USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1077 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 Single : A 3 THR OG1 : rot 166:sc= 1.3 USER MOD Single : A 9 SER OG : rot 180:sc= 0.101 USER MOD Single : A 10 ASN : amide:sc= 0.124 K(o=0.12,f=-4.6!) USER MOD Single : A 24 LYS NZ :NH3+ -130:sc= -1.18 (180deg=-3.88!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.254 X(o=-0.25,f=-0.3) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 33:sc= 0.355 USER MOD Single : A 34 THR OG1 : rot 110:sc= 0.00318 USER MOD Single : A 37 LYS NZ :NH3+ -152:sc= 0.266 (180deg=0.0218) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 179:sc= 1.13 (180deg=1.12) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot -131:sc= -0.399 USER MOD Single : A 74 GLN : amide:sc= 0.177 X(o=0.18,f=-0.029) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 144:sc= -2.17! (180deg=-5.66!) USER MOD Single : A 87 GLN : amide:sc= -1.23 K(o=-1.2,f=0) USER MOD Single : A 89 GLN : amide:sc= 0.00614 X(o=0.0061,f=-0.3) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.207 K(o=-0.21,f=-2.4!) USER MOD Single : A 100 LYS NZ :NH3+ -134:sc= 1.02 (180deg=0.0229) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0.0659 (180deg=0.0659) USER MOD Single : A 109 THR OG1 : rot 130:sc= 0.818 USER MOD Single : A 111 ASN : amide:sc= 0.316 K(o=0.32,f=-6.8!) USER MOD Single : A 116 LYS NZ :NH3+ -142:sc= 0.532 (180deg=-0.0777) USER MOD Single : A 117 LYS NZ :NH3+ -164:sc= -0.0785 (180deg=-0.374) USER MOD Single : A 120 LYS NZ :NH3+ -165:sc= -0.0456 (180deg=-0.205) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -1.581 -13.492 -0.702 1.00 11.24 N ATOM 21 CA GLY A 2 -0.352 -12.709 -0.566 1.00 52.42 C ATOM 22 C GLY A 2 -0.482 -11.389 -1.299 1.00 71.44 C ATOM 23 O GLY A 2 0.231 -11.124 -2.273 1.00 15.35 O ATOM 0 HA2 GLY A 2 -0.144 -12.528 0.488 1.00 52.42 H new ATOM 0 HA3 GLY A 2 0.492 -13.272 -0.965 1.00 52.42 H new ATOM 27 N THR A 3 -1.451 -10.587 -0.856 1.00 73.32 N ATOM 28 CA THR A 3 -1.741 -9.267 -1.422 1.00 30.03 C ATOM 29 C THR A 3 -1.058 -8.173 -0.592 1.00 32.03 C ATOM 30 O THR A 3 -0.997 -8.256 0.641 1.00 14.42 O ATOM 31 CB THR A 3 -3.285 -9.033 -1.475 1.00 21.13 C ATOM 32 OG1 THR A 3 -3.868 -9.551 -0.274 1.00 64.14 O ATOM 33 CG2 THR A 3 -3.937 -9.713 -2.690 1.00 70.22 C ATOM 0 H THR A 3 -2.066 -10.839 -0.082 1.00 73.32 H new ATOM 0 HA THR A 3 -1.349 -9.224 -2.438 1.00 30.03 H new ATOM 0 HB THR A 3 -3.461 -7.961 -1.568 1.00 21.13 H new ATOM 0 HG1 THR A 3 -4.784 -9.215 -0.184 1.00 64.14 H new ATOM 0 HG21 THR A 3 -5.010 -9.521 -2.682 1.00 70.22 H new ATOM 0 HG22 THR A 3 -3.504 -9.313 -3.607 1.00 70.22 H new ATOM 0 HG23 THR A 3 -3.760 -10.788 -2.644 1.00 70.22 H new ATOM 41 N VAL A 4 -0.538 -7.155 -1.291 1.00 54.10 N ATOM 42 CA VAL A 4 0.162 -6.018 -0.692 1.00 52.21 C ATOM 43 C VAL A 4 -0.567 -4.751 -1.148 1.00 65.35 C ATOM 44 O VAL A 4 -0.590 -4.458 -2.344 1.00 31.34 O ATOM 45 CB VAL A 4 1.684 -5.969 -1.148 1.00 3.13 C ATOM 46 CG1 VAL A 4 2.467 -4.861 -0.407 1.00 13.01 C ATOM 47 CG2 VAL A 4 2.373 -7.345 -0.976 1.00 32.52 C ATOM 0 H VAL A 4 -0.595 -7.101 -2.308 1.00 54.10 H new ATOM 0 HA VAL A 4 0.159 -6.107 0.394 1.00 52.21 H new ATOM 0 HB VAL A 4 1.691 -5.724 -2.210 1.00 3.13 H new ATOM 0 HG11 VAL A 4 3.503 -4.859 -0.746 1.00 13.01 H new ATOM 0 HG12 VAL A 4 2.014 -3.892 -0.618 1.00 13.01 H new ATOM 0 HG13 VAL A 4 2.436 -5.049 0.666 1.00 13.01 H new ATOM 0 HG21 VAL A 4 3.412 -7.274 -1.297 1.00 32.52 H new ATOM 0 HG22 VAL A 4 2.337 -7.642 0.072 1.00 32.52 H new ATOM 0 HG23 VAL A 4 1.856 -8.089 -1.582 1.00 32.52 H new ATOM 57 N VAL A 5 -1.188 -4.021 -0.210 1.00 71.23 N ATOM 58 CA VAL A 5 -1.945 -2.790 -0.510 1.00 72.23 C ATOM 59 C VAL A 5 -1.303 -1.601 0.220 1.00 74.02 C ATOM 60 O VAL A 5 -1.236 -1.562 1.446 1.00 54.43 O ATOM 61 CB VAL A 5 -3.489 -2.940 -0.176 1.00 72.35 C ATOM 62 CG1 VAL A 5 -4.177 -3.896 -1.184 1.00 21.14 C ATOM 63 CG2 VAL A 5 -3.733 -3.427 1.276 1.00 3.15 C ATOM 0 H VAL A 5 -1.181 -4.265 0.780 1.00 71.23 H new ATOM 0 HA VAL A 5 -1.894 -2.604 -1.583 1.00 72.23 H new ATOM 0 HB VAL A 5 -3.930 -1.947 -0.266 1.00 72.35 H new ATOM 0 HG11 VAL A 5 -5.235 -3.985 -0.937 1.00 21.14 H new ATOM 0 HG12 VAL A 5 -4.072 -3.498 -2.193 1.00 21.14 H new ATOM 0 HG13 VAL A 5 -3.708 -4.879 -1.131 1.00 21.14 H new ATOM 0 HG21 VAL A 5 -4.805 -3.514 1.455 1.00 3.15 H new ATOM 0 HG22 VAL A 5 -3.261 -4.399 1.418 1.00 3.15 H new ATOM 0 HG23 VAL A 5 -3.305 -2.711 1.977 1.00 3.15 H new ATOM 73 N ILE A 6 -0.782 -0.647 -0.556 1.00 54.41 N ATOM 74 CA ILE A 6 0.011 0.480 -0.036 1.00 14.11 C ATOM 75 C ILE A 6 -0.868 1.737 -0.027 1.00 1.13 C ATOM 76 O ILE A 6 -1.304 2.169 -1.088 1.00 60.10 O ATOM 77 CB ILE A 6 1.284 0.731 -0.939 1.00 34.12 C ATOM 78 CG1 ILE A 6 2.064 -0.598 -1.234 1.00 32.12 C ATOM 79 CG2 ILE A 6 2.223 1.784 -0.307 1.00 12.32 C ATOM 80 CD1 ILE A 6 2.719 -1.252 -0.037 1.00 20.44 C ATOM 0 H ILE A 6 -0.897 -0.631 -1.569 1.00 54.41 H new ATOM 0 HA ILE A 6 0.348 0.246 0.974 1.00 14.11 H new ATOM 0 HB ILE A 6 0.924 1.121 -1.891 1.00 34.12 H new ATOM 0 HG12 ILE A 6 1.373 -1.312 -1.682 1.00 32.12 H new ATOM 0 HG13 ILE A 6 2.833 -0.389 -1.977 1.00 32.12 H new ATOM 0 HG21 ILE A 6 3.089 1.934 -0.952 1.00 12.32 H new ATOM 0 HG22 ILE A 6 1.688 2.727 -0.193 1.00 12.32 H new ATOM 0 HG23 ILE A 6 2.555 1.435 0.671 1.00 12.32 H new ATOM 0 HD11 ILE A 6 3.230 -2.162 -0.353 1.00 20.44 H new ATOM 0 HD12 ILE A 6 3.441 -0.565 0.403 1.00 20.44 H new ATOM 0 HD13 ILE A 6 1.958 -1.502 0.703 1.00 20.44 H new ATOM 92 N VAL A 7 -1.147 2.302 1.158 1.00 51.33 N ATOM 93 CA VAL A 7 -1.919 3.553 1.283 1.00 43.32 C ATOM 94 C VAL A 7 -0.955 4.744 1.208 1.00 65.32 C ATOM 95 O VAL A 7 -0.115 4.941 2.099 1.00 0.00 O ATOM 96 CB VAL A 7 -2.745 3.611 2.620 1.00 44.35 C ATOM 97 CG1 VAL A 7 -3.599 4.903 2.716 1.00 64.33 C ATOM 98 CG2 VAL A 7 -3.621 2.358 2.763 1.00 1.41 C ATOM 0 H VAL A 7 -0.848 1.910 2.051 1.00 51.33 H new ATOM 0 HA VAL A 7 -2.636 3.593 0.463 1.00 43.32 H new ATOM 0 HB VAL A 7 -2.036 3.635 3.448 1.00 44.35 H new ATOM 0 HG11 VAL A 7 -4.154 4.904 3.654 1.00 64.33 H new ATOM 0 HG12 VAL A 7 -2.945 5.775 2.680 1.00 64.33 H new ATOM 0 HG13 VAL A 7 -4.298 4.940 1.881 1.00 64.33 H new ATOM 0 HG21 VAL A 7 -4.186 2.413 3.693 1.00 1.41 H new ATOM 0 HG22 VAL A 7 -4.312 2.299 1.922 1.00 1.41 H new ATOM 0 HG23 VAL A 7 -2.988 1.471 2.776 1.00 1.41 H new ATOM 108 N VAL A 8 -1.073 5.506 0.113 1.00 22.12 N ATOM 109 CA VAL A 8 -0.214 6.652 -0.195 1.00 2.31 C ATOM 110 C VAL A 8 -1.058 7.941 -0.177 1.00 74.51 C ATOM 111 O VAL A 8 -2.123 8.004 -0.819 1.00 23.33 O ATOM 112 CB VAL A 8 0.467 6.523 -1.613 1.00 35.11 C ATOM 113 CG1 VAL A 8 1.552 7.604 -1.805 1.00 33.13 C ATOM 114 CG2 VAL A 8 1.003 5.095 -1.878 1.00 65.35 C ATOM 0 H VAL A 8 -1.785 5.337 -0.598 1.00 22.12 H new ATOM 0 HA VAL A 8 0.571 6.683 0.561 1.00 2.31 H new ATOM 0 HB VAL A 8 -0.303 6.698 -2.364 1.00 35.11 H new ATOM 0 HG11 VAL A 8 2.006 7.493 -2.790 1.00 33.13 H new ATOM 0 HG12 VAL A 8 1.100 8.592 -1.723 1.00 33.13 H new ATOM 0 HG13 VAL A 8 2.318 7.491 -1.038 1.00 33.13 H new ATOM 0 HG21 VAL A 8 1.462 5.056 -2.866 1.00 65.35 H new ATOM 0 HG22 VAL A 8 1.745 4.839 -1.122 1.00 65.35 H new ATOM 0 HG23 VAL A 8 0.179 4.383 -1.833 1.00 65.35 H new ATOM 124 N SER A 9 -0.554 8.954 0.532 1.00 72.13 N ATOM 125 CA SER A 9 -1.174 10.287 0.642 1.00 71.45 C ATOM 126 C SER A 9 -0.175 11.242 1.307 1.00 31.23 C ATOM 127 O SER A 9 0.688 10.807 2.073 1.00 54.41 O ATOM 128 CB SER A 9 -2.500 10.221 1.453 1.00 31.13 C ATOM 129 OG SER A 9 -3.051 11.512 1.685 1.00 51.35 O ATOM 0 H SER A 9 0.316 8.874 1.059 1.00 72.13 H new ATOM 0 HA SER A 9 -1.422 10.654 -0.354 1.00 71.45 H new ATOM 0 HB2 SER A 9 -3.224 9.610 0.914 1.00 31.13 H new ATOM 0 HB3 SER A 9 -2.316 9.729 2.408 1.00 31.13 H new ATOM 0 HG SER A 9 -3.883 11.426 2.195 1.00 51.35 H new ATOM 135 N ASN A 10 -0.312 12.546 1.021 1.00 60.00 N ATOM 136 CA ASN A 10 0.558 13.604 1.588 1.00 32.40 C ATOM 137 C ASN A 10 -0.107 14.273 2.797 1.00 42.23 C ATOM 138 O ASN A 10 0.433 15.235 3.355 1.00 52.40 O ATOM 139 CB ASN A 10 0.921 14.649 0.492 1.00 51.53 C ATOM 140 CG ASN A 10 1.966 14.143 -0.505 1.00 60.51 C ATOM 141 OD1 ASN A 10 2.889 13.414 -0.139 1.00 22.41 O ATOM 142 ND2 ASN A 10 1.838 14.522 -1.764 1.00 73.32 N ATOM 0 H ASN A 10 -1.029 12.904 0.389 1.00 60.00 H new ATOM 0 HA ASN A 10 1.482 13.142 1.937 1.00 32.40 H new ATOM 0 HB2 ASN A 10 0.017 14.926 -0.050 1.00 51.53 H new ATOM 0 HB3 ASN A 10 1.295 15.553 0.972 1.00 51.53 H new ATOM 0 HD21 ASN A 10 2.514 14.210 -2.462 1.00 73.32 H new ATOM 0 HD22 ASN A 10 1.063 15.126 -2.038 1.00 73.32 H new ATOM 149 N ASP A 11 -1.276 13.744 3.204 1.00 63.34 N ATOM 150 CA ASP A 11 -2.030 14.228 4.369 1.00 32.31 C ATOM 151 C ASP A 11 -1.903 13.211 5.515 1.00 60.00 C ATOM 152 O ASP A 11 -2.250 12.033 5.347 1.00 25.54 O ATOM 153 CB ASP A 11 -3.516 14.432 3.999 1.00 21.14 C ATOM 154 CG ASP A 11 -3.710 15.425 2.850 1.00 20.31 C ATOM 155 OD1 ASP A 11 -3.623 16.650 3.095 1.00 12.42 O ATOM 156 OD2 ASP A 11 -3.912 14.990 1.691 1.00 15.44 O ATOM 0 H ASP A 11 -1.725 12.962 2.727 1.00 63.34 H new ATOM 0 HA ASP A 11 -1.621 15.186 4.689 1.00 32.31 H new ATOM 0 HB2 ASP A 11 -3.952 13.472 3.721 1.00 21.14 H new ATOM 0 HB3 ASP A 11 -4.059 14.787 4.875 1.00 21.14 H new ATOM 161 N GLU A 12 -1.420 13.692 6.672 1.00 13.43 N ATOM 162 CA GLU A 12 -1.176 12.880 7.880 1.00 44.43 C ATOM 163 C GLU A 12 -2.476 12.293 8.434 1.00 13.24 C ATOM 164 O GLU A 12 -2.570 11.091 8.682 1.00 53.15 O ATOM 165 CB GLU A 12 -0.478 13.758 8.956 1.00 15.35 C ATOM 166 CG GLU A 12 0.931 14.246 8.567 1.00 70.51 C ATOM 167 CD GLU A 12 1.907 13.087 8.318 1.00 41.23 C ATOM 168 OE1 GLU A 12 2.525 12.598 9.287 1.00 43.33 O ATOM 169 OE2 GLU A 12 2.040 12.632 7.157 1.00 2.14 O ATOM 0 H GLU A 12 -1.183 14.676 6.799 1.00 13.43 H new ATOM 0 HA GLU A 12 -0.530 12.045 7.611 1.00 44.43 H new ATOM 0 HB2 GLU A 12 -1.105 14.625 9.162 1.00 15.35 H new ATOM 0 HB3 GLU A 12 -0.408 13.188 9.883 1.00 15.35 H new ATOM 0 HG2 GLU A 12 0.864 14.860 7.669 1.00 70.51 H new ATOM 0 HG3 GLU A 12 1.323 14.883 9.360 1.00 70.51 H new ATOM 176 N ARG A 13 -3.476 13.168 8.590 1.00 71.34 N ATOM 177 CA ARG A 13 -4.772 12.820 9.184 1.00 75.03 C ATOM 178 C ARG A 13 -5.570 11.877 8.283 1.00 52.42 C ATOM 179 O ARG A 13 -6.429 11.165 8.768 1.00 55.43 O ATOM 180 CB ARG A 13 -5.601 14.085 9.499 1.00 3.14 C ATOM 181 CG ARG A 13 -4.901 15.096 10.438 1.00 34.45 C ATOM 182 CD ARG A 13 -5.821 16.266 10.837 1.00 74.40 C ATOM 183 NE ARG A 13 -6.366 16.978 9.657 1.00 51.50 N ATOM 184 CZ ARG A 13 -7.672 17.205 9.405 1.00 64.11 C ATOM 185 NH1 ARG A 13 -8.624 16.786 10.243 1.00 25.41 N ATOM 186 NH2 ARG A 13 -8.013 17.848 8.296 1.00 54.41 N ATOM 0 H ARG A 13 -3.408 14.145 8.305 1.00 71.34 H new ATOM 0 HA ARG A 13 -4.564 12.300 10.119 1.00 75.03 H new ATOM 0 HB2 ARG A 13 -5.844 14.587 8.562 1.00 3.14 H new ATOM 0 HB3 ARG A 13 -6.545 13.782 9.952 1.00 3.14 H new ATOM 0 HG2 ARG A 13 -4.565 14.579 11.337 1.00 34.45 H new ATOM 0 HG3 ARG A 13 -4.012 15.489 9.945 1.00 34.45 H new ATOM 0 HD2 ARG A 13 -6.644 15.888 11.443 1.00 74.40 H new ATOM 0 HD3 ARG A 13 -5.264 16.968 11.458 1.00 74.40 H new ATOM 0 HE ARG A 13 -5.694 17.328 8.974 1.00 51.50 H new ATOM 0 HH11 ARG A 13 -8.370 16.283 11.093 1.00 25.41 H new ATOM 0 HH12 ARG A 13 -9.605 16.969 10.033 1.00 25.41 H new ATOM 0 HH21 ARG A 13 -7.292 18.164 7.647 1.00 54.41 H new ATOM 0 HH22 ARG A 13 -8.996 18.027 8.092 1.00 54.41 H new ATOM 200 N ILE A 14 -5.315 11.917 6.962 1.00 5.31 N ATOM 201 CA ILE A 14 -5.936 10.982 6.007 1.00 73.34 C ATOM 202 C ILE A 14 -5.301 9.586 6.156 1.00 72.31 C ATOM 203 O ILE A 14 -6.000 8.588 6.108 1.00 75.23 O ATOM 204 CB ILE A 14 -5.853 11.533 4.527 1.00 10.21 C ATOM 205 CG1 ILE A 14 -6.684 12.858 4.403 1.00 42.21 C ATOM 206 CG2 ILE A 14 -6.301 10.492 3.470 1.00 21.14 C ATOM 207 CD1 ILE A 14 -8.131 12.765 4.875 1.00 1.03 C ATOM 0 H ILE A 14 -4.681 12.590 6.531 1.00 5.31 H new ATOM 0 HA ILE A 14 -6.998 10.890 6.236 1.00 73.34 H new ATOM 0 HB ILE A 14 -4.805 11.744 4.317 1.00 10.21 H new ATOM 0 HG12 ILE A 14 -6.182 13.638 4.975 1.00 42.21 H new ATOM 0 HG13 ILE A 14 -6.679 13.175 3.360 1.00 42.21 H new ATOM 0 HG21 ILE A 14 -6.222 10.928 2.474 1.00 21.14 H new ATOM 0 HG22 ILE A 14 -5.661 9.612 3.533 1.00 21.14 H new ATOM 0 HG23 ILE A 14 -7.335 10.203 3.659 1.00 21.14 H new ATOM 0 HD11 ILE A 14 -8.618 13.732 4.748 1.00 1.03 H new ATOM 0 HD12 ILE A 14 -8.658 12.013 4.287 1.00 1.03 H new ATOM 0 HD13 ILE A 14 -8.153 12.483 5.928 1.00 1.03 H new ATOM 219 N LEU A 15 -3.982 9.528 6.406 1.00 61.32 N ATOM 220 CA LEU A 15 -3.290 8.251 6.709 1.00 20.22 C ATOM 221 C LEU A 15 -3.776 7.668 8.058 1.00 43.11 C ATOM 222 O LEU A 15 -3.927 6.459 8.198 1.00 61.53 O ATOM 223 CB LEU A 15 -1.754 8.458 6.710 1.00 11.04 C ATOM 224 CG LEU A 15 -1.131 8.793 5.320 1.00 61.24 C ATOM 225 CD1 LEU A 15 0.355 9.183 5.457 1.00 71.01 C ATOM 226 CD2 LEU A 15 -1.328 7.614 4.330 1.00 55.30 C ATOM 0 H LEU A 15 -3.370 10.344 6.406 1.00 61.32 H new ATOM 0 HA LEU A 15 -3.536 7.530 5.929 1.00 20.22 H new ATOM 0 HB2 LEU A 15 -1.512 9.264 7.403 1.00 11.04 H new ATOM 0 HB3 LEU A 15 -1.281 7.554 7.094 1.00 11.04 H new ATOM 0 HG LEU A 15 -1.654 9.657 4.910 1.00 61.24 H new ATOM 0 HD11 LEU A 15 0.764 9.411 4.473 1.00 71.01 H new ATOM 0 HD12 LEU A 15 0.443 10.060 6.099 1.00 71.01 H new ATOM 0 HD13 LEU A 15 0.910 8.354 5.897 1.00 71.01 H new ATOM 0 HD21 LEU A 15 -0.886 7.870 3.367 1.00 55.30 H new ATOM 0 HD22 LEU A 15 -0.844 6.721 4.726 1.00 55.30 H new ATOM 0 HD23 LEU A 15 -2.393 7.422 4.200 1.00 55.30 H new ATOM 238 N GLU A 16 -4.040 8.558 9.029 1.00 52.11 N ATOM 239 CA GLU A 16 -4.548 8.181 10.364 1.00 55.05 C ATOM 240 C GLU A 16 -6.021 7.728 10.296 1.00 12.14 C ATOM 241 O GLU A 16 -6.377 6.709 10.880 1.00 70.45 O ATOM 242 CB GLU A 16 -4.380 9.372 11.336 1.00 62.20 C ATOM 243 CG GLU A 16 -2.912 9.768 11.583 1.00 74.32 C ATOM 244 CD GLU A 16 -2.778 10.965 12.525 1.00 45.14 C ATOM 245 OE1 GLU A 16 -2.861 12.116 12.048 1.00 1.41 O ATOM 246 OE2 GLU A 16 -2.625 10.759 13.752 1.00 13.11 O ATOM 0 H GLU A 16 -3.908 9.563 8.913 1.00 52.11 H new ATOM 0 HA GLU A 16 -3.967 7.335 10.733 1.00 55.05 H new ATOM 0 HB2 GLU A 16 -4.917 10.233 10.938 1.00 62.20 H new ATOM 0 HB3 GLU A 16 -4.844 9.120 12.289 1.00 62.20 H new ATOM 0 HG2 GLU A 16 -2.376 8.917 12.003 1.00 74.32 H new ATOM 0 HG3 GLU A 16 -2.438 10.005 10.630 1.00 74.32 H new ATOM 253 N GLU A 17 -6.842 8.479 9.540 1.00 24.53 N ATOM 254 CA GLU A 17 -8.279 8.190 9.343 1.00 44.32 C ATOM 255 C GLU A 17 -8.461 6.822 8.660 1.00 43.42 C ATOM 256 O GLU A 17 -9.175 5.951 9.162 1.00 64.31 O ATOM 257 CB GLU A 17 -8.914 9.322 8.478 1.00 43.05 C ATOM 258 CG GLU A 17 -10.391 9.118 8.074 1.00 11.30 C ATOM 259 CD GLU A 17 -11.337 8.936 9.272 1.00 70.20 C ATOM 260 OE1 GLU A 17 -11.502 9.890 10.057 1.00 75.51 O ATOM 261 OE2 GLU A 17 -11.938 7.846 9.422 1.00 41.22 O ATOM 0 H GLU A 17 -6.526 9.312 9.043 1.00 24.53 H new ATOM 0 HA GLU A 17 -8.779 8.153 10.311 1.00 44.32 H new ATOM 0 HB2 GLU A 17 -8.835 10.260 9.028 1.00 43.05 H new ATOM 0 HB3 GLU A 17 -8.322 9.434 7.570 1.00 43.05 H new ATOM 0 HG2 GLU A 17 -10.721 9.976 7.488 1.00 11.30 H new ATOM 0 HG3 GLU A 17 -10.465 8.244 7.427 1.00 11.30 H new ATOM 268 N LEU A 18 -7.738 6.654 7.543 1.00 14.24 N ATOM 269 CA LEU A 18 -7.777 5.446 6.702 1.00 31.13 C ATOM 270 C LEU A 18 -7.184 4.235 7.455 1.00 1.54 C ATOM 271 O LEU A 18 -7.593 3.095 7.205 1.00 41.12 O ATOM 272 CB LEU A 18 -7.044 5.719 5.349 1.00 61.14 C ATOM 273 CG LEU A 18 -7.890 6.404 4.205 1.00 22.12 C ATOM 274 CD1 LEU A 18 -8.611 7.692 4.665 1.00 13.32 C ATOM 275 CD2 LEU A 18 -7.012 6.677 2.965 1.00 52.41 C ATOM 0 H LEU A 18 -7.098 7.366 7.191 1.00 14.24 H new ATOM 0 HA LEU A 18 -8.814 5.197 6.475 1.00 31.13 H new ATOM 0 HB2 LEU A 18 -6.177 6.348 5.553 1.00 61.14 H new ATOM 0 HB3 LEU A 18 -6.666 4.769 4.970 1.00 61.14 H new ATOM 0 HG LEU A 18 -8.674 5.696 3.936 1.00 22.12 H new ATOM 0 HD11 LEU A 18 -9.174 8.112 3.831 1.00 13.32 H new ATOM 0 HD12 LEU A 18 -9.294 7.455 5.481 1.00 13.32 H new ATOM 0 HD13 LEU A 18 -7.874 8.419 5.008 1.00 13.32 H new ATOM 0 HD21 LEU A 18 -7.615 7.149 2.189 1.00 52.41 H new ATOM 0 HD22 LEU A 18 -6.191 7.339 3.239 1.00 52.41 H new ATOM 0 HD23 LEU A 18 -6.610 5.736 2.590 1.00 52.41 H new ATOM 287 N LEU A 19 -6.229 4.501 8.382 1.00 12.54 N ATOM 288 CA LEU A 19 -5.664 3.476 9.287 1.00 71.44 C ATOM 289 C LEU A 19 -6.775 2.866 10.147 1.00 74.13 C ATOM 290 O LEU A 19 -6.942 1.653 10.188 1.00 4.31 O ATOM 291 CB LEU A 19 -4.578 4.087 10.215 1.00 30.15 C ATOM 292 CG LEU A 19 -3.850 3.087 11.172 1.00 23.23 C ATOM 293 CD1 LEU A 19 -2.875 2.175 10.403 1.00 52.12 C ATOM 294 CD2 LEU A 19 -3.152 3.824 12.333 1.00 74.23 C ATOM 0 H LEU A 19 -5.832 5.430 8.520 1.00 12.54 H new ATOM 0 HA LEU A 19 -5.205 2.702 8.672 1.00 71.44 H new ATOM 0 HB2 LEU A 19 -3.828 4.573 9.591 1.00 30.15 H new ATOM 0 HB3 LEU A 19 -5.042 4.865 10.821 1.00 30.15 H new ATOM 0 HG LEU A 19 -4.611 2.442 11.612 1.00 23.23 H new ATOM 0 HD11 LEU A 19 -2.387 1.494 11.100 1.00 52.12 H new ATOM 0 HD12 LEU A 19 -3.425 1.600 9.658 1.00 52.12 H new ATOM 0 HD13 LEU A 19 -2.121 2.785 9.906 1.00 52.12 H new ATOM 0 HD21 LEU A 19 -2.656 3.099 12.978 1.00 74.23 H new ATOM 0 HD22 LEU A 19 -2.413 4.518 11.932 1.00 74.23 H new ATOM 0 HD23 LEU A 19 -3.893 4.377 12.911 1.00 74.23 H new ATOM 306 N GLU A 20 -7.548 3.756 10.789 1.00 4.14 N ATOM 307 CA GLU A 20 -8.615 3.386 11.734 1.00 5.32 C ATOM 308 C GLU A 20 -9.721 2.564 11.055 1.00 23.11 C ATOM 309 O GLU A 20 -10.317 1.699 11.688 1.00 23.14 O ATOM 310 CB GLU A 20 -9.203 4.665 12.365 1.00 15.30 C ATOM 311 CG GLU A 20 -8.164 5.499 13.134 1.00 70.10 C ATOM 312 CD GLU A 20 -8.740 6.824 13.645 1.00 50.45 C ATOM 313 OE1 GLU A 20 -9.551 6.802 14.600 1.00 70.43 O ATOM 314 OE2 GLU A 20 -8.405 7.894 13.088 1.00 25.54 O ATOM 0 H GLU A 20 -7.449 4.764 10.666 1.00 4.14 H new ATOM 0 HA GLU A 20 -8.181 2.758 12.512 1.00 5.32 H new ATOM 0 HB2 GLU A 20 -9.643 5.280 11.580 1.00 15.30 H new ATOM 0 HB3 GLU A 20 -10.010 4.389 13.043 1.00 15.30 H new ATOM 0 HG2 GLU A 20 -7.790 4.919 13.978 1.00 70.10 H new ATOM 0 HG3 GLU A 20 -7.313 5.703 12.484 1.00 70.10 H new ATOM 321 N VAL A 21 -9.959 2.839 9.758 1.00 71.51 N ATOM 322 CA VAL A 21 -10.960 2.124 8.944 1.00 33.32 C ATOM 323 C VAL A 21 -10.532 0.653 8.725 1.00 2.14 C ATOM 324 O VAL A 21 -11.362 -0.264 8.779 1.00 62.11 O ATOM 325 CB VAL A 21 -11.201 2.848 7.565 1.00 24.44 C ATOM 326 CG1 VAL A 21 -12.289 2.142 6.732 1.00 52.31 C ATOM 327 CG2 VAL A 21 -11.563 4.335 7.782 1.00 33.41 C ATOM 0 H VAL A 21 -9.461 3.566 9.244 1.00 71.51 H new ATOM 0 HA VAL A 21 -11.903 2.132 9.490 1.00 33.32 H new ATOM 0 HB VAL A 21 -10.269 2.795 7.003 1.00 24.44 H new ATOM 0 HG11 VAL A 21 -12.426 2.671 5.789 1.00 52.31 H new ATOM 0 HG12 VAL A 21 -11.984 1.115 6.531 1.00 52.31 H new ATOM 0 HG13 VAL A 21 -13.228 2.140 7.286 1.00 52.31 H new ATOM 0 HG21 VAL A 21 -11.725 4.815 6.817 1.00 33.41 H new ATOM 0 HG22 VAL A 21 -12.472 4.405 8.379 1.00 33.41 H new ATOM 0 HG23 VAL A 21 -10.747 4.836 8.304 1.00 33.41 H new ATOM 337 N VAL A 22 -9.216 0.452 8.521 1.00 14.42 N ATOM 338 CA VAL A 22 -8.611 -0.883 8.350 1.00 70.11 C ATOM 339 C VAL A 22 -8.613 -1.642 9.702 1.00 2.25 C ATOM 340 O VAL A 22 -9.004 -2.810 9.768 1.00 3.23 O ATOM 341 CB VAL A 22 -7.141 -0.767 7.775 1.00 12.40 C ATOM 342 CG1 VAL A 22 -6.465 -2.146 7.626 1.00 50.45 C ATOM 343 CG2 VAL A 22 -7.130 -0.009 6.423 1.00 65.24 C ATOM 0 H VAL A 22 -8.540 1.214 8.470 1.00 14.42 H new ATOM 0 HA VAL A 22 -9.207 -1.445 7.631 1.00 70.11 H new ATOM 0 HB VAL A 22 -6.562 -0.195 8.500 1.00 12.40 H new ATOM 0 HG11 VAL A 22 -5.458 -2.017 7.228 1.00 50.45 H new ATOM 0 HG12 VAL A 22 -6.411 -2.632 8.600 1.00 50.45 H new ATOM 0 HG13 VAL A 22 -7.048 -2.765 6.944 1.00 50.45 H new ATOM 0 HG21 VAL A 22 -6.108 0.056 6.051 1.00 65.24 H new ATOM 0 HG22 VAL A 22 -7.746 -0.545 5.701 1.00 65.24 H new ATOM 0 HG23 VAL A 22 -7.529 0.995 6.566 1.00 65.24 H new ATOM 353 N LEU A 23 -8.218 -0.941 10.787 1.00 24.02 N ATOM 354 CA LEU A 23 -8.125 -1.531 12.145 1.00 4.01 C ATOM 355 C LEU A 23 -9.502 -1.983 12.695 1.00 41.40 C ATOM 356 O LEU A 23 -9.607 -3.071 13.278 1.00 55.22 O ATOM 357 CB LEU A 23 -7.408 -0.545 13.127 1.00 44.41 C ATOM 358 CG LEU A 23 -5.842 -0.641 13.173 1.00 35.00 C ATOM 359 CD1 LEU A 23 -5.197 -0.382 11.802 1.00 3.32 C ATOM 360 CD2 LEU A 23 -5.258 0.297 14.247 1.00 24.31 C ATOM 0 H LEU A 23 -7.956 0.044 10.750 1.00 24.02 H new ATOM 0 HA LEU A 23 -7.520 -2.434 12.063 1.00 4.01 H new ATOM 0 HB2 LEU A 23 -7.682 0.474 12.853 1.00 44.41 H new ATOM 0 HB3 LEU A 23 -7.793 -0.719 14.132 1.00 44.41 H new ATOM 0 HG LEU A 23 -5.598 -1.667 13.448 1.00 35.00 H new ATOM 0 HD11 LEU A 23 -4.113 -0.460 11.889 1.00 3.32 H new ATOM 0 HD12 LEU A 23 -5.558 -1.120 11.085 1.00 3.32 H new ATOM 0 HD13 LEU A 23 -5.462 0.618 11.458 1.00 3.32 H new ATOM 0 HD21 LEU A 23 -4.172 0.209 14.255 1.00 24.31 H new ATOM 0 HD22 LEU A 23 -5.537 1.326 14.022 1.00 24.31 H new ATOM 0 HD23 LEU A 23 -5.652 0.020 15.225 1.00 24.31 H new ATOM 372 N LYS A 24 -10.554 -1.163 12.492 1.00 54.22 N ATOM 373 CA LYS A 24 -11.919 -1.475 13.004 1.00 42.33 C ATOM 374 C LYS A 24 -12.561 -2.613 12.202 1.00 21.01 C ATOM 375 O LYS A 24 -13.443 -3.324 12.706 1.00 23.53 O ATOM 376 CB LYS A 24 -12.827 -0.197 13.029 1.00 60.34 C ATOM 377 CG LYS A 24 -13.202 0.462 11.664 1.00 52.44 C ATOM 378 CD LYS A 24 -14.373 -0.196 10.875 1.00 45.25 C ATOM 379 CE LYS A 24 -15.726 -0.223 11.629 1.00 5.43 C ATOM 380 NZ LYS A 24 -15.775 -1.255 12.699 1.00 75.53 N ATOM 0 H LYS A 24 -10.493 -0.283 11.981 1.00 54.22 H new ATOM 0 HA LYS A 24 -11.819 -1.817 14.034 1.00 42.33 H new ATOM 0 HB2 LYS A 24 -13.754 -0.456 13.541 1.00 60.34 H new ATOM 0 HB3 LYS A 24 -12.327 0.556 13.637 1.00 60.34 H new ATOM 0 HG2 LYS A 24 -13.458 1.506 11.847 1.00 52.44 H new ATOM 0 HG3 LYS A 24 -12.317 0.458 11.028 1.00 52.44 H new ATOM 0 HD2 LYS A 24 -14.507 0.340 9.935 1.00 45.25 H new ATOM 0 HD3 LYS A 24 -14.093 -1.219 10.622 1.00 45.25 H new ATOM 0 HE2 LYS A 24 -15.910 0.757 12.069 1.00 5.43 H new ATOM 0 HE3 LYS A 24 -16.529 -0.409 10.916 1.00 5.43 H new ATOM 0 HZ1 LYS A 24 -16.641 -1.822 12.595 1.00 75.53 H new ATOM 0 HZ2 LYS A 24 -14.944 -1.875 12.621 1.00 75.53 H new ATOM 0 HZ3 LYS A 24 -15.775 -0.791 13.630 1.00 75.53 H new ATOM 394 N SER A 25 -12.135 -2.738 10.936 1.00 44.41 N ATOM 395 CA SER A 25 -12.569 -3.808 10.039 1.00 33.11 C ATOM 396 C SER A 25 -11.963 -5.149 10.485 1.00 41.11 C ATOM 397 O SER A 25 -12.666 -6.164 10.548 1.00 4.43 O ATOM 398 CB SER A 25 -12.159 -3.456 8.592 1.00 71.13 C ATOM 399 OG SER A 25 -12.494 -4.488 7.675 1.00 43.35 O ATOM 0 H SER A 25 -11.474 -2.091 10.507 1.00 44.41 H new ATOM 0 HA SER A 25 -13.654 -3.907 10.077 1.00 33.11 H new ATOM 0 HB2 SER A 25 -12.651 -2.531 8.291 1.00 71.13 H new ATOM 0 HB3 SER A 25 -11.085 -3.273 8.554 1.00 71.13 H new ATOM 0 HG SER A 25 -12.219 -4.225 6.772 1.00 43.35 H new ATOM 405 N ASP A 26 -10.660 -5.115 10.835 1.00 51.34 N ATOM 406 CA ASP A 26 -9.917 -6.285 11.345 1.00 53.43 C ATOM 407 C ASP A 26 -8.524 -5.831 11.848 1.00 62.10 C ATOM 408 O ASP A 26 -7.736 -5.326 11.048 1.00 44.50 O ATOM 409 CB ASP A 26 -9.758 -7.384 10.250 1.00 13.31 C ATOM 410 CG ASP A 26 -9.181 -8.698 10.812 1.00 4.45 C ATOM 411 OD1 ASP A 26 -7.939 -8.866 10.840 1.00 1.14 O ATOM 412 OD2 ASP A 26 -9.977 -9.573 11.231 1.00 21.30 O ATOM 0 H ASP A 26 -10.092 -4.270 10.771 1.00 51.34 H new ATOM 0 HA ASP A 26 -10.484 -6.719 12.168 1.00 53.43 H new ATOM 0 HB2 ASP A 26 -10.729 -7.582 9.795 1.00 13.31 H new ATOM 0 HB3 ASP A 26 -9.105 -7.013 9.460 1.00 13.31 H new ATOM 417 N PRO A 27 -8.195 -6.016 13.171 1.00 73.51 N ATOM 418 CA PRO A 27 -6.904 -5.541 13.763 1.00 12.05 C ATOM 419 C PRO A 27 -5.679 -6.403 13.364 1.00 55.13 C ATOM 420 O PRO A 27 -4.539 -5.924 13.394 1.00 52.52 O ATOM 421 CB PRO A 27 -7.176 -5.637 15.285 1.00 10.03 C ATOM 422 CG PRO A 27 -8.164 -6.756 15.427 1.00 23.32 C ATOM 423 CD PRO A 27 -9.052 -6.683 14.199 1.00 71.30 C ATOM 0 HA PRO A 27 -6.640 -4.544 13.411 1.00 12.05 H new ATOM 0 HB2 PRO A 27 -6.260 -5.845 15.838 1.00 10.03 H new ATOM 0 HB3 PRO A 27 -7.578 -4.702 15.675 1.00 10.03 H new ATOM 0 HG2 PRO A 27 -7.658 -7.719 15.486 1.00 23.32 H new ATOM 0 HG3 PRO A 27 -8.750 -6.647 16.340 1.00 23.32 H new ATOM 0 HD2 PRO A 27 -9.366 -7.675 13.874 1.00 71.30 H new ATOM 0 HD3 PRO A 27 -9.958 -6.110 14.395 1.00 71.30 H new ATOM 431 N ASN A 28 -5.929 -7.669 12.989 1.00 24.31 N ATOM 432 CA ASN A 28 -4.870 -8.662 12.705 1.00 5.22 C ATOM 433 C ASN A 28 -4.307 -8.488 11.278 1.00 45.32 C ATOM 434 O ASN A 28 -3.230 -9.011 10.953 1.00 63.33 O ATOM 435 CB ASN A 28 -5.443 -10.081 12.933 1.00 4.02 C ATOM 436 CG ASN A 28 -4.450 -11.220 12.714 1.00 0.41 C ATOM 437 OD1 ASN A 28 -3.241 -11.080 12.915 1.00 4.30 O ATOM 438 ND2 ASN A 28 -4.961 -12.369 12.327 1.00 53.04 N ATOM 0 H ASN A 28 -6.873 -8.037 12.873 1.00 24.31 H new ATOM 0 HA ASN A 28 -4.032 -8.507 13.384 1.00 5.22 H new ATOM 0 HB2 ASN A 28 -5.825 -10.143 13.952 1.00 4.02 H new ATOM 0 HB3 ASN A 28 -6.292 -10.226 12.265 1.00 4.02 H new ATOM 0 HD21 ASN A 28 -4.353 -13.176 12.185 1.00 53.04 H new ATOM 0 HD22 ASN A 28 -5.965 -12.453 12.169 1.00 53.04 H new ATOM 445 N VAL A 29 -5.043 -7.755 10.427 1.00 54.13 N ATOM 446 CA VAL A 29 -4.526 -7.278 9.137 1.00 2.45 C ATOM 447 C VAL A 29 -3.315 -6.356 9.390 1.00 44.44 C ATOM 448 O VAL A 29 -3.435 -5.324 10.059 1.00 25.41 O ATOM 449 CB VAL A 29 -5.651 -6.560 8.307 1.00 43.52 C ATOM 450 CG1 VAL A 29 -5.090 -5.824 7.072 1.00 43.55 C ATOM 451 CG2 VAL A 29 -6.723 -7.586 7.883 1.00 11.10 C ATOM 0 H VAL A 29 -6.007 -7.479 10.613 1.00 54.13 H new ATOM 0 HA VAL A 29 -4.197 -8.128 8.539 1.00 2.45 H new ATOM 0 HB VAL A 29 -6.102 -5.803 8.949 1.00 43.52 H new ATOM 0 HG11 VAL A 29 -5.907 -5.344 6.532 1.00 43.55 H new ATOM 0 HG12 VAL A 29 -4.374 -5.068 7.393 1.00 43.55 H new ATOM 0 HG13 VAL A 29 -4.593 -6.539 6.417 1.00 43.55 H new ATOM 0 HG21 VAL A 29 -7.501 -7.083 7.308 1.00 11.10 H new ATOM 0 HG22 VAL A 29 -6.263 -8.361 7.270 1.00 11.10 H new ATOM 0 HG23 VAL A 29 -7.164 -8.039 8.771 1.00 11.10 H new ATOM 461 N LYS A 30 -2.152 -6.776 8.871 1.00 15.30 N ATOM 462 CA LYS A 30 -0.847 -6.218 9.249 1.00 34.52 C ATOM 463 C LYS A 30 -0.633 -4.806 8.656 1.00 11.50 C ATOM 464 O LYS A 30 -0.288 -4.663 7.480 1.00 23.14 O ATOM 465 CB LYS A 30 0.272 -7.201 8.809 1.00 34.21 C ATOM 466 CG LYS A 30 1.689 -6.832 9.291 1.00 63.43 C ATOM 467 CD LYS A 30 1.801 -6.765 10.835 1.00 40.22 C ATOM 468 CE LYS A 30 3.207 -6.369 11.298 1.00 60.34 C ATOM 469 NZ LYS A 30 3.305 -6.224 12.774 1.00 64.01 N ATOM 0 H LYS A 30 -2.091 -7.517 8.173 1.00 15.30 H new ATOM 0 HA LYS A 30 -0.812 -6.101 10.332 1.00 34.52 H new ATOM 0 HB2 LYS A 30 0.026 -8.197 9.179 1.00 34.21 H new ATOM 0 HB3 LYS A 30 0.278 -7.258 7.720 1.00 34.21 H new ATOM 0 HG2 LYS A 30 2.399 -7.566 8.912 1.00 63.43 H new ATOM 0 HG3 LYS A 30 1.972 -5.868 8.869 1.00 63.43 H new ATOM 0 HD2 LYS A 30 1.078 -6.045 11.219 1.00 40.22 H new ATOM 0 HD3 LYS A 30 1.541 -7.735 11.259 1.00 40.22 H new ATOM 0 HE2 LYS A 30 3.921 -7.121 10.963 1.00 60.34 H new ATOM 0 HE3 LYS A 30 3.489 -5.428 10.825 1.00 60.34 H new ATOM 0 HZ1 LYS A 30 4.276 -5.956 13.033 1.00 64.01 H new ATOM 0 HZ2 LYS A 30 2.645 -5.487 13.095 1.00 64.01 H new ATOM 0 HZ3 LYS A 30 3.063 -7.128 13.228 1.00 64.01 H new ATOM 483 N THR A 31 -0.886 -3.774 9.482 1.00 1.41 N ATOM 484 CA THR A 31 -0.682 -2.364 9.111 1.00 13.14 C ATOM 485 C THR A 31 0.667 -1.857 9.660 1.00 2.43 C ATOM 486 O THR A 31 0.856 -1.774 10.880 1.00 22.31 O ATOM 487 CB THR A 31 -1.847 -1.464 9.638 1.00 40.14 C ATOM 488 OG1 THR A 31 -1.967 -1.591 11.066 1.00 50.41 O ATOM 489 CG2 THR A 31 -3.187 -1.824 8.984 1.00 20.51 C ATOM 0 H THR A 31 -1.240 -3.897 10.431 1.00 1.41 H new ATOM 0 HA THR A 31 -0.672 -2.302 8.023 1.00 13.14 H new ATOM 0 HB THR A 31 -1.604 -0.434 9.375 1.00 40.14 H new ATOM 0 HG1 THR A 31 -1.081 -1.741 11.457 1.00 50.41 H new ATOM 0 HG21 THR A 31 -3.970 -1.176 9.378 1.00 20.51 H new ATOM 0 HG22 THR A 31 -3.113 -1.690 7.905 1.00 20.51 H new ATOM 0 HG23 THR A 31 -3.432 -2.863 9.204 1.00 20.51 H new ATOM 497 N VAL A 32 1.609 -1.544 8.750 1.00 11.03 N ATOM 498 CA VAL A 32 2.953 -1.045 9.102 1.00 50.13 C ATOM 499 C VAL A 32 3.180 0.309 8.408 1.00 44.04 C ATOM 500 O VAL A 32 3.087 0.392 7.182 1.00 45.12 O ATOM 501 CB VAL A 32 4.093 -2.054 8.669 1.00 2.42 C ATOM 502 CG1 VAL A 32 5.455 -1.676 9.293 1.00 25.45 C ATOM 503 CG2 VAL A 32 3.723 -3.517 8.994 1.00 72.42 C ATOM 0 H VAL A 32 1.459 -1.630 7.745 1.00 11.03 H new ATOM 0 HA VAL A 32 3.001 -0.938 10.186 1.00 50.13 H new ATOM 0 HB VAL A 32 4.189 -1.974 7.586 1.00 2.42 H new ATOM 0 HG11 VAL A 32 6.213 -2.391 8.973 1.00 25.45 H new ATOM 0 HG12 VAL A 32 5.740 -0.676 8.967 1.00 25.45 H new ATOM 0 HG13 VAL A 32 5.375 -1.694 10.380 1.00 25.45 H new ATOM 0 HG21 VAL A 32 4.533 -4.175 8.680 1.00 72.42 H new ATOM 0 HG22 VAL A 32 3.565 -3.622 10.067 1.00 72.42 H new ATOM 0 HG23 VAL A 32 2.810 -3.788 8.464 1.00 72.42 H new ATOM 513 N ARG A 33 3.445 1.370 9.187 1.00 44.12 N ATOM 514 CA ARG A 33 3.764 2.702 8.642 1.00 74.35 C ATOM 515 C ARG A 33 5.277 2.943 8.740 1.00 30.34 C ATOM 516 O ARG A 33 5.806 3.127 9.845 1.00 74.32 O ATOM 517 CB ARG A 33 2.973 3.821 9.379 1.00 14.00 C ATOM 518 CG ARG A 33 3.241 5.236 8.816 1.00 2.10 C ATOM 519 CD ARG A 33 2.296 6.313 9.365 1.00 34.21 C ATOM 520 NE ARG A 33 2.584 7.624 8.765 1.00 33.23 N ATOM 521 CZ ARG A 33 1.777 8.693 8.806 1.00 0.43 C ATOM 522 NH1 ARG A 33 0.594 8.644 9.429 1.00 63.04 N ATOM 523 NH2 ARG A 33 2.162 9.815 8.214 1.00 2.12 N ATOM 0 H ARG A 33 3.445 1.331 10.206 1.00 44.12 H new ATOM 0 HA ARG A 33 3.463 2.734 7.595 1.00 74.35 H new ATOM 0 HB2 ARG A 33 1.906 3.607 9.311 1.00 14.00 H new ATOM 0 HB3 ARG A 33 3.234 3.804 10.437 1.00 14.00 H new ATOM 0 HG2 ARG A 33 4.269 5.518 9.044 1.00 2.10 H new ATOM 0 HG3 ARG A 33 3.151 5.207 7.730 1.00 2.10 H new ATOM 0 HD2 ARG A 33 1.263 6.034 9.159 1.00 34.21 H new ATOM 0 HD3 ARG A 33 2.400 6.374 10.448 1.00 34.21 H new ATOM 0 HE ARG A 33 3.473 7.729 8.276 1.00 33.23 H new ATOM 0 HH11 ARG A 33 0.292 7.782 9.884 1.00 63.04 H new ATOM 0 HH12 ARG A 33 -0.006 9.468 9.449 1.00 63.04 H new ATOM 0 HH21 ARG A 33 3.062 9.856 7.736 1.00 2.12 H new ATOM 0 HH22 ARG A 33 1.558 10.637 8.237 1.00 2.12 H new ATOM 537 N THR A 34 5.968 2.925 7.582 1.00 63.44 N ATOM 538 CA THR A 34 7.440 3.019 7.522 1.00 71.24 C ATOM 539 C THR A 34 7.938 3.286 6.085 1.00 31.14 C ATOM 540 O THR A 34 7.241 3.006 5.101 1.00 64.13 O ATOM 541 CB THR A 34 8.119 1.713 8.080 1.00 63.34 C ATOM 542 OG1 THR A 34 9.551 1.783 7.954 1.00 74.43 O ATOM 543 CG2 THR A 34 7.593 0.452 7.376 1.00 50.01 C ATOM 0 H THR A 34 5.524 2.845 6.667 1.00 63.44 H new ATOM 0 HA THR A 34 7.725 3.863 8.150 1.00 71.24 H new ATOM 0 HB THR A 34 7.859 1.645 9.136 1.00 63.34 H new ATOM 0 HG1 THR A 34 9.953 1.877 8.843 1.00 74.43 H new ATOM 0 HG21 THR A 34 8.086 -0.428 7.789 1.00 50.01 H new ATOM 0 HG22 THR A 34 6.517 0.371 7.530 1.00 50.01 H new ATOM 0 HG23 THR A 34 7.802 0.517 6.308 1.00 50.01 H new ATOM 551 N ASP A 35 9.170 3.801 6.003 1.00 4.31 N ATOM 552 CA ASP A 35 9.879 4.108 4.746 1.00 0.01 C ATOM 553 C ASP A 35 11.350 3.646 4.834 1.00 75.34 C ATOM 554 O ASP A 35 12.174 4.012 3.986 1.00 5.24 O ATOM 555 CB ASP A 35 9.816 5.635 4.480 1.00 42.44 C ATOM 556 CG ASP A 35 10.498 6.463 5.595 1.00 71.00 C ATOM 557 OD1 ASP A 35 9.910 6.603 6.688 1.00 35.24 O ATOM 558 OD2 ASP A 35 11.633 6.958 5.398 1.00 32.51 O ATOM 0 H ASP A 35 9.721 4.024 6.832 1.00 4.31 H new ATOM 0 HA ASP A 35 9.399 3.577 3.925 1.00 0.01 H new ATOM 0 HB2 ASP A 35 10.295 5.854 3.526 1.00 42.44 H new ATOM 0 HB3 ASP A 35 8.774 5.942 4.391 1.00 42.44 H new ATOM 563 N ASP A 36 11.671 2.821 5.859 1.00 10.23 N ATOM 564 CA ASP A 36 13.038 2.307 6.099 1.00 33.20 C ATOM 565 C ASP A 36 13.463 1.265 5.008 1.00 11.10 C ATOM 566 O ASP A 36 14.617 0.809 4.976 1.00 11.10 O ATOM 567 CB ASP A 36 13.103 1.717 7.538 1.00 70.00 C ATOM 568 CG ASP A 36 14.493 1.182 7.943 1.00 42.41 C ATOM 569 OD1 ASP A 36 15.390 2.007 8.236 1.00 11.10 O ATOM 570 OD2 ASP A 36 14.689 -0.054 7.977 1.00 34.25 O ATOM 0 H ASP A 36 10.988 2.494 6.542 1.00 10.23 H new ATOM 0 HA ASP A 36 13.755 3.124 6.021 1.00 33.20 H new ATOM 0 HB2 ASP A 36 12.802 2.488 8.248 1.00 70.00 H new ATOM 0 HB3 ASP A 36 12.377 0.908 7.619 1.00 70.00 H new ATOM 575 N LYS A 37 12.489 0.902 4.137 1.00 72.33 N ATOM 576 CA LYS A 37 12.694 0.160 2.871 1.00 72.01 C ATOM 577 C LYS A 37 12.860 -1.345 3.136 1.00 64.23 C ATOM 578 O LYS A 37 11.938 -2.126 2.874 1.00 61.34 O ATOM 579 CB LYS A 37 13.866 0.752 2.016 1.00 23.54 C ATOM 580 CG LYS A 37 13.884 0.296 0.539 1.00 54.33 C ATOM 581 CD LYS A 37 14.993 0.974 -0.310 1.00 12.10 C ATOM 582 CE LYS A 37 14.883 2.504 -0.377 1.00 64.33 C ATOM 583 NZ LYS A 37 15.862 3.101 -1.334 1.00 52.44 N ATOM 0 H LYS A 37 11.508 1.126 4.303 1.00 72.33 H new ATOM 0 HA LYS A 37 11.795 0.286 2.268 1.00 72.01 H new ATOM 0 HB2 LYS A 37 13.805 1.840 2.045 1.00 23.54 H new ATOM 0 HB3 LYS A 37 14.812 0.473 2.479 1.00 23.54 H new ATOM 0 HG2 LYS A 37 14.021 -0.785 0.503 1.00 54.33 H new ATOM 0 HG3 LYS A 37 12.914 0.509 0.090 1.00 54.33 H new ATOM 0 HD2 LYS A 37 15.966 0.708 0.103 1.00 12.10 H new ATOM 0 HD3 LYS A 37 14.957 0.573 -1.323 1.00 12.10 H new ATOM 0 HE2 LYS A 37 13.872 2.781 -0.675 1.00 64.33 H new ATOM 0 HE3 LYS A 37 15.048 2.922 0.616 1.00 64.33 H new ATOM 0 HZ1 LYS A 37 16.099 4.067 -1.031 1.00 52.44 H new ATOM 0 HZ2 LYS A 37 16.726 2.522 -1.353 1.00 52.44 H new ATOM 0 HZ3 LYS A 37 15.444 3.130 -2.286 1.00 52.44 H new ATOM 597 N GLU A 38 14.020 -1.726 3.699 1.00 21.40 N ATOM 598 CA GLU A 38 14.314 -3.118 4.115 1.00 62.23 C ATOM 599 C GLU A 38 13.350 -3.578 5.234 1.00 50.50 C ATOM 600 O GLU A 38 13.078 -4.778 5.375 1.00 62.14 O ATOM 601 CB GLU A 38 15.790 -3.227 4.564 1.00 23.51 C ATOM 602 CG GLU A 38 16.162 -2.311 5.744 1.00 61.32 C ATOM 603 CD GLU A 38 17.655 -2.353 6.096 1.00 63.22 C ATOM 604 OE1 GLU A 38 18.084 -3.308 6.773 1.00 71.13 O ATOM 605 OE2 GLU A 38 18.401 -1.427 5.698 1.00 50.32 O ATOM 0 H GLU A 38 14.786 -1.078 3.881 1.00 21.40 H new ATOM 0 HA GLU A 38 14.160 -3.781 3.264 1.00 62.23 H new ATOM 0 HB2 GLU A 38 15.998 -4.260 4.842 1.00 23.51 H new ATOM 0 HB3 GLU A 38 16.434 -2.989 3.717 1.00 23.51 H new ATOM 0 HG2 GLU A 38 15.881 -1.286 5.502 1.00 61.32 H new ATOM 0 HG3 GLU A 38 15.581 -2.603 6.619 1.00 61.32 H new ATOM 612 N LYS A 39 12.857 -2.592 6.020 1.00 32.15 N ATOM 613 CA LYS A 39 11.805 -2.786 7.030 1.00 34.41 C ATOM 614 C LYS A 39 10.521 -3.333 6.382 1.00 32.22 C ATOM 615 O LYS A 39 9.976 -4.320 6.845 1.00 60.44 O ATOM 616 CB LYS A 39 11.504 -1.439 7.726 1.00 53.41 C ATOM 617 CG LYS A 39 10.388 -1.415 8.813 1.00 20.23 C ATOM 618 CD LYS A 39 10.783 -2.043 10.177 1.00 24.33 C ATOM 619 CE LYS A 39 10.599 -3.565 10.236 1.00 71.24 C ATOM 620 NZ LYS A 39 11.063 -4.136 11.531 1.00 11.43 N ATOM 0 H LYS A 39 13.187 -1.629 5.965 1.00 32.15 H new ATOM 0 HA LYS A 39 12.156 -3.510 7.765 1.00 34.41 H new ATOM 0 HB2 LYS A 39 12.427 -1.086 8.186 1.00 53.41 H new ATOM 0 HB3 LYS A 39 11.236 -0.716 6.955 1.00 53.41 H new ATOM 0 HG2 LYS A 39 10.088 -0.381 8.980 1.00 20.23 H new ATOM 0 HG3 LYS A 39 9.515 -1.942 8.427 1.00 20.23 H new ATOM 0 HD2 LYS A 39 11.825 -1.804 10.388 1.00 24.33 H new ATOM 0 HD3 LYS A 39 10.185 -1.584 10.964 1.00 24.33 H new ATOM 0 HE2 LYS A 39 9.547 -3.808 10.089 1.00 71.24 H new ATOM 0 HE3 LYS A 39 11.150 -4.028 9.418 1.00 71.24 H new ATOM 0 HZ1 LYS A 39 10.920 -5.166 11.527 1.00 11.43 H new ATOM 0 HZ2 LYS A 39 12.074 -3.927 11.660 1.00 11.43 H new ATOM 0 HZ3 LYS A 39 10.520 -3.714 12.311 1.00 11.43 H new ATOM 634 N VAL A 40 10.069 -2.692 5.292 1.00 61.51 N ATOM 635 CA VAL A 40 8.828 -3.103 4.603 1.00 3.14 C ATOM 636 C VAL A 40 9.030 -4.474 3.926 1.00 61.34 C ATOM 637 O VAL A 40 8.126 -5.297 3.909 1.00 62.23 O ATOM 638 CB VAL A 40 8.365 -2.049 3.534 1.00 71.52 C ATOM 639 CG1 VAL A 40 6.986 -2.419 2.932 1.00 44.43 C ATOM 640 CG2 VAL A 40 8.348 -0.617 4.111 1.00 52.25 C ATOM 0 H VAL A 40 10.539 -1.892 4.869 1.00 61.51 H new ATOM 0 HA VAL A 40 8.046 -3.173 5.359 1.00 3.14 H new ATOM 0 HB VAL A 40 9.099 -2.071 2.728 1.00 71.52 H new ATOM 0 HG11 VAL A 40 6.697 -1.668 2.196 1.00 44.43 H new ATOM 0 HG12 VAL A 40 7.050 -3.394 2.449 1.00 44.43 H new ATOM 0 HG13 VAL A 40 6.240 -2.455 3.726 1.00 44.43 H new ATOM 0 HG21 VAL A 40 8.022 0.082 3.341 1.00 52.25 H new ATOM 0 HG22 VAL A 40 7.660 -0.573 4.955 1.00 52.25 H new ATOM 0 HG23 VAL A 40 9.350 -0.348 4.445 1.00 52.25 H new ATOM 650 N LYS A 41 10.254 -4.706 3.409 1.00 72.42 N ATOM 651 CA LYS A 41 10.619 -5.957 2.708 1.00 34.42 C ATOM 652 C LYS A 41 10.551 -7.177 3.651 1.00 71.20 C ATOM 653 O LYS A 41 10.069 -8.240 3.258 1.00 3.35 O ATOM 654 CB LYS A 41 12.034 -5.831 2.082 1.00 34.23 C ATOM 655 CG LYS A 41 12.152 -4.736 1.002 1.00 1.21 C ATOM 656 CD LYS A 41 13.591 -4.585 0.457 1.00 1.13 C ATOM 657 CE LYS A 41 13.728 -3.405 -0.515 1.00 43.41 C ATOM 658 NZ LYS A 41 15.115 -3.271 -1.034 1.00 33.50 N ATOM 0 H LYS A 41 11.018 -4.032 3.465 1.00 72.42 H new ATOM 0 HA LYS A 41 9.893 -6.116 1.911 1.00 34.42 H new ATOM 0 HB2 LYS A 41 12.753 -5.623 2.875 1.00 34.23 H new ATOM 0 HB3 LYS A 41 12.312 -6.790 1.644 1.00 34.23 H new ATOM 0 HG2 LYS A 41 11.479 -4.971 0.178 1.00 1.21 H new ATOM 0 HG3 LYS A 41 11.825 -3.784 1.419 1.00 1.21 H new ATOM 0 HD2 LYS A 41 14.280 -4.447 1.291 1.00 1.13 H new ATOM 0 HD3 LYS A 41 13.883 -5.505 -0.049 1.00 1.13 H new ATOM 0 HE2 LYS A 41 13.040 -3.540 -1.349 1.00 43.41 H new ATOM 0 HE3 LYS A 41 13.439 -2.483 -0.010 1.00 43.41 H new ATOM 0 HZ1 LYS A 41 15.165 -2.463 -1.687 1.00 33.50 H new ATOM 0 HZ2 LYS A 41 15.769 -3.116 -0.240 1.00 33.50 H new ATOM 0 HZ3 LYS A 41 15.382 -4.140 -1.538 1.00 33.50 H new ATOM 672 N GLU A 42 11.031 -7.021 4.902 1.00 62.43 N ATOM 673 CA GLU A 42 10.963 -8.111 5.899 1.00 43.41 C ATOM 674 C GLU A 42 9.501 -8.347 6.335 1.00 12.45 C ATOM 675 O GLU A 42 9.134 -9.470 6.675 1.00 60.21 O ATOM 676 CB GLU A 42 11.892 -7.859 7.119 1.00 44.20 C ATOM 677 CG GLU A 42 11.504 -6.657 7.991 1.00 64.01 C ATOM 678 CD GLU A 42 12.306 -6.551 9.294 1.00 1.44 C ATOM 679 OE1 GLU A 42 11.951 -7.246 10.272 1.00 60.22 O ATOM 680 OE2 GLU A 42 13.277 -5.767 9.356 1.00 55.52 O ATOM 0 H GLU A 42 11.464 -6.163 5.243 1.00 62.43 H new ATOM 0 HA GLU A 42 11.332 -9.018 5.421 1.00 43.41 H new ATOM 0 HB2 GLU A 42 11.900 -8.753 7.742 1.00 44.20 H new ATOM 0 HB3 GLU A 42 12.910 -7.713 6.758 1.00 44.20 H new ATOM 0 HG2 GLU A 42 11.643 -5.742 7.415 1.00 64.01 H new ATOM 0 HG3 GLU A 42 10.443 -6.723 8.233 1.00 64.01 H new ATOM 687 N GLU A 43 8.678 -7.271 6.327 1.00 23.31 N ATOM 688 CA GLU A 43 7.228 -7.371 6.595 1.00 3.20 C ATOM 689 C GLU A 43 6.505 -8.133 5.464 1.00 21.24 C ATOM 690 O GLU A 43 5.552 -8.869 5.725 1.00 72.13 O ATOM 691 CB GLU A 43 6.582 -5.968 6.777 1.00 74.21 C ATOM 692 CG GLU A 43 7.182 -5.110 7.906 1.00 60.03 C ATOM 693 CD GLU A 43 7.270 -5.841 9.256 1.00 4.24 C ATOM 694 OE1 GLU A 43 6.229 -6.005 9.915 1.00 51.02 O ATOM 695 OE2 GLU A 43 8.381 -6.270 9.654 1.00 43.14 O ATOM 0 H GLU A 43 8.998 -6.321 6.137 1.00 23.31 H new ATOM 0 HA GLU A 43 7.114 -7.927 7.526 1.00 3.20 H new ATOM 0 HB2 GLU A 43 6.672 -5.420 5.839 1.00 74.21 H new ATOM 0 HB3 GLU A 43 5.517 -6.098 6.969 1.00 74.21 H new ATOM 0 HG2 GLU A 43 8.180 -4.785 7.613 1.00 60.03 H new ATOM 0 HG3 GLU A 43 6.578 -4.211 8.028 1.00 60.03 H new ATOM 702 N ILE A 44 6.972 -7.929 4.209 1.00 11.04 N ATOM 703 CA ILE A 44 6.463 -8.637 3.013 1.00 21.54 C ATOM 704 C ILE A 44 6.773 -10.149 3.122 1.00 4.34 C ATOM 705 O ILE A 44 5.928 -10.983 2.787 1.00 52.32 O ATOM 706 CB ILE A 44 7.078 -8.034 1.682 1.00 72.04 C ATOM 707 CG1 ILE A 44 6.570 -6.576 1.430 1.00 11.12 C ATOM 708 CG2 ILE A 44 6.792 -8.921 0.447 1.00 5.03 C ATOM 709 CD1 ILE A 44 7.119 -5.926 0.167 1.00 34.44 C ATOM 0 H ILE A 44 7.717 -7.265 3.998 1.00 11.04 H new ATOM 0 HA ILE A 44 5.383 -8.500 2.968 1.00 21.54 H new ATOM 0 HB ILE A 44 8.158 -8.008 1.826 1.00 72.04 H new ATOM 0 HG12 ILE A 44 5.482 -6.589 1.373 1.00 11.12 H new ATOM 0 HG13 ILE A 44 6.837 -5.958 2.287 1.00 11.12 H new ATOM 0 HG21 ILE A 44 7.234 -8.465 -0.439 1.00 5.03 H new ATOM 0 HG22 ILE A 44 7.225 -9.909 0.601 1.00 5.03 H new ATOM 0 HG23 ILE A 44 5.715 -9.015 0.308 1.00 5.03 H new ATOM 0 HD11 ILE A 44 6.715 -4.918 0.071 1.00 34.44 H new ATOM 0 HD12 ILE A 44 8.206 -5.877 0.226 1.00 34.44 H new ATOM 0 HD13 ILE A 44 6.829 -6.517 -0.702 1.00 34.44 H new ATOM 721 N GLU A 45 7.987 -10.471 3.630 1.00 43.13 N ATOM 722 CA GLU A 45 8.417 -11.859 3.897 1.00 1.05 C ATOM 723 C GLU A 45 7.463 -12.550 4.891 1.00 54.41 C ATOM 724 O GLU A 45 7.036 -13.691 4.671 1.00 14.22 O ATOM 725 CB GLU A 45 9.873 -11.887 4.439 1.00 70.10 C ATOM 726 CG GLU A 45 10.356 -13.288 4.861 1.00 1.43 C ATOM 727 CD GLU A 45 11.813 -13.325 5.331 1.00 52.25 C ATOM 728 OE1 GLU A 45 12.068 -13.067 6.528 1.00 11.35 O ATOM 729 OE2 GLU A 45 12.713 -13.614 4.511 1.00 62.44 O ATOM 0 H GLU A 45 8.693 -9.774 3.865 1.00 43.13 H new ATOM 0 HA GLU A 45 8.386 -12.407 2.955 1.00 1.05 H new ATOM 0 HB2 GLU A 45 10.543 -11.498 3.672 1.00 70.10 H new ATOM 0 HB3 GLU A 45 9.945 -11.216 5.295 1.00 70.10 H new ATOM 0 HG2 GLU A 45 9.716 -13.656 5.663 1.00 1.43 H new ATOM 0 HG3 GLU A 45 10.238 -13.971 4.020 1.00 1.43 H new ATOM 736 N LYS A 46 7.124 -11.825 5.970 1.00 52.55 N ATOM 737 CA LYS A 46 6.187 -12.311 6.997 1.00 5.21 C ATOM 738 C LYS A 46 4.767 -12.449 6.408 1.00 51.41 C ATOM 739 O LYS A 46 4.051 -13.384 6.733 1.00 32.20 O ATOM 740 CB LYS A 46 6.166 -11.349 8.212 1.00 34.41 C ATOM 741 CG LYS A 46 7.545 -11.097 8.869 1.00 24.31 C ATOM 742 CD LYS A 46 7.465 -10.128 10.077 1.00 42.22 C ATOM 743 CE LYS A 46 8.845 -9.710 10.605 1.00 2.31 C ATOM 744 NZ LYS A 46 9.617 -8.936 9.601 1.00 52.52 N ATOM 0 H LYS A 46 7.489 -10.891 6.155 1.00 52.55 H new ATOM 0 HA LYS A 46 6.525 -13.291 7.333 1.00 5.21 H new ATOM 0 HB2 LYS A 46 5.752 -10.393 7.892 1.00 34.41 H new ATOM 0 HB3 LYS A 46 5.490 -11.753 8.965 1.00 34.41 H new ATOM 0 HG2 LYS A 46 7.965 -12.047 9.198 1.00 24.31 H new ATOM 0 HG3 LYS A 46 8.228 -10.687 8.125 1.00 24.31 H new ATOM 0 HD2 LYS A 46 6.909 -9.237 9.785 1.00 42.22 H new ATOM 0 HD3 LYS A 46 6.904 -10.604 10.881 1.00 42.22 H new ATOM 0 HE2 LYS A 46 8.721 -9.111 11.507 1.00 2.31 H new ATOM 0 HE3 LYS A 46 9.409 -10.599 10.888 1.00 2.31 H new ATOM 0 HZ1 LYS A 46 10.534 -8.660 10.006 1.00 52.52 H new ATOM 0 HZ2 LYS A 46 9.773 -9.522 8.756 1.00 52.52 H new ATOM 0 HZ3 LYS A 46 9.085 -8.083 9.337 1.00 52.52 H new ATOM 758 N ALA A 47 4.411 -11.519 5.505 1.00 4.33 N ATOM 759 CA ALA A 47 3.053 -11.400 4.935 1.00 10.45 C ATOM 760 C ALA A 47 2.734 -12.519 3.928 1.00 13.35 C ATOM 761 O ALA A 47 1.591 -12.945 3.828 1.00 43.13 O ATOM 762 CB ALA A 47 2.889 -10.029 4.272 1.00 3.22 C ATOM 0 H ALA A 47 5.062 -10.821 5.145 1.00 4.33 H new ATOM 0 HA ALA A 47 2.344 -11.502 5.757 1.00 10.45 H new ATOM 0 HB1 ALA A 47 1.886 -9.945 3.853 1.00 3.22 H new ATOM 0 HB2 ALA A 47 3.039 -9.245 5.015 1.00 3.22 H new ATOM 0 HB3 ALA A 47 3.625 -9.919 3.476 1.00 3.22 H new ATOM 768 N ARG A 48 3.732 -12.944 3.137 1.00 42.42 N ATOM 769 CA ARG A 48 3.553 -14.061 2.183 1.00 62.42 C ATOM 770 C ARG A 48 3.568 -15.421 2.891 1.00 21.34 C ATOM 771 O ARG A 48 2.893 -16.365 2.468 1.00 33.13 O ATOM 772 CB ARG A 48 4.594 -13.982 1.030 1.00 51.11 C ATOM 773 CG ARG A 48 6.097 -13.888 1.405 1.00 71.32 C ATOM 774 CD ARG A 48 6.794 -15.241 1.673 1.00 32.44 C ATOM 775 NE ARG A 48 8.258 -15.091 1.673 1.00 44.03 N ATOM 776 CZ ARG A 48 9.120 -15.750 2.462 1.00 63.43 C ATOM 777 NH1 ARG A 48 8.698 -16.638 3.361 1.00 65.11 N ATOM 778 NH2 ARG A 48 10.413 -15.519 2.331 1.00 35.23 N ATOM 0 H ARG A 48 4.667 -12.537 3.135 1.00 42.42 H new ATOM 0 HA ARG A 48 2.566 -13.961 1.732 1.00 62.42 H new ATOM 0 HB2 ARG A 48 4.462 -14.863 0.401 1.00 51.11 H new ATOM 0 HB3 ARG A 48 4.348 -13.114 0.418 1.00 51.11 H new ATOM 0 HG2 ARG A 48 6.625 -13.379 0.599 1.00 71.32 H new ATOM 0 HG3 ARG A 48 6.195 -13.265 2.294 1.00 71.32 H new ATOM 0 HD2 ARG A 48 6.466 -15.639 2.633 1.00 32.44 H new ATOM 0 HD3 ARG A 48 6.499 -15.963 0.911 1.00 32.44 H new ATOM 0 HE ARG A 48 8.654 -14.424 1.011 1.00 44.03 H new ATOM 0 HH11 ARG A 48 7.701 -16.829 3.460 1.00 65.11 H new ATOM 0 HH12 ARG A 48 9.372 -17.127 3.950 1.00 65.11 H new ATOM 0 HH21 ARG A 48 10.743 -14.848 1.638 1.00 35.23 H new ATOM 0 HH22 ARG A 48 11.082 -16.012 2.923 1.00 35.23 H new ATOM 792 N LYS A 49 4.345 -15.496 3.983 1.00 1.24 N ATOM 793 CA LYS A 49 4.513 -16.725 4.779 1.00 24.20 C ATOM 794 C LYS A 49 3.260 -16.982 5.644 1.00 64.15 C ATOM 795 O LYS A 49 2.801 -18.119 5.779 1.00 60.03 O ATOM 796 CB LYS A 49 5.788 -16.592 5.651 1.00 63.44 C ATOM 797 CG LYS A 49 6.160 -17.852 6.461 1.00 74.04 C ATOM 798 CD LYS A 49 7.473 -17.684 7.261 1.00 0.40 C ATOM 799 CE LYS A 49 7.419 -16.531 8.280 1.00 23.22 C ATOM 800 NZ LYS A 49 8.708 -16.385 9.011 1.00 62.33 N ATOM 0 H LYS A 49 4.877 -14.703 4.341 1.00 1.24 H new ATOM 0 HA LYS A 49 4.630 -17.582 4.116 1.00 24.20 H new ATOM 0 HB2 LYS A 49 6.627 -16.334 5.004 1.00 63.44 H new ATOM 0 HB3 LYS A 49 5.651 -15.761 6.343 1.00 63.44 H new ATOM 0 HG2 LYS A 49 5.348 -18.089 7.149 1.00 74.04 H new ATOM 0 HG3 LYS A 49 6.259 -18.699 5.782 1.00 74.04 H new ATOM 0 HD2 LYS A 49 7.693 -18.614 7.786 1.00 0.40 H new ATOM 0 HD3 LYS A 49 8.294 -17.508 6.566 1.00 0.40 H new ATOM 0 HE2 LYS A 49 7.185 -15.600 7.764 1.00 23.22 H new ATOM 0 HE3 LYS A 49 6.614 -16.712 8.993 1.00 23.22 H new ATOM 0 HZ1 LYS A 49 8.636 -15.599 9.689 1.00 62.33 H new ATOM 0 HZ2 LYS A 49 8.919 -17.266 9.523 1.00 62.33 H new ATOM 0 HZ3 LYS A 49 9.471 -16.188 8.333 1.00 62.33 H new ATOM 814 N GLN A 50 2.708 -15.889 6.187 1.00 22.23 N ATOM 815 CA GLN A 50 1.497 -15.902 7.027 1.00 54.31 C ATOM 816 C GLN A 50 0.250 -15.836 6.129 1.00 41.14 C ATOM 817 O GLN A 50 -0.577 -16.755 6.118 1.00 34.22 O ATOM 818 CB GLN A 50 1.549 -14.691 8.007 1.00 23.25 C ATOM 819 CG GLN A 50 0.383 -14.587 9.014 1.00 31.20 C ATOM 820 CD GLN A 50 0.276 -15.778 9.972 1.00 31.52 C ATOM 821 OE1 GLN A 50 1.269 -16.416 10.322 1.00 61.12 O ATOM 822 NE2 GLN A 50 -0.929 -16.072 10.429 1.00 3.31 N ATOM 0 H GLN A 50 3.094 -14.954 6.054 1.00 22.23 H new ATOM 0 HA GLN A 50 1.448 -16.822 7.610 1.00 54.31 H new ATOM 0 HB2 GLN A 50 2.483 -14.741 8.566 1.00 23.25 H new ATOM 0 HB3 GLN A 50 1.578 -13.774 7.419 1.00 23.25 H new ATOM 0 HG2 GLN A 50 0.502 -13.674 9.598 1.00 31.20 H new ATOM 0 HG3 GLN A 50 -0.552 -14.493 8.462 1.00 31.20 H new ATOM 0 HE21 GLN A 50 -1.737 -15.529 10.124 1.00 3.31 H new ATOM 0 HE22 GLN A 50 -1.051 -16.842 11.086 1.00 3.31 H new ATOM 831 N GLY A 51 0.148 -14.743 5.365 1.00 55.15 N ATOM 832 CA GLY A 51 -1.013 -14.455 4.508 1.00 11.03 C ATOM 833 C GLY A 51 -1.559 -13.057 4.787 1.00 3.34 C ATOM 834 O GLY A 51 -0.833 -12.220 5.346 1.00 50.31 O ATOM 0 H GLY A 51 0.873 -14.027 5.322 1.00 55.15 H new ATOM 0 HA2 GLY A 51 -0.726 -14.536 3.460 1.00 11.03 H new ATOM 0 HA3 GLY A 51 -1.793 -15.196 4.683 1.00 11.03 H new ATOM 838 N ARG A 52 -2.831 -12.815 4.384 1.00 44.10 N ATOM 839 CA ARG A 52 -3.584 -11.559 4.649 1.00 41.50 C ATOM 840 C ARG A 52 -3.097 -10.364 3.772 1.00 44.52 C ATOM 841 O ARG A 52 -1.952 -10.351 3.303 1.00 21.12 O ATOM 842 CB ARG A 52 -3.578 -11.204 6.182 1.00 11.41 C ATOM 843 CG ARG A 52 -4.396 -12.190 7.049 1.00 34.35 C ATOM 844 CD ARG A 52 -4.333 -11.886 8.566 1.00 3.12 C ATOM 845 NE ARG A 52 -5.453 -12.514 9.300 1.00 61.32 N ATOM 846 CZ ARG A 52 -5.559 -13.813 9.641 1.00 32.51 C ATOM 847 NH1 ARG A 52 -4.613 -14.687 9.349 1.00 3.45 N ATOM 848 NH2 ARG A 52 -6.643 -14.224 10.274 1.00 32.10 N ATOM 0 H ARG A 52 -3.374 -13.498 3.856 1.00 44.10 H new ATOM 0 HA ARG A 52 -4.617 -11.744 4.355 1.00 41.50 H new ATOM 0 HB2 ARG A 52 -2.548 -11.188 6.539 1.00 11.41 H new ATOM 0 HB3 ARG A 52 -3.977 -10.199 6.315 1.00 11.41 H new ATOM 0 HG2 ARG A 52 -5.437 -12.167 6.726 1.00 34.35 H new ATOM 0 HG3 ARG A 52 -4.031 -13.202 6.875 1.00 34.35 H new ATOM 0 HD2 ARG A 52 -3.387 -12.246 8.970 1.00 3.12 H new ATOM 0 HD3 ARG A 52 -4.356 -10.807 8.722 1.00 3.12 H new ATOM 0 HE ARG A 52 -6.222 -11.903 9.575 1.00 61.32 H new ATOM 0 HH11 ARG A 52 -3.775 -14.385 8.853 1.00 3.45 H new ATOM 0 HH12 ARG A 52 -4.721 -15.664 9.620 1.00 3.45 H new ATOM 0 HH21 ARG A 52 -7.385 -13.561 10.498 1.00 32.10 H new ATOM 0 HH22 ARG A 52 -6.738 -15.204 10.539 1.00 32.10 H new ATOM 862 N PRO A 53 -3.987 -9.332 3.517 1.00 4.20 N ATOM 863 CA PRO A 53 -3.595 -8.113 2.786 1.00 51.10 C ATOM 864 C PRO A 53 -2.766 -7.181 3.693 1.00 30.42 C ATOM 865 O PRO A 53 -3.325 -6.504 4.559 1.00 24.04 O ATOM 866 CB PRO A 53 -4.951 -7.461 2.360 1.00 20.11 C ATOM 867 CG PRO A 53 -6.052 -8.330 2.936 1.00 52.01 C ATOM 868 CD PRO A 53 -5.408 -9.260 3.941 1.00 2.25 C ATOM 0 HA PRO A 53 -2.962 -8.320 1.923 1.00 51.10 H new ATOM 0 HB2 PRO A 53 -5.026 -6.441 2.737 1.00 20.11 H new ATOM 0 HB3 PRO A 53 -5.030 -7.406 1.274 1.00 20.11 H new ATOM 0 HG2 PRO A 53 -6.816 -7.717 3.414 1.00 52.01 H new ATOM 0 HG3 PRO A 53 -6.546 -8.898 2.148 1.00 52.01 H new ATOM 0 HD2 PRO A 53 -5.501 -8.874 4.956 1.00 2.25 H new ATOM 0 HD3 PRO A 53 -5.877 -10.244 3.930 1.00 2.25 H new ATOM 876 N ILE A 54 -1.436 -7.201 3.529 1.00 11.54 N ATOM 877 CA ILE A 54 -0.532 -6.329 4.303 1.00 13.50 C ATOM 878 C ILE A 54 -0.671 -4.866 3.816 1.00 64.31 C ATOM 879 O ILE A 54 -0.484 -4.573 2.630 1.00 52.52 O ATOM 880 CB ILE A 54 0.968 -6.817 4.244 1.00 74.10 C ATOM 881 CG1 ILE A 54 1.894 -5.866 5.076 1.00 21.22 C ATOM 882 CG2 ILE A 54 1.473 -6.981 2.789 1.00 62.43 C ATOM 883 CD1 ILE A 54 3.358 -6.258 5.105 1.00 44.34 C ATOM 0 H ILE A 54 -0.958 -7.812 2.866 1.00 11.54 H new ATOM 0 HA ILE A 54 -0.828 -6.383 5.351 1.00 13.50 H new ATOM 0 HB ILE A 54 1.008 -7.807 4.697 1.00 74.10 H new ATOM 0 HG12 ILE A 54 1.812 -4.858 4.670 1.00 21.22 H new ATOM 0 HG13 ILE A 54 1.524 -5.828 6.100 1.00 21.22 H new ATOM 0 HG21 ILE A 54 2.509 -7.318 2.799 1.00 62.43 H new ATOM 0 HG22 ILE A 54 0.857 -7.716 2.271 1.00 62.43 H new ATOM 0 HG23 ILE A 54 1.408 -6.024 2.271 1.00 62.43 H new ATOM 0 HD11 ILE A 54 3.915 -5.539 5.705 1.00 44.34 H new ATOM 0 HD12 ILE A 54 3.460 -7.252 5.541 1.00 44.34 H new ATOM 0 HD13 ILE A 54 3.753 -6.266 4.089 1.00 44.34 H new ATOM 895 N VAL A 55 -1.051 -3.969 4.738 1.00 34.25 N ATOM 896 CA VAL A 55 -1.333 -2.561 4.426 1.00 30.43 C ATOM 897 C VAL A 55 -0.175 -1.677 4.919 1.00 71.41 C ATOM 898 O VAL A 55 0.089 -1.620 6.123 1.00 21.35 O ATOM 899 CB VAL A 55 -2.699 -2.075 5.066 1.00 42.10 C ATOM 900 CG1 VAL A 55 -3.193 -0.792 4.373 1.00 3.34 C ATOM 901 CG2 VAL A 55 -3.785 -3.175 5.011 1.00 61.23 C ATOM 0 H VAL A 55 -1.172 -4.201 5.724 1.00 34.25 H new ATOM 0 HA VAL A 55 -1.429 -2.472 3.344 1.00 30.43 H new ATOM 0 HB VAL A 55 -2.509 -1.857 6.117 1.00 42.10 H new ATOM 0 HG11 VAL A 55 -4.132 -0.473 4.825 1.00 3.34 H new ATOM 0 HG12 VAL A 55 -2.448 -0.005 4.490 1.00 3.34 H new ATOM 0 HG13 VAL A 55 -3.349 -0.989 3.312 1.00 3.34 H new ATOM 0 HG21 VAL A 55 -4.705 -2.801 5.460 1.00 61.23 H new ATOM 0 HG22 VAL A 55 -3.973 -3.449 3.973 1.00 61.23 H new ATOM 0 HG23 VAL A 55 -3.443 -4.052 5.561 1.00 61.23 H new ATOM 911 N ILE A 56 0.536 -1.006 3.993 1.00 61.10 N ATOM 912 CA ILE A 56 1.679 -0.136 4.339 1.00 21.04 C ATOM 913 C ILE A 56 1.288 1.338 4.139 1.00 10.04 C ATOM 914 O ILE A 56 0.936 1.745 3.030 1.00 73.01 O ATOM 915 CB ILE A 56 2.957 -0.476 3.480 1.00 0.30 C ATOM 916 CG1 ILE A 56 3.341 -1.989 3.614 1.00 12.11 C ATOM 917 CG2 ILE A 56 4.161 0.439 3.841 1.00 11.14 C ATOM 918 CD1 ILE A 56 3.750 -2.440 5.007 1.00 21.22 C ATOM 0 H ILE A 56 0.338 -1.050 2.993 1.00 61.10 H new ATOM 0 HA ILE A 56 1.929 -0.313 5.385 1.00 21.04 H new ATOM 0 HB ILE A 56 2.704 -0.281 2.438 1.00 0.30 H new ATOM 0 HG12 ILE A 56 2.492 -2.591 3.291 1.00 12.11 H new ATOM 0 HG13 ILE A 56 4.161 -2.200 2.928 1.00 12.11 H new ATOM 0 HG21 ILE A 56 5.020 0.170 3.226 1.00 11.14 H new ATOM 0 HG22 ILE A 56 3.895 1.480 3.658 1.00 11.14 H new ATOM 0 HG23 ILE A 56 4.414 0.309 4.893 1.00 11.14 H new ATOM 0 HD11 ILE A 56 3.995 -3.502 4.988 1.00 21.22 H new ATOM 0 HD12 ILE A 56 4.622 -1.872 5.332 1.00 21.22 H new ATOM 0 HD13 ILE A 56 2.927 -2.270 5.701 1.00 21.22 H new ATOM 930 N PHE A 57 1.339 2.122 5.228 1.00 13.11 N ATOM 931 CA PHE A 57 1.027 3.563 5.210 1.00 60.11 C ATOM 932 C PHE A 57 2.317 4.374 5.039 1.00 73.13 C ATOM 933 O PHE A 57 3.315 4.120 5.722 1.00 4.41 O ATOM 934 CB PHE A 57 0.279 3.968 6.512 1.00 13.05 C ATOM 935 CG PHE A 57 -1.161 3.476 6.560 1.00 20.41 C ATOM 936 CD1 PHE A 57 -1.451 2.126 6.766 1.00 61.20 C ATOM 937 CD2 PHE A 57 -2.222 4.355 6.364 1.00 34.32 C ATOM 938 CE1 PHE A 57 -2.754 1.681 6.770 1.00 12.22 C ATOM 939 CE2 PHE A 57 -3.521 3.903 6.360 1.00 53.14 C ATOM 940 CZ PHE A 57 -3.786 2.569 6.562 1.00 71.14 C ATOM 0 H PHE A 57 1.599 1.774 6.151 1.00 13.11 H new ATOM 0 HA PHE A 57 0.372 3.778 4.365 1.00 60.11 H new ATOM 0 HB2 PHE A 57 0.820 3.571 7.371 1.00 13.05 H new ATOM 0 HB3 PHE A 57 0.287 5.054 6.604 1.00 13.05 H new ATOM 0 HD1 PHE A 57 -0.646 1.424 6.924 1.00 61.20 H new ATOM 0 HD2 PHE A 57 -2.023 5.406 6.213 1.00 34.32 H new ATOM 0 HE1 PHE A 57 -2.967 0.635 6.936 1.00 12.22 H new ATOM 0 HE2 PHE A 57 -4.333 4.596 6.198 1.00 53.14 H new ATOM 0 HZ PHE A 57 -4.807 2.216 6.558 1.00 71.14 H new ATOM 950 N ILE A 58 2.284 5.333 4.109 1.00 15.52 N ATOM 951 CA ILE A 58 3.439 6.179 3.731 1.00 62.24 C ATOM 952 C ILE A 58 2.947 7.557 3.255 1.00 23.02 C ATOM 953 O ILE A 58 1.756 7.744 2.967 1.00 13.34 O ATOM 954 CB ILE A 58 4.263 5.556 2.538 1.00 0.44 C ATOM 955 CG1 ILE A 58 3.303 5.264 1.347 1.00 24.24 C ATOM 956 CG2 ILE A 58 5.070 4.303 2.951 1.00 21.34 C ATOM 957 CD1 ILE A 58 4.001 4.890 0.077 1.00 63.23 C ATOM 0 H ILE A 58 1.439 5.554 3.582 1.00 15.52 H new ATOM 0 HA ILE A 58 4.070 6.256 4.616 1.00 62.24 H new ATOM 0 HB ILE A 58 5.010 6.286 2.225 1.00 0.44 H new ATOM 0 HG12 ILE A 58 2.627 4.457 1.629 1.00 24.24 H new ATOM 0 HG13 ILE A 58 2.688 6.146 1.165 1.00 24.24 H new ATOM 0 HG21 ILE A 58 5.615 3.921 2.088 1.00 21.34 H new ATOM 0 HG22 ILE A 58 5.776 4.568 3.738 1.00 21.34 H new ATOM 0 HG23 ILE A 58 4.388 3.536 3.318 1.00 21.34 H new ATOM 0 HD11 ILE A 58 3.263 4.703 -0.703 1.00 63.23 H new ATOM 0 HD12 ILE A 58 4.656 5.705 -0.232 1.00 63.23 H new ATOM 0 HD13 ILE A 58 4.594 3.990 0.239 1.00 63.23 H new ATOM 969 N ARG A 59 3.892 8.491 3.101 1.00 62.31 N ATOM 970 CA ARG A 59 3.640 9.786 2.454 1.00 21.44 C ATOM 971 C ARG A 59 4.076 9.702 0.976 1.00 34.44 C ATOM 972 O ARG A 59 4.887 8.837 0.624 1.00 24.43 O ATOM 973 CB ARG A 59 4.393 10.904 3.224 1.00 62.54 C ATOM 974 CG ARG A 59 3.886 12.338 2.955 1.00 23.14 C ATOM 975 CD ARG A 59 4.524 13.371 3.900 1.00 74.24 C ATOM 976 NE ARG A 59 4.341 12.999 5.319 1.00 5.12 N ATOM 977 CZ ARG A 59 5.301 12.998 6.262 1.00 32.23 C ATOM 978 NH1 ARG A 59 6.554 13.354 5.975 1.00 4.42 N ATOM 979 NH2 ARG A 59 4.993 12.640 7.500 1.00 54.34 N ATOM 0 H ARG A 59 4.853 8.372 3.421 1.00 62.31 H new ATOM 0 HA ARG A 59 2.578 10.030 2.478 1.00 21.44 H new ATOM 0 HB2 ARG A 59 4.317 10.703 4.293 1.00 62.54 H new ATOM 0 HB3 ARG A 59 5.450 10.854 2.964 1.00 62.54 H new ATOM 0 HG2 ARG A 59 4.104 12.610 1.922 1.00 23.14 H new ATOM 0 HG3 ARG A 59 2.802 12.365 3.069 1.00 23.14 H new ATOM 0 HD2 ARG A 59 5.588 13.457 3.680 1.00 74.24 H new ATOM 0 HD3 ARG A 59 4.081 14.351 3.720 1.00 74.24 H new ATOM 0 HE ARG A 59 3.404 12.718 5.609 1.00 5.12 H new ATOM 0 HH11 ARG A 59 6.800 13.634 5.026 1.00 4.42 H new ATOM 0 HH12 ARG A 59 7.266 13.346 6.705 1.00 4.42 H new ATOM 0 HH21 ARG A 59 4.037 12.369 7.730 1.00 54.34 H new ATOM 0 HH22 ARG A 59 5.712 12.635 8.223 1.00 54.34 H new ATOM 993 N GLY A 60 3.529 10.594 0.128 1.00 51.23 N ATOM 994 CA GLY A 60 3.825 10.619 -1.320 1.00 40.51 C ATOM 995 C GLY A 60 5.301 10.833 -1.660 1.00 74.40 C ATOM 996 O GLY A 60 5.751 10.459 -2.753 1.00 20.23 O ATOM 0 H GLY A 60 2.872 11.316 0.425 1.00 51.23 H new ATOM 0 HA2 GLY A 60 3.496 9.679 -1.762 1.00 40.51 H new ATOM 0 HA3 GLY A 60 3.239 11.412 -1.785 1.00 40.51 H new ATOM 1000 N ALA A 61 6.054 11.435 -0.716 1.00 14.20 N ATOM 1001 CA ALA A 61 7.514 11.619 -0.850 1.00 73.12 C ATOM 1002 C ALA A 61 8.217 10.262 -0.677 1.00 3.24 C ATOM 1003 O ALA A 61 9.095 9.887 -1.452 1.00 0.14 O ATOM 1004 CB ALA A 61 8.009 12.631 0.198 1.00 70.24 C ATOM 0 H ALA A 61 5.671 11.805 0.154 1.00 14.20 H new ATOM 0 HA ALA A 61 7.748 12.010 -1.840 1.00 73.12 H new ATOM 0 HB1 ALA A 61 9.086 12.764 0.095 1.00 70.24 H new ATOM 0 HB2 ALA A 61 7.509 13.588 0.044 1.00 70.24 H new ATOM 0 HB3 ALA A 61 7.783 12.260 1.198 1.00 70.24 H new ATOM 1010 N TYR A 62 7.755 9.532 0.347 1.00 52.43 N ATOM 1011 CA TYR A 62 8.253 8.201 0.731 1.00 51.21 C ATOM 1012 C TYR A 62 7.902 7.116 -0.304 1.00 63.54 C ATOM 1013 O TYR A 62 8.539 6.074 -0.333 1.00 70.14 O ATOM 1014 CB TYR A 62 7.734 7.812 2.141 1.00 75.02 C ATOM 1015 CG TYR A 62 8.209 8.756 3.260 1.00 65.44 C ATOM 1016 CD1 TYR A 62 9.554 9.115 3.367 1.00 72.15 C ATOM 1017 CD2 TYR A 62 7.327 9.276 4.214 1.00 61.25 C ATOM 1018 CE1 TYR A 62 9.997 9.950 4.368 1.00 34.15 C ATOM 1019 CE2 TYR A 62 7.769 10.116 5.221 1.00 35.12 C ATOM 1020 CZ TYR A 62 9.106 10.447 5.294 1.00 32.22 C ATOM 1021 OH TYR A 62 9.553 11.280 6.300 1.00 1.11 O ATOM 0 H TYR A 62 7.001 9.860 0.951 1.00 52.43 H new ATOM 0 HA TYR A 62 9.341 8.263 0.761 1.00 51.21 H new ATOM 0 HB2 TYR A 62 6.644 7.801 2.126 1.00 75.02 H new ATOM 0 HB3 TYR A 62 8.060 6.798 2.371 1.00 75.02 H new ATOM 0 HD1 TYR A 62 10.262 8.729 2.649 1.00 72.15 H new ATOM 0 HD2 TYR A 62 6.280 9.016 4.163 1.00 61.25 H new ATOM 0 HE1 TYR A 62 11.042 10.215 4.427 1.00 34.15 H new ATOM 0 HE2 TYR A 62 7.071 10.510 5.945 1.00 35.12 H new ATOM 0 HH TYR A 62 8.798 11.542 6.867 1.00 1.11 H new ATOM 1031 N GLU A 63 6.827 7.336 -1.078 1.00 34.43 N ATOM 1032 CA GLU A 63 6.350 6.387 -2.112 1.00 42.22 C ATOM 1033 C GLU A 63 7.459 5.970 -3.117 1.00 2.20 C ATOM 1034 O GLU A 63 7.438 4.850 -3.647 1.00 3.35 O ATOM 1035 CB GLU A 63 5.145 6.997 -2.857 1.00 4.45 C ATOM 1036 CG GLU A 63 4.397 5.990 -3.766 1.00 12.32 C ATOM 1037 CD GLU A 63 3.360 6.616 -4.710 1.00 51.42 C ATOM 1038 OE1 GLU A 63 3.541 7.779 -5.140 1.00 32.23 O ATOM 1039 OE2 GLU A 63 2.362 5.947 -5.038 1.00 71.42 O ATOM 0 H GLU A 63 6.258 8.179 -1.008 1.00 34.43 H new ATOM 0 HA GLU A 63 6.048 5.475 -1.598 1.00 42.22 H new ATOM 0 HB2 GLU A 63 4.445 7.402 -2.126 1.00 4.45 H new ATOM 0 HB3 GLU A 63 5.491 7.833 -3.465 1.00 4.45 H new ATOM 0 HG2 GLU A 63 5.130 5.448 -4.364 1.00 12.32 H new ATOM 0 HG3 GLU A 63 3.896 5.256 -3.135 1.00 12.32 H new ATOM 1046 N GLU A 64 8.433 6.878 -3.348 1.00 74.50 N ATOM 1047 CA GLU A 64 9.632 6.604 -4.177 1.00 4.41 C ATOM 1048 C GLU A 64 10.415 5.366 -3.656 1.00 21.34 C ATOM 1049 O GLU A 64 10.840 4.510 -4.437 1.00 2.05 O ATOM 1050 CB GLU A 64 10.539 7.860 -4.203 1.00 61.31 C ATOM 1051 CG GLU A 64 11.849 7.684 -4.984 1.00 41.52 C ATOM 1052 CD GLU A 64 12.758 8.917 -4.901 1.00 60.35 C ATOM 1053 OE1 GLU A 64 12.549 9.880 -5.671 1.00 61.20 O ATOM 1054 OE2 GLU A 64 13.658 8.945 -4.033 1.00 21.42 O ATOM 0 H GLU A 64 8.412 7.823 -2.965 1.00 74.50 H new ATOM 0 HA GLU A 64 9.307 6.374 -5.192 1.00 4.41 H new ATOM 0 HB2 GLU A 64 9.979 8.688 -4.639 1.00 61.31 H new ATOM 0 HB3 GLU A 64 10.777 8.142 -3.177 1.00 61.31 H new ATOM 0 HG2 GLU A 64 12.384 6.817 -4.597 1.00 41.52 H new ATOM 0 HG3 GLU A 64 11.619 7.477 -6.029 1.00 41.52 H new ATOM 1061 N VAL A 65 10.549 5.295 -2.321 1.00 73.53 N ATOM 1062 CA VAL A 65 11.180 4.170 -1.589 1.00 25.22 C ATOM 1063 C VAL A 65 10.461 2.831 -1.893 1.00 54.01 C ATOM 1064 O VAL A 65 11.107 1.788 -2.053 1.00 10.11 O ATOM 1065 CB VAL A 65 11.142 4.472 -0.039 1.00 3.12 C ATOM 1066 CG1 VAL A 65 11.608 3.297 0.822 1.00 13.14 C ATOM 1067 CG2 VAL A 65 11.930 5.766 0.304 1.00 71.53 C ATOM 0 H VAL A 65 10.215 6.033 -1.701 1.00 73.53 H new ATOM 0 HA VAL A 65 12.214 4.073 -1.919 1.00 25.22 H new ATOM 0 HB VAL A 65 10.093 4.631 0.209 1.00 3.12 H new ATOM 0 HG11 VAL A 65 11.556 3.574 1.875 1.00 13.14 H new ATOM 0 HG12 VAL A 65 10.965 2.436 0.641 1.00 13.14 H new ATOM 0 HG13 VAL A 65 12.636 3.042 0.564 1.00 13.14 H new ATOM 0 HG21 VAL A 65 11.884 5.946 1.378 1.00 71.53 H new ATOM 0 HG22 VAL A 65 12.970 5.650 -0.001 1.00 71.53 H new ATOM 0 HG23 VAL A 65 11.489 6.611 -0.224 1.00 71.53 H new ATOM 1077 N VAL A 66 9.111 2.892 -1.984 1.00 5.12 N ATOM 1078 CA VAL A 66 8.246 1.718 -2.255 1.00 71.33 C ATOM 1079 C VAL A 66 8.572 1.057 -3.604 1.00 24.22 C ATOM 1080 O VAL A 66 8.421 -0.146 -3.737 1.00 61.24 O ATOM 1081 CB VAL A 66 6.712 2.076 -2.138 1.00 5.52 C ATOM 1082 CG1 VAL A 66 5.776 0.886 -2.489 1.00 61.53 C ATOM 1083 CG2 VAL A 66 6.411 2.597 -0.721 1.00 64.21 C ATOM 0 H VAL A 66 8.589 3.761 -1.871 1.00 5.12 H new ATOM 0 HA VAL A 66 8.466 0.984 -1.480 1.00 71.33 H new ATOM 0 HB VAL A 66 6.506 2.852 -2.875 1.00 5.52 H new ATOM 0 HG11 VAL A 66 4.737 1.199 -2.389 1.00 61.53 H new ATOM 0 HG12 VAL A 66 5.962 0.567 -3.515 1.00 61.53 H new ATOM 0 HG13 VAL A 66 5.972 0.056 -1.810 1.00 61.53 H new ATOM 0 HG21 VAL A 66 5.352 2.844 -0.641 1.00 64.21 H new ATOM 0 HG22 VAL A 66 6.660 1.828 0.010 1.00 64.21 H new ATOM 0 HG23 VAL A 66 7.007 3.489 -0.527 1.00 64.21 H new ATOM 1093 N ARG A 67 9.032 1.846 -4.585 1.00 0.22 N ATOM 1094 CA ARG A 67 9.446 1.319 -5.907 1.00 74.20 C ATOM 1095 C ARG A 67 10.638 0.324 -5.779 1.00 10.53 C ATOM 1096 O ARG A 67 10.722 -0.656 -6.529 1.00 1.30 O ATOM 1097 CB ARG A 67 9.773 2.500 -6.856 1.00 54.02 C ATOM 1098 CG ARG A 67 10.111 2.102 -8.312 1.00 14.34 C ATOM 1099 CD ARG A 67 10.096 3.304 -9.277 1.00 12.12 C ATOM 1100 NE ARG A 67 10.556 2.946 -10.633 1.00 53.04 N ATOM 1101 CZ ARG A 67 11.558 3.545 -11.303 1.00 50.34 C ATOM 1102 NH1 ARG A 67 12.245 4.554 -10.763 1.00 50.41 N ATOM 1103 NH2 ARG A 67 11.852 3.149 -12.532 1.00 31.33 N ATOM 0 H ARG A 67 9.130 2.857 -4.494 1.00 0.22 H new ATOM 0 HA ARG A 67 8.620 0.751 -6.336 1.00 74.20 H new ATOM 0 HB2 ARG A 67 8.921 3.180 -6.871 1.00 54.02 H new ATOM 0 HB3 ARG A 67 10.616 3.054 -6.443 1.00 54.02 H new ATOM 0 HG2 ARG A 67 11.095 1.634 -8.337 1.00 14.34 H new ATOM 0 HG3 ARG A 67 9.394 1.356 -8.656 1.00 14.34 H new ATOM 0 HD2 ARG A 67 9.085 3.707 -9.334 1.00 12.12 H new ATOM 0 HD3 ARG A 67 10.732 4.094 -8.878 1.00 12.12 H new ATOM 0 HE ARG A 67 10.074 2.180 -11.102 1.00 53.04 H new ATOM 0 HH11 ARG A 67 12.014 4.884 -9.826 1.00 50.41 H new ATOM 0 HH12 ARG A 67 13.001 4.995 -11.287 1.00 50.41 H new ATOM 0 HH21 ARG A 67 11.320 2.394 -12.966 1.00 31.33 H new ATOM 0 HH22 ARG A 67 12.610 3.599 -13.045 1.00 31.33 H new ATOM 1117 N ASP A 68 11.537 0.570 -4.804 1.00 40.44 N ATOM 1118 CA ASP A 68 12.663 -0.351 -4.486 1.00 72.21 C ATOM 1119 C ASP A 68 12.155 -1.592 -3.716 1.00 51.24 C ATOM 1120 O ASP A 68 12.731 -2.678 -3.806 1.00 54.31 O ATOM 1121 CB ASP A 68 13.732 0.359 -3.628 1.00 20.25 C ATOM 1122 CG ASP A 68 14.227 1.682 -4.224 1.00 72.33 C ATOM 1123 OD1 ASP A 68 14.949 1.657 -5.240 1.00 40.13 O ATOM 1124 OD2 ASP A 68 13.896 2.762 -3.678 1.00 12.02 O ATOM 0 H ASP A 68 11.510 1.403 -4.216 1.00 40.44 H new ATOM 0 HA ASP A 68 13.105 -0.662 -5.433 1.00 72.21 H new ATOM 0 HB2 ASP A 68 13.321 0.549 -2.637 1.00 20.25 H new ATOM 0 HB3 ASP A 68 14.582 -0.310 -3.497 1.00 20.25 H new ATOM 1129 N ILE A 69 11.100 -1.384 -2.917 1.00 65.10 N ATOM 1130 CA ILE A 69 10.434 -2.439 -2.124 1.00 65.34 C ATOM 1131 C ILE A 69 9.605 -3.363 -3.050 1.00 32.12 C ATOM 1132 O ILE A 69 9.449 -4.559 -2.782 1.00 23.00 O ATOM 1133 CB ILE A 69 9.527 -1.787 -1.014 1.00 72.32 C ATOM 1134 CG1 ILE A 69 10.357 -0.772 -0.162 1.00 14.23 C ATOM 1135 CG2 ILE A 69 8.883 -2.854 -0.113 1.00 2.51 C ATOM 1136 CD1 ILE A 69 9.537 0.098 0.775 1.00 61.31 C ATOM 0 H ILE A 69 10.674 -0.465 -2.798 1.00 65.10 H new ATOM 0 HA ILE A 69 11.192 -3.048 -1.631 1.00 65.34 H new ATOM 0 HB ILE A 69 8.721 -1.249 -1.513 1.00 72.32 H new ATOM 0 HG12 ILE A 69 11.088 -1.327 0.427 1.00 14.23 H new ATOM 0 HG13 ILE A 69 10.917 -0.125 -0.838 1.00 14.23 H new ATOM 0 HG21 ILE A 69 8.264 -2.368 0.641 1.00 2.51 H new ATOM 0 HG22 ILE A 69 8.264 -3.516 -0.718 1.00 2.51 H new ATOM 0 HG23 ILE A 69 9.664 -3.435 0.378 1.00 2.51 H new ATOM 0 HD11 ILE A 69 10.200 0.768 1.322 1.00 61.31 H new ATOM 0 HD12 ILE A 69 8.824 0.685 0.196 1.00 61.31 H new ATOM 0 HD13 ILE A 69 8.998 -0.534 1.480 1.00 61.31 H new ATOM 1148 N VAL A 70 9.100 -2.767 -4.149 1.00 30.32 N ATOM 1149 CA VAL A 70 8.401 -3.466 -5.238 1.00 62.23 C ATOM 1150 C VAL A 70 9.352 -4.490 -5.876 1.00 1.32 C ATOM 1151 O VAL A 70 8.952 -5.618 -6.144 1.00 4.13 O ATOM 1152 CB VAL A 70 7.868 -2.431 -6.322 1.00 72.52 C ATOM 1153 CG1 VAL A 70 7.631 -3.083 -7.705 1.00 33.11 C ATOM 1154 CG2 VAL A 70 6.579 -1.721 -5.827 1.00 34.44 C ATOM 0 H VAL A 70 9.171 -1.761 -4.304 1.00 30.32 H new ATOM 0 HA VAL A 70 7.536 -3.990 -4.832 1.00 62.23 H new ATOM 0 HB VAL A 70 8.653 -1.686 -6.451 1.00 72.52 H new ATOM 0 HG11 VAL A 70 7.268 -2.330 -8.405 1.00 33.11 H new ATOM 0 HG12 VAL A 70 8.567 -3.501 -8.075 1.00 33.11 H new ATOM 0 HG13 VAL A 70 6.891 -3.878 -7.611 1.00 33.11 H new ATOM 0 HG21 VAL A 70 6.236 -1.019 -6.587 1.00 34.44 H new ATOM 0 HG22 VAL A 70 5.803 -2.464 -5.642 1.00 34.44 H new ATOM 0 HG23 VAL A 70 6.792 -1.181 -4.904 1.00 34.44 H new ATOM 1164 N GLU A 71 10.627 -4.075 -6.049 1.00 10.11 N ATOM 1165 CA GLU A 71 11.698 -4.915 -6.626 1.00 75.40 C ATOM 1166 C GLU A 71 11.799 -6.264 -5.868 1.00 50.52 C ATOM 1167 O GLU A 71 11.954 -7.314 -6.481 1.00 11.55 O ATOM 1168 CB GLU A 71 13.063 -4.130 -6.616 1.00 73.23 C ATOM 1169 CG GLU A 71 13.803 -4.054 -7.973 1.00 52.24 C ATOM 1170 CD GLU A 71 14.300 -5.414 -8.496 1.00 53.35 C ATOM 1171 OE1 GLU A 71 15.351 -5.898 -8.027 1.00 50.50 O ATOM 1172 OE2 GLU A 71 13.660 -5.994 -9.397 1.00 64.33 O ATOM 0 H GLU A 71 10.943 -3.140 -5.790 1.00 10.11 H new ATOM 0 HA GLU A 71 11.455 -5.145 -7.663 1.00 75.40 H new ATOM 0 HB2 GLU A 71 12.874 -3.114 -6.268 1.00 73.23 H new ATOM 0 HB3 GLU A 71 13.725 -4.598 -5.888 1.00 73.23 H new ATOM 0 HG2 GLU A 71 13.136 -3.614 -8.714 1.00 52.24 H new ATOM 0 HG3 GLU A 71 14.655 -3.382 -7.873 1.00 52.24 H new ATOM 1179 N TYR A 72 11.644 -6.196 -4.530 1.00 74.32 N ATOM 1180 CA TYR A 72 11.610 -7.375 -3.643 1.00 13.15 C ATOM 1181 C TYR A 72 10.273 -8.145 -3.767 1.00 42.31 C ATOM 1182 O TYR A 72 10.266 -9.374 -3.857 1.00 34.13 O ATOM 1183 CB TYR A 72 11.826 -6.925 -2.174 1.00 15.33 C ATOM 1184 CG TYR A 72 11.739 -8.056 -1.147 1.00 70.53 C ATOM 1185 CD1 TYR A 72 12.824 -8.903 -0.906 1.00 10.54 C ATOM 1186 CD2 TYR A 72 10.561 -8.295 -0.430 1.00 32.03 C ATOM 1187 CE1 TYR A 72 12.733 -9.938 0.002 1.00 1.14 C ATOM 1188 CE2 TYR A 72 10.475 -9.324 0.474 1.00 5.34 C ATOM 1189 CZ TYR A 72 11.560 -10.142 0.687 1.00 53.51 C ATOM 1190 OH TYR A 72 11.466 -11.172 1.598 1.00 13.52 O ATOM 0 H TYR A 72 11.538 -5.313 -4.031 1.00 74.32 H new ATOM 0 HA TYR A 72 12.410 -8.050 -3.946 1.00 13.15 H new ATOM 0 HB2 TYR A 72 12.804 -6.451 -2.092 1.00 15.33 H new ATOM 0 HB3 TYR A 72 11.083 -6.167 -1.926 1.00 15.33 H new ATOM 0 HD1 TYR A 72 13.750 -8.745 -1.440 1.00 10.54 H new ATOM 0 HD2 TYR A 72 9.704 -7.658 -0.591 1.00 32.03 H new ATOM 0 HE1 TYR A 72 13.581 -10.585 0.173 1.00 1.14 H new ATOM 0 HE2 TYR A 72 9.557 -9.491 1.017 1.00 5.34 H new ATOM 0 HH TYR A 72 10.651 -11.688 1.425 1.00 13.52 H new ATOM 1200 N ALA A 73 9.153 -7.400 -3.740 1.00 51.55 N ATOM 1201 CA ALA A 73 7.784 -7.963 -3.753 1.00 22.14 C ATOM 1202 C ALA A 73 7.505 -8.793 -5.024 1.00 72.42 C ATOM 1203 O ALA A 73 6.708 -9.742 -5.002 1.00 14.44 O ATOM 1204 CB ALA A 73 6.766 -6.826 -3.607 1.00 50.55 C ATOM 0 H ALA A 73 9.169 -6.381 -3.708 1.00 51.55 H new ATOM 0 HA ALA A 73 7.690 -8.648 -2.910 1.00 22.14 H new ATOM 0 HB1 ALA A 73 5.757 -7.238 -3.616 1.00 50.55 H new ATOM 0 HB2 ALA A 73 6.936 -6.304 -2.665 1.00 50.55 H new ATOM 0 HB3 ALA A 73 6.880 -6.127 -4.435 1.00 50.55 H new ATOM 1210 N GLN A 74 8.160 -8.401 -6.130 1.00 42.34 N ATOM 1211 CA GLN A 74 8.079 -9.105 -7.412 1.00 25.05 C ATOM 1212 C GLN A 74 8.862 -10.444 -7.359 1.00 12.50 C ATOM 1213 O GLN A 74 8.478 -11.414 -8.018 1.00 65.43 O ATOM 1214 CB GLN A 74 8.601 -8.194 -8.556 1.00 60.14 C ATOM 1215 CG GLN A 74 7.806 -6.882 -8.777 1.00 74.32 C ATOM 1216 CD GLN A 74 6.335 -7.102 -9.117 1.00 41.20 C ATOM 1217 OE1 GLN A 74 5.474 -7.132 -8.236 1.00 23.30 O ATOM 1218 NE2 GLN A 74 6.039 -7.275 -10.394 1.00 75.33 N ATOM 0 H GLN A 74 8.764 -7.580 -6.155 1.00 42.34 H new ATOM 0 HA GLN A 74 7.035 -9.343 -7.613 1.00 25.05 H new ATOM 0 HB2 GLN A 74 9.640 -7.939 -8.348 1.00 60.14 H new ATOM 0 HB3 GLN A 74 8.592 -8.765 -9.485 1.00 60.14 H new ATOM 0 HG2 GLN A 74 7.874 -6.271 -7.877 1.00 74.32 H new ATOM 0 HG3 GLN A 74 8.274 -6.316 -9.582 1.00 74.32 H new ATOM 0 HE21 GLN A 74 6.777 -7.244 -11.097 1.00 75.33 H new ATOM 0 HE22 GLN A 74 5.073 -7.439 -10.676 1.00 75.33 H new ATOM 1227 N LYS A 75 9.955 -10.493 -6.556 1.00 15.02 N ATOM 1228 CA LYS A 75 10.745 -11.745 -6.332 1.00 24.02 C ATOM 1229 C LYS A 75 9.903 -12.764 -5.542 1.00 31.54 C ATOM 1230 O LYS A 75 9.983 -13.980 -5.769 1.00 21.14 O ATOM 1231 CB LYS A 75 12.075 -11.463 -5.559 1.00 11.32 C ATOM 1232 CG LYS A 75 12.919 -10.303 -6.118 1.00 54.15 C ATOM 1233 CD LYS A 75 13.252 -10.447 -7.621 1.00 71.23 C ATOM 1234 CE LYS A 75 14.011 -9.229 -8.165 1.00 62.35 C ATOM 1235 NZ LYS A 75 14.213 -9.320 -9.633 1.00 64.51 N ATOM 0 H LYS A 75 10.314 -9.684 -6.050 1.00 15.02 H new ATOM 0 HA LYS A 75 11.001 -12.150 -7.311 1.00 24.02 H new ATOM 0 HB2 LYS A 75 11.834 -11.248 -4.518 1.00 11.32 H new ATOM 0 HB3 LYS A 75 12.681 -12.369 -5.566 1.00 11.32 H new ATOM 0 HG2 LYS A 75 12.383 -9.367 -5.961 1.00 54.15 H new ATOM 0 HG3 LYS A 75 13.849 -10.236 -5.553 1.00 54.15 H new ATOM 0 HD2 LYS A 75 13.851 -11.345 -7.774 1.00 71.23 H new ATOM 0 HD3 LYS A 75 12.329 -10.580 -8.185 1.00 71.23 H new ATOM 0 HE2 LYS A 75 13.458 -8.320 -7.929 1.00 62.35 H new ATOM 0 HE3 LYS A 75 14.978 -9.151 -7.668 1.00 62.35 H new ATOM 0 HZ1 LYS A 75 14.729 -8.480 -9.965 1.00 64.51 H new ATOM 0 HZ2 LYS A 75 14.763 -10.174 -9.856 1.00 64.51 H new ATOM 0 HZ3 LYS A 75 13.289 -9.369 -10.108 1.00 64.51 H new ATOM 1249 N GLU A 76 9.109 -12.226 -4.600 1.00 0.31 N ATOM 1250 CA GLU A 76 8.140 -12.990 -3.796 1.00 61.11 C ATOM 1251 C GLU A 76 6.987 -13.525 -4.676 1.00 11.44 C ATOM 1252 O GLU A 76 6.363 -14.545 -4.353 1.00 64.35 O ATOM 1253 CB GLU A 76 7.579 -12.070 -2.674 1.00 14.40 C ATOM 1254 CG GLU A 76 8.638 -11.503 -1.704 1.00 73.42 C ATOM 1255 CD GLU A 76 9.144 -12.509 -0.646 1.00 25.12 C ATOM 1256 OE1 GLU A 76 9.871 -13.464 -0.995 1.00 23.21 O ATOM 1257 OE2 GLU A 76 8.840 -12.330 0.550 1.00 74.04 O ATOM 0 H GLU A 76 9.123 -11.232 -4.372 1.00 0.31 H new ATOM 0 HA GLU A 76 8.644 -13.849 -3.353 1.00 61.11 H new ATOM 0 HB2 GLU A 76 7.051 -11.237 -3.138 1.00 14.40 H new ATOM 0 HB3 GLU A 76 6.844 -12.632 -2.098 1.00 14.40 H new ATOM 0 HG2 GLU A 76 9.489 -11.147 -2.284 1.00 73.42 H new ATOM 0 HG3 GLU A 76 8.217 -10.638 -1.192 1.00 73.42 H new ATOM 1264 N GLY A 77 6.712 -12.816 -5.787 1.00 45.03 N ATOM 1265 CA GLY A 77 5.638 -13.185 -6.710 1.00 34.42 C ATOM 1266 C GLY A 77 4.262 -12.899 -6.132 1.00 63.33 C ATOM 1267 O GLY A 77 3.306 -13.654 -6.353 1.00 20.54 O ATOM 0 H GLY A 77 7.227 -11.980 -6.063 1.00 45.03 H new ATOM 0 HA2 GLY A 77 5.759 -12.636 -7.644 1.00 34.42 H new ATOM 0 HA3 GLY A 77 5.716 -14.245 -6.951 1.00 34.42 H new ATOM 1271 N LEU A 78 4.179 -11.799 -5.372 1.00 54.33 N ATOM 1272 CA LEU A 78 2.952 -11.380 -4.691 1.00 32.03 C ATOM 1273 C LEU A 78 2.097 -10.482 -5.577 1.00 14.23 C ATOM 1274 O LEU A 78 2.575 -9.909 -6.569 1.00 61.54 O ATOM 1275 CB LEU A 78 3.296 -10.661 -3.362 1.00 63.00 C ATOM 1276 CG LEU A 78 3.976 -11.555 -2.286 1.00 13.54 C ATOM 1277 CD1 LEU A 78 4.182 -10.783 -0.972 1.00 51.13 C ATOM 1278 CD2 LEU A 78 3.185 -12.860 -2.062 1.00 3.32 C ATOM 0 H LEU A 78 4.968 -11.172 -5.213 1.00 54.33 H new ATOM 0 HA LEU A 78 2.370 -12.275 -4.471 1.00 32.03 H new ATOM 0 HB2 LEU A 78 3.953 -9.820 -3.581 1.00 63.00 H new ATOM 0 HB3 LEU A 78 2.379 -10.248 -2.942 1.00 63.00 H new ATOM 0 HG LEU A 78 4.962 -11.834 -2.658 1.00 13.54 H new ATOM 0 HD11 LEU A 78 4.659 -11.433 -0.239 1.00 51.13 H new ATOM 0 HD12 LEU A 78 4.816 -9.916 -1.155 1.00 51.13 H new ATOM 0 HD13 LEU A 78 3.217 -10.452 -0.589 1.00 51.13 H new ATOM 0 HD21 LEU A 78 3.685 -13.463 -1.305 1.00 3.32 H new ATOM 0 HD22 LEU A 78 2.176 -12.621 -1.727 1.00 3.32 H new ATOM 0 HD23 LEU A 78 3.134 -13.419 -2.996 1.00 3.32 H new ATOM 1290 N ARG A 79 0.818 -10.387 -5.205 1.00 31.44 N ATOM 1291 CA ARG A 79 -0.142 -9.503 -5.851 1.00 62.34 C ATOM 1292 C ARG A 79 0.027 -8.115 -5.208 1.00 20.40 C ATOM 1293 O ARG A 79 -0.452 -7.877 -4.100 1.00 13.12 O ATOM 1294 CB ARG A 79 -1.583 -10.088 -5.682 1.00 32.40 C ATOM 1295 CG ARG A 79 -2.670 -9.497 -6.620 1.00 32.12 C ATOM 1296 CD ARG A 79 -3.141 -8.076 -6.240 1.00 61.00 C ATOM 1297 NE ARG A 79 -3.995 -7.490 -7.281 1.00 62.41 N ATOM 1298 CZ ARG A 79 -3.657 -6.454 -8.061 1.00 45.42 C ATOM 1299 NH1 ARG A 79 -2.471 -5.866 -7.945 1.00 14.33 N ATOM 1300 NH2 ARG A 79 -4.524 -6.000 -8.947 1.00 62.13 N ATOM 0 H ARG A 79 0.421 -10.930 -4.438 1.00 31.44 H new ATOM 0 HA ARG A 79 0.026 -9.415 -6.924 1.00 62.34 H new ATOM 0 HB2 ARG A 79 -1.538 -11.165 -5.844 1.00 32.40 H new ATOM 0 HB3 ARG A 79 -1.898 -9.933 -4.650 1.00 32.40 H new ATOM 0 HG2 ARG A 79 -2.281 -9.477 -7.638 1.00 32.12 H new ATOM 0 HG3 ARG A 79 -3.532 -10.164 -6.621 1.00 32.12 H new ATOM 0 HD2 ARG A 79 -3.689 -8.114 -5.299 1.00 61.00 H new ATOM 0 HD3 ARG A 79 -2.273 -7.436 -6.078 1.00 61.00 H new ATOM 0 HE ARG A 79 -4.917 -7.903 -7.421 1.00 62.41 H new ATOM 0 HH11 ARG A 79 -1.801 -6.202 -7.254 1.00 14.33 H new ATOM 0 HH12 ARG A 79 -2.231 -5.079 -8.547 1.00 14.33 H new ATOM 0 HH21 ARG A 79 -5.441 -6.437 -9.033 1.00 62.13 H new ATOM 0 HH22 ARG A 79 -4.276 -5.212 -9.545 1.00 62.13 H new ATOM 1314 N VAL A 80 0.731 -7.215 -5.906 1.00 33.23 N ATOM 1315 CA VAL A 80 1.098 -5.891 -5.383 1.00 63.25 C ATOM 1316 C VAL A 80 0.200 -4.846 -6.055 1.00 4.20 C ATOM 1317 O VAL A 80 0.156 -4.740 -7.290 1.00 23.01 O ATOM 1318 CB VAL A 80 2.623 -5.562 -5.632 1.00 40.22 C ATOM 1319 CG1 VAL A 80 3.031 -4.219 -4.973 1.00 25.35 C ATOM 1320 CG2 VAL A 80 3.512 -6.725 -5.132 1.00 23.11 C ATOM 0 H VAL A 80 1.064 -7.385 -6.855 1.00 33.23 H new ATOM 0 HA VAL A 80 0.951 -5.879 -4.303 1.00 63.25 H new ATOM 0 HB VAL A 80 2.774 -5.451 -6.706 1.00 40.22 H new ATOM 0 HG11 VAL A 80 4.086 -4.025 -5.165 1.00 25.35 H new ATOM 0 HG12 VAL A 80 2.432 -3.411 -5.392 1.00 25.35 H new ATOM 0 HG13 VAL A 80 2.862 -4.275 -3.898 1.00 25.35 H new ATOM 0 HG21 VAL A 80 4.560 -6.484 -5.310 1.00 23.11 H new ATOM 0 HG22 VAL A 80 3.350 -6.874 -4.064 1.00 23.11 H new ATOM 0 HG23 VAL A 80 3.253 -7.638 -5.669 1.00 23.11 H new ATOM 1330 N LEU A 81 -0.533 -4.115 -5.222 1.00 32.23 N ATOM 1331 CA LEU A 81 -1.553 -3.161 -5.635 1.00 11.31 C ATOM 1332 C LEU A 81 -1.354 -1.897 -4.799 1.00 33.20 C ATOM 1333 O LEU A 81 -1.635 -1.894 -3.597 1.00 41.42 O ATOM 1334 CB LEU A 81 -2.948 -3.795 -5.373 1.00 35.31 C ATOM 1335 CG LEU A 81 -4.194 -3.032 -5.899 1.00 31.44 C ATOM 1336 CD1 LEU A 81 -4.104 -2.857 -7.408 1.00 3.13 C ATOM 1337 CD2 LEU A 81 -5.502 -3.754 -5.499 1.00 34.42 C ATOM 0 H LEU A 81 -0.429 -4.173 -4.209 1.00 32.23 H new ATOM 0 HA LEU A 81 -1.482 -2.911 -6.694 1.00 11.31 H new ATOM 0 HB2 LEU A 81 -2.953 -4.791 -5.815 1.00 35.31 H new ATOM 0 HB3 LEU A 81 -3.062 -3.923 -4.297 1.00 35.31 H new ATOM 0 HG LEU A 81 -4.213 -2.045 -5.437 1.00 31.44 H new ATOM 0 HD11 LEU A 81 -4.983 -2.321 -7.765 1.00 3.13 H new ATOM 0 HD12 LEU A 81 -3.207 -2.289 -7.656 1.00 3.13 H new ATOM 0 HD13 LEU A 81 -4.057 -3.836 -7.886 1.00 3.13 H new ATOM 0 HD21 LEU A 81 -6.357 -3.196 -5.881 1.00 34.42 H new ATOM 0 HD22 LEU A 81 -5.506 -4.759 -5.921 1.00 34.42 H new ATOM 0 HD23 LEU A 81 -5.566 -3.816 -4.413 1.00 34.42 H new ATOM 1349 N VAL A 82 -0.847 -0.832 -5.420 1.00 64.32 N ATOM 1350 CA VAL A 82 -0.549 0.420 -4.708 1.00 33.02 C ATOM 1351 C VAL A 82 -1.726 1.401 -4.879 1.00 1.42 C ATOM 1352 O VAL A 82 -2.205 1.647 -5.994 1.00 71.33 O ATOM 1353 CB VAL A 82 0.831 1.045 -5.170 1.00 3.00 C ATOM 1354 CG1 VAL A 82 2.006 0.080 -4.874 1.00 33.30 C ATOM 1355 CG2 VAL A 82 0.826 1.429 -6.655 1.00 24.22 C ATOM 0 H VAL A 82 -0.632 -0.807 -6.417 1.00 64.32 H new ATOM 0 HA VAL A 82 -0.435 0.205 -3.646 1.00 33.02 H new ATOM 0 HB VAL A 82 0.969 1.959 -4.592 1.00 3.00 H new ATOM 0 HG11 VAL A 82 2.941 0.534 -5.201 1.00 33.30 H new ATOM 0 HG12 VAL A 82 2.054 -0.117 -3.803 1.00 33.30 H new ATOM 0 HG13 VAL A 82 1.851 -0.857 -5.409 1.00 33.30 H new ATOM 0 HG21 VAL A 82 1.793 1.853 -6.924 1.00 24.22 H new ATOM 0 HG22 VAL A 82 0.638 0.542 -7.260 1.00 24.22 H new ATOM 0 HG23 VAL A 82 0.043 2.165 -6.838 1.00 24.22 H new ATOM 1365 N ILE A 83 -2.246 1.873 -3.744 1.00 0.32 N ATOM 1366 CA ILE A 83 -3.349 2.840 -3.680 1.00 2.53 C ATOM 1367 C ILE A 83 -2.771 4.231 -3.367 1.00 14.23 C ATOM 1368 O ILE A 83 -2.276 4.467 -2.268 1.00 64.23 O ATOM 1369 CB ILE A 83 -4.403 2.427 -2.582 1.00 14.35 C ATOM 1370 CG1 ILE A 83 -5.084 1.078 -2.973 1.00 4.30 C ATOM 1371 CG2 ILE A 83 -5.452 3.548 -2.333 1.00 31.20 C ATOM 1372 CD1 ILE A 83 -6.092 0.567 -1.968 1.00 52.33 C ATOM 0 H ILE A 83 -1.907 1.590 -2.825 1.00 0.32 H new ATOM 0 HA ILE A 83 -3.864 2.858 -4.641 1.00 2.53 H new ATOM 0 HB ILE A 83 -3.873 2.285 -1.640 1.00 14.35 H new ATOM 0 HG12 ILE A 83 -5.581 1.202 -3.935 1.00 4.30 H new ATOM 0 HG13 ILE A 83 -4.311 0.322 -3.109 1.00 4.30 H new ATOM 0 HG21 ILE A 83 -6.159 3.222 -1.570 1.00 31.20 H new ATOM 0 HG22 ILE A 83 -4.945 4.452 -1.996 1.00 31.20 H new ATOM 0 HG23 ILE A 83 -5.988 3.757 -3.259 1.00 31.20 H new ATOM 0 HD11 ILE A 83 -6.514 -0.374 -2.322 1.00 52.33 H new ATOM 0 HD12 ILE A 83 -5.600 0.406 -1.009 1.00 52.33 H new ATOM 0 HD13 ILE A 83 -6.890 1.300 -1.848 1.00 52.33 H new ATOM 1384 N LYS A 84 -2.845 5.143 -4.330 1.00 32.31 N ATOM 1385 CA LYS A 84 -2.264 6.497 -4.221 1.00 11.22 C ATOM 1386 C LYS A 84 -3.341 7.537 -4.546 1.00 32.33 C ATOM 1387 O LYS A 84 -4.056 7.414 -5.547 1.00 51.12 O ATOM 1388 CB LYS A 84 -1.019 6.608 -5.167 1.00 23.14 C ATOM 1389 CG LYS A 84 -1.247 6.030 -6.588 1.00 73.25 C ATOM 1390 CD LYS A 84 0.021 5.933 -7.477 1.00 65.21 C ATOM 1391 CE LYS A 84 0.571 7.280 -7.951 1.00 55.02 C ATOM 1392 NZ LYS A 84 1.351 7.979 -6.898 1.00 14.12 N ATOM 0 H LYS A 84 -3.312 4.972 -5.221 1.00 32.31 H new ATOM 0 HA LYS A 84 -1.919 6.688 -3.205 1.00 11.22 H new ATOM 0 HB2 LYS A 84 -0.736 7.657 -5.255 1.00 23.14 H new ATOM 0 HB3 LYS A 84 -0.179 6.088 -4.706 1.00 23.14 H new ATOM 0 HG2 LYS A 84 -1.680 5.034 -6.492 1.00 73.25 H new ATOM 0 HG3 LYS A 84 -1.983 6.650 -7.100 1.00 73.25 H new ATOM 0 HD2 LYS A 84 0.800 5.413 -6.920 1.00 65.21 H new ATOM 0 HD3 LYS A 84 -0.209 5.322 -8.350 1.00 65.21 H new ATOM 0 HE2 LYS A 84 1.205 7.123 -8.824 1.00 55.02 H new ATOM 0 HE3 LYS A 84 -0.256 7.915 -8.268 1.00 55.02 H new ATOM 0 HZ1 LYS A 84 2.149 8.483 -7.334 1.00 14.12 H new ATOM 0 HZ2 LYS A 84 0.738 8.661 -6.407 1.00 14.12 H new ATOM 0 HZ3 LYS A 84 1.712 7.284 -6.214 1.00 14.12 H new ATOM 1406 N VAL A 85 -3.491 8.546 -3.676 1.00 31.04 N ATOM 1407 CA VAL A 85 -4.468 9.620 -3.881 1.00 14.24 C ATOM 1408 C VAL A 85 -3.833 10.687 -4.784 1.00 53.32 C ATOM 1409 O VAL A 85 -2.912 11.404 -4.363 1.00 61.14 O ATOM 1410 CB VAL A 85 -4.958 10.245 -2.514 1.00 2.34 C ATOM 1411 CG1 VAL A 85 -5.992 11.381 -2.736 1.00 71.45 C ATOM 1412 CG2 VAL A 85 -5.531 9.147 -1.582 1.00 71.01 C ATOM 0 H VAL A 85 -2.944 8.639 -2.820 1.00 31.04 H new ATOM 0 HA VAL A 85 -5.356 9.208 -4.361 1.00 14.24 H new ATOM 0 HB VAL A 85 -4.090 10.690 -2.028 1.00 2.34 H new ATOM 0 HG11 VAL A 85 -6.303 11.783 -1.772 1.00 71.45 H new ATOM 0 HG12 VAL A 85 -5.539 12.174 -3.331 1.00 71.45 H new ATOM 0 HG13 VAL A 85 -6.861 10.985 -3.261 1.00 71.45 H new ATOM 0 HG21 VAL A 85 -5.862 9.600 -0.647 1.00 71.01 H new ATOM 0 HG22 VAL A 85 -6.376 8.661 -2.069 1.00 71.01 H new ATOM 0 HG23 VAL A 85 -4.758 8.407 -1.373 1.00 71.01 H new ATOM 1422 N ALA A 86 -4.287 10.721 -6.055 1.00 34.22 N ATOM 1423 CA ALA A 86 -3.829 11.697 -7.049 1.00 30.43 C ATOM 1424 C ALA A 86 -4.248 13.114 -6.629 1.00 3.23 C ATOM 1425 O ALA A 86 -5.362 13.318 -6.143 1.00 45.25 O ATOM 1426 CB ALA A 86 -4.376 11.340 -8.440 1.00 12.00 C ATOM 0 H ALA A 86 -4.983 10.068 -6.415 1.00 34.22 H new ATOM 0 HA ALA A 86 -2.741 11.669 -7.102 1.00 30.43 H new ATOM 0 HB1 ALA A 86 -4.028 12.073 -9.167 1.00 12.00 H new ATOM 0 HB2 ALA A 86 -4.023 10.349 -8.726 1.00 12.00 H new ATOM 0 HB3 ALA A 86 -5.466 11.344 -8.414 1.00 12.00 H new ATOM 1432 N GLN A 87 -3.326 14.078 -6.752 1.00 62.43 N ATOM 1433 CA GLN A 87 -3.584 15.489 -6.389 1.00 24.00 C ATOM 1434 C GLN A 87 -3.096 16.404 -7.530 1.00 53.50 C ATOM 1435 O GLN A 87 -2.539 17.483 -7.289 1.00 33.43 O ATOM 1436 CB GLN A 87 -2.908 15.829 -5.015 1.00 44.12 C ATOM 1437 CG GLN A 87 -3.456 15.025 -3.812 1.00 25.34 C ATOM 1438 CD GLN A 87 -2.860 15.440 -2.463 1.00 51.53 C ATOM 1439 OE1 GLN A 87 -3.370 16.343 -1.799 1.00 34.03 O ATOM 1440 NE2 GLN A 87 -1.789 14.781 -2.033 1.00 71.05 N ATOM 0 H GLN A 87 -2.383 13.909 -7.103 1.00 62.43 H new ATOM 0 HA GLN A 87 -4.654 15.655 -6.262 1.00 24.00 H new ATOM 0 HB2 GLN A 87 -1.836 15.649 -5.098 1.00 44.12 H new ATOM 0 HB3 GLN A 87 -3.038 16.892 -4.814 1.00 44.12 H new ATOM 0 HG2 GLN A 87 -4.539 15.144 -3.771 1.00 25.34 H new ATOM 0 HG3 GLN A 87 -3.257 13.966 -3.975 1.00 25.34 H new ATOM 0 HE21 GLN A 87 -1.386 14.037 -2.602 1.00 71.05 H new ATOM 0 HE22 GLN A 87 -1.371 15.019 -1.134 1.00 71.05 H new ATOM 1449 N ASP A 88 -3.332 15.932 -8.784 1.00 44.33 N ATOM 1450 CA ASP A 88 -2.998 16.654 -10.048 1.00 45.45 C ATOM 1451 C ASP A 88 -1.461 16.893 -10.188 1.00 75.52 C ATOM 1452 O ASP A 88 -1.001 17.771 -10.927 1.00 31.43 O ATOM 1453 CB ASP A 88 -3.828 17.981 -10.123 1.00 14.00 C ATOM 1454 CG ASP A 88 -3.833 18.656 -11.514 1.00 10.33 C ATOM 1455 OD1 ASP A 88 -4.562 18.173 -12.412 1.00 42.23 O ATOM 1456 OD2 ASP A 88 -3.144 19.682 -11.711 1.00 60.44 O ATOM 0 H ASP A 88 -3.767 15.024 -8.950 1.00 44.33 H new ATOM 0 HA ASP A 88 -3.275 16.033 -10.900 1.00 45.45 H new ATOM 0 HB2 ASP A 88 -4.857 17.768 -9.833 1.00 14.00 H new ATOM 0 HB3 ASP A 88 -3.430 18.685 -9.393 1.00 14.00 H new ATOM 1461 N GLN A 89 -0.669 16.051 -9.500 1.00 12.45 N ATOM 1462 CA GLN A 89 0.799 16.191 -9.423 1.00 50.53 C ATOM 1463 C GLN A 89 1.470 15.427 -10.573 1.00 51.13 C ATOM 1464 O GLN A 89 1.249 14.221 -10.722 1.00 55.04 O ATOM 1465 CB GLN A 89 1.314 15.654 -8.060 1.00 23.32 C ATOM 1466 CG GLN A 89 0.663 16.295 -6.821 1.00 52.31 C ATOM 1467 CD GLN A 89 0.929 17.800 -6.669 1.00 72.21 C ATOM 1468 OE1 GLN A 89 1.974 18.311 -7.082 1.00 72.33 O ATOM 1469 NE2 GLN A 89 -0.011 18.520 -6.066 1.00 43.42 N ATOM 0 H GLN A 89 -1.029 15.251 -8.980 1.00 12.45 H new ATOM 0 HA GLN A 89 1.053 17.248 -9.509 1.00 50.53 H new ATOM 0 HB2 GLN A 89 1.147 14.578 -8.024 1.00 23.32 H new ATOM 0 HB3 GLN A 89 2.391 15.811 -8.008 1.00 23.32 H new ATOM 0 HG2 GLN A 89 -0.414 16.132 -6.867 1.00 52.31 H new ATOM 0 HG3 GLN A 89 1.026 15.783 -5.930 1.00 52.31 H new ATOM 0 HE21 GLN A 89 -0.864 18.070 -5.735 1.00 43.42 H new ATOM 0 HE22 GLN A 89 0.121 19.523 -5.934 1.00 43.42 H new ATOM 1478 N GLU A 90 2.311 16.138 -11.352 1.00 24.23 N ATOM 1479 CA GLU A 90 3.052 15.566 -12.497 1.00 73.52 C ATOM 1480 C GLU A 90 4.005 14.445 -12.045 1.00 24.11 C ATOM 1481 O GLU A 90 4.126 13.423 -12.720 1.00 15.04 O ATOM 1482 CB GLU A 90 3.862 16.670 -13.220 1.00 24.14 C ATOM 1483 CG GLU A 90 4.700 16.170 -14.420 1.00 71.33 C ATOM 1484 CD GLU A 90 5.592 17.258 -15.030 1.00 1.10 C ATOM 1485 OE1 GLU A 90 5.074 18.109 -15.777 1.00 14.34 O ATOM 1486 OE2 GLU A 90 6.808 17.279 -14.747 1.00 13.15 O ATOM 0 H GLU A 90 2.497 17.130 -11.204 1.00 24.23 H new ATOM 0 HA GLU A 90 2.319 15.142 -13.184 1.00 73.52 H new ATOM 0 HB2 GLU A 90 3.173 17.438 -13.570 1.00 24.14 H new ATOM 0 HB3 GLU A 90 4.529 17.144 -12.500 1.00 24.14 H new ATOM 0 HG2 GLU A 90 5.324 15.337 -14.097 1.00 71.33 H new ATOM 0 HG3 GLU A 90 4.029 15.786 -15.189 1.00 71.33 H new ATOM 1493 N LEU A 91 4.659 14.666 -10.888 1.00 25.14 N ATOM 1494 CA LEU A 91 5.632 13.720 -10.302 1.00 64.21 C ATOM 1495 C LEU A 91 4.923 12.404 -9.929 1.00 21.43 C ATOM 1496 O LEU A 91 5.465 11.315 -10.117 1.00 45.15 O ATOM 1497 CB LEU A 91 6.332 14.329 -9.039 1.00 73.04 C ATOM 1498 CG LEU A 91 7.316 15.538 -9.266 1.00 11.20 C ATOM 1499 CD1 LEU A 91 6.584 16.819 -9.721 1.00 72.14 C ATOM 1500 CD2 LEU A 91 8.169 15.807 -8.000 1.00 55.02 C ATOM 0 H LEU A 91 4.527 15.510 -10.330 1.00 25.14 H new ATOM 0 HA LEU A 91 6.401 13.520 -11.048 1.00 64.21 H new ATOM 0 HB2 LEU A 91 5.555 14.653 -8.347 1.00 73.04 H new ATOM 0 HB3 LEU A 91 6.887 13.532 -8.545 1.00 73.04 H new ATOM 0 HG LEU A 91 7.984 15.251 -10.078 1.00 11.20 H new ATOM 0 HD11 LEU A 91 7.308 17.621 -9.863 1.00 72.14 H new ATOM 0 HD12 LEU A 91 6.066 16.628 -10.661 1.00 72.14 H new ATOM 0 HD13 LEU A 91 5.860 17.114 -8.961 1.00 72.14 H new ATOM 0 HD21 LEU A 91 8.839 16.646 -8.185 1.00 55.02 H new ATOM 0 HD22 LEU A 91 7.513 16.044 -7.163 1.00 55.02 H new ATOM 0 HD23 LEU A 91 8.756 14.920 -7.761 1.00 55.02 H new ATOM 1512 N LEU A 92 3.685 12.552 -9.431 1.00 45.01 N ATOM 1513 CA LEU A 92 2.816 11.435 -9.035 1.00 71.21 C ATOM 1514 C LEU A 92 2.371 10.625 -10.264 1.00 40.43 C ATOM 1515 O LEU A 92 2.354 9.397 -10.219 1.00 14.32 O ATOM 1516 CB LEU A 92 1.602 12.013 -8.246 1.00 64.53 C ATOM 1517 CG LEU A 92 0.472 11.023 -7.762 1.00 40.11 C ATOM 1518 CD1 LEU A 92 -0.155 11.491 -6.429 1.00 53.12 C ATOM 1519 CD2 LEU A 92 -0.640 10.822 -8.832 1.00 72.43 C ATOM 0 H LEU A 92 3.254 13.466 -9.290 1.00 45.01 H new ATOM 0 HA LEU A 92 3.361 10.744 -8.392 1.00 71.21 H new ATOM 0 HB2 LEU A 92 1.993 12.524 -7.366 1.00 64.53 H new ATOM 0 HB3 LEU A 92 1.131 12.771 -8.872 1.00 64.53 H new ATOM 0 HG LEU A 92 0.958 10.060 -7.604 1.00 40.11 H new ATOM 0 HD11 LEU A 92 -0.929 10.787 -6.124 1.00 53.12 H new ATOM 0 HD12 LEU A 92 0.617 11.537 -5.660 1.00 53.12 H new ATOM 0 HD13 LEU A 92 -0.595 12.479 -6.561 1.00 53.12 H new ATOM 0 HD21 LEU A 92 -1.393 10.133 -8.450 1.00 72.43 H new ATOM 0 HD22 LEU A 92 -1.107 11.781 -9.056 1.00 72.43 H new ATOM 0 HD23 LEU A 92 -0.200 10.411 -9.741 1.00 72.43 H new ATOM 1531 N GLU A 93 2.023 11.341 -11.354 1.00 43.12 N ATOM 1532 CA GLU A 93 1.489 10.738 -12.598 1.00 14.34 C ATOM 1533 C GLU A 93 2.603 10.079 -13.435 1.00 42.33 C ATOM 1534 O GLU A 93 2.351 9.095 -14.140 1.00 34.53 O ATOM 1535 CB GLU A 93 0.738 11.820 -13.419 1.00 64.11 C ATOM 1536 CG GLU A 93 -0.523 12.377 -12.716 1.00 62.55 C ATOM 1537 CD GLU A 93 -1.142 13.569 -13.462 1.00 63.41 C ATOM 1538 OE1 GLU A 93 -1.840 13.356 -14.480 1.00 53.35 O ATOM 1539 OE2 GLU A 93 -0.911 14.732 -13.055 1.00 14.01 O ATOM 0 H GLU A 93 2.104 12.357 -11.398 1.00 43.12 H new ATOM 0 HA GLU A 93 0.789 9.948 -12.326 1.00 14.34 H new ATOM 0 HB2 GLU A 93 1.421 12.644 -13.626 1.00 64.11 H new ATOM 0 HB3 GLU A 93 0.449 11.397 -14.381 1.00 64.11 H new ATOM 0 HG2 GLU A 93 -1.265 11.584 -12.629 1.00 62.55 H new ATOM 0 HG3 GLU A 93 -0.263 12.683 -11.703 1.00 62.55 H new ATOM 1546 N ARG A 94 3.830 10.619 -13.336 1.00 12.41 N ATOM 1547 CA ARG A 94 5.014 10.037 -13.990 1.00 11.45 C ATOM 1548 C ARG A 94 5.379 8.721 -13.282 1.00 62.00 C ATOM 1549 O ARG A 94 5.465 7.672 -13.925 1.00 15.10 O ATOM 1550 CB ARG A 94 6.203 11.038 -13.948 1.00 71.41 C ATOM 1551 CG ARG A 94 7.526 10.504 -14.559 1.00 0.03 C ATOM 1552 CD ARG A 94 8.672 11.528 -14.489 1.00 51.14 C ATOM 1553 NE ARG A 94 8.430 12.704 -15.352 1.00 3.10 N ATOM 1554 CZ ARG A 94 8.655 13.987 -15.013 1.00 52.10 C ATOM 1555 NH1 ARG A 94 9.133 14.306 -13.811 1.00 65.21 N ATOM 1556 NH2 ARG A 94 8.418 14.948 -15.900 1.00 13.34 N ATOM 0 H ARG A 94 4.028 11.466 -12.804 1.00 12.41 H new ATOM 0 HA ARG A 94 4.792 9.831 -15.037 1.00 11.45 H new ATOM 0 HB2 ARG A 94 5.915 11.945 -14.479 1.00 71.41 H new ATOM 0 HB3 ARG A 94 6.386 11.320 -12.911 1.00 71.41 H new ATOM 0 HG2 ARG A 94 7.823 9.597 -14.033 1.00 0.03 H new ATOM 0 HG3 ARG A 94 7.355 10.228 -15.599 1.00 0.03 H new ATOM 0 HD2 ARG A 94 8.799 11.857 -13.458 1.00 51.14 H new ATOM 0 HD3 ARG A 94 9.604 11.047 -14.787 1.00 51.14 H new ATOM 0 HE ARG A 94 8.060 12.528 -16.286 1.00 3.10 H new ATOM 0 HH11 ARG A 94 9.334 13.573 -13.131 1.00 65.21 H new ATOM 0 HH12 ARG A 94 9.298 15.283 -13.571 1.00 65.21 H new ATOM 0 HH21 ARG A 94 8.069 14.710 -16.828 1.00 13.34 H new ATOM 0 HH22 ARG A 94 8.585 15.923 -15.652 1.00 13.34 H new ATOM 1570 N PHE A 95 5.506 8.805 -11.939 1.00 50.21 N ATOM 1571 CA PHE A 95 5.848 7.665 -11.059 1.00 62.11 C ATOM 1572 C PHE A 95 4.796 6.540 -11.176 1.00 73.43 C ATOM 1573 O PHE A 95 5.130 5.346 -11.119 1.00 15.44 O ATOM 1574 CB PHE A 95 5.951 8.167 -9.590 1.00 22.15 C ATOM 1575 CG PHE A 95 6.405 7.111 -8.587 1.00 70.42 C ATOM 1576 CD1 PHE A 95 7.761 6.825 -8.418 1.00 22.11 C ATOM 1577 CD2 PHE A 95 5.479 6.377 -7.837 1.00 15.11 C ATOM 1578 CE1 PHE A 95 8.173 5.858 -7.525 1.00 41.13 C ATOM 1579 CE2 PHE A 95 5.901 5.407 -6.952 1.00 54.50 C ATOM 1580 CZ PHE A 95 7.241 5.144 -6.800 1.00 0.53 C ATOM 0 H PHE A 95 5.372 9.678 -11.429 1.00 50.21 H new ATOM 0 HA PHE A 95 6.807 7.252 -11.370 1.00 62.11 H new ATOM 0 HB2 PHE A 95 6.647 9.005 -9.555 1.00 22.15 H new ATOM 0 HB3 PHE A 95 4.977 8.547 -9.281 1.00 22.15 H new ATOM 0 HD1 PHE A 95 8.496 7.368 -8.994 1.00 22.11 H new ATOM 0 HD2 PHE A 95 4.423 6.572 -7.952 1.00 15.11 H new ATOM 0 HE1 PHE A 95 9.226 5.659 -7.393 1.00 41.13 H new ATOM 0 HE2 PHE A 95 5.175 4.852 -6.376 1.00 54.50 H new ATOM 0 HZ PHE A 95 7.565 4.377 -6.112 1.00 0.53 H new ATOM 1590 N TYR A 96 3.532 6.971 -11.355 1.00 4.12 N ATOM 1591 CA TYR A 96 2.363 6.097 -11.552 1.00 32.32 C ATOM 1592 C TYR A 96 2.596 5.094 -12.698 1.00 24.41 C ATOM 1593 O TYR A 96 2.203 3.924 -12.591 1.00 24.20 O ATOM 1594 CB TYR A 96 1.116 6.990 -11.831 1.00 41.14 C ATOM 1595 CG TYR A 96 -0.111 6.264 -12.397 1.00 23.22 C ATOM 1596 CD1 TYR A 96 -0.956 5.557 -11.560 1.00 23.13 C ATOM 1597 CD2 TYR A 96 -0.409 6.284 -13.767 1.00 31.25 C ATOM 1598 CE1 TYR A 96 -2.046 4.884 -12.051 1.00 63.12 C ATOM 1599 CE2 TYR A 96 -1.503 5.612 -14.266 1.00 65.22 C ATOM 1600 CZ TYR A 96 -2.327 4.915 -13.401 1.00 4.14 C ATOM 1601 OH TYR A 96 -3.420 4.228 -13.891 1.00 52.22 O ATOM 0 H TYR A 96 3.292 7.962 -11.367 1.00 4.12 H new ATOM 0 HA TYR A 96 2.197 5.508 -10.650 1.00 32.32 H new ATOM 0 HB2 TYR A 96 0.828 7.480 -10.901 1.00 41.14 H new ATOM 0 HB3 TYR A 96 1.404 7.776 -12.529 1.00 41.14 H new ATOM 0 HD1 TYR A 96 -0.754 5.535 -10.499 1.00 23.13 H new ATOM 0 HD2 TYR A 96 0.229 6.835 -14.442 1.00 31.25 H new ATOM 0 HE1 TYR A 96 -2.685 4.329 -11.380 1.00 63.12 H new ATOM 0 HE2 TYR A 96 -1.716 5.629 -15.325 1.00 65.22 H new ATOM 0 HH TYR A 96 -3.477 4.354 -14.861 1.00 52.22 H new ATOM 1611 N GLU A 97 3.251 5.570 -13.776 1.00 61.14 N ATOM 1612 CA GLU A 97 3.482 4.761 -14.975 1.00 3.45 C ATOM 1613 C GLU A 97 4.494 3.656 -14.668 1.00 23.40 C ATOM 1614 O GLU A 97 4.241 2.509 -14.996 1.00 34.33 O ATOM 1615 CB GLU A 97 3.991 5.600 -16.177 1.00 1.11 C ATOM 1616 CG GLU A 97 4.154 4.769 -17.501 1.00 53.34 C ATOM 1617 CD GLU A 97 5.466 5.009 -18.272 1.00 63.32 C ATOM 1618 OE1 GLU A 97 6.544 4.665 -17.742 1.00 75.44 O ATOM 1619 OE2 GLU A 97 5.427 5.493 -19.427 1.00 14.12 O ATOM 0 H GLU A 97 3.628 6.516 -13.834 1.00 61.14 H new ATOM 0 HA GLU A 97 2.520 4.333 -15.258 1.00 3.45 H new ATOM 0 HB2 GLU A 97 3.296 6.421 -16.356 1.00 1.11 H new ATOM 0 HB3 GLU A 97 4.951 6.046 -15.917 1.00 1.11 H new ATOM 0 HG2 GLU A 97 4.085 3.709 -17.256 1.00 53.34 H new ATOM 0 HG3 GLU A 97 3.317 4.999 -18.160 1.00 53.34 H new ATOM 1626 N GLN A 98 5.613 4.036 -14.001 1.00 10.14 N ATOM 1627 CA GLN A 98 6.751 3.124 -13.710 1.00 30.34 C ATOM 1628 C GLN A 98 6.307 1.849 -12.970 1.00 13.10 C ATOM 1629 O GLN A 98 6.832 0.758 -13.237 1.00 22.43 O ATOM 1630 CB GLN A 98 7.859 3.855 -12.888 1.00 24.30 C ATOM 1631 CG GLN A 98 8.793 4.774 -13.714 1.00 73.32 C ATOM 1632 CD GLN A 98 8.139 6.078 -14.141 1.00 63.33 C ATOM 1633 OE1 GLN A 98 8.252 7.098 -13.457 1.00 23.13 O ATOM 1634 NE2 GLN A 98 7.437 6.061 -15.261 1.00 3.20 N ATOM 0 H GLN A 98 5.753 4.983 -13.649 1.00 10.14 H new ATOM 0 HA GLN A 98 7.160 2.823 -14.675 1.00 30.34 H new ATOM 0 HB2 GLN A 98 7.379 4.453 -12.113 1.00 24.30 H new ATOM 0 HB3 GLN A 98 8.468 3.106 -12.382 1.00 24.30 H new ATOM 0 HG2 GLN A 98 9.682 4.999 -13.125 1.00 73.32 H new ATOM 0 HG3 GLN A 98 9.126 4.236 -14.602 1.00 73.32 H new ATOM 0 HE21 GLN A 98 7.363 5.201 -15.804 1.00 3.20 H new ATOM 0 HE22 GLN A 98 6.969 6.908 -15.582 1.00 3.20 H new ATOM 1643 N LEU A 99 5.358 2.017 -12.037 1.00 44.42 N ATOM 1644 CA LEU A 99 4.745 0.912 -11.271 1.00 33.21 C ATOM 1645 C LEU A 99 4.114 -0.122 -12.229 1.00 31.32 C ATOM 1646 O LEU A 99 4.448 -1.308 -12.195 1.00 54.44 O ATOM 1647 CB LEU A 99 3.682 1.517 -10.312 1.00 35.13 C ATOM 1648 CG LEU A 99 4.257 2.464 -9.206 1.00 63.42 C ATOM 1649 CD1 LEU A 99 3.186 3.433 -8.669 1.00 55.54 C ATOM 1650 CD2 LEU A 99 4.893 1.647 -8.063 1.00 25.22 C ATOM 0 H LEU A 99 4.987 2.934 -11.787 1.00 44.42 H new ATOM 0 HA LEU A 99 5.503 0.389 -10.688 1.00 33.21 H new ATOM 0 HB2 LEU A 99 2.954 2.073 -10.903 1.00 35.13 H new ATOM 0 HB3 LEU A 99 3.144 0.702 -9.828 1.00 35.13 H new ATOM 0 HG LEU A 99 5.037 3.071 -9.666 1.00 63.42 H new ATOM 0 HD11 LEU A 99 3.625 4.073 -7.904 1.00 55.54 H new ATOM 0 HD12 LEU A 99 2.811 4.050 -9.486 1.00 55.54 H new ATOM 0 HD13 LEU A 99 2.363 2.863 -8.237 1.00 55.54 H new ATOM 0 HD21 LEU A 99 5.286 2.325 -7.306 1.00 25.22 H new ATOM 0 HD22 LEU A 99 4.139 1.000 -7.615 1.00 25.22 H new ATOM 0 HD23 LEU A 99 5.704 1.037 -8.460 1.00 25.22 H new ATOM 1662 N LYS A 100 3.276 0.391 -13.141 1.00 23.51 N ATOM 1663 CA LYS A 100 2.524 -0.419 -14.120 1.00 41.41 C ATOM 1664 C LYS A 100 3.437 -0.924 -15.260 1.00 72.00 C ATOM 1665 O LYS A 100 3.190 -1.987 -15.849 1.00 35.33 O ATOM 1666 CB LYS A 100 1.346 0.420 -14.689 1.00 75.44 C ATOM 1667 CG LYS A 100 0.470 1.125 -13.607 1.00 32.10 C ATOM 1668 CD LYS A 100 -1.051 1.038 -13.879 1.00 32.43 C ATOM 1669 CE LYS A 100 -1.576 -0.407 -13.802 1.00 3.03 C ATOM 1670 NZ LYS A 100 -3.046 -0.485 -14.015 1.00 63.43 N ATOM 0 H LYS A 100 3.097 1.392 -13.224 1.00 23.51 H new ATOM 0 HA LYS A 100 2.129 -1.298 -13.611 1.00 41.41 H new ATOM 0 HB2 LYS A 100 1.748 1.177 -15.362 1.00 75.44 H new ATOM 0 HB3 LYS A 100 0.708 -0.231 -15.286 1.00 75.44 H new ATOM 0 HG2 LYS A 100 0.682 0.679 -12.635 1.00 32.10 H new ATOM 0 HG3 LYS A 100 0.759 2.174 -13.546 1.00 32.10 H new ATOM 0 HD2 LYS A 100 -1.583 1.655 -13.155 1.00 32.43 H new ATOM 0 HD3 LYS A 100 -1.266 1.448 -14.866 1.00 32.43 H new ATOM 0 HE2 LYS A 100 -1.070 -1.016 -14.551 1.00 3.03 H new ATOM 0 HE3 LYS A 100 -1.329 -0.830 -12.828 1.00 3.03 H new ATOM 0 HZ1 LYS A 100 -3.469 -1.104 -13.294 1.00 63.43 H new ATOM 0 HZ2 LYS A 100 -3.459 0.467 -13.939 1.00 63.43 H new ATOM 0 HZ3 LYS A 100 -3.240 -0.872 -14.961 1.00 63.43 H new ATOM 1684 N LYS A 101 4.498 -0.142 -15.526 1.00 63.24 N ATOM 1685 CA LYS A 101 5.469 -0.375 -16.613 1.00 71.42 C ATOM 1686 C LYS A 101 6.398 -1.543 -16.224 1.00 31.31 C ATOM 1687 O LYS A 101 6.947 -2.240 -17.087 1.00 35.44 O ATOM 1688 CB LYS A 101 6.290 0.938 -16.854 1.00 53.02 C ATOM 1689 CG LYS A 101 6.930 1.095 -18.250 1.00 10.41 C ATOM 1690 CD LYS A 101 5.868 1.268 -19.369 1.00 11.43 C ATOM 1691 CE LYS A 101 6.468 1.759 -20.700 1.00 24.45 C ATOM 1692 NZ LYS A 101 6.985 3.155 -20.608 1.00 1.40 N ATOM 0 H LYS A 101 4.711 0.691 -14.978 1.00 63.24 H new ATOM 0 HA LYS A 101 4.951 -0.638 -17.535 1.00 71.42 H new ATOM 0 HB2 LYS A 101 5.632 1.790 -16.681 1.00 53.02 H new ATOM 0 HB3 LYS A 101 7.082 0.989 -16.106 1.00 53.02 H new ATOM 0 HG2 LYS A 101 7.595 1.958 -18.247 1.00 10.41 H new ATOM 0 HG3 LYS A 101 7.543 0.220 -18.466 1.00 10.41 H new ATOM 0 HD2 LYS A 101 5.364 0.316 -19.534 1.00 11.43 H new ATOM 0 HD3 LYS A 101 5.110 1.977 -19.036 1.00 11.43 H new ATOM 0 HE2 LYS A 101 7.278 1.093 -20.998 1.00 24.45 H new ATOM 0 HE3 LYS A 101 5.708 1.706 -21.480 1.00 24.45 H new ATOM 0 HZ1 LYS A 101 7.379 3.441 -21.527 1.00 1.40 H new ATOM 0 HZ2 LYS A 101 6.208 3.796 -20.349 1.00 1.40 H new ATOM 0 HZ3 LYS A 101 7.729 3.203 -19.883 1.00 1.40 H new ATOM 1706 N ASP A 102 6.565 -1.727 -14.901 1.00 2.31 N ATOM 1707 CA ASP A 102 7.333 -2.834 -14.317 1.00 21.42 C ATOM 1708 C ASP A 102 6.429 -4.081 -14.206 1.00 61.14 C ATOM 1709 O ASP A 102 6.587 -5.034 -14.983 1.00 4.32 O ATOM 1710 CB ASP A 102 7.906 -2.415 -12.932 1.00 52.21 C ATOM 1711 CG ASP A 102 8.696 -3.540 -12.232 1.00 72.03 C ATOM 1712 OD1 ASP A 102 9.876 -3.759 -12.590 1.00 31.41 O ATOM 1713 OD2 ASP A 102 8.140 -4.213 -11.331 1.00 2.00 O ATOM 0 H ASP A 102 6.164 -1.101 -14.202 1.00 2.31 H new ATOM 0 HA ASP A 102 8.178 -3.080 -14.961 1.00 21.42 H new ATOM 0 HB2 ASP A 102 8.557 -1.551 -13.063 1.00 52.21 H new ATOM 0 HB3 ASP A 102 7.085 -2.101 -12.287 1.00 52.21 H new ATOM 1718 N GLY A 103 5.459 -4.049 -13.262 1.00 61.00 N ATOM 1719 CA GLY A 103 4.526 -5.167 -13.065 1.00 13.32 C ATOM 1720 C GLY A 103 3.691 -5.028 -11.798 1.00 4.14 C ATOM 1721 O GLY A 103 3.517 -5.997 -11.052 1.00 43.32 O ATOM 0 H GLY A 103 5.308 -3.262 -12.631 1.00 61.00 H new ATOM 0 HA2 GLY A 103 3.861 -5.235 -13.926 1.00 13.32 H new ATOM 0 HA3 GLY A 103 5.089 -6.100 -13.023 1.00 13.32 H new ATOM 1725 N VAL A 104 3.165 -3.817 -11.559 1.00 63.44 N ATOM 1726 CA VAL A 104 2.340 -3.490 -10.370 1.00 73.21 C ATOM 1727 C VAL A 104 1.064 -2.760 -10.816 1.00 3.24 C ATOM 1728 O VAL A 104 1.129 -1.813 -11.607 1.00 62.33 O ATOM 1729 CB VAL A 104 3.134 -2.589 -9.342 1.00 54.42 C ATOM 1730 CG1 VAL A 104 2.266 -2.147 -8.139 1.00 33.03 C ATOM 1731 CG2 VAL A 104 4.402 -3.309 -8.853 1.00 2.24 C ATOM 0 H VAL A 104 3.298 -3.025 -12.188 1.00 63.44 H new ATOM 0 HA VAL A 104 2.082 -4.424 -9.870 1.00 73.21 H new ATOM 0 HB VAL A 104 3.421 -1.684 -9.877 1.00 54.42 H new ATOM 0 HG11 VAL A 104 2.863 -1.531 -7.466 1.00 33.03 H new ATOM 0 HG12 VAL A 104 1.413 -1.571 -8.498 1.00 33.03 H new ATOM 0 HG13 VAL A 104 1.910 -3.028 -7.604 1.00 33.03 H new ATOM 0 HG21 VAL A 104 4.933 -2.671 -8.147 1.00 2.24 H new ATOM 0 HG22 VAL A 104 4.124 -4.242 -8.362 1.00 2.24 H new ATOM 0 HG23 VAL A 104 5.048 -3.525 -9.704 1.00 2.24 H new ATOM 1741 N ASP A 105 -0.092 -3.207 -10.305 1.00 3.41 N ATOM 1742 CA ASP A 105 -1.386 -2.579 -10.592 1.00 21.22 C ATOM 1743 C ASP A 105 -1.607 -1.417 -9.604 1.00 60.34 C ATOM 1744 O ASP A 105 -1.125 -1.471 -8.464 1.00 62.43 O ATOM 1745 CB ASP A 105 -2.524 -3.625 -10.482 1.00 11.41 C ATOM 1746 CG ASP A 105 -3.860 -3.227 -11.154 1.00 54.13 C ATOM 1747 OD1 ASP A 105 -3.915 -2.219 -11.905 1.00 63.12 O ATOM 1748 OD2 ASP A 105 -4.861 -3.939 -10.939 1.00 42.31 O ATOM 0 H ASP A 105 -0.155 -4.013 -9.682 1.00 3.41 H new ATOM 0 HA ASP A 105 -1.391 -2.188 -11.609 1.00 21.22 H new ATOM 0 HB2 ASP A 105 -2.179 -4.560 -10.924 1.00 11.41 H new ATOM 0 HB3 ASP A 105 -2.712 -3.822 -9.427 1.00 11.41 H new ATOM 1753 N VAL A 106 -2.339 -0.371 -10.035 1.00 75.31 N ATOM 1754 CA VAL A 106 -2.488 0.873 -9.253 1.00 33.34 C ATOM 1755 C VAL A 106 -3.953 1.353 -9.237 1.00 45.31 C ATOM 1756 O VAL A 106 -4.643 1.267 -10.257 1.00 64.11 O ATOM 1757 CB VAL A 106 -1.604 2.042 -9.834 1.00 54.13 C ATOM 1758 CG1 VAL A 106 -1.674 3.275 -8.921 1.00 64.24 C ATOM 1759 CG2 VAL A 106 -0.136 1.633 -10.086 1.00 14.52 C ATOM 0 H VAL A 106 -2.838 -0.363 -10.924 1.00 75.31 H new ATOM 0 HA VAL A 106 -2.159 0.633 -8.242 1.00 33.34 H new ATOM 0 HB VAL A 106 -2.023 2.290 -10.809 1.00 54.13 H new ATOM 0 HG11 VAL A 106 -1.058 4.072 -9.338 1.00 64.24 H new ATOM 0 HG12 VAL A 106 -2.707 3.615 -8.848 1.00 64.24 H new ATOM 0 HG13 VAL A 106 -1.307 3.014 -7.928 1.00 64.24 H new ATOM 0 HG21 VAL A 106 0.415 2.484 -10.485 1.00 14.52 H new ATOM 0 HG22 VAL A 106 0.319 1.314 -9.148 1.00 14.52 H new ATOM 0 HG23 VAL A 106 -0.105 0.812 -10.802 1.00 14.52 H new ATOM 1769 N ARG A 107 -4.422 1.865 -8.076 1.00 43.31 N ATOM 1770 CA ARG A 107 -5.682 2.636 -7.965 1.00 34.11 C ATOM 1771 C ARG A 107 -5.333 4.085 -7.575 1.00 30.24 C ATOM 1772 O ARG A 107 -4.889 4.328 -6.445 1.00 22.53 O ATOM 1773 CB ARG A 107 -6.673 2.023 -6.908 1.00 0.05 C ATOM 1774 CG ARG A 107 -7.480 0.791 -7.390 1.00 43.22 C ATOM 1775 CD ARG A 107 -6.606 -0.446 -7.619 1.00 1.34 C ATOM 1776 NE ARG A 107 -7.277 -1.508 -8.388 1.00 61.12 N ATOM 1777 CZ ARG A 107 -7.056 -1.775 -9.688 1.00 3.15 C ATOM 1778 NH1 ARG A 107 -6.199 -1.065 -10.406 1.00 21.35 N ATOM 1779 NH2 ARG A 107 -7.646 -2.805 -10.242 1.00 51.45 N ATOM 0 H ARG A 107 -3.935 1.755 -7.186 1.00 43.31 H new ATOM 0 HA ARG A 107 -6.189 2.602 -8.929 1.00 34.11 H new ATOM 0 HB2 ARG A 107 -6.104 1.739 -6.023 1.00 0.05 H new ATOM 0 HB3 ARG A 107 -7.375 2.798 -6.601 1.00 0.05 H new ATOM 0 HG2 ARG A 107 -8.247 0.555 -6.653 1.00 43.22 H new ATOM 0 HG3 ARG A 107 -7.995 1.041 -8.317 1.00 43.22 H new ATOM 0 HD2 ARG A 107 -5.698 -0.147 -8.144 1.00 1.34 H new ATOM 0 HD3 ARG A 107 -6.299 -0.847 -6.653 1.00 1.34 H new ATOM 0 HE ARG A 107 -7.961 -2.085 -7.898 1.00 61.12 H new ATOM 0 HH11 ARG A 107 -5.688 -0.295 -9.975 1.00 21.35 H new ATOM 0 HH12 ARG A 107 -6.050 -1.289 -11.390 1.00 21.35 H new ATOM 0 HH21 ARG A 107 -8.266 -3.396 -9.689 1.00 51.45 H new ATOM 0 HH22 ARG A 107 -7.485 -3.016 -11.227 1.00 51.45 H new ATOM 1793 N VAL A 108 -5.487 5.034 -8.520 1.00 70.31 N ATOM 1794 CA VAL A 108 -5.474 6.471 -8.205 1.00 0.10 C ATOM 1795 C VAL A 108 -6.902 6.888 -7.834 1.00 55.50 C ATOM 1796 O VAL A 108 -7.817 6.833 -8.663 1.00 74.44 O ATOM 1797 CB VAL A 108 -4.887 7.384 -9.365 1.00 72.35 C ATOM 1798 CG1 VAL A 108 -3.348 7.276 -9.438 1.00 4.35 C ATOM 1799 CG2 VAL A 108 -5.515 7.059 -10.743 1.00 0.10 C ATOM 0 H VAL A 108 -5.622 4.827 -9.510 1.00 70.31 H new ATOM 0 HA VAL A 108 -4.794 6.626 -7.368 1.00 0.10 H new ATOM 0 HB VAL A 108 -5.153 8.411 -9.116 1.00 72.35 H new ATOM 0 HG11 VAL A 108 -2.976 7.912 -10.241 1.00 4.35 H new ATOM 0 HG12 VAL A 108 -2.915 7.598 -8.491 1.00 4.35 H new ATOM 0 HG13 VAL A 108 -3.065 6.242 -9.634 1.00 4.35 H new ATOM 0 HG21 VAL A 108 -5.081 7.709 -11.503 1.00 0.10 H new ATOM 0 HG22 VAL A 108 -5.314 6.019 -10.998 1.00 0.10 H new ATOM 0 HG23 VAL A 108 -6.592 7.220 -10.699 1.00 0.10 H new ATOM 1809 N THR A 109 -7.101 7.250 -6.566 1.00 15.32 N ATOM 1810 CA THR A 109 -8.433 7.547 -6.034 1.00 32.53 C ATOM 1811 C THR A 109 -8.796 9.022 -6.265 1.00 64.20 C ATOM 1812 O THR A 109 -9.952 9.340 -6.562 1.00 3.21 O ATOM 1813 CB THR A 109 -8.498 7.185 -4.519 1.00 24.12 C ATOM 1814 OG1 THR A 109 -7.948 5.869 -4.336 1.00 24.14 O ATOM 1815 CG2 THR A 109 -9.937 7.206 -3.981 1.00 23.11 C ATOM 0 H THR A 109 -6.350 7.345 -5.883 1.00 15.32 H new ATOM 0 HA THR A 109 -9.165 6.938 -6.565 1.00 32.53 H new ATOM 0 HB THR A 109 -7.926 7.932 -3.968 1.00 24.12 H new ATOM 0 HG1 THR A 109 -7.282 5.890 -3.617 1.00 24.14 H new ATOM 0 HG21 THR A 109 -9.933 6.948 -2.922 1.00 23.11 H new ATOM 0 HG22 THR A 109 -10.359 8.203 -4.110 1.00 23.11 H new ATOM 0 HG23 THR A 109 -10.541 6.483 -4.529 1.00 23.11 H new ATOM 1823 N ASP A 110 -7.779 9.906 -6.108 1.00 65.22 N ATOM 1824 CA ASP A 110 -7.917 11.383 -6.254 1.00 42.30 C ATOM 1825 C ASP A 110 -8.918 11.951 -5.203 1.00 53.03 C ATOM 1826 O ASP A 110 -9.355 13.102 -5.272 1.00 45.41 O ATOM 1827 CB ASP A 110 -8.326 11.744 -7.729 1.00 31.51 C ATOM 1828 CG ASP A 110 -8.020 13.204 -8.149 1.00 31.22 C ATOM 1829 OD1 ASP A 110 -8.836 14.108 -7.874 1.00 20.41 O ATOM 1830 OD2 ASP A 110 -6.967 13.444 -8.776 1.00 41.32 O ATOM 0 H ASP A 110 -6.830 9.614 -5.874 1.00 65.22 H new ATOM 0 HA ASP A 110 -6.954 11.855 -6.057 1.00 42.30 H new ATOM 0 HB2 ASP A 110 -7.808 11.069 -8.410 1.00 31.51 H new ATOM 0 HB3 ASP A 110 -9.394 11.562 -7.850 1.00 31.51 H new ATOM 1835 N ASN A 111 -9.190 11.141 -4.172 1.00 44.34 N ATOM 1836 CA ASN A 111 -10.306 11.340 -3.244 1.00 43.41 C ATOM 1837 C ASN A 111 -10.015 10.558 -1.946 1.00 14.53 C ATOM 1838 O ASN A 111 -9.258 9.580 -1.959 1.00 71.24 O ATOM 1839 CB ASN A 111 -11.622 10.858 -3.935 1.00 64.53 C ATOM 1840 CG ASN A 111 -12.890 11.146 -3.137 1.00 23.41 C ATOM 1841 OD1 ASN A 111 -13.324 10.339 -2.325 1.00 43.42 O ATOM 1842 ND2 ASN A 111 -13.502 12.297 -3.369 1.00 50.31 N ATOM 0 H ASN A 111 -8.630 10.316 -3.957 1.00 44.34 H new ATOM 0 HA ASN A 111 -10.426 12.392 -2.985 1.00 43.41 H new ATOM 0 HB2 ASN A 111 -11.703 11.338 -4.910 1.00 64.53 H new ATOM 0 HB3 ASN A 111 -11.554 9.785 -4.112 1.00 64.53 H new ATOM 0 HD21 ASN A 111 -14.358 12.530 -2.865 1.00 50.31 H new ATOM 0 HD22 ASN A 111 -13.118 12.951 -4.051 1.00 50.31 H new ATOM 1849 N GLU A 112 -10.594 11.013 -0.833 1.00 21.31 N ATOM 1850 CA GLU A 112 -10.339 10.461 0.518 1.00 53.22 C ATOM 1851 C GLU A 112 -11.457 9.480 0.926 1.00 41.51 C ATOM 1852 O GLU A 112 -11.204 8.451 1.571 1.00 70.22 O ATOM 1853 CB GLU A 112 -10.271 11.640 1.518 1.00 71.35 C ATOM 1854 CG GLU A 112 -9.279 12.766 1.110 1.00 33.14 C ATOM 1855 CD GLU A 112 -9.488 14.112 1.833 1.00 54.22 C ATOM 1856 OE1 GLU A 112 -10.387 14.224 2.696 1.00 23.44 O ATOM 1857 OE2 GLU A 112 -8.759 15.077 1.518 1.00 73.03 O ATOM 0 H GLU A 112 -11.262 11.784 -0.834 1.00 21.31 H new ATOM 0 HA GLU A 112 -9.398 9.911 0.519 1.00 53.22 H new ATOM 0 HB2 GLU A 112 -11.267 12.070 1.624 1.00 71.35 H new ATOM 0 HB3 GLU A 112 -9.984 11.255 2.497 1.00 71.35 H new ATOM 0 HG2 GLU A 112 -8.263 12.422 1.302 1.00 33.14 H new ATOM 0 HG3 GLU A 112 -9.362 12.931 0.036 1.00 33.14 H new ATOM 1864 N ASP A 113 -12.689 9.840 0.530 1.00 2.24 N ATOM 1865 CA ASP A 113 -13.924 9.111 0.868 1.00 3.12 C ATOM 1866 C ASP A 113 -13.943 7.712 0.217 1.00 44.23 C ATOM 1867 O ASP A 113 -14.102 6.703 0.905 1.00 14.45 O ATOM 1868 CB ASP A 113 -15.142 9.965 0.415 1.00 31.11 C ATOM 1869 CG ASP A 113 -16.503 9.281 0.620 1.00 21.24 C ATOM 1870 OD1 ASP A 113 -17.024 9.299 1.758 1.00 35.31 O ATOM 1871 OD2 ASP A 113 -17.071 8.751 -0.360 1.00 61.33 O ATOM 0 H ASP A 113 -12.858 10.664 -0.047 1.00 2.24 H new ATOM 0 HA ASP A 113 -13.973 8.954 1.946 1.00 3.12 H new ATOM 0 HB2 ASP A 113 -15.135 10.907 0.964 1.00 31.11 H new ATOM 0 HB3 ASP A 113 -15.027 10.210 -0.641 1.00 31.11 H new ATOM 1876 N GLU A 114 -13.741 7.671 -1.108 1.00 63.15 N ATOM 1877 CA GLU A 114 -13.654 6.413 -1.887 1.00 32.21 C ATOM 1878 C GLU A 114 -12.428 5.567 -1.455 1.00 4.12 C ATOM 1879 O GLU A 114 -12.475 4.331 -1.504 1.00 43.32 O ATOM 1880 CB GLU A 114 -13.647 6.761 -3.413 1.00 13.31 C ATOM 1881 CG GLU A 114 -13.289 5.614 -4.411 1.00 72.11 C ATOM 1882 CD GLU A 114 -14.111 4.310 -4.277 1.00 4.01 C ATOM 1883 OE1 GLU A 114 -15.342 4.381 -4.077 1.00 10.03 O ATOM 1884 OE2 GLU A 114 -13.527 3.202 -4.406 1.00 51.23 O ATOM 0 H GLU A 114 -13.632 8.510 -1.678 1.00 63.15 H new ATOM 0 HA GLU A 114 -14.526 5.791 -1.685 1.00 32.21 H new ATOM 0 HB2 GLU A 114 -14.634 7.140 -3.676 1.00 13.31 H new ATOM 0 HB3 GLU A 114 -12.940 7.576 -3.569 1.00 13.31 H new ATOM 0 HG2 GLU A 114 -13.410 5.993 -5.426 1.00 72.11 H new ATOM 0 HG3 GLU A 114 -12.234 5.368 -4.287 1.00 72.11 H new ATOM 1891 N ALA A 115 -11.356 6.238 -0.988 1.00 1.13 N ATOM 1892 CA ALA A 115 -10.129 5.566 -0.522 1.00 45.21 C ATOM 1893 C ALA A 115 -10.404 4.704 0.732 1.00 12.05 C ATOM 1894 O ALA A 115 -10.105 3.506 0.737 1.00 34.22 O ATOM 1895 CB ALA A 115 -9.030 6.605 -0.250 1.00 51.03 C ATOM 0 H ALA A 115 -11.317 7.255 -0.924 1.00 1.13 H new ATOM 0 HA ALA A 115 -9.784 4.894 -1.308 1.00 45.21 H new ATOM 0 HB1 ALA A 115 -8.128 6.099 0.094 1.00 51.03 H new ATOM 0 HB2 ALA A 115 -8.812 7.153 -1.167 1.00 51.03 H new ATOM 0 HB3 ALA A 115 -9.370 7.302 0.516 1.00 51.03 H new ATOM 1901 N LYS A 116 -11.017 5.327 1.760 1.00 1.40 N ATOM 1902 CA LYS A 116 -11.290 4.666 3.060 1.00 2.12 C ATOM 1903 C LYS A 116 -12.381 3.578 2.936 1.00 62.24 C ATOM 1904 O LYS A 116 -12.259 2.510 3.547 1.00 2.33 O ATOM 1905 CB LYS A 116 -11.663 5.717 4.147 1.00 30.53 C ATOM 1906 CG LYS A 116 -12.895 6.593 3.833 1.00 14.23 C ATOM 1907 CD LYS A 116 -13.150 7.712 4.879 1.00 24.31 C ATOM 1908 CE LYS A 116 -13.471 7.166 6.279 1.00 64.42 C ATOM 1909 NZ LYS A 116 -13.849 8.248 7.231 1.00 34.11 N ATOM 0 H LYS A 116 -11.336 6.295 1.717 1.00 1.40 H new ATOM 0 HA LYS A 116 -10.374 4.165 3.371 1.00 2.12 H new ATOM 0 HB2 LYS A 116 -11.841 5.194 5.086 1.00 30.53 H new ATOM 0 HB3 LYS A 116 -10.805 6.371 4.304 1.00 30.53 H new ATOM 0 HG2 LYS A 116 -12.765 7.049 2.851 1.00 14.23 H new ATOM 0 HG3 LYS A 116 -13.777 5.956 3.774 1.00 14.23 H new ATOM 0 HD2 LYS A 116 -12.270 8.353 4.938 1.00 24.31 H new ATOM 0 HD3 LYS A 116 -13.977 8.336 4.540 1.00 24.31 H new ATOM 0 HE2 LYS A 116 -14.286 6.445 6.208 1.00 64.42 H new ATOM 0 HE3 LYS A 116 -12.604 6.630 6.666 1.00 64.42 H new ATOM 0 HZ1 LYS A 116 -13.452 8.039 8.169 1.00 34.11 H new ATOM 0 HZ2 LYS A 116 -13.474 9.156 6.891 1.00 34.11 H new ATOM 0 HZ3 LYS A 116 -14.885 8.305 7.298 1.00 34.11 H new ATOM 1923 N LYS A 117 -13.424 3.854 2.119 1.00 32.33 N ATOM 1924 CA LYS A 117 -14.529 2.903 1.861 1.00 13.30 C ATOM 1925 C LYS A 117 -13.998 1.594 1.251 1.00 55.20 C ATOM 1926 O LYS A 117 -14.342 0.491 1.707 1.00 1.53 O ATOM 1927 CB LYS A 117 -15.588 3.531 0.906 1.00 60.14 C ATOM 1928 CG LYS A 117 -16.446 4.640 1.540 1.00 71.23 C ATOM 1929 CD LYS A 117 -17.532 5.183 0.582 1.00 74.24 C ATOM 1930 CE LYS A 117 -18.496 6.155 1.288 1.00 13.34 C ATOM 1931 NZ LYS A 117 -19.194 5.517 2.439 1.00 32.20 N ATOM 0 H LYS A 117 -13.523 4.739 1.622 1.00 32.33 H new ATOM 0 HA LYS A 117 -15.001 2.680 2.818 1.00 13.30 H new ATOM 0 HB2 LYS A 117 -15.075 3.940 0.035 1.00 60.14 H new ATOM 0 HB3 LYS A 117 -16.247 2.741 0.546 1.00 60.14 H new ATOM 0 HG2 LYS A 117 -16.923 4.253 2.440 1.00 71.23 H new ATOM 0 HG3 LYS A 117 -15.799 5.461 1.850 1.00 71.23 H new ATOM 0 HD2 LYS A 117 -17.054 5.692 -0.255 1.00 74.24 H new ATOM 0 HD3 LYS A 117 -18.098 4.349 0.167 1.00 74.24 H new ATOM 0 HE2 LYS A 117 -17.940 7.025 1.639 1.00 13.34 H new ATOM 0 HE3 LYS A 117 -19.234 6.516 0.572 1.00 13.34 H new ATOM 0 HZ1 LYS A 117 -20.013 6.096 2.713 1.00 32.20 H new ATOM 0 HZ2 LYS A 117 -19.517 4.567 2.166 1.00 32.20 H new ATOM 0 HZ3 LYS A 117 -18.539 5.442 3.244 1.00 32.20 H new ATOM 1945 N ARG A 118 -13.143 1.746 0.224 1.00 73.40 N ATOM 1946 CA ARG A 118 -12.579 0.615 -0.521 1.00 41.54 C ATOM 1947 C ARG A 118 -11.556 -0.156 0.336 1.00 40.33 C ATOM 1948 O ARG A 118 -11.469 -1.369 0.208 1.00 44.11 O ATOM 1949 CB ARG A 118 -11.936 1.114 -1.840 1.00 2.33 C ATOM 1950 CG ARG A 118 -11.504 -0.004 -2.819 1.00 51.42 C ATOM 1951 CD ARG A 118 -10.885 0.551 -4.122 1.00 32.41 C ATOM 1952 NE ARG A 118 -9.642 1.312 -3.873 1.00 22.03 N ATOM 1953 CZ ARG A 118 -9.534 2.653 -3.837 1.00 64.15 C ATOM 1954 NH1 ARG A 118 -10.589 3.444 -4.029 1.00 23.11 N ATOM 1955 NH2 ARG A 118 -8.361 3.193 -3.579 1.00 33.32 N ATOM 0 H ARG A 118 -12.826 2.656 -0.110 1.00 73.40 H new ATOM 0 HA ARG A 118 -13.386 -0.074 -0.769 1.00 41.54 H new ATOM 0 HB2 ARG A 118 -12.645 1.768 -2.348 1.00 2.33 H new ATOM 0 HB3 ARG A 118 -11.063 1.719 -1.595 1.00 2.33 H new ATOM 0 HG2 ARG A 118 -10.781 -0.654 -2.326 1.00 51.42 H new ATOM 0 HG3 ARG A 118 -12.369 -0.619 -3.066 1.00 51.42 H new ATOM 0 HD2 ARG A 118 -10.673 -0.275 -4.801 1.00 32.41 H new ATOM 0 HD3 ARG A 118 -11.609 1.195 -4.620 1.00 32.41 H new ATOM 0 HE ARG A 118 -8.791 0.773 -3.714 1.00 22.03 H new ATOM 0 HH11 ARG A 118 -11.506 3.036 -4.209 1.00 23.11 H new ATOM 0 HH12 ARG A 118 -10.479 4.458 -3.996 1.00 23.11 H new ATOM 0 HH21 ARG A 118 -7.551 2.597 -3.410 1.00 33.32 H new ATOM 0 HH22 ARG A 118 -8.262 4.208 -3.548 1.00 33.32 H new ATOM 1969 N LEU A 119 -10.814 0.559 1.222 1.00 10.02 N ATOM 1970 CA LEU A 119 -9.823 -0.062 2.142 1.00 10.35 C ATOM 1971 C LEU A 119 -10.482 -1.113 3.051 1.00 31.14 C ATOM 1972 O LEU A 119 -9.975 -2.225 3.184 1.00 4.42 O ATOM 1973 CB LEU A 119 -9.089 1.006 3.009 1.00 64.31 C ATOM 1974 CG LEU A 119 -7.904 1.752 2.322 1.00 73.12 C ATOM 1975 CD1 LEU A 119 -7.310 2.811 3.261 1.00 70.10 C ATOM 1976 CD2 LEU A 119 -6.822 0.759 1.857 1.00 60.11 C ATOM 0 H LEU A 119 -10.884 1.572 1.319 1.00 10.02 H new ATOM 0 HA LEU A 119 -9.083 -0.559 1.515 1.00 10.35 H new ATOM 0 HB2 LEU A 119 -9.820 1.747 3.331 1.00 64.31 H new ATOM 0 HB3 LEU A 119 -8.712 0.518 3.908 1.00 64.31 H new ATOM 0 HG LEU A 119 -8.292 2.261 1.440 1.00 73.12 H new ATOM 0 HD11 LEU A 119 -6.485 3.319 2.761 1.00 70.10 H new ATOM 0 HD12 LEU A 119 -8.079 3.538 3.522 1.00 70.10 H new ATOM 0 HD13 LEU A 119 -6.944 2.329 4.167 1.00 70.10 H new ATOM 0 HD21 LEU A 119 -6.007 1.305 1.381 1.00 60.11 H new ATOM 0 HD22 LEU A 119 -6.438 0.210 2.717 1.00 60.11 H new ATOM 0 HD23 LEU A 119 -7.254 0.058 1.143 1.00 60.11 H new ATOM 1988 N LYS A 120 -11.622 -0.741 3.649 1.00 25.13 N ATOM 1989 CA LYS A 120 -12.417 -1.642 4.505 1.00 74.11 C ATOM 1990 C LYS A 120 -12.908 -2.866 3.697 1.00 21.41 C ATOM 1991 O LYS A 120 -12.866 -4.005 4.179 1.00 65.34 O ATOM 1992 CB LYS A 120 -13.614 -0.864 5.097 1.00 71.13 C ATOM 1993 CG LYS A 120 -14.496 -1.682 6.053 1.00 24.11 C ATOM 1994 CD LYS A 120 -15.674 -0.864 6.629 1.00 10.21 C ATOM 1995 CE LYS A 120 -16.643 -1.740 7.433 1.00 4.14 C ATOM 1996 NZ LYS A 120 -17.276 -2.793 6.585 1.00 61.24 N ATOM 0 H LYS A 120 -12.022 0.193 3.555 1.00 25.13 H new ATOM 0 HA LYS A 120 -11.791 -2.007 5.319 1.00 74.11 H new ATOM 0 HB2 LYS A 120 -13.236 0.009 5.629 1.00 71.13 H new ATOM 0 HB3 LYS A 120 -14.232 -0.496 4.278 1.00 71.13 H new ATOM 0 HG2 LYS A 120 -14.887 -2.551 5.525 1.00 24.11 H new ATOM 0 HG3 LYS A 120 -13.884 -2.057 6.874 1.00 24.11 H new ATOM 0 HD2 LYS A 120 -15.286 -0.071 7.269 1.00 10.21 H new ATOM 0 HD3 LYS A 120 -16.213 -0.381 5.814 1.00 10.21 H new ATOM 0 HE2 LYS A 120 -16.108 -2.211 8.257 1.00 4.14 H new ATOM 0 HE3 LYS A 120 -17.419 -1.114 7.873 1.00 4.14 H new ATOM 0 HZ1 LYS A 120 -18.096 -3.193 7.083 1.00 61.24 H new ATOM 0 HZ2 LYS A 120 -17.588 -2.374 5.686 1.00 61.24 H new ATOM 0 HZ3 LYS A 120 -16.585 -3.547 6.394 1.00 61.24 H new ATOM 2010 N GLU A 121 -13.322 -2.586 2.446 1.00 32.13 N ATOM 2011 CA GLU A 121 -13.809 -3.589 1.485 1.00 63.20 C ATOM 2012 C GLU A 121 -12.685 -4.590 1.089 1.00 60.32 C ATOM 2013 O GLU A 121 -12.963 -5.764 0.830 1.00 51.51 O ATOM 2014 CB GLU A 121 -14.370 -2.853 0.230 1.00 14.14 C ATOM 2015 CG GLU A 121 -14.993 -3.759 -0.856 1.00 63.31 C ATOM 2016 CD GLU A 121 -16.293 -4.454 -0.410 1.00 41.34 C ATOM 2017 OE1 GLU A 121 -16.223 -5.513 0.246 1.00 31.30 O ATOM 2018 OE2 GLU A 121 -17.395 -3.942 -0.715 1.00 24.32 O ATOM 0 H GLU A 121 -13.327 -1.638 2.070 1.00 32.13 H new ATOM 0 HA GLU A 121 -14.603 -4.173 1.950 1.00 63.20 H new ATOM 0 HB2 GLU A 121 -15.125 -2.139 0.558 1.00 14.14 H new ATOM 0 HB3 GLU A 121 -13.562 -2.278 -0.222 1.00 14.14 H new ATOM 0 HG2 GLU A 121 -15.198 -3.160 -1.743 1.00 63.31 H new ATOM 0 HG3 GLU A 121 -14.266 -4.518 -1.145 1.00 63.31 H new ATOM 2025 N LEU A 122 -11.416 -4.107 1.066 1.00 71.21 N ATOM 2026 CA LEU A 122 -10.233 -4.928 0.702 1.00 65.05 C ATOM 2027 C LEU A 122 -10.068 -6.110 1.675 1.00 55.32 C ATOM 2028 O LEU A 122 -9.899 -7.255 1.259 1.00 32.24 O ATOM 2029 CB LEU A 122 -8.921 -4.084 0.700 1.00 32.34 C ATOM 2030 CG LEU A 122 -8.839 -2.882 -0.292 1.00 25.31 C ATOM 2031 CD1 LEU A 122 -7.443 -2.252 -0.270 1.00 71.13 C ATOM 2032 CD2 LEU A 122 -9.253 -3.258 -1.729 1.00 73.23 C ATOM 0 H LEU A 122 -11.185 -3.141 1.298 1.00 71.21 H new ATOM 0 HA LEU A 122 -10.408 -5.304 -0.306 1.00 65.05 H new ATOM 0 HB2 LEU A 122 -8.767 -3.699 1.708 1.00 32.34 H new ATOM 0 HB3 LEU A 122 -8.090 -4.755 0.485 1.00 32.34 H new ATOM 0 HG LEU A 122 -9.562 -2.143 0.053 1.00 25.31 H new ATOM 0 HD11 LEU A 122 -7.410 -1.416 -0.969 1.00 71.13 H new ATOM 0 HD12 LEU A 122 -7.222 -1.893 0.735 1.00 71.13 H new ATOM 0 HD13 LEU A 122 -6.703 -2.998 -0.560 1.00 71.13 H new ATOM 0 HD21 LEU A 122 -9.175 -2.381 -2.371 1.00 73.23 H new ATOM 0 HD22 LEU A 122 -8.595 -4.042 -2.104 1.00 73.23 H new ATOM 0 HD23 LEU A 122 -10.282 -3.617 -1.729 1.00 73.23 H new ATOM 2044 N LEU A 123 -10.152 -5.790 2.976 1.00 23.32 N ATOM 2045 CA LEU A 123 -9.997 -6.764 4.083 1.00 54.54 C ATOM 2046 C LEU A 123 -11.057 -7.879 4.005 1.00 40.22 C ATOM 2047 O LEU A 123 -10.800 -9.025 4.385 1.00 54.23 O ATOM 2048 CB LEU A 123 -10.086 -6.034 5.458 1.00 2.44 C ATOM 2049 CG LEU A 123 -8.806 -5.280 5.938 1.00 0.04 C ATOM 2050 CD1 LEU A 123 -8.358 -4.159 4.986 1.00 61.43 C ATOM 2051 CD2 LEU A 123 -9.016 -4.747 7.363 1.00 33.21 C ATOM 0 H LEU A 123 -10.331 -4.839 3.299 1.00 23.32 H new ATOM 0 HA LEU A 123 -9.015 -7.228 3.985 1.00 54.54 H new ATOM 0 HB2 LEU A 123 -10.905 -5.316 5.409 1.00 2.44 H new ATOM 0 HB3 LEU A 123 -10.352 -6.770 6.217 1.00 2.44 H new ATOM 0 HG LEU A 123 -7.992 -6.005 5.937 1.00 0.04 H new ATOM 0 HD11 LEU A 123 -7.463 -3.680 5.384 1.00 61.43 H new ATOM 0 HD12 LEU A 123 -8.138 -4.581 4.005 1.00 61.43 H new ATOM 0 HD13 LEU A 123 -9.154 -3.421 4.893 1.00 61.43 H new ATOM 0 HD21 LEU A 123 -8.119 -4.222 7.691 1.00 33.21 H new ATOM 0 HD22 LEU A 123 -9.862 -4.060 7.374 1.00 33.21 H new ATOM 0 HD23 LEU A 123 -9.216 -5.580 8.037 1.00 33.21 H new ATOM 2063 N GLU A 124 -12.236 -7.515 3.495 1.00 55.21 N ATOM 2064 CA GLU A 124 -13.392 -8.415 3.388 1.00 71.53 C ATOM 2065 C GLU A 124 -13.221 -9.453 2.252 1.00 45.42 C ATOM 2066 O GLU A 124 -13.778 -10.556 2.330 1.00 24.24 O ATOM 2067 CB GLU A 124 -14.671 -7.561 3.183 1.00 72.02 C ATOM 2068 CG GLU A 124 -14.982 -6.614 4.369 1.00 31.13 C ATOM 2069 CD GLU A 124 -16.231 -5.739 4.166 1.00 2.04 C ATOM 2070 OE1 GLU A 124 -17.326 -6.302 3.943 1.00 13.32 O ATOM 2071 OE2 GLU A 124 -16.135 -4.491 4.273 1.00 42.02 O ATOM 0 H GLU A 124 -12.419 -6.576 3.140 1.00 55.21 H new ATOM 0 HA GLU A 124 -13.477 -8.988 4.311 1.00 71.53 H new ATOM 0 HB2 GLU A 124 -14.560 -6.968 2.275 1.00 72.02 H new ATOM 0 HB3 GLU A 124 -15.521 -8.226 3.028 1.00 72.02 H new ATOM 0 HG2 GLU A 124 -15.113 -7.211 5.271 1.00 31.13 H new ATOM 0 HG3 GLU A 124 -14.122 -5.966 4.538 1.00 31.13 H new ATOM 2078 N LYS A 125 -12.437 -9.105 1.213 1.00 41.34 N ATOM 2079 CA LYS A 125 -12.262 -9.960 0.012 1.00 13.44 C ATOM 2080 C LYS A 125 -10.815 -9.893 -0.541 1.00 22.44 C ATOM 2081 O LYS A 125 -10.592 -9.701 -1.748 1.00 5.13 O ATOM 2082 CB LYS A 125 -13.328 -9.562 -1.053 1.00 34.15 C ATOM 2083 CG LYS A 125 -13.371 -8.056 -1.389 1.00 74.22 C ATOM 2084 CD LYS A 125 -14.477 -7.691 -2.405 1.00 15.31 C ATOM 2085 CE LYS A 125 -15.894 -8.010 -1.896 1.00 51.54 C ATOM 2086 NZ LYS A 125 -16.942 -7.488 -2.818 1.00 71.32 N ATOM 0 H LYS A 125 -11.910 -8.233 1.177 1.00 41.34 H new ATOM 0 HA LYS A 125 -12.419 -11.003 0.288 1.00 13.44 H new ATOM 0 HB2 LYS A 125 -13.133 -10.120 -1.969 1.00 34.15 H new ATOM 0 HB3 LYS A 125 -14.311 -9.869 -0.696 1.00 34.15 H new ATOM 0 HG2 LYS A 125 -13.528 -7.490 -0.471 1.00 74.22 H new ATOM 0 HG3 LYS A 125 -12.404 -7.752 -1.789 1.00 74.22 H new ATOM 0 HD2 LYS A 125 -14.412 -6.628 -2.638 1.00 15.31 H new ATOM 0 HD3 LYS A 125 -14.301 -8.232 -3.335 1.00 15.31 H new ATOM 0 HE2 LYS A 125 -16.008 -9.089 -1.789 1.00 51.54 H new ATOM 0 HE3 LYS A 125 -16.031 -7.575 -0.906 1.00 51.54 H new ATOM 0 HZ1 LYS A 125 -17.883 -7.722 -2.442 1.00 71.32 H new ATOM 0 HZ2 LYS A 125 -16.849 -6.455 -2.900 1.00 71.32 H new ATOM 0 HZ3 LYS A 125 -16.826 -7.922 -3.756 1.00 71.32 H new ATOM 2100 N VAL A 126 -9.839 -10.045 0.386 1.00 70.41 N ATOM 2101 CA VAL A 126 -8.390 -10.249 0.091 1.00 12.41 C ATOM 2102 C VAL A 126 -7.659 -8.954 -0.385 1.00 4.42 C ATOM 2103 O VAL A 126 -6.466 -8.803 -0.145 1.00 64.53 O ATOM 2104 CB VAL A 126 -8.129 -11.456 -0.911 1.00 30.40 C ATOM 2105 CG1 VAL A 126 -6.618 -11.705 -1.151 1.00 22.14 C ATOM 2106 CG2 VAL A 126 -8.814 -12.756 -0.415 1.00 74.23 C ATOM 0 H VAL A 126 -10.037 -10.030 1.386 1.00 70.41 H new ATOM 0 HA VAL A 126 -7.949 -10.519 1.051 1.00 12.41 H new ATOM 0 HB VAL A 126 -8.572 -11.168 -1.865 1.00 30.40 H new ATOM 0 HG11 VAL A 126 -6.492 -12.539 -1.842 1.00 22.14 H new ATOM 0 HG12 VAL A 126 -6.165 -10.810 -1.576 1.00 22.14 H new ATOM 0 HG13 VAL A 126 -6.133 -11.942 -0.204 1.00 22.14 H new ATOM 0 HG21 VAL A 126 -8.617 -13.563 -1.121 1.00 74.23 H new ATOM 0 HG22 VAL A 126 -8.417 -13.026 0.564 1.00 74.23 H new ATOM 0 HG23 VAL A 126 -9.889 -12.594 -0.339 1.00 74.23 H new ATOM 2116 N GLY A 127 -8.358 -8.018 -1.040 1.00 4.22 N ATOM 2117 CA GLY A 127 -7.758 -6.724 -1.420 1.00 42.53 C ATOM 2118 C GLY A 127 -7.385 -6.615 -2.879 1.00 1.34 C ATOM 2119 O GLY A 127 -6.968 -5.544 -3.326 1.00 2.13 O ATOM 0 H GLY A 127 -9.333 -8.127 -1.318 1.00 4.22 H new ATOM 0 HA2 GLY A 127 -8.460 -5.926 -1.176 1.00 42.53 H new ATOM 0 HA3 GLY A 127 -6.866 -6.559 -0.816 1.00 42.53 H new