USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1061 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 126 SER OG : rot -1:sc= 0.268 USER MOD Set 1.2: A 128 SER OG : rot 89:sc= -0.0228 USER MOD Single : A 9 THR OG1 : rot 38:sc= -0.301 USER MOD Single : A 20 LYS NZ :NH3+ -123:sc= 0.368 (180deg=0.0606) USER MOD Single : A 23 GLN : amide:sc= -1.26 K(o=-1.3,f=-0.38) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.0757 K(o=-0.076,f=-2) USER MOD Single : A 28 ASN : amide:sc= 0.225 X(o=0.22,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 28:sc= 0.487 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -168:sc= 0.272 (180deg=0.02) USER MOD Single : A 39 LYS NZ :NH3+ -146:sc= -1.21 (180deg=-3.13!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ -149:sc= -0.703 (180deg=-1.28) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.0335 X(o=-0.033,f=-0.26) USER MOD Single : A 67 LYS NZ :NH3+ 168:sc= 0.726 (180deg=0.625) USER MOD Single : A 72 TYR OH : rot -90:sc= 0.145 USER MOD Single : A 74 GLN : amide:sc= -0.323 X(o=-0.32,f=-0.012) USER MOD Single : A 75 LYS NZ :NH3+ -151:sc= 0.65 (180deg=0.257) USER MOD Single : A 86 SER OG : rot 160:sc= 0.0759 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 94 LYS NZ :NH3+ -166:sc= -0.0004 (180deg=-0.138) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 143:sc= 0.784 (180deg=0.174) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 171:sc= -0.0181 (180deg=-0.125) USER MOD Single : A 104 TYR OH : rot 30:sc= -0.26 USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -33:sc= -0.488 USER MOD Single : A 111 ASN : amide:sc= 0.184 K(o=0.18,f=-2!) USER MOD Single : A 116 LYS NZ :NH3+ -150:sc= 0.467 (180deg=0.111) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -113:sc= 0.784 (180deg=-0.103) USER MOD Single : A 120 LYS NZ :NH3+ -173:sc= 0.301 (180deg=0.277) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 3.600 -0.707 13.577 1.00 51.54 N ATOM 21 CA GLY A 2 4.092 -0.790 12.197 1.00 44.50 C ATOM 22 C GLY A 2 2.964 -0.497 11.227 1.00 53.44 C ATOM 23 O GLY A 2 1.801 -0.440 11.628 1.00 34.22 O ATOM 0 HA2 GLY A 2 4.905 -0.079 12.048 1.00 44.50 H new ATOM 0 HA3 GLY A 2 4.498 -1.783 12.006 1.00 44.50 H new ATOM 27 N VAL A 3 3.297 -0.302 9.947 1.00 54.32 N ATOM 28 CA VAL A 3 2.312 0.048 8.896 1.00 0.12 C ATOM 29 C VAL A 3 2.625 -0.751 7.613 1.00 3.42 C ATOM 30 O VAL A 3 3.784 -0.931 7.259 1.00 62.35 O ATOM 31 CB VAL A 3 2.311 1.608 8.600 1.00 35.24 C ATOM 32 CG1 VAL A 3 1.428 1.982 7.388 1.00 75.03 C ATOM 33 CG2 VAL A 3 1.872 2.429 9.845 1.00 45.41 C ATOM 0 H VAL A 3 4.254 -0.380 9.602 1.00 54.32 H new ATOM 0 HA VAL A 3 1.315 -0.215 9.251 1.00 0.12 H new ATOM 0 HB VAL A 3 3.342 1.865 8.355 1.00 35.24 H new ATOM 0 HG11 VAL A 3 1.464 3.060 7.231 1.00 75.03 H new ATOM 0 HG12 VAL A 3 1.797 1.473 6.498 1.00 75.03 H new ATOM 0 HG13 VAL A 3 0.399 1.677 7.580 1.00 75.03 H new ATOM 0 HG21 VAL A 3 1.884 3.492 9.603 1.00 45.41 H new ATOM 0 HG22 VAL A 3 0.864 2.135 10.138 1.00 45.41 H new ATOM 0 HG23 VAL A 3 2.560 2.237 10.669 1.00 45.41 H new ATOM 43 N VAL A 4 1.585 -1.272 6.943 1.00 40.33 N ATOM 44 CA VAL A 4 1.723 -1.925 5.632 1.00 50.52 C ATOM 45 C VAL A 4 0.883 -1.136 4.614 1.00 34.43 C ATOM 46 O VAL A 4 -0.353 -1.125 4.698 1.00 64.43 O ATOM 47 CB VAL A 4 1.280 -3.443 5.685 1.00 32.14 C ATOM 48 CG1 VAL A 4 1.495 -4.152 4.327 1.00 23.31 C ATOM 49 CG2 VAL A 4 2.006 -4.197 6.828 1.00 13.21 C ATOM 0 H VAL A 4 0.627 -1.253 7.294 1.00 40.33 H new ATOM 0 HA VAL A 4 2.771 -1.922 5.333 1.00 50.52 H new ATOM 0 HB VAL A 4 0.210 -3.461 5.895 1.00 32.14 H new ATOM 0 HG11 VAL A 4 1.179 -5.192 4.405 1.00 23.31 H new ATOM 0 HG12 VAL A 4 0.907 -3.651 3.558 1.00 23.31 H new ATOM 0 HG13 VAL A 4 2.551 -4.113 4.059 1.00 23.31 H new ATOM 0 HG21 VAL A 4 1.682 -5.238 6.841 1.00 13.21 H new ATOM 0 HG22 VAL A 4 3.083 -4.154 6.666 1.00 13.21 H new ATOM 0 HG23 VAL A 4 1.764 -3.730 7.783 1.00 13.21 H new ATOM 59 N ILE A 5 1.564 -0.458 3.672 1.00 2.25 N ATOM 60 CA ILE A 5 0.918 0.408 2.677 1.00 63.21 C ATOM 61 C ILE A 5 0.730 -0.362 1.354 1.00 3.52 C ATOM 62 O ILE A 5 1.689 -0.615 0.638 1.00 31.22 O ATOM 63 CB ILE A 5 1.756 1.722 2.431 1.00 41.24 C ATOM 64 CG1 ILE A 5 2.007 2.479 3.776 1.00 64.50 C ATOM 65 CG2 ILE A 5 1.064 2.641 1.394 1.00 3.13 C ATOM 66 CD1 ILE A 5 2.892 3.711 3.671 1.00 22.44 C ATOM 0 H ILE A 5 2.579 -0.497 3.582 1.00 2.25 H new ATOM 0 HA ILE A 5 -0.058 0.702 3.064 1.00 63.21 H new ATOM 0 HB ILE A 5 2.723 1.432 2.021 1.00 41.24 H new ATOM 0 HG12 ILE A 5 1.044 2.777 4.191 1.00 64.50 H new ATOM 0 HG13 ILE A 5 2.459 1.786 4.485 1.00 64.50 H new ATOM 0 HG21 ILE A 5 1.665 3.538 1.245 1.00 3.13 H new ATOM 0 HG22 ILE A 5 0.964 2.110 0.447 1.00 3.13 H new ATOM 0 HG23 ILE A 5 0.076 2.922 1.759 1.00 3.13 H new ATOM 0 HD11 ILE A 5 3.004 4.163 4.656 1.00 22.44 H new ATOM 0 HD12 ILE A 5 3.872 3.424 3.290 1.00 22.44 H new ATOM 0 HD13 ILE A 5 2.435 4.430 2.991 1.00 22.44 H new ATOM 78 N LEU A 6 -0.517 -0.721 1.038 1.00 10.21 N ATOM 79 CA LEU A 6 -0.861 -1.460 -0.183 1.00 44.33 C ATOM 80 C LEU A 6 -1.325 -0.461 -1.243 1.00 60.43 C ATOM 81 O LEU A 6 -2.456 0.021 -1.194 1.00 75.30 O ATOM 82 CB LEU A 6 -1.995 -2.465 0.147 1.00 62.24 C ATOM 83 CG LEU A 6 -1.776 -3.305 1.431 1.00 32.21 C ATOM 84 CD1 LEU A 6 -3.013 -4.129 1.775 1.00 55.20 C ATOM 85 CD2 LEU A 6 -0.537 -4.187 1.306 1.00 33.54 C ATOM 0 H LEU A 6 -1.323 -0.506 1.625 1.00 10.21 H new ATOM 0 HA LEU A 6 0.002 -2.008 -0.561 1.00 44.33 H new ATOM 0 HB2 LEU A 6 -2.930 -1.914 0.247 1.00 62.24 H new ATOM 0 HB3 LEU A 6 -2.114 -3.144 -0.697 1.00 62.24 H new ATOM 0 HG LEU A 6 -1.607 -2.612 2.255 1.00 32.21 H new ATOM 0 HD11 LEU A 6 -2.825 -4.706 2.680 1.00 55.20 H new ATOM 0 HD12 LEU A 6 -3.860 -3.463 1.938 1.00 55.20 H new ATOM 0 HD13 LEU A 6 -3.238 -4.808 0.952 1.00 55.20 H new ATOM 0 HD21 LEU A 6 -0.408 -4.765 2.221 1.00 33.54 H new ATOM 0 HD22 LEU A 6 -0.657 -4.866 0.462 1.00 33.54 H new ATOM 0 HD23 LEU A 6 0.341 -3.561 1.146 1.00 33.54 H new ATOM 97 N VAL A 7 -0.445 -0.139 -2.195 1.00 14.15 N ATOM 98 CA VAL A 7 -0.753 0.830 -3.250 1.00 44.12 C ATOM 99 C VAL A 7 -1.281 0.085 -4.495 1.00 43.35 C ATOM 100 O VAL A 7 -0.508 -0.529 -5.226 1.00 61.04 O ATOM 101 CB VAL A 7 0.514 1.705 -3.594 1.00 60.03 C ATOM 102 CG1 VAL A 7 0.202 2.753 -4.684 1.00 31.13 C ATOM 103 CG2 VAL A 7 1.074 2.391 -2.325 1.00 22.43 C ATOM 0 H VAL A 7 0.492 -0.538 -2.256 1.00 14.15 H new ATOM 0 HA VAL A 7 -1.528 1.511 -2.898 1.00 44.12 H new ATOM 0 HB VAL A 7 1.276 1.033 -3.988 1.00 60.03 H new ATOM 0 HG11 VAL A 7 1.098 3.337 -4.895 1.00 31.13 H new ATOM 0 HG12 VAL A 7 -0.123 2.247 -5.593 1.00 31.13 H new ATOM 0 HG13 VAL A 7 -0.589 3.416 -4.335 1.00 31.13 H new ATOM 0 HG21 VAL A 7 1.947 2.988 -2.589 1.00 22.43 H new ATOM 0 HG22 VAL A 7 0.310 3.037 -1.893 1.00 22.43 H new ATOM 0 HG23 VAL A 7 1.361 1.632 -1.597 1.00 22.43 H new ATOM 113 N LEU A 8 -2.618 0.150 -4.707 1.00 64.32 N ATOM 114 CA LEU A 8 -3.310 -0.502 -5.839 1.00 43.02 C ATOM 115 C LEU A 8 -3.351 0.470 -7.023 1.00 25.40 C ATOM 116 O LEU A 8 -4.162 1.392 -7.038 1.00 2.11 O ATOM 117 CB LEU A 8 -4.766 -0.927 -5.451 1.00 21.12 C ATOM 118 CG LEU A 8 -4.921 -2.188 -4.536 1.00 62.32 C ATOM 119 CD1 LEU A 8 -4.312 -1.975 -3.144 1.00 44.51 C ATOM 120 CD2 LEU A 8 -6.396 -2.627 -4.443 1.00 43.33 C ATOM 0 H LEU A 8 -3.249 0.661 -4.090 1.00 64.32 H new ATOM 0 HA LEU A 8 -2.762 -1.404 -6.109 1.00 43.02 H new ATOM 0 HB2 LEU A 8 -5.242 -0.084 -4.949 1.00 21.12 H new ATOM 0 HB3 LEU A 8 -5.323 -1.106 -6.371 1.00 21.12 H new ATOM 0 HG LEU A 8 -4.357 -2.995 -5.005 1.00 62.32 H new ATOM 0 HD11 LEU A 8 -4.445 -2.877 -2.547 1.00 44.51 H new ATOM 0 HD12 LEU A 8 -3.248 -1.758 -3.242 1.00 44.51 H new ATOM 0 HD13 LEU A 8 -4.810 -1.139 -2.653 1.00 44.51 H new ATOM 0 HD21 LEU A 8 -6.475 -3.505 -3.802 1.00 43.33 H new ATOM 0 HD22 LEU A 8 -6.991 -1.816 -4.023 1.00 43.33 H new ATOM 0 HD23 LEU A 8 -6.766 -2.871 -5.439 1.00 43.33 H new ATOM 132 N THR A 9 -2.496 0.244 -8.026 1.00 10.41 N ATOM 133 CA THR A 9 -2.364 1.150 -9.167 1.00 45.14 C ATOM 134 C THR A 9 -3.004 0.527 -10.413 1.00 4.31 C ATOM 135 O THR A 9 -2.717 -0.623 -10.759 1.00 65.40 O ATOM 136 CB THR A 9 -0.846 1.431 -9.449 1.00 30.30 C ATOM 137 OG1 THR A 9 -0.140 0.187 -9.599 1.00 11.12 O ATOM 138 CG2 THR A 9 -0.180 2.252 -8.333 1.00 11.24 C ATOM 0 H THR A 9 -1.880 -0.568 -8.068 1.00 10.41 H new ATOM 0 HA THR A 9 -2.872 2.085 -8.932 1.00 45.14 H new ATOM 0 HB THR A 9 -0.797 2.016 -10.368 1.00 30.30 H new ATOM 0 HG1 THR A 9 -0.708 -0.456 -10.072 1.00 11.12 H new ATOM 0 HG21 THR A 9 0.869 2.417 -8.579 1.00 11.24 H new ATOM 0 HG22 THR A 9 -0.686 3.213 -8.237 1.00 11.24 H new ATOM 0 HG23 THR A 9 -0.250 1.709 -7.390 1.00 11.24 H new ATOM 146 N GLY A 10 -3.820 1.331 -11.119 1.00 31.52 N ATOM 147 CA GLY A 10 -4.368 0.969 -12.430 1.00 23.05 C ATOM 148 C GLY A 10 -3.387 1.288 -13.557 1.00 21.32 C ATOM 149 O GLY A 10 -3.733 1.190 -14.738 1.00 34.24 O ATOM 0 H GLY A 10 -4.116 2.251 -10.792 1.00 31.52 H new ATOM 0 HA2 GLY A 10 -4.606 -0.095 -12.444 1.00 23.05 H new ATOM 0 HA3 GLY A 10 -5.301 1.507 -12.596 1.00 23.05 H new ATOM 153 N ASP A 11 -2.159 1.679 -13.161 1.00 25.43 N ATOM 154 CA ASP A 11 -1.055 2.003 -14.060 1.00 31.23 C ATOM 155 C ASP A 11 0.251 1.585 -13.347 1.00 53.22 C ATOM 156 O ASP A 11 0.610 2.169 -12.319 1.00 34.45 O ATOM 157 CB ASP A 11 -1.078 3.530 -14.374 1.00 50.44 C ATOM 158 CG ASP A 11 -0.200 3.947 -15.568 1.00 75.51 C ATOM 159 OD1 ASP A 11 0.929 3.451 -15.692 1.00 75.04 O ATOM 160 OD2 ASP A 11 -0.642 4.782 -16.391 1.00 74.42 O ATOM 0 H ASP A 11 -1.910 1.778 -12.177 1.00 25.43 H new ATOM 0 HA ASP A 11 -1.135 1.475 -15.010 1.00 31.23 H new ATOM 0 HB2 ASP A 11 -2.106 3.832 -14.572 1.00 50.44 H new ATOM 0 HB3 ASP A 11 -0.750 4.076 -13.489 1.00 50.44 H new ATOM 165 N GLU A 12 0.953 0.582 -13.911 1.00 33.53 N ATOM 166 CA GLU A 12 2.089 -0.087 -13.236 1.00 43.11 C ATOM 167 C GLU A 12 3.338 0.812 -13.116 1.00 3.33 C ATOM 168 O GLU A 12 4.019 0.767 -12.085 1.00 22.44 O ATOM 169 CB GLU A 12 2.454 -1.416 -13.951 1.00 71.25 C ATOM 170 CG GLU A 12 3.646 -2.171 -13.307 1.00 31.11 C ATOM 171 CD GLU A 12 3.944 -3.519 -13.969 1.00 22.13 C ATOM 172 OE1 GLU A 12 4.642 -3.547 -15.006 1.00 13.44 O ATOM 173 OE2 GLU A 12 3.468 -4.555 -13.468 1.00 14.32 O ATOM 0 H GLU A 12 0.752 0.213 -14.841 1.00 33.53 H new ATOM 0 HA GLU A 12 1.754 -0.303 -12.222 1.00 43.11 H new ATOM 0 HB2 GLU A 12 1.581 -2.069 -13.951 1.00 71.25 H new ATOM 0 HB3 GLU A 12 2.692 -1.203 -14.993 1.00 71.25 H new ATOM 0 HG2 GLU A 12 4.536 -1.544 -13.362 1.00 31.11 H new ATOM 0 HG3 GLU A 12 3.435 -2.333 -12.250 1.00 31.11 H new ATOM 180 N ARG A 13 3.653 1.619 -14.161 1.00 5.21 N ATOM 181 CA ARG A 13 4.861 2.487 -14.132 1.00 3.52 C ATOM 182 C ARG A 13 4.761 3.550 -13.024 1.00 70.10 C ATOM 183 O ARG A 13 5.778 3.931 -12.460 1.00 33.13 O ATOM 184 CB ARG A 13 5.198 3.102 -15.532 1.00 13.42 C ATOM 185 CG ARG A 13 4.051 3.828 -16.274 1.00 14.25 C ATOM 186 CD ARG A 13 3.761 5.272 -15.798 1.00 42.24 C ATOM 187 NE ARG A 13 2.512 5.785 -16.387 1.00 20.51 N ATOM 188 CZ ARG A 13 2.017 7.021 -16.223 1.00 60.40 C ATOM 189 NH1 ARG A 13 2.655 7.930 -15.487 1.00 63.24 N ATOM 190 NH2 ARG A 13 0.850 7.329 -16.764 1.00 61.14 N ATOM 0 H ARG A 13 3.102 1.688 -15.017 1.00 5.21 H new ATOM 0 HA ARG A 13 5.708 1.847 -13.884 1.00 3.52 H new ATOM 0 HB2 ARG A 13 6.019 3.808 -15.403 1.00 13.42 H new ATOM 0 HB3 ARG A 13 5.564 2.301 -16.175 1.00 13.42 H new ATOM 0 HG2 ARG A 13 4.289 3.855 -17.337 1.00 14.25 H new ATOM 0 HG3 ARG A 13 3.141 3.238 -16.166 1.00 14.25 H new ATOM 0 HD2 ARG A 13 3.689 5.292 -14.711 1.00 42.24 H new ATOM 0 HD3 ARG A 13 4.591 5.923 -16.074 1.00 42.24 H new ATOM 0 HE ARG A 13 1.976 5.143 -16.971 1.00 20.51 H new ATOM 0 HH11 ARG A 13 3.538 7.692 -15.035 1.00 63.24 H new ATOM 0 HH12 ARG A 13 2.261 8.864 -15.376 1.00 63.24 H new ATOM 0 HH21 ARG A 13 0.336 6.630 -17.300 1.00 61.14 H new ATOM 0 HH22 ARG A 13 0.464 8.266 -16.646 1.00 61.14 H new ATOM 204 N ILE A 14 3.513 3.977 -12.700 1.00 32.11 N ATOM 205 CA ILE A 14 3.234 4.873 -11.557 1.00 23.11 C ATOM 206 C ILE A 14 3.692 4.207 -10.240 1.00 35.12 C ATOM 207 O ILE A 14 4.357 4.843 -9.433 1.00 4.35 O ATOM 208 CB ILE A 14 1.701 5.274 -11.475 1.00 2.21 C ATOM 209 CG1 ILE A 14 1.306 6.209 -12.668 1.00 54.53 C ATOM 210 CG2 ILE A 14 1.342 5.925 -10.113 1.00 43.42 C ATOM 211 CD1 ILE A 14 -0.130 6.723 -12.642 1.00 44.15 C ATOM 0 H ILE A 14 2.679 3.709 -13.223 1.00 32.11 H new ATOM 0 HA ILE A 14 3.798 5.793 -11.711 1.00 23.11 H new ATOM 0 HB ILE A 14 1.120 4.355 -11.553 1.00 2.21 H new ATOM 0 HG12 ILE A 14 1.981 7.065 -12.677 1.00 54.53 H new ATOM 0 HG13 ILE A 14 1.465 5.668 -13.601 1.00 54.53 H new ATOM 0 HG21 ILE A 14 0.283 6.183 -10.101 1.00 43.42 H new ATOM 0 HG22 ILE A 14 1.553 5.222 -9.307 1.00 43.42 H new ATOM 0 HG23 ILE A 14 1.937 6.827 -9.973 1.00 43.42 H new ATOM 0 HD11 ILE A 14 -0.304 7.361 -13.509 1.00 44.15 H new ATOM 0 HD12 ILE A 14 -0.819 5.879 -12.668 1.00 44.15 H new ATOM 0 HD13 ILE A 14 -0.294 7.297 -11.730 1.00 44.15 H new ATOM 223 N ALA A 15 3.358 2.908 -10.074 1.00 64.45 N ATOM 224 CA ALA A 15 3.732 2.115 -8.880 1.00 74.31 C ATOM 225 C ALA A 15 5.260 2.058 -8.681 1.00 24.33 C ATOM 226 O ALA A 15 5.748 2.079 -7.551 1.00 73.11 O ATOM 227 CB ALA A 15 3.159 0.691 -8.984 1.00 54.01 C ATOM 0 H ALA A 15 2.822 2.380 -10.763 1.00 64.45 H new ATOM 0 HA ALA A 15 3.304 2.614 -8.010 1.00 74.31 H new ATOM 0 HB1 ALA A 15 3.442 0.120 -8.100 1.00 54.01 H new ATOM 0 HB2 ALA A 15 2.072 0.740 -9.052 1.00 54.01 H new ATOM 0 HB3 ALA A 15 3.557 0.203 -9.874 1.00 54.01 H new ATOM 233 N GLU A 16 5.993 1.991 -9.804 1.00 32.12 N ATOM 234 CA GLU A 16 7.467 1.934 -9.813 1.00 13.22 C ATOM 235 C GLU A 16 8.081 3.325 -9.512 1.00 62.23 C ATOM 236 O GLU A 16 9.160 3.414 -8.914 1.00 1.21 O ATOM 237 CB GLU A 16 7.946 1.389 -11.184 1.00 34.31 C ATOM 238 CG GLU A 16 7.366 0.000 -11.558 1.00 34.35 C ATOM 239 CD GLU A 16 7.780 -0.468 -12.966 1.00 22.01 C ATOM 240 OE1 GLU A 16 7.285 0.107 -13.954 1.00 54.52 O ATOM 241 OE2 GLU A 16 8.616 -1.396 -13.095 1.00 70.41 O ATOM 0 H GLU A 16 5.580 1.975 -10.736 1.00 32.12 H new ATOM 0 HA GLU A 16 7.806 1.261 -9.026 1.00 13.22 H new ATOM 0 HB2 GLU A 16 7.674 2.104 -11.961 1.00 34.31 H new ATOM 0 HB3 GLU A 16 9.034 1.325 -11.176 1.00 34.31 H new ATOM 0 HG2 GLU A 16 7.698 -0.735 -10.825 1.00 34.35 H new ATOM 0 HG3 GLU A 16 6.278 0.039 -11.500 1.00 34.35 H new ATOM 248 N GLU A 17 7.378 4.400 -9.930 1.00 72.32 N ATOM 249 CA GLU A 17 7.777 5.802 -9.637 1.00 1.03 C ATOM 250 C GLU A 17 7.494 6.157 -8.168 1.00 60.44 C ATOM 251 O GLU A 17 8.187 6.985 -7.568 1.00 44.52 O ATOM 252 CB GLU A 17 7.020 6.793 -10.554 1.00 15.24 C ATOM 253 CG GLU A 17 7.288 6.616 -12.058 1.00 5.24 C ATOM 254 CD GLU A 17 8.760 6.805 -12.451 1.00 23.35 C ATOM 255 OE1 GLU A 17 9.231 7.959 -12.476 1.00 4.31 O ATOM 256 OE2 GLU A 17 9.464 5.812 -12.724 1.00 44.44 O ATOM 0 H GLU A 17 6.521 4.326 -10.478 1.00 72.32 H new ATOM 0 HA GLU A 17 8.847 5.884 -9.826 1.00 1.03 H new ATOM 0 HB2 GLU A 17 5.950 6.686 -10.375 1.00 15.24 H new ATOM 0 HB3 GLU A 17 7.291 7.809 -10.268 1.00 15.24 H new ATOM 0 HG2 GLU A 17 6.966 5.619 -12.360 1.00 5.24 H new ATOM 0 HG3 GLU A 17 6.679 7.330 -12.613 1.00 5.24 H new ATOM 263 N LEU A 18 6.439 5.542 -7.624 1.00 64.41 N ATOM 264 CA LEU A 18 6.060 5.676 -6.212 1.00 14.33 C ATOM 265 C LEU A 18 7.022 4.857 -5.336 1.00 40.13 C ATOM 266 O LEU A 18 7.328 5.261 -4.224 1.00 21.21 O ATOM 267 CB LEU A 18 4.595 5.210 -5.992 1.00 63.53 C ATOM 268 CG LEU A 18 3.479 6.077 -6.656 1.00 55.53 C ATOM 269 CD1 LEU A 18 2.090 5.442 -6.435 1.00 44.12 C ATOM 270 CD2 LEU A 18 3.519 7.541 -6.158 1.00 52.05 C ATOM 0 H LEU A 18 5.818 4.932 -8.155 1.00 64.41 H new ATOM 0 HA LEU A 18 6.128 6.726 -5.928 1.00 14.33 H new ATOM 0 HB2 LEU A 18 4.502 4.190 -6.366 1.00 63.53 H new ATOM 0 HB3 LEU A 18 4.406 5.175 -4.919 1.00 63.53 H new ATOM 0 HG LEU A 18 3.671 6.102 -7.729 1.00 55.53 H new ATOM 0 HD11 LEU A 18 1.327 6.062 -6.906 1.00 44.12 H new ATOM 0 HD12 LEU A 18 2.071 4.446 -6.877 1.00 44.12 H new ATOM 0 HD13 LEU A 18 1.889 5.369 -5.366 1.00 44.12 H new ATOM 0 HD21 LEU A 18 2.727 8.112 -6.643 1.00 52.05 H new ATOM 0 HD22 LEU A 18 3.372 7.562 -5.078 1.00 52.05 H new ATOM 0 HD23 LEU A 18 4.486 7.982 -6.401 1.00 52.05 H new ATOM 282 N ARG A 19 7.494 3.711 -5.875 1.00 42.54 N ATOM 283 CA ARG A 19 8.489 2.840 -5.209 1.00 54.53 C ATOM 284 C ARG A 19 9.809 3.596 -5.031 1.00 72.31 C ATOM 285 O ARG A 19 10.408 3.601 -3.949 1.00 52.54 O ATOM 286 CB ARG A 19 8.709 1.554 -6.051 1.00 31.42 C ATOM 287 CG ARG A 19 9.678 0.549 -5.409 1.00 75.24 C ATOM 288 CD ARG A 19 9.909 -0.715 -6.250 1.00 32.11 C ATOM 289 NE ARG A 19 10.836 -1.638 -5.577 1.00 75.12 N ATOM 290 CZ ARG A 19 11.520 -2.628 -6.170 1.00 35.14 C ATOM 291 NH1 ARG A 19 11.407 -2.860 -7.482 1.00 43.55 N ATOM 292 NH2 ARG A 19 12.306 -3.396 -5.435 1.00 61.54 N ATOM 0 H ARG A 19 7.195 3.363 -6.786 1.00 42.54 H new ATOM 0 HA ARG A 19 8.117 2.555 -4.225 1.00 54.53 H new ATOM 0 HB2 ARG A 19 7.747 1.066 -6.210 1.00 31.42 H new ATOM 0 HB3 ARG A 19 9.090 1.835 -7.033 1.00 31.42 H new ATOM 0 HG2 ARG A 19 10.636 1.040 -5.239 1.00 75.24 H new ATOM 0 HG3 ARG A 19 9.291 0.258 -4.432 1.00 75.24 H new ATOM 0 HD2 ARG A 19 8.957 -1.216 -6.428 1.00 32.11 H new ATOM 0 HD3 ARG A 19 10.310 -0.438 -7.225 1.00 32.11 H new ATOM 0 HE ARG A 19 10.970 -1.515 -4.573 1.00 75.12 H new ATOM 0 HH11 ARG A 19 10.792 -2.279 -8.052 1.00 43.55 H new ATOM 0 HH12 ARG A 19 11.936 -3.618 -7.913 1.00 43.55 H new ATOM 0 HH21 ARG A 19 12.386 -3.232 -4.431 1.00 61.54 H new ATOM 0 HH22 ARG A 19 12.832 -4.153 -5.871 1.00 61.54 H new ATOM 306 N LYS A 20 10.203 4.247 -6.130 1.00 44.32 N ATOM 307 CA LYS A 20 11.308 5.191 -6.208 1.00 62.44 C ATOM 308 C LYS A 20 11.163 6.291 -5.140 1.00 30.43 C ATOM 309 O LYS A 20 12.118 6.612 -4.426 1.00 52.20 O ATOM 310 CB LYS A 20 11.251 5.783 -7.643 1.00 74.02 C ATOM 311 CG LYS A 20 12.135 7.007 -7.935 1.00 22.41 C ATOM 312 CD LYS A 20 11.876 7.578 -9.355 1.00 21.13 C ATOM 313 CE LYS A 20 12.216 6.578 -10.483 1.00 24.44 C ATOM 314 NZ LYS A 20 12.012 7.155 -11.841 1.00 53.33 N ATOM 0 H LYS A 20 9.735 4.120 -7.027 1.00 44.32 H new ATOM 0 HA LYS A 20 12.267 4.710 -6.018 1.00 62.44 H new ATOM 0 HB2 LYS A 20 11.524 4.995 -8.345 1.00 74.02 H new ATOM 0 HB3 LYS A 20 10.217 6.055 -7.855 1.00 74.02 H new ATOM 0 HG2 LYS A 20 11.943 7.780 -7.191 1.00 22.41 H new ATOM 0 HG3 LYS A 20 13.185 6.728 -7.841 1.00 22.41 H new ATOM 0 HD2 LYS A 20 10.828 7.867 -9.438 1.00 21.13 H new ATOM 0 HD3 LYS A 20 12.468 8.483 -9.490 1.00 21.13 H new ATOM 0 HE2 LYS A 20 13.253 6.259 -10.380 1.00 24.44 H new ATOM 0 HE3 LYS A 20 11.596 5.688 -10.374 1.00 24.44 H new ATOM 0 HZ1 LYS A 20 11.345 6.561 -12.374 1.00 53.33 H new ATOM 0 HZ2 LYS A 20 11.627 8.117 -11.755 1.00 53.33 H new ATOM 0 HZ3 LYS A 20 12.922 7.190 -12.344 1.00 53.33 H new ATOM 328 N GLU A 21 9.931 6.799 -5.015 1.00 15.44 N ATOM 329 CA GLU A 21 9.612 7.950 -4.168 1.00 64.41 C ATOM 330 C GLU A 21 9.589 7.599 -2.653 1.00 44.42 C ATOM 331 O GLU A 21 9.914 8.450 -1.813 1.00 13.30 O ATOM 332 CB GLU A 21 8.257 8.548 -4.622 1.00 62.52 C ATOM 333 CG GLU A 21 7.950 9.934 -4.047 1.00 73.32 C ATOM 334 CD GLU A 21 9.030 10.983 -4.393 1.00 24.11 C ATOM 335 OE1 GLU A 21 8.999 11.541 -5.513 1.00 33.22 O ATOM 336 OE2 GLU A 21 9.908 11.258 -3.542 1.00 44.23 O ATOM 0 H GLU A 21 9.121 6.418 -5.504 1.00 15.44 H new ATOM 0 HA GLU A 21 10.405 8.688 -4.289 1.00 64.41 H new ATOM 0 HB2 GLU A 21 8.248 8.610 -5.710 1.00 62.52 H new ATOM 0 HB3 GLU A 21 7.458 7.864 -4.335 1.00 62.52 H new ATOM 0 HG2 GLU A 21 6.986 10.274 -4.427 1.00 73.32 H new ATOM 0 HG3 GLU A 21 7.857 9.860 -2.963 1.00 73.32 H new ATOM 343 N VAL A 22 9.202 6.347 -2.323 1.00 44.11 N ATOM 344 CA VAL A 22 9.214 5.830 -0.932 1.00 43.23 C ATOM 345 C VAL A 22 10.656 5.807 -0.392 1.00 40.21 C ATOM 346 O VAL A 22 10.916 6.226 0.740 1.00 64.13 O ATOM 347 CB VAL A 22 8.588 4.375 -0.840 1.00 63.32 C ATOM 348 CG1 VAL A 22 8.755 3.752 0.568 1.00 75.10 C ATOM 349 CG2 VAL A 22 7.101 4.380 -1.236 1.00 1.44 C ATOM 0 H VAL A 22 8.873 5.667 -3.009 1.00 44.11 H new ATOM 0 HA VAL A 22 8.602 6.499 -0.326 1.00 43.23 H new ATOM 0 HB VAL A 22 9.141 3.758 -1.548 1.00 63.32 H new ATOM 0 HG11 VAL A 22 8.311 2.757 0.581 1.00 75.10 H new ATOM 0 HG12 VAL A 22 9.815 3.679 0.810 1.00 75.10 H new ATOM 0 HG13 VAL A 22 8.257 4.381 1.306 1.00 75.10 H new ATOM 0 HG21 VAL A 22 6.702 3.369 -1.163 1.00 1.44 H new ATOM 0 HG22 VAL A 22 6.548 5.038 -0.566 1.00 1.44 H new ATOM 0 HG23 VAL A 22 6.999 4.737 -2.261 1.00 1.44 H new ATOM 359 N GLN A 23 11.570 5.341 -1.255 1.00 61.20 N ATOM 360 CA GLN A 23 13.011 5.237 -0.958 1.00 41.14 C ATOM 361 C GLN A 23 13.643 6.630 -0.758 1.00 63.43 C ATOM 362 O GLN A 23 14.573 6.791 0.038 1.00 65.21 O ATOM 363 CB GLN A 23 13.710 4.469 -2.110 1.00 31.35 C ATOM 364 CG GLN A 23 13.152 3.042 -2.330 1.00 1.34 C ATOM 365 CD GLN A 23 13.595 2.399 -3.651 1.00 64.11 C ATOM 366 OE1 GLN A 23 14.698 2.643 -4.153 1.00 40.34 O ATOM 367 NE2 GLN A 23 12.732 1.587 -4.240 1.00 40.21 N ATOM 0 H GLN A 23 11.329 5.021 -2.193 1.00 61.20 H new ATOM 0 HA GLN A 23 13.145 4.689 -0.025 1.00 41.14 H new ATOM 0 HB2 GLN A 23 13.603 5.039 -3.033 1.00 31.35 H new ATOM 0 HB3 GLN A 23 14.777 4.404 -1.898 1.00 31.35 H new ATOM 0 HG2 GLN A 23 13.470 2.407 -1.503 1.00 1.34 H new ATOM 0 HG3 GLN A 23 12.063 3.080 -2.303 1.00 1.34 H new ATOM 0 HE21 GLN A 23 11.828 1.402 -3.806 1.00 40.21 H new ATOM 0 HE22 GLN A 23 12.971 1.147 -5.128 1.00 40.21 H new ATOM 376 N LYS A 24 13.105 7.636 -1.481 1.00 73.34 N ATOM 377 CA LYS A 24 13.552 9.042 -1.376 1.00 2.23 C ATOM 378 C LYS A 24 12.966 9.723 -0.117 1.00 14.41 C ATOM 379 O LYS A 24 13.566 10.661 0.418 1.00 31.34 O ATOM 380 CB LYS A 24 13.168 9.837 -2.659 1.00 40.51 C ATOM 381 CG LYS A 24 13.850 9.345 -3.962 1.00 1.21 C ATOM 382 CD LYS A 24 15.398 9.355 -3.883 1.00 21.22 C ATOM 383 CE LYS A 24 16.077 8.966 -5.210 1.00 65.41 C ATOM 384 NZ LYS A 24 17.564 8.930 -5.088 1.00 41.03 N ATOM 0 H LYS A 24 12.350 7.497 -2.153 1.00 73.34 H new ATOM 0 HA LYS A 24 14.638 9.042 -1.281 1.00 2.23 H new ATOM 0 HB2 LYS A 24 12.087 9.786 -2.790 1.00 40.51 H new ATOM 0 HB3 LYS A 24 13.421 10.886 -2.508 1.00 40.51 H new ATOM 0 HG2 LYS A 24 13.511 8.333 -4.182 1.00 1.21 H new ATOM 0 HG3 LYS A 24 13.531 9.976 -4.792 1.00 1.21 H new ATOM 0 HD2 LYS A 24 15.734 10.349 -3.589 1.00 21.22 H new ATOM 0 HD3 LYS A 24 15.720 8.666 -3.102 1.00 21.22 H new ATOM 0 HE2 LYS A 24 15.716 7.988 -5.529 1.00 65.41 H new ATOM 0 HE3 LYS A 24 15.794 9.679 -5.985 1.00 65.41 H new ATOM 0 HZ1 LYS A 24 17.981 8.664 -6.003 1.00 41.03 H new ATOM 0 HZ2 LYS A 24 17.912 9.869 -4.809 1.00 41.03 H new ATOM 0 HZ3 LYS A 24 17.836 8.231 -4.367 1.00 41.03 H new ATOM 398 N HIS A 25 11.791 9.249 0.349 1.00 10.01 N ATOM 399 CA HIS A 25 11.137 9.777 1.574 1.00 3.33 C ATOM 400 C HIS A 25 11.715 9.108 2.839 1.00 51.11 C ATOM 401 O HIS A 25 11.645 9.687 3.932 1.00 4.22 O ATOM 402 CB HIS A 25 9.596 9.580 1.505 1.00 41.05 C ATOM 403 CG HIS A 25 8.838 10.186 2.676 1.00 1.13 C ATOM 404 ND1 HIS A 25 8.416 11.492 2.661 1.00 4.11 N ATOM 405 CD2 HIS A 25 8.477 9.634 3.862 1.00 32.53 C ATOM 406 CE1 HIS A 25 7.818 11.702 3.821 1.00 0.24 C ATOM 407 NE2 HIS A 25 7.830 10.605 4.576 1.00 75.34 N ATOM 0 H HIS A 25 11.271 8.498 -0.105 1.00 10.01 H new ATOM 0 HA HIS A 25 11.343 10.846 1.632 1.00 3.33 H new ATOM 0 HB2 HIS A 25 9.226 10.021 0.579 1.00 41.05 H new ATOM 0 HB3 HIS A 25 9.379 8.513 1.459 1.00 41.05 H new ATOM 0 HD2 HIS A 25 8.665 8.620 4.182 1.00 32.53 H new ATOM 0 HE1 HIS A 25 7.377 12.642 4.118 1.00 0.24 H new ATOM 0 HE2 HIS A 25 7.432 10.507 5.510 1.00 75.34 H new ATOM 415 N ASP A 26 12.263 7.887 2.683 1.00 20.11 N ATOM 416 CA ASP A 26 12.913 7.145 3.787 1.00 43.13 C ATOM 417 C ASP A 26 13.647 5.899 3.221 1.00 23.52 C ATOM 418 O ASP A 26 13.042 5.119 2.472 1.00 3.14 O ATOM 419 CB ASP A 26 11.868 6.726 4.861 1.00 53.55 C ATOM 420 CG ASP A 26 12.504 6.116 6.125 1.00 25.40 C ATOM 421 OD1 ASP A 26 12.847 6.877 7.067 1.00 70.41 O ATOM 422 OD2 ASP A 26 12.665 4.876 6.186 1.00 44.41 O ATOM 0 H ASP A 26 12.269 7.387 1.794 1.00 20.11 H new ATOM 0 HA ASP A 26 13.642 7.797 4.267 1.00 43.13 H new ATOM 0 HB2 ASP A 26 11.279 7.598 5.144 1.00 53.55 H new ATOM 0 HB3 ASP A 26 11.179 6.003 4.425 1.00 53.55 H new ATOM 427 N PRO A 27 14.956 5.678 3.576 1.00 32.05 N ATOM 428 CA PRO A 27 15.779 4.575 3.000 1.00 33.31 C ATOM 429 C PRO A 27 15.478 3.189 3.615 1.00 51.10 C ATOM 430 O PRO A 27 15.849 2.157 3.037 1.00 34.02 O ATOM 431 CB PRO A 27 17.222 5.031 3.330 1.00 41.11 C ATOM 432 CG PRO A 27 17.088 5.772 4.628 1.00 63.50 C ATOM 433 CD PRO A 27 15.750 6.488 4.553 1.00 31.53 C ATOM 0 HA PRO A 27 15.582 4.429 1.938 1.00 33.31 H new ATOM 0 HB2 PRO A 27 17.896 4.180 3.425 1.00 41.11 H new ATOM 0 HB3 PRO A 27 17.626 5.671 2.546 1.00 41.11 H new ATOM 0 HG2 PRO A 27 17.119 5.087 5.475 1.00 63.50 H new ATOM 0 HG3 PRO A 27 17.905 6.481 4.761 1.00 63.50 H new ATOM 0 HD2 PRO A 27 15.263 6.526 5.528 1.00 31.53 H new ATOM 0 HD3 PRO A 27 15.867 7.518 4.215 1.00 31.53 H new ATOM 441 N ASN A 28 14.807 3.175 4.783 1.00 40.33 N ATOM 442 CA ASN A 28 14.606 1.945 5.584 1.00 13.23 C ATOM 443 C ASN A 28 13.333 1.206 5.146 1.00 23.43 C ATOM 444 O ASN A 28 13.259 -0.025 5.272 1.00 12.40 O ATOM 445 CB ASN A 28 14.526 2.283 7.094 1.00 54.22 C ATOM 446 CG ASN A 28 15.655 3.195 7.571 1.00 13.51 C ATOM 447 OD1 ASN A 28 16.737 2.735 7.948 1.00 14.42 O ATOM 448 ND2 ASN A 28 15.410 4.499 7.553 1.00 40.43 N ATOM 0 H ASN A 28 14.390 4.008 5.198 1.00 40.33 H new ATOM 0 HA ASN A 28 15.462 1.293 5.413 1.00 13.23 H new ATOM 0 HB2 ASN A 28 13.569 2.762 7.302 1.00 54.22 H new ATOM 0 HB3 ASN A 28 14.550 1.357 7.668 1.00 54.22 H new ATOM 0 HD21 ASN A 28 16.128 5.157 7.857 1.00 40.43 H new ATOM 0 HD22 ASN A 28 14.504 4.843 7.235 1.00 40.43 H new ATOM 455 N VAL A 29 12.331 1.963 4.652 1.00 34.42 N ATOM 456 CA VAL A 29 11.047 1.389 4.196 1.00 20.31 C ATOM 457 C VAL A 29 11.257 0.577 2.912 1.00 55.34 C ATOM 458 O VAL A 29 11.752 1.109 1.910 1.00 55.20 O ATOM 459 CB VAL A 29 9.948 2.484 3.924 1.00 40.14 C ATOM 460 CG1 VAL A 29 8.563 1.840 3.656 1.00 71.42 C ATOM 461 CG2 VAL A 29 9.875 3.488 5.079 1.00 22.20 C ATOM 0 H VAL A 29 12.387 2.977 4.558 1.00 34.42 H new ATOM 0 HA VAL A 29 10.692 0.750 5.005 1.00 20.31 H new ATOM 0 HB VAL A 29 10.238 3.027 3.025 1.00 40.14 H new ATOM 0 HG11 VAL A 29 7.827 2.623 3.472 1.00 71.42 H new ATOM 0 HG12 VAL A 29 8.627 1.190 2.784 1.00 71.42 H new ATOM 0 HG13 VAL A 29 8.260 1.254 4.524 1.00 71.42 H new ATOM 0 HG21 VAL A 29 9.108 4.233 4.866 1.00 22.20 H new ATOM 0 HG22 VAL A 29 9.625 2.964 6.001 1.00 22.20 H new ATOM 0 HG23 VAL A 29 10.840 3.982 5.193 1.00 22.20 H new ATOM 471 N LYS A 30 10.896 -0.711 2.956 1.00 3.42 N ATOM 472 CA LYS A 30 11.038 -1.623 1.812 1.00 33.24 C ATOM 473 C LYS A 30 9.713 -1.835 1.098 1.00 14.13 C ATOM 474 O LYS A 30 8.636 -1.614 1.651 1.00 42.31 O ATOM 475 CB LYS A 30 11.670 -2.967 2.225 1.00 54.53 C ATOM 476 CG LYS A 30 13.198 -2.873 2.379 1.00 20.22 C ATOM 477 CD LYS A 30 13.898 -4.234 2.256 1.00 51.14 C ATOM 478 CE LYS A 30 13.584 -5.191 3.409 1.00 32.35 C ATOM 479 NZ LYS A 30 14.311 -6.474 3.243 1.00 33.05 N ATOM 0 H LYS A 30 10.497 -1.151 3.785 1.00 3.42 H new ATOM 0 HA LYS A 30 11.720 -1.146 1.108 1.00 33.24 H new ATOM 0 HB2 LYS A 30 11.232 -3.297 3.167 1.00 54.53 H new ATOM 0 HB3 LYS A 30 11.428 -3.724 1.479 1.00 54.53 H new ATOM 0 HG2 LYS A 30 13.593 -2.197 1.620 1.00 20.22 H new ATOM 0 HG3 LYS A 30 13.434 -2.436 3.349 1.00 20.22 H new ATOM 0 HD2 LYS A 30 13.603 -4.701 1.316 1.00 51.14 H new ATOM 0 HD3 LYS A 30 14.975 -4.076 2.209 1.00 51.14 H new ATOM 0 HE2 LYS A 30 13.863 -4.730 4.356 1.00 32.35 H new ATOM 0 HE3 LYS A 30 12.511 -5.379 3.450 1.00 32.35 H new ATOM 0 HZ1 LYS A 30 14.083 -7.107 4.036 1.00 33.05 H new ATOM 0 HZ2 LYS A 30 14.025 -6.922 2.349 1.00 33.05 H new ATOM 0 HZ3 LYS A 30 15.335 -6.293 3.228 1.00 33.05 H new ATOM 493 N THR A 31 9.837 -2.284 -0.148 1.00 43.02 N ATOM 494 CA THR A 31 8.746 -2.320 -1.120 1.00 62.12 C ATOM 495 C THR A 31 8.724 -3.686 -1.832 1.00 52.44 C ATOM 496 O THR A 31 9.757 -4.131 -2.347 1.00 12.51 O ATOM 497 CB THR A 31 8.934 -1.164 -2.158 1.00 13.32 C ATOM 498 OG1 THR A 31 10.262 -1.224 -2.713 1.00 75.23 O ATOM 499 CG2 THR A 31 8.717 0.235 -1.539 1.00 63.34 C ATOM 0 H THR A 31 10.718 -2.641 -0.519 1.00 43.02 H new ATOM 0 HA THR A 31 7.795 -2.182 -0.606 1.00 62.12 H new ATOM 0 HB THR A 31 8.180 -1.307 -2.932 1.00 13.32 H new ATOM 0 HG1 THR A 31 10.584 -2.149 -2.692 1.00 75.23 H new ATOM 0 HG21 THR A 31 8.860 0.998 -2.304 1.00 63.34 H new ATOM 0 HG22 THR A 31 7.704 0.304 -1.143 1.00 63.34 H new ATOM 0 HG23 THR A 31 9.434 0.391 -0.733 1.00 63.34 H new ATOM 507 N VAL A 32 7.544 -4.344 -1.845 1.00 13.42 N ATOM 508 CA VAL A 32 7.360 -5.692 -2.436 1.00 3.43 C ATOM 509 C VAL A 32 6.276 -5.645 -3.543 1.00 61.23 C ATOM 510 O VAL A 32 5.210 -5.069 -3.326 1.00 31.54 O ATOM 511 CB VAL A 32 6.954 -6.744 -1.326 1.00 61.01 C ATOM 512 CG1 VAL A 32 6.759 -8.164 -1.915 1.00 53.21 C ATOM 513 CG2 VAL A 32 7.987 -6.775 -0.171 1.00 22.44 C ATOM 0 H VAL A 32 6.689 -3.956 -1.446 1.00 13.42 H new ATOM 0 HA VAL A 32 8.307 -6.004 -2.875 1.00 3.43 H new ATOM 0 HB VAL A 32 5.996 -6.418 -0.922 1.00 61.01 H new ATOM 0 HG11 VAL A 32 6.481 -8.854 -1.118 1.00 53.21 H new ATOM 0 HG12 VAL A 32 5.970 -8.141 -2.666 1.00 53.21 H new ATOM 0 HG13 VAL A 32 7.689 -8.498 -2.376 1.00 53.21 H new ATOM 0 HG21 VAL A 32 7.678 -7.508 0.574 1.00 22.44 H new ATOM 0 HG22 VAL A 32 8.966 -7.049 -0.565 1.00 22.44 H new ATOM 0 HG23 VAL A 32 8.045 -5.790 0.292 1.00 22.44 H new ATOM 523 N PRO A 33 6.541 -6.221 -4.764 1.00 31.35 N ATOM 524 CA PRO A 33 5.530 -6.293 -5.855 1.00 24.45 C ATOM 525 C PRO A 33 4.519 -7.468 -5.693 1.00 71.01 C ATOM 526 O PRO A 33 4.642 -8.294 -4.777 1.00 21.22 O ATOM 527 CB PRO A 33 6.421 -6.465 -7.105 1.00 61.15 C ATOM 528 CG PRO A 33 7.602 -7.256 -6.623 1.00 54.10 C ATOM 529 CD PRO A 33 7.853 -6.796 -5.200 1.00 22.13 C ATOM 0 HA PRO A 33 4.880 -5.418 -5.884 1.00 24.45 H new ATOM 0 HB2 PRO A 33 5.891 -6.989 -7.900 1.00 61.15 H new ATOM 0 HB3 PRO A 33 6.728 -5.500 -7.509 1.00 61.15 H new ATOM 0 HG2 PRO A 33 7.397 -8.326 -6.658 1.00 54.10 H new ATOM 0 HG3 PRO A 33 8.475 -7.078 -7.251 1.00 54.10 H new ATOM 0 HD2 PRO A 33 8.157 -7.625 -4.561 1.00 22.13 H new ATOM 0 HD3 PRO A 33 8.648 -6.052 -5.156 1.00 22.13 H new ATOM 537 N THR A 34 3.546 -7.532 -6.630 1.00 21.15 N ATOM 538 CA THR A 34 2.431 -8.517 -6.618 1.00 42.32 C ATOM 539 C THR A 34 2.925 -9.974 -6.791 1.00 31.22 C ATOM 540 O THR A 34 2.300 -10.917 -6.278 1.00 32.22 O ATOM 541 CB THR A 34 1.417 -8.220 -7.771 1.00 71.23 C ATOM 542 OG1 THR A 34 2.061 -8.413 -9.042 1.00 14.02 O ATOM 543 CG2 THR A 34 0.855 -6.797 -7.710 1.00 23.22 C ATOM 0 H THR A 34 3.509 -6.896 -7.426 1.00 21.15 H new ATOM 0 HA THR A 34 1.953 -8.416 -5.644 1.00 42.32 H new ATOM 0 HB THR A 34 0.584 -8.912 -7.649 1.00 71.23 H new ATOM 0 HG1 THR A 34 1.424 -8.228 -9.763 1.00 14.02 H new ATOM 0 HG21 THR A 34 0.157 -6.646 -8.533 1.00 23.22 H new ATOM 0 HG22 THR A 34 0.336 -6.651 -6.763 1.00 23.22 H new ATOM 0 HG23 THR A 34 1.672 -6.080 -7.790 1.00 23.22 H new ATOM 551 N LYS A 35 4.025 -10.116 -7.561 1.00 11.34 N ATOM 552 CA LYS A 35 4.636 -11.415 -7.920 1.00 70.13 C ATOM 553 C LYS A 35 5.008 -12.228 -6.671 1.00 11.15 C ATOM 554 O LYS A 35 4.785 -13.440 -6.602 1.00 42.05 O ATOM 555 CB LYS A 35 5.919 -11.174 -8.763 1.00 2.23 C ATOM 556 CG LYS A 35 5.731 -10.347 -10.057 1.00 35.45 C ATOM 557 CD LYS A 35 7.090 -10.004 -10.727 1.00 60.21 C ATOM 558 CE LYS A 35 8.010 -9.173 -9.801 1.00 43.14 C ATOM 559 NZ LYS A 35 9.308 -8.815 -10.446 1.00 65.31 N ATOM 0 H LYS A 35 4.522 -9.318 -7.957 1.00 11.34 H new ATOM 0 HA LYS A 35 3.902 -11.979 -8.495 1.00 70.13 H new ATOM 0 HB2 LYS A 35 6.653 -10.669 -8.135 1.00 2.23 H new ATOM 0 HB3 LYS A 35 6.341 -12.142 -9.032 1.00 2.23 H new ATOM 0 HG2 LYS A 35 5.111 -10.906 -10.758 1.00 35.45 H new ATOM 0 HG3 LYS A 35 5.198 -9.425 -9.825 1.00 35.45 H new ATOM 0 HD2 LYS A 35 7.598 -10.927 -11.006 1.00 60.21 H new ATOM 0 HD3 LYS A 35 6.909 -9.449 -11.648 1.00 60.21 H new ATOM 0 HE2 LYS A 35 7.492 -8.260 -9.506 1.00 43.14 H new ATOM 0 HE3 LYS A 35 8.206 -9.737 -8.889 1.00 43.14 H new ATOM 0 HZ1 LYS A 35 9.884 -8.259 -9.782 1.00 65.31 H new ATOM 0 HZ2 LYS A 35 9.818 -9.683 -10.704 1.00 65.31 H new ATOM 0 HZ3 LYS A 35 9.127 -8.252 -11.302 1.00 65.31 H new ATOM 573 N ASP A 36 5.565 -11.518 -5.685 1.00 12.32 N ATOM 574 CA ASP A 36 6.119 -12.100 -4.450 1.00 0.34 C ATOM 575 C ASP A 36 5.037 -12.221 -3.353 1.00 43.44 C ATOM 576 O ASP A 36 5.325 -12.011 -2.182 1.00 54.12 O ATOM 577 CB ASP A 36 7.302 -11.204 -3.977 1.00 33.13 C ATOM 578 CG ASP A 36 8.464 -11.151 -4.982 1.00 32.20 C ATOM 579 OD1 ASP A 36 8.300 -10.535 -6.057 1.00 40.32 O ATOM 580 OD2 ASP A 36 9.551 -11.710 -4.699 1.00 25.11 O ATOM 0 H ASP A 36 5.647 -10.502 -5.720 1.00 12.32 H new ATOM 0 HA ASP A 36 6.477 -13.110 -4.648 1.00 0.34 H new ATOM 0 HB2 ASP A 36 6.935 -10.192 -3.802 1.00 33.13 H new ATOM 0 HB3 ASP A 36 7.673 -11.578 -3.023 1.00 33.13 H new ATOM 585 N LYS A 37 3.819 -12.655 -3.759 1.00 24.52 N ATOM 586 CA LYS A 37 2.599 -12.677 -2.908 1.00 1.20 C ATOM 587 C LYS A 37 2.799 -13.437 -1.569 1.00 73.21 C ATOM 588 O LYS A 37 2.473 -12.910 -0.496 1.00 21.52 O ATOM 589 CB LYS A 37 1.424 -13.318 -3.702 1.00 24.13 C ATOM 590 CG LYS A 37 0.114 -13.504 -2.894 1.00 1.05 C ATOM 591 CD LYS A 37 -0.536 -12.171 -2.459 1.00 54.42 C ATOM 592 CE LYS A 37 -1.715 -12.382 -1.491 1.00 41.23 C ATOM 593 NZ LYS A 37 -2.776 -13.271 -2.049 1.00 53.22 N ATOM 0 H LYS A 37 3.652 -13.006 -4.702 1.00 24.52 H new ATOM 0 HA LYS A 37 2.373 -11.642 -2.651 1.00 1.20 H new ATOM 0 HB2 LYS A 37 1.212 -12.697 -4.572 1.00 24.13 H new ATOM 0 HB3 LYS A 37 1.745 -14.291 -4.075 1.00 24.13 H new ATOM 0 HG2 LYS A 37 -0.599 -14.067 -3.497 1.00 1.05 H new ATOM 0 HG3 LYS A 37 0.325 -14.103 -2.008 1.00 1.05 H new ATOM 0 HD2 LYS A 37 0.215 -11.542 -1.981 1.00 54.42 H new ATOM 0 HD3 LYS A 37 -0.885 -11.635 -3.342 1.00 54.42 H new ATOM 0 HE2 LYS A 37 -1.342 -12.810 -0.561 1.00 41.23 H new ATOM 0 HE3 LYS A 37 -2.152 -11.415 -1.244 1.00 41.23 H new ATOM 0 HZ1 LYS A 37 -3.625 -13.216 -1.451 1.00 53.22 H new ATOM 0 HZ2 LYS A 37 -3.012 -12.966 -3.015 1.00 53.22 H new ATOM 0 HZ3 LYS A 37 -2.431 -14.252 -2.070 1.00 53.22 H new ATOM 607 N GLU A 38 3.335 -14.668 -1.656 1.00 73.10 N ATOM 608 CA GLU A 38 3.561 -15.534 -0.478 1.00 15.35 C ATOM 609 C GLU A 38 4.707 -14.972 0.380 1.00 64.50 C ATOM 610 O GLU A 38 4.703 -15.087 1.611 1.00 32.11 O ATOM 611 CB GLU A 38 3.901 -16.976 -0.925 1.00 65.54 C ATOM 612 CG GLU A 38 2.882 -17.605 -1.893 1.00 11.21 C ATOM 613 CD GLU A 38 3.260 -19.037 -2.297 1.00 21.12 C ATOM 614 OE1 GLU A 38 2.945 -19.983 -1.543 1.00 45.32 O ATOM 615 OE2 GLU A 38 3.894 -19.227 -3.359 1.00 45.35 O ATOM 0 H GLU A 38 3.623 -15.091 -2.538 1.00 73.10 H new ATOM 0 HA GLU A 38 2.647 -15.555 0.115 1.00 15.35 H new ATOM 0 HB2 GLU A 38 4.881 -16.973 -1.402 1.00 65.54 H new ATOM 0 HB3 GLU A 38 3.979 -17.608 -0.040 1.00 65.54 H new ATOM 0 HG2 GLU A 38 1.897 -17.611 -1.425 1.00 11.21 H new ATOM 0 HG3 GLU A 38 2.806 -16.987 -2.788 1.00 11.21 H new ATOM 622 N LYS A 39 5.677 -14.348 -0.316 1.00 54.24 N ATOM 623 CA LYS A 39 6.869 -13.755 0.294 1.00 11.24 C ATOM 624 C LYS A 39 6.523 -12.464 1.072 1.00 43.35 C ATOM 625 O LYS A 39 7.223 -12.139 2.029 1.00 33.54 O ATOM 626 CB LYS A 39 7.949 -13.477 -0.794 1.00 61.44 C ATOM 627 CG LYS A 39 8.472 -14.745 -1.521 1.00 72.05 C ATOM 628 CD LYS A 39 9.594 -14.464 -2.566 1.00 25.24 C ATOM 629 CE LYS A 39 10.972 -14.130 -1.950 1.00 72.53 C ATOM 630 NZ LYS A 39 10.988 -12.851 -1.183 1.00 72.52 N ATOM 0 H LYS A 39 5.648 -14.244 -1.330 1.00 54.24 H new ATOM 0 HA LYS A 39 7.273 -14.469 1.012 1.00 11.24 H new ATOM 0 HB2 LYS A 39 7.533 -12.795 -1.535 1.00 61.44 H new ATOM 0 HB3 LYS A 39 8.792 -12.967 -0.329 1.00 61.44 H new ATOM 0 HG2 LYS A 39 8.851 -15.446 -0.778 1.00 72.05 H new ATOM 0 HG3 LYS A 39 7.637 -15.233 -2.023 1.00 72.05 H new ATOM 0 HD2 LYS A 39 9.700 -15.336 -3.211 1.00 25.24 H new ATOM 0 HD3 LYS A 39 9.283 -13.634 -3.201 1.00 25.24 H new ATOM 0 HE2 LYS A 39 11.273 -14.944 -1.290 1.00 72.53 H new ATOM 0 HE3 LYS A 39 11.714 -14.075 -2.747 1.00 72.53 H new ATOM 0 HZ1 LYS A 39 11.916 -12.394 -1.289 1.00 72.52 H new ATOM 0 HZ2 LYS A 39 10.247 -12.219 -1.547 1.00 72.52 H new ATOM 0 HZ3 LYS A 39 10.812 -13.047 -0.177 1.00 72.52 H new ATOM 644 N VAL A 40 5.430 -11.755 0.656 1.00 73.23 N ATOM 645 CA VAL A 40 4.958 -10.519 1.331 1.00 60.11 C ATOM 646 C VAL A 40 4.722 -10.789 2.831 1.00 65.21 C ATOM 647 O VAL A 40 5.163 -10.025 3.686 1.00 52.34 O ATOM 648 CB VAL A 40 3.612 -9.945 0.726 1.00 11.24 C ATOM 649 CG1 VAL A 40 3.216 -8.635 1.431 1.00 43.14 C ATOM 650 CG2 VAL A 40 3.678 -9.730 -0.803 1.00 14.02 C ATOM 0 H VAL A 40 4.862 -12.025 -0.147 1.00 73.23 H new ATOM 0 HA VAL A 40 5.744 -9.780 1.175 1.00 60.11 H new ATOM 0 HB VAL A 40 2.847 -10.700 0.906 1.00 11.24 H new ATOM 0 HG11 VAL A 40 2.289 -8.256 1.001 1.00 43.14 H new ATOM 0 HG12 VAL A 40 3.072 -8.823 2.495 1.00 43.14 H new ATOM 0 HG13 VAL A 40 4.006 -7.896 1.297 1.00 43.14 H new ATOM 0 HG21 VAL A 40 2.725 -9.335 -1.156 1.00 14.02 H new ATOM 0 HG22 VAL A 40 4.473 -9.022 -1.037 1.00 14.02 H new ATOM 0 HG23 VAL A 40 3.882 -10.681 -1.296 1.00 14.02 H new ATOM 660 N LYS A 41 4.047 -11.921 3.098 1.00 33.22 N ATOM 661 CA LYS A 41 3.680 -12.393 4.445 1.00 14.21 C ATOM 662 C LYS A 41 4.912 -12.492 5.368 1.00 41.11 C ATOM 663 O LYS A 41 4.862 -12.092 6.543 1.00 45.43 O ATOM 664 CB LYS A 41 2.980 -13.769 4.285 1.00 15.34 C ATOM 665 CG LYS A 41 2.493 -14.421 5.589 1.00 61.44 C ATOM 666 CD LYS A 41 1.728 -15.741 5.335 1.00 33.41 C ATOM 667 CE LYS A 41 1.157 -16.350 6.620 1.00 21.41 C ATOM 668 NZ LYS A 41 0.276 -17.514 6.340 1.00 52.40 N ATOM 0 H LYS A 41 3.732 -12.551 2.360 1.00 33.22 H new ATOM 0 HA LYS A 41 3.005 -11.680 4.919 1.00 14.21 H new ATOM 0 HB2 LYS A 41 2.125 -13.647 3.620 1.00 15.34 H new ATOM 0 HB3 LYS A 41 3.671 -14.453 3.794 1.00 15.34 H new ATOM 0 HG2 LYS A 41 3.348 -14.618 6.236 1.00 61.44 H new ATOM 0 HG3 LYS A 41 1.845 -13.725 6.121 1.00 61.44 H new ATOM 0 HD2 LYS A 41 0.915 -15.556 4.633 1.00 33.41 H new ATOM 0 HD3 LYS A 41 2.398 -16.460 4.864 1.00 33.41 H new ATOM 0 HE2 LYS A 41 1.976 -16.662 7.268 1.00 21.41 H new ATOM 0 HE3 LYS A 41 0.593 -15.591 7.162 1.00 21.41 H new ATOM 0 HZ1 LYS A 41 -0.089 -17.896 7.236 1.00 52.40 H new ATOM 0 HZ2 LYS A 41 -0.520 -17.211 5.743 1.00 52.40 H new ATOM 0 HZ3 LYS A 41 0.820 -18.250 5.846 1.00 52.40 H new ATOM 682 N GLU A 42 6.021 -12.993 4.801 1.00 34.32 N ATOM 683 CA GLU A 42 7.307 -13.100 5.499 1.00 11.53 C ATOM 684 C GLU A 42 7.923 -11.705 5.719 1.00 63.50 C ATOM 685 O GLU A 42 8.466 -11.426 6.789 1.00 31.20 O ATOM 686 CB GLU A 42 8.279 -13.999 4.691 1.00 62.14 C ATOM 687 CG GLU A 42 7.781 -15.439 4.442 1.00 24.13 C ATOM 688 CD GLU A 42 7.455 -16.208 5.741 1.00 34.30 C ATOM 689 OE1 GLU A 42 8.375 -16.437 6.561 1.00 24.34 O ATOM 690 OE2 GLU A 42 6.284 -16.600 5.948 1.00 34.34 O ATOM 0 H GLU A 42 6.048 -13.336 3.841 1.00 34.32 H new ATOM 0 HA GLU A 42 7.136 -13.555 6.474 1.00 11.53 H new ATOM 0 HB2 GLU A 42 8.472 -13.526 3.728 1.00 62.14 H new ATOM 0 HB3 GLU A 42 9.231 -14.046 5.220 1.00 62.14 H new ATOM 0 HG2 GLU A 42 6.890 -15.404 3.816 1.00 24.13 H new ATOM 0 HG3 GLU A 42 8.541 -15.987 3.885 1.00 24.13 H new ATOM 697 N GLU A 43 7.815 -10.834 4.694 1.00 30.13 N ATOM 698 CA GLU A 43 8.414 -9.481 4.705 1.00 2.03 C ATOM 699 C GLU A 43 7.667 -8.511 5.646 1.00 42.23 C ATOM 700 O GLU A 43 8.234 -7.504 6.081 1.00 54.34 O ATOM 701 CB GLU A 43 8.546 -8.922 3.266 1.00 22.44 C ATOM 702 CG GLU A 43 9.364 -9.815 2.300 1.00 45.31 C ATOM 703 CD GLU A 43 10.743 -10.240 2.852 1.00 43.20 C ATOM 704 OE1 GLU A 43 11.733 -9.503 2.647 1.00 13.24 O ATOM 705 OE2 GLU A 43 10.848 -11.324 3.490 1.00 51.34 O ATOM 0 H GLU A 43 7.310 -11.048 3.834 1.00 30.13 H new ATOM 0 HA GLU A 43 9.420 -9.574 5.114 1.00 2.03 H new ATOM 0 HB2 GLU A 43 7.548 -8.781 2.852 1.00 22.44 H new ATOM 0 HB3 GLU A 43 9.013 -7.938 3.314 1.00 22.44 H new ATOM 0 HG2 GLU A 43 8.785 -10.709 2.070 1.00 45.31 H new ATOM 0 HG3 GLU A 43 9.509 -9.280 1.362 1.00 45.31 H new ATOM 712 N ILE A 44 6.394 -8.824 5.938 1.00 52.44 N ATOM 713 CA ILE A 44 5.576 -8.091 6.927 1.00 43.21 C ATOM 714 C ILE A 44 6.109 -8.385 8.346 1.00 64.20 C ATOM 715 O ILE A 44 6.169 -7.494 9.197 1.00 31.52 O ATOM 716 CB ILE A 44 4.049 -8.479 6.792 1.00 5.11 C ATOM 717 CG1 ILE A 44 3.470 -7.945 5.443 1.00 74.31 C ATOM 718 CG2 ILE A 44 3.198 -7.982 7.993 1.00 31.42 C ATOM 719 CD1 ILE A 44 2.022 -8.324 5.180 1.00 32.41 C ATOM 0 H ILE A 44 5.898 -9.597 5.494 1.00 52.44 H new ATOM 0 HA ILE A 44 5.653 -7.020 6.738 1.00 43.21 H new ATOM 0 HB ILE A 44 3.992 -9.568 6.798 1.00 5.11 H new ATOM 0 HG12 ILE A 44 3.555 -6.858 5.431 1.00 74.31 H new ATOM 0 HG13 ILE A 44 4.084 -8.321 4.625 1.00 74.31 H new ATOM 0 HG21 ILE A 44 2.158 -8.276 7.848 1.00 31.42 H new ATOM 0 HG22 ILE A 44 3.575 -8.425 8.915 1.00 31.42 H new ATOM 0 HG23 ILE A 44 3.262 -6.896 8.060 1.00 31.42 H new ATOM 0 HD11 ILE A 44 1.706 -7.911 4.222 1.00 32.41 H new ATOM 0 HD12 ILE A 44 1.929 -9.410 5.155 1.00 32.41 H new ATOM 0 HD13 ILE A 44 1.391 -7.924 5.974 1.00 32.41 H new ATOM 731 N GLU A 45 6.530 -9.651 8.571 1.00 3.24 N ATOM 732 CA GLU A 45 7.173 -10.077 9.829 1.00 34.25 C ATOM 733 C GLU A 45 8.569 -9.423 9.963 1.00 72.44 C ATOM 734 O GLU A 45 8.991 -9.068 11.071 1.00 2.34 O ATOM 735 CB GLU A 45 7.287 -11.623 9.891 1.00 31.24 C ATOM 736 CG GLU A 45 7.884 -12.155 11.211 1.00 53.33 C ATOM 737 CD GLU A 45 8.071 -13.679 11.237 1.00 0.43 C ATOM 738 OE1 GLU A 45 7.063 -14.406 11.252 1.00 52.21 O ATOM 739 OE2 GLU A 45 9.229 -14.159 11.229 1.00 3.42 O ATOM 0 H GLU A 45 6.433 -10.401 7.887 1.00 3.24 H new ATOM 0 HA GLU A 45 6.553 -9.749 10.663 1.00 34.25 H new ATOM 0 HB2 GLU A 45 6.297 -12.056 9.751 1.00 31.24 H new ATOM 0 HB3 GLU A 45 7.905 -11.965 9.061 1.00 31.24 H new ATOM 0 HG2 GLU A 45 8.849 -11.677 11.381 1.00 53.33 H new ATOM 0 HG3 GLU A 45 7.234 -11.864 12.036 1.00 53.33 H new ATOM 746 N LYS A 46 9.262 -9.246 8.809 1.00 41.13 N ATOM 747 CA LYS A 46 10.571 -8.553 8.760 1.00 64.23 C ATOM 748 C LYS A 46 10.392 -7.078 9.164 1.00 73.32 C ATOM 749 O LYS A 46 11.216 -6.520 9.883 1.00 61.42 O ATOM 750 CB LYS A 46 11.216 -8.612 7.347 1.00 62.23 C ATOM 751 CG LYS A 46 11.328 -10.011 6.704 1.00 10.12 C ATOM 752 CD LYS A 46 11.982 -11.080 7.596 1.00 34.51 C ATOM 753 CE LYS A 46 12.248 -12.391 6.828 1.00 21.35 C ATOM 754 NZ LYS A 46 11.026 -12.887 6.144 1.00 55.34 N ATOM 0 H LYS A 46 8.934 -9.575 7.901 1.00 41.13 H new ATOM 0 HA LYS A 46 11.234 -9.066 9.456 1.00 64.23 H new ATOM 0 HB2 LYS A 46 10.637 -7.974 6.680 1.00 62.23 H new ATOM 0 HB3 LYS A 46 12.216 -8.183 7.409 1.00 62.23 H new ATOM 0 HG2 LYS A 46 10.329 -10.350 6.428 1.00 10.12 H new ATOM 0 HG3 LYS A 46 11.902 -9.927 5.781 1.00 10.12 H new ATOM 0 HD2 LYS A 46 12.922 -10.695 7.993 1.00 34.51 H new ATOM 0 HD3 LYS A 46 11.336 -11.285 8.449 1.00 34.51 H new ATOM 0 HE2 LYS A 46 13.036 -12.228 6.092 1.00 21.35 H new ATOM 0 HE3 LYS A 46 12.611 -13.151 7.520 1.00 21.35 H new ATOM 0 HZ1 LYS A 46 11.050 -13.926 6.100 1.00 55.34 H new ATOM 0 HZ2 LYS A 46 10.184 -12.583 6.673 1.00 55.34 H new ATOM 0 HZ3 LYS A 46 10.987 -12.500 5.179 1.00 55.34 H new ATOM 768 N ALA A 47 9.285 -6.482 8.677 1.00 62.12 N ATOM 769 CA ALA A 47 8.897 -5.094 8.964 1.00 14.11 C ATOM 770 C ALA A 47 8.627 -4.895 10.469 1.00 24.34 C ATOM 771 O ALA A 47 9.039 -3.886 11.048 1.00 33.13 O ATOM 772 CB ALA A 47 7.664 -4.717 8.120 1.00 1.42 C ATOM 0 H ALA A 47 8.627 -6.963 8.063 1.00 62.12 H new ATOM 0 HA ALA A 47 9.721 -4.433 8.694 1.00 14.11 H new ATOM 0 HB1 ALA A 47 7.378 -3.687 8.334 1.00 1.42 H new ATOM 0 HB2 ALA A 47 7.904 -4.814 7.061 1.00 1.42 H new ATOM 0 HB3 ALA A 47 6.837 -5.382 8.367 1.00 1.42 H new ATOM 778 N ARG A 48 7.952 -5.891 11.090 1.00 54.11 N ATOM 779 CA ARG A 48 7.684 -5.904 12.547 1.00 54.50 C ATOM 780 C ARG A 48 8.999 -5.944 13.347 1.00 32.43 C ATOM 781 O ARG A 48 9.174 -5.183 14.304 1.00 24.43 O ATOM 782 CB ARG A 48 6.819 -7.133 12.942 1.00 13.23 C ATOM 783 CG ARG A 48 5.389 -7.150 12.368 1.00 61.14 C ATOM 784 CD ARG A 48 4.609 -8.405 12.802 1.00 51.03 C ATOM 785 NE ARG A 48 4.446 -8.493 14.269 1.00 73.10 N ATOM 786 CZ ARG A 48 4.098 -9.607 14.948 1.00 0.21 C ATOM 787 NH1 ARG A 48 3.868 -10.758 14.316 1.00 70.14 N ATOM 788 NH2 ARG A 48 3.967 -9.558 16.267 1.00 71.03 N ATOM 0 H ARG A 48 7.580 -6.703 10.598 1.00 54.11 H new ATOM 0 HA ARG A 48 7.142 -4.989 12.785 1.00 54.50 H new ATOM 0 HB2 ARG A 48 7.333 -8.037 12.616 1.00 13.23 H new ATOM 0 HB3 ARG A 48 6.756 -7.177 14.029 1.00 13.23 H new ATOM 0 HG2 ARG A 48 4.855 -6.259 12.698 1.00 61.14 H new ATOM 0 HG3 ARG A 48 5.434 -7.110 11.280 1.00 61.14 H new ATOM 0 HD2 ARG A 48 3.626 -8.399 12.331 1.00 51.03 H new ATOM 0 HD3 ARG A 48 5.129 -9.294 12.444 1.00 51.03 H new ATOM 0 HE ARG A 48 4.609 -7.645 14.811 1.00 73.10 H new ATOM 0 HH11 ARG A 48 3.954 -10.808 13.301 1.00 70.14 H new ATOM 0 HH12 ARG A 48 3.606 -11.588 14.848 1.00 70.14 H new ATOM 0 HH21 ARG A 48 4.129 -8.682 16.763 1.00 71.03 H new ATOM 0 HH22 ARG A 48 3.704 -10.397 16.785 1.00 71.03 H new ATOM 802 N LYS A 49 9.916 -6.832 12.914 1.00 14.34 N ATOM 803 CA LYS A 49 11.205 -7.081 13.590 1.00 20.21 C ATOM 804 C LYS A 49 12.093 -5.814 13.510 1.00 2.25 C ATOM 805 O LYS A 49 12.704 -5.398 14.502 1.00 24.13 O ATOM 806 CB LYS A 49 11.894 -8.332 12.932 1.00 42.14 C ATOM 807 CG LYS A 49 12.953 -9.078 13.802 1.00 73.31 C ATOM 808 CD LYS A 49 14.287 -8.318 13.983 1.00 64.10 C ATOM 809 CE LYS A 49 15.278 -9.051 14.903 1.00 74.03 C ATOM 810 NZ LYS A 49 16.504 -8.244 15.150 1.00 13.03 N ATOM 0 H LYS A 49 9.782 -7.401 12.078 1.00 14.34 H new ATOM 0 HA LYS A 49 11.047 -7.298 14.646 1.00 20.21 H new ATOM 0 HB2 LYS A 49 11.117 -9.044 12.655 1.00 42.14 H new ATOM 0 HB3 LYS A 49 12.376 -8.011 12.009 1.00 42.14 H new ATOM 0 HG2 LYS A 49 12.524 -9.273 14.785 1.00 73.31 H new ATOM 0 HG3 LYS A 49 13.160 -10.047 13.347 1.00 73.31 H new ATOM 0 HD2 LYS A 49 14.749 -8.169 13.007 1.00 64.10 H new ATOM 0 HD3 LYS A 49 14.082 -7.329 14.393 1.00 64.10 H new ATOM 0 HE2 LYS A 49 14.794 -9.276 15.853 1.00 74.03 H new ATOM 0 HE3 LYS A 49 15.555 -10.004 14.453 1.00 74.03 H new ATOM 0 HZ1 LYS A 49 17.147 -8.772 15.774 1.00 13.03 H new ATOM 0 HZ2 LYS A 49 16.980 -8.051 14.246 1.00 13.03 H new ATOM 0 HZ3 LYS A 49 16.242 -7.345 15.603 1.00 13.03 H new ATOM 824 N GLN A 50 12.093 -5.181 12.324 1.00 3.03 N ATOM 825 CA GLN A 50 12.889 -3.970 12.038 1.00 2.33 C ATOM 826 C GLN A 50 12.210 -2.697 12.591 1.00 53.32 C ATOM 827 O GLN A 50 12.845 -1.631 12.631 1.00 30.32 O ATOM 828 CB GLN A 50 13.121 -3.837 10.504 1.00 2.34 C ATOM 829 CG GLN A 50 14.035 -4.924 9.884 1.00 13.30 C ATOM 830 CD GLN A 50 15.472 -4.927 10.437 1.00 52.52 C ATOM 831 OE1 GLN A 50 16.020 -3.889 10.819 1.00 42.14 O ATOM 832 NE2 GLN A 50 16.102 -6.094 10.465 1.00 74.31 N ATOM 0 H GLN A 50 11.537 -5.496 11.529 1.00 3.03 H new ATOM 0 HA GLN A 50 13.851 -4.074 12.541 1.00 2.33 H new ATOM 0 HB2 GLN A 50 12.154 -3.867 10.001 1.00 2.34 H new ATOM 0 HB3 GLN A 50 13.556 -2.858 10.301 1.00 2.34 H new ATOM 0 HG2 GLN A 50 13.588 -5.903 10.059 1.00 13.30 H new ATOM 0 HG3 GLN A 50 14.073 -4.779 8.804 1.00 13.30 H new ATOM 0 HE21 GLN A 50 15.627 -6.938 10.144 1.00 74.31 H new ATOM 0 HE22 GLN A 50 17.061 -6.148 10.808 1.00 74.31 H new ATOM 841 N GLY A 51 10.924 -2.817 12.998 1.00 43.41 N ATOM 842 CA GLY A 51 10.146 -1.682 13.516 1.00 65.22 C ATOM 843 C GLY A 51 9.869 -0.618 12.456 1.00 22.33 C ATOM 844 O GLY A 51 9.696 0.566 12.775 1.00 32.00 O ATOM 0 H GLY A 51 10.407 -3.696 12.975 1.00 43.41 H new ATOM 0 HA2 GLY A 51 9.199 -2.048 13.912 1.00 65.22 H new ATOM 0 HA3 GLY A 51 10.685 -1.228 14.347 1.00 65.22 H new ATOM 848 N ARG A 52 9.831 -1.054 11.189 1.00 22.33 N ATOM 849 CA ARG A 52 9.651 -0.182 10.011 1.00 1.12 C ATOM 850 C ARG A 52 8.416 -0.618 9.201 1.00 73.22 C ATOM 851 O ARG A 52 7.975 -1.760 9.327 1.00 74.14 O ATOM 852 CB ARG A 52 10.941 -0.217 9.128 1.00 30.05 C ATOM 853 CG ARG A 52 12.094 0.660 9.663 1.00 0.43 C ATOM 854 CD ARG A 52 11.721 2.157 9.688 1.00 13.44 C ATOM 855 NE ARG A 52 12.813 2.992 10.197 1.00 60.43 N ATOM 856 CZ ARG A 52 13.000 4.286 9.891 1.00 74.11 C ATOM 857 NH1 ARG A 52 12.165 4.921 9.071 1.00 35.32 N ATOM 858 NH2 ARG A 52 14.046 4.930 10.387 1.00 11.42 N ATOM 0 H ARG A 52 9.926 -2.040 10.946 1.00 22.33 H new ATOM 0 HA ARG A 52 9.485 0.842 10.346 1.00 1.12 H new ATOM 0 HB2 ARG A 52 11.288 -1.247 9.051 1.00 30.05 H new ATOM 0 HB3 ARG A 52 10.687 0.110 8.120 1.00 30.05 H new ATOM 0 HG2 ARG A 52 12.358 0.336 10.670 1.00 0.43 H new ATOM 0 HG3 ARG A 52 12.977 0.517 9.040 1.00 0.43 H new ATOM 0 HD2 ARG A 52 11.458 2.481 8.681 1.00 13.44 H new ATOM 0 HD3 ARG A 52 10.837 2.299 10.310 1.00 13.44 H new ATOM 0 HE ARG A 52 13.482 2.557 10.832 1.00 60.43 H new ATOM 0 HH11 ARG A 52 11.371 4.424 8.667 1.00 35.32 H new ATOM 0 HH12 ARG A 52 12.319 5.904 8.847 1.00 35.32 H new ATOM 0 HH21 ARG A 52 14.703 4.443 10.997 1.00 11.42 H new ATOM 0 HH22 ARG A 52 14.195 5.913 10.159 1.00 11.42 H new ATOM 872 N PRO A 53 7.802 0.304 8.396 1.00 41.15 N ATOM 873 CA PRO A 53 6.714 -0.067 7.466 1.00 35.32 C ATOM 874 C PRO A 53 7.211 -0.781 6.185 1.00 53.14 C ATOM 875 O PRO A 53 8.418 -0.855 5.908 1.00 32.51 O ATOM 876 CB PRO A 53 6.059 1.295 7.144 1.00 30.32 C ATOM 877 CG PRO A 53 7.182 2.273 7.237 1.00 63.04 C ATOM 878 CD PRO A 53 8.059 1.779 8.370 1.00 11.43 C ATOM 0 HA PRO A 53 6.030 -0.793 7.906 1.00 35.32 H new ATOM 0 HB2 PRO A 53 5.611 1.296 6.150 1.00 30.32 H new ATOM 0 HB3 PRO A 53 5.265 1.532 7.852 1.00 30.32 H new ATOM 0 HG2 PRO A 53 7.739 2.320 6.302 1.00 63.04 H new ATOM 0 HG3 PRO A 53 6.811 3.278 7.438 1.00 63.04 H new ATOM 0 HD2 PRO A 53 9.111 2.000 8.188 1.00 11.43 H new ATOM 0 HD3 PRO A 53 7.794 2.249 9.317 1.00 11.43 H new ATOM 886 N ILE A 54 6.243 -1.279 5.405 1.00 11.21 N ATOM 887 CA ILE A 54 6.481 -1.993 4.141 1.00 63.31 C ATOM 888 C ILE A 54 5.370 -1.615 3.142 1.00 5.30 C ATOM 889 O ILE A 54 4.181 -1.751 3.440 1.00 32.03 O ATOM 890 CB ILE A 54 6.545 -3.560 4.361 1.00 1.02 C ATOM 891 CG1 ILE A 54 6.661 -4.323 2.998 1.00 40.14 C ATOM 892 CG2 ILE A 54 5.347 -4.071 5.197 1.00 11.02 C ATOM 893 CD1 ILE A 54 6.629 -5.838 3.111 1.00 52.43 C ATOM 0 H ILE A 54 5.253 -1.196 5.638 1.00 11.21 H new ATOM 0 HA ILE A 54 7.449 -1.695 3.739 1.00 63.31 H new ATOM 0 HB ILE A 54 7.449 -3.770 4.933 1.00 1.02 H new ATOM 0 HG12 ILE A 54 5.846 -4.004 2.349 1.00 40.14 H new ATOM 0 HG13 ILE A 54 7.591 -4.029 2.511 1.00 40.14 H new ATOM 0 HG21 ILE A 54 5.427 -5.150 5.326 1.00 11.02 H new ATOM 0 HG22 ILE A 54 5.352 -3.588 6.174 1.00 11.02 H new ATOM 0 HG23 ILE A 54 4.416 -3.835 4.681 1.00 11.02 H new ATOM 0 HD11 ILE A 54 6.715 -6.279 2.118 1.00 52.43 H new ATOM 0 HD12 ILE A 54 7.460 -6.174 3.731 1.00 52.43 H new ATOM 0 HD13 ILE A 54 5.689 -6.149 3.566 1.00 52.43 H new ATOM 905 N VAL A 55 5.765 -1.100 1.967 1.00 1.22 N ATOM 906 CA VAL A 55 4.823 -0.656 0.928 1.00 70.41 C ATOM 907 C VAL A 55 4.727 -1.723 -0.180 1.00 60.41 C ATOM 908 O VAL A 55 5.660 -1.908 -0.963 1.00 63.21 O ATOM 909 CB VAL A 55 5.257 0.734 0.316 1.00 35.52 C ATOM 910 CG1 VAL A 55 4.219 1.251 -0.700 1.00 1.31 C ATOM 911 CG2 VAL A 55 5.512 1.778 1.430 1.00 74.21 C ATOM 0 H VAL A 55 6.745 -0.980 1.711 1.00 1.22 H new ATOM 0 HA VAL A 55 3.843 -0.525 1.388 1.00 70.41 H new ATOM 0 HB VAL A 55 6.193 0.579 -0.220 1.00 35.52 H new ATOM 0 HG11 VAL A 55 4.549 2.209 -1.102 1.00 1.31 H new ATOM 0 HG12 VAL A 55 4.117 0.532 -1.513 1.00 1.31 H new ATOM 0 HG13 VAL A 55 3.256 1.377 -0.204 1.00 1.31 H new ATOM 0 HG21 VAL A 55 5.809 2.725 0.980 1.00 74.21 H new ATOM 0 HG22 VAL A 55 4.600 1.922 2.009 1.00 74.21 H new ATOM 0 HG23 VAL A 55 6.307 1.423 2.086 1.00 74.21 H new ATOM 921 N VAL A 56 3.595 -2.438 -0.219 1.00 54.34 N ATOM 922 CA VAL A 56 3.334 -3.487 -1.209 1.00 72.02 C ATOM 923 C VAL A 56 2.575 -2.887 -2.395 1.00 5.53 C ATOM 924 O VAL A 56 1.454 -2.392 -2.232 1.00 55.52 O ATOM 925 CB VAL A 56 2.496 -4.665 -0.589 1.00 1.03 C ATOM 926 CG1 VAL A 56 2.311 -5.828 -1.600 1.00 31.02 C ATOM 927 CG2 VAL A 56 3.138 -5.155 0.730 1.00 12.43 C ATOM 0 H VAL A 56 2.830 -2.302 0.442 1.00 54.34 H new ATOM 0 HA VAL A 56 4.291 -3.891 -1.540 1.00 72.02 H new ATOM 0 HB VAL A 56 1.501 -4.284 -0.358 1.00 1.03 H new ATOM 0 HG11 VAL A 56 1.727 -6.624 -1.137 1.00 31.02 H new ATOM 0 HG12 VAL A 56 1.788 -5.462 -2.484 1.00 31.02 H new ATOM 0 HG13 VAL A 56 3.287 -6.216 -1.891 1.00 31.02 H new ATOM 0 HG21 VAL A 56 2.544 -5.970 1.143 1.00 12.43 H new ATOM 0 HG22 VAL A 56 4.150 -5.508 0.533 1.00 12.43 H new ATOM 0 HG23 VAL A 56 3.173 -4.333 1.445 1.00 12.43 H new ATOM 937 N PHE A 57 3.194 -2.909 -3.577 1.00 32.22 N ATOM 938 CA PHE A 57 2.578 -2.396 -4.798 1.00 73.43 C ATOM 939 C PHE A 57 1.735 -3.487 -5.444 1.00 2.02 C ATOM 940 O PHE A 57 2.254 -4.469 -5.986 1.00 44.53 O ATOM 941 CB PHE A 57 3.656 -1.843 -5.749 1.00 73.01 C ATOM 942 CG PHE A 57 4.282 -0.585 -5.178 1.00 25.12 C ATOM 943 CD1 PHE A 57 3.622 0.638 -5.299 1.00 13.13 C ATOM 944 CD2 PHE A 57 5.476 -0.624 -4.471 1.00 51.43 C ATOM 945 CE1 PHE A 57 4.139 1.782 -4.738 1.00 2.11 C ATOM 946 CE2 PHE A 57 5.996 0.524 -3.917 1.00 74.34 C ATOM 947 CZ PHE A 57 5.326 1.729 -4.049 1.00 21.22 C ATOM 0 H PHE A 57 4.134 -3.282 -3.713 1.00 32.22 H new ATOM 0 HA PHE A 57 1.913 -1.566 -4.557 1.00 73.43 H new ATOM 0 HB2 PHE A 57 4.426 -2.597 -5.911 1.00 73.01 H new ATOM 0 HB3 PHE A 57 3.213 -1.626 -6.721 1.00 73.01 H new ATOM 0 HD1 PHE A 57 2.690 0.687 -5.842 1.00 13.13 H new ATOM 0 HD2 PHE A 57 6.000 -1.561 -4.355 1.00 51.43 H new ATOM 0 HE1 PHE A 57 3.613 2.720 -4.839 1.00 2.11 H new ATOM 0 HE2 PHE A 57 6.931 0.485 -3.377 1.00 74.34 H new ATOM 0 HZ PHE A 57 5.737 2.626 -3.610 1.00 21.22 H new ATOM 957 N VAL A 58 0.426 -3.296 -5.316 1.00 33.02 N ATOM 958 CA VAL A 58 -0.609 -4.145 -5.887 1.00 23.21 C ATOM 959 C VAL A 58 -1.155 -3.441 -7.151 1.00 62.03 C ATOM 960 O VAL A 58 -1.055 -2.218 -7.266 1.00 34.22 O ATOM 961 CB VAL A 58 -1.758 -4.387 -4.829 1.00 23.10 C ATOM 962 CG1 VAL A 58 -2.810 -5.390 -5.350 1.00 43.51 C ATOM 963 CG2 VAL A 58 -1.181 -4.852 -3.465 1.00 35.14 C ATOM 0 H VAL A 58 0.043 -2.511 -4.789 1.00 33.02 H new ATOM 0 HA VAL A 58 -0.203 -5.120 -6.156 1.00 23.21 H new ATOM 0 HB VAL A 58 -2.259 -3.431 -4.675 1.00 23.10 H new ATOM 0 HG11 VAL A 58 -3.584 -5.531 -4.595 1.00 43.51 H new ATOM 0 HG12 VAL A 58 -3.261 -5.003 -6.264 1.00 43.51 H new ATOM 0 HG13 VAL A 58 -2.329 -6.346 -5.559 1.00 43.51 H new ATOM 0 HG21 VAL A 58 -1.997 -5.010 -2.760 1.00 35.14 H new ATOM 0 HG22 VAL A 58 -0.633 -5.785 -3.601 1.00 35.14 H new ATOM 0 HG23 VAL A 58 -0.507 -4.089 -3.076 1.00 35.14 H new ATOM 973 N ARG A 59 -1.649 -4.196 -8.141 1.00 34.02 N ATOM 974 CA ARG A 59 -2.364 -3.601 -9.290 1.00 23.04 C ATOM 975 C ARG A 59 -3.846 -3.342 -8.920 1.00 54.53 C ATOM 976 O ARG A 59 -4.386 -3.954 -7.985 1.00 51.31 O ATOM 977 CB ARG A 59 -2.252 -4.505 -10.550 1.00 1.10 C ATOM 978 CG ARG A 59 -0.883 -4.463 -11.284 1.00 64.32 C ATOM 979 CD ARG A 59 -0.871 -5.370 -12.541 1.00 10.40 C ATOM 980 NE ARG A 59 0.313 -5.182 -13.413 1.00 30.45 N ATOM 981 CZ ARG A 59 0.413 -5.655 -14.677 1.00 40.31 C ATOM 982 NH1 ARG A 59 -0.582 -6.353 -15.229 1.00 5.44 N ATOM 983 NH2 ARG A 59 1.501 -5.422 -15.396 1.00 72.33 N ATOM 0 H ARG A 59 -1.570 -5.212 -8.175 1.00 34.02 H new ATOM 0 HA ARG A 59 -1.896 -2.647 -9.530 1.00 23.04 H new ATOM 0 HB2 ARG A 59 -2.456 -5.535 -10.256 1.00 1.10 H new ATOM 0 HB3 ARG A 59 -3.031 -4.215 -11.255 1.00 1.10 H new ATOM 0 HG2 ARG A 59 -0.659 -3.437 -11.575 1.00 64.32 H new ATOM 0 HG3 ARG A 59 -0.095 -4.780 -10.601 1.00 64.32 H new ATOM 0 HD2 ARG A 59 -0.913 -6.412 -12.224 1.00 10.40 H new ATOM 0 HD3 ARG A 59 -1.772 -5.177 -13.123 1.00 10.40 H new ATOM 0 HE ARG A 59 1.105 -4.662 -13.035 1.00 30.45 H new ATOM 0 HH11 ARG A 59 -1.433 -6.536 -14.697 1.00 5.44 H new ATOM 0 HH12 ARG A 59 -0.492 -6.703 -16.183 1.00 5.44 H new ATOM 0 HH21 ARG A 59 2.270 -4.883 -14.997 1.00 72.33 H new ATOM 0 HH22 ARG A 59 1.570 -5.781 -16.348 1.00 72.33 H new ATOM 997 N GLY A 60 -4.495 -2.458 -9.699 1.00 52.25 N ATOM 998 CA GLY A 60 -5.861 -1.992 -9.433 1.00 63.32 C ATOM 999 C GLY A 60 -6.942 -2.981 -9.868 1.00 73.34 C ATOM 1000 O GLY A 60 -8.133 -2.672 -9.785 1.00 22.12 O ATOM 0 H GLY A 60 -4.081 -2.046 -10.535 1.00 52.25 H new ATOM 0 HA2 GLY A 60 -5.968 -1.797 -8.366 1.00 63.32 H new ATOM 0 HA3 GLY A 60 -6.019 -1.044 -9.948 1.00 63.32 H new ATOM 1004 N GLY A 61 -6.514 -4.148 -10.380 1.00 11.04 N ATOM 1005 CA GLY A 61 -7.410 -5.268 -10.685 1.00 74.41 C ATOM 1006 C GLY A 61 -6.969 -6.539 -9.967 1.00 45.13 C ATOM 1007 O GLY A 61 -7.309 -7.647 -10.387 1.00 43.01 O ATOM 0 H GLY A 61 -5.535 -4.338 -10.593 1.00 11.04 H new ATOM 0 HA2 GLY A 61 -8.428 -5.014 -10.388 1.00 74.41 H new ATOM 0 HA3 GLY A 61 -7.426 -5.442 -11.761 1.00 74.41 H new ATOM 1011 N ASP A 62 -6.210 -6.359 -8.864 1.00 34.32 N ATOM 1012 CA ASP A 62 -5.636 -7.464 -8.055 1.00 44.24 C ATOM 1013 C ASP A 62 -5.924 -7.238 -6.560 1.00 24.42 C ATOM 1014 O ASP A 62 -5.118 -7.583 -5.685 1.00 4.30 O ATOM 1015 CB ASP A 62 -4.109 -7.603 -8.339 1.00 50.45 C ATOM 1016 CG ASP A 62 -3.815 -8.240 -9.705 1.00 21.44 C ATOM 1017 OD1 ASP A 62 -3.815 -9.486 -9.804 1.00 72.02 O ATOM 1018 OD2 ASP A 62 -3.599 -7.510 -10.692 1.00 23.40 O ATOM 0 H ASP A 62 -5.974 -5.434 -8.504 1.00 34.32 H new ATOM 0 HA ASP A 62 -6.111 -8.403 -8.341 1.00 44.24 H new ATOM 0 HB2 ASP A 62 -3.644 -6.618 -8.295 1.00 50.45 H new ATOM 0 HB3 ASP A 62 -3.651 -8.207 -7.555 1.00 50.45 H new ATOM 1023 N ASP A 63 -7.136 -6.724 -6.301 1.00 44.24 N ATOM 1024 CA ASP A 63 -7.667 -6.444 -4.950 1.00 2.31 C ATOM 1025 C ASP A 63 -7.632 -7.685 -4.035 1.00 43.53 C ATOM 1026 O ASP A 63 -7.489 -7.540 -2.816 1.00 21.20 O ATOM 1027 CB ASP A 63 -9.124 -5.912 -5.049 1.00 12.32 C ATOM 1028 CG ASP A 63 -9.239 -4.548 -5.753 1.00 44.34 C ATOM 1029 OD1 ASP A 63 -8.950 -4.471 -6.967 1.00 64.22 O ATOM 1030 OD2 ASP A 63 -9.628 -3.552 -5.100 1.00 65.15 O ATOM 0 H ASP A 63 -7.794 -6.484 -7.042 1.00 44.24 H new ATOM 0 HA ASP A 63 -7.022 -5.687 -4.504 1.00 2.31 H new ATOM 0 HB2 ASP A 63 -9.731 -6.640 -5.586 1.00 12.32 H new ATOM 0 HB3 ASP A 63 -9.540 -5.829 -4.045 1.00 12.32 H new ATOM 1035 N GLU A 64 -7.771 -8.891 -4.637 1.00 34.33 N ATOM 1036 CA GLU A 64 -7.743 -10.175 -3.900 1.00 63.52 C ATOM 1037 C GLU A 64 -6.406 -10.376 -3.162 1.00 5.21 C ATOM 1038 O GLU A 64 -6.393 -10.880 -2.042 1.00 73.30 O ATOM 1039 CB GLU A 64 -8.023 -11.366 -4.851 1.00 60.11 C ATOM 1040 CG GLU A 64 -9.412 -11.330 -5.517 1.00 72.23 C ATOM 1041 CD GLU A 64 -10.577 -11.382 -4.507 1.00 4.51 C ATOM 1042 OE1 GLU A 64 -10.852 -12.468 -3.960 1.00 73.54 O ATOM 1043 OE2 GLU A 64 -11.220 -10.339 -4.255 1.00 64.41 O ATOM 0 H GLU A 64 -7.905 -9.000 -5.642 1.00 34.33 H new ATOM 0 HA GLU A 64 -8.534 -10.137 -3.151 1.00 63.52 H new ATOM 0 HB2 GLU A 64 -7.260 -11.382 -5.629 1.00 60.11 H new ATOM 0 HB3 GLU A 64 -7.926 -12.295 -4.290 1.00 60.11 H new ATOM 0 HG2 GLU A 64 -9.498 -10.421 -6.113 1.00 72.23 H new ATOM 0 HG3 GLU A 64 -9.499 -12.171 -6.205 1.00 72.23 H new ATOM 1050 N ARG A 65 -5.290 -9.949 -3.798 1.00 71.52 N ATOM 1051 CA ARG A 65 -3.956 -9.993 -3.168 1.00 43.11 C ATOM 1052 C ARG A 65 -3.901 -9.004 -1.996 1.00 42.24 C ATOM 1053 O ARG A 65 -3.478 -9.359 -0.896 1.00 42.15 O ATOM 1054 CB ARG A 65 -2.816 -9.650 -4.179 1.00 13.21 C ATOM 1055 CG ARG A 65 -2.856 -10.450 -5.495 1.00 21.34 C ATOM 1056 CD ARG A 65 -1.642 -10.172 -6.408 1.00 61.52 C ATOM 1057 NE ARG A 65 -1.921 -10.515 -7.814 1.00 52.34 N ATOM 1058 CZ ARG A 65 -1.033 -10.981 -8.712 1.00 42.13 C ATOM 1059 NH1 ARG A 65 0.235 -11.211 -8.381 1.00 64.24 N ATOM 1060 NH2 ARG A 65 -1.415 -11.165 -9.970 1.00 74.31 N ATOM 0 H ARG A 65 -5.290 -9.571 -4.745 1.00 71.52 H new ATOM 0 HA ARG A 65 -3.799 -11.012 -2.814 1.00 43.11 H new ATOM 0 HB2 ARG A 65 -2.867 -8.587 -4.415 1.00 13.21 H new ATOM 0 HB3 ARG A 65 -1.855 -9.823 -3.694 1.00 13.21 H new ATOM 0 HG2 ARG A 65 -2.894 -11.515 -5.265 1.00 21.34 H new ATOM 0 HG3 ARG A 65 -3.772 -10.207 -6.034 1.00 21.34 H new ATOM 0 HD2 ARG A 65 -1.369 -9.119 -6.339 1.00 61.52 H new ATOM 0 HD3 ARG A 65 -0.785 -10.747 -6.057 1.00 61.52 H new ATOM 0 HE ARG A 65 -2.880 -10.387 -8.138 1.00 52.34 H new ATOM 0 HH11 ARG A 65 0.554 -11.034 -7.428 1.00 64.24 H new ATOM 0 HH12 ARG A 65 0.889 -11.564 -9.080 1.00 64.24 H new ATOM 0 HH21 ARG A 65 -2.373 -10.954 -10.248 1.00 74.31 H new ATOM 0 HH22 ARG A 65 -0.750 -11.518 -10.658 1.00 74.31 H new ATOM 1074 N ALA A 66 -4.377 -7.773 -2.268 1.00 43.35 N ATOM 1075 CA ALA A 66 -4.345 -6.648 -1.317 1.00 12.11 C ATOM 1076 C ALA A 66 -5.042 -6.994 0.010 1.00 53.44 C ATOM 1077 O ALA A 66 -4.435 -6.878 1.068 1.00 64.21 O ATOM 1078 CB ALA A 66 -4.987 -5.410 -1.952 1.00 4.31 C ATOM 0 H ALA A 66 -4.799 -7.531 -3.165 1.00 43.35 H new ATOM 0 HA ALA A 66 -3.301 -6.437 -1.087 1.00 12.11 H new ATOM 0 HB1 ALA A 66 -4.960 -4.582 -1.243 1.00 4.31 H new ATOM 0 HB2 ALA A 66 -4.436 -5.136 -2.852 1.00 4.31 H new ATOM 0 HB3 ALA A 66 -6.022 -5.630 -2.213 1.00 4.31 H new ATOM 1084 N LYS A 67 -6.289 -7.490 -0.080 1.00 35.52 N ATOM 1085 CA LYS A 67 -7.147 -7.754 1.101 1.00 43.03 C ATOM 1086 C LYS A 67 -6.614 -8.921 1.960 1.00 51.30 C ATOM 1087 O LYS A 67 -6.871 -8.965 3.168 1.00 54.33 O ATOM 1088 CB LYS A 67 -8.617 -7.995 0.656 1.00 33.42 C ATOM 1089 CG LYS A 67 -8.829 -9.227 -0.255 1.00 54.13 C ATOM 1090 CD LYS A 67 -10.246 -9.291 -0.883 1.00 61.02 C ATOM 1091 CE LYS A 67 -10.560 -8.087 -1.790 1.00 4.34 C ATOM 1092 NZ LYS A 67 -11.914 -8.187 -2.403 1.00 40.04 N ATOM 0 H LYS A 67 -6.734 -7.720 -0.968 1.00 35.52 H new ATOM 0 HA LYS A 67 -7.120 -6.869 1.736 1.00 43.03 H new ATOM 0 HB2 LYS A 67 -9.236 -8.109 1.546 1.00 33.42 H new ATOM 0 HB3 LYS A 67 -8.972 -7.108 0.131 1.00 33.42 H new ATOM 0 HG2 LYS A 67 -8.086 -9.212 -1.053 1.00 54.13 H new ATOM 0 HG3 LYS A 67 -8.655 -10.133 0.325 1.00 54.13 H new ATOM 0 HD2 LYS A 67 -10.339 -10.209 -1.463 1.00 61.02 H new ATOM 0 HD3 LYS A 67 -10.988 -9.341 -0.086 1.00 61.02 H new ATOM 0 HE2 LYS A 67 -10.493 -7.168 -1.208 1.00 4.34 H new ATOM 0 HE3 LYS A 67 -9.810 -8.021 -2.578 1.00 4.34 H new ATOM 0 HZ1 LYS A 67 -12.167 -7.276 -2.836 1.00 40.04 H new ATOM 0 HZ2 LYS A 67 -11.911 -8.928 -3.132 1.00 40.04 H new ATOM 0 HZ3 LYS A 67 -12.611 -8.427 -1.669 1.00 40.04 H new ATOM 1106 N ASP A 68 -5.894 -9.868 1.321 1.00 42.33 N ATOM 1107 CA ASP A 68 -5.198 -10.971 2.027 1.00 53.24 C ATOM 1108 C ASP A 68 -4.055 -10.416 2.887 1.00 23.12 C ATOM 1109 O ASP A 68 -3.993 -10.650 4.099 1.00 24.32 O ATOM 1110 CB ASP A 68 -4.624 -12.004 1.008 1.00 42.31 C ATOM 1111 CG ASP A 68 -5.674 -12.854 0.276 1.00 72.45 C ATOM 1112 OD1 ASP A 68 -6.886 -12.567 0.372 1.00 34.00 O ATOM 1113 OD2 ASP A 68 -5.282 -13.818 -0.419 1.00 10.51 O ATOM 0 H ASP A 68 -5.778 -9.892 0.308 1.00 42.33 H new ATOM 0 HA ASP A 68 -5.924 -11.471 2.668 1.00 53.24 H new ATOM 0 HB2 ASP A 68 -4.032 -11.468 0.266 1.00 42.31 H new ATOM 0 HB3 ASP A 68 -3.943 -12.672 1.536 1.00 42.31 H new ATOM 1118 N ILE A 69 -3.178 -9.644 2.224 1.00 62.13 N ATOM 1119 CA ILE A 69 -2.010 -8.987 2.838 1.00 32.21 C ATOM 1120 C ILE A 69 -2.467 -7.996 3.942 1.00 75.55 C ATOM 1121 O ILE A 69 -1.804 -7.838 4.969 1.00 33.35 O ATOM 1122 CB ILE A 69 -1.184 -8.244 1.717 1.00 63.32 C ATOM 1123 CG1 ILE A 69 -0.680 -9.261 0.636 1.00 73.52 C ATOM 1124 CG2 ILE A 69 -0.011 -7.442 2.309 1.00 22.23 C ATOM 1125 CD1 ILE A 69 -0.114 -8.629 -0.631 1.00 52.33 C ATOM 0 H ILE A 69 -3.262 -9.455 1.225 1.00 62.13 H new ATOM 0 HA ILE A 69 -1.373 -9.737 3.308 1.00 32.21 H new ATOM 0 HB ILE A 69 -1.852 -7.531 1.234 1.00 63.32 H new ATOM 0 HG12 ILE A 69 0.088 -9.892 1.083 1.00 73.52 H new ATOM 0 HG13 ILE A 69 -1.508 -9.914 0.359 1.00 73.52 H new ATOM 0 HG21 ILE A 69 0.533 -6.945 1.505 1.00 22.23 H new ATOM 0 HG22 ILE A 69 -0.395 -6.695 3.003 1.00 22.23 H new ATOM 0 HG23 ILE A 69 0.661 -8.117 2.838 1.00 22.23 H new ATOM 0 HD11 ILE A 69 0.207 -9.413 -1.316 1.00 52.33 H new ATOM 0 HD12 ILE A 69 -0.882 -8.022 -1.109 1.00 52.33 H new ATOM 0 HD13 ILE A 69 0.738 -8.000 -0.374 1.00 52.33 H new ATOM 1137 N ALA A 70 -3.648 -7.395 3.710 1.00 54.33 N ATOM 1138 CA ALA A 70 -4.263 -6.393 4.587 1.00 23.04 C ATOM 1139 C ALA A 70 -4.798 -7.021 5.877 1.00 64.31 C ATOM 1140 O ALA A 70 -4.593 -6.475 6.966 1.00 14.22 O ATOM 1141 CB ALA A 70 -5.398 -5.699 3.832 1.00 62.33 C ATOM 0 H ALA A 70 -4.212 -7.601 2.885 1.00 54.33 H new ATOM 0 HA ALA A 70 -3.500 -5.667 4.870 1.00 23.04 H new ATOM 0 HB1 ALA A 70 -5.861 -4.952 4.477 1.00 62.33 H new ATOM 0 HB2 ALA A 70 -4.999 -5.212 2.942 1.00 62.33 H new ATOM 0 HB3 ALA A 70 -6.144 -6.437 3.538 1.00 62.33 H new ATOM 1147 N GLU A 71 -5.513 -8.156 5.735 1.00 43.41 N ATOM 1148 CA GLU A 71 -6.071 -8.893 6.882 1.00 61.23 C ATOM 1149 C GLU A 71 -4.945 -9.381 7.790 1.00 15.13 C ATOM 1150 O GLU A 71 -5.025 -9.240 9.009 1.00 60.42 O ATOM 1151 CB GLU A 71 -6.927 -10.101 6.426 1.00 51.05 C ATOM 1152 CG GLU A 71 -7.600 -10.859 7.598 1.00 33.31 C ATOM 1153 CD GLU A 71 -8.311 -12.151 7.180 1.00 35.04 C ATOM 1154 OE1 GLU A 71 -9.290 -12.070 6.408 1.00 30.02 O ATOM 1155 OE2 GLU A 71 -7.886 -13.250 7.615 1.00 30.20 O ATOM 0 H GLU A 71 -5.717 -8.582 4.831 1.00 43.41 H new ATOM 0 HA GLU A 71 -6.717 -8.207 7.430 1.00 61.23 H new ATOM 0 HB2 GLU A 71 -7.698 -9.751 5.739 1.00 51.05 H new ATOM 0 HB3 GLU A 71 -6.296 -10.794 5.870 1.00 51.05 H new ATOM 0 HG2 GLU A 71 -6.843 -11.099 8.344 1.00 33.31 H new ATOM 0 HG3 GLU A 71 -8.322 -10.198 8.077 1.00 33.31 H new ATOM 1162 N TYR A 72 -3.887 -9.925 7.156 1.00 63.02 N ATOM 1163 CA TYR A 72 -2.713 -10.457 7.854 1.00 63.52 C ATOM 1164 C TYR A 72 -1.991 -9.334 8.618 1.00 4.20 C ATOM 1165 O TYR A 72 -1.662 -9.496 9.788 1.00 41.11 O ATOM 1166 CB TYR A 72 -1.747 -11.156 6.858 1.00 24.53 C ATOM 1167 CG TYR A 72 -0.463 -11.706 7.513 1.00 34.40 C ATOM 1168 CD1 TYR A 72 -0.496 -12.834 8.343 1.00 53.24 C ATOM 1169 CD2 TYR A 72 0.779 -11.089 7.322 1.00 61.01 C ATOM 1170 CE1 TYR A 72 0.653 -13.313 8.949 1.00 11.13 C ATOM 1171 CE2 TYR A 72 1.926 -11.571 7.925 1.00 74.13 C ATOM 1172 CZ TYR A 72 1.859 -12.680 8.736 1.00 54.12 C ATOM 1173 OH TYR A 72 3.001 -13.163 9.347 1.00 22.54 O ATOM 0 H TYR A 72 -3.829 -10.005 6.141 1.00 63.02 H new ATOM 0 HA TYR A 72 -3.050 -11.203 8.574 1.00 63.52 H new ATOM 0 HB2 TYR A 72 -2.274 -11.976 6.371 1.00 24.53 H new ATOM 0 HB3 TYR A 72 -1.470 -10.447 6.078 1.00 24.53 H new ATOM 0 HD1 TYR A 72 -1.435 -13.339 8.513 1.00 53.24 H new ATOM 0 HD2 TYR A 72 0.843 -10.216 6.689 1.00 61.01 H new ATOM 0 HE1 TYR A 72 0.605 -14.182 9.588 1.00 11.13 H new ATOM 0 HE2 TYR A 72 2.873 -11.078 7.760 1.00 74.13 H new ATOM 0 HH TYR A 72 3.114 -12.729 10.218 1.00 22.54 H new ATOM 1183 N ALA A 73 -1.800 -8.192 7.939 1.00 15.21 N ATOM 1184 CA ALA A 73 -1.112 -7.016 8.493 1.00 24.21 C ATOM 1185 C ALA A 73 -1.829 -6.470 9.746 1.00 10.23 C ATOM 1186 O ALA A 73 -1.201 -6.295 10.793 1.00 31.22 O ATOM 1187 CB ALA A 73 -1.004 -5.937 7.418 1.00 4.13 C ATOM 0 H ALA A 73 -2.122 -8.058 6.981 1.00 15.21 H new ATOM 0 HA ALA A 73 -0.112 -7.319 8.805 1.00 24.21 H new ATOM 0 HB1 ALA A 73 -0.494 -5.065 7.828 1.00 4.13 H new ATOM 0 HB2 ALA A 73 -0.438 -6.323 6.570 1.00 4.13 H new ATOM 0 HB3 ALA A 73 -2.003 -5.651 7.088 1.00 4.13 H new ATOM 1193 N GLN A 74 -3.155 -6.235 9.627 1.00 63.24 N ATOM 1194 CA GLN A 74 -3.987 -5.756 10.755 1.00 72.43 C ATOM 1195 C GLN A 74 -4.008 -6.796 11.896 1.00 42.44 C ATOM 1196 O GLN A 74 -4.040 -6.433 13.075 1.00 72.14 O ATOM 1197 CB GLN A 74 -5.434 -5.423 10.286 1.00 41.22 C ATOM 1198 CG GLN A 74 -6.381 -4.965 11.424 1.00 31.43 C ATOM 1199 CD GLN A 74 -7.807 -4.617 10.981 1.00 63.01 C ATOM 1200 OE1 GLN A 74 -8.778 -4.899 11.692 1.00 4.21 O ATOM 1201 NE2 GLN A 74 -7.945 -3.925 9.864 1.00 62.04 N ATOM 0 H GLN A 74 -3.673 -6.370 8.759 1.00 63.24 H new ATOM 0 HA GLN A 74 -3.540 -4.837 11.135 1.00 72.43 H new ATOM 0 HB2 GLN A 74 -5.388 -4.639 9.530 1.00 41.22 H new ATOM 0 HB3 GLN A 74 -5.860 -6.304 9.806 1.00 41.22 H new ATOM 0 HG2 GLN A 74 -6.432 -5.755 12.173 1.00 31.43 H new ATOM 0 HG3 GLN A 74 -5.945 -4.092 11.910 1.00 31.43 H new ATOM 0 HE21 GLN A 74 -7.127 -3.706 9.296 1.00 62.04 H new ATOM 0 HE22 GLN A 74 -8.870 -3.610 9.570 1.00 62.04 H new ATOM 1210 N LYS A 75 -3.941 -8.086 11.515 1.00 20.05 N ATOM 1211 CA LYS A 75 -3.911 -9.224 12.455 1.00 32.41 C ATOM 1212 C LYS A 75 -2.576 -9.260 13.236 1.00 2.35 C ATOM 1213 O LYS A 75 -2.547 -9.699 14.391 1.00 1.54 O ATOM 1214 CB LYS A 75 -4.136 -10.541 11.668 1.00 35.13 C ATOM 1215 CG LYS A 75 -4.335 -11.814 12.521 1.00 41.12 C ATOM 1216 CD LYS A 75 -4.692 -13.053 11.658 1.00 34.43 C ATOM 1217 CE LYS A 75 -5.997 -12.870 10.858 1.00 10.32 C ATOM 1218 NZ LYS A 75 -6.344 -14.067 10.046 1.00 12.52 N ATOM 0 H LYS A 75 -3.906 -8.371 10.536 1.00 20.05 H new ATOM 0 HA LYS A 75 -4.710 -9.107 13.187 1.00 32.41 H new ATOM 0 HB2 LYS A 75 -5.011 -10.415 11.030 1.00 35.13 H new ATOM 0 HB3 LYS A 75 -3.281 -10.698 11.010 1.00 35.13 H new ATOM 0 HG2 LYS A 75 -3.424 -12.017 13.084 1.00 41.12 H new ATOM 0 HG3 LYS A 75 -5.128 -11.641 13.249 1.00 41.12 H new ATOM 0 HD2 LYS A 75 -3.874 -13.257 10.967 1.00 34.43 H new ATOM 0 HD3 LYS A 75 -4.787 -13.925 12.305 1.00 34.43 H new ATOM 0 HE2 LYS A 75 -6.814 -12.654 11.547 1.00 10.32 H new ATOM 0 HE3 LYS A 75 -5.898 -12.006 10.201 1.00 10.32 H new ATOM 0 HZ1 LYS A 75 -6.879 -13.772 9.205 1.00 12.52 H new ATOM 0 HZ2 LYS A 75 -5.472 -14.550 9.750 1.00 12.52 H new ATOM 0 HZ3 LYS A 75 -6.923 -14.717 10.615 1.00 12.52 H new ATOM 1232 N GLU A 76 -1.480 -8.768 12.610 1.00 44.24 N ATOM 1233 CA GLU A 76 -0.161 -8.621 13.279 1.00 43.12 C ATOM 1234 C GLU A 76 -0.150 -7.399 14.228 1.00 55.53 C ATOM 1235 O GLU A 76 0.799 -7.220 15.004 1.00 4.43 O ATOM 1236 CB GLU A 76 0.971 -8.483 12.221 1.00 42.25 C ATOM 1237 CG GLU A 76 1.107 -9.662 11.230 1.00 22.01 C ATOM 1238 CD GLU A 76 1.421 -11.024 11.879 1.00 44.11 C ATOM 1239 OE1 GLU A 76 0.484 -11.716 12.342 1.00 10.11 O ATOM 1240 OE2 GLU A 76 2.608 -11.429 11.907 1.00 52.14 O ATOM 0 H GLU A 76 -1.482 -8.464 11.636 1.00 44.24 H new ATOM 0 HA GLU A 76 0.015 -9.518 13.873 1.00 43.12 H new ATOM 0 HB2 GLU A 76 0.801 -7.570 11.650 1.00 42.25 H new ATOM 0 HB3 GLU A 76 1.919 -8.360 12.744 1.00 42.25 H new ATOM 0 HG2 GLU A 76 0.179 -9.751 10.665 1.00 22.01 H new ATOM 0 HG3 GLU A 76 1.895 -9.427 10.515 1.00 22.01 H new ATOM 1247 N GLY A 77 -1.207 -6.570 14.139 1.00 24.34 N ATOM 1248 CA GLY A 77 -1.350 -5.359 14.949 1.00 52.24 C ATOM 1249 C GLY A 77 -0.741 -4.147 14.271 1.00 61.30 C ATOM 1250 O GLY A 77 -0.243 -3.236 14.942 1.00 5.43 O ATOM 0 H GLY A 77 -1.985 -6.727 13.499 1.00 24.34 H new ATOM 0 HA2 GLY A 77 -2.407 -5.174 15.141 1.00 52.24 H new ATOM 0 HA3 GLY A 77 -0.872 -5.512 15.917 1.00 52.24 H new ATOM 1254 N LEU A 78 -0.774 -4.153 12.926 1.00 1.21 N ATOM 1255 CA LEU A 78 -0.198 -3.085 12.087 1.00 55.24 C ATOM 1256 C LEU A 78 -1.330 -2.273 11.427 1.00 52.11 C ATOM 1257 O LEU A 78 -2.399 -2.823 11.126 1.00 31.15 O ATOM 1258 CB LEU A 78 0.732 -3.695 10.984 1.00 41.44 C ATOM 1259 CG LEU A 78 1.758 -4.779 11.457 1.00 50.22 C ATOM 1260 CD1 LEU A 78 2.645 -5.257 10.296 1.00 21.54 C ATOM 1261 CD2 LEU A 78 2.615 -4.289 12.633 1.00 22.41 C ATOM 0 H LEU A 78 -1.204 -4.904 12.387 1.00 1.21 H new ATOM 0 HA LEU A 78 0.398 -2.427 12.719 1.00 55.24 H new ATOM 0 HB2 LEU A 78 0.102 -4.136 10.212 1.00 41.44 H new ATOM 0 HB3 LEU A 78 1.286 -2.881 10.517 1.00 41.44 H new ATOM 0 HG LEU A 78 1.175 -5.630 11.811 1.00 50.22 H new ATOM 0 HD11 LEU A 78 3.346 -6.009 10.659 1.00 21.54 H new ATOM 0 HD12 LEU A 78 2.020 -5.690 9.515 1.00 21.54 H new ATOM 0 HD13 LEU A 78 3.199 -4.411 9.889 1.00 21.54 H new ATOM 0 HD21 LEU A 78 3.312 -5.074 12.927 1.00 22.41 H new ATOM 0 HD22 LEU A 78 3.173 -3.402 12.332 1.00 22.41 H new ATOM 0 HD23 LEU A 78 1.969 -4.043 13.476 1.00 22.41 H new ATOM 1273 N ARG A 79 -1.098 -0.961 11.224 1.00 33.23 N ATOM 1274 CA ARG A 79 -2.011 -0.100 10.453 1.00 24.44 C ATOM 1275 C ARG A 79 -1.879 -0.403 8.962 1.00 22.30 C ATOM 1276 O ARG A 79 -0.789 -0.318 8.401 1.00 12.54 O ATOM 1277 CB ARG A 79 -1.745 1.409 10.726 1.00 32.11 C ATOM 1278 CG ARG A 79 -2.357 1.959 12.030 1.00 74.02 C ATOM 1279 CD ARG A 79 -3.900 2.047 11.995 1.00 44.20 C ATOM 1280 NE ARG A 79 -4.561 0.724 11.992 1.00 1.04 N ATOM 1281 CZ ARG A 79 -5.677 0.397 11.313 1.00 52.54 C ATOM 1282 NH1 ARG A 79 -6.312 1.285 10.546 1.00 64.32 N ATOM 1283 NH2 ARG A 79 -6.172 -0.828 11.434 1.00 54.34 N ATOM 0 H ARG A 79 -0.279 -0.473 11.587 1.00 33.23 H new ATOM 0 HA ARG A 79 -3.030 -0.317 10.775 1.00 24.44 H new ATOM 0 HB2 ARG A 79 -0.668 1.572 10.752 1.00 32.11 H new ATOM 0 HB3 ARG A 79 -2.135 1.987 9.888 1.00 32.11 H new ATOM 0 HG2 ARG A 79 -2.056 1.321 12.861 1.00 74.02 H new ATOM 0 HG3 ARG A 79 -1.948 2.951 12.224 1.00 74.02 H new ATOM 0 HD2 ARG A 79 -4.244 2.616 12.859 1.00 44.20 H new ATOM 0 HD3 ARG A 79 -4.206 2.600 11.107 1.00 44.20 H new ATOM 0 HE ARG A 79 -4.132 -0.009 12.557 1.00 1.04 H new ATOM 0 HH11 ARG A 79 -5.954 2.236 10.464 1.00 64.32 H new ATOM 0 HH12 ARG A 79 -7.156 1.012 10.042 1.00 64.32 H new ATOM 0 HH21 ARG A 79 -5.708 -1.508 12.036 1.00 54.34 H new ATOM 0 HH22 ARG A 79 -7.017 -1.089 10.925 1.00 54.34 H new ATOM 1297 N VAL A 80 -2.992 -0.776 8.336 1.00 13.42 N ATOM 1298 CA VAL A 80 -3.037 -1.055 6.902 1.00 12.45 C ATOM 1299 C VAL A 80 -3.515 0.194 6.176 1.00 32.42 C ATOM 1300 O VAL A 80 -4.641 0.638 6.392 1.00 42.23 O ATOM 1301 CB VAL A 80 -4.003 -2.241 6.578 1.00 71.44 C ATOM 1302 CG1 VAL A 80 -3.960 -2.603 5.075 1.00 42.02 C ATOM 1303 CG2 VAL A 80 -3.698 -3.457 7.470 1.00 12.25 C ATOM 0 H VAL A 80 -3.889 -0.894 8.808 1.00 13.42 H new ATOM 0 HA VAL A 80 -2.037 -1.336 6.573 1.00 12.45 H new ATOM 0 HB VAL A 80 -5.021 -1.920 6.801 1.00 71.44 H new ATOM 0 HG11 VAL A 80 -4.642 -3.431 4.880 1.00 42.02 H new ATOM 0 HG12 VAL A 80 -4.261 -1.738 4.484 1.00 42.02 H new ATOM 0 HG13 VAL A 80 -2.947 -2.895 4.800 1.00 42.02 H new ATOM 0 HG21 VAL A 80 -4.383 -4.269 7.225 1.00 12.25 H new ATOM 0 HG22 VAL A 80 -2.672 -3.785 7.300 1.00 12.25 H new ATOM 0 HG23 VAL A 80 -3.822 -3.180 8.517 1.00 12.25 H new ATOM 1313 N ILE A 81 -2.644 0.772 5.350 1.00 14.24 N ATOM 1314 CA ILE A 81 -2.982 1.926 4.518 1.00 13.13 C ATOM 1315 C ILE A 81 -3.076 1.446 3.061 1.00 70.53 C ATOM 1316 O ILE A 81 -2.089 1.025 2.488 1.00 50.12 O ATOM 1317 CB ILE A 81 -1.933 3.116 4.679 1.00 34.22 C ATOM 1318 CG1 ILE A 81 -2.174 3.965 5.983 1.00 23.32 C ATOM 1319 CG2 ILE A 81 -1.944 4.046 3.444 1.00 65.52 C ATOM 1320 CD1 ILE A 81 -1.999 3.242 7.310 1.00 22.03 C ATOM 0 H ILE A 81 -1.682 0.452 5.239 1.00 14.24 H new ATOM 0 HA ILE A 81 -3.939 2.337 4.839 1.00 13.13 H new ATOM 0 HB ILE A 81 -0.954 2.644 4.765 1.00 34.22 H new ATOM 0 HG12 ILE A 81 -1.493 4.816 5.966 1.00 23.32 H new ATOM 0 HG13 ILE A 81 -3.186 4.367 5.945 1.00 23.32 H new ATOM 0 HG21 ILE A 81 -1.218 4.847 3.585 1.00 65.52 H new ATOM 0 HG22 ILE A 81 -1.683 3.473 2.554 1.00 65.52 H new ATOM 0 HG23 ILE A 81 -2.938 4.475 3.321 1.00 65.52 H new ATOM 0 HD11 ILE A 81 -2.192 3.934 8.130 1.00 22.03 H new ATOM 0 HD12 ILE A 81 -2.700 2.409 7.366 1.00 22.03 H new ATOM 0 HD13 ILE A 81 -0.979 2.864 7.387 1.00 22.03 H new ATOM 1332 N VAL A 82 -4.277 1.472 2.481 1.00 43.13 N ATOM 1333 CA VAL A 82 -4.494 1.103 1.071 1.00 64.22 C ATOM 1334 C VAL A 82 -4.563 2.390 0.234 1.00 3.52 C ATOM 1335 O VAL A 82 -5.411 3.211 0.486 1.00 0.12 O ATOM 1336 CB VAL A 82 -5.831 0.276 0.899 1.00 1.42 C ATOM 1337 CG1 VAL A 82 -6.108 -0.047 -0.586 1.00 41.55 C ATOM 1338 CG2 VAL A 82 -5.822 -1.011 1.768 1.00 1.44 C ATOM 0 H VAL A 82 -5.129 1.748 2.970 1.00 43.13 H new ATOM 0 HA VAL A 82 -3.669 0.476 0.734 1.00 64.22 H new ATOM 0 HB VAL A 82 -6.649 0.903 1.255 1.00 1.42 H new ATOM 0 HG11 VAL A 82 -7.034 -0.616 -0.668 1.00 41.55 H new ATOM 0 HG12 VAL A 82 -6.202 0.882 -1.149 1.00 41.55 H new ATOM 0 HG13 VAL A 82 -5.284 -0.635 -0.990 1.00 41.55 H new ATOM 0 HG21 VAL A 82 -6.756 -1.554 1.624 1.00 1.44 H new ATOM 0 HG22 VAL A 82 -4.985 -1.644 1.472 1.00 1.44 H new ATOM 0 HG23 VAL A 82 -5.718 -0.740 2.819 1.00 1.44 H new ATOM 1348 N ILE A 83 -3.648 2.596 -0.725 1.00 15.53 N ATOM 1349 CA ILE A 83 -3.674 3.788 -1.610 1.00 32.43 C ATOM 1350 C ILE A 83 -3.994 3.362 -3.045 1.00 4.23 C ATOM 1351 O ILE A 83 -3.156 2.789 -3.741 1.00 50.34 O ATOM 1352 CB ILE A 83 -2.314 4.581 -1.548 1.00 41.12 C ATOM 1353 CG1 ILE A 83 -2.035 4.992 -0.074 1.00 23.12 C ATOM 1354 CG2 ILE A 83 -2.318 5.818 -2.491 1.00 62.52 C ATOM 1355 CD1 ILE A 83 -0.711 5.665 0.168 1.00 15.54 C ATOM 0 H ILE A 83 -2.877 1.956 -0.914 1.00 15.53 H new ATOM 0 HA ILE A 83 -4.456 4.461 -1.258 1.00 32.43 H new ATOM 0 HB ILE A 83 -1.513 3.932 -1.901 1.00 41.12 H new ATOM 0 HG12 ILE A 83 -2.829 5.662 0.255 1.00 23.12 H new ATOM 0 HG13 ILE A 83 -2.090 4.101 0.551 1.00 23.12 H new ATOM 0 HG21 ILE A 83 -1.361 6.335 -2.417 1.00 62.52 H new ATOM 0 HG22 ILE A 83 -2.475 5.491 -3.519 1.00 62.52 H new ATOM 0 HG23 ILE A 83 -3.120 6.495 -2.199 1.00 62.52 H new ATOM 0 HD11 ILE A 83 -0.616 5.910 1.226 1.00 15.54 H new ATOM 0 HD12 ILE A 83 0.097 4.994 -0.123 1.00 15.54 H new ATOM 0 HD13 ILE A 83 -0.654 6.579 -0.423 1.00 15.54 H new ATOM 1367 N ILE A 84 -5.230 3.630 -3.470 1.00 75.44 N ATOM 1368 CA ILE A 84 -5.702 3.300 -4.817 1.00 42.11 C ATOM 1369 C ILE A 84 -5.393 4.482 -5.739 1.00 44.43 C ATOM 1370 O ILE A 84 -5.825 5.609 -5.474 1.00 13.25 O ATOM 1371 CB ILE A 84 -7.242 2.994 -4.825 1.00 12.44 C ATOM 1372 CG1 ILE A 84 -7.579 1.945 -3.724 1.00 70.10 C ATOM 1373 CG2 ILE A 84 -7.714 2.509 -6.226 1.00 45.52 C ATOM 1374 CD1 ILE A 84 -9.050 1.741 -3.495 1.00 71.32 C ATOM 0 H ILE A 84 -5.934 4.083 -2.888 1.00 75.44 H new ATOM 0 HA ILE A 84 -5.191 2.402 -5.166 1.00 42.11 H new ATOM 0 HB ILE A 84 -7.780 3.916 -4.605 1.00 12.44 H new ATOM 0 HG12 ILE A 84 -7.130 0.990 -3.998 1.00 70.10 H new ATOM 0 HG13 ILE A 84 -7.117 2.257 -2.787 1.00 70.10 H new ATOM 0 HG21 ILE A 84 -8.784 2.305 -6.199 1.00 45.52 H new ATOM 0 HG22 ILE A 84 -7.510 3.283 -6.966 1.00 45.52 H new ATOM 0 HG23 ILE A 84 -7.178 1.599 -6.495 1.00 45.52 H new ATOM 0 HD11 ILE A 84 -9.197 0.995 -2.714 1.00 71.32 H new ATOM 0 HD12 ILE A 84 -9.504 2.683 -3.188 1.00 71.32 H new ATOM 0 HD13 ILE A 84 -9.517 1.396 -4.417 1.00 71.32 H new ATOM 1386 N VAL A 85 -4.594 4.216 -6.773 1.00 72.42 N ATOM 1387 CA VAL A 85 -4.199 5.190 -7.793 1.00 23.23 C ATOM 1388 C VAL A 85 -4.905 4.823 -9.101 1.00 33.22 C ATOM 1389 O VAL A 85 -4.569 3.804 -9.711 1.00 50.43 O ATOM 1390 CB VAL A 85 -2.637 5.167 -8.008 1.00 64.12 C ATOM 1391 CG1 VAL A 85 -2.172 6.330 -8.912 1.00 31.24 C ATOM 1392 CG2 VAL A 85 -1.893 5.154 -6.651 1.00 65.33 C ATOM 0 H VAL A 85 -4.192 3.292 -6.929 1.00 72.42 H new ATOM 0 HA VAL A 85 -4.482 6.192 -7.472 1.00 23.23 H new ATOM 0 HB VAL A 85 -2.383 4.244 -8.529 1.00 64.12 H new ATOM 0 HG11 VAL A 85 -1.090 6.283 -9.038 1.00 31.24 H new ATOM 0 HG12 VAL A 85 -2.655 6.249 -9.886 1.00 31.24 H new ATOM 0 HG13 VAL A 85 -2.442 7.280 -8.451 1.00 31.24 H new ATOM 0 HG21 VAL A 85 -0.817 5.138 -6.826 1.00 65.33 H new ATOM 0 HG22 VAL A 85 -2.155 6.047 -6.084 1.00 65.33 H new ATOM 0 HG23 VAL A 85 -2.182 4.268 -6.086 1.00 65.33 H new ATOM 1402 N SER A 86 -5.896 5.625 -9.511 1.00 33.31 N ATOM 1403 CA SER A 86 -6.683 5.348 -10.723 1.00 1.14 C ATOM 1404 C SER A 86 -7.265 6.646 -11.287 1.00 21.22 C ATOM 1405 O SER A 86 -7.663 7.550 -10.537 1.00 74.52 O ATOM 1406 CB SER A 86 -7.818 4.336 -10.419 1.00 11.55 C ATOM 1407 OG SER A 86 -8.547 3.984 -11.592 1.00 42.43 O ATOM 0 H SER A 86 -6.174 6.475 -9.020 1.00 33.31 H new ATOM 0 HA SER A 86 -6.021 4.908 -11.469 1.00 1.14 H new ATOM 0 HB2 SER A 86 -7.392 3.437 -9.973 1.00 11.55 H new ATOM 0 HB3 SER A 86 -8.499 4.765 -9.684 1.00 11.55 H new ATOM 0 HG SER A 86 -9.019 3.139 -11.442 1.00 42.43 H new ATOM 1413 N GLN A 87 -7.322 6.700 -12.626 1.00 31.00 N ATOM 1414 CA GLN A 87 -7.932 7.803 -13.383 1.00 52.34 C ATOM 1415 C GLN A 87 -9.478 7.759 -13.285 1.00 2.41 C ATOM 1416 O GLN A 87 -10.157 8.709 -13.682 1.00 64.41 O ATOM 1417 CB GLN A 87 -7.471 7.742 -14.867 1.00 3.45 C ATOM 1418 CG GLN A 87 -7.872 6.447 -15.613 1.00 62.43 C ATOM 1419 CD GLN A 87 -7.398 6.384 -17.071 1.00 62.44 C ATOM 1420 OE1 GLN A 87 -7.244 7.408 -17.746 1.00 3.51 O ATOM 1421 NE2 GLN A 87 -7.190 5.178 -17.580 1.00 1.52 N ATOM 0 H GLN A 87 -6.939 5.967 -13.223 1.00 31.00 H new ATOM 0 HA GLN A 87 -7.602 8.747 -12.949 1.00 52.34 H new ATOM 0 HB2 GLN A 87 -7.889 8.597 -15.399 1.00 3.45 H new ATOM 0 HB3 GLN A 87 -6.386 7.845 -14.901 1.00 3.45 H new ATOM 0 HG2 GLN A 87 -7.466 5.591 -15.074 1.00 62.43 H new ATOM 0 HG3 GLN A 87 -8.958 6.351 -15.592 1.00 62.43 H new ATOM 0 HE21 GLN A 87 -7.325 4.350 -17.000 1.00 1.52 H new ATOM 0 HE22 GLN A 87 -6.895 5.078 -18.551 1.00 1.52 H new ATOM 1430 N ASP A 88 -10.014 6.638 -12.772 1.00 52.45 N ATOM 1431 CA ASP A 88 -11.452 6.451 -12.513 1.00 60.54 C ATOM 1432 C ASP A 88 -11.729 6.578 -11.004 1.00 60.32 C ATOM 1433 O ASP A 88 -11.265 5.749 -10.213 1.00 13.50 O ATOM 1434 CB ASP A 88 -11.915 5.061 -13.039 1.00 62.01 C ATOM 1435 CG ASP A 88 -13.397 4.735 -12.744 1.00 10.54 C ATOM 1436 OD1 ASP A 88 -14.256 5.632 -12.890 1.00 35.34 O ATOM 1437 OD2 ASP A 88 -13.712 3.579 -12.383 1.00 23.30 O ATOM 0 H ASP A 88 -9.452 5.824 -12.522 1.00 52.45 H new ATOM 0 HA ASP A 88 -12.015 7.222 -13.039 1.00 60.54 H new ATOM 0 HB2 ASP A 88 -11.753 5.020 -14.116 1.00 62.01 H new ATOM 0 HB3 ASP A 88 -11.289 4.289 -12.593 1.00 62.01 H new ATOM 1442 N GLU A 89 -12.485 7.632 -10.622 1.00 33.42 N ATOM 1443 CA GLU A 89 -12.885 7.892 -9.219 1.00 61.02 C ATOM 1444 C GLU A 89 -13.859 6.832 -8.679 1.00 61.55 C ATOM 1445 O GLU A 89 -13.997 6.673 -7.461 1.00 64.00 O ATOM 1446 CB GLU A 89 -13.497 9.306 -9.048 1.00 4.42 C ATOM 1447 CG GLU A 89 -12.528 10.465 -9.328 1.00 51.14 C ATOM 1448 CD GLU A 89 -13.108 11.835 -8.941 1.00 14.52 C ATOM 1449 OE1 GLU A 89 -13.867 12.423 -9.739 1.00 73.23 O ATOM 1450 OE2 GLU A 89 -12.815 12.331 -7.826 1.00 62.40 O ATOM 0 H GLU A 89 -12.836 8.328 -11.279 1.00 33.42 H new ATOM 0 HA GLU A 89 -11.968 7.835 -8.632 1.00 61.02 H new ATOM 0 HB2 GLU A 89 -14.354 9.399 -9.715 1.00 4.42 H new ATOM 0 HB3 GLU A 89 -13.873 9.403 -8.030 1.00 4.42 H new ATOM 0 HG2 GLU A 89 -11.602 10.299 -8.777 1.00 51.14 H new ATOM 0 HG3 GLU A 89 -12.272 10.470 -10.388 1.00 51.14 H new ATOM 1457 N GLU A 90 -14.547 6.131 -9.591 1.00 0.23 N ATOM 1458 CA GLU A 90 -15.466 5.039 -9.234 1.00 52.12 C ATOM 1459 C GLU A 90 -14.674 3.784 -8.814 1.00 42.11 C ATOM 1460 O GLU A 90 -15.136 3.024 -7.970 1.00 23.24 O ATOM 1461 CB GLU A 90 -16.427 4.759 -10.414 1.00 4.43 C ATOM 1462 CG GLU A 90 -17.257 5.994 -10.828 1.00 64.45 C ATOM 1463 CD GLU A 90 -18.125 5.758 -12.068 1.00 34.43 C ATOM 1464 OE1 GLU A 90 -19.261 5.254 -11.931 1.00 55.40 O ATOM 1465 OE2 GLU A 90 -17.684 6.087 -13.191 1.00 34.03 O ATOM 0 H GLU A 90 -14.483 6.304 -10.594 1.00 0.23 H new ATOM 0 HA GLU A 90 -16.071 5.334 -8.377 1.00 52.12 H new ATOM 0 HB2 GLU A 90 -15.849 4.414 -11.271 1.00 4.43 H new ATOM 0 HB3 GLU A 90 -17.104 3.950 -10.139 1.00 4.43 H new ATOM 0 HG2 GLU A 90 -17.897 6.287 -9.996 1.00 64.45 H new ATOM 0 HG3 GLU A 90 -16.582 6.828 -11.020 1.00 64.45 H new ATOM 1472 N ALA A 91 -13.470 3.589 -9.405 1.00 31.11 N ATOM 1473 CA ALA A 91 -12.518 2.533 -8.983 1.00 1.34 C ATOM 1474 C ALA A 91 -11.861 2.905 -7.649 1.00 53.25 C ATOM 1475 O ALA A 91 -11.625 2.033 -6.796 1.00 33.20 O ATOM 1476 CB ALA A 91 -11.445 2.304 -10.063 1.00 2.01 C ATOM 0 H ALA A 91 -13.133 4.156 -10.183 1.00 31.11 H new ATOM 0 HA ALA A 91 -13.075 1.605 -8.850 1.00 1.34 H new ATOM 0 HB1 ALA A 91 -10.757 1.526 -9.733 1.00 2.01 H new ATOM 0 HB2 ALA A 91 -11.924 1.995 -10.992 1.00 2.01 H new ATOM 0 HB3 ALA A 91 -10.893 3.229 -10.230 1.00 2.01 H new ATOM 1482 N LEU A 92 -11.584 4.223 -7.490 1.00 64.22 N ATOM 1483 CA LEU A 92 -11.017 4.791 -6.258 1.00 41.14 C ATOM 1484 C LEU A 92 -11.944 4.511 -5.059 1.00 63.41 C ATOM 1485 O LEU A 92 -11.519 3.921 -4.074 1.00 41.03 O ATOM 1486 CB LEU A 92 -10.778 6.328 -6.411 1.00 33.15 C ATOM 1487 CG LEU A 92 -9.722 6.775 -7.474 1.00 35.45 C ATOM 1488 CD1 LEU A 92 -9.590 8.315 -7.544 1.00 44.31 C ATOM 1489 CD2 LEU A 92 -8.363 6.126 -7.207 1.00 61.04 C ATOM 0 H LEU A 92 -11.751 4.917 -8.219 1.00 64.22 H new ATOM 0 HA LEU A 92 -10.055 4.312 -6.076 1.00 41.14 H new ATOM 0 HB2 LEU A 92 -11.730 6.797 -6.660 1.00 33.15 H new ATOM 0 HB3 LEU A 92 -10.472 6.722 -5.442 1.00 33.15 H new ATOM 0 HG LEU A 92 -10.080 6.433 -8.445 1.00 35.45 H new ATOM 0 HD11 LEU A 92 -8.846 8.583 -8.295 1.00 44.31 H new ATOM 0 HD12 LEU A 92 -10.552 8.751 -7.815 1.00 44.31 H new ATOM 0 HD13 LEU A 92 -9.279 8.698 -6.572 1.00 44.31 H new ATOM 0 HD21 LEU A 92 -7.648 6.455 -7.961 1.00 61.04 H new ATOM 0 HD22 LEU A 92 -8.008 6.419 -6.219 1.00 61.04 H new ATOM 0 HD23 LEU A 92 -8.463 5.041 -7.250 1.00 61.04 H new ATOM 1501 N ARG A 93 -13.232 4.901 -5.201 1.00 74.14 N ATOM 1502 CA ARG A 93 -14.235 4.798 -4.119 1.00 52.12 C ATOM 1503 C ARG A 93 -14.710 3.352 -3.879 1.00 54.42 C ATOM 1504 O ARG A 93 -15.061 3.002 -2.745 1.00 63.41 O ATOM 1505 CB ARG A 93 -15.453 5.711 -4.399 1.00 23.15 C ATOM 1506 CG ARG A 93 -15.196 7.222 -4.207 1.00 22.14 C ATOM 1507 CD ARG A 93 -16.507 8.034 -4.212 1.00 43.42 C ATOM 1508 NE ARG A 93 -17.434 7.600 -3.145 1.00 31.04 N ATOM 1509 CZ ARG A 93 -18.427 8.343 -2.624 1.00 22.03 C ATOM 1510 NH1 ARG A 93 -18.665 9.591 -3.054 1.00 30.11 N ATOM 1511 NH2 ARG A 93 -19.198 7.825 -1.674 1.00 73.45 N ATOM 0 H ARG A 93 -13.603 5.294 -6.066 1.00 74.14 H new ATOM 0 HA ARG A 93 -13.734 5.133 -3.211 1.00 52.12 H new ATOM 0 HB2 ARG A 93 -15.787 5.542 -5.423 1.00 23.15 H new ATOM 0 HB3 ARG A 93 -16.271 5.411 -3.744 1.00 23.15 H new ATOM 0 HG2 ARG A 93 -14.672 7.384 -3.265 1.00 22.14 H new ATOM 0 HG3 ARG A 93 -14.543 7.583 -5.001 1.00 22.14 H new ATOM 0 HD2 ARG A 93 -16.278 9.092 -4.085 1.00 43.42 H new ATOM 0 HD3 ARG A 93 -16.995 7.928 -5.181 1.00 43.42 H new ATOM 0 HE ARG A 93 -17.310 6.658 -2.773 1.00 31.04 H new ATOM 0 HH11 ARG A 93 -18.087 9.995 -3.791 1.00 30.11 H new ATOM 0 HH12 ARG A 93 -19.424 10.136 -2.644 1.00 30.11 H new ATOM 0 HH21 ARG A 93 -19.034 6.873 -1.347 1.00 73.45 H new ATOM 0 HH22 ARG A 93 -19.954 8.379 -1.272 1.00 73.45 H new ATOM 1525 N LYS A 94 -14.730 2.530 -4.940 1.00 51.44 N ATOM 1526 CA LYS A 94 -15.152 1.122 -4.858 1.00 11.35 C ATOM 1527 C LYS A 94 -14.255 0.338 -3.885 1.00 55.42 C ATOM 1528 O LYS A 94 -14.751 -0.345 -2.987 1.00 42.22 O ATOM 1529 CB LYS A 94 -15.131 0.495 -6.272 1.00 25.22 C ATOM 1530 CG LYS A 94 -15.377 -1.018 -6.320 1.00 65.34 C ATOM 1531 CD LYS A 94 -15.542 -1.548 -7.760 1.00 21.13 C ATOM 1532 CE LYS A 94 -15.455 -3.078 -7.838 1.00 50.42 C ATOM 1533 NZ LYS A 94 -14.079 -3.564 -7.550 1.00 62.43 N ATOM 0 H LYS A 94 -14.455 2.822 -5.878 1.00 51.44 H new ATOM 0 HA LYS A 94 -16.169 1.074 -4.470 1.00 11.35 H new ATOM 0 HB2 LYS A 94 -15.887 0.989 -6.882 1.00 25.22 H new ATOM 0 HB3 LYS A 94 -14.164 0.704 -6.730 1.00 25.22 H new ATOM 0 HG2 LYS A 94 -14.544 -1.533 -5.841 1.00 65.34 H new ATOM 0 HG3 LYS A 94 -16.272 -1.255 -5.745 1.00 65.34 H new ATOM 0 HD2 LYS A 94 -16.504 -1.222 -8.156 1.00 21.13 H new ATOM 0 HD3 LYS A 94 -14.771 -1.111 -8.395 1.00 21.13 H new ATOM 0 HE2 LYS A 94 -16.154 -3.519 -7.127 1.00 50.42 H new ATOM 0 HE3 LYS A 94 -15.758 -3.410 -8.831 1.00 50.42 H new ATOM 0 HZ1 LYS A 94 -13.995 -4.560 -7.838 1.00 62.43 H new ATOM 0 HZ2 LYS A 94 -13.391 -2.991 -8.079 1.00 62.43 H new ATOM 0 HZ3 LYS A 94 -13.888 -3.482 -6.531 1.00 62.43 H new ATOM 1547 N GLY A 95 -12.933 0.470 -4.069 1.00 1.32 N ATOM 1548 CA GLY A 95 -11.961 -0.136 -3.163 1.00 13.11 C ATOM 1549 C GLY A 95 -11.852 0.606 -1.836 1.00 63.53 C ATOM 1550 O GLY A 95 -11.562 -0.012 -0.806 1.00 12.43 O ATOM 0 H GLY A 95 -12.517 0.993 -4.840 1.00 1.32 H new ATOM 0 HA2 GLY A 95 -12.243 -1.172 -2.973 1.00 13.11 H new ATOM 0 HA3 GLY A 95 -10.984 -0.155 -3.645 1.00 13.11 H new ATOM 1554 N TYR A 96 -12.071 1.948 -1.880 1.00 63.20 N ATOM 1555 CA TYR A 96 -11.934 2.840 -0.708 1.00 41.53 C ATOM 1556 C TYR A 96 -12.881 2.420 0.406 1.00 4.34 C ATOM 1557 O TYR A 96 -12.441 2.039 1.483 1.00 51.03 O ATOM 1558 CB TYR A 96 -12.196 4.322 -1.111 1.00 62.13 C ATOM 1559 CG TYR A 96 -12.241 5.352 0.041 1.00 12.24 C ATOM 1560 CD1 TYR A 96 -11.086 5.728 0.718 1.00 44.02 C ATOM 1561 CD2 TYR A 96 -13.448 5.933 0.461 1.00 14.22 C ATOM 1562 CE1 TYR A 96 -11.124 6.634 1.759 1.00 62.21 C ATOM 1563 CE2 TYR A 96 -13.488 6.837 1.507 1.00 22.44 C ATOM 1564 CZ TYR A 96 -12.321 7.183 2.151 1.00 50.11 C ATOM 1565 OH TYR A 96 -12.361 8.066 3.214 1.00 34.11 O ATOM 0 H TYR A 96 -12.347 2.437 -2.732 1.00 63.20 H new ATOM 0 HA TYR A 96 -10.912 2.757 -0.339 1.00 41.53 H new ATOM 0 HB2 TYR A 96 -11.419 4.628 -1.812 1.00 62.13 H new ATOM 0 HB3 TYR A 96 -13.144 4.367 -1.647 1.00 62.13 H new ATOM 0 HD1 TYR A 96 -10.138 5.302 0.423 1.00 44.02 H new ATOM 0 HD2 TYR A 96 -14.365 5.668 -0.044 1.00 14.22 H new ATOM 0 HE1 TYR A 96 -10.212 6.912 2.266 1.00 62.21 H new ATOM 0 HE2 TYR A 96 -14.428 7.269 1.817 1.00 22.44 H new ATOM 0 HH TYR A 96 -13.284 8.361 3.359 1.00 34.11 H new ATOM 1575 N GLU A 97 -14.174 2.417 0.080 1.00 20.22 N ATOM 1576 CA GLU A 97 -15.253 2.194 1.047 1.00 40.32 C ATOM 1577 C GLU A 97 -15.309 0.716 1.466 1.00 20.13 C ATOM 1578 O GLU A 97 -15.614 0.414 2.608 1.00 21.35 O ATOM 1579 CB GLU A 97 -16.586 2.697 0.425 1.00 24.33 C ATOM 1580 CG GLU A 97 -16.524 4.187 -0.006 1.00 25.12 C ATOM 1581 CD GLU A 97 -17.755 4.683 -0.777 1.00 22.25 C ATOM 1582 OE1 GLU A 97 -17.778 4.579 -2.017 1.00 12.52 O ATOM 1583 OE2 GLU A 97 -18.706 5.198 -0.151 1.00 34.34 O ATOM 0 H GLU A 97 -14.507 2.571 -0.872 1.00 20.22 H new ATOM 0 HA GLU A 97 -15.070 2.758 1.961 1.00 40.32 H new ATOM 0 HB2 GLU A 97 -16.832 2.083 -0.441 1.00 24.33 H new ATOM 0 HB3 GLU A 97 -17.391 2.566 1.148 1.00 24.33 H new ATOM 0 HG2 GLU A 97 -16.397 4.804 0.884 1.00 25.12 H new ATOM 0 HG3 GLU A 97 -15.640 4.335 -0.626 1.00 25.12 H new ATOM 1590 N ASP A 98 -14.952 -0.178 0.528 1.00 70.02 N ATOM 1591 CA ASP A 98 -14.877 -1.639 0.759 1.00 24.52 C ATOM 1592 C ASP A 98 -13.847 -1.990 1.860 1.00 41.12 C ATOM 1593 O ASP A 98 -14.179 -2.629 2.865 1.00 44.11 O ATOM 1594 CB ASP A 98 -14.516 -2.331 -0.597 1.00 42.21 C ATOM 1595 CG ASP A 98 -14.065 -3.804 -0.489 1.00 34.03 C ATOM 1596 OD1 ASP A 98 -14.913 -4.679 -0.211 1.00 44.14 O ATOM 1597 OD2 ASP A 98 -12.868 -4.096 -0.729 1.00 2.53 O ATOM 0 H ASP A 98 -14.704 0.092 -0.424 1.00 70.02 H new ATOM 0 HA ASP A 98 -15.842 -2.001 1.114 1.00 24.52 H new ATOM 0 HB2 ASP A 98 -15.385 -2.282 -1.253 1.00 42.21 H new ATOM 0 HB3 ASP A 98 -13.721 -1.760 -1.077 1.00 42.21 H new ATOM 1602 N LYS A 99 -12.610 -1.517 1.672 1.00 63.23 N ATOM 1603 CA LYS A 99 -11.471 -1.825 2.560 1.00 62.10 C ATOM 1604 C LYS A 99 -11.491 -0.972 3.850 1.00 5.45 C ATOM 1605 O LYS A 99 -10.971 -1.395 4.889 1.00 65.21 O ATOM 1606 CB LYS A 99 -10.159 -1.668 1.742 1.00 13.10 C ATOM 1607 CG LYS A 99 -10.040 -2.724 0.613 1.00 0.44 C ATOM 1608 CD LYS A 99 -8.982 -2.399 -0.456 1.00 15.52 C ATOM 1609 CE LYS A 99 -9.035 -3.383 -1.640 1.00 1.34 C ATOM 1610 NZ LYS A 99 -10.376 -3.398 -2.293 1.00 52.11 N ATOM 0 H LYS A 99 -12.364 -0.904 0.895 1.00 63.23 H new ATOM 0 HA LYS A 99 -11.543 -2.854 2.911 1.00 62.10 H new ATOM 0 HB2 LYS A 99 -10.122 -0.669 1.308 1.00 13.10 H new ATOM 0 HB3 LYS A 99 -9.303 -1.757 2.411 1.00 13.10 H new ATOM 0 HG2 LYS A 99 -9.802 -3.690 1.060 1.00 0.44 H new ATOM 0 HG3 LYS A 99 -11.010 -2.828 0.126 1.00 0.44 H new ATOM 0 HD2 LYS A 99 -9.136 -1.384 -0.821 1.00 15.52 H new ATOM 0 HD3 LYS A 99 -7.990 -2.428 -0.005 1.00 15.52 H new ATOM 0 HE2 LYS A 99 -8.277 -3.109 -2.374 1.00 1.34 H new ATOM 0 HE3 LYS A 99 -8.791 -4.386 -1.289 1.00 1.34 H new ATOM 0 HZ1 LYS A 99 -10.260 -3.508 -3.321 1.00 52.11 H new ATOM 0 HZ2 LYS A 99 -10.935 -4.192 -1.921 1.00 52.11 H new ATOM 0 HZ3 LYS A 99 -10.869 -2.504 -2.093 1.00 52.11 H new ATOM 1624 N LYS A 100 -12.113 0.219 3.772 1.00 74.32 N ATOM 1625 CA LYS A 100 -12.264 1.137 4.925 1.00 34.45 C ATOM 1626 C LYS A 100 -13.156 0.506 6.014 1.00 31.51 C ATOM 1627 O LYS A 100 -12.863 0.638 7.207 1.00 75.12 O ATOM 1628 CB LYS A 100 -12.833 2.494 4.447 1.00 2.03 C ATOM 1629 CG LYS A 100 -12.937 3.603 5.518 1.00 20.14 C ATOM 1630 CD LYS A 100 -13.369 4.954 4.894 1.00 53.21 C ATOM 1631 CE LYS A 100 -13.391 6.119 5.897 1.00 24.31 C ATOM 1632 NZ LYS A 100 -14.455 5.968 6.923 1.00 4.33 N ATOM 0 H LYS A 100 -12.526 0.575 2.910 1.00 74.32 H new ATOM 0 HA LYS A 100 -11.284 1.313 5.368 1.00 34.45 H new ATOM 0 HB2 LYS A 100 -12.207 2.861 3.633 1.00 2.03 H new ATOM 0 HB3 LYS A 100 -13.827 2.323 4.033 1.00 2.03 H new ATOM 0 HG2 LYS A 100 -13.656 3.307 6.282 1.00 20.14 H new ATOM 0 HG3 LYS A 100 -11.974 3.722 6.016 1.00 20.14 H new ATOM 0 HD2 LYS A 100 -12.689 5.201 4.078 1.00 53.21 H new ATOM 0 HD3 LYS A 100 -14.362 4.842 4.459 1.00 53.21 H new ATOM 0 HE2 LYS A 100 -12.422 6.187 6.391 1.00 24.31 H new ATOM 0 HE3 LYS A 100 -13.541 7.055 5.358 1.00 24.31 H new ATOM 0 HZ1 LYS A 100 -14.427 6.779 7.574 1.00 4.33 H new ATOM 0 HZ2 LYS A 100 -15.384 5.930 6.457 1.00 4.33 H new ATOM 0 HZ3 LYS A 100 -14.300 5.089 7.457 1.00 4.33 H new ATOM 1646 N LYS A 101 -14.219 -0.217 5.579 1.00 51.23 N ATOM 1647 CA LYS A 101 -15.132 -0.969 6.486 1.00 63.10 C ATOM 1648 C LYS A 101 -14.367 -2.022 7.315 1.00 53.32 C ATOM 1649 O LYS A 101 -14.681 -2.269 8.486 1.00 62.43 O ATOM 1650 CB LYS A 101 -16.236 -1.696 5.662 1.00 12.42 C ATOM 1651 CG LYS A 101 -17.213 -0.763 4.921 1.00 54.44 C ATOM 1652 CD LYS A 101 -18.128 -1.527 3.935 1.00 14.02 C ATOM 1653 CE LYS A 101 -18.946 -0.584 3.037 1.00 13.12 C ATOM 1654 NZ LYS A 101 -19.845 0.307 3.819 1.00 53.34 N ATOM 0 H LYS A 101 -14.469 -0.297 4.593 1.00 51.23 H new ATOM 0 HA LYS A 101 -15.582 -0.243 7.163 1.00 63.10 H new ATOM 0 HB2 LYS A 101 -15.755 -2.347 4.932 1.00 12.42 H new ATOM 0 HB3 LYS A 101 -16.807 -2.337 6.334 1.00 12.42 H new ATOM 0 HG2 LYS A 101 -17.829 -0.235 5.649 1.00 54.44 H new ATOM 0 HG3 LYS A 101 -16.647 -0.008 4.376 1.00 54.44 H new ATOM 0 HD2 LYS A 101 -17.518 -2.180 3.310 1.00 14.02 H new ATOM 0 HD3 LYS A 101 -18.807 -2.168 4.497 1.00 14.02 H new ATOM 0 HE2 LYS A 101 -18.267 0.024 2.439 1.00 13.12 H new ATOM 0 HE3 LYS A 101 -19.541 -1.175 2.341 1.00 13.12 H new ATOM 0 HZ1 LYS A 101 -20.374 0.923 3.169 1.00 53.34 H new ATOM 0 HZ2 LYS A 101 -20.512 -0.270 4.370 1.00 53.34 H new ATOM 0 HZ3 LYS A 101 -19.278 0.892 4.465 1.00 53.34 H new ATOM 1668 N LYS A 102 -13.343 -2.615 6.677 1.00 52.43 N ATOM 1669 CA LYS A 102 -12.543 -3.720 7.245 1.00 13.42 C ATOM 1670 C LYS A 102 -11.501 -3.206 8.266 1.00 51.04 C ATOM 1671 O LYS A 102 -10.818 -4.003 8.919 1.00 34.14 O ATOM 1672 CB LYS A 102 -11.846 -4.482 6.089 1.00 14.23 C ATOM 1673 CG LYS A 102 -12.806 -4.935 4.962 1.00 24.54 C ATOM 1674 CD LYS A 102 -12.093 -5.654 3.797 1.00 61.12 C ATOM 1675 CE LYS A 102 -11.420 -6.970 4.216 1.00 72.10 C ATOM 1676 NZ LYS A 102 -12.384 -7.914 4.846 1.00 62.10 N ATOM 0 H LYS A 102 -13.042 -2.339 5.742 1.00 52.43 H new ATOM 0 HA LYS A 102 -13.209 -4.394 7.783 1.00 13.42 H new ATOM 0 HB2 LYS A 102 -11.075 -3.843 5.660 1.00 14.23 H new ATOM 0 HB3 LYS A 102 -11.343 -5.358 6.497 1.00 14.23 H new ATOM 0 HG2 LYS A 102 -13.559 -5.601 5.383 1.00 24.54 H new ATOM 0 HG3 LYS A 102 -13.333 -4.064 4.573 1.00 24.54 H new ATOM 0 HD2 LYS A 102 -12.817 -5.859 3.008 1.00 61.12 H new ATOM 0 HD3 LYS A 102 -11.341 -4.988 3.374 1.00 61.12 H new ATOM 0 HE2 LYS A 102 -10.970 -7.441 3.342 1.00 72.10 H new ATOM 0 HE3 LYS A 102 -10.612 -6.757 4.915 1.00 72.10 H new ATOM 0 HZ1 LYS A 102 -11.929 -8.840 4.974 1.00 62.10 H new ATOM 0 HZ2 LYS A 102 -12.680 -7.542 5.771 1.00 62.10 H new ATOM 0 HZ3 LYS A 102 -13.217 -8.020 4.233 1.00 62.10 H new ATOM 1690 N GLY A 103 -11.391 -1.868 8.377 1.00 71.31 N ATOM 1691 CA GLY A 103 -10.523 -1.220 9.360 1.00 65.14 C ATOM 1692 C GLY A 103 -9.184 -0.814 8.778 1.00 52.22 C ATOM 1693 O GLY A 103 -8.197 -0.713 9.508 1.00 72.04 O ATOM 0 H GLY A 103 -11.903 -1.213 7.786 1.00 71.31 H new ATOM 0 HA2 GLY A 103 -11.025 -0.338 9.757 1.00 65.14 H new ATOM 0 HA3 GLY A 103 -10.360 -1.898 10.198 1.00 65.14 H new ATOM 1697 N TYR A 104 -9.135 -0.599 7.453 1.00 45.42 N ATOM 1698 CA TYR A 104 -7.914 -0.154 6.754 1.00 71.23 C ATOM 1699 C TYR A 104 -8.051 1.346 6.434 1.00 63.22 C ATOM 1700 O TYR A 104 -9.126 1.782 5.993 1.00 74.53 O ATOM 1701 CB TYR A 104 -7.692 -0.974 5.441 1.00 74.11 C ATOM 1702 CG TYR A 104 -7.861 -2.508 5.567 1.00 62.51 C ATOM 1703 CD1 TYR A 104 -7.506 -3.207 6.726 1.00 75.40 C ATOM 1704 CD2 TYR A 104 -8.406 -3.255 4.520 1.00 12.03 C ATOM 1705 CE1 TYR A 104 -7.683 -4.579 6.826 1.00 25.10 C ATOM 1706 CE2 TYR A 104 -8.587 -4.620 4.619 1.00 32.30 C ATOM 1707 CZ TYR A 104 -8.230 -5.277 5.776 1.00 74.14 C ATOM 1708 OH TYR A 104 -8.414 -6.642 5.873 1.00 71.25 O ATOM 0 H TYR A 104 -9.937 -0.728 6.836 1.00 45.42 H new ATOM 0 HA TYR A 104 -7.048 -0.320 7.395 1.00 71.23 H new ATOM 0 HB2 TYR A 104 -8.390 -0.611 4.686 1.00 74.11 H new ATOM 0 HB3 TYR A 104 -6.688 -0.767 5.072 1.00 74.11 H new ATOM 0 HD1 TYR A 104 -7.085 -2.666 7.561 1.00 75.40 H new ATOM 0 HD2 TYR A 104 -8.693 -2.751 3.609 1.00 12.03 H new ATOM 0 HE1 TYR A 104 -7.392 -5.098 7.727 1.00 25.10 H new ATOM 0 HE2 TYR A 104 -9.008 -5.172 3.791 1.00 32.30 H new ATOM 0 HH TYR A 104 -8.573 -6.885 6.809 1.00 71.25 H new ATOM 1718 N ASP A 105 -6.995 2.140 6.686 1.00 34.45 N ATOM 1719 CA ASP A 105 -6.976 3.567 6.320 1.00 2.31 C ATOM 1720 C ASP A 105 -6.717 3.677 4.818 1.00 21.04 C ATOM 1721 O ASP A 105 -5.577 3.567 4.368 1.00 60.41 O ATOM 1722 CB ASP A 105 -5.887 4.339 7.111 1.00 54.23 C ATOM 1723 CG ASP A 105 -6.007 4.150 8.625 1.00 52.43 C ATOM 1724 OD1 ASP A 105 -7.025 4.586 9.207 1.00 11.22 O ATOM 1725 OD2 ASP A 105 -5.089 3.568 9.240 1.00 22.34 O ATOM 0 H ASP A 105 -6.142 1.816 7.143 1.00 34.45 H new ATOM 0 HA ASP A 105 -7.938 4.014 6.572 1.00 2.31 H new ATOM 0 HB2 ASP A 105 -4.902 4.005 6.785 1.00 54.23 H new ATOM 0 HB3 ASP A 105 -5.958 5.401 6.875 1.00 54.23 H new ATOM 1730 N VAL A 106 -7.775 3.897 4.035 1.00 74.01 N ATOM 1731 CA VAL A 106 -7.662 3.929 2.574 1.00 41.31 C ATOM 1732 C VAL A 106 -7.590 5.385 2.094 1.00 41.31 C ATOM 1733 O VAL A 106 -8.198 6.278 2.687 1.00 71.42 O ATOM 1734 CB VAL A 106 -8.841 3.160 1.862 1.00 54.01 C ATOM 1735 CG1 VAL A 106 -8.554 2.986 0.349 1.00 72.11 C ATOM 1736 CG2 VAL A 106 -9.100 1.793 2.532 1.00 63.13 C ATOM 0 H VAL A 106 -8.719 4.056 4.387 1.00 74.01 H new ATOM 0 HA VAL A 106 -6.744 3.410 2.299 1.00 41.31 H new ATOM 0 HB VAL A 106 -9.743 3.762 1.969 1.00 54.01 H new ATOM 0 HG11 VAL A 106 -9.381 2.453 -0.119 1.00 72.11 H new ATOM 0 HG12 VAL A 106 -8.444 3.966 -0.116 1.00 72.11 H new ATOM 0 HG13 VAL A 106 -7.634 2.417 0.216 1.00 72.11 H new ATOM 0 HG21 VAL A 106 -9.918 1.286 2.020 1.00 63.13 H new ATOM 0 HG22 VAL A 106 -8.200 1.182 2.472 1.00 63.13 H new ATOM 0 HG23 VAL A 106 -9.366 1.945 3.578 1.00 63.13 H new ATOM 1746 N TYR A 107 -6.777 5.611 1.064 1.00 32.35 N ATOM 1747 CA TYR A 107 -6.576 6.895 0.414 1.00 12.45 C ATOM 1748 C TYR A 107 -6.832 6.721 -1.087 1.00 44.20 C ATOM 1749 O TYR A 107 -6.469 5.696 -1.676 1.00 2.12 O ATOM 1750 CB TYR A 107 -5.132 7.394 0.669 1.00 54.54 C ATOM 1751 CG TYR A 107 -4.830 7.705 2.145 1.00 52.12 C ATOM 1752 CD1 TYR A 107 -5.160 8.941 2.701 1.00 61.10 C ATOM 1753 CD2 TYR A 107 -4.230 6.762 2.984 1.00 50.34 C ATOM 1754 CE1 TYR A 107 -4.900 9.227 4.027 1.00 74.00 C ATOM 1755 CE2 TYR A 107 -3.970 7.042 4.313 1.00 21.33 C ATOM 1756 CZ TYR A 107 -4.306 8.277 4.831 1.00 40.33 C ATOM 1757 OH TYR A 107 -4.054 8.563 6.161 1.00 44.44 O ATOM 0 H TYR A 107 -6.218 4.868 0.645 1.00 32.35 H new ATOM 0 HA TYR A 107 -7.265 7.637 0.818 1.00 12.45 H new ATOM 0 HB2 TYR A 107 -4.430 6.639 0.316 1.00 54.54 H new ATOM 0 HB3 TYR A 107 -4.959 8.292 0.076 1.00 54.54 H new ATOM 0 HD1 TYR A 107 -5.629 9.691 2.081 1.00 61.10 H new ATOM 0 HD2 TYR A 107 -3.964 5.794 2.586 1.00 50.34 H new ATOM 0 HE1 TYR A 107 -5.161 10.193 4.433 1.00 74.00 H new ATOM 0 HE2 TYR A 107 -3.506 6.298 4.943 1.00 21.33 H new ATOM 0 HH TYR A 107 -3.633 7.788 6.588 1.00 44.44 H new ATOM 1767 N THR A 108 -7.472 7.719 -1.686 1.00 12.14 N ATOM 1768 CA THR A 108 -7.793 7.751 -3.115 1.00 73.40 C ATOM 1769 C THR A 108 -6.898 8.790 -3.798 1.00 24.42 C ATOM 1770 O THR A 108 -6.549 9.805 -3.175 1.00 12.15 O ATOM 1771 CB THR A 108 -9.301 8.120 -3.313 1.00 45.02 C ATOM 1772 OG1 THR A 108 -9.608 9.383 -2.687 1.00 61.33 O ATOM 1773 CG2 THR A 108 -10.227 7.039 -2.729 1.00 2.34 C ATOM 0 H THR A 108 -7.791 8.548 -1.184 1.00 12.14 H new ATOM 0 HA THR A 108 -7.617 6.771 -3.558 1.00 73.40 H new ATOM 0 HB THR A 108 -9.471 8.192 -4.387 1.00 45.02 H new ATOM 0 HG1 THR A 108 -10.555 9.595 -2.825 1.00 61.33 H new ATOM 0 HG21 THR A 108 -11.267 7.328 -2.884 1.00 2.34 H new ATOM 0 HG22 THR A 108 -10.036 6.089 -3.227 1.00 2.34 H new ATOM 0 HG23 THR A 108 -10.035 6.934 -1.661 1.00 2.34 H new ATOM 1781 N SER A 109 -6.523 8.545 -5.065 1.00 72.04 N ATOM 1782 CA SER A 109 -5.673 9.472 -5.825 1.00 32.11 C ATOM 1783 C SER A 109 -6.061 9.504 -7.309 1.00 63.33 C ATOM 1784 O SER A 109 -6.234 8.457 -7.940 1.00 0.13 O ATOM 1785 CB SER A 109 -4.183 9.106 -5.652 1.00 25.52 C ATOM 1786 OG SER A 109 -3.934 7.746 -5.912 1.00 3.03 O ATOM 0 H SER A 109 -6.797 7.710 -5.584 1.00 72.04 H new ATOM 0 HA SER A 109 -5.831 10.474 -5.425 1.00 32.11 H new ATOM 0 HB2 SER A 109 -3.580 9.718 -6.323 1.00 25.52 H new ATOM 0 HB3 SER A 109 -3.869 9.343 -4.636 1.00 25.52 H new ATOM 0 HG SER A 109 -4.709 7.213 -5.637 1.00 3.03 H new ATOM 1792 N ARG A 110 -6.183 10.739 -7.823 1.00 22.03 N ATOM 1793 CA ARG A 110 -6.473 11.062 -9.232 1.00 22.43 C ATOM 1794 C ARG A 110 -5.440 10.403 -10.176 1.00 21.54 C ATOM 1795 O ARG A 110 -5.798 9.864 -11.230 1.00 14.30 O ATOM 1796 CB ARG A 110 -6.428 12.610 -9.364 1.00 53.00 C ATOM 1797 CG ARG A 110 -6.692 13.209 -10.766 1.00 75.32 C ATOM 1798 CD ARG A 110 -8.184 13.368 -11.108 1.00 55.21 C ATOM 1799 NE ARG A 110 -8.872 12.099 -11.386 1.00 42.33 N ATOM 1800 CZ ARG A 110 -10.169 12.006 -11.729 1.00 4.04 C ATOM 1801 NH1 ARG A 110 -10.936 13.097 -11.824 1.00 15.13 N ATOM 1802 NH2 ARG A 110 -10.693 10.824 -12.006 1.00 3.14 N ATOM 0 H ARG A 110 -6.078 11.574 -7.246 1.00 22.03 H new ATOM 0 HA ARG A 110 -7.452 10.678 -9.517 1.00 22.43 H new ATOM 0 HB2 ARG A 110 -7.161 13.029 -8.674 1.00 53.00 H new ATOM 0 HB3 ARG A 110 -5.447 12.949 -9.031 1.00 53.00 H new ATOM 0 HG2 ARG A 110 -6.209 14.184 -10.830 1.00 75.32 H new ATOM 0 HG3 ARG A 110 -6.224 12.572 -11.516 1.00 75.32 H new ATOM 0 HD2 ARG A 110 -8.685 13.867 -10.279 1.00 55.21 H new ATOM 0 HD3 ARG A 110 -8.280 14.019 -11.977 1.00 55.21 H new ATOM 0 HE ARG A 110 -8.333 11.236 -11.314 1.00 42.33 H new ATOM 0 HH11 ARG A 110 -10.539 14.017 -11.635 1.00 15.13 H new ATOM 0 HH12 ARG A 110 -11.918 13.009 -12.085 1.00 15.13 H new ATOM 0 HH21 ARG A 110 -10.114 9.986 -11.959 1.00 3.14 H new ATOM 0 HH22 ARG A 110 -11.676 10.750 -12.266 1.00 3.14 H new ATOM 1816 N ASN A 111 -4.161 10.468 -9.751 1.00 44.23 N ATOM 1817 CA ASN A 111 -3.008 9.866 -10.457 1.00 2.41 C ATOM 1818 C ASN A 111 -1.774 9.915 -9.527 1.00 62.34 C ATOM 1819 O ASN A 111 -1.933 10.096 -8.314 1.00 12.44 O ATOM 1820 CB ASN A 111 -2.744 10.588 -11.822 1.00 41.22 C ATOM 1821 CG ASN A 111 -2.100 11.975 -11.685 1.00 0.23 C ATOM 1822 OD1 ASN A 111 -0.877 12.112 -11.736 1.00 33.13 O ATOM 1823 ND2 ASN A 111 -2.903 12.998 -11.504 1.00 51.44 N ATOM 0 H ASN A 111 -3.895 10.949 -8.892 1.00 44.23 H new ATOM 0 HA ASN A 111 -3.225 8.825 -10.697 1.00 2.41 H new ATOM 0 HB2 ASN A 111 -2.098 9.959 -12.434 1.00 41.22 H new ATOM 0 HB3 ASN A 111 -3.689 10.689 -12.356 1.00 41.22 H new ATOM 0 HD21 ASN A 111 -2.518 13.937 -11.401 1.00 51.44 H new ATOM 0 HD22 ASN A 111 -3.912 12.854 -11.466 1.00 51.44 H new ATOM 1830 N GLU A 112 -0.556 9.744 -10.109 1.00 53.35 N ATOM 1831 CA GLU A 112 0.733 9.721 -9.378 1.00 54.02 C ATOM 1832 C GLU A 112 0.951 10.963 -8.487 1.00 62.34 C ATOM 1833 O GLU A 112 1.541 10.832 -7.416 1.00 20.44 O ATOM 1834 CB GLU A 112 1.908 9.614 -10.379 1.00 0.11 C ATOM 1835 CG GLU A 112 3.298 9.409 -9.729 1.00 42.44 C ATOM 1836 CD GLU A 112 4.460 9.582 -10.716 1.00 33.11 C ATOM 1837 OE1 GLU A 112 4.510 8.842 -11.722 1.00 61.24 O ATOM 1838 OE2 GLU A 112 5.307 10.486 -10.508 1.00 63.24 O ATOM 0 H GLU A 112 -0.445 9.617 -11.115 1.00 53.35 H new ATOM 0 HA GLU A 112 0.697 8.849 -8.724 1.00 54.02 H new ATOM 0 HB2 GLU A 112 1.714 8.784 -11.058 1.00 0.11 H new ATOM 0 HB3 GLU A 112 1.935 10.520 -10.984 1.00 0.11 H new ATOM 0 HG2 GLU A 112 3.417 10.119 -8.910 1.00 42.44 H new ATOM 0 HG3 GLU A 112 3.345 8.410 -9.295 1.00 42.44 H new ATOM 1845 N ASP A 113 0.488 12.155 -8.944 1.00 53.42 N ATOM 1846 CA ASP A 113 0.677 13.428 -8.202 1.00 34.23 C ATOM 1847 C ASP A 113 0.076 13.337 -6.792 1.00 71.05 C ATOM 1848 O ASP A 113 0.749 13.601 -5.789 1.00 62.40 O ATOM 1849 CB ASP A 113 0.031 14.634 -8.950 1.00 64.34 C ATOM 1850 CG ASP A 113 0.638 14.928 -10.328 1.00 5.10 C ATOM 1851 OD1 ASP A 113 1.877 15.059 -10.426 1.00 52.45 O ATOM 1852 OD2 ASP A 113 -0.109 15.035 -11.325 1.00 20.12 O ATOM 0 H ASP A 113 -0.019 12.261 -9.823 1.00 53.42 H new ATOM 0 HA ASP A 113 1.752 13.593 -8.132 1.00 34.23 H new ATOM 0 HB2 ASP A 113 -1.035 14.442 -9.070 1.00 64.34 H new ATOM 0 HB3 ASP A 113 0.126 15.524 -8.328 1.00 64.34 H new ATOM 1857 N GLU A 114 -1.194 12.914 -6.752 1.00 13.05 N ATOM 1858 CA GLU A 114 -1.981 12.787 -5.521 1.00 30.01 C ATOM 1859 C GLU A 114 -1.511 11.568 -4.708 1.00 24.11 C ATOM 1860 O GLU A 114 -1.458 11.623 -3.479 1.00 70.00 O ATOM 1861 CB GLU A 114 -3.496 12.675 -5.855 1.00 24.11 C ATOM 1862 CG GLU A 114 -4.152 13.964 -6.407 1.00 75.11 C ATOM 1863 CD GLU A 114 -3.572 14.487 -7.740 1.00 32.23 C ATOM 1864 OE1 GLU A 114 -3.369 13.678 -8.674 1.00 60.44 O ATOM 1865 OE2 GLU A 114 -3.341 15.713 -7.868 1.00 20.14 O ATOM 0 H GLU A 114 -1.711 12.646 -7.589 1.00 13.05 H new ATOM 0 HA GLU A 114 -1.829 13.681 -4.916 1.00 30.01 H new ATOM 0 HB2 GLU A 114 -3.632 11.877 -6.585 1.00 24.11 H new ATOM 0 HB3 GLU A 114 -4.028 12.375 -4.952 1.00 24.11 H new ATOM 0 HG2 GLU A 114 -5.218 13.779 -6.542 1.00 75.11 H new ATOM 0 HG3 GLU A 114 -4.057 14.749 -5.657 1.00 75.11 H new ATOM 1872 N ALA A 115 -1.148 10.487 -5.425 1.00 21.40 N ATOM 1873 CA ALA A 115 -0.649 9.225 -4.832 1.00 4.44 C ATOM 1874 C ALA A 115 0.626 9.460 -4.016 1.00 12.30 C ATOM 1875 O ALA A 115 0.797 8.898 -2.935 1.00 73.44 O ATOM 1876 CB ALA A 115 -0.374 8.210 -5.940 1.00 34.24 C ATOM 0 H ALA A 115 -1.192 10.462 -6.444 1.00 21.40 H new ATOM 0 HA ALA A 115 -1.415 8.838 -4.160 1.00 4.44 H new ATOM 0 HB1 ALA A 115 -0.007 7.282 -5.501 1.00 34.24 H new ATOM 0 HB2 ALA A 115 -1.295 8.012 -6.489 1.00 34.24 H new ATOM 0 HB3 ALA A 115 0.376 8.610 -6.622 1.00 34.24 H new ATOM 1882 N LYS A 116 1.482 10.327 -4.572 1.00 5.54 N ATOM 1883 CA LYS A 116 2.781 10.711 -4.005 1.00 64.11 C ATOM 1884 C LYS A 116 2.589 11.478 -2.687 1.00 2.42 C ATOM 1885 O LYS A 116 3.374 11.318 -1.749 1.00 30.14 O ATOM 1886 CB LYS A 116 3.523 11.566 -5.067 1.00 22.31 C ATOM 1887 CG LYS A 116 4.956 12.013 -4.704 1.00 64.30 C ATOM 1888 CD LYS A 116 5.724 12.578 -5.929 1.00 52.41 C ATOM 1889 CE LYS A 116 5.886 11.542 -7.068 1.00 72.32 C ATOM 1890 NZ LYS A 116 6.573 12.113 -8.263 1.00 2.31 N ATOM 0 H LYS A 116 1.283 10.795 -5.456 1.00 5.54 H new ATOM 0 HA LYS A 116 3.376 9.829 -3.767 1.00 64.11 H new ATOM 0 HB2 LYS A 116 3.567 10.996 -5.995 1.00 22.31 H new ATOM 0 HB3 LYS A 116 2.927 12.456 -5.267 1.00 22.31 H new ATOM 0 HG2 LYS A 116 4.911 12.773 -3.924 1.00 64.30 H new ATOM 0 HG3 LYS A 116 5.505 11.166 -4.292 1.00 64.30 H new ATOM 0 HD2 LYS A 116 5.196 13.451 -6.311 1.00 52.41 H new ATOM 0 HD3 LYS A 116 6.710 12.916 -5.609 1.00 52.41 H new ATOM 0 HE2 LYS A 116 6.454 10.687 -6.700 1.00 72.32 H new ATOM 0 HE3 LYS A 116 4.904 11.171 -7.360 1.00 72.32 H new ATOM 0 HZ1 LYS A 116 6.234 11.633 -9.121 1.00 2.31 H new ATOM 0 HZ2 LYS A 116 6.365 13.130 -8.330 1.00 2.31 H new ATOM 0 HZ3 LYS A 116 7.600 11.975 -8.172 1.00 2.31 H new ATOM 1904 N LYS A 117 1.514 12.288 -2.631 1.00 4.04 N ATOM 1905 CA LYS A 117 1.146 13.047 -1.425 1.00 25.30 C ATOM 1906 C LYS A 117 0.649 12.088 -0.331 1.00 52.02 C ATOM 1907 O LYS A 117 1.186 12.066 0.780 1.00 13.14 O ATOM 1908 CB LYS A 117 0.053 14.100 -1.754 1.00 41.23 C ATOM 1909 CG LYS A 117 0.411 15.076 -2.901 1.00 21.14 C ATOM 1910 CD LYS A 117 1.641 15.955 -2.613 1.00 22.03 C ATOM 1911 CE LYS A 117 1.406 16.959 -1.474 1.00 44.44 C ATOM 1912 NZ LYS A 117 2.627 17.753 -1.186 1.00 32.30 N ATOM 0 H LYS A 117 0.881 12.433 -3.417 1.00 4.04 H new ATOM 0 HA LYS A 117 2.030 13.572 -1.061 1.00 25.30 H new ATOM 0 HB2 LYS A 117 -0.867 13.577 -2.015 1.00 41.23 H new ATOM 0 HB3 LYS A 117 -0.154 14.680 -0.855 1.00 41.23 H new ATOM 0 HG2 LYS A 117 0.592 14.502 -3.810 1.00 21.14 H new ATOM 0 HG3 LYS A 117 -0.446 15.721 -3.097 1.00 21.14 H new ATOM 0 HD2 LYS A 117 2.486 15.316 -2.358 1.00 22.03 H new ATOM 0 HD3 LYS A 117 1.913 16.498 -3.518 1.00 22.03 H new ATOM 0 HE2 LYS A 117 0.590 17.630 -1.742 1.00 44.44 H new ATOM 0 HE3 LYS A 117 1.098 16.425 -0.575 1.00 44.44 H new ATOM 0 HZ1 LYS A 117 2.433 18.420 -0.412 1.00 32.30 H new ATOM 0 HZ2 LYS A 117 3.399 17.114 -0.907 1.00 32.30 H new ATOM 0 HZ3 LYS A 117 2.906 18.282 -2.037 1.00 32.30 H new ATOM 1926 N LYS A 118 -0.349 11.253 -0.705 1.00 61.30 N ATOM 1927 CA LYS A 118 -1.038 10.319 0.211 1.00 72.12 C ATOM 1928 C LYS A 118 -0.067 9.272 0.795 1.00 11.42 C ATOM 1929 O LYS A 118 -0.230 8.840 1.945 1.00 42.43 O ATOM 1930 CB LYS A 118 -2.200 9.600 -0.550 1.00 4.41 C ATOM 1931 CG LYS A 118 -3.282 10.522 -1.203 1.00 32.14 C ATOM 1932 CD LYS A 118 -4.439 10.983 -0.268 1.00 3.42 C ATOM 1933 CE LYS A 118 -4.016 11.902 0.889 1.00 23.23 C ATOM 1934 NZ LYS A 118 -3.339 13.134 0.410 1.00 42.32 N ATOM 0 H LYS A 118 -0.701 11.210 -1.662 1.00 61.30 H new ATOM 0 HA LYS A 118 -1.441 10.898 1.042 1.00 72.12 H new ATOM 0 HB2 LYS A 118 -1.763 8.980 -1.333 1.00 4.41 H new ATOM 0 HB3 LYS A 118 -2.700 8.928 0.147 1.00 4.41 H new ATOM 0 HG2 LYS A 118 -2.785 11.408 -1.598 1.00 32.14 H new ATOM 0 HG3 LYS A 118 -3.716 9.994 -2.052 1.00 32.14 H new ATOM 0 HD2 LYS A 118 -5.186 11.502 -0.869 1.00 3.42 H new ATOM 0 HD3 LYS A 118 -4.923 10.099 0.149 1.00 3.42 H new ATOM 0 HE2 LYS A 118 -4.895 12.176 1.472 1.00 23.23 H new ATOM 0 HE3 LYS A 118 -3.347 11.358 1.556 1.00 23.23 H new ATOM 0 HZ1 LYS A 118 -2.341 13.118 0.703 1.00 42.32 H new ATOM 0 HZ2 LYS A 118 -3.394 13.179 -0.628 1.00 42.32 H new ATOM 0 HZ3 LYS A 118 -3.807 13.968 0.818 1.00 42.32 H new ATOM 1948 N LEU A 119 0.944 8.884 -0.017 1.00 71.22 N ATOM 1949 CA LEU A 119 1.944 7.865 0.354 1.00 20.23 C ATOM 1950 C LEU A 119 2.852 8.412 1.451 1.00 62.34 C ATOM 1951 O LEU A 119 3.076 7.748 2.461 1.00 34.22 O ATOM 1952 CB LEU A 119 2.767 7.387 -0.897 1.00 60.41 C ATOM 1953 CG LEU A 119 2.983 5.841 -1.029 1.00 12.45 C ATOM 1954 CD1 LEU A 119 3.655 5.482 -2.364 1.00 43.34 C ATOM 1955 CD2 LEU A 119 3.770 5.260 0.166 1.00 62.52 C ATOM 0 H LEU A 119 1.086 9.272 -0.950 1.00 71.22 H new ATOM 0 HA LEU A 119 1.425 6.988 0.740 1.00 20.23 H new ATOM 0 HB2 LEU A 119 2.262 7.741 -1.796 1.00 60.41 H new ATOM 0 HB3 LEU A 119 3.744 7.869 -0.870 1.00 60.41 H new ATOM 0 HG LEU A 119 1.995 5.380 -1.016 1.00 12.45 H new ATOM 0 HD11 LEU A 119 3.791 4.402 -2.424 1.00 43.34 H new ATOM 0 HD12 LEU A 119 3.026 5.815 -3.189 1.00 43.34 H new ATOM 0 HD13 LEU A 119 4.626 5.974 -2.426 1.00 43.34 H new ATOM 0 HD21 LEU A 119 3.896 4.186 0.031 1.00 62.52 H new ATOM 0 HD22 LEU A 119 4.749 5.736 0.223 1.00 62.52 H new ATOM 0 HD23 LEU A 119 3.221 5.448 1.089 1.00 62.52 H new ATOM 1967 N LYS A 120 3.329 9.649 1.248 1.00 11.13 N ATOM 1968 CA LYS A 120 4.249 10.307 2.184 1.00 23.30 C ATOM 1969 C LYS A 120 3.559 10.665 3.502 1.00 35.44 C ATOM 1970 O LYS A 120 4.192 10.615 4.547 1.00 70.33 O ATOM 1971 CB LYS A 120 4.892 11.553 1.540 1.00 63.31 C ATOM 1972 CG LYS A 120 5.829 11.201 0.372 1.00 34.32 C ATOM 1973 CD LYS A 120 6.702 12.388 -0.073 1.00 4.11 C ATOM 1974 CE LYS A 120 7.768 11.953 -1.078 1.00 11.01 C ATOM 1975 NZ LYS A 120 8.788 12.996 -1.322 1.00 14.14 N ATOM 0 H LYS A 120 3.089 10.217 0.436 1.00 11.13 H new ATOM 0 HA LYS A 120 5.041 9.596 2.416 1.00 23.30 H new ATOM 0 HB2 LYS A 120 4.106 12.218 1.182 1.00 63.31 H new ATOM 0 HB3 LYS A 120 5.453 12.100 2.298 1.00 63.31 H new ATOM 0 HG2 LYS A 120 6.473 10.373 0.666 1.00 34.32 H new ATOM 0 HG3 LYS A 120 5.234 10.857 -0.474 1.00 34.32 H new ATOM 0 HD2 LYS A 120 6.072 13.157 -0.519 1.00 4.11 H new ATOM 0 HD3 LYS A 120 7.182 12.835 0.798 1.00 4.11 H new ATOM 0 HE2 LYS A 120 8.258 11.051 -0.712 1.00 11.01 H new ATOM 0 HE3 LYS A 120 7.287 11.694 -2.021 1.00 11.01 H new ATOM 0 HZ1 LYS A 120 9.415 12.695 -2.095 1.00 14.14 H new ATOM 0 HZ2 LYS A 120 8.318 13.886 -1.584 1.00 14.14 H new ATOM 0 HZ3 LYS A 120 9.349 13.142 -0.459 1.00 14.14 H new ATOM 1989 N GLU A 121 2.262 11.009 3.433 1.00 64.22 N ATOM 1990 CA GLU A 121 1.429 11.250 4.628 1.00 43.23 C ATOM 1991 C GLU A 121 1.308 9.969 5.471 1.00 22.11 C ATOM 1992 O GLU A 121 1.470 10.005 6.688 1.00 73.15 O ATOM 1993 CB GLU A 121 0.044 11.793 4.198 1.00 71.33 C ATOM 1994 CG GLU A 121 0.114 13.218 3.602 1.00 14.12 C ATOM 1995 CD GLU A 121 -1.164 13.642 2.870 1.00 71.20 C ATOM 1996 OE1 GLU A 121 -2.268 13.519 3.442 1.00 33.40 O ATOM 1997 OE2 GLU A 121 -1.076 14.086 1.702 1.00 21.03 O ATOM 0 H GLU A 121 1.761 11.128 2.552 1.00 64.22 H new ATOM 0 HA GLU A 121 1.906 12.002 5.256 1.00 43.23 H new ATOM 0 HB2 GLU A 121 -0.393 11.118 3.462 1.00 71.33 H new ATOM 0 HB3 GLU A 121 -0.622 11.798 5.061 1.00 71.33 H new ATOM 0 HG2 GLU A 121 0.316 13.928 4.404 1.00 14.12 H new ATOM 0 HG3 GLU A 121 0.954 13.272 2.909 1.00 14.12 H new ATOM 2004 N ALA A 122 1.086 8.834 4.787 1.00 13.10 N ATOM 2005 CA ALA A 122 1.013 7.501 5.414 1.00 22.32 C ATOM 2006 C ALA A 122 2.380 7.083 6.002 1.00 64.34 C ATOM 2007 O ALA A 122 2.449 6.397 7.034 1.00 22.50 O ATOM 2008 CB ALA A 122 0.536 6.485 4.377 1.00 34.44 C ATOM 0 H ALA A 122 0.951 8.814 3.776 1.00 13.10 H new ATOM 0 HA ALA A 122 0.303 7.537 6.240 1.00 22.32 H new ATOM 0 HB1 ALA A 122 0.480 5.497 4.834 1.00 34.44 H new ATOM 0 HB2 ALA A 122 -0.450 6.773 4.013 1.00 34.44 H new ATOM 0 HB3 ALA A 122 1.238 6.459 3.543 1.00 34.44 H new ATOM 2014 N LEU A 123 3.460 7.516 5.324 1.00 0.34 N ATOM 2015 CA LEU A 123 4.845 7.275 5.759 1.00 3.41 C ATOM 2016 C LEU A 123 5.189 8.134 7.003 1.00 61.04 C ATOM 2017 O LEU A 123 5.902 7.671 7.890 1.00 32.02 O ATOM 2018 CB LEU A 123 5.833 7.539 4.586 1.00 63.22 C ATOM 2019 CG LEU A 123 5.847 6.471 3.436 1.00 21.02 C ATOM 2020 CD1 LEU A 123 6.679 6.944 2.219 1.00 63.13 C ATOM 2021 CD2 LEU A 123 6.350 5.105 3.951 1.00 53.34 C ATOM 0 H LEU A 123 3.393 8.045 4.455 1.00 0.34 H new ATOM 0 HA LEU A 123 4.944 6.229 6.050 1.00 3.41 H new ATOM 0 HB2 LEU A 123 5.595 8.509 4.149 1.00 63.22 H new ATOM 0 HB3 LEU A 123 6.840 7.613 4.997 1.00 63.22 H new ATOM 0 HG LEU A 123 4.818 6.349 3.098 1.00 21.02 H new ATOM 0 HD11 LEU A 123 6.663 6.175 1.446 1.00 63.13 H new ATOM 0 HD12 LEU A 123 6.253 7.866 1.823 1.00 63.13 H new ATOM 0 HD13 LEU A 123 7.708 7.124 2.530 1.00 63.13 H new ATOM 0 HD21 LEU A 123 6.349 4.385 3.133 1.00 53.34 H new ATOM 0 HD22 LEU A 123 7.363 5.213 4.338 1.00 53.34 H new ATOM 0 HD23 LEU A 123 5.693 4.752 4.746 1.00 53.34 H new ATOM 2033 N GLU A 124 4.634 9.361 7.081 1.00 35.41 N ATOM 2034 CA GLU A 124 4.827 10.265 8.245 1.00 13.34 C ATOM 2035 C GLU A 124 4.255 9.636 9.531 1.00 31.53 C ATOM 2036 O GLU A 124 4.855 9.757 10.603 1.00 44.34 O ATOM 2037 CB GLU A 124 4.170 11.652 7.980 1.00 35.55 C ATOM 2038 CG GLU A 124 4.885 12.512 6.913 1.00 32.43 C ATOM 2039 CD GLU A 124 4.169 13.844 6.632 1.00 23.13 C ATOM 2040 OE1 GLU A 124 3.280 13.877 5.755 1.00 34.53 O ATOM 2041 OE2 GLU A 124 4.484 14.866 7.292 1.00 52.44 O ATOM 0 H GLU A 124 4.044 9.755 6.348 1.00 35.41 H new ATOM 0 HA GLU A 124 5.898 10.411 8.383 1.00 13.34 H new ATOM 0 HB2 GLU A 124 3.137 11.496 7.669 1.00 35.55 H new ATOM 0 HB3 GLU A 124 4.140 12.210 8.916 1.00 35.55 H new ATOM 0 HG2 GLU A 124 5.904 12.717 7.243 1.00 32.43 H new ATOM 0 HG3 GLU A 124 4.958 11.943 5.986 1.00 32.43 H new ATOM 2048 N LYS A 125 3.105 8.930 9.394 1.00 31.30 N ATOM 2049 CA LYS A 125 2.393 8.315 10.544 1.00 30.33 C ATOM 2050 C LYS A 125 3.100 7.018 10.996 1.00 60.11 C ATOM 2051 O LYS A 125 2.966 6.596 12.147 1.00 35.52 O ATOM 2052 CB LYS A 125 0.887 8.034 10.209 1.00 32.43 C ATOM 2053 CG LYS A 125 0.165 9.163 9.426 1.00 70.04 C ATOM 2054 CD LYS A 125 0.394 10.595 9.994 1.00 63.40 C ATOM 2055 CE LYS A 125 -0.100 11.693 9.028 1.00 71.13 C ATOM 2056 NZ LYS A 125 0.314 13.051 9.477 1.00 1.42 N ATOM 0 H LYS A 125 2.649 8.772 8.495 1.00 31.30 H new ATOM 0 HA LYS A 125 2.421 9.030 11.366 1.00 30.33 H new ATOM 0 HB2 LYS A 125 0.826 7.114 9.628 1.00 32.43 H new ATOM 0 HB3 LYS A 125 0.350 7.859 11.141 1.00 32.43 H new ATOM 0 HG2 LYS A 125 0.500 9.140 8.389 1.00 70.04 H new ATOM 0 HG3 LYS A 125 -0.905 8.956 9.420 1.00 70.04 H new ATOM 0 HD2 LYS A 125 -0.125 10.693 10.948 1.00 63.40 H new ATOM 0 HD3 LYS A 125 1.456 10.739 10.193 1.00 63.40 H new ATOM 0 HE2 LYS A 125 0.295 11.504 8.030 1.00 71.13 H new ATOM 0 HE3 LYS A 125 -1.187 11.650 8.954 1.00 71.13 H new ATOM 0 HZ1 LYS A 125 -0.036 13.761 8.803 1.00 1.42 H new ATOM 0 HZ2 LYS A 125 -0.084 13.242 10.419 1.00 1.42 H new ATOM 0 HZ3 LYS A 125 1.352 13.100 9.523 1.00 1.42 H new ATOM 2070 N SER A 126 3.858 6.395 10.064 1.00 23.01 N ATOM 2071 CA SER A 126 4.669 5.193 10.345 1.00 64.42 C ATOM 2072 C SER A 126 6.074 5.557 10.847 1.00 72.33 C ATOM 2073 O SER A 126 6.895 4.666 11.125 1.00 24.15 O ATOM 2074 CB SER A 126 4.752 4.317 9.083 1.00 0.25 C ATOM 2075 OG SER A 126 5.301 4.998 7.979 1.00 23.15 O ATOM 0 H SER A 126 3.923 6.713 9.097 1.00 23.01 H new ATOM 0 HA SER A 126 4.180 4.632 11.141 1.00 64.42 H new ATOM 0 HB2 SER A 126 5.357 3.436 9.297 1.00 0.25 H new ATOM 0 HB3 SER A 126 3.754 3.963 8.826 1.00 0.25 H new ATOM 0 HG SER A 126 5.507 5.921 8.234 1.00 23.15 H new ATOM 2081 N GLY A 127 6.339 6.876 10.954 1.00 2.42 N ATOM 2082 CA GLY A 127 7.602 7.390 11.488 1.00 41.32 C ATOM 2083 C GLY A 127 8.688 7.551 10.432 1.00 72.32 C ATOM 2084 O GLY A 127 9.811 7.958 10.751 1.00 23.01 O ATOM 0 H GLY A 127 5.683 7.605 10.672 1.00 2.42 H new ATOM 0 HA2 GLY A 127 7.421 8.355 11.962 1.00 41.32 H new ATOM 0 HA3 GLY A 127 7.960 6.715 12.266 1.00 41.32 H new ATOM 2088 N SER A 128 8.357 7.223 9.178 1.00 54.23 N ATOM 2089 CA SER A 128 9.276 7.321 8.046 1.00 24.14 C ATOM 2090 C SER A 128 9.429 8.795 7.631 1.00 72.40 C ATOM 2091 O SER A 128 8.506 9.375 7.056 1.00 73.21 O ATOM 2092 CB SER A 128 8.722 6.471 6.893 1.00 63.44 C ATOM 2093 OG SER A 128 8.353 5.187 7.358 1.00 12.45 O ATOM 0 H SER A 128 7.432 6.878 8.921 1.00 54.23 H new ATOM 0 HA SER A 128 10.263 6.947 8.318 1.00 24.14 H new ATOM 0 HB2 SER A 128 7.858 6.966 6.451 1.00 63.44 H new ATOM 0 HB3 SER A 128 9.473 6.378 6.108 1.00 63.44 H new ATOM 0 HG SER A 128 7.422 5.205 7.663 1.00 12.45 H new