USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 920 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 42 ASN :FLIP amide:sc= -6.16! C(o=-8!,f=-7.3!) USER MOD Set 1.2: A 140 THR OG1 : rot 87:sc= -1.12 USER MOD Set 2.1: A 25 HIS :FLIP no HD1:sc= -4.11! C(o=-7.6!,f=-5.9!) USER MOD Set 2.2: A 105 MET CE :methyl 161:sc= -1.83 (180deg=-3.11!) USER MOD Set 3.1: A 61 TYR OH : rot 151:sc= 0.762 USER MOD Set 3.2: A 65 LYS NZ :NH3+ -176:sc= 0.927 (180deg=0.0119) USER MOD Set 4.1: A 29 ASN : amide:sc= -2.81! C(o=-9!,f=-8.7!) USER MOD Set 4.2: A 32 GLN : amide:sc= -0.242 X(o=-9,f=-8.7) USER MOD Set 4.3: A 33 HIS : no HE2:sc= -5.96! C(o=-9!,f=-14!) USER MOD Single : A 13 SER OG : rot 25:sc= 0.103 USER MOD Single : A 14 SER OG : rot -23:sc= 1.17 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 150:sc= -0.401 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 142:sc= 0.586 USER MOD Single : A 41 TYR OH : rot 100:sc= -1.89! USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 5:sc= -0.262! USER MOD Single : A 58 THR OG1 : rot 102:sc= 0.82 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 2.04 K(o=2,f=-0.018) USER MOD Single : A 63 LYS NZ :NH3+ 179:sc= 1.23 (180deg=1.19) USER MOD Single : A 64 TYR OH : rot -139:sc= 0.919 USER MOD Single : A 66 SER OG : rot 113:sc= 0.116 USER MOD Single : A 67 GLN :FLIP amide:sc= -0.0343 F(o=-1.4,f=-0.034) USER MOD Single : A 70 THR OG1 : rot 40:sc= -2.66! USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ -146:sc= 0.45 (180deg=-0.344) USER MOD Single : A 109 ASN :FLIP amide:sc= -0.541 F(o=-3.2!,f=-0.54) USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 HIS : no HD1:sc= -5.28! C(o=-5.3!,f=-13!) USER MOD Single : A 119 TYR OH : rot 77:sc= -3.84! USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl 140:sc= -10.4! (180deg=-14.6!) USER MOD Single : A 123 LYS NZ :NH3+ -179:sc= 0.861 (180deg=0.859) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 THR OG1 : rot 107:sc= 1.26 USER MOD Single : A 126 LYS NZ :NH3+ -155:sc= -5.48! (180deg=-7.47!) USER MOD Single : A 138 ASN : amide:sc= -0.213 X(o=-0.21,f=-0.63) USER MOD Single : A 141 SER OG : rot -116:sc= 1.94 USER MOD Single : A 155 SER OG : rot 180:sc= 0.0636 USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ -112:sc= -0.725 (180deg=-2.8!) USER MOD Single : A 166 LYS NZ :NH3+ -176:sc= 1.23 (180deg=1.2) USER MOD ----------------------------------------------------------------- ATOM 34 N SER A 13 -10.249 14.136 -0.646 1.00 0.52 N ATOM 35 CA SER A 13 -11.360 13.473 0.026 1.00 0.53 C ATOM 36 C SER A 13 -11.292 11.972 -0.205 1.00 0.41 C ATOM 37 O SER A 13 -12.240 11.234 0.071 1.00 0.53 O ATOM 38 CB SER A 13 -12.686 14.017 -0.499 1.00 0.79 C ATOM 39 OG SER A 13 -12.758 15.427 -0.361 1.00 1.58 O ATOM 0 HA SER A 13 -11.291 13.670 1.096 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.802 13.746 -1.548 1.00 0.79 H new ATOM 0 HB3 SER A 13 -13.511 13.554 0.043 1.00 0.79 H new ATOM 0 HG SER A 13 -11.852 15.800 -0.334 1.00 1.58 H new ATOM 45 N SER A 14 -10.147 11.539 -0.703 1.00 0.32 N ATOM 46 CA SER A 14 -9.922 10.194 -1.121 1.00 0.22 C ATOM 47 C SER A 14 -8.518 10.155 -1.638 1.00 0.21 C ATOM 48 O SER A 14 -7.827 11.172 -1.673 1.00 0.35 O ATOM 49 CB SER A 14 -10.905 9.792 -2.220 1.00 0.25 C ATOM 50 OG SER A 14 -10.769 10.636 -3.361 1.00 1.17 O ATOM 0 H SER A 14 -9.334 12.142 -0.825 1.00 0.32 H new ATOM 0 HA SER A 14 -10.068 9.496 -0.297 1.00 0.22 H new ATOM 0 HB2 SER A 14 -10.731 8.755 -2.507 1.00 0.25 H new ATOM 0 HB3 SER A 14 -11.925 9.850 -1.840 1.00 0.25 H new ATOM 0 HG SER A 14 -10.363 11.486 -3.092 1.00 1.17 H new ATOM 56 N ILE A 15 -8.102 9.003 -2.028 1.00 0.18 N ATOM 57 CA ILE A 15 -6.785 8.827 -2.542 1.00 0.18 C ATOM 58 C ILE A 15 -6.771 9.042 -4.050 1.00 0.17 C ATOM 59 O ILE A 15 -5.721 9.249 -4.641 1.00 0.19 O ATOM 60 CB ILE A 15 -6.308 7.430 -2.192 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.340 6.405 -2.664 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.073 7.328 -0.705 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.750 5.100 -3.135 1.00 0.38 C ATOM 0 H ILE A 15 -8.664 8.152 -2.001 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.113 9.561 -2.096 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.364 7.223 -2.697 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.033 6.203 -1.848 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.922 6.841 -3.476 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.731 6.323 -0.459 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.316 8.053 -0.406 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.003 7.535 -0.175 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.551 4.432 -3.451 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.080 5.286 -3.974 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.192 4.638 -2.320 1.00 0.38 H new ATOM 75 N PHE A 16 -7.959 9.029 -4.656 1.00 0.18 N ATOM 76 CA PHE A 16 -8.097 9.201 -6.103 1.00 0.19 C ATOM 77 C PHE A 16 -7.779 10.623 -6.509 1.00 0.21 C ATOM 78 O PHE A 16 -7.606 10.927 -7.690 1.00 0.30 O ATOM 79 CB PHE A 16 -9.500 8.846 -6.550 1.00 0.20 C ATOM 80 CG PHE A 16 -9.888 7.453 -6.196 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.114 6.390 -6.612 1.00 0.22 C ATOM 82 CD2 PHE A 16 -11.031 7.203 -5.475 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.479 5.096 -6.320 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.393 5.910 -5.174 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.618 4.857 -5.602 1.00 0.19 C ATOM 0 H PHE A 16 -8.843 8.901 -4.164 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.388 8.530 -6.588 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.207 9.541 -6.096 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.575 8.975 -7.630 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.210 6.576 -7.174 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.648 8.025 -5.143 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.868 4.272 -6.657 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.288 5.721 -4.600 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.909 3.843 -5.371 1.00 0.19 H new ATOM 95 N ASP A 17 -7.712 11.495 -5.515 1.00 0.21 N ATOM 96 CA ASP A 17 -7.278 12.861 -5.726 1.00 0.26 C ATOM 97 C ASP A 17 -5.830 12.845 -6.185 1.00 0.25 C ATOM 98 O ASP A 17 -5.359 13.761 -6.862 1.00 0.32 O ATOM 99 CB ASP A 17 -7.408 13.676 -4.438 1.00 0.32 C ATOM 100 CG ASP A 17 -8.851 13.863 -3.994 1.00 1.13 C ATOM 101 OD1 ASP A 17 -9.391 12.967 -3.313 1.00 2.11 O ATOM 102 OD2 ASP A 17 -9.459 14.904 -4.333 1.00 1.30 O ATOM 0 H ASP A 17 -7.955 11.276 -4.549 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.907 13.327 -6.485 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -6.851 13.180 -3.643 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.950 14.654 -4.586 1.00 0.32 H new ATOM 107 N PHE A 18 -5.137 11.771 -5.819 1.00 0.22 N ATOM 108 CA PHE A 18 -3.758 11.573 -6.201 1.00 0.23 C ATOM 109 C PHE A 18 -3.641 10.421 -7.147 1.00 0.26 C ATOM 110 O PHE A 18 -3.766 9.261 -6.756 1.00 0.29 O ATOM 111 CB PHE A 18 -2.897 11.319 -4.989 1.00 0.21 C ATOM 112 CG PHE A 18 -2.993 12.435 -4.018 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.601 13.708 -4.378 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.511 12.223 -2.763 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.718 14.754 -3.497 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.639 13.262 -1.881 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.242 14.533 -2.240 1.00 0.31 C ATOM 0 H PHE A 18 -5.523 11.018 -5.249 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.412 12.481 -6.694 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.205 10.390 -4.510 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.859 11.190 -5.297 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.197 13.883 -5.364 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.819 11.230 -2.471 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.401 15.745 -3.786 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.053 13.086 -0.899 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.341 15.351 -1.541 1.00 0.31 H new ATOM 127 N GLU A 19 -3.425 10.757 -8.393 1.00 0.35 N ATOM 128 CA GLU A 19 -3.179 9.758 -9.408 1.00 0.43 C ATOM 129 C GLU A 19 -2.059 8.827 -8.959 1.00 0.34 C ATOM 130 O GLU A 19 -1.103 9.240 -8.288 1.00 0.37 O ATOM 131 CB GLU A 19 -2.821 10.413 -10.741 1.00 0.63 C ATOM 132 CG GLU A 19 -2.831 9.441 -11.912 1.00 1.08 C ATOM 133 CD GLU A 19 -4.197 8.829 -12.145 1.00 2.04 C ATOM 134 OE1 GLU A 19 -4.561 7.886 -11.407 1.00 2.86 O ATOM 135 OE2 GLU A 19 -4.909 9.275 -13.068 1.00 2.30 O ATOM 0 H GLU A 19 -3.414 11.719 -8.733 1.00 0.35 H new ATOM 0 HA GLU A 19 -4.090 9.177 -9.550 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -3.525 11.220 -10.942 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.832 10.865 -10.662 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -2.510 9.961 -12.815 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -2.107 8.647 -11.728 1.00 1.08 H new ATOM 142 N VAL A 20 -2.182 7.584 -9.355 1.00 0.29 N ATOM 143 CA VAL A 20 -1.220 6.559 -9.014 1.00 0.26 C ATOM 144 C VAL A 20 -0.474 6.210 -10.263 1.00 0.25 C ATOM 145 O VAL A 20 -0.935 6.515 -11.350 1.00 0.28 O ATOM 146 CB VAL A 20 -1.917 5.299 -8.442 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.971 4.117 -8.301 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.508 5.627 -7.106 1.00 0.49 C ATOM 0 H VAL A 20 -2.957 7.250 -9.927 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.543 6.930 -8.244 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.694 5.007 -9.148 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.514 3.263 -7.896 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.564 3.858 -9.278 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.156 4.382 -7.627 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -3.000 4.744 -6.699 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.718 5.947 -6.427 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.237 6.429 -7.218 1.00 0.49 H new ATOM 158 N LEU A 21 0.695 5.633 -10.125 1.00 0.28 N ATOM 159 CA LEU A 21 1.493 5.331 -11.276 1.00 0.35 C ATOM 160 C LEU A 21 1.896 3.871 -11.267 1.00 0.38 C ATOM 161 O LEU A 21 1.666 3.173 -10.294 1.00 0.58 O ATOM 162 CB LEU A 21 2.703 6.263 -11.313 1.00 0.45 C ATOM 163 CG LEU A 21 2.354 7.743 -11.095 1.00 0.46 C ATOM 164 CD1 LEU A 21 3.599 8.591 -10.996 1.00 0.69 C ATOM 165 CD2 LEU A 21 1.459 8.259 -12.205 1.00 0.68 C ATOM 0 H LEU A 21 1.108 5.367 -9.231 1.00 0.28 H new ATOM 0 HA LEU A 21 0.913 5.497 -12.184 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.414 5.951 -10.548 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.203 6.155 -12.275 1.00 0.45 H new ATOM 0 HG LEU A 21 1.815 7.815 -10.151 1.00 0.46 H new ATOM 0 HD11 LEU A 21 3.318 9.633 -10.842 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.205 8.251 -10.157 1.00 0.69 H new ATOM 0 HD13 LEU A 21 4.174 8.503 -11.918 1.00 0.69 H new ATOM 0 HD21 LEU A 21 1.227 9.309 -12.027 1.00 0.68 H new ATOM 0 HD22 LEU A 21 1.971 8.158 -13.162 1.00 0.68 H new ATOM 0 HD23 LEU A 21 0.535 7.681 -12.225 1.00 0.68 H new ATOM 177 N ASP A 22 2.415 3.405 -12.378 1.00 0.33 N ATOM 178 CA ASP A 22 2.938 2.056 -12.486 1.00 0.37 C ATOM 179 C ASP A 22 4.390 2.060 -12.034 1.00 0.35 C ATOM 180 O ASP A 22 4.897 3.112 -11.653 1.00 0.40 O ATOM 181 CB ASP A 22 2.779 1.576 -13.938 1.00 0.50 C ATOM 182 CG ASP A 22 3.310 0.182 -14.189 1.00 1.16 C ATOM 183 OD1 ASP A 22 2.634 -0.781 -13.785 1.00 1.48 O ATOM 184 OD2 ASP A 22 4.398 0.045 -14.780 1.00 1.87 O ATOM 0 H ASP A 22 2.489 3.949 -13.238 1.00 0.33 H new ATOM 0 HA ASP A 22 2.390 1.364 -11.847 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.723 1.604 -14.205 1.00 0.50 H new ATOM 0 HB3 ASP A 22 3.294 2.274 -14.599 1.00 0.50 H new ATOM 189 N ALA A 23 5.066 0.922 -12.068 1.00 0.39 N ATOM 190 CA ALA A 23 6.454 0.851 -11.620 1.00 0.42 C ATOM 191 C ALA A 23 7.366 1.711 -12.492 1.00 0.47 C ATOM 192 O ALA A 23 8.536 1.923 -12.170 1.00 0.59 O ATOM 193 CB ALA A 23 6.932 -0.591 -11.590 1.00 0.52 C ATOM 0 H ALA A 23 4.681 0.037 -12.399 1.00 0.39 H new ATOM 0 HA ALA A 23 6.500 1.249 -10.606 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.968 -0.624 -11.254 1.00 0.52 H new ATOM 0 HB2 ALA A 23 6.310 -1.166 -10.905 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.861 -1.019 -12.590 1.00 0.52 H new ATOM 199 N ASP A 24 6.828 2.218 -13.593 1.00 0.46 N ATOM 200 CA ASP A 24 7.567 3.147 -14.429 1.00 0.54 C ATOM 201 C ASP A 24 7.025 4.560 -14.307 1.00 0.51 C ATOM 202 O ASP A 24 7.415 5.435 -15.075 1.00 0.62 O ATOM 203 CB ASP A 24 7.549 2.714 -15.896 1.00 0.69 C ATOM 204 CG ASP A 24 8.382 1.478 -16.160 1.00 1.43 C ATOM 205 OD1 ASP A 24 9.609 1.612 -16.356 1.00 1.51 O ATOM 206 OD2 ASP A 24 7.818 0.367 -16.160 1.00 2.34 O ATOM 0 H ASP A 24 5.888 2.002 -13.925 1.00 0.46 H new ATOM 0 HA ASP A 24 8.597 3.138 -14.073 1.00 0.54 H new ATOM 0 HB2 ASP A 24 6.520 2.523 -16.200 1.00 0.69 H new ATOM 0 HB3 ASP A 24 7.917 3.532 -16.515 1.00 0.69 H new ATOM 211 N HIS A 25 6.097 4.776 -13.369 1.00 0.43 N ATOM 212 CA HIS A 25 5.600 6.111 -13.076 1.00 0.44 C ATOM 213 C HIS A 25 4.704 6.598 -14.207 1.00 0.47 C ATOM 214 O HIS A 25 4.389 7.780 -14.317 1.00 0.54 O ATOM 215 CB HIS A 25 6.759 7.076 -12.769 1.00 0.54 C ATOM 216 CG HIS A 25 7.070 7.150 -11.304 1.00 0.64 C ATOM 217 ND1 HIS A 25 6.260 6.986 -10.243 1.00 0.73 N flip ATOM 218 CD2 HIS A 25 8.321 7.407 -10.786 1.00 1.47 C flip ATOM 219 CE1 HIS A 25 7.010 7.148 -9.108 1.00 0.59 C flip ATOM 220 NE2 HIS A 25 8.253 7.395 -9.460 1.00 1.26 N flip ATOM 0 H HIS A 25 5.679 4.038 -12.803 1.00 0.43 H new ATOM 0 HA HIS A 25 4.987 6.076 -12.175 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.649 6.754 -13.310 1.00 0.54 H new ATOM 0 HB3 HIS A 25 6.506 8.071 -13.134 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.214 7.589 -11.366 1.00 1.47 H new ATOM 0 HE1 HIS A 25 6.642 7.084 -8.095 1.00 0.59 H new ATOM 0 HE2 HIS A 25 9.033 7.551 -8.822 1.00 1.26 H new ATOM 229 N LYS A 26 4.303 5.646 -15.039 1.00 0.48 N ATOM 230 CA LYS A 26 3.216 5.833 -15.985 1.00 0.53 C ATOM 231 C LYS A 26 1.921 5.754 -15.202 1.00 0.41 C ATOM 232 O LYS A 26 1.778 4.859 -14.384 1.00 0.38 O ATOM 233 CB LYS A 26 3.231 4.708 -17.019 1.00 0.67 C ATOM 234 CG LYS A 26 4.597 4.429 -17.616 1.00 1.00 C ATOM 235 CD LYS A 26 4.618 3.091 -18.339 1.00 2.12 C ATOM 236 CE LYS A 26 4.230 1.955 -17.403 1.00 3.15 C ATOM 237 NZ LYS A 26 4.523 0.620 -17.990 1.00 4.25 N ATOM 0 H LYS A 26 4.726 4.719 -15.075 1.00 0.48 H new ATOM 0 HA LYS A 26 3.317 6.790 -16.497 1.00 0.53 H new ATOM 0 HB2 LYS A 26 2.858 3.796 -16.553 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.540 4.960 -17.824 1.00 0.67 H new ATOM 0 HG2 LYS A 26 4.863 5.225 -18.311 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.349 4.431 -16.827 1.00 1.00 H new ATOM 0 HD2 LYS A 26 3.931 3.120 -19.184 1.00 2.12 H new ATOM 0 HD3 LYS A 26 5.613 2.909 -18.744 1.00 2.12 H new ATOM 0 HE2 LYS A 26 4.768 2.062 -16.461 1.00 3.15 H new ATOM 0 HE3 LYS A 26 3.167 2.023 -17.172 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 4.243 -0.123 -17.319 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 3.990 0.506 -18.876 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 5.541 0.543 -18.187 1.00 4.25 H new ATOM 251 N PRO A 27 0.980 6.677 -15.408 1.00 0.41 N ATOM 252 CA PRO A 27 -0.259 6.717 -14.622 1.00 0.37 C ATOM 253 C PRO A 27 -0.967 5.362 -14.518 1.00 0.32 C ATOM 254 O PRO A 27 -1.416 4.788 -15.512 1.00 0.36 O ATOM 255 CB PRO A 27 -1.115 7.720 -15.391 1.00 0.46 C ATOM 256 CG PRO A 27 -0.119 8.639 -16.005 1.00 0.54 C ATOM 257 CD PRO A 27 1.039 7.767 -16.398 1.00 0.50 C ATOM 0 HA PRO A 27 -0.068 6.989 -13.584 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.725 7.228 -16.148 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -1.797 8.254 -14.729 1.00 0.46 H new ATOM 0 HG2 PRO A 27 -0.538 9.150 -16.872 1.00 0.54 H new ATOM 0 HG3 PRO A 27 0.191 9.410 -15.300 1.00 0.54 H new ATOM 0 HD2 PRO A 27 0.936 7.394 -17.417 1.00 0.50 H new ATOM 0 HD3 PRO A 27 1.985 8.306 -16.350 1.00 0.50 H new ATOM 265 N TYR A 28 -1.035 4.875 -13.288 1.00 0.28 N ATOM 266 CA TYR A 28 -1.855 3.730 -12.912 1.00 0.26 C ATOM 267 C TYR A 28 -3.306 4.174 -12.801 1.00 0.25 C ATOM 268 O TYR A 28 -3.585 5.335 -12.517 1.00 0.37 O ATOM 269 CB TYR A 28 -1.404 3.192 -11.550 1.00 0.30 C ATOM 270 CG TYR A 28 -1.427 1.686 -11.414 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.586 0.960 -11.643 1.00 0.50 C ATOM 272 CD2 TYR A 28 -0.279 0.994 -11.052 1.00 0.82 C ATOM 273 CE1 TYR A 28 -2.598 -0.416 -11.523 1.00 0.64 C ATOM 274 CE2 TYR A 28 -0.282 -0.379 -10.923 1.00 1.10 C ATOM 275 CZ TYR A 28 -1.445 -1.081 -11.162 1.00 0.92 C ATOM 276 OH TYR A 28 -1.454 -2.453 -11.055 1.00 1.20 O ATOM 0 H TYR A 28 -0.512 5.271 -12.507 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.751 2.951 -13.667 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.391 3.543 -11.356 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -2.043 3.621 -10.778 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -3.493 1.478 -11.919 1.00 0.50 H new ATOM 0 HD2 TYR A 28 0.634 1.541 -10.868 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -3.507 -0.969 -11.711 1.00 0.64 H new ATOM 0 HE2 TYR A 28 0.619 -0.901 -10.637 1.00 1.10 H new ATOM 0 HH TYR A 28 -0.565 -2.804 -11.270 1.00 1.20 H new ATOM 286 N ASN A 29 -4.225 3.253 -13.013 1.00 0.34 N ATOM 287 CA ASN A 29 -5.633 3.569 -12.920 1.00 0.42 C ATOM 288 C ASN A 29 -6.120 3.287 -11.508 1.00 0.34 C ATOM 289 O ASN A 29 -6.635 2.211 -11.210 1.00 0.44 O ATOM 290 CB ASN A 29 -6.438 2.776 -13.953 1.00 0.67 C ATOM 291 CG ASN A 29 -7.892 3.211 -14.030 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.766 2.435 -14.420 1.00 1.18 O ATOM 293 ND2 ASN A 29 -8.163 4.452 -13.655 1.00 1.51 N ATOM 0 H ASN A 29 -4.021 2.282 -13.250 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.779 4.627 -13.138 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -5.977 2.893 -14.934 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.394 1.716 -13.704 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -9.123 4.795 -13.683 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.412 5.065 -13.338 1.00 1.51 H new ATOM 300 N LEU A 30 -5.920 4.258 -10.632 1.00 0.25 N ATOM 301 CA LEU A 30 -6.308 4.129 -9.237 1.00 0.20 C ATOM 302 C LEU A 30 -7.820 4.073 -9.102 1.00 0.19 C ATOM 303 O LEU A 30 -8.367 3.193 -8.433 1.00 0.19 O ATOM 304 CB LEU A 30 -5.777 5.317 -8.428 1.00 0.22 C ATOM 305 CG LEU A 30 -6.143 5.320 -6.968 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.589 4.093 -6.270 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.654 6.591 -6.299 1.00 0.28 C ATOM 0 H LEU A 30 -5.487 5.152 -10.865 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.880 3.203 -8.853 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.690 5.336 -8.513 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -6.148 6.237 -8.880 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.230 5.289 -6.888 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.866 4.118 -5.216 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.999 3.195 -6.732 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.503 4.083 -6.359 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.928 6.575 -5.244 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.570 6.657 -6.392 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.113 7.455 -6.780 1.00 0.28 H new ATOM 319 N VAL A 31 -8.485 4.996 -9.782 1.00 0.20 N ATOM 320 CA VAL A 31 -9.909 5.251 -9.575 1.00 0.19 C ATOM 321 C VAL A 31 -10.791 4.108 -10.073 1.00 0.20 C ATOM 322 O VAL A 31 -12.011 4.167 -9.955 1.00 0.23 O ATOM 323 CB VAL A 31 -10.356 6.552 -10.262 1.00 0.22 C ATOM 324 CG1 VAL A 31 -11.154 7.431 -9.325 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.176 7.318 -10.811 1.00 0.87 C ATOM 0 H VAL A 31 -8.056 5.590 -10.492 1.00 0.20 H new ATOM 0 HA VAL A 31 -10.034 5.342 -8.496 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.000 6.265 -11.093 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -11.452 8.341 -9.846 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -12.043 6.895 -8.992 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -10.542 7.691 -8.461 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.527 8.232 -11.290 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.497 7.572 -9.997 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -8.652 6.703 -11.543 1.00 0.87 H new ATOM 335 N GLN A 32 -10.190 3.065 -10.626 1.00 0.21 N ATOM 336 CA GLN A 32 -10.959 1.890 -11.012 1.00 0.23 C ATOM 337 C GLN A 32 -11.329 1.096 -9.766 1.00 0.22 C ATOM 338 O GLN A 32 -12.135 0.171 -9.814 1.00 0.28 O ATOM 339 CB GLN A 32 -10.175 1.001 -11.978 1.00 0.26 C ATOM 340 CG GLN A 32 -8.949 0.364 -11.346 1.00 0.29 C ATOM 341 CD GLN A 32 -8.210 -0.568 -12.283 1.00 0.35 C ATOM 342 OE1 GLN A 32 -7.584 -1.532 -11.842 1.00 1.02 O ATOM 343 NE2 GLN A 32 -8.269 -0.287 -13.575 1.00 0.75 N ATOM 0 H GLN A 32 -9.189 3.007 -10.815 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.862 2.225 -11.523 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.832 0.216 -12.353 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.865 1.595 -12.838 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -8.270 1.149 -11.015 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -9.253 -0.190 -10.458 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -8.800 0.522 -13.897 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -7.784 -0.880 -14.249 1.00 0.75 H new ATOM 352 N HIS A 33 -10.715 1.469 -8.650 1.00 0.17 N ATOM 353 CA HIS A 33 -11.031 0.869 -7.363 1.00 0.16 C ATOM 354 C HIS A 33 -12.038 1.741 -6.643 1.00 0.16 C ATOM 355 O HIS A 33 -12.220 1.658 -5.435 1.00 0.17 O ATOM 356 CB HIS A 33 -9.746 0.640 -6.546 1.00 0.16 C ATOM 357 CG HIS A 33 -8.797 -0.246 -7.282 1.00 0.16 C ATOM 358 ND1 HIS A 33 -9.145 -1.525 -7.636 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.559 -0.027 -7.816 1.00 0.22 C ATOM 360 CE1 HIS A 33 -8.190 -2.061 -8.354 1.00 0.27 C ATOM 361 NE2 HIS A 33 -7.214 -1.175 -8.492 1.00 0.28 N ATOM 0 H HIS A 33 -9.992 2.188 -8.612 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.483 -0.113 -7.505 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.268 1.597 -6.337 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.997 0.192 -5.585 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -10.016 -1.989 -7.379 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.967 0.872 -7.725 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -8.197 -3.060 -8.765 1.00 0.27 H new ATOM 370 N LYS A 34 -12.683 2.595 -7.425 1.00 0.19 N ATOM 371 CA LYS A 34 -13.860 3.301 -6.974 1.00 0.19 C ATOM 372 C LYS A 34 -15.049 2.356 -7.023 1.00 0.21 C ATOM 373 O LYS A 34 -15.487 1.952 -8.103 1.00 0.33 O ATOM 374 CB LYS A 34 -14.149 4.517 -7.852 1.00 0.22 C ATOM 375 CG LYS A 34 -13.348 5.734 -7.489 1.00 0.28 C ATOM 376 CD LYS A 34 -14.147 7.009 -7.700 1.00 0.69 C ATOM 377 CE LYS A 34 -14.568 7.144 -9.145 1.00 1.01 C ATOM 378 NZ LYS A 34 -15.120 8.490 -9.451 1.00 1.56 N ATOM 0 H LYS A 34 -12.403 2.813 -8.381 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.686 3.649 -5.956 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.948 4.258 -8.892 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -15.210 4.759 -7.783 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -13.035 5.668 -6.447 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.441 5.767 -8.093 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -15.028 7.002 -7.059 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -13.548 7.872 -7.409 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -13.711 6.951 -9.790 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -15.317 6.386 -9.375 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -15.394 8.533 -10.453 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -15.954 8.667 -8.856 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -14.398 9.213 -9.258 1.00 1.56 H new ATOM 392 N GLY A 35 -15.547 1.987 -5.866 1.00 0.18 N ATOM 393 CA GLY A 35 -16.652 1.066 -5.800 1.00 0.20 C ATOM 394 C GLY A 35 -16.392 -0.039 -4.807 1.00 0.17 C ATOM 395 O GLY A 35 -17.267 -0.381 -4.009 1.00 0.20 O ATOM 0 H GLY A 35 -15.204 2.310 -4.961 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.558 1.603 -5.519 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.828 0.636 -6.786 1.00 0.20 H new ATOM 399 N SER A 36 -15.193 -0.602 -4.845 1.00 0.16 N ATOM 400 CA SER A 36 -14.784 -1.548 -3.844 1.00 0.16 C ATOM 401 C SER A 36 -13.443 -1.128 -3.301 1.00 0.14 C ATOM 402 O SER A 36 -12.560 -0.738 -4.062 1.00 0.16 O ATOM 403 CB SER A 36 -14.697 -2.953 -4.425 1.00 0.20 C ATOM 404 OG SER A 36 -15.938 -3.346 -4.987 1.00 0.29 O ATOM 0 H SER A 36 -14.493 -0.413 -5.563 1.00 0.16 H new ATOM 0 HA SER A 36 -15.523 -1.564 -3.043 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.920 -2.987 -5.189 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.408 -3.656 -3.644 1.00 0.20 H new ATOM 0 HG SER A 36 -15.778 -3.865 -5.803 1.00 0.29 H new ATOM 410 N PRO A 37 -13.302 -1.167 -1.975 1.00 0.12 N ATOM 411 CA PRO A 37 -12.070 -0.860 -1.272 1.00 0.12 C ATOM 412 C PRO A 37 -10.850 -1.448 -1.933 1.00 0.12 C ATOM 413 O PRO A 37 -10.912 -2.456 -2.633 1.00 0.15 O ATOM 414 CB PRO A 37 -12.278 -1.497 0.112 1.00 0.15 C ATOM 415 CG PRO A 37 -13.535 -2.265 -0.014 1.00 0.18 C ATOM 416 CD PRO A 37 -14.336 -1.515 -1.021 1.00 0.15 C ATOM 0 HA PRO A 37 -11.885 0.214 -1.248 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.443 -2.145 0.379 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.354 -0.738 0.890 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.344 -3.287 -0.341 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -14.058 -2.329 0.940 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -15.121 -2.127 -1.465 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.820 -0.636 -0.595 1.00 0.15 H new ATOM 424 N LEU A 38 -9.755 -0.794 -1.686 1.00 0.14 N ATOM 425 CA LEU A 38 -8.476 -1.172 -2.204 1.00 0.13 C ATOM 426 C LEU A 38 -7.474 -0.994 -1.076 1.00 0.13 C ATOM 427 O LEU A 38 -7.626 -0.117 -0.249 1.00 0.20 O ATOM 428 CB LEU A 38 -8.101 -0.314 -3.422 1.00 0.16 C ATOM 429 CG LEU A 38 -8.241 1.207 -3.288 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.566 1.885 -4.461 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.702 1.643 -3.233 1.00 0.26 C ATOM 0 H LEU A 38 -9.727 0.041 -1.101 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.487 -2.207 -2.547 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -7.066 -0.535 -3.683 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.717 -0.636 -4.262 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.765 1.500 -2.352 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.667 2.966 -4.364 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.509 1.619 -4.476 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -8.035 1.559 -5.389 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.755 2.728 -3.138 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.209 1.334 -4.147 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -10.188 1.180 -2.374 1.00 0.26 H new ATOM 443 N LEU A 39 -6.510 -1.856 -0.992 1.00 0.18 N ATOM 444 CA LEU A 39 -5.491 -1.749 0.017 1.00 0.19 C ATOM 445 C LEU A 39 -4.204 -1.363 -0.655 1.00 0.18 C ATOM 446 O LEU A 39 -3.701 -2.077 -1.518 1.00 0.21 O ATOM 447 CB LEU A 39 -5.305 -3.067 0.753 1.00 0.23 C ATOM 448 CG LEU A 39 -6.082 -3.254 2.070 1.00 0.35 C ATOM 449 CD1 LEU A 39 -5.377 -2.572 3.224 1.00 1.10 C ATOM 450 CD2 LEU A 39 -7.505 -2.739 1.953 1.00 1.19 C ATOM 0 H LEU A 39 -6.403 -2.654 -1.618 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.788 -0.997 0.748 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.587 -3.874 0.077 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.243 -3.187 0.967 1.00 0.23 H new ATOM 0 HG LEU A 39 -6.120 -4.325 2.270 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -5.949 -2.722 4.140 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -4.381 -2.998 3.345 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -5.293 -1.505 3.019 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -8.024 -2.887 2.900 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -7.489 -1.677 1.710 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -8.025 -3.284 1.165 1.00 1.19 H new ATOM 462 N ILE A 40 -3.692 -0.223 -0.300 1.00 0.19 N ATOM 463 CA ILE A 40 -2.471 0.241 -0.907 1.00 0.20 C ATOM 464 C ILE A 40 -1.339 0.152 0.093 1.00 0.18 C ATOM 465 O ILE A 40 -1.481 0.582 1.238 1.00 0.20 O ATOM 466 CB ILE A 40 -2.646 1.663 -1.431 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.975 1.762 -2.168 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.507 2.036 -2.362 1.00 0.37 C ATOM 469 CD1 ILE A 40 -4.115 3.043 -2.927 1.00 0.35 C ATOM 0 H ILE A 40 -4.093 0.401 0.400 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.224 -0.394 -1.758 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.638 2.356 -0.590 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.068 0.923 -2.858 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.792 1.677 -1.451 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.652 3.054 -2.724 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.561 1.973 -1.823 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.489 1.349 -3.208 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -5.080 3.062 -3.434 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -4.051 3.884 -2.236 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.316 3.118 -3.665 1.00 0.35 H new ATOM 481 N TYR A 41 -0.237 -0.455 -0.325 1.00 0.18 N ATOM 482 CA TYR A 41 0.810 -0.814 0.607 1.00 0.19 C ATOM 483 C TYR A 41 2.084 -0.028 0.337 1.00 0.20 C ATOM 484 O TYR A 41 2.537 0.046 -0.797 1.00 0.27 O ATOM 485 CB TYR A 41 1.133 -2.322 0.509 1.00 0.20 C ATOM 486 CG TYR A 41 -0.001 -3.276 0.855 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.314 -2.970 0.514 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.228 -4.461 1.527 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.358 -3.820 0.837 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.805 -5.311 1.847 1.00 0.35 C ATOM 491 CZ TYR A 41 -2.053 -5.048 1.466 1.00 0.33 C ATOM 492 OH TYR A 41 -3.115 -5.841 1.842 1.00 0.42 O ATOM 0 H TYR A 41 -0.050 -0.705 -1.296 1.00 0.18 H new ATOM 0 HA TYR A 41 0.445 -0.576 1.606 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.463 -2.536 -0.508 1.00 0.20 H new ATOM 0 HB3 TYR A 41 1.974 -2.536 1.169 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.523 -2.051 -0.013 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.237 -4.725 1.806 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.380 -3.551 0.614 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.600 -6.206 2.416 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.246 -6.549 1.177 1.00 0.42 H new ATOM 502 N ASN A 42 2.648 0.568 1.370 1.00 0.28 N ATOM 503 CA ASN A 42 4.002 1.105 1.291 1.00 0.34 C ATOM 504 C ASN A 42 4.968 -0.030 1.572 1.00 0.37 C ATOM 505 O ASN A 42 5.321 -0.324 2.708 1.00 0.54 O ATOM 506 CB ASN A 42 4.197 2.253 2.282 1.00 0.46 C ATOM 507 CG ASN A 42 3.719 1.931 3.678 1.00 1.50 C ATOM 508 OD1 ASN A 42 4.619 1.461 4.526 1.00 2.27 O flip ATOM 509 ND2 ASN A 42 2.551 2.130 4.000 1.00 2.35 N flip ATOM 0 H ASN A 42 2.194 0.695 2.275 1.00 0.28 H new ATOM 0 HA ASN A 42 4.185 1.514 0.298 1.00 0.34 H new ATOM 0 HB2 ASN A 42 5.255 2.514 2.320 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.664 3.131 1.918 1.00 0.46 H new ATOM 0 HD21 ASN A 42 1.888 2.494 3.315 1.00 2.35 H new ATOM 0 HD22 ASN A 42 2.244 1.932 4.952 1.00 2.35 H new ATOM 516 N VAL A 43 5.414 -0.657 0.523 1.00 0.36 N ATOM 517 CA VAL A 43 6.010 -1.961 0.644 1.00 0.38 C ATOM 518 C VAL A 43 7.518 -1.898 0.498 1.00 0.42 C ATOM 519 O VAL A 43 8.058 -0.952 -0.077 1.00 0.50 O ATOM 520 CB VAL A 43 5.380 -2.909 -0.400 1.00 0.39 C ATOM 521 CG1 VAL A 43 5.390 -2.281 -1.765 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.085 -4.236 -0.463 1.00 0.98 C ATOM 0 H VAL A 43 5.378 -0.289 -0.428 1.00 0.36 H new ATOM 0 HA VAL A 43 5.809 -2.350 1.642 1.00 0.38 H new ATOM 0 HB VAL A 43 4.352 -3.083 -0.081 1.00 0.39 H new ATOM 0 HG11 VAL A 43 4.942 -2.966 -2.484 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.818 -1.353 -1.743 1.00 1.03 H new ATOM 0 HG13 VAL A 43 6.417 -2.067 -2.060 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.606 -4.868 -1.211 1.00 0.98 H new ATOM 0 HG22 VAL A 43 7.129 -4.081 -0.734 1.00 0.98 H new ATOM 0 HG23 VAL A 43 6.032 -4.723 0.511 1.00 0.98 H new ATOM 650 N GLY A 52 5.438 -11.236 5.769 1.00 0.45 N ATOM 651 CA GLY A 52 4.114 -11.828 5.616 1.00 0.51 C ATOM 652 C GLY A 52 3.210 -11.065 4.664 1.00 0.41 C ATOM 653 O GLY A 52 2.398 -11.665 3.958 1.00 0.41 O ATOM 0 HA2 GLY A 52 4.223 -12.852 5.258 1.00 0.51 H new ATOM 0 HA3 GLY A 52 3.635 -11.882 6.593 1.00 0.51 H new ATOM 657 N GLY A 53 3.355 -9.744 4.641 1.00 0.44 N ATOM 658 CA GLY A 53 2.507 -8.904 3.812 1.00 0.50 C ATOM 659 C GLY A 53 2.491 -9.309 2.350 1.00 0.36 C ATOM 660 O GLY A 53 1.562 -8.969 1.635 1.00 0.32 O ATOM 0 H GLY A 53 4.051 -9.236 5.187 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.489 -8.936 4.200 1.00 0.50 H new ATOM 0 HA3 GLY A 53 2.846 -7.871 3.890 1.00 0.50 H new ATOM 664 N TYR A 54 3.512 -10.031 1.900 1.00 0.37 N ATOM 665 CA TYR A 54 3.577 -10.467 0.511 1.00 0.36 C ATOM 666 C TYR A 54 2.447 -11.435 0.220 1.00 0.26 C ATOM 667 O TYR A 54 1.584 -11.160 -0.609 1.00 0.25 O ATOM 668 CB TYR A 54 4.900 -11.156 0.232 1.00 0.45 C ATOM 669 CG TYR A 54 5.444 -10.941 -1.159 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.620 -10.880 -2.282 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.802 -10.789 -1.336 1.00 0.53 C ATOM 672 CE1 TYR A 54 5.153 -10.679 -3.545 1.00 0.46 C ATOM 673 CE2 TYR A 54 7.346 -10.592 -2.574 1.00 0.65 C ATOM 674 CZ TYR A 54 6.524 -10.535 -3.682 1.00 0.56 C ATOM 675 OH TYR A 54 7.073 -10.349 -4.928 1.00 0.70 O ATOM 0 H TYR A 54 4.302 -10.325 2.474 1.00 0.37 H new ATOM 0 HA TYR A 54 3.486 -9.589 -0.128 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.637 -10.803 0.954 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.778 -12.226 0.398 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.552 -10.991 -2.166 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.453 -10.826 -0.475 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.509 -10.635 -4.411 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.415 -10.481 -2.685 1.00 0.65 H new ATOM 0 HH TYR A 54 8.046 -10.265 -4.847 1.00 0.70 H new ATOM 685 N GLU A 55 2.455 -12.558 0.931 1.00 0.25 N ATOM 686 CA GLU A 55 1.440 -13.592 0.776 1.00 0.27 C ATOM 687 C GLU A 55 0.057 -13.018 1.080 1.00 0.22 C ATOM 688 O GLU A 55 -0.965 -13.510 0.600 1.00 0.25 O ATOM 689 CB GLU A 55 1.785 -14.787 1.686 1.00 0.36 C ATOM 690 CG GLU A 55 1.686 -14.516 3.185 1.00 1.14 C ATOM 691 CD GLU A 55 0.320 -14.818 3.763 1.00 1.92 C ATOM 692 OE1 GLU A 55 -0.041 -16.007 3.860 1.00 2.39 O ATOM 693 OE2 GLU A 55 -0.413 -13.859 4.095 1.00 2.61 O ATOM 0 H GLU A 55 3.165 -12.776 1.630 1.00 0.25 H new ATOM 0 HA GLU A 55 1.422 -13.948 -0.254 1.00 0.27 H new ATOM 0 HB2 GLU A 55 1.120 -15.615 1.439 1.00 0.36 H new ATOM 0 HB3 GLU A 55 2.800 -15.114 1.459 1.00 0.36 H new ATOM 0 HG2 GLU A 55 2.433 -15.116 3.705 1.00 1.14 H new ATOM 0 HG3 GLU A 55 1.929 -13.470 3.374 1.00 1.14 H new ATOM 700 N THR A 56 0.061 -11.927 1.826 1.00 0.25 N ATOM 701 CA THR A 56 -1.146 -11.250 2.236 1.00 0.24 C ATOM 702 C THR A 56 -1.712 -10.429 1.094 1.00 0.21 C ATOM 703 O THR A 56 -2.826 -10.669 0.627 1.00 0.22 O ATOM 704 CB THR A 56 -0.824 -10.350 3.440 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.505 -11.170 4.570 1.00 0.33 O ATOM 706 CG2 THR A 56 -1.974 -9.421 3.770 1.00 0.25 C ATOM 0 H THR A 56 0.915 -11.485 2.165 1.00 0.25 H new ATOM 0 HA THR A 56 -1.898 -11.986 2.520 1.00 0.24 H new ATOM 0 HB THR A 56 0.032 -9.725 3.183 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.483 -12.111 4.296 1.00 0.33 H new ATOM 0 HG21 THR A 56 -1.707 -8.802 4.626 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.184 -8.783 2.912 1.00 0.25 H new ATOM 0 HG23 THR A 56 -2.860 -10.009 4.010 1.00 0.25 H new ATOM 714 N ALA A 57 -0.916 -9.496 0.624 1.00 0.19 N ATOM 715 CA ALA A 57 -1.304 -8.622 -0.456 1.00 0.20 C ATOM 716 C ALA A 57 -1.592 -9.421 -1.716 1.00 0.19 C ATOM 717 O ALA A 57 -2.493 -9.083 -2.485 1.00 0.22 O ATOM 718 CB ALA A 57 -0.201 -7.621 -0.703 1.00 0.22 C ATOM 0 H ALA A 57 0.023 -9.322 0.983 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.217 -8.094 -0.181 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.488 -6.957 -1.518 1.00 0.22 H new ATOM 0 HB2 ALA A 57 -0.033 -7.035 0.200 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.715 -8.148 -0.969 1.00 0.22 H new ATOM 724 N THR A 58 -0.830 -10.495 -1.906 1.00 0.17 N ATOM 725 CA THR A 58 -0.990 -11.347 -3.069 1.00 0.17 C ATOM 726 C THR A 58 -2.405 -11.942 -3.112 1.00 0.17 C ATOM 727 O THR A 58 -3.171 -11.716 -4.059 1.00 0.19 O ATOM 728 CB THR A 58 0.032 -12.505 -3.066 1.00 0.20 C ATOM 729 OG1 THR A 58 1.366 -11.985 -3.024 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.128 -13.378 -4.299 1.00 0.26 C ATOM 0 H THR A 58 -0.095 -10.792 -1.264 1.00 0.17 H new ATOM 0 HA THR A 58 -0.821 -10.724 -3.947 1.00 0.17 H new ATOM 0 HB THR A 58 -0.154 -13.113 -2.180 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.717 -12.059 -2.112 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.604 -14.185 -4.271 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.133 -13.800 -4.318 1.00 0.26 H new ATOM 0 HG23 THR A 58 0.030 -12.776 -5.194 1.00 0.26 H new ATOM 738 N THR A 59 -2.750 -12.679 -2.057 1.00 0.16 N ATOM 739 CA THR A 59 -4.023 -13.381 -1.985 1.00 0.17 C ATOM 740 C THR A 59 -5.201 -12.415 -1.830 1.00 0.16 C ATOM 741 O THR A 59 -6.266 -12.646 -2.387 1.00 0.19 O ATOM 742 CB THR A 59 -4.017 -14.403 -0.827 1.00 0.20 C ATOM 743 OG1 THR A 59 -3.036 -15.417 -1.087 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.383 -15.055 -0.643 1.00 0.46 C ATOM 0 H THR A 59 -2.158 -12.804 -1.236 1.00 0.16 H new ATOM 0 HA THR A 59 -4.151 -13.912 -2.928 1.00 0.17 H new ATOM 0 HB THR A 59 -3.772 -13.868 0.091 1.00 0.20 H new ATOM 0 HG1 THR A 59 -3.031 -16.064 -0.351 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.338 -15.767 0.181 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.125 -14.288 -0.420 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.664 -15.576 -1.558 1.00 0.46 H new ATOM 752 N LEU A 60 -4.999 -11.323 -1.106 1.00 0.13 N ATOM 753 CA LEU A 60 -6.060 -10.363 -0.860 1.00 0.13 C ATOM 754 C LEU A 60 -6.533 -9.757 -2.155 1.00 0.13 C ATOM 755 O LEU A 60 -7.724 -9.751 -2.460 1.00 0.15 O ATOM 756 CB LEU A 60 -5.556 -9.277 0.062 1.00 0.13 C ATOM 757 CG LEU A 60 -5.594 -9.652 1.525 1.00 0.14 C ATOM 758 CD1 LEU A 60 -4.945 -8.572 2.361 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.033 -9.860 1.947 1.00 0.35 C ATOM 0 H LEU A 60 -4.105 -11.081 -0.678 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.899 -10.877 -0.391 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.531 -9.027 -0.213 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.155 -8.379 -0.089 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.038 -10.577 1.678 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -4.980 -8.856 3.413 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -3.907 -8.448 2.053 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.480 -7.633 2.221 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.067 -10.131 3.002 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.595 -8.939 1.790 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.475 -10.660 1.353 1.00 0.35 H new ATOM 771 N TYR A 61 -5.575 -9.259 -2.909 1.00 0.14 N ATOM 772 CA TYR A 61 -5.836 -8.689 -4.207 1.00 0.15 C ATOM 773 C TYR A 61 -6.637 -9.645 -5.073 1.00 0.17 C ATOM 774 O TYR A 61 -7.708 -9.315 -5.514 1.00 0.22 O ATOM 775 CB TYR A 61 -4.528 -8.361 -4.896 1.00 0.17 C ATOM 776 CG TYR A 61 -4.752 -7.867 -6.286 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.570 -6.784 -6.503 1.00 0.16 C ATOM 778 CD2 TYR A 61 -4.176 -8.493 -7.369 1.00 0.28 C ATOM 779 CE1 TYR A 61 -5.815 -6.324 -7.769 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.404 -8.041 -8.649 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.227 -6.953 -8.848 1.00 0.23 C ATOM 782 OH TYR A 61 -5.473 -6.510 -10.127 1.00 0.28 O ATOM 0 H TYR A 61 -4.593 -9.240 -2.635 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.419 -7.779 -4.066 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.992 -7.605 -4.322 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.896 -9.249 -4.921 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.027 -6.287 -5.660 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.537 -9.350 -7.212 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.464 -5.475 -7.923 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.942 -8.535 -9.491 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.698 -6.702 -10.695 1.00 0.28 H new ATOM 792 N ASN A 62 -6.129 -10.840 -5.257 1.00 0.18 N ATOM 793 CA ASN A 62 -6.702 -11.794 -6.191 1.00 0.22 C ATOM 794 C ASN A 62 -8.017 -12.340 -5.674 1.00 0.20 C ATOM 795 O ASN A 62 -8.855 -12.793 -6.451 1.00 0.24 O ATOM 796 CB ASN A 62 -5.722 -12.935 -6.479 1.00 0.27 C ATOM 797 CG ASN A 62 -4.578 -12.496 -7.371 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.673 -12.555 -8.597 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.486 -12.051 -6.772 1.00 1.12 N ATOM 0 H ASN A 62 -5.305 -11.184 -4.765 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.897 -11.267 -7.125 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.322 -13.314 -5.539 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.255 -13.759 -6.954 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -2.689 -11.743 -7.328 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.441 -12.016 -5.754 1.00 1.12 H new ATOM 806 N LYS A 63 -8.209 -12.302 -4.361 1.00 0.18 N ATOM 807 CA LYS A 63 -9.407 -12.856 -3.788 1.00 0.20 C ATOM 808 C LYS A 63 -10.499 -11.814 -3.810 1.00 0.18 C ATOM 809 O LYS A 63 -11.682 -12.146 -3.747 1.00 0.22 O ATOM 810 CB LYS A 63 -9.152 -13.355 -2.356 1.00 0.26 C ATOM 811 CG LYS A 63 -10.378 -13.956 -1.673 1.00 0.29 C ATOM 812 CD LYS A 63 -10.002 -14.815 -0.472 1.00 0.64 C ATOM 813 CE LYS A 63 -9.355 -13.995 0.632 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.101 -14.807 1.852 1.00 1.54 N ATOM 0 H LYS A 63 -7.556 -11.898 -3.690 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.722 -13.715 -4.381 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.360 -14.104 -2.380 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -8.786 -12.524 -1.754 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.042 -13.154 -1.351 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -10.933 -14.560 -2.391 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -10.894 -15.306 -0.084 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -9.317 -15.602 -0.789 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.414 -13.579 0.271 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -10.000 -13.153 0.884 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -8.644 -14.215 2.574 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.003 -15.170 2.222 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -8.478 -15.605 1.614 1.00 1.54 H new ATOM 828 N TYR A 64 -10.121 -10.540 -3.914 1.00 0.16 N ATOM 829 CA TYR A 64 -11.119 -9.508 -3.761 1.00 0.16 C ATOM 830 C TYR A 64 -11.154 -8.494 -4.887 1.00 0.17 C ATOM 831 O TYR A 64 -12.067 -7.664 -4.943 1.00 0.17 O ATOM 832 CB TYR A 64 -10.969 -8.864 -2.401 1.00 0.15 C ATOM 833 CG TYR A 64 -11.425 -9.805 -1.322 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.721 -10.286 -1.277 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.541 -10.184 -0.325 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.121 -11.126 -0.257 1.00 0.23 C ATOM 837 CE2 TYR A 64 -10.926 -11.020 0.690 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.307 -11.587 0.605 1.00 0.24 C ATOM 839 OH TYR A 64 -12.617 -12.325 1.745 1.00 0.31 O ATOM 0 H TYR A 64 -9.171 -10.217 -4.096 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.094 -9.991 -3.825 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.928 -8.588 -2.235 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.553 -7.944 -2.361 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.425 -10.002 -2.045 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.527 -9.813 -0.348 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.163 -11.402 -0.188 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.265 -11.258 1.510 1.00 0.23 H new ATOM 0 HH TYR A 64 -12.055 -12.027 2.491 1.00 0.31 H new ATOM 849 N LYS A 65 -10.207 -8.571 -5.808 1.00 0.20 N ATOM 850 CA LYS A 65 -10.279 -7.764 -7.015 1.00 0.23 C ATOM 851 C LYS A 65 -11.495 -8.187 -7.787 1.00 0.20 C ATOM 852 O LYS A 65 -12.065 -7.419 -8.554 1.00 0.22 O ATOM 853 CB LYS A 65 -9.030 -7.897 -7.884 1.00 0.34 C ATOM 854 CG LYS A 65 -8.624 -9.323 -8.193 1.00 0.29 C ATOM 855 CD LYS A 65 -7.371 -9.342 -9.037 1.00 0.38 C ATOM 856 CE LYS A 65 -7.690 -9.214 -10.514 1.00 0.80 C ATOM 857 NZ LYS A 65 -6.467 -8.962 -11.325 1.00 1.35 N ATOM 0 H LYS A 65 -9.389 -9.176 -5.745 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.344 -6.715 -6.728 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -9.199 -7.370 -8.823 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -8.201 -7.398 -7.383 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.453 -9.869 -7.265 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.432 -9.832 -8.718 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.715 -8.526 -8.734 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.827 -10.270 -8.861 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -8.175 -10.126 -10.861 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -8.399 -8.400 -10.663 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -6.734 -8.813 -12.319 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -5.981 -8.115 -10.967 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -5.830 -9.781 -11.257 1.00 1.35 H new ATOM 871 N SER A 66 -11.891 -9.424 -7.531 1.00 0.23 N ATOM 872 CA SER A 66 -13.132 -9.971 -8.051 1.00 0.26 C ATOM 873 C SER A 66 -14.297 -8.996 -7.821 1.00 0.25 C ATOM 874 O SER A 66 -15.167 -8.843 -8.678 1.00 0.31 O ATOM 875 CB SER A 66 -13.409 -11.295 -7.353 1.00 0.32 C ATOM 876 OG SER A 66 -12.187 -11.947 -7.046 1.00 1.28 O ATOM 0 H SER A 66 -11.359 -10.077 -6.956 1.00 0.23 H new ATOM 0 HA SER A 66 -13.037 -10.128 -9.125 1.00 0.26 H new ATOM 0 HB2 SER A 66 -13.978 -11.122 -6.439 1.00 0.32 H new ATOM 0 HB3 SER A 66 -14.020 -11.932 -7.993 1.00 0.32 H new ATOM 0 HG SER A 66 -12.064 -11.971 -6.074 1.00 1.28 H new ATOM 882 N GLN A 67 -14.306 -8.332 -6.664 1.00 0.21 N ATOM 883 CA GLN A 67 -15.306 -7.304 -6.389 1.00 0.20 C ATOM 884 C GLN A 67 -14.838 -5.917 -6.858 1.00 0.20 C ATOM 885 O GLN A 67 -15.646 -5.091 -7.280 1.00 0.27 O ATOM 886 CB GLN A 67 -15.640 -7.274 -4.898 1.00 0.21 C ATOM 887 CG GLN A 67 -16.276 -8.562 -4.401 1.00 0.38 C ATOM 888 CD GLN A 67 -16.630 -8.519 -2.927 1.00 0.52 C ATOM 889 OE1 GLN A 67 -15.718 -8.974 -2.084 1.00 1.11 O flip ATOM 890 NE2 GLN A 67 -17.725 -8.098 -2.552 1.00 0.46 N flip ATOM 0 H GLN A 67 -13.637 -8.487 -5.909 1.00 0.21 H new ATOM 0 HA GLN A 67 -16.205 -7.558 -6.951 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.728 -7.085 -4.332 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.316 -6.442 -4.700 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.178 -8.762 -4.980 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.592 -9.391 -4.580 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -18.401 -7.756 -3.235 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -17.956 -8.092 -1.559 1.00 0.46 H new ATOM 899 N GLY A 68 -13.530 -5.675 -6.794 1.00 0.17 N ATOM 900 CA GLY A 68 -12.975 -4.386 -7.170 1.00 0.18 C ATOM 901 C GLY A 68 -11.749 -4.041 -6.344 1.00 0.15 C ATOM 902 O GLY A 68 -11.114 -3.004 -6.552 1.00 0.17 O ATOM 0 H GLY A 68 -12.838 -6.358 -6.485 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.710 -4.398 -8.227 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.731 -3.612 -7.040 1.00 0.18 H new ATOM 906 N PHE A 69 -11.414 -4.926 -5.412 1.00 0.14 N ATOM 907 CA PHE A 69 -10.300 -4.724 -4.492 1.00 0.13 C ATOM 908 C PHE A 69 -8.954 -4.802 -5.200 1.00 0.14 C ATOM 909 O PHE A 69 -8.778 -5.546 -6.150 1.00 0.18 O ATOM 910 CB PHE A 69 -10.356 -5.778 -3.384 1.00 0.14 C ATOM 911 CG PHE A 69 -9.280 -5.625 -2.367 1.00 0.12 C ATOM 912 CD1 PHE A 69 -9.017 -4.408 -1.757 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.544 -6.716 -2.010 1.00 0.14 C ATOM 914 CE1 PHE A 69 -8.018 -4.303 -0.809 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.567 -6.627 -1.078 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.284 -5.264 -0.499 1.00 0.14 C ATOM 0 H PHE A 69 -11.909 -5.807 -5.272 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.395 -3.724 -4.069 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.325 -5.722 -2.888 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.284 -6.769 -3.832 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.597 -3.537 -2.025 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.744 -7.668 -2.479 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.866 -3.354 -0.317 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.012 -7.498 -0.761 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.454 -5.120 0.177 1.00 0.14 H new ATOM 926 N THR A 70 -8.011 -4.002 -4.750 1.00 0.13 N ATOM 927 CA THR A 70 -6.669 -4.082 -5.237 1.00 0.12 C ATOM 928 C THR A 70 -5.732 -4.010 -4.080 1.00 0.12 C ATOM 929 O THR A 70 -6.063 -3.473 -3.043 1.00 0.19 O ATOM 930 CB THR A 70 -6.338 -2.940 -6.203 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.274 -3.315 -7.074 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.947 -1.673 -5.460 1.00 0.19 C ATOM 0 H THR A 70 -8.161 -3.285 -4.040 1.00 0.13 H new ATOM 0 HA THR A 70 -6.565 -5.024 -5.776 1.00 0.12 H new ATOM 0 HB THR A 70 -7.238 -2.740 -6.784 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.388 -4.250 -7.346 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.719 -0.885 -6.178 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.772 -1.355 -4.823 1.00 0.19 H new ATOM 0 HG23 THR A 70 -5.068 -1.868 -4.845 1.00 0.19 H new ATOM 940 N VAL A 71 -4.599 -4.583 -4.244 1.00 0.13 N ATOM 941 CA VAL A 71 -3.486 -4.223 -3.442 1.00 0.13 C ATOM 942 C VAL A 71 -2.454 -3.564 -4.326 1.00 0.13 C ATOM 943 O VAL A 71 -1.755 -4.242 -5.066 1.00 0.15 O ATOM 944 CB VAL A 71 -2.877 -5.446 -2.764 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.543 -5.090 -2.140 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.823 -5.998 -1.716 1.00 0.17 C ATOM 0 H VAL A 71 -4.414 -5.312 -4.934 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.815 -3.538 -2.661 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.713 -6.216 -3.518 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.119 -5.972 -1.659 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.862 -4.736 -2.914 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.687 -4.306 -1.397 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.372 -6.870 -1.242 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -4.016 -5.235 -0.962 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.762 -6.286 -2.189 1.00 0.17 H new ATOM 956 N LEU A 72 -2.373 -2.246 -4.292 1.00 0.17 N ATOM 957 CA LEU A 72 -1.298 -1.595 -5.034 1.00 0.22 C ATOM 958 C LEU A 72 -0.158 -1.379 -4.071 1.00 0.19 C ATOM 959 O LEU A 72 -0.326 -0.739 -3.042 1.00 0.28 O ATOM 960 CB LEU A 72 -1.635 -0.228 -5.656 1.00 0.43 C ATOM 961 CG LEU A 72 -3.056 0.042 -6.121 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.355 1.524 -6.018 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.230 -0.406 -7.553 1.00 1.00 C ATOM 0 H LEU A 72 -3.004 -1.625 -3.785 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.073 -2.255 -5.872 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -1.377 0.538 -4.925 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -0.976 -0.085 -6.513 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.745 -0.515 -5.486 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.375 1.713 -6.352 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.247 1.846 -4.982 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -2.658 2.080 -6.645 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -4.252 -0.207 -7.875 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.536 0.140 -8.192 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -3.028 -1.474 -7.627 1.00 1.00 H new ATOM 975 N ALA A 73 0.983 -1.916 -4.387 1.00 0.22 N ATOM 976 CA ALA A 73 2.120 -1.801 -3.521 1.00 0.30 C ATOM 977 C ALA A 73 3.174 -0.858 -4.099 1.00 0.23 C ATOM 978 O ALA A 73 3.543 -0.951 -5.259 1.00 0.32 O ATOM 979 CB ALA A 73 2.685 -3.181 -3.264 1.00 0.51 C ATOM 0 H ALA A 73 1.152 -2.442 -5.244 1.00 0.22 H new ATOM 0 HA ALA A 73 1.805 -1.364 -2.574 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.550 -3.103 -2.606 1.00 0.51 H new ATOM 0 HB2 ALA A 73 1.925 -3.803 -2.792 1.00 0.51 H new ATOM 0 HB3 ALA A 73 2.987 -3.632 -4.209 1.00 0.51 H new ATOM 985 N PHE A 74 3.624 0.073 -3.280 1.00 0.29 N ATOM 986 CA PHE A 74 4.667 1.018 -3.653 1.00 0.33 C ATOM 987 C PHE A 74 5.950 0.666 -2.883 1.00 0.35 C ATOM 988 O PHE A 74 6.062 0.965 -1.695 1.00 0.37 O ATOM 989 CB PHE A 74 4.208 2.445 -3.319 1.00 0.44 C ATOM 990 CG PHE A 74 3.078 2.990 -4.167 1.00 0.36 C ATOM 991 CD1 PHE A 74 2.280 2.117 -4.894 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.828 4.354 -4.265 1.00 0.41 C ATOM 993 CE1 PHE A 74 1.249 2.597 -5.701 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.808 4.833 -5.063 1.00 0.43 C ATOM 995 CZ PHE A 74 0.975 4.022 -5.677 1.00 0.35 C ATOM 0 H PHE A 74 3.276 0.198 -2.330 1.00 0.29 H new ATOM 0 HA PHE A 74 4.865 0.962 -4.723 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.898 2.471 -2.274 1.00 0.44 H new ATOM 0 HB3 PHE A 74 5.064 3.113 -3.415 1.00 0.44 H new ATOM 0 HD1 PHE A 74 2.460 1.054 -4.834 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.440 5.049 -3.709 1.00 0.41 H new ATOM 0 HE1 PHE A 74 0.673 1.929 -6.324 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.692 5.900 -5.186 1.00 0.43 H new ATOM 0 HZ PHE A 74 0.092 4.414 -6.161 1.00 0.35 H new ATOM 1005 N PRO A 75 6.928 0.019 -3.556 1.00 0.37 N ATOM 1006 CA PRO A 75 8.050 -0.688 -2.896 1.00 0.46 C ATOM 1007 C PRO A 75 9.172 0.197 -2.344 1.00 0.61 C ATOM 1008 O PRO A 75 10.341 -0.155 -2.442 1.00 1.30 O ATOM 1009 CB PRO A 75 8.574 -1.606 -3.996 1.00 0.54 C ATOM 1010 CG PRO A 75 8.232 -0.924 -5.276 1.00 0.44 C ATOM 1011 CD PRO A 75 7.011 -0.070 -5.020 1.00 0.38 C ATOM 0 HA PRO A 75 7.695 -1.193 -1.998 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.650 -1.754 -3.905 1.00 0.54 H new ATOM 0 HB3 PRO A 75 8.111 -2.591 -3.940 1.00 0.54 H new ATOM 0 HG2 PRO A 75 9.065 -0.310 -5.618 1.00 0.44 H new ATOM 0 HG3 PRO A 75 8.032 -1.655 -6.059 1.00 0.44 H new ATOM 0 HD2 PRO A 75 7.114 0.916 -5.473 1.00 0.38 H new ATOM 0 HD3 PRO A 75 6.114 -0.523 -5.442 1.00 0.38 H new ATOM 1019 N SER A 76 8.767 1.260 -1.662 1.00 0.41 N ATOM 1020 CA SER A 76 9.657 2.246 -1.012 1.00 0.37 C ATOM 1021 C SER A 76 10.839 2.759 -1.827 1.00 0.50 C ATOM 1022 O SER A 76 11.446 2.077 -2.643 1.00 0.74 O ATOM 1023 CB SER A 76 10.127 1.679 0.338 1.00 0.53 C ATOM 1024 OG SER A 76 11.075 2.510 0.974 1.00 1.44 O ATOM 0 H SER A 76 7.779 1.478 -1.535 1.00 0.41 H new ATOM 0 HA SER A 76 9.045 3.139 -0.889 1.00 0.37 H new ATOM 0 HB2 SER A 76 9.266 1.549 0.993 1.00 0.53 H new ATOM 0 HB3 SER A 76 10.561 0.691 0.182 1.00 0.53 H new ATOM 0 HG SER A 76 11.341 2.109 1.827 1.00 1.44 H new ATOM 1388 N ALA A 100 4.967 -8.743 -8.172 1.00 0.51 N ATOM 1389 CA ALA A 100 4.101 -9.718 -7.544 1.00 0.43 C ATOM 1390 C ALA A 100 2.905 -10.043 -8.415 1.00 0.40 C ATOM 1391 O ALA A 100 2.879 -9.729 -9.605 1.00 0.55 O ATOM 1392 CB ALA A 100 3.627 -9.179 -6.211 1.00 0.43 C ATOM 0 HA ALA A 100 4.669 -10.637 -7.399 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.974 -9.910 -5.734 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.487 -8.988 -5.569 1.00 0.43 H new ATOM 0 HB3 ALA A 100 3.078 -8.251 -6.368 1.00 0.43 H new ATOM 1398 N GLU A 101 1.909 -10.669 -7.807 1.00 0.34 N ATOM 1399 CA GLU A 101 0.701 -11.026 -8.514 1.00 0.40 C ATOM 1400 C GLU A 101 -0.418 -10.052 -8.159 1.00 0.43 C ATOM 1401 O GLU A 101 -1.600 -10.399 -8.169 1.00 0.67 O ATOM 1402 CB GLU A 101 0.306 -12.466 -8.192 1.00 0.50 C ATOM 1403 CG GLU A 101 1.452 -13.446 -8.374 1.00 0.67 C ATOM 1404 CD GLU A 101 1.037 -14.882 -8.165 1.00 1.24 C ATOM 1405 OE1 GLU A 101 1.014 -15.340 -7.006 1.00 1.99 O ATOM 1406 OE2 GLU A 101 0.738 -15.564 -9.163 1.00 1.57 O ATOM 0 H GLU A 101 1.919 -10.938 -6.823 1.00 0.34 H new ATOM 0 HA GLU A 101 0.880 -10.960 -9.587 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.051 -12.519 -7.163 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -0.524 -12.762 -8.833 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.863 -13.334 -9.377 1.00 0.67 H new ATOM 0 HG3 GLU A 101 2.250 -13.198 -7.674 1.00 0.67 H new ATOM 1413 N PHE A 102 -0.013 -8.833 -7.828 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.913 -7.746 -7.529 1.00 0.40 C ATOM 1415 C PHE A 102 -0.213 -6.441 -7.889 1.00 0.45 C ATOM 1416 O PHE A 102 1.000 -6.437 -8.115 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.331 -7.769 -6.056 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.201 -7.771 -5.088 1.00 0.45 C ATOM 1419 CD1 PHE A 102 0.381 -8.959 -4.706 1.00 0.52 C ATOM 1420 CD2 PHE A 102 0.260 -6.592 -4.547 1.00 0.62 C ATOM 1421 CE1 PHE A 102 1.406 -8.979 -3.793 1.00 0.59 C ATOM 1422 CE2 PHE A 102 1.295 -6.599 -3.636 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.867 -7.801 -3.259 1.00 0.44 C ATOM 0 H PHE A 102 0.972 -8.575 -7.761 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.827 -7.845 -8.114 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.960 -6.901 -5.857 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -1.944 -8.653 -5.880 1.00 0.84 H new ATOM 0 HD1 PHE A 102 0.027 -9.887 -5.130 1.00 0.52 H new ATOM 0 HD2 PHE A 102 -0.192 -5.655 -4.838 1.00 0.62 H new ATOM 0 HE1 PHE A 102 1.848 -9.918 -3.496 1.00 0.59 H new ATOM 0 HE2 PHE A 102 1.657 -5.671 -3.219 1.00 0.58 H new ATOM 0 HZ PHE A 102 2.677 -7.813 -2.544 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.955 -5.335 -7.979 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.409 -4.020 -8.338 1.00 0.39 C ATOM 1435 C PRO A 103 0.797 -3.616 -7.520 1.00 0.41 C ATOM 1436 O PRO A 103 0.819 -3.763 -6.307 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.586 -3.099 -8.080 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.742 -3.966 -8.392 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.401 -5.258 -7.739 1.00 0.27 C ATOM 0 HA PRO A 103 -0.034 -3.997 -9.361 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.608 -2.748 -7.048 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.557 -2.215 -8.717 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -3.671 -3.552 -7.999 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -2.875 -4.084 -9.467 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.641 -5.256 -6.676 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.936 -6.097 -8.185 1.00 0.27 H new ATOM 1447 N ILE A 104 1.817 -3.163 -8.222 1.00 0.35 N ATOM 1448 CA ILE A 104 2.978 -2.542 -7.616 1.00 0.35 C ATOM 1449 C ILE A 104 3.386 -1.387 -8.498 1.00 0.33 C ATOM 1450 O ILE A 104 3.332 -1.490 -9.728 1.00 0.44 O ATOM 1451 CB ILE A 104 4.177 -3.496 -7.471 1.00 0.41 C ATOM 1452 CG1 ILE A 104 3.786 -4.737 -6.668 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.355 -2.764 -6.808 1.00 0.45 C ATOM 1454 CD1 ILE A 104 4.754 -5.860 -6.852 1.00 1.34 C ATOM 0 H ILE A 104 1.863 -3.216 -9.240 1.00 0.35 H new ATOM 0 HA ILE A 104 2.703 -2.228 -6.609 1.00 0.35 H new ATOM 0 HB ILE A 104 4.486 -3.823 -8.464 1.00 0.41 H new ATOM 0 HG12 ILE A 104 3.729 -4.479 -5.610 1.00 0.52 H new ATOM 0 HG13 ILE A 104 2.791 -5.064 -6.971 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.199 -3.447 -6.710 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.647 -1.913 -7.423 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.056 -2.412 -5.821 1.00 0.45 H new ATOM 0 HD11 ILE A 104 4.432 -6.718 -6.262 1.00 1.34 H new ATOM 0 HD12 ILE A 104 4.793 -6.138 -7.905 1.00 1.34 H new ATOM 0 HD13 ILE A 104 5.744 -5.544 -6.524 1.00 1.34 H new ATOM 1466 N MET A 105 3.776 -0.296 -7.892 1.00 0.29 N ATOM 1467 CA MET A 105 4.048 0.905 -8.639 1.00 0.30 C ATOM 1468 C MET A 105 5.496 1.334 -8.471 1.00 0.27 C ATOM 1469 O MET A 105 6.276 0.660 -7.803 1.00 0.35 O ATOM 1470 CB MET A 105 3.055 1.985 -8.198 1.00 0.43 C ATOM 1471 CG MET A 105 3.646 3.234 -7.553 1.00 1.50 C ATOM 1472 SD MET A 105 3.832 4.606 -8.708 1.00 2.49 S ATOM 1473 CE MET A 105 4.008 5.983 -7.583 1.00 3.03 C ATOM 0 H MET A 105 3.912 -0.214 -6.885 1.00 0.29 H new ATOM 0 HA MET A 105 3.913 0.727 -9.706 1.00 0.30 H new ATOM 0 HB2 MET A 105 2.477 2.293 -9.069 1.00 0.43 H new ATOM 0 HB3 MET A 105 2.355 1.537 -7.493 1.00 0.43 H new ATOM 0 HG2 MET A 105 3.007 3.546 -6.727 1.00 1.50 H new ATOM 0 HG3 MET A 105 4.620 2.990 -7.128 1.00 1.50 H new ATOM 0 HE1 MET A 105 4.459 6.826 -8.107 1.00 3.03 H new ATOM 0 HE2 MET A 105 3.027 6.273 -7.206 1.00 3.03 H new ATOM 0 HE3 MET A 105 4.646 5.692 -6.748 1.00 3.03 H new ATOM 1483 N ALA A 106 5.859 2.438 -9.101 1.00 0.33 N ATOM 1484 CA ALA A 106 7.205 2.944 -9.002 1.00 0.52 C ATOM 1485 C ALA A 106 7.432 3.467 -7.596 1.00 0.66 C ATOM 1486 O ALA A 106 6.911 4.522 -7.235 1.00 1.46 O ATOM 1487 CB ALA A 106 7.458 4.026 -10.028 1.00 0.70 C ATOM 0 H ALA A 106 5.236 2.996 -9.685 1.00 0.33 H new ATOM 0 HA ALA A 106 7.908 2.136 -9.207 1.00 0.52 H new ATOM 0 HB1 ALA A 106 8.481 4.389 -9.930 1.00 0.70 H new ATOM 0 HB2 ALA A 106 7.312 3.620 -11.029 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.764 4.850 -9.866 1.00 0.70 H new ATOM 1493 N LYS A 107 8.165 2.693 -6.805 1.00 0.40 N ATOM 1494 CA LYS A 107 8.388 2.985 -5.393 1.00 0.36 C ATOM 1495 C LYS A 107 8.697 4.430 -5.138 1.00 0.38 C ATOM 1496 O LYS A 107 9.550 5.043 -5.788 1.00 0.59 O ATOM 1497 CB LYS A 107 9.526 2.132 -4.848 1.00 0.49 C ATOM 1498 CG LYS A 107 10.781 2.130 -5.703 1.00 0.84 C ATOM 1499 CD LYS A 107 11.208 0.710 -6.018 1.00 0.83 C ATOM 1500 CE LYS A 107 11.930 0.043 -4.857 1.00 0.95 C ATOM 1501 NZ LYS A 107 13.184 0.743 -4.488 1.00 1.76 N ATOM 0 H LYS A 107 8.624 1.841 -7.126 1.00 0.40 H new ATOM 0 HA LYS A 107 7.456 2.748 -4.881 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.783 2.487 -3.850 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.174 1.106 -4.740 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.598 2.675 -6.629 1.00 0.84 H new ATOM 0 HG3 LYS A 107 11.584 2.650 -5.181 1.00 0.84 H new ATOM 0 HD2 LYS A 107 10.330 0.121 -6.281 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.861 0.716 -6.891 1.00 0.83 H new ATOM 0 HE2 LYS A 107 11.268 0.012 -3.992 1.00 0.95 H new ATOM 0 HE3 LYS A 107 12.159 -0.990 -5.121 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 13.888 0.048 -4.167 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 13.553 1.253 -5.316 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 12.991 1.419 -3.722 1.00 1.76 H new ATOM 1515 N ILE A 108 8.007 4.954 -4.160 1.00 0.31 N ATOM 1516 CA ILE A 108 8.233 6.287 -3.730 1.00 0.35 C ATOM 1517 C ILE A 108 8.655 6.264 -2.278 1.00 0.36 C ATOM 1518 O ILE A 108 8.626 5.223 -1.619 1.00 0.42 O ATOM 1519 CB ILE A 108 6.988 7.192 -3.910 1.00 0.48 C ATOM 1520 CG1 ILE A 108 6.103 7.216 -2.652 1.00 0.82 C ATOM 1521 CG2 ILE A 108 6.183 6.747 -5.125 1.00 0.68 C ATOM 1522 CD1 ILE A 108 5.378 5.932 -2.351 1.00 0.64 C ATOM 0 H ILE A 108 7.276 4.461 -3.647 1.00 0.31 H new ATOM 0 HA ILE A 108 9.020 6.714 -4.352 1.00 0.35 H new ATOM 0 HB ILE A 108 7.343 8.210 -4.072 1.00 0.48 H new ATOM 0 HG12 ILE A 108 6.726 7.472 -1.795 1.00 0.82 H new ATOM 0 HG13 ILE A 108 5.367 8.013 -2.761 1.00 0.82 H new ATOM 0 HG21 ILE A 108 5.311 7.391 -5.240 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.804 6.815 -6.018 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.857 5.716 -4.988 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.783 6.054 -1.446 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.723 5.680 -3.185 1.00 0.64 H new ATOM 0 HD13 ILE A 108 6.102 5.131 -2.204 1.00 0.64 H new ATOM 1534 N ASN A 109 9.025 7.416 -1.805 1.00 0.38 N ATOM 1535 CA ASN A 109 9.570 7.591 -0.466 1.00 0.44 C ATOM 1536 C ASN A 109 8.480 7.483 0.568 1.00 0.47 C ATOM 1537 O ASN A 109 7.903 8.481 0.971 1.00 0.76 O ATOM 1538 CB ASN A 109 10.257 8.941 -0.441 1.00 0.53 C ATOM 1539 CG ASN A 109 11.015 9.289 0.835 1.00 0.98 C ATOM 1540 OD1 ASN A 109 10.505 8.903 1.990 1.00 1.73 O flip ATOM 1541 ND2 ASN A 109 12.046 9.951 0.775 1.00 1.16 N flip ATOM 0 H ASN A 109 8.961 8.284 -2.337 1.00 0.38 H new ATOM 0 HA ASN A 109 10.290 6.809 -0.224 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.955 8.985 -1.277 1.00 0.53 H new ATOM 0 HB3 ASN A 109 9.505 9.711 -0.613 1.00 0.53 H new ATOM 0 HD21 ASN A 109 12.417 10.235 -0.131 1.00 1.16 H new ATOM 0 HD22 ASN A 109 12.532 10.217 1.631 1.00 1.16 H new ATOM 1548 N VAL A 110 8.196 6.274 1.017 1.00 0.41 N ATOM 1549 CA VAL A 110 7.193 6.122 2.035 1.00 0.42 C ATOM 1550 C VAL A 110 7.831 6.347 3.386 1.00 0.44 C ATOM 1551 O VAL A 110 8.253 5.423 4.074 1.00 0.48 O ATOM 1552 CB VAL A 110 6.554 4.725 1.961 1.00 0.43 C ATOM 1553 CG1 VAL A 110 5.631 4.663 0.764 1.00 0.60 C ATOM 1554 CG2 VAL A 110 7.611 3.634 1.850 1.00 0.77 C ATOM 0 H VAL A 110 8.636 5.410 0.699 1.00 0.41 H new ATOM 0 HA VAL A 110 6.402 6.856 1.880 1.00 0.42 H new ATOM 0 HB VAL A 110 5.992 4.555 2.879 1.00 0.43 H new ATOM 0 HG11 VAL A 110 5.175 3.675 0.707 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.851 5.417 0.867 1.00 0.60 H new ATOM 0 HG13 VAL A 110 6.201 4.853 -0.145 1.00 0.60 H new ATOM 0 HG21 VAL A 110 7.125 2.660 1.800 1.00 0.77 H new ATOM 0 HG22 VAL A 110 8.203 3.791 0.948 1.00 0.77 H new ATOM 0 HG23 VAL A 110 8.263 3.669 2.723 1.00 0.77 H new ATOM 1564 N ASN A 111 7.811 7.602 3.777 1.00 0.48 N ATOM 1565 CA ASN A 111 8.361 8.039 5.035 1.00 0.56 C ATOM 1566 C ASN A 111 8.260 9.550 5.089 1.00 0.62 C ATOM 1567 O ASN A 111 7.771 10.175 4.148 1.00 0.67 O ATOM 1568 CB ASN A 111 9.806 7.569 5.240 1.00 0.65 C ATOM 1569 CG ASN A 111 10.182 7.519 6.717 1.00 1.20 C ATOM 1570 OD1 ASN A 111 9.883 6.551 7.419 1.00 1.90 O ATOM 1571 ND2 ASN A 111 10.853 8.558 7.198 1.00 1.72 N ATOM 0 H ASN A 111 7.406 8.355 3.221 1.00 0.48 H new ATOM 0 HA ASN A 111 7.790 7.591 5.848 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.932 6.580 4.799 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.485 8.241 4.715 1.00 0.65 H new ATOM 0 HD21 ASN A 111 11.138 8.572 8.177 1.00 1.72 H new ATOM 0 HD22 ASN A 111 11.084 9.343 6.588 1.00 1.72 H new ATOM 1624 N HIS A 116 4.660 10.231 -1.078 1.00 0.42 N ATOM 1625 CA HIS A 116 4.006 10.646 -2.268 1.00 0.35 C ATOM 1626 C HIS A 116 2.667 11.229 -1.907 1.00 0.29 C ATOM 1627 O HIS A 116 2.015 10.689 -1.043 1.00 0.29 O ATOM 1628 CB HIS A 116 3.901 9.408 -3.159 1.00 0.35 C ATOM 1629 CG HIS A 116 2.977 9.535 -4.293 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.663 9.733 -4.086 1.00 0.33 N ATOM 1631 CD2 HIS A 116 3.163 9.530 -5.627 1.00 0.31 C ATOM 1632 CE1 HIS A 116 1.053 9.869 -5.214 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.929 9.749 -6.192 1.00 0.32 N ATOM 0 HA HIS A 116 4.548 11.423 -2.807 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.893 9.170 -3.543 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.586 8.564 -2.546 1.00 0.35 H new ATOM 0 HD2 HIS A 116 4.097 9.383 -6.149 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.004 10.052 -5.338 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.727 9.808 -7.190 1.00 0.32 H new ATOM 1642 N PRO A 117 2.259 12.336 -2.550 1.00 0.31 N ATOM 1643 CA PRO A 117 0.993 13.022 -2.291 1.00 0.31 C ATOM 1644 C PRO A 117 -0.122 12.073 -1.845 1.00 0.26 C ATOM 1645 O PRO A 117 -0.817 12.347 -0.884 1.00 0.27 O ATOM 1646 CB PRO A 117 0.667 13.663 -3.648 1.00 0.37 C ATOM 1647 CG PRO A 117 1.903 13.522 -4.493 1.00 0.40 C ATOM 1648 CD PRO A 117 3.003 13.046 -3.587 1.00 0.38 C ATOM 0 HA PRO A 117 1.073 13.737 -1.472 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.183 13.167 -4.117 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.397 14.712 -3.527 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.737 12.812 -5.304 1.00 0.40 H new ATOM 0 HG3 PRO A 117 2.167 14.475 -4.952 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.704 12.392 -4.106 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.582 13.874 -3.179 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.258 10.950 -2.546 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.202 9.892 -2.191 1.00 0.23 C ATOM 1658 C LEU A 118 -0.934 9.305 -0.796 1.00 0.27 C ATOM 1659 O LEU A 118 -1.822 9.275 0.044 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.121 8.803 -3.249 1.00 0.24 C ATOM 1661 CG LEU A 118 -1.923 7.545 -2.980 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.393 7.825 -3.163 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.471 6.422 -3.894 1.00 0.27 C ATOM 0 H LEU A 118 0.288 10.747 -3.383 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.203 10.321 -2.155 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.452 9.223 -4.199 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.075 8.522 -3.372 1.00 0.24 H new ATOM 0 HG LEU A 118 -1.754 7.231 -1.950 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -3.963 6.917 -2.968 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.704 8.605 -2.468 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.576 8.156 -4.185 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.057 5.527 -3.687 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.615 6.718 -4.933 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.416 6.213 -3.719 1.00 0.27 H new ATOM 1675 N TYR A 119 0.300 8.872 -0.541 1.00 0.32 N ATOM 1676 CA TYR A 119 0.649 8.231 0.725 1.00 0.42 C ATOM 1677 C TYR A 119 0.819 9.252 1.811 1.00 0.40 C ATOM 1678 O TYR A 119 0.545 8.993 2.980 1.00 0.41 O ATOM 1679 CB TYR A 119 1.931 7.425 0.614 1.00 0.57 C ATOM 1680 CG TYR A 119 1.740 6.084 -0.018 1.00 0.54 C ATOM 1681 CD1 TYR A 119 0.936 5.941 -1.130 1.00 0.92 C ATOM 1682 CD2 TYR A 119 2.357 4.965 0.501 1.00 1.09 C ATOM 1683 CE1 TYR A 119 0.739 4.710 -1.708 1.00 1.74 C ATOM 1684 CE2 TYR A 119 2.174 3.731 -0.071 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.419 3.605 -1.191 1.00 2.20 C ATOM 1686 OH TYR A 119 1.139 2.381 -1.746 1.00 3.04 O ATOM 0 H TYR A 119 1.077 8.954 -1.197 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.173 7.558 0.971 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.658 7.992 0.032 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.354 7.292 1.610 1.00 0.57 H new ATOM 0 HD1 TYR A 119 0.454 6.810 -1.553 1.00 0.92 H new ATOM 0 HD2 TYR A 119 2.992 5.061 1.369 1.00 1.09 H new ATOM 0 HE1 TYR A 119 0.069 4.599 -2.548 1.00 1.74 H new ATOM 0 HE2 TYR A 119 2.632 2.859 0.371 1.00 1.88 H new ATOM 0 HH TYR A 119 1.590 2.304 -2.613 1.00 3.04 H new ATOM 1696 N GLU A 120 1.296 10.410 1.420 1.00 0.40 N ATOM 1697 CA GLU A 120 1.394 11.517 2.324 1.00 0.42 C ATOM 1698 C GLU A 120 0.003 11.851 2.746 1.00 0.37 C ATOM 1699 O GLU A 120 -0.256 12.086 3.921 1.00 0.43 O ATOM 1700 CB GLU A 120 2.057 12.708 1.635 1.00 0.50 C ATOM 1701 CG GLU A 120 3.033 13.456 2.514 1.00 0.76 C ATOM 1702 CD GLU A 120 2.380 14.083 3.726 1.00 1.58 C ATOM 1703 OE1 GLU A 120 1.725 15.137 3.579 1.00 2.44 O ATOM 1704 OE2 GLU A 120 2.518 13.522 4.835 1.00 1.93 O ATOM 0 H GLU A 120 1.623 10.605 0.474 1.00 0.40 H new ATOM 0 HA GLU A 120 2.008 11.267 3.189 1.00 0.42 H new ATOM 0 HB2 GLU A 120 2.580 12.356 0.745 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.283 13.398 1.298 1.00 0.50 H new ATOM 0 HG2 GLU A 120 3.815 12.771 2.843 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.519 14.235 1.926 1.00 0.76 H new ATOM 1711 N TYR A 121 -0.911 11.788 1.787 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.315 11.952 2.114 1.00 0.28 C ATOM 1713 C TYR A 121 -2.777 10.800 2.993 1.00 0.27 C ATOM 1714 O TYR A 121 -3.636 10.964 3.850 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.170 12.008 0.852 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.652 12.081 1.122 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.266 13.295 1.379 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.435 10.934 1.126 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -6.618 13.368 1.634 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.786 10.999 1.383 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.375 12.219 1.638 1.00 0.46 C ATOM 1722 OH TYR A 121 -8.723 12.293 1.904 1.00 0.56 O ATOM 0 H TYR A 121 -0.710 11.628 0.800 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.432 12.894 2.650 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -2.875 12.876 0.263 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -2.964 11.126 0.246 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -4.676 14.199 1.380 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -4.977 9.977 0.925 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.082 14.323 1.830 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.382 10.098 1.385 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.113 11.395 1.868 1.00 0.56 H new ATOM 1732 N MET A 122 -2.151 9.654 2.814 1.00 0.27 N ATOM 1733 CA MET A 122 -2.652 8.423 3.392 1.00 0.29 C ATOM 1734 C MET A 122 -2.381 8.374 4.878 1.00 0.33 C ATOM 1735 O MET A 122 -3.301 8.234 5.686 1.00 0.35 O ATOM 1736 CB MET A 122 -2.060 7.207 2.700 1.00 0.33 C ATOM 1737 CG MET A 122 -2.830 6.848 1.454 1.00 0.71 C ATOM 1738 SD MET A 122 -2.167 5.429 0.589 1.00 0.56 S ATOM 1739 CE MET A 122 -3.400 5.308 -0.691 1.00 0.55 C ATOM 0 H MET A 122 -1.293 9.549 2.272 1.00 0.27 H new ATOM 0 HA MET A 122 -3.731 8.403 3.240 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.020 7.405 2.441 1.00 0.33 H new ATOM 0 HB3 MET A 122 -2.062 6.360 3.386 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.867 6.648 1.723 1.00 0.71 H new ATOM 0 HG3 MET A 122 -2.835 7.705 0.780 1.00 0.71 H new ATOM 0 HE1 MET A 122 -2.919 5.061 -1.637 1.00 0.55 H new ATOM 0 HE2 MET A 122 -4.116 4.528 -0.434 1.00 0.55 H new ATOM 0 HE3 MET A 122 -3.920 6.261 -0.786 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.112 8.519 5.243 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.734 8.495 6.641 1.00 0.45 C ATOM 1751 C LYS A 123 -1.215 9.741 7.362 1.00 0.47 C ATOM 1752 O LYS A 123 -1.497 9.686 8.555 1.00 0.54 O ATOM 1753 CB LYS A 123 0.778 8.314 6.851 1.00 0.53 C ATOM 1754 CG LYS A 123 1.653 8.978 5.809 1.00 0.48 C ATOM 1755 CD LYS A 123 2.922 9.565 6.416 1.00 1.00 C ATOM 1756 CE LYS A 123 2.622 10.658 7.434 1.00 1.05 C ATOM 1757 NZ LYS A 123 1.972 11.845 6.814 1.00 1.46 N ATOM 0 H LYS A 123 -0.338 8.653 4.593 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.226 7.622 7.070 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.043 8.709 7.832 1.00 0.53 H new ATOM 0 HB3 LYS A 123 1.002 7.247 6.866 1.00 0.53 H new ATOM 0 HG2 LYS A 123 1.921 8.250 5.044 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.089 9.768 5.313 1.00 0.48 H new ATOM 0 HD2 LYS A 123 3.494 8.771 6.896 1.00 1.00 H new ATOM 0 HD3 LYS A 123 3.547 9.973 5.622 1.00 1.00 H new ATOM 0 HE2 LYS A 123 1.974 10.257 8.213 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.549 10.965 7.917 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 1.803 12.568 7.542 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 2.593 12.235 6.076 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 1.065 11.562 6.390 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.307 10.869 6.653 1.00 0.43 N ATOM 1772 CA LYS A 124 -1.723 12.091 7.316 1.00 0.50 C ATOM 1773 C LYS A 124 -3.224 12.103 7.569 1.00 0.49 C ATOM 1774 O LYS A 124 -3.698 12.754 8.498 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.269 13.359 6.586 1.00 0.56 C ATOM 1776 CG LYS A 124 -2.108 13.768 5.389 1.00 0.59 C ATOM 1777 CD LYS A 124 -1.492 14.987 4.726 1.00 0.97 C ATOM 1778 CE LYS A 124 -2.141 15.304 3.396 1.00 1.41 C ATOM 1779 NZ LYS A 124 -1.353 16.317 2.648 1.00 1.99 N ATOM 0 H LYS A 124 -1.106 10.955 5.657 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.216 12.099 8.281 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.261 14.183 7.299 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -0.241 13.216 6.253 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -2.168 12.945 4.676 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.127 13.990 5.706 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -1.588 15.847 5.389 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -0.426 14.817 4.577 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -2.226 14.394 2.803 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -3.153 15.674 3.560 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -1.818 16.517 1.740 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -1.293 17.192 3.207 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -0.395 15.952 2.473 1.00 1.99 H new ATOM 1793 N THR A 125 -3.968 11.381 6.741 1.00 0.42 N ATOM 1794 CA THR A 125 -5.410 11.268 6.933 1.00 0.44 C ATOM 1795 C THR A 125 -5.717 10.356 8.118 1.00 0.44 C ATOM 1796 O THR A 125 -6.552 10.678 8.965 1.00 0.56 O ATOM 1797 CB THR A 125 -6.122 10.744 5.666 1.00 0.49 C ATOM 1798 OG1 THR A 125 -5.978 11.691 4.602 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.601 10.491 5.919 1.00 0.59 C ATOM 0 H THR A 125 -3.603 10.869 5.938 1.00 0.42 H new ATOM 0 HA THR A 125 -5.790 12.269 7.137 1.00 0.44 H new ATOM 0 HB THR A 125 -5.656 9.798 5.390 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.343 11.345 3.940 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.069 10.123 5.006 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.713 9.748 6.709 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.082 11.420 6.224 1.00 0.59 H new ATOM 1807 N LYS A 126 -5.025 9.223 8.182 1.00 0.44 N ATOM 1808 CA LYS A 126 -5.205 8.277 9.273 1.00 0.54 C ATOM 1809 C LYS A 126 -3.932 7.476 9.535 1.00 0.57 C ATOM 1810 O LYS A 126 -3.317 6.931 8.613 1.00 0.68 O ATOM 1811 CB LYS A 126 -6.404 7.339 9.014 1.00 0.78 C ATOM 1812 CG LYS A 126 -6.766 7.139 7.548 1.00 1.26 C ATOM 1813 CD LYS A 126 -5.697 6.392 6.765 1.00 0.92 C ATOM 1814 CE LYS A 126 -5.619 4.928 7.119 1.00 1.27 C ATOM 1815 NZ LYS A 126 -5.239 4.699 8.539 1.00 1.85 N ATOM 0 H LYS A 126 -4.333 8.939 7.488 1.00 0.44 H new ATOM 0 HA LYS A 126 -5.423 8.857 10.170 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.185 6.366 9.454 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -7.275 7.736 9.536 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -7.705 6.590 7.484 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -6.933 8.112 7.085 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -5.900 6.492 5.699 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -4.728 6.857 6.950 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -6.584 4.460 6.926 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -4.892 4.440 6.470 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -4.796 3.763 8.633 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -4.567 5.433 8.841 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -6.089 4.741 9.137 1.00 1.85 H new ATOM 1985 N TRP A 137 7.687 0.755 7.806 1.00 0.69 N ATOM 1986 CA TRP A 137 7.708 -0.696 7.876 1.00 0.45 C ATOM 1987 C TRP A 137 7.657 -1.281 6.487 1.00 0.43 C ATOM 1988 O TRP A 137 7.525 -0.558 5.504 1.00 0.55 O ATOM 1989 CB TRP A 137 6.533 -1.257 8.697 1.00 0.42 C ATOM 1990 CG TRP A 137 6.668 -1.055 10.166 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.096 -1.955 11.101 1.00 0.93 C ATOM 1992 CD2 TRP A 137 6.362 0.141 10.868 1.00 1.00 C ATOM 1993 NE1 TRP A 137 7.125 -1.351 12.337 1.00 1.11 N ATOM 1994 CE2 TRP A 137 6.665 -0.071 12.216 1.00 1.16 C ATOM 1995 CE3 TRP A 137 5.873 1.379 10.470 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 6.498 0.916 13.175 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 5.706 2.360 11.417 1.00 1.97 C ATOM 1998 CH2 TRP A 137 6.019 2.127 12.760 1.00 1.97 C ATOM 0 HA TRP A 137 8.636 -0.978 8.374 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.610 -0.786 8.359 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.439 -2.324 8.495 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.369 -2.981 10.901 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.439 -1.788 13.203 1.00 1.11 H new ATOM 0 HE3 TRP A 137 5.629 1.567 9.435 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 6.738 0.735 14.212 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 5.327 3.327 11.120 1.00 1.97 H new ATOM 0 HH2 TRP A 137 5.880 2.918 13.482 1.00 1.97 H new ATOM 2009 N ASN A 138 7.826 -2.586 6.423 1.00 0.37 N ATOM 2010 CA ASN A 138 7.500 -3.382 5.243 1.00 0.38 C ATOM 2011 C ASN A 138 6.082 -3.056 4.746 1.00 0.31 C ATOM 2012 O ASN A 138 5.536 -2.014 5.050 1.00 0.30 O ATOM 2013 CB ASN A 138 7.634 -4.874 5.550 1.00 0.41 C ATOM 2014 CG ASN A 138 8.923 -5.203 6.279 1.00 1.06 C ATOM 2015 OD1 ASN A 138 8.956 -5.238 7.508 1.00 2.04 O ATOM 2016 ND2 ASN A 138 9.994 -5.430 5.532 1.00 1.40 N ATOM 0 H ASN A 138 8.198 -3.137 7.196 1.00 0.37 H new ATOM 0 HA ASN A 138 8.206 -3.130 4.452 1.00 0.38 H new ATOM 0 HB2 ASN A 138 6.786 -5.195 6.155 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.593 -5.439 4.619 1.00 0.41 H new ATOM 0 HD21 ASN A 138 10.888 -5.643 5.974 1.00 1.40 H new ATOM 0 HD22 ASN A 138 9.924 -5.391 4.515 1.00 1.40 H new ATOM 2023 N PHE A 139 5.496 -3.978 4.010 1.00 0.34 N ATOM 2024 CA PHE A 139 4.285 -3.755 3.208 1.00 0.36 C ATOM 2025 C PHE A 139 3.299 -2.662 3.724 1.00 0.32 C ATOM 2026 O PHE A 139 2.886 -1.856 2.914 1.00 0.57 O ATOM 2027 CB PHE A 139 3.573 -5.094 3.138 1.00 0.55 C ATOM 2028 CG PHE A 139 3.893 -5.912 1.915 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.180 -6.397 1.654 1.00 0.61 C ATOM 2030 CD2 PHE A 139 2.883 -6.214 1.027 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.419 -7.161 0.525 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.119 -6.975 -0.090 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.386 -7.453 -0.344 1.00 1.89 C ATOM 0 H PHE A 139 5.849 -4.933 3.944 1.00 0.34 H new ATOM 0 HA PHE A 139 4.607 -3.367 2.242 1.00 0.36 H new ATOM 0 HB2 PHE A 139 3.830 -5.674 4.024 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.497 -4.921 3.172 1.00 0.55 H new ATOM 0 HD1 PHE A 139 5.988 -6.175 2.335 1.00 0.61 H new ATOM 0 HD2 PHE A 139 1.886 -5.844 1.214 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.414 -7.529 0.323 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.311 -7.199 -0.771 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.571 -8.055 -1.221 1.00 1.89 H new ATOM 2043 N THR A 140 2.936 -2.632 5.028 1.00 0.25 N ATOM 2044 CA THR A 140 2.090 -1.572 5.620 1.00 0.25 C ATOM 2045 C THR A 140 0.965 -1.090 4.700 1.00 0.22 C ATOM 2046 O THR A 140 1.147 -0.231 3.837 1.00 0.29 O ATOM 2047 CB THR A 140 2.927 -0.365 6.072 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.086 -0.813 6.779 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.118 0.545 6.978 1.00 0.60 C ATOM 0 H THR A 140 3.223 -3.344 5.699 1.00 0.25 H new ATOM 0 HA THR A 140 1.623 -2.042 6.485 1.00 0.25 H new ATOM 0 HB THR A 140 3.225 0.191 5.183 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.809 -0.992 6.142 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.732 1.392 7.285 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.242 0.908 6.441 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.799 -0.010 7.860 1.00 0.60 H new ATOM 2057 N SER A 141 -0.208 -1.618 4.933 1.00 0.19 N ATOM 2058 CA SER A 141 -1.348 -1.354 4.081 1.00 0.20 C ATOM 2059 C SER A 141 -2.146 -0.148 4.560 1.00 0.22 C ATOM 2060 O SER A 141 -2.008 0.267 5.703 1.00 0.39 O ATOM 2061 CB SER A 141 -2.246 -2.562 4.106 1.00 0.26 C ATOM 2062 OG SER A 141 -1.490 -3.754 4.205 1.00 0.62 O ATOM 0 H SER A 141 -0.404 -2.242 5.715 1.00 0.19 H new ATOM 0 HA SER A 141 -0.984 -1.143 3.075 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.933 -2.492 4.950 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.854 -2.587 3.201 1.00 0.26 H new ATOM 0 HG SER A 141 -1.626 -4.295 3.399 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.991 0.399 3.691 1.00 0.19 N ATOM 2069 CA PHE A 142 -4.005 1.345 4.103 1.00 0.18 C ATOM 2070 C PHE A 142 -5.301 0.822 3.578 1.00 0.18 C ATOM 2071 O PHE A 142 -5.425 0.544 2.401 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.775 2.742 3.514 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.475 3.399 3.877 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -1.346 3.215 3.095 1.00 0.42 C ATOM 2075 CD2 PHE A 142 -2.394 4.236 4.977 1.00 0.35 C ATOM 2076 CE1 PHE A 142 -0.162 3.846 3.406 1.00 0.55 C ATOM 2077 CE2 PHE A 142 -1.212 4.876 5.289 1.00 0.50 C ATOM 2078 CZ PHE A 142 -0.097 4.680 4.502 1.00 0.57 C ATOM 0 H PHE A 142 -2.987 0.197 2.691 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.987 1.444 5.188 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.834 2.672 2.428 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.590 3.390 3.836 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -1.395 2.569 2.231 1.00 0.42 H new ATOM 0 HD2 PHE A 142 -3.265 4.390 5.597 1.00 0.35 H new ATOM 0 HE1 PHE A 142 0.713 3.688 2.793 1.00 0.55 H new ATOM 0 HE2 PHE A 142 -1.160 5.529 6.148 1.00 0.50 H new ATOM 0 HZ PHE A 142 0.829 5.181 4.744 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.266 0.665 4.422 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.523 0.228 3.933 1.00 0.16 C ATOM 2090 C LEU A 143 -8.225 1.407 3.335 1.00 0.15 C ATOM 2091 O LEU A 143 -8.683 2.318 4.024 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.344 -0.427 5.013 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.841 -0.445 4.731 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -10.174 -1.411 3.603 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.626 -0.788 5.977 1.00 0.43 C ATOM 0 H LEU A 143 -6.210 0.829 5.427 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.376 -0.535 3.169 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.998 -1.452 5.147 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -8.169 0.094 5.954 1.00 0.21 H new ATOM 0 HG LEU A 143 -10.130 0.557 4.415 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.249 -1.404 3.423 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.652 -1.105 2.696 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.860 -2.417 3.881 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.691 -0.794 5.746 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -10.327 -1.773 6.336 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.426 -0.045 6.749 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.223 1.389 2.034 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.811 2.412 1.238 1.00 0.14 C ATOM 2109 C ILE A 144 -10.236 1.992 0.948 1.00 0.15 C ATOM 2110 O ILE A 144 -10.480 0.838 0.615 1.00 0.19 O ATOM 2111 CB ILE A 144 -8.028 2.551 -0.071 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.518 2.657 0.167 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.538 3.733 -0.856 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.088 3.887 0.900 1.00 0.19 C ATOM 0 H ILE A 144 -7.799 0.639 1.488 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.793 3.372 1.754 1.00 0.14 H new ATOM 0 HB ILE A 144 -8.190 1.644 -0.653 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.190 1.782 0.728 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -6.009 2.627 -0.796 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -7.975 3.823 -1.785 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.594 3.590 -1.084 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.414 4.642 -0.267 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.005 3.877 1.023 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.381 4.770 0.332 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.564 3.912 1.880 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.171 2.901 1.078 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.580 2.519 1.069 1.00 0.15 C ATOM 2128 C ASP A 145 -13.139 2.536 -0.356 1.00 0.14 C ATOM 2129 O ASP A 145 -12.391 2.762 -1.302 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.362 3.418 2.049 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.500 4.202 1.420 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -14.235 5.244 0.792 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.661 3.756 1.535 1.00 0.75 O ATOM 0 H ASP A 145 -10.996 3.900 1.190 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.692 1.492 1.417 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -13.765 2.796 2.848 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.667 4.119 2.511 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.431 2.264 -0.506 1.00 0.17 N ATOM 2139 CA ARG A 146 -15.067 2.166 -1.817 1.00 0.17 C ATOM 2140 C ARG A 146 -14.825 3.414 -2.662 1.00 0.18 C ATOM 2141 O ARG A 146 -14.528 3.316 -3.847 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.565 1.934 -1.658 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.900 0.702 -0.839 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.389 0.429 -0.833 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.143 1.553 -0.288 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.297 1.989 -0.782 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -20.830 1.404 -1.849 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -20.914 3.014 -0.209 1.00 2.22 N ATOM 0 H ARG A 146 -15.067 2.105 0.276 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.617 1.319 -2.335 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -17.012 2.808 -1.185 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -17.017 1.839 -2.645 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.372 -0.161 -1.245 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.550 0.837 0.184 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.725 0.224 -1.849 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.592 -0.465 -0.244 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.759 2.035 0.525 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.353 0.618 -2.291 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -21.716 1.741 -2.226 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.502 3.465 0.608 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -21.800 3.351 -0.586 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.930 4.587 -2.056 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.724 5.830 -2.789 1.00 0.21 C ATOM 2164 C ASP A 147 -13.284 6.272 -2.624 1.00 0.18 C ATOM 2165 O ASP A 147 -12.960 7.453 -2.760 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.663 6.934 -2.295 1.00 0.28 C ATOM 2167 CG ASP A 147 -17.121 6.580 -2.463 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.691 6.882 -3.533 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.705 5.998 -1.528 1.00 2.00 O ATOM 0 H ASP A 147 -15.154 4.706 -1.068 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.944 5.650 -3.841 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.461 7.133 -1.242 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.452 7.855 -2.839 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.429 5.305 -2.318 1.00 0.16 N ATOM 2175 CA GLY A 148 -11.014 5.548 -2.195 1.00 0.16 C ATOM 2176 C GLY A 148 -10.642 6.340 -0.971 1.00 0.15 C ATOM 2177 O GLY A 148 -9.739 7.165 -1.027 1.00 0.17 O ATOM 0 H GLY A 148 -12.704 4.337 -2.150 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.491 4.592 -2.172 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.667 6.080 -3.081 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.311 6.104 0.137 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.951 6.798 1.358 1.00 0.18 C ATOM 2183 C VAL A 149 -10.179 5.887 2.311 1.00 0.17 C ATOM 2184 O VAL A 149 -10.737 4.967 2.899 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.187 7.376 2.075 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.779 8.171 3.310 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -12.993 8.244 1.125 1.00 1.12 C ATOM 0 H VAL A 149 -12.091 5.452 0.220 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.306 7.627 1.066 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.811 6.544 2.400 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.669 8.568 3.798 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.246 7.519 4.002 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -11.129 8.995 3.014 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -13.862 8.644 1.647 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.373 9.067 0.769 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.323 7.645 0.276 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.869 6.130 2.444 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.010 5.422 3.397 1.00 0.20 C ATOM 2199 C PRO A 150 -8.488 5.667 4.815 1.00 0.23 C ATOM 2200 O PRO A 150 -8.663 6.817 5.218 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.635 6.069 3.209 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.890 7.344 2.485 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.136 7.137 1.683 1.00 0.41 C ATOM 0 HA PRO A 150 -8.007 4.344 3.233 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.153 6.253 4.169 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -5.971 5.420 2.638 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -7.013 8.170 3.186 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.050 7.597 1.838 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.708 8.060 1.584 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.911 6.792 0.674 1.00 0.41 H new ATOM 2211 N VAL A 151 -8.710 4.610 5.572 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.204 4.766 6.930 1.00 0.29 C ATOM 2213 C VAL A 151 -8.457 3.879 7.916 1.00 0.32 C ATOM 2214 O VAL A 151 -8.242 4.259 9.066 1.00 0.61 O ATOM 2215 CB VAL A 151 -10.727 4.495 7.011 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -11.517 5.668 6.449 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.081 3.215 6.264 1.00 1.13 C ATOM 0 H VAL A 151 -8.559 3.645 5.277 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.021 5.803 7.211 1.00 0.29 H new ATOM 0 HB VAL A 151 -10.994 4.373 8.061 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -12.584 5.454 6.517 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -11.290 6.567 7.022 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.244 5.824 5.405 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.155 3.040 6.331 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -10.794 3.314 5.217 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -10.548 2.375 6.709 1.00 1.13 H new ATOM 2227 N GLU A 152 -8.012 2.726 7.456 1.00 0.19 N ATOM 2228 CA GLU A 152 -7.187 1.854 8.289 1.00 0.20 C ATOM 2229 C GLU A 152 -5.795 1.780 7.717 1.00 0.20 C ATOM 2230 O GLU A 152 -5.584 2.103 6.560 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.738 0.436 8.343 1.00 0.21 C ATOM 2232 CG GLU A 152 -9.209 0.369 8.651 1.00 0.57 C ATOM 2233 CD GLU A 152 -9.547 0.865 10.040 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -9.308 0.120 11.008 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -10.056 1.993 10.170 1.00 1.17 O ATOM 0 H GLU A 152 -8.202 2.368 6.520 1.00 0.19 H new ATOM 0 HA GLU A 152 -7.184 2.276 9.294 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.554 -0.052 7.386 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -7.192 -0.128 9.099 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.755 0.961 7.917 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.550 -0.661 8.546 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.842 1.399 8.526 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.559 0.997 8.001 1.00 0.24 C ATOM 2244 C ARG A 153 -3.044 -0.197 8.777 1.00 0.25 C ATOM 2245 O ARG A 153 -3.055 -0.207 10.012 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.533 2.131 7.962 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.165 1.745 8.505 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.125 2.817 8.260 1.00 0.47 C ATOM 2249 NE ARG A 153 -0.579 4.179 8.575 1.00 0.65 N ATOM 2250 CZ ARG A 153 0.217 5.111 9.092 1.00 1.51 C ATOM 2251 NH1 ARG A 153 1.447 4.795 9.468 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -0.220 6.353 9.249 1.00 1.85 N ATOM 0 H ARG A 153 -4.925 1.358 9.542 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.708 0.714 6.959 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.421 2.471 6.933 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.916 2.974 8.537 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.242 1.555 9.576 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.841 0.815 8.039 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.759 2.593 8.857 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.179 2.780 7.214 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.552 4.421 8.388 1.00 0.65 H new ATOM 0 HH11 ARG A 153 1.783 3.838 9.361 1.00 2.16 H new ATOM 0 HH12 ARG A 153 2.058 5.509 9.865 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -1.171 6.598 8.973 1.00 1.85 H new ATOM 0 HH22 ARG A 153 0.395 7.064 9.646 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.608 -1.194 8.042 1.00 0.24 N ATOM 2267 CA PHE A 154 -2.184 -2.448 8.616 1.00 0.22 C ATOM 2268 C PHE A 154 -0.675 -2.522 8.594 1.00 0.24 C ATOM 2269 O PHE A 154 -0.041 -2.004 7.683 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.788 -3.605 7.817 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.286 -3.657 7.899 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.913 -4.328 8.935 1.00 0.21 C ATOM 2273 CD2 PHE A 154 -5.065 -3.031 6.939 1.00 0.22 C ATOM 2274 CE1 PHE A 154 -6.292 -4.376 9.010 1.00 0.22 C ATOM 2275 CE2 PHE A 154 -6.442 -3.076 7.011 1.00 0.24 C ATOM 2276 CZ PHE A 154 -7.057 -3.748 8.047 1.00 0.22 C ATOM 0 H PHE A 154 -2.538 -1.157 7.025 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.527 -2.519 9.648 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.490 -3.512 6.773 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.377 -4.546 8.183 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.319 -4.819 9.692 1.00 0.21 H new ATOM 0 HD2 PHE A 154 -4.589 -2.502 6.126 1.00 0.22 H new ATOM 0 HE1 PHE A 154 -6.771 -4.904 9.821 1.00 0.22 H new ATOM 0 HE2 PHE A 154 -7.039 -2.585 6.256 1.00 0.24 H new ATOM 0 HZ PHE A 154 -8.135 -3.783 8.105 1.00 0.22 H new ATOM 2286 N SER A 155 -0.099 -3.141 9.600 1.00 0.22 N ATOM 2287 CA SER A 155 1.334 -3.323 9.632 1.00 0.25 C ATOM 2288 C SER A 155 1.707 -4.480 8.715 1.00 0.22 C ATOM 2289 O SER A 155 0.849 -5.297 8.403 1.00 0.26 O ATOM 2290 CB SER A 155 1.788 -3.579 11.070 1.00 0.35 C ATOM 2291 OG SER A 155 0.875 -4.427 11.747 1.00 1.11 O ATOM 0 H SER A 155 -0.598 -3.525 10.403 1.00 0.22 H new ATOM 0 HA SER A 155 1.839 -2.424 9.278 1.00 0.25 H new ATOM 0 HB2 SER A 155 2.779 -4.034 11.067 1.00 0.35 H new ATOM 0 HB3 SER A 155 1.874 -2.632 11.602 1.00 0.35 H new ATOM 0 HG SER A 155 1.187 -4.578 12.664 1.00 1.11 H new ATOM 2297 N PRO A 156 2.955 -4.565 8.235 1.00 0.25 N ATOM 2298 CA PRO A 156 3.376 -5.680 7.384 1.00 0.29 C ATOM 2299 C PRO A 156 3.120 -7.008 8.072 1.00 0.39 C ATOM 2300 O PRO A 156 2.607 -7.950 7.475 1.00 0.78 O ATOM 2301 CB PRO A 156 4.879 -5.452 7.197 1.00 0.34 C ATOM 2302 CG PRO A 156 5.264 -4.448 8.232 1.00 0.36 C ATOM 2303 CD PRO A 156 4.040 -3.614 8.478 1.00 0.33 C ATOM 0 HA PRO A 156 2.833 -5.716 6.440 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.435 -6.380 7.325 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.098 -5.085 6.194 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.592 -4.939 9.148 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.093 -3.831 7.887 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.015 -3.220 9.494 1.00 0.33 H new ATOM 0 HD3 PRO A 156 3.989 -2.759 7.804 1.00 0.33 H new ATOM 2311 N GLY A 157 3.492 -7.043 9.344 1.00 0.36 N ATOM 2312 CA GLY A 157 3.205 -8.162 10.215 1.00 0.46 C ATOM 2313 C GLY A 157 1.730 -8.571 10.257 1.00 0.41 C ATOM 2314 O GLY A 157 1.410 -9.669 10.716 1.00 0.50 O ATOM 0 H GLY A 157 4.005 -6.288 9.799 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.798 -9.018 9.893 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.529 -7.912 11.225 1.00 0.46 H new ATOM 2318 N ALA A 158 0.831 -7.704 9.788 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.582 -8.052 9.691 1.00 0.31 C ATOM 2320 C ALA A 158 -0.843 -8.729 8.352 1.00 0.34 C ATOM 2321 O ALA A 158 -0.342 -8.288 7.319 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.456 -6.815 9.851 1.00 0.37 C ATOM 0 H ALA A 158 1.057 -6.761 9.472 1.00 0.34 H new ATOM 0 HA ALA A 158 -0.836 -8.742 10.496 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.506 -7.099 9.775 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.272 -6.363 10.826 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.217 -6.097 9.067 1.00 0.37 H new ATOM 2328 N SER A 159 -1.627 -9.794 8.363 1.00 0.26 N ATOM 2329 CA SER A 159 -1.772 -10.624 7.190 1.00 0.30 C ATOM 2330 C SER A 159 -3.187 -10.570 6.622 1.00 0.23 C ATOM 2331 O SER A 159 -4.012 -9.759 7.050 1.00 0.22 O ATOM 2332 CB SER A 159 -1.366 -12.059 7.532 1.00 0.41 C ATOM 2333 OG SER A 159 0.005 -12.112 7.898 1.00 1.42 O ATOM 0 H SER A 159 -2.169 -10.100 9.171 1.00 0.26 H new ATOM 0 HA SER A 159 -1.113 -10.239 6.412 1.00 0.30 H new ATOM 0 HB2 SER A 159 -1.982 -12.433 8.350 1.00 0.41 H new ATOM 0 HB3 SER A 159 -1.546 -12.708 6.675 1.00 0.41 H new ATOM 0 HG SER A 159 0.250 -13.036 8.116 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.429 -11.434 5.637 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.685 -11.501 4.890 1.00 0.20 C ATOM 2341 C VAL A 160 -5.911 -11.309 5.785 1.00 0.21 C ATOM 2342 O VAL A 160 -6.703 -10.400 5.560 1.00 0.20 O ATOM 2343 CB VAL A 160 -4.798 -12.872 4.195 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.081 -12.984 3.393 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.600 -13.131 3.300 1.00 0.26 C ATOM 0 H VAL A 160 -2.742 -12.122 5.329 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.667 -10.690 4.162 1.00 0.20 H new ATOM 0 HB VAL A 160 -4.818 -13.629 4.979 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.128 -13.963 2.916 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -6.937 -12.862 4.057 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.101 -12.207 2.629 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -3.706 -14.105 2.823 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.543 -12.356 2.535 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.689 -13.118 3.898 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.043 -12.146 6.811 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.247 -12.156 7.639 1.00 0.31 C ATOM 2357 C LYS A 161 -7.337 -10.889 8.485 1.00 0.26 C ATOM 2358 O LYS A 161 -8.433 -10.392 8.758 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.279 -13.406 8.529 1.00 0.45 C ATOM 2360 CG LYS A 161 -6.186 -13.452 9.588 1.00 1.12 C ATOM 2361 CD LYS A 161 -6.119 -14.801 10.303 1.00 1.80 C ATOM 2362 CE LYS A 161 -7.376 -15.107 11.114 1.00 2.67 C ATOM 2363 NZ LYS A 161 -8.501 -15.600 10.271 1.00 3.46 N ATOM 0 H LYS A 161 -5.334 -12.824 7.089 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.113 -12.182 6.978 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -8.249 -13.461 9.023 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -7.193 -14.290 7.897 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -5.223 -13.244 9.121 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -6.362 -12.664 10.321 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -5.967 -15.590 9.566 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -5.254 -14.813 10.965 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -7.141 -15.855 11.872 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -7.691 -14.207 11.641 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -9.260 -14.889 10.254 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -8.162 -15.767 9.302 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -8.868 -16.489 10.667 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.180 -10.356 8.865 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.112 -9.138 9.661 1.00 0.27 C ATOM 2379 C ASP A 162 -6.628 -7.967 8.846 1.00 0.22 C ATOM 2380 O ASP A 162 -7.301 -7.080 9.360 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.671 -8.851 10.096 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.092 -9.913 11.006 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.304 -9.834 12.236 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.405 -10.824 10.500 1.00 1.40 O ATOM 0 H ASP A 162 -5.270 -10.754 8.631 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.727 -9.275 10.550 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.043 -8.762 9.209 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.639 -7.889 10.607 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.303 -7.981 7.566 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.717 -6.933 6.652 1.00 0.15 C ATOM 2391 C ILE A 163 -8.156 -7.130 6.203 1.00 0.14 C ATOM 2392 O ILE A 163 -8.935 -6.175 6.168 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.786 -6.889 5.421 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.392 -6.383 5.820 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.385 -6.025 4.317 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.371 -6.473 4.705 1.00 0.21 C ATOM 0 H ILE A 163 -5.746 -8.717 7.132 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.650 -5.985 7.185 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.683 -7.902 5.032 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.471 -5.346 6.146 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.036 -6.959 6.674 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.711 -6.010 3.461 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.347 -6.438 4.014 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.526 -5.009 4.686 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.411 -6.098 5.060 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.263 -7.512 4.394 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.704 -5.873 3.858 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.512 -8.368 5.874 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.845 -8.671 5.373 1.00 0.13 C ATOM 2410 C GLU A 164 -10.923 -8.164 6.320 1.00 0.15 C ATOM 2411 O GLU A 164 -11.917 -7.610 5.887 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.064 -10.172 5.199 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.410 -10.788 3.983 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.844 -12.224 3.781 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -11.038 -12.454 3.507 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -9.000 -13.132 3.885 1.00 0.67 O ATOM 0 H GLU A 164 -7.895 -9.177 5.946 1.00 0.13 H new ATOM 0 HA GLU A 164 -9.917 -8.171 4.407 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.691 -10.681 6.088 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.136 -10.362 5.149 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.663 -10.204 3.098 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.326 -10.747 4.093 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.728 -8.366 7.611 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.742 -8.007 8.595 1.00 0.21 C ATOM 2425 C GLU A 165 -12.084 -6.515 8.563 1.00 0.21 C ATOM 2426 O GLU A 165 -13.145 -6.114 9.039 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.319 -8.436 10.000 1.00 0.27 C ATOM 2428 CG GLU A 165 -9.953 -7.933 10.420 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.585 -8.380 11.818 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -10.082 -7.782 12.796 1.00 0.87 O ATOM 2431 OE2 GLU A 165 -8.776 -9.321 11.948 1.00 0.83 O ATOM 0 H GLU A 165 -9.881 -8.775 8.005 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.648 -8.549 8.325 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.060 -8.079 10.715 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.324 -9.525 10.052 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.203 -8.293 9.716 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -9.938 -6.844 10.373 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.204 -5.691 8.004 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.545 -4.293 7.783 1.00 0.20 C ATOM 2440 C LYS A 166 -11.906 -4.051 6.322 1.00 0.19 C ATOM 2441 O LYS A 166 -12.652 -3.130 5.993 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.429 -3.347 8.235 1.00 0.25 C ATOM 2443 CG LYS A 166 -10.386 -3.142 9.741 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.764 -2.797 10.285 1.00 0.58 C ATOM 2445 CE LYS A 166 -11.727 -2.480 11.771 1.00 1.09 C ATOM 2446 NZ LYS A 166 -11.406 -1.053 12.041 1.00 1.71 N ATOM 0 H LYS A 166 -10.268 -5.961 7.701 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.418 -4.072 8.398 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.470 -3.743 7.902 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.562 -2.381 7.748 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -10.017 -4.047 10.224 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.685 -2.343 9.983 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -12.164 -1.941 9.742 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -12.442 -3.632 10.109 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -12.693 -2.722 12.215 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -10.985 -3.114 12.256 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -11.326 -0.903 13.067 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -10.505 -0.807 11.584 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -12.163 -0.449 11.661 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.403 -4.915 5.465 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.620 -4.825 4.033 1.00 0.15 C ATOM 2462 C LEU A 167 -13.017 -5.304 3.635 1.00 0.15 C ATOM 2463 O LEU A 167 -13.763 -4.594 2.959 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.586 -5.688 3.323 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.948 -6.031 1.892 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.767 -4.823 1.002 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.139 -7.207 1.398 1.00 0.16 C ATOM 0 H LEU A 167 -10.826 -5.708 5.744 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.526 -3.778 3.744 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.628 -5.169 3.330 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.452 -6.612 3.885 1.00 0.13 H new ATOM 0 HG LEU A 167 -11.998 -6.321 1.859 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.031 -5.084 -0.023 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.412 -4.016 1.349 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.727 -4.497 1.038 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.417 -7.433 0.369 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.078 -6.962 1.442 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.337 -8.075 2.027 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.336 -6.522 4.057 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.571 -7.205 3.686 1.00 0.19 C ATOM 2481 C ILE A 168 -15.811 -6.341 3.937 1.00 0.22 C ATOM 2482 O ILE A 168 -16.685 -6.275 3.074 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.707 -8.554 4.427 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.510 -9.457 4.110 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.011 -9.244 4.054 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.521 -10.764 4.873 1.00 0.24 C ATOM 0 H ILE A 168 -12.737 -7.070 4.674 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.510 -7.395 2.614 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.721 -8.359 5.499 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.498 -9.670 3.041 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.589 -8.920 4.338 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.086 -10.192 4.587 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.851 -8.606 4.328 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.030 -9.429 2.980 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.645 -11.352 4.599 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.501 -10.560 5.944 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.424 -11.322 4.626 1.00 0.24 H new ATOM 2498 N PRO A 169 -15.919 -5.673 5.111 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.007 -4.728 5.370 1.00 0.29 C ATOM 2500 C PRO A 169 -17.189 -3.715 4.242 1.00 0.29 C ATOM 2501 O PRO A 169 -18.313 -3.461 3.814 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.571 -4.020 6.651 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.735 -5.021 7.362 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.042 -5.823 6.295 1.00 0.24 C ATOM 0 HA PRO A 169 -17.968 -5.237 5.451 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.005 -3.114 6.431 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.430 -3.721 7.252 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.011 -4.531 8.013 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.349 -5.663 7.994 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.039 -5.445 6.099 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -14.938 -6.868 6.585 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.088 -3.159 3.741 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.168 -2.169 2.675 1.00 0.22 C ATOM 2514 C LEU A 170 -16.440 -2.835 1.324 1.00 0.20 C ATOM 2515 O LEU A 170 -17.192 -2.297 0.513 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.905 -1.299 2.609 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.647 -0.398 3.809 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.262 0.214 3.692 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.709 0.687 3.891 1.00 0.69 C ATOM 0 H LEU A 170 -15.141 -3.375 4.053 1.00 0.22 H new ATOM 0 HA LEU A 170 -17.007 -1.513 2.907 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.044 -1.954 2.481 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.965 -0.674 1.718 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.697 -0.989 4.723 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -13.076 0.859 4.550 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.515 -0.579 3.665 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.200 0.802 2.776 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.513 1.324 4.753 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.685 1.289 2.982 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.692 0.227 3.996 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.826 -4.000 1.072 1.00 0.18 N ATOM 2532 CA LEU A 171 -16.074 -4.740 -0.177 1.00 0.20 C ATOM 2533 C LEU A 171 -17.533 -5.084 -0.287 1.00 0.27 C ATOM 2534 O LEU A 171 -18.223 -4.703 -1.235 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.290 -6.054 -0.228 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.791 -5.914 -0.349 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -13.128 -7.282 -0.344 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.433 -5.157 -1.616 1.00 0.31 C ATOM 0 H LEU A 171 -15.163 -4.447 1.705 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.754 -4.095 -0.995 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.512 -6.624 0.674 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.652 -6.640 -1.073 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.425 -5.350 0.509 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -12.048 -7.163 -0.432 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.362 -7.796 0.588 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.498 -7.869 -1.185 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.350 -5.064 -1.690 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.811 -5.699 -2.483 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.882 -4.164 -1.586 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.970 -5.830 0.700 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.338 -6.247 0.781 1.00 0.39 C ATOM 2552 C GLY A 172 -20.300 -5.078 0.879 1.00 0.66 C ATOM 2553 O GLY A 172 -21.399 -5.130 0.328 1.00 1.12 O ATOM 0 H GLY A 172 -17.383 -6.161 1.466 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.585 -6.843 -0.098 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.466 -6.892 1.650 1.00 0.39 H new