USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 544 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 159 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 LYS NZ :NH3+ 154:sc= -0.29 (180deg=-1.3!) USER MOD Single : A 170 LYS NZ :NH3+ -174:sc= -1.98 (180deg=-2.79) USER MOD Single : A 175 THR OG1 : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot -36:sc= 0.121! USER MOD Single : A 177 TYR OH : rot 180:sc= 0 USER MOD Single : A 181 ASN :FLIP amide:sc= -0.451 F(o=-1.2,f=-0.45) USER MOD Single : A 185 CYS SG : rot -114:sc= -1.29! USER MOD Single : A 187 HIS : no HD1:sc= -0.62 X(o=-0.62,f=-0.62) USER MOD Single : A 188 HIS : no HE2:sc= -22.6! C(o=-23!,f=-23!) USER MOD Single : A 189 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 190 CYS SG : rot 26:sc= -0.679! USER MOD Single : A 196 LYS NZ :NH3+ -123:sc=-0.00585 (180deg=-0.478) USER MOD Single : A 213 SER OG : rot -170:sc= -0.261 USER MOD Single : A 232 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 233 SER OG : rot 67:sc= 1.11 USER MOD Single : A 235 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 238 THR OG1 : rot 180:sc= 0.0265 USER MOD Single : A 240 GLN : amide:sc= -6.01! C(o=-6!,f=-14!) USER MOD Single : A 243 LYS NZ :NH3+ -112:sc= -0.961 (180deg=-1.72!) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : B 473 SER OG : rot 180:sc= 0 USER MOD Single : B 478 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.322) USER MOD ----------------------------------------------------------------- ATOM 36 N TYR A 159 -4.461 -2.143 -3.970 1.00 70.35 N ATOM 37 CA TYR A 159 -4.450 -3.593 -3.859 1.00 4.03 C ATOM 38 C TYR A 159 -3.430 -4.209 -4.819 1.00 65.41 C ATOM 39 O TYR A 159 -3.082 -3.605 -5.831 1.00 74.53 O ATOM 40 CB TYR A 159 -5.852 -4.056 -4.258 1.00 23.45 C ATOM 41 CG TYR A 159 -6.911 -3.837 -3.176 1.00 21.43 C ATOM 42 CD1 TYR A 159 -6.699 -4.309 -1.897 1.00 24.53 C ATOM 43 CD2 TYR A 159 -8.080 -3.168 -3.479 1.00 10.44 C ATOM 44 CE1 TYR A 159 -7.696 -4.103 -0.878 1.00 33.34 C ATOM 45 CE2 TYR A 159 -9.076 -2.961 -2.461 1.00 23.55 C ATOM 46 CZ TYR A 159 -8.836 -3.439 -1.210 1.00 30.21 C ATOM 47 OH TYR A 159 -9.777 -3.244 -0.249 1.00 61.44 O ATOM 0 HA TYR A 159 -4.180 -3.899 -2.848 1.00 4.03 H new ATOM 0 HB2 TYR A 159 -6.155 -3.526 -5.161 1.00 23.45 H new ATOM 0 HB3 TYR A 159 -5.816 -5.116 -4.507 1.00 23.45 H new ATOM 0 HD1 TYR A 159 -5.785 -4.833 -1.660 1.00 24.53 H new ATOM 0 HD2 TYR A 159 -8.247 -2.800 -4.480 1.00 10.44 H new ATOM 0 HE1 TYR A 159 -7.542 -4.467 0.127 1.00 33.34 H new ATOM 0 HE2 TYR A 159 -9.994 -2.438 -2.685 1.00 23.55 H new ATOM 0 HH TYR A 159 -10.536 -2.755 -0.629 1.00 61.44 H new ATOM 56 N ALA A 160 -2.980 -5.404 -4.465 1.00 61.02 N ATOM 57 CA ALA A 160 -2.007 -6.109 -5.282 1.00 63.31 C ATOM 58 C ALA A 160 -2.638 -7.394 -5.824 1.00 43.45 C ATOM 59 O ALA A 160 -3.435 -8.034 -5.141 1.00 45.12 O ATOM 60 CB ALA A 160 -0.748 -6.381 -4.456 1.00 25.53 C ATOM 0 H ALA A 160 -3.271 -5.902 -3.624 1.00 61.02 H new ATOM 0 HA ALA A 160 -1.711 -5.501 -6.137 1.00 63.31 H new ATOM 0 HB1 ALA A 160 -0.018 -6.910 -5.069 1.00 25.53 H new ATOM 0 HB2 ALA A 160 -0.322 -5.436 -4.119 1.00 25.53 H new ATOM 0 HB3 ALA A 160 -1.006 -6.992 -3.591 1.00 25.53 H new ATOM 66 N ILE A 161 -2.257 -7.732 -7.046 1.00 54.14 N ATOM 67 CA ILE A 161 -2.774 -8.928 -7.688 1.00 33.41 C ATOM 68 C ILE A 161 -1.608 -9.758 -8.228 1.00 53.50 C ATOM 69 O ILE A 161 -0.717 -9.226 -8.889 1.00 72.20 O ATOM 70 CB ILE A 161 -3.811 -8.560 -8.751 1.00 33.14 C ATOM 71 CG1 ILE A 161 -4.848 -9.674 -8.914 1.00 70.01 C ATOM 72 CG2 ILE A 161 -3.135 -8.208 -10.078 1.00 3.43 C ATOM 73 CD1 ILE A 161 -4.280 -10.835 -9.732 1.00 51.01 C ATOM 0 H ILE A 161 -1.595 -7.198 -7.610 1.00 54.14 H new ATOM 0 HA ILE A 161 -3.300 -9.551 -6.964 1.00 33.41 H new ATOM 0 HB ILE A 161 -4.344 -7.670 -8.415 1.00 33.14 H new ATOM 0 HG12 ILE A 161 -5.159 -10.033 -7.933 1.00 70.01 H new ATOM 0 HG13 ILE A 161 -5.737 -9.279 -9.405 1.00 70.01 H new ATOM 0 HG21 ILE A 161 -3.895 -7.950 -10.816 1.00 3.43 H new ATOM 0 HG22 ILE A 161 -2.468 -7.359 -9.932 1.00 3.43 H new ATOM 0 HG23 ILE A 161 -2.561 -9.064 -10.432 1.00 3.43 H new ATOM 0 HD11 ILE A 161 -5.037 -11.613 -9.833 1.00 51.01 H new ATOM 0 HD12 ILE A 161 -3.993 -10.477 -10.721 1.00 51.01 H new ATOM 0 HD13 ILE A 161 -3.405 -11.243 -9.226 1.00 51.01 H new ATOM 84 N VAL A 162 -1.650 -11.047 -7.928 1.00 23.14 N ATOM 85 CA VAL A 162 -0.608 -11.956 -8.375 1.00 43.12 C ATOM 86 C VAL A 162 -1.005 -12.556 -9.725 1.00 14.21 C ATOM 87 O VAL A 162 -2.058 -13.180 -9.846 1.00 62.13 O ATOM 88 CB VAL A 162 -0.343 -13.016 -7.304 1.00 14.05 C ATOM 89 CG1 VAL A 162 0.096 -14.338 -7.938 1.00 24.12 C ATOM 90 CG2 VAL A 162 0.691 -12.524 -6.290 1.00 71.34 C ATOM 0 H VAL A 162 -2.390 -11.485 -7.380 1.00 23.14 H new ATOM 0 HA VAL A 162 0.330 -11.420 -8.521 1.00 43.12 H new ATOM 0 HB VAL A 162 -1.277 -13.194 -6.770 1.00 14.05 H new ATOM 0 HG11 VAL A 162 0.278 -15.074 -7.155 1.00 24.12 H new ATOM 0 HG12 VAL A 162 -0.688 -14.701 -8.602 1.00 24.12 H new ATOM 0 HG13 VAL A 162 1.011 -14.182 -8.509 1.00 24.12 H new ATOM 0 HG21 VAL A 162 0.861 -13.296 -5.540 1.00 71.34 H new ATOM 0 HG22 VAL A 162 1.627 -12.304 -6.803 1.00 71.34 H new ATOM 0 HG23 VAL A 162 0.323 -11.621 -5.804 1.00 71.34 H new ATOM 100 N LEU A 163 -0.141 -12.345 -10.708 1.00 24.35 N ATOM 101 CA LEU A 163 -0.388 -12.857 -12.044 1.00 2.04 C ATOM 102 C LEU A 163 0.385 -14.163 -12.236 1.00 10.10 C ATOM 103 O LEU A 163 0.127 -14.908 -13.181 1.00 70.10 O ATOM 104 CB LEU A 163 -0.068 -11.791 -13.094 1.00 60.44 C ATOM 105 CG LEU A 163 -0.184 -10.338 -12.632 1.00 11.21 C ATOM 106 CD1 LEU A 163 0.537 -9.396 -13.598 1.00 11.11 C ATOM 107 CD2 LEU A 163 -1.649 -9.942 -12.432 1.00 1.11 C ATOM 0 H LEU A 163 0.731 -11.826 -10.605 1.00 24.35 H new ATOM 0 HA LEU A 163 -1.445 -13.091 -12.174 1.00 2.04 H new ATOM 0 HB2 LEU A 163 0.948 -11.957 -13.453 1.00 60.44 H new ATOM 0 HB3 LEU A 163 -0.735 -11.935 -13.944 1.00 60.44 H new ATOM 0 HG LEU A 163 0.310 -10.247 -11.665 1.00 11.21 H new ATOM 0 HD11 LEU A 163 0.439 -8.369 -13.246 1.00 11.11 H new ATOM 0 HD12 LEU A 163 1.593 -9.664 -13.647 1.00 11.11 H new ATOM 0 HD13 LEU A 163 0.094 -9.483 -14.590 1.00 11.11 H new ATOM 0 HD21 LEU A 163 -1.704 -8.904 -12.103 1.00 1.11 H new ATOM 0 HD22 LEU A 163 -2.188 -10.054 -13.373 1.00 1.11 H new ATOM 0 HD23 LEU A 163 -2.100 -10.586 -11.677 1.00 1.11 H new ATOM 118 N TYR A 164 1.317 -14.401 -11.326 1.00 41.20 N ATOM 119 CA TYR A 164 2.129 -15.605 -11.383 1.00 52.43 C ATOM 120 C TYR A 164 2.443 -16.122 -9.979 1.00 24.25 C ATOM 121 O TYR A 164 2.415 -15.362 -9.012 1.00 24.02 O ATOM 122 CB TYR A 164 3.437 -15.198 -12.068 1.00 63.21 C ATOM 123 CG TYR A 164 3.274 -14.093 -13.113 1.00 52.15 C ATOM 124 CD1 TYR A 164 2.960 -14.417 -14.416 1.00 31.22 C ATOM 125 CD2 TYR A 164 3.443 -12.771 -12.752 1.00 52.32 C ATOM 126 CE1 TYR A 164 2.807 -13.377 -15.401 1.00 61.21 C ATOM 127 CE2 TYR A 164 3.290 -11.731 -13.736 1.00 50.35 C ATOM 128 CZ TYR A 164 2.980 -12.086 -15.012 1.00 40.43 C ATOM 129 OH TYR A 164 2.836 -11.103 -15.941 1.00 43.14 O ATOM 0 H TYR A 164 1.528 -13.781 -10.544 1.00 41.20 H new ATOM 0 HA TYR A 164 1.604 -16.397 -11.918 1.00 52.43 H new ATOM 0 HB2 TYR A 164 4.144 -14.864 -11.309 1.00 63.21 H new ATOM 0 HB3 TYR A 164 3.873 -16.075 -12.546 1.00 63.21 H new ATOM 0 HD1 TYR A 164 2.829 -15.451 -14.698 1.00 31.22 H new ATOM 0 HD2 TYR A 164 3.690 -12.517 -11.732 1.00 52.32 H new ATOM 0 HE1 TYR A 164 2.561 -13.617 -16.425 1.00 61.21 H new ATOM 0 HE2 TYR A 164 3.418 -10.693 -13.467 1.00 50.35 H new ATOM 0 HH TYR A 164 2.987 -10.231 -15.520 1.00 43.14 H new ATOM 138 N ASP A 165 2.734 -17.413 -9.909 1.00 1.45 N ATOM 139 CA ASP A 165 3.051 -18.042 -8.638 1.00 51.44 C ATOM 140 C ASP A 165 4.571 -18.157 -8.497 1.00 1.45 C ATOM 141 O ASP A 165 5.294 -18.129 -9.492 1.00 24.05 O ATOM 142 CB ASP A 165 2.461 -19.450 -8.557 1.00 32.45 C ATOM 143 CG ASP A 165 3.008 -20.317 -7.421 1.00 11.42 C ATOM 144 OD1 ASP A 165 3.080 -19.881 -6.264 1.00 45.04 O ATOM 145 OD2 ASP A 165 3.375 -21.504 -7.769 1.00 33.15 O ATOM 0 H ASP A 165 2.757 -18.041 -10.713 1.00 1.45 H new ATOM 0 HA ASP A 165 2.627 -17.428 -7.843 1.00 51.44 H new ATOM 0 HB2 ASP A 165 1.380 -19.369 -8.443 1.00 32.45 H new ATOM 0 HB3 ASP A 165 2.644 -19.959 -9.503 1.00 32.45 H new ATOM 150 N PHE A 166 5.009 -18.284 -7.253 1.00 12.22 N ATOM 151 CA PHE A 166 6.429 -18.403 -6.969 1.00 42.11 C ATOM 152 C PHE A 166 6.662 -19.012 -5.585 1.00 32.30 C ATOM 153 O PHE A 166 6.065 -18.575 -4.602 1.00 74.15 O ATOM 154 CB PHE A 166 7.011 -16.989 -6.995 1.00 0.24 C ATOM 155 CG PHE A 166 8.351 -16.853 -6.270 1.00 61.05 C ATOM 156 CD1 PHE A 166 9.274 -17.848 -6.357 1.00 54.45 C ATOM 157 CD2 PHE A 166 8.618 -15.739 -5.536 1.00 74.01 C ATOM 158 CE1 PHE A 166 10.519 -17.722 -5.683 1.00 1.02 C ATOM 159 CE2 PHE A 166 9.862 -15.614 -4.863 1.00 61.45 C ATOM 160 CZ PHE A 166 10.785 -16.608 -4.950 1.00 54.05 C ATOM 0 H PHE A 166 4.406 -18.307 -6.431 1.00 12.22 H new ATOM 0 HA PHE A 166 6.902 -19.051 -7.706 1.00 42.11 H new ATOM 0 HB2 PHE A 166 7.138 -16.679 -8.032 1.00 0.24 H new ATOM 0 HB3 PHE A 166 6.294 -16.304 -6.543 1.00 0.24 H new ATOM 0 HD1 PHE A 166 9.061 -18.733 -6.938 1.00 54.45 H new ATOM 0 HD2 PHE A 166 7.884 -14.950 -5.465 1.00 74.01 H new ATOM 0 HE1 PHE A 166 11.253 -18.511 -5.753 1.00 1.02 H new ATOM 0 HE2 PHE A 166 10.075 -14.729 -4.282 1.00 61.45 H new ATOM 0 HZ PHE A 166 11.730 -16.513 -4.437 1.00 54.05 H new ATOM 169 N LYS A 167 7.530 -20.012 -5.551 1.00 14.51 N ATOM 170 CA LYS A 167 7.850 -20.686 -4.304 1.00 3.32 C ATOM 171 C LYS A 167 8.596 -19.718 -3.384 1.00 63.02 C ATOM 172 O LYS A 167 9.656 -19.205 -3.743 1.00 30.44 O ATOM 173 CB LYS A 167 8.609 -21.985 -4.576 1.00 62.11 C ATOM 174 CG LYS A 167 7.811 -22.903 -5.505 1.00 41.32 C ATOM 175 CD LYS A 167 8.180 -24.370 -5.276 1.00 4.31 C ATOM 176 CE LYS A 167 7.504 -24.915 -4.015 1.00 14.21 C ATOM 177 NZ LYS A 167 6.041 -24.696 -4.077 1.00 60.02 N ATOM 0 H LYS A 167 8.022 -20.372 -6.368 1.00 14.51 H new ATOM 0 HA LYS A 167 6.938 -20.981 -3.785 1.00 3.32 H new ATOM 0 HB2 LYS A 167 9.576 -21.758 -5.026 1.00 62.11 H new ATOM 0 HB3 LYS A 167 8.808 -22.498 -3.635 1.00 62.11 H new ATOM 0 HG2 LYS A 167 6.744 -22.762 -5.333 1.00 41.32 H new ATOM 0 HG3 LYS A 167 8.005 -22.633 -6.543 1.00 41.32 H new ATOM 0 HD2 LYS A 167 7.879 -24.963 -6.140 1.00 4.31 H new ATOM 0 HD3 LYS A 167 9.262 -24.467 -5.184 1.00 4.31 H new ATOM 0 HE2 LYS A 167 7.715 -25.980 -3.913 1.00 14.21 H new ATOM 0 HE3 LYS A 167 7.915 -24.423 -3.133 1.00 14.21 H new ATOM 0 HZ1 LYS A 167 5.558 -25.410 -3.495 1.00 60.02 H new ATOM 0 HZ2 LYS A 167 5.817 -23.746 -3.718 1.00 60.02 H new ATOM 0 HZ3 LYS A 167 5.719 -24.778 -5.063 1.00 60.02 H new ATOM 186 N ALA A 168 8.015 -19.496 -2.214 1.00 1.03 N ATOM 187 CA ALA A 168 8.612 -18.599 -1.239 1.00 10.34 C ATOM 188 C ALA A 168 9.525 -19.399 -0.309 1.00 30.41 C ATOM 189 O ALA A 168 9.192 -20.517 0.083 1.00 3.41 O ATOM 190 CB ALA A 168 7.506 -17.862 -0.480 1.00 54.14 C ATOM 0 H ALA A 168 7.136 -19.922 -1.919 1.00 1.03 H new ATOM 0 HA ALA A 168 9.225 -17.846 -1.734 1.00 10.34 H new ATOM 0 HB1 ALA A 168 7.953 -17.189 0.252 1.00 54.14 H new ATOM 0 HB2 ALA A 168 6.904 -17.286 -1.183 1.00 54.14 H new ATOM 0 HB3 ALA A 168 6.872 -18.586 0.033 1.00 54.14 H new ATOM 196 N GLU A 169 10.658 -18.795 0.019 1.00 13.20 N ATOM 197 CA GLU A 169 11.622 -19.437 0.896 1.00 70.20 C ATOM 198 C GLU A 169 12.404 -18.386 1.685 1.00 62.41 C ATOM 199 O GLU A 169 13.497 -18.661 2.177 1.00 64.23 O ATOM 200 CB GLU A 169 12.566 -20.344 0.104 1.00 41.41 C ATOM 201 CG GLU A 169 13.239 -19.573 -1.033 1.00 14.42 C ATOM 202 CD GLU A 169 14.399 -20.375 -1.628 1.00 10.04 C ATOM 203 OE1 GLU A 169 15.556 -19.932 -1.565 1.00 11.24 O ATOM 204 OE2 GLU A 169 14.065 -21.497 -2.169 1.00 72.12 O ATOM 0 H GLU A 169 10.930 -17.868 -0.307 1.00 13.20 H new ATOM 0 HA GLU A 169 11.079 -20.064 1.603 1.00 70.20 H new ATOM 0 HB2 GLU A 169 13.325 -20.755 0.769 1.00 41.41 H new ATOM 0 HB3 GLU A 169 12.009 -21.188 -0.303 1.00 41.41 H new ATOM 0 HG2 GLU A 169 12.508 -19.353 -1.811 1.00 14.42 H new ATOM 0 HG3 GLU A 169 13.606 -18.617 -0.661 1.00 14.42 H new ATOM 210 N LYS A 170 11.814 -17.203 1.780 1.00 22.31 N ATOM 211 CA LYS A 170 12.443 -16.109 2.501 1.00 34.43 C ATOM 212 C LYS A 170 11.832 -16.010 3.901 1.00 52.35 C ATOM 213 O LYS A 170 11.000 -16.832 4.279 1.00 33.21 O ATOM 214 CB LYS A 170 12.348 -14.813 1.695 1.00 41.11 C ATOM 215 CG LYS A 170 12.240 -15.105 0.197 1.00 51.34 C ATOM 216 CD LYS A 170 10.794 -14.982 -0.284 1.00 25.31 C ATOM 217 CE LYS A 170 10.636 -15.542 -1.698 1.00 74.14 C ATOM 218 NZ LYS A 170 9.213 -15.532 -2.105 1.00 23.53 N ATOM 0 H LYS A 170 10.908 -16.978 1.370 1.00 22.31 H new ATOM 0 HA LYS A 170 13.508 -16.299 2.630 1.00 34.43 H new ATOM 0 HB2 LYS A 170 11.479 -14.241 2.021 1.00 41.11 H new ATOM 0 HB3 LYS A 170 13.226 -14.196 1.886 1.00 41.11 H new ATOM 0 HG2 LYS A 170 12.872 -14.412 -0.358 1.00 51.34 H new ATOM 0 HG3 LYS A 170 12.611 -16.109 -0.009 1.00 51.34 H new ATOM 0 HD2 LYS A 170 10.134 -15.517 0.398 1.00 25.31 H new ATOM 0 HD3 LYS A 170 10.490 -13.936 -0.268 1.00 25.31 H new ATOM 0 HE2 LYS A 170 11.224 -14.949 -2.398 1.00 74.14 H new ATOM 0 HE3 LYS A 170 11.024 -16.560 -1.738 1.00 74.14 H new ATOM 0 HZ1 LYS A 170 9.111 -16.008 -3.024 1.00 23.53 H new ATOM 0 HZ2 LYS A 170 8.644 -16.032 -1.392 1.00 23.53 H new ATOM 0 HZ3 LYS A 170 8.882 -14.549 -2.185 1.00 23.53 H new ATOM 227 N ALA A 171 12.271 -14.995 4.631 1.00 44.11 N ATOM 228 CA ALA A 171 11.778 -14.777 5.981 1.00 0.51 C ATOM 229 C ALA A 171 10.262 -14.574 5.939 1.00 13.21 C ATOM 230 O ALA A 171 9.563 -14.895 6.899 1.00 21.14 O ATOM 231 CB ALA A 171 12.509 -13.585 6.604 1.00 62.40 C ATOM 0 H ALA A 171 12.962 -14.315 4.314 1.00 44.11 H new ATOM 0 HA ALA A 171 11.977 -15.646 6.608 1.00 0.51 H new ATOM 0 HB1 ALA A 171 12.140 -13.421 7.616 1.00 62.40 H new ATOM 0 HB2 ALA A 171 13.579 -13.791 6.637 1.00 62.40 H new ATOM 0 HB3 ALA A 171 12.329 -12.693 6.003 1.00 62.40 H new ATOM 237 N ASP A 172 9.799 -14.042 4.818 1.00 14.10 N ATOM 238 CA ASP A 172 8.379 -13.792 4.639 1.00 34.52 C ATOM 239 C ASP A 172 7.810 -14.802 3.639 1.00 52.43 C ATOM 240 O ASP A 172 6.739 -14.585 3.073 1.00 43.21 O ATOM 241 CB ASP A 172 8.132 -12.388 4.084 1.00 75.13 C ATOM 242 CG ASP A 172 8.346 -11.251 5.085 1.00 43.53 C ATOM 243 OD1 ASP A 172 9.463 -10.732 5.233 1.00 3.13 O ATOM 244 OD2 ASP A 172 7.292 -10.895 5.739 1.00 13.52 O ATOM 0 H ASP A 172 10.382 -13.777 4.024 1.00 14.10 H new ATOM 0 HA ASP A 172 7.895 -13.886 5.611 1.00 34.52 H new ATOM 0 HB2 ASP A 172 8.791 -12.230 3.231 1.00 75.13 H new ATOM 0 HB3 ASP A 172 7.109 -12.336 3.711 1.00 75.13 H new ATOM 249 N GLU A 173 8.553 -15.883 3.452 1.00 34.41 N ATOM 250 CA GLU A 173 8.136 -16.927 2.530 1.00 3.01 C ATOM 251 C GLU A 173 6.617 -17.103 2.581 1.00 74.43 C ATOM 252 O GLU A 173 6.088 -17.691 3.523 1.00 41.43 O ATOM 253 CB GLU A 173 8.852 -18.244 2.834 1.00 2.20 C ATOM 254 CG GLU A 173 8.802 -18.564 4.329 1.00 24.02 C ATOM 255 CD GLU A 173 9.931 -19.516 4.725 1.00 70.15 C ATOM 256 OE1 GLU A 173 11.012 -19.482 4.118 1.00 31.34 O ATOM 257 OE2 GLU A 173 9.656 -20.312 5.702 1.00 74.21 O ATOM 0 H GLU A 173 9.441 -16.059 3.923 1.00 34.41 H new ATOM 0 HA GLU A 173 8.413 -16.626 1.520 1.00 3.01 H new ATOM 0 HB2 GLU A 173 8.388 -19.053 2.270 1.00 2.20 H new ATOM 0 HB3 GLU A 173 9.890 -18.182 2.507 1.00 2.20 H new ATOM 0 HG2 GLU A 173 8.881 -17.642 4.905 1.00 24.02 H new ATOM 0 HG3 GLU A 173 7.840 -19.013 4.576 1.00 24.02 H new ATOM 263 N LEU A 174 5.958 -16.585 1.555 1.00 51.52 N ATOM 264 CA LEU A 174 4.511 -16.678 1.471 1.00 34.31 C ATOM 265 C LEU A 174 4.105 -16.939 0.019 1.00 34.54 C ATOM 266 O LEU A 174 3.977 -16.006 -0.772 1.00 22.32 O ATOM 267 CB LEU A 174 3.858 -15.434 2.078 1.00 33.42 C ATOM 268 CG LEU A 174 2.443 -15.623 2.630 1.00 61.30 C ATOM 269 CD1 LEU A 174 1.395 -15.444 1.530 1.00 44.34 C ATOM 270 CD2 LEU A 174 2.306 -16.972 3.338 1.00 62.05 C ATOM 0 H LEU A 174 6.400 -16.099 0.775 1.00 51.52 H new ATOM 0 HA LEU A 174 4.148 -17.520 2.061 1.00 34.31 H new ATOM 0 HB2 LEU A 174 4.495 -15.069 2.883 1.00 33.42 H new ATOM 0 HB3 LEU A 174 3.829 -14.655 1.317 1.00 33.42 H new ATOM 0 HG LEU A 174 2.262 -14.848 3.375 1.00 61.30 H new ATOM 0 HD11 LEU A 174 0.399 -15.584 1.950 1.00 44.34 H new ATOM 0 HD12 LEU A 174 1.475 -14.441 1.111 1.00 44.34 H new ATOM 0 HD13 LEU A 174 1.564 -16.180 0.744 1.00 44.34 H new ATOM 0 HD21 LEU A 174 1.291 -17.081 3.721 1.00 62.05 H new ATOM 0 HD22 LEU A 174 2.516 -17.776 2.633 1.00 62.05 H new ATOM 0 HD23 LEU A 174 3.013 -17.022 4.166 1.00 62.05 H new ATOM 281 N THR A 175 3.914 -18.214 -0.288 1.00 21.13 N ATOM 282 CA THR A 175 3.525 -18.611 -1.632 1.00 24.01 C ATOM 283 C THR A 175 2.156 -18.026 -1.984 1.00 61.03 C ATOM 284 O THR A 175 1.343 -17.761 -1.100 1.00 45.13 O ATOM 285 CB THR A 175 3.572 -20.138 -1.705 1.00 15.41 C ATOM 286 OG1 THR A 175 4.371 -20.405 -2.855 1.00 62.24 O ATOM 287 CG2 THR A 175 2.211 -20.749 -2.048 1.00 62.13 C ATOM 0 H THR A 175 4.021 -18.986 0.370 1.00 21.13 H new ATOM 0 HA THR A 175 4.214 -18.215 -2.378 1.00 24.01 H new ATOM 0 HB THR A 175 3.920 -20.537 -0.752 1.00 15.41 H new ATOM 0 HG1 THR A 175 4.455 -21.374 -2.977 1.00 62.24 H new ATOM 0 HG21 THR A 175 2.299 -21.835 -2.087 1.00 62.13 H new ATOM 0 HG22 THR A 175 1.485 -20.471 -1.284 1.00 62.13 H new ATOM 0 HG23 THR A 175 1.879 -20.377 -3.017 1.00 62.13 H new ATOM 295 N THR A 176 1.942 -17.843 -3.279 1.00 30.42 N ATOM 296 CA THR A 176 0.685 -17.296 -3.759 1.00 12.12 C ATOM 297 C THR A 176 0.438 -17.720 -5.209 1.00 42.43 C ATOM 298 O THR A 176 1.030 -17.164 -6.132 1.00 54.14 O ATOM 299 CB THR A 176 0.727 -15.779 -3.569 1.00 13.55 C ATOM 300 OG1 THR A 176 1.105 -15.609 -2.206 1.00 63.04 O ATOM 301 CG2 THR A 176 -0.660 -15.139 -3.654 1.00 20.12 C ATOM 0 H THR A 176 2.618 -18.064 -4.010 1.00 30.42 H new ATOM 0 HA THR A 176 -0.159 -17.686 -3.191 1.00 12.12 H new ATOM 0 HB THR A 176 1.377 -15.337 -4.324 1.00 13.55 H new ATOM 0 HG1 THR A 176 0.696 -16.314 -1.663 1.00 63.04 H new ATOM 0 HG21 THR A 176 -0.573 -14.062 -3.512 1.00 20.12 H new ATOM 0 HG22 THR A 176 -1.095 -15.342 -4.632 1.00 20.12 H new ATOM 0 HG23 THR A 176 -1.301 -15.556 -2.878 1.00 20.12 H new ATOM 309 N TYR A 177 -0.438 -18.702 -5.363 1.00 44.11 N ATOM 310 CA TYR A 177 -0.771 -19.207 -6.684 1.00 43.04 C ATOM 311 C TYR A 177 -0.983 -18.059 -7.673 1.00 64.03 C ATOM 312 O TYR A 177 -1.220 -16.922 -7.268 1.00 31.51 O ATOM 313 CB TYR A 177 -2.084 -19.976 -6.523 1.00 1.41 C ATOM 314 CG TYR A 177 -1.904 -21.438 -6.113 1.00 62.34 C ATOM 315 CD1 TYR A 177 -1.726 -22.409 -7.077 1.00 40.01 C ATOM 316 CD2 TYR A 177 -1.918 -21.786 -4.777 1.00 70.41 C ATOM 317 CE1 TYR A 177 -1.555 -23.786 -6.691 1.00 2.44 C ATOM 318 CE2 TYR A 177 -1.747 -23.164 -4.391 1.00 21.04 C ATOM 319 CZ TYR A 177 -1.575 -24.095 -5.367 1.00 65.25 C ATOM 320 OH TYR A 177 -1.414 -25.395 -5.001 1.00 32.15 O ATOM 0 H TYR A 177 -0.927 -19.161 -4.595 1.00 44.11 H new ATOM 0 HA TYR A 177 0.034 -19.832 -7.070 1.00 43.04 H new ATOM 0 HB2 TYR A 177 -2.698 -19.473 -5.776 1.00 1.41 H new ATOM 0 HB3 TYR A 177 -2.633 -19.938 -7.464 1.00 1.41 H new ATOM 0 HD1 TYR A 177 -1.715 -22.136 -8.122 1.00 40.01 H new ATOM 0 HD2 TYR A 177 -2.057 -21.026 -4.022 1.00 70.41 H new ATOM 0 HE1 TYR A 177 -1.414 -24.555 -7.436 1.00 2.44 H new ATOM 0 HE2 TYR A 177 -1.755 -23.451 -3.350 1.00 21.04 H new ATOM 0 HH TYR A 177 -1.449 -25.467 -4.024 1.00 32.15 H new ATOM 329 N VAL A 178 -0.890 -18.397 -8.951 1.00 44.24 N ATOM 330 CA VAL A 178 -1.068 -17.408 -10.000 1.00 12.13 C ATOM 331 C VAL A 178 -2.486 -16.838 -9.922 1.00 33.14 C ATOM 332 O VAL A 178 -3.382 -17.466 -9.359 1.00 74.34 O ATOM 333 CB VAL A 178 -0.747 -18.026 -11.362 1.00 33.50 C ATOM 334 CG1 VAL A 178 0.468 -18.953 -11.271 1.00 3.34 C ATOM 335 CG2 VAL A 178 -1.961 -18.768 -11.928 1.00 65.23 C ATOM 0 H VAL A 178 -0.694 -19.341 -9.283 1.00 44.24 H new ATOM 0 HA VAL A 178 -0.375 -16.578 -9.863 1.00 12.13 H new ATOM 0 HB VAL A 178 -0.500 -17.215 -12.048 1.00 33.50 H new ATOM 0 HG11 VAL A 178 0.675 -19.379 -12.253 1.00 3.34 H new ATOM 0 HG12 VAL A 178 1.334 -18.385 -10.932 1.00 3.34 H new ATOM 0 HG13 VAL A 178 0.261 -19.756 -10.563 1.00 3.34 H new ATOM 0 HG21 VAL A 178 -1.706 -19.198 -12.897 1.00 65.23 H new ATOM 0 HG22 VAL A 178 -2.252 -19.564 -11.243 1.00 65.23 H new ATOM 0 HG23 VAL A 178 -2.790 -18.071 -12.048 1.00 65.23 H new ATOM 345 N GLY A 179 -2.646 -15.654 -10.495 1.00 71.20 N ATOM 346 CA GLY A 179 -3.940 -14.992 -10.497 1.00 13.31 C ATOM 347 C GLY A 179 -4.546 -14.970 -9.093 1.00 0.23 C ATOM 348 O GLY A 179 -5.606 -15.550 -8.861 1.00 20.12 O ATOM 0 H GLY A 179 -1.901 -15.136 -10.961 1.00 71.20 H new ATOM 0 HA2 GLY A 179 -3.830 -13.972 -10.866 1.00 13.31 H new ATOM 0 HA3 GLY A 179 -4.615 -15.507 -11.180 1.00 13.31 H new ATOM 352 N GLU A 180 -3.848 -14.293 -8.193 1.00 2.42 N ATOM 353 CA GLU A 180 -4.305 -14.187 -6.817 1.00 55.41 C ATOM 354 C GLU A 180 -4.559 -12.723 -6.453 1.00 11.31 C ATOM 355 O GLU A 180 -4.131 -11.818 -7.170 1.00 63.43 O ATOM 356 CB GLU A 180 -3.301 -14.825 -5.855 1.00 54.41 C ATOM 357 CG GLU A 180 -4.017 -15.519 -4.696 1.00 63.43 C ATOM 358 CD GLU A 180 -5.017 -16.556 -5.211 1.00 71.21 C ATOM 359 OE1 GLU A 180 -4.711 -17.294 -6.159 1.00 64.41 O ATOM 360 OE2 GLU A 180 -6.146 -16.580 -4.588 1.00 12.34 O ATOM 0 H GLU A 180 -2.970 -13.813 -8.389 1.00 2.42 H new ATOM 0 HA GLU A 180 -5.244 -14.732 -6.724 1.00 55.41 H new ATOM 0 HB2 GLU A 180 -2.686 -15.547 -6.392 1.00 54.41 H new ATOM 0 HB3 GLU A 180 -2.628 -14.061 -5.466 1.00 54.41 H new ATOM 0 HG2 GLU A 180 -3.285 -16.004 -4.050 1.00 63.43 H new ATOM 0 HG3 GLU A 180 -4.537 -14.778 -4.089 1.00 63.43 H new ATOM 366 N ASN A 181 -5.254 -12.534 -5.341 1.00 51.12 N ATOM 367 CA ASN A 181 -5.569 -11.194 -4.874 1.00 32.31 C ATOM 368 C ASN A 181 -5.038 -11.018 -3.451 1.00 43.43 C ATOM 369 O ASN A 181 -5.385 -11.784 -2.554 1.00 12.01 O ATOM 370 CB ASN A 181 -7.081 -10.963 -4.846 1.00 33.43 C ATOM 371 CG ASN A 181 -7.686 -11.117 -6.243 1.00 74.11 C ATOM 372 OD1 ASN A 181 -7.347 -10.147 -7.089 1.00 33.43 O flip ATOM 373 ND2 ASN A 181 -8.411 -12.053 -6.535 1.00 21.33 N flip ATOM 0 H ASN A 181 -5.608 -13.286 -4.750 1.00 51.12 H new ATOM 0 HA ASN A 181 -5.107 -10.481 -5.557 1.00 32.31 H new ATOM 0 HB2 ASN A 181 -7.548 -11.673 -4.163 1.00 33.43 H new ATOM 0 HB3 ASN A 181 -7.293 -9.965 -4.462 1.00 33.43 H new ATOM 0 HD21 ASN A 181 -8.632 -12.764 -5.838 1.00 21.33 H new ATOM 0 HD22 ASN A 181 -8.797 -12.125 -7.477 1.00 21.33 H new ATOM 379 N LEU A 182 -4.203 -10.001 -3.287 1.00 33.24 N ATOM 380 CA LEU A 182 -3.620 -9.714 -1.987 1.00 14.12 C ATOM 381 C LEU A 182 -3.550 -8.198 -1.789 1.00 1.23 C ATOM 382 O LEU A 182 -3.511 -7.443 -2.759 1.00 51.23 O ATOM 383 CB LEU A 182 -2.268 -10.415 -1.840 1.00 64.21 C ATOM 384 CG LEU A 182 -1.560 -10.788 -3.144 1.00 41.42 C ATOM 385 CD1 LEU A 182 -1.602 -9.629 -4.141 1.00 1.23 C ATOM 386 CD2 LEU A 182 -0.129 -11.260 -2.875 1.00 33.41 C ATOM 0 H LEU A 182 -3.917 -9.366 -4.032 1.00 33.24 H new ATOM 0 HA LEU A 182 -4.249 -10.113 -1.191 1.00 14.12 H new ATOM 0 HB2 LEU A 182 -1.607 -9.768 -1.263 1.00 64.21 H new ATOM 0 HB3 LEU A 182 -2.414 -11.324 -1.256 1.00 64.21 H new ATOM 0 HG LEU A 182 -2.095 -11.623 -3.597 1.00 41.42 H new ATOM 0 HD11 LEU A 182 -1.092 -9.920 -5.059 1.00 1.23 H new ATOM 0 HD12 LEU A 182 -2.639 -9.380 -4.365 1.00 1.23 H new ATOM 0 HD13 LEU A 182 -1.105 -8.760 -3.710 1.00 1.23 H new ATOM 0 HD21 LEU A 182 0.352 -11.519 -3.818 1.00 33.41 H new ATOM 0 HD22 LEU A 182 0.432 -10.462 -2.389 1.00 33.41 H new ATOM 0 HD23 LEU A 182 -0.151 -12.136 -2.226 1.00 33.41 H new ATOM 397 N PHE A 183 -3.539 -7.799 -0.525 1.00 14.32 N ATOM 398 CA PHE A 183 -3.475 -6.387 -0.188 1.00 2.11 C ATOM 399 C PHE A 183 -2.115 -6.028 0.413 1.00 50.05 C ATOM 400 O PHE A 183 -1.782 -6.467 1.513 1.00 41.22 O ATOM 401 CB PHE A 183 -4.564 -6.128 0.856 1.00 32.11 C ATOM 402 CG PHE A 183 -4.349 -4.855 1.676 1.00 1.35 C ATOM 403 CD1 PHE A 183 -3.604 -4.896 2.812 1.00 1.01 C ATOM 404 CD2 PHE A 183 -4.904 -3.681 1.269 1.00 32.50 C ATOM 405 CE1 PHE A 183 -3.404 -3.713 3.574 1.00 73.51 C ATOM 406 CE2 PHE A 183 -4.704 -2.500 2.030 1.00 64.01 C ATOM 407 CZ PHE A 183 -3.958 -2.541 3.166 1.00 24.34 C ATOM 0 H PHE A 183 -3.573 -8.428 0.277 1.00 14.32 H new ATOM 0 HA PHE A 183 -3.617 -5.783 -1.084 1.00 2.11 H new ATOM 0 HB2 PHE A 183 -5.528 -6.065 0.352 1.00 32.11 H new ATOM 0 HB3 PHE A 183 -4.614 -6.980 1.534 1.00 32.11 H new ATOM 0 HD1 PHE A 183 -3.164 -5.828 3.136 1.00 1.01 H new ATOM 0 HD2 PHE A 183 -5.497 -3.648 0.367 1.00 32.50 H new ATOM 0 HE1 PHE A 183 -2.812 -3.745 4.477 1.00 73.51 H new ATOM 0 HE2 PHE A 183 -5.144 -1.568 1.707 1.00 64.01 H new ATOM 0 HZ PHE A 183 -3.806 -1.642 3.744 1.00 24.34 H new ATOM 416 N ILE A 184 -1.364 -5.233 -0.336 1.00 22.21 N ATOM 417 CA ILE A 184 -0.047 -4.809 0.109 1.00 34.40 C ATOM 418 C ILE A 184 -0.198 -3.817 1.263 1.00 32.12 C ATOM 419 O ILE A 184 -1.198 -3.104 1.348 1.00 71.25 O ATOM 420 CB ILE A 184 0.766 -4.265 -1.067 1.00 33.43 C ATOM 421 CG1 ILE A 184 1.322 -5.405 -1.923 1.00 32.15 C ATOM 422 CG2 ILE A 184 1.869 -3.323 -0.582 1.00 2.35 C ATOM 423 CD1 ILE A 184 1.887 -4.875 -3.242 1.00 12.42 C ATOM 0 H ILE A 184 -1.643 -4.871 -1.248 1.00 22.21 H new ATOM 0 HA ILE A 184 0.518 -5.659 0.491 1.00 34.40 H new ATOM 0 HB ILE A 184 0.099 -3.681 -1.702 1.00 33.43 H new ATOM 0 HG12 ILE A 184 2.103 -5.930 -1.373 1.00 32.15 H new ATOM 0 HG13 ILE A 184 0.534 -6.130 -2.126 1.00 32.15 H new ATOM 0 HG21 ILE A 184 2.432 -2.951 -1.438 1.00 2.35 H new ATOM 0 HG22 ILE A 184 1.422 -2.484 -0.048 1.00 2.35 H new ATOM 0 HG23 ILE A 184 2.540 -3.862 0.087 1.00 2.35 H new ATOM 0 HD11 ILE A 184 2.276 -5.706 -3.831 1.00 12.42 H new ATOM 0 HD12 ILE A 184 1.097 -4.372 -3.800 1.00 12.42 H new ATOM 0 HD13 ILE A 184 2.691 -4.169 -3.036 1.00 12.42 H new ATOM 434 N CYS A 185 0.809 -3.802 2.124 1.00 20.53 N ATOM 435 CA CYS A 185 0.800 -2.910 3.270 1.00 54.33 C ATOM 436 C CYS A 185 2.214 -2.353 3.456 1.00 33.43 C ATOM 437 O CYS A 185 2.388 -1.159 3.696 1.00 74.45 O ATOM 438 CB CYS A 185 0.293 -3.612 4.531 1.00 41.14 C ATOM 439 SG CYS A 185 -0.522 -2.403 5.636 1.00 63.11 S ATOM 0 H CYS A 185 1.637 -4.394 2.051 1.00 20.53 H new ATOM 0 HA CYS A 185 0.107 -2.088 3.088 1.00 54.33 H new ATOM 0 HB2 CYS A 185 -0.409 -4.401 4.261 1.00 41.14 H new ATOM 0 HB3 CYS A 185 1.124 -4.089 5.050 1.00 41.14 H new ATOM 0 HG CYS A 185 0.165 -2.287 6.734 1.00 63.11 H new ATOM 444 N ALA A 186 3.187 -3.245 3.338 1.00 35.24 N ATOM 445 CA ALA A 186 4.579 -2.858 3.489 1.00 52.00 C ATOM 446 C ALA A 186 5.289 -2.986 2.140 1.00 21.11 C ATOM 447 O ALA A 186 4.757 -3.590 1.209 1.00 43.21 O ATOM 448 CB ALA A 186 5.231 -3.715 4.575 1.00 61.44 C ATOM 0 H ALA A 186 3.038 -4.234 3.140 1.00 35.24 H new ATOM 0 HA ALA A 186 4.656 -1.817 3.804 1.00 52.00 H new ATOM 0 HB1 ALA A 186 6.276 -3.425 4.689 1.00 61.44 H new ATOM 0 HB2 ALA A 186 4.708 -3.565 5.519 1.00 61.44 H new ATOM 0 HB3 ALA A 186 5.175 -4.766 4.292 1.00 61.44 H new ATOM 454 N HIS A 187 6.480 -2.409 2.077 1.00 34.34 N ATOM 455 CA HIS A 187 7.269 -2.451 0.857 1.00 4.05 C ATOM 456 C HIS A 187 8.739 -2.189 1.187 1.00 42.53 C ATOM 457 O HIS A 187 9.048 -1.470 2.138 1.00 32.41 O ATOM 458 CB HIS A 187 6.712 -1.476 -0.184 1.00 25.54 C ATOM 459 CG HIS A 187 7.269 -0.077 -0.075 1.00 52.15 C ATOM 460 ND1 HIS A 187 8.306 0.381 -0.868 1.00 73.45 N ATOM 461 CD2 HIS A 187 6.922 0.959 0.741 1.00 24.11 C ATOM 462 CE1 HIS A 187 8.565 1.636 -0.536 1.00 60.21 C ATOM 463 NE2 HIS A 187 7.706 1.993 0.462 1.00 14.33 N ATOM 0 H HIS A 187 6.918 -1.910 2.851 1.00 34.34 H new ATOM 0 HA HIS A 187 7.204 -3.444 0.412 1.00 4.05 H new ATOM 0 HB2 HIS A 187 6.924 -1.864 -1.180 1.00 25.54 H new ATOM 0 HB3 HIS A 187 5.628 -1.433 -0.083 1.00 25.54 H new ATOM 0 HD2 HIS A 187 6.142 0.941 1.488 1.00 24.11 H new ATOM 0 HE1 HIS A 187 9.323 2.266 -0.977 1.00 60.21 H new ATOM 0 HE2 HIS A 187 7.672 2.904 0.919 1.00 14.33 H new ATOM 471 N HIS A 188 9.608 -2.784 0.385 1.00 31.11 N ATOM 472 CA HIS A 188 11.039 -2.624 0.579 1.00 64.41 C ATOM 473 C HIS A 188 11.734 -2.520 -0.780 1.00 23.20 C ATOM 474 O HIS A 188 11.465 -3.312 -1.681 1.00 62.44 O ATOM 475 CB HIS A 188 11.599 -3.755 1.446 1.00 45.41 C ATOM 476 CG HIS A 188 10.542 -4.656 2.037 1.00 30.42 C ATOM 477 ND1 HIS A 188 10.521 -6.025 1.826 1.00 21.04 N ATOM 478 CD2 HIS A 188 9.472 -4.373 2.834 1.00 60.21 C ATOM 479 CE1 HIS A 188 9.480 -6.531 2.470 1.00 63.22 C ATOM 480 NE2 HIS A 188 8.830 -5.506 3.095 1.00 54.44 N ATOM 0 H HIS A 188 9.349 -3.379 -0.402 1.00 31.11 H new ATOM 0 HA HIS A 188 11.235 -1.698 1.119 1.00 64.41 H new ATOM 0 HB2 HIS A 188 12.280 -4.357 0.844 1.00 45.41 H new ATOM 0 HB3 HIS A 188 12.187 -3.322 2.255 1.00 45.41 H new ATOM 0 HD1 HIS A 188 11.193 -6.553 1.269 1.00 21.04 H new ATOM 0 HD2 HIS A 188 9.194 -3.393 3.192 1.00 60.21 H new ATOM 0 HE1 HIS A 188 9.195 -7.572 2.496 1.00 63.22 H new ATOM 487 N ASN A 189 12.614 -1.535 -0.883 1.00 55.20 N ATOM 488 CA ASN A 189 13.349 -1.316 -2.117 1.00 13.40 C ATOM 489 C ASN A 189 12.371 -1.308 -3.294 1.00 52.01 C ATOM 490 O ASN A 189 12.726 -1.703 -4.404 1.00 41.34 O ATOM 491 CB ASN A 189 14.368 -2.432 -2.357 1.00 41.24 C ATOM 492 CG ASN A 189 15.516 -2.352 -1.348 1.00 30.21 C ATOM 493 OD1 ASN A 189 15.711 -1.358 -0.668 1.00 74.53 O ATOM 494 ND2 ASN A 189 16.261 -3.452 -1.289 1.00 51.12 N ATOM 0 H ASN A 189 12.834 -0.880 -0.133 1.00 55.20 H new ATOM 0 HA ASN A 189 13.871 -0.363 -2.033 1.00 13.40 H new ATOM 0 HB2 ASN A 189 13.876 -3.402 -2.278 1.00 41.24 H new ATOM 0 HB3 ASN A 189 14.763 -2.357 -3.370 1.00 41.24 H new ATOM 0 HD21 ASN A 189 17.051 -3.499 -0.646 1.00 51.12 H new ATOM 0 HD22 ASN A 189 16.042 -4.249 -1.887 1.00 51.12 H new ATOM 500 N CYS A 190 11.159 -0.854 -3.012 1.00 10.21 N ATOM 501 CA CYS A 190 10.128 -0.790 -4.033 1.00 11.22 C ATOM 502 C CYS A 190 10.251 -2.030 -4.920 1.00 74.31 C ATOM 503 O CYS A 190 10.007 -1.964 -6.124 1.00 73.04 O ATOM 504 CB CYS A 190 10.216 0.503 -4.845 1.00 14.41 C ATOM 505 SG CYS A 190 11.943 0.791 -5.379 1.00 62.41 S ATOM 0 H CYS A 190 10.868 -0.527 -2.091 1.00 10.21 H new ATOM 0 HA CYS A 190 9.146 -0.779 -3.560 1.00 11.22 H new ATOM 0 HB2 CYS A 190 9.563 0.440 -5.716 1.00 14.41 H new ATOM 0 HB3 CYS A 190 9.867 1.343 -4.245 1.00 14.41 H new ATOM 0 HG CYS A 190 12.572 -0.345 -5.446 1.00 62.41 H new ATOM 510 N GLU A 191 10.630 -3.133 -4.290 1.00 54.13 N ATOM 511 CA GLU A 191 10.789 -4.386 -5.007 1.00 35.41 C ATOM 512 C GLU A 191 10.011 -5.502 -4.306 1.00 21.35 C ATOM 513 O GLU A 191 9.401 -6.345 -4.961 1.00 74.12 O ATOM 514 CB GLU A 191 12.267 -4.755 -5.148 1.00 43.22 C ATOM 515 CG GLU A 191 12.443 -5.988 -6.035 1.00 74.12 C ATOM 516 CD GLU A 191 13.745 -5.907 -6.835 1.00 54.14 C ATOM 517 OE1 GLU A 191 13.721 -6.011 -8.070 1.00 12.11 O ATOM 518 OE2 GLU A 191 14.809 -5.727 -6.128 1.00 53.41 O ATOM 0 H GLU A 191 10.831 -3.184 -3.291 1.00 54.13 H new ATOM 0 HA GLU A 191 10.382 -4.260 -6.010 1.00 35.41 H new ATOM 0 HB2 GLU A 191 12.816 -3.915 -5.574 1.00 43.22 H new ATOM 0 HB3 GLU A 191 12.693 -4.948 -4.163 1.00 43.22 H new ATOM 0 HG2 GLU A 191 12.446 -6.887 -5.418 1.00 74.12 H new ATOM 0 HG3 GLU A 191 11.597 -6.073 -6.717 1.00 74.12 H new ATOM 524 N TRP A 192 10.056 -5.469 -2.982 1.00 63.12 N ATOM 525 CA TRP A 192 9.362 -6.466 -2.184 1.00 54.34 C ATOM 526 C TRP A 192 8.207 -5.773 -1.459 1.00 52.54 C ATOM 527 O TRP A 192 8.412 -4.773 -0.772 1.00 70.01 O ATOM 528 CB TRP A 192 10.328 -7.174 -1.231 1.00 32.00 C ATOM 529 CG TRP A 192 11.339 -8.085 -1.931 1.00 22.35 C ATOM 530 CD1 TRP A 192 12.620 -7.826 -2.222 1.00 62.45 C ATOM 531 CD2 TRP A 192 11.096 -9.421 -2.420 1.00 54.23 C ATOM 532 NE1 TRP A 192 13.220 -8.893 -2.859 1.00 11.12 N ATOM 533 CE2 TRP A 192 12.264 -9.894 -2.984 1.00 3.12 C ATOM 534 CE3 TRP A 192 9.929 -10.205 -2.387 1.00 1.01 C ATOM 535 CZ2 TRP A 192 12.378 -11.166 -3.557 1.00 64.05 C ATOM 536 CZ3 TRP A 192 10.060 -11.473 -2.964 1.00 21.53 C ATOM 537 CH2 TRP A 192 11.228 -11.964 -3.536 1.00 60.13 C ATOM 0 H TRP A 192 10.562 -4.767 -2.442 1.00 63.12 H new ATOM 0 HA TRP A 192 8.952 -7.251 -2.819 1.00 54.34 H new ATOM 0 HB2 TRP A 192 10.869 -6.423 -0.655 1.00 32.00 H new ATOM 0 HB3 TRP A 192 9.752 -7.767 -0.520 1.00 32.00 H new ATOM 0 HD1 TRP A 192 13.121 -6.898 -1.988 1.00 62.45 H new ATOM 0 HE1 TRP A 192 14.187 -8.939 -3.179 1.00 11.12 H new ATOM 0 HE3 TRP A 192 9.005 -9.856 -1.951 1.00 1.01 H new ATOM 0 HZ2 TRP A 192 13.304 -11.513 -3.992 1.00 64.05 H new ATOM 0 HZ3 TRP A 192 9.192 -12.116 -2.965 1.00 21.53 H new ATOM 0 HH2 TRP A 192 11.248 -12.956 -3.962 1.00 60.13 H new ATOM 547 N PHE A 193 7.019 -6.330 -1.638 1.00 65.12 N ATOM 548 CA PHE A 193 5.832 -5.777 -1.009 1.00 21.44 C ATOM 549 C PHE A 193 5.204 -6.784 -0.044 1.00 24.12 C ATOM 550 O PHE A 193 5.016 -7.949 -0.390 1.00 54.10 O ATOM 551 CB PHE A 193 4.834 -5.473 -2.128 1.00 10.53 C ATOM 552 CG PHE A 193 5.322 -4.420 -3.127 1.00 24.44 C ATOM 553 CD1 PHE A 193 6.366 -3.611 -2.806 1.00 42.00 C ATOM 554 CD2 PHE A 193 4.711 -4.295 -4.335 1.00 13.34 C ATOM 555 CE1 PHE A 193 6.819 -2.635 -3.732 1.00 0.33 C ATOM 556 CE2 PHE A 193 5.163 -3.318 -5.262 1.00 73.52 C ATOM 557 CZ PHE A 193 6.208 -2.509 -4.941 1.00 24.03 C ATOM 0 H PHE A 193 6.853 -7.158 -2.209 1.00 65.12 H new ATOM 0 HA PHE A 193 6.093 -4.884 -0.442 1.00 21.44 H new ATOM 0 HB2 PHE A 193 4.614 -6.395 -2.666 1.00 10.53 H new ATOM 0 HB3 PHE A 193 3.899 -5.132 -1.684 1.00 10.53 H new ATOM 0 HD1 PHE A 193 6.851 -3.711 -1.846 1.00 42.00 H new ATOM 0 HD2 PHE A 193 3.882 -4.938 -4.590 1.00 13.34 H new ATOM 0 HE1 PHE A 193 7.649 -1.992 -3.477 1.00 0.33 H new ATOM 0 HE2 PHE A 193 4.677 -3.218 -6.221 1.00 73.52 H new ATOM 0 HZ PHE A 193 6.553 -1.767 -5.646 1.00 24.03 H new ATOM 566 N ILE A 194 4.896 -6.299 1.150 1.00 5.35 N ATOM 567 CA ILE A 194 4.293 -7.141 2.169 1.00 45.22 C ATOM 568 C ILE A 194 2.774 -6.956 2.144 1.00 31.51 C ATOM 569 O ILE A 194 2.259 -5.951 2.631 1.00 64.52 O ATOM 570 CB ILE A 194 4.923 -6.863 3.535 1.00 73.53 C ATOM 571 CG1 ILE A 194 6.450 -6.832 3.439 1.00 34.43 C ATOM 572 CG2 ILE A 194 4.436 -7.872 4.578 1.00 4.42 C ATOM 573 CD1 ILE A 194 7.016 -8.240 3.240 1.00 44.30 C ATOM 0 H ILE A 194 5.053 -5.332 1.435 1.00 5.35 H new ATOM 0 HA ILE A 194 4.490 -8.192 1.960 1.00 45.22 H new ATOM 0 HB ILE A 194 4.601 -5.875 3.865 1.00 73.53 H new ATOM 0 HG12 ILE A 194 6.753 -6.194 2.609 1.00 34.43 H new ATOM 0 HG13 ILE A 194 6.866 -6.394 4.346 1.00 34.43 H new ATOM 0 HG21 ILE A 194 4.899 -7.653 5.540 1.00 4.42 H new ATOM 0 HG22 ILE A 194 3.352 -7.803 4.672 1.00 4.42 H new ATOM 0 HG23 ILE A 194 4.710 -8.880 4.265 1.00 4.42 H new ATOM 0 HD11 ILE A 194 8.103 -8.189 3.175 1.00 44.30 H new ATOM 0 HD12 ILE A 194 6.732 -8.869 4.084 1.00 44.30 H new ATOM 0 HD13 ILE A 194 6.617 -8.666 2.319 1.00 44.30 H new ATOM 584 N ALA A 195 2.100 -7.942 1.570 1.00 73.31 N ATOM 585 CA ALA A 195 0.650 -7.902 1.475 1.00 53.43 C ATOM 586 C ALA A 195 0.054 -8.983 2.379 1.00 0.34 C ATOM 587 O ALA A 195 0.785 -9.778 2.967 1.00 35.31 O ATOM 588 CB ALA A 195 0.231 -8.068 0.013 1.00 4.22 C ATOM 0 H ALA A 195 2.531 -8.773 1.166 1.00 73.31 H new ATOM 0 HA ALA A 195 0.269 -6.940 1.817 1.00 53.43 H new ATOM 0 HB1 ALA A 195 -0.856 -8.038 -0.060 1.00 4.22 H new ATOM 0 HB2 ALA A 195 0.657 -7.260 -0.582 1.00 4.22 H new ATOM 0 HB3 ALA A 195 0.594 -9.025 -0.363 1.00 4.22 H new ATOM 594 N LYS A 196 -1.269 -8.976 2.462 1.00 41.55 N ATOM 595 CA LYS A 196 -1.972 -9.945 3.286 1.00 51.30 C ATOM 596 C LYS A 196 -3.308 -10.292 2.627 1.00 51.44 C ATOM 597 O LYS A 196 -3.757 -9.593 1.719 1.00 65.21 O ATOM 598 CB LYS A 196 -2.108 -9.431 4.720 1.00 12.11 C ATOM 599 CG LYS A 196 -3.430 -8.685 4.912 1.00 31.42 C ATOM 600 CD LYS A 196 -3.357 -7.742 6.114 1.00 3.13 C ATOM 601 CE LYS A 196 -3.641 -8.491 7.417 1.00 65.32 C ATOM 602 NZ LYS A 196 -2.393 -9.070 7.965 1.00 35.14 N ATOM 0 H LYS A 196 -1.872 -8.315 1.972 1.00 41.55 H new ATOM 0 HA LYS A 196 -1.401 -10.871 3.358 1.00 51.30 H new ATOM 0 HB2 LYS A 196 -2.054 -10.268 5.417 1.00 12.11 H new ATOM 0 HB3 LYS A 196 -1.275 -8.768 4.953 1.00 12.11 H new ATOM 0 HG2 LYS A 196 -3.665 -8.116 4.012 1.00 31.42 H new ATOM 0 HG3 LYS A 196 -4.239 -9.402 5.056 1.00 31.42 H new ATOM 0 HD2 LYS A 196 -2.369 -7.284 6.162 1.00 3.13 H new ATOM 0 HD3 LYS A 196 -4.078 -6.934 5.991 1.00 3.13 H new ATOM 0 HE2 LYS A 196 -4.084 -7.811 8.145 1.00 65.32 H new ATOM 0 HE3 LYS A 196 -4.368 -9.283 7.237 1.00 65.32 H new ATOM 0 HZ1 LYS A 196 -2.508 -10.097 8.079 1.00 35.14 H new ATOM 0 HZ2 LYS A 196 -1.606 -8.880 7.312 1.00 35.14 H new ATOM 0 HZ3 LYS A 196 -2.187 -8.640 8.889 1.00 35.14 H new ATOM 611 N PRO A 197 -3.922 -11.400 3.122 1.00 13.14 N ATOM 612 CA PRO A 197 -5.198 -11.848 2.592 1.00 33.11 C ATOM 613 C PRO A 197 -6.340 -10.954 3.080 1.00 62.54 C ATOM 614 O PRO A 197 -6.117 -10.022 3.851 1.00 45.20 O ATOM 615 CB PRO A 197 -5.332 -13.290 3.055 1.00 33.20 C ATOM 616 CG PRO A 197 -4.355 -13.449 4.208 1.00 25.41 C ATOM 617 CD PRO A 197 -3.419 -12.252 4.195 1.00 22.11 C ATOM 0 HA PRO A 197 -5.246 -11.787 1.505 1.00 33.11 H new ATOM 0 HB2 PRO A 197 -6.352 -13.505 3.375 1.00 33.20 H new ATOM 0 HB3 PRO A 197 -5.099 -13.983 2.247 1.00 33.20 H new ATOM 0 HG2 PRO A 197 -4.890 -13.505 5.156 1.00 25.41 H new ATOM 0 HG3 PRO A 197 -3.791 -14.376 4.105 1.00 25.41 H new ATOM 0 HD2 PRO A 197 -3.429 -11.731 5.152 1.00 22.11 H new ATOM 0 HD3 PRO A 197 -2.389 -12.557 4.009 1.00 22.11 H new ATOM 692 N GLY A 203 -1.050 -14.723 6.219 1.00 22.12 N ATOM 693 CA GLY A 203 -0.363 -13.470 5.956 1.00 41.42 C ATOM 694 C GLY A 203 0.161 -12.849 7.253 1.00 13.44 C ATOM 695 O GLY A 203 -0.020 -13.410 8.332 1.00 60.44 O ATOM 0 HA2 GLY A 203 0.467 -13.643 5.270 1.00 41.42 H new ATOM 0 HA3 GLY A 203 -1.043 -12.774 5.464 1.00 41.42 H new ATOM 699 N PRO A 204 0.815 -11.666 7.100 1.00 50.24 N ATOM 700 CA PRO A 204 0.986 -11.069 5.787 1.00 21.34 C ATOM 701 C PRO A 204 2.059 -11.807 4.984 1.00 11.14 C ATOM 702 O PRO A 204 3.058 -12.254 5.543 1.00 54.03 O ATOM 703 CB PRO A 204 1.340 -9.616 6.058 1.00 31.52 C ATOM 704 CG PRO A 204 1.810 -9.564 7.503 1.00 72.41 C ATOM 705 CD PRO A 204 1.408 -10.869 8.170 1.00 71.15 C ATOM 0 HA PRO A 204 0.088 -11.138 5.174 1.00 21.34 H new ATOM 0 HB2 PRO A 204 2.121 -9.271 5.381 1.00 31.52 H new ATOM 0 HB3 PRO A 204 0.477 -8.968 5.905 1.00 31.52 H new ATOM 0 HG2 PRO A 204 2.891 -9.429 7.548 1.00 72.41 H new ATOM 0 HG3 PRO A 204 1.361 -8.716 8.020 1.00 72.41 H new ATOM 0 HD2 PRO A 204 2.270 -11.372 8.607 1.00 71.15 H new ATOM 0 HD3 PRO A 204 0.696 -10.698 8.977 1.00 71.15 H new ATOM 710 N GLY A 205 1.814 -11.910 3.685 1.00 44.23 N ATOM 711 CA GLY A 205 2.748 -12.586 2.801 1.00 13.45 C ATOM 712 C GLY A 205 3.522 -11.578 1.948 1.00 35.13 C ATOM 713 O GLY A 205 3.015 -10.500 1.641 1.00 31.03 O ATOM 0 H GLY A 205 0.984 -11.537 3.225 1.00 44.23 H new ATOM 0 HA2 GLY A 205 3.446 -13.181 3.390 1.00 13.45 H new ATOM 0 HA3 GLY A 205 2.207 -13.276 2.154 1.00 13.45 H new ATOM 717 N LEU A 206 4.736 -11.966 1.587 1.00 42.33 N ATOM 718 CA LEU A 206 5.585 -11.110 0.775 1.00 72.02 C ATOM 719 C LEU A 206 5.287 -11.359 -0.705 1.00 63.41 C ATOM 720 O LEU A 206 4.973 -12.482 -1.097 1.00 51.21 O ATOM 721 CB LEU A 206 7.056 -11.305 1.148 1.00 42.13 C ATOM 722 CG LEU A 206 8.076 -10.931 0.071 1.00 10.44 C ATOM 723 CD1 LEU A 206 8.947 -9.757 0.525 1.00 64.33 C ATOM 724 CD2 LEU A 206 8.915 -12.144 -0.336 1.00 25.01 C ATOM 0 H LEU A 206 5.152 -12.862 1.842 1.00 42.33 H new ATOM 0 HA LEU A 206 5.367 -10.060 0.972 1.00 72.02 H new ATOM 0 HB2 LEU A 206 7.266 -10.714 2.040 1.00 42.13 H new ATOM 0 HB3 LEU A 206 7.207 -12.351 1.416 1.00 42.13 H new ATOM 0 HG LEU A 206 7.532 -10.605 -0.816 1.00 10.44 H new ATOM 0 HD11 LEU A 206 9.664 -9.511 -0.259 1.00 64.33 H new ATOM 0 HD12 LEU A 206 8.316 -8.891 0.724 1.00 64.33 H new ATOM 0 HD13 LEU A 206 9.483 -10.032 1.434 1.00 64.33 H new ATOM 0 HD21 LEU A 206 9.632 -11.850 -1.103 1.00 25.01 H new ATOM 0 HD22 LEU A 206 9.450 -12.525 0.534 1.00 25.01 H new ATOM 0 HD23 LEU A 206 8.262 -12.923 -0.730 1.00 25.01 H new ATOM 735 N VAL A 207 5.396 -10.294 -1.486 1.00 65.30 N ATOM 736 CA VAL A 207 5.142 -10.384 -2.914 1.00 64.11 C ATOM 737 C VAL A 207 5.929 -9.289 -3.636 1.00 61.21 C ATOM 738 O VAL A 207 5.760 -8.105 -3.348 1.00 41.02 O ATOM 739 CB VAL A 207 3.637 -10.316 -3.183 1.00 42.14 C ATOM 740 CG1 VAL A 207 3.052 -11.716 -3.380 1.00 4.10 C ATOM 741 CG2 VAL A 207 2.912 -9.572 -2.059 1.00 71.00 C ATOM 0 H VAL A 207 5.657 -9.364 -1.157 1.00 65.30 H new ATOM 0 HA VAL A 207 5.485 -11.342 -3.304 1.00 64.11 H new ATOM 0 HB VAL A 207 3.486 -9.757 -4.106 1.00 42.14 H new ATOM 0 HG11 VAL A 207 1.981 -11.640 -3.570 1.00 4.10 H new ATOM 0 HG12 VAL A 207 3.537 -12.197 -4.229 1.00 4.10 H new ATOM 0 HG13 VAL A 207 3.220 -12.310 -2.482 1.00 4.10 H new ATOM 0 HG21 VAL A 207 1.844 -9.538 -2.275 1.00 71.00 H new ATOM 0 HG22 VAL A 207 3.075 -10.091 -1.115 1.00 71.00 H new ATOM 0 HG23 VAL A 207 3.300 -8.556 -1.986 1.00 71.00 H new ATOM 751 N PRO A 208 6.794 -9.735 -4.586 1.00 2.34 N ATOM 752 CA PRO A 208 7.607 -8.806 -5.353 1.00 34.31 C ATOM 753 C PRO A 208 6.767 -8.083 -6.407 1.00 14.34 C ATOM 754 O PRO A 208 5.610 -8.435 -6.633 1.00 11.32 O ATOM 755 CB PRO A 208 8.713 -9.657 -5.955 1.00 33.33 C ATOM 756 CG PRO A 208 8.218 -11.093 -5.889 1.00 2.43 C ATOM 757 CD PRO A 208 7.019 -11.130 -4.954 1.00 12.31 C ATOM 0 HA PRO A 208 8.026 -8.008 -4.740 1.00 34.31 H new ATOM 0 HB2 PRO A 208 8.917 -9.361 -6.984 1.00 33.33 H new ATOM 0 HB3 PRO A 208 9.643 -9.539 -5.399 1.00 33.33 H new ATOM 0 HG2 PRO A 208 7.939 -11.447 -6.882 1.00 2.43 H new ATOM 0 HG3 PRO A 208 9.006 -11.752 -5.525 1.00 2.43 H new ATOM 0 HD2 PRO A 208 6.145 -11.556 -5.447 1.00 12.31 H new ATOM 0 HD3 PRO A 208 7.220 -11.744 -4.076 1.00 12.31 H new ATOM 762 N VAL A 209 7.382 -7.085 -7.025 1.00 31.40 N ATOM 763 CA VAL A 209 6.704 -6.309 -8.051 1.00 52.25 C ATOM 764 C VAL A 209 6.940 -6.962 -9.415 1.00 3.25 C ATOM 765 O VAL A 209 6.535 -6.421 -10.443 1.00 22.31 O ATOM 766 CB VAL A 209 7.169 -4.853 -7.997 1.00 63.02 C ATOM 767 CG1 VAL A 209 7.598 -4.466 -6.580 1.00 1.34 C ATOM 768 CG2 VAL A 209 8.298 -4.599 -8.999 1.00 33.30 C ATOM 0 H VAL A 209 8.342 -6.796 -6.835 1.00 31.40 H new ATOM 0 HA VAL A 209 5.628 -6.299 -7.876 1.00 52.25 H new ATOM 0 HB VAL A 209 6.325 -4.222 -8.276 1.00 63.02 H new ATOM 0 HG11 VAL A 209 7.924 -3.426 -6.570 1.00 1.34 H new ATOM 0 HG12 VAL A 209 6.756 -4.589 -5.899 1.00 1.34 H new ATOM 0 HG13 VAL A 209 8.420 -5.107 -6.261 1.00 1.34 H new ATOM 0 HG21 VAL A 209 8.609 -3.556 -8.940 1.00 33.30 H new ATOM 0 HG22 VAL A 209 9.144 -5.244 -8.765 1.00 33.30 H new ATOM 0 HG23 VAL A 209 7.945 -4.815 -10.007 1.00 33.30 H new ATOM 778 N GLY A 210 7.591 -8.114 -9.380 1.00 75.05 N ATOM 779 CA GLY A 210 7.884 -8.846 -10.601 1.00 50.34 C ATOM 780 C GLY A 210 6.939 -10.037 -10.766 1.00 73.51 C ATOM 781 O GLY A 210 6.880 -10.644 -11.835 1.00 13.53 O ATOM 0 H GLY A 210 7.924 -8.560 -8.525 1.00 75.05 H new ATOM 0 HA2 GLY A 210 7.790 -8.181 -11.459 1.00 50.34 H new ATOM 0 HA3 GLY A 210 8.916 -9.196 -10.581 1.00 50.34 H new ATOM 785 N PHE A 211 6.223 -10.337 -9.693 1.00 41.24 N ATOM 786 CA PHE A 211 5.284 -11.445 -9.705 1.00 72.10 C ATOM 787 C PHE A 211 3.879 -10.979 -9.318 1.00 42.22 C ATOM 788 O PHE A 211 2.941 -11.774 -9.293 1.00 51.02 O ATOM 789 CB PHE A 211 5.774 -12.460 -8.671 1.00 44.25 C ATOM 790 CG PHE A 211 6.713 -13.526 -9.241 1.00 45.43 C ATOM 791 CD1 PHE A 211 8.047 -13.280 -9.330 1.00 31.12 C ATOM 792 CD2 PHE A 211 6.212 -14.720 -9.658 1.00 22.43 C ATOM 793 CE1 PHE A 211 8.918 -14.269 -9.859 1.00 31.44 C ATOM 794 CE2 PHE A 211 7.082 -15.709 -10.187 1.00 42.54 C ATOM 795 CZ PHE A 211 8.417 -15.463 -10.276 1.00 74.11 C ATOM 0 H PHE A 211 6.274 -9.831 -8.809 1.00 41.24 H new ATOM 0 HA PHE A 211 5.232 -11.876 -10.705 1.00 72.10 H new ATOM 0 HB2 PHE A 211 6.288 -11.928 -7.870 1.00 44.25 H new ATOM 0 HB3 PHE A 211 4.911 -12.953 -8.223 1.00 44.25 H new ATOM 0 HD1 PHE A 211 8.444 -12.332 -8.998 1.00 31.12 H new ATOM 0 HD2 PHE A 211 5.152 -14.915 -9.587 1.00 22.43 H new ATOM 0 HE1 PHE A 211 9.978 -14.073 -9.930 1.00 31.44 H new ATOM 0 HE2 PHE A 211 6.684 -16.657 -10.519 1.00 42.54 H new ATOM 0 HZ PHE A 211 9.079 -16.216 -10.678 1.00 74.11 H new ATOM 804 N VAL A 212 3.779 -9.690 -9.024 1.00 34.12 N ATOM 805 CA VAL A 212 2.505 -9.108 -8.639 1.00 11.31 C ATOM 806 C VAL A 212 2.368 -7.724 -9.277 1.00 40.42 C ATOM 807 O VAL A 212 3.361 -7.122 -9.683 1.00 71.30 O ATOM 808 CB VAL A 212 2.384 -9.077 -7.114 1.00 63.50 C ATOM 809 CG1 VAL A 212 2.928 -10.365 -6.495 1.00 64.53 C ATOM 810 CG2 VAL A 212 3.087 -7.849 -6.532 1.00 23.42 C ATOM 0 H VAL A 212 4.559 -9.033 -9.045 1.00 34.12 H new ATOM 0 HA VAL A 212 1.680 -9.719 -9.006 1.00 11.31 H new ATOM 0 HB VAL A 212 1.325 -9.006 -6.864 1.00 63.50 H new ATOM 0 HG11 VAL A 212 2.830 -10.317 -5.410 1.00 64.53 H new ATOM 0 HG12 VAL A 212 2.363 -11.217 -6.873 1.00 64.53 H new ATOM 0 HG13 VAL A 212 3.979 -10.480 -6.760 1.00 64.53 H new ATOM 0 HG21 VAL A 212 2.985 -7.852 -5.447 1.00 23.42 H new ATOM 0 HG22 VAL A 212 4.144 -7.875 -6.798 1.00 23.42 H new ATOM 0 HG23 VAL A 212 2.633 -6.944 -6.936 1.00 23.42 H new ATOM 820 N SER A 213 1.130 -7.259 -9.346 1.00 11.23 N ATOM 821 CA SER A 213 0.850 -5.958 -9.927 1.00 13.14 C ATOM 822 C SER A 213 -0.004 -5.127 -8.967 1.00 43.24 C ATOM 823 O SER A 213 -0.817 -5.673 -8.222 1.00 75.10 O ATOM 824 CB SER A 213 0.144 -6.098 -11.278 1.00 51.20 C ATOM 825 OG SER A 213 1.070 -6.231 -12.353 1.00 63.14 O ATOM 0 H SER A 213 0.309 -7.761 -9.009 1.00 11.23 H new ATOM 0 HA SER A 213 1.799 -5.448 -10.093 1.00 13.14 H new ATOM 0 HB2 SER A 213 -0.513 -6.968 -11.255 1.00 51.20 H new ATOM 0 HB3 SER A 213 -0.487 -5.226 -11.449 1.00 51.20 H new ATOM 0 HG SER A 213 0.593 -6.159 -13.206 1.00 63.14 H new ATOM 830 N ILE A 214 0.211 -3.820 -9.014 1.00 60.11 N ATOM 831 CA ILE A 214 -0.528 -2.909 -8.156 1.00 13.21 C ATOM 832 C ILE A 214 -1.745 -2.376 -8.916 1.00 42.32 C ATOM 833 O ILE A 214 -1.662 -2.098 -10.112 1.00 24.31 O ATOM 834 CB ILE A 214 0.393 -1.811 -7.622 1.00 3.41 C ATOM 835 CG1 ILE A 214 1.678 -2.406 -7.043 1.00 34.31 C ATOM 836 CG2 ILE A 214 -0.338 -0.929 -6.607 1.00 40.21 C ATOM 837 CD1 ILE A 214 1.503 -2.755 -5.565 1.00 64.54 C ATOM 0 H ILE A 214 0.886 -3.371 -9.633 1.00 60.11 H new ATOM 0 HA ILE A 214 -0.904 -3.432 -7.277 1.00 13.21 H new ATOM 0 HB ILE A 214 0.682 -1.172 -8.456 1.00 3.41 H new ATOM 0 HG12 ILE A 214 1.952 -3.301 -7.602 1.00 34.31 H new ATOM 0 HG13 ILE A 214 2.496 -1.695 -7.158 1.00 34.31 H new ATOM 0 HG21 ILE A 214 0.339 -0.156 -6.242 1.00 40.21 H new ATOM 0 HG22 ILE A 214 -1.199 -0.461 -7.085 1.00 40.21 H new ATOM 0 HG23 ILE A 214 -0.675 -1.540 -5.770 1.00 40.21 H new ATOM 0 HD11 ILE A 214 2.431 -3.176 -5.178 1.00 64.54 H new ATOM 0 HD12 ILE A 214 1.253 -1.854 -5.006 1.00 64.54 H new ATOM 0 HD13 ILE A 214 0.700 -3.484 -5.456 1.00 64.54 H new ATOM 848 N ILE A 215 -2.847 -2.249 -8.190 1.00 74.33 N ATOM 849 CA ILE A 215 -4.079 -1.755 -8.781 1.00 44.11 C ATOM 850 C ILE A 215 -4.813 -0.882 -7.760 1.00 74.14 C ATOM 851 O ILE A 215 -4.797 -1.171 -6.564 1.00 71.03 O ATOM 852 CB ILE A 215 -4.920 -2.914 -9.317 1.00 61.05 C ATOM 853 CG1 ILE A 215 -4.762 -4.158 -8.439 1.00 42.24 C ATOM 854 CG2 ILE A 215 -4.587 -3.202 -10.782 1.00 2.31 C ATOM 855 CD1 ILE A 215 -3.412 -4.834 -8.684 1.00 73.25 C ATOM 0 H ILE A 215 -2.912 -2.480 -7.199 1.00 74.33 H new ATOM 0 HA ILE A 215 -3.862 -1.125 -9.644 1.00 44.11 H new ATOM 0 HB ILE A 215 -5.969 -2.621 -9.277 1.00 61.05 H new ATOM 0 HG12 ILE A 215 -4.848 -3.879 -7.389 1.00 42.24 H new ATOM 0 HG13 ILE A 215 -5.568 -4.861 -8.649 1.00 42.24 H new ATOM 0 HG21 ILE A 215 -5.199 -4.031 -11.138 1.00 2.31 H new ATOM 0 HG22 ILE A 215 -4.791 -2.316 -11.383 1.00 2.31 H new ATOM 0 HG23 ILE A 215 -3.533 -3.465 -10.871 1.00 2.31 H new ATOM 0 HD11 ILE A 215 -3.325 -5.715 -8.048 1.00 73.25 H new ATOM 0 HD12 ILE A 215 -3.339 -5.133 -9.730 1.00 73.25 H new ATOM 0 HD13 ILE A 215 -2.608 -4.137 -8.449 1.00 73.25 H new ATOM 991 N ASP A 226 3.315 4.409 -12.073 1.00 31.42 N ATOM 992 CA ASP A 226 4.090 3.192 -11.900 1.00 30.51 C ATOM 993 C ASP A 226 4.072 2.787 -10.424 1.00 51.44 C ATOM 994 O ASP A 226 3.993 3.642 -9.544 1.00 24.14 O ATOM 995 CB ASP A 226 5.547 3.404 -12.315 1.00 70.21 C ATOM 996 CG ASP A 226 6.294 2.133 -12.726 1.00 53.41 C ATOM 997 OD1 ASP A 226 5.677 1.114 -13.070 1.00 51.13 O ATOM 998 OD2 ASP A 226 7.580 2.219 -12.684 1.00 54.03 O ATOM 0 HA ASP A 226 3.646 2.417 -12.525 1.00 30.51 H new ATOM 0 HB2 ASP A 226 5.573 4.108 -13.147 1.00 70.21 H new ATOM 0 HB3 ASP A 226 6.081 3.869 -11.487 1.00 70.21 H new ATOM 1003 N VAL A 227 4.149 1.484 -10.200 1.00 61.23 N ATOM 1004 CA VAL A 227 4.143 0.955 -8.847 1.00 72.01 C ATOM 1005 C VAL A 227 4.995 1.855 -7.949 1.00 63.31 C ATOM 1006 O VAL A 227 4.584 2.201 -6.843 1.00 4.13 O ATOM 1007 CB VAL A 227 4.612 -0.502 -8.852 1.00 44.53 C ATOM 1008 CG1 VAL A 227 5.691 -0.726 -9.913 1.00 23.40 C ATOM 1009 CG2 VAL A 227 5.109 -0.921 -7.467 1.00 62.24 C ATOM 0 H VAL A 227 4.216 0.778 -10.933 1.00 61.23 H new ATOM 0 HA VAL A 227 3.131 0.955 -8.441 1.00 72.01 H new ATOM 0 HB VAL A 227 3.758 -1.130 -9.106 1.00 44.53 H new ATOM 0 HG11 VAL A 227 6.007 -1.769 -9.896 1.00 23.40 H new ATOM 0 HG12 VAL A 227 5.289 -0.485 -10.897 1.00 23.40 H new ATOM 0 HG13 VAL A 227 6.547 -0.084 -9.703 1.00 23.40 H new ATOM 0 HG21 VAL A 227 5.437 -1.960 -7.497 1.00 62.24 H new ATOM 0 HG22 VAL A 227 5.944 -0.286 -7.173 1.00 62.24 H new ATOM 0 HG23 VAL A 227 4.301 -0.816 -6.743 1.00 62.24 H new ATOM 1019 N ILE A 228 6.166 2.207 -8.459 1.00 2.44 N ATOM 1020 CA ILE A 228 7.079 3.060 -7.717 1.00 64.22 C ATOM 1021 C ILE A 228 6.444 4.439 -7.530 1.00 15.54 C ATOM 1022 O ILE A 228 6.418 4.971 -6.421 1.00 73.23 O ATOM 1023 CB ILE A 228 8.448 3.100 -8.398 1.00 33.04 C ATOM 1024 CG1 ILE A 228 9.022 1.691 -8.558 1.00 33.02 C ATOM 1025 CG2 ILE A 228 9.406 4.028 -7.649 1.00 52.03 C ATOM 1026 CD1 ILE A 228 8.728 1.134 -9.953 1.00 24.11 C ATOM 0 H ILE A 228 6.504 1.917 -9.377 1.00 2.44 H new ATOM 0 HA ILE A 228 7.256 2.653 -6.721 1.00 64.22 H new ATOM 0 HB ILE A 228 8.320 3.511 -9.399 1.00 33.04 H new ATOM 0 HG12 ILE A 228 10.099 1.712 -8.390 1.00 33.02 H new ATOM 0 HG13 ILE A 228 8.595 1.032 -7.802 1.00 33.02 H new ATOM 0 HG21 ILE A 228 10.372 4.038 -8.154 1.00 52.03 H new ATOM 0 HG22 ILE A 228 8.995 5.037 -7.631 1.00 52.03 H new ATOM 0 HG23 ILE A 228 9.535 3.671 -6.627 1.00 52.03 H new ATOM 0 HD11 ILE A 228 9.147 0.131 -10.040 1.00 24.11 H new ATOM 0 HD12 ILE A 228 7.650 1.092 -10.108 1.00 24.11 H new ATOM 0 HD13 ILE A 228 9.178 1.782 -10.706 1.00 24.11 H new ATOM 1037 N GLU A 229 5.946 4.980 -8.633 1.00 2.12 N ATOM 1038 CA GLU A 229 5.313 6.288 -8.605 1.00 1.01 C ATOM 1039 C GLU A 229 4.077 6.260 -7.704 1.00 70.13 C ATOM 1040 O GLU A 229 3.577 7.308 -7.297 1.00 62.31 O ATOM 1041 CB GLU A 229 4.951 6.752 -10.017 1.00 35.05 C ATOM 1042 CG GLU A 229 6.199 6.859 -10.896 1.00 73.31 C ATOM 1043 CD GLU A 229 5.995 7.884 -12.014 1.00 61.13 C ATOM 1044 OE1 GLU A 229 4.853 8.271 -12.300 1.00 5.43 O ATOM 1045 OE2 GLU A 229 7.078 8.279 -12.595 1.00 64.12 O ATOM 0 H GLU A 229 5.968 4.536 -9.551 1.00 2.12 H new ATOM 0 HA GLU A 229 6.023 7.005 -8.193 1.00 1.01 H new ATOM 0 HB2 GLU A 229 4.246 6.051 -10.464 1.00 35.05 H new ATOM 0 HB3 GLU A 229 4.452 7.720 -9.969 1.00 35.05 H new ATOM 0 HG2 GLU A 229 7.055 7.147 -10.285 1.00 73.31 H new ATOM 0 HG3 GLU A 229 6.429 5.885 -11.328 1.00 73.31 H new ATOM 1051 N ASP A 230 3.620 5.050 -7.417 1.00 20.24 N ATOM 1052 CA ASP A 230 2.452 4.872 -6.571 1.00 30.41 C ATOM 1053 C ASP A 230 2.894 4.786 -5.109 1.00 54.12 C ATOM 1054 O ASP A 230 2.090 4.985 -4.201 1.00 1.02 O ATOM 1055 CB ASP A 230 1.712 3.578 -6.918 1.00 52.45 C ATOM 1056 CG ASP A 230 0.446 3.318 -6.101 1.00 2.31 C ATOM 1057 OD1 ASP A 230 -0.654 3.760 -6.468 1.00 53.03 O ATOM 1058 OD2 ASP A 230 0.621 2.622 -5.029 1.00 32.13 O ATOM 0 H ASP A 230 4.038 4.183 -7.755 1.00 20.24 H new ATOM 0 HA ASP A 230 1.788 5.721 -6.731 1.00 30.41 H new ATOM 0 HB2 ASP A 230 1.446 3.602 -7.975 1.00 52.45 H new ATOM 0 HB3 ASP A 230 2.394 2.739 -6.780 1.00 52.45 H new ATOM 1063 N ILE A 231 4.174 4.489 -4.929 1.00 5.15 N ATOM 1064 CA ILE A 231 4.733 4.375 -3.592 1.00 21.04 C ATOM 1065 C ILE A 231 4.856 5.769 -2.974 1.00 20.22 C ATOM 1066 O ILE A 231 4.127 6.105 -2.042 1.00 12.14 O ATOM 1067 CB ILE A 231 6.052 3.600 -3.628 1.00 15.42 C ATOM 1068 CG1 ILE A 231 5.800 2.091 -3.645 1.00 71.42 C ATOM 1069 CG2 ILE A 231 6.965 4.017 -2.473 1.00 22.43 C ATOM 1070 CD1 ILE A 231 6.698 1.397 -4.670 1.00 72.03 C ATOM 0 H ILE A 231 4.838 4.324 -5.685 1.00 5.15 H new ATOM 0 HA ILE A 231 4.068 3.799 -2.949 1.00 21.04 H new ATOM 0 HB ILE A 231 6.571 3.850 -4.553 1.00 15.42 H new ATOM 0 HG12 ILE A 231 5.985 1.677 -2.654 1.00 71.42 H new ATOM 0 HG13 ILE A 231 4.754 1.896 -3.881 1.00 71.42 H new ATOM 0 HG21 ILE A 231 7.895 3.451 -2.522 1.00 22.43 H new ATOM 0 HG22 ILE A 231 7.184 5.082 -2.548 1.00 22.43 H new ATOM 0 HG23 ILE A 231 6.467 3.815 -1.525 1.00 22.43 H new ATOM 0 HD11 ILE A 231 6.499 0.325 -4.662 1.00 72.03 H new ATOM 0 HD12 ILE A 231 6.493 1.797 -5.663 1.00 72.03 H new ATOM 0 HD13 ILE A 231 7.743 1.574 -4.417 1.00 72.03 H new ATOM 1081 N LYS A 232 5.784 6.543 -3.518 1.00 22.25 N ATOM 1082 CA LYS A 232 6.012 7.893 -3.031 1.00 23.32 C ATOM 1083 C LYS A 232 4.710 8.692 -3.128 1.00 63.42 C ATOM 1084 O LYS A 232 4.531 9.681 -2.420 1.00 3.03 O ATOM 1085 CB LYS A 232 7.186 8.538 -3.770 1.00 14.25 C ATOM 1086 CG LYS A 232 6.716 9.211 -5.063 1.00 43.23 C ATOM 1087 CD LYS A 232 6.490 8.179 -6.168 1.00 63.42 C ATOM 1088 CE LYS A 232 7.822 7.645 -6.701 1.00 23.43 C ATOM 1089 NZ LYS A 232 8.337 8.520 -7.776 1.00 55.04 N ATOM 0 H LYS A 232 6.387 6.261 -4.291 1.00 22.25 H new ATOM 0 HA LYS A 232 6.298 7.876 -1.979 1.00 23.32 H new ATOM 0 HB2 LYS A 232 7.666 9.275 -3.126 1.00 14.25 H new ATOM 0 HB3 LYS A 232 7.935 7.781 -4.001 1.00 14.25 H new ATOM 0 HG2 LYS A 232 5.792 9.758 -4.877 1.00 43.23 H new ATOM 0 HG3 LYS A 232 7.458 9.940 -5.388 1.00 43.23 H new ATOM 0 HD2 LYS A 232 5.891 7.354 -5.783 1.00 63.42 H new ATOM 0 HD3 LYS A 232 5.923 8.631 -6.982 1.00 63.42 H new ATOM 0 HE2 LYS A 232 8.549 7.589 -5.890 1.00 23.43 H new ATOM 0 HE3 LYS A 232 7.689 6.632 -7.081 1.00 23.43 H new ATOM 0 HZ1 LYS A 232 9.241 8.144 -8.127 1.00 55.04 H new ATOM 0 HZ2 LYS A 232 7.650 8.553 -8.556 1.00 55.04 H new ATOM 0 HZ3 LYS A 232 8.483 9.480 -7.403 1.00 55.04 H new ATOM 1098 N SER A 233 3.835 8.232 -4.010 1.00 13.00 N ATOM 1099 CA SER A 233 2.555 8.891 -4.209 1.00 70.12 C ATOM 1100 C SER A 233 1.889 9.157 -2.857 1.00 74.13 C ATOM 1101 O SER A 233 1.565 10.299 -2.535 1.00 72.41 O ATOM 1102 CB SER A 233 1.636 8.051 -5.098 1.00 54.40 C ATOM 1103 OG SER A 233 1.651 8.497 -6.452 1.00 1.24 O ATOM 0 H SER A 233 3.987 7.411 -4.595 1.00 13.00 H new ATOM 0 HA SER A 233 2.733 9.841 -4.713 1.00 70.12 H new ATOM 0 HB2 SER A 233 1.946 7.007 -5.057 1.00 54.40 H new ATOM 0 HB3 SER A 233 0.618 8.096 -4.712 1.00 54.40 H new ATOM 0 HG SER A 233 2.534 8.328 -6.842 1.00 1.24 H new ATOM 1108 N VAL A 234 1.704 8.084 -2.103 1.00 72.30 N ATOM 1109 CA VAL A 234 1.081 8.186 -0.794 1.00 52.42 C ATOM 1110 C VAL A 234 2.169 8.208 0.282 1.00 72.11 C ATOM 1111 O VAL A 234 1.919 7.842 1.429 1.00 21.01 O ATOM 1112 CB VAL A 234 0.073 7.052 -0.603 1.00 73.24 C ATOM 1113 CG1 VAL A 234 -0.693 6.775 -1.899 1.00 52.35 C ATOM 1114 CG2 VAL A 234 0.763 5.785 -0.093 1.00 43.00 C ATOM 0 H VAL A 234 1.975 7.139 -2.374 1.00 72.30 H new ATOM 0 HA VAL A 234 0.520 9.117 -0.709 1.00 52.42 H new ATOM 0 HB VAL A 234 -0.648 7.368 0.151 1.00 73.24 H new ATOM 0 HG11 VAL A 234 -1.403 5.964 -1.736 1.00 52.35 H new ATOM 0 HG12 VAL A 234 -1.231 7.673 -2.203 1.00 52.35 H new ATOM 0 HG13 VAL A 234 0.009 6.490 -2.683 1.00 52.35 H new ATOM 0 HG21 VAL A 234 0.024 4.994 0.034 1.00 43.00 H new ATOM 0 HG22 VAL A 234 1.516 5.465 -0.814 1.00 43.00 H new ATOM 0 HG23 VAL A 234 1.242 5.992 0.864 1.00 43.00 H new ATOM 1124 N ASN A 235 3.353 8.640 -0.127 1.00 5.12 N ATOM 1125 CA ASN A 235 4.479 8.714 0.789 1.00 34.10 C ATOM 1126 C ASN A 235 4.490 7.469 1.678 1.00 42.03 C ATOM 1127 O ASN A 235 4.826 7.548 2.859 1.00 15.24 O ATOM 1128 CB ASN A 235 4.372 9.941 1.696 1.00 53.31 C ATOM 1129 CG ASN A 235 4.211 11.220 0.871 1.00 50.11 C ATOM 1130 OD1 ASN A 235 5.158 11.757 0.320 1.00 2.51 O ATOM 1131 ND2 ASN A 235 2.963 11.676 0.817 1.00 20.03 N ATOM 0 H ASN A 235 3.557 8.942 -1.080 1.00 5.12 H new ATOM 0 HA ASN A 235 5.391 8.782 0.197 1.00 34.10 H new ATOM 0 HB2 ASN A 235 3.521 9.828 2.368 1.00 53.31 H new ATOM 0 HB3 ASN A 235 5.263 10.016 2.319 1.00 53.31 H new ATOM 0 HD21 ASN A 235 2.752 12.524 0.291 1.00 20.03 H new ATOM 0 HD22 ASN A 235 2.217 11.178 1.302 1.00 20.03 H new ATOM 1137 N LEU A 236 4.119 6.348 1.076 1.00 63.33 N ATOM 1138 CA LEU A 236 4.082 5.088 1.800 1.00 54.21 C ATOM 1139 C LEU A 236 5.483 4.764 2.324 1.00 52.30 C ATOM 1140 O LEU A 236 6.424 4.626 1.544 1.00 71.52 O ATOM 1141 CB LEU A 236 3.483 3.986 0.924 1.00 52.04 C ATOM 1142 CG LEU A 236 3.908 2.556 1.263 1.00 74.42 C ATOM 1143 CD1 LEU A 236 3.148 2.032 2.483 1.00 33.44 C ATOM 1144 CD2 LEU A 236 3.751 1.635 0.050 1.00 62.45 C ATOM 0 H LEU A 236 3.842 6.286 0.096 1.00 63.33 H new ATOM 0 HA LEU A 236 3.427 5.166 2.668 1.00 54.21 H new ATOM 0 HB2 LEU A 236 2.397 4.047 0.990 1.00 52.04 H new ATOM 0 HB3 LEU A 236 3.751 4.188 -0.113 1.00 52.04 H new ATOM 0 HG LEU A 236 4.966 2.567 1.524 1.00 74.42 H new ATOM 0 HD11 LEU A 236 3.469 1.014 2.702 1.00 33.44 H new ATOM 0 HD12 LEU A 236 3.354 2.670 3.342 1.00 33.44 H new ATOM 0 HD13 LEU A 236 2.078 2.038 2.275 1.00 33.44 H new ATOM 0 HD21 LEU A 236 4.060 0.625 0.318 1.00 62.45 H new ATOM 0 HD22 LEU A 236 2.708 1.624 -0.266 1.00 62.45 H new ATOM 0 HD23 LEU A 236 4.373 2.000 -0.767 1.00 62.45 H new ATOM 1155 N PRO A 237 5.580 4.651 3.675 1.00 23.24 N ATOM 1156 CA PRO A 237 6.849 4.347 4.313 1.00 11.20 C ATOM 1157 C PRO A 237 7.215 2.873 4.129 1.00 13.11 C ATOM 1158 O PRO A 237 6.360 2.054 3.796 1.00 54.10 O ATOM 1159 CB PRO A 237 6.660 4.734 5.770 1.00 41.23 C ATOM 1160 CG PRO A 237 5.158 4.803 5.992 1.00 4.41 C ATOM 1161 CD PRO A 237 4.485 4.809 4.629 1.00 5.50 C ATOM 0 HA PRO A 237 7.682 4.896 3.874 1.00 11.20 H new ATOM 0 HB2 PRO A 237 7.119 4.000 6.432 1.00 41.23 H new ATOM 0 HB3 PRO A 237 7.131 5.694 5.983 1.00 41.23 H new ATOM 0 HG2 PRO A 237 4.820 3.951 6.581 1.00 4.41 H new ATOM 0 HG3 PRO A 237 4.896 5.701 6.551 1.00 4.41 H new ATOM 0 HD2 PRO A 237 3.762 3.998 4.540 1.00 5.50 H new ATOM 0 HD3 PRO A 237 3.943 5.739 4.459 1.00 5.50 H new ATOM 1166 N THR A 238 8.488 2.580 4.353 1.00 51.21 N ATOM 1167 CA THR A 238 8.978 1.219 4.216 1.00 14.01 C ATOM 1168 C THR A 238 8.397 0.329 5.317 1.00 42.30 C ATOM 1169 O THR A 238 7.735 0.819 6.230 1.00 23.33 O ATOM 1170 CB THR A 238 10.508 1.265 4.215 1.00 22.42 C ATOM 1171 OG1 THR A 238 10.818 2.465 3.512 1.00 54.12 O ATOM 1172 CG2 THR A 238 11.126 0.159 3.358 1.00 11.31 C ATOM 0 H THR A 238 9.195 3.262 4.628 1.00 51.21 H new ATOM 0 HA THR A 238 8.651 0.774 3.276 1.00 14.01 H new ATOM 0 HB THR A 238 10.875 1.179 5.238 1.00 22.42 H new ATOM 0 HG1 THR A 238 11.791 2.575 3.466 1.00 54.12 H new ATOM 0 HG21 THR A 238 12.213 0.237 3.392 1.00 11.31 H new ATOM 0 HG22 THR A 238 10.820 -0.814 3.743 1.00 11.31 H new ATOM 0 HG23 THR A 238 10.786 0.265 2.328 1.00 11.31 H new ATOM 1180 N VAL A 239 8.668 -0.961 5.195 1.00 21.52 N ATOM 1181 CA VAL A 239 8.180 -1.923 6.168 1.00 63.25 C ATOM 1182 C VAL A 239 8.837 -1.649 7.523 1.00 44.05 C ATOM 1183 O VAL A 239 8.154 -1.556 8.541 1.00 23.41 O ATOM 1184 CB VAL A 239 8.423 -3.348 5.664 1.00 12.20 C ATOM 1185 CG1 VAL A 239 9.917 -3.612 5.466 1.00 10.34 C ATOM 1186 CG2 VAL A 239 7.805 -4.378 6.611 1.00 20.22 C ATOM 0 H VAL A 239 9.219 -1.363 4.437 1.00 21.52 H new ATOM 0 HA VAL A 239 7.103 -1.819 6.301 1.00 63.25 H new ATOM 0 HB VAL A 239 7.934 -3.448 4.695 1.00 12.20 H new ATOM 0 HG11 VAL A 239 10.062 -4.631 5.108 1.00 10.34 H new ATOM 0 HG12 VAL A 239 10.317 -2.910 4.734 1.00 10.34 H new ATOM 0 HG13 VAL A 239 10.438 -3.483 6.415 1.00 10.34 H new ATOM 0 HG21 VAL A 239 7.992 -5.382 6.229 1.00 20.22 H new ATOM 0 HG22 VAL A 239 8.252 -4.277 7.600 1.00 20.22 H new ATOM 0 HG23 VAL A 239 6.730 -4.211 6.679 1.00 20.22 H new ATOM 1196 N GLN A 240 10.156 -1.528 7.491 1.00 50.43 N ATOM 1197 CA GLN A 240 10.913 -1.265 8.704 1.00 72.44 C ATOM 1198 C GLN A 240 10.621 0.146 9.218 1.00 33.40 C ATOM 1199 O GLN A 240 10.936 0.471 10.361 1.00 30.03 O ATOM 1200 CB GLN A 240 12.411 -1.464 8.468 1.00 62.24 C ATOM 1201 CG GLN A 240 12.871 -0.727 7.208 1.00 1.45 C ATOM 1202 CD GLN A 240 13.036 -1.696 6.036 1.00 13.11 C ATOM 1203 OE1 GLN A 240 12.468 -2.775 6.004 1.00 62.00 O ATOM 1204 NE2 GLN A 240 13.844 -1.252 5.077 1.00 34.21 N ATOM 0 H GLN A 240 10.720 -1.607 6.645 1.00 50.43 H new ATOM 0 HA GLN A 240 10.600 -1.979 9.466 1.00 72.44 H new ATOM 0 HB2 GLN A 240 12.970 -1.101 9.330 1.00 62.24 H new ATOM 0 HB3 GLN A 240 12.629 -2.528 8.372 1.00 62.24 H new ATOM 0 HG2 GLN A 240 12.146 0.044 6.948 1.00 1.45 H new ATOM 0 HG3 GLN A 240 13.817 -0.222 7.403 1.00 1.45 H new ATOM 0 HE21 GLN A 240 14.288 -0.338 5.167 1.00 34.21 H new ATOM 0 HE22 GLN A 240 14.019 -1.825 4.252 1.00 34.21 H new ATOM 1211 N GLU A 241 10.022 0.945 8.348 1.00 11.43 N ATOM 1212 CA GLU A 241 9.683 2.313 8.700 1.00 51.41 C ATOM 1213 C GLU A 241 8.295 2.370 9.340 1.00 24.33 C ATOM 1214 O GLU A 241 8.078 3.112 10.297 1.00 53.25 O ATOM 1215 CB GLU A 241 9.760 3.230 7.476 1.00 70.34 C ATOM 1216 CG GLU A 241 11.209 3.607 7.163 1.00 64.11 C ATOM 1217 CD GLU A 241 11.695 4.728 8.084 1.00 64.31 C ATOM 1218 OE1 GLU A 241 12.424 4.463 9.052 1.00 54.33 O ATOM 1219 OE2 GLU A 241 11.289 5.910 7.765 1.00 64.30 O ATOM 0 H GLU A 241 9.763 0.671 7.400 1.00 11.43 H new ATOM 0 HA GLU A 241 10.412 2.670 9.428 1.00 51.41 H new ATOM 0 HB2 GLU A 241 9.316 2.731 6.615 1.00 70.34 H new ATOM 0 HB3 GLU A 241 9.177 4.133 7.656 1.00 70.34 H new ATOM 0 HG2 GLU A 241 11.849 2.733 7.279 1.00 64.11 H new ATOM 0 HG3 GLU A 241 11.289 3.925 6.123 1.00 64.11 H new ATOM 1225 N TRP A 242 7.391 1.574 8.787 1.00 2.14 N ATOM 1226 CA TRP A 242 6.030 1.524 9.293 1.00 30.41 C ATOM 1227 C TRP A 242 6.016 0.616 10.524 1.00 23.32 C ATOM 1228 O TRP A 242 5.717 1.067 11.629 1.00 12.20 O ATOM 1229 CB TRP A 242 5.057 1.068 8.203 1.00 24.24 C ATOM 1230 CG TRP A 242 3.886 0.233 8.725 1.00 12.14 C ATOM 1231 CD1 TRP A 242 3.198 0.396 9.862 1.00 24.12 C ATOM 1232 CD2 TRP A 242 3.291 -0.911 8.077 1.00 31.15 C ATOM 1233 NE1 TRP A 242 2.206 -0.554 9.995 1.00 22.25 N ATOM 1234 CE2 TRP A 242 2.264 -1.374 8.874 1.00 62.41 C ATOM 1235 CE3 TRP A 242 3.608 -1.533 6.857 1.00 12.01 C ATOM 1236 CZ2 TRP A 242 1.472 -2.479 8.540 1.00 72.22 C ATOM 1237 CZ3 TRP A 242 2.808 -2.637 6.536 1.00 4.34 C ATOM 1238 CH2 TRP A 242 1.771 -3.115 7.329 1.00 30.42 C ATOM 0 H TRP A 242 7.575 0.959 7.994 1.00 2.14 H new ATOM 0 HA TRP A 242 5.692 2.517 9.589 1.00 30.41 H new ATOM 0 HB2 TRP A 242 4.664 1.946 7.690 1.00 24.24 H new ATOM 0 HB3 TRP A 242 5.604 0.485 7.462 1.00 24.24 H new ATOM 0 HD1 TRP A 242 3.395 1.174 10.585 1.00 24.12 H new ATOM 0 HE1 TRP A 242 1.551 -0.639 10.772 1.00 22.25 H new ATOM 0 HE3 TRP A 242 4.406 -1.187 6.217 1.00 12.01 H new ATOM 0 HZ2 TRP A 242 0.674 -2.822 9.182 1.00 72.22 H new ATOM 0 HZ3 TRP A 242 3.011 -3.152 5.609 1.00 4.34 H new ATOM 0 HH2 TRP A 242 1.198 -3.974 7.012 1.00 30.42 H new ATOM 1248 N LYS A 243 6.343 -0.646 10.293 1.00 33.51 N ATOM 1249 CA LYS A 243 6.372 -1.622 11.370 1.00 14.24 C ATOM 1250 C LYS A 243 7.219 -1.079 12.521 1.00 22.02 C ATOM 1251 O LYS A 243 7.055 -1.495 13.667 1.00 3.31 O ATOM 1252 CB LYS A 243 6.842 -2.982 10.848 1.00 43.31 C ATOM 1253 CG LYS A 243 5.766 -3.639 9.982 1.00 4.24 C ATOM 1254 CD LYS A 243 6.184 -5.050 9.564 1.00 64.31 C ATOM 1255 CE LYS A 243 6.871 -5.783 10.718 1.00 42.31 C ATOM 1256 NZ LYS A 243 6.024 -5.749 11.931 1.00 1.21 N ATOM 0 H LYS A 243 6.590 -1.016 9.375 1.00 33.51 H new ATOM 0 HA LYS A 243 5.369 -1.787 11.762 1.00 14.24 H new ATOM 0 HB2 LYS A 243 7.755 -2.856 10.266 1.00 43.31 H new ATOM 0 HB3 LYS A 243 7.086 -3.633 11.687 1.00 43.31 H new ATOM 0 HG2 LYS A 243 4.827 -3.683 10.534 1.00 4.24 H new ATOM 0 HG3 LYS A 243 5.587 -3.031 9.095 1.00 4.24 H new ATOM 0 HD2 LYS A 243 5.308 -5.612 9.242 1.00 64.31 H new ATOM 0 HD3 LYS A 243 6.859 -4.995 8.710 1.00 64.31 H new ATOM 0 HE2 LYS A 243 7.068 -6.817 10.434 1.00 42.31 H new ATOM 0 HE3 LYS A 243 7.835 -5.320 10.928 1.00 42.31 H new ATOM 0 HZ1 LYS A 243 6.478 -5.156 12.655 1.00 1.21 H new ATOM 0 HZ2 LYS A 243 5.092 -5.353 11.693 1.00 1.21 H new ATOM 0 HZ3 LYS A 243 5.906 -6.714 12.299 1.00 1.21 H new ATOM 1265 N SER A 244 8.106 -0.157 12.177 1.00 45.33 N ATOM 1266 CA SER A 244 8.981 0.448 13.168 1.00 20.43 C ATOM 1267 C SER A 244 8.207 0.697 14.465 1.00 11.13 C ATOM 1268 O SER A 244 8.477 0.062 15.483 1.00 5.42 O ATOM 1269 CB SER A 244 9.580 1.756 12.649 1.00 20.03 C ATOM 1270 OG SER A 244 10.902 1.968 13.137 1.00 53.25 O ATOM 0 H SER A 244 8.238 0.186 11.226 1.00 45.33 H new ATOM 0 HA SER A 244 9.801 -0.242 13.367 1.00 20.43 H new ATOM 0 HB2 SER A 244 9.594 1.741 11.559 1.00 20.03 H new ATOM 0 HB3 SER A 244 8.945 2.590 12.948 1.00 20.03 H new ATOM 0 HG SER A 244 11.250 2.812 12.782 1.00 53.25 H new ATOM 1577 N PHE B 470 9.884 -8.031 8.657 1.00 44.34 N ATOM 1578 CA PHE B 470 9.196 -8.391 7.429 1.00 40.34 C ATOM 1579 C PHE B 470 10.094 -8.162 6.212 1.00 72.41 C ATOM 1580 O PHE B 470 9.616 -7.773 5.147 1.00 63.30 O ATOM 1581 CB PHE B 470 7.969 -7.484 7.321 1.00 51.34 C ATOM 1582 CG PHE B 470 6.760 -7.976 8.117 1.00 25.42 C ATOM 1583 CD1 PHE B 470 6.925 -8.897 9.106 1.00 12.34 C ATOM 1584 CD2 PHE B 470 5.520 -7.494 7.837 1.00 3.25 C ATOM 1585 CE1 PHE B 470 5.801 -9.354 9.844 1.00 2.41 C ATOM 1586 CE2 PHE B 470 4.396 -7.951 8.577 1.00 12.23 C ATOM 1587 CZ PHE B 470 4.561 -8.871 9.564 1.00 21.15 C ATOM 0 HA PHE B 470 8.921 -9.445 7.451 1.00 40.34 H new ATOM 0 HB2 PHE B 470 8.237 -6.485 7.666 1.00 51.34 H new ATOM 0 HB3 PHE B 470 7.688 -7.394 6.272 1.00 51.34 H new ATOM 0 HD1 PHE B 470 7.910 -9.280 9.329 1.00 12.34 H new ATOM 0 HD2 PHE B 470 5.389 -6.764 7.052 1.00 3.25 H new ATOM 0 HE1 PHE B 470 5.931 -10.085 10.628 1.00 2.41 H new ATOM 0 HE2 PHE B 470 3.411 -7.567 8.355 1.00 12.23 H new ATOM 0 HZ PHE B 470 3.707 -9.219 10.126 1.00 21.15 H new ATOM 1596 N ILE B 471 11.380 -8.416 6.409 1.00 14.53 N ATOM 1597 CA ILE B 471 12.349 -8.242 5.340 1.00 0.11 C ATOM 1598 C ILE B 471 12.589 -9.587 4.652 1.00 72.12 C ATOM 1599 O ILE B 471 12.653 -10.623 5.311 1.00 65.51 O ATOM 1600 CB ILE B 471 13.624 -7.587 5.874 1.00 74.35 C ATOM 1601 CG1 ILE B 471 13.304 -6.586 6.985 1.00 12.23 C ATOM 1602 CG2 ILE B 471 14.430 -6.948 4.740 1.00 24.23 C ATOM 1603 CD1 ILE B 471 12.597 -5.351 6.422 1.00 54.13 C ATOM 0 H ILE B 471 11.773 -8.741 7.292 1.00 14.53 H new ATOM 0 HA ILE B 471 11.963 -7.561 4.582 1.00 0.11 H new ATOM 0 HB ILE B 471 14.248 -8.365 6.313 1.00 74.35 H new ATOM 0 HG12 ILE B 471 12.673 -7.060 7.736 1.00 12.23 H new ATOM 0 HG13 ILE B 471 14.225 -6.286 7.486 1.00 12.23 H new ATOM 0 HG21 ILE B 471 15.331 -6.490 5.148 1.00 24.23 H new ATOM 0 HG22 ILE B 471 14.708 -7.713 4.015 1.00 24.23 H new ATOM 0 HG23 ILE B 471 13.825 -6.186 4.249 1.00 24.23 H new ATOM 0 HD11 ILE B 471 12.380 -4.655 7.232 1.00 54.13 H new ATOM 0 HD12 ILE B 471 13.241 -4.866 5.689 1.00 54.13 H new ATOM 0 HD13 ILE B 471 11.665 -5.652 5.943 1.00 54.13 H new ATOM 1614 N PRO B 472 12.719 -9.527 3.300 1.00 14.44 N ATOM 1615 CA PRO B 472 12.951 -10.728 2.515 1.00 5.22 C ATOM 1616 C PRO B 472 14.395 -11.211 2.667 1.00 31.23 C ATOM 1617 O PRO B 472 15.135 -10.713 3.514 1.00 34.14 O ATOM 1618 CB PRO B 472 12.602 -10.339 1.088 1.00 12.21 C ATOM 1619 CG PRO B 472 12.635 -8.819 1.049 1.00 22.52 C ATOM 1620 CD PRO B 472 12.650 -8.317 2.484 1.00 24.44 C ATOM 0 HA PRO B 472 12.342 -11.570 2.844 1.00 5.22 H new ATOM 0 HB2 PRO B 472 13.316 -10.763 0.382 1.00 12.21 H new ATOM 0 HB3 PRO B 472 11.617 -10.715 0.810 1.00 12.21 H new ATOM 0 HG2 PRO B 472 13.518 -8.470 0.513 1.00 22.52 H new ATOM 0 HG3 PRO B 472 11.766 -8.432 0.518 1.00 22.52 H new ATOM 0 HD2 PRO B 472 13.505 -7.667 2.667 1.00 24.44 H new ATOM 0 HD3 PRO B 472 11.755 -7.737 2.710 1.00 24.44 H new ATOM 1625 N SER B 473 14.753 -12.177 1.832 1.00 4.04 N ATOM 1626 CA SER B 473 16.094 -12.733 1.863 1.00 32.14 C ATOM 1627 C SER B 473 16.657 -12.820 0.443 1.00 2.24 C ATOM 1628 O SER B 473 17.642 -13.515 0.203 1.00 24.50 O ATOM 1629 CB SER B 473 16.102 -14.113 2.522 1.00 71.25 C ATOM 1630 OG SER B 473 16.450 -14.045 3.902 1.00 4.44 O ATOM 0 H SER B 473 14.137 -12.588 1.131 1.00 4.04 H new ATOM 0 HA SER B 473 16.725 -12.072 2.457 1.00 32.14 H new ATOM 0 HB2 SER B 473 15.118 -14.569 2.419 1.00 71.25 H new ATOM 0 HB3 SER B 473 16.809 -14.759 2.001 1.00 71.25 H new ATOM 0 HG SER B 473 16.442 -14.947 4.286 1.00 4.44 H new ATOM 1635 N ARG B 474 16.007 -12.102 -0.462 1.00 71.12 N ATOM 1636 CA ARG B 474 16.430 -12.088 -1.852 1.00 72.05 C ATOM 1637 C ARG B 474 16.179 -10.712 -2.470 1.00 62.00 C ATOM 1638 O ARG B 474 15.305 -9.975 -2.017 1.00 43.30 O ATOM 1639 CB ARG B 474 15.685 -13.149 -2.664 1.00 14.23 C ATOM 1640 CG ARG B 474 15.913 -14.545 -2.084 1.00 60.43 C ATOM 1641 CD ARG B 474 17.314 -15.059 -2.425 1.00 60.50 C ATOM 1642 NE ARG B 474 17.296 -16.534 -2.549 1.00 13.40 N ATOM 1643 CZ ARG B 474 18.232 -17.249 -3.208 1.00 32.14 C ATOM 1644 NH1 ARG B 474 19.269 -16.630 -3.810 1.00 64.03 N ATOM 1645 NH2 ARG B 474 18.117 -18.564 -3.256 1.00 21.03 N ATOM 0 H ARG B 474 15.190 -11.526 -0.259 1.00 71.12 H new ATOM 0 HA ARG B 474 17.497 -12.311 -1.877 1.00 72.05 H new ATOM 0 HB2 ARG B 474 14.618 -12.924 -2.671 1.00 14.23 H new ATOM 0 HB3 ARG B 474 16.023 -13.122 -3.700 1.00 14.23 H new ATOM 0 HG2 ARG B 474 15.785 -14.518 -1.002 1.00 60.43 H new ATOM 0 HG3 ARG B 474 15.164 -15.233 -2.477 1.00 60.43 H new ATOM 0 HD2 ARG B 474 17.657 -14.612 -3.358 1.00 60.50 H new ATOM 0 HD3 ARG B 474 18.019 -14.760 -1.649 1.00 60.50 H new ATOM 0 HE ARG B 474 16.528 -17.042 -2.109 1.00 13.40 H new ATOM 0 HH11 ARG B 474 19.350 -15.614 -3.769 1.00 64.03 H new ATOM 0 HH12 ARG B 474 19.972 -17.178 -4.306 1.00 64.03 H new ATOM 0 HH21 ARG B 474 17.330 -19.024 -2.799 1.00 21.03 H new ATOM 0 HH22 ARG B 474 18.816 -19.119 -3.750 1.00 21.03 H new ATOM 1655 N PRO B 475 16.983 -10.399 -3.522 1.00 70.10 N ATOM 1656 CA PRO B 475 16.857 -9.123 -4.207 1.00 23.53 C ATOM 1657 C PRO B 475 15.616 -9.103 -5.102 1.00 11.42 C ATOM 1658 O PRO B 475 14.959 -8.072 -5.234 1.00 13.44 O ATOM 1659 CB PRO B 475 18.153 -8.963 -4.983 1.00 71.21 C ATOM 1660 CG PRO B 475 18.757 -10.355 -5.077 1.00 53.03 C ATOM 1661 CD PRO B 475 18.029 -11.248 -4.084 1.00 13.45 C ATOM 0 HA PRO B 475 16.715 -8.288 -3.520 1.00 23.53 H new ATOM 0 HB2 PRO B 475 17.966 -8.551 -5.975 1.00 71.21 H new ATOM 0 HB3 PRO B 475 18.830 -8.277 -4.475 1.00 71.21 H new ATOM 0 HG2 PRO B 475 18.656 -10.747 -6.089 1.00 53.03 H new ATOM 0 HG3 PRO B 475 19.823 -10.324 -4.852 1.00 53.03 H new ATOM 0 HD2 PRO B 475 17.607 -12.125 -4.575 1.00 13.45 H new ATOM 0 HD3 PRO B 475 18.704 -11.611 -3.309 1.00 13.45 H new ATOM 1666 N ALA B 476 15.335 -10.254 -5.695 1.00 23.44 N ATOM 1667 CA ALA B 476 14.185 -10.381 -6.575 1.00 32.43 C ATOM 1668 C ALA B 476 14.323 -11.660 -7.405 1.00 2.32 C ATOM 1669 O ALA B 476 15.384 -11.928 -7.966 1.00 42.10 O ATOM 1670 CB ALA B 476 14.068 -9.130 -7.446 1.00 15.13 C ATOM 0 H ALA B 476 15.883 -11.107 -5.584 1.00 23.44 H new ATOM 0 HA ALA B 476 13.265 -10.461 -5.996 1.00 32.43 H new ATOM 0 HB1 ALA B 476 13.206 -9.225 -8.106 1.00 15.13 H new ATOM 0 HB2 ALA B 476 13.943 -8.254 -6.810 1.00 15.13 H new ATOM 0 HB3 ALA B 476 14.972 -9.017 -8.044 1.00 15.13 H new ATOM 1676 N PRO B 477 13.206 -12.433 -7.458 1.00 21.02 N ATOM 1677 CA PRO B 477 13.191 -13.676 -8.210 1.00 71.21 C ATOM 1678 C PRO B 477 13.119 -13.407 -9.715 1.00 4.44 C ATOM 1679 O PRO B 477 13.244 -12.263 -10.151 1.00 23.10 O ATOM 1680 CB PRO B 477 11.987 -14.441 -7.684 1.00 52.44 C ATOM 1681 CG PRO B 477 11.108 -13.410 -6.996 1.00 4.30 C ATOM 1682 CD PRO B 477 11.931 -12.147 -6.806 1.00 53.43 C ATOM 0 HA PRO B 477 14.103 -14.258 -8.078 1.00 71.21 H new ATOM 0 HB2 PRO B 477 11.451 -14.932 -8.496 1.00 52.44 H new ATOM 0 HB3 PRO B 477 12.294 -15.221 -6.987 1.00 52.44 H new ATOM 0 HG2 PRO B 477 10.223 -13.202 -7.597 1.00 4.30 H new ATOM 0 HG3 PRO B 477 10.759 -13.787 -6.034 1.00 4.30 H new ATOM 0 HD2 PRO B 477 11.441 -11.284 -7.256 1.00 53.43 H new ATOM 0 HD3 PRO B 477 12.069 -11.920 -5.749 1.00 53.43 H new ATOM 1687 N LYS B 478 12.915 -14.479 -10.466 1.00 2.32 N ATOM 1688 CA LYS B 478 12.823 -14.371 -11.912 1.00 54.21 C ATOM 1689 C LYS B 478 11.503 -14.983 -12.382 1.00 21.14 C ATOM 1690 O LYS B 478 11.403 -16.197 -12.556 1.00 50.44 O ATOM 1691 CB LYS B 478 14.057 -14.988 -12.575 1.00 60.33 C ATOM 1692 CG LYS B 478 14.372 -16.360 -11.975 1.00 73.15 C ATOM 1693 CD LYS B 478 15.331 -16.234 -10.790 1.00 72.32 C ATOM 1694 CE LYS B 478 15.192 -17.427 -9.842 1.00 51.20 C ATOM 1695 NZ LYS B 478 15.148 -18.694 -10.607 1.00 61.14 N ATOM 0 H LYS B 478 12.811 -15.426 -10.101 1.00 2.32 H new ATOM 0 HA LYS B 478 12.816 -13.324 -12.216 1.00 54.21 H new ATOM 0 HB2 LYS B 478 13.888 -15.086 -13.647 1.00 60.33 H new ATOM 0 HB3 LYS B 478 14.913 -14.326 -12.447 1.00 60.33 H new ATOM 0 HG2 LYS B 478 13.448 -16.839 -11.650 1.00 73.15 H new ATOM 0 HG3 LYS B 478 14.813 -17.002 -12.738 1.00 73.15 H new ATOM 0 HD2 LYS B 478 16.357 -16.171 -11.153 1.00 72.32 H new ATOM 0 HD3 LYS B 478 15.127 -15.310 -10.249 1.00 72.32 H new ATOM 0 HE2 LYS B 478 16.030 -17.445 -9.145 1.00 51.20 H new ATOM 0 HE3 LYS B 478 14.285 -17.323 -9.247 1.00 51.20 H new ATOM 0 HZ1 LYS B 478 15.359 -19.490 -9.972 1.00 61.14 H new ATOM 0 HZ2 LYS B 478 14.200 -18.820 -11.016 1.00 61.14 H new ATOM 0 HZ3 LYS B 478 15.854 -18.663 -11.370 1.00 61.14 H new ATOM 1704 N PRO B 479 10.493 -14.093 -12.578 1.00 53.23 N ATOM 1705 CA PRO B 479 9.183 -14.533 -13.024 1.00 0.22 C ATOM 1706 C PRO B 479 9.201 -14.891 -14.511 1.00 74.33 C ATOM 1707 O PRO B 479 10.152 -14.568 -15.220 1.00 52.54 O ATOM 1708 CB PRO B 479 8.250 -13.376 -12.704 1.00 15.43 C ATOM 1709 CG PRO B 479 9.142 -12.158 -12.521 1.00 34.42 C ATOM 1710 CD PRO B 479 10.574 -12.648 -12.383 1.00 62.21 C ATOM 0 HA PRO B 479 8.853 -15.444 -12.525 1.00 0.22 H new ATOM 0 HB2 PRO B 479 7.534 -13.218 -13.510 1.00 15.43 H new ATOM 0 HB3 PRO B 479 7.674 -13.577 -11.801 1.00 15.43 H new ATOM 0 HG2 PRO B 479 9.049 -11.485 -13.373 1.00 34.42 H new ATOM 0 HG3 PRO B 479 8.844 -11.595 -11.636 1.00 34.42 H new ATOM 0 HD2 PRO B 479 11.224 -12.184 -13.125 1.00 62.21 H new ATOM 0 HD3 PRO B 479 10.983 -12.403 -11.403 1.00 62.21 H new ATOM 1715 N PRO B 480 8.111 -15.575 -14.951 1.00 51.30 N ATOM 1716 CA PRO B 480 7.992 -15.982 -16.341 1.00 42.34 C ATOM 1717 C PRO B 480 7.649 -14.788 -17.235 1.00 31.23 C ATOM 1718 O PRO B 480 8.250 -14.607 -18.293 1.00 34.43 O ATOM 1719 CB PRO B 480 6.918 -17.057 -16.347 1.00 63.43 C ATOM 1720 CG PRO B 480 6.151 -16.886 -15.046 1.00 31.14 C ATOM 1721 CD PRO B 480 6.965 -15.977 -14.140 1.00 42.53 C ATOM 0 HA PRO B 480 8.926 -16.370 -16.746 1.00 42.34 H new ATOM 0 HB2 PRO B 480 6.258 -16.945 -17.207 1.00 63.43 H new ATOM 0 HB3 PRO B 480 7.361 -18.051 -16.412 1.00 63.43 H new ATOM 0 HG2 PRO B 480 5.168 -16.454 -15.236 1.00 31.14 H new ATOM 0 HG3 PRO B 480 5.988 -17.853 -14.569 1.00 31.14 H new ATOM 0 HD2 PRO B 480 6.383 -15.112 -13.821 1.00 42.53 H new ATOM 0 HD3 PRO B 480 7.282 -16.499 -13.237 1.00 42.53 H new