USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1051 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 89 HIS : no HD1:sc= -0.222 K(o=1,f=-0.11) USER MOD Set 1.2: A 110 THR OG1 : rot 87:sc= 1.25 USER MOD Set 2.1: A 37 THR OG1 : rot 16:sc= 0.911 USER MOD Set 2.2: A 41 ASN : amide:sc= -0.332 X(o=0.58,f=0.19) USER MOD Set 3.1: A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 28 SER OG : rot 171:sc= 0.834 USER MOD Set 4.1: A 5 ASN : amide:sc= 0 K(o=0.67,f=0.12) USER MOD Set 4.2: A 7 THR OG1 : rot 63:sc= 0.674 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -108:sc= 0.204 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= -0.0197 USER MOD Single : A 24 LYS NZ :NH3+ -113:sc= 0.802 (180deg=0.355) USER MOD Single : A 29 SER OG : rot -28:sc= -0.438 USER MOD Single : A 30 THR OG1 : rot 43:sc= 0.718 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.00224 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -1.49 K(o=-1.5,f=-4.2!) USER MOD Single : A 65 GLN : amide:sc= 1.21 K(o=1.2,f=-0.006) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 45:sc= 0.24 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 165:sc= 1.58 USER MOD Single : A 84 THR OG1 : rot -90:sc= 0.808 USER MOD Single : A 86 SER OG : rot -118:sc= 0.384 USER MOD Single : A 95 ASN : amide:sc= -0.0208 K(o=-0.021,f=-4.4!) USER MOD Single : A 106 SER OG : rot -61:sc= 1.35 USER MOD Single : A 108 ASN : amide:sc= -0.906 K(o=-0.91,f=-3.2!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.88 K(o=-0.88,f=-1.8!) USER MOD Single : A 118 ASN : amide:sc= -0.592 K(o=-0.59,f=0) USER MOD Single : A 120 GLN : amide:sc= 0.936 K(o=0.94,f=-8!) USER MOD Single : A 122 MET CE :methyl -139:sc= -0.958 (180deg=-2.58) USER MOD Single : A 123 GLN : amide:sc= 1.13 K(o=1.1,f=-0.26) USER MOD Single : A 124 THR OG1 : rot -140:sc= 0.487 USER MOD Single : A 129 GLN : amide:sc= 1.37 K(o=1.4,f=-5.6!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 45.388 -3.958 -70.432 1.00 11.00 N ATOM 2 CA MET A 1 44.151 -4.730 -70.402 1.00 43.05 C ATOM 3 C MET A 1 43.063 -3.800 -70.920 1.00 22.02 C ATOM 4 O MET A 1 43.201 -2.588 -70.783 1.00 54.12 O ATOM 5 CB MET A 1 43.880 -5.197 -68.938 1.00 52.33 C ATOM 6 CG MET A 1 42.854 -6.329 -68.739 1.00 32.33 C ATOM 7 SD MET A 1 41.147 -5.870 -69.092 1.00 4.13 S ATOM 8 CE MET A 1 40.292 -7.389 -68.690 1.00 64.04 C ATOM 0 H1 MET A 1 45.996 -4.307 -71.200 1.00 11.00 H new ATOM 0 H2 MET A 1 45.167 -2.955 -70.594 1.00 11.00 H new ATOM 0 H3 MET A 1 45.884 -4.061 -69.524 1.00 11.00 H new ATOM 0 HA MET A 1 44.194 -5.628 -71.018 1.00 43.05 H new ATOM 0 HB2 MET A 1 44.827 -5.519 -68.505 1.00 52.33 H new ATOM 0 HB3 MET A 1 43.545 -4.333 -68.364 1.00 52.33 H new ATOM 0 HG2 MET A 1 43.130 -7.167 -69.378 1.00 32.33 H new ATOM 0 HG3 MET A 1 42.916 -6.680 -67.709 1.00 32.33 H new ATOM 0 HE1 MET A 1 39.223 -7.260 -68.859 1.00 64.04 H new ATOM 0 HE2 MET A 1 40.665 -8.195 -69.323 1.00 64.04 H new ATOM 0 HE3 MET A 1 40.467 -7.639 -67.644 1.00 64.04 H new ATOM 20 N SER A 2 42.019 -4.347 -71.536 1.00 41.43 N ATOM 21 CA SER A 2 40.920 -3.565 -72.095 1.00 62.42 C ATOM 22 C SER A 2 40.330 -2.573 -71.076 1.00 52.32 C ATOM 23 O SER A 2 40.061 -1.416 -71.413 1.00 1.44 O ATOM 24 CB SER A 2 39.850 -4.515 -72.596 1.00 34.20 C ATOM 25 OG SER A 2 40.394 -5.397 -73.564 1.00 62.55 O ATOM 0 H SER A 2 41.911 -5.353 -71.662 1.00 41.43 H new ATOM 0 HA SER A 2 41.308 -2.967 -72.920 1.00 62.42 H new ATOM 0 HB2 SER A 2 39.441 -5.086 -71.762 1.00 34.20 H new ATOM 0 HB3 SER A 2 39.026 -3.950 -73.031 1.00 34.20 H new ATOM 0 HG SER A 2 39.695 -6.007 -73.880 1.00 62.55 H new ATOM 31 N ASP A 3 40.161 -3.017 -69.853 1.00 2.23 N ATOM 32 CA ASP A 3 39.663 -2.180 -68.777 1.00 4.43 C ATOM 33 C ASP A 3 40.101 -2.768 -67.462 1.00 62.11 C ATOM 34 O ASP A 3 39.648 -3.844 -67.080 1.00 43.54 O ATOM 35 CB ASP A 3 38.128 -2.068 -68.815 1.00 22.45 C ATOM 36 CG ASP A 3 37.564 -1.263 -67.656 1.00 3.20 C ATOM 37 OD1 ASP A 3 37.672 -0.014 -67.672 1.00 23.42 O ATOM 38 OD2 ASP A 3 36.969 -1.863 -66.719 1.00 64.52 O ATOM 0 H ASP A 3 40.365 -3.975 -69.570 1.00 2.23 H new ATOM 0 HA ASP A 3 40.070 -1.176 -68.897 1.00 4.43 H new ATOM 0 HB2 ASP A 3 37.826 -1.604 -69.754 1.00 22.45 H new ATOM 0 HB3 ASP A 3 37.695 -3.068 -68.800 1.00 22.45 H new ATOM 43 N ASN A 4 41.015 -2.123 -66.802 1.00 32.35 N ATOM 44 CA ASN A 4 41.454 -2.593 -65.516 1.00 53.24 C ATOM 45 C ASN A 4 41.677 -1.414 -64.623 1.00 32.42 C ATOM 46 O ASN A 4 42.127 -0.353 -65.074 1.00 42.21 O ATOM 47 CB ASN A 4 42.735 -3.439 -65.625 1.00 13.13 C ATOM 48 CG ASN A 4 43.097 -4.156 -64.325 1.00 50.11 C ATOM 49 OD1 ASN A 4 42.636 -5.269 -64.080 1.00 5.12 O ATOM 50 ND2 ASN A 4 43.918 -3.553 -63.499 1.00 70.53 N ATOM 0 H ASN A 4 41.472 -1.272 -67.129 1.00 32.35 H new ATOM 0 HA ASN A 4 40.682 -3.238 -65.096 1.00 53.24 H new ATOM 0 HB2 ASN A 4 42.608 -4.178 -66.416 1.00 13.13 H new ATOM 0 HB3 ASN A 4 43.564 -2.795 -65.920 1.00 13.13 H new ATOM 0 HD21 ASN A 4 44.190 -4.008 -62.627 1.00 70.53 H new ATOM 0 HD22 ASN A 4 44.285 -2.629 -63.728 1.00 70.53 H new ATOM 57 N ASN A 5 41.323 -1.571 -63.396 1.00 51.12 N ATOM 58 CA ASN A 5 41.476 -0.545 -62.406 1.00 20.51 C ATOM 59 C ASN A 5 41.582 -1.215 -61.074 1.00 2.43 C ATOM 60 O ASN A 5 40.773 -2.115 -60.775 1.00 21.11 O ATOM 61 CB ASN A 5 40.247 0.387 -62.415 1.00 62.35 C ATOM 62 CG ASN A 5 40.318 1.508 -61.386 1.00 31.44 C ATOM 63 OD1 ASN A 5 41.395 1.977 -61.022 1.00 24.52 O ATOM 64 ND2 ASN A 5 39.170 1.945 -60.922 1.00 62.41 N ATOM 0 H ASN A 5 40.909 -2.432 -63.038 1.00 51.12 H new ATOM 0 HA ASN A 5 42.364 0.052 -62.614 1.00 20.51 H new ATOM 0 HB2 ASN A 5 40.141 0.824 -63.408 1.00 62.35 H new ATOM 0 HB3 ASN A 5 39.351 -0.206 -62.231 1.00 62.35 H new ATOM 0 HD21 ASN A 5 39.151 2.699 -60.235 1.00 62.41 H new ATOM 0 HD22 ASN A 5 38.297 1.531 -61.248 1.00 62.41 H new ATOM 71 N GLY A 6 42.578 -0.836 -60.294 1.00 73.24 N ATOM 72 CA GLY A 6 42.724 -1.350 -58.947 1.00 32.01 C ATOM 73 C GLY A 6 41.656 -0.754 -58.074 1.00 40.33 C ATOM 74 O GLY A 6 41.901 0.189 -57.324 1.00 61.44 O ATOM 0 H GLY A 6 43.300 -0.171 -60.573 1.00 73.24 H new ATOM 0 HA2 GLY A 6 42.645 -2.437 -58.949 1.00 32.01 H new ATOM 0 HA3 GLY A 6 43.711 -1.103 -58.555 1.00 32.01 H new ATOM 78 N THR A 7 40.494 -1.321 -58.172 1.00 4.23 N ATOM 79 CA THR A 7 39.310 -0.792 -57.598 1.00 4.01 C ATOM 80 C THR A 7 39.242 -1.083 -56.099 1.00 30.34 C ATOM 81 O THR A 7 39.378 -2.245 -55.677 1.00 73.24 O ATOM 82 CB THR A 7 38.103 -1.420 -58.325 1.00 50.41 C ATOM 83 OG1 THR A 7 38.259 -1.219 -59.751 1.00 43.53 O ATOM 84 CG2 THR A 7 36.791 -0.801 -57.871 1.00 72.11 C ATOM 0 H THR A 7 40.345 -2.197 -58.674 1.00 4.23 H new ATOM 0 HA THR A 7 39.301 0.292 -57.715 1.00 4.01 H new ATOM 0 HB THR A 7 38.073 -2.483 -58.086 1.00 50.41 H new ATOM 0 HG1 THR A 7 39.064 -1.685 -60.061 1.00 43.53 H new ATOM 0 HG21 THR A 7 35.964 -1.269 -58.405 1.00 72.11 H new ATOM 0 HG22 THR A 7 36.666 -0.958 -56.800 1.00 72.11 H new ATOM 0 HG23 THR A 7 36.801 0.268 -58.082 1.00 72.11 H new ATOM 92 N PRO A 8 39.088 -0.038 -55.274 1.00 2.42 N ATOM 93 CA PRO A 8 38.895 -0.195 -53.849 1.00 22.33 C ATOM 94 C PRO A 8 37.566 -0.865 -53.589 1.00 31.15 C ATOM 95 O PRO A 8 36.558 -0.526 -54.227 1.00 21.44 O ATOM 96 CB PRO A 8 38.863 1.244 -53.305 1.00 13.41 C ATOM 97 CG PRO A 8 39.417 2.088 -54.392 1.00 20.11 C ATOM 98 CD PRO A 8 39.090 1.381 -55.670 1.00 13.14 C ATOM 0 HA PRO A 8 39.671 -0.803 -53.384 1.00 22.33 H new ATOM 0 HB2 PRO A 8 37.847 1.546 -53.052 1.00 13.41 H new ATOM 0 HB3 PRO A 8 39.458 1.334 -52.396 1.00 13.41 H new ATOM 0 HG2 PRO A 8 38.977 3.085 -54.374 1.00 20.11 H new ATOM 0 HG3 PRO A 8 40.494 2.212 -54.279 1.00 20.11 H new ATOM 0 HD2 PRO A 8 38.123 1.691 -56.066 1.00 13.14 H new ATOM 0 HD3 PRO A 8 39.831 1.583 -56.444 1.00 13.14 H new ATOM 106 N GLU A 9 37.551 -1.831 -52.715 1.00 14.21 N ATOM 107 CA GLU A 9 36.315 -2.468 -52.374 1.00 15.14 C ATOM 108 C GLU A 9 35.458 -1.551 -51.504 1.00 61.51 C ATOM 109 O GLU A 9 35.983 -0.864 -50.622 1.00 22.22 O ATOM 110 CB GLU A 9 36.512 -3.895 -51.795 1.00 44.43 C ATOM 111 CG GLU A 9 37.714 -4.110 -50.862 1.00 62.35 C ATOM 112 CD GLU A 9 37.696 -3.314 -49.586 1.00 52.41 C ATOM 113 OE1 GLU A 9 36.965 -3.690 -48.639 1.00 4.25 O ATOM 114 OE2 GLU A 9 38.445 -2.329 -49.486 1.00 0.54 O ATOM 0 H GLU A 9 38.373 -2.191 -52.231 1.00 14.21 H new ATOM 0 HA GLU A 9 35.755 -2.633 -53.294 1.00 15.14 H new ATOM 0 HB2 GLU A 9 35.608 -4.167 -51.251 1.00 44.43 H new ATOM 0 HB3 GLU A 9 36.603 -4.590 -52.630 1.00 44.43 H new ATOM 0 HG2 GLU A 9 37.769 -5.169 -50.608 1.00 62.35 H new ATOM 0 HG3 GLU A 9 38.624 -3.865 -51.409 1.00 62.35 H new ATOM 121 N PRO A 10 34.146 -1.453 -51.794 1.00 20.21 N ATOM 122 CA PRO A 10 33.253 -0.581 -51.053 1.00 10.03 C ATOM 123 C PRO A 10 33.199 -0.946 -49.590 1.00 30.41 C ATOM 124 O PRO A 10 32.885 -2.087 -49.216 1.00 40.40 O ATOM 125 CB PRO A 10 31.884 -0.785 -51.703 1.00 51.13 C ATOM 126 CG PRO A 10 32.182 -1.365 -53.038 1.00 54.51 C ATOM 127 CD PRO A 10 33.430 -2.174 -52.863 1.00 31.23 C ATOM 0 HA PRO A 10 33.588 0.455 -51.089 1.00 10.03 H new ATOM 0 HB2 PRO A 10 31.260 -1.455 -51.111 1.00 51.13 H new ATOM 0 HB3 PRO A 10 31.344 0.158 -51.793 1.00 51.13 H new ATOM 0 HG2 PRO A 10 31.358 -1.988 -53.386 1.00 54.51 H new ATOM 0 HG3 PRO A 10 32.325 -0.581 -53.782 1.00 54.51 H new ATOM 0 HD2 PRO A 10 33.208 -3.202 -52.577 1.00 31.23 H new ATOM 0 HD3 PRO A 10 34.015 -2.218 -53.782 1.00 31.23 H new ATOM 135 N GLN A 11 33.539 -0.003 -48.777 1.00 73.54 N ATOM 136 CA GLN A 11 33.516 -0.172 -47.364 1.00 72.41 C ATOM 137 C GLN A 11 32.082 -0.011 -46.934 1.00 24.44 C ATOM 138 O GLN A 11 31.523 1.090 -47.025 1.00 4.13 O ATOM 139 CB GLN A 11 34.420 0.864 -46.702 1.00 53.14 C ATOM 140 CG GLN A 11 35.855 0.805 -47.211 1.00 61.23 C ATOM 141 CD GLN A 11 36.762 1.857 -46.612 1.00 42.42 C ATOM 142 OE1 GLN A 11 36.331 2.958 -46.259 1.00 62.35 O ATOM 143 NE2 GLN A 11 38.018 1.536 -46.488 1.00 55.34 N ATOM 0 H GLN A 11 33.845 0.921 -49.081 1.00 73.54 H new ATOM 0 HA GLN A 11 33.889 -1.152 -47.068 1.00 72.41 H new ATOM 0 HB2 GLN A 11 34.016 1.860 -46.882 1.00 53.14 H new ATOM 0 HB3 GLN A 11 34.415 0.708 -45.623 1.00 53.14 H new ATOM 0 HG2 GLN A 11 36.266 -0.181 -46.995 1.00 61.23 H new ATOM 0 HG3 GLN A 11 35.850 0.918 -48.295 1.00 61.23 H new ATOM 0 HE21 GLN A 11 38.342 0.617 -46.790 1.00 55.34 H new ATOM 0 HE22 GLN A 11 38.678 2.204 -46.089 1.00 55.34 H new ATOM 152 N VAL A 12 31.469 -1.104 -46.547 1.00 21.31 N ATOM 153 CA VAL A 12 30.071 -1.118 -46.233 1.00 43.01 C ATOM 154 C VAL A 12 29.737 -0.246 -45.034 1.00 53.43 C ATOM 155 O VAL A 12 30.368 -0.339 -43.959 1.00 4.34 O ATOM 156 CB VAL A 12 29.499 -2.557 -46.075 1.00 32.32 C ATOM 157 CG1 VAL A 12 29.617 -3.318 -47.381 1.00 60.15 C ATOM 158 CG2 VAL A 12 30.181 -3.330 -44.959 1.00 20.22 C ATOM 0 H VAL A 12 31.931 -2.007 -46.443 1.00 21.31 H new ATOM 0 HA VAL A 12 29.571 -0.679 -47.097 1.00 43.01 H new ATOM 0 HB VAL A 12 28.447 -2.456 -45.807 1.00 32.32 H new ATOM 0 HG11 VAL A 12 29.213 -4.322 -47.255 1.00 60.15 H new ATOM 0 HG12 VAL A 12 29.057 -2.797 -48.158 1.00 60.15 H new ATOM 0 HG13 VAL A 12 30.666 -3.383 -47.671 1.00 60.15 H new ATOM 0 HG21 VAL A 12 29.747 -4.327 -44.889 1.00 20.22 H new ATOM 0 HG22 VAL A 12 31.247 -3.413 -45.172 1.00 20.22 H new ATOM 0 HG23 VAL A 12 30.040 -2.806 -44.014 1.00 20.22 H new ATOM 168 N GLU A 13 28.807 0.641 -45.242 1.00 31.50 N ATOM 169 CA GLU A 13 28.359 1.521 -44.214 1.00 65.10 C ATOM 170 C GLU A 13 27.239 0.868 -43.434 1.00 2.55 C ATOM 171 O GLU A 13 26.404 0.160 -43.999 1.00 73.14 O ATOM 172 CB GLU A 13 27.906 2.872 -44.785 1.00 22.00 C ATOM 173 CG GLU A 13 27.494 3.881 -43.716 1.00 42.14 C ATOM 174 CD GLU A 13 28.603 4.195 -42.727 1.00 72.44 C ATOM 175 OE1 GLU A 13 29.012 3.291 -41.953 1.00 41.21 O ATOM 176 OE2 GLU A 13 29.053 5.348 -42.681 1.00 4.34 O ATOM 0 H GLU A 13 28.338 0.771 -46.138 1.00 31.50 H new ATOM 0 HA GLU A 13 29.196 1.717 -43.544 1.00 65.10 H new ATOM 0 HB2 GLU A 13 28.716 3.295 -45.379 1.00 22.00 H new ATOM 0 HB3 GLU A 13 27.067 2.708 -45.461 1.00 22.00 H new ATOM 0 HG2 GLU A 13 27.177 4.804 -44.201 1.00 42.14 H new ATOM 0 HG3 GLU A 13 26.632 3.493 -43.173 1.00 42.14 H new ATOM 183 N THR A 14 27.245 1.068 -42.165 1.00 11.13 N ATOM 184 CA THR A 14 26.244 0.533 -41.315 1.00 14.15 C ATOM 185 C THR A 14 25.869 1.599 -40.294 1.00 51.31 C ATOM 186 O THR A 14 26.732 2.367 -39.846 1.00 25.41 O ATOM 187 CB THR A 14 26.717 -0.791 -40.624 1.00 12.32 C ATOM 188 OG1 THR A 14 25.665 -1.343 -39.822 1.00 31.24 O ATOM 189 CG2 THR A 14 27.956 -0.568 -39.754 1.00 40.34 C ATOM 0 H THR A 14 27.956 1.616 -41.681 1.00 11.13 H new ATOM 0 HA THR A 14 25.367 0.266 -41.905 1.00 14.15 H new ATOM 0 HB THR A 14 26.978 -1.491 -41.418 1.00 12.32 H new ATOM 0 HG1 THR A 14 25.976 -2.170 -39.399 1.00 31.24 H new ATOM 0 HG21 THR A 14 28.251 -1.511 -39.293 1.00 40.34 H new ATOM 0 HG22 THR A 14 28.772 -0.195 -40.372 1.00 40.34 H new ATOM 0 HG23 THR A 14 27.728 0.161 -38.976 1.00 40.34 H new ATOM 197 N THR A 15 24.616 1.689 -39.966 1.00 31.25 N ATOM 198 CA THR A 15 24.177 2.646 -39.034 1.00 43.22 C ATOM 199 C THR A 15 23.878 1.932 -37.727 1.00 42.11 C ATOM 200 O THR A 15 23.178 0.909 -37.692 1.00 64.12 O ATOM 201 CB THR A 15 22.957 3.482 -39.567 1.00 25.24 C ATOM 202 OG1 THR A 15 22.614 4.542 -38.656 1.00 71.44 O ATOM 203 CG2 THR A 15 21.729 2.615 -39.830 1.00 40.41 C ATOM 0 H THR A 15 23.879 1.094 -40.345 1.00 31.25 H new ATOM 0 HA THR A 15 24.963 3.382 -38.866 1.00 43.22 H new ATOM 0 HB THR A 15 23.274 3.913 -40.516 1.00 25.24 H new ATOM 0 HG1 THR A 15 21.854 5.047 -39.013 1.00 71.44 H new ATOM 0 HG21 THR A 15 20.914 3.240 -40.197 1.00 40.41 H new ATOM 0 HG22 THR A 15 21.971 1.859 -40.577 1.00 40.41 H new ATOM 0 HG23 THR A 15 21.424 2.126 -38.905 1.00 40.41 H new ATOM 211 N SER A 16 24.490 2.386 -36.691 1.00 10.43 N ATOM 212 CA SER A 16 24.323 1.794 -35.397 1.00 61.42 C ATOM 213 C SER A 16 24.324 2.872 -34.317 1.00 1.53 C ATOM 214 O SER A 16 25.385 3.323 -33.866 1.00 33.41 O ATOM 215 CB SER A 16 25.426 0.753 -35.150 1.00 64.35 C ATOM 216 OG SER A 16 25.457 -0.209 -36.215 1.00 64.34 O ATOM 0 H SER A 16 25.126 3.183 -36.710 1.00 10.43 H new ATOM 0 HA SER A 16 23.360 1.284 -35.357 1.00 61.42 H new ATOM 0 HB2 SER A 16 26.393 1.250 -35.073 1.00 64.35 H new ATOM 0 HB3 SER A 16 25.251 0.247 -34.200 1.00 64.35 H new ATOM 0 HG SER A 16 26.166 -0.864 -36.044 1.00 64.34 H new ATOM 222 N VAL A 17 23.143 3.325 -33.969 1.00 74.14 N ATOM 223 CA VAL A 17 22.956 4.334 -32.955 1.00 31.14 C ATOM 224 C VAL A 17 21.537 4.209 -32.397 1.00 41.24 C ATOM 225 O VAL A 17 20.592 3.960 -33.155 1.00 75.03 O ATOM 226 CB VAL A 17 23.232 5.780 -33.511 1.00 25.34 C ATOM 227 CG1 VAL A 17 22.326 6.129 -34.688 1.00 72.44 C ATOM 228 CG2 VAL A 17 23.130 6.834 -32.413 1.00 64.52 C ATOM 0 H VAL A 17 22.273 2.998 -34.389 1.00 74.14 H new ATOM 0 HA VAL A 17 23.677 4.174 -32.154 1.00 31.14 H new ATOM 0 HB VAL A 17 24.257 5.779 -33.881 1.00 25.34 H new ATOM 0 HG11 VAL A 17 22.554 7.136 -35.037 1.00 72.44 H new ATOM 0 HG12 VAL A 17 22.492 5.418 -35.498 1.00 72.44 H new ATOM 0 HG13 VAL A 17 21.284 6.082 -34.372 1.00 72.44 H new ATOM 0 HG21 VAL A 17 23.327 7.819 -32.835 1.00 64.52 H new ATOM 0 HG22 VAL A 17 22.128 6.817 -31.984 1.00 64.52 H new ATOM 0 HG23 VAL A 17 23.862 6.620 -31.634 1.00 64.52 H new ATOM 238 N PHE A 18 21.404 4.312 -31.088 1.00 33.52 N ATOM 239 CA PHE A 18 20.113 4.189 -30.421 1.00 23.42 C ATOM 240 C PHE A 18 20.231 4.667 -28.980 1.00 4.54 C ATOM 241 O PHE A 18 21.333 5.010 -28.523 1.00 74.21 O ATOM 242 CB PHE A 18 19.591 2.725 -30.471 1.00 32.13 C ATOM 243 CG PHE A 18 20.459 1.693 -29.771 1.00 44.11 C ATOM 244 CD1 PHE A 18 21.643 1.250 -30.343 1.00 10.24 C ATOM 245 CD2 PHE A 18 20.076 1.156 -28.555 1.00 11.40 C ATOM 246 CE1 PHE A 18 22.424 0.301 -29.717 1.00 41.22 C ATOM 247 CE2 PHE A 18 20.853 0.209 -27.923 1.00 10.44 C ATOM 248 CZ PHE A 18 22.028 -0.221 -28.505 1.00 75.51 C ATOM 0 H PHE A 18 22.184 4.483 -30.454 1.00 33.52 H new ATOM 0 HA PHE A 18 19.391 4.814 -30.947 1.00 23.42 H new ATOM 0 HB2 PHE A 18 18.596 2.698 -30.027 1.00 32.13 H new ATOM 0 HB3 PHE A 18 19.482 2.433 -31.515 1.00 32.13 H new ATOM 0 HD1 PHE A 18 21.958 1.655 -31.293 1.00 10.24 H new ATOM 0 HD2 PHE A 18 19.156 1.483 -28.095 1.00 11.40 H new ATOM 0 HE1 PHE A 18 23.343 -0.032 -30.176 1.00 41.22 H new ATOM 0 HE2 PHE A 18 20.542 -0.197 -26.972 1.00 10.44 H new ATOM 0 HZ PHE A 18 22.636 -0.965 -28.012 1.00 75.51 H new ATOM 258 N ARG A 19 19.123 4.713 -28.281 1.00 12.44 N ATOM 259 CA ARG A 19 19.107 5.111 -26.886 1.00 71.35 C ATOM 260 C ARG A 19 18.969 3.895 -25.993 1.00 54.24 C ATOM 261 O ARG A 19 17.935 3.239 -25.981 1.00 32.45 O ATOM 262 CB ARG A 19 17.978 6.110 -26.613 1.00 44.53 C ATOM 263 CG ARG A 19 18.183 7.443 -27.295 1.00 53.14 C ATOM 264 CD ARG A 19 17.025 8.394 -27.057 1.00 54.04 C ATOM 265 NE ARG A 19 17.298 9.715 -27.636 1.00 33.23 N ATOM 266 CZ ARG A 19 16.376 10.600 -28.040 1.00 10.35 C ATOM 267 NH1 ARG A 19 15.072 10.315 -27.944 1.00 42.43 N ATOM 268 NH2 ARG A 19 16.767 11.771 -28.541 1.00 31.35 N ATOM 0 H ARG A 19 18.205 4.477 -28.659 1.00 12.44 H new ATOM 0 HA ARG A 19 20.053 5.603 -26.661 1.00 71.35 H new ATOM 0 HB2 ARG A 19 17.033 5.680 -26.946 1.00 44.53 H new ATOM 0 HB3 ARG A 19 17.894 6.269 -25.538 1.00 44.53 H new ATOM 0 HG2 ARG A 19 19.104 7.897 -26.931 1.00 53.14 H new ATOM 0 HG3 ARG A 19 18.307 7.286 -28.366 1.00 53.14 H new ATOM 0 HD2 ARG A 19 16.116 7.982 -27.496 1.00 54.04 H new ATOM 0 HD3 ARG A 19 16.846 8.493 -25.986 1.00 54.04 H new ATOM 0 HE ARG A 19 18.277 9.983 -27.740 1.00 33.23 H new ATOM 0 HH11 ARG A 19 14.773 9.418 -27.561 1.00 42.43 H new ATOM 0 HH12 ARG A 19 14.377 10.995 -28.254 1.00 42.43 H new ATOM 0 HH21 ARG A 19 17.761 11.988 -28.615 1.00 31.35 H new ATOM 0 HH22 ARG A 19 16.072 12.451 -28.851 1.00 31.35 H new ATOM 282 N ALA A 20 20.010 3.587 -25.268 1.00 43.42 N ATOM 283 CA ALA A 20 20.012 2.441 -24.371 1.00 2.43 C ATOM 284 C ALA A 20 19.994 2.923 -22.931 1.00 12.01 C ATOM 285 O ALA A 20 20.299 2.166 -21.995 1.00 63.40 O ATOM 286 CB ALA A 20 21.248 1.590 -24.624 1.00 34.10 C ATOM 0 H ALA A 20 20.883 4.115 -25.275 1.00 43.42 H new ATOM 0 HA ALA A 20 19.125 1.835 -24.555 1.00 2.43 H new ATOM 0 HB1 ALA A 20 21.244 0.734 -23.950 1.00 34.10 H new ATOM 0 HB2 ALA A 20 21.243 1.239 -25.656 1.00 34.10 H new ATOM 0 HB3 ALA A 20 22.143 2.187 -24.448 1.00 34.10 H new ATOM 292 N ASP A 21 19.616 4.170 -22.765 1.00 33.03 N ATOM 293 CA ASP A 21 19.616 4.832 -21.471 1.00 13.55 C ATOM 294 C ASP A 21 18.555 4.261 -20.562 1.00 42.21 C ATOM 295 O ASP A 21 18.877 3.755 -19.489 1.00 12.24 O ATOM 296 CB ASP A 21 19.354 6.340 -21.644 1.00 32.51 C ATOM 297 CG ASP A 21 20.411 7.051 -22.450 1.00 74.34 C ATOM 298 OD1 ASP A 21 20.482 6.851 -23.678 1.00 12.33 O ATOM 299 OD2 ASP A 21 21.207 7.819 -21.873 1.00 10.24 O ATOM 0 H ASP A 21 19.296 4.764 -23.530 1.00 33.03 H new ATOM 0 HA ASP A 21 20.596 4.669 -21.022 1.00 13.55 H new ATOM 0 HB2 ASP A 21 18.387 6.478 -22.127 1.00 32.51 H new ATOM 0 HB3 ASP A 21 19.288 6.803 -20.660 1.00 32.51 H new ATOM 304 N LEU A 22 17.307 4.264 -21.054 1.00 63.12 N ATOM 305 CA LEU A 22 16.117 3.861 -20.294 1.00 65.01 C ATOM 306 C LEU A 22 16.067 4.640 -18.981 1.00 0.34 C ATOM 307 O LEU A 22 16.684 4.263 -17.987 1.00 70.41 O ATOM 308 CB LEU A 22 16.045 2.312 -20.091 1.00 51.24 C ATOM 309 CG LEU A 22 14.718 1.692 -19.537 1.00 51.04 C ATOM 310 CD1 LEU A 22 14.532 1.922 -18.044 1.00 0.21 C ATOM 311 CD2 LEU A 22 13.510 2.222 -20.300 1.00 64.31 C ATOM 0 H LEU A 22 17.094 4.552 -22.009 1.00 63.12 H new ATOM 0 HA LEU A 22 15.226 4.112 -20.869 1.00 65.01 H new ATOM 0 HB2 LEU A 22 16.255 1.842 -21.052 1.00 51.24 H new ATOM 0 HB3 LEU A 22 16.851 2.028 -19.414 1.00 51.24 H new ATOM 0 HG LEU A 22 14.799 0.616 -19.689 1.00 51.04 H new ATOM 0 HD11 LEU A 22 13.595 1.469 -17.720 1.00 0.21 H new ATOM 0 HD12 LEU A 22 15.361 1.469 -17.500 1.00 0.21 H new ATOM 0 HD13 LEU A 22 14.507 2.993 -17.841 1.00 0.21 H new ATOM 0 HD21 LEU A 22 12.601 1.777 -19.897 1.00 64.31 H new ATOM 0 HD22 LEU A 22 13.460 3.306 -20.195 1.00 64.31 H new ATOM 0 HD23 LEU A 22 13.604 1.963 -21.355 1.00 64.31 H new ATOM 323 N LEU A 23 15.379 5.740 -18.999 1.00 43.04 N ATOM 324 CA LEU A 23 15.317 6.614 -17.850 1.00 42.31 C ATOM 325 C LEU A 23 14.489 6.002 -16.732 1.00 11.01 C ATOM 326 O LEU A 23 13.278 5.843 -16.865 1.00 71.01 O ATOM 327 CB LEU A 23 14.765 7.990 -18.247 1.00 5.13 C ATOM 328 CG LEU A 23 15.564 8.748 -19.319 1.00 54.34 C ATOM 329 CD1 LEU A 23 14.907 10.077 -19.640 1.00 45.10 C ATOM 330 CD2 LEU A 23 17.007 8.963 -18.877 1.00 71.42 C ATOM 0 H LEU A 23 14.843 6.064 -19.804 1.00 43.04 H new ATOM 0 HA LEU A 23 16.332 6.745 -17.475 1.00 42.31 H new ATOM 0 HB2 LEU A 23 13.744 7.861 -18.606 1.00 5.13 H new ATOM 0 HB3 LEU A 23 14.713 8.611 -17.353 1.00 5.13 H new ATOM 0 HG LEU A 23 15.571 8.138 -20.222 1.00 54.34 H new ATOM 0 HD11 LEU A 23 15.489 10.596 -20.401 1.00 45.10 H new ATOM 0 HD12 LEU A 23 13.897 9.903 -20.012 1.00 45.10 H new ATOM 0 HD13 LEU A 23 14.862 10.688 -18.738 1.00 45.10 H new ATOM 0 HD21 LEU A 23 17.549 9.502 -19.654 1.00 71.42 H new ATOM 0 HD22 LEU A 23 17.022 9.544 -17.955 1.00 71.42 H new ATOM 0 HD23 LEU A 23 17.483 7.997 -18.705 1.00 71.42 H new ATOM 342 N LYS A 24 15.153 5.621 -15.670 1.00 20.12 N ATOM 343 CA LYS A 24 14.511 5.090 -14.483 1.00 54.23 C ATOM 344 C LYS A 24 15.318 5.588 -13.309 1.00 11.12 C ATOM 345 O LYS A 24 16.226 6.403 -13.510 1.00 0.43 O ATOM 346 CB LYS A 24 14.420 3.518 -14.495 1.00 23.55 C ATOM 347 CG LYS A 24 15.699 2.709 -14.145 1.00 34.45 C ATOM 348 CD LYS A 24 16.853 2.925 -15.105 1.00 43.43 C ATOM 349 CE LYS A 24 18.066 2.068 -14.734 1.00 64.10 C ATOM 350 NZ LYS A 24 18.643 2.418 -13.406 1.00 2.15 N ATOM 0 H LYS A 24 16.169 5.670 -15.600 1.00 20.12 H new ATOM 0 HA LYS A 24 13.477 5.430 -14.429 1.00 54.23 H new ATOM 0 HB2 LYS A 24 13.637 3.224 -13.796 1.00 23.55 H new ATOM 0 HB3 LYS A 24 14.092 3.210 -15.488 1.00 23.55 H new ATOM 0 HG2 LYS A 24 16.022 2.979 -13.140 1.00 34.45 H new ATOM 0 HG3 LYS A 24 15.450 1.648 -14.126 1.00 34.45 H new ATOM 0 HD2 LYS A 24 16.533 2.684 -16.119 1.00 43.43 H new ATOM 0 HD3 LYS A 24 17.136 3.977 -15.102 1.00 43.43 H new ATOM 0 HE2 LYS A 24 17.775 1.018 -14.732 1.00 64.10 H new ATOM 0 HE3 LYS A 24 18.833 2.184 -15.499 1.00 64.10 H new ATOM 0 HZ1 LYS A 24 19.589 2.829 -13.536 1.00 2.15 H new ATOM 0 HZ2 LYS A 24 18.028 3.109 -12.931 1.00 2.15 H new ATOM 0 HZ3 LYS A 24 18.715 1.560 -12.822 1.00 2.15 H new ATOM 364 N GLU A 25 15.026 5.152 -12.112 1.00 12.24 N ATOM 365 CA GLU A 25 15.817 5.594 -11.002 1.00 74.53 C ATOM 366 C GLU A 25 17.107 4.781 -10.939 1.00 12.31 C ATOM 367 O GLU A 25 17.149 3.628 -11.387 1.00 21.15 O ATOM 368 CB GLU A 25 15.041 5.554 -9.674 1.00 73.32 C ATOM 369 CG GLU A 25 15.805 6.184 -8.503 1.00 11.13 C ATOM 370 CD GLU A 25 16.234 7.616 -8.794 1.00 4.50 C ATOM 371 OE1 GLU A 25 17.217 7.830 -9.558 1.00 1.12 O ATOM 372 OE2 GLU A 25 15.588 8.558 -8.285 1.00 33.42 O ATOM 0 H GLU A 25 14.267 4.509 -11.887 1.00 12.24 H new ATOM 0 HA GLU A 25 16.072 6.642 -11.159 1.00 74.53 H new ATOM 0 HB2 GLU A 25 14.092 6.074 -9.801 1.00 73.32 H new ATOM 0 HB3 GLU A 25 14.807 4.518 -9.430 1.00 73.32 H new ATOM 0 HG2 GLU A 25 15.176 6.170 -7.613 1.00 11.13 H new ATOM 0 HG3 GLU A 25 16.686 5.582 -8.281 1.00 11.13 H new ATOM 379 N MET A 26 18.139 5.391 -10.429 1.00 10.12 N ATOM 380 CA MET A 26 19.449 4.783 -10.315 1.00 51.43 C ATOM 381 C MET A 26 19.435 3.630 -9.309 1.00 2.31 C ATOM 382 O MET A 26 18.487 3.477 -8.525 1.00 23.54 O ATOM 383 CB MET A 26 20.479 5.837 -9.882 1.00 74.14 C ATOM 384 CG MET A 26 20.223 6.419 -8.494 1.00 63.11 C ATOM 385 SD MET A 26 21.379 7.734 -8.053 1.00 62.10 S ATOM 386 CE MET A 26 20.820 8.100 -6.386 1.00 73.43 C ATOM 0 H MET A 26 18.100 6.345 -10.071 1.00 10.12 H new ATOM 0 HA MET A 26 19.724 4.383 -11.291 1.00 51.43 H new ATOM 0 HB2 MET A 26 21.472 5.389 -9.900 1.00 74.14 H new ATOM 0 HB3 MET A 26 20.482 6.648 -10.610 1.00 74.14 H new ATOM 0 HG2 MET A 26 19.206 6.808 -8.452 1.00 63.11 H new ATOM 0 HG3 MET A 26 20.290 5.621 -7.754 1.00 63.11 H new ATOM 0 HE1 MET A 26 21.432 8.897 -5.964 1.00 73.43 H new ATOM 0 HE2 MET A 26 19.778 8.419 -6.413 1.00 73.43 H new ATOM 0 HE3 MET A 26 20.910 7.207 -5.768 1.00 73.43 H new ATOM 396 N GLU A 27 20.458 2.828 -9.354 1.00 5.24 N ATOM 397 CA GLU A 27 20.622 1.745 -8.437 1.00 72.23 C ATOM 398 C GLU A 27 21.266 2.276 -7.156 1.00 11.35 C ATOM 399 O GLU A 27 22.491 2.443 -7.076 1.00 23.12 O ATOM 400 CB GLU A 27 21.474 0.636 -9.088 1.00 74.45 C ATOM 401 CG GLU A 27 21.726 -0.591 -8.227 1.00 74.15 C ATOM 402 CD GLU A 27 20.461 -1.278 -7.795 1.00 35.43 C ATOM 403 OE1 GLU A 27 19.904 -2.060 -8.578 1.00 11.20 O ATOM 404 OE2 GLU A 27 20.012 -1.062 -6.649 1.00 72.33 O ATOM 0 H GLU A 27 21.210 2.911 -10.038 1.00 5.24 H new ATOM 0 HA GLU A 27 19.656 1.310 -8.183 1.00 72.23 H new ATOM 0 HB2 GLU A 27 20.982 0.318 -10.007 1.00 74.45 H new ATOM 0 HB3 GLU A 27 22.436 1.062 -9.372 1.00 74.45 H new ATOM 0 HG2 GLU A 27 22.344 -1.296 -8.782 1.00 74.15 H new ATOM 0 HG3 GLU A 27 22.293 -0.297 -7.344 1.00 74.15 H new ATOM 411 N SER A 28 20.440 2.630 -6.205 1.00 64.03 N ATOM 412 CA SER A 28 20.911 3.105 -4.925 1.00 2.24 C ATOM 413 C SER A 28 21.291 1.904 -4.055 1.00 20.21 C ATOM 414 O SER A 28 22.251 1.955 -3.274 1.00 61.41 O ATOM 415 CB SER A 28 19.815 3.924 -4.244 1.00 12.11 C ATOM 416 OG SER A 28 19.351 4.972 -5.089 1.00 33.01 O ATOM 0 H SER A 28 19.424 2.598 -6.293 1.00 64.03 H new ATOM 0 HA SER A 28 21.786 3.740 -5.065 1.00 2.24 H new ATOM 0 HB2 SER A 28 18.983 3.272 -3.979 1.00 12.11 H new ATOM 0 HB3 SER A 28 20.198 4.346 -3.315 1.00 12.11 H new ATOM 0 HG SER A 28 18.553 5.382 -4.694 1.00 33.01 H new ATOM 422 N SER A 29 20.532 0.820 -4.247 1.00 32.22 N ATOM 423 CA SER A 29 20.697 -0.457 -3.571 1.00 35.24 C ATOM 424 C SER A 29 20.405 -0.371 -2.074 1.00 32.55 C ATOM 425 O SER A 29 21.142 0.273 -1.310 1.00 61.03 O ATOM 426 CB SER A 29 22.100 -1.015 -3.808 1.00 52.21 C ATOM 427 OG SER A 29 22.412 -1.034 -5.196 1.00 1.52 O ATOM 0 H SER A 29 19.755 0.816 -4.907 1.00 32.22 H new ATOM 0 HA SER A 29 19.963 -1.138 -4.002 1.00 35.24 H new ATOM 0 HB2 SER A 29 22.832 -0.408 -3.275 1.00 52.21 H new ATOM 0 HB3 SER A 29 22.167 -2.024 -3.402 1.00 52.21 H new ATOM 0 HG SER A 29 21.586 -1.126 -5.716 1.00 1.52 H new ATOM 433 N THR A 30 19.336 -0.989 -1.653 1.00 54.32 N ATOM 434 CA THR A 30 19.055 -1.051 -0.259 1.00 74.32 C ATOM 435 C THR A 30 19.884 -2.213 0.331 1.00 33.24 C ATOM 436 O THR A 30 20.144 -3.217 -0.361 1.00 54.51 O ATOM 437 CB THR A 30 17.523 -1.210 0.027 1.00 52.10 C ATOM 438 OG1 THR A 30 17.261 -0.937 1.403 1.00 55.02 O ATOM 439 CG2 THR A 30 17.015 -2.612 -0.309 1.00 22.52 C ATOM 0 H THR A 30 18.655 -1.451 -2.255 1.00 54.32 H new ATOM 0 HA THR A 30 19.337 -0.114 0.221 1.00 74.32 H new ATOM 0 HB THR A 30 16.998 -0.500 -0.612 1.00 52.10 H new ATOM 0 HG1 THR A 30 17.767 -0.145 1.682 1.00 55.02 H new ATOM 0 HG21 THR A 30 15.948 -2.674 -0.094 1.00 22.52 H new ATOM 0 HG22 THR A 30 17.185 -2.817 -1.366 1.00 22.52 H new ATOM 0 HG23 THR A 30 17.549 -3.347 0.293 1.00 22.52 H new ATOM 447 N GLY A 31 20.338 -2.064 1.544 1.00 5.21 N ATOM 448 CA GLY A 31 21.165 -3.069 2.140 1.00 44.31 C ATOM 449 C GLY A 31 20.390 -3.944 3.077 1.00 33.54 C ATOM 450 O GLY A 31 20.333 -3.676 4.283 1.00 74.25 O ATOM 0 H GLY A 31 20.148 -1.256 2.137 1.00 5.21 H new ATOM 0 HA2 GLY A 31 21.613 -3.682 1.358 1.00 44.31 H new ATOM 0 HA3 GLY A 31 21.983 -2.593 2.680 1.00 44.31 H new ATOM 454 N THR A 32 19.776 -4.963 2.542 1.00 62.43 N ATOM 455 CA THR A 32 19.024 -5.896 3.331 1.00 14.41 C ATOM 456 C THR A 32 19.994 -6.744 4.151 1.00 25.40 C ATOM 457 O THR A 32 20.846 -7.453 3.597 1.00 51.13 O ATOM 458 CB THR A 32 18.213 -6.815 2.426 1.00 72.34 C ATOM 459 OG1 THR A 32 17.611 -6.031 1.371 1.00 22.41 O ATOM 460 CG2 THR A 32 17.116 -7.511 3.225 1.00 73.23 C ATOM 0 H THR A 32 19.784 -5.169 1.543 1.00 62.43 H new ATOM 0 HA THR A 32 18.347 -5.348 3.986 1.00 14.41 H new ATOM 0 HB THR A 32 18.874 -7.570 2.001 1.00 72.34 H new ATOM 0 HG1 THR A 32 17.089 -6.618 0.784 1.00 22.41 H new ATOM 0 HG21 THR A 32 16.545 -8.164 2.566 1.00 73.23 H new ATOM 0 HG22 THR A 32 17.566 -8.103 4.022 1.00 73.23 H new ATOM 0 HG23 THR A 32 16.452 -6.763 3.659 1.00 73.23 H new ATOM 468 N ALA A 33 19.875 -6.656 5.435 1.00 52.25 N ATOM 469 CA ALA A 33 20.755 -7.363 6.329 1.00 64.43 C ATOM 470 C ALA A 33 20.290 -8.800 6.491 1.00 25.41 C ATOM 471 O ALA A 33 19.076 -9.054 6.537 1.00 61.15 O ATOM 472 CB ALA A 33 20.811 -6.667 7.683 1.00 3.11 C ATOM 0 H ALA A 33 19.165 -6.092 5.903 1.00 52.25 H new ATOM 0 HA ALA A 33 21.758 -7.365 5.902 1.00 64.43 H new ATOM 0 HB1 ALA A 33 21.481 -7.215 8.346 1.00 3.11 H new ATOM 0 HB2 ALA A 33 21.180 -5.650 7.554 1.00 3.11 H new ATOM 0 HB3 ALA A 33 19.812 -6.638 8.119 1.00 3.11 H new ATOM 478 N PRO A 34 21.234 -9.762 6.541 1.00 5.34 N ATOM 479 CA PRO A 34 20.928 -11.186 6.748 1.00 61.42 C ATOM 480 C PRO A 34 20.005 -11.399 7.946 1.00 22.33 C ATOM 481 O PRO A 34 20.050 -10.623 8.920 1.00 74.31 O ATOM 482 CB PRO A 34 22.294 -11.804 7.012 1.00 43.12 C ATOM 483 CG PRO A 34 23.235 -10.935 6.268 1.00 22.11 C ATOM 484 CD PRO A 34 22.684 -9.544 6.366 1.00 3.51 C ATOM 0 HA PRO A 34 20.407 -11.626 5.898 1.00 61.42 H new ATOM 0 HB2 PRO A 34 22.525 -11.821 8.077 1.00 43.12 H new ATOM 0 HB3 PRO A 34 22.340 -12.834 6.660 1.00 43.12 H new ATOM 0 HG2 PRO A 34 24.236 -10.989 6.696 1.00 22.11 H new ATOM 0 HG3 PRO A 34 23.316 -11.250 5.228 1.00 22.11 H new ATOM 0 HD2 PRO A 34 23.113 -9.000 7.208 1.00 3.51 H new ATOM 0 HD3 PRO A 34 22.898 -8.963 5.469 1.00 3.51 H new ATOM 492 N ALA A 35 19.141 -12.408 7.829 1.00 23.42 N ATOM 493 CA ALA A 35 18.113 -12.777 8.820 1.00 32.32 C ATOM 494 C ALA A 35 16.869 -11.897 8.701 1.00 64.12 C ATOM 495 O ALA A 35 15.815 -12.221 9.243 1.00 52.24 O ATOM 496 CB ALA A 35 18.639 -12.838 10.257 1.00 3.34 C ATOM 0 H ALA A 35 19.133 -13.018 7.012 1.00 23.42 H new ATOM 0 HA ALA A 35 17.819 -13.798 8.575 1.00 32.32 H new ATOM 0 HB1 ALA A 35 17.828 -13.115 10.930 1.00 3.34 H new ATOM 0 HB2 ALA A 35 19.434 -13.581 10.322 1.00 3.34 H new ATOM 0 HB3 ALA A 35 19.030 -11.862 10.543 1.00 3.34 H new ATOM 502 N SER A 36 16.987 -10.793 7.999 1.00 71.15 N ATOM 503 CA SER A 36 15.850 -9.955 7.729 1.00 24.41 C ATOM 504 C SER A 36 15.315 -10.370 6.370 1.00 1.55 C ATOM 505 O SER A 36 15.987 -10.179 5.346 1.00 54.24 O ATOM 506 CB SER A 36 16.274 -8.489 7.734 1.00 70.31 C ATOM 507 OG SER A 36 17.009 -8.192 8.924 1.00 25.11 O ATOM 0 H SER A 36 17.865 -10.457 7.605 1.00 71.15 H new ATOM 0 HA SER A 36 15.077 -10.068 8.489 1.00 24.41 H new ATOM 0 HB2 SER A 36 16.886 -8.277 6.857 1.00 70.31 H new ATOM 0 HB3 SER A 36 15.394 -7.848 7.672 1.00 70.31 H new ATOM 0 HG SER A 36 17.278 -7.250 8.916 1.00 25.11 H new ATOM 513 N THR A 37 14.165 -11.010 6.361 1.00 45.50 N ATOM 514 CA THR A 37 13.611 -11.557 5.153 1.00 71.31 C ATOM 515 C THR A 37 12.164 -12.009 5.436 1.00 53.52 C ATOM 516 O THR A 37 11.721 -11.984 6.602 1.00 53.01 O ATOM 517 CB THR A 37 14.501 -12.777 4.695 1.00 34.52 C ATOM 518 OG1 THR A 37 14.070 -13.332 3.444 1.00 5.50 O ATOM 519 CG2 THR A 37 14.528 -13.877 5.761 1.00 42.41 C ATOM 0 H THR A 37 13.593 -11.163 7.192 1.00 45.50 H new ATOM 0 HA THR A 37 13.599 -10.813 4.357 1.00 71.31 H new ATOM 0 HB THR A 37 15.508 -12.383 4.559 1.00 34.52 H new ATOM 0 HG1 THR A 37 13.470 -12.700 2.995 1.00 5.50 H new ATOM 0 HG21 THR A 37 15.149 -14.703 5.416 1.00 42.41 H new ATOM 0 HG22 THR A 37 14.940 -13.476 6.687 1.00 42.41 H new ATOM 0 HG23 THR A 37 13.514 -14.235 5.940 1.00 42.41 H new ATOM 527 N GLY A 38 11.432 -12.363 4.396 1.00 44.02 N ATOM 528 CA GLY A 38 10.109 -12.875 4.553 1.00 42.10 C ATOM 529 C GLY A 38 9.339 -12.871 3.251 1.00 20.02 C ATOM 530 O GLY A 38 8.922 -13.917 2.772 1.00 30.44 O ATOM 0 H GLY A 38 11.748 -12.299 3.428 1.00 44.02 H new ATOM 0 HA2 GLY A 38 10.158 -13.892 4.941 1.00 42.10 H new ATOM 0 HA3 GLY A 38 9.575 -12.277 5.291 1.00 42.10 H new ATOM 534 N ALA A 39 9.250 -11.709 2.637 1.00 55.21 N ATOM 535 CA ALA A 39 8.408 -11.509 1.457 1.00 1.44 C ATOM 536 C ALA A 39 8.956 -12.209 0.227 1.00 53.11 C ATOM 537 O ALA A 39 8.201 -12.680 -0.612 1.00 1.24 O ATOM 538 CB ALA A 39 8.218 -10.034 1.191 1.00 31.43 C ATOM 0 H ALA A 39 9.754 -10.874 2.934 1.00 55.21 H new ATOM 0 HA ALA A 39 7.440 -11.961 1.672 1.00 1.44 H new ATOM 0 HB1 ALA A 39 7.590 -9.901 0.310 1.00 31.43 H new ATOM 0 HB2 ALA A 39 7.739 -9.568 2.052 1.00 31.43 H new ATOM 0 HB3 ALA A 39 9.188 -9.568 1.018 1.00 31.43 H new ATOM 544 N GLU A 40 10.255 -12.293 0.136 1.00 34.00 N ATOM 545 CA GLU A 40 10.898 -12.952 -0.983 1.00 44.31 C ATOM 546 C GLU A 40 10.969 -14.458 -0.760 1.00 41.21 C ATOM 547 O GLU A 40 11.287 -15.214 -1.664 1.00 21.44 O ATOM 548 CB GLU A 40 12.293 -12.358 -1.304 1.00 3.31 C ATOM 549 CG GLU A 40 13.316 -12.385 -0.164 1.00 70.41 C ATOM 550 CD GLU A 40 12.967 -11.468 0.976 1.00 60.45 C ATOM 551 OE1 GLU A 40 13.268 -10.279 0.902 1.00 72.15 O ATOM 552 OE2 GLU A 40 12.361 -11.940 1.962 1.00 31.20 O ATOM 0 H GLU A 40 10.900 -11.911 0.828 1.00 34.00 H new ATOM 0 HA GLU A 40 10.278 -12.767 -1.860 1.00 44.31 H new ATOM 0 HB2 GLU A 40 12.710 -12.901 -2.152 1.00 3.31 H new ATOM 0 HB3 GLU A 40 12.161 -11.324 -1.622 1.00 3.31 H new ATOM 0 HG2 GLU A 40 13.402 -13.404 0.213 1.00 70.41 H new ATOM 0 HG3 GLU A 40 14.294 -12.107 -0.557 1.00 70.41 H new ATOM 559 N ASN A 41 10.685 -14.887 0.458 1.00 14.13 N ATOM 560 CA ASN A 41 10.676 -16.316 0.774 1.00 52.35 C ATOM 561 C ASN A 41 9.350 -16.922 0.392 1.00 32.34 C ATOM 562 O ASN A 41 9.215 -18.137 0.292 1.00 12.11 O ATOM 563 CB ASN A 41 10.961 -16.596 2.256 1.00 34.44 C ATOM 564 CG ASN A 41 12.333 -16.158 2.700 1.00 70.44 C ATOM 565 OD1 ASN A 41 13.284 -16.110 1.912 1.00 34.21 O ATOM 566 ND2 ASN A 41 12.467 -15.870 3.966 1.00 44.23 N ATOM 0 H ASN A 41 10.458 -14.276 1.243 1.00 14.13 H new ATOM 0 HA ASN A 41 11.479 -16.773 0.195 1.00 52.35 H new ATOM 0 HB2 ASN A 41 10.212 -16.088 2.864 1.00 34.44 H new ATOM 0 HB3 ASN A 41 10.852 -17.664 2.443 1.00 34.44 H new ATOM 0 HD21 ASN A 41 13.378 -15.595 4.333 1.00 44.23 H new ATOM 0 HD22 ASN A 41 11.661 -15.920 4.589 1.00 44.23 H new ATOM 573 N LEU A 42 8.364 -16.076 0.219 1.00 31.01 N ATOM 574 CA LEU A 42 7.051 -16.485 -0.191 1.00 12.32 C ATOM 575 C LEU A 42 6.774 -16.027 -1.610 1.00 22.12 C ATOM 576 O LEU A 42 6.474 -14.857 -1.831 1.00 44.32 O ATOM 577 CB LEU A 42 5.955 -15.933 0.745 1.00 45.32 C ATOM 578 CG LEU A 42 5.669 -16.689 2.056 1.00 54.40 C ATOM 579 CD1 LEU A 42 5.293 -18.135 1.777 1.00 70.42 C ATOM 580 CD2 LEU A 42 6.827 -16.596 3.043 1.00 4.55 C ATOM 0 H LEU A 42 8.457 -15.070 0.362 1.00 31.01 H new ATOM 0 HA LEU A 42 7.025 -17.574 -0.141 1.00 12.32 H new ATOM 0 HB2 LEU A 42 6.223 -14.908 1.003 1.00 45.32 H new ATOM 0 HB3 LEU A 42 5.025 -15.886 0.178 1.00 45.32 H new ATOM 0 HG LEU A 42 4.817 -16.201 2.529 1.00 54.40 H new ATOM 0 HD11 LEU A 42 5.096 -18.648 2.718 1.00 70.42 H new ATOM 0 HD12 LEU A 42 4.399 -18.165 1.153 1.00 70.42 H new ATOM 0 HD13 LEU A 42 6.114 -18.631 1.259 1.00 70.42 H new ATOM 0 HD21 LEU A 42 6.576 -17.145 3.951 1.00 4.55 H new ATOM 0 HD22 LEU A 42 7.723 -17.026 2.595 1.00 4.55 H new ATOM 0 HD23 LEU A 42 7.011 -15.551 3.290 1.00 4.55 H new ATOM 592 N PRO A 43 6.901 -16.924 -2.606 1.00 10.32 N ATOM 593 CA PRO A 43 6.589 -16.588 -3.994 1.00 34.01 C ATOM 594 C PRO A 43 5.098 -16.289 -4.136 1.00 4.22 C ATOM 595 O PRO A 43 4.679 -15.430 -4.911 1.00 23.23 O ATOM 596 CB PRO A 43 6.976 -17.848 -4.782 1.00 31.31 C ATOM 597 CG PRO A 43 7.037 -18.949 -3.780 1.00 4.55 C ATOM 598 CD PRO A 43 7.382 -18.313 -2.463 1.00 61.20 C ATOM 0 HA PRO A 43 7.118 -15.704 -4.349 1.00 34.01 H new ATOM 0 HB2 PRO A 43 6.242 -18.065 -5.558 1.00 31.31 H new ATOM 0 HB3 PRO A 43 7.937 -17.718 -5.280 1.00 31.31 H new ATOM 0 HG2 PRO A 43 6.082 -19.471 -3.720 1.00 4.55 H new ATOM 0 HG3 PRO A 43 7.787 -19.688 -4.062 1.00 4.55 H new ATOM 0 HD2 PRO A 43 6.893 -18.822 -1.633 1.00 61.20 H new ATOM 0 HD3 PRO A 43 8.454 -18.347 -2.271 1.00 61.20 H new ATOM 606 N ALA A 44 4.321 -16.992 -3.350 1.00 72.03 N ATOM 607 CA ALA A 44 2.911 -16.806 -3.260 1.00 51.11 C ATOM 608 C ALA A 44 2.526 -17.013 -1.812 1.00 12.21 C ATOM 609 O ALA A 44 2.591 -18.129 -1.296 1.00 5.01 O ATOM 610 CB ALA A 44 2.179 -17.775 -4.174 1.00 44.35 C ATOM 0 H ALA A 44 4.672 -17.730 -2.740 1.00 72.03 H new ATOM 0 HA ALA A 44 2.630 -15.804 -3.584 1.00 51.11 H new ATOM 0 HB1 ALA A 44 1.104 -17.615 -4.088 1.00 44.35 H new ATOM 0 HB2 ALA A 44 2.490 -17.608 -5.205 1.00 44.35 H new ATOM 0 HB3 ALA A 44 2.417 -18.799 -3.885 1.00 44.35 H new ATOM 616 N GLY A 45 2.184 -15.945 -1.151 1.00 24.05 N ATOM 617 CA GLY A 45 1.890 -16.011 0.264 1.00 44.32 C ATOM 618 C GLY A 45 1.845 -14.636 0.871 1.00 35.03 C ATOM 619 O GLY A 45 1.261 -14.428 1.936 1.00 14.35 O ATOM 0 H GLY A 45 2.100 -15.015 -1.562 1.00 24.05 H new ATOM 0 HA2 GLY A 45 0.934 -16.511 0.417 1.00 44.32 H new ATOM 0 HA3 GLY A 45 2.648 -16.610 0.769 1.00 44.32 H new ATOM 623 N SER A 46 2.436 -13.693 0.188 1.00 0.01 N ATOM 624 CA SER A 46 2.400 -12.330 0.614 1.00 21.30 C ATOM 625 C SER A 46 1.163 -11.693 -0.013 1.00 32.42 C ATOM 626 O SER A 46 0.695 -12.139 -1.066 1.00 33.21 O ATOM 627 CB SER A 46 3.651 -11.622 0.115 1.00 63.44 C ATOM 628 OG SER A 46 4.808 -12.417 0.350 1.00 10.32 O ATOM 0 H SER A 46 2.953 -13.853 -0.676 1.00 0.01 H new ATOM 0 HA SER A 46 2.361 -12.255 1.701 1.00 21.30 H new ATOM 0 HB2 SER A 46 3.557 -11.415 -0.951 1.00 63.44 H new ATOM 0 HB3 SER A 46 3.756 -10.661 0.618 1.00 63.44 H new ATOM 0 HG SER A 46 5.601 -11.945 0.021 1.00 10.32 H new ATOM 634 N ALA A 47 0.635 -10.694 0.624 1.00 44.52 N ATOM 635 CA ALA A 47 -0.569 -10.059 0.159 1.00 10.30 C ATOM 636 C ALA A 47 -0.230 -8.809 -0.634 1.00 64.14 C ATOM 637 O ALA A 47 0.955 -8.447 -0.755 1.00 2.40 O ATOM 638 CB ALA A 47 -1.474 -9.749 1.327 1.00 65.54 C ATOM 0 H ALA A 47 1.021 -10.293 1.479 1.00 44.52 H new ATOM 0 HA ALA A 47 -1.102 -10.738 -0.506 1.00 10.30 H new ATOM 0 HB1 ALA A 47 -2.383 -9.268 0.965 1.00 65.54 H new ATOM 0 HB2 ALA A 47 -1.733 -10.674 1.842 1.00 65.54 H new ATOM 0 HB3 ALA A 47 -0.960 -9.080 2.018 1.00 65.54 H new ATOM 644 N LEU A 48 -1.234 -8.139 -1.148 1.00 42.43 N ATOM 645 CA LEU A 48 -1.006 -6.997 -1.994 1.00 73.34 C ATOM 646 C LEU A 48 -1.895 -5.842 -1.614 1.00 21.31 C ATOM 647 O LEU A 48 -2.933 -6.021 -0.986 1.00 12.13 O ATOM 648 CB LEU A 48 -1.206 -7.329 -3.501 1.00 15.13 C ATOM 649 CG LEU A 48 -2.639 -7.653 -4.000 1.00 42.21 C ATOM 650 CD1 LEU A 48 -2.666 -7.653 -5.513 1.00 25.05 C ATOM 651 CD2 LEU A 48 -3.114 -9.006 -3.500 1.00 24.43 C ATOM 0 H LEU A 48 -2.216 -8.367 -0.994 1.00 42.43 H new ATOM 0 HA LEU A 48 0.035 -6.712 -1.842 1.00 73.34 H new ATOM 0 HB2 LEU A 48 -0.836 -6.483 -4.080 1.00 15.13 H new ATOM 0 HB3 LEU A 48 -0.570 -8.181 -3.741 1.00 15.13 H new ATOM 0 HG LEU A 48 -3.306 -6.886 -3.607 1.00 42.21 H new ATOM 0 HD11 LEU A 48 -3.674 -7.881 -5.859 1.00 25.05 H new ATOM 0 HD12 LEU A 48 -2.369 -6.671 -5.882 1.00 25.05 H new ATOM 0 HD13 LEU A 48 -1.974 -8.407 -5.889 1.00 25.05 H new ATOM 0 HD21 LEU A 48 -4.121 -9.198 -3.870 1.00 24.43 H new ATOM 0 HD22 LEU A 48 -2.441 -9.784 -3.860 1.00 24.43 H new ATOM 0 HD23 LEU A 48 -3.121 -9.009 -2.410 1.00 24.43 H new ATOM 663 N LEU A 49 -1.481 -4.681 -1.988 1.00 54.12 N ATOM 664 CA LEU A 49 -2.252 -3.499 -1.804 1.00 52.22 C ATOM 665 C LEU A 49 -2.497 -2.856 -3.150 1.00 62.33 C ATOM 666 O LEU A 49 -1.631 -2.897 -4.034 1.00 2.13 O ATOM 667 CB LEU A 49 -1.608 -2.539 -0.752 1.00 53.23 C ATOM 668 CG LEU A 49 -0.097 -2.190 -0.884 1.00 4.14 C ATOM 669 CD1 LEU A 49 0.200 -1.272 -2.062 1.00 2.32 C ATOM 670 CD2 LEU A 49 0.421 -1.583 0.413 1.00 71.23 C ATOM 0 H LEU A 49 -0.580 -4.523 -2.439 1.00 54.12 H new ATOM 0 HA LEU A 49 -3.223 -3.755 -1.379 1.00 52.22 H new ATOM 0 HB2 LEU A 49 -2.166 -1.603 -0.773 1.00 53.23 H new ATOM 0 HB3 LEU A 49 -1.761 -2.979 0.234 1.00 53.23 H new ATOM 0 HG LEU A 49 0.427 -3.125 -1.080 1.00 4.14 H new ATOM 0 HD11 LEU A 49 1.269 -1.065 -2.101 1.00 2.32 H new ATOM 0 HD12 LEU A 49 -0.110 -1.756 -2.988 1.00 2.32 H new ATOM 0 HD13 LEU A 49 -0.346 -0.337 -1.941 1.00 2.32 H new ATOM 0 HD21 LEU A 49 1.479 -1.344 0.306 1.00 71.23 H new ATOM 0 HD22 LEU A 49 -0.136 -0.673 0.637 1.00 71.23 H new ATOM 0 HD23 LEU A 49 0.291 -2.297 1.226 1.00 71.23 H new ATOM 682 N VAL A 50 -3.671 -2.354 -3.343 1.00 34.15 N ATOM 683 CA VAL A 50 -4.001 -1.715 -4.582 1.00 23.33 C ATOM 684 C VAL A 50 -4.281 -0.247 -4.344 1.00 33.14 C ATOM 685 O VAL A 50 -4.907 0.134 -3.331 1.00 33.04 O ATOM 686 CB VAL A 50 -5.185 -2.406 -5.344 1.00 44.44 C ATOM 687 CG1 VAL A 50 -4.855 -3.847 -5.678 1.00 20.12 C ATOM 688 CG2 VAL A 50 -6.471 -2.353 -4.557 1.00 52.31 C ATOM 0 H VAL A 50 -4.425 -2.372 -2.657 1.00 34.15 H new ATOM 0 HA VAL A 50 -3.135 -1.817 -5.236 1.00 23.33 H new ATOM 0 HB VAL A 50 -5.326 -1.847 -6.269 1.00 44.44 H new ATOM 0 HG11 VAL A 50 -5.694 -4.300 -6.206 1.00 20.12 H new ATOM 0 HG12 VAL A 50 -3.968 -3.880 -6.311 1.00 20.12 H new ATOM 0 HG13 VAL A 50 -4.665 -4.399 -4.758 1.00 20.12 H new ATOM 0 HG21 VAL A 50 -7.264 -2.843 -5.122 1.00 52.31 H new ATOM 0 HG22 VAL A 50 -6.336 -2.864 -3.604 1.00 52.31 H new ATOM 0 HG23 VAL A 50 -6.744 -1.313 -4.376 1.00 52.31 H new ATOM 698 N VAL A 51 -3.791 0.570 -5.229 1.00 12.32 N ATOM 699 CA VAL A 51 -3.977 1.992 -5.135 1.00 32.51 C ATOM 700 C VAL A 51 -5.196 2.353 -5.948 1.00 33.12 C ATOM 701 O VAL A 51 -5.209 2.167 -7.164 1.00 60.31 O ATOM 702 CB VAL A 51 -2.746 2.765 -5.697 1.00 74.21 C ATOM 703 CG1 VAL A 51 -2.887 4.267 -5.480 1.00 11.23 C ATOM 704 CG2 VAL A 51 -1.435 2.255 -5.099 1.00 54.33 C ATOM 0 H VAL A 51 -3.249 0.270 -6.040 1.00 12.32 H new ATOM 0 HA VAL A 51 -4.098 2.268 -4.087 1.00 32.51 H new ATOM 0 HB VAL A 51 -2.716 2.578 -6.770 1.00 74.21 H new ATOM 0 HG11 VAL A 51 -2.012 4.777 -5.883 1.00 11.23 H new ATOM 0 HG12 VAL A 51 -3.782 4.626 -5.988 1.00 11.23 H new ATOM 0 HG13 VAL A 51 -2.968 4.474 -4.413 1.00 11.23 H new ATOM 0 HG21 VAL A 51 -0.601 2.819 -5.516 1.00 54.33 H new ATOM 0 HG22 VAL A 51 -1.455 2.383 -4.017 1.00 54.33 H new ATOM 0 HG23 VAL A 51 -1.313 1.198 -5.337 1.00 54.33 H new ATOM 714 N LYS A 52 -6.213 2.844 -5.287 1.00 53.30 N ATOM 715 CA LYS A 52 -7.429 3.208 -5.973 1.00 42.33 C ATOM 716 C LYS A 52 -7.335 4.637 -6.442 1.00 43.34 C ATOM 717 O LYS A 52 -7.813 4.988 -7.523 1.00 34.41 O ATOM 718 CB LYS A 52 -8.650 3.019 -5.066 1.00 72.22 C ATOM 719 CG LYS A 52 -8.948 1.571 -4.686 1.00 62.51 C ATOM 720 CD LYS A 52 -9.335 0.737 -5.903 1.00 60.05 C ATOM 721 CE LYS A 52 -9.715 -0.676 -5.498 1.00 64.32 C ATOM 722 NZ LYS A 52 -10.111 -1.512 -6.654 1.00 54.21 N ATOM 0 H LYS A 52 -6.225 3.001 -4.279 1.00 53.30 H new ATOM 0 HA LYS A 52 -7.553 2.554 -6.836 1.00 42.33 H new ATOM 0 HB2 LYS A 52 -8.500 3.596 -4.153 1.00 72.22 H new ATOM 0 HB3 LYS A 52 -9.524 3.436 -5.566 1.00 72.22 H new ATOM 0 HG2 LYS A 52 -8.072 1.133 -4.208 1.00 62.51 H new ATOM 0 HG3 LYS A 52 -9.756 1.545 -3.955 1.00 62.51 H new ATOM 0 HD2 LYS A 52 -10.171 1.208 -6.420 1.00 60.05 H new ATOM 0 HD3 LYS A 52 -8.503 0.706 -6.606 1.00 60.05 H new ATOM 0 HE2 LYS A 52 -8.872 -1.143 -4.988 1.00 64.32 H new ATOM 0 HE3 LYS A 52 -10.538 -0.637 -4.784 1.00 64.32 H new ATOM 0 HZ1 LYS A 52 -10.361 -2.466 -6.323 1.00 54.21 H new ATOM 0 HZ2 LYS A 52 -10.932 -1.084 -7.127 1.00 54.21 H new ATOM 0 HZ3 LYS A 52 -9.319 -1.574 -7.325 1.00 54.21 H new ATOM 736 N ARG A 53 -6.702 5.447 -5.636 1.00 72.32 N ATOM 737 CA ARG A 53 -6.524 6.840 -5.928 1.00 24.54 C ATOM 738 C ARG A 53 -5.247 7.291 -5.301 1.00 12.01 C ATOM 739 O ARG A 53 -5.033 7.069 -4.114 1.00 31.42 O ATOM 740 CB ARG A 53 -7.711 7.637 -5.385 1.00 64.42 C ATOM 741 CG ARG A 53 -7.657 9.140 -5.608 1.00 51.31 C ATOM 742 CD ARG A 53 -9.015 9.752 -5.313 1.00 2.34 C ATOM 743 NE ARG A 53 -10.024 9.177 -6.206 1.00 52.52 N ATOM 744 CZ ARG A 53 -11.340 9.107 -5.991 1.00 71.43 C ATOM 745 NH1 ARG A 53 -11.882 9.558 -4.861 1.00 35.03 N ATOM 746 NH2 ARG A 53 -12.113 8.555 -6.916 1.00 15.41 N ATOM 0 H ARG A 53 -6.292 5.153 -4.750 1.00 72.32 H new ATOM 0 HA ARG A 53 -6.475 7.003 -7.005 1.00 24.54 H new ATOM 0 HB2 ARG A 53 -8.622 7.253 -5.844 1.00 64.42 H new ATOM 0 HB3 ARG A 53 -7.790 7.450 -4.314 1.00 64.42 H new ATOM 0 HG2 ARG A 53 -6.899 9.586 -4.964 1.00 51.31 H new ATOM 0 HG3 ARG A 53 -7.367 9.354 -6.637 1.00 51.31 H new ATOM 0 HD2 ARG A 53 -9.289 9.568 -4.274 1.00 2.34 H new ATOM 0 HD3 ARG A 53 -8.973 10.833 -5.445 1.00 2.34 H new ATOM 0 HE ARG A 53 -9.685 8.789 -7.086 1.00 52.52 H new ATOM 0 HH11 ARG A 53 -11.289 9.967 -4.139 1.00 35.03 H new ATOM 0 HH12 ARG A 53 -12.890 9.494 -4.718 1.00 35.03 H new ATOM 0 HH21 ARG A 53 -11.700 8.192 -7.775 1.00 15.41 H new ATOM 0 HH22 ARG A 53 -13.120 8.493 -6.768 1.00 15.41 H new ATOM 760 N GLY A 54 -4.389 7.863 -6.091 1.00 15.34 N ATOM 761 CA GLY A 54 -3.145 8.333 -5.599 1.00 33.52 C ATOM 762 C GLY A 54 -2.098 8.366 -6.678 1.00 32.13 C ATOM 763 O GLY A 54 -1.796 7.322 -7.263 1.00 3.50 O ATOM 0 H GLY A 54 -4.538 8.013 -7.089 1.00 15.34 H new ATOM 0 HA2 GLY A 54 -3.272 9.333 -5.184 1.00 33.52 H new ATOM 0 HA3 GLY A 54 -2.809 7.690 -4.785 1.00 33.52 H new ATOM 767 N PRO A 55 -1.498 9.560 -6.952 1.00 44.13 N ATOM 768 CA PRO A 55 -0.423 9.754 -7.975 1.00 52.11 C ATOM 769 C PRO A 55 0.799 8.847 -7.772 1.00 11.44 C ATOM 770 O PRO A 55 1.700 8.822 -8.597 1.00 3.31 O ATOM 771 CB PRO A 55 -0.021 11.216 -7.784 1.00 23.14 C ATOM 772 CG PRO A 55 -1.250 11.855 -7.266 1.00 34.12 C ATOM 773 CD PRO A 55 -1.854 10.853 -6.330 1.00 0.12 C ATOM 0 HA PRO A 55 -0.784 9.504 -8.972 1.00 52.11 H new ATOM 0 HB2 PRO A 55 0.807 11.315 -7.082 1.00 23.14 H new ATOM 0 HB3 PRO A 55 0.300 11.668 -8.722 1.00 23.14 H new ATOM 0 HG2 PRO A 55 -1.021 12.787 -6.749 1.00 34.12 H new ATOM 0 HG3 PRO A 55 -1.937 12.100 -8.076 1.00 34.12 H new ATOM 0 HD2 PRO A 55 -1.445 10.943 -5.324 1.00 0.12 H new ATOM 0 HD3 PRO A 55 -2.934 10.977 -6.247 1.00 0.12 H new ATOM 781 N ASN A 56 0.826 8.161 -6.635 1.00 51.22 N ATOM 782 CA ASN A 56 1.857 7.183 -6.292 1.00 31.43 C ATOM 783 C ASN A 56 2.027 6.155 -7.416 1.00 33.34 C ATOM 784 O ASN A 56 3.141 5.751 -7.721 1.00 31.45 O ATOM 785 CB ASN A 56 1.471 6.468 -4.980 1.00 63.35 C ATOM 786 CG ASN A 56 2.431 5.348 -4.585 1.00 55.33 C ATOM 787 OD1 ASN A 56 3.415 5.576 -3.907 1.00 3.20 O ATOM 788 ND2 ASN A 56 2.120 4.128 -4.970 1.00 24.30 N ATOM 0 H ASN A 56 0.118 8.270 -5.909 1.00 51.22 H new ATOM 0 HA ASN A 56 2.805 7.705 -6.160 1.00 31.43 H new ATOM 0 HB2 ASN A 56 1.432 7.202 -4.175 1.00 63.35 H new ATOM 0 HB3 ASN A 56 0.468 6.055 -5.084 1.00 63.35 H new ATOM 0 HD21 ASN A 56 2.711 3.342 -4.700 1.00 24.30 H new ATOM 0 HD22 ASN A 56 1.288 3.969 -5.538 1.00 24.30 H new ATOM 795 N ALA A 57 0.894 5.753 -8.038 1.00 33.32 N ATOM 796 CA ALA A 57 0.909 4.777 -9.136 1.00 73.21 C ATOM 797 C ALA A 57 -0.484 4.524 -9.682 1.00 63.14 C ATOM 798 O ALA A 57 -0.753 4.761 -10.856 1.00 72.34 O ATOM 799 CB ALA A 57 1.507 3.445 -8.695 1.00 42.33 C ATOM 0 H ALA A 57 -0.036 6.093 -7.794 1.00 33.32 H new ATOM 0 HA ALA A 57 1.530 5.212 -9.919 1.00 73.21 H new ATOM 0 HB1 ALA A 57 1.501 2.748 -9.533 1.00 42.33 H new ATOM 0 HB2 ALA A 57 2.532 3.600 -8.359 1.00 42.33 H new ATOM 0 HB3 ALA A 57 0.915 3.033 -7.877 1.00 42.33 H new ATOM 805 N GLY A 58 -1.370 4.050 -8.818 1.00 74.31 N ATOM 806 CA GLY A 58 -2.685 3.651 -9.270 1.00 4.14 C ATOM 807 C GLY A 58 -2.608 2.275 -9.899 1.00 25.53 C ATOM 808 O GLY A 58 -3.016 2.075 -11.038 1.00 34.34 O ATOM 0 H GLY A 58 -1.203 3.935 -7.818 1.00 74.31 H new ATOM 0 HA2 GLY A 58 -3.382 3.641 -8.432 1.00 4.14 H new ATOM 0 HA3 GLY A 58 -3.067 4.372 -9.993 1.00 4.14 H new ATOM 812 N ALA A 59 -2.066 1.334 -9.149 1.00 14.14 N ATOM 813 CA ALA A 59 -1.832 -0.006 -9.617 1.00 53.00 C ATOM 814 C ALA A 59 -1.817 -0.925 -8.412 1.00 20.33 C ATOM 815 O ALA A 59 -2.119 -0.475 -7.292 1.00 41.32 O ATOM 816 CB ALA A 59 -0.498 -0.070 -10.358 1.00 52.54 C ATOM 0 H ALA A 59 -1.774 1.488 -8.184 1.00 14.14 H new ATOM 0 HA ALA A 59 -2.616 -0.314 -10.308 1.00 53.00 H new ATOM 0 HB1 ALA A 59 -0.326 -1.087 -10.710 1.00 52.54 H new ATOM 0 HB2 ALA A 59 -0.522 0.610 -11.210 1.00 52.54 H new ATOM 0 HB3 ALA A 59 0.307 0.222 -9.684 1.00 52.54 H new ATOM 822 N ARG A 60 -1.448 -2.169 -8.608 1.00 70.05 N ATOM 823 CA ARG A 60 -1.434 -3.131 -7.531 1.00 23.34 C ATOM 824 C ARG A 60 -0.001 -3.489 -7.177 1.00 63.44 C ATOM 825 O ARG A 60 0.850 -3.603 -8.061 1.00 72.04 O ATOM 826 CB ARG A 60 -2.228 -4.386 -7.916 1.00 52.45 C ATOM 827 CG ARG A 60 -1.638 -5.204 -9.059 1.00 40.34 C ATOM 828 CD ARG A 60 -2.470 -6.442 -9.361 1.00 22.33 C ATOM 829 NE ARG A 60 -3.813 -6.104 -9.851 1.00 5.04 N ATOM 830 CZ ARG A 60 -4.786 -6.992 -10.126 1.00 25.14 C ATOM 831 NH1 ARG A 60 -4.624 -8.291 -9.843 1.00 51.13 N ATOM 832 NH2 ARG A 60 -5.922 -6.571 -10.657 1.00 30.32 N ATOM 0 H ARG A 60 -1.151 -2.541 -9.510 1.00 70.05 H new ATOM 0 HA ARG A 60 -1.910 -2.687 -6.657 1.00 23.34 H new ATOM 0 HB2 ARG A 60 -2.312 -5.027 -7.038 1.00 52.45 H new ATOM 0 HB3 ARG A 60 -3.240 -4.086 -8.190 1.00 52.45 H new ATOM 0 HG2 ARG A 60 -1.573 -4.584 -9.953 1.00 40.34 H new ATOM 0 HG3 ARG A 60 -0.621 -5.503 -8.804 1.00 40.34 H new ATOM 0 HD2 ARG A 60 -1.956 -7.050 -10.106 1.00 22.33 H new ATOM 0 HD3 ARG A 60 -2.556 -7.048 -8.459 1.00 22.33 H new ATOM 0 HE ARG A 60 -4.025 -5.117 -9.994 1.00 5.04 H new ATOM 0 HH11 ARG A 60 -3.757 -8.615 -9.415 1.00 51.13 H new ATOM 0 HH12 ARG A 60 -5.368 -8.956 -10.055 1.00 51.13 H new ATOM 0 HH21 ARG A 60 -6.056 -5.579 -10.855 1.00 30.32 H new ATOM 0 HH22 ARG A 60 -6.664 -7.238 -10.868 1.00 30.32 H new ATOM 846 N PHE A 61 0.278 -3.630 -5.910 1.00 33.15 N ATOM 847 CA PHE A 61 1.611 -3.975 -5.467 1.00 61.34 C ATOM 848 C PHE A 61 1.565 -5.047 -4.409 1.00 52.21 C ATOM 849 O PHE A 61 0.948 -4.866 -3.356 1.00 3.43 O ATOM 850 CB PHE A 61 2.362 -2.755 -4.919 1.00 34.44 C ATOM 851 CG PHE A 61 2.605 -1.673 -5.922 1.00 63.43 C ATOM 852 CD1 PHE A 61 3.657 -1.770 -6.816 1.00 11.11 C ATOM 853 CD2 PHE A 61 1.787 -0.559 -5.973 1.00 13.14 C ATOM 854 CE1 PHE A 61 3.888 -0.780 -7.744 1.00 73.42 C ATOM 855 CE2 PHE A 61 2.011 0.431 -6.897 1.00 34.41 C ATOM 856 CZ PHE A 61 3.063 0.323 -7.787 1.00 1.14 C ATOM 0 H PHE A 61 -0.401 -3.512 -5.158 1.00 33.15 H new ATOM 0 HA PHE A 61 2.147 -4.349 -6.340 1.00 61.34 H new ATOM 0 HB2 PHE A 61 1.795 -2.340 -4.086 1.00 34.44 H new ATOM 0 HB3 PHE A 61 3.321 -3.084 -4.519 1.00 34.44 H new ATOM 0 HD1 PHE A 61 4.305 -2.633 -6.785 1.00 11.11 H new ATOM 0 HD2 PHE A 61 0.964 -0.467 -5.279 1.00 13.14 H new ATOM 0 HE1 PHE A 61 4.713 -0.867 -8.436 1.00 73.42 H new ATOM 0 HE2 PHE A 61 1.364 1.295 -6.929 1.00 34.41 H new ATOM 0 HZ PHE A 61 3.238 1.102 -8.515 1.00 1.14 H new ATOM 866 N LEU A 62 2.171 -6.165 -4.702 1.00 15.32 N ATOM 867 CA LEU A 62 2.305 -7.235 -3.747 1.00 3.11 C ATOM 868 C LEU A 62 3.553 -6.958 -2.943 1.00 71.42 C ATOM 869 O LEU A 62 4.546 -6.491 -3.506 1.00 75.21 O ATOM 870 CB LEU A 62 2.339 -8.608 -4.482 1.00 41.44 C ATOM 871 CG LEU A 62 2.516 -9.891 -3.630 1.00 54.02 C ATOM 872 CD1 LEU A 62 1.880 -11.075 -4.335 1.00 30.50 C ATOM 873 CD2 LEU A 62 3.994 -10.199 -3.426 1.00 75.24 C ATOM 0 H LEU A 62 2.588 -6.362 -5.612 1.00 15.32 H new ATOM 0 HA LEU A 62 1.454 -7.286 -3.068 1.00 3.11 H new ATOM 0 HB2 LEU A 62 1.411 -8.707 -5.045 1.00 41.44 H new ATOM 0 HB3 LEU A 62 3.151 -8.576 -5.209 1.00 41.44 H new ATOM 0 HG LEU A 62 2.037 -9.721 -2.666 1.00 54.02 H new ATOM 0 HD11 LEU A 62 2.009 -11.972 -3.729 1.00 30.50 H new ATOM 0 HD12 LEU A 62 0.816 -10.884 -4.479 1.00 30.50 H new ATOM 0 HD13 LEU A 62 2.357 -11.220 -5.304 1.00 30.50 H new ATOM 0 HD21 LEU A 62 4.098 -11.103 -2.826 1.00 75.24 H new ATOM 0 HD22 LEU A 62 4.471 -10.350 -4.394 1.00 75.24 H new ATOM 0 HD23 LEU A 62 4.472 -9.365 -2.912 1.00 75.24 H new ATOM 885 N LEU A 63 3.514 -7.190 -1.647 1.00 32.24 N ATOM 886 CA LEU A 63 4.661 -6.867 -0.819 1.00 20.20 C ATOM 887 C LEU A 63 5.783 -7.843 -1.111 1.00 64.12 C ATOM 888 O LEU A 63 5.682 -9.038 -0.832 1.00 12.12 O ATOM 889 CB LEU A 63 4.279 -6.874 0.665 1.00 74.24 C ATOM 890 CG LEU A 63 3.159 -5.897 1.069 1.00 10.02 C ATOM 891 CD1 LEU A 63 2.841 -6.026 2.545 1.00 41.32 C ATOM 892 CD2 LEU A 63 3.542 -4.457 0.735 1.00 41.32 C ATOM 0 H LEU A 63 2.719 -7.593 -1.151 1.00 32.24 H new ATOM 0 HA LEU A 63 5.007 -5.861 -1.056 1.00 20.20 H new ATOM 0 HB2 LEU A 63 3.972 -7.884 0.938 1.00 74.24 H new ATOM 0 HB3 LEU A 63 5.168 -6.642 1.252 1.00 74.24 H new ATOM 0 HG LEU A 63 2.268 -6.156 0.497 1.00 10.02 H new ATOM 0 HD11 LEU A 63 2.047 -5.327 2.809 1.00 41.32 H new ATOM 0 HD12 LEU A 63 2.514 -7.044 2.759 1.00 41.32 H new ATOM 0 HD13 LEU A 63 3.732 -5.800 3.130 1.00 41.32 H new ATOM 0 HD21 LEU A 63 2.734 -3.788 1.030 1.00 41.32 H new ATOM 0 HD22 LEU A 63 4.451 -4.188 1.273 1.00 41.32 H new ATOM 0 HD23 LEU A 63 3.715 -4.366 -0.337 1.00 41.32 H new ATOM 904 N ASP A 64 6.845 -7.310 -1.667 1.00 13.23 N ATOM 905 CA ASP A 64 7.961 -8.105 -2.164 1.00 14.32 C ATOM 906 C ASP A 64 9.236 -7.783 -1.409 1.00 43.44 C ATOM 907 O ASP A 64 10.087 -8.648 -1.184 1.00 53.43 O ATOM 908 CB ASP A 64 8.128 -7.822 -3.662 1.00 0.44 C ATOM 909 CG ASP A 64 9.285 -8.541 -4.312 1.00 31.42 C ATOM 910 OD1 ASP A 64 9.181 -9.744 -4.559 1.00 13.02 O ATOM 911 OD2 ASP A 64 10.279 -7.878 -4.674 1.00 31.14 O ATOM 0 H ASP A 64 6.967 -6.305 -1.792 1.00 13.23 H new ATOM 0 HA ASP A 64 7.754 -9.164 -2.009 1.00 14.32 H new ATOM 0 HB2 ASP A 64 7.208 -8.102 -4.176 1.00 0.44 H new ATOM 0 HB3 ASP A 64 8.258 -6.749 -3.803 1.00 0.44 H new ATOM 916 N GLN A 65 9.354 -6.555 -0.991 1.00 32.33 N ATOM 917 CA GLN A 65 10.499 -6.123 -0.238 1.00 32.44 C ATOM 918 C GLN A 65 10.126 -6.174 1.246 1.00 73.24 C ATOM 919 O GLN A 65 9.049 -5.684 1.621 1.00 43.21 O ATOM 920 CB GLN A 65 10.912 -4.703 -0.677 1.00 64.02 C ATOM 921 CG GLN A 65 12.226 -4.217 -0.088 1.00 25.33 C ATOM 922 CD GLN A 65 12.681 -2.892 -0.668 1.00 2.33 C ATOM 923 OE1 GLN A 65 13.380 -2.852 -1.670 1.00 20.11 O ATOM 924 NE2 GLN A 65 12.324 -1.808 -0.039 1.00 32.44 N ATOM 0 H GLN A 65 8.661 -5.826 -1.162 1.00 32.33 H new ATOM 0 HA GLN A 65 11.356 -6.773 -0.416 1.00 32.44 H new ATOM 0 HB2 GLN A 65 10.985 -4.680 -1.764 1.00 64.02 H new ATOM 0 HB3 GLN A 65 10.123 -4.006 -0.396 1.00 64.02 H new ATOM 0 HG2 GLN A 65 12.119 -4.117 0.992 1.00 25.33 H new ATOM 0 HG3 GLN A 65 12.996 -4.968 -0.264 1.00 25.33 H new ATOM 0 HE21 GLN A 65 11.740 -1.871 0.795 1.00 32.44 H new ATOM 0 HE22 GLN A 65 12.628 -0.896 -0.381 1.00 32.44 H new ATOM 933 N PRO A 66 10.999 -6.775 2.116 1.00 42.13 N ATOM 934 CA PRO A 66 10.731 -6.966 3.556 1.00 14.12 C ATOM 935 C PRO A 66 10.347 -5.678 4.277 1.00 12.41 C ATOM 936 O PRO A 66 9.679 -5.695 5.318 1.00 40.43 O ATOM 937 CB PRO A 66 12.045 -7.536 4.122 1.00 43.44 C ATOM 938 CG PRO A 66 13.058 -7.315 3.055 1.00 35.23 C ATOM 939 CD PRO A 66 12.308 -7.331 1.755 1.00 22.35 C ATOM 0 HA PRO A 66 9.876 -7.626 3.703 1.00 14.12 H new ATOM 0 HB2 PRO A 66 12.328 -7.030 5.045 1.00 43.44 H new ATOM 0 HB3 PRO A 66 11.946 -8.596 4.357 1.00 43.44 H new ATOM 0 HG2 PRO A 66 13.571 -6.364 3.197 1.00 35.23 H new ATOM 0 HG3 PRO A 66 13.820 -8.094 3.074 1.00 35.23 H new ATOM 0 HD2 PRO A 66 12.806 -6.728 0.996 1.00 22.35 H new ATOM 0 HD3 PRO A 66 12.220 -8.340 1.353 1.00 22.35 H new ATOM 947 N THR A 67 10.793 -4.590 3.761 1.00 10.21 N ATOM 948 CA THR A 67 10.420 -3.325 4.252 1.00 4.43 C ATOM 949 C THR A 67 10.050 -2.440 3.069 1.00 52.14 C ATOM 950 O THR A 67 10.904 -1.930 2.348 1.00 45.24 O ATOM 951 CB THR A 67 11.535 -2.723 5.128 1.00 2.22 C ATOM 952 OG1 THR A 67 11.839 -3.680 6.169 1.00 70.33 O ATOM 953 CG2 THR A 67 11.071 -1.427 5.772 1.00 54.44 C ATOM 0 H THR A 67 11.439 -4.560 2.972 1.00 10.21 H new ATOM 0 HA THR A 67 9.549 -3.410 4.902 1.00 4.43 H new ATOM 0 HB THR A 67 12.410 -2.510 4.514 1.00 2.22 H new ATOM 0 HG1 THR A 67 12.549 -3.324 6.743 1.00 70.33 H new ATOM 0 HG21 THR A 67 11.873 -1.018 6.386 1.00 54.44 H new ATOM 0 HG22 THR A 67 10.807 -0.709 4.996 1.00 54.44 H new ATOM 0 HG23 THR A 67 10.199 -1.623 6.397 1.00 54.44 H new ATOM 961 N THR A 68 8.778 -2.355 2.828 1.00 3.34 N ATOM 962 CA THR A 68 8.243 -1.596 1.746 1.00 4.12 C ATOM 963 C THR A 68 8.006 -0.168 2.228 1.00 23.43 C ATOM 964 O THR A 68 7.228 0.062 3.140 1.00 41.52 O ATOM 965 CB THR A 68 6.929 -2.252 1.268 1.00 1.43 C ATOM 966 OG1 THR A 68 7.209 -3.599 0.807 1.00 74.00 O ATOM 967 CG2 THR A 68 6.272 -1.452 0.152 1.00 41.11 C ATOM 0 H THR A 68 8.069 -2.823 3.392 1.00 3.34 H new ATOM 0 HA THR A 68 8.936 -1.573 0.905 1.00 4.12 H new ATOM 0 HB THR A 68 6.235 -2.277 2.108 1.00 1.43 H new ATOM 0 HG1 THR A 68 7.801 -4.047 1.446 1.00 74.00 H new ATOM 0 HG21 THR A 68 5.351 -1.946 -0.156 1.00 41.11 H new ATOM 0 HG22 THR A 68 6.043 -0.448 0.510 1.00 41.11 H new ATOM 0 HG23 THR A 68 6.951 -1.388 -0.698 1.00 41.11 H new ATOM 975 N THR A 69 8.714 0.763 1.666 1.00 31.23 N ATOM 976 CA THR A 69 8.604 2.122 2.091 1.00 0.10 C ATOM 977 C THR A 69 7.865 2.978 1.047 1.00 20.44 C ATOM 978 O THR A 69 8.251 3.037 -0.147 1.00 61.41 O ATOM 979 CB THR A 69 10.001 2.712 2.482 1.00 55.13 C ATOM 980 OG1 THR A 69 9.894 4.082 2.863 1.00 14.43 O ATOM 981 CG2 THR A 69 11.021 2.562 1.357 1.00 15.41 C ATOM 0 H THR A 69 9.377 0.604 0.908 1.00 31.23 H new ATOM 0 HA THR A 69 7.995 2.145 2.995 1.00 0.10 H new ATOM 0 HB THR A 69 10.356 2.135 3.336 1.00 55.13 H new ATOM 0 HG1 THR A 69 10.780 4.425 3.104 1.00 14.43 H new ATOM 0 HG21 THR A 69 11.975 2.985 1.672 1.00 15.41 H new ATOM 0 HG22 THR A 69 11.152 1.505 1.123 1.00 15.41 H new ATOM 0 HG23 THR A 69 10.666 3.089 0.471 1.00 15.41 H new ATOM 989 N ALA A 70 6.779 3.574 1.489 1.00 5.33 N ATOM 990 CA ALA A 70 5.960 4.431 0.670 1.00 30.43 C ATOM 991 C ALA A 70 6.212 5.865 1.055 1.00 24.02 C ATOM 992 O ALA A 70 5.933 6.276 2.190 1.00 44.40 O ATOM 993 CB ALA A 70 4.491 4.097 0.854 1.00 20.13 C ATOM 0 H ALA A 70 6.437 3.473 2.445 1.00 5.33 H new ATOM 0 HA ALA A 70 6.217 4.279 -0.378 1.00 30.43 H new ATOM 0 HB1 ALA A 70 3.887 4.754 0.228 1.00 20.13 H new ATOM 0 HB2 ALA A 70 4.315 3.060 0.567 1.00 20.13 H new ATOM 0 HB3 ALA A 70 4.214 4.237 1.899 1.00 20.13 H new ATOM 999 N GLY A 71 6.754 6.617 0.139 1.00 65.23 N ATOM 1000 CA GLY A 71 7.082 7.982 0.436 1.00 73.33 C ATOM 1001 C GLY A 71 8.467 8.013 0.942 1.00 54.41 C ATOM 1002 O GLY A 71 8.695 7.939 2.130 1.00 20.40 O ATOM 0 H GLY A 71 6.976 6.313 -0.809 1.00 65.23 H new ATOM 0 HA2 GLY A 71 6.987 8.600 -0.457 1.00 73.33 H new ATOM 0 HA3 GLY A 71 6.395 8.387 1.179 1.00 73.33 H new ATOM 1006 N ARG A 72 9.377 8.072 0.027 1.00 52.22 N ATOM 1007 CA ARG A 72 10.762 7.943 0.240 1.00 2.42 C ATOM 1008 C ARG A 72 11.318 8.154 -1.141 1.00 25.10 C ATOM 1009 O ARG A 72 10.666 7.773 -2.110 1.00 21.31 O ATOM 1010 CB ARG A 72 11.021 6.505 0.709 1.00 22.12 C ATOM 1011 CG ARG A 72 12.453 6.078 0.920 1.00 25.13 C ATOM 1012 CD ARG A 72 13.120 6.608 2.175 1.00 63.01 C ATOM 1013 NE ARG A 72 14.365 5.832 2.422 1.00 21.43 N ATOM 1014 CZ ARG A 72 15.410 6.202 3.195 1.00 43.30 C ATOM 1015 NH1 ARG A 72 15.415 7.382 3.806 1.00 5.31 N ATOM 1016 NH2 ARG A 72 16.444 5.373 3.364 1.00 44.04 N ATOM 0 H ARG A 72 9.145 8.223 -0.955 1.00 52.22 H new ATOM 0 HA ARG A 72 11.191 8.622 0.976 1.00 2.42 H new ATOM 0 HB2 ARG A 72 10.487 6.358 1.648 1.00 22.12 H new ATOM 0 HB3 ARG A 72 10.575 5.830 -0.021 1.00 22.12 H new ATOM 0 HG2 ARG A 72 12.488 4.989 0.945 1.00 25.13 H new ATOM 0 HG3 ARG A 72 13.038 6.396 0.058 1.00 25.13 H new ATOM 0 HD2 ARG A 72 13.352 7.667 2.060 1.00 63.01 H new ATOM 0 HD3 ARG A 72 12.445 6.520 3.027 1.00 63.01 H new ATOM 0 HE ARG A 72 14.438 4.926 1.959 1.00 21.43 H new ATOM 0 HH11 ARG A 72 14.625 8.018 3.694 1.00 5.31 H new ATOM 0 HH12 ARG A 72 16.208 7.652 4.387 1.00 5.31 H new ATOM 0 HH21 ARG A 72 16.445 4.460 2.909 1.00 44.04 H new ATOM 0 HH22 ARG A 72 17.232 5.653 3.948 1.00 44.04 H new ATOM 1030 N HIS A 73 12.413 8.794 -1.259 1.00 62.03 N ATOM 1031 CA HIS A 73 12.967 9.068 -2.577 1.00 3.15 C ATOM 1032 C HIS A 73 14.241 8.273 -2.936 1.00 4.12 C ATOM 1033 O HIS A 73 14.201 7.505 -3.894 1.00 32.54 O ATOM 1034 CB HIS A 73 13.109 10.581 -2.858 1.00 30.33 C ATOM 1035 CG HIS A 73 11.789 11.293 -2.987 1.00 32.03 C ATOM 1036 ND1 HIS A 73 11.174 11.973 -1.960 1.00 73.42 N ATOM 1037 CD2 HIS A 73 10.967 11.417 -4.058 1.00 25.11 C ATOM 1038 CE1 HIS A 73 10.030 12.471 -2.415 1.00 54.15 C ATOM 1039 NE2 HIS A 73 9.850 12.167 -3.690 1.00 41.41 N ATOM 0 H HIS A 73 12.964 9.149 -0.477 1.00 62.03 H new ATOM 0 HA HIS A 73 12.215 8.681 -3.265 1.00 3.15 H new ATOM 0 HB2 HIS A 73 13.683 11.040 -2.053 1.00 30.33 H new ATOM 0 HB3 HIS A 73 13.679 10.720 -3.776 1.00 30.33 H new ATOM 0 HD2 HIS A 73 11.148 11.002 -5.038 1.00 25.11 H new ATOM 0 HE1 HIS A 73 9.337 13.049 -1.822 1.00 54.15 H new ATOM 0 HE2 HIS A 73 9.060 12.427 -4.280 1.00 41.41 H new ATOM 1047 N PRO A 74 15.383 8.402 -2.177 1.00 24.42 N ATOM 1048 CA PRO A 74 16.664 7.770 -2.576 1.00 65.11 C ATOM 1049 C PRO A 74 16.638 6.244 -2.538 1.00 14.44 C ATOM 1050 O PRO A 74 17.168 5.584 -3.422 1.00 43.42 O ATOM 1051 CB PRO A 74 17.683 8.290 -1.544 1.00 42.13 C ATOM 1052 CG PRO A 74 16.993 9.372 -0.783 1.00 22.25 C ATOM 1053 CD PRO A 74 15.521 9.125 -0.897 1.00 25.22 C ATOM 0 HA PRO A 74 16.899 8.023 -3.610 1.00 65.11 H new ATOM 0 HB2 PRO A 74 18.004 7.490 -0.877 1.00 42.13 H new ATOM 0 HB3 PRO A 74 18.577 8.671 -2.038 1.00 42.13 H new ATOM 0 HG2 PRO A 74 17.304 9.366 0.262 1.00 22.25 H new ATOM 0 HG3 PRO A 74 17.251 10.351 -1.187 1.00 22.25 H new ATOM 0 HD2 PRO A 74 15.149 8.533 -0.061 1.00 25.22 H new ATOM 0 HD3 PRO A 74 14.958 10.058 -0.902 1.00 25.22 H new ATOM 1061 N GLU A 75 16.013 5.705 -1.523 1.00 4.14 N ATOM 1062 CA GLU A 75 15.942 4.302 -1.305 1.00 24.22 C ATOM 1063 C GLU A 75 14.484 3.955 -1.053 1.00 24.41 C ATOM 1064 O GLU A 75 14.049 3.795 0.084 1.00 2.04 O ATOM 1065 CB GLU A 75 16.803 3.969 -0.100 1.00 31.21 C ATOM 1066 CG GLU A 75 16.792 2.535 0.294 1.00 41.34 C ATOM 1067 CD GLU A 75 17.550 2.304 1.558 1.00 14.31 C ATOM 1068 OE1 GLU A 75 17.163 2.870 2.605 1.00 5.13 O ATOM 1069 OE2 GLU A 75 18.524 1.540 1.550 1.00 24.23 O ATOM 0 H GLU A 75 15.530 6.254 -0.812 1.00 4.14 H new ATOM 0 HA GLU A 75 16.305 3.731 -2.159 1.00 24.22 H new ATOM 0 HB2 GLU A 75 17.830 4.266 -0.311 1.00 31.21 H new ATOM 0 HB3 GLU A 75 16.466 4.567 0.747 1.00 31.21 H new ATOM 0 HG2 GLU A 75 15.762 2.200 0.421 1.00 41.34 H new ATOM 0 HG3 GLU A 75 17.226 1.935 -0.506 1.00 41.34 H new ATOM 1076 N SER A 76 13.734 3.945 -2.096 1.00 72.51 N ATOM 1077 CA SER A 76 12.310 3.811 -2.025 1.00 35.20 C ATOM 1078 C SER A 76 11.797 2.492 -2.596 1.00 14.04 C ATOM 1079 O SER A 76 12.549 1.708 -3.193 1.00 60.45 O ATOM 1080 CB SER A 76 11.751 4.973 -2.804 1.00 30.03 C ATOM 1081 OG SER A 76 12.536 5.165 -3.966 1.00 43.23 O ATOM 0 H SER A 76 14.094 4.031 -3.047 1.00 72.51 H new ATOM 0 HA SER A 76 11.992 3.810 -0.982 1.00 35.20 H new ATOM 0 HB2 SER A 76 10.714 4.780 -3.077 1.00 30.03 H new ATOM 0 HB3 SER A 76 11.756 5.875 -2.192 1.00 30.03 H new ATOM 0 HG SER A 76 12.056 5.745 -4.593 1.00 43.23 H new ATOM 1087 N ASP A 77 10.520 2.239 -2.375 1.00 5.54 N ATOM 1088 CA ASP A 77 9.853 1.098 -2.960 1.00 32.13 C ATOM 1089 C ASP A 77 8.848 1.633 -3.965 1.00 24.35 C ATOM 1090 O ASP A 77 8.896 1.303 -5.149 1.00 30.03 O ATOM 1091 CB ASP A 77 9.158 0.248 -1.892 1.00 1.22 C ATOM 1092 CG ASP A 77 8.556 -1.028 -2.457 1.00 42.54 C ATOM 1093 OD1 ASP A 77 7.445 -0.988 -2.987 1.00 22.53 O ATOM 1094 OD2 ASP A 77 9.189 -2.098 -2.348 1.00 51.24 O ATOM 0 H ASP A 77 9.921 2.818 -1.787 1.00 5.54 H new ATOM 0 HA ASP A 77 10.578 0.447 -3.448 1.00 32.13 H new ATOM 0 HB2 ASP A 77 9.876 -0.008 -1.113 1.00 1.22 H new ATOM 0 HB3 ASP A 77 8.372 0.837 -1.419 1.00 1.22 H new ATOM 1099 N ILE A 78 7.966 2.507 -3.485 1.00 63.02 N ATOM 1100 CA ILE A 78 7.007 3.199 -4.331 1.00 61.25 C ATOM 1101 C ILE A 78 7.140 4.710 -4.121 1.00 65.05 C ATOM 1102 O ILE A 78 7.557 5.161 -3.032 1.00 31.32 O ATOM 1103 CB ILE A 78 5.537 2.733 -4.100 1.00 13.04 C ATOM 1104 CG1 ILE A 78 5.146 2.825 -2.615 1.00 62.40 C ATOM 1105 CG2 ILE A 78 5.325 1.320 -4.639 1.00 22.00 C ATOM 1106 CD1 ILE A 78 3.710 2.431 -2.328 1.00 71.13 C ATOM 0 H ILE A 78 7.899 2.753 -2.497 1.00 63.02 H new ATOM 0 HA ILE A 78 7.241 2.946 -5.365 1.00 61.25 H new ATOM 0 HB ILE A 78 4.883 3.407 -4.652 1.00 13.04 H new ATOM 0 HG12 ILE A 78 5.810 2.184 -2.035 1.00 62.40 H new ATOM 0 HG13 ILE A 78 5.307 3.846 -2.270 1.00 62.40 H new ATOM 0 HG21 ILE A 78 4.293 1.016 -4.467 1.00 22.00 H new ATOM 0 HG22 ILE A 78 5.535 1.303 -5.709 1.00 22.00 H new ATOM 0 HG23 ILE A 78 5.996 0.631 -4.127 1.00 22.00 H new ATOM 0 HD11 ILE A 78 3.514 2.523 -1.260 1.00 71.13 H new ATOM 0 HD12 ILE A 78 3.036 3.087 -2.878 1.00 71.13 H new ATOM 0 HD13 ILE A 78 3.547 1.399 -2.639 1.00 71.13 H new ATOM 1118 N PHE A 79 6.802 5.482 -5.135 1.00 54.42 N ATOM 1119 CA PHE A 79 7.023 6.919 -5.109 1.00 61.25 C ATOM 1120 C PHE A 79 5.721 7.702 -5.078 1.00 61.12 C ATOM 1121 O PHE A 79 4.919 7.623 -6.003 1.00 2.23 O ATOM 1122 CB PHE A 79 7.795 7.371 -6.362 1.00 3.12 C ATOM 1123 CG PHE A 79 9.156 6.761 -6.567 1.00 2.11 C ATOM 1124 CD1 PHE A 79 9.303 5.576 -7.274 1.00 71.40 C ATOM 1125 CD2 PHE A 79 10.288 7.392 -6.084 1.00 60.22 C ATOM 1126 CE1 PHE A 79 10.552 5.032 -7.486 1.00 14.45 C ATOM 1127 CE2 PHE A 79 11.538 6.856 -6.300 1.00 32.43 C ATOM 1128 CZ PHE A 79 11.672 5.672 -7.002 1.00 5.11 C ATOM 0 H PHE A 79 6.371 5.138 -5.993 1.00 54.42 H new ATOM 0 HA PHE A 79 7.591 7.120 -4.201 1.00 61.25 H new ATOM 0 HB2 PHE A 79 7.185 7.148 -7.238 1.00 3.12 H new ATOM 0 HB3 PHE A 79 7.909 8.454 -6.321 1.00 3.12 H new ATOM 0 HD1 PHE A 79 8.429 5.074 -7.663 1.00 71.40 H new ATOM 0 HD2 PHE A 79 10.191 8.315 -5.532 1.00 60.22 H new ATOM 0 HE1 PHE A 79 10.652 4.105 -8.031 1.00 14.45 H new ATOM 0 HE2 PHE A 79 12.414 7.361 -5.921 1.00 32.43 H new ATOM 0 HZ PHE A 79 12.652 5.250 -7.170 1.00 5.11 H new ATOM 1138 N LEU A 80 5.508 8.449 -4.021 1.00 71.21 N ATOM 1139 CA LEU A 80 4.411 9.392 -3.985 1.00 42.32 C ATOM 1140 C LEU A 80 4.761 10.582 -4.863 1.00 1.21 C ATOM 1141 O LEU A 80 5.619 11.396 -4.525 1.00 51.13 O ATOM 1142 CB LEU A 80 4.060 9.865 -2.556 1.00 54.04 C ATOM 1143 CG LEU A 80 3.228 8.921 -1.658 1.00 72.43 C ATOM 1144 CD1 LEU A 80 3.942 7.613 -1.387 1.00 31.53 C ATOM 1145 CD2 LEU A 80 2.873 9.615 -0.350 1.00 45.11 C ATOM 0 H LEU A 80 6.077 8.424 -3.175 1.00 71.21 H new ATOM 0 HA LEU A 80 3.524 8.882 -4.360 1.00 42.32 H new ATOM 0 HB2 LEU A 80 4.994 10.080 -2.038 1.00 54.04 H new ATOM 0 HB3 LEU A 80 3.518 10.807 -2.641 1.00 54.04 H new ATOM 0 HG LEU A 80 2.312 8.682 -2.197 1.00 72.43 H new ATOM 0 HD11 LEU A 80 3.319 6.983 -0.752 1.00 31.53 H new ATOM 0 HD12 LEU A 80 4.134 7.101 -2.330 1.00 31.53 H new ATOM 0 HD13 LEU A 80 4.888 7.812 -0.883 1.00 31.53 H new ATOM 0 HD21 LEU A 80 2.287 8.939 0.273 1.00 45.11 H new ATOM 0 HD22 LEU A 80 3.787 9.892 0.175 1.00 45.11 H new ATOM 0 HD23 LEU A 80 2.290 10.512 -0.560 1.00 45.11 H new ATOM 1157 N ASP A 81 4.107 10.654 -5.994 1.00 12.02 N ATOM 1158 CA ASP A 81 4.325 11.703 -7.007 1.00 64.41 C ATOM 1159 C ASP A 81 3.558 12.982 -6.647 1.00 32.24 C ATOM 1160 O ASP A 81 3.618 13.992 -7.341 1.00 11.14 O ATOM 1161 CB ASP A 81 3.878 11.146 -8.372 1.00 24.15 C ATOM 1162 CG ASP A 81 4.021 12.089 -9.552 1.00 63.03 C ATOM 1163 OD1 ASP A 81 5.147 12.314 -10.014 1.00 52.14 O ATOM 1164 OD2 ASP A 81 2.989 12.565 -10.078 1.00 35.11 O ATOM 0 H ASP A 81 3.389 9.980 -6.260 1.00 12.02 H new ATOM 0 HA ASP A 81 5.380 11.972 -7.047 1.00 64.41 H new ATOM 0 HB2 ASP A 81 4.454 10.244 -8.581 1.00 24.15 H new ATOM 0 HB3 ASP A 81 2.833 10.847 -8.296 1.00 24.15 H new ATOM 1169 N ASP A 82 2.886 12.940 -5.526 1.00 4.21 N ATOM 1170 CA ASP A 82 2.077 14.057 -5.075 1.00 53.14 C ATOM 1171 C ASP A 82 2.858 14.884 -4.046 1.00 62.15 C ATOM 1172 O ASP A 82 3.861 14.407 -3.505 1.00 20.41 O ATOM 1173 CB ASP A 82 0.775 13.534 -4.466 1.00 31.32 C ATOM 1174 CG ASP A 82 -0.209 14.632 -4.169 1.00 31.42 C ATOM 1175 OD1 ASP A 82 -0.941 15.047 -5.093 1.00 51.41 O ATOM 1176 OD2 ASP A 82 -0.261 15.105 -3.023 1.00 34.24 O ATOM 0 H ASP A 82 2.880 12.137 -4.898 1.00 4.21 H new ATOM 0 HA ASP A 82 1.836 14.698 -5.923 1.00 53.14 H new ATOM 0 HB2 ASP A 82 0.320 12.819 -5.151 1.00 31.32 H new ATOM 0 HB3 ASP A 82 1.000 12.995 -3.546 1.00 31.32 H new ATOM 1181 N VAL A 83 2.402 16.098 -3.772 1.00 61.43 N ATOM 1182 CA VAL A 83 3.056 17.010 -2.833 1.00 25.41 C ATOM 1183 C VAL A 83 2.917 16.518 -1.365 1.00 33.40 C ATOM 1184 O VAL A 83 3.697 16.897 -0.485 1.00 41.32 O ATOM 1185 CB VAL A 83 2.486 18.465 -2.986 1.00 12.10 C ATOM 1186 CG1 VAL A 83 1.012 18.550 -2.590 1.00 40.33 C ATOM 1187 CG2 VAL A 83 3.319 19.485 -2.218 1.00 63.55 C ATOM 0 H VAL A 83 1.560 16.485 -4.197 1.00 61.43 H new ATOM 0 HA VAL A 83 4.119 17.025 -3.075 1.00 25.41 H new ATOM 0 HB VAL A 83 2.554 18.714 -4.045 1.00 12.10 H new ATOM 0 HG11 VAL A 83 0.661 19.575 -2.712 1.00 40.33 H new ATOM 0 HG12 VAL A 83 0.425 17.887 -3.226 1.00 40.33 H new ATOM 0 HG13 VAL A 83 0.897 18.249 -1.549 1.00 40.33 H new ATOM 0 HG21 VAL A 83 2.890 20.478 -2.350 1.00 63.55 H new ATOM 0 HG22 VAL A 83 3.321 19.229 -1.158 1.00 63.55 H new ATOM 0 HG23 VAL A 83 4.342 19.478 -2.595 1.00 63.55 H new ATOM 1197 N THR A 84 1.960 15.634 -1.121 1.00 74.23 N ATOM 1198 CA THR A 84 1.697 15.102 0.221 1.00 65.21 C ATOM 1199 C THR A 84 2.772 14.093 0.715 1.00 35.20 C ATOM 1200 O THR A 84 2.612 13.460 1.770 1.00 45.32 O ATOM 1201 CB THR A 84 0.298 14.462 0.279 1.00 63.05 C ATOM 1202 OG1 THR A 84 0.109 13.637 -0.875 1.00 70.21 O ATOM 1203 CG2 THR A 84 -0.790 15.528 0.335 1.00 52.03 C ATOM 0 H THR A 84 1.342 15.262 -1.842 1.00 74.23 H new ATOM 0 HA THR A 84 1.743 15.954 0.899 1.00 65.21 H new ATOM 0 HB THR A 84 0.228 13.858 1.184 1.00 63.05 H new ATOM 0 HG1 THR A 84 -0.290 14.168 -1.595 1.00 70.21 H new ATOM 0 HG21 THR A 84 -1.768 15.048 0.375 1.00 52.03 H new ATOM 0 HG22 THR A 84 -0.651 16.143 1.224 1.00 52.03 H new ATOM 0 HG23 THR A 84 -0.730 16.156 -0.554 1.00 52.03 H new ATOM 1211 N VAL A 85 3.883 14.010 0.006 1.00 52.03 N ATOM 1212 CA VAL A 85 4.928 13.069 0.329 1.00 2.42 C ATOM 1213 C VAL A 85 5.856 13.598 1.444 1.00 33.43 C ATOM 1214 O VAL A 85 6.377 14.720 1.373 1.00 51.10 O ATOM 1215 CB VAL A 85 5.755 12.666 -0.944 1.00 10.23 C ATOM 1216 CG1 VAL A 85 6.462 13.862 -1.577 1.00 64.00 C ATOM 1217 CG2 VAL A 85 6.749 11.554 -0.636 1.00 31.31 C ATOM 0 H VAL A 85 4.082 14.593 -0.807 1.00 52.03 H new ATOM 0 HA VAL A 85 4.438 12.172 0.708 1.00 2.42 H new ATOM 0 HB VAL A 85 5.037 12.289 -1.673 1.00 10.23 H new ATOM 0 HG11 VAL A 85 7.020 13.533 -2.453 1.00 64.00 H new ATOM 0 HG12 VAL A 85 5.723 14.605 -1.876 1.00 64.00 H new ATOM 0 HG13 VAL A 85 7.148 14.303 -0.854 1.00 64.00 H new ATOM 0 HG21 VAL A 85 7.303 11.301 -1.540 1.00 31.31 H new ATOM 0 HG22 VAL A 85 7.444 11.890 0.134 1.00 31.31 H new ATOM 0 HG23 VAL A 85 6.212 10.674 -0.281 1.00 31.31 H new ATOM 1227 N SER A 86 5.985 12.808 2.487 1.00 43.42 N ATOM 1228 CA SER A 86 6.897 13.072 3.586 1.00 23.20 C ATOM 1229 C SER A 86 8.290 12.533 3.201 1.00 33.22 C ATOM 1230 O SER A 86 8.416 11.831 2.187 1.00 41.20 O ATOM 1231 CB SER A 86 6.352 12.347 4.844 1.00 12.25 C ATOM 1232 OG SER A 86 7.187 12.481 5.988 1.00 0.11 O ATOM 0 H SER A 86 5.450 11.947 2.600 1.00 43.42 H new ATOM 0 HA SER A 86 6.978 14.139 3.794 1.00 23.20 H new ATOM 0 HB2 SER A 86 5.363 12.740 5.079 1.00 12.25 H new ATOM 0 HB3 SER A 86 6.229 11.288 4.617 1.00 12.25 H new ATOM 0 HG SER A 86 7.499 11.596 6.271 1.00 0.11 H new ATOM 1238 N ARG A 87 9.329 12.873 3.991 1.00 73.23 N ATOM 1239 CA ARG A 87 10.686 12.338 3.763 1.00 20.24 C ATOM 1240 C ARG A 87 10.629 10.822 3.791 1.00 50.13 C ATOM 1241 O ARG A 87 11.298 10.143 3.016 1.00 21.31 O ATOM 1242 CB ARG A 87 11.680 12.876 4.794 1.00 71.45 C ATOM 1243 CG ARG A 87 11.844 14.383 4.729 1.00 1.12 C ATOM 1244 CD ARG A 87 12.804 14.907 5.776 1.00 22.41 C ATOM 1245 NE ARG A 87 12.377 14.587 7.143 1.00 64.13 N ATOM 1246 CZ ARG A 87 11.932 15.467 8.059 1.00 71.20 C ATOM 1247 NH1 ARG A 87 11.737 16.754 7.746 1.00 2.11 N ATOM 1248 NH2 ARG A 87 11.671 15.047 9.288 1.00 3.21 N ATOM 0 H ARG A 87 9.256 13.509 4.785 1.00 73.23 H new ATOM 0 HA ARG A 87 11.040 12.667 2.786 1.00 20.24 H new ATOM 0 HB2 ARG A 87 11.347 12.595 5.793 1.00 71.45 H new ATOM 0 HB3 ARG A 87 12.650 12.403 4.637 1.00 71.45 H new ATOM 0 HG2 ARG A 87 12.203 14.664 3.739 1.00 1.12 H new ATOM 0 HG3 ARG A 87 10.872 14.857 4.862 1.00 1.12 H new ATOM 0 HD2 ARG A 87 13.793 14.485 5.600 1.00 22.41 H new ATOM 0 HD3 ARG A 87 12.895 15.988 5.671 1.00 22.41 H new ATOM 0 HE ARG A 87 12.422 13.608 7.425 1.00 64.13 H new ATOM 0 HH11 ARG A 87 11.926 17.083 6.799 1.00 2.11 H new ATOM 0 HH12 ARG A 87 11.399 17.406 8.454 1.00 2.11 H new ATOM 0 HH21 ARG A 87 11.808 14.066 9.532 1.00 3.21 H new ATOM 0 HH22 ARG A 87 11.333 15.705 9.991 1.00 3.21 H new ATOM 1262 N ARG A 88 9.860 10.314 4.711 1.00 60.21 N ATOM 1263 CA ARG A 88 9.441 8.948 4.707 1.00 24.32 C ATOM 1264 C ARG A 88 8.057 8.945 5.284 1.00 15.22 C ATOM 1265 O ARG A 88 7.815 9.618 6.298 1.00 54.23 O ATOM 1266 CB ARG A 88 10.421 7.925 5.374 1.00 63.02 C ATOM 1267 CG ARG A 88 10.609 7.962 6.887 1.00 52.53 C ATOM 1268 CD ARG A 88 11.237 9.237 7.396 1.00 64.51 C ATOM 1269 NE ARG A 88 11.608 9.098 8.810 1.00 42.51 N ATOM 1270 CZ ARG A 88 11.015 9.706 9.844 1.00 62.41 C ATOM 1271 NH1 ARG A 88 9.938 10.460 9.658 1.00 40.53 N ATOM 1272 NH2 ARG A 88 11.499 9.538 11.064 1.00 63.21 N ATOM 0 H ARG A 88 9.501 10.852 5.500 1.00 60.21 H new ATOM 0 HA ARG A 88 9.446 8.570 3.685 1.00 24.32 H new ATOM 0 HB2 ARG A 88 10.082 6.923 5.109 1.00 63.02 H new ATOM 0 HB3 ARG A 88 11.401 8.062 4.917 1.00 63.02 H new ATOM 0 HG2 ARG A 88 9.639 7.830 7.367 1.00 52.53 H new ATOM 0 HG3 ARG A 88 11.230 7.118 7.186 1.00 52.53 H new ATOM 0 HD2 ARG A 88 12.120 9.476 6.804 1.00 64.51 H new ATOM 0 HD3 ARG A 88 10.539 10.066 7.277 1.00 64.51 H new ATOM 0 HE ARG A 88 12.391 8.480 9.024 1.00 42.51 H new ATOM 0 HH11 ARG A 88 9.555 10.580 8.720 1.00 40.53 H new ATOM 0 HH12 ARG A 88 9.493 10.919 10.453 1.00 40.53 H new ATOM 0 HH21 ARG A 88 12.318 8.949 11.211 1.00 63.21 H new ATOM 0 HH22 ARG A 88 11.053 9.998 11.858 1.00 63.21 H new ATOM 1286 N HIS A 89 7.127 8.315 4.605 1.00 11.40 N ATOM 1287 CA HIS A 89 5.740 8.434 4.999 1.00 70.24 C ATOM 1288 C HIS A 89 5.174 7.146 5.623 1.00 63.53 C ATOM 1289 O HIS A 89 4.987 7.062 6.838 1.00 64.41 O ATOM 1290 CB HIS A 89 4.894 8.931 3.802 1.00 54.24 C ATOM 1291 CG HIS A 89 3.487 9.316 4.140 1.00 70.01 C ATOM 1292 ND1 HIS A 89 3.151 10.614 4.451 1.00 62.10 N ATOM 1293 CD2 HIS A 89 2.383 8.548 4.208 1.00 53.31 C ATOM 1294 CE1 HIS A 89 1.851 10.589 4.703 1.00 21.34 C ATOM 1295 NE2 HIS A 89 1.348 9.363 4.573 1.00 62.33 N ATOM 0 H HIS A 89 7.299 7.725 3.791 1.00 11.40 H new ATOM 0 HA HIS A 89 5.685 9.177 5.795 1.00 70.24 H new ATOM 0 HB2 HIS A 89 5.393 9.791 3.356 1.00 54.24 H new ATOM 0 HB3 HIS A 89 4.869 8.148 3.044 1.00 54.24 H new ATOM 0 HD2 HIS A 89 2.326 7.488 4.011 1.00 53.31 H new ATOM 0 HE1 HIS A 89 1.270 11.456 4.980 1.00 21.34 H new ATOM 0 HE2 HIS A 89 0.377 9.085 4.718 1.00 62.33 H new ATOM 1303 N ALA A 90 4.920 6.158 4.827 1.00 61.01 N ATOM 1304 CA ALA A 90 4.339 4.948 5.340 1.00 13.24 C ATOM 1305 C ALA A 90 5.283 3.808 5.135 1.00 50.24 C ATOM 1306 O ALA A 90 5.659 3.493 4.005 1.00 43.11 O ATOM 1307 CB ALA A 90 2.993 4.668 4.687 1.00 3.02 C ATOM 0 H ALA A 90 5.102 6.159 3.823 1.00 61.01 H new ATOM 0 HA ALA A 90 4.163 5.069 6.409 1.00 13.24 H new ATOM 0 HB1 ALA A 90 2.576 3.747 5.094 1.00 3.02 H new ATOM 0 HB2 ALA A 90 2.312 5.495 4.889 1.00 3.02 H new ATOM 0 HB3 ALA A 90 3.126 4.562 3.610 1.00 3.02 H new ATOM 1313 N GLU A 91 5.690 3.198 6.198 1.00 32.25 N ATOM 1314 CA GLU A 91 6.594 2.111 6.086 1.00 3.32 C ATOM 1315 C GLU A 91 5.855 0.843 6.436 1.00 44.01 C ATOM 1316 O GLU A 91 5.218 0.746 7.497 1.00 62.40 O ATOM 1317 CB GLU A 91 7.803 2.333 6.995 1.00 5.24 C ATOM 1318 CG GLU A 91 8.904 1.310 6.820 1.00 72.21 C ATOM 1319 CD GLU A 91 10.118 1.602 7.676 1.00 23.23 C ATOM 1320 OE1 GLU A 91 10.184 1.134 8.836 1.00 20.34 O ATOM 1321 OE2 GLU A 91 11.041 2.294 7.195 1.00 20.33 O ATOM 0 H GLU A 91 5.410 3.435 7.150 1.00 32.25 H new ATOM 0 HA GLU A 91 6.973 2.031 5.067 1.00 3.32 H new ATOM 0 HB2 GLU A 91 8.210 3.326 6.804 1.00 5.24 H new ATOM 0 HB3 GLU A 91 7.471 2.319 8.033 1.00 5.24 H new ATOM 0 HG2 GLU A 91 8.518 0.322 7.070 1.00 72.21 H new ATOM 0 HG3 GLU A 91 9.203 1.280 5.772 1.00 72.21 H new ATOM 1328 N PHE A 92 5.929 -0.111 5.559 1.00 71.44 N ATOM 1329 CA PHE A 92 5.259 -1.355 5.745 1.00 74.22 C ATOM 1330 C PHE A 92 6.314 -2.417 5.945 1.00 73.41 C ATOM 1331 O PHE A 92 7.093 -2.719 5.023 1.00 13.11 O ATOM 1332 CB PHE A 92 4.410 -1.713 4.505 1.00 45.33 C ATOM 1333 CG PHE A 92 3.539 -0.595 3.968 1.00 33.13 C ATOM 1334 CD1 PHE A 92 2.448 -0.128 4.676 1.00 2.33 C ATOM 1335 CD2 PHE A 92 3.817 -0.028 2.735 1.00 53.35 C ATOM 1336 CE1 PHE A 92 1.652 0.880 4.172 1.00 61.40 C ATOM 1337 CE2 PHE A 92 3.028 0.982 2.227 1.00 33.42 C ATOM 1338 CZ PHE A 92 1.943 1.437 2.946 1.00 22.12 C ATOM 0 H PHE A 92 6.460 -0.045 4.690 1.00 71.44 H new ATOM 0 HA PHE A 92 4.594 -1.288 6.606 1.00 74.22 H new ATOM 0 HB2 PHE A 92 5.079 -2.043 3.710 1.00 45.33 H new ATOM 0 HB3 PHE A 92 3.771 -2.560 4.755 1.00 45.33 H new ATOM 0 HD1 PHE A 92 2.215 -0.559 5.639 1.00 2.33 H new ATOM 0 HD2 PHE A 92 4.663 -0.382 2.164 1.00 53.35 H new ATOM 0 HE1 PHE A 92 0.802 1.232 4.738 1.00 61.40 H new ATOM 0 HE2 PHE A 92 3.260 1.417 1.266 1.00 33.42 H new ATOM 0 HZ PHE A 92 1.323 2.228 2.549 1.00 22.12 H new ATOM 1348 N ARG A 93 6.368 -2.958 7.112 1.00 65.21 N ATOM 1349 CA ARG A 93 7.319 -3.972 7.412 1.00 5.12 C ATOM 1350 C ARG A 93 6.606 -5.299 7.373 1.00 51.02 C ATOM 1351 O ARG A 93 5.440 -5.412 7.789 1.00 23.04 O ATOM 1352 CB ARG A 93 7.917 -3.782 8.816 1.00 71.13 C ATOM 1353 CG ARG A 93 9.083 -4.726 9.107 1.00 21.23 C ATOM 1354 CD ARG A 93 9.434 -4.811 10.590 1.00 10.12 C ATOM 1355 NE ARG A 93 9.640 -3.502 11.214 1.00 53.11 N ATOM 1356 CZ ARG A 93 10.826 -2.951 11.498 1.00 51.13 C ATOM 1357 NH1 ARG A 93 11.961 -3.526 11.096 1.00 14.40 N ATOM 1358 NH2 ARG A 93 10.878 -1.811 12.175 1.00 24.21 N ATOM 0 H ARG A 93 5.753 -2.710 7.887 1.00 65.21 H new ATOM 0 HA ARG A 93 8.129 -3.925 6.684 1.00 5.12 H new ATOM 0 HB2 ARG A 93 8.257 -2.752 8.923 1.00 71.13 H new ATOM 0 HB3 ARG A 93 7.136 -3.939 9.561 1.00 71.13 H new ATOM 0 HG2 ARG A 93 8.835 -5.722 8.742 1.00 21.23 H new ATOM 0 HG3 ARG A 93 9.959 -4.392 8.552 1.00 21.23 H new ATOM 0 HD2 ARG A 93 8.635 -5.334 11.116 1.00 10.12 H new ATOM 0 HD3 ARG A 93 10.338 -5.408 10.708 1.00 10.12 H new ATOM 0 HE ARG A 93 8.807 -2.964 11.453 1.00 53.11 H new ATOM 0 HH11 ARG A 93 11.932 -4.397 10.565 1.00 14.40 H new ATOM 0 HH12 ARG A 93 12.858 -3.095 11.319 1.00 14.40 H new ATOM 0 HH21 ARG A 93 10.016 -1.358 12.477 1.00 24.21 H new ATOM 0 HH22 ARG A 93 11.780 -1.388 12.393 1.00 24.21 H new ATOM 1372 N ILE A 94 7.267 -6.289 6.904 1.00 24.51 N ATOM 1373 CA ILE A 94 6.702 -7.580 6.928 1.00 25.20 C ATOM 1374 C ILE A 94 7.544 -8.425 7.831 1.00 71.45 C ATOM 1375 O ILE A 94 8.778 -8.266 7.890 1.00 40.04 O ATOM 1376 CB ILE A 94 6.503 -8.215 5.495 1.00 42.24 C ATOM 1377 CG1 ILE A 94 7.810 -8.375 4.708 1.00 23.43 C ATOM 1378 CG2 ILE A 94 5.520 -7.398 4.674 1.00 11.41 C ATOM 1379 CD1 ILE A 94 8.645 -9.589 5.071 1.00 54.12 C ATOM 0 H ILE A 94 8.201 -6.229 6.499 1.00 24.51 H new ATOM 0 HA ILE A 94 5.686 -7.518 7.317 1.00 25.20 H new ATOM 0 HB ILE A 94 6.107 -9.215 5.670 1.00 42.24 H new ATOM 0 HG12 ILE A 94 7.571 -8.424 3.646 1.00 23.43 H new ATOM 0 HG13 ILE A 94 8.416 -7.481 4.857 1.00 23.43 H new ATOM 0 HG21 ILE A 94 5.399 -7.854 3.692 1.00 11.41 H new ATOM 0 HG22 ILE A 94 4.556 -7.370 5.182 1.00 11.41 H new ATOM 0 HG23 ILE A 94 5.899 -6.382 4.558 1.00 11.41 H new ATOM 0 HD11 ILE A 94 9.546 -9.608 4.457 1.00 54.12 H new ATOM 0 HD12 ILE A 94 8.924 -9.537 6.123 1.00 54.12 H new ATOM 0 HD13 ILE A 94 8.066 -10.495 4.893 1.00 54.12 H new ATOM 1391 N ASN A 95 6.905 -9.230 8.573 1.00 13.34 N ATOM 1392 CA ASN A 95 7.543 -10.083 9.502 1.00 30.50 C ATOM 1393 C ASN A 95 7.194 -11.474 9.040 1.00 24.30 C ATOM 1394 O ASN A 95 6.137 -11.651 8.433 1.00 34.42 O ATOM 1395 CB ASN A 95 7.019 -9.766 10.923 1.00 3.53 C ATOM 1396 CG ASN A 95 7.847 -10.353 12.053 1.00 0.22 C ATOM 1397 OD1 ASN A 95 8.448 -11.417 11.930 1.00 45.24 O ATOM 1398 ND2 ASN A 95 7.888 -9.654 13.166 1.00 55.13 N ATOM 0 H ASN A 95 5.889 -9.323 8.556 1.00 13.34 H new ATOM 0 HA ASN A 95 8.625 -9.961 9.550 1.00 30.50 H new ATOM 0 HB2 ASN A 95 6.977 -8.684 11.046 1.00 3.53 H new ATOM 0 HB3 ASN A 95 5.998 -10.137 11.009 1.00 3.53 H new ATOM 0 HD21 ASN A 95 8.431 -9.992 13.961 1.00 55.13 H new ATOM 0 HD22 ASN A 95 7.377 -8.774 13.235 1.00 55.13 H new ATOM 1405 N GLU A 96 8.078 -12.424 9.227 1.00 14.01 N ATOM 1406 CA GLU A 96 7.925 -13.834 8.776 1.00 63.45 C ATOM 1407 C GLU A 96 6.678 -14.583 9.377 1.00 64.35 C ATOM 1408 O GLU A 96 6.657 -15.817 9.443 1.00 31.24 O ATOM 1409 CB GLU A 96 9.192 -14.597 9.144 1.00 34.23 C ATOM 1410 CG GLU A 96 9.482 -14.577 10.632 1.00 15.43 C ATOM 1411 CD GLU A 96 10.643 -15.440 11.008 1.00 15.14 C ATOM 1412 OE1 GLU A 96 10.485 -16.679 11.042 1.00 63.03 O ATOM 1413 OE2 GLU A 96 11.728 -14.911 11.310 1.00 22.53 O ATOM 0 H GLU A 96 8.961 -12.257 9.710 1.00 14.01 H new ATOM 0 HA GLU A 96 7.760 -13.800 7.699 1.00 63.45 H new ATOM 0 HB2 GLU A 96 9.097 -15.631 8.811 1.00 34.23 H new ATOM 0 HB3 GLU A 96 10.038 -14.166 8.608 1.00 34.23 H new ATOM 0 HG2 GLU A 96 9.681 -13.552 10.945 1.00 15.43 H new ATOM 0 HG3 GLU A 96 8.597 -14.910 11.174 1.00 15.43 H new ATOM 1420 N GLY A 97 5.664 -13.849 9.730 1.00 2.23 N ATOM 1421 CA GLY A 97 4.472 -14.386 10.299 1.00 15.34 C ATOM 1422 C GLY A 97 3.377 -13.338 10.361 1.00 71.13 C ATOM 1423 O GLY A 97 2.215 -13.631 10.095 1.00 43.24 O ATOM 0 H GLY A 97 5.647 -12.834 9.626 1.00 2.23 H new ATOM 0 HA2 GLY A 97 4.133 -15.236 9.707 1.00 15.34 H new ATOM 0 HA3 GLY A 97 4.680 -14.759 11.302 1.00 15.34 H new ATOM 1427 N GLU A 98 3.750 -12.099 10.672 1.00 34.55 N ATOM 1428 CA GLU A 98 2.774 -11.030 10.836 1.00 43.04 C ATOM 1429 C GLU A 98 3.132 -9.816 9.980 1.00 4.22 C ATOM 1430 O GLU A 98 4.220 -9.741 9.413 1.00 52.23 O ATOM 1431 CB GLU A 98 2.695 -10.620 12.308 1.00 22.11 C ATOM 1432 CG GLU A 98 2.339 -11.761 13.242 1.00 73.41 C ATOM 1433 CD GLU A 98 2.296 -11.343 14.676 1.00 61.52 C ATOM 1434 OE1 GLU A 98 3.376 -11.240 15.311 1.00 30.15 O ATOM 1435 OE2 GLU A 98 1.193 -11.131 15.217 1.00 2.11 O ATOM 0 H GLU A 98 4.719 -11.813 10.815 1.00 34.55 H new ATOM 0 HA GLU A 98 1.804 -11.404 10.507 1.00 43.04 H new ATOM 0 HB2 GLU A 98 3.654 -10.201 12.611 1.00 22.11 H new ATOM 0 HB3 GLU A 98 1.953 -9.829 12.416 1.00 22.11 H new ATOM 0 HG2 GLU A 98 1.369 -12.168 12.958 1.00 73.41 H new ATOM 0 HG3 GLU A 98 3.068 -12.563 13.124 1.00 73.41 H new ATOM 1442 N PHE A 99 2.228 -8.870 9.908 1.00 42.52 N ATOM 1443 CA PHE A 99 2.428 -7.654 9.128 1.00 55.52 C ATOM 1444 C PHE A 99 2.429 -6.429 10.052 1.00 32.34 C ATOM 1445 O PHE A 99 1.494 -6.242 10.837 1.00 24.32 O ATOM 1446 CB PHE A 99 1.315 -7.497 8.091 1.00 22.33 C ATOM 1447 CG PHE A 99 1.237 -8.573 7.043 1.00 31.41 C ATOM 1448 CD1 PHE A 99 1.959 -8.458 5.869 1.00 4.40 C ATOM 1449 CD2 PHE A 99 0.429 -9.685 7.223 1.00 71.02 C ATOM 1450 CE1 PHE A 99 1.881 -9.428 4.892 1.00 71.12 C ATOM 1451 CE2 PHE A 99 0.344 -10.660 6.249 1.00 44.55 C ATOM 1452 CZ PHE A 99 1.073 -10.532 5.082 1.00 11.24 C ATOM 0 H PHE A 99 1.328 -8.913 10.386 1.00 42.52 H new ATOM 0 HA PHE A 99 3.388 -7.729 8.618 1.00 55.52 H new ATOM 0 HB2 PHE A 99 0.360 -7.457 8.615 1.00 22.33 H new ATOM 0 HB3 PHE A 99 1.444 -6.538 7.590 1.00 22.33 H new ATOM 0 HD1 PHE A 99 2.592 -7.597 5.715 1.00 4.40 H new ATOM 0 HD2 PHE A 99 -0.140 -9.790 8.135 1.00 71.02 H new ATOM 0 HE1 PHE A 99 2.450 -9.325 3.980 1.00 71.12 H new ATOM 0 HE2 PHE A 99 -0.291 -11.521 6.399 1.00 44.55 H new ATOM 0 HZ PHE A 99 1.011 -11.294 4.319 1.00 11.24 H new ATOM 1462 N GLU A 100 3.439 -5.588 9.929 1.00 41.45 N ATOM 1463 CA GLU A 100 3.597 -4.419 10.792 1.00 71.35 C ATOM 1464 C GLU A 100 3.642 -3.150 9.945 1.00 14.15 C ATOM 1465 O GLU A 100 4.514 -3.002 9.104 1.00 72.44 O ATOM 1466 CB GLU A 100 4.910 -4.528 11.571 1.00 74.02 C ATOM 1467 CG GLU A 100 5.181 -3.353 12.503 1.00 14.40 C ATOM 1468 CD GLU A 100 6.605 -3.314 12.983 1.00 45.13 C ATOM 1469 OE1 GLU A 100 6.937 -3.977 13.998 1.00 61.32 O ATOM 1470 OE2 GLU A 100 7.420 -2.617 12.361 1.00 54.41 O ATOM 0 H GLU A 100 4.175 -5.691 9.231 1.00 41.45 H new ATOM 0 HA GLU A 100 2.753 -4.376 11.481 1.00 71.35 H new ATOM 0 HB2 GLU A 100 4.897 -5.447 12.157 1.00 74.02 H new ATOM 0 HB3 GLU A 100 5.734 -4.613 10.863 1.00 74.02 H new ATOM 0 HG2 GLU A 100 4.950 -2.422 11.985 1.00 14.40 H new ATOM 0 HG3 GLU A 100 4.513 -3.414 13.362 1.00 14.40 H new ATOM 1477 N VAL A 101 2.723 -2.246 10.146 1.00 74.30 N ATOM 1478 CA VAL A 101 2.749 -1.008 9.387 1.00 4.43 C ATOM 1479 C VAL A 101 2.827 0.201 10.317 1.00 22.41 C ATOM 1480 O VAL A 101 2.086 0.288 11.312 1.00 3.31 O ATOM 1481 CB VAL A 101 1.568 -0.894 8.377 1.00 41.25 C ATOM 1482 CG1 VAL A 101 1.606 -2.063 7.408 1.00 51.23 C ATOM 1483 CG2 VAL A 101 0.217 -0.839 9.075 1.00 73.05 C ATOM 0 H VAL A 101 1.957 -2.331 10.814 1.00 74.30 H new ATOM 0 HA VAL A 101 3.656 -1.023 8.782 1.00 4.43 H new ATOM 0 HB VAL A 101 1.690 0.042 7.833 1.00 41.25 H new ATOM 0 HG11 VAL A 101 0.778 -1.979 6.704 1.00 51.23 H new ATOM 0 HG12 VAL A 101 2.549 -2.053 6.862 1.00 51.23 H new ATOM 0 HG13 VAL A 101 1.518 -2.998 7.962 1.00 51.23 H new ATOM 0 HG21 VAL A 101 -0.575 -0.760 8.330 1.00 73.05 H new ATOM 0 HG22 VAL A 101 0.073 -1.746 9.662 1.00 73.05 H new ATOM 0 HG23 VAL A 101 0.183 0.029 9.734 1.00 73.05 H new ATOM 1493 N VAL A 102 3.778 1.078 10.051 1.00 12.15 N ATOM 1494 CA VAL A 102 3.995 2.256 10.872 1.00 21.21 C ATOM 1495 C VAL A 102 3.836 3.559 10.090 1.00 41.02 C ATOM 1496 O VAL A 102 4.278 3.676 8.924 1.00 52.31 O ATOM 1497 CB VAL A 102 5.363 2.249 11.608 1.00 32.02 C ATOM 1498 CG1 VAL A 102 5.449 1.090 12.591 1.00 62.42 C ATOM 1499 CG2 VAL A 102 6.525 2.205 10.622 1.00 51.14 C ATOM 0 H VAL A 102 4.420 0.995 9.263 1.00 12.15 H new ATOM 0 HA VAL A 102 3.210 2.210 11.627 1.00 21.21 H new ATOM 0 HB VAL A 102 5.436 3.180 12.170 1.00 32.02 H new ATOM 0 HG11 VAL A 102 6.417 1.109 13.092 1.00 62.42 H new ATOM 0 HG12 VAL A 102 4.655 1.182 13.332 1.00 62.42 H new ATOM 0 HG13 VAL A 102 5.337 0.148 12.054 1.00 62.42 H new ATOM 0 HG21 VAL A 102 7.467 2.201 11.170 1.00 51.14 H new ATOM 0 HG22 VAL A 102 6.454 1.302 10.016 1.00 51.14 H new ATOM 0 HG23 VAL A 102 6.486 3.081 9.974 1.00 51.14 H new ATOM 1509 N ASP A 103 3.179 4.509 10.706 1.00 61.52 N ATOM 1510 CA ASP A 103 3.034 5.842 10.143 1.00 70.14 C ATOM 1511 C ASP A 103 4.135 6.740 10.641 1.00 43.00 C ATOM 1512 O ASP A 103 4.169 7.111 11.823 1.00 63.33 O ATOM 1513 CB ASP A 103 1.681 6.472 10.480 1.00 43.11 C ATOM 1514 CG ASP A 103 1.606 7.947 10.072 1.00 72.32 C ATOM 1515 OD1 ASP A 103 1.954 8.282 8.931 1.00 51.20 O ATOM 1516 OD2 ASP A 103 1.213 8.793 10.914 1.00 24.31 O ATOM 0 H ASP A 103 2.727 4.388 11.612 1.00 61.52 H new ATOM 0 HA ASP A 103 3.095 5.736 9.060 1.00 70.14 H new ATOM 0 HB2 ASP A 103 0.889 5.918 9.976 1.00 43.11 H new ATOM 0 HB3 ASP A 103 1.499 6.384 11.551 1.00 43.11 H new ATOM 1521 N VAL A 104 5.043 7.061 9.767 1.00 40.42 N ATOM 1522 CA VAL A 104 6.135 7.961 10.079 1.00 22.30 C ATOM 1523 C VAL A 104 6.004 9.234 9.252 1.00 4.54 C ATOM 1524 O VAL A 104 6.840 10.139 9.313 1.00 53.31 O ATOM 1525 CB VAL A 104 7.538 7.301 9.886 1.00 40.35 C ATOM 1526 CG1 VAL A 104 7.776 6.232 10.946 1.00 1.41 C ATOM 1527 CG2 VAL A 104 7.668 6.682 8.501 1.00 45.14 C ATOM 0 H VAL A 104 5.055 6.709 8.810 1.00 40.42 H new ATOM 0 HA VAL A 104 6.065 8.211 11.138 1.00 22.30 H new ATOM 0 HB VAL A 104 8.288 8.085 9.990 1.00 40.35 H new ATOM 0 HG11 VAL A 104 8.758 5.783 10.796 1.00 1.41 H new ATOM 0 HG12 VAL A 104 7.732 6.685 11.936 1.00 1.41 H new ATOM 0 HG13 VAL A 104 7.009 5.462 10.865 1.00 1.41 H new ATOM 0 HG21 VAL A 104 8.654 6.230 8.395 1.00 45.14 H new ATOM 0 HG22 VAL A 104 6.903 5.917 8.371 1.00 45.14 H new ATOM 0 HG23 VAL A 104 7.540 7.455 7.743 1.00 45.14 H new ATOM 1537 N GLY A 105 4.902 9.313 8.530 1.00 42.43 N ATOM 1538 CA GLY A 105 4.604 10.442 7.703 1.00 35.43 C ATOM 1539 C GLY A 105 3.537 11.262 8.338 1.00 3.13 C ATOM 1540 O GLY A 105 2.703 11.878 7.655 1.00 11.32 O ATOM 0 H GLY A 105 4.190 8.583 8.508 1.00 42.43 H new ATOM 0 HA2 GLY A 105 5.500 11.045 7.557 1.00 35.43 H new ATOM 0 HA3 GLY A 105 4.281 10.108 6.717 1.00 35.43 H new ATOM 1544 N SER A 106 3.607 11.323 9.658 1.00 34.11 N ATOM 1545 CA SER A 106 2.658 11.994 10.527 1.00 35.21 C ATOM 1546 C SER A 106 2.627 13.528 10.325 1.00 45.42 C ATOM 1547 O SER A 106 1.952 14.253 11.057 1.00 63.11 O ATOM 1548 CB SER A 106 3.010 11.629 11.951 1.00 74.24 C ATOM 1549 OG SER A 106 3.144 10.213 12.055 1.00 4.14 O ATOM 0 H SER A 106 4.367 10.883 10.177 1.00 34.11 H new ATOM 0 HA SER A 106 1.650 11.660 10.280 1.00 35.21 H new ATOM 0 HB2 SER A 106 3.940 12.116 12.244 1.00 74.24 H new ATOM 0 HB3 SER A 106 2.236 11.984 12.631 1.00 74.24 H new ATOM 0 HG SER A 106 2.291 9.786 11.828 1.00 4.14 H new ATOM 1555 N LEU A 107 3.366 13.999 9.334 1.00 33.34 N ATOM 1556 CA LEU A 107 3.336 15.377 8.917 1.00 1.42 C ATOM 1557 C LEU A 107 1.989 15.628 8.269 1.00 34.35 C ATOM 1558 O LEU A 107 1.421 16.717 8.372 1.00 13.42 O ATOM 1559 CB LEU A 107 4.462 15.689 7.910 1.00 45.32 C ATOM 1560 CG LEU A 107 5.921 15.662 8.420 1.00 40.32 C ATOM 1561 CD1 LEU A 107 6.366 14.270 8.827 1.00 71.33 C ATOM 1562 CD2 LEU A 107 6.856 16.223 7.371 1.00 32.13 C ATOM 0 H LEU A 107 4.010 13.421 8.794 1.00 33.34 H new ATOM 0 HA LEU A 107 3.487 16.022 9.783 1.00 1.42 H new ATOM 0 HB2 LEU A 107 4.382 14.977 7.089 1.00 45.32 H new ATOM 0 HB3 LEU A 107 4.272 16.678 7.493 1.00 45.32 H new ATOM 0 HG LEU A 107 5.959 16.287 9.312 1.00 40.32 H new ATOM 0 HD11 LEU A 107 7.397 14.306 9.178 1.00 71.33 H new ATOM 0 HD12 LEU A 107 5.723 13.902 9.627 1.00 71.33 H new ATOM 0 HD13 LEU A 107 6.297 13.601 7.969 1.00 71.33 H new ATOM 0 HD21 LEU A 107 7.880 16.197 7.745 1.00 32.13 H new ATOM 0 HD22 LEU A 107 6.786 15.624 6.463 1.00 32.13 H new ATOM 0 HD23 LEU A 107 6.577 17.253 7.148 1.00 32.13 H new ATOM 1574 N ASN A 108 1.489 14.607 7.598 1.00 54.21 N ATOM 1575 CA ASN A 108 0.155 14.641 7.026 1.00 73.44 C ATOM 1576 C ASN A 108 -0.646 13.521 7.678 1.00 22.23 C ATOM 1577 O ASN A 108 -1.804 13.695 8.049 1.00 1.33 O ATOM 1578 CB ASN A 108 0.173 14.449 5.506 1.00 22.43 C ATOM 1579 CG ASN A 108 -1.150 14.851 4.863 1.00 11.25 C ATOM 1580 OD1 ASN A 108 -2.086 14.071 4.788 1.00 75.52 O ATOM 1581 ND2 ASN A 108 -1.216 16.060 4.366 1.00 35.34 N ATOM 0 H ASN A 108 1.993 13.735 7.434 1.00 54.21 H new ATOM 0 HA ASN A 108 -0.292 15.617 7.214 1.00 73.44 H new ATOM 0 HB2 ASN A 108 0.980 15.042 5.075 1.00 22.43 H new ATOM 0 HB3 ASN A 108 0.386 13.405 5.275 1.00 22.43 H new ATOM 0 HD21 ASN A 108 -2.067 16.374 3.900 1.00 35.34 H new ATOM 0 HD22 ASN A 108 -0.416 16.688 4.445 1.00 35.34 H new ATOM 1588 N GLY A 109 0.005 12.383 7.870 1.00 63.25 N ATOM 1589 CA GLY A 109 -0.617 11.278 8.552 1.00 74.10 C ATOM 1590 C GLY A 109 -1.039 10.166 7.631 1.00 13.12 C ATOM 1591 O GLY A 109 -1.461 10.402 6.496 1.00 3.23 O ATOM 0 H GLY A 109 0.961 12.209 7.561 1.00 63.25 H new ATOM 0 HA2 GLY A 109 0.077 10.882 9.293 1.00 74.10 H new ATOM 0 HA3 GLY A 109 -1.490 11.641 9.095 1.00 74.10 H new ATOM 1595 N THR A 110 -0.872 8.969 8.090 1.00 40.31 N ATOM 1596 CA THR A 110 -1.353 7.818 7.397 1.00 14.35 C ATOM 1597 C THR A 110 -2.535 7.273 8.187 1.00 43.34 C ATOM 1598 O THR A 110 -2.441 7.044 9.406 1.00 51.14 O ATOM 1599 CB THR A 110 -0.246 6.754 7.265 1.00 12.12 C ATOM 1600 OG1 THR A 110 0.916 7.370 6.702 1.00 21.10 O ATOM 1601 CG2 THR A 110 -0.684 5.606 6.365 1.00 14.44 C ATOM 0 H THR A 110 -0.393 8.760 8.966 1.00 40.31 H new ATOM 0 HA THR A 110 -1.660 8.084 6.386 1.00 14.35 H new ATOM 0 HB THR A 110 -0.033 6.350 8.255 1.00 12.12 H new ATOM 0 HG1 THR A 110 1.455 7.768 7.418 1.00 21.10 H new ATOM 0 HG21 THR A 110 0.120 4.873 6.293 1.00 14.44 H new ATOM 0 HG22 THR A 110 -1.571 5.132 6.786 1.00 14.44 H new ATOM 0 HG23 THR A 110 -0.915 5.990 5.371 1.00 14.44 H new ATOM 1609 N TYR A 111 -3.642 7.122 7.527 1.00 20.33 N ATOM 1610 CA TYR A 111 -4.848 6.684 8.168 1.00 34.24 C ATOM 1611 C TYR A 111 -5.097 5.240 7.838 1.00 65.32 C ATOM 1612 O TYR A 111 -4.992 4.845 6.703 1.00 21.44 O ATOM 1613 CB TYR A 111 -6.045 7.531 7.687 1.00 61.33 C ATOM 1614 CG TYR A 111 -5.957 9.008 8.024 1.00 43.03 C ATOM 1615 CD1 TYR A 111 -5.143 9.874 7.297 1.00 73.30 C ATOM 1616 CD2 TYR A 111 -6.690 9.533 9.068 1.00 10.12 C ATOM 1617 CE1 TYR A 111 -5.063 11.214 7.616 1.00 24.45 C ATOM 1618 CE2 TYR A 111 -6.621 10.869 9.390 1.00 53.12 C ATOM 1619 CZ TYR A 111 -5.806 11.707 8.666 1.00 33.11 C ATOM 1620 OH TYR A 111 -5.725 13.044 9.006 1.00 4.24 O ATOM 0 H TYR A 111 -3.737 7.299 6.527 1.00 20.33 H new ATOM 0 HA TYR A 111 -4.737 6.802 9.246 1.00 34.24 H new ATOM 0 HB2 TYR A 111 -6.136 7.424 6.606 1.00 61.33 H new ATOM 0 HB3 TYR A 111 -6.957 7.127 8.125 1.00 61.33 H new ATOM 0 HD1 TYR A 111 -4.565 9.490 6.470 1.00 73.30 H new ATOM 0 HD2 TYR A 111 -7.331 8.882 9.644 1.00 10.12 H new ATOM 0 HE1 TYR A 111 -4.423 11.871 7.047 1.00 24.45 H new ATOM 0 HE2 TYR A 111 -7.206 11.259 10.210 1.00 53.12 H new ATOM 0 HH TYR A 111 -6.314 13.224 9.768 1.00 4.24 H new ATOM 1630 N VAL A 112 -5.431 4.473 8.807 1.00 34.35 N ATOM 1631 CA VAL A 112 -5.785 3.108 8.594 1.00 44.24 C ATOM 1632 C VAL A 112 -7.143 2.903 9.217 1.00 70.45 C ATOM 1633 O VAL A 112 -7.373 3.333 10.340 1.00 53.43 O ATOM 1634 CB VAL A 112 -4.710 2.112 9.143 1.00 25.32 C ATOM 1635 CG1 VAL A 112 -4.454 2.295 10.637 1.00 22.32 C ATOM 1636 CG2 VAL A 112 -5.087 0.671 8.822 1.00 4.41 C ATOM 0 H VAL A 112 -5.469 4.771 9.782 1.00 34.35 H new ATOM 0 HA VAL A 112 -5.826 2.892 7.526 1.00 44.24 H new ATOM 0 HB VAL A 112 -3.774 2.343 8.634 1.00 25.32 H new ATOM 0 HG11 VAL A 112 -3.700 1.580 10.967 1.00 22.32 H new ATOM 0 HG12 VAL A 112 -4.099 3.309 10.824 1.00 22.32 H new ATOM 0 HG13 VAL A 112 -5.379 2.127 11.188 1.00 22.32 H new ATOM 0 HG21 VAL A 112 -4.324 -0.001 9.214 1.00 4.41 H new ATOM 0 HG22 VAL A 112 -6.048 0.436 9.280 1.00 4.41 H new ATOM 0 HG23 VAL A 112 -5.160 0.546 7.742 1.00 4.41 H new ATOM 1646 N ASN A 113 -8.075 2.361 8.438 1.00 12.24 N ATOM 1647 CA ASN A 113 -9.490 2.197 8.866 1.00 20.41 C ATOM 1648 C ASN A 113 -10.112 3.574 9.072 1.00 62.34 C ATOM 1649 O ASN A 113 -11.109 3.716 9.772 1.00 32.03 O ATOM 1650 CB ASN A 113 -9.628 1.376 10.183 1.00 33.04 C ATOM 1651 CG ASN A 113 -9.094 -0.036 10.096 1.00 51.31 C ATOM 1652 OD1 ASN A 113 -7.923 -0.290 10.385 1.00 63.22 O ATOM 1653 ND2 ASN A 113 -9.933 -0.955 9.715 1.00 15.52 N ATOM 0 H ASN A 113 -7.888 2.020 7.495 1.00 12.24 H new ATOM 0 HA ASN A 113 -10.006 1.645 8.080 1.00 20.41 H new ATOM 0 HB2 ASN A 113 -9.104 1.901 10.981 1.00 33.04 H new ATOM 0 HB3 ASN A 113 -10.680 1.337 10.464 1.00 33.04 H new ATOM 0 HD21 ASN A 113 -9.629 -1.926 9.647 1.00 15.52 H new ATOM 0 HD22 ASN A 113 -10.894 -0.704 9.484 1.00 15.52 H new ATOM 1660 N ARG A 114 -9.503 4.583 8.407 1.00 41.21 N ATOM 1661 CA ARG A 114 -9.864 6.012 8.530 1.00 12.24 C ATOM 1662 C ARG A 114 -9.348 6.644 9.824 1.00 34.03 C ATOM 1663 O ARG A 114 -9.609 7.819 10.091 1.00 11.43 O ATOM 1664 CB ARG A 114 -11.372 6.287 8.332 1.00 72.25 C ATOM 1665 CG ARG A 114 -11.832 6.336 6.880 1.00 1.42 C ATOM 1666 CD ARG A 114 -11.235 7.547 6.172 1.00 20.11 C ATOM 1667 NE ARG A 114 -11.576 8.801 6.868 1.00 12.22 N ATOM 1668 CZ ARG A 114 -10.765 9.868 6.999 1.00 32.30 C ATOM 1669 NH1 ARG A 114 -9.582 9.909 6.369 1.00 55.05 N ATOM 1670 NH2 ARG A 114 -11.145 10.901 7.747 1.00 23.32 N ATOM 0 H ARG A 114 -8.733 4.422 7.758 1.00 41.21 H new ATOM 0 HA ARG A 114 -9.350 6.501 7.703 1.00 12.24 H new ATOM 0 HB2 ARG A 114 -11.938 5.514 8.851 1.00 72.25 H new ATOM 0 HB3 ARG A 114 -11.619 7.236 8.808 1.00 72.25 H new ATOM 0 HG2 ARG A 114 -11.532 5.423 6.366 1.00 1.42 H new ATOM 0 HG3 ARG A 114 -12.920 6.383 6.838 1.00 1.42 H new ATOM 0 HD2 ARG A 114 -10.151 7.442 6.119 1.00 20.11 H new ATOM 0 HD3 ARG A 114 -11.601 7.588 5.146 1.00 20.11 H new ATOM 0 HE ARG A 114 -12.504 8.866 7.285 1.00 12.22 H new ATOM 0 HH11 ARG A 114 -9.289 9.127 5.784 1.00 55.05 H new ATOM 0 HH12 ARG A 114 -8.976 10.722 6.475 1.00 55.05 H new ATOM 0 HH21 ARG A 114 -12.049 10.883 8.220 1.00 23.32 H new ATOM 0 HH22 ARG A 114 -10.532 11.710 7.848 1.00 23.32 H new ATOM 1684 N GLU A 115 -8.579 5.899 10.587 1.00 54.24 N ATOM 1685 CA GLU A 115 -8.048 6.390 11.835 1.00 53.22 C ATOM 1686 C GLU A 115 -6.522 6.549 11.742 1.00 0.13 C ATOM 1687 O GLU A 115 -5.828 5.646 11.275 1.00 70.00 O ATOM 1688 CB GLU A 115 -8.432 5.434 12.976 1.00 23.44 C ATOM 1689 CG GLU A 115 -7.920 5.856 14.337 1.00 14.24 C ATOM 1690 CD GLU A 115 -8.389 4.961 15.446 1.00 51.10 C ATOM 1691 OE1 GLU A 115 -9.459 5.222 16.013 1.00 71.40 O ATOM 1692 OE2 GLU A 115 -7.685 3.993 15.790 1.00 53.22 O ATOM 0 H GLU A 115 -8.307 4.943 10.360 1.00 54.24 H new ATOM 0 HA GLU A 115 -8.476 7.370 12.044 1.00 53.22 H new ATOM 0 HB2 GLU A 115 -9.518 5.353 13.018 1.00 23.44 H new ATOM 0 HB3 GLU A 115 -8.047 4.440 12.747 1.00 23.44 H new ATOM 0 HG2 GLU A 115 -6.830 5.865 14.322 1.00 14.24 H new ATOM 0 HG3 GLU A 115 -8.244 6.877 14.540 1.00 14.24 H new ATOM 1699 N PRO A 116 -5.981 7.710 12.133 1.00 61.13 N ATOM 1700 CA PRO A 116 -4.541 7.914 12.162 1.00 24.23 C ATOM 1701 C PRO A 116 -3.937 7.175 13.360 1.00 74.51 C ATOM 1702 O PRO A 116 -4.181 7.535 14.523 1.00 12.23 O ATOM 1703 CB PRO A 116 -4.389 9.433 12.313 1.00 65.12 C ATOM 1704 CG PRO A 116 -5.651 9.889 12.975 1.00 55.01 C ATOM 1705 CD PRO A 116 -6.727 8.907 12.582 1.00 24.21 C ATOM 0 HA PRO A 116 -4.030 7.536 11.276 1.00 24.23 H new ATOM 0 HB2 PRO A 116 -3.516 9.684 12.915 1.00 65.12 H new ATOM 0 HB3 PRO A 116 -4.257 9.914 11.344 1.00 65.12 H new ATOM 0 HG2 PRO A 116 -5.531 9.918 14.058 1.00 55.01 H new ATOM 0 HG3 PRO A 116 -5.913 10.898 12.656 1.00 55.01 H new ATOM 0 HD2 PRO A 116 -7.381 8.676 13.423 1.00 24.21 H new ATOM 0 HD3 PRO A 116 -7.358 9.305 11.787 1.00 24.21 H new ATOM 1713 N ARG A 117 -3.198 6.137 13.094 1.00 63.42 N ATOM 1714 CA ARG A 117 -2.645 5.319 14.151 1.00 1.35 C ATOM 1715 C ARG A 117 -1.146 5.217 13.914 1.00 21.43 C ATOM 1716 O ARG A 117 -0.706 5.397 12.775 1.00 74.50 O ATOM 1717 CB ARG A 117 -3.331 3.945 14.125 1.00 64.52 C ATOM 1718 CG ARG A 117 -3.326 3.222 15.455 1.00 21.00 C ATOM 1719 CD ARG A 117 -4.144 1.943 15.397 1.00 63.25 C ATOM 1720 NE ARG A 117 -4.409 1.406 16.738 1.00 75.31 N ATOM 1721 CZ ARG A 117 -5.130 0.300 17.008 1.00 53.33 C ATOM 1722 NH1 ARG A 117 -5.480 -0.537 16.026 1.00 65.22 N ATOM 1723 NH2 ARG A 117 -5.445 0.008 18.265 1.00 2.34 N ATOM 0 H ARG A 117 -2.960 5.830 12.151 1.00 63.42 H new ATOM 0 HA ARG A 117 -2.816 5.751 15.137 1.00 1.35 H new ATOM 0 HB2 ARG A 117 -4.363 4.073 13.798 1.00 64.52 H new ATOM 0 HB3 ARG A 117 -2.837 3.319 13.382 1.00 64.52 H new ATOM 0 HG2 ARG A 117 -2.300 2.986 15.738 1.00 21.00 H new ATOM 0 HG3 ARG A 117 -3.728 3.877 16.228 1.00 21.00 H new ATOM 0 HD2 ARG A 117 -5.089 2.138 14.890 1.00 63.25 H new ATOM 0 HD3 ARG A 117 -3.613 1.198 14.805 1.00 63.25 H new ATOM 0 HE ARG A 117 -4.015 1.912 17.531 1.00 75.31 H new ATOM 0 HH11 ARG A 117 -5.201 -0.340 15.065 1.00 65.22 H new ATOM 0 HH12 ARG A 117 -6.026 -1.372 16.238 1.00 65.22 H new ATOM 0 HH21 ARG A 117 -5.141 0.620 19.022 1.00 2.34 H new ATOM 0 HH22 ARG A 117 -5.991 -0.828 18.473 1.00 2.34 H new ATOM 1737 N ASN A 118 -0.361 4.981 14.952 1.00 61.52 N ATOM 1738 CA ASN A 118 1.098 4.979 14.791 1.00 11.22 C ATOM 1739 C ASN A 118 1.572 3.654 14.236 1.00 40.04 C ATOM 1740 O ASN A 118 2.311 3.612 13.251 1.00 24.45 O ATOM 1741 CB ASN A 118 1.818 5.285 16.115 1.00 12.14 C ATOM 1742 CG ASN A 118 3.341 5.409 15.968 1.00 64.14 C ATOM 1743 OD1 ASN A 118 4.091 5.039 16.868 1.00 75.32 O ATOM 1744 ND2 ASN A 118 3.807 5.992 14.889 1.00 1.41 N ATOM 0 H ASN A 118 -0.692 4.791 15.898 1.00 61.52 H new ATOM 0 HA ASN A 118 1.347 5.770 14.084 1.00 11.22 H new ATOM 0 HB2 ASN A 118 1.424 6.214 16.528 1.00 12.14 H new ATOM 0 HB3 ASN A 118 1.593 4.496 16.833 1.00 12.14 H new ATOM 0 HD21 ASN A 118 4.810 6.146 14.785 1.00 1.41 H new ATOM 0 HD22 ASN A 118 3.166 6.291 14.154 1.00 1.41 H new ATOM 1751 N ALA A 119 1.139 2.588 14.853 1.00 64.44 N ATOM 1752 CA ALA A 119 1.482 1.264 14.430 1.00 23.41 C ATOM 1753 C ALA A 119 0.216 0.454 14.329 1.00 23.22 C ATOM 1754 O ALA A 119 -0.689 0.613 15.144 1.00 61.14 O ATOM 1755 CB ALA A 119 2.450 0.622 15.415 1.00 22.45 C ATOM 0 H ALA A 119 0.532 2.618 15.672 1.00 64.44 H new ATOM 0 HA ALA A 119 1.975 1.302 13.459 1.00 23.41 H new ATOM 0 HB1 ALA A 119 2.699 -0.384 15.077 1.00 22.45 H new ATOM 0 HB2 ALA A 119 3.359 1.221 15.474 1.00 22.45 H new ATOM 0 HB3 ALA A 119 1.985 0.569 16.400 1.00 22.45 H new ATOM 1761 N GLN A 120 0.130 -0.359 13.321 1.00 22.51 N ATOM 1762 CA GLN A 120 -1.027 -1.193 13.102 1.00 24.34 C ATOM 1763 C GLN A 120 -0.584 -2.572 12.633 1.00 70.00 C ATOM 1764 O GLN A 120 0.482 -2.705 12.002 1.00 2.33 O ATOM 1765 CB GLN A 120 -1.920 -0.537 12.024 1.00 43.53 C ATOM 1766 CG GLN A 120 -3.126 -1.365 11.595 1.00 62.44 C ATOM 1767 CD GLN A 120 -4.195 -1.480 12.653 1.00 53.11 C ATOM 1768 OE1 GLN A 120 -4.416 -0.564 13.440 1.00 22.33 O ATOM 1769 NE2 GLN A 120 -4.829 -2.613 12.709 1.00 3.44 N ATOM 0 H GLN A 120 0.862 -0.468 12.619 1.00 22.51 H new ATOM 0 HA GLN A 120 -1.588 -1.298 14.031 1.00 24.34 H new ATOM 0 HB2 GLN A 120 -2.273 0.423 12.401 1.00 43.53 H new ATOM 0 HB3 GLN A 120 -1.310 -0.329 11.145 1.00 43.53 H new ATOM 0 HG2 GLN A 120 -3.561 -0.920 10.700 1.00 62.44 H new ATOM 0 HG3 GLN A 120 -2.789 -2.365 11.322 1.00 62.44 H new ATOM 0 HE21 GLN A 120 -4.617 -3.350 12.037 1.00 3.44 H new ATOM 0 HE22 GLN A 120 -5.539 -2.765 13.425 1.00 3.44 H new ATOM 1778 N VAL A 121 -1.332 -3.598 12.986 1.00 71.02 N ATOM 1779 CA VAL A 121 -1.145 -4.892 12.383 1.00 13.53 C ATOM 1780 C VAL A 121 -2.026 -4.886 11.147 1.00 63.42 C ATOM 1781 O VAL A 121 -3.252 -4.698 11.248 1.00 42.51 O ATOM 1782 CB VAL A 121 -1.519 -6.075 13.327 1.00 33.31 C ATOM 1783 CG1 VAL A 121 -1.333 -7.415 12.617 1.00 74.42 C ATOM 1784 CG2 VAL A 121 -0.665 -6.040 14.588 1.00 14.42 C ATOM 0 H VAL A 121 -2.072 -3.556 13.686 1.00 71.02 H new ATOM 0 HA VAL A 121 -0.092 -5.051 12.150 1.00 13.53 H new ATOM 0 HB VAL A 121 -2.568 -5.967 13.603 1.00 33.31 H new ATOM 0 HG11 VAL A 121 -1.600 -8.226 13.295 1.00 74.42 H new ATOM 0 HG12 VAL A 121 -1.974 -7.452 11.736 1.00 74.42 H new ATOM 0 HG13 VAL A 121 -0.292 -7.524 12.313 1.00 74.42 H new ATOM 0 HG21 VAL A 121 -0.939 -6.873 15.236 1.00 14.42 H new ATOM 0 HG22 VAL A 121 0.388 -6.122 14.317 1.00 14.42 H new ATOM 0 HG23 VAL A 121 -0.832 -5.100 15.114 1.00 14.42 H new ATOM 1794 N MET A 122 -1.390 -5.010 10.004 1.00 23.44 N ATOM 1795 CA MET A 122 -2.024 -4.855 8.689 1.00 34.15 C ATOM 1796 C MET A 122 -3.221 -5.803 8.527 1.00 1.11 C ATOM 1797 O MET A 122 -3.069 -7.031 8.530 1.00 53.42 O ATOM 1798 CB MET A 122 -0.977 -5.112 7.617 1.00 55.22 C ATOM 1799 CG MET A 122 -1.290 -4.581 6.238 1.00 61.50 C ATOM 1800 SD MET A 122 -1.493 -2.796 6.222 1.00 60.44 S ATOM 1801 CE MET A 122 -1.175 -2.448 4.497 1.00 70.31 C ATOM 0 H MET A 122 -0.395 -5.226 9.948 1.00 23.44 H new ATOM 0 HA MET A 122 -2.412 -3.841 8.592 1.00 34.15 H new ATOM 0 HB2 MET A 122 -0.035 -4.675 7.947 1.00 55.22 H new ATOM 0 HB3 MET A 122 -0.820 -6.188 7.542 1.00 55.22 H new ATOM 0 HG2 MET A 122 -0.488 -4.859 5.554 1.00 61.50 H new ATOM 0 HG3 MET A 122 -2.201 -5.051 5.869 1.00 61.50 H new ATOM 0 HE1 MET A 122 -0.569 -1.546 4.414 1.00 70.31 H new ATOM 0 HE2 MET A 122 -0.641 -3.286 4.049 1.00 70.31 H new ATOM 0 HE3 MET A 122 -2.121 -2.299 3.975 1.00 70.31 H new ATOM 1811 N GLN A 123 -4.389 -5.223 8.373 1.00 33.23 N ATOM 1812 CA GLN A 123 -5.629 -5.965 8.327 1.00 5.14 C ATOM 1813 C GLN A 123 -6.140 -6.024 6.882 1.00 11.24 C ATOM 1814 O GLN A 123 -6.207 -4.998 6.202 1.00 61.05 O ATOM 1815 CB GLN A 123 -6.632 -5.287 9.278 1.00 30.25 C ATOM 1816 CG GLN A 123 -7.913 -6.051 9.509 1.00 63.55 C ATOM 1817 CD GLN A 123 -8.734 -5.484 10.647 1.00 3.24 C ATOM 1818 OE1 GLN A 123 -8.553 -5.867 11.793 1.00 25.15 O ATOM 1819 NE2 GLN A 123 -9.634 -4.604 10.356 1.00 53.33 N ATOM 0 H GLN A 123 -4.507 -4.215 8.275 1.00 33.23 H new ATOM 0 HA GLN A 123 -5.486 -6.994 8.656 1.00 5.14 H new ATOM 0 HB2 GLN A 123 -6.145 -5.126 10.240 1.00 30.25 H new ATOM 0 HB3 GLN A 123 -6.881 -4.304 8.878 1.00 30.25 H new ATOM 0 HG2 GLN A 123 -8.508 -6.039 8.596 1.00 63.55 H new ATOM 0 HG3 GLN A 123 -7.676 -7.094 9.721 1.00 63.55 H new ATOM 0 HE21 GLN A 123 -9.761 -4.305 9.389 1.00 53.33 H new ATOM 0 HE22 GLN A 123 -10.218 -4.209 11.093 1.00 53.33 H new ATOM 1828 N THR A 124 -6.474 -7.219 6.415 1.00 2.10 N ATOM 1829 CA THR A 124 -6.872 -7.412 5.034 1.00 30.53 C ATOM 1830 C THR A 124 -8.324 -7.008 4.780 1.00 54.34 C ATOM 1831 O THR A 124 -9.248 -7.408 5.507 1.00 23.42 O ATOM 1832 CB THR A 124 -6.586 -8.869 4.523 1.00 13.44 C ATOM 1833 OG1 THR A 124 -7.027 -9.027 3.170 1.00 45.04 O ATOM 1834 CG2 THR A 124 -7.249 -9.929 5.398 1.00 54.45 C ATOM 0 H THR A 124 -6.476 -8.070 6.977 1.00 2.10 H new ATOM 0 HA THR A 124 -6.246 -6.739 4.449 1.00 30.53 H new ATOM 0 HB THR A 124 -5.507 -9.012 4.577 1.00 13.44 H new ATOM 0 HG1 THR A 124 -7.440 -9.909 3.061 1.00 45.04 H new ATOM 0 HG21 THR A 124 -7.022 -10.920 5.004 1.00 54.45 H new ATOM 0 HG22 THR A 124 -6.871 -9.848 6.417 1.00 54.45 H new ATOM 0 HG23 THR A 124 -8.328 -9.777 5.399 1.00 54.45 H new ATOM 1842 N GLY A 125 -8.509 -6.197 3.771 1.00 13.21 N ATOM 1843 CA GLY A 125 -9.811 -5.765 3.391 1.00 1.45 C ATOM 1844 C GLY A 125 -10.036 -4.335 3.733 1.00 62.53 C ATOM 1845 O GLY A 125 -11.003 -3.725 3.280 1.00 44.40 O ATOM 0 H GLY A 125 -7.755 -5.822 3.195 1.00 13.21 H new ATOM 0 HA2 GLY A 125 -9.944 -5.908 2.319 1.00 1.45 H new ATOM 0 HA3 GLY A 125 -10.559 -6.381 3.890 1.00 1.45 H new ATOM 1849 N ASP A 126 -9.141 -3.783 4.509 1.00 65.05 N ATOM 1850 CA ASP A 126 -9.286 -2.422 4.951 1.00 73.31 C ATOM 1851 C ASP A 126 -8.416 -1.472 4.198 1.00 42.15 C ATOM 1852 O ASP A 126 -7.541 -1.882 3.412 1.00 24.40 O ATOM 1853 CB ASP A 126 -9.104 -2.271 6.453 1.00 31.31 C ATOM 1854 CG ASP A 126 -10.292 -2.786 7.212 1.00 54.21 C ATOM 1855 OD1 ASP A 126 -11.365 -2.156 7.150 1.00 22.41 O ATOM 1856 OD2 ASP A 126 -10.179 -3.794 7.904 1.00 70.12 O ATOM 0 H ASP A 126 -8.303 -4.256 4.848 1.00 65.05 H new ATOM 0 HA ASP A 126 -10.318 -2.152 4.725 1.00 73.31 H new ATOM 0 HB2 ASP A 126 -8.210 -2.810 6.767 1.00 31.31 H new ATOM 0 HB3 ASP A 126 -8.945 -1.221 6.696 1.00 31.31 H new ATOM 1861 N GLU A 127 -8.622 -0.208 4.458 1.00 61.13 N ATOM 1862 CA GLU A 127 -7.979 0.825 3.715 1.00 74.10 C ATOM 1863 C GLU A 127 -6.913 1.529 4.524 1.00 70.33 C ATOM 1864 O GLU A 127 -7.052 1.755 5.751 1.00 54.55 O ATOM 1865 CB GLU A 127 -9.007 1.827 3.211 1.00 50.34 C ATOM 1866 CG GLU A 127 -9.755 2.552 4.316 1.00 51.02 C ATOM 1867 CD GLU A 127 -10.779 3.479 3.771 1.00 64.42 C ATOM 1868 OE1 GLU A 127 -10.414 4.497 3.174 1.00 23.02 O ATOM 1869 OE2 GLU A 127 -11.970 3.183 3.879 1.00 64.11 O ATOM 0 H GLU A 127 -9.243 0.127 5.194 1.00 61.13 H new ATOM 0 HA GLU A 127 -7.484 0.356 2.864 1.00 74.10 H new ATOM 0 HB2 GLU A 127 -8.505 2.563 2.583 1.00 50.34 H new ATOM 0 HB3 GLU A 127 -9.727 1.307 2.579 1.00 50.34 H new ATOM 0 HG2 GLU A 127 -10.235 1.823 4.969 1.00 51.02 H new ATOM 0 HG3 GLU A 127 -9.047 3.111 4.928 1.00 51.02 H new ATOM 1876 N ILE A 128 -5.865 1.856 3.834 1.00 23.33 N ATOM 1877 CA ILE A 128 -4.739 2.556 4.344 1.00 23.40 C ATOM 1878 C ILE A 128 -4.580 3.782 3.459 1.00 62.14 C ATOM 1879 O ILE A 128 -4.330 3.668 2.264 1.00 42.32 O ATOM 1880 CB ILE A 128 -3.413 1.702 4.301 1.00 74.04 C ATOM 1881 CG1 ILE A 128 -3.506 0.398 5.140 1.00 23.30 C ATOM 1882 CG2 ILE A 128 -2.218 2.526 4.768 1.00 31.23 C ATOM 1883 CD1 ILE A 128 -4.346 -0.721 4.539 1.00 52.20 C ATOM 0 H ILE A 128 -5.772 1.626 2.845 1.00 23.33 H new ATOM 0 HA ILE A 128 -4.904 2.803 5.393 1.00 23.40 H new ATOM 0 HB ILE A 128 -3.274 1.413 3.259 1.00 74.04 H new ATOM 0 HG12 ILE A 128 -2.496 0.021 5.303 1.00 23.30 H new ATOM 0 HG13 ILE A 128 -3.915 0.647 6.119 1.00 23.30 H new ATOM 0 HG21 ILE A 128 -1.317 1.914 4.729 1.00 31.23 H new ATOM 0 HG22 ILE A 128 -2.097 3.392 4.118 1.00 31.23 H new ATOM 0 HG23 ILE A 128 -2.385 2.861 5.792 1.00 31.23 H new ATOM 0 HD11 ILE A 128 -4.340 -1.581 5.209 1.00 52.20 H new ATOM 0 HD12 ILE A 128 -5.370 -0.374 4.403 1.00 52.20 H new ATOM 0 HD13 ILE A 128 -3.930 -1.010 3.574 1.00 52.20 H new ATOM 1895 N GLN A 129 -4.794 4.918 4.015 1.00 61.22 N ATOM 1896 CA GLN A 129 -4.737 6.134 3.275 1.00 5.22 C ATOM 1897 C GLN A 129 -3.443 6.841 3.563 1.00 43.45 C ATOM 1898 O GLN A 129 -3.160 7.192 4.716 1.00 72.44 O ATOM 1899 CB GLN A 129 -5.897 7.048 3.639 1.00 1.23 C ATOM 1900 CG GLN A 129 -7.258 6.383 3.585 1.00 62.04 C ATOM 1901 CD GLN A 129 -8.377 7.359 3.832 1.00 34.11 C ATOM 1902 OE1 GLN A 129 -8.213 8.364 4.530 1.00 24.30 O ATOM 1903 NE2 GLN A 129 -9.526 7.054 3.338 1.00 51.30 N ATOM 0 H GLN A 129 -5.016 5.036 5.004 1.00 61.22 H new ATOM 0 HA GLN A 129 -4.802 5.891 2.214 1.00 5.22 H new ATOM 0 HB2 GLN A 129 -5.736 7.437 4.644 1.00 1.23 H new ATOM 0 HB3 GLN A 129 -5.896 7.903 2.963 1.00 1.23 H new ATOM 0 HG2 GLN A 129 -7.394 5.916 2.610 1.00 62.04 H new ATOM 0 HG3 GLN A 129 -7.302 5.587 4.328 1.00 62.04 H new ATOM 0 HE21 GLN A 129 -9.629 6.216 2.765 1.00 51.30 H new ATOM 0 HE22 GLN A 129 -10.334 7.650 3.520 1.00 51.30 H new ATOM 1912 N ILE A 130 -2.668 7.044 2.543 1.00 72.20 N ATOM 1913 CA ILE A 130 -1.434 7.766 2.668 1.00 73.42 C ATOM 1914 C ILE A 130 -1.718 9.231 2.393 1.00 72.31 C ATOM 1915 O ILE A 130 -1.922 9.654 1.242 1.00 74.31 O ATOM 1916 CB ILE A 130 -0.300 7.195 1.744 1.00 12.34 C ATOM 1917 CG1 ILE A 130 -0.760 7.093 0.271 1.00 72.34 C ATOM 1918 CG2 ILE A 130 0.162 5.833 2.263 1.00 30.41 C ATOM 1919 CD1 ILE A 130 0.290 6.566 -0.686 1.00 45.44 C ATOM 0 H ILE A 130 -2.870 6.715 1.599 1.00 72.20 H new ATOM 0 HA ILE A 130 -1.050 7.649 3.681 1.00 73.42 H new ATOM 0 HB ILE A 130 0.540 7.889 1.773 1.00 12.34 H new ATOM 0 HG12 ILE A 130 -1.635 6.444 0.222 1.00 72.34 H new ATOM 0 HG13 ILE A 130 -1.076 8.080 -0.066 1.00 72.34 H new ATOM 0 HG21 ILE A 130 0.949 5.445 1.616 1.00 30.41 H new ATOM 0 HG22 ILE A 130 0.547 5.941 3.277 1.00 30.41 H new ATOM 0 HG23 ILE A 130 -0.680 5.140 2.267 1.00 30.41 H new ATOM 0 HD11 ILE A 130 -0.122 6.529 -1.694 1.00 45.44 H new ATOM 0 HD12 ILE A 130 1.158 7.225 -0.673 1.00 45.44 H new ATOM 0 HD13 ILE A 130 0.591 5.564 -0.380 1.00 45.44 H new ATOM 1931 N GLY A 131 -1.844 9.981 3.457 1.00 43.44 N ATOM 1932 CA GLY A 131 -2.228 11.345 3.344 1.00 42.53 C ATOM 1933 C GLY A 131 -3.715 11.413 3.142 1.00 72.23 C ATOM 1934 O GLY A 131 -4.487 11.358 4.097 1.00 23.23 O ATOM 0 H GLY A 131 -1.683 9.659 4.411 1.00 43.44 H new ATOM 0 HA2 GLY A 131 -1.944 11.893 4.242 1.00 42.53 H new ATOM 0 HA3 GLY A 131 -1.711 11.815 2.507 1.00 42.53 H new ATOM 1938 N LYS A 132 -4.120 11.469 1.896 1.00 64.31 N ATOM 1939 CA LYS A 132 -5.528 11.477 1.538 1.00 35.51 C ATOM 1940 C LYS A 132 -5.773 10.572 0.350 1.00 33.14 C ATOM 1941 O LYS A 132 -6.818 10.637 -0.296 1.00 4.21 O ATOM 1942 CB LYS A 132 -6.019 12.896 1.230 1.00 61.00 C ATOM 1943 CG LYS A 132 -6.018 13.823 2.426 1.00 45.33 C ATOM 1944 CD LYS A 132 -6.517 15.193 2.057 1.00 33.43 C ATOM 1945 CE LYS A 132 -6.505 16.114 3.257 1.00 1.34 C ATOM 1946 NZ LYS A 132 -6.897 17.483 2.893 1.00 35.31 N ATOM 0 H LYS A 132 -3.487 11.510 1.097 1.00 64.31 H new ATOM 0 HA LYS A 132 -6.091 11.104 2.393 1.00 35.51 H new ATOM 0 HB2 LYS A 132 -5.390 13.325 0.450 1.00 61.00 H new ATOM 0 HB3 LYS A 132 -7.031 12.840 0.828 1.00 61.00 H new ATOM 0 HG2 LYS A 132 -6.646 13.405 3.213 1.00 45.33 H new ATOM 0 HG3 LYS A 132 -5.008 13.898 2.830 1.00 45.33 H new ATOM 0 HD2 LYS A 132 -5.893 15.611 1.267 1.00 33.43 H new ATOM 0 HD3 LYS A 132 -7.529 15.121 1.659 1.00 33.43 H new ATOM 0 HE2 LYS A 132 -7.185 15.730 4.017 1.00 1.34 H new ATOM 0 HE3 LYS A 132 -5.508 16.125 3.698 1.00 1.34 H new ATOM 0 HZ1 LYS A 132 -6.878 18.086 3.740 1.00 35.31 H new ATOM 0 HZ2 LYS A 132 -6.233 17.858 2.186 1.00 35.31 H new ATOM 0 HZ3 LYS A 132 -7.858 17.475 2.496 1.00 35.31 H new ATOM 1960 N PHE A 133 -4.817 9.719 0.063 1.00 71.44 N ATOM 1961 CA PHE A 133 -4.937 8.806 -1.051 1.00 11.25 C ATOM 1962 C PHE A 133 -5.264 7.430 -0.544 1.00 14.31 C ATOM 1963 O PHE A 133 -4.603 6.922 0.363 1.00 72.05 O ATOM 1964 CB PHE A 133 -3.684 8.831 -1.906 1.00 32.11 C ATOM 1965 CG PHE A 133 -3.430 10.193 -2.467 1.00 75.30 C ATOM 1966 CD1 PHE A 133 -4.359 10.786 -3.312 1.00 51.14 C ATOM 1967 CD2 PHE A 133 -2.295 10.894 -2.131 1.00 31.42 C ATOM 1968 CE1 PHE A 133 -4.150 12.051 -3.810 1.00 5.12 C ATOM 1969 CE2 PHE A 133 -2.084 12.157 -2.623 1.00 64.53 C ATOM 1970 CZ PHE A 133 -3.011 12.737 -3.465 1.00 32.14 C ATOM 0 H PHE A 133 -3.945 9.638 0.587 1.00 71.44 H new ATOM 0 HA PHE A 133 -5.756 9.123 -1.696 1.00 11.25 H new ATOM 0 HB2 PHE A 133 -2.828 8.517 -1.308 1.00 32.11 H new ATOM 0 HB3 PHE A 133 -3.784 8.114 -2.721 1.00 32.11 H new ATOM 0 HD1 PHE A 133 -5.256 10.248 -3.581 1.00 51.14 H new ATOM 0 HD2 PHE A 133 -1.564 10.446 -1.474 1.00 31.42 H new ATOM 0 HE1 PHE A 133 -4.877 12.502 -4.469 1.00 5.12 H new ATOM 0 HE2 PHE A 133 -1.190 12.699 -2.351 1.00 64.53 H new ATOM 0 HZ PHE A 133 -2.841 13.731 -3.853 1.00 32.14 H new ATOM 1980 N ARG A 134 -6.259 6.822 -1.137 1.00 11.33 N ATOM 1981 CA ARG A 134 -6.819 5.612 -0.607 1.00 22.21 C ATOM 1982 C ARG A 134 -6.208 4.375 -1.258 1.00 15.21 C ATOM 1983 O ARG A 134 -6.258 4.192 -2.494 1.00 1.41 O ATOM 1984 CB ARG A 134 -8.328 5.652 -0.837 1.00 12.03 C ATOM 1985 CG ARG A 134 -9.150 4.702 0.006 1.00 14.34 C ATOM 1986 CD ARG A 134 -10.634 4.884 -0.289 1.00 42.51 C ATOM 1987 NE ARG A 134 -11.473 4.273 0.740 1.00 55.55 N ATOM 1988 CZ ARG A 134 -12.769 3.970 0.627 1.00 1.34 C ATOM 1989 NH1 ARG A 134 -13.438 4.272 -0.474 1.00 52.25 N ATOM 1990 NH2 ARG A 134 -13.405 3.426 1.656 1.00 12.42 N ATOM 0 H ARG A 134 -6.700 7.152 -1.996 1.00 11.33 H new ATOM 0 HA ARG A 134 -6.597 5.546 0.458 1.00 22.21 H new ATOM 0 HB2 ARG A 134 -8.678 6.668 -0.651 1.00 12.03 H new ATOM 0 HB3 ARG A 134 -8.522 5.436 -1.888 1.00 12.03 H new ATOM 0 HG2 ARG A 134 -8.855 3.673 -0.200 1.00 14.34 H new ATOM 0 HG3 ARG A 134 -8.957 4.883 1.063 1.00 14.34 H new ATOM 0 HD2 ARG A 134 -10.862 5.947 -0.359 1.00 42.51 H new ATOM 0 HD3 ARG A 134 -10.868 4.443 -1.258 1.00 42.51 H new ATOM 0 HE ARG A 134 -11.025 4.057 1.631 1.00 55.55 H new ATOM 0 HH11 ARG A 134 -12.964 4.740 -1.246 1.00 52.25 H new ATOM 0 HH12 ARG A 134 -14.427 4.036 -0.550 1.00 52.25 H new ATOM 0 HH21 ARG A 134 -12.904 3.242 2.525 1.00 12.42 H new ATOM 0 HH22 ARG A 134 -14.395 3.192 1.578 1.00 12.42 H new ATOM 2004 N LEU A 135 -5.635 3.546 -0.427 1.00 31.24 N ATOM 2005 CA LEU A 135 -5.075 2.277 -0.809 1.00 0.51 C ATOM 2006 C LEU A 135 -5.765 1.216 -0.008 1.00 41.15 C ATOM 2007 O LEU A 135 -6.125 1.446 1.138 1.00 1.32 O ATOM 2008 CB LEU A 135 -3.550 2.194 -0.551 1.00 25.33 C ATOM 2009 CG LEU A 135 -2.607 2.915 -1.527 1.00 1.20 C ATOM 2010 CD1 LEU A 135 -2.790 4.423 -1.514 1.00 63.12 C ATOM 2011 CD2 LEU A 135 -1.160 2.554 -1.233 1.00 4.53 C ATOM 0 H LEU A 135 -5.542 3.743 0.570 1.00 31.24 H new ATOM 0 HA LEU A 135 -5.224 2.144 -1.881 1.00 0.51 H new ATOM 0 HB2 LEU A 135 -3.360 2.587 0.448 1.00 25.33 H new ATOM 0 HB3 LEU A 135 -3.272 1.140 -0.537 1.00 25.33 H new ATOM 0 HG LEU A 135 -2.868 2.573 -2.529 1.00 1.20 H new ATOM 0 HD11 LEU A 135 -2.098 4.880 -2.222 1.00 63.12 H new ATOM 0 HD12 LEU A 135 -3.814 4.668 -1.797 1.00 63.12 H new ATOM 0 HD13 LEU A 135 -2.589 4.805 -0.513 1.00 63.12 H new ATOM 0 HD21 LEU A 135 -0.506 3.073 -1.933 1.00 4.53 H new ATOM 0 HD22 LEU A 135 -0.910 2.852 -0.215 1.00 4.53 H new ATOM 0 HD23 LEU A 135 -1.025 1.478 -1.340 1.00 4.53 H new ATOM 2023 N VAL A 136 -5.988 0.098 -0.590 1.00 71.20 N ATOM 2024 CA VAL A 136 -6.636 -0.983 0.116 1.00 34.14 C ATOM 2025 C VAL A 136 -5.801 -2.254 0.019 1.00 64.14 C ATOM 2026 O VAL A 136 -5.321 -2.618 -1.062 1.00 65.33 O ATOM 2027 CB VAL A 136 -8.132 -1.184 -0.326 1.00 44.23 C ATOM 2028 CG1 VAL A 136 -8.263 -1.390 -1.814 1.00 13.25 C ATOM 2029 CG2 VAL A 136 -8.800 -2.327 0.431 1.00 42.23 C ATOM 0 H VAL A 136 -5.737 -0.110 -1.557 1.00 71.20 H new ATOM 0 HA VAL A 136 -6.693 -0.713 1.170 1.00 34.14 H new ATOM 0 HB VAL A 136 -8.651 -0.260 -0.071 1.00 44.23 H new ATOM 0 HG11 VAL A 136 -9.314 -1.524 -2.072 1.00 13.25 H new ATOM 0 HG12 VAL A 136 -7.869 -0.519 -2.338 1.00 13.25 H new ATOM 0 HG13 VAL A 136 -7.701 -2.276 -2.110 1.00 13.25 H new ATOM 0 HG21 VAL A 136 -9.832 -2.432 0.095 1.00 42.23 H new ATOM 0 HG22 VAL A 136 -8.260 -3.255 0.240 1.00 42.23 H new ATOM 0 HG23 VAL A 136 -8.786 -2.113 1.500 1.00 42.23 H new ATOM 2039 N PHE A 137 -5.580 -2.875 1.154 1.00 40.32 N ATOM 2040 CA PHE A 137 -4.752 -4.059 1.266 1.00 23.32 C ATOM 2041 C PHE A 137 -5.619 -5.305 1.258 1.00 61.24 C ATOM 2042 O PHE A 137 -6.534 -5.429 2.069 1.00 74.32 O ATOM 2043 CB PHE A 137 -3.954 -3.964 2.569 1.00 1.31 C ATOM 2044 CG PHE A 137 -3.057 -5.132 2.896 1.00 11.21 C ATOM 2045 CD1 PHE A 137 -1.806 -5.252 2.315 1.00 10.12 C ATOM 2046 CD2 PHE A 137 -3.458 -6.090 3.815 1.00 51.54 C ATOM 2047 CE1 PHE A 137 -0.977 -6.304 2.640 1.00 15.10 C ATOM 2048 CE2 PHE A 137 -2.632 -7.143 4.148 1.00 5.54 C ATOM 2049 CZ PHE A 137 -1.389 -7.250 3.562 1.00 55.45 C ATOM 0 H PHE A 137 -5.976 -2.568 2.042 1.00 40.32 H new ATOM 0 HA PHE A 137 -4.068 -4.123 0.420 1.00 23.32 H new ATOM 0 HB2 PHE A 137 -3.341 -3.064 2.529 1.00 1.31 H new ATOM 0 HB3 PHE A 137 -4.658 -3.834 3.391 1.00 1.31 H new ATOM 0 HD1 PHE A 137 -1.476 -4.513 1.599 1.00 10.12 H new ATOM 0 HD2 PHE A 137 -4.431 -6.010 4.277 1.00 51.54 H new ATOM 0 HE1 PHE A 137 -0.006 -6.390 2.175 1.00 15.10 H new ATOM 0 HE2 PHE A 137 -2.958 -7.881 4.866 1.00 5.54 H new ATOM 0 HZ PHE A 137 -0.737 -8.071 3.822 1.00 55.45 H new ATOM 2059 N LEU A 138 -5.335 -6.218 0.357 1.00 43.05 N ATOM 2060 CA LEU A 138 -6.092 -7.443 0.248 1.00 1.33 C ATOM 2061 C LEU A 138 -5.175 -8.641 0.250 1.00 21.34 C ATOM 2062 O LEU A 138 -4.063 -8.603 -0.294 1.00 22.20 O ATOM 2063 CB LEU A 138 -6.934 -7.522 -1.048 1.00 52.03 C ATOM 2064 CG LEU A 138 -8.062 -6.508 -1.284 1.00 52.22 C ATOM 2065 CD1 LEU A 138 -8.983 -6.376 -0.084 1.00 44.51 C ATOM 2066 CD2 LEU A 138 -7.548 -5.166 -1.773 1.00 52.00 C ATOM 0 H LEU A 138 -4.575 -6.132 -0.318 1.00 43.05 H new ATOM 0 HA LEU A 138 -6.759 -7.447 1.110 1.00 1.33 H new ATOM 0 HB2 LEU A 138 -6.245 -7.445 -1.889 1.00 52.03 H new ATOM 0 HB3 LEU A 138 -7.377 -8.517 -1.089 1.00 52.03 H new ATOM 0 HG LEU A 138 -8.670 -6.912 -2.094 1.00 52.22 H new ATOM 0 HD11 LEU A 138 -9.763 -5.647 -0.303 1.00 44.51 H new ATOM 0 HD12 LEU A 138 -9.439 -7.342 0.132 1.00 44.51 H new ATOM 0 HD13 LEU A 138 -8.408 -6.044 0.781 1.00 44.51 H new ATOM 0 HD21 LEU A 138 -8.388 -4.488 -1.923 1.00 52.00 H new ATOM 0 HD22 LEU A 138 -6.869 -4.744 -1.032 1.00 52.00 H new ATOM 0 HD23 LEU A 138 -7.017 -5.301 -2.716 1.00 52.00 H new ATOM 2078 N ALA A 139 -5.631 -9.693 0.855 1.00 63.42 N ATOM 2079 CA ALA A 139 -4.954 -10.959 0.797 1.00 73.21 C ATOM 2080 C ALA A 139 -5.449 -11.669 -0.445 1.00 51.21 C ATOM 2081 O ALA A 139 -6.457 -12.385 -0.416 1.00 5.21 O ATOM 2082 CB ALA A 139 -5.202 -11.791 2.053 1.00 73.34 C ATOM 0 H ALA A 139 -6.488 -9.702 1.407 1.00 63.42 H new ATOM 0 HA ALA A 139 -3.875 -10.810 0.749 1.00 73.21 H new ATOM 0 HB1 ALA A 139 -4.673 -12.741 1.971 1.00 73.34 H new ATOM 0 HB2 ALA A 139 -4.840 -11.249 2.926 1.00 73.34 H new ATOM 0 HB3 ALA A 139 -6.270 -11.979 2.160 1.00 73.34 H new ATOM 2088 N GLY A 140 -4.806 -11.373 -1.543 1.00 21.42 N ATOM 2089 CA GLY A 140 -5.224 -11.876 -2.825 1.00 52.41 C ATOM 2090 C GLY A 140 -4.890 -13.332 -3.051 1.00 21.42 C ATOM 2091 O GLY A 140 -4.417 -14.017 -2.135 1.00 34.24 O ATOM 0 H GLY A 140 -3.979 -10.777 -1.574 1.00 21.42 H new ATOM 0 HA2 GLY A 140 -6.301 -11.741 -2.923 1.00 52.41 H new ATOM 0 HA3 GLY A 140 -4.755 -11.280 -3.608 1.00 52.41 H new ATOM 2095 N PRO A 141 -5.140 -13.830 -4.264 1.00 4.20 N ATOM 2096 CA PRO A 141 -4.885 -15.212 -4.610 1.00 52.11 C ATOM 2097 C PRO A 141 -3.401 -15.529 -4.716 1.00 74.12 C ATOM 2098 O PRO A 141 -2.593 -14.729 -5.234 1.00 54.14 O ATOM 2099 CB PRO A 141 -5.560 -15.385 -5.969 1.00 0.21 C ATOM 2100 CG PRO A 141 -5.595 -14.022 -6.558 1.00 20.44 C ATOM 2101 CD PRO A 141 -5.703 -13.071 -5.403 1.00 72.21 C ATOM 0 HA PRO A 141 -5.266 -15.886 -3.843 1.00 52.11 H new ATOM 0 HB2 PRO A 141 -5.001 -16.074 -6.602 1.00 0.21 H new ATOM 0 HB3 PRO A 141 -6.565 -15.794 -5.861 1.00 0.21 H new ATOM 0 HG2 PRO A 141 -4.695 -13.826 -7.141 1.00 20.44 H new ATOM 0 HG3 PRO A 141 -6.443 -13.912 -7.234 1.00 20.44 H new ATOM 0 HD2 PRO A 141 -5.144 -12.154 -5.587 1.00 72.21 H new ATOM 0 HD3 PRO A 141 -6.738 -12.782 -5.218 1.00 72.21 H new ATOM 2109 N ALA A 142 -3.055 -16.678 -4.232 1.00 63.24 N ATOM 2110 CA ALA A 142 -1.717 -17.173 -4.301 1.00 3.54 C ATOM 2111 C ALA A 142 -1.643 -18.151 -5.457 1.00 64.22 C ATOM 2112 O ALA A 142 -2.162 -19.260 -5.371 1.00 70.11 O ATOM 2113 CB ALA A 142 -1.360 -17.860 -2.984 1.00 35.31 C ATOM 0 H ALA A 142 -3.707 -17.311 -3.769 1.00 63.24 H new ATOM 0 HA ALA A 142 -1.007 -16.361 -4.461 1.00 3.54 H new ATOM 0 HB1 ALA A 142 -0.339 -18.238 -3.036 1.00 35.31 H new ATOM 0 HB2 ALA A 142 -1.441 -17.144 -2.166 1.00 35.31 H new ATOM 0 HB3 ALA A 142 -2.045 -18.689 -2.809 1.00 35.31 H new ATOM 2119 N GLU A 143 -1.066 -17.731 -6.548 1.00 21.43 N ATOM 2120 CA GLU A 143 -0.969 -18.585 -7.708 1.00 34.13 C ATOM 2121 C GLU A 143 0.389 -19.256 -7.706 1.00 41.22 C ATOM 2122 O GLU A 143 0.485 -20.408 -7.259 1.00 37.42 O ATOM 2123 CB GLU A 143 -1.210 -17.787 -9.005 1.00 13.32 C ATOM 2124 CG GLU A 143 -1.319 -18.642 -10.267 1.00 32.41 C ATOM 2125 CD GLU A 143 -1.602 -17.817 -11.501 1.00 61.34 C ATOM 2126 OE1 GLU A 143 -2.737 -17.297 -11.643 1.00 1.32 O ATOM 2127 OE2 GLU A 143 -0.707 -17.665 -12.362 1.00 62.24 O ATOM 2128 OXT GLU A 143 1.400 -18.609 -8.091 1.00 37.42 O ATOM 0 H GLU A 143 -0.655 -16.805 -6.663 1.00 21.43 H new ATOM 0 HA GLU A 143 -1.743 -19.351 -7.666 1.00 34.13 H new ATOM 0 HB2 GLU A 143 -2.126 -17.207 -8.894 1.00 13.32 H new ATOM 0 HB3 GLU A 143 -0.396 -17.074 -9.134 1.00 13.32 H new ATOM 0 HG2 GLU A 143 -0.391 -19.195 -10.409 1.00 32.41 H new ATOM 0 HG3 GLU A 143 -2.112 -19.378 -10.136 1.00 32.41 H new TER 2135 GLU A 143