USER MOD reduce.3.24.130724 H: found=0, std=0, add=434, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 435 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 : A1054 SER OG : rot 38:sc= 0.00512 USER MOD Single : A1055 ASN : amide:sc= -0.148 X(o=-0.15,f=-0.026) USER MOD Single : A1060 TYR OH : rot 180:sc= 0 USER MOD Single : A1062 LYS NZ :NH3+ -113:sc= -0.257 (180deg=-1.09) USER MOD Single : A1063 GLN : amide:sc= -1.98! C(o=-2!,f=-2!) USER MOD Single : A1064 MET CE :methyl 142:sc= -5.15 (180deg=-7.71!) USER MOD Single : A1066 TYR OH : rot 30:sc= -0.15 USER MOD Single : A1068 TYR OH : rot 180:sc= 0 USER MOD Single : A1071 SER OG : rot 180:sc= 0 USER MOD Single : A1087 TYR OH : rot 180:sc= 0 USER MOD Single : A1088 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.0781) USER MOD Single : A1093 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1095 ASN : amide:sc= -0.378 X(o=-0.38,f=-0.42) USER MOD Single : A1097 LYS NZ :NH3+ 153:sc= -0.14 (180deg=-1.1) USER MOD Single : A1099 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0266) USER MOD Single : A1100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A1054 -1.988 -8.777 21.602 1.00 12.20 N ATOM 2 CA SER A1054 -1.879 -7.420 22.125 1.00 53.22 C ATOM 3 C SER A1054 -1.041 -6.546 21.196 1.00 23.02 C ATOM 4 O SER A1054 -1.548 -5.610 20.582 1.00 52.12 O ATOM 5 CB SER A1054 -1.260 -7.438 23.524 1.00 75.43 C ATOM 6 OG SER A1054 -2.132 -8.047 24.460 1.00 14.51 O ATOM 0 HA SER A1054 -2.882 -6.998 22.185 1.00 53.22 H new ATOM 0 HB2 SER A1054 -0.314 -7.978 23.499 1.00 75.43 H new ATOM 0 HB3 SER A1054 -1.037 -6.419 23.840 1.00 75.43 H new ATOM 0 HG SER A1054 -2.586 -8.806 24.038 1.00 14.51 H new ATOM 12 N ASN A1055 0.248 -6.861 21.102 1.00 55.13 N ATOM 13 CA ASN A1055 1.158 -6.105 20.249 1.00 30.14 C ATOM 14 C ASN A1055 0.859 -6.359 18.774 1.00 11.54 C ATOM 15 O ASN A1055 0.398 -7.436 18.401 1.00 61.40 O ATOM 16 CB ASN A1055 2.609 -6.479 20.558 1.00 11.55 C ATOM 17 CG ASN A1055 3.197 -5.637 21.674 1.00 63.14 C ATOM 18 OD1 ASN A1055 3.664 -6.163 22.684 1.00 50.22 O ATOM 19 ND2 ASN A1055 3.178 -4.321 21.494 1.00 1.14 N ATOM 0 H ASN A1055 0.685 -7.633 21.605 1.00 55.13 H new ATOM 0 HA ASN A1055 1.011 -5.045 20.454 1.00 30.14 H new ATOM 0 HB2 ASN A1055 2.659 -7.532 20.836 1.00 11.55 H new ATOM 0 HB3 ASN A1055 3.212 -6.358 19.658 1.00 11.55 H new ATOM 0 HD21 ASN A1055 3.561 -3.703 22.209 1.00 1.14 H new ATOM 0 HD22 ASN A1055 2.781 -3.929 20.640 1.00 1.14 H new ATOM 26 N ALA A1056 1.126 -5.357 17.942 1.00 34.11 N ATOM 27 CA ALA A1056 0.889 -5.473 16.509 1.00 52.24 C ATOM 28 C ALA A1056 2.125 -5.067 15.713 1.00 34.33 C ATOM 29 O ALA A1056 2.946 -4.278 16.182 1.00 73.20 O ATOM 30 CB ALA A1056 -0.305 -4.622 16.102 1.00 74.15 C ATOM 0 H ALA A1056 1.506 -4.457 18.236 1.00 34.11 H new ATOM 0 HA ALA A1056 0.672 -6.517 16.285 1.00 52.24 H new ATOM 0 HB1 ALA A1056 -0.471 -4.718 15.029 1.00 74.15 H new ATOM 0 HB2 ALA A1056 -1.192 -4.960 16.638 1.00 74.15 H new ATOM 0 HB3 ALA A1056 -0.108 -3.578 16.347 1.00 74.15 H new ATOM 36 N ASP A1057 2.252 -5.613 14.509 1.00 61.22 N ATOM 37 CA ASP A1057 3.389 -5.308 13.648 1.00 42.15 C ATOM 38 C ASP A1057 3.274 -6.040 12.314 1.00 13.43 C ATOM 39 O ASP A1057 3.239 -7.270 12.271 1.00 71.43 O ATOM 40 CB ASP A1057 4.699 -5.688 14.341 1.00 34.24 C ATOM 41 CG ASP A1057 5.756 -4.610 14.215 1.00 72.31 C ATOM 42 OD1 ASP A1057 5.673 -3.807 13.262 1.00 72.15 O ATOM 43 OD2 ASP A1057 6.667 -4.569 15.067 1.00 4.15 O ATOM 0 H ASP A1057 1.582 -6.269 14.107 1.00 61.22 H new ATOM 0 HA ASP A1057 3.388 -4.235 13.454 1.00 42.15 H new ATOM 0 HB2 ASP A1057 4.505 -5.881 15.396 1.00 34.24 H new ATOM 0 HB3 ASP A1057 5.078 -6.616 13.912 1.00 34.24 H new ATOM 48 N VAL A1058 3.212 -5.276 11.228 1.00 23.24 N ATOM 49 CA VAL A1058 3.100 -5.852 9.894 1.00 50.01 C ATOM 50 C VAL A1058 3.610 -4.884 8.833 1.00 64.45 C ATOM 51 O VAL A1058 2.851 -4.076 8.297 1.00 24.20 O ATOM 52 CB VAL A1058 1.644 -6.233 9.567 1.00 21.22 C ATOM 53 CG1 VAL A1058 0.705 -5.083 9.894 1.00 52.33 C ATOM 54 CG2 VAL A1058 1.515 -6.641 8.107 1.00 14.10 C ATOM 0 H VAL A1058 3.237 -4.256 11.246 1.00 23.24 H new ATOM 0 HA VAL A1058 3.714 -6.753 9.886 1.00 50.01 H new ATOM 0 HB VAL A1058 1.362 -7.086 10.184 1.00 21.22 H new ATOM 0 HG11 VAL A1058 -0.319 -5.371 9.656 1.00 52.33 H new ATOM 0 HG12 VAL A1058 0.778 -4.844 10.955 1.00 52.33 H new ATOM 0 HG13 VAL A1058 0.982 -4.208 9.305 1.00 52.33 H new ATOM 0 HG21 VAL A1058 0.480 -6.907 7.894 1.00 14.10 H new ATOM 0 HG22 VAL A1058 1.815 -5.810 7.469 1.00 14.10 H new ATOM 0 HG23 VAL A1058 2.158 -7.499 7.911 1.00 14.10 H new ATOM 64 N VAL A1059 4.902 -4.971 8.532 1.00 41.43 N ATOM 65 CA VAL A1059 5.515 -4.103 7.533 1.00 12.42 C ATOM 66 C VAL A1059 6.021 -4.909 6.342 1.00 14.41 C ATOM 67 O VAL A1059 5.908 -4.476 5.195 1.00 42.11 O ATOM 68 CB VAL A1059 6.686 -3.300 8.130 1.00 52.45 C ATOM 69 CG1 VAL A1059 7.161 -2.238 7.149 1.00 33.54 C ATOM 70 CG2 VAL A1059 6.279 -2.670 9.454 1.00 40.33 C ATOM 0 H VAL A1059 5.545 -5.634 8.966 1.00 41.43 H new ATOM 0 HA VAL A1059 4.743 -3.410 7.198 1.00 12.42 H new ATOM 0 HB VAL A1059 7.514 -3.983 8.318 1.00 52.45 H new ATOM 0 HG11 VAL A1059 7.989 -1.681 7.588 1.00 33.54 H new ATOM 0 HG12 VAL A1059 7.494 -2.716 6.228 1.00 33.54 H new ATOM 0 HG13 VAL A1059 6.341 -1.555 6.927 1.00 33.54 H new ATOM 0 HG21 VAL A1059 7.118 -2.106 9.862 1.00 40.33 H new ATOM 0 HG22 VAL A1059 5.435 -1.999 9.294 1.00 40.33 H new ATOM 0 HG23 VAL A1059 5.992 -3.453 10.156 1.00 40.33 H new ATOM 80 N TYR A1060 6.578 -6.081 6.622 1.00 20.11 N ATOM 81 CA TYR A1060 7.103 -6.947 5.573 1.00 33.31 C ATOM 82 C TYR A1060 6.578 -8.372 5.729 1.00 64.32 C ATOM 83 O TYR A1060 5.720 -8.816 4.968 1.00 53.43 O ATOM 84 CB TYR A1060 8.632 -6.949 5.603 1.00 61.43 C ATOM 85 CG TYR A1060 9.243 -5.580 5.404 1.00 61.01 C ATOM 86 CD1 TYR A1060 9.429 -4.719 6.478 1.00 14.53 C ATOM 87 CD2 TYR A1060 9.635 -5.149 4.143 1.00 52.14 C ATOM 88 CE1 TYR A1060 9.986 -3.468 6.302 1.00 53.54 C ATOM 89 CE2 TYR A1060 10.194 -3.899 3.958 1.00 32.41 C ATOM 90 CZ TYR A1060 10.367 -3.062 5.040 1.00 75.53 C ATOM 91 OH TYR A1060 10.923 -1.816 4.860 1.00 45.22 O ATOM 0 H TYR A1060 6.678 -6.454 7.566 1.00 20.11 H new ATOM 0 HA TYR A1060 6.765 -6.558 4.612 1.00 33.31 H new ATOM 0 HB2 TYR A1060 8.968 -7.352 6.558 1.00 61.43 H new ATOM 0 HB3 TYR A1060 9.001 -7.619 4.827 1.00 61.43 H new ATOM 0 HD1 TYR A1060 9.133 -5.034 7.468 1.00 14.53 H new ATOM 0 HD2 TYR A1060 9.501 -5.802 3.293 1.00 52.14 H new ATOM 0 HE1 TYR A1060 10.123 -2.811 7.148 1.00 53.54 H new ATOM 0 HE2 TYR A1060 10.494 -3.579 2.971 1.00 32.41 H new ATOM 0 HH TYR A1060 11.136 -1.687 3.912 1.00 45.22 H new ATOM 101 N GLU A1061 7.103 -9.083 6.723 1.00 51.04 N ATOM 102 CA GLU A1061 6.688 -10.457 6.980 1.00 61.11 C ATOM 103 C GLU A1061 6.808 -10.794 8.463 1.00 5.41 C ATOM 104 O GLU A1061 6.976 -11.955 8.836 1.00 4.52 O ATOM 105 CB GLU A1061 7.533 -11.431 6.155 1.00 54.43 C ATOM 106 CG GLU A1061 8.916 -11.677 6.733 1.00 22.13 C ATOM 107 CD GLU A1061 9.869 -12.289 5.724 1.00 44.41 C ATOM 108 OE1 GLU A1061 9.388 -12.903 4.750 1.00 13.22 O ATOM 109 OE2 GLU A1061 11.097 -12.152 5.909 1.00 33.34 O ATOM 0 H GLU A1061 7.815 -8.730 7.362 1.00 51.04 H new ATOM 0 HA GLU A1061 5.643 -10.554 6.687 1.00 61.11 H new ATOM 0 HB2 GLU A1061 7.006 -12.382 6.079 1.00 54.43 H new ATOM 0 HB3 GLU A1061 7.636 -11.042 5.142 1.00 54.43 H new ATOM 0 HG2 GLU A1061 9.329 -10.734 7.092 1.00 22.13 H new ATOM 0 HG3 GLU A1061 8.833 -12.338 7.596 1.00 22.13 H new ATOM 116 N LYS A1062 6.722 -9.769 9.305 1.00 20.10 N ATOM 117 CA LYS A1062 6.820 -9.953 10.748 1.00 30.11 C ATOM 118 C LYS A1062 5.468 -10.337 11.341 1.00 70.25 C ATOM 119 O LYS A1062 5.308 -10.391 12.559 1.00 23.34 O ATOM 120 CB LYS A1062 7.336 -8.675 11.412 1.00 14.11 C ATOM 121 CG LYS A1062 6.518 -7.442 11.074 1.00 51.44 C ATOM 122 CD LYS A1062 6.971 -6.234 11.877 1.00 12.11 C ATOM 123 CE LYS A1062 8.423 -5.884 11.586 1.00 50.31 C ATOM 124 NZ LYS A1062 8.634 -5.544 10.152 1.00 24.31 N ATOM 0 H LYS A1062 6.585 -8.802 9.012 1.00 20.10 H new ATOM 0 HA LYS A1062 7.524 -10.763 10.939 1.00 30.11 H new ATOM 0 HB2 LYS A1062 7.340 -8.813 12.493 1.00 14.11 H new ATOM 0 HB3 LYS A1062 8.370 -8.510 11.108 1.00 14.11 H new ATOM 0 HG2 LYS A1062 6.607 -7.226 10.009 1.00 51.44 H new ATOM 0 HG3 LYS A1062 5.464 -7.638 11.273 1.00 51.44 H new ATOM 0 HD2 LYS A1062 6.336 -5.380 11.642 1.00 12.11 H new ATOM 0 HD3 LYS A1062 6.851 -6.437 12.941 1.00 12.11 H new ATOM 0 HE2 LYS A1062 8.725 -5.041 12.207 1.00 50.31 H new ATOM 0 HE3 LYS A1062 9.061 -6.725 11.858 1.00 50.31 H new ATOM 0 HZ1 LYS A1062 9.228 -6.272 9.706 1.00 24.31 H new ATOM 0 HZ2 LYS A1062 7.715 -5.502 9.666 1.00 24.31 H new ATOM 0 HZ3 LYS A1062 9.106 -4.620 10.080 1.00 24.31 H new ATOM 138 N GLN A1063 4.500 -10.604 10.470 1.00 55.13 N ATOM 139 CA GLN A1063 3.162 -10.983 10.909 1.00 23.50 C ATOM 140 C GLN A1063 3.171 -12.367 11.549 1.00 23.02 C ATOM 141 O GLN A1063 2.188 -12.788 12.158 1.00 53.54 O ATOM 142 CB GLN A1063 2.190 -10.962 9.728 1.00 32.12 C ATOM 143 CG GLN A1063 2.270 -9.692 8.897 1.00 42.22 C ATOM 144 CD GLN A1063 1.375 -9.736 7.674 1.00 22.45 C ATOM 145 OE1 GLN A1063 1.852 -9.694 6.540 1.00 45.23 O ATOM 146 NE2 GLN A1063 0.069 -9.824 7.898 1.00 42.33 N ATOM 0 H GLN A1063 4.617 -10.565 9.457 1.00 55.13 H new ATOM 0 HA GLN A1063 2.833 -10.259 11.655 1.00 23.50 H new ATOM 0 HB2 GLN A1063 2.392 -11.820 9.086 1.00 32.12 H new ATOM 0 HB3 GLN A1063 1.173 -11.077 10.103 1.00 32.12 H new ATOM 0 HG2 GLN A1063 1.991 -8.839 9.516 1.00 42.22 H new ATOM 0 HG3 GLN A1063 3.301 -9.533 8.582 1.00 42.22 H new ATOM 0 HE21 GLN A1063 -0.283 -9.856 8.855 1.00 42.33 H new ATOM 0 HE22 GLN A1063 -0.582 -9.859 7.113 1.00 42.33 H new ATOM 155 N MET A1064 4.290 -13.072 11.408 1.00 10.54 N ATOM 156 CA MET A1064 4.427 -14.409 11.975 1.00 50.05 C ATOM 157 C MET A1064 3.243 -15.288 11.586 1.00 52.30 C ATOM 158 O MET A1064 2.836 -16.170 12.343 1.00 41.20 O ATOM 159 CB MET A1064 4.541 -14.332 13.498 1.00 44.13 C ATOM 160 CG MET A1064 5.698 -13.470 13.977 1.00 12.23 C ATOM 161 SD MET A1064 7.297 -14.072 13.403 1.00 65.11 S ATOM 162 CE MET A1064 7.405 -13.274 11.803 1.00 30.25 C ATOM 0 H MET A1064 5.114 -12.740 10.907 1.00 10.54 H new ATOM 0 HA MET A1064 5.336 -14.855 11.573 1.00 50.05 H new ATOM 0 HB2 MET A1064 3.611 -13.936 13.904 1.00 44.13 H new ATOM 0 HB3 MET A1064 4.659 -15.339 13.897 1.00 44.13 H new ATOM 0 HG2 MET A1064 5.553 -12.448 13.628 1.00 12.23 H new ATOM 0 HG3 MET A1064 5.696 -13.439 15.067 1.00 12.23 H new ATOM 0 HE1 MET A1064 8.433 -12.959 11.622 1.00 30.25 H new ATOM 0 HE2 MET A1064 7.098 -13.974 11.026 1.00 30.25 H new ATOM 0 HE3 MET A1064 6.750 -12.403 11.786 1.00 30.25 H new ATOM 172 N LEU A1065 2.692 -15.042 10.402 1.00 64.44 N ATOM 173 CA LEU A1065 1.554 -15.812 9.912 1.00 15.51 C ATOM 174 C LEU A1065 2.019 -17.032 9.124 1.00 3.32 C ATOM 175 O LEU A1065 1.483 -18.128 9.285 1.00 22.44 O ATOM 176 CB LEU A1065 0.659 -14.935 9.034 1.00 44.45 C ATOM 177 CG LEU A1065 -0.520 -14.263 9.738 1.00 14.42 C ATOM 178 CD1 LEU A1065 -0.885 -12.961 9.042 1.00 74.04 C ATOM 179 CD2 LEU A1065 -1.718 -15.200 9.783 1.00 54.32 C ATOM 0 H LEU A1065 3.015 -14.315 9.764 1.00 64.44 H new ATOM 0 HA LEU A1065 0.983 -16.156 10.774 1.00 15.51 H new ATOM 0 HB2 LEU A1065 1.276 -14.159 8.581 1.00 44.45 H new ATOM 0 HB3 LEU A1065 0.270 -15.547 8.221 1.00 44.45 H new ATOM 0 HG LEU A1065 -0.225 -14.033 10.762 1.00 14.42 H new ATOM 0 HD11 LEU A1065 -1.726 -12.497 9.557 1.00 74.04 H new ATOM 0 HD12 LEU A1065 -0.030 -12.286 9.062 1.00 74.04 H new ATOM 0 HD13 LEU A1065 -1.161 -13.166 8.008 1.00 74.04 H new ATOM 0 HD21 LEU A1065 -2.548 -14.705 10.288 1.00 54.32 H new ATOM 0 HD22 LEU A1065 -2.014 -15.461 8.767 1.00 54.32 H new ATOM 0 HD23 LEU A1065 -1.451 -16.106 10.327 1.00 54.32 H new ATOM 191 N TYR A1066 3.021 -16.834 8.275 1.00 62.10 N ATOM 192 CA TYR A1066 3.559 -17.919 7.462 1.00 41.54 C ATOM 193 C TYR A1066 3.949 -19.110 8.331 1.00 4.45 C ATOM 194 O TYR A1066 4.006 -20.246 7.860 1.00 65.32 O ATOM 195 CB TYR A1066 4.773 -17.435 6.667 1.00 44.52 C ATOM 196 CG TYR A1066 6.017 -17.259 7.509 1.00 71.01 C ATOM 197 CD1 TYR A1066 6.285 -16.053 8.144 1.00 45.53 C ATOM 198 CD2 TYR A1066 6.924 -18.300 7.669 1.00 4.32 C ATOM 199 CE1 TYR A1066 7.422 -15.888 8.914 1.00 55.35 C ATOM 200 CE2 TYR A1066 8.061 -18.144 8.438 1.00 23.11 C ATOM 201 CZ TYR A1066 8.306 -16.936 9.058 1.00 74.25 C ATOM 202 OH TYR A1066 9.438 -16.776 9.824 1.00 74.40 O ATOM 0 H TYR A1066 3.477 -15.933 8.132 1.00 62.10 H new ATOM 0 HA TYR A1066 2.781 -18.238 6.768 1.00 41.54 H new ATOM 0 HB2 TYR A1066 4.982 -18.148 5.869 1.00 44.52 H new ATOM 0 HB3 TYR A1066 4.530 -16.485 6.190 1.00 44.52 H new ATOM 0 HD1 TYR A1066 5.594 -15.230 8.035 1.00 45.53 H new ATOM 0 HD2 TYR A1066 6.737 -19.247 7.184 1.00 4.32 H new ATOM 0 HE1 TYR A1066 7.616 -14.943 9.400 1.00 55.35 H new ATOM 0 HE2 TYR A1066 8.755 -18.964 8.553 1.00 23.11 H new ATOM 0 HH TYR A1066 9.262 -16.127 10.537 1.00 74.40 H new ATOM 212 N LEU A1067 4.216 -18.842 9.605 1.00 15.51 N ATOM 213 CA LEU A1067 4.600 -19.891 10.544 1.00 43.44 C ATOM 214 C LEU A1067 3.379 -20.677 11.011 1.00 51.03 C ATOM 215 O LEU A1067 3.429 -21.901 11.142 1.00 51.22 O ATOM 216 CB LEU A1067 5.322 -19.285 11.749 1.00 45.43 C ATOM 217 CG LEU A1067 6.543 -18.420 11.434 1.00 2.24 C ATOM 218 CD1 LEU A1067 6.659 -17.278 12.432 1.00 51.35 C ATOM 219 CD2 LEU A1067 7.809 -19.264 11.436 1.00 43.41 C ATOM 0 H LEU A1067 4.174 -17.907 10.011 1.00 15.51 H new ATOM 0 HA LEU A1067 5.275 -20.575 10.030 1.00 43.44 H new ATOM 0 HB2 LEU A1067 4.608 -18.681 12.309 1.00 45.43 H new ATOM 0 HB3 LEU A1067 5.636 -20.097 12.405 1.00 45.43 H new ATOM 0 HG LEU A1067 6.416 -17.994 10.439 1.00 2.24 H new ATOM 0 HD11 LEU A1067 7.533 -16.673 12.193 1.00 51.35 H new ATOM 0 HD12 LEU A1067 5.764 -16.658 12.381 1.00 51.35 H new ATOM 0 HD13 LEU A1067 6.763 -17.683 13.438 1.00 51.35 H new ATOM 0 HD21 LEU A1067 8.668 -18.632 11.210 1.00 43.41 H new ATOM 0 HD22 LEU A1067 7.941 -19.719 12.418 1.00 43.41 H new ATOM 0 HD23 LEU A1067 7.726 -20.047 10.682 1.00 43.41 H new ATOM 231 N TYR A1068 2.284 -19.968 11.257 1.00 3.33 N ATOM 232 CA TYR A1068 1.050 -20.599 11.710 1.00 0.11 C ATOM 233 C TYR A1068 0.431 -21.443 10.600 1.00 14.30 C ATOM 234 O TYR A1068 -0.122 -22.513 10.853 1.00 73.43 O ATOM 235 CB TYR A1068 0.051 -19.539 12.177 1.00 4.23 C ATOM 236 CG TYR A1068 -1.228 -19.516 11.373 1.00 61.11 C ATOM 237 CD1 TYR A1068 -2.257 -20.410 11.640 1.00 30.41 C ATOM 238 CD2 TYR A1068 -1.408 -18.598 10.345 1.00 12.50 C ATOM 239 CE1 TYR A1068 -3.427 -20.393 10.906 1.00 14.45 C ATOM 240 CE2 TYR A1068 -2.576 -18.573 9.607 1.00 15.33 C ATOM 241 CZ TYR A1068 -3.582 -19.472 9.891 1.00 73.11 C ATOM 242 OH TYR A1068 -4.748 -19.451 9.159 1.00 21.21 O ATOM 0 H TYR A1068 2.225 -18.955 11.150 1.00 3.33 H new ATOM 0 HA TYR A1068 1.293 -21.253 12.547 1.00 0.11 H new ATOM 0 HB2 TYR A1068 -0.192 -19.717 13.225 1.00 4.23 H new ATOM 0 HB3 TYR A1068 0.523 -18.558 12.121 1.00 4.23 H new ATOM 0 HD1 TYR A1068 -2.140 -21.131 12.435 1.00 30.41 H new ATOM 0 HD2 TYR A1068 -0.622 -17.893 10.119 1.00 12.50 H new ATOM 0 HE1 TYR A1068 -4.216 -21.097 11.126 1.00 14.45 H new ATOM 0 HE2 TYR A1068 -2.700 -17.853 8.812 1.00 15.33 H new ATOM 0 HH TYR A1068 -4.698 -18.743 8.484 1.00 21.21 H new ATOM 252 N VAL A1069 0.528 -20.952 9.368 1.00 42.01 N ATOM 253 CA VAL A1069 -0.020 -21.659 8.218 1.00 32.43 C ATOM 254 C VAL A1069 0.821 -22.884 7.874 1.00 63.43 C ATOM 255 O VAL A1069 0.298 -23.905 7.427 1.00 51.41 O ATOM 256 CB VAL A1069 -0.102 -20.744 6.982 1.00 45.03 C ATOM 257 CG1 VAL A1069 1.290 -20.327 6.533 1.00 43.32 C ATOM 258 CG2 VAL A1069 -0.850 -21.438 5.854 1.00 55.43 C ATOM 0 H VAL A1069 0.981 -20.067 9.142 1.00 42.01 H new ATOM 0 HA VAL A1069 -1.026 -21.977 8.493 1.00 32.43 H new ATOM 0 HB VAL A1069 -0.654 -19.844 7.253 1.00 45.03 H new ATOM 0 HG11 VAL A1069 1.212 -19.681 5.659 1.00 43.32 H new ATOM 0 HG12 VAL A1069 1.786 -19.787 7.340 1.00 43.32 H new ATOM 0 HG13 VAL A1069 1.871 -21.213 6.278 1.00 43.32 H new ATOM 0 HG21 VAL A1069 -0.898 -20.777 4.989 1.00 55.43 H new ATOM 0 HG22 VAL A1069 -0.328 -22.355 5.581 1.00 55.43 H new ATOM 0 HG23 VAL A1069 -1.861 -21.680 6.183 1.00 55.43 H new ATOM 268 N LEU A1070 2.128 -22.775 8.086 1.00 31.41 N ATOM 269 CA LEU A1070 3.044 -23.874 7.800 1.00 74.43 C ATOM 270 C LEU A1070 2.922 -24.973 8.850 1.00 13.31 C ATOM 271 O LEU A1070 3.038 -26.158 8.540 1.00 75.11 O ATOM 272 CB LEU A1070 4.484 -23.363 7.744 1.00 43.41 C ATOM 273 CG LEU A1070 5.491 -24.267 7.032 1.00 3.12 C ATOM 274 CD1 LEU A1070 5.238 -24.270 5.533 1.00 32.33 C ATOM 275 CD2 LEU A1070 6.914 -23.821 7.334 1.00 23.42 C ATOM 0 H LEU A1070 2.577 -21.937 8.455 1.00 31.41 H new ATOM 0 HA LEU A1070 2.776 -24.293 6.830 1.00 74.43 H new ATOM 0 HB2 LEU A1070 4.485 -22.392 7.249 1.00 43.41 H new ATOM 0 HB3 LEU A1070 4.830 -23.201 8.765 1.00 43.41 H new ATOM 0 HG LEU A1070 5.364 -25.284 7.403 1.00 3.12 H new ATOM 0 HD11 LEU A1070 5.964 -24.919 5.043 1.00 32.33 H new ATOM 0 HD12 LEU A1070 4.231 -24.637 5.335 1.00 32.33 H new ATOM 0 HD13 LEU A1070 5.337 -23.256 5.145 1.00 32.33 H new ATOM 0 HD21 LEU A1070 7.617 -24.475 6.819 1.00 23.42 H new ATOM 0 HD22 LEU A1070 7.055 -22.796 6.991 1.00 23.42 H new ATOM 0 HD23 LEU A1070 7.091 -23.872 8.408 1.00 23.42 H new ATOM 287 N SER A1071 2.685 -24.571 10.095 1.00 41.31 N ATOM 288 CA SER A1071 2.548 -25.521 11.192 1.00 53.31 C ATOM 289 C SER A1071 1.207 -26.245 11.120 1.00 64.42 C ATOM 290 O SER A1071 1.076 -27.379 11.577 1.00 32.34 O ATOM 291 CB SER A1071 2.680 -24.802 12.536 1.00 64.30 C ATOM 292 OG SER A1071 2.415 -25.683 13.614 1.00 14.33 O ATOM 0 H SER A1071 2.584 -23.594 10.369 1.00 41.31 H new ATOM 0 HA SER A1071 3.345 -26.259 11.102 1.00 53.31 H new ATOM 0 HB2 SER A1071 3.685 -24.392 12.636 1.00 64.30 H new ATOM 0 HB3 SER A1071 1.988 -23.961 12.571 1.00 64.30 H new ATOM 0 HG SER A1071 2.507 -25.200 14.462 1.00 14.33 H new ATOM 298 N GLY A1072 0.212 -25.579 10.542 1.00 40.22 N ATOM 299 CA GLY A1072 -1.106 -26.174 10.420 1.00 51.23 C ATOM 300 C GLY A1072 -1.177 -27.203 9.309 1.00 14.44 C ATOM 301 O GLY A1072 -1.841 -28.231 9.449 1.00 42.41 O ATOM 0 H GLY A1072 0.295 -24.638 10.156 1.00 40.22 H new ATOM 0 HA2 GLY A1072 -1.378 -26.645 11.365 1.00 51.23 H new ATOM 0 HA3 GLY A1072 -1.839 -25.390 10.232 1.00 51.23 H new ATOM 305 N ILE A1073 -0.496 -26.925 8.204 1.00 23.43 N ATOM 306 CA ILE A1073 -0.485 -27.836 7.065 1.00 11.04 C ATOM 307 C ILE A1073 0.395 -29.051 7.340 1.00 62.04 C ATOM 308 O ILE A1073 0.130 -30.147 6.848 1.00 51.12 O ATOM 309 CB ILE A1073 0.012 -27.134 5.787 1.00 5.34 C ATOM 310 CG1 ILE A1073 1.494 -26.777 5.921 1.00 72.15 C ATOM 311 CG2 ILE A1073 -0.816 -25.888 5.511 1.00 40.45 C ATOM 312 CD1 ILE A1073 2.066 -26.104 4.692 1.00 1.10 C ATOM 0 H ILE A1073 0.055 -26.077 8.072 1.00 23.43 H new ATOM 0 HA ILE A1073 -1.514 -28.163 6.913 1.00 11.04 H new ATOM 0 HB ILE A1073 -0.104 -27.817 4.945 1.00 5.34 H new ATOM 0 HG12 ILE A1073 1.625 -26.119 6.780 1.00 72.15 H new ATOM 0 HG13 ILE A1073 2.061 -27.685 6.126 1.00 72.15 H new ATOM 0 HG21 ILE A1073 -0.453 -25.403 4.605 1.00 40.45 H new ATOM 0 HG22 ILE A1073 -1.861 -26.168 5.379 1.00 40.45 H new ATOM 0 HG23 ILE A1073 -0.728 -25.199 6.351 1.00 40.45 H new ATOM 0 HD11 ILE A1073 3.120 -25.879 4.857 1.00 1.10 H new ATOM 0 HD12 ILE A1073 1.967 -26.769 3.834 1.00 1.10 H new ATOM 0 HD13 ILE A1073 1.524 -25.178 4.498 1.00 1.10 H new ATOM 324 N GLY A1074 1.444 -28.847 8.131 1.00 61.51 N ATOM 325 CA GLY A1074 2.347 -29.935 8.459 1.00 32.15 C ATOM 326 C GLY A1074 1.754 -30.896 9.471 1.00 12.45 C ATOM 327 O GLY A1074 2.018 -32.096 9.428 1.00 63.03 O ATOM 0 H GLY A1074 1.685 -27.949 8.550 1.00 61.51 H new ATOM 0 HA2 GLY A1074 2.599 -30.480 7.550 1.00 32.15 H new ATOM 0 HA3 GLY A1074 3.277 -29.525 8.853 1.00 32.15 H new ATOM 331 N GLY A1075 0.949 -30.366 10.387 1.00 15.33 N ATOM 332 CA GLY A1075 0.330 -31.198 11.403 1.00 45.23 C ATOM 333 C GLY A1075 -0.821 -32.019 10.857 1.00 13.30 C ATOM 334 O GLY A1075 -1.069 -33.135 11.314 1.00 52.01 O ATOM 0 H GLY A1075 0.714 -29.375 10.444 1.00 15.33 H new ATOM 0 HA2 GLY A1075 1.079 -31.866 11.828 1.00 45.23 H new ATOM 0 HA3 GLY A1075 -0.031 -30.567 12.215 1.00 45.23 H new ATOM 338 N LEU A1076 -1.529 -31.465 9.879 1.00 11.12 N ATOM 339 CA LEU A1076 -2.663 -32.152 9.272 1.00 54.10 C ATOM 340 C LEU A1076 -2.192 -33.295 8.378 1.00 2.21 C ATOM 341 O LEU A1076 -2.808 -34.361 8.339 1.00 23.11 O ATOM 342 CB LEU A1076 -3.505 -31.167 8.458 1.00 33.22 C ATOM 343 CG LEU A1076 -4.768 -30.641 9.140 1.00 12.45 C ATOM 344 CD1 LEU A1076 -4.427 -30.017 10.485 1.00 54.43 C ATOM 345 CD2 LEU A1076 -5.477 -29.633 8.247 1.00 30.12 C ATOM 0 H LEU A1076 -1.338 -30.542 9.490 1.00 11.12 H new ATOM 0 HA LEU A1076 -3.274 -32.569 10.072 1.00 54.10 H new ATOM 0 HB2 LEU A1076 -2.878 -30.316 8.193 1.00 33.22 H new ATOM 0 HB3 LEU A1076 -3.795 -31.652 7.526 1.00 33.22 H new ATOM 0 HG LEU A1076 -5.442 -31.481 9.312 1.00 12.45 H new ATOM 0 HD11 LEU A1076 -5.338 -29.648 10.956 1.00 54.43 H new ATOM 0 HD12 LEU A1076 -3.964 -30.767 11.127 1.00 54.43 H new ATOM 0 HD13 LEU A1076 -3.734 -29.189 10.337 1.00 54.43 H new ATOM 0 HD21 LEU A1076 -6.374 -29.270 8.749 1.00 30.12 H new ATOM 0 HD22 LEU A1076 -4.810 -28.795 8.043 1.00 30.12 H new ATOM 0 HD23 LEU A1076 -5.756 -30.111 7.308 1.00 30.12 H new ATOM 357 N LEU A1077 -1.096 -33.067 7.663 1.00 51.31 N ATOM 358 CA LEU A1077 -0.540 -34.079 6.772 1.00 42.11 C ATOM 359 C LEU A1077 0.048 -35.240 7.566 1.00 21.31 C ATOM 360 O LEU A1077 -0.067 -36.400 7.167 1.00 62.01 O ATOM 361 CB LEU A1077 0.536 -33.462 5.875 1.00 4.43 C ATOM 362 CG LEU A1077 0.711 -34.102 4.499 1.00 74.43 C ATOM 363 CD1 LEU A1077 -0.372 -33.623 3.545 1.00 41.13 C ATOM 364 CD2 LEU A1077 2.092 -33.793 3.939 1.00 73.31 C ATOM 0 H LEU A1077 -0.575 -32.190 7.683 1.00 51.31 H new ATOM 0 HA LEU A1077 -1.348 -34.462 6.149 1.00 42.11 H new ATOM 0 HB2 LEU A1077 0.303 -32.406 5.735 1.00 4.43 H new ATOM 0 HB3 LEU A1077 1.490 -33.511 6.400 1.00 4.43 H new ATOM 0 HG LEU A1077 0.618 -35.183 4.608 1.00 74.43 H new ATOM 0 HD11 LEU A1077 -0.231 -34.090 2.570 1.00 41.13 H new ATOM 0 HD12 LEU A1077 -1.351 -33.896 3.939 1.00 41.13 H new ATOM 0 HD13 LEU A1077 -0.312 -32.540 3.441 1.00 41.13 H new ATOM 0 HD21 LEU A1077 2.199 -34.257 2.958 1.00 73.31 H new ATOM 0 HD22 LEU A1077 2.213 -32.714 3.845 1.00 73.31 H new ATOM 0 HD23 LEU A1077 2.854 -34.187 4.612 1.00 73.31 H new ATOM 376 N LEU A1078 0.676 -34.922 8.692 1.00 24.41 N ATOM 377 CA LEU A1078 1.281 -35.940 9.545 1.00 65.32 C ATOM 378 C LEU A1078 0.213 -36.719 10.306 1.00 53.33 C ATOM 379 O LEU A1078 0.425 -37.868 10.693 1.00 12.23 O ATOM 380 CB LEU A1078 2.257 -35.294 10.530 1.00 43.32 C ATOM 381 CG LEU A1078 3.730 -35.299 10.117 1.00 12.42 C ATOM 382 CD1 LEU A1078 3.894 -34.718 8.721 1.00 21.11 C ATOM 383 CD2 LEU A1078 4.568 -34.522 11.122 1.00 51.21 C ATOM 0 H LEU A1078 0.780 -33.967 9.036 1.00 24.41 H new ATOM 0 HA LEU A1078 1.826 -36.636 8.907 1.00 65.32 H new ATOM 0 HB2 LEU A1078 1.949 -34.261 10.691 1.00 43.32 H new ATOM 0 HB3 LEU A1078 2.167 -35.806 11.488 1.00 43.32 H new ATOM 0 HG LEU A1078 4.081 -36.331 10.103 1.00 12.42 H new ATOM 0 HD11 LEU A1078 4.948 -34.729 8.444 1.00 21.11 H new ATOM 0 HD12 LEU A1078 3.325 -35.316 8.009 1.00 21.11 H new ATOM 0 HD13 LEU A1078 3.527 -33.692 8.709 1.00 21.11 H new ATOM 0 HD21 LEU A1078 5.613 -34.536 10.812 1.00 51.21 H new ATOM 0 HD22 LEU A1078 4.217 -33.491 11.169 1.00 51.21 H new ATOM 0 HD23 LEU A1078 4.475 -34.982 12.106 1.00 51.21 H new ATOM 395 N LEU A1079 -0.937 -36.085 10.515 1.00 23.42 N ATOM 396 CA LEU A1079 -2.041 -36.719 11.227 1.00 5.11 C ATOM 397 C LEU A1079 -2.750 -37.734 10.338 1.00 14.45 C ATOM 398 O LEU A1079 -3.169 -38.795 10.802 1.00 13.34 O ATOM 399 CB LEU A1079 -3.036 -35.661 11.710 1.00 62.23 C ATOM 400 CG LEU A1079 -4.418 -36.175 12.114 1.00 23.32 C ATOM 401 CD1 LEU A1079 -4.296 -37.240 13.194 1.00 73.31 C ATOM 402 CD2 LEU A1079 -5.295 -35.028 12.591 1.00 61.32 C ATOM 0 H LEU A1079 -1.128 -35.133 10.202 1.00 23.42 H new ATOM 0 HA LEU A1079 -1.632 -37.244 12.090 1.00 5.11 H new ATOM 0 HB2 LEU A1079 -2.599 -35.143 12.564 1.00 62.23 H new ATOM 0 HB3 LEU A1079 -3.162 -34.922 10.919 1.00 62.23 H new ATOM 0 HG LEU A1079 -4.887 -36.625 11.239 1.00 23.32 H new ATOM 0 HD11 LEU A1079 -5.289 -37.594 13.469 1.00 73.31 H new ATOM 0 HD12 LEU A1079 -3.705 -38.074 12.817 1.00 73.31 H new ATOM 0 HD13 LEU A1079 -3.807 -36.815 14.070 1.00 73.31 H new ATOM 0 HD21 LEU A1079 -6.275 -35.413 12.874 1.00 61.32 H new ATOM 0 HD22 LEU A1079 -4.830 -34.549 13.453 1.00 61.32 H new ATOM 0 HD23 LEU A1079 -5.410 -34.299 11.788 1.00 61.32 H new ATOM 414 N LEU A1080 -2.881 -37.403 9.058 1.00 1.04 N ATOM 415 CA LEU A1080 -3.539 -38.288 8.103 1.00 60.11 C ATOM 416 C LEU A1080 -2.641 -39.469 7.747 1.00 73.23 C ATOM 417 O LEU A1080 -3.120 -40.584 7.533 1.00 62.43 O ATOM 418 CB LEU A1080 -3.911 -37.516 6.837 1.00 73.12 C ATOM 419 CG LEU A1080 -4.588 -38.327 5.730 1.00 24.10 C ATOM 420 CD1 LEU A1080 -5.849 -38.996 6.253 1.00 1.34 C ATOM 421 CD2 LEU A1080 -4.908 -37.439 4.538 1.00 53.15 C ATOM 0 H LEU A1080 -2.541 -36.529 8.658 1.00 1.04 H new ATOM 0 HA LEU A1080 -4.447 -38.673 8.567 1.00 60.11 H new ATOM 0 HB2 LEU A1080 -4.573 -36.697 7.117 1.00 73.12 H new ATOM 0 HB3 LEU A1080 -3.005 -37.068 6.429 1.00 73.12 H new ATOM 0 HG LEU A1080 -3.898 -39.105 5.403 1.00 24.10 H new ATOM 0 HD11 LEU A1080 -6.317 -39.568 5.452 1.00 1.34 H new ATOM 0 HD12 LEU A1080 -5.592 -39.665 7.074 1.00 1.34 H new ATOM 0 HD13 LEU A1080 -6.544 -38.235 6.609 1.00 1.34 H new ATOM 0 HD21 LEU A1080 -5.389 -38.033 3.761 1.00 53.15 H new ATOM 0 HD22 LEU A1080 -5.579 -36.638 4.850 1.00 53.15 H new ATOM 0 HD23 LEU A1080 -3.986 -37.008 4.147 1.00 53.15 H new ATOM 433 N LEU A1081 -1.338 -39.218 7.686 1.00 2.33 N ATOM 434 CA LEU A1081 -0.372 -40.261 7.359 1.00 51.12 C ATOM 435 C LEU A1081 -0.122 -41.168 8.559 1.00 71.03 C ATOM 436 O LEU A1081 0.100 -42.369 8.405 1.00 44.00 O ATOM 437 CB LEU A1081 0.945 -39.636 6.894 1.00 55.32 C ATOM 438 CG LEU A1081 2.071 -39.597 7.929 1.00 75.42 C ATOM 439 CD1 LEU A1081 2.782 -40.940 7.993 1.00 62.22 C ATOM 440 CD2 LEU A1081 3.056 -38.485 7.602 1.00 53.25 C ATOM 0 H LEU A1081 -0.926 -38.301 7.859 1.00 2.33 H new ATOM 0 HA LEU A1081 -0.786 -40.865 6.551 1.00 51.12 H new ATOM 0 HB2 LEU A1081 1.298 -40.187 6.023 1.00 55.32 H new ATOM 0 HB3 LEU A1081 0.744 -38.616 6.566 1.00 55.32 H new ATOM 0 HG LEU A1081 1.635 -39.393 8.907 1.00 75.42 H new ATOM 0 HD11 LEU A1081 3.580 -40.894 8.734 1.00 62.22 H new ATOM 0 HD12 LEU A1081 2.070 -41.716 8.274 1.00 62.22 H new ATOM 0 HD13 LEU A1081 3.207 -41.174 7.017 1.00 62.22 H new ATOM 0 HD21 LEU A1081 3.850 -38.472 8.348 1.00 53.25 H new ATOM 0 HD22 LEU A1081 3.487 -38.659 6.616 1.00 53.25 H new ATOM 0 HD23 LEU A1081 2.537 -37.526 7.607 1.00 53.25 H new ATOM 452 N ILE A1082 -0.163 -40.586 9.753 1.00 20.51 N ATOM 453 CA ILE A1082 0.056 -41.343 10.979 1.00 54.23 C ATOM 454 C ILE A1082 -1.127 -42.257 11.280 1.00 63.22 C ATOM 455 O ILE A1082 -0.959 -43.352 11.817 1.00 40.41 O ATOM 456 CB ILE A1082 0.288 -40.410 12.183 1.00 62.54 C ATOM 457 CG1 ILE A1082 1.740 -39.927 12.209 1.00 61.34 C ATOM 458 CG2 ILE A1082 -0.062 -41.123 13.480 1.00 65.13 C ATOM 459 CD1 ILE A1082 1.941 -38.661 13.012 1.00 31.22 C ATOM 0 H ILE A1082 -0.346 -39.593 9.897 1.00 20.51 H new ATOM 0 HA ILE A1082 0.949 -41.948 10.821 1.00 54.23 H new ATOM 0 HB ILE A1082 -0.362 -39.541 12.082 1.00 62.54 H new ATOM 0 HG12 ILE A1082 2.369 -40.715 12.624 1.00 61.34 H new ATOM 0 HG13 ILE A1082 2.076 -39.756 11.186 1.00 61.34 H new ATOM 0 HG21 ILE A1082 0.107 -40.451 14.322 1.00 65.13 H new ATOM 0 HG22 ILE A1082 -1.110 -41.422 13.459 1.00 65.13 H new ATOM 0 HG23 ILE A1082 0.566 -42.007 13.590 1.00 65.13 H new ATOM 0 HD11 ILE A1082 2.993 -38.377 12.987 1.00 31.22 H new ATOM 0 HD12 ILE A1082 1.339 -37.859 12.584 1.00 31.22 H new ATOM 0 HD13 ILE A1082 1.636 -38.833 14.044 1.00 31.22 H new ATOM 471 N PHE A1083 -2.324 -41.801 10.926 1.00 22.04 N ATOM 472 CA PHE A1083 -3.537 -42.578 11.157 1.00 24.14 C ATOM 473 C PHE A1083 -3.623 -43.752 10.187 1.00 51.30 C ATOM 474 O PHE A1083 -4.044 -44.849 10.558 1.00 44.12 O ATOM 475 CB PHE A1083 -4.774 -41.689 11.012 1.00 63.30 C ATOM 476 CG PHE A1083 -5.839 -41.973 12.031 1.00 35.21 C ATOM 477 CD1 PHE A1083 -5.540 -41.984 13.384 1.00 73.23 C ATOM 478 CD2 PHE A1083 -7.143 -42.231 11.635 1.00 22.35 C ATOM 479 CE1 PHE A1083 -6.519 -42.246 14.323 1.00 63.10 C ATOM 480 CE2 PHE A1083 -8.126 -42.494 12.570 1.00 41.42 C ATOM 481 CZ PHE A1083 -7.814 -42.502 13.915 1.00 2.23 C ATOM 0 H PHE A1083 -2.480 -40.898 10.478 1.00 22.04 H new ATOM 0 HA PHE A1083 -3.499 -42.971 12.173 1.00 24.14 H new ATOM 0 HB2 PHE A1083 -4.473 -40.645 11.095 1.00 63.30 H new ATOM 0 HB3 PHE A1083 -5.192 -41.822 10.014 1.00 63.30 H new ATOM 0 HD1 PHE A1083 -4.529 -41.785 13.708 1.00 73.23 H new ATOM 0 HD2 PHE A1083 -7.393 -42.226 10.584 1.00 22.35 H new ATOM 0 HE1 PHE A1083 -6.272 -42.251 15.374 1.00 63.10 H new ATOM 0 HE2 PHE A1083 -9.138 -42.693 12.249 1.00 41.42 H new ATOM 0 HZ PHE A1083 -8.581 -42.708 14.647 1.00 2.23 H new ATOM 491 N ILE A1084 -3.224 -43.513 8.942 1.00 22.54 N ATOM 492 CA ILE A1084 -3.256 -44.550 7.918 1.00 33.23 C ATOM 493 C ILE A1084 -2.112 -45.541 8.103 1.00 3.23 C ATOM 494 O ILE A1084 -2.271 -46.739 7.870 1.00 4.01 O ATOM 495 CB ILE A1084 -3.174 -43.946 6.503 1.00 31.31 C ATOM 496 CG1 ILE A1084 -4.404 -43.080 6.222 1.00 24.13 C ATOM 497 CG2 ILE A1084 -3.048 -45.050 5.463 1.00 14.41 C ATOM 498 CD1 ILE A1084 -4.350 -42.369 4.889 1.00 50.41 C ATOM 0 H ILE A1084 -2.875 -42.611 8.618 1.00 22.54 H new ATOM 0 HA ILE A1084 -4.207 -45.072 8.027 1.00 33.23 H new ATOM 0 HB ILE A1084 -2.288 -43.314 6.444 1.00 31.31 H new ATOM 0 HG12 ILE A1084 -5.295 -43.707 6.254 1.00 24.13 H new ATOM 0 HG13 ILE A1084 -4.506 -42.340 7.016 1.00 24.13 H new ATOM 0 HG21 ILE A1084 -2.991 -44.608 4.468 1.00 14.41 H new ATOM 0 HG22 ILE A1084 -2.145 -45.629 5.655 1.00 14.41 H new ATOM 0 HG23 ILE A1084 -3.918 -45.705 5.520 1.00 14.41 H new ATOM 0 HD11 ILE A1084 -5.254 -41.774 4.757 1.00 50.41 H new ATOM 0 HD12 ILE A1084 -3.478 -41.716 4.860 1.00 50.41 H new ATOM 0 HD13 ILE A1084 -4.279 -43.104 4.087 1.00 50.41 H new ATOM 510 N VAL A1085 -0.959 -45.032 8.525 1.00 64.40 N ATOM 511 CA VAL A1085 0.212 -45.873 8.744 1.00 25.34 C ATOM 512 C VAL A1085 -0.001 -46.815 9.923 1.00 11.42 C ATOM 513 O VAL A1085 0.522 -47.930 9.944 1.00 5.54 O ATOM 514 CB VAL A1085 1.472 -45.025 9.000 1.00 70.53 C ATOM 515 CG1 VAL A1085 2.555 -45.863 9.661 1.00 22.41 C ATOM 516 CG2 VAL A1085 1.977 -44.415 7.700 1.00 15.23 C ATOM 0 H VAL A1085 -0.811 -44.042 8.722 1.00 64.40 H new ATOM 0 HA VAL A1085 0.355 -46.459 7.836 1.00 25.34 H new ATOM 0 HB VAL A1085 1.210 -44.213 9.678 1.00 70.53 H new ATOM 0 HG11 VAL A1085 3.437 -45.247 9.834 1.00 22.41 H new ATOM 0 HG12 VAL A1085 2.188 -46.246 10.613 1.00 22.41 H new ATOM 0 HG13 VAL A1085 2.817 -46.697 9.011 1.00 22.41 H new ATOM 0 HG21 VAL A1085 2.868 -43.819 7.900 1.00 15.23 H new ATOM 0 HG22 VAL A1085 2.223 -45.210 6.996 1.00 15.23 H new ATOM 0 HG23 VAL A1085 1.203 -43.778 7.272 1.00 15.23 H new ATOM 526 N LEU A1086 -0.773 -46.360 10.905 1.00 21.53 N ATOM 527 CA LEU A1086 -1.056 -47.163 12.090 1.00 51.22 C ATOM 528 C LEU A1086 -2.184 -48.153 11.819 1.00 34.33 C ATOM 529 O LEU A1086 -2.195 -49.260 12.359 1.00 71.43 O ATOM 530 CB LEU A1086 -1.428 -46.258 13.265 1.00 10.04 C ATOM 531 CG LEU A1086 -0.274 -45.492 13.914 1.00 52.43 C ATOM 532 CD1 LEU A1086 -0.777 -44.656 15.081 1.00 15.13 C ATOM 533 CD2 LEU A1086 0.812 -46.453 14.373 1.00 5.12 C ATOM 0 H LEU A1086 -1.214 -45.440 10.904 1.00 21.53 H new ATOM 0 HA LEU A1086 -0.157 -47.725 12.342 1.00 51.22 H new ATOM 0 HB2 LEU A1086 -2.169 -45.536 12.921 1.00 10.04 H new ATOM 0 HB3 LEU A1086 -1.908 -46.868 14.030 1.00 10.04 H new ATOM 0 HG LEU A1086 0.154 -44.820 13.170 1.00 52.43 H new ATOM 0 HD11 LEU A1086 0.058 -44.118 15.530 1.00 15.13 H new ATOM 0 HD12 LEU A1086 -1.519 -43.941 14.724 1.00 15.13 H new ATOM 0 HD13 LEU A1086 -1.231 -45.308 15.827 1.00 15.13 H new ATOM 0 HD21 LEU A1086 1.625 -45.891 14.832 1.00 5.12 H new ATOM 0 HD22 LEU A1086 0.397 -47.150 15.101 1.00 5.12 H new ATOM 0 HD23 LEU A1086 1.193 -47.007 13.516 1.00 5.12 H new ATOM 545 N TYR A1087 -3.130 -47.749 10.979 1.00 34.31 N ATOM 546 CA TYR A1087 -4.263 -48.601 10.636 1.00 32.55 C ATOM 547 C TYR A1087 -3.845 -49.697 9.661 1.00 72.31 C ATOM 548 O TYR A1087 -4.543 -50.698 9.495 1.00 23.11 O ATOM 549 CB TYR A1087 -5.391 -47.766 10.029 1.00 72.12 C ATOM 550 CG TYR A1087 -5.925 -48.322 8.729 1.00 61.22 C ATOM 551 CD1 TYR A1087 -5.327 -48.001 7.516 1.00 51.01 C ATOM 552 CD2 TYR A1087 -7.026 -49.168 8.711 1.00 22.23 C ATOM 553 CE1 TYR A1087 -5.811 -48.506 6.325 1.00 31.54 C ATOM 554 CE2 TYR A1087 -7.516 -49.680 7.526 1.00 73.51 C ATOM 555 CZ TYR A1087 -6.905 -49.346 6.335 1.00 12.25 C ATOM 556 OH TYR A1087 -7.391 -49.852 5.151 1.00 22.11 O ATOM 0 H TYR A1087 -3.135 -46.837 10.523 1.00 34.31 H new ATOM 0 HA TYR A1087 -4.621 -49.072 11.552 1.00 32.55 H new ATOM 0 HB2 TYR A1087 -6.208 -47.697 10.748 1.00 72.12 H new ATOM 0 HB3 TYR A1087 -5.030 -46.752 9.859 1.00 72.12 H new ATOM 0 HD1 TYR A1087 -4.469 -47.345 7.505 1.00 51.01 H new ATOM 0 HD2 TYR A1087 -7.508 -49.430 9.641 1.00 22.23 H new ATOM 0 HE1 TYR A1087 -5.336 -48.245 5.391 1.00 31.54 H new ATOM 0 HE2 TYR A1087 -8.372 -50.338 7.531 1.00 73.51 H new ATOM 0 HH TYR A1087 -8.163 -50.427 5.333 1.00 22.11 H new ATOM 566 N LYS A1088 -2.699 -49.501 9.016 1.00 0.22 N ATOM 567 CA LYS A1088 -2.185 -50.472 8.057 1.00 40.23 C ATOM 568 C LYS A1088 -1.032 -51.271 8.658 1.00 51.43 C ATOM 569 O LYS A1088 -0.671 -52.333 8.152 1.00 33.10 O ATOM 570 CB LYS A1088 -1.718 -49.762 6.784 1.00 34.35 C ATOM 571 CG LYS A1088 -0.382 -49.054 6.935 1.00 33.44 C ATOM 572 CD LYS A1088 0.768 -49.928 6.464 1.00 22.30 C ATOM 573 CE LYS A1088 1.085 -49.687 4.995 1.00 1.50 C ATOM 574 NZ LYS A1088 1.787 -48.391 4.786 1.00 51.33 N ATOM 0 H LYS A1088 -2.109 -48.678 9.140 1.00 0.22 H new ATOM 0 HA LYS A1088 -2.991 -51.162 7.807 1.00 40.23 H new ATOM 0 HB2 LYS A1088 -1.643 -50.492 5.978 1.00 34.35 H new ATOM 0 HB3 LYS A1088 -2.473 -49.035 6.486 1.00 34.35 H new ATOM 0 HG2 LYS A1088 -0.394 -48.127 6.362 1.00 33.44 H new ATOM 0 HG3 LYS A1088 -0.229 -48.782 7.979 1.00 33.44 H new ATOM 0 HD2 LYS A1088 1.653 -49.723 7.067 1.00 22.30 H new ATOM 0 HD3 LYS A1088 0.515 -50.977 6.616 1.00 22.30 H new ATOM 0 HE2 LYS A1088 1.705 -50.501 4.619 1.00 1.50 H new ATOM 0 HE3 LYS A1088 0.161 -49.697 4.417 1.00 1.50 H new ATOM 0 HZ1 LYS A1088 2.194 -48.367 3.829 1.00 51.33 H new ATOM 0 HZ2 LYS A1088 1.111 -47.608 4.895 1.00 51.33 H new ATOM 0 HZ3 LYS A1088 2.548 -48.291 5.488 1.00 51.33 H new ATOM 588 N VAL A1089 -0.461 -50.754 9.741 1.00 40.13 N ATOM 589 CA VAL A1089 0.648 -51.420 10.412 1.00 65.40 C ATOM 590 C VAL A1089 0.144 -52.437 11.430 1.00 73.52 C ATOM 591 O VAL A1089 0.738 -53.499 11.608 1.00 11.14 O ATOM 592 CB VAL A1089 1.565 -50.407 11.124 1.00 32.14 C ATOM 593 CG1 VAL A1089 2.202 -51.036 12.354 1.00 31.43 C ATOM 594 CG2 VAL A1089 2.627 -49.887 10.170 1.00 61.54 C ATOM 0 H VAL A1089 -0.749 -49.876 10.172 1.00 40.13 H new ATOM 0 HA VAL A1089 1.220 -51.936 9.641 1.00 65.40 H new ATOM 0 HB VAL A1089 0.959 -49.562 11.450 1.00 32.14 H new ATOM 0 HG11 VAL A1089 2.846 -50.306 12.844 1.00 31.43 H new ATOM 0 HG12 VAL A1089 1.422 -51.353 13.046 1.00 31.43 H new ATOM 0 HG13 VAL A1089 2.795 -51.900 12.055 1.00 31.43 H new ATOM 0 HG21 VAL A1089 3.265 -49.173 10.690 1.00 61.54 H new ATOM 0 HG22 VAL A1089 3.232 -50.719 9.810 1.00 61.54 H new ATOM 0 HG23 VAL A1089 2.147 -49.395 9.324 1.00 61.54 H new ATOM 604 N GLY A1090 -0.958 -52.103 12.095 1.00 63.30 N ATOM 605 CA GLY A1090 -1.524 -52.998 13.087 1.00 13.32 C ATOM 606 C GLY A1090 -1.866 -52.286 14.381 1.00 24.13 C ATOM 607 O GLY A1090 -1.504 -52.746 15.465 1.00 41.15 O ATOM 0 H GLY A1090 -1.468 -51.229 11.964 1.00 63.30 H new ATOM 0 HA2 GLY A1090 -2.423 -53.462 12.682 1.00 13.32 H new ATOM 0 HA3 GLY A1090 -0.816 -53.801 13.294 1.00 13.32 H new ATOM 611 N PHE A1091 -2.563 -51.161 14.270 1.00 1.15 N ATOM 612 CA PHE A1091 -2.951 -50.383 15.441 1.00 2.12 C ATOM 613 C PHE A1091 -4.463 -50.183 15.485 1.00 33.33 C ATOM 614 O PHE A1091 -5.137 -50.664 16.397 1.00 54.34 O ATOM 615 CB PHE A1091 -2.247 -49.025 15.433 1.00 2.33 C ATOM 616 CG PHE A1091 -1.801 -48.574 16.795 1.00 55.45 C ATOM 617 CD1 PHE A1091 -0.975 -49.372 17.569 1.00 10.30 C ATOM 618 CD2 PHE A1091 -2.209 -47.349 17.301 1.00 75.40 C ATOM 619 CE1 PHE A1091 -0.564 -48.959 18.822 1.00 23.32 C ATOM 620 CE2 PHE A1091 -1.800 -46.931 18.553 1.00 62.42 C ATOM 621 CZ PHE A1091 -0.977 -47.737 19.315 1.00 1.34 C ATOM 0 H PHE A1091 -2.871 -50.767 13.381 1.00 1.15 H new ATOM 0 HA PHE A1091 -2.649 -50.937 16.330 1.00 2.12 H new ATOM 0 HB2 PHE A1091 -1.380 -49.078 14.774 1.00 2.33 H new ATOM 0 HB3 PHE A1091 -2.921 -48.278 15.014 1.00 2.33 H new ATOM 0 HD1 PHE A1091 -0.648 -50.329 17.189 1.00 10.30 H new ATOM 0 HD2 PHE A1091 -2.853 -46.715 16.710 1.00 75.40 H new ATOM 0 HE1 PHE A1091 0.080 -49.591 19.415 1.00 23.32 H new ATOM 0 HE2 PHE A1091 -2.124 -45.974 18.936 1.00 62.42 H new ATOM 0 HZ PHE A1091 -0.657 -47.412 20.294 1.00 1.34 H new ATOM 631 N PHE A1092 -4.989 -49.472 14.494 1.00 34.50 N ATOM 632 CA PHE A1092 -6.422 -49.207 14.419 1.00 62.31 C ATOM 633 C PHE A1092 -7.124 -50.253 13.559 1.00 32.23 C ATOM 634 O PHE A1092 -8.257 -50.053 13.118 1.00 64.14 O ATOM 635 CB PHE A1092 -6.674 -47.810 13.851 1.00 52.33 C ATOM 636 CG PHE A1092 -6.427 -46.706 14.839 1.00 44.01 C ATOM 637 CD1 PHE A1092 -7.325 -46.463 15.865 1.00 14.31 C ATOM 638 CD2 PHE A1092 -5.295 -45.912 14.743 1.00 22.41 C ATOM 639 CE1 PHE A1092 -7.101 -45.448 16.776 1.00 72.41 C ATOM 640 CE2 PHE A1092 -5.065 -44.896 15.652 1.00 64.44 C ATOM 641 CZ PHE A1092 -5.969 -44.664 16.670 1.00 62.41 C ATOM 0 H PHE A1092 -4.445 -49.069 13.731 1.00 34.50 H new ATOM 0 HA PHE A1092 -6.830 -49.260 15.429 1.00 62.31 H new ATOM 0 HB2 PHE A1092 -6.033 -47.659 12.982 1.00 52.33 H new ATOM 0 HB3 PHE A1092 -7.705 -47.749 13.501 1.00 52.33 H new ATOM 0 HD1 PHE A1092 -8.211 -47.074 15.954 1.00 14.31 H new ATOM 0 HD2 PHE A1092 -4.585 -46.089 13.949 1.00 22.41 H new ATOM 0 HE1 PHE A1092 -7.811 -45.268 17.570 1.00 72.41 H new ATOM 0 HE2 PHE A1092 -4.179 -44.284 15.566 1.00 64.44 H new ATOM 0 HZ PHE A1092 -5.791 -43.871 17.382 1.00 62.41 H new ATOM 651 N LYS A1093 -6.443 -51.370 13.322 1.00 14.32 N ATOM 652 CA LYS A1093 -7.001 -52.449 12.516 1.00 22.33 C ATOM 653 C LYS A1093 -8.284 -52.988 13.139 1.00 14.12 C ATOM 654 O LYS A1093 -8.243 -53.760 14.096 1.00 33.35 O ATOM 655 CB LYS A1093 -5.980 -53.580 12.366 1.00 74.53 C ATOM 656 CG LYS A1093 -6.015 -54.254 11.005 1.00 51.15 C ATOM 657 CD LYS A1093 -7.438 -54.413 10.497 1.00 70.01 C ATOM 658 CE LYS A1093 -7.496 -55.320 9.277 1.00 12.53 C ATOM 659 NZ LYS A1093 -7.669 -56.750 9.657 1.00 43.42 N ATOM 0 H LYS A1093 -5.504 -51.551 13.677 1.00 14.32 H new ATOM 0 HA LYS A1093 -7.238 -52.047 11.531 1.00 22.33 H new ATOM 0 HB2 LYS A1093 -4.980 -53.181 12.539 1.00 74.53 H new ATOM 0 HB3 LYS A1093 -6.163 -54.328 13.137 1.00 74.53 H new ATOM 0 HG2 LYS A1093 -5.437 -53.666 10.292 1.00 51.15 H new ATOM 0 HG3 LYS A1093 -5.540 -55.233 11.071 1.00 51.15 H new ATOM 0 HD2 LYS A1093 -8.064 -54.825 11.288 1.00 70.01 H new ATOM 0 HD3 LYS A1093 -7.847 -53.435 10.244 1.00 70.01 H new ATOM 0 HE2 LYS A1093 -8.321 -55.012 8.635 1.00 12.53 H new ATOM 0 HE3 LYS A1093 -6.581 -55.207 8.696 1.00 12.53 H new ATOM 0 HZ1 LYS A1093 -7.704 -57.336 8.798 1.00 43.42 H new ATOM 0 HZ2 LYS A1093 -6.869 -57.051 10.249 1.00 43.42 H new ATOM 0 HZ3 LYS A1093 -8.555 -56.863 10.189 1.00 43.42 H new ATOM 673 N ARG A1094 -9.422 -52.576 12.589 1.00 14.03 N ATOM 674 CA ARG A1094 -10.717 -53.018 13.092 1.00 61.21 C ATOM 675 C ARG A1094 -11.842 -52.573 12.162 1.00 54.11 C ATOM 676 O ARG A1094 -11.687 -51.622 11.397 1.00 74.41 O ATOM 677 CB ARG A1094 -10.956 -52.469 14.499 1.00 14.43 C ATOM 678 CG ARG A1094 -11.824 -53.369 15.365 1.00 51.54 C ATOM 679 CD ARG A1094 -11.051 -54.581 15.857 1.00 23.33 C ATOM 680 NE ARG A1094 -11.175 -55.716 14.947 1.00 21.42 N ATOM 681 CZ ARG A1094 -12.252 -56.492 14.881 1.00 11.13 C ATOM 682 NH1 ARG A1094 -13.291 -56.255 15.668 1.00 14.23 N ATOM 683 NH2 ARG A1094 -12.290 -57.506 14.027 1.00 52.01 N ATOM 0 H ARG A1094 -9.473 -51.937 11.795 1.00 14.03 H new ATOM 0 HA ARG A1094 -10.711 -54.107 13.131 1.00 61.21 H new ATOM 0 HB2 ARG A1094 -9.994 -52.323 14.991 1.00 14.43 H new ATOM 0 HB3 ARG A1094 -11.427 -51.489 14.422 1.00 14.43 H new ATOM 0 HG2 ARG A1094 -12.198 -52.804 16.218 1.00 51.54 H new ATOM 0 HG3 ARG A1094 -12.693 -53.697 14.794 1.00 51.54 H new ATOM 0 HD2 ARG A1094 -9.999 -54.319 15.968 1.00 23.33 H new ATOM 0 HD3 ARG A1094 -11.415 -54.867 16.844 1.00 23.33 H new ATOM 0 HE ARG A1094 -10.392 -55.925 14.328 1.00 21.42 H new ATOM 0 HH11 ARG A1094 -13.265 -55.476 16.326 1.00 14.23 H new ATOM 0 HH12 ARG A1094 -14.117 -56.852 15.616 1.00 14.23 H new ATOM 0 HH21 ARG A1094 -11.492 -57.691 13.420 1.00 52.01 H new ATOM 0 HH22 ARG A1094 -13.117 -58.101 13.978 1.00 52.01 H new ATOM 697 N ASN A1095 -12.973 -53.266 12.235 1.00 52.04 N ATOM 698 CA ASN A1095 -14.124 -52.942 11.399 1.00 62.11 C ATOM 699 C ASN A1095 -15.304 -52.485 12.251 1.00 61.13 C ATOM 700 O ASN A1095 -16.445 -52.884 12.016 1.00 3.41 O ATOM 701 CB ASN A1095 -14.528 -54.156 10.559 1.00 41.21 C ATOM 702 CG ASN A1095 -15.569 -53.813 9.511 1.00 53.12 C ATOM 703 OD1 ASN A1095 -16.690 -54.322 9.543 1.00 63.14 O ATOM 704 ND2 ASN A1095 -15.202 -52.945 8.574 1.00 4.04 N ATOM 0 H ASN A1095 -13.118 -54.056 12.864 1.00 52.04 H new ATOM 0 HA ASN A1095 -13.841 -52.126 10.734 1.00 62.11 H new ATOM 0 HB2 ASN A1095 -13.645 -54.566 10.069 1.00 41.21 H new ATOM 0 HB3 ASN A1095 -14.919 -54.934 11.215 1.00 41.21 H new ATOM 0 HD21 ASN A1095 -15.860 -52.676 7.842 1.00 4.04 H new ATOM 0 HD22 ASN A1095 -14.262 -52.548 8.586 1.00 4.04 H new ATOM 711 N LEU A1096 -15.021 -51.644 13.241 1.00 60.52 N ATOM 712 CA LEU A1096 -16.058 -51.131 14.128 1.00 51.34 C ATOM 713 C LEU A1096 -16.311 -49.649 13.870 1.00 34.20 C ATOM 714 O LEU A1096 -15.401 -48.908 13.497 1.00 41.40 O ATOM 715 CB LEU A1096 -15.659 -51.345 15.589 1.00 42.22 C ATOM 716 CG LEU A1096 -16.763 -51.130 16.625 1.00 44.22 C ATOM 717 CD1 LEU A1096 -17.524 -52.423 16.870 1.00 33.33 C ATOM 718 CD2 LEU A1096 -16.177 -50.600 17.926 1.00 12.11 C ATOM 0 H LEU A1096 -14.082 -51.304 13.449 1.00 60.52 H new ATOM 0 HA LEU A1096 -16.978 -51.679 13.925 1.00 51.34 H new ATOM 0 HB2 LEU A1096 -15.281 -52.362 15.696 1.00 42.22 H new ATOM 0 HB3 LEU A1096 -14.834 -50.672 15.822 1.00 42.22 H new ATOM 0 HG LEU A1096 -17.461 -50.389 16.235 1.00 44.22 H new ATOM 0 HD11 LEU A1096 -18.306 -52.251 17.610 1.00 33.33 H new ATOM 0 HD12 LEU A1096 -17.976 -52.762 15.938 1.00 33.33 H new ATOM 0 HD13 LEU A1096 -16.837 -53.185 17.238 1.00 33.33 H new ATOM 0 HD21 LEU A1096 -16.977 -50.453 18.652 1.00 12.11 H new ATOM 0 HD22 LEU A1096 -15.457 -51.318 18.320 1.00 12.11 H new ATOM 0 HD23 LEU A1096 -15.677 -49.650 17.739 1.00 12.11 H new ATOM 730 N LYS A1097 -17.554 -49.223 14.071 1.00 45.21 N ATOM 731 CA LYS A1097 -17.928 -47.829 13.864 1.00 45.13 C ATOM 732 C LYS A1097 -17.913 -47.060 15.181 1.00 62.15 C ATOM 733 O LYS A1097 -18.435 -47.530 16.190 1.00 2.54 O ATOM 734 CB LYS A1097 -19.316 -47.741 13.226 1.00 24.11 C ATOM 735 CG LYS A1097 -19.461 -48.579 11.967 1.00 44.31 C ATOM 736 CD LYS A1097 -20.918 -48.744 11.573 1.00 34.52 C ATOM 737 CE LYS A1097 -21.534 -49.975 12.221 1.00 41.42 C ATOM 738 NZ LYS A1097 -22.063 -49.679 13.583 1.00 63.54 N ATOM 0 H LYS A1097 -18.319 -49.824 14.377 1.00 45.21 H new ATOM 0 HA LYS A1097 -17.197 -47.379 13.192 1.00 45.13 H new ATOM 0 HB2 LYS A1097 -20.062 -48.061 13.953 1.00 24.11 H new ATOM 0 HB3 LYS A1097 -19.531 -46.700 12.986 1.00 24.11 H new ATOM 0 HG2 LYS A1097 -18.913 -48.109 11.150 1.00 44.31 H new ATOM 0 HG3 LYS A1097 -19.013 -49.560 12.128 1.00 44.31 H new ATOM 0 HD2 LYS A1097 -21.479 -47.857 11.868 1.00 34.52 H new ATOM 0 HD3 LYS A1097 -20.996 -48.824 10.489 1.00 34.52 H new ATOM 0 HE2 LYS A1097 -22.341 -50.351 11.592 1.00 41.42 H new ATOM 0 HE3 LYS A1097 -20.785 -50.765 12.286 1.00 41.42 H new ATOM 0 HZ1 LYS A1097 -22.838 -50.336 13.805 1.00 63.54 H new ATOM 0 HZ2 LYS A1097 -21.302 -49.792 14.283 1.00 63.54 H new ATOM 0 HZ3 LYS A1097 -22.418 -48.702 13.613 1.00 63.54 H new ATOM 752 N GLU A1098 -17.311 -45.874 15.162 1.00 51.44 N ATOM 753 CA GLU A1098 -17.230 -45.040 16.356 1.00 64.31 C ATOM 754 C GLU A1098 -18.025 -43.751 16.175 1.00 54.00 C ATOM 755 O GLU A1098 -18.902 -43.431 16.977 1.00 34.20 O ATOM 756 CB GLU A1098 -15.770 -44.711 16.676 1.00 62.13 C ATOM 757 CG GLU A1098 -15.080 -45.765 17.527 1.00 54.53 C ATOM 758 CD GLU A1098 -13.573 -45.752 17.363 1.00 72.10 C ATOM 759 OE1 GLU A1098 -13.079 -45.036 16.468 1.00 54.12 O ATOM 760 OE2 GLU A1098 -12.888 -46.459 18.131 1.00 2.34 O ATOM 0 H GLU A1098 -16.873 -45.470 14.334 1.00 51.44 H new ATOM 0 HA GLU A1098 -17.661 -45.598 17.188 1.00 64.31 H new ATOM 0 HB2 GLU A1098 -15.220 -44.593 15.742 1.00 62.13 H new ATOM 0 HB3 GLU A1098 -15.728 -43.753 17.194 1.00 62.13 H new ATOM 0 HG2 GLU A1098 -15.329 -45.600 18.575 1.00 54.53 H new ATOM 0 HG3 GLU A1098 -15.462 -46.750 17.259 1.00 54.53 H new ATOM 767 N LYS A1099 -17.712 -43.014 15.115 1.00 63.42 N ATOM 768 CA LYS A1099 -18.397 -41.759 14.825 1.00 5.04 C ATOM 769 C LYS A1099 -18.854 -41.713 13.371 1.00 53.53 C ATOM 770 O LYS A1099 -18.071 -41.405 12.474 1.00 74.24 O ATOM 771 CB LYS A1099 -17.477 -40.573 15.120 1.00 44.13 C ATOM 772 CG LYS A1099 -16.066 -40.748 14.582 1.00 14.12 C ATOM 773 CD LYS A1099 -15.422 -39.411 14.261 1.00 42.53 C ATOM 774 CE LYS A1099 -15.742 -38.963 12.843 1.00 63.11 C ATOM 775 NZ LYS A1099 -14.947 -39.716 11.832 1.00 41.11 N ATOM 0 H LYS A1099 -16.988 -43.264 14.442 1.00 63.42 H new ATOM 0 HA LYS A1099 -19.277 -41.697 15.466 1.00 5.04 H new ATOM 0 HB2 LYS A1099 -17.912 -39.671 14.689 1.00 44.13 H new ATOM 0 HB3 LYS A1099 -17.429 -40.420 16.198 1.00 44.13 H new ATOM 0 HG2 LYS A1099 -15.459 -41.278 15.316 1.00 14.12 H new ATOM 0 HG3 LYS A1099 -16.092 -41.365 13.684 1.00 14.12 H new ATOM 0 HD2 LYS A1099 -15.771 -38.659 14.969 1.00 42.53 H new ATOM 0 HD3 LYS A1099 -14.342 -39.488 14.384 1.00 42.53 H new ATOM 0 HE2 LYS A1099 -16.805 -39.105 12.648 1.00 63.11 H new ATOM 0 HE3 LYS A1099 -15.539 -37.897 12.744 1.00 63.11 H new ATOM 0 HZ1 LYS A1099 -15.050 -39.263 10.902 1.00 41.11 H new ATOM 0 HZ2 LYS A1099 -13.944 -39.716 12.108 1.00 41.11 H new ATOM 0 HZ3 LYS A1099 -15.291 -40.696 11.780 1.00 41.11 H new ATOM 789 N MET A1100 -20.129 -42.017 13.146 1.00 70.11 N ATOM 790 CA MET A1100 -20.691 -42.007 11.801 1.00 40.43 C ATOM 791 C MET A1100 -20.791 -40.582 11.265 1.00 32.13 C ATOM 792 O MET A1100 -20.868 -39.625 12.034 1.00 72.34 O ATOM 793 CB MET A1100 -22.072 -42.665 11.797 1.00 51.53 C ATOM 794 CG MET A1100 -22.023 -44.181 11.697 1.00 3.24 C ATOM 795 SD MET A1100 -21.532 -44.754 10.060 1.00 34.22 S ATOM 796 CE MET A1100 -23.097 -45.355 9.429 1.00 21.24 C ATOM 0 H MET A1100 -20.792 -42.273 13.878 1.00 70.11 H new ATOM 0 HA MET A1100 -20.025 -42.575 11.151 1.00 40.43 H new ATOM 0 HB2 MET A1100 -22.601 -42.386 12.708 1.00 51.53 H new ATOM 0 HB3 MET A1100 -22.650 -42.272 10.960 1.00 51.53 H new ATOM 0 HG2 MET A1100 -21.323 -44.568 12.438 1.00 3.24 H new ATOM 0 HG3 MET A1100 -23.004 -44.589 11.941 1.00 3.24 H new ATOM 0 HE1 MET A1100 -22.958 -45.743 8.420 1.00 21.24 H new ATOM 0 HE2 MET A1100 -23.469 -46.150 10.076 1.00 21.24 H new ATOM 0 HE3 MET A1100 -23.818 -44.538 9.407 1.00 21.24 H new ATOM 806 N GLU A1101 -20.790 -40.451 9.942 1.00 52.13 N ATOM 807 CA GLU A1101 -20.880 -39.142 9.304 1.00 11.54 C ATOM 808 C GLU A1101 -22.163 -39.023 8.487 1.00 32.02 C ATOM 809 O GLU A1101 -22.122 -38.820 7.274 1.00 40.42 O ATOM 810 CB GLU A1101 -19.666 -38.903 8.406 1.00 23.21 C ATOM 811 CG GLU A1101 -18.453 -38.370 9.151 1.00 43.41 C ATOM 812 CD GLU A1101 -17.420 -37.760 8.224 1.00 73.51 C ATOM 813 OE1 GLU A1101 -17.815 -37.209 7.175 1.00 3.33 O ATOM 814 OE2 GLU A1101 -16.216 -37.835 8.547 1.00 54.32 O ATOM 0 H GLU A1101 -20.728 -41.234 9.292 1.00 52.13 H new ATOM 0 HA GLU A1101 -20.897 -38.384 10.088 1.00 11.54 H new ATOM 0 HB2 GLU A1101 -19.398 -39.839 7.915 1.00 23.21 H new ATOM 0 HB3 GLU A1101 -19.939 -38.198 7.621 1.00 23.21 H new ATOM 0 HG2 GLU A1101 -18.776 -37.620 9.873 1.00 43.41 H new ATOM 0 HG3 GLU A1101 -17.994 -39.181 9.717 1.00 43.41 H new ATOM 821 N ALA A1102 -23.302 -39.150 9.161 1.00 21.30 N ATOM 822 CA ALA A1102 -24.596 -39.055 8.498 1.00 34.11 C ATOM 823 C ALA A1102 -24.815 -37.663 7.917 1.00 21.11 C ATOM 824 O ALA A1102 -24.751 -36.664 8.632 1.00 31.14 O ATOM 825 CB ALA A1102 -25.714 -39.406 9.469 1.00 44.03 C ATOM 0 H ALA A1102 -23.354 -39.319 10.166 1.00 21.30 H new ATOM 0 HA ALA A1102 -24.607 -39.769 7.675 1.00 34.11 H new ATOM 0 HB1 ALA A1102 -26.675 -39.331 8.960 1.00 44.03 H new ATOM 0 HB2 ALA A1102 -25.574 -40.424 9.832 1.00 44.03 H new ATOM 0 HB3 ALA A1102 -25.695 -38.715 10.311 1.00 44.03 H new ATOM 831 N GLY A1103 -25.072 -37.604 6.614 1.00 54.04 N ATOM 832 CA GLY A1103 -25.295 -36.327 5.959 1.00 32.23 C ATOM 833 C GLY A1103 -25.367 -36.455 4.450 1.00 32.03 C ATOM 834 O GLY A1103 -24.906 -37.460 3.911 1.00 33.20 O ATOM 0 H GLY A1103 -25.130 -38.417 6.000 1.00 54.04 H new ATOM 0 HA2 GLY A1103 -26.223 -35.890 6.328 1.00 32.23 H new ATOM 0 HA3 GLY A1103 -24.491 -35.640 6.225 1.00 32.23 H new TER 838 GLY A1103