PHE A 120 -12.993 4.178 3.753 1.00 0.00 O ATOM 1796 CB PHE A 120 -13.569 5.336 1.161 1.00 0.00 C ATOM 1797 CG PHE A 120 -13.911 5.493 -0.310 1.00 0.00 C ATOM 1798 CD1 PHE A 120 -15.213 5.864 -0.689 1.00 0.00 C ATOM 1799 CD2 PHE A 120 -13.070 4.912 -1.276 1.00 0.00 C ATOM 1800 CE1 PHE A 120 -15.595 5.849 -2.041 1.00 0.00 C ATOM 1801 CE2 PHE A 120 -13.429 4.929 -2.634 1.00 0.00 C ATOM 1802 CZ PHE A 120 -14.677 5.442 -3.023 1.00 0.00 C ATOM 0 H PHE A 120 -15.449 4.869 3.100 1.00 0.00 H new ATOM 0 HA PHE A 120 -14.225 3.324 0.885 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -13.946 6.190 1.724 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -12.487 5.321 1.292 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -15.926 6.163 0.065 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -12.142 4.450 -0.972 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -16.593 6.150 -2.325 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -12.746 4.548 -3.378 1.00 0.00 H new ATOM 0 HZ PHE A 120 -14.929 5.523 -4.070 1.00 0.00 H new ATOM 1812 N GLY A 121 -13.062 2.161 2.733 1.00 0.00 N ATOM 1813 CA GLY A 121 -12.273 1.440 3.706 1.00 0.00 C ATOM 1814 C GLY A 121 -10.842 1.937 3.631 1.00 0.00 C ATOM 1815 O GLY A 121 -10.244 1.915 2.553 1.00 0.00 O ATOM 0 H GLY A 121 -13.387 1.576 1.963 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -12.675 1.593 4.708 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -12.313 0.369 3.507 1.00 0.00 H new ATOM 1819 N TYR A 122 -10.307 2.406 4.761 1.00 0.00 N ATOM 1820 CA TYR A 122 -8.933 2.841 4.852 1.00 0.00 C ATOM 1821 C TYR A 122 -8.251 2.216 6.055 1.00 0.00 C ATOM 1822 O TYR A 122 -8.865 1.575 6.911 1.00 0.00 O ATOM 1823 CB TYR A 122 -8.817 4.373 4.826 1.00 0.00 C ATOM 1824 CG TYR A 122 -9.136 5.119 6.107 1.00 0.00 C ATOM 1825 CD1 TYR A 122 -8.081 5.476 6.969 1.00 0.00 C ATOM 1826 CD2 TYR A 122 -10.411 5.676 6.303 1.00 0.00 C ATOM 1827 CE1 TYR A 122 -8.290 6.412 7.994 1.00 0.00 C ATOM 1828 CE2 TYR A 122 -10.637 6.551 7.382 1.00 0.00 C ATOM 1829 CZ TYR A 122 -9.571 6.944 8.205 1.00 0.00 C ATOM 1830 OH TYR A 122 -9.777 7.867 9.185 1.00 0.00 O ATOM 0 H TYR A 122 -10.826 2.490 5.635 1.00 0.00 H new ATOM 0 HA TYR A 122 -8.403 2.488 3.967 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -7.799 4.629 4.532 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -9.478 4.748 4.045 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -7.107 5.028 6.841 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -11.217 5.433 5.626 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -7.466 6.722 8.619 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -11.633 6.921 7.577 1.00 0.00 H new ATOM 0 HH TYR A 122 -10.721 8.130 9.193 1.00 0.00 H new ATOM 1840 N THR A 123 -6.935 2.365 6.088 1.00 0.00 N ATOM 1841 CA THR A 123 -6.109 1.823 7.141 1.00 0.00 C ATOM 1842 C THR A 123 -4.853 2.675 7.178 1.00 0.00 C ATOM 1843 O THR A 123 -4.202 2.830 6.148 1.00 0.00 O ATOM 1844 CB THR A 123 -5.830 0.345 6.837 1.00 0.00 C ATOM 1845 OG1 THR A 123 -6.968 -0.437 7.133 1.00 0.00 O ATOM 1846 CG2 THR A 123 -4.612 -0.209 7.574 1.00 0.00 C ATOM 0 H THR A 123 -6.411 2.872 5.374 1.00 0.00 H new ATOM 0 HA THR A 123 -6.584 1.852 8.122 1.00 0.00 H new ATOM 0 HB THR A 123 -5.602 0.289 5.773 1.00 0.00 H new ATOM 0 HG1 THR A 123 -6.719 -1.157 7.749 1.00 0.00 H new ATOM 0 HG21 THR A 123 -4.474 -1.258 7.312 1.00 0.00 H new ATOM 0 HG22 THR A 123 -3.725 0.356 7.287 1.00 0.00 H new ATOM 0 HG23 THR A 123 -4.766 -0.121 8.649 1.00 0.00 H new ATOM 1854 N ASP A 124 -4.546 3.236 8.349 1.00 0.00 N ATOM 1855 CA ASP A 124 -3.342 4.013 8.594 1.00 0.00 C ATOM 1856 C ASP A 124 -2.437 3.208 9.506 1.00 0.00 C ATOM 1857 O ASP A 124 -2.750 3.098 10.688 1.00 0.00 O ATOM 1858 CB ASP A 124 -3.680 5.361 9.246 1.00 0.00 C ATOM 1859 CG ASP A 124 -3.885 6.434 8.197 1.00 0.00 C ATOM 1860 OD1 ASP A 124 -4.989 6.593 7.688 1.00 0.00 O ATOM 1861 OD2 ASP A 124 -2.775 7.149 7.888 1.00 0.00 O ATOM 0 H ASP A 124 -5.146 3.157 9.170 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.843 4.220 7.647 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.582 5.261 9.850 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -2.875 5.655 9.920 1.00 0.00 H new ATOM 1867 N PHE A 125 -1.346 2.651 8.974 1.00 0.00 N ATOM 1868 CA PHE A 125 -0.340 1.992 9.797 1.00 0.00 C ATOM 1869 C PHE A 125 0.986 2.727 9.611 1.00 0.00 C ATOM 1870 O PHE A 125 1.227 3.317 8.556 1.00 0.00 O ATOM 1871 CB PHE A 125 -0.244 0.491 9.514 1.00 0.00 C ATOM 1872 CG PHE A 125 0.527 0.074 8.279 1.00 0.00 C ATOM 1873 CD1 PHE A 125 -0.113 0.039 7.028 1.00 0.00 C ATOM 1874 CD2 PHE A 125 1.831 -0.443 8.411 1.00 0.00 C ATOM 1875 CE1 PHE A 125 0.495 -0.623 5.946 1.00 0.00 C ATOM 1876 CE2 PHE A 125 2.462 -1.050 7.313 1.00 0.00 C ATOM 1877 CZ PHE A 125 1.783 -1.164 6.090 1.00 0.00 C ATOM 0 H PHE A 125 -1.141 2.646 7.975 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.630 2.049 10.846 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.215 0.012 10.378 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -1.257 0.096 9.431 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.071 0.520 6.898 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.346 -0.372 9.358 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -0.028 -0.715 5.006 1.00 0.00 H new ATOM 0 HE2 PHE A 125 3.469 -1.429 7.410 1.00 0.00 H new ATOM 0 HZ PHE A 125 2.252 -1.669 5.258 1.00 0.00 H new ATOM 1887 N THR A 126 1.826 2.707 10.645 1.00 0.00 N ATOM 1888 CA THR A 126 3.064 3.469 10.699 1.00 0.00 C ATOM 1889 C THR A 126 4.279 2.540 10.726 1.00 0.00 C ATOM 1890 O THR A 126 4.224 1.474 11.337 1.00 0.00 O ATOM 1891 CB THR A 126 3.027 4.378 11.934 1.00 0.00 C ATOM 1892 OG1 THR A 126 1.817 5.112 11.948 1.00 0.00 O ATOM 1893 CG2 THR A 126 4.192 5.368 11.936 1.00 0.00 C ATOM 0 H THR A 126 1.658 2.149 11.482 1.00 0.00 H new ATOM 0 HA THR A 126 3.156 4.083 9.803 1.00 0.00 H new ATOM 0 HB THR A 126 3.103 3.741 12.815 1.00 0.00 H new ATOM 0 HG1 THR A 126 1.897 5.887 11.353 1.00 0.00 H new ATOM 0 HG21 THR A 126 4.134 5.996 12.825 1.00 0.00 H new ATOM 0 HG22 THR A 126 5.135 4.821 11.939 1.00 0.00 H new ATOM 0 HG23 THR A 126 4.139 5.994 11.045 1.00 0.00 H new ATOM 1901 N TRP A 127 5.380 2.957 10.092 1.00 0.00 N ATOM 1902 CA TRP A 127 6.658 2.265 10.103 1.00 0.00 C ATOM 1903 C TRP A 127 7.789 3.295 10.089 1.00 0.00 C ATOM 1904 O TRP A 127 7.605 4.412 9.610 1.00 0.00 O ATOM 1905 CB TRP A 127 6.715 1.318 8.893 1.00 0.00 C ATOM 1906 CG TRP A 127 7.968 0.522 8.661 1.00 0.00 C ATOM 1907 CD1 TRP A 127 8.672 -0.137 9.604 1.00 0.00 C ATOM 1908 CD2 TRP A 127 8.633 0.218 7.398 1.00 0.00 C ATOM 1909 NE1 TRP A 127 9.711 -0.832 9.017 1.00 0.00 N ATOM 1910 CE2 TRP A 127 9.719 -0.672 7.645 1.00 0.00 C ATOM 1911 CE3 TRP A 127 8.427 0.605 6.061 1.00 0.00 C ATOM 1912 CZ2 TRP A 127 10.525 -1.173 6.609 1.00 0.00 C ATOM 1913 CZ3 TRP A 127 9.241 0.132 5.021 1.00 0.00 C ATOM 1914 CH2 TRP A 127 10.264 -0.788 5.284 1.00 0.00 C ATOM 0 H TRP A 127 5.399 3.815 9.541 1.00 0.00 H new ATOM 0 HA TRP A 127 6.774 1.666 11.006 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.888 0.614 8.984 1.00 0.00 H new ATOM 0 HB3 TRP A 127 6.530 1.913 7.998 1.00 0.00 H new ATOM 0 HD1 TRP A 127 8.455 -0.123 10.662 1.00 0.00 H new ATOM 0 HE1 TRP A 127 10.388 -1.394 9.533 1.00 0.00 H new ATOM 0 HE3 TRP A 127 7.620 1.285 5.829 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 11.338 -1.848 6.830 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 9.078 0.479 4.011 1.00 0.00 H new ATOM 0 HH2 TRP A 127 10.848 -1.198 4.473 1.00 0.00 H new ATOM 1925 N HIS A 128 8.950 2.919 10.633 1.00 0.00 N ATOM 1926 CA HIS A 128 10.178 3.702 10.622 1.00 0.00 C ATOM 1927 C HIS A 128 11.260 2.815 10.004 1.00 0.00 C ATOM 1928 O HIS A 128 11.841 1.997 10.716 1.00 0.00 O ATOM 1929 CB HIS A 128 10.541 4.121 12.051 1.00 0.00 C ATOM 1930 CG HIS A 128 9.566 5.119 12.617 1.00 0.00 C ATOM 1931 ND1 HIS A 128 8.460 4.834 13.397 1.00 0.00 N ATOM 1932 CD2 HIS A 128 9.550 6.454 12.328 1.00 0.00 C ATOM 1933 CE1 HIS A 128 7.786 5.985 13.581 1.00 0.00 C ATOM 1934 NE2 HIS A 128 8.431 6.980 12.940 1.00 0.00 N ATOM 0 H HIS A 128 9.059 2.024 11.111 1.00 0.00 H new ATOM 0 HA HIS A 128 10.068 4.618 10.041 1.00 0.00 H new ATOM 0 HB2 HIS A 128 10.567 3.239 12.691 1.00 0.00 H new ATOM 0 HB3 HIS A 128 11.543 4.550 12.058 1.00 0.00 H new ATOM 0 HD1 HIS A 128 8.202 3.919 13.766 1.00 0.00 H new ATOM 0 HD2 HIS A 128 10.274 6.994 11.735 1.00 0.00 H new ATOM 0 HE1 HIS A 128 6.875 6.094 14.151 1.00 0.00 H new ATOM 1943 N PRO A 129 11.501 2.909 8.690 1.00 0.00 N ATOM 1944 CA PRO A 129 12.408 2.017 8.001 1.00 0.00 C ATOM 1945 C PRO A 129 13.866 2.460 8.174 1.00 0.00 C ATOM 1946 O PRO A 129 14.155 3.661 8.196 1.00 0.00 O ATOM 1947 CB PRO A 129 12.014 2.129 6.538 1.00 0.00 C ATOM 1948 CG PRO A 129 11.552 3.572 6.405 1.00 0.00 C ATOM 1949 CD PRO A 129 10.870 3.819 7.751 1.00 0.00 C ATOM 0 HA PRO A 129 12.341 1.001 8.389 1.00 0.00 H new ATOM 0 HB2 PRO A 129 12.855 1.914 5.878 1.00 0.00 H new ATOM 0 HB3 PRO A 129 11.220 1.428 6.281 1.00 0.00 H new ATOM 0 HG2 PRO A 129 12.387 4.253 6.241 1.00 0.00 H new ATOM 0 HG3 PRO A 129 10.864 3.704 5.570 1.00 0.00 H new ATOM 0 HD2 PRO A 129 10.994 4.855 8.067 1.00 0.00 H new ATOM 0 HD3 PRO A 129 9.798 3.632 7.686 1.00 0.00 H new ATOM 1957 N THR A 130 14.793 1.502 8.243 1.00 0.00 N ATOM 1958 CA THR A 130 16.228 1.754 8.253 1.00 0.00 C ATOM 1959 C THR A 130 16.755 1.600 6.823 1.00 0.00 C ATOM 1960 O THR A 130 16.117 0.936 6.005 1.00 0.00 O ATOM 1961 CB THR A 130 16.892 0.772 9.224 1.00 0.00 C ATOM 1962 OG1 THR A 130 16.351 -0.516 9.015 1.00 0.00 O ATOM 1963 CG2 THR A 130 16.612 1.181 10.672 1.00 0.00 C ATOM 0 H THR A 130 14.558 0.511 8.294 1.00 0.00 H new ATOM 0 HA THR A 130 16.457 2.764 8.592 1.00 0.00 H new ATOM 0 HB THR A 130 17.968 0.776 9.047 1.00 0.00 H new ATOM 0 HG1 THR A 130 16.131 -0.628 8.067 1.00 0.00 H new ATOM 0 HG21 THR A 130 17.091 0.473 11.349 1.00 0.00 H new ATOM 0 HG22 THR A 130 17.009 2.180 10.851 1.00 0.00 H new ATOM 0 HG23 THR A 130 15.536 1.181 10.848 1.00 0.00 H new ATOM 1971 N ALA A 131 17.890 2.230 6.501 1.00 0.00 N ATOM 1972 CA ALA A 131 18.413 2.256 5.138 1.00 0.00 C ATOM 1973 C ALA A 131 18.616 0.854 4.547 1.00 0.00 C ATOM 1974 O ALA A 131 18.996 -0.075 5.256 1.00 0.00 O ATOM 1975 CB ALA A 131 19.698 3.086 5.066 1.00 0.00 C ATOM 0 H ALA A 131 18.466 2.732 7.176 1.00 0.00 H new ATOM 0 HA ALA A 131 17.656 2.737 4.519 1.00 0.00 H new ATOM 0 HB1 ALA A 131 20.070 3.092 4.042 1.00 0.00 H new ATOM 0 HB2 ALA A 131 19.489 4.108 5.382 1.00 0.00 H new ATOM 0 HB3 ALA A 131 20.450 2.650 5.723 1.00 0.00 H new ATOM 1981 N GLY A 132 18.372 0.723 3.239 1.00 0.00 N ATOM 1982 CA GLY A 132 18.536 -0.486 2.453 1.00 0.00 C ATOM 1983 C GLY A 132 17.387 -0.623 1.463 1.00 0.00 C ATOM 1984 O GLY A 132 17.073 0.331 0.747 1.00 0.00 O ATOM 0 H GLY A 132 18.037 1.506 2.677 1.00 0.00 H new ATOM 0 HA2 GLY A 132 19.486 -0.456 1.919 1.00 0.00 H new ATOM 0 HA3 GLY A 132 18.567 -1.355 3.110 1.00 0.00 H new ATOM 1988 N THR A 133 16.774 -1.804 1.374 1.00 0.00 N ATOM 1989 CA THR A 133 15.746 -2.087 0.384 1.00 0.00 C ATOM 1990 C THR A 133 14.781 -3.125 0.948 1.00 0.00 C ATOM 1991 O THR A 133 15.185 -3.988 1.727 1.00 0.00 O ATOM 1992 CB THR A 133 16.406 -2.538 -0.931 1.00 0.00 C ATOM 1993 OG1 THR A 133 17.363 -1.574 -1.332 1.00 0.00 O ATOM 1994 CG2 THR A 133 15.402 -2.709 -2.076 1.00 0.00 C ATOM 0 H THR A 133 16.980 -2.590 1.990 1.00 0.00 H new ATOM 0 HA THR A 133 15.168 -1.191 0.159 1.00 0.00 H new ATOM 0 HB THR A 133 16.865 -3.507 -0.733 1.00 0.00 H new ATOM 0 HG1 THR A 133 17.785 -1.861 -2.169 1.00 0.00 H new ATOM 0 HG21 THR A 133 15.928 -3.028 -2.976 1.00 0.00 H new ATOM 0 HG22 THR A 133 14.662 -3.461 -1.802 1.00 0.00 H new ATOM 0 HG23 THR A 133 14.901 -1.760 -2.266 1.00 0.00 H new ATOM 2002 N TYR A 134 13.504 -2.990 0.590 1.00 0.00 N ATOM 2003 CA TYR A 134 12.384 -3.781 1.059 1.00 0.00 C ATOM 2004 C TYR A 134 11.389 -3.887 -0.099 1.00 0.00 C ATOM 2005 O TYR A 134 11.591 -3.276 -1.149 1.00 0.00 O ATOM 2006 CB TYR A 134 11.742 -3.121 2.294 1.00 0.00 C ATOM 2007 CG TYR A 134 12.687 -2.772 3.422 1.00 0.00 C ATOM 2008 CD1 TYR A 134 13.436 -1.585 3.338 1.00 0.00 C ATOM 2009 CD2 TYR A 134 12.684 -3.513 4.617 1.00 0.00 C ATOM 2010 CE1 TYR A 134 14.216 -1.167 4.423 1.00 0.00 C ATOM 2011 CE2 TYR A 134 13.447 -3.077 5.715 1.00 0.00 C ATOM 2012 CZ TYR A 134 14.198 -1.895 5.622 1.00 0.00 C ATOM 2013 OH TYR A 134 14.834 -1.410 6.722 1.00 0.00 O ATOM 0 H TYR A 134 13.214 -2.277 -0.079 1.00 0.00 H new ATOM 0 HA TYR A 134 12.707 -4.776 1.365 1.00 0.00 H new ATOM 0 HB2 TYR A 134 11.237 -2.210 1.974 1.00 0.00 H new ATOM 0 HB3 TYR A 134 10.975 -3.791 2.682 1.00 0.00 H new ATOM 0 HD1 TYR A 134 13.410 -0.994 2.434 1.00 0.00 H new ATOM 0 HD2 TYR A 134 12.096 -4.416 4.692 1.00 0.00 H new ATOM 0 HE1 TYR A 134 14.832 -0.284 4.337 1.00 0.00 H new ATOM 0 HE2 TYR A 134 13.455 -3.652 6.629 1.00 0.00 H new ATOM 0 HH TYR A 134 15.220 -0.533 6.517 1.00 0.00 H new ATOM 2023 N TYR A 135 10.319 -4.653 0.091 1.00 0.00 N ATOM 2024 CA TYR A 135 9.260 -4.866 -0.872 1.00 0.00 C ATOM 2025 C TYR A 135 7.932 -4.939 -0.125 1.00 0.00 C ATOM 2026 O TYR A 135 7.933 -5.291 1.056 1.00 0.00 O ATOM 2027 CB TYR A 135 9.495 -6.161 -1.650 1.00 0.00 C ATOM 2028 CG TYR A 135 10.712 -6.166 -2.557 1.00 0.00 C ATOM 2029 CD1 TYR A 135 11.980 -6.482 -2.036 1.00 0.00 C ATOM 2030 CD2 TYR A 135 10.559 -5.985 -3.944 1.00 0.00 C ATOM 2031 CE1 TYR A 135 13.088 -6.608 -2.890 1.00 0.00 C ATOM 2032 CE2 TYR A 135 11.661 -6.138 -4.803 1.00 0.00 C ATOM 2033 CZ TYR A 135 12.927 -6.443 -4.274 1.00 0.00 C ATOM 2034 OH TYR A 135 13.995 -6.609 -5.103 1.00 0.00 O ATOM 0 H TYR A 135 10.166 -5.162 0.962 1.00 0.00 H new ATOM 0 HA TYR A 135 9.244 -4.041 -1.585 1.00 0.00 H new ATOM 0 HB2 TYR A 135 9.591 -6.980 -0.937 1.00 0.00 H new ATOM 0 HB3 TYR A 135 8.612 -6.367 -2.255 1.00 0.00 H new ATOM 0 HD1 TYR A 135 12.102 -6.629 -0.973 1.00 0.00 H new ATOM 0 HD2 TYR A 135 9.592 -5.728 -4.350 1.00 0.00 H new ATOM 0 HE1 TYR A 135 14.063 -6.832 -2.482 1.00 0.00 H new ATOM 0 HE2 TYR A 135 11.535 -6.021 -5.869 1.00 0.00 H new ATOM 0 HH TYR A 135 13.715 -6.461 -6.030 1.00 0.00 H new ATOM 2044 N TYR A 136 6.820 -4.630 -0.803 1.00 0.00 N ATOM 2045 CA TYR A 136 5.468 -4.737 -0.259 1.00 0.00 C ATOM 2046 C TYR A 136 4.612 -5.678 -1.106 1.00 0.00 C ATOM 2047 O TYR A 136 4.824 -5.749 -2.317 1.00 0.00 O ATOM 2048 CB TYR A 136 4.817 -3.357 -0.128 1.00 0.00 C ATOM 2049 CG TYR A 136 4.676 -2.568 -1.416 1.00 0.00 C ATOM 2050 CD1 TYR A 136 3.510 -2.674 -2.197 1.00 0.00 C ATOM 2051 CD2 TYR A 136 5.668 -1.635 -1.769 1.00 0.00 C ATOM 2052 CE1 TYR A 136 3.314 -1.813 -3.292 1.00 0.00 C ATOM 2053 CE2 TYR A 136 5.467 -0.766 -2.852 1.00 0.00 C ATOM 2054 CZ TYR A 136 4.272 -0.831 -3.588 1.00 0.00 C ATOM 2055 OH TYR A 136 4.081 -0.006 -4.651 1.00 0.00 O ATOM 0 H TYR A 136 6.839 -4.292 -1.765 1.00 0.00 H new ATOM 0 HA TYR A 136 5.539 -5.164 0.741 1.00 0.00 H new ATOM 0 HB2 TYR A 136 3.826 -3.484 0.309 1.00 0.00 H new ATOM 0 HB3 TYR A 136 5.402 -2.765 0.576 1.00 0.00 H new ATOM 0 HD1 TYR A 136 2.765 -3.417 -1.955 1.00 0.00 H new ATOM 0 HD2 TYR A 136 6.587 -1.588 -1.204 1.00 0.00 H new ATOM 0 HE1 TYR A 136 2.429 -1.907 -3.903 1.00 0.00 H new ATOM 0 HE2 TYR A 136 6.229 -0.049 -3.119 1.00 0.00 H new ATOM 0 HH TYR A 136 4.922 0.449 -4.867 1.00 0.00 H new ATOM 2065 N VAL A 137 3.671 -6.404 -0.477 1.00 0.00 N ATOM 2066 CA VAL A 137 2.840 -7.427 -1.113 1.00 0.00 C ATOM 2067 C VAL A 137 1.465 -7.563 -0.440 1.00 0.00 C ATOM 2068 O VAL A 137 1.295 -7.169 0.713 1.00 0.00 O ATOM 2069 CB VAL A 137 3.541 -8.800 -1.060 1.00 0.00 C ATOM 2070 CG1 VAL A 137 4.986 -8.755 -1.556 1.00 0.00 C ATOM 2071 CG2 VAL A 137 3.558 -9.416 0.349 1.00 0.00 C ATOM 0 H VAL A 137 3.466 -6.288 0.515 1.00 0.00 H new ATOM 0 HA VAL A 137 2.695 -7.109 -2.145 1.00 0.00 H new ATOM 0 HB VAL A 137 2.941 -9.420 -1.726 1.00 0.00 H new ATOM 0 HG11 VAL A 137 5.423 -9.751 -1.493 1.00 0.00 H new ATOM 0 HG12 VAL A 137 5.005 -8.415 -2.591 1.00 0.00 H new ATOM 0 HG13 VAL A 137 5.562 -8.067 -0.937 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.065 -10.380 0.318 1.00 0.00 H new ATOM 0 HG22 VAL A 137 4.086 -8.750 1.031 1.00 0.00 H new ATOM 0 HG23 VAL A 137 2.535 -9.555 0.698 1.00 0.00 H new ATOM 2081 N CYS A 138 0.500 -8.155 -1.155 1.00 0.00 N ATOM 2082 CA CYS A 138 -0.821 -8.552 -0.654 1.00 0.00 C ATOM 2083 C CYS A 138 -0.825 -10.067 -0.423 1.00 0.00 C ATOM 2084 O CYS A 138 -0.392 -10.809 -1.297 1.00 0.00 O ATOM 2085 CB CYS A 138 -1.865 -8.215 -1.712 1.00 0.00 C ATOM 2086 SG CYS A 138 -3.495 -8.954 -1.496 1.00 0.00 S ATOM 0 H CYS A 138 0.625 -8.380 -2.142 1.00 0.00 H new ATOM 0 HA CYS A 138 -1.044 -8.030 0.276 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -1.983 -7.132 -1.743 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -1.477 -8.521 -2.684 1.00 0.00 H new ATOM 0 HG CYS A 138 -3.939 -9.370 -2.645 1.00 0.00 H new ATOM 2091 N GLN A 139 -1.325 -10.547 0.720 1.00 0.00 N ATOM 2092 CA GLN A 139 -1.225 -11.970 1.067 1.00 0.00 C ATOM 2093 C GLN A 139 -2.112 -12.876 0.216 1.00 0.00 C ATOM 2094 O GLN A 139 -1.764 -14.030 -0.017 1.00 0.00 O ATOM 2095 CB GLN A 139 -1.613 -12.187 2.531 1.00 0.00 C ATOM 2096 CG GLN A 139 -0.782 -11.369 3.518 1.00 0.00 C ATOM 2097 CD GLN A 139 -1.471 -11.326 4.875 1.00 0.00 C ATOM 2098 OE1 GLN A 139 -2.518 -10.697 5.003 1.00 0.00 O ATOM 2099 NE2 GLN A 139 -0.925 -12.001 5.882 1.00 0.00 N ATOM 0 H GLN A 139 -1.801 -9.975 1.418 1.00 0.00 H new ATOM 0 HA GLN A 139 -0.186 -12.240 0.879 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -2.665 -11.934 2.659 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -1.508 -13.245 2.772 1.00 0.00 H new ATOM 0 HG2 GLN A 139 0.211 -11.807 3.620 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -0.646 -10.356 3.139 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -0.054 -12.513 5.740 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -1.377 -12.007 6.796 1.00 0.00 H new ATOM 2108 N ILE A 140 -3.290 -12.381 -0.168 1.00 0.00 N ATOM 2109 CA ILE A 140 -4.316 -13.164 -0.850 1.00 0.00 C ATOM 2110 C ILE A 140 -3.690 -13.944 -2.026 1.00 0.00 C ATOM 2111 O ILE A 140 -2.979 -13.330 -2.823 1.00 0.00 O ATOM 2112 CB ILE A 140 -5.487 -12.246 -1.255 1.00 0.00 C ATOM 2113 CG1 ILE A 140 -6.077 -11.574 0.004 1.00 0.00 C ATOM 2114 CG2 ILE A 140 -6.579 -13.026 -2.002 1.00 0.00 C ATOM 2115 CD1 ILE A 140 -7.204 -10.580 -0.285 1.00 0.00 C ATOM 0 H ILE A 140 -3.560 -11.410 -0.010 1.00 0.00 H new ATOM 0 HA ILE A 140 -4.735 -13.916 -0.181 1.00 0.00 H new ATOM 0 HB ILE A 140 -5.105 -11.482 -1.932 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -6.453 -12.348 0.673 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -5.278 -11.056 0.534 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -7.389 -12.349 -2.273 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -6.158 -13.467 -2.905 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -6.966 -13.816 -1.359 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -7.562 -10.154 0.652 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.830 -9.783 -0.927 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -8.024 -11.095 -0.786 1.00 0.00 H new ATOM 2127 N PRO A 141 -3.911 -15.272 -2.122 1.00 0.00 N ATOM 2128 CA PRO A 141 -3.275 -16.141 -3.105 1.00 0.00 C ATOM 2129 C PRO A 141 -3.187 -15.562 -4.517 1.00 0.00 C ATOM 2130 O PRO A 141 -4.092 -14.865 -4.972 1.00 0.00 O ATOM 2131 CB PRO A 141 -4.088 -17.436 -3.098 1.00 0.00 C ATOM 2132 CG PRO A 141 -4.540 -17.535 -1.645 1.00 0.00 C ATOM 2133 CD PRO A 141 -4.752 -16.075 -1.241 1.00 0.00 C ATOM 0 HA PRO A 141 -2.232 -16.287 -2.824 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -4.934 -17.388 -3.784 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -3.486 -18.295 -3.395 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -5.457 -18.116 -1.548 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -3.788 -18.019 -1.022 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -5.800 -15.793 -1.343 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -4.480 -15.918 -0.197 1.00 0.00 H new ATOM 2141 N GLY A 142 -2.082 -15.836 -5.212 1.00 0.00 N ATOM 2142 CA GLY A 142 -1.855 -15.404 -6.584 1.00 0.00 C ATOM 2143 C GLY A 142 -1.459 -13.930 -6.679 1.00 0.00 C ATOM 2144 O GLY A 142 -0.568 -13.575 -7.452 1.00 0.00 O ATOM 0 H GLY A 142 -1.307 -16.375 -4.826 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -1.071 -16.016 -7.029 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -2.760 -15.572 -7.168 1.00 0.00 H new ATOM 2148 N HIS A 143 -2.095 -13.065 -5.884 1.00 0.00 N ATOM 2149 CA HIS A 143 -1.923 -11.623 -5.964 1.00 0.00 C ATOM 2150 C HIS A 143 -0.448 -11.223 -5.850 1.00 0.00 C ATOM 2151 O HIS A 143 0.028 -10.426 -6.655 1.00 0.00 O ATOM 2152 CB HIS A 143 -2.777 -10.904 -4.912 1.00 0.00 C ATOM 2153 CG HIS A 143 -4.282 -11.070 -5.003 1.00 0.00 C ATOM 2154 ND1 HIS A 143 -5.206 -10.277 -4.320 1.00 0.00 N ATOM 2155 CD2 HIS A 143 -4.967 -11.983 -5.758 1.00 0.00 C ATOM 2156 CE1 HIS A 143 -6.417 -10.750 -4.651 1.00 0.00 C ATOM 2157 NE2 HIS A 143 -6.304 -11.775 -5.510 1.00 0.00 N ATOM 0 H HIS A 143 -2.751 -13.357 -5.159 1.00 0.00 H new ATOM 0 HA HIS A 143 -2.270 -11.307 -6.948 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -2.459 -11.248 -3.928 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -2.552 -9.839 -4.966 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -4.541 -12.723 -6.420 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -7.353 -10.360 -4.278 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -7.076 -12.308 -5.910 1.00 0.00 H new ATOM 2165 N ALA A 144 0.290 -11.766 -4.875 1.00 0.00 N ATOM 2166 CA ALA A 144 1.723 -11.491 -4.773 1.00 0.00 C ATOM 2167 C ALA A 144 2.558 -12.372 -5.719 1.00 0.00 C ATOM 2168 O ALA A 144 3.745 -12.117 -5.905 1.00 0.00 O ATOM 2169 CB ALA A 144 2.214 -11.585 -3.333 1.00 0.00 C ATOM 0 H ALA A 144 -0.077 -12.389 -4.156 1.00 0.00 H new ATOM 0 HA ALA A 144 1.867 -10.461 -5.099 1.00 0.00 H new ATOM 0 HB1 ALA A 144 3.283 -11.374 -3.299 1.00 0.00 H new ATOM 0 HB2 ALA A 144 1.681 -10.859 -2.719 1.00 0.00 H new ATOM 0 HB3 ALA A 144 2.030 -12.589 -2.951 1.00 0.00 H new ATOM 2175 N ALA A 145 1.981 -13.412 -6.329 1.00 0.00 N ATOM 2176 CA ALA A 145 2.714 -14.176 -7.329 1.00 0.00 C ATOM 2177 C ALA A 145 2.877 -13.277 -8.548 1.00 0.00 C ATOM 2178 O ALA A 145 3.991 -12.983 -8.975 1.00 0.00 O ATOM 2179 CB ALA A 145 1.994 -15.480 -7.697 1.00 0.00 C ATOM 0 H ALA A 145 1.030 -13.735 -6.150 1.00 0.00 H new ATOM 0 HA ALA A 145 3.685 -14.473 -6.933 1.00 0.00 H new ATOM 0 HB1 ALA A 145 2.576 -16.018 -8.446 1.00 0.00 H new ATOM 0 HB2 ALA A 145 1.886 -16.100 -6.807 1.00 0.00 H new ATOM 0 HB3 ALA A 145 1.008 -15.250 -8.100 1.00 0.00 H new ATOM 2185 N THR A 146 1.745 -12.819 -9.084 1.00 0.00 N ATOM 2186 CA THR A 146 1.685 -11.990 -10.274 1.00 0.00 C ATOM 2187 C THR A 146 0.432 -11.119 -10.176 1.00 0.00 C ATOM 2188 O THR A 146 -0.618 -11.515 -10.682 1.00 0.00 O ATOM 2189 CB THR A 146 1.632 -12.882 -11.530 1.00 0.00 C ATOM 2190 OG1 THR A 146 0.586 -13.825 -11.412 1.00 0.00 O ATOM 2191 CG2 THR A 146 2.936 -13.641 -11.792 1.00 0.00 C ATOM 0 H THR A 146 0.827 -13.022 -8.689 1.00 0.00 H new ATOM 0 HA THR A 146 2.570 -11.358 -10.349 1.00 0.00 H new ATOM 0 HB THR A 146 1.464 -12.208 -12.370 1.00 0.00 H new ATOM 0 HG1 THR A 146 -0.241 -13.366 -11.157 1.00 0.00 H new ATOM 0 HG21 THR A 146 2.829 -14.249 -12.690 1.00 0.00 H new ATOM 0 HG22 THR A 146 3.750 -12.929 -11.930 1.00 0.00 H new ATOM 0 HG23 THR A 146 3.159 -14.286 -10.942 1.00 0.00 H new ATOM 2199 N GLY A 147 0.520 -9.952 -9.534 1.00 0.00 N ATOM 2200 CA GLY A 147 -0.640 -9.082 -9.455 1.00 0.00 C ATOM 2201 C GLY A 147 -0.365 -7.744 -8.779 1.00 0.00 C ATOM 2202 O GLY A 147 -0.475 -6.704 -9.426 1.00 0.00 O ATOM 0 H GLY A 147 1.360 -9.600 -9.075 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -1.013 -8.899 -10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -1.431 -9.597 -8.910 1.00 0.00 H new ATOM 2206 N MET A 148 -0.061 -7.757 -7.478 1.00 0.00 N ATOM 2207 CA MET A 148 0.094 -6.540 -6.694 1.00 0.00 C ATOM 2208 C MET A 148 1.237 -6.652 -5.685 1.00 0.00 C ATOM 2209 O MET A 148 1.155 -7.423 -4.727 1.00 0.00 O ATOM 2210 CB MET A 148 -1.244 -6.141 -6.062 1.00 0.00 C ATOM 2211 CG MET A 148 -1.753 -7.056 -4.947 1.00 0.00 C ATOM 2212 SD MET A 148 -3.563 -7.119 -4.803 1.00 0.00 S ATOM 2213 CE MET A 148 -3.946 -5.369 -4.599 1.00 0.00 C ATOM 0 H MET A 148 0.083 -8.614 -6.944 1.00 0.00 H new ATOM 0 HA MET A 148 0.384 -5.729 -7.362 1.00 0.00 H new ATOM 0 HB2 MET A 148 -1.149 -5.131 -5.662 1.00 0.00 H new ATOM 0 HB3 MET A 148 -1.998 -6.103 -6.848 1.00 0.00 H new ATOM 0 HG2 MET A 148 -1.378 -8.065 -5.121 1.00 0.00 H new ATOM 0 HG3 MET A 148 -1.336 -6.720 -3.998 1.00 0.00 H new ATOM 0 HE1 MET A 148 -4.966 -5.178 -4.933 1.00 0.00 H new ATOM 0 HE2 MET A 148 -3.852 -5.096 -3.548 1.00 0.00 H new ATOM 0 HE3 MET A 148 -3.252 -4.773 -5.192 1.00 0.00 H new ATOM 2223 N PHE A 149 2.292 -5.862 -5.898 1.00 0.00 N ATOM 2224 CA PHE A 149 3.446 -5.766 -5.018 1.00 0.00 C ATOM 2225 C PHE A 149 4.217 -4.487 -5.377 1.00 0.00 C ATOM 2226 O PHE A 149 3.677 -3.650 -6.097 1.00 0.00 O ATOM 2227 CB PHE A 149 4.257 -7.080 -5.087 1.00 0.00 C ATOM 2228 CG PHE A 149 4.610 -7.599 -6.474 1.00 0.00 C ATOM 2229 CD1 PHE A 149 5.436 -6.856 -7.342 1.00 0.00 C ATOM 2230 CD2 PHE A 149 4.177 -8.881 -6.866 1.00 0.00 C ATOM 2231 CE1 PHE A 149 5.802 -7.384 -8.592 1.00 0.00 C ATOM 2232 CE2 PHE A 149 4.567 -9.420 -8.103 1.00 0.00 C ATOM 2233 CZ PHE A 149 5.371 -8.666 -8.972 1.00 0.00 C ATOM 0 H PHE A 149 2.363 -5.255 -6.715 1.00 0.00 H new ATOM 0 HA PHE A 149 3.169 -5.667 -3.968 1.00 0.00 H new ATOM 0 HB2 PHE A 149 5.184 -6.936 -4.532 1.00 0.00 H new ATOM 0 HB3 PHE A 149 3.692 -7.855 -4.568 1.00 0.00 H new ATOM 0 HD1 PHE A 149 5.788 -5.879 -7.046 1.00 0.00 H new ATOM 0 HD2 PHE A 149 3.539 -9.454 -6.209 1.00 0.00 H new ATOM 0 HE1 PHE A 149 6.417 -6.802 -9.263 1.00 0.00 H new ATOM 0 HE2 PHE A 149 4.249 -10.413 -8.385 1.00 0.00 H new ATOM 0 HZ PHE A 149 5.658 -9.071 -9.931 1.00 0.00 H new ATOM 2243 N GLY A 150 5.452 -4.301 -4.903 1.00 0.00 N ATOM 2244 CA GLY A 150 6.290 -3.162 -5.281 1.00 0.00 C ATOM 2245 C GLY A 150 7.508 -3.102 -4.375 1.00 0.00 C ATOM 2246 O GLY A 150 7.611 -3.888 -3.432 1.00 0.00 O ATOM 0 H GLY A 150 5.899 -4.939 -4.244 1.00 0.00 H new ATOM 0 HA2 GLY A 150 6.602 -3.257 -6.321 1.00 0.00 H new ATOM 0 HA3 GLY A 150 5.720 -2.236 -5.202 1.00 0.00 H new ATOM 2250 N LYS A 151 8.434 -2.192 -4.693 1.00 0.00 N ATOM 2251 CA LYS A 151 9.730 -2.068 -4.045 1.00 0.00 C ATOM 2252 C LYS A 151 9.795 -0.800 -3.197 1.00 0.00 C ATOM 2253 O LYS A 151 9.173 0.212 -3.527 1.00 0.00 O ATOM 2254 CB LYS A 151 10.847 -2.044 -5.101 1.00 0.00 C ATOM 2255 CG LYS A 151 10.565 -2.934 -6.319 1.00 0.00 C ATOM 2256 CD LYS A 151 11.818 -3.049 -7.197 1.00 0.00 C ATOM 2257 CE LYS A 151 11.550 -3.858 -8.473 1.00 0.00 C ATOM 2258 NZ LYS A 151 10.578 -3.189 -9.357 1.00 0.00 N ATOM 0 H LYS A 151 8.292 -1.503 -5.432 1.00 0.00 H new ATOM 0 HA LYS A 151 9.868 -2.929 -3.392 1.00 0.00 H new ATOM 0 HB2 LYS A 151 10.994 -1.018 -5.438 1.00 0.00 H new ATOM 0 HB3 LYS A 151 11.780 -2.364 -4.637 1.00 0.00 H new ATOM 0 HG2 LYS A 151 10.252 -3.925 -5.989 1.00 0.00 H new ATOM 0 HG3 LYS A 151 9.743 -2.517 -6.900 1.00 0.00 H new ATOM 0 HD2 LYS A 151 12.166 -2.052 -7.466 1.00 0.00 H new ATOM 0 HD3 LYS A 151 12.618 -3.523 -6.628 1.00 0.00 H new ATOM 0 HE2 LYS A 151 12.486 -4.007 -9.011 1.00 0.00 H new ATOM 0 HE3 LYS A 151 11.176 -4.846 -8.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 10.564 -3.666 -10.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 9.631 -3.235 -8.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 10.852 -2.194 -9.485 1.00 0.00 H new ATOM 2272 N ILE A 152 10.588 -0.846 -2.129 1.00 0.00 N ATOM 2273 CA ILE A 152 10.884 0.279 -1.264 1.00 0.00 C ATOM 2274 C ILE A 152 12.405 0.341 -1.162 1.00 0.00 C ATOM 2275 O ILE A 152 13.030 -0.677 -0.883 1.00 0.00 O ATOM 2276 CB ILE A 152 10.276 0.040 0.127 1.00 0.00 C ATOM 2277 CG1 ILE A 152 8.789 -0.339 0.049 1.00 0.00 C ATOM 2278 CG2 ILE A 152 10.508 1.252 1.034 1.00 0.00 C ATOM 2279 CD1 ILE A 152 8.112 -0.431 1.417 1.00 0.00 C ATOM 0 H ILE A 152 11.057 -1.703 -1.837 1.00 0.00 H new ATOM 0 HA ILE A 152 10.470 1.208 -1.655 1.00 0.00 H new ATOM 0 HB ILE A 152 10.789 -0.814 0.570 1.00 0.00 H new ATOM 0 HG12 ILE A 152 8.265 0.399 -0.558 1.00 0.00 H new ATOM 0 HG13 ILE A 152 8.692 -1.298 -0.461 1.00 0.00 H new ATOM 0 HG21 ILE A 152 10.070 1.062 2.014 1.00 0.00 H new ATOM 0 HG22 ILE A 152 11.579 1.426 1.143 1.00 0.00 H new ATOM 0 HG23 ILE A 152 10.041 2.132 0.592 1.00 0.00 H new ATOM 0 HD11 ILE A 152 7.064 -0.702 1.287 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.611 -1.190 2.020 1.00 0.00 H new ATOM 0 HD13 ILE A 152 8.177 0.533 1.921 1.00 0.00 H new ATOM 2291 N VAL A 153 13.006 1.508 -1.381 1.00 0.00 N ATOM 2292 CA VAL A 153 14.424 1.744 -1.180 1.00 0.00 C ATOM 2293 C VAL A 153 14.505 2.810 -0.103 1.00 0.00 C ATOM 2294 O VAL A 153 13.751 3.781 -0.153 1.00 0.00 O ATOM 2295 CB VAL A 153 15.095 2.254 -2.454 1.00 0.00 C ATOM 2296 CG1 VAL A 153 16.622 2.153 -2.292 1.00 0.00 C ATOM 2297 CG2 VAL A 153 14.669 1.445 -3.689 1.00 0.00 C ATOM 0 H VAL A 153 12.504 2.332 -1.711 1.00 0.00 H new ATOM 0 HA VAL A 153 14.935 0.822 -0.903 1.00 0.00 H new ATOM 0 HB VAL A 153 14.787 3.289 -2.605 1.00 0.00 H new ATOM 0 HG11 VAL A 153 17.109 2.515 -3.198 1.00 0.00 H new ATOM 0 HG12 VAL A 153 16.939 2.759 -1.443 1.00 0.00 H new ATOM 0 HG13 VAL A 153 16.902 1.114 -2.121 1.00 0.00 H new ATOM 0 HG21 VAL A 153 15.169 1.840 -4.573 1.00 0.00 H new ATOM 0 HG22 VAL A 153 14.946 0.400 -3.553 1.00 0.00 H new ATOM 0 HG23 VAL A 153 13.589 1.520 -3.819 1.00 0.00 H new ATOM 2307 N VAL A 154 15.396 2.637 0.866 1.00 0.00 N ATOM 2308 CA VAL A 154 15.490 3.518 2.013 1.00 0.00 C ATOM 2309 C VAL A 154 16.931 4.014 2.067 1.00 0.00 C ATOM 2310 O VAL A 154 17.845 3.192 2.070 1.00 0.00 O ATOM 2311 CB VAL A 154 15.054 2.737 3.259 1.00 0.00 C ATOM 2312 CG1 VAL A 154 14.952 3.686 4.452 1.00 0.00 C ATOM 2313 CG2 VAL A 154 13.684 2.080 3.040 1.00 0.00 C ATOM 0 H VAL A 154 16.075 1.876 0.874 1.00 0.00 H new ATOM 0 HA VAL A 154 14.836 4.388 1.951 1.00 0.00 H new ATOM 0 HB VAL A 154 15.797 1.963 3.451 1.00 0.00 H new ATOM 0 HG11 VAL A 154 14.642 3.128 5.335 1.00 0.00 H new ATOM 0 HG12 VAL A 154 15.923 4.146 4.635 1.00 0.00 H new ATOM 0 HG13 VAL A 154 14.218 4.463 4.237 1.00 0.00 H new ATOM 0 HG21 VAL A 154 13.396 1.532 3.937 1.00 0.00 H new ATOM 0 HG22 VAL A 154 12.941 2.849 2.830 1.00 0.00 H new ATOM 0 HG23 VAL A 154 13.741 1.392 2.197 1.00 0.00 H new ATOM 2323 N LYS A 155 17.160 5.329 2.045 1.00 0.00 N ATOM 2324 CA LYS A 155 18.513 5.882 1.970 1.00 0.00 C ATOM 2325 C LYS A 155 18.641 7.137 2.826 1.00 0.00 C ATOM 2326 O LYS A 155 17.640 7.692 3.272 1.00 0.00 O ATOM 2327 CB LYS A 155 18.875 6.196 0.511 1.00 0.00 C ATOM 2328 CG LYS A 155 18.770 4.966 -0.402 1.00 0.00 C ATOM 2329 CD LYS A 155 19.196 5.256 -1.848 1.00 0.00 C ATOM 2330 CE LYS A 155 18.170 6.132 -2.579 1.00 0.00 C ATOM 2331 NZ LYS A 155 18.510 6.279 -4.005 1.00 0.00 N ATOM 0 H LYS A 155 16.422 6.033 2.078 1.00 0.00 H new ATOM 0 HA LYS A 155 19.207 5.136 2.357 1.00 0.00 H new ATOM 0 HB2 LYS A 155 18.215 6.979 0.137 1.00 0.00 H new ATOM 0 HB3 LYS A 155 19.891 6.589 0.469 1.00 0.00 H new ATOM 0 HG2 LYS A 155 19.392 4.167 0.001 1.00 0.00 H new ATOM 0 HG3 LYS A 155 17.742 4.603 -0.397 1.00 0.00 H new ATOM 0 HD2 LYS A 155 20.165 5.754 -1.848 1.00 0.00 H new ATOM 0 HD3 LYS A 155 19.320 4.316 -2.386 1.00 0.00 H new ATOM 0 HE2 LYS A 155 17.178 5.691 -2.483 1.00 0.00 H new ATOM 0 HE3 LYS A 155 18.128 7.115 -2.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 17.798 6.876 -4.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 19.446 6.722 -4.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 18.526 5.342 -4.456 1.00 0.00 H new