USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=19 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 42:sc= -0.0147 USER MOD Single : A 9 SER OG : rot 130:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.0304 X(o=-0.03,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 60:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.0439 X(o=-0.044,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 148:sc= 0.579 (180deg=-1.28!) USER MOD Single : A 31 THR OG1 : rot -14:sc= 0.981 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0.186 USER MOD Single : A 37 LYS NZ :NH3+ -171:sc= 0.277 (180deg=0.23) USER MOD Single : A 39 LYS NZ :NH3+ 135:sc=-0.000369 (180deg=-0.0887) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 172:sc= 0.859 (180deg=0.817) USER MOD Single : A 49 LYS NZ :NH3+ -118:sc= 0.621 (180deg=0.0578) USER MOD Single : A 50 GLN : amide:sc= -0.0134 X(o=-0.013,f=-0.15) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.382 K(o=-0.38,f=-2.2) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -156:sc= 0.365 (180deg=0.034) USER MOD Single : A 87 GLN : amide:sc= -0.387 X(o=-0.39,f=-0.28) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.252 X(o=-0.25,f=-0.48) USER MOD Single : A 100 LYS NZ :NH3+ 158:sc= 0.231 (180deg=-0.167) USER MOD Single : A 101 LYS NZ :NH3+ -174:sc=-0.00493 (180deg=-0.0733) USER MOD Single : A 109 THR OG1 : rot -170:sc= 0.00639 USER MOD Single : A 111 ASN : amide:sc= -0.233 K(o=-0.23,f=-5.1!) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -176:sc= 0.711 (180deg=0.7) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ -157:sc= 0.917 (180deg=0.536) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -1.320 -13.341 -1.370 1.00 30.51 N ATOM 21 CA GLY A 2 -0.344 -12.377 -1.871 1.00 25.45 C ATOM 22 C GLY A 2 -0.954 -11.038 -2.216 1.00 53.23 C ATOM 23 O GLY A 2 -0.916 -10.608 -3.371 1.00 43.23 O ATOM 0 HA2 GLY A 2 0.433 -12.233 -1.120 1.00 25.45 H new ATOM 0 HA3 GLY A 2 0.141 -12.787 -2.757 1.00 25.45 H new ATOM 27 N THR A 3 -1.542 -10.377 -1.217 1.00 75.53 N ATOM 28 CA THR A 3 -2.174 -9.068 -1.383 1.00 52.12 C ATOM 29 C THR A 3 -1.475 -8.037 -0.485 1.00 73.43 C ATOM 30 O THR A 3 -1.644 -8.047 0.743 1.00 63.34 O ATOM 31 CB THR A 3 -3.700 -9.152 -1.061 1.00 72.44 C ATOM 32 OG1 THR A 3 -3.901 -9.736 0.236 1.00 62.14 O ATOM 33 CG2 THR A 3 -4.459 -9.986 -2.111 1.00 15.43 C ATOM 0 H THR A 3 -1.593 -10.738 -0.264 1.00 75.53 H new ATOM 0 HA THR A 3 -2.071 -8.750 -2.421 1.00 52.12 H new ATOM 0 HB THR A 3 -4.092 -8.135 -1.078 1.00 72.44 H new ATOM 0 HG1 THR A 3 -3.239 -9.376 0.863 1.00 62.14 H new ATOM 0 HG21 THR A 3 -5.517 -10.021 -1.852 1.00 15.43 H new ATOM 0 HG22 THR A 3 -4.341 -9.529 -3.093 1.00 15.43 H new ATOM 0 HG23 THR A 3 -4.057 -10.999 -2.131 1.00 15.43 H new ATOM 41 N VAL A 4 -0.662 -7.174 -1.108 1.00 0.11 N ATOM 42 CA VAL A 4 0.069 -6.105 -0.417 1.00 42.31 C ATOM 43 C VAL A 4 -0.576 -4.797 -0.856 1.00 2.34 C ATOM 44 O VAL A 4 -0.545 -4.479 -2.043 1.00 41.21 O ATOM 45 CB VAL A 4 1.607 -6.108 -0.798 1.00 11.03 C ATOM 46 CG1 VAL A 4 2.398 -5.031 -0.013 1.00 72.51 C ATOM 47 CG2 VAL A 4 2.226 -7.513 -0.606 1.00 74.14 C ATOM 0 H VAL A 4 -0.492 -7.199 -2.113 1.00 0.11 H new ATOM 0 HA VAL A 4 0.016 -6.244 0.663 1.00 42.31 H new ATOM 0 HB VAL A 4 1.680 -5.852 -1.855 1.00 11.03 H new ATOM 0 HG11 VAL A 4 3.448 -5.067 -0.304 1.00 72.51 H new ATOM 0 HG12 VAL A 4 1.992 -4.045 -0.239 1.00 72.51 H new ATOM 0 HG13 VAL A 4 2.311 -5.223 1.056 1.00 72.51 H new ATOM 0 HG21 VAL A 4 3.282 -7.485 -0.875 1.00 74.14 H new ATOM 0 HG22 VAL A 4 2.125 -7.816 0.436 1.00 74.14 H new ATOM 0 HG23 VAL A 4 1.708 -8.229 -1.244 1.00 74.14 H new ATOM 57 N VAL A 5 -1.198 -4.069 0.075 1.00 65.22 N ATOM 58 CA VAL A 5 -1.870 -2.789 -0.235 1.00 2.43 C ATOM 59 C VAL A 5 -1.155 -1.648 0.510 1.00 54.44 C ATOM 60 O VAL A 5 -0.820 -1.785 1.681 1.00 70.01 O ATOM 61 CB VAL A 5 -3.422 -2.843 0.069 1.00 2.31 C ATOM 62 CG1 VAL A 5 -4.126 -3.875 -0.842 1.00 54.43 C ATOM 63 CG2 VAL A 5 -3.724 -3.159 1.542 1.00 21.24 C ATOM 0 H VAL A 5 -1.254 -4.340 1.057 1.00 65.22 H new ATOM 0 HA VAL A 5 -1.796 -2.598 -1.305 1.00 2.43 H new ATOM 0 HB VAL A 5 -3.812 -1.847 -0.141 1.00 2.31 H new ATOM 0 HG11 VAL A 5 -5.192 -3.894 -0.614 1.00 54.43 H new ATOM 0 HG12 VAL A 5 -3.983 -3.596 -1.886 1.00 54.43 H new ATOM 0 HG13 VAL A 5 -3.700 -4.863 -0.669 1.00 54.43 H new ATOM 0 HG21 VAL A 5 -4.803 -3.184 1.695 1.00 21.24 H new ATOM 0 HG22 VAL A 5 -3.298 -4.128 1.801 1.00 21.24 H new ATOM 0 HG23 VAL A 5 -3.285 -2.389 2.177 1.00 21.24 H new ATOM 73 N ILE A 6 -0.860 -0.549 -0.199 1.00 1.23 N ATOM 74 CA ILE A 6 -0.037 0.557 0.317 1.00 61.15 C ATOM 75 C ILE A 6 -0.867 1.844 0.278 1.00 50.21 C ATOM 76 O ILE A 6 -1.218 2.321 -0.796 1.00 72.41 O ATOM 77 CB ILE A 6 1.307 0.776 -0.515 1.00 61.21 C ATOM 78 CG1 ILE A 6 2.202 -0.514 -0.584 1.00 12.30 C ATOM 79 CG2 ILE A 6 2.132 1.951 0.073 1.00 63.22 C ATOM 80 CD1 ILE A 6 1.736 -1.588 -1.554 1.00 2.53 C ATOM 0 H ILE A 6 -1.188 -0.400 -1.153 1.00 1.23 H new ATOM 0 HA ILE A 6 0.256 0.301 1.335 1.00 61.15 H new ATOM 0 HB ILE A 6 0.999 1.015 -1.533 1.00 61.21 H new ATOM 0 HG12 ILE A 6 3.214 -0.217 -0.858 1.00 12.30 H new ATOM 0 HG13 ILE A 6 2.256 -0.950 0.414 1.00 12.30 H new ATOM 0 HG21 ILE A 6 3.044 2.083 -0.509 1.00 63.22 H new ATOM 0 HG22 ILE A 6 1.541 2.866 0.034 1.00 63.22 H new ATOM 0 HG23 ILE A 6 2.391 1.731 1.109 1.00 63.22 H new ATOM 0 HD11 ILE A 6 2.425 -2.432 -1.521 1.00 2.53 H new ATOM 0 HD12 ILE A 6 0.738 -1.924 -1.273 1.00 2.53 H new ATOM 0 HD13 ILE A 6 1.711 -1.180 -2.564 1.00 2.53 H new ATOM 92 N VAL A 7 -1.168 2.390 1.455 1.00 2.33 N ATOM 93 CA VAL A 7 -1.861 3.670 1.605 1.00 0.51 C ATOM 94 C VAL A 7 -0.832 4.805 1.548 1.00 4.41 C ATOM 95 O VAL A 7 0.078 4.880 2.385 1.00 63.03 O ATOM 96 CB VAL A 7 -2.634 3.734 2.972 1.00 33.43 C ATOM 97 CG1 VAL A 7 -3.354 5.087 3.174 1.00 15.40 C ATOM 98 CG2 VAL A 7 -3.618 2.559 3.091 1.00 4.01 C ATOM 0 H VAL A 7 -0.934 1.950 2.345 1.00 2.33 H new ATOM 0 HA VAL A 7 -2.584 3.774 0.796 1.00 0.51 H new ATOM 0 HB VAL A 7 -1.895 3.650 3.769 1.00 33.43 H new ATOM 0 HG11 VAL A 7 -3.874 5.083 4.132 1.00 15.40 H new ATOM 0 HG12 VAL A 7 -2.622 5.894 3.162 1.00 15.40 H new ATOM 0 HG13 VAL A 7 -4.075 5.239 2.371 1.00 15.40 H new ATOM 0 HG21 VAL A 7 -4.144 2.620 4.044 1.00 4.01 H new ATOM 0 HG22 VAL A 7 -4.339 2.604 2.275 1.00 4.01 H new ATOM 0 HG23 VAL A 7 -3.070 1.618 3.039 1.00 4.01 H new ATOM 108 N VAL A 8 -0.967 5.652 0.522 1.00 14.40 N ATOM 109 CA VAL A 8 -0.138 6.846 0.325 1.00 63.12 C ATOM 110 C VAL A 8 -1.077 8.057 0.169 1.00 71.43 C ATOM 111 O VAL A 8 -2.155 7.927 -0.424 1.00 75.11 O ATOM 112 CB VAL A 8 0.781 6.716 -0.950 1.00 50.42 C ATOM 113 CG1 VAL A 8 1.855 7.815 -1.004 1.00 2.24 C ATOM 114 CG2 VAL A 8 1.415 5.318 -1.062 1.00 11.45 C ATOM 0 H VAL A 8 -1.668 5.525 -0.208 1.00 14.40 H new ATOM 0 HA VAL A 8 0.519 6.968 1.186 1.00 63.12 H new ATOM 0 HB VAL A 8 0.130 6.853 -1.814 1.00 50.42 H new ATOM 0 HG11 VAL A 8 2.464 7.685 -1.899 1.00 2.24 H new ATOM 0 HG12 VAL A 8 1.374 8.793 -1.031 1.00 2.24 H new ATOM 0 HG13 VAL A 8 2.490 7.747 -0.120 1.00 2.24 H new ATOM 0 HG21 VAL A 8 2.040 5.272 -1.954 1.00 11.45 H new ATOM 0 HG22 VAL A 8 2.026 5.124 -0.181 1.00 11.45 H new ATOM 0 HG23 VAL A 8 0.629 4.566 -1.131 1.00 11.45 H new ATOM 124 N SER A 9 -0.669 9.212 0.701 1.00 64.40 N ATOM 125 CA SER A 9 -1.434 10.470 0.604 1.00 71.30 C ATOM 126 C SER A 9 -0.606 11.614 1.176 1.00 41.50 C ATOM 127 O SER A 9 -0.031 11.473 2.262 1.00 42.41 O ATOM 128 CB SER A 9 -2.779 10.389 1.363 1.00 53.34 C ATOM 129 OG SER A 9 -3.507 11.612 1.293 1.00 3.54 O ATOM 0 H SER A 9 0.206 9.307 1.216 1.00 64.40 H new ATOM 0 HA SER A 9 -1.651 10.644 -0.450 1.00 71.30 H new ATOM 0 HB2 SER A 9 -3.383 9.583 0.945 1.00 53.34 H new ATOM 0 HB3 SER A 9 -2.591 10.138 2.407 1.00 53.34 H new ATOM 0 HG SER A 9 -4.428 11.429 1.011 1.00 3.54 H new ATOM 135 N ASN A 10 -0.588 12.752 0.456 1.00 1.32 N ATOM 136 CA ASN A 10 0.123 13.984 0.862 1.00 44.43 C ATOM 137 C ASN A 10 -0.299 14.448 2.274 1.00 55.40 C ATOM 138 O ASN A 10 0.460 15.127 2.970 1.00 50.15 O ATOM 139 CB ASN A 10 -0.158 15.090 -0.200 1.00 12.03 C ATOM 140 CG ASN A 10 0.345 16.493 0.180 1.00 13.24 C ATOM 141 OD1 ASN A 10 1.476 16.875 -0.128 1.00 13.22 O ATOM 142 ND2 ASN A 10 -0.504 17.268 0.851 1.00 71.54 N ATOM 0 H ASN A 10 -1.073 12.845 -0.437 1.00 1.32 H new ATOM 0 HA ASN A 10 1.193 13.781 0.910 1.00 44.43 H new ATOM 0 HB2 ASN A 10 0.306 14.796 -1.142 1.00 12.03 H new ATOM 0 HB3 ASN A 10 -1.233 15.140 -0.376 1.00 12.03 H new ATOM 0 HD21 ASN A 10 -0.226 18.210 1.127 1.00 71.54 H new ATOM 0 HD22 ASN A 10 -1.433 16.920 1.090 1.00 71.54 H new ATOM 149 N ASP A 11 -1.510 14.058 2.684 1.00 54.00 N ATOM 150 CA ASP A 11 -2.097 14.444 3.971 1.00 70.41 C ATOM 151 C ASP A 11 -2.045 13.284 4.985 1.00 55.43 C ATOM 152 O ASP A 11 -2.532 12.181 4.714 1.00 14.43 O ATOM 153 CB ASP A 11 -3.535 14.932 3.730 1.00 74.02 C ATOM 154 CG ASP A 11 -3.556 16.199 2.849 1.00 52.45 C ATOM 155 OD1 ASP A 11 -3.605 16.080 1.605 1.00 31.53 O ATOM 156 OD2 ASP A 11 -3.485 17.320 3.393 1.00 74.15 O ATOM 0 H ASP A 11 -2.117 13.459 2.125 1.00 54.00 H new ATOM 0 HA ASP A 11 -1.515 15.255 4.409 1.00 70.41 H new ATOM 0 HB2 ASP A 11 -4.114 14.143 3.250 1.00 74.02 H new ATOM 0 HB3 ASP A 11 -4.015 15.143 4.686 1.00 74.02 H new ATOM 161 N GLU A 12 -1.455 13.575 6.165 1.00 14.20 N ATOM 162 CA GLU A 12 -1.249 12.610 7.271 1.00 31.21 C ATOM 163 C GLU A 12 -2.577 12.129 7.892 1.00 23.42 C ATOM 164 O GLU A 12 -2.653 11.006 8.398 1.00 54.44 O ATOM 165 CB GLU A 12 -0.350 13.248 8.362 1.00 71.20 C ATOM 166 CG GLU A 12 -0.900 14.576 8.939 1.00 61.14 C ATOM 167 CD GLU A 12 -0.077 15.113 10.115 1.00 31.44 C ATOM 168 OE1 GLU A 12 0.950 15.782 9.879 1.00 3.24 O ATOM 169 OE2 GLU A 12 -0.454 14.876 11.284 1.00 3.45 O ATOM 0 H GLU A 12 -1.101 14.507 6.381 1.00 14.20 H new ATOM 0 HA GLU A 12 -0.758 11.732 6.850 1.00 31.21 H new ATOM 0 HB2 GLU A 12 -0.225 12.535 9.177 1.00 71.20 H new ATOM 0 HB3 GLU A 12 0.639 13.429 7.942 1.00 71.20 H new ATOM 0 HG2 GLU A 12 -0.923 15.326 8.148 1.00 61.14 H new ATOM 0 HG3 GLU A 12 -1.929 14.424 9.264 1.00 61.14 H new ATOM 176 N ARG A 13 -3.617 12.994 7.849 1.00 12.41 N ATOM 177 CA ARG A 13 -4.956 12.652 8.368 1.00 43.11 C ATOM 178 C ARG A 13 -5.589 11.508 7.574 1.00 11.32 C ATOM 179 O ARG A 13 -6.429 10.797 8.099 1.00 12.23 O ATOM 180 CB ARG A 13 -5.913 13.862 8.353 1.00 14.44 C ATOM 181 CG ARG A 13 -5.531 15.026 9.291 1.00 64.22 C ATOM 182 CD ARG A 13 -6.654 16.086 9.378 1.00 32.21 C ATOM 183 NE ARG A 13 -7.002 16.651 8.053 1.00 43.32 N ATOM 184 CZ ARG A 13 -8.146 16.423 7.373 1.00 22.13 C ATOM 185 NH1 ARG A 13 -9.098 15.638 7.873 1.00 43.43 N ATOM 186 NH2 ARG A 13 -8.322 16.977 6.182 1.00 72.52 N ATOM 0 H ARG A 13 -3.551 13.934 7.459 1.00 12.41 H new ATOM 0 HA ARG A 13 -4.807 12.337 9.401 1.00 43.11 H new ATOM 0 HB2 ARG A 13 -5.971 14.244 7.334 1.00 14.44 H new ATOM 0 HB3 ARG A 13 -6.911 13.516 8.621 1.00 14.44 H new ATOM 0 HG2 ARG A 13 -5.321 14.636 10.287 1.00 64.22 H new ATOM 0 HG3 ARG A 13 -4.615 15.496 8.933 1.00 64.22 H new ATOM 0 HD2 ARG A 13 -7.542 15.635 9.822 1.00 32.21 H new ATOM 0 HD3 ARG A 13 -6.339 16.891 10.042 1.00 32.21 H new ATOM 0 HE ARG A 13 -6.316 17.267 7.616 1.00 43.32 H new ATOM 0 HH11 ARG A 13 -8.970 15.198 8.784 1.00 43.43 H new ATOM 0 HH12 ARG A 13 -9.956 15.477 7.345 1.00 43.43 H new ATOM 0 HH21 ARG A 13 -7.595 17.572 5.784 1.00 72.52 H new ATOM 0 HH22 ARG A 13 -9.184 16.808 5.664 1.00 72.52 H new ATOM 200 N ILE A 14 -5.199 11.370 6.299 1.00 34.24 N ATOM 201 CA ILE A 14 -5.661 10.275 5.435 1.00 34.33 C ATOM 202 C ILE A 14 -4.954 8.965 5.836 1.00 4.23 C ATOM 203 O ILE A 14 -5.565 7.910 5.836 1.00 74.33 O ATOM 204 CB ILE A 14 -5.414 10.631 3.923 1.00 33.03 C ATOM 205 CG1 ILE A 14 -6.161 11.947 3.533 1.00 61.22 C ATOM 206 CG2 ILE A 14 -5.811 9.483 2.967 1.00 41.12 C ATOM 207 CD1 ILE A 14 -7.678 11.903 3.697 1.00 21.42 C ATOM 0 H ILE A 14 -4.555 12.013 5.838 1.00 34.24 H new ATOM 0 HA ILE A 14 -6.734 10.134 5.566 1.00 34.33 H new ATOM 0 HB ILE A 14 -4.341 10.784 3.811 1.00 33.03 H new ATOM 0 HG12 ILE A 14 -5.769 12.763 4.140 1.00 61.22 H new ATOM 0 HG13 ILE A 14 -5.930 12.183 2.494 1.00 61.22 H new ATOM 0 HG21 ILE A 14 -5.619 9.784 1.937 1.00 41.12 H new ATOM 0 HG22 ILE A 14 -5.223 8.595 3.201 1.00 41.12 H new ATOM 0 HG23 ILE A 14 -6.871 9.259 3.088 1.00 41.12 H new ATOM 0 HD11 ILE A 14 -8.104 12.862 3.401 1.00 21.42 H new ATOM 0 HD12 ILE A 14 -8.089 11.114 3.068 1.00 21.42 H new ATOM 0 HD13 ILE A 14 -7.926 11.702 4.739 1.00 21.42 H new ATOM 219 N LEU A 15 -3.667 9.056 6.223 1.00 60.33 N ATOM 220 CA LEU A 15 -2.918 7.898 6.767 1.00 4.52 C ATOM 221 C LEU A 15 -3.521 7.440 8.106 1.00 55.21 C ATOM 222 O LEU A 15 -3.555 6.247 8.402 1.00 15.34 O ATOM 223 CB LEU A 15 -1.419 8.243 6.948 1.00 12.12 C ATOM 224 CG LEU A 15 -0.638 8.539 5.637 1.00 74.13 C ATOM 225 CD1 LEU A 15 0.827 8.918 5.941 1.00 11.23 C ATOM 226 CD2 LEU A 15 -0.726 7.340 4.664 1.00 11.32 C ATOM 0 H LEU A 15 -3.122 9.916 6.171 1.00 60.33 H new ATOM 0 HA LEU A 15 -3.000 7.081 6.050 1.00 4.52 H new ATOM 0 HB2 LEU A 15 -1.340 9.112 7.601 1.00 12.12 H new ATOM 0 HB3 LEU A 15 -0.932 7.413 7.461 1.00 12.12 H new ATOM 0 HG LEU A 15 -1.102 9.396 5.148 1.00 74.13 H new ATOM 0 HD11 LEU A 15 1.352 9.120 5.007 1.00 11.23 H new ATOM 0 HD12 LEU A 15 0.850 9.808 6.570 1.00 11.23 H new ATOM 0 HD13 LEU A 15 1.316 8.094 6.461 1.00 11.23 H new ATOM 0 HD21 LEU A 15 -0.173 7.569 3.753 1.00 11.32 H new ATOM 0 HD22 LEU A 15 -0.298 6.456 5.136 1.00 11.32 H new ATOM 0 HD23 LEU A 15 -1.770 7.149 4.416 1.00 11.32 H new ATOM 238 N GLU A 16 -3.998 8.411 8.901 1.00 74.00 N ATOM 239 CA GLU A 16 -4.633 8.157 10.200 1.00 71.54 C ATOM 240 C GLU A 16 -6.029 7.536 10.008 1.00 1.24 C ATOM 241 O GLU A 16 -6.351 6.508 10.611 1.00 72.10 O ATOM 242 CB GLU A 16 -4.761 9.480 10.992 1.00 40.10 C ATOM 243 CG GLU A 16 -5.311 9.306 12.427 1.00 4.41 C ATOM 244 CD GLU A 16 -5.863 10.603 13.034 1.00 33.42 C ATOM 245 OE1 GLU A 16 -5.140 11.616 13.059 1.00 12.10 O ATOM 246 OE2 GLU A 16 -7.032 10.614 13.476 1.00 44.23 O ATOM 0 H GLU A 16 -3.953 9.400 8.657 1.00 74.00 H new ATOM 0 HA GLU A 16 -4.010 7.458 10.757 1.00 71.54 H new ATOM 0 HB2 GLU A 16 -3.782 9.956 11.045 1.00 40.10 H new ATOM 0 HB3 GLU A 16 -5.415 10.158 10.443 1.00 40.10 H new ATOM 0 HG2 GLU A 16 -6.101 8.555 12.416 1.00 4.41 H new ATOM 0 HG3 GLU A 16 -4.516 8.924 13.068 1.00 4.41 H new ATOM 253 N GLU A 17 -6.835 8.194 9.156 1.00 0.33 N ATOM 254 CA GLU A 17 -8.236 7.823 8.888 1.00 50.45 C ATOM 255 C GLU A 17 -8.325 6.405 8.315 1.00 15.13 C ATOM 256 O GLU A 17 -9.043 5.547 8.841 1.00 3.44 O ATOM 257 CB GLU A 17 -8.857 8.853 7.896 1.00 35.42 C ATOM 258 CG GLU A 17 -10.325 8.599 7.485 1.00 72.53 C ATOM 259 CD GLU A 17 -11.306 8.603 8.673 1.00 23.31 C ATOM 260 OE1 GLU A 17 -11.531 7.533 9.274 1.00 14.32 O ATOM 261 OE2 GLU A 17 -11.847 9.675 9.015 1.00 52.30 O ATOM 0 H GLU A 17 -6.527 9.010 8.627 1.00 0.33 H new ATOM 0 HA GLU A 17 -8.794 7.838 9.824 1.00 50.45 H new ATOM 0 HB2 GLU A 17 -8.793 9.844 8.345 1.00 35.42 H new ATOM 0 HB3 GLU A 17 -8.246 8.872 6.993 1.00 35.42 H new ATOM 0 HG2 GLU A 17 -10.631 9.362 6.769 1.00 72.53 H new ATOM 0 HG3 GLU A 17 -10.390 7.638 6.974 1.00 72.53 H new ATOM 268 N LEU A 18 -7.530 6.180 7.264 1.00 33.45 N ATOM 269 CA LEU A 18 -7.493 4.921 6.521 1.00 60.53 C ATOM 270 C LEU A 18 -6.879 3.791 7.368 1.00 11.41 C ATOM 271 O LEU A 18 -7.215 2.624 7.156 1.00 44.33 O ATOM 272 CB LEU A 18 -6.756 5.128 5.165 1.00 22.22 C ATOM 273 CG LEU A 18 -7.618 5.729 3.988 1.00 55.12 C ATOM 274 CD1 LEU A 18 -8.261 7.092 4.330 1.00 62.12 C ATOM 275 CD2 LEU A 18 -6.787 5.820 2.694 1.00 75.10 C ATOM 0 H LEU A 18 -6.884 6.881 6.901 1.00 33.45 H new ATOM 0 HA LEU A 18 -8.512 4.608 6.295 1.00 60.53 H new ATOM 0 HB2 LEU A 18 -5.903 5.785 5.335 1.00 22.22 H new ATOM 0 HB3 LEU A 18 -6.358 4.166 4.841 1.00 22.22 H new ATOM 0 HG LEU A 18 -8.445 5.037 3.831 1.00 55.12 H new ATOM 0 HD11 LEU A 18 -8.839 7.446 3.476 1.00 62.12 H new ATOM 0 HD12 LEU A 18 -8.919 6.978 5.191 1.00 62.12 H new ATOM 0 HD13 LEU A 18 -7.479 7.815 4.564 1.00 62.12 H new ATOM 0 HD21 LEU A 18 -7.401 6.237 1.896 1.00 75.10 H new ATOM 0 HD22 LEU A 18 -5.923 6.463 2.861 1.00 75.10 H new ATOM 0 HD23 LEU A 18 -6.448 4.824 2.408 1.00 75.10 H new ATOM 287 N LEU A 19 -5.987 4.151 8.328 1.00 12.11 N ATOM 288 CA LEU A 19 -5.427 3.181 9.297 1.00 21.55 C ATOM 289 C LEU A 19 -6.544 2.515 10.093 1.00 74.51 C ATOM 290 O LEU A 19 -6.607 1.295 10.182 1.00 54.50 O ATOM 291 CB LEU A 19 -4.436 3.850 10.286 1.00 20.23 C ATOM 292 CG LEU A 19 -3.780 2.884 11.333 1.00 11.33 C ATOM 293 CD1 LEU A 19 -2.816 1.888 10.668 1.00 65.10 C ATOM 294 CD2 LEU A 19 -3.087 3.654 12.466 1.00 34.13 C ATOM 0 H LEU A 19 -5.643 5.104 8.449 1.00 12.11 H new ATOM 0 HA LEU A 19 -4.885 2.435 8.716 1.00 21.55 H new ATOM 0 HB2 LEU A 19 -3.643 4.329 9.712 1.00 20.23 H new ATOM 0 HB3 LEU A 19 -4.962 4.639 10.824 1.00 20.23 H new ATOM 0 HG LEU A 19 -4.591 2.307 11.778 1.00 11.33 H new ATOM 0 HD11 LEU A 19 -2.383 1.238 11.428 1.00 65.10 H new ATOM 0 HD12 LEU A 19 -3.360 1.285 9.941 1.00 65.10 H new ATOM 0 HD13 LEU A 19 -2.020 2.435 10.162 1.00 65.10 H new ATOM 0 HD21 LEU A 19 -2.646 2.948 13.169 1.00 34.13 H new ATOM 0 HD22 LEU A 19 -2.304 4.288 12.049 1.00 34.13 H new ATOM 0 HD23 LEU A 19 -3.818 4.274 12.985 1.00 34.13 H new ATOM 306 N GLU A 20 -7.443 3.347 10.625 1.00 61.43 N ATOM 307 CA GLU A 20 -8.537 2.894 11.490 1.00 54.21 C ATOM 308 C GLU A 20 -9.554 2.065 10.697 1.00 71.01 C ATOM 309 O GLU A 20 -10.124 1.111 11.228 1.00 11.15 O ATOM 310 CB GLU A 20 -9.202 4.116 12.154 1.00 14.05 C ATOM 311 CG GLU A 20 -8.209 5.065 12.856 1.00 62.40 C ATOM 312 CD GLU A 20 -7.418 4.410 14.002 1.00 3.53 C ATOM 313 OE1 GLU A 20 -7.959 4.297 15.122 1.00 24.24 O ATOM 314 OE2 GLU A 20 -6.243 4.038 13.797 1.00 35.41 O ATOM 0 H GLU A 20 -7.433 4.355 10.468 1.00 61.43 H new ATOM 0 HA GLU A 20 -8.135 2.247 12.270 1.00 54.21 H new ATOM 0 HB2 GLU A 20 -9.750 4.676 11.396 1.00 14.05 H new ATOM 0 HB3 GLU A 20 -9.933 3.767 12.883 1.00 14.05 H new ATOM 0 HG2 GLU A 20 -7.506 5.450 12.117 1.00 62.40 H new ATOM 0 HG3 GLU A 20 -8.757 5.921 13.250 1.00 62.40 H new ATOM 321 N VAL A 21 -9.744 2.429 9.414 1.00 12.41 N ATOM 322 CA VAL A 21 -10.596 1.673 8.480 1.00 44.13 C ATOM 323 C VAL A 21 -10.033 0.247 8.264 1.00 4.33 C ATOM 324 O VAL A 21 -10.796 -0.719 8.178 1.00 0.21 O ATOM 325 CB VAL A 21 -10.739 2.430 7.107 1.00 2.32 C ATOM 326 CG1 VAL A 21 -11.582 1.638 6.083 1.00 72.20 C ATOM 327 CG2 VAL A 21 -11.331 3.840 7.322 1.00 74.03 C ATOM 0 H VAL A 21 -9.311 3.254 8.998 1.00 12.41 H new ATOM 0 HA VAL A 21 -11.589 1.588 8.921 1.00 44.13 H new ATOM 0 HB VAL A 21 -9.736 2.526 6.690 1.00 2.32 H new ATOM 0 HG11 VAL A 21 -11.650 2.203 5.153 1.00 72.20 H new ATOM 0 HG12 VAL A 21 -11.109 0.676 5.889 1.00 72.20 H new ATOM 0 HG13 VAL A 21 -12.583 1.476 6.483 1.00 72.20 H new ATOM 0 HG21 VAL A 21 -11.422 4.347 6.361 1.00 74.03 H new ATOM 0 HG22 VAL A 21 -12.316 3.755 7.782 1.00 74.03 H new ATOM 0 HG23 VAL A 21 -10.674 4.415 7.975 1.00 74.03 H new ATOM 337 N VAL A 22 -8.691 0.133 8.228 1.00 41.23 N ATOM 338 CA VAL A 22 -7.993 -1.156 8.093 1.00 52.42 C ATOM 339 C VAL A 22 -8.137 -1.979 9.387 1.00 20.25 C ATOM 340 O VAL A 22 -8.525 -3.154 9.348 1.00 62.23 O ATOM 341 CB VAL A 22 -6.465 -0.948 7.739 1.00 62.40 C ATOM 342 CG1 VAL A 22 -5.654 -2.259 7.878 1.00 35.23 C ATOM 343 CG2 VAL A 22 -6.302 -0.350 6.320 1.00 5.31 C ATOM 0 H VAL A 22 -8.062 0.934 8.292 1.00 41.23 H new ATOM 0 HA VAL A 22 -8.455 -1.704 7.272 1.00 52.42 H new ATOM 0 HB VAL A 22 -6.062 -0.238 8.461 1.00 62.40 H new ATOM 0 HG11 VAL A 22 -4.611 -2.070 7.625 1.00 35.23 H new ATOM 0 HG12 VAL A 22 -5.719 -2.620 8.904 1.00 35.23 H new ATOM 0 HG13 VAL A 22 -6.060 -3.012 7.202 1.00 35.23 H new ATOM 0 HG21 VAL A 22 -5.243 -0.217 6.101 1.00 5.31 H new ATOM 0 HG22 VAL A 22 -6.742 -1.027 5.587 1.00 5.31 H new ATOM 0 HG23 VAL A 22 -6.807 0.615 6.272 1.00 5.31 H new ATOM 353 N LEU A 23 -7.845 -1.323 10.529 1.00 23.12 N ATOM 354 CA LEU A 23 -7.841 -1.952 11.862 1.00 45.41 C ATOM 355 C LEU A 23 -9.222 -2.546 12.242 1.00 25.21 C ATOM 356 O LEU A 23 -9.301 -3.647 12.806 1.00 52.05 O ATOM 357 CB LEU A 23 -7.382 -0.911 12.923 1.00 25.41 C ATOM 358 CG LEU A 23 -5.903 -0.406 12.826 1.00 71.15 C ATOM 359 CD1 LEU A 23 -5.606 0.644 13.921 1.00 4.40 C ATOM 360 CD2 LEU A 23 -4.897 -1.581 12.891 1.00 3.11 C ATOM 0 H LEU A 23 -7.603 -0.332 10.550 1.00 23.12 H new ATOM 0 HA LEU A 23 -7.140 -2.787 11.835 1.00 45.41 H new ATOM 0 HB2 LEU A 23 -8.041 -0.045 12.856 1.00 25.41 H new ATOM 0 HB3 LEU A 23 -7.528 -1.347 13.911 1.00 25.41 H new ATOM 0 HG LEU A 23 -5.780 0.075 11.855 1.00 71.15 H new ATOM 0 HD11 LEU A 23 -4.573 0.979 13.833 1.00 4.40 H new ATOM 0 HD12 LEU A 23 -6.276 1.496 13.800 1.00 4.40 H new ATOM 0 HD13 LEU A 23 -5.760 0.198 14.904 1.00 4.40 H new ATOM 0 HD21 LEU A 23 -3.880 -1.194 12.821 1.00 3.11 H new ATOM 0 HD22 LEU A 23 -5.019 -2.112 13.835 1.00 3.11 H new ATOM 0 HD23 LEU A 23 -5.083 -2.265 12.063 1.00 3.11 H new ATOM 372 N LYS A 24 -10.304 -1.809 11.918 1.00 35.14 N ATOM 373 CA LYS A 24 -11.689 -2.220 12.261 1.00 14.32 C ATOM 374 C LYS A 24 -12.223 -3.282 11.282 1.00 21.52 C ATOM 375 O LYS A 24 -13.098 -4.075 11.643 1.00 43.33 O ATOM 376 CB LYS A 24 -12.645 -0.993 12.290 1.00 62.23 C ATOM 377 CG LYS A 24 -12.928 -0.352 10.908 1.00 55.24 C ATOM 378 CD LYS A 24 -13.876 0.866 10.982 1.00 53.52 C ATOM 379 CE LYS A 24 -13.323 2.018 11.835 1.00 5.21 C ATOM 380 NZ LYS A 24 -14.211 3.215 11.801 1.00 24.42 N ATOM 0 H LYS A 24 -10.249 -0.922 11.417 1.00 35.14 H new ATOM 0 HA LYS A 24 -11.656 -2.661 13.257 1.00 14.32 H new ATOM 0 HB2 LYS A 24 -13.593 -1.300 12.733 1.00 62.23 H new ATOM 0 HB3 LYS A 24 -12.218 -0.234 12.945 1.00 62.23 H new ATOM 0 HG2 LYS A 24 -11.984 -0.042 10.459 1.00 55.24 H new ATOM 0 HG3 LYS A 24 -13.364 -1.103 10.249 1.00 55.24 H new ATOM 0 HD2 LYS A 24 -14.067 1.230 9.973 1.00 53.52 H new ATOM 0 HD3 LYS A 24 -14.834 0.547 11.392 1.00 53.52 H new ATOM 0 HE2 LYS A 24 -13.206 1.682 12.865 1.00 5.21 H new ATOM 0 HE3 LYS A 24 -12.331 2.292 11.475 1.00 5.21 H new ATOM 0 HZ1 LYS A 24 -13.801 3.968 12.389 1.00 24.42 H new ATOM 0 HZ2 LYS A 24 -14.302 3.552 10.821 1.00 24.42 H new ATOM 0 HZ3 LYS A 24 -15.150 2.961 12.169 1.00 24.42 H new ATOM 394 N SER A 25 -11.698 -3.279 10.041 1.00 31.11 N ATOM 395 CA SER A 25 -12.136 -4.208 8.986 1.00 72.33 C ATOM 396 C SER A 25 -11.507 -5.591 9.192 1.00 20.13 C ATOM 397 O SER A 25 -12.175 -6.629 9.049 1.00 20.52 O ATOM 398 CB SER A 25 -11.770 -3.648 7.594 1.00 5.34 C ATOM 399 OG SER A 25 -12.349 -4.417 6.548 1.00 14.53 O ATOM 0 H SER A 25 -10.963 -2.636 9.745 1.00 31.11 H new ATOM 0 HA SER A 25 -13.219 -4.313 9.044 1.00 72.33 H new ATOM 0 HB2 SER A 25 -12.109 -2.615 7.517 1.00 5.34 H new ATOM 0 HB3 SER A 25 -10.686 -3.637 7.480 1.00 5.34 H new ATOM 0 HG SER A 25 -13.325 -4.409 6.638 1.00 14.53 H new ATOM 405 N ASP A 26 -10.219 -5.587 9.556 1.00 31.11 N ATOM 406 CA ASP A 26 -9.432 -6.803 9.753 1.00 60.52 C ATOM 407 C ASP A 26 -8.372 -6.533 10.850 1.00 51.41 C ATOM 408 O ASP A 26 -7.391 -5.818 10.602 1.00 43.42 O ATOM 409 CB ASP A 26 -8.765 -7.242 8.419 1.00 32.35 C ATOM 410 CG ASP A 26 -8.156 -8.652 8.485 1.00 31.34 C ATOM 411 OD1 ASP A 26 -7.057 -8.809 9.037 1.00 40.34 O ATOM 412 OD2 ASP A 26 -8.792 -9.618 8.008 1.00 1.13 O ATOM 0 H ASP A 26 -9.692 -4.730 9.723 1.00 31.11 H new ATOM 0 HA ASP A 26 -10.080 -7.619 10.074 1.00 60.52 H new ATOM 0 HB2 ASP A 26 -9.507 -7.210 7.621 1.00 32.35 H new ATOM 0 HB3 ASP A 26 -7.985 -6.527 8.157 1.00 32.35 H new ATOM 417 N PRO A 27 -8.553 -7.093 12.094 1.00 31.53 N ATOM 418 CA PRO A 27 -7.622 -6.857 13.234 1.00 65.31 C ATOM 419 C PRO A 27 -6.339 -7.706 13.160 1.00 63.01 C ATOM 420 O PRO A 27 -5.448 -7.572 14.011 1.00 61.23 O ATOM 421 CB PRO A 27 -8.489 -7.247 14.449 1.00 40.42 C ATOM 422 CG PRO A 27 -9.369 -8.350 13.941 1.00 3.31 C ATOM 423 CD PRO A 27 -9.675 -7.998 12.497 1.00 62.41 C ATOM 0 HA PRO A 27 -7.246 -5.834 13.261 1.00 65.31 H new ATOM 0 HB2 PRO A 27 -7.874 -7.582 15.285 1.00 40.42 H new ATOM 0 HB3 PRO A 27 -9.077 -6.401 14.805 1.00 40.42 H new ATOM 0 HG2 PRO A 27 -8.867 -9.315 14.011 1.00 3.31 H new ATOM 0 HG3 PRO A 27 -10.284 -8.423 14.529 1.00 3.31 H new ATOM 0 HD2 PRO A 27 -9.713 -8.888 11.870 1.00 62.41 H new ATOM 0 HD3 PRO A 27 -10.641 -7.501 12.404 1.00 62.41 H new ATOM 431 N ASN A 28 -6.256 -8.571 12.136 1.00 54.44 N ATOM 432 CA ASN A 28 -5.111 -9.463 11.941 1.00 21.24 C ATOM 433 C ASN A 28 -3.976 -8.693 11.277 1.00 32.54 C ATOM 434 O ASN A 28 -2.817 -8.894 11.633 1.00 31.24 O ATOM 435 CB ASN A 28 -5.487 -10.691 11.076 1.00 73.21 C ATOM 436 CG ASN A 28 -6.707 -11.438 11.604 1.00 51.42 C ATOM 437 OD1 ASN A 28 -6.598 -12.360 12.417 1.00 32.12 O ATOM 438 ND2 ASN A 28 -7.874 -11.051 11.129 1.00 43.23 N ATOM 0 H ASN A 28 -6.980 -8.668 11.424 1.00 54.44 H new ATOM 0 HA ASN A 28 -4.794 -9.828 12.918 1.00 21.24 H new ATOM 0 HB2 ASN A 28 -5.682 -10.364 10.055 1.00 73.21 H new ATOM 0 HB3 ASN A 28 -4.639 -11.374 11.036 1.00 73.21 H new ATOM 0 HD21 ASN A 28 -8.728 -11.518 11.432 1.00 43.23 H new ATOM 0 HD22 ASN A 28 -7.923 -10.284 10.458 1.00 43.23 H new ATOM 445 N VAL A 29 -4.333 -7.798 10.319 1.00 4.24 N ATOM 446 CA VAL A 29 -3.354 -6.997 9.562 1.00 0.21 C ATOM 447 C VAL A 29 -2.414 -6.250 10.524 1.00 32.11 C ATOM 448 O VAL A 29 -2.861 -5.363 11.257 1.00 33.52 O ATOM 449 CB VAL A 29 -4.022 -5.940 8.602 1.00 21.32 C ATOM 450 CG1 VAL A 29 -2.939 -5.159 7.826 1.00 21.43 C ATOM 451 CG2 VAL A 29 -5.022 -6.586 7.625 1.00 3.32 C ATOM 0 H VAL A 29 -5.302 -7.617 10.056 1.00 4.24 H new ATOM 0 HA VAL A 29 -2.801 -7.707 8.948 1.00 0.21 H new ATOM 0 HB VAL A 29 -4.586 -5.248 9.227 1.00 21.32 H new ATOM 0 HG11 VAL A 29 -3.416 -4.433 7.167 1.00 21.43 H new ATOM 0 HG12 VAL A 29 -2.290 -4.639 8.531 1.00 21.43 H new ATOM 0 HG13 VAL A 29 -2.345 -5.853 7.231 1.00 21.43 H new ATOM 0 HG21 VAL A 29 -5.455 -5.817 6.986 1.00 3.32 H new ATOM 0 HG22 VAL A 29 -4.505 -7.321 7.009 1.00 3.32 H new ATOM 0 HG23 VAL A 29 -5.815 -7.078 8.188 1.00 3.32 H new ATOM 461 N LYS A 30 -1.128 -6.634 10.505 1.00 40.12 N ATOM 462 CA LYS A 30 -0.100 -6.114 11.431 1.00 25.40 C ATOM 463 C LYS A 30 0.048 -4.577 11.273 1.00 62.45 C ATOM 464 O LYS A 30 0.246 -3.872 12.265 1.00 45.34 O ATOM 465 CB LYS A 30 1.241 -6.886 11.160 1.00 53.23 C ATOM 466 CG LYS A 30 2.276 -6.924 12.322 1.00 42.10 C ATOM 467 CD LYS A 30 3.024 -5.591 12.568 1.00 43.50 C ATOM 468 CE LYS A 30 3.892 -5.153 11.372 1.00 71.42 C ATOM 469 NZ LYS A 30 4.573 -3.852 11.628 1.00 3.03 N ATOM 0 H LYS A 30 -0.766 -7.320 9.842 1.00 40.12 H new ATOM 0 HA LYS A 30 -0.392 -6.283 12.468 1.00 25.40 H new ATOM 0 HB2 LYS A 30 0.993 -7.913 10.892 1.00 53.23 H new ATOM 0 HB3 LYS A 30 1.722 -6.437 10.291 1.00 53.23 H new ATOM 0 HG2 LYS A 30 1.761 -7.210 13.239 1.00 42.10 H new ATOM 0 HG3 LYS A 30 3.009 -7.703 12.112 1.00 42.10 H new ATOM 0 HD2 LYS A 30 2.297 -4.809 12.787 1.00 43.50 H new ATOM 0 HD3 LYS A 30 3.657 -5.694 13.450 1.00 43.50 H new ATOM 0 HE2 LYS A 30 4.639 -5.919 11.165 1.00 71.42 H new ATOM 0 HE3 LYS A 30 3.268 -5.068 10.482 1.00 71.42 H new ATOM 0 HZ1 LYS A 30 5.490 -3.838 11.138 1.00 3.03 H new ATOM 0 HZ2 LYS A 30 3.980 -3.074 11.275 1.00 3.03 H new ATOM 0 HZ3 LYS A 30 4.725 -3.735 12.650 1.00 3.03 H new ATOM 483 N THR A 31 -0.114 -4.106 10.010 1.00 24.41 N ATOM 484 CA THR A 31 0.072 -2.697 9.560 1.00 42.00 C ATOM 485 C THR A 31 1.506 -2.174 9.827 1.00 14.41 C ATOM 486 O THR A 31 2.051 -2.318 10.926 1.00 61.10 O ATOM 487 CB THR A 31 -0.999 -1.669 10.115 1.00 2.23 C ATOM 488 OG1 THR A 31 -0.912 -1.524 11.540 1.00 13.34 O ATOM 489 CG2 THR A 31 -2.443 -2.057 9.740 1.00 52.14 C ATOM 0 H THR A 31 -0.389 -4.721 9.244 1.00 24.41 H new ATOM 0 HA THR A 31 -0.091 -2.751 8.484 1.00 42.00 H new ATOM 0 HB THR A 31 -0.761 -0.718 9.639 1.00 2.23 H new ATOM 0 HG1 THR A 31 -0.364 -2.247 11.910 1.00 13.34 H new ATOM 0 HG21 THR A 31 -3.135 -1.319 10.145 1.00 52.14 H new ATOM 0 HG22 THR A 31 -2.541 -2.089 8.655 1.00 52.14 H new ATOM 0 HG23 THR A 31 -2.675 -3.038 10.154 1.00 52.14 H new ATOM 497 N VAL A 32 2.122 -1.575 8.794 1.00 41.43 N ATOM 498 CA VAL A 32 3.491 -1.039 8.854 1.00 42.43 C ATOM 499 C VAL A 32 3.461 0.412 8.377 1.00 51.41 C ATOM 500 O VAL A 32 2.999 0.671 7.273 1.00 64.03 O ATOM 501 CB VAL A 32 4.482 -1.857 7.931 1.00 74.33 C ATOM 502 CG1 VAL A 32 5.947 -1.407 8.133 1.00 70.44 C ATOM 503 CG2 VAL A 32 4.335 -3.377 8.145 1.00 65.32 C ATOM 0 H VAL A 32 1.678 -1.448 7.884 1.00 41.43 H new ATOM 0 HA VAL A 32 3.846 -1.114 9.882 1.00 42.43 H new ATOM 0 HB VAL A 32 4.208 -1.642 6.898 1.00 74.33 H new ATOM 0 HG11 VAL A 32 6.600 -1.990 7.483 1.00 70.44 H new ATOM 0 HG12 VAL A 32 6.040 -0.349 7.886 1.00 70.44 H new ATOM 0 HG13 VAL A 32 6.236 -1.564 9.172 1.00 70.44 H new ATOM 0 HG21 VAL A 32 5.032 -3.905 7.494 1.00 65.32 H new ATOM 0 HG22 VAL A 32 4.554 -3.621 9.185 1.00 65.32 H new ATOM 0 HG23 VAL A 32 3.315 -3.681 7.908 1.00 65.32 H new ATOM 513 N ARG A 33 3.928 1.360 9.203 1.00 74.31 N ATOM 514 CA ARG A 33 4.052 2.771 8.797 1.00 21.51 C ATOM 515 C ARG A 33 5.531 3.171 8.821 1.00 50.21 C ATOM 516 O ARG A 33 6.089 3.444 9.890 1.00 24.23 O ATOM 517 CB ARG A 33 3.195 3.703 9.702 1.00 1.12 C ATOM 518 CG ARG A 33 3.248 5.201 9.294 1.00 43.41 C ATOM 519 CD ARG A 33 2.263 6.079 10.075 1.00 42.03 C ATOM 520 NE ARG A 33 0.855 5.718 9.803 1.00 43.24 N ATOM 521 CZ ARG A 33 -0.195 6.093 10.549 1.00 75.14 C ATOM 522 NH1 ARG A 33 -0.024 6.842 11.631 1.00 62.13 N ATOM 523 NH2 ARG A 33 -1.423 5.729 10.197 1.00 63.42 N ATOM 0 H ARG A 33 4.228 1.175 10.160 1.00 74.31 H new ATOM 0 HA ARG A 33 3.668 2.885 7.783 1.00 21.51 H new ATOM 0 HB2 ARG A 33 2.159 3.366 9.675 1.00 1.12 H new ATOM 0 HB3 ARG A 33 3.536 3.605 10.733 1.00 1.12 H new ATOM 0 HG2 ARG A 33 4.260 5.577 9.448 1.00 43.41 H new ATOM 0 HG3 ARG A 33 3.035 5.288 8.229 1.00 43.41 H new ATOM 0 HD2 ARG A 33 2.461 5.983 11.143 1.00 42.03 H new ATOM 0 HD3 ARG A 33 2.425 7.125 9.814 1.00 42.03 H new ATOM 0 HE ARG A 33 0.668 5.139 8.985 1.00 43.24 H new ATOM 0 HH11 ARG A 33 0.913 7.139 11.903 1.00 62.13 H new ATOM 0 HH12 ARG A 33 -0.830 7.121 12.191 1.00 62.13 H new ATOM 0 HH21 ARG A 33 -1.567 5.165 9.360 1.00 63.42 H new ATOM 0 HH22 ARG A 33 -2.222 6.014 10.764 1.00 63.42 H new ATOM 537 N THR A 34 6.157 3.132 7.631 1.00 43.22 N ATOM 538 CA THR A 34 7.559 3.514 7.419 1.00 32.24 C ATOM 539 C THR A 34 7.891 3.439 5.921 1.00 30.12 C ATOM 540 O THR A 34 7.278 2.658 5.177 1.00 54.32 O ATOM 541 CB THR A 34 8.571 2.602 8.225 1.00 14.21 C ATOM 542 OG1 THR A 34 9.894 3.149 8.145 1.00 21.14 O ATOM 543 CG2 THR A 34 8.602 1.149 7.716 1.00 2.22 C ATOM 0 H THR A 34 5.691 2.828 6.776 1.00 43.22 H new ATOM 0 HA THR A 34 7.673 4.533 7.789 1.00 32.24 H new ATOM 0 HB THR A 34 8.221 2.586 9.257 1.00 14.21 H new ATOM 0 HG1 THR A 34 10.514 2.580 8.647 1.00 21.14 H new ATOM 0 HG21 THR A 34 9.313 0.572 8.307 1.00 2.22 H new ATOM 0 HG22 THR A 34 7.609 0.709 7.812 1.00 2.22 H new ATOM 0 HG23 THR A 34 8.905 1.137 6.669 1.00 2.22 H new ATOM 551 N ASP A 35 8.866 4.250 5.495 1.00 3.21 N ATOM 552 CA ASP A 35 9.412 4.214 4.122 1.00 51.40 C ATOM 553 C ASP A 35 10.699 3.383 4.070 1.00 34.02 C ATOM 554 O ASP A 35 11.274 3.221 2.986 1.00 70.51 O ATOM 555 CB ASP A 35 9.690 5.649 3.605 1.00 42.44 C ATOM 556 CG ASP A 35 10.747 6.404 4.436 1.00 71.03 C ATOM 557 OD1 ASP A 35 10.404 6.894 5.532 1.00 33.15 O ATOM 558 OD2 ASP A 35 11.916 6.514 4.006 1.00 42.50 O ATOM 0 H ASP A 35 9.304 4.954 6.090 1.00 3.21 H new ATOM 0 HA ASP A 35 8.667 3.746 3.478 1.00 51.40 H new ATOM 0 HB2 ASP A 35 10.023 5.596 2.569 1.00 42.44 H new ATOM 0 HB3 ASP A 35 8.759 6.217 3.612 1.00 42.44 H new ATOM 563 N ASP A 36 11.152 2.875 5.252 1.00 73.34 N ATOM 564 CA ASP A 36 12.389 2.082 5.383 1.00 52.53 C ATOM 565 C ASP A 36 12.296 0.837 4.477 1.00 62.52 C ATOM 566 O ASP A 36 11.619 -0.139 4.809 1.00 0.54 O ATOM 567 CB ASP A 36 12.636 1.686 6.868 1.00 54.20 C ATOM 568 CG ASP A 36 14.070 1.192 7.157 1.00 42.32 C ATOM 569 OD1 ASP A 36 14.449 0.113 6.663 1.00 61.35 O ATOM 570 OD2 ASP A 36 14.823 1.878 7.883 1.00 14.14 O ATOM 0 H ASP A 36 10.662 3.010 6.136 1.00 73.34 H new ATOM 0 HA ASP A 36 13.240 2.684 5.064 1.00 52.53 H new ATOM 0 HB2 ASP A 36 12.425 2.547 7.503 1.00 54.20 H new ATOM 0 HB3 ASP A 36 11.930 0.903 7.147 1.00 54.20 H new ATOM 575 N LYS A 37 12.979 0.930 3.334 1.00 22.32 N ATOM 576 CA LYS A 37 12.852 0.004 2.198 1.00 33.40 C ATOM 577 C LYS A 37 13.139 -1.460 2.572 1.00 54.21 C ATOM 578 O LYS A 37 12.349 -2.353 2.240 1.00 21.12 O ATOM 579 CB LYS A 37 13.769 0.500 1.048 1.00 41.22 C ATOM 580 CG LYS A 37 15.244 0.740 1.447 1.00 23.31 C ATOM 581 CD LYS A 37 16.010 1.669 0.471 1.00 55.20 C ATOM 582 CE LYS A 37 15.849 1.252 -0.997 1.00 61.43 C ATOM 583 NZ LYS A 37 16.772 1.979 -1.909 1.00 3.24 N ATOM 0 H LYS A 37 13.657 1.673 3.165 1.00 22.32 H new ATOM 0 HA LYS A 37 11.813 0.007 1.868 1.00 33.40 H new ATOM 0 HB2 LYS A 37 13.741 -0.231 0.240 1.00 41.22 H new ATOM 0 HB3 LYS A 37 13.359 1.429 0.652 1.00 41.22 H new ATOM 0 HG2 LYS A 37 15.275 1.173 2.447 1.00 23.31 H new ATOM 0 HG3 LYS A 37 15.758 -0.220 1.500 1.00 23.31 H new ATOM 0 HD2 LYS A 37 15.653 2.692 0.595 1.00 55.20 H new ATOM 0 HD3 LYS A 37 17.069 1.667 0.730 1.00 55.20 H new ATOM 0 HE2 LYS A 37 16.027 0.180 -1.087 1.00 61.43 H new ATOM 0 HE3 LYS A 37 14.820 1.432 -1.310 1.00 61.43 H new ATOM 0 HZ1 LYS A 37 16.518 1.773 -2.896 1.00 3.24 H new ATOM 0 HZ2 LYS A 37 16.695 3.002 -1.738 1.00 3.24 H new ATOM 0 HZ3 LYS A 37 17.749 1.671 -1.731 1.00 3.24 H new ATOM 597 N GLU A 38 14.238 -1.686 3.304 1.00 15.33 N ATOM 598 CA GLU A 38 14.673 -3.036 3.699 1.00 21.20 C ATOM 599 C GLU A 38 13.785 -3.585 4.830 1.00 60.14 C ATOM 600 O GLU A 38 13.594 -4.803 4.937 1.00 22.53 O ATOM 601 CB GLU A 38 16.168 -3.007 4.112 1.00 23.41 C ATOM 602 CG GLU A 38 16.471 -2.115 5.326 1.00 65.12 C ATOM 603 CD GLU A 38 17.967 -1.964 5.615 1.00 0.45 C ATOM 604 OE1 GLU A 38 18.557 -2.879 6.222 1.00 71.41 O ATOM 605 OE2 GLU A 38 18.560 -0.937 5.223 1.00 41.04 O ATOM 0 H GLU A 38 14.850 -0.942 3.639 1.00 15.33 H new ATOM 0 HA GLU A 38 14.567 -3.709 2.848 1.00 21.20 H new ATOM 0 HB2 GLU A 38 16.492 -4.024 4.333 1.00 23.41 H new ATOM 0 HB3 GLU A 38 16.760 -2.661 3.265 1.00 23.41 H new ATOM 0 HG2 GLU A 38 16.040 -1.128 5.158 1.00 65.12 H new ATOM 0 HG3 GLU A 38 15.980 -2.532 6.205 1.00 65.12 H new ATOM 612 N LYS A 39 13.221 -2.669 5.660 1.00 14.52 N ATOM 613 CA LYS A 39 12.303 -3.047 6.743 1.00 15.45 C ATOM 614 C LYS A 39 10.990 -3.583 6.174 1.00 35.24 C ATOM 615 O LYS A 39 10.556 -4.659 6.565 1.00 55.24 O ATOM 616 CB LYS A 39 12.022 -1.874 7.712 1.00 31.44 C ATOM 617 CG LYS A 39 11.002 -2.224 8.813 1.00 74.31 C ATOM 618 CD LYS A 39 10.773 -1.100 9.837 1.00 42.50 C ATOM 619 CE LYS A 39 9.644 -1.459 10.818 1.00 51.02 C ATOM 620 NZ LYS A 39 9.910 -2.732 11.553 1.00 74.44 N ATOM 0 H LYS A 39 13.392 -1.666 5.592 1.00 14.52 H new ATOM 0 HA LYS A 39 12.795 -3.834 7.315 1.00 15.45 H new ATOM 0 HB2 LYS A 39 12.958 -1.565 8.178 1.00 31.44 H new ATOM 0 HB3 LYS A 39 11.653 -1.021 7.142 1.00 31.44 H new ATOM 0 HG2 LYS A 39 10.050 -2.474 8.345 1.00 74.31 H new ATOM 0 HG3 LYS A 39 11.343 -3.116 9.339 1.00 74.31 H new ATOM 0 HD2 LYS A 39 11.694 -0.916 10.391 1.00 42.50 H new ATOM 0 HD3 LYS A 39 10.525 -0.175 9.316 1.00 42.50 H new ATOM 0 HE2 LYS A 39 9.519 -0.648 11.535 1.00 51.02 H new ATOM 0 HE3 LYS A 39 8.706 -1.548 10.271 1.00 51.02 H new ATOM 0 HZ1 LYS A 39 9.692 -2.603 12.562 1.00 74.44 H new ATOM 0 HZ2 LYS A 39 9.312 -3.489 11.164 1.00 74.44 H new ATOM 0 HZ3 LYS A 39 10.911 -2.992 11.446 1.00 74.44 H new ATOM 634 N VAL A 40 10.387 -2.840 5.227 1.00 21.12 N ATOM 635 CA VAL A 40 9.071 -3.188 4.659 1.00 3.31 C ATOM 636 C VAL A 40 9.119 -4.569 3.960 1.00 33.51 C ATOM 637 O VAL A 40 8.173 -5.343 4.050 1.00 23.33 O ATOM 638 CB VAL A 40 8.554 -2.073 3.677 1.00 60.00 C ATOM 639 CG1 VAL A 40 7.195 -2.453 3.052 1.00 14.22 C ATOM 640 CG2 VAL A 40 8.453 -0.702 4.393 1.00 12.00 C ATOM 0 H VAL A 40 10.794 -1.990 4.837 1.00 21.12 H new ATOM 0 HA VAL A 40 8.361 -3.251 5.484 1.00 3.31 H new ATOM 0 HB VAL A 40 9.284 -1.990 2.872 1.00 60.00 H new ATOM 0 HG11 VAL A 40 6.869 -1.659 2.379 1.00 14.22 H new ATOM 0 HG12 VAL A 40 7.299 -3.383 2.493 1.00 14.22 H new ATOM 0 HG13 VAL A 40 6.456 -2.586 3.842 1.00 14.22 H new ATOM 0 HG21 VAL A 40 8.093 0.050 3.690 1.00 12.00 H new ATOM 0 HG22 VAL A 40 7.759 -0.779 5.230 1.00 12.00 H new ATOM 0 HG23 VAL A 40 9.436 -0.412 4.763 1.00 12.00 H new ATOM 650 N LYS A 41 10.260 -4.868 3.310 1.00 53.03 N ATOM 651 CA LYS A 41 10.542 -6.200 2.725 1.00 30.12 C ATOM 652 C LYS A 41 10.569 -7.300 3.811 1.00 2.44 C ATOM 653 O LYS A 41 10.030 -8.391 3.631 1.00 42.54 O ATOM 654 CB LYS A 41 11.903 -6.172 1.995 1.00 51.04 C ATOM 655 CG LYS A 41 11.977 -5.182 0.819 1.00 42.11 C ATOM 656 CD LYS A 41 13.364 -5.203 0.132 1.00 14.24 C ATOM 657 CE LYS A 41 13.442 -4.267 -1.076 1.00 24.13 C ATOM 658 NZ LYS A 41 14.730 -4.389 -1.809 1.00 10.31 N ATOM 0 H LYS A 41 11.014 -4.195 3.174 1.00 53.03 H new ATOM 0 HA LYS A 41 9.743 -6.432 2.021 1.00 30.12 H new ATOM 0 HB2 LYS A 41 12.682 -5.920 2.715 1.00 51.04 H new ATOM 0 HB3 LYS A 41 12.123 -7.173 1.625 1.00 51.04 H new ATOM 0 HG2 LYS A 41 11.206 -5.428 0.088 1.00 42.11 H new ATOM 0 HG3 LYS A 41 11.765 -4.175 1.179 1.00 42.11 H new ATOM 0 HD2 LYS A 41 14.127 -4.918 0.856 1.00 14.24 H new ATOM 0 HD3 LYS A 41 13.591 -6.220 -0.187 1.00 14.24 H new ATOM 0 HE2 LYS A 41 12.619 -4.487 -1.756 1.00 24.13 H new ATOM 0 HE3 LYS A 41 13.314 -3.237 -0.743 1.00 24.13 H new ATOM 0 HZ1 LYS A 41 14.733 -3.735 -2.618 1.00 10.31 H new ATOM 0 HZ2 LYS A 41 15.516 -4.153 -1.171 1.00 10.31 H new ATOM 0 HZ3 LYS A 41 14.843 -5.364 -2.152 1.00 10.31 H new ATOM 672 N GLU A 42 11.197 -6.969 4.944 1.00 20.44 N ATOM 673 CA GLU A 42 11.354 -7.870 6.106 1.00 64.54 C ATOM 674 C GLU A 42 9.962 -8.107 6.762 1.00 63.12 C ATOM 675 O GLU A 42 9.699 -9.166 7.345 1.00 20.34 O ATOM 676 CB GLU A 42 12.399 -7.221 7.083 1.00 44.33 C ATOM 677 CG GLU A 42 13.227 -8.178 7.977 1.00 54.23 C ATOM 678 CD GLU A 42 12.476 -8.695 9.208 1.00 61.25 C ATOM 679 OE1 GLU A 42 12.438 -7.987 10.236 1.00 20.55 O ATOM 680 OE2 GLU A 42 11.914 -9.806 9.165 1.00 62.02 O ATOM 0 H GLU A 42 11.620 -6.052 5.089 1.00 20.44 H new ATOM 0 HA GLU A 42 11.731 -8.851 5.816 1.00 64.54 H new ATOM 0 HB2 GLU A 42 13.095 -6.629 6.488 1.00 44.33 H new ATOM 0 HB3 GLU A 42 11.867 -6.528 7.734 1.00 44.33 H new ATOM 0 HG2 GLU A 42 13.549 -9.030 7.378 1.00 54.23 H new ATOM 0 HG3 GLU A 42 14.128 -7.661 8.306 1.00 54.23 H new ATOM 687 N GLU A 43 9.075 -7.098 6.644 1.00 3.25 N ATOM 688 CA GLU A 43 7.680 -7.165 7.121 1.00 64.11 C ATOM 689 C GLU A 43 6.803 -8.011 6.161 1.00 64.12 C ATOM 690 O GLU A 43 5.881 -8.704 6.608 1.00 22.43 O ATOM 691 CB GLU A 43 7.113 -5.723 7.275 1.00 32.41 C ATOM 692 CG GLU A 43 7.906 -4.792 8.236 1.00 33.35 C ATOM 693 CD GLU A 43 7.694 -5.056 9.741 1.00 14.31 C ATOM 694 OE1 GLU A 43 8.037 -6.155 10.221 1.00 43.43 O ATOM 695 OE2 GLU A 43 7.197 -4.151 10.457 1.00 42.31 O ATOM 0 H GLU A 43 9.310 -6.205 6.210 1.00 3.25 H new ATOM 0 HA GLU A 43 7.662 -7.657 8.094 1.00 64.11 H new ATOM 0 HB2 GLU A 43 7.080 -5.257 6.290 1.00 32.41 H new ATOM 0 HB3 GLU A 43 6.085 -5.791 7.630 1.00 32.41 H new ATOM 0 HG2 GLU A 43 8.969 -4.890 8.014 1.00 33.35 H new ATOM 0 HG3 GLU A 43 7.630 -3.759 8.024 1.00 33.35 H new ATOM 702 N ILE A 44 7.099 -7.937 4.836 1.00 14.54 N ATOM 703 CA ILE A 44 6.453 -8.784 3.797 1.00 52.25 C ATOM 704 C ILE A 44 6.788 -10.278 4.050 1.00 73.33 C ATOM 705 O ILE A 44 5.932 -11.154 3.857 1.00 2.10 O ATOM 706 CB ILE A 44 6.897 -8.354 2.331 1.00 72.01 C ATOM 707 CG1 ILE A 44 6.384 -6.922 1.958 1.00 15.44 C ATOM 708 CG2 ILE A 44 6.439 -9.374 1.258 1.00 31.35 C ATOM 709 CD1 ILE A 44 6.872 -6.413 0.601 1.00 51.34 C ATOM 0 H ILE A 44 7.791 -7.290 4.459 1.00 14.54 H new ATOM 0 HA ILE A 44 5.375 -8.641 3.867 1.00 52.25 H new ATOM 0 HB ILE A 44 7.987 -8.337 2.342 1.00 72.01 H new ATOM 0 HG12 ILE A 44 5.294 -6.927 1.961 1.00 15.44 H new ATOM 0 HG13 ILE A 44 6.701 -6.222 2.731 1.00 15.44 H new ATOM 0 HG21 ILE A 44 6.765 -9.038 0.274 1.00 31.35 H new ATOM 0 HG22 ILE A 44 6.877 -10.349 1.472 1.00 31.35 H new ATOM 0 HG23 ILE A 44 5.352 -9.454 1.272 1.00 31.35 H new ATOM 0 HD11 ILE A 44 6.471 -5.416 0.421 1.00 51.34 H new ATOM 0 HD12 ILE A 44 7.961 -6.372 0.598 1.00 51.34 H new ATOM 0 HD13 ILE A 44 6.532 -7.088 -0.184 1.00 51.34 H new ATOM 721 N GLU A 45 8.032 -10.536 4.517 1.00 35.12 N ATOM 722 CA GLU A 45 8.516 -11.894 4.886 1.00 30.44 C ATOM 723 C GLU A 45 7.584 -12.523 5.956 1.00 51.54 C ATOM 724 O GLU A 45 7.280 -13.723 5.919 1.00 71.34 O ATOM 725 CB GLU A 45 9.994 -11.799 5.404 1.00 61.43 C ATOM 726 CG GLU A 45 10.858 -13.085 5.270 1.00 53.14 C ATOM 727 CD GLU A 45 10.380 -14.290 6.101 1.00 73.02 C ATOM 728 OE1 GLU A 45 10.530 -14.278 7.328 1.00 24.54 O ATOM 729 OE2 GLU A 45 9.843 -15.254 5.536 1.00 1.22 O ATOM 0 H GLU A 45 8.733 -9.808 4.650 1.00 35.12 H new ATOM 0 HA GLU A 45 8.497 -12.540 4.008 1.00 30.44 H new ATOM 0 HB2 GLU A 45 10.494 -10.994 4.865 1.00 61.43 H new ATOM 0 HB3 GLU A 45 9.970 -11.512 6.455 1.00 61.43 H new ATOM 0 HG2 GLU A 45 10.885 -13.377 4.220 1.00 53.14 H new ATOM 0 HG3 GLU A 45 11.881 -12.847 5.561 1.00 53.14 H new ATOM 736 N LYS A 46 7.125 -11.685 6.894 1.00 53.32 N ATOM 737 CA LYS A 46 6.198 -12.100 7.956 1.00 43.34 C ATOM 738 C LYS A 46 4.784 -12.354 7.391 1.00 73.43 C ATOM 739 O LYS A 46 4.158 -13.380 7.691 1.00 32.13 O ATOM 740 CB LYS A 46 6.140 -11.015 9.062 1.00 33.13 C ATOM 741 CG LYS A 46 7.510 -10.672 9.680 1.00 13.44 C ATOM 742 CD LYS A 46 7.399 -9.653 10.834 1.00 13.02 C ATOM 743 CE LYS A 46 8.766 -9.264 11.412 1.00 0.02 C ATOM 744 NZ LYS A 46 9.623 -8.594 10.398 1.00 12.01 N ATOM 0 H LYS A 46 7.386 -10.700 6.939 1.00 53.32 H new ATOM 0 HA LYS A 46 6.566 -13.033 8.384 1.00 43.34 H new ATOM 0 HB2 LYS A 46 5.705 -10.108 8.643 1.00 33.13 H new ATOM 0 HB3 LYS A 46 5.471 -11.353 9.853 1.00 33.13 H new ATOM 0 HG2 LYS A 46 7.977 -11.585 10.049 1.00 13.44 H new ATOM 0 HG3 LYS A 46 8.164 -10.270 8.906 1.00 13.44 H new ATOM 0 HD2 LYS A 46 6.892 -8.757 10.475 1.00 13.02 H new ATOM 0 HD3 LYS A 46 6.780 -10.073 11.627 1.00 13.02 H new ATOM 0 HE2 LYS A 46 8.625 -8.600 12.265 1.00 0.02 H new ATOM 0 HE3 LYS A 46 9.271 -10.156 11.783 1.00 0.02 H new ATOM 0 HZ1 LYS A 46 10.481 -8.226 10.857 1.00 12.01 H new ATOM 0 HZ2 LYS A 46 9.890 -9.279 9.662 1.00 12.01 H new ATOM 0 HZ3 LYS A 46 9.098 -7.808 9.965 1.00 12.01 H new ATOM 758 N ALA A 47 4.303 -11.415 6.558 1.00 55.41 N ATOM 759 CA ALA A 47 2.912 -11.407 6.050 1.00 3.50 C ATOM 760 C ALA A 47 2.617 -12.605 5.128 1.00 14.31 C ATOM 761 O ALA A 47 1.500 -13.143 5.141 1.00 24.21 O ATOM 762 CB ALA A 47 2.633 -10.087 5.331 1.00 30.21 C ATOM 0 H ALA A 47 4.866 -10.637 6.215 1.00 55.41 H new ATOM 0 HA ALA A 47 2.245 -11.502 6.907 1.00 3.50 H new ATOM 0 HB1 ALA A 47 1.609 -10.085 4.959 1.00 30.21 H new ATOM 0 HB2 ALA A 47 2.768 -9.258 6.026 1.00 30.21 H new ATOM 0 HB3 ALA A 47 3.323 -9.975 4.495 1.00 30.21 H new ATOM 768 N ARG A 48 3.634 -13.020 4.343 1.00 73.14 N ATOM 769 CA ARG A 48 3.541 -14.212 3.468 1.00 71.15 C ATOM 770 C ARG A 48 3.486 -15.499 4.321 1.00 4.41 C ATOM 771 O ARG A 48 2.795 -16.464 3.973 1.00 61.23 O ATOM 772 CB ARG A 48 4.748 -14.279 2.473 1.00 72.42 C ATOM 773 CG ARG A 48 6.121 -14.585 3.131 1.00 65.31 C ATOM 774 CD ARG A 48 7.265 -14.824 2.135 1.00 42.22 C ATOM 775 NE ARG A 48 8.512 -15.253 2.814 1.00 51.05 N ATOM 776 CZ ARG A 48 9.442 -16.094 2.302 1.00 11.11 C ATOM 777 NH1 ARG A 48 9.319 -16.606 1.080 1.00 61.21 N ATOM 778 NH2 ARG A 48 10.509 -16.406 3.023 1.00 61.00 N ATOM 0 H ARG A 48 4.535 -12.545 4.296 1.00 73.14 H new ATOM 0 HA ARG A 48 2.624 -14.130 2.885 1.00 71.15 H new ATOM 0 HB2 ARG A 48 4.541 -15.044 1.725 1.00 72.42 H new ATOM 0 HB3 ARG A 48 4.818 -13.328 1.945 1.00 72.42 H new ATOM 0 HG2 ARG A 48 6.391 -13.754 3.782 1.00 65.31 H new ATOM 0 HG3 ARG A 48 6.018 -15.466 3.765 1.00 65.31 H new ATOM 0 HD2 ARG A 48 6.965 -15.584 1.414 1.00 42.22 H new ATOM 0 HD3 ARG A 48 7.454 -13.909 1.574 1.00 42.22 H new ATOM 0 HE ARG A 48 8.684 -14.882 3.748 1.00 51.05 H new ATOM 0 HH11 ARG A 48 8.510 -16.367 0.506 1.00 61.21 H new ATOM 0 HH12 ARG A 48 10.033 -17.237 0.717 1.00 61.21 H new ATOM 0 HH21 ARG A 48 10.626 -16.013 3.957 1.00 61.00 H new ATOM 0 HH22 ARG A 48 11.213 -17.039 2.644 1.00 61.00 H new ATOM 792 N LYS A 49 4.213 -15.466 5.460 1.00 34.42 N ATOM 793 CA LYS A 49 4.405 -16.617 6.356 1.00 12.42 C ATOM 794 C LYS A 49 3.093 -16.985 7.068 1.00 42.53 C ATOM 795 O LYS A 49 2.783 -18.160 7.250 1.00 64.13 O ATOM 796 CB LYS A 49 5.516 -16.283 7.390 1.00 3.12 C ATOM 797 CG LYS A 49 6.021 -17.482 8.223 1.00 34.50 C ATOM 798 CD LYS A 49 7.036 -17.070 9.318 1.00 15.13 C ATOM 799 CE LYS A 49 8.230 -16.256 8.781 1.00 60.35 C ATOM 800 NZ LYS A 49 8.979 -16.964 7.703 1.00 14.31 N ATOM 0 H LYS A 49 4.688 -14.623 5.783 1.00 34.42 H new ATOM 0 HA LYS A 49 4.711 -17.480 5.765 1.00 12.42 H new ATOM 0 HB2 LYS A 49 6.363 -15.846 6.861 1.00 3.12 H new ATOM 0 HB3 LYS A 49 5.138 -15.521 8.072 1.00 3.12 H new ATOM 0 HG2 LYS A 49 5.170 -17.977 8.691 1.00 34.50 H new ATOM 0 HG3 LYS A 49 6.487 -18.209 7.558 1.00 34.50 H new ATOM 0 HD2 LYS A 49 6.520 -16.483 10.077 1.00 15.13 H new ATOM 0 HD3 LYS A 49 7.411 -17.968 9.810 1.00 15.13 H new ATOM 0 HE2 LYS A 49 7.869 -15.301 8.399 1.00 60.35 H new ATOM 0 HE3 LYS A 49 8.910 -16.034 9.603 1.00 60.35 H new ATOM 0 HZ1 LYS A 49 9.957 -17.134 8.014 1.00 14.31 H new ATOM 0 HZ2 LYS A 49 8.517 -17.873 7.499 1.00 14.31 H new ATOM 0 HZ3 LYS A 49 8.986 -16.379 6.843 1.00 14.31 H new ATOM 814 N GLN A 50 2.331 -15.950 7.452 1.00 53.20 N ATOM 815 CA GLN A 50 1.054 -16.106 8.172 1.00 43.23 C ATOM 816 C GLN A 50 -0.112 -16.257 7.182 1.00 11.01 C ATOM 817 O GLN A 50 -0.988 -17.107 7.366 1.00 54.24 O ATOM 818 CB GLN A 50 0.829 -14.886 9.105 1.00 0.31 C ATOM 819 CG GLN A 50 -0.449 -14.962 9.975 1.00 63.12 C ATOM 820 CD GLN A 50 -0.488 -16.161 10.936 1.00 51.22 C ATOM 821 OE1 GLN A 50 0.537 -16.611 11.449 1.00 52.43 O ATOM 822 NE2 GLN A 50 -1.670 -16.700 11.178 1.00 45.03 N ATOM 0 H GLN A 50 2.582 -14.978 7.272 1.00 53.20 H new ATOM 0 HA GLN A 50 1.097 -17.011 8.778 1.00 43.23 H new ATOM 0 HB2 GLN A 50 1.693 -14.784 9.762 1.00 0.31 H new ATOM 0 HB3 GLN A 50 0.784 -13.984 8.495 1.00 0.31 H new ATOM 0 HG2 GLN A 50 -0.535 -14.043 10.555 1.00 63.12 H new ATOM 0 HG3 GLN A 50 -1.319 -15.008 9.320 1.00 63.12 H new ATOM 0 HE21 GLN A 50 -2.507 -16.311 10.743 1.00 45.03 H new ATOM 0 HE22 GLN A 50 -1.746 -17.505 11.800 1.00 45.03 H new ATOM 831 N GLY A 51 -0.113 -15.407 6.140 1.00 40.23 N ATOM 832 CA GLY A 51 -1.168 -15.404 5.118 1.00 14.51 C ATOM 833 C GLY A 51 -2.140 -14.237 5.253 1.00 64.42 C ATOM 834 O GLY A 51 -2.966 -14.012 4.359 1.00 63.20 O ATOM 0 H GLY A 51 0.614 -14.708 5.985 1.00 40.23 H new ATOM 0 HA2 GLY A 51 -0.707 -15.371 4.131 1.00 14.51 H new ATOM 0 HA3 GLY A 51 -1.724 -16.339 5.178 1.00 14.51 H new ATOM 838 N ARG A 52 -2.050 -13.504 6.380 1.00 43.40 N ATOM 839 CA ARG A 52 -2.862 -12.293 6.638 1.00 60.10 C ATOM 840 C ARG A 52 -2.353 -11.114 5.760 1.00 50.22 C ATOM 841 O ARG A 52 -1.180 -11.117 5.353 1.00 13.13 O ATOM 842 CB ARG A 52 -2.802 -11.925 8.154 1.00 72.32 C ATOM 843 CG ARG A 52 -1.385 -11.588 8.678 1.00 24.23 C ATOM 844 CD ARG A 52 -1.342 -11.278 10.187 1.00 35.32 C ATOM 845 NE ARG A 52 0.044 -11.189 10.689 1.00 64.13 N ATOM 846 CZ ARG A 52 0.446 -10.543 11.801 1.00 72.41 C ATOM 847 NH1 ARG A 52 -0.418 -9.885 12.573 1.00 64.31 N ATOM 848 NH2 ARG A 52 1.729 -10.572 12.137 1.00 10.40 N ATOM 0 H ARG A 52 -1.411 -13.734 7.141 1.00 43.40 H new ATOM 0 HA ARG A 52 -3.901 -12.493 6.374 1.00 60.10 H new ATOM 0 HB2 ARG A 52 -3.455 -11.071 8.333 1.00 72.32 H new ATOM 0 HB3 ARG A 52 -3.201 -12.758 8.733 1.00 72.32 H new ATOM 0 HG2 ARG A 52 -0.721 -12.426 8.469 1.00 24.23 H new ATOM 0 HG3 ARG A 52 -0.998 -10.730 8.128 1.00 24.23 H new ATOM 0 HD2 ARG A 52 -1.860 -10.338 10.380 1.00 35.32 H new ATOM 0 HD3 ARG A 52 -1.877 -12.055 10.733 1.00 35.32 H new ATOM 0 HE ARG A 52 0.765 -11.661 10.143 1.00 64.13 H new ATOM 0 HH11 ARG A 52 -1.408 -9.863 12.327 1.00 64.31 H new ATOM 0 HH12 ARG A 52 -0.090 -9.403 13.410 1.00 64.31 H new ATOM 0 HH21 ARG A 52 2.397 -11.079 11.556 1.00 10.40 H new ATOM 0 HH22 ARG A 52 2.048 -10.087 12.976 1.00 10.40 H new ATOM 862 N PRO A 53 -3.218 -10.089 5.446 1.00 43.40 N ATOM 863 CA PRO A 53 -2.805 -8.936 4.607 1.00 70.12 C ATOM 864 C PRO A 53 -1.786 -8.016 5.321 1.00 4.21 C ATOM 865 O PRO A 53 -1.637 -8.053 6.556 1.00 13.10 O ATOM 866 CB PRO A 53 -4.136 -8.178 4.314 1.00 3.13 C ATOM 867 CG PRO A 53 -5.244 -9.073 4.813 1.00 4.53 C ATOM 868 CD PRO A 53 -4.642 -9.963 5.872 1.00 10.51 C ATOM 0 HA PRO A 53 -2.294 -9.264 3.702 1.00 70.12 H new ATOM 0 HB2 PRO A 53 -4.155 -7.213 4.821 1.00 3.13 H new ATOM 0 HB3 PRO A 53 -4.245 -7.980 3.248 1.00 3.13 H new ATOM 0 HG2 PRO A 53 -6.063 -8.482 5.224 1.00 4.53 H new ATOM 0 HG3 PRO A 53 -5.658 -9.667 3.998 1.00 4.53 H new ATOM 0 HD2 PRO A 53 -4.727 -9.521 6.865 1.00 10.51 H new ATOM 0 HD3 PRO A 53 -5.137 -10.933 5.911 1.00 10.51 H new ATOM 876 N ILE A 54 -1.098 -7.181 4.531 1.00 45.22 N ATOM 877 CA ILE A 54 -0.146 -6.180 5.041 1.00 44.43 C ATOM 878 C ILE A 54 -0.447 -4.827 4.371 1.00 52.13 C ATOM 879 O ILE A 54 -0.567 -4.744 3.140 1.00 61.42 O ATOM 880 CB ILE A 54 1.350 -6.632 4.805 1.00 42.43 C ATOM 881 CG1 ILE A 54 2.359 -5.576 5.366 1.00 63.41 C ATOM 882 CG2 ILE A 54 1.637 -6.953 3.314 1.00 31.43 C ATOM 883 CD1 ILE A 54 3.830 -5.956 5.240 1.00 32.12 C ATOM 0 H ILE A 54 -1.185 -7.179 3.515 1.00 45.22 H new ATOM 0 HA ILE A 54 -0.267 -6.079 6.120 1.00 44.43 H new ATOM 0 HB ILE A 54 1.493 -7.558 5.361 1.00 42.43 H new ATOM 0 HG12 ILE A 54 2.198 -4.631 4.847 1.00 63.41 H new ATOM 0 HG13 ILE A 54 2.133 -5.404 6.418 1.00 63.41 H new ATOM 0 HG21 ILE A 54 2.677 -7.259 3.201 1.00 31.43 H new ATOM 0 HG22 ILE A 54 0.983 -7.760 2.983 1.00 31.43 H new ATOM 0 HG23 ILE A 54 1.452 -6.066 2.709 1.00 31.43 H new ATOM 0 HD11 ILE A 54 4.448 -5.161 5.657 1.00 32.12 H new ATOM 0 HD12 ILE A 54 4.014 -6.882 5.785 1.00 32.12 H new ATOM 0 HD13 ILE A 54 4.081 -6.097 4.189 1.00 32.12 H new ATOM 895 N VAL A 55 -0.631 -3.772 5.192 1.00 25.44 N ATOM 896 CA VAL A 55 -0.961 -2.424 4.696 1.00 32.13 C ATOM 897 C VAL A 55 0.153 -1.441 5.098 1.00 34.14 C ATOM 898 O VAL A 55 0.429 -1.276 6.289 1.00 14.24 O ATOM 899 CB VAL A 55 -2.364 -1.915 5.214 1.00 30.25 C ATOM 900 CG1 VAL A 55 -2.786 -0.627 4.480 1.00 24.34 C ATOM 901 CG2 VAL A 55 -3.459 -2.994 5.059 1.00 43.23 C ATOM 0 H VAL A 55 -0.555 -3.831 6.207 1.00 25.44 H new ATOM 0 HA VAL A 55 -1.031 -2.478 3.610 1.00 32.13 H new ATOM 0 HB VAL A 55 -2.253 -1.698 6.276 1.00 30.25 H new ATOM 0 HG11 VAL A 55 -3.755 -0.296 4.854 1.00 24.34 H new ATOM 0 HG12 VAL A 55 -2.044 0.152 4.656 1.00 24.34 H new ATOM 0 HG13 VAL A 55 -2.858 -0.825 3.410 1.00 24.34 H new ATOM 0 HG21 VAL A 55 -4.408 -2.604 5.427 1.00 43.23 H new ATOM 0 HG22 VAL A 55 -3.560 -3.262 4.007 1.00 43.23 H new ATOM 0 HG23 VAL A 55 -3.183 -3.878 5.634 1.00 43.23 H new ATOM 911 N ILE A 56 0.800 -0.814 4.095 1.00 40.43 N ATOM 912 CA ILE A 56 1.943 0.099 4.310 1.00 12.43 C ATOM 913 C ILE A 56 1.451 1.554 4.289 1.00 13.05 C ATOM 914 O ILE A 56 0.641 1.911 3.448 1.00 72.12 O ATOM 915 CB ILE A 56 3.057 -0.110 3.209 1.00 14.44 C ATOM 916 CG1 ILE A 56 3.415 -1.622 3.054 1.00 12.40 C ATOM 917 CG2 ILE A 56 4.326 0.731 3.503 1.00 5.41 C ATOM 918 CD1 ILE A 56 3.865 -2.314 4.332 1.00 2.23 C ATOM 0 H ILE A 56 0.546 -0.926 3.113 1.00 40.43 H new ATOM 0 HA ILE A 56 2.384 -0.125 5.281 1.00 12.43 H new ATOM 0 HB ILE A 56 2.645 0.243 2.263 1.00 14.44 H new ATOM 0 HG12 ILE A 56 2.544 -2.147 2.663 1.00 12.40 H new ATOM 0 HG13 ILE A 56 4.206 -1.718 2.310 1.00 12.40 H new ATOM 0 HG21 ILE A 56 5.066 0.558 2.722 1.00 5.41 H new ATOM 0 HG22 ILE A 56 4.064 1.789 3.526 1.00 5.41 H new ATOM 0 HG23 ILE A 56 4.741 0.439 4.468 1.00 5.41 H new ATOM 0 HD11 ILE A 56 4.090 -3.359 4.120 1.00 2.23 H new ATOM 0 HD12 ILE A 56 4.758 -1.821 4.718 1.00 2.23 H new ATOM 0 HD13 ILE A 56 3.070 -2.258 5.076 1.00 2.23 H new ATOM 930 N PHE A 57 1.935 2.384 5.228 1.00 74.23 N ATOM 931 CA PHE A 57 1.516 3.798 5.358 1.00 31.25 C ATOM 932 C PHE A 57 2.723 4.725 5.182 1.00 24.42 C ATOM 933 O PHE A 57 3.688 4.663 5.952 1.00 70.32 O ATOM 934 CB PHE A 57 0.828 4.030 6.727 1.00 25.12 C ATOM 935 CG PHE A 57 -0.557 3.414 6.828 1.00 34.21 C ATOM 936 CD1 PHE A 57 -0.724 2.056 7.103 1.00 24.20 C ATOM 937 CD2 PHE A 57 -1.694 4.188 6.609 1.00 11.23 C ATOM 938 CE1 PHE A 57 -1.983 1.499 7.157 1.00 72.32 C ATOM 939 CE2 PHE A 57 -2.949 3.626 6.654 1.00 33.34 C ATOM 940 CZ PHE A 57 -3.092 2.285 6.923 1.00 73.44 C ATOM 0 H PHE A 57 2.628 2.098 5.920 1.00 74.23 H new ATOM 0 HA PHE A 57 0.794 4.029 4.574 1.00 31.25 H new ATOM 0 HB2 PHE A 57 1.458 3.617 7.515 1.00 25.12 H new ATOM 0 HB3 PHE A 57 0.753 5.102 6.909 1.00 25.12 H new ATOM 0 HD1 PHE A 57 0.143 1.435 7.275 1.00 24.20 H new ATOM 0 HD2 PHE A 57 -1.589 5.243 6.401 1.00 11.23 H new ATOM 0 HE1 PHE A 57 -2.101 0.449 7.382 1.00 72.32 H new ATOM 0 HE2 PHE A 57 -3.821 4.238 6.478 1.00 33.34 H new ATOM 0 HZ PHE A 57 -4.078 1.845 6.951 1.00 73.44 H new ATOM 950 N ILE A 58 2.642 5.577 4.150 1.00 5.04 N ATOM 951 CA ILE A 58 3.676 6.574 3.791 1.00 43.21 C ATOM 952 C ILE A 58 2.990 7.828 3.234 1.00 63.32 C ATOM 953 O ILE A 58 1.915 7.728 2.640 1.00 23.11 O ATOM 954 CB ILE A 58 4.697 6.003 2.733 1.00 21.13 C ATOM 955 CG1 ILE A 58 3.943 5.241 1.608 1.00 33.33 C ATOM 956 CG2 ILE A 58 5.766 5.103 3.395 1.00 41.13 C ATOM 957 CD1 ILE A 58 4.838 4.638 0.554 1.00 14.10 C ATOM 0 H ILE A 58 1.838 5.597 3.523 1.00 5.04 H new ATOM 0 HA ILE A 58 4.242 6.821 4.689 1.00 43.21 H new ATOM 0 HB ILE A 58 5.222 6.848 2.287 1.00 21.13 H new ATOM 0 HG12 ILE A 58 3.348 4.447 2.060 1.00 33.33 H new ATOM 0 HG13 ILE A 58 3.246 5.927 1.126 1.00 33.33 H new ATOM 0 HG21 ILE A 58 6.450 4.730 2.633 1.00 41.13 H new ATOM 0 HG22 ILE A 58 6.324 5.682 4.131 1.00 41.13 H new ATOM 0 HG23 ILE A 58 5.279 4.262 3.889 1.00 41.13 H new ATOM 0 HD11 ILE A 58 4.229 4.126 -0.191 1.00 14.10 H new ATOM 0 HD12 ILE A 58 5.414 5.427 0.071 1.00 14.10 H new ATOM 0 HD13 ILE A 58 5.518 3.925 1.019 1.00 14.10 H new ATOM 969 N ARG A 59 3.608 9.010 3.431 1.00 3.24 N ATOM 970 CA ARG A 59 2.981 10.298 3.069 1.00 21.13 C ATOM 971 C ARG A 59 2.985 10.522 1.533 1.00 3.32 C ATOM 972 O ARG A 59 2.002 10.220 0.883 1.00 22.33 O ATOM 973 CB ARG A 59 3.657 11.469 3.831 1.00 24.02 C ATOM 974 CG ARG A 59 2.914 12.819 3.761 1.00 4.42 C ATOM 975 CD ARG A 59 3.655 13.938 4.510 1.00 4.51 C ATOM 976 NE ARG A 59 2.924 15.213 4.468 1.00 30.25 N ATOM 977 CZ ARG A 59 3.474 16.437 4.574 1.00 50.54 C ATOM 978 NH1 ARG A 59 4.793 16.593 4.736 1.00 22.42 N ATOM 979 NH2 ARG A 59 2.691 17.505 4.498 1.00 13.11 N ATOM 0 H ARG A 59 4.539 9.100 3.838 1.00 3.24 H new ATOM 0 HA ARG A 59 1.936 10.265 3.376 1.00 21.13 H new ATOM 0 HB2 ARG A 59 3.763 11.186 4.878 1.00 24.02 H new ATOM 0 HB3 ARG A 59 4.663 11.606 3.434 1.00 24.02 H new ATOM 0 HG2 ARG A 59 2.787 13.107 2.717 1.00 4.42 H new ATOM 0 HG3 ARG A 59 1.916 12.703 4.183 1.00 4.42 H new ATOM 0 HD2 ARG A 59 3.804 13.641 5.548 1.00 4.51 H new ATOM 0 HD3 ARG A 59 4.644 14.073 4.072 1.00 4.51 H new ATOM 0 HE ARG A 59 1.912 15.166 4.348 1.00 30.25 H new ATOM 0 HH11 ARG A 59 5.401 15.776 4.781 1.00 22.42 H new ATOM 0 HH12 ARG A 59 5.190 17.529 4.814 1.00 22.42 H new ATOM 0 HH21 ARG A 59 1.687 17.392 4.361 1.00 13.11 H new ATOM 0 HH22 ARG A 59 3.093 18.439 4.577 1.00 13.11 H new ATOM 993 N GLY A 60 4.101 10.995 0.941 1.00 74.05 N ATOM 994 CA GLY A 60 4.101 11.339 -0.494 1.00 31.24 C ATOM 995 C GLY A 60 5.441 11.104 -1.169 1.00 44.41 C ATOM 996 O GLY A 60 5.567 10.216 -2.014 1.00 2.25 O ATOM 0 H GLY A 60 4.990 11.144 1.419 1.00 74.05 H new ATOM 0 HA2 GLY A 60 3.338 10.749 -1.002 1.00 31.24 H new ATOM 0 HA3 GLY A 60 3.823 12.387 -0.609 1.00 31.24 H new ATOM 1000 N ALA A 61 6.446 11.912 -0.790 1.00 33.11 N ATOM 1001 CA ALA A 61 7.834 11.783 -1.295 1.00 64.15 C ATOM 1002 C ALA A 61 8.451 10.410 -0.950 1.00 32.15 C ATOM 1003 O ALA A 61 9.380 9.936 -1.616 1.00 71.24 O ATOM 1004 CB ALA A 61 8.688 12.925 -0.739 1.00 14.22 C ATOM 0 H ALA A 61 6.324 12.675 -0.124 1.00 33.11 H new ATOM 0 HA ALA A 61 7.809 11.849 -2.383 1.00 64.15 H new ATOM 0 HB1 ALA A 61 9.708 12.830 -1.110 1.00 14.22 H new ATOM 0 HB2 ALA A 61 8.272 13.880 -1.060 1.00 14.22 H new ATOM 0 HB3 ALA A 61 8.692 12.879 0.350 1.00 14.22 H new ATOM 1010 N TYR A 62 7.898 9.796 0.098 1.00 54.12 N ATOM 1011 CA TYR A 62 8.280 8.472 0.585 1.00 72.33 C ATOM 1012 C TYR A 62 7.890 7.357 -0.414 1.00 61.30 C ATOM 1013 O TYR A 62 8.529 6.304 -0.444 1.00 75.44 O ATOM 1014 CB TYR A 62 7.618 8.228 1.950 1.00 41.42 C ATOM 1015 CG TYR A 62 7.900 9.318 2.996 1.00 4.22 C ATOM 1016 CD1 TYR A 62 9.129 9.398 3.651 1.00 73.33 C ATOM 1017 CD2 TYR A 62 6.934 10.264 3.332 1.00 2.24 C ATOM 1018 CE1 TYR A 62 9.377 10.375 4.599 1.00 73.45 C ATOM 1019 CE2 TYR A 62 7.178 11.237 4.282 1.00 44.01 C ATOM 1020 CZ TYR A 62 8.397 11.289 4.912 1.00 74.23 C ATOM 1021 OH TYR A 62 8.639 12.265 5.862 1.00 11.24 O ATOM 0 H TYR A 62 7.150 10.220 0.646 1.00 54.12 H new ATOM 0 HA TYR A 62 9.365 8.442 0.689 1.00 72.33 H new ATOM 0 HB2 TYR A 62 6.540 8.148 1.808 1.00 41.42 H new ATOM 0 HB3 TYR A 62 7.961 7.270 2.340 1.00 41.42 H new ATOM 0 HD1 TYR A 62 9.903 8.683 3.413 1.00 73.33 H new ATOM 0 HD2 TYR A 62 5.973 10.236 2.839 1.00 2.24 H new ATOM 0 HE1 TYR A 62 10.337 10.420 5.092 1.00 73.45 H new ATOM 0 HE2 TYR A 62 6.411 11.956 4.529 1.00 44.01 H new ATOM 0 HH TYR A 62 7.844 12.829 5.962 1.00 11.24 H new ATOM 1031 N GLU A 63 6.802 7.593 -1.196 1.00 0.33 N ATOM 1032 CA GLU A 63 6.274 6.617 -2.183 1.00 1.43 C ATOM 1033 C GLU A 63 7.335 6.260 -3.245 1.00 73.33 C ATOM 1034 O GLU A 63 7.340 5.152 -3.759 1.00 22.14 O ATOM 1035 CB GLU A 63 4.976 7.131 -2.866 1.00 64.52 C ATOM 1036 CG GLU A 63 4.129 6.018 -3.566 1.00 22.10 C ATOM 1037 CD GLU A 63 3.037 6.517 -4.546 1.00 34.30 C ATOM 1038 OE1 GLU A 63 2.490 7.631 -4.378 1.00 31.33 O ATOM 1039 OE2 GLU A 63 2.714 5.779 -5.503 1.00 52.24 O ATOM 0 H GLU A 63 6.270 8.462 -1.159 1.00 0.33 H new ATOM 0 HA GLU A 63 6.025 5.712 -1.629 1.00 1.43 H new ATOM 0 HB2 GLU A 63 4.357 7.624 -2.117 1.00 64.52 H new ATOM 0 HB3 GLU A 63 5.244 7.886 -3.605 1.00 64.52 H new ATOM 0 HG2 GLU A 63 4.807 5.361 -4.111 1.00 22.10 H new ATOM 0 HG3 GLU A 63 3.650 5.414 -2.795 1.00 22.10 H new ATOM 1046 N GLU A 64 8.253 7.203 -3.515 1.00 22.50 N ATOM 1047 CA GLU A 64 9.341 7.047 -4.507 1.00 73.24 C ATOM 1048 C GLU A 64 10.188 5.758 -4.266 1.00 33.42 C ATOM 1049 O GLU A 64 10.688 5.129 -5.206 1.00 43.21 O ATOM 1050 CB GLU A 64 10.233 8.309 -4.428 1.00 3.13 C ATOM 1051 CG GLU A 64 11.358 8.400 -5.478 1.00 72.43 C ATOM 1052 CD GLU A 64 10.841 8.461 -6.925 1.00 63.35 C ATOM 1053 OE1 GLU A 64 10.116 9.413 -7.272 1.00 2.20 O ATOM 1054 OE2 GLU A 64 11.167 7.572 -7.731 1.00 61.42 O ATOM 0 H GLU A 64 8.264 8.109 -3.046 1.00 22.50 H new ATOM 0 HA GLU A 64 8.905 6.939 -5.500 1.00 73.24 H new ATOM 0 HB2 GLU A 64 9.596 9.188 -4.528 1.00 3.13 H new ATOM 0 HB3 GLU A 64 10.683 8.352 -3.436 1.00 3.13 H new ATOM 0 HG2 GLU A 64 11.961 9.286 -5.278 1.00 72.43 H new ATOM 0 HG3 GLU A 64 12.015 7.537 -5.371 1.00 72.43 H new ATOM 1061 N VAL A 65 10.291 5.376 -2.987 1.00 44.35 N ATOM 1062 CA VAL A 65 11.097 4.242 -2.511 1.00 35.12 C ATOM 1063 C VAL A 65 10.405 2.862 -2.775 1.00 33.41 C ATOM 1064 O VAL A 65 11.083 1.832 -2.841 1.00 53.20 O ATOM 1065 CB VAL A 65 11.429 4.434 -0.981 1.00 64.32 C ATOM 1066 CG1 VAL A 65 12.484 3.434 -0.494 1.00 73.51 C ATOM 1067 CG2 VAL A 65 11.867 5.895 -0.672 1.00 54.23 C ATOM 0 H VAL A 65 9.803 5.860 -2.233 1.00 44.35 H new ATOM 0 HA VAL A 65 12.026 4.228 -3.081 1.00 35.12 H new ATOM 0 HB VAL A 65 10.509 4.234 -0.431 1.00 64.32 H new ATOM 0 HG11 VAL A 65 12.683 3.601 0.565 1.00 73.51 H new ATOM 0 HG12 VAL A 65 12.116 2.418 -0.638 1.00 73.51 H new ATOM 0 HG13 VAL A 65 13.404 3.570 -1.062 1.00 73.51 H new ATOM 0 HG21 VAL A 65 12.088 5.991 0.391 1.00 54.23 H new ATOM 0 HG22 VAL A 65 12.758 6.138 -1.251 1.00 54.23 H new ATOM 0 HG23 VAL A 65 11.062 6.580 -0.939 1.00 54.23 H new ATOM 1077 N VAL A 66 9.054 2.855 -2.888 1.00 40.14 N ATOM 1078 CA VAL A 66 8.235 1.617 -3.078 1.00 0.24 C ATOM 1079 C VAL A 66 8.708 0.756 -4.276 1.00 25.15 C ATOM 1080 O VAL A 66 8.586 -0.464 -4.239 1.00 64.45 O ATOM 1081 CB VAL A 66 6.695 1.952 -3.216 1.00 22.41 C ATOM 1082 CG1 VAL A 66 5.819 0.698 -3.499 1.00 74.34 C ATOM 1083 CG2 VAL A 66 6.194 2.678 -1.957 1.00 31.33 C ATOM 0 H VAL A 66 8.494 3.707 -2.851 1.00 40.14 H new ATOM 0 HA VAL A 66 8.384 1.023 -2.176 1.00 0.24 H new ATOM 0 HB VAL A 66 6.594 2.605 -4.083 1.00 22.41 H new ATOM 0 HG11 VAL A 66 4.774 0.996 -3.583 1.00 74.34 H new ATOM 0 HG12 VAL A 66 6.140 0.233 -4.431 1.00 74.34 H new ATOM 0 HG13 VAL A 66 5.929 -0.015 -2.682 1.00 74.34 H new ATOM 0 HG21 VAL A 66 5.133 2.903 -2.065 1.00 31.33 H new ATOM 0 HG22 VAL A 66 6.343 2.040 -1.086 1.00 31.33 H new ATOM 0 HG23 VAL A 66 6.750 3.606 -1.827 1.00 31.33 H new ATOM 1093 N ARG A 67 9.252 1.403 -5.325 1.00 11.42 N ATOM 1094 CA ARG A 67 9.808 0.705 -6.518 1.00 12.05 C ATOM 1095 C ARG A 67 10.916 -0.315 -6.138 1.00 42.32 C ATOM 1096 O ARG A 67 11.048 -1.378 -6.764 1.00 24.21 O ATOM 1097 CB ARG A 67 10.354 1.754 -7.512 1.00 23.33 C ATOM 1098 CG ARG A 67 11.091 1.193 -8.757 1.00 65.23 C ATOM 1099 CD ARG A 67 11.676 2.316 -9.634 1.00 70.23 C ATOM 1100 NE ARG A 67 12.516 3.256 -8.855 1.00 1.23 N ATOM 1101 CZ ARG A 67 12.201 4.540 -8.599 1.00 55.13 C ATOM 1102 NH1 ARG A 67 11.081 5.071 -9.078 1.00 11.44 N ATOM 1103 NH2 ARG A 67 12.991 5.270 -7.826 1.00 42.12 N ATOM 0 H ARG A 67 9.322 2.419 -5.377 1.00 11.42 H new ATOM 0 HA ARG A 67 9.004 0.136 -6.984 1.00 12.05 H new ATOM 0 HB2 ARG A 67 9.522 2.369 -7.854 1.00 23.33 H new ATOM 0 HB3 ARG A 67 11.038 2.412 -6.976 1.00 23.33 H new ATOM 0 HG2 ARG A 67 11.893 0.529 -8.435 1.00 65.23 H new ATOM 0 HG3 ARG A 67 10.399 0.594 -9.349 1.00 65.23 H new ATOM 0 HD2 ARG A 67 12.272 1.877 -10.434 1.00 70.23 H new ATOM 0 HD3 ARG A 67 10.863 2.866 -10.108 1.00 70.23 H new ATOM 0 HE ARG A 67 13.399 2.904 -8.485 1.00 1.23 H new ATOM 0 HH11 ARG A 67 10.450 4.505 -9.646 1.00 11.44 H new ATOM 0 HH12 ARG A 67 10.852 6.045 -8.878 1.00 11.44 H new ATOM 0 HH21 ARG A 67 13.835 4.859 -7.427 1.00 42.12 H new ATOM 0 HH22 ARG A 67 12.755 6.243 -7.630 1.00 42.12 H new ATOM 1117 N ASP A 68 11.700 0.027 -5.110 1.00 50.52 N ATOM 1118 CA ASP A 68 12.736 -0.863 -4.557 1.00 0.14 C ATOM 1119 C ASP A 68 12.079 -2.016 -3.778 1.00 63.21 C ATOM 1120 O ASP A 68 12.452 -3.186 -3.925 1.00 50.24 O ATOM 1121 CB ASP A 68 13.672 -0.071 -3.611 1.00 33.23 C ATOM 1122 CG ASP A 68 14.327 1.164 -4.260 1.00 34.42 C ATOM 1123 OD1 ASP A 68 13.657 2.210 -4.377 1.00 14.43 O ATOM 1124 OD2 ASP A 68 15.519 1.101 -4.631 1.00 12.21 O ATOM 0 H ASP A 68 11.637 0.928 -4.635 1.00 50.52 H new ATOM 0 HA ASP A 68 13.321 -1.270 -5.382 1.00 0.14 H new ATOM 0 HB2 ASP A 68 13.102 0.250 -2.739 1.00 33.23 H new ATOM 0 HB3 ASP A 68 14.456 -0.738 -3.252 1.00 33.23 H new ATOM 1129 N ILE A 69 11.074 -1.646 -2.966 1.00 71.02 N ATOM 1130 CA ILE A 69 10.375 -2.553 -2.038 1.00 12.12 C ATOM 1131 C ILE A 69 9.589 -3.645 -2.794 1.00 5.04 C ATOM 1132 O ILE A 69 9.599 -4.824 -2.405 1.00 41.21 O ATOM 1133 CB ILE A 69 9.397 -1.735 -1.117 1.00 12.50 C ATOM 1134 CG1 ILE A 69 10.169 -0.611 -0.347 1.00 43.23 C ATOM 1135 CG2 ILE A 69 8.637 -2.664 -0.146 1.00 11.23 C ATOM 1136 CD1 ILE A 69 9.291 0.316 0.484 1.00 55.01 C ATOM 0 H ILE A 69 10.718 -0.691 -2.935 1.00 71.02 H new ATOM 0 HA ILE A 69 11.130 -3.045 -1.424 1.00 12.12 H new ATOM 0 HB ILE A 69 8.655 -1.254 -1.754 1.00 12.50 H new ATOM 0 HG12 ILE A 69 10.902 -1.079 0.310 1.00 43.23 H new ATOM 0 HG13 ILE A 69 10.724 -0.012 -1.069 1.00 43.23 H new ATOM 0 HG21 ILE A 69 7.969 -2.070 0.478 1.00 11.23 H new ATOM 0 HG22 ILE A 69 8.054 -3.387 -0.716 1.00 11.23 H new ATOM 0 HG23 ILE A 69 9.351 -3.191 0.487 1.00 11.23 H new ATOM 0 HD11 ILE A 69 9.914 1.060 0.979 1.00 55.01 H new ATOM 0 HD12 ILE A 69 8.574 0.818 -0.166 1.00 55.01 H new ATOM 0 HD13 ILE A 69 8.755 -0.266 1.234 1.00 55.01 H new ATOM 1148 N VAL A 70 8.951 -3.228 -3.896 1.00 41.43 N ATOM 1149 CA VAL A 70 8.013 -4.057 -4.654 1.00 11.11 C ATOM 1150 C VAL A 70 8.735 -5.230 -5.334 1.00 42.42 C ATOM 1151 O VAL A 70 8.157 -6.298 -5.480 1.00 12.00 O ATOM 1152 CB VAL A 70 7.205 -3.206 -5.704 1.00 22.32 C ATOM 1153 CG1 VAL A 70 8.088 -2.654 -6.842 1.00 44.52 C ATOM 1154 CG2 VAL A 70 6.023 -4.002 -6.268 1.00 13.23 C ATOM 0 H VAL A 70 9.075 -2.295 -4.288 1.00 41.43 H new ATOM 0 HA VAL A 70 7.296 -4.469 -3.944 1.00 11.11 H new ATOM 0 HB VAL A 70 6.818 -2.342 -5.164 1.00 22.32 H new ATOM 0 HG11 VAL A 70 7.473 -2.077 -7.532 1.00 44.52 H new ATOM 0 HG12 VAL A 70 8.863 -2.012 -6.423 1.00 44.52 H new ATOM 0 HG13 VAL A 70 8.553 -3.483 -7.376 1.00 44.52 H new ATOM 0 HG21 VAL A 70 5.483 -3.389 -6.990 1.00 13.23 H new ATOM 0 HG22 VAL A 70 6.392 -4.902 -6.760 1.00 13.23 H new ATOM 0 HG23 VAL A 70 5.352 -4.281 -5.456 1.00 13.23 H new ATOM 1164 N GLU A 71 10.018 -5.011 -5.709 1.00 33.31 N ATOM 1165 CA GLU A 71 10.870 -6.023 -6.365 1.00 32.24 C ATOM 1166 C GLU A 71 10.992 -7.304 -5.504 1.00 14.24 C ATOM 1167 O GLU A 71 11.096 -8.418 -6.036 1.00 31.42 O ATOM 1168 CB GLU A 71 12.264 -5.419 -6.661 1.00 70.11 C ATOM 1169 CG GLU A 71 13.217 -6.358 -7.428 1.00 62.23 C ATOM 1170 CD GLU A 71 14.604 -5.751 -7.657 1.00 12.43 C ATOM 1171 OE1 GLU A 71 14.766 -4.966 -8.607 1.00 65.21 O ATOM 1172 OE2 GLU A 71 15.540 -6.056 -6.883 1.00 51.12 O ATOM 0 H GLU A 71 10.491 -4.119 -5.562 1.00 33.31 H new ATOM 0 HA GLU A 71 10.402 -6.312 -7.306 1.00 32.24 H new ATOM 0 HB2 GLU A 71 12.134 -4.503 -7.238 1.00 70.11 H new ATOM 0 HB3 GLU A 71 12.732 -5.138 -5.718 1.00 70.11 H new ATOM 0 HG2 GLU A 71 13.322 -7.291 -6.874 1.00 62.23 H new ATOM 0 HG3 GLU A 71 12.773 -6.608 -8.392 1.00 62.23 H new ATOM 1179 N TYR A 72 10.920 -7.121 -4.174 1.00 44.24 N ATOM 1180 CA TYR A 72 10.936 -8.232 -3.202 1.00 11.54 C ATOM 1181 C TYR A 72 9.630 -9.034 -3.294 1.00 10.44 C ATOM 1182 O TYR A 72 9.645 -10.263 -3.352 1.00 65.24 O ATOM 1183 CB TYR A 72 11.129 -7.679 -1.772 1.00 5.13 C ATOM 1184 CG TYR A 72 11.176 -8.737 -0.649 1.00 13.14 C ATOM 1185 CD1 TYR A 72 10.009 -9.177 -0.012 1.00 42.22 C ATOM 1186 CD2 TYR A 72 12.388 -9.279 -0.212 1.00 23.23 C ATOM 1187 CE1 TYR A 72 10.052 -10.112 0.999 1.00 64.20 C ATOM 1188 CE2 TYR A 72 12.431 -10.213 0.805 1.00 61.33 C ATOM 1189 CZ TYR A 72 11.261 -10.624 1.407 1.00 22.02 C ATOM 1190 OH TYR A 72 11.303 -11.550 2.424 1.00 35.40 O ATOM 0 H TYR A 72 10.849 -6.200 -3.741 1.00 44.24 H new ATOM 0 HA TYR A 72 11.768 -8.896 -3.436 1.00 11.54 H new ATOM 0 HB2 TYR A 72 12.056 -7.105 -1.745 1.00 5.13 H new ATOM 0 HB3 TYR A 72 10.317 -6.984 -1.558 1.00 5.13 H new ATOM 0 HD1 TYR A 72 9.055 -8.775 -0.320 1.00 42.22 H new ATOM 0 HD2 TYR A 72 13.309 -8.961 -0.678 1.00 23.23 H new ATOM 0 HE1 TYR A 72 9.138 -10.442 1.470 1.00 64.20 H new ATOM 0 HE2 TYR A 72 13.378 -10.620 1.127 1.00 61.33 H new ATOM 0 HH TYR A 72 12.233 -11.812 2.590 1.00 35.40 H new ATOM 1200 N ALA A 73 8.502 -8.307 -3.304 1.00 71.12 N ATOM 1201 CA ALA A 73 7.162 -8.897 -3.435 1.00 73.02 C ATOM 1202 C ALA A 73 6.975 -9.550 -4.821 1.00 55.12 C ATOM 1203 O ALA A 73 6.178 -10.470 -4.969 1.00 45.34 O ATOM 1204 CB ALA A 73 6.091 -7.845 -3.160 1.00 12.34 C ATOM 0 H ALA A 73 8.494 -7.290 -3.221 1.00 71.12 H new ATOM 0 HA ALA A 73 7.057 -9.687 -2.691 1.00 73.02 H new ATOM 0 HB1 ALA A 73 5.104 -8.296 -3.261 1.00 12.34 H new ATOM 0 HB2 ALA A 73 6.212 -7.458 -2.148 1.00 12.34 H new ATOM 0 HB3 ALA A 73 6.191 -7.028 -3.875 1.00 12.34 H new ATOM 1210 N GLN A 74 7.702 -9.029 -5.833 1.00 32.11 N ATOM 1211 CA GLN A 74 7.722 -9.594 -7.198 1.00 35.51 C ATOM 1212 C GLN A 74 8.476 -10.936 -7.218 1.00 35.34 C ATOM 1213 O GLN A 74 8.090 -11.848 -7.949 1.00 44.42 O ATOM 1214 CB GLN A 74 8.369 -8.605 -8.204 1.00 43.54 C ATOM 1215 CG GLN A 74 7.576 -7.298 -8.428 1.00 74.12 C ATOM 1216 CD GLN A 74 8.268 -6.328 -9.393 1.00 42.45 C ATOM 1217 OE1 GLN A 74 9.496 -6.299 -9.490 1.00 61.03 O ATOM 1218 NE2 GLN A 74 7.492 -5.518 -10.100 1.00 33.25 N ATOM 0 H GLN A 74 8.292 -8.204 -5.725 1.00 32.11 H new ATOM 0 HA GLN A 74 6.689 -9.765 -7.502 1.00 35.51 H new ATOM 0 HB2 GLN A 74 9.368 -8.351 -7.851 1.00 43.54 H new ATOM 0 HB3 GLN A 74 8.488 -9.110 -9.163 1.00 43.54 H new ATOM 0 HG2 GLN A 74 6.587 -7.543 -8.816 1.00 74.12 H new ATOM 0 HG3 GLN A 74 7.428 -6.802 -7.469 1.00 74.12 H new ATOM 0 HE21 GLN A 74 6.478 -5.565 -9.998 1.00 33.25 H new ATOM 0 HE22 GLN A 74 7.909 -4.847 -10.746 1.00 33.25 H new ATOM 1227 N LYS A 75 9.564 -11.035 -6.419 1.00 43.44 N ATOM 1228 CA LYS A 75 10.259 -12.324 -6.157 1.00 4.13 C ATOM 1229 C LYS A 75 9.278 -13.321 -5.518 1.00 11.34 C ATOM 1230 O LYS A 75 9.208 -14.492 -5.902 1.00 2.41 O ATOM 1231 CB LYS A 75 11.484 -12.132 -5.208 1.00 40.43 C ATOM 1232 CG LYS A 75 12.674 -11.361 -5.813 1.00 65.41 C ATOM 1233 CD LYS A 75 13.289 -12.085 -7.033 1.00 70.51 C ATOM 1234 CE LYS A 75 14.543 -11.385 -7.576 1.00 74.53 C ATOM 1235 NZ LYS A 75 15.092 -12.072 -8.777 1.00 55.33 N ATOM 0 H LYS A 75 9.983 -10.237 -5.942 1.00 43.44 H new ATOM 0 HA LYS A 75 10.620 -12.708 -7.111 1.00 4.13 H new ATOM 0 HB2 LYS A 75 11.150 -11.607 -4.313 1.00 40.43 H new ATOM 0 HB3 LYS A 75 11.833 -13.114 -4.890 1.00 40.43 H new ATOM 0 HG2 LYS A 75 12.344 -10.367 -6.113 1.00 65.41 H new ATOM 0 HG3 LYS A 75 13.441 -11.226 -5.050 1.00 65.41 H new ATOM 0 HD2 LYS A 75 13.543 -13.107 -6.752 1.00 70.51 H new ATOM 0 HD3 LYS A 75 12.543 -12.148 -7.825 1.00 70.51 H new ATOM 0 HE2 LYS A 75 14.301 -10.353 -7.828 1.00 74.53 H new ATOM 0 HE3 LYS A 75 15.305 -11.352 -6.797 1.00 74.53 H new ATOM 0 HZ1 LYS A 75 15.937 -11.566 -9.110 1.00 55.33 H new ATOM 0 HZ2 LYS A 75 15.348 -13.050 -8.531 1.00 55.33 H new ATOM 0 HZ3 LYS A 75 14.375 -12.081 -9.530 1.00 55.33 H new ATOM 1249 N GLU A 76 8.505 -12.798 -4.555 1.00 63.44 N ATOM 1250 CA GLU A 76 7.505 -13.563 -3.806 1.00 53.50 C ATOM 1251 C GLU A 76 6.231 -13.823 -4.631 1.00 54.04 C ATOM 1252 O GLU A 76 5.379 -14.611 -4.216 1.00 42.50 O ATOM 1253 CB GLU A 76 7.172 -12.822 -2.480 1.00 22.12 C ATOM 1254 CG GLU A 76 8.343 -12.751 -1.476 1.00 34.20 C ATOM 1255 CD GLU A 76 8.956 -14.129 -1.163 1.00 10.43 C ATOM 1256 OE1 GLU A 76 8.190 -15.107 -0.995 1.00 45.42 O ATOM 1257 OE2 GLU A 76 10.198 -14.252 -1.112 1.00 74.04 O ATOM 0 H GLU A 76 8.560 -11.819 -4.273 1.00 63.44 H new ATOM 0 HA GLU A 76 7.928 -14.541 -3.577 1.00 53.50 H new ATOM 0 HB2 GLU A 76 6.850 -11.808 -2.716 1.00 22.12 H new ATOM 0 HB3 GLU A 76 6.329 -13.321 -2.001 1.00 22.12 H new ATOM 0 HG2 GLU A 76 9.118 -12.098 -1.877 1.00 34.20 H new ATOM 0 HG3 GLU A 76 7.992 -12.297 -0.549 1.00 34.20 H new ATOM 1264 N GLY A 77 6.099 -13.134 -5.785 1.00 30.31 N ATOM 1265 CA GLY A 77 4.966 -13.316 -6.704 1.00 63.12 C ATOM 1266 C GLY A 77 3.658 -12.711 -6.202 1.00 12.51 C ATOM 1267 O GLY A 77 2.594 -12.946 -6.792 1.00 63.34 O ATOM 0 H GLY A 77 6.775 -12.439 -6.101 1.00 30.31 H new ATOM 0 HA2 GLY A 77 5.216 -12.869 -7.666 1.00 63.12 H new ATOM 0 HA3 GLY A 77 4.819 -14.382 -6.877 1.00 63.12 H new ATOM 1271 N LEU A 78 3.740 -11.936 -5.107 1.00 41.41 N ATOM 1272 CA LEU A 78 2.576 -11.286 -4.479 1.00 0.14 C ATOM 1273 C LEU A 78 2.117 -10.104 -5.346 1.00 10.34 C ATOM 1274 O LEU A 78 2.965 -9.360 -5.869 1.00 51.12 O ATOM 1275 CB LEU A 78 2.937 -10.767 -3.049 1.00 73.14 C ATOM 1276 CG LEU A 78 3.757 -11.730 -2.131 1.00 33.34 C ATOM 1277 CD1 LEU A 78 3.947 -11.133 -0.724 1.00 14.25 C ATOM 1278 CD2 LEU A 78 3.145 -13.139 -2.056 1.00 62.41 C ATOM 0 H LEU A 78 4.620 -11.742 -4.630 1.00 41.41 H new ATOM 0 HA LEU A 78 1.774 -12.019 -4.395 1.00 0.14 H new ATOM 0 HB2 LEU A 78 3.501 -9.840 -3.157 1.00 73.14 H new ATOM 0 HB3 LEU A 78 2.009 -10.517 -2.535 1.00 73.14 H new ATOM 0 HG LEU A 78 4.739 -11.838 -2.592 1.00 33.34 H new ATOM 0 HD11 LEU A 78 4.521 -11.826 -0.109 1.00 14.25 H new ATOM 0 HD12 LEU A 78 4.482 -10.186 -0.800 1.00 14.25 H new ATOM 0 HD13 LEU A 78 2.972 -10.963 -0.266 1.00 14.25 H new ATOM 0 HD21 LEU A 78 3.754 -13.766 -1.405 1.00 62.41 H new ATOM 0 HD22 LEU A 78 2.133 -13.075 -1.655 1.00 62.41 H new ATOM 0 HD23 LEU A 78 3.113 -13.575 -3.054 1.00 62.41 H new ATOM 1290 N ARG A 79 0.786 -9.936 -5.513 1.00 10.13 N ATOM 1291 CA ARG A 79 0.230 -8.738 -6.155 1.00 70.32 C ATOM 1292 C ARG A 79 0.410 -7.552 -5.191 1.00 54.31 C ATOM 1293 O ARG A 79 0.216 -7.686 -3.973 1.00 22.01 O ATOM 1294 CB ARG A 79 -1.271 -8.921 -6.591 1.00 72.34 C ATOM 1295 CG ARG A 79 -2.366 -8.304 -5.665 1.00 22.14 C ATOM 1296 CD ARG A 79 -3.762 -8.342 -6.311 1.00 1.43 C ATOM 1297 NE ARG A 79 -4.787 -7.596 -5.544 1.00 33.11 N ATOM 1298 CZ ARG A 79 -5.538 -6.588 -6.045 1.00 62.52 C ATOM 1299 NH1 ARG A 79 -5.389 -6.181 -7.304 1.00 10.44 N ATOM 1300 NH2 ARG A 79 -6.454 -6.004 -5.284 1.00 54.52 N ATOM 0 H ARG A 79 0.086 -10.614 -5.212 1.00 10.13 H new ATOM 0 HA ARG A 79 0.770 -8.548 -7.082 1.00 70.32 H new ATOM 0 HB2 ARG A 79 -1.388 -8.490 -7.585 1.00 72.34 H new ATOM 0 HB3 ARG A 79 -1.468 -9.989 -6.681 1.00 72.34 H new ATOM 0 HG2 ARG A 79 -2.390 -8.848 -4.721 1.00 22.14 H new ATOM 0 HG3 ARG A 79 -2.103 -7.272 -5.432 1.00 22.14 H new ATOM 0 HD2 ARG A 79 -3.700 -7.928 -7.317 1.00 1.43 H new ATOM 0 HD3 ARG A 79 -4.079 -9.380 -6.412 1.00 1.43 H new ATOM 0 HE ARG A 79 -4.937 -7.861 -4.570 1.00 33.11 H new ATOM 0 HH11 ARG A 79 -4.700 -6.631 -7.907 1.00 10.44 H new ATOM 0 HH12 ARG A 79 -5.964 -5.420 -7.665 1.00 10.44 H new ATOM 0 HH21 ARG A 79 -6.592 -6.315 -4.322 1.00 54.52 H new ATOM 0 HH22 ARG A 79 -7.021 -5.244 -5.660 1.00 54.52 H new ATOM 1314 N VAL A 80 0.829 -6.422 -5.743 1.00 73.32 N ATOM 1315 CA VAL A 80 1.079 -5.196 -4.995 1.00 31.11 C ATOM 1316 C VAL A 80 0.157 -4.124 -5.554 1.00 53.24 C ATOM 1317 O VAL A 80 0.034 -3.960 -6.779 1.00 70.54 O ATOM 1318 CB VAL A 80 2.589 -4.767 -5.076 1.00 72.01 C ATOM 1319 CG1 VAL A 80 2.847 -3.400 -4.401 1.00 42.31 C ATOM 1320 CG2 VAL A 80 3.476 -5.859 -4.445 1.00 15.24 C ATOM 0 H VAL A 80 1.008 -6.329 -6.743 1.00 73.32 H new ATOM 0 HA VAL A 80 0.871 -5.352 -3.936 1.00 31.11 H new ATOM 0 HB VAL A 80 2.846 -4.653 -6.129 1.00 72.01 H new ATOM 0 HG11 VAL A 80 3.904 -3.147 -4.483 1.00 42.31 H new ATOM 0 HG12 VAL A 80 2.251 -2.632 -4.895 1.00 42.31 H new ATOM 0 HG13 VAL A 80 2.568 -3.455 -3.349 1.00 42.31 H new ATOM 0 HG21 VAL A 80 4.522 -5.557 -4.504 1.00 15.24 H new ATOM 0 HG22 VAL A 80 3.196 -5.997 -3.401 1.00 15.24 H new ATOM 0 HG23 VAL A 80 3.338 -6.796 -4.984 1.00 15.24 H new ATOM 1330 N LEU A 81 -0.486 -3.418 -4.642 1.00 40.51 N ATOM 1331 CA LEU A 81 -1.562 -2.506 -4.937 1.00 12.43 C ATOM 1332 C LEU A 81 -1.320 -1.240 -4.131 1.00 4.33 C ATOM 1333 O LEU A 81 -1.484 -1.242 -2.919 1.00 12.25 O ATOM 1334 CB LEU A 81 -2.896 -3.193 -4.539 1.00 41.02 C ATOM 1335 CG LEU A 81 -4.205 -2.389 -4.774 1.00 2.41 C ATOM 1336 CD1 LEU A 81 -4.396 -2.076 -6.246 1.00 52.55 C ATOM 1337 CD2 LEU A 81 -5.419 -3.144 -4.218 1.00 1.30 C ATOM 0 H LEU A 81 -0.263 -3.469 -3.648 1.00 40.51 H new ATOM 0 HA LEU A 81 -1.612 -2.247 -5.995 1.00 12.43 H new ATOM 0 HB2 LEU A 81 -2.971 -4.130 -5.090 1.00 41.02 H new ATOM 0 HB3 LEU A 81 -2.842 -3.449 -3.481 1.00 41.02 H new ATOM 0 HG LEU A 81 -4.117 -1.445 -4.237 1.00 2.41 H new ATOM 0 HD11 LEU A 81 -5.319 -1.513 -6.381 1.00 52.55 H new ATOM 0 HD12 LEU A 81 -3.554 -1.484 -6.604 1.00 52.55 H new ATOM 0 HD13 LEU A 81 -4.452 -3.006 -6.811 1.00 52.55 H new ATOM 0 HD21 LEU A 81 -6.323 -2.561 -4.395 1.00 1.30 H new ATOM 0 HD22 LEU A 81 -5.507 -4.109 -4.717 1.00 1.30 H new ATOM 0 HD23 LEU A 81 -5.291 -3.299 -3.147 1.00 1.30 H new ATOM 1349 N VAL A 82 -0.901 -0.167 -4.796 1.00 43.22 N ATOM 1350 CA VAL A 82 -0.646 1.106 -4.122 1.00 61.44 C ATOM 1351 C VAL A 82 -1.881 1.989 -4.302 1.00 3.53 C ATOM 1352 O VAL A 82 -2.183 2.413 -5.406 1.00 73.11 O ATOM 1353 CB VAL A 82 0.649 1.809 -4.687 1.00 4.54 C ATOM 1354 CG1 VAL A 82 0.927 3.147 -3.966 1.00 25.35 C ATOM 1355 CG2 VAL A 82 1.876 0.865 -4.608 1.00 33.43 C ATOM 0 H VAL A 82 -0.730 -0.152 -5.802 1.00 43.22 H new ATOM 0 HA VAL A 82 -0.463 0.933 -3.061 1.00 61.44 H new ATOM 0 HB VAL A 82 0.468 2.035 -5.738 1.00 4.54 H new ATOM 0 HG11 VAL A 82 1.826 3.604 -4.380 1.00 25.35 H new ATOM 0 HG12 VAL A 82 0.080 3.819 -4.107 1.00 25.35 H new ATOM 0 HG13 VAL A 82 1.071 2.963 -2.901 1.00 25.35 H new ATOM 0 HG21 VAL A 82 2.754 1.375 -5.004 1.00 33.43 H new ATOM 0 HG22 VAL A 82 2.055 0.588 -3.569 1.00 33.43 H new ATOM 0 HG23 VAL A 82 1.683 -0.033 -5.195 1.00 33.43 H new ATOM 1365 N ILE A 83 -2.597 2.239 -3.209 1.00 1.25 N ATOM 1366 CA ILE A 83 -3.790 3.088 -3.201 1.00 21.23 C ATOM 1367 C ILE A 83 -3.378 4.465 -2.685 1.00 11.35 C ATOM 1368 O ILE A 83 -3.065 4.628 -1.500 1.00 41.44 O ATOM 1369 CB ILE A 83 -4.909 2.451 -2.299 1.00 44.23 C ATOM 1370 CG1 ILE A 83 -5.340 1.082 -2.905 1.00 71.35 C ATOM 1371 CG2 ILE A 83 -6.127 3.396 -2.124 1.00 40.44 C ATOM 1372 CD1 ILE A 83 -6.342 0.311 -2.080 1.00 14.04 C ATOM 0 H ILE A 83 -2.365 1.855 -2.293 1.00 1.25 H new ATOM 0 HA ILE A 83 -4.203 3.180 -4.205 1.00 21.23 H new ATOM 0 HB ILE A 83 -4.498 2.292 -1.302 1.00 44.23 H new ATOM 0 HG12 ILE A 83 -5.762 1.256 -3.895 1.00 71.35 H new ATOM 0 HG13 ILE A 83 -4.452 0.465 -3.041 1.00 71.35 H new ATOM 0 HG21 ILE A 83 -6.874 2.914 -1.494 1.00 40.44 H new ATOM 0 HG22 ILE A 83 -5.802 4.325 -1.656 1.00 40.44 H new ATOM 0 HG23 ILE A 83 -6.561 3.614 -3.100 1.00 40.44 H new ATOM 0 HD11 ILE A 83 -6.581 -0.627 -2.581 1.00 14.04 H new ATOM 0 HD12 ILE A 83 -5.919 0.100 -1.098 1.00 14.04 H new ATOM 0 HD13 ILE A 83 -7.250 0.903 -1.964 1.00 14.04 H new ATOM 1384 N LYS A 84 -3.356 5.450 -3.589 1.00 1.25 N ATOM 1385 CA LYS A 84 -2.798 6.776 -3.308 1.00 31.03 C ATOM 1386 C LYS A 84 -3.676 7.902 -3.862 1.00 43.03 C ATOM 1387 O LYS A 84 -4.284 7.775 -4.933 1.00 64.13 O ATOM 1388 CB LYS A 84 -1.315 6.851 -3.768 1.00 44.41 C ATOM 1389 CG LYS A 84 -0.985 6.474 -5.224 1.00 52.30 C ATOM 1390 CD LYS A 84 -1.176 7.639 -6.218 1.00 11.33 C ATOM 1391 CE LYS A 84 -0.300 7.476 -7.460 1.00 2.44 C ATOM 1392 NZ LYS A 84 1.153 7.476 -7.124 1.00 22.22 N ATOM 0 H LYS A 84 -3.724 5.350 -4.535 1.00 1.25 H new ATOM 0 HA LYS A 84 -2.798 6.930 -2.229 1.00 31.03 H new ATOM 0 HB2 LYS A 84 -0.966 7.870 -3.600 1.00 44.41 H new ATOM 0 HB3 LYS A 84 -0.731 6.202 -3.115 1.00 44.41 H new ATOM 0 HG2 LYS A 84 0.047 6.127 -5.277 1.00 52.30 H new ATOM 0 HG3 LYS A 84 -1.618 5.640 -5.528 1.00 52.30 H new ATOM 0 HD2 LYS A 84 -2.223 7.694 -6.516 1.00 11.33 H new ATOM 0 HD3 LYS A 84 -0.935 8.581 -5.725 1.00 11.33 H new ATOM 0 HE2 LYS A 84 -0.555 6.544 -7.964 1.00 2.44 H new ATOM 0 HE3 LYS A 84 -0.510 8.285 -8.160 1.00 2.44 H new ATOM 0 HZ1 LYS A 84 1.702 7.769 -7.957 1.00 22.22 H new ATOM 0 HZ2 LYS A 84 1.329 8.140 -6.343 1.00 22.22 H new ATOM 0 HZ3 LYS A 84 1.443 6.519 -6.837 1.00 22.22 H new ATOM 1406 N VAL A 85 -3.756 8.991 -3.088 1.00 72.10 N ATOM 1407 CA VAL A 85 -4.549 10.177 -3.423 1.00 3.04 C ATOM 1408 C VAL A 85 -3.714 11.087 -4.360 1.00 32.35 C ATOM 1409 O VAL A 85 -2.583 11.459 -4.020 1.00 51.33 O ATOM 1410 CB VAL A 85 -4.957 10.921 -2.092 1.00 23.42 C ATOM 1411 CG1 VAL A 85 -5.761 12.204 -2.362 1.00 64.31 C ATOM 1412 CG2 VAL A 85 -5.732 9.968 -1.145 1.00 74.33 C ATOM 0 H VAL A 85 -3.264 9.073 -2.198 1.00 72.10 H new ATOM 0 HA VAL A 85 -5.465 9.899 -3.944 1.00 3.04 H new ATOM 0 HB VAL A 85 -4.034 11.225 -1.599 1.00 23.42 H new ATOM 0 HG11 VAL A 85 -6.018 12.679 -1.415 1.00 64.31 H new ATOM 0 HG12 VAL A 85 -5.162 12.890 -2.961 1.00 64.31 H new ATOM 0 HG13 VAL A 85 -6.674 11.954 -2.902 1.00 64.31 H new ATOM 0 HG21 VAL A 85 -6.003 10.502 -0.234 1.00 74.33 H new ATOM 0 HG22 VAL A 85 -6.636 9.617 -1.642 1.00 74.33 H new ATOM 0 HG23 VAL A 85 -5.102 9.115 -0.892 1.00 74.33 H new ATOM 1422 N ALA A 86 -4.283 11.408 -5.546 1.00 61.30 N ATOM 1423 CA ALA A 86 -3.561 12.090 -6.641 1.00 74.14 C ATOM 1424 C ALA A 86 -3.293 13.574 -6.326 1.00 11.43 C ATOM 1425 O ALA A 86 -2.142 13.949 -6.071 1.00 73.14 O ATOM 1426 CB ALA A 86 -4.342 11.931 -7.954 1.00 70.34 C ATOM 0 H ALA A 86 -5.257 11.200 -5.769 1.00 61.30 H new ATOM 0 HA ALA A 86 -2.585 11.617 -6.748 1.00 74.14 H new ATOM 0 HB1 ALA A 86 -3.807 12.435 -8.759 1.00 70.34 H new ATOM 0 HB2 ALA A 86 -4.442 10.872 -8.192 1.00 70.34 H new ATOM 0 HB3 ALA A 86 -5.332 12.373 -7.844 1.00 70.34 H new ATOM 1432 N GLN A 87 -4.379 14.387 -6.341 1.00 70.23 N ATOM 1433 CA GLN A 87 -4.362 15.854 -6.092 1.00 54.10 C ATOM 1434 C GLN A 87 -3.526 16.602 -7.151 1.00 75.14 C ATOM 1435 O GLN A 87 -4.079 17.249 -8.051 1.00 14.34 O ATOM 1436 CB GLN A 87 -3.883 16.184 -4.641 1.00 15.22 C ATOM 1437 CG GLN A 87 -4.785 15.590 -3.551 1.00 25.51 C ATOM 1438 CD GLN A 87 -6.203 16.151 -3.587 1.00 60.31 C ATOM 1439 OE1 GLN A 87 -6.422 17.330 -3.855 1.00 21.44 O ATOM 1440 NE2 GLN A 87 -7.181 15.303 -3.386 1.00 4.22 N ATOM 0 H GLN A 87 -5.316 14.033 -6.531 1.00 70.23 H new ATOM 0 HA GLN A 87 -5.388 16.209 -6.183 1.00 54.10 H new ATOM 0 HB2 GLN A 87 -2.869 15.808 -4.507 1.00 15.22 H new ATOM 0 HB3 GLN A 87 -3.841 17.266 -4.518 1.00 15.22 H new ATOM 0 HG2 GLN A 87 -4.824 14.507 -3.669 1.00 25.51 H new ATOM 0 HG3 GLN A 87 -4.345 15.789 -2.574 1.00 25.51 H new ATOM 0 HE21 GLN A 87 -6.974 14.329 -3.165 1.00 4.22 H new ATOM 0 HE22 GLN A 87 -8.149 15.617 -3.451 1.00 4.22 H new ATOM 1449 N ASP A 88 -2.195 16.500 -7.018 1.00 62.32 N ATOM 1450 CA ASP A 88 -1.221 17.015 -7.992 1.00 73.14 C ATOM 1451 C ASP A 88 -1.437 16.365 -9.378 1.00 10.14 C ATOM 1452 O ASP A 88 -1.515 17.068 -10.391 1.00 12.05 O ATOM 1453 CB ASP A 88 0.210 16.728 -7.452 1.00 32.01 C ATOM 1454 CG ASP A 88 1.325 16.954 -8.487 1.00 44.14 C ATOM 1455 OD1 ASP A 88 1.653 16.005 -9.212 1.00 2.23 O ATOM 1456 OD2 ASP A 88 1.867 18.075 -8.581 1.00 75.33 O ATOM 0 H ASP A 88 -1.757 16.049 -6.215 1.00 62.32 H new ATOM 0 HA ASP A 88 -1.353 18.089 -8.119 1.00 73.14 H new ATOM 0 HB2 ASP A 88 0.396 17.365 -6.588 1.00 32.01 H new ATOM 0 HB3 ASP A 88 0.256 15.696 -7.103 1.00 32.01 H new ATOM 1461 N GLN A 89 -1.523 15.011 -9.372 1.00 43.44 N ATOM 1462 CA GLN A 89 -1.718 14.152 -10.568 1.00 41.44 C ATOM 1463 C GLN A 89 -0.433 14.045 -11.426 1.00 63.13 C ATOM 1464 O GLN A 89 0.185 12.991 -11.467 1.00 72.53 O ATOM 1465 CB GLN A 89 -2.931 14.581 -11.461 1.00 4.52 C ATOM 1466 CG GLN A 89 -4.301 14.557 -10.760 1.00 72.32 C ATOM 1467 CD GLN A 89 -5.431 15.047 -11.667 1.00 4.52 C ATOM 1468 OE1 GLN A 89 -6.089 14.264 -12.354 1.00 63.31 O ATOM 1469 NE2 GLN A 89 -5.630 16.354 -11.716 1.00 60.42 N ATOM 0 H GLN A 89 -1.457 14.471 -8.510 1.00 43.44 H new ATOM 0 HA GLN A 89 -1.953 13.166 -10.166 1.00 41.44 H new ATOM 0 HB2 GLN A 89 -2.749 15.589 -11.834 1.00 4.52 H new ATOM 0 HB3 GLN A 89 -2.973 13.923 -12.329 1.00 4.52 H new ATOM 0 HG2 GLN A 89 -4.519 13.541 -10.430 1.00 72.32 H new ATOM 0 HG3 GLN A 89 -4.260 15.181 -9.867 1.00 72.32 H new ATOM 0 HE21 GLN A 89 -5.069 16.977 -11.135 1.00 60.42 H new ATOM 0 HE22 GLN A 89 -6.344 16.738 -12.335 1.00 60.42 H new ATOM 1478 N GLU A 90 -0.025 15.164 -12.050 1.00 42.23 N ATOM 1479 CA GLU A 90 0.935 15.181 -13.179 1.00 50.04 C ATOM 1480 C GLU A 90 2.390 14.832 -12.774 1.00 51.32 C ATOM 1481 O GLU A 90 3.038 14.024 -13.443 1.00 3.14 O ATOM 1482 CB GLU A 90 0.853 16.565 -13.879 1.00 42.30 C ATOM 1483 CG GLU A 90 -0.534 16.875 -14.494 1.00 11.02 C ATOM 1484 CD GLU A 90 -0.618 18.267 -15.151 1.00 23.35 C ATOM 1485 OE1 GLU A 90 0.043 18.482 -16.187 1.00 15.33 O ATOM 1486 OE2 GLU A 90 -1.327 19.159 -14.627 1.00 31.44 O ATOM 0 H GLU A 90 -0.353 16.093 -11.786 1.00 42.23 H new ATOM 0 HA GLU A 90 0.647 14.390 -13.871 1.00 50.04 H new ATOM 0 HB2 GLU A 90 1.101 17.342 -13.156 1.00 42.30 H new ATOM 0 HB3 GLU A 90 1.606 16.609 -14.665 1.00 42.30 H new ATOM 0 HG2 GLU A 90 -0.770 16.115 -15.239 1.00 11.02 H new ATOM 0 HG3 GLU A 90 -1.292 16.804 -13.714 1.00 11.02 H new ATOM 1493 N LEU A 91 2.905 15.446 -11.698 1.00 71.24 N ATOM 1494 CA LEU A 91 4.271 15.160 -11.178 1.00 52.52 C ATOM 1495 C LEU A 91 4.270 13.823 -10.399 1.00 44.50 C ATOM 1496 O LEU A 91 5.274 13.113 -10.350 1.00 2.43 O ATOM 1497 CB LEU A 91 4.796 16.323 -10.277 1.00 55.31 C ATOM 1498 CG LEU A 91 5.101 17.700 -10.977 1.00 11.00 C ATOM 1499 CD1 LEU A 91 3.836 18.376 -11.549 1.00 70.24 C ATOM 1500 CD2 LEU A 91 5.838 18.645 -10.006 1.00 75.24 C ATOM 0 H LEU A 91 2.400 16.150 -11.161 1.00 71.24 H new ATOM 0 HA LEU A 91 4.948 15.076 -12.028 1.00 52.52 H new ATOM 0 HB2 LEU A 91 4.060 16.500 -9.492 1.00 55.31 H new ATOM 0 HB3 LEU A 91 5.709 15.984 -9.788 1.00 55.31 H new ATOM 0 HG LEU A 91 5.748 17.487 -11.828 1.00 11.00 H new ATOM 0 HD11 LEU A 91 4.109 19.321 -12.019 1.00 70.24 H new ATOM 0 HD12 LEU A 91 3.377 17.721 -12.290 1.00 70.24 H new ATOM 0 HD13 LEU A 91 3.127 18.564 -10.742 1.00 70.24 H new ATOM 0 HD21 LEU A 91 6.042 19.593 -10.505 1.00 75.24 H new ATOM 0 HD22 LEU A 91 5.216 18.823 -9.129 1.00 75.24 H new ATOM 0 HD23 LEU A 91 6.778 18.188 -9.697 1.00 75.24 H new ATOM 1512 N LEU A 92 3.113 13.513 -9.803 1.00 51.24 N ATOM 1513 CA LEU A 92 2.836 12.246 -9.107 1.00 11.53 C ATOM 1514 C LEU A 92 2.733 11.073 -10.116 1.00 30.22 C ATOM 1515 O LEU A 92 2.978 9.907 -9.765 1.00 35.44 O ATOM 1516 CB LEU A 92 1.537 12.455 -8.254 1.00 54.15 C ATOM 1517 CG LEU A 92 0.742 11.181 -7.759 1.00 35.22 C ATOM 1518 CD1 LEU A 92 0.228 11.355 -6.307 1.00 20.04 C ATOM 1519 CD2 LEU A 92 -0.445 10.861 -8.714 1.00 12.00 C ATOM 0 H LEU A 92 2.319 14.153 -9.790 1.00 51.24 H new ATOM 0 HA LEU A 92 3.652 11.972 -8.438 1.00 11.53 H new ATOM 0 HB2 LEU A 92 1.809 13.037 -7.374 1.00 54.15 H new ATOM 0 HB3 LEU A 92 0.851 13.066 -8.841 1.00 54.15 H new ATOM 0 HG LEU A 92 1.438 10.342 -7.771 1.00 35.22 H new ATOM 0 HD11 LEU A 92 -0.313 10.459 -6.003 1.00 20.04 H new ATOM 0 HD12 LEU A 92 1.074 11.513 -5.638 1.00 20.04 H new ATOM 0 HD13 LEU A 92 -0.439 12.216 -6.258 1.00 20.04 H new ATOM 0 HD21 LEU A 92 -0.976 9.981 -8.352 1.00 12.00 H new ATOM 0 HD22 LEU A 92 -1.128 11.710 -8.743 1.00 12.00 H new ATOM 0 HD23 LEU A 92 -0.063 10.668 -9.717 1.00 12.00 H new ATOM 1531 N GLU A 93 2.397 11.419 -11.375 1.00 51.31 N ATOM 1532 CA GLU A 93 2.263 10.477 -12.501 1.00 42.32 C ATOM 1533 C GLU A 93 3.634 9.931 -12.943 1.00 33.15 C ATOM 1534 O GLU A 93 3.700 8.875 -13.562 1.00 54.31 O ATOM 1535 CB GLU A 93 1.496 11.159 -13.664 1.00 2.53 C ATOM 1536 CG GLU A 93 1.200 10.269 -14.884 1.00 64.44 C ATOM 1537 CD GLU A 93 0.295 10.954 -15.922 1.00 63.20 C ATOM 1538 OE1 GLU A 93 0.795 11.773 -16.715 1.00 74.15 O ATOM 1539 OE2 GLU A 93 -0.928 10.683 -15.935 1.00 12.25 O ATOM 0 H GLU A 93 2.207 12.385 -11.642 1.00 51.31 H new ATOM 0 HA GLU A 93 1.683 9.613 -12.176 1.00 42.32 H new ATOM 0 HB2 GLU A 93 0.550 11.539 -13.277 1.00 2.53 H new ATOM 0 HB3 GLU A 93 2.073 12.021 -13.998 1.00 2.53 H new ATOM 0 HG2 GLU A 93 2.140 9.988 -15.359 1.00 64.44 H new ATOM 0 HG3 GLU A 93 0.725 9.347 -14.548 1.00 64.44 H new ATOM 1546 N ARG A 94 4.718 10.665 -12.627 1.00 34.30 N ATOM 1547 CA ARG A 94 6.103 10.199 -12.856 1.00 20.23 C ATOM 1548 C ARG A 94 6.334 8.807 -12.208 1.00 43.14 C ATOM 1549 O ARG A 94 6.811 7.877 -12.873 1.00 53.13 O ATOM 1550 CB ARG A 94 7.111 11.249 -12.300 1.00 23.10 C ATOM 1551 CG ARG A 94 8.602 10.834 -12.357 1.00 43.23 C ATOM 1552 CD ARG A 94 9.148 10.686 -13.784 1.00 44.44 C ATOM 1553 NE ARG A 94 9.190 11.972 -14.495 1.00 12.20 N ATOM 1554 CZ ARG A 94 9.634 12.160 -15.747 1.00 11.45 C ATOM 1555 NH1 ARG A 94 10.085 11.140 -16.474 1.00 4.23 N ATOM 1556 NH2 ARG A 94 9.618 13.380 -16.269 1.00 24.23 N ATOM 0 H ARG A 94 4.661 11.593 -12.208 1.00 34.30 H new ATOM 0 HA ARG A 94 6.265 10.092 -13.929 1.00 20.23 H new ATOM 0 HB2 ARG A 94 6.988 12.177 -12.859 1.00 23.10 H new ATOM 0 HB3 ARG A 94 6.851 11.464 -11.264 1.00 23.10 H new ATOM 0 HG2 ARG A 94 9.197 11.576 -11.825 1.00 43.23 H new ATOM 0 HG3 ARG A 94 8.727 9.888 -11.830 1.00 43.23 H new ATOM 0 HD2 ARG A 94 10.151 10.260 -13.746 1.00 44.44 H new ATOM 0 HD3 ARG A 94 8.525 9.985 -14.339 1.00 44.44 H new ATOM 0 HE ARG A 94 8.852 12.793 -13.993 1.00 12.20 H new ATOM 0 HH11 ARG A 94 10.096 10.199 -16.081 1.00 4.23 H new ATOM 0 HH12 ARG A 94 10.419 11.300 -17.424 1.00 4.23 H new ATOM 0 HH21 ARG A 94 9.270 14.165 -15.719 1.00 24.23 H new ATOM 0 HH22 ARG A 94 9.954 13.532 -17.220 1.00 24.23 H new ATOM 1570 N PHE A 95 5.984 8.674 -10.911 1.00 30.55 N ATOM 1571 CA PHE A 95 6.097 7.389 -10.192 1.00 3.32 C ATOM 1572 C PHE A 95 4.920 6.456 -10.530 1.00 34.31 C ATOM 1573 O PHE A 95 5.117 5.255 -10.707 1.00 64.31 O ATOM 1574 CB PHE A 95 6.198 7.600 -8.658 1.00 10.22 C ATOM 1575 CG PHE A 95 6.565 6.325 -7.897 1.00 61.32 C ATOM 1576 CD1 PHE A 95 7.861 5.812 -7.973 1.00 13.10 C ATOM 1577 CD2 PHE A 95 5.627 5.626 -7.136 1.00 62.44 C ATOM 1578 CE1 PHE A 95 8.203 4.649 -7.317 1.00 25.23 C ATOM 1579 CE2 PHE A 95 5.972 4.456 -6.483 1.00 73.22 C ATOM 1580 CZ PHE A 95 7.263 3.970 -6.570 1.00 30.04 C ATOM 0 H PHE A 95 5.622 9.439 -10.342 1.00 30.55 H new ATOM 0 HA PHE A 95 7.019 6.914 -10.527 1.00 3.32 H new ATOM 0 HB2 PHE A 95 6.945 8.366 -8.452 1.00 10.22 H new ATOM 0 HB3 PHE A 95 5.245 7.976 -8.286 1.00 10.22 H new ATOM 0 HD1 PHE A 95 8.607 6.334 -8.554 1.00 13.10 H new ATOM 0 HD2 PHE A 95 4.618 6.003 -7.056 1.00 62.44 H new ATOM 0 HE1 PHE A 95 9.211 4.268 -7.388 1.00 25.23 H new ATOM 0 HE2 PHE A 95 5.232 3.922 -5.905 1.00 73.22 H new ATOM 0 HZ PHE A 95 7.535 3.061 -6.054 1.00 30.04 H new ATOM 1590 N TYR A 96 3.702 7.031 -10.606 1.00 53.22 N ATOM 1591 CA TYR A 96 2.457 6.278 -10.875 1.00 5.14 C ATOM 1592 C TYR A 96 2.575 5.440 -12.173 1.00 22.22 C ATOM 1593 O TYR A 96 2.307 4.236 -12.169 1.00 62.14 O ATOM 1594 CB TYR A 96 1.259 7.270 -10.945 1.00 1.21 C ATOM 1595 CG TYR A 96 -0.083 6.680 -11.414 1.00 72.43 C ATOM 1596 CD1 TYR A 96 -0.858 5.879 -10.578 1.00 43.11 C ATOM 1597 CD2 TYR A 96 -0.585 6.942 -12.693 1.00 72.32 C ATOM 1598 CE1 TYR A 96 -2.067 5.357 -10.990 1.00 73.45 C ATOM 1599 CE2 TYR A 96 -1.794 6.419 -13.109 1.00 31.00 C ATOM 1600 CZ TYR A 96 -2.534 5.628 -12.252 1.00 33.13 C ATOM 1601 OH TYR A 96 -3.749 5.107 -12.662 1.00 35.32 O ATOM 0 H TYR A 96 3.553 8.032 -10.482 1.00 53.22 H new ATOM 0 HA TYR A 96 2.285 5.575 -10.060 1.00 5.14 H new ATOM 0 HB2 TYR A 96 1.115 7.705 -9.956 1.00 1.21 H new ATOM 0 HB3 TYR A 96 1.528 8.086 -11.616 1.00 1.21 H new ATOM 0 HD1 TYR A 96 -0.503 5.661 -9.582 1.00 43.11 H new ATOM 0 HD2 TYR A 96 -0.017 7.565 -13.368 1.00 72.32 H new ATOM 0 HE1 TYR A 96 -2.645 4.736 -10.321 1.00 73.45 H new ATOM 0 HE2 TYR A 96 -2.160 6.628 -14.103 1.00 31.00 H new ATOM 0 HH TYR A 96 -3.935 5.394 -13.580 1.00 35.32 H new ATOM 1611 N GLU A 97 3.047 6.080 -13.253 1.00 51.20 N ATOM 1612 CA GLU A 97 3.151 5.460 -14.585 1.00 32.42 C ATOM 1613 C GLU A 97 4.209 4.341 -14.605 1.00 23.31 C ATOM 1614 O GLU A 97 4.057 3.376 -15.350 1.00 40.45 O ATOM 1615 CB GLU A 97 3.479 6.539 -15.646 1.00 62.33 C ATOM 1616 CG GLU A 97 3.439 6.034 -17.104 1.00 62.34 C ATOM 1617 CD GLU A 97 3.829 7.102 -18.135 1.00 22.50 C ATOM 1618 OE1 GLU A 97 2.995 7.977 -18.450 1.00 55.51 O ATOM 1619 OE2 GLU A 97 4.970 7.060 -18.655 1.00 13.31 O ATOM 0 H GLU A 97 3.369 7.047 -13.228 1.00 51.20 H new ATOM 0 HA GLU A 97 2.189 5.006 -14.824 1.00 32.42 H new ATOM 0 HB2 GLU A 97 2.772 7.362 -15.540 1.00 62.33 H new ATOM 0 HB3 GLU A 97 4.471 6.942 -15.441 1.00 62.33 H new ATOM 0 HG2 GLU A 97 4.112 5.182 -17.203 1.00 62.34 H new ATOM 0 HG3 GLU A 97 2.435 5.675 -17.328 1.00 62.34 H new ATOM 1626 N GLN A 98 5.247 4.470 -13.744 1.00 42.43 N ATOM 1627 CA GLN A 98 6.352 3.488 -13.632 1.00 50.52 C ATOM 1628 C GLN A 98 5.776 2.090 -13.306 1.00 14.43 C ATOM 1629 O GLN A 98 6.102 1.098 -13.960 1.00 44.51 O ATOM 1630 CB GLN A 98 7.370 3.956 -12.528 1.00 53.13 C ATOM 1631 CG GLN A 98 8.826 3.427 -12.645 1.00 40.23 C ATOM 1632 CD GLN A 98 8.983 1.903 -12.559 1.00 51.14 C ATOM 1633 OE1 GLN A 98 9.130 1.340 -11.475 1.00 54.00 O ATOM 1634 NE2 GLN A 98 8.931 1.222 -13.697 1.00 65.22 N ATOM 0 H GLN A 98 5.341 5.260 -13.106 1.00 42.43 H new ATOM 0 HA GLN A 98 6.885 3.424 -14.581 1.00 50.52 H new ATOM 0 HB2 GLN A 98 7.403 5.045 -12.537 1.00 53.13 H new ATOM 0 HB3 GLN A 98 6.978 3.657 -11.556 1.00 53.13 H new ATOM 0 HG2 GLN A 98 9.242 3.765 -13.594 1.00 40.23 H new ATOM 0 HG3 GLN A 98 9.424 3.882 -11.855 1.00 40.23 H new ATOM 0 HE21 GLN A 98 8.808 1.715 -14.581 1.00 65.22 H new ATOM 0 HE22 GLN A 98 9.014 0.205 -13.687 1.00 65.22 H new ATOM 1643 N LEU A 99 4.868 2.058 -12.320 1.00 70.05 N ATOM 1644 CA LEU A 99 4.257 0.814 -11.811 1.00 74.15 C ATOM 1645 C LEU A 99 3.217 0.273 -12.803 1.00 61.21 C ATOM 1646 O LEU A 99 3.048 -0.936 -12.923 1.00 25.13 O ATOM 1647 CB LEU A 99 3.621 1.047 -10.407 1.00 65.51 C ATOM 1648 CG LEU A 99 4.607 1.230 -9.201 1.00 12.50 C ATOM 1649 CD1 LEU A 99 5.534 2.434 -9.400 1.00 31.50 C ATOM 1650 CD2 LEU A 99 3.834 1.353 -7.868 1.00 71.21 C ATOM 0 H LEU A 99 4.532 2.898 -11.848 1.00 70.05 H new ATOM 0 HA LEU A 99 5.042 0.066 -11.706 1.00 74.15 H new ATOM 0 HB2 LEU A 99 2.988 1.932 -10.464 1.00 65.51 H new ATOM 0 HB3 LEU A 99 2.968 0.202 -10.186 1.00 65.51 H new ATOM 0 HG LEU A 99 5.231 0.338 -9.158 1.00 12.50 H new ATOM 0 HD11 LEU A 99 6.201 2.525 -8.543 1.00 31.50 H new ATOM 0 HD12 LEU A 99 6.124 2.293 -10.305 1.00 31.50 H new ATOM 0 HD13 LEU A 99 4.937 3.341 -9.494 1.00 31.50 H new ATOM 0 HD21 LEU A 99 4.541 1.479 -7.048 1.00 71.21 H new ATOM 0 HD22 LEU A 99 3.170 2.216 -7.911 1.00 71.21 H new ATOM 0 HD23 LEU A 99 3.245 0.450 -7.704 1.00 71.21 H new ATOM 1662 N LYS A 100 2.546 1.184 -13.530 1.00 21.20 N ATOM 1663 CA LYS A 100 1.552 0.815 -14.561 1.00 3.43 C ATOM 1664 C LYS A 100 2.256 0.210 -15.800 1.00 54.12 C ATOM 1665 O LYS A 100 1.728 -0.686 -16.466 1.00 44.23 O ATOM 1666 CB LYS A 100 0.722 2.071 -14.960 1.00 43.20 C ATOM 1667 CG LYS A 100 -0.055 2.774 -13.808 1.00 2.12 C ATOM 1668 CD LYS A 100 -1.442 2.147 -13.455 1.00 41.13 C ATOM 1669 CE LYS A 100 -1.389 0.754 -12.800 1.00 12.33 C ATOM 1670 NZ LYS A 100 -2.750 0.246 -12.440 1.00 75.15 N ATOM 0 H LYS A 100 2.674 2.190 -13.423 1.00 21.20 H new ATOM 0 HA LYS A 100 0.879 0.061 -14.154 1.00 3.43 H new ATOM 0 HB2 LYS A 100 1.396 2.798 -15.412 1.00 43.20 H new ATOM 0 HB3 LYS A 100 0.006 1.779 -15.728 1.00 43.20 H new ATOM 0 HG2 LYS A 100 0.568 2.764 -12.913 1.00 2.12 H new ATOM 0 HG3 LYS A 100 -0.206 3.819 -14.079 1.00 2.12 H new ATOM 0 HD2 LYS A 100 -1.968 2.826 -12.784 1.00 41.13 H new ATOM 0 HD3 LYS A 100 -2.034 2.079 -14.368 1.00 41.13 H new ATOM 0 HE2 LYS A 100 -0.910 0.052 -13.482 1.00 12.33 H new ATOM 0 HE3 LYS A 100 -0.771 0.799 -11.903 1.00 12.33 H new ATOM 0 HZ1 LYS A 100 -2.723 -0.791 -12.359 1.00 75.15 H new ATOM 0 HZ2 LYS A 100 -3.045 0.657 -11.531 1.00 75.15 H new ATOM 0 HZ3 LYS A 100 -3.429 0.518 -13.179 1.00 75.15 H new ATOM 1684 N LYS A 101 3.470 0.716 -16.061 1.00 31.31 N ATOM 1685 CA LYS A 101 4.335 0.305 -17.181 1.00 23.45 C ATOM 1686 C LYS A 101 5.029 -1.031 -16.849 1.00 4.21 C ATOM 1687 O LYS A 101 5.344 -1.828 -17.741 1.00 1.12 O ATOM 1688 CB LYS A 101 5.375 1.436 -17.432 1.00 61.42 C ATOM 1689 CG LYS A 101 6.247 1.278 -18.689 1.00 1.33 C ATOM 1690 CD LYS A 101 7.266 2.435 -18.839 1.00 4.21 C ATOM 1691 CE LYS A 101 8.068 2.342 -20.142 1.00 34.04 C ATOM 1692 NZ LYS A 101 8.807 1.058 -20.253 1.00 32.34 N ATOM 0 H LYS A 101 3.891 1.444 -15.483 1.00 31.31 H new ATOM 0 HA LYS A 101 3.745 0.151 -18.085 1.00 23.45 H new ATOM 0 HB2 LYS A 101 4.842 2.385 -17.499 1.00 61.42 H new ATOM 0 HB3 LYS A 101 6.031 1.500 -16.564 1.00 61.42 H new ATOM 0 HG2 LYS A 101 6.781 0.329 -18.643 1.00 1.33 H new ATOM 0 HG3 LYS A 101 5.608 1.241 -19.571 1.00 1.33 H new ATOM 0 HD2 LYS A 101 6.737 3.388 -18.808 1.00 4.21 H new ATOM 0 HD3 LYS A 101 7.952 2.424 -17.992 1.00 4.21 H new ATOM 0 HE2 LYS A 101 7.392 2.446 -20.991 1.00 34.04 H new ATOM 0 HE3 LYS A 101 8.773 3.171 -20.193 1.00 34.04 H new ATOM 0 HZ1 LYS A 101 9.414 1.079 -21.097 1.00 32.34 H new ATOM 0 HZ2 LYS A 101 9.396 0.922 -19.406 1.00 32.34 H new ATOM 0 HZ3 LYS A 101 8.129 0.273 -20.333 1.00 32.34 H new ATOM 1706 N ASP A 102 5.262 -1.247 -15.544 1.00 61.34 N ATOM 1707 CA ASP A 102 5.822 -2.498 -15.008 1.00 34.04 C ATOM 1708 C ASP A 102 4.764 -3.619 -15.052 1.00 51.22 C ATOM 1709 O ASP A 102 4.901 -4.601 -15.791 1.00 40.33 O ATOM 1710 CB ASP A 102 6.316 -2.265 -13.552 1.00 51.51 C ATOM 1711 CG ASP A 102 6.801 -3.550 -12.844 1.00 33.34 C ATOM 1712 OD1 ASP A 102 5.970 -4.250 -12.227 1.00 11.21 O ATOM 1713 OD2 ASP A 102 8.008 -3.861 -12.895 1.00 44.32 O ATOM 0 H ASP A 102 5.065 -0.551 -14.825 1.00 61.34 H new ATOM 0 HA ASP A 102 6.668 -2.806 -15.622 1.00 34.04 H new ATOM 0 HB2 ASP A 102 7.130 -1.540 -13.566 1.00 51.51 H new ATOM 0 HB3 ASP A 102 5.507 -1.824 -12.970 1.00 51.51 H new ATOM 1718 N GLY A 103 3.707 -3.436 -14.245 1.00 53.52 N ATOM 1719 CA GLY A 103 2.657 -4.435 -14.051 1.00 32.42 C ATOM 1720 C GLY A 103 1.954 -4.263 -12.708 1.00 63.50 C ATOM 1721 O GLY A 103 0.822 -4.731 -12.536 1.00 20.13 O ATOM 0 H GLY A 103 3.561 -2.582 -13.707 1.00 53.52 H new ATOM 0 HA2 GLY A 103 1.927 -4.356 -14.856 1.00 32.42 H new ATOM 0 HA3 GLY A 103 3.090 -5.434 -14.110 1.00 32.42 H new ATOM 1725 N VAL A 104 2.642 -3.590 -11.753 1.00 73.32 N ATOM 1726 CA VAL A 104 2.109 -3.296 -10.401 1.00 11.23 C ATOM 1727 C VAL A 104 0.860 -2.399 -10.474 1.00 52.40 C ATOM 1728 O VAL A 104 0.842 -1.400 -11.206 1.00 35.40 O ATOM 1729 CB VAL A 104 3.199 -2.604 -9.503 1.00 51.32 C ATOM 1730 CG1 VAL A 104 2.662 -2.248 -8.094 1.00 21.34 C ATOM 1731 CG2 VAL A 104 4.452 -3.489 -9.405 1.00 11.03 C ATOM 0 H VAL A 104 3.587 -3.235 -11.901 1.00 73.32 H new ATOM 0 HA VAL A 104 1.830 -4.249 -9.952 1.00 11.23 H new ATOM 0 HB VAL A 104 3.468 -1.664 -9.984 1.00 51.32 H new ATOM 0 HG11 VAL A 104 3.452 -1.773 -7.513 1.00 21.34 H new ATOM 0 HG12 VAL A 104 1.819 -1.564 -8.188 1.00 21.34 H new ATOM 0 HG13 VAL A 104 2.336 -3.157 -7.588 1.00 21.34 H new ATOM 0 HG21 VAL A 104 5.197 -2.997 -8.780 1.00 11.03 H new ATOM 0 HG22 VAL A 104 4.186 -4.449 -8.963 1.00 11.03 H new ATOM 0 HG23 VAL A 104 4.863 -3.650 -10.402 1.00 11.03 H new ATOM 1741 N ASP A 105 -0.178 -2.750 -9.699 1.00 65.54 N ATOM 1742 CA ASP A 105 -1.461 -2.052 -9.738 1.00 23.53 C ATOM 1743 C ASP A 105 -1.445 -0.852 -8.775 1.00 2.13 C ATOM 1744 O ASP A 105 -1.780 -0.973 -7.608 1.00 61.31 O ATOM 1745 CB ASP A 105 -2.627 -3.031 -9.406 1.00 62.34 C ATOM 1746 CG ASP A 105 -4.025 -2.523 -9.826 1.00 1.24 C ATOM 1747 OD1 ASP A 105 -4.133 -1.615 -10.695 1.00 23.01 O ATOM 1748 OD2 ASP A 105 -5.032 -3.057 -9.310 1.00 73.21 O ATOM 0 H ASP A 105 -0.147 -3.522 -9.033 1.00 65.54 H new ATOM 0 HA ASP A 105 -1.624 -1.672 -10.746 1.00 23.53 H new ATOM 0 HB2 ASP A 105 -2.437 -3.984 -9.899 1.00 62.34 H new ATOM 0 HB3 ASP A 105 -2.630 -3.222 -8.333 1.00 62.34 H new ATOM 1753 N VAL A 106 -0.972 0.289 -9.258 1.00 55.15 N ATOM 1754 CA VAL A 106 -1.065 1.559 -8.518 1.00 32.33 C ATOM 1755 C VAL A 106 -2.348 2.286 -8.953 1.00 1.24 C ATOM 1756 O VAL A 106 -2.752 2.225 -10.125 1.00 71.24 O ATOM 1757 CB VAL A 106 0.218 2.431 -8.722 1.00 14.53 C ATOM 1758 CG1 VAL A 106 0.483 2.713 -10.201 1.00 75.30 C ATOM 1759 CG2 VAL A 106 0.191 3.732 -7.884 1.00 25.34 C ATOM 0 H VAL A 106 -0.515 0.370 -10.166 1.00 55.15 H new ATOM 0 HA VAL A 106 -1.122 1.363 -7.447 1.00 32.33 H new ATOM 0 HB VAL A 106 1.055 1.841 -8.349 1.00 14.53 H new ATOM 0 HG11 VAL A 106 1.382 3.321 -10.300 1.00 75.30 H new ATOM 0 HG12 VAL A 106 0.622 1.771 -10.732 1.00 75.30 H new ATOM 0 HG13 VAL A 106 -0.366 3.248 -10.627 1.00 75.30 H new ATOM 0 HG21 VAL A 106 1.104 4.299 -8.063 1.00 25.34 H new ATOM 0 HG22 VAL A 106 -0.672 4.333 -8.172 1.00 25.34 H new ATOM 0 HG23 VAL A 106 0.121 3.482 -6.825 1.00 25.34 H new ATOM 1769 N ARG A 107 -2.996 2.940 -7.994 1.00 15.14 N ATOM 1770 CA ARG A 107 -4.368 3.429 -8.115 1.00 5.45 C ATOM 1771 C ARG A 107 -4.431 4.880 -7.642 1.00 24.22 C ATOM 1772 O ARG A 107 -3.960 5.194 -6.543 1.00 51.12 O ATOM 1773 CB ARG A 107 -5.313 2.551 -7.240 1.00 72.43 C ATOM 1774 CG ARG A 107 -5.357 1.052 -7.613 1.00 12.34 C ATOM 1775 CD ARG A 107 -6.078 0.771 -8.944 1.00 43.05 C ATOM 1776 NE ARG A 107 -7.507 1.146 -8.897 1.00 63.33 N ATOM 1777 CZ ARG A 107 -8.460 0.498 -8.193 1.00 34.11 C ATOM 1778 NH1 ARG A 107 -8.179 -0.590 -7.479 1.00 54.14 N ATOM 1779 NH2 ARG A 107 -9.702 0.954 -8.203 1.00 11.42 N ATOM 0 H ARG A 107 -2.573 3.150 -7.090 1.00 15.14 H new ATOM 0 HA ARG A 107 -4.686 3.372 -9.156 1.00 5.45 H new ATOM 0 HB2 ARG A 107 -5.003 2.640 -6.199 1.00 72.43 H new ATOM 0 HB3 ARG A 107 -6.323 2.955 -7.308 1.00 72.43 H new ATOM 0 HG2 ARG A 107 -4.338 0.671 -7.674 1.00 12.34 H new ATOM 0 HG3 ARG A 107 -5.856 0.502 -6.815 1.00 12.34 H new ATOM 0 HD2 ARG A 107 -5.586 1.323 -9.745 1.00 43.05 H new ATOM 0 HD3 ARG A 107 -5.990 -0.288 -9.186 1.00 43.05 H new ATOM 0 HE ARG A 107 -7.797 1.960 -9.440 1.00 63.33 H new ATOM 0 HH11 ARG A 107 -7.226 -0.952 -7.455 1.00 54.14 H new ATOM 0 HH12 ARG A 107 -8.917 -1.061 -6.956 1.00 54.14 H new ATOM 0 HH21 ARG A 107 -9.934 1.790 -8.740 1.00 11.42 H new ATOM 0 HH22 ARG A 107 -10.427 0.470 -7.674 1.00 11.42 H new ATOM 1793 N VAL A 108 -4.987 5.764 -8.478 1.00 33.11 N ATOM 1794 CA VAL A 108 -5.330 7.133 -8.065 1.00 11.20 C ATOM 1795 C VAL A 108 -6.802 7.164 -7.607 1.00 21.23 C ATOM 1796 O VAL A 108 -7.722 6.897 -8.389 1.00 32.51 O ATOM 1797 CB VAL A 108 -5.047 8.201 -9.200 1.00 23.20 C ATOM 1798 CG1 VAL A 108 -3.525 8.426 -9.385 1.00 32.22 C ATOM 1799 CG2 VAL A 108 -5.706 7.810 -10.550 1.00 2.53 C ATOM 0 H VAL A 108 -5.211 5.555 -9.451 1.00 33.11 H new ATOM 0 HA VAL A 108 -4.685 7.414 -7.233 1.00 11.20 H new ATOM 0 HB VAL A 108 -5.501 9.137 -8.874 1.00 23.20 H new ATOM 0 HG11 VAL A 108 -3.359 9.164 -10.170 1.00 32.22 H new ATOM 0 HG12 VAL A 108 -3.094 8.787 -8.451 1.00 32.22 H new ATOM 0 HG13 VAL A 108 -3.049 7.486 -9.664 1.00 32.22 H new ATOM 0 HG21 VAL A 108 -5.484 8.572 -11.297 1.00 2.53 H new ATOM 0 HG22 VAL A 108 -5.312 6.850 -10.883 1.00 2.53 H new ATOM 0 HG23 VAL A 108 -6.785 7.733 -10.419 1.00 2.53 H new ATOM 1809 N THR A 109 -7.009 7.422 -6.310 1.00 63.13 N ATOM 1810 CA THR A 109 -8.349 7.580 -5.727 1.00 71.32 C ATOM 1811 C THR A 109 -8.773 9.049 -5.827 1.00 24.13 C ATOM 1812 O THR A 109 -9.881 9.353 -6.297 1.00 72.11 O ATOM 1813 CB THR A 109 -8.370 7.101 -4.240 1.00 31.31 C ATOM 1814 OG1 THR A 109 -7.268 7.687 -3.519 1.00 51.11 O ATOM 1815 CG2 THR A 109 -8.295 5.568 -4.135 1.00 50.40 C ATOM 0 H THR A 109 -6.253 7.527 -5.634 1.00 63.13 H new ATOM 0 HA THR A 109 -9.054 6.962 -6.283 1.00 71.32 H new ATOM 0 HB THR A 109 -9.314 7.425 -3.802 1.00 31.31 H new ATOM 0 HG1 THR A 109 -7.192 7.265 -2.638 1.00 51.11 H new ATOM 0 HG21 THR A 109 -8.312 5.274 -3.086 1.00 50.40 H new ATOM 0 HG22 THR A 109 -9.148 5.126 -4.650 1.00 50.40 H new ATOM 0 HG23 THR A 109 -7.372 5.217 -4.595 1.00 50.40 H new ATOM 1823 N ASP A 110 -7.867 9.939 -5.346 1.00 52.43 N ATOM 1824 CA ASP A 110 -7.971 11.425 -5.433 1.00 54.21 C ATOM 1825 C ASP A 110 -8.982 12.006 -4.408 1.00 64.43 C ATOM 1826 O ASP A 110 -8.675 12.969 -3.700 1.00 5.31 O ATOM 1827 CB ASP A 110 -8.274 11.909 -6.887 1.00 51.31 C ATOM 1828 CG ASP A 110 -8.261 13.445 -7.056 1.00 4.00 C ATOM 1829 OD1 ASP A 110 -7.184 14.012 -7.336 1.00 12.55 O ATOM 1830 OD2 ASP A 110 -9.332 14.088 -6.944 1.00 34.41 O ATOM 0 H ASP A 110 -7.016 9.636 -4.872 1.00 52.43 H new ATOM 0 HA ASP A 110 -6.991 11.819 -5.165 1.00 54.21 H new ATOM 0 HB2 ASP A 110 -7.539 11.473 -7.564 1.00 51.31 H new ATOM 0 HB3 ASP A 110 -9.250 11.529 -7.189 1.00 51.31 H new ATOM 1835 N ASN A 111 -10.190 11.431 -4.355 1.00 44.32 N ATOM 1836 CA ASN A 111 -11.223 11.784 -3.355 1.00 62.10 C ATOM 1837 C ASN A 111 -10.869 11.216 -1.957 1.00 1.14 C ATOM 1838 O ASN A 111 -10.201 10.176 -1.842 1.00 35.42 O ATOM 1839 CB ASN A 111 -12.609 11.265 -3.825 1.00 41.34 C ATOM 1840 CG ASN A 111 -13.760 11.621 -2.864 1.00 3.52 C ATOM 1841 OD1 ASN A 111 -14.093 10.857 -1.951 1.00 44.11 O ATOM 1842 ND2 ASN A 111 -14.357 12.789 -3.044 1.00 71.14 N ATOM 0 H ASN A 111 -10.486 10.703 -5.005 1.00 44.32 H new ATOM 0 HA ASN A 111 -11.262 12.870 -3.267 1.00 62.10 H new ATOM 0 HB2 ASN A 111 -12.828 11.679 -4.809 1.00 41.34 H new ATOM 0 HB3 ASN A 111 -12.563 10.182 -3.938 1.00 41.34 H new ATOM 0 HD21 ASN A 111 -15.111 13.077 -2.421 1.00 71.14 H new ATOM 0 HD22 ASN A 111 -14.062 13.400 -3.805 1.00 71.14 H new ATOM 1849 N GLU A 112 -11.355 11.913 -0.914 1.00 70.52 N ATOM 1850 CA GLU A 112 -11.112 11.571 0.499 1.00 30.15 C ATOM 1851 C GLU A 112 -11.723 10.207 0.882 1.00 11.54 C ATOM 1852 O GLU A 112 -11.006 9.259 1.228 1.00 62.13 O ATOM 1853 CB GLU A 112 -11.720 12.680 1.402 1.00 71.14 C ATOM 1854 CG GLU A 112 -11.181 14.098 1.137 1.00 32.30 C ATOM 1855 CD GLU A 112 -9.726 14.290 1.594 1.00 1.12 C ATOM 1856 OE1 GLU A 112 -9.520 14.607 2.783 1.00 54.43 O ATOM 1857 OE2 GLU A 112 -8.793 14.144 0.773 1.00 61.44 O ATOM 0 H GLU A 112 -11.937 12.743 -1.031 1.00 70.52 H new ATOM 0 HA GLU A 112 -10.034 11.501 0.645 1.00 30.15 H new ATOM 0 HB2 GLU A 112 -12.802 12.687 1.266 1.00 71.14 H new ATOM 0 HB3 GLU A 112 -11.531 12.424 2.445 1.00 71.14 H new ATOM 0 HG2 GLU A 112 -11.251 14.312 0.071 1.00 32.30 H new ATOM 0 HG3 GLU A 112 -11.814 14.822 1.650 1.00 32.30 H new ATOM 1864 N ASP A 113 -13.069 10.126 0.814 1.00 4.33 N ATOM 1865 CA ASP A 113 -13.823 8.977 1.350 1.00 43.24 C ATOM 1866 C ASP A 113 -13.709 7.746 0.426 1.00 61.44 C ATOM 1867 O ASP A 113 -13.760 6.617 0.900 1.00 24.24 O ATOM 1868 CB ASP A 113 -15.309 9.345 1.641 1.00 42.14 C ATOM 1869 CG ASP A 113 -15.910 8.521 2.807 1.00 71.42 C ATOM 1870 OD1 ASP A 113 -16.318 7.365 2.597 1.00 25.35 O ATOM 1871 OD2 ASP A 113 -15.962 9.027 3.956 1.00 63.35 O ATOM 0 H ASP A 113 -13.655 10.846 0.392 1.00 4.33 H new ATOM 0 HA ASP A 113 -13.369 8.709 2.304 1.00 43.24 H new ATOM 0 HB2 ASP A 113 -15.377 10.407 1.879 1.00 42.14 H new ATOM 0 HB3 ASP A 113 -15.903 9.181 0.742 1.00 42.14 H new ATOM 1876 N GLU A 114 -13.546 7.968 -0.895 1.00 63.05 N ATOM 1877 CA GLU A 114 -13.346 6.860 -1.860 1.00 33.23 C ATOM 1878 C GLU A 114 -12.061 6.055 -1.536 1.00 3.11 C ATOM 1879 O GLU A 114 -12.012 4.840 -1.769 1.00 51.22 O ATOM 1880 CB GLU A 114 -13.298 7.383 -3.318 1.00 12.25 C ATOM 1881 CG GLU A 114 -14.597 8.062 -3.815 1.00 2.41 C ATOM 1882 CD GLU A 114 -15.853 7.169 -3.740 1.00 21.54 C ATOM 1883 OE1 GLU A 114 -15.928 6.174 -4.488 1.00 61.24 O ATOM 1884 OE2 GLU A 114 -16.772 7.472 -2.950 1.00 74.00 O ATOM 0 H GLU A 114 -13.548 8.896 -1.318 1.00 63.05 H new ATOM 0 HA GLU A 114 -14.202 6.192 -1.764 1.00 33.23 H new ATOM 0 HB2 GLU A 114 -12.478 8.096 -3.405 1.00 12.25 H new ATOM 0 HB3 GLU A 114 -13.067 6.548 -3.980 1.00 12.25 H new ATOM 0 HG2 GLU A 114 -14.770 8.962 -3.225 1.00 2.41 H new ATOM 0 HG3 GLU A 114 -14.454 8.380 -4.848 1.00 2.41 H new ATOM 1891 N ALA A 115 -11.046 6.746 -0.980 1.00 5.15 N ATOM 1892 CA ALA A 115 -9.749 6.141 -0.613 1.00 5.22 C ATOM 1893 C ALA A 115 -9.893 5.062 0.487 1.00 55.35 C ATOM 1894 O ALA A 115 -9.330 3.965 0.368 1.00 24.31 O ATOM 1895 CB ALA A 115 -8.769 7.248 -0.190 1.00 43.41 C ATOM 0 H ALA A 115 -11.102 7.743 -0.772 1.00 5.15 H new ATOM 0 HA ALA A 115 -9.353 5.628 -1.489 1.00 5.22 H new ATOM 0 HB1 ALA A 115 -7.812 6.803 0.081 1.00 43.41 H new ATOM 0 HB2 ALA A 115 -8.625 7.942 -1.018 1.00 43.41 H new ATOM 0 HB3 ALA A 115 -9.175 7.785 0.667 1.00 43.41 H new ATOM 1901 N LYS A 116 -10.655 5.386 1.550 1.00 3.51 N ATOM 1902 CA LYS A 116 -10.910 4.456 2.680 1.00 63.25 C ATOM 1903 C LYS A 116 -11.884 3.327 2.299 1.00 70.41 C ATOM 1904 O LYS A 116 -11.748 2.200 2.801 1.00 62.33 O ATOM 1905 CB LYS A 116 -11.422 5.218 3.936 1.00 64.44 C ATOM 1906 CG LYS A 116 -12.496 6.288 3.662 1.00 72.52 C ATOM 1907 CD LYS A 116 -13.275 6.754 4.913 1.00 31.32 C ATOM 1908 CE LYS A 116 -14.222 5.668 5.467 1.00 52.44 C ATOM 1909 NZ LYS A 116 -15.163 6.215 6.490 1.00 14.21 N ATOM 0 H LYS A 116 -11.111 6.293 1.654 1.00 3.51 H new ATOM 0 HA LYS A 116 -9.953 3.993 2.923 1.00 63.25 H new ATOM 0 HB2 LYS A 116 -11.827 4.492 4.641 1.00 64.44 H new ATOM 0 HB3 LYS A 116 -10.572 5.696 4.423 1.00 64.44 H new ATOM 0 HG2 LYS A 116 -12.018 7.154 3.204 1.00 72.52 H new ATOM 0 HG3 LYS A 116 -13.205 5.894 2.935 1.00 72.52 H new ATOM 0 HD2 LYS A 116 -12.567 7.043 5.690 1.00 31.32 H new ATOM 0 HD3 LYS A 116 -13.855 7.643 4.664 1.00 31.32 H new ATOM 0 HE2 LYS A 116 -14.792 5.231 4.647 1.00 52.44 H new ATOM 0 HE3 LYS A 116 -13.633 4.864 5.909 1.00 52.44 H new ATOM 0 HZ1 LYS A 116 -15.781 5.453 6.836 1.00 14.21 H new ATOM 0 HZ2 LYS A 116 -14.621 6.609 7.285 1.00 14.21 H new ATOM 0 HZ3 LYS A 116 -15.744 6.964 6.062 1.00 14.21 H new ATOM 1923 N LYS A 117 -12.862 3.638 1.412 1.00 23.34 N ATOM 1924 CA LYS A 117 -13.855 2.649 0.928 1.00 52.12 C ATOM 1925 C LYS A 117 -13.156 1.455 0.258 1.00 4.13 C ATOM 1926 O LYS A 117 -13.487 0.306 0.556 1.00 2.42 O ATOM 1927 CB LYS A 117 -14.869 3.280 -0.063 1.00 51.43 C ATOM 1928 CG LYS A 117 -15.847 4.294 0.559 1.00 44.44 C ATOM 1929 CD LYS A 117 -16.792 4.916 -0.496 1.00 35.34 C ATOM 1930 CE LYS A 117 -17.722 5.977 0.097 1.00 23.45 C ATOM 1931 NZ LYS A 117 -18.673 6.512 -0.908 1.00 55.33 N ATOM 0 H LYS A 117 -12.983 4.570 1.017 1.00 23.34 H new ATOM 0 HA LYS A 117 -14.406 2.302 1.802 1.00 52.12 H new ATOM 0 HB2 LYS A 117 -14.314 3.776 -0.860 1.00 51.43 H new ATOM 0 HB3 LYS A 117 -15.446 2.480 -0.527 1.00 51.43 H new ATOM 0 HG2 LYS A 117 -16.440 3.800 1.329 1.00 44.44 H new ATOM 0 HG3 LYS A 117 -15.283 5.086 1.051 1.00 44.44 H new ATOM 0 HD2 LYS A 117 -16.197 5.364 -1.292 1.00 35.34 H new ATOM 0 HD3 LYS A 117 -17.391 4.127 -0.951 1.00 35.34 H new ATOM 0 HE2 LYS A 117 -18.279 5.546 0.929 1.00 23.45 H new ATOM 0 HE3 LYS A 117 -17.126 6.795 0.502 1.00 23.45 H new ATOM 0 HZ1 LYS A 117 -19.237 7.274 -0.481 1.00 55.33 H new ATOM 0 HZ2 LYS A 117 -18.144 6.886 -1.721 1.00 55.33 H new ATOM 0 HZ3 LYS A 117 -19.306 5.751 -1.227 1.00 55.33 H new ATOM 1945 N ARG A 118 -12.157 1.760 -0.606 1.00 5.11 N ATOM 1946 CA ARG A 118 -11.389 0.738 -1.350 1.00 65.02 C ATOM 1947 C ARG A 118 -10.775 -0.296 -0.386 1.00 44.11 C ATOM 1948 O ARG A 118 -11.027 -1.487 -0.530 1.00 2.41 O ATOM 1949 CB ARG A 118 -10.276 1.407 -2.234 1.00 63.22 C ATOM 1950 CG ARG A 118 -10.616 1.597 -3.738 1.00 24.13 C ATOM 1951 CD ARG A 118 -11.802 2.540 -4.024 1.00 42.21 C ATOM 1952 NE ARG A 118 -13.122 1.965 -3.686 1.00 54.15 N ATOM 1953 CZ ARG A 118 -14.261 2.678 -3.580 1.00 40.43 C ATOM 1954 NH1 ARG A 118 -14.257 3.994 -3.769 1.00 33.15 N ATOM 1955 NH2 ARG A 118 -15.403 2.074 -3.282 1.00 70.24 N ATOM 0 H ARG A 118 -11.864 2.717 -0.804 1.00 5.11 H new ATOM 0 HA ARG A 118 -12.078 0.215 -2.013 1.00 65.02 H new ATOM 0 HB2 ARG A 118 -10.042 2.383 -1.810 1.00 63.22 H new ATOM 0 HB3 ARG A 118 -9.372 0.803 -2.161 1.00 63.22 H new ATOM 0 HG2 ARG A 118 -9.734 1.982 -4.249 1.00 24.13 H new ATOM 0 HG3 ARG A 118 -10.834 0.621 -4.172 1.00 24.13 H new ATOM 0 HD2 ARG A 118 -11.664 3.462 -3.460 1.00 42.21 H new ATOM 0 HD3 ARG A 118 -11.793 2.808 -5.081 1.00 42.21 H new ATOM 0 HE ARG A 118 -13.174 0.960 -3.522 1.00 54.15 H new ATOM 0 HH11 ARG A 118 -13.386 4.474 -3.997 1.00 33.15 H new ATOM 0 HH12 ARG A 118 -15.125 4.524 -3.686 1.00 33.15 H new ATOM 0 HH21 ARG A 118 -15.422 1.065 -3.132 1.00 70.24 H new ATOM 0 HH22 ARG A 118 -16.262 2.618 -3.203 1.00 70.24 H new ATOM 1969 N LEU A 119 -10.063 0.203 0.650 1.00 13.01 N ATOM 1970 CA LEU A 119 -9.340 -0.638 1.635 1.00 61.13 C ATOM 1971 C LEU A 119 -10.250 -1.677 2.302 1.00 21.44 C ATOM 1972 O LEU A 119 -9.940 -2.868 2.294 1.00 31.02 O ATOM 1973 CB LEU A 119 -8.699 0.251 2.725 1.00 71.50 C ATOM 1974 CG LEU A 119 -7.531 1.155 2.255 1.00 44.32 C ATOM 1975 CD1 LEU A 119 -7.111 2.099 3.380 1.00 25.24 C ATOM 1976 CD2 LEU A 119 -6.335 0.310 1.754 1.00 63.25 C ATOM 0 H LEU A 119 -9.973 1.203 0.828 1.00 13.01 H new ATOM 0 HA LEU A 119 -8.569 -1.176 1.084 1.00 61.13 H new ATOM 0 HB2 LEU A 119 -9.475 0.885 3.153 1.00 71.50 H new ATOM 0 HB3 LEU A 119 -8.336 -0.393 3.526 1.00 71.50 H new ATOM 0 HG LEU A 119 -7.877 1.756 1.414 1.00 44.32 H new ATOM 0 HD11 LEU A 119 -6.290 2.729 3.039 1.00 25.24 H new ATOM 0 HD12 LEU A 119 -7.956 2.726 3.663 1.00 25.24 H new ATOM 0 HD13 LEU A 119 -6.787 1.516 4.242 1.00 25.24 H new ATOM 0 HD21 LEU A 119 -5.532 0.972 1.431 1.00 63.25 H new ATOM 0 HD22 LEU A 119 -5.977 -0.328 2.562 1.00 63.25 H new ATOM 0 HD23 LEU A 119 -6.653 -0.310 0.916 1.00 63.25 H new ATOM 1988 N LYS A 120 -11.384 -1.206 2.838 1.00 73.03 N ATOM 1989 CA LYS A 120 -12.310 -2.047 3.609 1.00 64.11 C ATOM 1990 C LYS A 120 -12.909 -3.160 2.722 1.00 3.31 C ATOM 1991 O LYS A 120 -12.982 -4.318 3.139 1.00 12.34 O ATOM 1992 CB LYS A 120 -13.431 -1.175 4.226 1.00 1.33 C ATOM 1993 CG LYS A 120 -14.309 -1.909 5.261 1.00 62.33 C ATOM 1994 CD LYS A 120 -15.440 -1.014 5.827 1.00 64.01 C ATOM 1995 CE LYS A 120 -16.324 -1.757 6.839 1.00 50.44 C ATOM 1996 NZ LYS A 120 -17.449 -0.915 7.339 1.00 3.41 N ATOM 0 H LYS A 120 -11.685 -0.235 2.750 1.00 73.03 H new ATOM 0 HA LYS A 120 -11.755 -2.525 4.416 1.00 64.11 H new ATOM 0 HB2 LYS A 120 -12.978 -0.305 4.702 1.00 1.33 H new ATOM 0 HB3 LYS A 120 -14.069 -0.803 3.424 1.00 1.33 H new ATOM 0 HG2 LYS A 120 -14.748 -2.793 4.798 1.00 62.33 H new ATOM 0 HG3 LYS A 120 -13.682 -2.258 6.082 1.00 62.33 H new ATOM 0 HD2 LYS A 120 -15.001 -0.139 6.306 1.00 64.01 H new ATOM 0 HD3 LYS A 120 -16.058 -0.652 5.006 1.00 64.01 H new ATOM 0 HE2 LYS A 120 -16.726 -2.657 6.374 1.00 50.44 H new ATOM 0 HE3 LYS A 120 -15.713 -2.080 7.682 1.00 50.44 H new ATOM 0 HZ1 LYS A 120 -18.016 -1.461 8.019 1.00 3.41 H new ATOM 0 HZ2 LYS A 120 -17.067 -0.069 7.808 1.00 3.41 H new ATOM 0 HZ3 LYS A 120 -18.049 -0.627 6.540 1.00 3.41 H new ATOM 2010 N GLU A 121 -13.258 -2.784 1.469 1.00 50.25 N ATOM 2011 CA GLU A 121 -13.896 -3.691 0.488 1.00 33.14 C ATOM 2012 C GLU A 121 -12.931 -4.777 0.006 1.00 44.51 C ATOM 2013 O GLU A 121 -13.343 -5.905 -0.259 1.00 23.32 O ATOM 2014 CB GLU A 121 -14.447 -2.892 -0.703 1.00 61.12 C ATOM 2015 CG GLU A 121 -15.528 -1.878 -0.298 1.00 14.13 C ATOM 2016 CD GLU A 121 -16.021 -1.012 -1.455 1.00 23.22 C ATOM 2017 OE1 GLU A 121 -15.198 -0.611 -2.312 1.00 4.05 O ATOM 2018 OE2 GLU A 121 -17.234 -0.743 -1.522 1.00 52.32 O ATOM 0 H GLU A 121 -13.104 -1.842 1.110 1.00 50.25 H new ATOM 0 HA GLU A 121 -14.724 -4.190 0.992 1.00 33.14 H new ATOM 0 HB2 GLU A 121 -13.627 -2.365 -1.190 1.00 61.12 H new ATOM 0 HB3 GLU A 121 -14.862 -3.583 -1.436 1.00 61.12 H new ATOM 0 HG2 GLU A 121 -16.375 -2.415 0.129 1.00 14.13 H new ATOM 0 HG3 GLU A 121 -15.132 -1.232 0.485 1.00 14.13 H new ATOM 2025 N LEU A 122 -11.647 -4.423 -0.090 1.00 13.01 N ATOM 2026 CA LEU A 122 -10.577 -5.375 -0.413 1.00 14.05 C ATOM 2027 C LEU A 122 -10.418 -6.380 0.744 1.00 2.12 C ATOM 2028 O LEU A 122 -10.383 -7.595 0.527 1.00 12.51 O ATOM 2029 CB LEU A 122 -9.255 -4.610 -0.652 1.00 44.43 C ATOM 2030 CG LEU A 122 -9.252 -3.586 -1.824 1.00 51.13 C ATOM 2031 CD1 LEU A 122 -7.962 -2.763 -1.800 1.00 4.10 C ATOM 2032 CD2 LEU A 122 -9.458 -4.257 -3.195 1.00 73.31 C ATOM 0 H LEU A 122 -11.318 -3.468 0.054 1.00 13.01 H new ATOM 0 HA LEU A 122 -10.832 -5.921 -1.321 1.00 14.05 H new ATOM 0 HB2 LEU A 122 -8.996 -4.081 0.265 1.00 44.43 H new ATOM 0 HB3 LEU A 122 -8.466 -5.340 -0.833 1.00 44.43 H new ATOM 0 HG LEU A 122 -10.101 -2.919 -1.678 1.00 51.13 H new ATOM 0 HD11 LEU A 122 -7.970 -2.050 -2.624 1.00 4.10 H new ATOM 0 HD12 LEU A 122 -7.891 -2.225 -0.855 1.00 4.10 H new ATOM 0 HD13 LEU A 122 -7.104 -3.428 -1.904 1.00 4.10 H new ATOM 0 HD21 LEU A 122 -9.447 -3.498 -3.977 1.00 73.31 H new ATOM 0 HD22 LEU A 122 -8.656 -4.973 -3.374 1.00 73.31 H new ATOM 0 HD23 LEU A 122 -10.417 -4.776 -3.206 1.00 73.31 H new ATOM 2044 N LEU A 123 -10.379 -5.823 1.972 1.00 54.20 N ATOM 2045 CA LEU A 123 -10.231 -6.569 3.245 1.00 71.35 C ATOM 2046 C LEU A 123 -11.435 -7.495 3.534 1.00 62.35 C ATOM 2047 O LEU A 123 -11.310 -8.392 4.371 1.00 31.13 O ATOM 2048 CB LEU A 123 -9.972 -5.579 4.432 1.00 63.14 C ATOM 2049 CG LEU A 123 -8.474 -5.221 4.765 1.00 5.30 C ATOM 2050 CD1 LEU A 123 -7.688 -4.692 3.545 1.00 11.42 C ATOM 2051 CD2 LEU A 123 -8.424 -4.220 5.941 1.00 41.43 C ATOM 0 H LEU A 123 -10.451 -4.815 2.112 1.00 54.20 H new ATOM 0 HA LEU A 123 -9.364 -7.221 3.141 1.00 71.35 H new ATOM 0 HB2 LEU A 123 -10.500 -4.650 4.217 1.00 63.14 H new ATOM 0 HB3 LEU A 123 -10.424 -6.003 5.329 1.00 63.14 H new ATOM 0 HG LEU A 123 -7.977 -6.147 5.056 1.00 5.30 H new ATOM 0 HD11 LEU A 123 -6.664 -4.464 3.842 1.00 11.42 H new ATOM 0 HD12 LEU A 123 -7.678 -5.450 2.762 1.00 11.42 H new ATOM 0 HD13 LEU A 123 -8.166 -3.788 3.169 1.00 11.42 H new ATOM 0 HD21 LEU A 123 -7.386 -3.976 6.167 1.00 41.43 H new ATOM 0 HD22 LEU A 123 -8.959 -3.311 5.668 1.00 41.43 H new ATOM 0 HD23 LEU A 123 -8.891 -4.666 6.819 1.00 41.43 H new ATOM 2063 N GLU A 124 -12.602 -7.256 2.878 1.00 21.41 N ATOM 2064 CA GLU A 124 -13.786 -8.156 2.993 1.00 73.31 C ATOM 2065 C GLU A 124 -13.427 -9.605 2.599 1.00 63.00 C ATOM 2066 O GLU A 124 -13.995 -10.561 3.133 1.00 1.33 O ATOM 2067 CB GLU A 124 -14.968 -7.661 2.117 1.00 65.35 C ATOM 2068 CG GLU A 124 -15.521 -6.274 2.481 1.00 23.54 C ATOM 2069 CD GLU A 124 -15.974 -6.139 3.946 1.00 51.42 C ATOM 2070 OE1 GLU A 124 -17.049 -6.669 4.294 1.00 3.04 O ATOM 2071 OE2 GLU A 124 -15.278 -5.482 4.748 1.00 24.42 O ATOM 0 H GLU A 124 -12.750 -6.453 2.267 1.00 21.41 H new ATOM 0 HA GLU A 124 -14.095 -8.137 4.038 1.00 73.31 H new ATOM 0 HB2 GLU A 124 -14.644 -7.643 1.076 1.00 65.35 H new ATOM 0 HB3 GLU A 124 -15.779 -8.387 2.186 1.00 65.35 H new ATOM 0 HG2 GLU A 124 -14.755 -5.525 2.279 1.00 23.54 H new ATOM 0 HG3 GLU A 124 -16.365 -6.050 1.829 1.00 23.54 H new ATOM 2078 N LYS A 125 -12.484 -9.740 1.648 1.00 41.13 N ATOM 2079 CA LYS A 125 -11.910 -11.033 1.238 1.00 13.51 C ATOM 2080 C LYS A 125 -10.495 -11.174 1.834 1.00 53.44 C ATOM 2081 O LYS A 125 -10.243 -12.081 2.630 1.00 63.41 O ATOM 2082 CB LYS A 125 -11.891 -11.163 -0.317 1.00 13.11 C ATOM 2083 CG LYS A 125 -13.301 -11.326 -0.986 1.00 65.31 C ATOM 2084 CD LYS A 125 -13.700 -10.158 -1.920 1.00 32.15 C ATOM 2085 CE LYS A 125 -13.898 -8.831 -1.184 1.00 64.33 C ATOM 2086 NZ LYS A 125 -14.381 -7.752 -2.083 1.00 12.11 N ATOM 0 H LYS A 125 -12.096 -8.946 1.138 1.00 41.13 H new ATOM 0 HA LYS A 125 -12.532 -11.843 1.620 1.00 13.51 H new ATOM 0 HB2 LYS A 125 -11.407 -10.280 -0.735 1.00 13.11 H new ATOM 0 HB3 LYS A 125 -11.276 -12.021 -0.587 1.00 13.11 H new ATOM 0 HG2 LYS A 125 -13.314 -12.254 -1.558 1.00 65.31 H new ATOM 0 HG3 LYS A 125 -14.053 -11.423 -0.203 1.00 65.31 H new ATOM 0 HD2 LYS A 125 -12.930 -10.032 -2.681 1.00 32.15 H new ATOM 0 HD3 LYS A 125 -14.622 -10.417 -2.440 1.00 32.15 H new ATOM 0 HE2 LYS A 125 -14.612 -8.972 -0.373 1.00 64.33 H new ATOM 0 HE3 LYS A 125 -12.955 -8.527 -0.729 1.00 64.33 H new ATOM 0 HZ1 LYS A 125 -14.137 -6.826 -1.677 1.00 12.11 H new ATOM 0 HZ2 LYS A 125 -13.931 -7.850 -3.016 1.00 12.11 H new ATOM 0 HZ3 LYS A 125 -15.413 -7.823 -2.187 1.00 12.11 H new ATOM 2100 N VAL A 126 -9.585 -10.258 1.444 1.00 74.14 N ATOM 2101 CA VAL A 126 -8.199 -10.221 1.953 1.00 34.35 C ATOM 2102 C VAL A 126 -7.514 -8.894 1.536 1.00 23.34 C ATOM 2103 O VAL A 126 -7.037 -8.135 2.379 1.00 12.41 O ATOM 2104 CB VAL A 126 -7.359 -11.490 1.489 1.00 73.55 C ATOM 2105 CG1 VAL A 126 -7.279 -11.631 -0.050 1.00 70.04 C ATOM 2106 CG2 VAL A 126 -5.955 -11.507 2.134 1.00 34.53 C ATOM 0 H VAL A 126 -9.791 -9.523 0.767 1.00 74.14 H new ATOM 0 HA VAL A 126 -8.237 -10.261 3.042 1.00 34.35 H new ATOM 0 HB VAL A 126 -7.902 -12.364 1.848 1.00 73.55 H new ATOM 0 HG11 VAL A 126 -6.694 -12.514 -0.304 1.00 70.04 H new ATOM 0 HG12 VAL A 126 -8.284 -11.732 -0.459 1.00 70.04 H new ATOM 0 HG13 VAL A 126 -6.803 -10.746 -0.472 1.00 70.04 H new ATOM 0 HG21 VAL A 126 -5.409 -12.387 1.795 1.00 34.53 H new ATOM 0 HG22 VAL A 126 -5.410 -10.608 1.844 1.00 34.53 H new ATOM 0 HG23 VAL A 126 -6.053 -11.537 3.219 1.00 34.53 H new ATOM 2116 N GLY A 127 -7.546 -8.597 0.231 1.00 42.33 N ATOM 2117 CA GLY A 127 -6.902 -7.415 -0.337 1.00 72.44 C ATOM 2118 C GLY A 127 -7.126 -7.359 -1.836 1.00 45.15 C ATOM 2119 O GLY A 127 -6.220 -7.018 -2.609 1.00 1.13 O ATOM 0 H GLY A 127 -8.023 -9.175 -0.461 1.00 42.33 H new ATOM 0 HA2 GLY A 127 -7.302 -6.515 0.131 1.00 72.44 H new ATOM 0 HA3 GLY A 127 -5.833 -7.437 -0.123 1.00 72.44 H new