USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1085 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 29 TYR OH : rot -25:sc= 0.517 USER MOD Set 1.2: A 97 THR OG1 : rot 146:sc= 2.04 USER MOD Set 2.1: A 12 LYS NZ :NH3+ 173:sc= 0.784 (180deg=0) USER MOD Set 2.2: A 89 HIS : no HD1:sc= 1.16 K(o=1.9,f=-6.7!) USER MOD Single : A 5 ASN : amide:sc= -0.29 X(o=-0.29,f=-0.64) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= 0.583 K(o=0.58,f=-5.2!) USER MOD Single : A 39 ASN : amide:sc= -1.07 K(o=-1.1,f=-1.8!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -86:sc= 0.441 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 CYS SG : rot 47:sc= 0.721 USER MOD Single : A 58 GLN : amide:sc= -0.312 X(o=-0.31,f=-0.08) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0.00379 USER MOD Single : A 74 ASN : amide:sc= -0.0122 X(o=-0.012,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0.14) USER MOD Single : A 81 THR OG1 : rot 70:sc= 0.0916 USER MOD Single : A 83 CYS SG : rot -120:sc= -0.931 USER MOD Single : A 87 CYS SG : rot 84:sc= -0.128 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 HIS : no HD1:sc= 0.468 K(o=0.47,f=-1.9!) USER MOD Single : A 112 THR OG1 : rot 73:sc= 0.819 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= -0.622 USER MOD Single : A 129 SER OG : rot 52:sc= 0.996 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 ASN : amide:sc= -0.408 K(o=-0.41,f=-1.9) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 -4.344 1.971 -9.901 1.00 13.00 N ATOM 2 CA GLY A 2 -3.691 1.655 -11.158 1.00 45.03 C ATOM 3 C GLY A 2 -2.369 0.939 -10.961 1.00 13.03 C ATOM 4 O GLY A 2 -2.242 -0.242 -11.279 1.00 42.04 O ATOM 0 HA2 GLY A 2 -4.352 1.032 -11.761 1.00 45.03 H new ATOM 0 HA3 GLY A 2 -3.522 2.575 -11.718 1.00 45.03 H new ATOM 8 N ALA A 3 -1.382 1.658 -10.437 1.00 12.22 N ATOM 9 CA ALA A 3 -0.063 1.084 -10.197 1.00 72.11 C ATOM 10 C ALA A 3 0.642 1.789 -9.043 1.00 34.11 C ATOM 11 O ALA A 3 0.340 2.941 -8.731 1.00 52.31 O ATOM 12 CB ALA A 3 0.782 1.160 -11.460 1.00 21.21 C ATOM 0 H ALA A 3 -1.470 2.639 -10.171 1.00 12.22 H new ATOM 0 HA ALA A 3 -0.194 0.037 -9.922 1.00 72.11 H new ATOM 0 HB1 ALA A 3 1.764 0.728 -11.267 1.00 21.21 H new ATOM 0 HB2 ALA A 3 0.292 0.604 -12.260 1.00 21.21 H new ATOM 0 HB3 ALA A 3 0.896 2.202 -11.759 1.00 21.21 H new ATOM 18 N ARG A 4 1.579 1.090 -8.413 1.00 65.21 N ATOM 19 CA ARG A 4 2.325 1.649 -7.292 1.00 2.25 C ATOM 20 C ARG A 4 3.789 1.862 -7.665 1.00 24.53 C ATOM 21 O ARG A 4 4.392 2.870 -7.300 1.00 41.32 O ATOM 22 CB ARG A 4 2.227 0.727 -6.076 1.00 34.11 C ATOM 23 CG ARG A 4 1.025 1.013 -5.190 1.00 32.51 C ATOM 24 CD ARG A 4 0.475 -0.261 -4.568 1.00 24.14 C ATOM 25 NE ARG A 4 -0.985 -0.278 -4.553 1.00 53.12 N ATOM 26 CZ ARG A 4 -1.703 -1.150 -3.856 1.00 31.44 C ATOM 27 NH1 ARG A 4 -1.099 -2.072 -3.118 1.00 52.12 N ATOM 28 NH2 ARG A 4 -3.029 -1.103 -3.894 1.00 41.34 N ATOM 0 H ARG A 4 1.840 0.135 -8.659 1.00 65.21 H new ATOM 0 HA ARG A 4 1.887 2.616 -7.043 1.00 2.25 H new ATOM 0 HB2 ARG A 4 2.178 -0.307 -6.418 1.00 34.11 H new ATOM 0 HB3 ARG A 4 3.136 0.824 -5.483 1.00 34.11 H new ATOM 0 HG2 ARG A 4 1.310 1.710 -4.402 1.00 32.51 H new ATOM 0 HG3 ARG A 4 0.246 1.498 -5.778 1.00 32.51 H new ATOM 0 HD2 ARG A 4 0.842 -1.123 -5.125 1.00 24.14 H new ATOM 0 HD3 ARG A 4 0.849 -0.357 -3.549 1.00 24.14 H new ATOM 0 HE ARG A 4 -1.481 0.419 -5.109 1.00 53.12 H new ATOM 0 HH11 ARG A 4 -0.080 -2.112 -3.085 1.00 52.12 H new ATOM 0 HH12 ARG A 4 -1.653 -2.741 -2.583 1.00 52.12 H new ATOM 0 HH21 ARG A 4 -3.498 -0.396 -4.460 1.00 41.34 H new ATOM 0 HH22 ARG A 4 -3.579 -1.774 -3.358 1.00 41.34 H new ATOM 42 N ASN A 5 4.354 0.904 -8.393 1.00 51.13 N ATOM 43 CA ASN A 5 5.747 0.986 -8.815 1.00 5.44 C ATOM 44 C ASN A 5 5.935 0.368 -10.196 1.00 43.34 C ATOM 45 O ASN A 5 6.400 -0.765 -10.324 1.00 31.55 O ATOM 46 CB ASN A 5 6.651 0.280 -7.802 1.00 2.44 C ATOM 47 CG ASN A 5 6.095 -1.063 -7.367 1.00 44.35 C ATOM 48 OD1 ASN A 5 5.144 -1.131 -6.589 1.00 21.24 O ATOM 49 ND2 ASN A 5 6.687 -2.138 -7.872 1.00 63.42 N ATOM 0 H ASN A 5 3.868 0.062 -8.703 1.00 51.13 H new ATOM 0 HA ASN A 5 6.023 2.039 -8.867 1.00 5.44 H new ATOM 0 HB2 ASN A 5 7.639 0.137 -8.239 1.00 2.44 H new ATOM 0 HB3 ASN A 5 6.779 0.918 -6.927 1.00 2.44 H new ATOM 0 HD21 ASN A 5 6.356 -3.069 -7.618 1.00 63.42 H new ATOM 0 HD22 ASN A 5 7.473 -2.033 -8.514 1.00 63.42 H new ATOM 56 N SER A 6 5.571 1.121 -11.230 1.00 64.14 N ATOM 57 CA SER A 6 5.696 0.646 -12.604 1.00 0.03 C ATOM 58 C SER A 6 6.779 1.420 -13.350 1.00 34.24 C ATOM 59 O SER A 6 7.511 0.858 -14.163 1.00 54.30 O ATOM 60 CB SER A 6 4.360 0.780 -13.335 1.00 42.02 C ATOM 61 OG SER A 6 4.549 0.815 -14.740 1.00 33.13 O ATOM 0 H SER A 6 5.187 2.062 -11.142 1.00 64.14 H new ATOM 0 HA SER A 6 5.981 -0.406 -12.575 1.00 0.03 H new ATOM 0 HB2 SER A 6 3.713 -0.057 -13.073 1.00 42.02 H new ATOM 0 HB3 SER A 6 3.854 1.689 -13.010 1.00 42.02 H new ATOM 0 HG SER A 6 3.680 0.900 -15.185 1.00 33.13 H new ATOM 67 N VAL A 7 6.873 2.715 -13.066 1.00 32.01 N ATOM 68 CA VAL A 7 7.865 3.568 -13.708 1.00 43.33 C ATOM 69 C VAL A 7 9.263 3.287 -13.170 1.00 52.22 C ATOM 70 O VAL A 7 10.177 2.956 -13.927 1.00 15.52 O ATOM 71 CB VAL A 7 7.540 5.060 -13.504 1.00 75.14 C ATOM 72 CG1 VAL A 7 8.467 5.928 -14.340 1.00 2.54 C ATOM 73 CG2 VAL A 7 6.083 5.339 -13.845 1.00 43.33 C ATOM 0 H VAL A 7 6.274 3.196 -12.395 1.00 32.01 H new ATOM 0 HA VAL A 7 7.836 3.339 -14.773 1.00 43.33 H new ATOM 0 HB VAL A 7 7.698 5.308 -12.454 1.00 75.14 H new ATOM 0 HG11 VAL A 7 8.222 6.978 -14.183 1.00 2.54 H new ATOM 0 HG12 VAL A 7 9.500 5.748 -14.043 1.00 2.54 H new ATOM 0 HG13 VAL A 7 8.344 5.681 -15.394 1.00 2.54 H new ATOM 0 HG21 VAL A 7 5.871 6.398 -13.695 1.00 43.33 H new ATOM 0 HG22 VAL A 7 5.896 5.075 -14.886 1.00 43.33 H new ATOM 0 HG23 VAL A 7 5.438 4.744 -13.198 1.00 43.33 H new ATOM 83 N LEU A 8 9.424 3.419 -11.858 1.00 33.10 N ATOM 84 CA LEU A 8 10.712 3.178 -11.216 1.00 33.41 C ATOM 85 C LEU A 8 10.585 2.123 -10.120 1.00 51.54 C ATOM 86 O LEU A 8 9.742 2.238 -9.231 1.00 22.23 O ATOM 87 CB LEU A 8 11.261 4.478 -10.627 1.00 64.34 C ATOM 88 CG LEU A 8 11.618 5.572 -11.635 1.00 2.32 C ATOM 89 CD1 LEU A 8 12.219 6.775 -10.924 1.00 13.21 C ATOM 90 CD2 LEU A 8 12.580 5.036 -12.685 1.00 42.30 C ATOM 0 H LEU A 8 8.679 3.692 -11.217 1.00 33.10 H new ATOM 0 HA LEU A 8 11.404 2.808 -11.972 1.00 33.41 H new ATOM 0 HB2 LEU A 8 10.523 4.879 -9.932 1.00 64.34 H new ATOM 0 HB3 LEU A 8 12.152 4.242 -10.045 1.00 64.34 H new ATOM 0 HG LEU A 8 10.704 5.890 -12.137 1.00 2.32 H new ATOM 0 HD11 LEU A 8 12.467 7.544 -11.656 1.00 13.21 H new ATOM 0 HD12 LEU A 8 11.498 7.173 -10.210 1.00 13.21 H new ATOM 0 HD13 LEU A 8 13.123 6.471 -10.396 1.00 13.21 H new ATOM 0 HD21 LEU A 8 12.823 5.828 -13.394 1.00 42.30 H new ATOM 0 HD22 LEU A 8 13.493 4.691 -12.200 1.00 42.30 H new ATOM 0 HD23 LEU A 8 12.114 4.205 -13.215 1.00 42.30 H new ATOM 102 N ARG A 9 11.429 1.099 -10.192 1.00 14.44 N ATOM 103 CA ARG A 9 11.413 0.026 -9.206 1.00 55.10 C ATOM 104 C ARG A 9 12.170 0.433 -7.945 1.00 53.31 C ATOM 105 O ARG A 9 12.528 1.598 -7.773 1.00 45.33 O ATOM 106 CB ARG A 9 12.028 -1.245 -9.794 1.00 73.13 C ATOM 107 CG ARG A 9 13.512 -1.120 -10.098 1.00 14.41 C ATOM 108 CD ARG A 9 13.899 -1.931 -11.324 1.00 73.00 C ATOM 109 NE ARG A 9 14.297 -3.293 -10.976 1.00 53.53 N ATOM 110 CZ ARG A 9 14.396 -4.278 -11.861 1.00 70.13 C ATOM 111 NH1 ARG A 9 14.129 -4.055 -13.140 1.00 31.41 N ATOM 112 NH2 ARG A 9 14.764 -5.491 -11.467 1.00 43.23 N ATOM 0 H ARG A 9 12.132 0.990 -10.923 1.00 14.44 H new ATOM 0 HA ARG A 9 10.375 -0.170 -8.938 1.00 55.10 H new ATOM 0 HB2 ARG A 9 11.877 -2.068 -9.096 1.00 73.13 H new ATOM 0 HB3 ARG A 9 11.499 -1.504 -10.711 1.00 73.13 H new ATOM 0 HG2 ARG A 9 13.765 -0.072 -10.259 1.00 14.41 H new ATOM 0 HG3 ARG A 9 14.090 -1.459 -9.239 1.00 14.41 H new ATOM 0 HD2 ARG A 9 13.058 -1.965 -12.017 1.00 73.00 H new ATOM 0 HD3 ARG A 9 14.719 -1.435 -11.843 1.00 73.00 H new ATOM 0 HE ARG A 9 14.510 -3.498 -10.000 1.00 53.53 H new ATOM 0 HH11 ARG A 9 13.846 -3.124 -13.447 1.00 31.41 H new ATOM 0 HH12 ARG A 9 14.206 -4.814 -13.817 1.00 31.41 H new ATOM 0 HH21 ARG A 9 14.971 -5.667 -10.484 1.00 43.23 H new ATOM 0 HH22 ARG A 9 14.840 -6.247 -12.147 1.00 43.23 H new ATOM 126 N GLY A 10 12.410 -0.534 -7.066 1.00 71.23 N ATOM 127 CA GLY A 10 13.122 -0.256 -5.833 1.00 3.22 C ATOM 128 C GLY A 10 14.543 0.211 -6.077 1.00 21.10 C ATOM 129 O GLY A 10 14.999 1.182 -5.472 1.00 35.41 O ATOM 0 H GLY A 10 12.124 -1.506 -7.186 1.00 71.23 H new ATOM 0 HA2 GLY A 10 12.584 0.507 -5.270 1.00 3.22 H new ATOM 0 HA3 GLY A 10 13.139 -1.155 -5.216 1.00 3.22 H new ATOM 133 N LYS A 11 15.248 -0.482 -6.965 1.00 21.32 N ATOM 134 CA LYS A 11 16.627 -0.134 -7.288 1.00 72.01 C ATOM 135 C LYS A 11 16.687 1.166 -8.083 1.00 3.25 C ATOM 136 O LYS A 11 17.622 1.954 -7.934 1.00 64.34 O ATOM 137 CB LYS A 11 17.285 -1.262 -8.085 1.00 22.03 C ATOM 138 CG LYS A 11 18.580 -1.766 -7.471 1.00 31.43 C ATOM 139 CD LYS A 11 18.325 -2.879 -6.468 1.00 73.45 C ATOM 140 CE LYS A 11 19.521 -3.812 -6.354 1.00 72.35 C ATOM 141 NZ LYS A 11 20.172 -3.717 -5.018 1.00 60.24 N ATOM 0 H LYS A 11 14.887 -1.289 -7.474 1.00 21.32 H new ATOM 0 HA LYS A 11 17.169 0.007 -6.353 1.00 72.01 H new ATOM 0 HB2 LYS A 11 16.585 -2.093 -8.168 1.00 22.03 H new ATOM 0 HB3 LYS A 11 17.485 -0.911 -9.097 1.00 22.03 H new ATOM 0 HG2 LYS A 11 19.240 -2.129 -8.259 1.00 31.43 H new ATOM 0 HG3 LYS A 11 19.095 -0.942 -6.978 1.00 31.43 H new ATOM 0 HD2 LYS A 11 18.105 -2.447 -5.492 1.00 73.45 H new ATOM 0 HD3 LYS A 11 17.446 -3.448 -6.770 1.00 73.45 H new ATOM 0 HE2 LYS A 11 19.199 -4.839 -6.529 1.00 72.35 H new ATOM 0 HE3 LYS A 11 20.247 -3.569 -7.130 1.00 72.35 H new ATOM 0 HZ1 LYS A 11 20.982 -4.368 -4.980 1.00 60.24 H new ATOM 0 HZ2 LYS A 11 20.502 -2.743 -4.861 1.00 60.24 H new ATOM 0 HZ3 LYS A 11 19.487 -3.974 -4.279 1.00 60.24 H new ATOM 155 N LYS A 12 15.684 1.388 -8.924 1.00 61.15 N ATOM 156 CA LYS A 12 15.621 2.594 -9.741 1.00 5.13 C ATOM 157 C LYS A 12 15.294 3.813 -8.885 1.00 53.32 C ATOM 158 O LYS A 12 15.827 4.901 -9.105 1.00 65.44 O ATOM 159 CB LYS A 12 14.572 2.435 -10.843 1.00 70.23 C ATOM 160 CG LYS A 12 15.007 1.512 -11.968 1.00 74.22 C ATOM 161 CD LYS A 12 13.978 1.471 -13.085 1.00 72.42 C ATOM 162 CE LYS A 12 14.304 0.391 -14.105 1.00 65.41 C ATOM 163 NZ LYS A 12 13.726 0.697 -15.442 1.00 61.42 N ATOM 0 H LYS A 12 14.902 0.747 -9.058 1.00 61.15 H new ATOM 0 HA LYS A 12 16.599 2.744 -10.199 1.00 5.13 H new ATOM 0 HB2 LYS A 12 13.651 2.050 -10.404 1.00 70.23 H new ATOM 0 HB3 LYS A 12 14.341 3.416 -11.258 1.00 70.23 H new ATOM 0 HG2 LYS A 12 15.964 1.848 -12.366 1.00 74.22 H new ATOM 0 HG3 LYS A 12 15.160 0.506 -11.576 1.00 74.22 H new ATOM 0 HD2 LYS A 12 12.989 1.288 -12.664 1.00 72.42 H new ATOM 0 HD3 LYS A 12 13.939 2.441 -13.581 1.00 72.42 H new ATOM 0 HE2 LYS A 12 15.386 0.289 -14.192 1.00 65.41 H new ATOM 0 HE3 LYS A 12 13.920 -0.567 -13.754 1.00 65.41 H new ATOM 0 HZ1 LYS A 12 14.068 0.001 -16.135 1.00 61.42 H new ATOM 0 HZ2 LYS A 12 12.688 0.653 -15.390 1.00 61.42 H new ATOM 0 HZ3 LYS A 12 14.017 1.651 -15.736 1.00 61.42 H new ATOM 177 N ALA A 13 14.414 3.625 -7.907 1.00 74.24 N ATOM 178 CA ALA A 13 14.018 4.709 -7.016 1.00 30.44 C ATOM 179 C ALA A 13 15.239 5.424 -6.446 1.00 52.33 C ATOM 180 O ALA A 13 15.254 6.650 -6.333 1.00 43.31 O ATOM 181 CB ALA A 13 13.144 4.175 -5.891 1.00 21.31 C ATOM 0 H ALA A 13 13.962 2.732 -7.712 1.00 74.24 H new ATOM 0 HA ALA A 13 13.443 5.432 -7.596 1.00 30.44 H new ATOM 0 HB1 ALA A 13 12.856 4.995 -5.234 1.00 21.31 H new ATOM 0 HB2 ALA A 13 12.249 3.716 -6.312 1.00 21.31 H new ATOM 0 HB3 ALA A 13 13.700 3.431 -5.320 1.00 21.31 H new ATOM 187 N ASP A 14 16.258 4.651 -6.089 1.00 13.41 N ATOM 188 CA ASP A 14 17.483 5.212 -5.531 1.00 22.41 C ATOM 189 C ASP A 14 18.124 6.194 -6.505 1.00 44.54 C ATOM 190 O ASP A 14 18.431 7.330 -6.146 1.00 34.12 O ATOM 191 CB ASP A 14 18.471 4.095 -5.189 1.00 62.32 C ATOM 192 CG ASP A 14 18.979 4.186 -3.763 1.00 55.35 C ATOM 193 OD1 ASP A 14 19.443 5.277 -3.368 1.00 55.35 O ATOM 194 OD2 ASP A 14 18.912 3.169 -3.044 1.00 72.11 O ATOM 0 H ASP A 14 16.260 3.635 -6.176 1.00 13.41 H new ATOM 0 HA ASP A 14 17.224 5.750 -4.619 1.00 22.41 H new ATOM 0 HB2 ASP A 14 17.988 3.129 -5.339 1.00 62.32 H new ATOM 0 HB3 ASP A 14 19.316 4.139 -5.876 1.00 62.32 H new ATOM 199 N GLU A 15 18.327 5.747 -7.741 1.00 52.24 N ATOM 200 CA GLU A 15 18.933 6.587 -8.768 1.00 3.33 C ATOM 201 C GLU A 15 18.223 7.935 -8.859 1.00 20.24 C ATOM 202 O GLU A 15 18.843 8.958 -9.148 1.00 12.41 O ATOM 203 CB GLU A 15 18.892 5.883 -10.125 1.00 55.51 C ATOM 204 CG GLU A 15 20.223 5.280 -10.540 1.00 4.20 C ATOM 205 CD GLU A 15 20.421 3.876 -10.002 1.00 2.34 C ATOM 206 OE1 GLU A 15 19.409 3.182 -9.772 1.00 70.12 O ATOM 207 OE2 GLU A 15 21.586 3.473 -9.810 1.00 65.54 O ATOM 0 H GLU A 15 18.081 4.808 -8.055 1.00 52.24 H new ATOM 0 HA GLU A 15 19.972 6.762 -8.490 1.00 3.33 H new ATOM 0 HB2 GLU A 15 18.140 5.094 -10.093 1.00 55.51 H new ATOM 0 HB3 GLU A 15 18.573 6.596 -10.885 1.00 55.51 H new ATOM 0 HG2 GLU A 15 20.285 5.260 -11.628 1.00 4.20 H new ATOM 0 HG3 GLU A 15 21.033 5.918 -10.186 1.00 4.20 H new ATOM 214 N LEU A 16 16.918 7.926 -8.610 1.00 73.42 N ATOM 215 CA LEU A 16 16.120 9.146 -8.664 1.00 4.52 C ATOM 216 C LEU A 16 16.454 10.067 -7.494 1.00 64.32 C ATOM 217 O LEU A 16 16.793 11.233 -7.688 1.00 42.44 O ATOM 218 CB LEU A 16 14.629 8.806 -8.651 1.00 22.15 C ATOM 219 CG LEU A 16 13.675 9.959 -8.962 1.00 62.43 C ATOM 220 CD1 LEU A 16 13.543 10.883 -7.761 1.00 43.24 C ATOM 221 CD2 LEU A 16 14.153 10.732 -10.183 1.00 31.15 C ATOM 0 H LEU A 16 16.390 7.087 -8.369 1.00 73.42 H new ATOM 0 HA LEU A 16 16.359 9.666 -9.592 1.00 4.52 H new ATOM 0 HB2 LEU A 16 14.452 8.010 -9.374 1.00 22.15 H new ATOM 0 HB3 LEU A 16 14.376 8.407 -7.669 1.00 22.15 H new ATOM 0 HG LEU A 16 12.692 9.542 -9.182 1.00 62.43 H new ATOM 0 HD11 LEU A 16 12.860 11.697 -8.002 1.00 43.24 H new ATOM 0 HD12 LEU A 16 13.154 10.322 -6.911 1.00 43.24 H new ATOM 0 HD13 LEU A 16 14.521 11.293 -7.508 1.00 43.24 H new ATOM 0 HD21 LEU A 16 13.462 11.549 -10.390 1.00 31.15 H new ATOM 0 HD22 LEU A 16 15.147 11.137 -9.991 1.00 31.15 H new ATOM 0 HD23 LEU A 16 14.193 10.064 -11.044 1.00 31.15 H new ATOM 233 N GLU A 17 16.356 9.532 -6.281 1.00 1.24 N ATOM 234 CA GLU A 17 16.649 10.307 -5.080 1.00 64.05 C ATOM 235 C GLU A 17 18.106 10.760 -5.068 1.00 21.41 C ATOM 236 O GLU A 17 18.472 11.690 -4.348 1.00 61.32 O ATOM 237 CB GLU A 17 16.349 9.480 -3.828 1.00 4.53 C ATOM 238 CG GLU A 17 15.294 10.099 -2.928 1.00 3.33 C ATOM 239 CD GLU A 17 14.030 9.265 -2.853 1.00 13.24 C ATOM 240 OE1 GLU A 17 14.112 8.105 -2.398 1.00 74.20 O ATOM 241 OE2 GLU A 17 12.959 9.773 -3.247 1.00 62.13 O ATOM 0 H GLU A 17 16.077 8.567 -6.104 1.00 1.24 H new ATOM 0 HA GLU A 17 16.012 11.191 -5.083 1.00 64.05 H new ATOM 0 HB2 GLU A 17 16.019 8.486 -4.130 1.00 4.53 H new ATOM 0 HB3 GLU A 17 17.270 9.351 -3.259 1.00 4.53 H new ATOM 0 HG2 GLU A 17 15.704 10.222 -1.925 1.00 3.33 H new ATOM 0 HG3 GLU A 17 15.047 11.095 -3.296 1.00 3.33 H new ATOM 248 N ARG A 18 18.933 10.096 -5.867 1.00 44.02 N ATOM 249 CA ARG A 18 20.351 10.428 -5.947 1.00 54.01 C ATOM 250 C ARG A 18 20.566 11.699 -6.764 1.00 62.41 C ATOM 251 O ARG A 18 21.453 12.499 -6.464 1.00 53.21 O ATOM 252 CB ARG A 18 21.134 9.271 -6.569 1.00 45.13 C ATOM 253 CG ARG A 18 22.624 9.312 -6.268 1.00 75.20 C ATOM 254 CD ARG A 18 22.937 8.677 -4.922 1.00 65.43 C ATOM 255 NE ARG A 18 24.138 7.847 -4.976 1.00 72.53 N ATOM 256 CZ ARG A 18 25.364 8.336 -5.120 1.00 52.20 C ATOM 257 NH1 ARG A 18 25.550 9.645 -5.225 1.00 23.20 N ATOM 258 NH2 ARG A 18 26.407 7.517 -5.159 1.00 73.05 N ATOM 0 H ARG A 18 18.646 9.324 -6.469 1.00 44.02 H new ATOM 0 HA ARG A 18 20.715 10.601 -4.934 1.00 54.01 H new ATOM 0 HB2 ARG A 18 20.724 8.329 -6.205 1.00 45.13 H new ATOM 0 HB3 ARG A 18 20.990 9.285 -7.649 1.00 45.13 H new ATOM 0 HG2 ARG A 18 23.170 8.790 -7.054 1.00 75.20 H new ATOM 0 HG3 ARG A 18 22.969 10.346 -6.273 1.00 75.20 H new ATOM 0 HD2 ARG A 18 23.070 9.459 -4.174 1.00 65.43 H new ATOM 0 HD3 ARG A 18 22.090 8.070 -4.602 1.00 65.43 H new ATOM 0 HE ARG A 18 24.029 6.836 -4.899 1.00 72.53 H new ATOM 0 HH11 ARG A 18 24.751 10.278 -5.195 1.00 23.20 H new ATOM 0 HH12 ARG A 18 26.493 10.019 -5.336 1.00 23.20 H new ATOM 0 HH21 ARG A 18 26.268 6.510 -5.078 1.00 73.05 H new ATOM 0 HH22 ARG A 18 27.348 7.895 -5.270 1.00 73.05 H new ATOM 272 N ILE A 19 19.749 11.877 -7.797 1.00 42.51 N ATOM 273 CA ILE A 19 19.850 13.050 -8.656 1.00 4.30 C ATOM 274 C ILE A 19 19.475 14.320 -7.899 1.00 44.02 C ATOM 275 O ILE A 19 18.486 14.349 -7.168 1.00 71.13 O ATOM 276 CB ILE A 19 18.946 12.919 -9.897 1.00 4.12 C ATOM 277 CG1 ILE A 19 19.334 11.683 -10.709 1.00 65.14 C ATOM 278 CG2 ILE A 19 19.037 14.174 -10.753 1.00 64.04 C ATOM 279 CD1 ILE A 19 18.161 11.011 -11.385 1.00 35.41 C ATOM 0 H ILE A 19 19.010 11.224 -8.059 1.00 42.51 H new ATOM 0 HA ILE A 19 20.889 13.116 -8.979 1.00 4.30 H new ATOM 0 HB ILE A 19 17.914 12.803 -9.567 1.00 4.12 H new ATOM 0 HG12 ILE A 19 20.063 11.970 -11.466 1.00 65.14 H new ATOM 0 HG13 ILE A 19 19.824 10.965 -10.051 1.00 65.14 H new ATOM 0 HG21 ILE A 19 18.393 14.067 -11.626 1.00 64.04 H new ATOM 0 HG22 ILE A 19 18.716 15.037 -10.169 1.00 64.04 H new ATOM 0 HG23 ILE A 19 20.067 14.319 -11.078 1.00 64.04 H new ATOM 0 HD11 ILE A 19 18.511 10.142 -11.943 1.00 35.41 H new ATOM 0 HD12 ILE A 19 17.441 10.692 -10.632 1.00 35.41 H new ATOM 0 HD13 ILE A 19 17.684 11.713 -12.069 1.00 35.41 H new ATOM 291 N ARG A 20 20.271 15.368 -8.082 1.00 45.11 N ATOM 292 CA ARG A 20 20.023 16.641 -7.418 1.00 11.45 C ATOM 293 C ARG A 20 19.102 17.522 -8.256 1.00 14.42 C ATOM 294 O ARG A 20 19.222 17.577 -9.480 1.00 50.24 O ATOM 295 CB ARG A 20 21.342 17.370 -7.155 1.00 4.20 C ATOM 296 CG ARG A 20 22.287 16.609 -6.241 1.00 21.34 C ATOM 297 CD ARG A 20 23.714 17.123 -6.360 1.00 33.11 C ATOM 298 NE ARG A 20 24.291 17.441 -5.057 1.00 43.32 N ATOM 299 CZ ARG A 20 25.523 17.909 -4.894 1.00 5.10 C ATOM 300 NH1 ARG A 20 26.303 18.113 -5.947 1.00 23.13 N ATOM 301 NH2 ARG A 20 25.979 18.175 -3.676 1.00 62.14 N ATOM 0 H ARG A 20 21.094 15.360 -8.685 1.00 45.11 H new ATOM 0 HA ARG A 20 19.533 16.435 -6.466 1.00 11.45 H new ATOM 0 HB2 ARG A 20 21.841 17.555 -8.106 1.00 4.20 H new ATOM 0 HB3 ARG A 20 21.128 18.343 -6.713 1.00 4.20 H new ATOM 0 HG2 ARG A 20 21.950 16.703 -5.209 1.00 21.34 H new ATOM 0 HG3 ARG A 20 22.260 15.548 -6.490 1.00 21.34 H new ATOM 0 HD2 ARG A 20 24.330 16.372 -6.856 1.00 33.11 H new ATOM 0 HD3 ARG A 20 23.728 18.013 -6.989 1.00 33.11 H new ATOM 0 HE ARG A 20 23.717 17.296 -4.227 1.00 43.32 H new ATOM 0 HH11 ARG A 20 25.957 17.910 -6.885 1.00 23.13 H new ATOM 0 HH12 ARG A 20 27.249 18.473 -5.819 1.00 23.13 H new ATOM 0 HH21 ARG A 20 25.383 18.020 -2.863 1.00 62.14 H new ATOM 0 HH22 ARG A 20 26.926 18.534 -3.553 1.00 62.14 H new ATOM 315 N LEU A 21 18.180 18.209 -7.590 1.00 3.15 N ATOM 316 CA LEU A 21 17.237 19.087 -8.273 1.00 70.00 C ATOM 317 C LEU A 21 17.968 20.214 -8.995 1.00 55.23 C ATOM 318 O LEU A 21 17.644 20.547 -10.135 1.00 74.14 O ATOM 319 CB LEU A 21 16.237 19.671 -7.273 1.00 13.13 C ATOM 320 CG LEU A 21 15.110 18.738 -6.829 1.00 74.22 C ATOM 321 CD1 LEU A 21 14.313 19.364 -5.695 1.00 43.32 C ATOM 322 CD2 LEU A 21 14.199 18.407 -8.003 1.00 31.22 C ATOM 0 H LEU A 21 18.066 18.175 -6.577 1.00 3.15 H new ATOM 0 HA LEU A 21 16.698 18.495 -9.013 1.00 70.00 H new ATOM 0 HB2 LEU A 21 16.785 19.993 -6.388 1.00 13.13 H new ATOM 0 HB3 LEU A 21 15.791 20.563 -7.714 1.00 13.13 H new ATOM 0 HG LEU A 21 15.554 17.811 -6.465 1.00 74.22 H new ATOM 0 HD11 LEU A 21 13.516 18.685 -5.393 1.00 43.32 H new ATOM 0 HD12 LEU A 21 14.972 19.550 -4.847 1.00 43.32 H new ATOM 0 HD13 LEU A 21 13.880 20.306 -6.032 1.00 43.32 H new ATOM 0 HD21 LEU A 21 13.402 17.742 -7.669 1.00 31.22 H new ATOM 0 HD22 LEU A 21 13.764 19.326 -8.396 1.00 31.22 H new ATOM 0 HD23 LEU A 21 14.778 17.916 -8.785 1.00 31.22 H new ATOM 334 N ARG A 22 18.957 20.797 -8.324 1.00 71.45 N ATOM 335 CA ARG A 22 19.734 21.886 -8.903 1.00 60.22 C ATOM 336 C ARG A 22 21.230 21.608 -8.786 1.00 40.20 C ATOM 337 O ARG A 22 21.677 20.833 -7.941 1.00 64.12 O ATOM 338 CB ARG A 22 19.394 23.207 -8.211 1.00 3.32 C ATOM 339 CG ARG A 22 18.266 23.974 -8.882 1.00 51.43 C ATOM 340 CD ARG A 22 16.940 23.751 -8.172 1.00 22.34 C ATOM 341 NE ARG A 22 15.811 23.781 -9.097 1.00 61.44 N ATOM 342 CZ ARG A 22 14.543 23.705 -8.712 1.00 32.44 C ATOM 343 NH1 ARG A 22 14.243 23.594 -7.425 1.00 45.00 N ATOM 344 NH2 ARG A 22 13.570 23.738 -9.614 1.00 12.14 N ATOM 0 H ARG A 22 19.238 20.533 -7.380 1.00 71.45 H new ATOM 0 HA ARG A 22 19.477 21.961 -9.960 1.00 60.22 H new ATOM 0 HB2 ARG A 22 19.119 23.005 -7.176 1.00 3.32 H new ATOM 0 HB3 ARG A 22 20.285 23.835 -8.187 1.00 3.32 H new ATOM 0 HG2 ARG A 22 18.502 25.038 -8.888 1.00 51.43 H new ATOM 0 HG3 ARG A 22 18.180 23.660 -9.922 1.00 51.43 H new ATOM 0 HD2 ARG A 22 16.962 22.790 -7.658 1.00 22.34 H new ATOM 0 HD3 ARG A 22 16.804 24.518 -7.409 1.00 22.34 H new ATOM 0 HE ARG A 22 16.007 23.865 -10.094 1.00 61.44 H new ATOM 0 HH11 ARG A 22 14.987 23.567 -6.728 1.00 45.00 H new ATOM 0 HH12 ARG A 22 13.268 23.536 -7.132 1.00 45.00 H new ATOM 0 HH21 ARG A 22 13.796 23.822 -10.605 1.00 12.14 H new ATOM 0 HH22 ARG A 22 12.596 23.679 -9.316 1.00 12.14 H new ATOM 358 N PRO A 23 22.022 22.255 -9.654 1.00 12.43 N ATOM 359 CA PRO A 23 23.479 22.094 -9.668 1.00 34.03 C ATOM 360 C PRO A 23 24.143 22.718 -8.445 1.00 2.31 C ATOM 361 O PRO A 23 25.161 22.225 -7.960 1.00 35.34 O ATOM 362 CB PRO A 23 23.905 22.828 -10.941 1.00 51.24 C ATOM 363 CG PRO A 23 22.827 23.829 -11.179 1.00 41.52 C ATOM 364 CD PRO A 23 21.556 23.194 -10.688 1.00 1.15 C ATOM 0 HA PRO A 23 23.773 21.045 -9.646 1.00 34.03 H new ATOM 0 HB2 PRO A 23 24.874 23.312 -10.814 1.00 51.24 H new ATOM 0 HB3 PRO A 23 24.000 22.141 -11.782 1.00 51.24 H new ATOM 0 HG2 PRO A 23 23.031 24.757 -10.645 1.00 41.52 H new ATOM 0 HG3 PRO A 23 22.754 24.080 -12.237 1.00 41.52 H new ATOM 0 HD2 PRO A 23 20.869 23.934 -10.278 1.00 1.15 H new ATOM 0 HD3 PRO A 23 21.028 22.679 -11.490 1.00 1.15 H new ATOM 372 N GLY A 24 23.559 23.807 -7.951 1.00 4.11 N ATOM 373 CA GLY A 24 24.109 24.480 -6.789 1.00 20.31 C ATOM 374 C GLY A 24 23.444 24.044 -5.498 1.00 13.41 C ATOM 375 O GLY A 24 24.112 23.829 -4.489 1.00 25.13 O ATOM 0 H GLY A 24 22.716 24.234 -8.335 1.00 4.11 H new ATOM 0 HA2 GLY A 24 25.179 24.279 -6.729 1.00 20.31 H new ATOM 0 HA3 GLY A 24 23.993 25.557 -6.908 1.00 20.31 H new ATOM 379 N GLY A 25 22.121 23.917 -5.530 1.00 31.22 N ATOM 380 CA GLY A 25 21.386 23.508 -4.347 1.00 20.11 C ATOM 381 C GLY A 25 21.871 22.182 -3.794 1.00 3.10 C ATOM 382 O GLY A 25 22.814 21.589 -4.318 1.00 63.14 O ATOM 0 H GLY A 25 21.545 24.090 -6.354 1.00 31.22 H new ATOM 0 HA2 GLY A 25 21.483 24.276 -3.579 1.00 20.11 H new ATOM 0 HA3 GLY A 25 20.326 23.431 -4.590 1.00 20.11 H new ATOM 386 N LYS A 26 21.227 21.716 -2.729 1.00 71.04 N ATOM 387 CA LYS A 26 21.598 20.453 -2.102 1.00 71.45 C ATOM 388 C LYS A 26 20.377 19.554 -1.927 1.00 0.35 C ATOM 389 O LYS A 26 20.365 18.667 -1.073 1.00 60.53 O ATOM 390 CB LYS A 26 22.257 20.707 -0.745 1.00 43.00 C ATOM 391 CG LYS A 26 21.361 21.440 0.238 1.00 1.33 C ATOM 392 CD LYS A 26 21.149 20.631 1.508 1.00 75.25 C ATOM 393 CE LYS A 26 22.326 20.767 2.459 1.00 32.05 C ATOM 394 NZ LYS A 26 22.190 21.958 3.344 1.00 54.11 N ATOM 0 H LYS A 26 20.445 22.195 -2.282 1.00 71.04 H new ATOM 0 HA LYS A 26 22.310 19.947 -2.754 1.00 71.45 H new ATOM 0 HB2 LYS A 26 22.555 19.753 -0.311 1.00 43.00 H new ATOM 0 HB3 LYS A 26 23.168 21.287 -0.896 1.00 43.00 H new ATOM 0 HG2 LYS A 26 21.805 22.403 0.489 1.00 1.33 H new ATOM 0 HG3 LYS A 26 20.398 21.645 -0.229 1.00 1.33 H new ATOM 0 HD2 LYS A 26 20.238 20.965 2.005 1.00 75.25 H new ATOM 0 HD3 LYS A 26 21.006 19.581 1.252 1.00 75.25 H new ATOM 0 HE2 LYS A 26 22.405 19.868 3.070 1.00 32.05 H new ATOM 0 HE3 LYS A 26 23.249 20.845 1.885 1.00 32.05 H new ATOM 0 HZ1 LYS A 26 23.013 22.015 3.978 1.00 54.11 H new ATOM 0 HZ2 LYS A 26 22.140 22.819 2.762 1.00 54.11 H new ATOM 0 HZ3 LYS A 26 21.322 21.872 3.910 1.00 54.11 H new ATOM 408 N LYS A 27 19.353 19.790 -2.738 1.00 52.32 N ATOM 409 CA LYS A 27 18.129 19.001 -2.675 1.00 74.53 C ATOM 410 C LYS A 27 18.071 17.992 -3.817 1.00 64.04 C ATOM 411 O LYS A 27 18.621 18.225 -4.894 1.00 11.24 O ATOM 412 CB LYS A 27 16.904 19.917 -2.729 1.00 15.42 C ATOM 413 CG LYS A 27 16.388 20.324 -1.359 1.00 51.22 C ATOM 414 CD LYS A 27 16.512 21.823 -1.140 1.00 51.52 C ATOM 415 CE LYS A 27 15.829 22.256 0.148 1.00 13.12 C ATOM 416 NZ LYS A 27 16.790 22.862 1.110 1.00 65.11 N ATOM 0 H LYS A 27 19.346 20.522 -3.448 1.00 52.32 H new ATOM 0 HA LYS A 27 18.127 18.456 -1.731 1.00 74.53 H new ATOM 0 HB2 LYS A 27 17.156 20.814 -3.294 1.00 15.42 H new ATOM 0 HB3 LYS A 27 16.106 19.411 -3.273 1.00 15.42 H new ATOM 0 HG2 LYS A 27 15.344 20.026 -1.259 1.00 51.22 H new ATOM 0 HG3 LYS A 27 16.946 19.795 -0.587 1.00 51.22 H new ATOM 0 HD2 LYS A 27 17.565 22.101 -1.106 1.00 51.52 H new ATOM 0 HD3 LYS A 27 16.070 22.353 -1.984 1.00 51.52 H new ATOM 0 HE2 LYS A 27 15.043 22.976 -0.082 1.00 13.12 H new ATOM 0 HE3 LYS A 27 15.347 21.395 0.610 1.00 13.12 H new ATOM 0 HZ1 LYS A 27 16.285 23.144 1.974 1.00 65.11 H new ATOM 0 HZ2 LYS A 27 17.526 22.167 1.350 1.00 65.11 H new ATOM 0 HZ3 LYS A 27 17.232 23.699 0.679 1.00 65.11 H new ATOM 430 N LYS A 28 17.403 16.869 -3.576 1.00 13.04 N ATOM 431 CA LYS A 28 17.271 15.825 -4.585 1.00 31.15 C ATOM 432 C LYS A 28 15.820 15.679 -5.030 1.00 73.24 C ATOM 433 O LYS A 28 14.912 16.238 -4.415 1.00 72.24 O ATOM 434 CB LYS A 28 17.785 14.491 -4.037 1.00 34.40 C ATOM 435 CG LYS A 28 19.297 14.424 -3.919 1.00 23.20 C ATOM 436 CD LYS A 28 19.726 13.847 -2.580 1.00 64.15 C ATOM 437 CE LYS A 28 20.384 14.901 -1.704 1.00 4.42 C ATOM 438 NZ LYS A 28 19.863 14.868 -0.309 1.00 4.12 N ATOM 0 H LYS A 28 16.944 16.659 -2.690 1.00 13.04 H new ATOM 0 HA LYS A 28 17.870 16.111 -5.449 1.00 31.15 H new ATOM 0 HB2 LYS A 28 17.344 14.317 -3.055 1.00 34.40 H new ATOM 0 HB3 LYS A 28 17.444 13.685 -4.687 1.00 34.40 H new ATOM 0 HG2 LYS A 28 19.699 13.812 -4.726 1.00 23.20 H new ATOM 0 HG3 LYS A 28 19.717 15.423 -4.037 1.00 23.20 H new ATOM 0 HD2 LYS A 28 18.858 13.435 -2.065 1.00 64.15 H new ATOM 0 HD3 LYS A 28 20.421 13.023 -2.743 1.00 64.15 H new ATOM 0 HE2 LYS A 28 21.462 14.742 -1.693 1.00 4.42 H new ATOM 0 HE3 LYS A 28 20.212 15.888 -2.133 1.00 4.42 H new ATOM 0 HZ1 LYS A 28 20.337 15.602 0.256 1.00 4.12 H new ATOM 0 HZ2 LYS A 28 18.838 15.045 -0.317 1.00 4.12 H new ATOM 0 HZ3 LYS A 28 20.050 13.934 0.109 1.00 4.12 H new ATOM 452 N TYR A 29 15.608 14.923 -6.103 1.00 24.23 N ATOM 453 CA TYR A 29 14.267 14.705 -6.631 1.00 62.23 C ATOM 454 C TYR A 29 13.461 13.791 -5.712 1.00 3.54 C ATOM 455 O TYR A 29 14.025 13.009 -4.945 1.00 51.34 O ATOM 456 CB TYR A 29 14.341 14.098 -8.033 1.00 20.02 C ATOM 457 CG TYR A 29 14.550 15.122 -9.126 1.00 34.00 C ATOM 458 CD1 TYR A 29 15.828 15.516 -9.502 1.00 22.43 C ATOM 459 CD2 TYR A 29 13.468 15.697 -9.782 1.00 22.31 C ATOM 460 CE1 TYR A 29 16.023 16.452 -10.499 1.00 31.32 C ATOM 461 CE2 TYR A 29 13.653 16.632 -10.781 1.00 11.31 C ATOM 462 CZ TYR A 29 14.933 17.007 -11.136 1.00 34.05 C ATOM 463 OH TYR A 29 15.123 17.939 -12.130 1.00 54.41 O ATOM 0 H TYR A 29 16.348 14.452 -6.623 1.00 24.23 H new ATOM 0 HA TYR A 29 13.764 15.671 -6.685 1.00 62.23 H new ATOM 0 HB2 TYR A 29 15.156 13.374 -8.064 1.00 20.02 H new ATOM 0 HB3 TYR A 29 13.420 13.550 -8.232 1.00 20.02 H new ATOM 0 HD1 TYR A 29 16.684 15.083 -9.006 1.00 22.43 H new ATOM 0 HD2 TYR A 29 12.465 15.407 -9.506 1.00 22.31 H new ATOM 0 HE1 TYR A 29 17.024 16.748 -10.778 1.00 31.32 H new ATOM 0 HE2 TYR A 29 12.801 17.067 -11.282 1.00 11.31 H new ATOM 0 HH TYR A 29 15.987 18.384 -12.001 1.00 54.41 H new ATOM 473 N ARG A 30 12.139 13.896 -5.795 1.00 44.11 N ATOM 474 CA ARG A 30 11.255 13.080 -4.971 1.00 64.01 C ATOM 475 C ARG A 30 10.082 12.552 -5.792 1.00 33.12 C ATOM 476 O ARG A 30 9.754 13.095 -6.848 1.00 25.42 O ATOM 477 CB ARG A 30 10.736 13.893 -3.784 1.00 53.32 C ATOM 478 CG ARG A 30 11.041 13.265 -2.434 1.00 65.44 C ATOM 479 CD ARG A 30 11.875 14.192 -1.564 1.00 54.32 C ATOM 480 NE ARG A 30 12.837 13.458 -0.747 1.00 21.43 N ATOM 481 CZ ARG A 30 13.653 14.038 0.125 1.00 24.14 C ATOM 482 NH1 ARG A 30 13.625 15.352 0.293 1.00 14.30 N ATOM 483 NH2 ARG A 30 14.501 13.302 0.833 1.00 4.34 N ATOM 0 H ARG A 30 11.656 14.538 -6.424 1.00 44.11 H new ATOM 0 HA ARG A 30 11.827 12.230 -4.598 1.00 64.01 H new ATOM 0 HB2 ARG A 30 11.175 14.890 -3.818 1.00 53.32 H new ATOM 0 HB3 ARG A 30 9.657 14.016 -3.883 1.00 53.32 H new ATOM 0 HG2 ARG A 30 10.108 13.027 -1.923 1.00 65.44 H new ATOM 0 HG3 ARG A 30 11.573 12.325 -2.581 1.00 65.44 H new ATOM 0 HD2 ARG A 30 12.405 14.903 -2.197 1.00 54.32 H new ATOM 0 HD3 ARG A 30 11.217 14.771 -0.916 1.00 54.32 H new ATOM 0 HE ARG A 30 12.885 12.445 -0.852 1.00 21.43 H new ATOM 0 HH11 ARG A 30 12.975 15.922 -0.249 1.00 14.30 H new ATOM 0 HH12 ARG A 30 14.253 15.794 0.964 1.00 14.30 H new ATOM 0 HH21 ARG A 30 14.526 12.290 0.707 1.00 4.34 H new ATOM 0 HH22 ARG A 30 15.128 13.748 1.503 1.00 4.34 H new ATOM 497 N LEU A 31 9.455 11.489 -5.300 1.00 35.23 N ATOM 498 CA LEU A 31 8.318 10.886 -5.987 1.00 52.31 C ATOM 499 C LEU A 31 7.323 11.953 -6.433 1.00 71.32 C ATOM 500 O LEU A 31 6.728 11.853 -7.506 1.00 72.52 O ATOM 501 CB LEU A 31 7.623 9.875 -5.074 1.00 60.40 C ATOM 502 CG LEU A 31 7.762 8.404 -5.472 1.00 42.20 C ATOM 503 CD1 LEU A 31 9.229 8.026 -5.609 1.00 54.15 C ATOM 504 CD2 LEU A 31 7.071 7.508 -4.455 1.00 41.01 C ATOM 0 H LEU A 31 9.715 11.027 -4.428 1.00 35.23 H new ATOM 0 HA LEU A 31 8.691 10.371 -6.872 1.00 52.31 H new ATOM 0 HB2 LEU A 31 8.017 9.996 -4.065 1.00 60.40 H new ATOM 0 HB3 LEU A 31 6.562 10.121 -5.034 1.00 60.40 H new ATOM 0 HG LEU A 31 7.279 8.261 -6.438 1.00 42.20 H new ATOM 0 HD11 LEU A 31 9.309 6.977 -5.892 1.00 54.15 H new ATOM 0 HD12 LEU A 31 9.694 8.646 -6.376 1.00 54.15 H new ATOM 0 HD13 LEU A 31 9.736 8.185 -4.657 1.00 54.15 H new ATOM 0 HD21 LEU A 31 7.180 6.466 -4.755 1.00 41.01 H new ATOM 0 HD22 LEU A 31 7.525 7.653 -3.475 1.00 41.01 H new ATOM 0 HD23 LEU A 31 6.012 7.762 -4.406 1.00 41.01 H new ATOM 516 N LYS A 32 7.148 12.975 -5.604 1.00 13.31 N ATOM 517 CA LYS A 32 6.228 14.064 -5.913 1.00 13.01 C ATOM 518 C LYS A 32 6.464 14.592 -7.325 1.00 61.51 C ATOM 519 O LYS A 32 5.516 14.871 -8.060 1.00 25.43 O ATOM 520 CB LYS A 32 6.390 15.199 -4.899 1.00 54.44 C ATOM 521 CG LYS A 32 5.714 14.927 -3.567 1.00 22.34 C ATOM 522 CD LYS A 32 5.415 16.214 -2.819 1.00 11.53 C ATOM 523 CE LYS A 32 5.795 16.107 -1.350 1.00 0.31 C ATOM 524 NZ LYS A 32 4.695 16.569 -0.458 1.00 44.30 N ATOM 0 H LYS A 32 7.632 13.073 -4.711 1.00 13.31 H new ATOM 0 HA LYS A 32 5.211 13.675 -5.855 1.00 13.01 H new ATOM 0 HB2 LYS A 32 7.452 15.373 -4.729 1.00 54.44 H new ATOM 0 HB3 LYS A 32 5.981 16.115 -5.324 1.00 54.44 H new ATOM 0 HG2 LYS A 32 4.787 14.379 -3.734 1.00 22.34 H new ATOM 0 HG3 LYS A 32 6.355 14.291 -2.956 1.00 22.34 H new ATOM 0 HD2 LYS A 32 5.961 17.038 -3.278 1.00 11.53 H new ATOM 0 HD3 LYS A 32 4.354 16.448 -2.905 1.00 11.53 H new ATOM 0 HE2 LYS A 32 6.044 15.073 -1.114 1.00 0.31 H new ATOM 0 HE3 LYS A 32 6.689 16.701 -1.162 1.00 0.31 H new ATOM 0 HZ1 LYS A 32 4.993 16.481 0.535 1.00 44.30 H new ATOM 0 HZ2 LYS A 32 4.474 17.564 -0.666 1.00 44.30 H new ATOM 0 HZ3 LYS A 32 3.849 15.986 -0.619 1.00 44.30 H new ATOM 538 N HIS A 33 7.732 14.723 -7.698 1.00 41.40 N ATOM 539 CA HIS A 33 8.093 15.214 -9.024 1.00 1.52 C ATOM 540 C HIS A 33 7.728 14.195 -10.098 1.00 30.43 C ATOM 541 O HIS A 33 7.353 14.630 -11.187 1.00 60.40 O ATOM 542 CB HIS A 33 9.589 15.525 -9.086 1.00 55.12 C ATOM 543 CG HIS A 33 10.033 16.540 -8.078 1.00 0.14 C ATOM 544 ND1 HIS A 33 10.918 16.252 -7.060 1.00 42.24 N ATOM 545 CD2 HIS A 33 9.708 17.845 -7.933 1.00 3.41 C ATOM 546 CE1 HIS A 33 11.119 17.337 -6.334 1.00 41.22 C ATOM 547 NE2 HIS A 33 10.397 18.318 -6.844 1.00 13.34 N ATOM 0 H HIS A 33 8.528 14.496 -7.101 1.00 41.40 H new ATOM 0 HA HIS A 33 7.532 16.129 -9.211 1.00 1.52 H new ATOM 0 HB2 HIS A 33 10.150 14.603 -8.932 1.00 55.12 H new ATOM 0 HB3 HIS A 33 9.836 15.885 -10.085 1.00 55.12 H new ATOM 0 HD2 HIS A 33 9.032 18.410 -8.558 1.00 3.41 H new ATOM 0 HE1 HIS A 33 11.764 17.409 -5.471 1.00 41.22 H new ATOM 0 HE2 HIS A 33 10.358 19.273 -6.487 1.00 13.34 H new ATOM 555 N ILE A 34 7.825 12.896 -9.832 1.00 32.35 N ATOM 556 CA ILE A 34 7.487 11.886 -10.827 1.00 32.04 C ATOM 557 C ILE A 34 6.002 11.930 -11.172 1.00 14.13 C ATOM 558 O ILE A 34 5.615 11.735 -12.325 1.00 2.45 O ATOM 559 CB ILE A 34 7.846 10.470 -10.336 1.00 43.43 C ATOM 560 CG1 ILE A 34 9.307 10.420 -9.885 1.00 30.21 C ATOM 561 CG2 ILE A 34 7.589 9.449 -11.433 1.00 62.44 C ATOM 562 CD1 ILE A 34 9.692 9.110 -9.232 1.00 5.40 C ATOM 0 H ILE A 34 8.135 12.519 -8.936 1.00 32.35 H new ATOM 0 HA ILE A 34 8.072 12.113 -11.718 1.00 32.04 H new ATOM 0 HB ILE A 34 7.213 10.224 -9.483 1.00 43.43 H new ATOM 0 HG12 ILE A 34 9.951 10.590 -10.747 1.00 30.21 H new ATOM 0 HG13 ILE A 34 9.491 11.234 -9.184 1.00 30.21 H new ATOM 0 HG21 ILE A 34 7.847 8.454 -11.071 1.00 62.44 H new ATOM 0 HG22 ILE A 34 6.535 9.472 -11.712 1.00 62.44 H new ATOM 0 HG23 ILE A 34 8.200 9.689 -12.303 1.00 62.44 H new ATOM 0 HD11 ILE A 34 10.741 9.145 -8.937 1.00 5.40 H new ATOM 0 HD12 ILE A 34 9.073 8.947 -8.350 1.00 5.40 H new ATOM 0 HD13 ILE A 34 9.540 8.293 -9.938 1.00 5.40 H new ATOM 574 N VAL A 35 5.173 12.190 -10.165 1.00 64.20 N ATOM 575 CA VAL A 35 3.731 12.263 -10.362 1.00 33.33 C ATOM 576 C VAL A 35 3.359 13.425 -11.276 1.00 10.34 C ATOM 577 O VAL A 35 2.685 13.241 -12.289 1.00 43.04 O ATOM 578 CB VAL A 35 2.988 12.419 -9.021 1.00 62.44 C ATOM 579 CG1 VAL A 35 1.491 12.549 -9.253 1.00 14.33 C ATOM 580 CG2 VAL A 35 3.294 11.246 -8.104 1.00 22.22 C ATOM 0 H VAL A 35 5.476 12.353 -9.205 1.00 64.20 H new ATOM 0 HA VAL A 35 3.428 11.326 -10.829 1.00 33.33 H new ATOM 0 HB VAL A 35 3.337 13.330 -8.535 1.00 62.44 H new ATOM 0 HG11 VAL A 35 0.982 12.658 -8.295 1.00 14.33 H new ATOM 0 HG12 VAL A 35 1.293 13.425 -9.871 1.00 14.33 H new ATOM 0 HG13 VAL A 35 1.123 11.657 -9.760 1.00 14.33 H new ATOM 0 HG21 VAL A 35 2.761 11.372 -7.162 1.00 22.22 H new ATOM 0 HG22 VAL A 35 2.974 10.319 -8.580 1.00 22.22 H new ATOM 0 HG23 VAL A 35 4.366 11.204 -7.912 1.00 22.22 H new ATOM 590 N TRP A 36 3.802 14.622 -10.909 1.00 52.32 N ATOM 591 CA TRP A 36 3.516 15.816 -11.696 1.00 41.42 C ATOM 592 C TRP A 36 3.849 15.592 -13.167 1.00 71.43 C ATOM 593 O TRP A 36 3.098 16.000 -14.052 1.00 72.33 O ATOM 594 CB TRP A 36 4.309 17.009 -11.158 1.00 53.14 C ATOM 595 CG TRP A 36 3.968 18.302 -11.833 1.00 52.54 C ATOM 596 CD1 TRP A 36 2.877 19.088 -11.596 1.00 0.22 C ATOM 597 CD2 TRP A 36 4.722 18.958 -12.859 1.00 10.33 C ATOM 598 NE1 TRP A 36 2.907 20.194 -12.411 1.00 41.23 N ATOM 599 CE2 TRP A 36 4.029 20.138 -13.196 1.00 31.34 C ATOM 600 CE3 TRP A 36 5.915 18.665 -13.524 1.00 3.41 C ATOM 601 CZ2 TRP A 36 4.491 21.021 -14.168 1.00 62.41 C ATOM 602 CZ3 TRP A 36 6.372 19.543 -14.489 1.00 20.30 C ATOM 603 CH2 TRP A 36 5.662 20.709 -14.803 1.00 30.32 C ATOM 0 H TRP A 36 4.360 14.792 -10.072 1.00 52.32 H new ATOM 0 HA TRP A 36 2.450 16.029 -11.612 1.00 41.42 H new ATOM 0 HB2 TRP A 36 4.124 17.106 -10.088 1.00 53.14 H new ATOM 0 HB3 TRP A 36 5.374 16.813 -11.281 1.00 53.14 H new ATOM 0 HD1 TRP A 36 2.104 18.872 -10.874 1.00 0.22 H new ATOM 0 HE1 TRP A 36 2.208 20.936 -12.429 1.00 41.23 H new ATOM 0 HE3 TRP A 36 6.470 17.769 -13.289 1.00 3.41 H new ATOM 0 HZ2 TRP A 36 3.945 21.920 -14.412 1.00 62.41 H new ATOM 0 HZ3 TRP A 36 7.293 19.326 -15.010 1.00 20.30 H new ATOM 0 HH2 TRP A 36 6.047 21.375 -15.561 1.00 30.32 H new ATOM 614 N ALA A 37 4.978 14.939 -13.421 1.00 42.02 N ATOM 615 CA ALA A 37 5.408 14.658 -14.785 1.00 30.10 C ATOM 616 C ALA A 37 4.344 13.872 -15.545 1.00 45.22 C ATOM 617 O ALA A 37 3.872 14.305 -16.596 1.00 23.22 O ATOM 618 CB ALA A 37 6.725 13.897 -14.777 1.00 60.43 C ATOM 0 H ALA A 37 5.612 14.595 -12.700 1.00 42.02 H new ATOM 0 HA ALA A 37 5.554 15.609 -15.297 1.00 30.10 H new ATOM 0 HB1 ALA A 37 7.034 13.694 -15.802 1.00 60.43 H new ATOM 0 HB2 ALA A 37 7.488 14.496 -14.280 1.00 60.43 H new ATOM 0 HB3 ALA A 37 6.598 12.955 -14.243 1.00 60.43 H new ATOM 624 N ALA A 38 3.974 12.715 -15.007 1.00 34.02 N ATOM 625 CA ALA A 38 2.965 11.870 -15.634 1.00 62.14 C ATOM 626 C ALA A 38 1.639 12.610 -15.776 1.00 4.13 C ATOM 627 O ALA A 38 0.898 12.398 -16.734 1.00 64.32 O ATOM 628 CB ALA A 38 2.775 10.592 -14.831 1.00 71.31 C ATOM 0 H ALA A 38 4.357 12.341 -14.139 1.00 34.02 H new ATOM 0 HA ALA A 38 3.314 11.610 -16.633 1.00 62.14 H new ATOM 0 HB1 ALA A 38 2.019 9.970 -15.310 1.00 71.31 H new ATOM 0 HB2 ALA A 38 3.718 10.047 -14.786 1.00 71.31 H new ATOM 0 HB3 ALA A 38 2.452 10.842 -13.820 1.00 71.31 H new ATOM 634 N ASN A 39 1.347 13.479 -14.814 1.00 53.41 N ATOM 635 CA ASN A 39 0.108 14.250 -14.831 1.00 40.23 C ATOM 636 C ASN A 39 0.103 15.245 -15.987 1.00 64.01 C ATOM 637 O ASN A 39 -0.781 15.214 -16.844 1.00 4.32 O ATOM 638 CB ASN A 39 -0.074 14.991 -13.505 1.00 70.13 C ATOM 639 CG ASN A 39 -0.459 14.060 -12.371 1.00 51.33 C ATOM 640 OD1 ASN A 39 -0.826 12.907 -12.597 1.00 74.11 O ATOM 641 ND2 ASN A 39 -0.376 14.558 -11.143 1.00 14.21 N ATOM 0 H ASN A 39 1.950 13.667 -14.013 1.00 53.41 H new ATOM 0 HA ASN A 39 -0.721 13.556 -14.968 1.00 40.23 H new ATOM 0 HB2 ASN A 39 0.852 15.507 -13.250 1.00 70.13 H new ATOM 0 HB3 ASN A 39 -0.843 15.755 -13.621 1.00 70.13 H new ATOM 0 HD21 ASN A 39 -0.622 13.979 -10.340 1.00 14.21 H new ATOM 0 HD22 ASN A 39 -0.067 15.520 -11.003 1.00 14.21 H new ATOM 648 N LYS A 40 1.097 16.127 -16.006 1.00 13.15 N ATOM 649 CA LYS A 40 1.210 17.131 -17.057 1.00 24.01 C ATOM 650 C LYS A 40 1.014 16.503 -18.433 1.00 52.34 C ATOM 651 O LYS A 40 0.437 17.118 -19.331 1.00 74.50 O ATOM 652 CB LYS A 40 2.575 17.819 -16.989 1.00 3.10 C ATOM 653 CG LYS A 40 2.698 18.816 -15.849 1.00 31.41 C ATOM 654 CD LYS A 40 1.842 20.048 -16.090 1.00 64.24 C ATOM 655 CE LYS A 40 0.667 20.107 -15.127 1.00 53.02 C ATOM 656 NZ LYS A 40 0.054 21.463 -15.083 1.00 34.23 N ATOM 0 H LYS A 40 1.836 16.167 -15.305 1.00 13.15 H new ATOM 0 HA LYS A 40 0.427 17.873 -16.901 1.00 24.01 H new ATOM 0 HB2 LYS A 40 3.350 17.060 -16.882 1.00 3.10 H new ATOM 0 HB3 LYS A 40 2.761 18.333 -17.932 1.00 3.10 H new ATOM 0 HG2 LYS A 40 2.398 18.341 -14.915 1.00 31.41 H new ATOM 0 HG3 LYS A 40 3.741 19.113 -15.735 1.00 31.41 H new ATOM 0 HD2 LYS A 40 2.452 20.944 -15.977 1.00 64.24 H new ATOM 0 HD3 LYS A 40 1.473 20.041 -17.116 1.00 64.24 H new ATOM 0 HE2 LYS A 40 -0.086 19.378 -15.427 1.00 53.02 H new ATOM 0 HE3 LYS A 40 1.002 19.827 -14.128 1.00 53.02 H new ATOM 0 HZ1 LYS A 40 -0.743 21.462 -14.415 1.00 34.23 H new ATOM 0 HZ2 LYS A 40 0.765 22.155 -14.772 1.00 34.23 H new ATOM 0 HZ3 LYS A 40 -0.288 21.720 -16.031 1.00 34.23 H new ATOM 670 N LEU A 41 1.496 15.276 -18.592 1.00 64.42 N ATOM 671 CA LEU A 41 1.373 14.563 -19.859 1.00 74.42 C ATOM 672 C LEU A 41 -0.093 14.326 -20.209 1.00 54.14 C ATOM 673 O LEU A 41 -0.600 14.862 -21.195 1.00 74.51 O ATOM 674 CB LEU A 41 2.114 13.227 -19.789 1.00 44.23 C ATOM 675 CG LEU A 41 3.636 13.309 -19.666 1.00 45.41 C ATOM 676 CD1 LEU A 41 4.216 11.953 -19.298 1.00 3.04 C ATOM 677 CD2 LEU A 41 4.249 13.821 -20.961 1.00 24.11 C ATOM 0 H LEU A 41 1.976 14.753 -17.859 1.00 64.42 H new ATOM 0 HA LEU A 41 1.820 15.179 -20.640 1.00 74.42 H new ATOM 0 HB2 LEU A 41 1.730 12.666 -18.937 1.00 44.23 H new ATOM 0 HB3 LEU A 41 1.872 12.653 -20.684 1.00 44.23 H new ATOM 0 HG LEU A 41 3.879 14.012 -18.870 1.00 45.41 H new ATOM 0 HD11 LEU A 41 5.300 12.031 -19.215 1.00 3.04 H new ATOM 0 HD12 LEU A 41 3.802 11.627 -18.344 1.00 3.04 H new ATOM 0 HD13 LEU A 41 3.963 11.227 -20.071 1.00 3.04 H new ATOM 0 HD21 LEU A 41 5.333 13.873 -20.855 1.00 24.11 H new ATOM 0 HD22 LEU A 41 3.996 13.143 -21.776 1.00 24.11 H new ATOM 0 HD23 LEU A 41 3.858 14.814 -21.181 1.00 24.11 H new ATOM 689 N ASP A 42 -0.768 13.523 -19.395 1.00 12.04 N ATOM 690 CA ASP A 42 -2.177 13.218 -19.617 1.00 60.41 C ATOM 691 C ASP A 42 -2.975 14.492 -19.875 1.00 22.10 C ATOM 692 O ASP A 42 -3.774 14.557 -20.810 1.00 61.11 O ATOM 693 CB ASP A 42 -2.756 12.474 -18.412 1.00 2.14 C ATOM 694 CG ASP A 42 -4.235 12.180 -18.569 1.00 30.32 C ATOM 695 OD1 ASP A 42 -4.698 12.069 -19.723 1.00 1.24 O ATOM 696 OD2 ASP A 42 -4.929 12.063 -17.537 1.00 71.41 O ATOM 0 H ASP A 42 -0.363 13.071 -18.575 1.00 12.04 H new ATOM 0 HA ASP A 42 -2.251 12.580 -20.498 1.00 60.41 H new ATOM 0 HB2 ASP A 42 -2.215 11.538 -18.273 1.00 2.14 H new ATOM 0 HB3 ASP A 42 -2.600 13.069 -17.512 1.00 2.14 H new ATOM 701 N ARG A 43 -2.755 15.501 -19.039 1.00 45.41 N ATOM 702 CA ARG A 43 -3.454 16.773 -19.176 1.00 61.13 C ATOM 703 C ARG A 43 -3.138 17.426 -20.518 1.00 54.40 C ATOM 704 O ARG A 43 -4.024 17.621 -21.350 1.00 52.40 O ATOM 705 CB ARG A 43 -3.070 17.716 -18.035 1.00 33.55 C ATOM 706 CG ARG A 43 -3.920 18.975 -17.972 1.00 72.51 C ATOM 707 CD ARG A 43 -3.676 19.749 -16.686 1.00 24.11 C ATOM 708 NE ARG A 43 -4.901 20.352 -16.168 1.00 71.32 N ATOM 709 CZ ARG A 43 -4.915 21.354 -15.297 1.00 73.12 C ATOM 710 NH1 ARG A 43 -3.777 21.863 -14.848 1.00 43.43 N ATOM 711 NH2 ARG A 43 -6.071 21.850 -14.873 1.00 22.02 N ATOM 0 H ARG A 43 -2.098 15.462 -18.260 1.00 45.41 H new ATOM 0 HA ARG A 43 -4.525 16.576 -19.131 1.00 61.13 H new ATOM 0 HB2 ARG A 43 -3.157 17.182 -17.089 1.00 33.55 H new ATOM 0 HB3 ARG A 43 -2.023 18.000 -18.146 1.00 33.55 H new ATOM 0 HG2 ARG A 43 -3.695 19.610 -18.829 1.00 72.51 H new ATOM 0 HG3 ARG A 43 -4.974 18.707 -18.042 1.00 72.51 H new ATOM 0 HD2 ARG A 43 -3.256 19.080 -15.935 1.00 24.11 H new ATOM 0 HD3 ARG A 43 -2.937 20.529 -16.867 1.00 24.11 H new ATOM 0 HE ARG A 43 -5.795 19.983 -16.493 1.00 71.32 H new ATOM 0 HH11 ARG A 43 -2.887 21.485 -15.171 1.00 43.43 H new ATOM 0 HH12 ARG A 43 -3.791 22.633 -14.179 1.00 43.43 H new ATOM 0 HH21 ARG A 43 -6.949 21.461 -15.216 1.00 22.02 H new ATOM 0 HH22 ARG A 43 -6.081 22.620 -14.204 1.00 22.02 H new ATOM 725 N PHE A 44 -1.868 17.763 -20.721 1.00 52.02 N ATOM 726 CA PHE A 44 -1.435 18.397 -21.962 1.00 24.23 C ATOM 727 C PHE A 44 -1.974 17.644 -23.174 1.00 63.44 C ATOM 728 O PHE A 44 -2.418 18.250 -24.149 1.00 31.42 O ATOM 729 CB PHE A 44 0.093 18.456 -22.021 1.00 74.44 C ATOM 730 CG PHE A 44 0.677 19.627 -21.285 1.00 11.05 C ATOM 731 CD1 PHE A 44 0.178 20.904 -21.480 1.00 14.51 C ATOM 732 CD2 PHE A 44 1.724 19.451 -20.395 1.00 22.51 C ATOM 733 CE1 PHE A 44 0.714 21.984 -20.803 1.00 73.52 C ATOM 734 CE2 PHE A 44 2.264 20.526 -19.715 1.00 72.42 C ATOM 735 CZ PHE A 44 1.757 21.794 -19.919 1.00 14.11 C ATOM 0 H PHE A 44 -1.122 17.608 -20.043 1.00 52.02 H new ATOM 0 HA PHE A 44 -1.832 19.412 -21.982 1.00 24.23 H new ATOM 0 HB2 PHE A 44 0.500 17.535 -21.604 1.00 74.44 H new ATOM 0 HB3 PHE A 44 0.407 18.500 -23.064 1.00 74.44 H new ATOM 0 HD1 PHE A 44 -0.639 21.058 -22.169 1.00 14.51 H new ATOM 0 HD2 PHE A 44 2.123 18.461 -20.231 1.00 22.51 H new ATOM 0 HE1 PHE A 44 0.317 22.975 -20.966 1.00 73.52 H new ATOM 0 HE2 PHE A 44 3.081 20.375 -19.025 1.00 72.42 H new ATOM 0 HZ PHE A 44 2.176 22.636 -19.388 1.00 14.11 H new ATOM 745 N GLY A 45 -1.930 16.316 -23.106 1.00 73.40 N ATOM 746 CA GLY A 45 -2.416 15.500 -24.204 1.00 51.44 C ATOM 747 C GLY A 45 -1.607 14.233 -24.388 1.00 25.11 C ATOM 748 O GLY A 45 -2.071 13.274 -25.007 1.00 3.15 O ATOM 0 H GLY A 45 -1.567 15.791 -22.310 1.00 73.40 H new ATOM 0 HA2 GLY A 45 -3.459 15.238 -24.024 1.00 51.44 H new ATOM 0 HA3 GLY A 45 -2.388 16.082 -25.125 1.00 51.44 H new ATOM 752 N LEU A 46 -0.391 14.226 -23.851 1.00 41.00 N ATOM 753 CA LEU A 46 0.487 13.066 -23.960 1.00 2.23 C ATOM 754 C LEU A 46 0.101 11.994 -22.947 1.00 12.30 C ATOM 755 O LEU A 46 -0.560 12.279 -21.949 1.00 34.21 O ATOM 756 CB LEU A 46 1.944 13.483 -23.749 1.00 11.35 C ATOM 757 CG LEU A 46 2.540 14.402 -24.815 1.00 3.31 C ATOM 758 CD1 LEU A 46 3.581 15.327 -24.202 1.00 71.11 C ATOM 759 CD2 LEU A 46 3.151 13.584 -25.943 1.00 74.14 C ATOM 0 H LEU A 46 0.009 15.010 -23.336 1.00 41.00 H new ATOM 0 HA LEU A 46 0.376 12.650 -24.961 1.00 2.23 H new ATOM 0 HB2 LEU A 46 2.022 13.982 -22.783 1.00 11.35 H new ATOM 0 HB3 LEU A 46 2.554 12.582 -23.692 1.00 11.35 H new ATOM 0 HG LEU A 46 1.738 15.014 -25.229 1.00 3.31 H new ATOM 0 HD11 LEU A 46 3.994 15.974 -24.976 1.00 71.11 H new ATOM 0 HD12 LEU A 46 3.115 15.938 -23.429 1.00 71.11 H new ATOM 0 HD13 LEU A 46 4.381 14.733 -23.761 1.00 71.11 H new ATOM 0 HD21 LEU A 46 3.570 14.255 -26.693 1.00 74.14 H new ATOM 0 HD22 LEU A 46 3.940 12.947 -25.544 1.00 74.14 H new ATOM 0 HD23 LEU A 46 2.381 12.964 -26.401 1.00 74.14 H new ATOM 771 N ALA A 47 0.521 10.761 -23.209 1.00 42.14 N ATOM 772 CA ALA A 47 0.222 9.647 -22.318 1.00 25.11 C ATOM 773 C ALA A 47 1.398 9.355 -21.391 1.00 53.14 C ATOM 774 O ALA A 47 2.402 10.066 -21.406 1.00 4.22 O ATOM 775 CB ALA A 47 -0.136 8.407 -23.125 1.00 31.13 C ATOM 0 H ALA A 47 1.069 10.508 -24.031 1.00 42.14 H new ATOM 0 HA ALA A 47 -0.633 9.926 -21.702 1.00 25.11 H new ATOM 0 HB1 ALA A 47 -0.357 7.583 -22.447 1.00 31.13 H new ATOM 0 HB2 ALA A 47 -1.011 8.614 -23.741 1.00 31.13 H new ATOM 0 HB3 ALA A 47 0.703 8.135 -23.765 1.00 31.13 H new ATOM 781 N GLU A 48 1.265 8.306 -20.586 1.00 42.03 N ATOM 782 CA GLU A 48 2.317 7.922 -19.652 1.00 1.11 C ATOM 783 C GLU A 48 3.168 6.792 -20.223 1.00 55.34 C ATOM 784 O GLU A 48 4.032 6.244 -19.539 1.00 51.43 O ATOM 785 CB GLU A 48 1.710 7.491 -18.315 1.00 11.44 C ATOM 786 CG GLU A 48 0.643 6.418 -18.449 1.00 13.10 C ATOM 787 CD GLU A 48 -0.760 6.993 -18.498 1.00 32.13 C ATOM 788 OE1 GLU A 48 -1.209 7.551 -17.475 1.00 22.05 O ATOM 789 OE2 GLU A 48 -1.408 6.885 -19.559 1.00 70.32 O ATOM 0 H GLU A 48 0.440 7.707 -20.562 1.00 42.03 H new ATOM 0 HA GLU A 48 2.957 8.789 -19.491 1.00 1.11 H new ATOM 0 HB2 GLU A 48 2.505 7.122 -17.667 1.00 11.44 H new ATOM 0 HB3 GLU A 48 1.277 8.363 -17.824 1.00 11.44 H new ATOM 0 HG2 GLU A 48 0.826 5.840 -19.355 1.00 13.10 H new ATOM 0 HG3 GLU A 48 0.720 5.728 -17.609 1.00 13.10 H new ATOM 796 N SER A 49 2.917 6.450 -21.484 1.00 2.43 N ATOM 797 CA SER A 49 3.657 5.383 -22.147 1.00 52.25 C ATOM 798 C SER A 49 5.100 5.804 -22.409 1.00 73.24 C ATOM 799 O SER A 49 5.927 4.996 -22.833 1.00 72.31 O ATOM 800 CB SER A 49 2.976 5.004 -23.464 1.00 13.33 C ATOM 801 OG SER A 49 1.566 4.991 -23.324 1.00 14.51 O ATOM 0 H SER A 49 2.208 6.896 -22.065 1.00 2.43 H new ATOM 0 HA SER A 49 3.665 4.515 -21.488 1.00 52.25 H new ATOM 0 HB2 SER A 49 3.261 5.713 -24.241 1.00 13.33 H new ATOM 0 HB3 SER A 49 3.322 4.022 -23.786 1.00 13.33 H new ATOM 0 HG SER A 49 1.155 4.748 -24.180 1.00 14.51 H new ATOM 807 N LEU A 50 5.394 7.073 -22.155 1.00 52.32 N ATOM 808 CA LEU A 50 6.737 7.604 -22.363 1.00 50.21 C ATOM 809 C LEU A 50 7.445 7.833 -21.031 1.00 55.11 C ATOM 810 O LEU A 50 8.236 8.766 -20.889 1.00 35.41 O ATOM 811 CB LEU A 50 6.673 8.913 -23.151 1.00 74.22 C ATOM 812 CG LEU A 50 5.788 8.904 -24.398 1.00 75.41 C ATOM 813 CD1 LEU A 50 5.575 10.319 -24.913 1.00 41.02 C ATOM 814 CD2 LEU A 50 6.399 8.026 -25.481 1.00 5.22 C ATOM 0 H LEU A 50 4.721 7.755 -21.805 1.00 52.32 H new ATOM 0 HA LEU A 50 7.306 6.871 -22.934 1.00 50.21 H new ATOM 0 HB2 LEU A 50 6.318 9.698 -22.484 1.00 74.22 H new ATOM 0 HB3 LEU A 50 7.686 9.183 -23.451 1.00 74.22 H new ATOM 0 HG LEU A 50 4.817 8.489 -24.127 1.00 75.41 H new ATOM 0 HD11 LEU A 50 4.943 10.292 -25.801 1.00 41.02 H new ATOM 0 HD12 LEU A 50 5.092 10.918 -24.141 1.00 41.02 H new ATOM 0 HD13 LEU A 50 6.538 10.763 -25.167 1.00 41.02 H new ATOM 0 HD21 LEU A 50 5.755 8.032 -26.361 1.00 5.22 H new ATOM 0 HD22 LEU A 50 7.383 8.411 -25.749 1.00 5.22 H new ATOM 0 HD23 LEU A 50 6.497 7.006 -25.110 1.00 5.22 H new ATOM 826 N LEU A 51 7.156 6.975 -20.059 1.00 71.31 N ATOM 827 CA LEU A 51 7.766 7.082 -18.739 1.00 10.04 C ATOM 828 C LEU A 51 8.419 5.765 -18.331 1.00 54.22 C ATOM 829 O LEU A 51 9.454 5.754 -17.668 1.00 60.43 O ATOM 830 CB LEU A 51 6.717 7.486 -17.701 1.00 72.01 C ATOM 831 CG LEU A 51 6.278 8.951 -17.726 1.00 74.34 C ATOM 832 CD1 LEU A 51 5.053 9.155 -16.848 1.00 12.41 C ATOM 833 CD2 LEU A 51 7.415 9.857 -17.279 1.00 30.31 C ATOM 0 H LEU A 51 6.503 6.198 -20.160 1.00 71.31 H new ATOM 0 HA LEU A 51 8.538 7.850 -18.785 1.00 10.04 H new ATOM 0 HB2 LEU A 51 5.835 6.861 -17.842 1.00 72.01 H new ATOM 0 HB3 LEU A 51 7.111 7.262 -16.710 1.00 72.01 H new ATOM 0 HG LEU A 51 6.014 9.214 -18.750 1.00 74.34 H new ATOM 0 HD11 LEU A 51 4.755 10.203 -16.878 1.00 12.41 H new ATOM 0 HD12 LEU A 51 4.235 8.534 -17.214 1.00 12.41 H new ATOM 0 HD13 LEU A 51 5.290 8.874 -15.822 1.00 12.41 H new ATOM 0 HD21 LEU A 51 7.084 10.895 -17.303 1.00 30.31 H new ATOM 0 HD22 LEU A 51 7.712 9.594 -16.264 1.00 30.31 H new ATOM 0 HD23 LEU A 51 8.265 9.732 -17.949 1.00 30.31 H new ATOM 845 N GLU A 52 7.805 4.657 -18.737 1.00 22.31 N ATOM 846 CA GLU A 52 8.329 3.334 -18.415 1.00 60.11 C ATOM 847 C GLU A 52 9.566 3.020 -19.250 1.00 45.55 C ATOM 848 O GLU A 52 10.598 2.608 -18.721 1.00 42.20 O ATOM 849 CB GLU A 52 7.258 2.267 -18.650 1.00 62.41 C ATOM 850 CG GLU A 52 5.868 2.691 -18.203 1.00 64.45 C ATOM 851 CD GLU A 52 4.899 1.527 -18.132 1.00 31.41 C ATOM 852 OE1 GLU A 52 5.358 0.367 -18.197 1.00 4.42 O ATOM 853 OE2 GLU A 52 3.681 1.774 -18.010 1.00 13.45 O ATOM 0 H GLU A 52 6.947 4.649 -19.288 1.00 22.31 H new ATOM 0 HA GLU A 52 8.612 3.330 -17.362 1.00 60.11 H new ATOM 0 HB2 GLU A 52 7.230 2.020 -19.711 1.00 62.41 H new ATOM 0 HB3 GLU A 52 7.540 1.358 -18.119 1.00 62.41 H new ATOM 0 HG2 GLU A 52 5.934 3.165 -17.223 1.00 64.45 H new ATOM 0 HG3 GLU A 52 5.481 3.440 -18.894 1.00 64.45 H new ATOM 860 N SER A 53 9.454 3.219 -20.560 1.00 25.01 N ATOM 861 CA SER A 53 10.563 2.953 -21.471 1.00 72.43 C ATOM 862 C SER A 53 11.374 4.221 -21.724 1.00 33.12 C ATOM 863 O SER A 53 10.843 5.330 -21.679 1.00 1.55 O ATOM 864 CB SER A 53 10.039 2.395 -22.796 1.00 4.42 C ATOM 865 OG SER A 53 10.121 3.366 -23.826 1.00 22.24 O ATOM 0 H SER A 53 8.608 3.563 -21.014 1.00 25.01 H new ATOM 0 HA SER A 53 11.214 2.213 -21.006 1.00 72.43 H new ATOM 0 HB2 SER A 53 10.615 1.513 -23.076 1.00 4.42 H new ATOM 0 HB3 SER A 53 9.004 2.074 -22.675 1.00 4.42 H new ATOM 0 HG SER A 53 9.317 3.926 -23.812 1.00 22.24 H new ATOM 871 N LYS A 54 12.664 4.047 -21.991 1.00 35.23 N ATOM 872 CA LYS A 54 13.550 5.174 -22.253 1.00 35.35 C ATOM 873 C LYS A 54 13.278 5.771 -23.629 1.00 51.43 C ATOM 874 O LYS A 54 13.290 6.989 -23.800 1.00 45.35 O ATOM 875 CB LYS A 54 15.012 4.733 -22.155 1.00 1.22 C ATOM 876 CG LYS A 54 15.393 3.664 -23.164 1.00 41.25 C ATOM 877 CD LYS A 54 16.742 3.044 -22.838 1.00 15.12 C ATOM 878 CE LYS A 54 16.591 1.818 -21.951 1.00 32.31 C ATOM 879 NZ LYS A 54 16.215 0.609 -22.734 1.00 20.11 N ATOM 0 H LYS A 54 13.119 3.135 -22.032 1.00 35.23 H new ATOM 0 HA LYS A 54 13.357 5.939 -21.501 1.00 35.35 H new ATOM 0 HB2 LYS A 54 15.655 5.601 -22.298 1.00 1.22 H new ATOM 0 HB3 LYS A 54 15.203 4.357 -21.150 1.00 1.22 H new ATOM 0 HG2 LYS A 54 14.629 2.887 -23.178 1.00 41.25 H new ATOM 0 HG3 LYS A 54 15.424 4.100 -24.163 1.00 41.25 H new ATOM 0 HD2 LYS A 54 17.249 2.766 -23.762 1.00 15.12 H new ATOM 0 HD3 LYS A 54 17.371 3.781 -22.339 1.00 15.12 H new ATOM 0 HE2 LYS A 54 17.528 1.633 -21.425 1.00 32.31 H new ATOM 0 HE3 LYS A 54 15.832 2.010 -21.193 1.00 32.31 H new ATOM 0 HZ1 LYS A 54 16.122 -0.205 -22.093 1.00 20.11 H new ATOM 0 HZ2 LYS A 54 15.309 0.776 -23.216 1.00 20.11 H new ATOM 0 HZ3 LYS A 54 16.951 0.410 -23.441 1.00 20.11 H new ATOM 893 N GLU A 55 13.032 4.904 -24.607 1.00 42.52 N ATOM 894 CA GLU A 55 12.757 5.348 -25.968 1.00 72.04 C ATOM 895 C GLU A 55 11.565 6.300 -26.001 1.00 15.23 C ATOM 896 O GLU A 55 11.557 7.278 -26.748 1.00 14.14 O ATOM 897 CB GLU A 55 12.488 4.145 -26.876 1.00 15.31 C ATOM 898 CG GLU A 55 13.717 3.291 -27.136 1.00 11.31 C ATOM 899 CD GLU A 55 13.429 1.807 -27.029 1.00 41.34 C ATOM 900 OE1 GLU A 55 13.136 1.338 -25.910 1.00 23.21 O ATOM 901 OE2 GLU A 55 13.497 1.114 -28.066 1.00 61.22 O ATOM 0 H GLU A 55 13.018 3.892 -24.482 1.00 42.52 H new ATOM 0 HA GLU A 55 13.635 5.881 -26.333 1.00 72.04 H new ATOM 0 HB2 GLU A 55 11.714 3.525 -26.423 1.00 15.31 H new ATOM 0 HB3 GLU A 55 12.095 4.500 -27.829 1.00 15.31 H new ATOM 0 HG2 GLU A 55 14.104 3.511 -28.131 1.00 11.31 H new ATOM 0 HG3 GLU A 55 14.498 3.558 -26.424 1.00 11.31 H new ATOM 908 N GLY A 56 10.558 6.006 -25.183 1.00 75.24 N ATOM 909 CA GLY A 56 9.373 6.843 -25.134 1.00 4.12 C ATOM 910 C GLY A 56 9.673 8.240 -24.627 1.00 12.34 C ATOM 911 O GLY A 56 9.255 9.230 -25.230 1.00 24.41 O ATOM 0 H GLY A 56 10.542 5.203 -24.554 1.00 75.24 H new ATOM 0 HA2 GLY A 56 8.935 6.907 -26.130 1.00 4.12 H new ATOM 0 HA3 GLY A 56 8.629 6.377 -24.488 1.00 4.12 H new ATOM 915 N CYS A 57 10.396 8.323 -23.515 1.00 65.40 N ATOM 916 CA CYS A 57 10.750 9.609 -22.926 1.00 75.01 C ATOM 917 C CYS A 57 11.467 10.493 -23.940 1.00 24.03 C ATOM 918 O CYS A 57 11.360 11.718 -23.895 1.00 62.02 O ATOM 919 CB CYS A 57 11.631 9.405 -21.694 1.00 23.34 C ATOM 920 SG CYS A 57 10.939 10.086 -20.168 1.00 61.13 S ATOM 0 H CYS A 57 10.748 7.514 -23.003 1.00 65.40 H new ATOM 0 HA CYS A 57 9.829 10.108 -22.625 1.00 75.01 H new ATOM 0 HB2 CYS A 57 11.803 8.337 -21.557 1.00 23.34 H new ATOM 0 HB3 CYS A 57 12.603 9.864 -21.876 1.00 23.34 H new ATOM 0 HG CYS A 57 9.690 9.739 -20.065 1.00 61.13 H new ATOM 926 N GLN A 58 12.201 9.863 -24.852 1.00 3.31 N ATOM 927 CA GLN A 58 12.940 10.592 -25.875 1.00 13.45 C ATOM 928 C GLN A 58 11.990 11.350 -26.796 1.00 71.32 C ATOM 929 O GLN A 58 12.402 12.250 -27.528 1.00 13.21 O ATOM 930 CB GLN A 58 13.805 9.632 -26.693 1.00 10.20 C ATOM 931 CG GLN A 58 15.038 10.286 -27.295 1.00 60.42 C ATOM 932 CD GLN A 58 16.162 9.298 -27.538 1.00 3.22 C ATOM 933 OE1 GLN A 58 16.028 8.371 -28.336 1.00 54.54 O ATOM 934 NE2 GLN A 58 17.281 9.493 -26.848 1.00 63.33 N ATOM 0 H GLN A 58 12.299 8.849 -24.903 1.00 3.31 H new ATOM 0 HA GLN A 58 13.586 11.314 -25.375 1.00 13.45 H new ATOM 0 HB2 GLN A 58 14.117 8.805 -26.056 1.00 10.20 H new ATOM 0 HB3 GLN A 58 13.202 9.206 -27.495 1.00 10.20 H new ATOM 0 HG2 GLN A 58 14.768 10.763 -28.237 1.00 60.42 H new ATOM 0 HG3 GLN A 58 15.389 11.074 -26.628 1.00 60.42 H new ATOM 0 HE21 GLN A 58 17.349 10.275 -26.197 1.00 63.33 H new ATOM 0 HE22 GLN A 58 18.072 8.861 -26.970 1.00 63.33 H new ATOM 943 N LYS A 59 10.715 10.979 -26.757 1.00 32.32 N ATOM 944 CA LYS A 59 9.703 11.623 -27.587 1.00 23.23 C ATOM 945 C LYS A 59 9.177 12.889 -26.920 1.00 31.42 C ATOM 946 O LYS A 59 8.727 13.816 -27.594 1.00 3.23 O ATOM 947 CB LYS A 59 8.546 10.658 -27.858 1.00 64.20 C ATOM 948 CG LYS A 59 8.259 10.455 -29.335 1.00 71.33 C ATOM 949 CD LYS A 59 7.196 9.390 -29.555 1.00 63.02 C ATOM 950 CE LYS A 59 6.539 9.532 -30.919 1.00 25.41 C ATOM 951 NZ LYS A 59 6.621 8.271 -31.708 1.00 5.23 N ATOM 0 H LYS A 59 10.357 10.235 -26.159 1.00 32.32 H new ATOM 0 HA LYS A 59 10.168 11.899 -28.534 1.00 23.23 H new ATOM 0 HB2 LYS A 59 8.774 9.693 -27.405 1.00 64.20 H new ATOM 0 HB3 LYS A 59 7.647 11.035 -27.370 1.00 64.20 H new ATOM 0 HG2 LYS A 59 7.929 11.396 -29.775 1.00 71.33 H new ATOM 0 HG3 LYS A 59 9.176 10.167 -29.849 1.00 71.33 H new ATOM 0 HD2 LYS A 59 7.647 8.401 -29.468 1.00 63.02 H new ATOM 0 HD3 LYS A 59 6.438 9.464 -28.775 1.00 63.02 H new ATOM 0 HE2 LYS A 59 5.494 9.813 -30.791 1.00 25.41 H new ATOM 0 HE3 LYS A 59 7.021 10.338 -31.472 1.00 25.41 H new ATOM 0 HZ1 LYS A 59 6.162 8.409 -32.631 1.00 5.23 H new ATOM 0 HZ2 LYS A 59 7.619 8.016 -31.852 1.00 5.23 H new ATOM 0 HZ3 LYS A 59 6.139 7.507 -31.192 1.00 5.23 H new ATOM 965 N ILE A 60 9.237 12.922 -25.592 1.00 40.12 N ATOM 966 CA ILE A 60 8.769 14.076 -24.836 1.00 2.43 C ATOM 967 C ILE A 60 9.797 15.202 -24.857 1.00 21.05 C ATOM 968 O ILE A 60 9.450 16.377 -24.737 1.00 33.11 O ATOM 969 CB ILE A 60 8.464 13.703 -23.373 1.00 35.12 C ATOM 970 CG1 ILE A 60 7.652 12.407 -23.313 1.00 74.11 C ATOM 971 CG2 ILE A 60 7.717 14.834 -22.683 1.00 13.42 C ATOM 972 CD1 ILE A 60 7.341 11.954 -21.904 1.00 34.42 C ATOM 0 H ILE A 60 9.605 12.163 -25.019 1.00 40.12 H new ATOM 0 HA ILE A 60 7.851 14.416 -25.316 1.00 2.43 H new ATOM 0 HB ILE A 60 9.407 13.544 -22.850 1.00 35.12 H new ATOM 0 HG12 ILE A 60 6.717 12.548 -23.855 1.00 74.11 H new ATOM 0 HG13 ILE A 60 8.203 11.619 -23.826 1.00 74.11 H new ATOM 0 HG21 ILE A 60 7.509 14.555 -21.650 1.00 13.42 H new ATOM 0 HG22 ILE A 60 8.328 15.737 -22.699 1.00 13.42 H new ATOM 0 HG23 ILE A 60 6.778 15.022 -23.205 1.00 13.42 H new ATOM 0 HD11 ILE A 60 6.764 11.030 -21.938 1.00 34.42 H new ATOM 0 HD12 ILE A 60 8.272 11.781 -21.364 1.00 34.42 H new ATOM 0 HD13 ILE A 60 6.763 12.724 -21.393 1.00 34.42 H new ATOM 984 N LEU A 61 11.064 14.835 -25.012 1.00 3.22 N ATOM 985 CA LEU A 61 12.145 15.814 -25.052 1.00 5.01 C ATOM 986 C LEU A 61 12.261 16.441 -26.437 1.00 63.40 C ATOM 987 O LEU A 61 12.536 17.634 -26.571 1.00 20.33 O ATOM 988 CB LEU A 61 13.471 15.156 -24.664 1.00 62.12 C ATOM 989 CG LEU A 61 13.567 14.634 -23.230 1.00 41.41 C ATOM 990 CD1 LEU A 61 14.796 13.755 -23.064 1.00 25.43 C ATOM 991 CD2 LEU A 61 13.600 15.792 -22.243 1.00 23.53 C ATOM 0 H LEU A 61 11.368 13.867 -25.112 1.00 3.22 H new ATOM 0 HA LEU A 61 11.915 16.602 -24.335 1.00 5.01 H new ATOM 0 HB2 LEU A 61 13.654 14.325 -25.345 1.00 62.12 H new ATOM 0 HB3 LEU A 61 14.272 15.879 -24.821 1.00 62.12 H new ATOM 0 HG LEU A 61 12.683 14.031 -23.023 1.00 41.41 H new ATOM 0 HD11 LEU A 61 14.848 13.393 -22.037 1.00 25.43 H new ATOM 0 HD12 LEU A 61 14.731 12.907 -23.745 1.00 25.43 H new ATOM 0 HD13 LEU A 61 15.691 14.335 -23.290 1.00 25.43 H new ATOM 0 HD21 LEU A 61 13.668 15.402 -21.227 1.00 23.53 H new ATOM 0 HD22 LEU A 61 14.466 16.421 -22.449 1.00 23.53 H new ATOM 0 HD23 LEU A 61 12.690 16.383 -22.345 1.00 23.53 H new ATOM 1003 N THR A 62 12.049 15.629 -27.469 1.00 11.54 N ATOM 1004 CA THR A 62 12.128 16.103 -28.844 1.00 51.43 C ATOM 1005 C THR A 62 11.003 17.085 -29.153 1.00 32.52 C ATOM 1006 O THR A 62 11.172 18.009 -29.949 1.00 24.13 O ATOM 1007 CB THR A 62 12.065 14.936 -29.846 1.00 23.33 C ATOM 1008 OG1 THR A 62 12.728 15.297 -31.063 1.00 4.21 O ATOM 1009 CG2 THR A 62 10.622 14.554 -30.143 1.00 51.31 C ATOM 0 H THR A 62 11.821 14.639 -27.377 1.00 11.54 H new ATOM 0 HA THR A 62 13.088 16.609 -28.948 1.00 51.43 H new ATOM 0 HB THR A 62 12.567 14.077 -29.400 1.00 23.33 H new ATOM 0 HG1 THR A 62 12.684 14.548 -31.694 1.00 4.21 H new ATOM 0 HG21 THR A 62 10.603 13.727 -30.853 1.00 51.31 H new ATOM 0 HG22 THR A 62 10.129 14.250 -29.220 1.00 51.31 H new ATOM 0 HG23 THR A 62 10.099 15.410 -30.569 1.00 51.31 H new ATOM 1017 N VAL A 63 9.854 16.879 -28.519 1.00 14.11 N ATOM 1018 CA VAL A 63 8.701 17.747 -28.725 1.00 73.11 C ATOM 1019 C VAL A 63 8.872 19.072 -27.991 1.00 64.24 C ATOM 1020 O VAL A 63 8.709 20.144 -28.576 1.00 13.23 O ATOM 1021 CB VAL A 63 7.399 17.074 -28.249 1.00 12.34 C ATOM 1022 CG1 VAL A 63 6.224 18.030 -28.380 1.00 41.45 C ATOM 1023 CG2 VAL A 63 7.146 15.793 -29.030 1.00 55.31 C ATOM 0 H VAL A 63 9.696 16.118 -27.858 1.00 14.11 H new ATOM 0 HA VAL A 63 8.634 17.934 -29.797 1.00 73.11 H new ATOM 0 HB VAL A 63 7.508 16.815 -27.196 1.00 12.34 H new ATOM 0 HG11 VAL A 63 5.314 17.537 -28.039 1.00 41.45 H new ATOM 0 HG12 VAL A 63 6.406 18.916 -27.772 1.00 41.45 H new ATOM 0 HG13 VAL A 63 6.108 18.324 -29.423 1.00 41.45 H new ATOM 0 HG21 VAL A 63 6.223 15.331 -28.681 1.00 55.31 H new ATOM 0 HG22 VAL A 63 7.057 16.025 -30.091 1.00 55.31 H new ATOM 0 HG23 VAL A 63 7.977 15.104 -28.878 1.00 55.31 H new ATOM 1033 N LEU A 64 9.202 18.993 -26.707 1.00 25.32 N ATOM 1034 CA LEU A 64 9.397 20.186 -25.891 1.00 63.12 C ATOM 1035 C LEU A 64 10.724 20.862 -26.223 1.00 53.22 C ATOM 1036 O LEU A 64 10.969 22.001 -25.825 1.00 54.13 O ATOM 1037 CB LEU A 64 9.353 19.826 -24.405 1.00 50.24 C ATOM 1038 CG LEU A 64 8.183 18.947 -23.962 1.00 65.31 C ATOM 1039 CD1 LEU A 64 8.497 18.269 -22.637 1.00 64.34 C ATOM 1040 CD2 LEU A 64 6.909 19.770 -23.853 1.00 75.15 C ATOM 0 H LEU A 64 9.340 18.114 -26.208 1.00 25.32 H new ATOM 0 HA LEU A 64 8.589 20.883 -26.113 1.00 63.12 H new ATOM 0 HB2 LEU A 64 10.282 19.317 -24.147 1.00 50.24 H new ATOM 0 HB3 LEU A 64 9.326 20.751 -23.828 1.00 50.24 H new ATOM 0 HG LEU A 64 8.029 18.174 -24.715 1.00 65.31 H new ATOM 0 HD11 LEU A 64 7.653 17.648 -22.337 1.00 64.34 H new ATOM 0 HD12 LEU A 64 9.385 17.646 -22.748 1.00 64.34 H new ATOM 0 HD13 LEU A 64 8.678 19.027 -21.875 1.00 64.34 H new ATOM 0 HD21 LEU A 64 6.087 19.128 -23.537 1.00 75.15 H new ATOM 0 HD22 LEU A 64 7.051 20.565 -23.121 1.00 75.15 H new ATOM 0 HD23 LEU A 64 6.675 20.208 -24.823 1.00 75.15 H new ATOM 1052 N ASP A 65 11.575 20.153 -26.956 1.00 1.41 N ATOM 1053 CA ASP A 65 12.876 20.685 -27.345 1.00 64.34 C ATOM 1054 C ASP A 65 12.725 22.028 -28.052 1.00 34.32 C ATOM 1055 O ASP A 65 13.172 23.067 -27.566 1.00 55.32 O ATOM 1056 CB ASP A 65 13.605 19.694 -28.255 1.00 53.54 C ATOM 1057 CG ASP A 65 14.793 19.047 -27.572 1.00 10.31 C ATOM 1058 OD1 ASP A 65 15.611 19.782 -26.980 1.00 3.51 O ATOM 1059 OD2 ASP A 65 14.905 17.804 -27.629 1.00 15.00 O ATOM 0 H ASP A 65 11.388 19.209 -27.293 1.00 1.41 H new ATOM 0 HA ASP A 65 13.464 20.836 -26.440 1.00 64.34 H new ATOM 0 HB2 ASP A 65 12.908 18.920 -28.576 1.00 53.54 H new ATOM 0 HB3 ASP A 65 13.943 20.211 -29.153 1.00 53.54 H new ATOM 1064 N PRO A 66 12.081 22.009 -29.228 1.00 74.34 N ATOM 1065 CA PRO A 66 11.856 23.217 -30.027 1.00 74.42 C ATOM 1066 C PRO A 66 10.848 24.162 -29.380 1.00 62.11 C ATOM 1067 O PRO A 66 10.641 25.280 -29.850 1.00 62.14 O ATOM 1068 CB PRO A 66 11.305 22.671 -31.348 1.00 13.23 C ATOM 1069 CG PRO A 66 10.688 21.364 -30.988 1.00 71.14 C ATOM 1070 CD PRO A 66 11.520 20.806 -29.868 1.00 64.10 C ATOM 0 HA PRO A 66 12.766 23.806 -30.139 1.00 74.42 H new ATOM 0 HB2 PRO A 66 10.571 23.350 -31.782 1.00 13.23 H new ATOM 0 HB3 PRO A 66 12.097 22.545 -32.086 1.00 13.23 H new ATOM 0 HG2 PRO A 66 9.652 21.495 -30.676 1.00 71.14 H new ATOM 0 HG3 PRO A 66 10.681 20.688 -31.843 1.00 71.14 H new ATOM 0 HD2 PRO A 66 10.917 20.224 -29.171 1.00 64.10 H new ATOM 0 HD3 PRO A 66 12.304 20.146 -30.240 1.00 64.10 H new ATOM 1078 N MET A 67 10.226 23.704 -28.299 1.00 1.05 N ATOM 1079 CA MET A 67 9.242 24.511 -27.586 1.00 22.54 C ATOM 1080 C MET A 67 9.879 25.218 -26.394 1.00 24.33 C ATOM 1081 O MET A 67 9.361 26.222 -25.906 1.00 2.23 O ATOM 1082 CB MET A 67 8.079 23.635 -27.113 1.00 43.42 C ATOM 1083 CG MET A 67 6.869 23.686 -28.031 1.00 32.30 C ATOM 1084 SD MET A 67 5.943 25.225 -27.875 1.00 41.50 S ATOM 1085 CE MET A 67 5.547 25.557 -29.590 1.00 74.00 C ATOM 0 H MET A 67 10.385 22.780 -27.898 1.00 1.05 H new ATOM 0 HA MET A 67 8.862 25.267 -28.273 1.00 22.54 H new ATOM 0 HB2 MET A 67 8.421 22.603 -27.033 1.00 43.42 H new ATOM 0 HB3 MET A 67 7.780 23.950 -26.113 1.00 43.42 H new ATOM 0 HG2 MET A 67 7.196 23.567 -29.064 1.00 32.30 H new ATOM 0 HG3 MET A 67 6.211 22.846 -27.806 1.00 32.30 H new ATOM 0 HE1 MET A 67 4.973 26.481 -29.659 1.00 74.00 H new ATOM 0 HE2 MET A 67 6.469 25.659 -30.163 1.00 74.00 H new ATOM 0 HE3 MET A 67 4.958 24.733 -29.994 1.00 74.00 H new ATOM 1095 N VAL A 68 11.005 24.685 -25.928 1.00 2.30 N ATOM 1096 CA VAL A 68 11.712 25.266 -24.794 1.00 4.35 C ATOM 1097 C VAL A 68 11.733 26.788 -24.878 1.00 11.44 C ATOM 1098 O VAL A 68 11.284 27.491 -23.972 1.00 50.02 O ATOM 1099 CB VAL A 68 13.161 24.748 -24.711 1.00 4.41 C ATOM 1100 CG1 VAL A 68 14.070 25.800 -24.092 1.00 11.04 C ATOM 1101 CG2 VAL A 68 13.218 23.450 -23.920 1.00 45.22 C ATOM 0 H VAL A 68 11.446 23.852 -26.319 1.00 2.30 H new ATOM 0 HA VAL A 68 11.172 24.963 -23.897 1.00 4.35 H new ATOM 0 HB VAL A 68 13.515 24.546 -25.722 1.00 4.41 H new ATOM 0 HG11 VAL A 68 15.089 25.416 -24.042 1.00 11.04 H new ATOM 0 HG12 VAL A 68 14.052 26.702 -24.704 1.00 11.04 H new ATOM 0 HG13 VAL A 68 13.721 26.036 -23.087 1.00 11.04 H new ATOM 0 HG21 VAL A 68 14.249 23.098 -23.871 1.00 45.22 H new ATOM 0 HG22 VAL A 68 12.845 23.623 -22.910 1.00 45.22 H new ATOM 0 HG23 VAL A 68 12.601 22.697 -24.411 1.00 45.22 H new ATOM 1111 N PRO A 69 12.265 27.311 -25.992 1.00 50.42 N ATOM 1112 CA PRO A 69 12.356 28.756 -26.224 1.00 11.34 C ATOM 1113 C PRO A 69 10.990 29.392 -26.460 1.00 24.03 C ATOM 1114 O PRO A 69 10.758 30.545 -26.094 1.00 14.12 O ATOM 1115 CB PRO A 69 13.219 28.861 -27.482 1.00 64.22 C ATOM 1116 CG PRO A 69 13.018 27.565 -28.189 1.00 53.43 C ATOM 1117 CD PRO A 69 12.820 26.534 -27.113 1.00 31.05 C ATOM 0 HA PRO A 69 12.769 29.281 -25.363 1.00 11.34 H new ATOM 0 HB2 PRO A 69 12.912 29.702 -28.103 1.00 64.22 H new ATOM 0 HB3 PRO A 69 14.268 29.016 -27.230 1.00 64.22 H new ATOM 0 HG2 PRO A 69 12.152 27.611 -28.850 1.00 53.43 H new ATOM 0 HG3 PRO A 69 13.880 27.321 -28.810 1.00 53.43 H new ATOM 0 HD2 PRO A 69 12.138 25.746 -27.432 1.00 31.05 H new ATOM 0 HD3 PRO A 69 13.759 26.052 -26.841 1.00 31.05 H new ATOM 1125 N THR A 70 10.088 28.633 -27.073 1.00 53.44 N ATOM 1126 CA THR A 70 8.745 29.124 -27.359 1.00 71.15 C ATOM 1127 C THR A 70 7.714 28.465 -26.449 1.00 44.33 C ATOM 1128 O THR A 70 6.633 28.082 -26.895 1.00 22.40 O ATOM 1129 CB THR A 70 8.354 28.868 -28.828 1.00 53.41 C ATOM 1130 OG1 THR A 70 9.518 28.925 -29.661 1.00 33.01 O ATOM 1131 CG2 THR A 70 7.334 29.891 -29.302 1.00 51.22 C ATOM 0 H THR A 70 10.262 27.676 -27.381 1.00 53.44 H new ATOM 0 HA THR A 70 8.755 30.198 -27.175 1.00 71.15 H new ATOM 0 HB THR A 70 7.908 27.876 -28.895 1.00 53.41 H new ATOM 0 HG1 THR A 70 9.262 28.760 -30.592 1.00 33.01 H new ATOM 0 HG21 THR A 70 7.073 29.690 -30.341 1.00 51.22 H new ATOM 0 HG22 THR A 70 6.439 29.825 -28.684 1.00 51.22 H new ATOM 0 HG23 THR A 70 7.758 30.892 -29.221 1.00 51.22 H new ATOM 1139 N GLY A 71 8.055 28.338 -25.171 1.00 64.24 N ATOM 1140 CA GLY A 71 7.148 27.726 -24.219 1.00 22.24 C ATOM 1141 C GLY A 71 7.178 28.411 -22.866 1.00 4.11 C ATOM 1142 O GLY A 71 8.192 28.992 -22.480 1.00 61.10 O ATOM 0 H GLY A 71 8.944 28.648 -24.778 1.00 64.24 H new ATOM 0 HA2 GLY A 71 6.134 27.758 -24.616 1.00 22.24 H new ATOM 0 HA3 GLY A 71 7.410 26.675 -24.097 1.00 22.24 H new ATOM 1146 N SER A 72 6.063 28.343 -22.146 1.00 4.44 N ATOM 1147 CA SER A 72 5.964 28.968 -20.831 1.00 21.50 C ATOM 1148 C SER A 72 6.907 28.294 -19.838 1.00 10.12 C ATOM 1149 O SER A 72 7.577 27.316 -20.168 1.00 55.40 O ATOM 1150 CB SER A 72 4.526 28.894 -20.316 1.00 74.10 C ATOM 1151 OG SER A 72 4.323 27.732 -19.531 1.00 4.42 O ATOM 0 H SER A 72 5.216 27.862 -22.450 1.00 4.44 H new ATOM 0 HA SER A 72 6.254 30.014 -20.929 1.00 21.50 H new ATOM 0 HB2 SER A 72 4.303 29.781 -19.723 1.00 74.10 H new ATOM 0 HB3 SER A 72 3.835 28.892 -21.159 1.00 74.10 H new ATOM 0 HG SER A 72 3.396 27.710 -19.213 1.00 4.42 H new ATOM 1157 N GLU A 73 6.952 28.827 -18.621 1.00 21.34 N ATOM 1158 CA GLU A 73 7.813 28.279 -17.580 1.00 42.11 C ATOM 1159 C GLU A 73 7.449 26.827 -17.281 1.00 60.45 C ATOM 1160 O GLU A 73 8.322 25.995 -17.041 1.00 23.40 O ATOM 1161 CB GLU A 73 7.704 29.115 -16.303 1.00 41.41 C ATOM 1162 CG GLU A 73 8.163 30.554 -16.478 1.00 22.32 C ATOM 1163 CD GLU A 73 7.241 31.548 -15.800 1.00 34.42 C ATOM 1164 OE1 GLU A 73 6.278 32.003 -16.452 1.00 53.00 O ATOM 1165 OE2 GLU A 73 7.480 31.869 -14.617 1.00 0.51 O ATOM 0 H GLU A 73 6.403 29.637 -18.332 1.00 21.34 H new ATOM 0 HA GLU A 73 8.841 28.312 -17.941 1.00 42.11 H new ATOM 0 HB2 GLU A 73 6.668 29.111 -15.963 1.00 41.41 H new ATOM 0 HB3 GLU A 73 8.298 28.645 -15.519 1.00 41.41 H new ATOM 0 HG2 GLU A 73 9.169 30.662 -16.072 1.00 22.32 H new ATOM 0 HG3 GLU A 73 8.222 30.786 -17.541 1.00 22.32 H new ATOM 1172 N ASN A 74 6.153 26.533 -17.299 1.00 33.43 N ATOM 1173 CA ASN A 74 5.673 25.182 -17.029 1.00 54.52 C ATOM 1174 C ASN A 74 6.213 24.196 -18.060 1.00 72.20 C ATOM 1175 O ASN A 74 6.216 22.985 -17.836 1.00 74.32 O ATOM 1176 CB ASN A 74 4.142 25.153 -17.032 1.00 3.23 C ATOM 1177 CG ASN A 74 3.565 25.010 -15.637 1.00 12.24 C ATOM 1178 OD1 ASN A 74 2.767 24.111 -15.373 1.00 33.11 O ATOM 1179 ND2 ASN A 74 3.967 25.899 -14.736 1.00 23.31 N ATOM 0 H ASN A 74 5.417 27.211 -17.497 1.00 33.43 H new ATOM 0 HA ASN A 74 6.034 24.885 -16.045 1.00 54.52 H new ATOM 0 HB2 ASN A 74 3.765 26.069 -17.486 1.00 3.23 H new ATOM 0 HB3 ASN A 74 3.798 24.325 -17.651 1.00 3.23 H new ATOM 0 HD21 ASN A 74 3.612 25.853 -13.781 1.00 23.31 H new ATOM 0 HD22 ASN A 74 4.630 26.628 -14.999 1.00 23.31 H new ATOM 1186 N LEU A 75 6.670 24.723 -19.190 1.00 72.14 N ATOM 1187 CA LEU A 75 7.215 23.890 -20.258 1.00 14.14 C ATOM 1188 C LEU A 75 8.696 23.610 -20.028 1.00 12.53 C ATOM 1189 O LEU A 75 9.209 22.560 -20.417 1.00 51.12 O ATOM 1190 CB LEU A 75 7.016 24.569 -21.614 1.00 44.41 C ATOM 1191 CG LEU A 75 7.371 23.732 -22.843 1.00 22.04 C ATOM 1192 CD1 LEU A 75 6.290 23.859 -23.905 1.00 25.44 C ATOM 1193 CD2 LEU A 75 8.722 24.152 -23.402 1.00 42.14 C ATOM 0 H LEU A 75 6.674 25.723 -19.391 1.00 72.14 H new ATOM 0 HA LEU A 75 6.680 22.940 -20.253 1.00 14.14 H new ATOM 0 HB2 LEU A 75 5.972 24.873 -21.696 1.00 44.41 H new ATOM 0 HB3 LEU A 75 7.616 25.479 -21.634 1.00 44.41 H new ATOM 0 HG LEU A 75 7.434 22.687 -22.541 1.00 22.04 H new ATOM 0 HD11 LEU A 75 6.560 23.257 -24.772 1.00 25.44 H new ATOM 0 HD12 LEU A 75 5.340 23.509 -23.501 1.00 25.44 H new ATOM 0 HD13 LEU A 75 6.194 24.903 -24.204 1.00 25.44 H new ATOM 0 HD21 LEU A 75 8.958 23.546 -24.276 1.00 42.14 H new ATOM 0 HD22 LEU A 75 8.686 25.203 -23.688 1.00 42.14 H new ATOM 0 HD23 LEU A 75 9.491 24.009 -22.642 1.00 42.14 H new ATOM 1205 N LYS A 76 9.380 24.555 -19.392 1.00 53.14 N ATOM 1206 CA LYS A 76 10.802 24.410 -19.106 1.00 51.20 C ATOM 1207 C LYS A 76 11.024 23.541 -17.873 1.00 31.14 C ATOM 1208 O LYS A 76 11.965 22.749 -17.820 1.00 63.13 O ATOM 1209 CB LYS A 76 11.444 25.784 -18.897 1.00 2.11 C ATOM 1210 CG LYS A 76 11.666 26.555 -20.187 1.00 32.33 C ATOM 1211 CD LYS A 76 12.562 27.762 -19.968 1.00 21.32 C ATOM 1212 CE LYS A 76 12.502 28.722 -21.146 1.00 71.11 C ATOM 1213 NZ LYS A 76 13.846 28.947 -21.746 1.00 51.11 N ATOM 0 H LYS A 76 8.972 25.430 -19.065 1.00 53.14 H new ATOM 0 HA LYS A 76 11.271 23.923 -19.961 1.00 51.20 H new ATOM 0 HB2 LYS A 76 10.811 26.375 -18.235 1.00 2.11 H new ATOM 0 HB3 LYS A 76 12.401 25.655 -18.391 1.00 2.11 H new ATOM 0 HG2 LYS A 76 12.115 25.898 -20.932 1.00 32.33 H new ATOM 0 HG3 LYS A 76 10.706 26.881 -20.587 1.00 32.33 H new ATOM 0 HD2 LYS A 76 12.259 28.281 -19.059 1.00 21.32 H new ATOM 0 HD3 LYS A 76 13.590 27.431 -19.819 1.00 21.32 H new ATOM 0 HE2 LYS A 76 11.827 28.325 -21.904 1.00 71.11 H new ATOM 0 HE3 LYS A 76 12.087 29.675 -20.818 1.00 71.11 H new ATOM 0 HZ1 LYS A 76 13.763 29.607 -22.546 1.00 51.11 H new ATOM 0 HZ2 LYS A 76 14.483 29.350 -21.029 1.00 51.11 H new ATOM 0 HZ3 LYS A 76 14.232 28.042 -22.083 1.00 51.11 H new ATOM 1227 N SER A 77 10.150 23.692 -16.883 1.00 12.22 N ATOM 1228 CA SER A 77 10.252 22.922 -15.649 1.00 32.53 C ATOM 1229 C SER A 77 10.164 21.426 -15.934 1.00 24.24 C ATOM 1230 O SER A 77 11.004 20.645 -15.481 1.00 53.33 O ATOM 1231 CB SER A 77 9.146 23.333 -14.674 1.00 65.22 C ATOM 1232 OG SER A 77 9.684 23.997 -13.544 1.00 13.51 O ATOM 0 H SER A 77 9.363 24.341 -16.911 1.00 12.22 H new ATOM 0 HA SER A 77 11.222 23.132 -15.197 1.00 32.53 H new ATOM 0 HB2 SER A 77 8.435 23.987 -15.180 1.00 65.22 H new ATOM 0 HB3 SER A 77 8.594 22.450 -14.352 1.00 65.22 H new ATOM 0 HG SER A 77 8.958 24.251 -12.937 1.00 13.51 H new ATOM 1238 N LEU A 78 9.142 21.032 -16.686 1.00 62.32 N ATOM 1239 CA LEU A 78 8.944 19.629 -17.033 1.00 33.34 C ATOM 1240 C LEU A 78 10.081 19.119 -17.911 1.00 62.33 C ATOM 1241 O LEU A 78 10.542 17.987 -17.754 1.00 50.12 O ATOM 1242 CB LEU A 78 7.607 19.445 -17.752 1.00 73.01 C ATOM 1243 CG LEU A 78 7.341 18.055 -18.331 1.00 43.35 C ATOM 1244 CD1 LEU A 78 7.243 17.023 -17.220 1.00 34.23 C ATOM 1245 CD2 LEU A 78 6.072 18.061 -19.171 1.00 32.20 C ATOM 0 H LEU A 78 8.438 21.664 -17.067 1.00 62.32 H new ATOM 0 HA LEU A 78 8.936 19.050 -16.110 1.00 33.34 H new ATOM 0 HB2 LEU A 78 6.806 19.685 -17.053 1.00 73.01 H new ATOM 0 HB3 LEU A 78 7.551 20.171 -18.563 1.00 73.01 H new ATOM 0 HG LEU A 78 8.178 17.785 -18.975 1.00 43.35 H new ATOM 0 HD11 LEU A 78 7.053 16.040 -17.652 1.00 34.23 H new ATOM 0 HD12 LEU A 78 8.179 17.000 -16.662 1.00 34.23 H new ATOM 0 HD13 LEU A 78 6.426 17.288 -16.548 1.00 34.23 H new ATOM 0 HD21 LEU A 78 5.898 17.064 -19.575 1.00 32.20 H new ATOM 0 HD22 LEU A 78 5.226 18.353 -18.549 1.00 32.20 H new ATOM 0 HD23 LEU A 78 6.182 18.771 -19.991 1.00 32.20 H new ATOM 1257 N PHE A 79 10.531 19.960 -18.836 1.00 72.21 N ATOM 1258 CA PHE A 79 11.616 19.595 -19.739 1.00 62.01 C ATOM 1259 C PHE A 79 12.847 19.148 -18.958 1.00 2.43 C ATOM 1260 O PHE A 79 13.533 18.203 -19.346 1.00 11.51 O ATOM 1261 CB PHE A 79 11.972 20.775 -20.645 1.00 44.32 C ATOM 1262 CG PHE A 79 12.860 20.400 -21.797 1.00 45.14 C ATOM 1263 CD1 PHE A 79 12.487 19.398 -22.678 1.00 51.41 C ATOM 1264 CD2 PHE A 79 14.068 21.048 -21.998 1.00 53.05 C ATOM 1265 CE1 PHE A 79 13.301 19.050 -23.740 1.00 51.43 C ATOM 1266 CE2 PHE A 79 14.886 20.705 -23.058 1.00 42.23 C ATOM 1267 CZ PHE A 79 14.502 19.705 -23.929 1.00 65.52 C ATOM 0 H PHE A 79 10.161 20.899 -18.980 1.00 72.21 H new ATOM 0 HA PHE A 79 11.278 18.762 -20.355 1.00 62.01 H new ATOM 0 HB2 PHE A 79 11.053 21.215 -21.033 1.00 44.32 H new ATOM 0 HB3 PHE A 79 12.467 21.543 -20.050 1.00 44.32 H new ATOM 0 HD1 PHE A 79 11.549 18.882 -22.533 1.00 51.41 H new ATOM 0 HD2 PHE A 79 14.374 21.830 -21.319 1.00 53.05 H new ATOM 0 HE1 PHE A 79 12.998 18.268 -24.420 1.00 51.43 H new ATOM 0 HE2 PHE A 79 15.825 21.219 -23.205 1.00 42.23 H new ATOM 0 HZ PHE A 79 15.140 19.435 -24.757 1.00 65.52 H new ATOM 1277 N ASN A 80 13.122 19.836 -17.853 1.00 52.34 N ATOM 1278 CA ASN A 80 14.272 19.512 -17.017 1.00 72.52 C ATOM 1279 C ASN A 80 14.059 18.187 -16.289 1.00 54.41 C ATOM 1280 O ASN A 80 15.009 17.449 -16.028 1.00 3.51 O ATOM 1281 CB ASN A 80 14.522 20.629 -16.003 1.00 50.31 C ATOM 1282 CG ASN A 80 15.399 21.733 -16.563 1.00 72.33 C ATOM 1283 OD1 ASN A 80 15.021 22.418 -17.513 1.00 50.33 O ATOM 1284 ND2 ASN A 80 16.577 21.909 -15.976 1.00 34.24 N ATOM 0 H ASN A 80 12.564 20.621 -17.517 1.00 52.34 H new ATOM 0 HA ASN A 80 15.144 19.415 -17.663 1.00 72.52 H new ATOM 0 HB2 ASN A 80 13.567 21.051 -15.689 1.00 50.31 H new ATOM 0 HB3 ASN A 80 14.993 20.210 -15.114 1.00 50.31 H new ATOM 0 HD21 ASN A 80 17.210 22.636 -16.310 1.00 34.24 H new ATOM 0 HD22 ASN A 80 16.849 21.317 -15.191 1.00 34.24 H new ATOM 1291 N THR A 81 12.804 17.892 -15.965 1.00 10.42 N ATOM 1292 CA THR A 81 12.465 16.659 -15.267 1.00 21.33 C ATOM 1293 C THR A 81 12.467 15.469 -16.221 1.00 22.21 C ATOM 1294 O THR A 81 12.875 14.367 -15.853 1.00 74.41 O ATOM 1295 CB THR A 81 11.085 16.756 -14.590 1.00 14.14 C ATOM 1296 OG1 THR A 81 11.025 17.927 -13.767 1.00 73.13 O ATOM 1297 CG2 THR A 81 10.808 15.522 -13.746 1.00 34.41 C ATOM 0 H THR A 81 12.005 18.491 -16.175 1.00 10.42 H new ATOM 0 HA THR A 81 13.227 16.510 -14.502 1.00 21.33 H new ATOM 0 HB THR A 81 10.326 16.821 -15.370 1.00 14.14 H new ATOM 0 HG1 THR A 81 11.007 18.725 -14.335 1.00 73.13 H new ATOM 0 HG21 THR A 81 9.828 15.614 -13.278 1.00 34.41 H new ATOM 0 HG22 THR A 81 10.826 14.636 -14.380 1.00 34.41 H new ATOM 0 HG23 THR A 81 11.572 15.431 -12.974 1.00 34.41 H new ATOM 1305 N VAL A 82 12.011 15.700 -17.448 1.00 33.32 N ATOM 1306 CA VAL A 82 11.962 14.646 -18.455 1.00 50.53 C ATOM 1307 C VAL A 82 13.345 14.054 -18.697 1.00 42.15 C ATOM 1308 O VAL A 82 13.506 12.835 -18.768 1.00 64.12 O ATOM 1309 CB VAL A 82 11.401 15.172 -19.790 1.00 34.03 C ATOM 1310 CG1 VAL A 82 11.328 14.053 -20.817 1.00 3.30 C ATOM 1311 CG2 VAL A 82 10.031 15.802 -19.579 1.00 1.21 C ATOM 0 H VAL A 82 11.671 16.606 -17.769 1.00 33.32 H new ATOM 0 HA VAL A 82 11.299 13.871 -18.071 1.00 50.53 H new ATOM 0 HB VAL A 82 12.075 15.939 -20.171 1.00 34.03 H new ATOM 0 HG11 VAL A 82 10.929 14.444 -21.753 1.00 3.30 H new ATOM 0 HG12 VAL A 82 12.326 13.650 -20.988 1.00 3.30 H new ATOM 0 HG13 VAL A 82 10.676 13.262 -20.447 1.00 3.30 H new ATOM 0 HG21 VAL A 82 9.649 16.169 -20.532 1.00 1.21 H new ATOM 0 HG22 VAL A 82 9.346 15.056 -19.176 1.00 1.21 H new ATOM 0 HG23 VAL A 82 10.117 16.633 -18.878 1.00 1.21 H new ATOM 1321 N CYS A 83 14.342 14.923 -18.824 1.00 71.14 N ATOM 1322 CA CYS A 83 15.714 14.485 -19.059 1.00 12.21 C ATOM 1323 C CYS A 83 16.193 13.571 -17.936 1.00 33.43 C ATOM 1324 O CYS A 83 17.019 12.685 -18.153 1.00 21.51 O ATOM 1325 CB CYS A 83 16.643 15.694 -19.180 1.00 62.21 C ATOM 1326 SG CYS A 83 16.587 16.509 -20.792 1.00 51.33 S ATOM 0 H CYS A 83 14.226 15.935 -18.768 1.00 71.14 H new ATOM 0 HA CYS A 83 15.735 13.924 -19.993 1.00 12.21 H new ATOM 0 HB2 CYS A 83 16.381 16.419 -18.409 1.00 62.21 H new ATOM 0 HB3 CYS A 83 17.666 15.374 -18.982 1.00 62.21 H new ATOM 0 HG CYS A 83 17.768 16.481 -21.334 1.00 51.33 H new ATOM 1332 N VAL A 84 15.668 13.792 -16.735 1.00 15.42 N ATOM 1333 CA VAL A 84 16.042 12.989 -15.577 1.00 1.41 C ATOM 1334 C VAL A 84 15.486 11.574 -15.688 1.00 35.34 C ATOM 1335 O VAL A 84 16.231 10.596 -15.613 1.00 73.34 O ATOM 1336 CB VAL A 84 15.540 13.625 -14.267 1.00 2.10 C ATOM 1337 CG1 VAL A 84 15.917 12.759 -13.075 1.00 61.50 C ATOM 1338 CG2 VAL A 84 16.097 15.032 -14.111 1.00 44.10 C ATOM 0 H VAL A 84 14.982 14.521 -16.539 1.00 15.42 H new ATOM 0 HA VAL A 84 17.131 12.948 -15.558 1.00 1.41 H new ATOM 0 HB VAL A 84 14.453 13.691 -14.308 1.00 2.10 H new ATOM 0 HG11 VAL A 84 15.554 13.224 -12.158 1.00 61.50 H new ATOM 0 HG12 VAL A 84 15.466 11.773 -13.185 1.00 61.50 H new ATOM 0 HG13 VAL A 84 17.001 12.659 -13.027 1.00 61.50 H new ATOM 0 HG21 VAL A 84 15.732 15.467 -13.180 1.00 44.10 H new ATOM 0 HG22 VAL A 84 17.186 14.992 -14.091 1.00 44.10 H new ATOM 0 HG23 VAL A 84 15.772 15.647 -14.950 1.00 44.10 H new ATOM 1348 N ILE A 85 14.173 11.472 -15.866 1.00 54.22 N ATOM 1349 CA ILE A 85 13.517 10.177 -15.989 1.00 33.52 C ATOM 1350 C ILE A 85 14.182 9.323 -17.063 1.00 5.22 C ATOM 1351 O ILE A 85 14.441 8.136 -16.856 1.00 13.33 O ATOM 1352 CB ILE A 85 12.022 10.332 -16.326 1.00 22.13 C ATOM 1353 CG1 ILE A 85 11.283 11.003 -15.166 1.00 73.34 C ATOM 1354 CG2 ILE A 85 11.407 8.976 -16.640 1.00 20.33 C ATOM 1355 CD1 ILE A 85 10.878 10.041 -14.071 1.00 34.23 C ATOM 0 H ILE A 85 13.543 12.272 -15.928 1.00 54.22 H new ATOM 0 HA ILE A 85 13.614 9.682 -15.023 1.00 33.52 H new ATOM 0 HB ILE A 85 11.926 10.965 -17.208 1.00 22.13 H new ATOM 0 HG12 ILE A 85 11.920 11.778 -14.740 1.00 73.34 H new ATOM 0 HG13 ILE A 85 10.392 11.498 -15.551 1.00 73.34 H new ATOM 0 HG21 ILE A 85 10.350 9.102 -16.876 1.00 20.33 H new ATOM 0 HG22 ILE A 85 11.920 8.533 -17.494 1.00 20.33 H new ATOM 0 HG23 ILE A 85 11.510 8.321 -15.775 1.00 20.33 H new ATOM 0 HD11 ILE A 85 10.359 10.585 -13.282 1.00 34.23 H new ATOM 0 HD12 ILE A 85 10.216 9.279 -14.482 1.00 34.23 H new ATOM 0 HD13 ILE A 85 11.767 9.564 -13.659 1.00 34.23 H new ATOM 1367 N TRP A 86 14.460 9.934 -18.209 1.00 41.21 N ATOM 1368 CA TRP A 86 15.098 9.230 -19.316 1.00 33.42 C ATOM 1369 C TRP A 86 16.463 8.691 -18.903 1.00 0.52 C ATOM 1370 O TRP A 86 16.815 7.556 -19.224 1.00 24.41 O ATOM 1371 CB TRP A 86 15.246 10.160 -20.521 1.00 55.21 C ATOM 1372 CG TRP A 86 15.844 9.488 -21.720 1.00 4.24 C ATOM 1373 CD1 TRP A 86 15.171 8.912 -22.759 1.00 14.34 C ATOM 1374 CD2 TRP A 86 17.239 9.322 -22.000 1.00 61.24 C ATOM 1375 NE1 TRP A 86 16.062 8.398 -23.669 1.00 20.01 N ATOM 1376 CE2 TRP A 86 17.337 8.636 -23.227 1.00 51.54 C ATOM 1377 CE3 TRP A 86 18.413 9.686 -21.337 1.00 52.12 C ATOM 1378 CZ2 TRP A 86 18.563 8.309 -23.801 1.00 50.23 C ATOM 1379 CZ3 TRP A 86 19.629 9.360 -21.907 1.00 52.43 C ATOM 1380 CH2 TRP A 86 19.696 8.678 -23.130 1.00 20.32 C ATOM 0 H TRP A 86 14.254 10.915 -18.396 1.00 41.21 H new ATOM 0 HA TRP A 86 14.464 8.388 -19.592 1.00 33.42 H new ATOM 0 HB2 TRP A 86 14.266 10.557 -20.787 1.00 55.21 H new ATOM 0 HB3 TRP A 86 15.869 11.009 -20.241 1.00 55.21 H new ATOM 0 HD1 TRP A 86 14.096 8.867 -22.852 1.00 14.34 H new ATOM 0 HE1 TRP A 86 15.815 7.917 -24.534 1.00 20.01 H new ATOM 0 HE3 TRP A 86 18.371 10.213 -20.395 1.00 52.12 H new ATOM 0 HZ2 TRP A 86 18.617 7.783 -24.743 1.00 50.23 H new ATOM 0 HZ3 TRP A 86 20.543 9.635 -21.402 1.00 52.43 H new ATOM 0 HH2 TRP A 86 20.662 8.439 -23.551 1.00 20.32 H new ATOM 1391 N CYS A 87 17.228 9.512 -18.191 1.00 31.02 N ATOM 1392 CA CYS A 87 18.555 9.117 -17.735 1.00 25.21 C ATOM 1393 C CYS A 87 18.487 7.845 -16.897 1.00 61.52 C ATOM 1394 O CYS A 87 19.252 6.904 -17.116 1.00 70.50 O ATOM 1395 CB CYS A 87 19.194 10.244 -16.921 1.00 23.50 C ATOM 1396 SG CYS A 87 20.054 11.481 -17.921 1.00 22.12 S ATOM 0 H CYS A 87 16.951 10.455 -17.917 1.00 31.02 H new ATOM 0 HA CYS A 87 19.169 8.919 -18.614 1.00 25.21 H new ATOM 0 HB2 CYS A 87 18.419 10.740 -16.336 1.00 23.50 H new ATOM 0 HB3 CYS A 87 19.900 9.811 -16.212 1.00 23.50 H new ATOM 0 HG CYS A 87 19.199 12.360 -18.354 1.00 22.12 H new ATOM 1402 N ILE A 88 17.568 7.822 -15.938 1.00 41.41 N ATOM 1403 CA ILE A 88 17.400 6.665 -15.068 1.00 31.11 C ATOM 1404 C ILE A 88 17.312 5.376 -15.878 1.00 53.53 C ATOM 1405 O ILE A 88 17.978 4.388 -15.567 1.00 51.44 O ATOM 1406 CB ILE A 88 16.139 6.796 -14.195 1.00 21.44 C ATOM 1407 CG1 ILE A 88 16.216 8.060 -13.336 1.00 72.20 C ATOM 1408 CG2 ILE A 88 15.971 5.564 -13.319 1.00 31.05 C ATOM 1409 CD1 ILE A 88 14.878 8.491 -12.773 1.00 65.23 C ATOM 0 H ILE A 88 16.928 8.592 -15.744 1.00 41.41 H new ATOM 0 HA ILE A 88 18.277 6.626 -14.422 1.00 31.11 H new ATOM 0 HB ILE A 88 15.270 6.875 -14.848 1.00 21.44 H new ATOM 0 HG12 ILE A 88 16.909 7.888 -12.513 1.00 72.20 H new ATOM 0 HG13 ILE A 88 16.628 8.872 -13.935 1.00 72.20 H new ATOM 0 HG21 ILE A 88 15.075 5.672 -12.708 1.00 31.05 H new ATOM 0 HG22 ILE A 88 15.876 4.680 -13.949 1.00 31.05 H new ATOM 0 HG23 ILE A 88 16.841 5.456 -12.672 1.00 31.05 H new ATOM 0 HD11 ILE A 88 15.008 9.393 -12.175 1.00 65.23 H new ATOM 0 HD12 ILE A 88 14.188 8.695 -13.591 1.00 65.23 H new ATOM 0 HD13 ILE A 88 14.474 7.696 -12.147 1.00 65.23 H new ATOM 1421 N HIS A 89 16.487 5.393 -16.920 1.00 54.43 N ATOM 1422 CA HIS A 89 16.313 4.226 -17.778 1.00 63.14 C ATOM 1423 C HIS A 89 17.510 4.054 -18.709 1.00 44.41 C ATOM 1424 O HIS A 89 17.947 2.914 -18.864 1.00 5.45 O ATOM 1425 CB HIS A 89 15.030 4.356 -18.598 1.00 52.23 C ATOM 1426 CG HIS A 89 13.782 4.314 -17.769 1.00 41.34 C ATOM 1427 ND1 HIS A 89 13.550 3.353 -16.808 1.00 12.40 N ATOM 1428 CD2 HIS A 89 12.697 5.123 -17.762 1.00 34.43 C ATOM 1429 CE1 HIS A 89 12.375 3.572 -16.245 1.00 55.44 C ATOM 1430 NE2 HIS A 89 11.837 4.641 -16.806 1.00 60.04 N ATOM 0 H HIS A 89 15.928 6.202 -17.191 1.00 54.43 H new ATOM 0 HA HIS A 89 16.240 3.345 -17.141 1.00 63.14 H new ATOM 0 HB2 HIS A 89 15.057 5.294 -19.153 1.00 52.23 H new ATOM 0 HB3 HIS A 89 14.995 3.552 -19.333 1.00 52.23 H new ATOM 0 HD2 HIS A 89 12.537 5.986 -18.391 1.00 34.43 H new ATOM 0 HE1 HIS A 89 11.930 2.979 -15.460 1.00 55.44 H new ATOM 0 HE2 HIS A 89 10.930 5.043 -16.568 1.00 60.04 H new ATOM 1438 N ALA A 90 18.032 5.117 -19.312 1.00 55.21 N ATOM 1439 CA ALA A 90 19.176 5.003 -20.208 1.00 1.12 C ATOM 1440 C ALA A 90 20.380 4.406 -19.487 1.00 11.11 C ATOM 1441 O ALA A 90 21.321 3.930 -20.121 1.00 53.33 O ATOM 1442 CB ALA A 90 19.528 6.363 -20.791 1.00 42.12 C ATOM 0 H ALA A 90 17.680 6.067 -19.196 1.00 55.21 H new ATOM 0 HA ALA A 90 18.903 4.331 -21.022 1.00 1.12 H new ATOM 0 HB1 ALA A 90 20.384 6.262 -21.458 1.00 42.12 H new ATOM 0 HB2 ALA A 90 18.676 6.751 -21.350 1.00 42.12 H new ATOM 0 HB3 ALA A 90 19.776 7.052 -19.984 1.00 42.12 H new ATOM 1448 N GLU A 91 20.344 4.437 -18.159 1.00 30.41 N ATOM 1449 CA GLU A 91 21.433 3.899 -17.353 1.00 64.22 C ATOM 1450 C GLU A 91 22.663 4.800 -17.430 1.00 52.02 C ATOM 1451 O GLU A 91 23.770 4.333 -17.691 1.00 3.41 O ATOM 1452 CB GLU A 91 21.793 2.487 -17.818 1.00 21.14 C ATOM 1453 CG GLU A 91 22.318 1.595 -16.706 1.00 5.00 C ATOM 1454 CD GLU A 91 21.633 0.243 -16.668 1.00 53.13 C ATOM 1455 OE1 GLU A 91 21.847 -0.557 -17.603 1.00 43.43 O ATOM 1456 OE2 GLU A 91 20.881 -0.016 -15.706 1.00 3.03 O ATOM 0 H GLU A 91 19.573 4.829 -17.619 1.00 30.41 H new ATOM 0 HA GLU A 91 21.097 3.858 -16.317 1.00 64.22 H new ATOM 0 HB2 GLU A 91 20.911 2.023 -18.259 1.00 21.14 H new ATOM 0 HB3 GLU A 91 22.545 2.553 -18.605 1.00 21.14 H new ATOM 0 HG2 GLU A 91 23.390 1.451 -16.837 1.00 5.00 H new ATOM 0 HG3 GLU A 91 22.178 2.096 -15.748 1.00 5.00 H new ATOM 1463 N GLU A 92 22.456 6.093 -17.203 1.00 3.34 N ATOM 1464 CA GLU A 92 23.547 7.060 -17.248 1.00 53.23 C ATOM 1465 C GLU A 92 23.704 7.767 -15.904 1.00 44.12 C ATOM 1466 O GLU A 92 22.729 8.247 -15.324 1.00 45.20 O ATOM 1467 CB GLU A 92 23.300 8.089 -18.353 1.00 10.44 C ATOM 1468 CG GLU A 92 23.654 7.588 -19.743 1.00 31.24 C ATOM 1469 CD GLU A 92 25.147 7.596 -20.002 1.00 63.14 C ATOM 1470 OE1 GLU A 92 25.913 7.253 -19.079 1.00 20.52 O ATOM 1471 OE2 GLU A 92 25.551 7.946 -21.132 1.00 54.15 O ATOM 0 H GLU A 92 21.544 6.495 -16.986 1.00 3.34 H new ATOM 0 HA GLU A 92 24.469 6.520 -17.464 1.00 53.23 H new ATOM 0 HB2 GLU A 92 22.250 8.381 -18.338 1.00 10.44 H new ATOM 0 HB3 GLU A 92 23.883 8.985 -18.140 1.00 10.44 H new ATOM 0 HG2 GLU A 92 23.273 6.575 -19.868 1.00 31.24 H new ATOM 0 HG3 GLU A 92 23.156 8.210 -20.487 1.00 31.24 H new ATOM 1478 N LYS A 93 24.938 7.827 -15.415 1.00 22.41 N ATOM 1479 CA LYS A 93 25.226 8.474 -14.141 1.00 15.42 C ATOM 1480 C LYS A 93 25.174 9.993 -14.278 1.00 61.24 C ATOM 1481 O LYS A 93 25.825 10.570 -15.149 1.00 25.11 O ATOM 1482 CB LYS A 93 26.600 8.045 -13.625 1.00 44.43 C ATOM 1483 CG LYS A 93 26.741 6.543 -13.444 1.00 41.43 C ATOM 1484 CD LYS A 93 27.756 5.958 -14.411 1.00 41.12 C ATOM 1485 CE LYS A 93 29.094 5.709 -13.731 1.00 44.34 C ATOM 1486 NZ LYS A 93 29.858 4.615 -14.393 1.00 42.04 N ATOM 0 H LYS A 93 25.755 7.435 -15.883 1.00 22.41 H new ATOM 0 HA LYS A 93 24.464 8.164 -13.426 1.00 15.42 H new ATOM 0 HB2 LYS A 93 27.364 8.392 -14.320 1.00 44.43 H new ATOM 0 HB3 LYS A 93 26.790 8.537 -12.671 1.00 44.43 H new ATOM 0 HG2 LYS A 93 27.045 6.326 -12.420 1.00 41.43 H new ATOM 0 HG3 LYS A 93 25.774 6.065 -13.597 1.00 41.43 H new ATOM 0 HD2 LYS A 93 27.374 5.022 -14.819 1.00 41.12 H new ATOM 0 HD3 LYS A 93 27.895 6.639 -15.251 1.00 41.12 H new ATOM 0 HE2 LYS A 93 29.685 6.625 -13.746 1.00 44.34 H new ATOM 0 HE3 LYS A 93 28.928 5.454 -12.684 1.00 44.34 H new ATOM 0 HZ1 LYS A 93 30.763 4.476 -13.900 1.00 42.04 H new ATOM 0 HZ2 LYS A 93 29.306 3.735 -14.357 1.00 42.04 H new ATOM 0 HZ3 LYS A 93 30.039 4.869 -15.385 1.00 42.04 H new ATOM 1500 N VAL A 94 24.395 10.635 -13.413 1.00 70.34 N ATOM 1501 CA VAL A 94 24.260 12.086 -13.437 1.00 13.52 C ATOM 1502 C VAL A 94 24.333 12.668 -12.029 1.00 64.13 C ATOM 1503 O VAL A 94 23.834 12.074 -11.073 1.00 41.53 O ATOM 1504 CB VAL A 94 22.933 12.516 -14.090 1.00 61.01 C ATOM 1505 CG1 VAL A 94 22.928 12.165 -15.570 1.00 11.44 C ATOM 1506 CG2 VAL A 94 21.755 11.871 -13.376 1.00 42.13 C ATOM 0 H VAL A 94 23.848 10.173 -12.687 1.00 70.34 H new ATOM 0 HA VAL A 94 25.089 12.471 -14.030 1.00 13.52 H new ATOM 0 HB VAL A 94 22.836 13.598 -13.998 1.00 61.01 H new ATOM 0 HG11 VAL A 94 21.983 12.476 -16.015 1.00 11.44 H new ATOM 0 HG12 VAL A 94 23.750 12.679 -16.069 1.00 11.44 H new ATOM 0 HG13 VAL A 94 23.048 11.088 -15.689 1.00 11.44 H new ATOM 0 HG21 VAL A 94 20.825 12.186 -13.850 1.00 42.13 H new ATOM 0 HG22 VAL A 94 21.843 10.786 -13.435 1.00 42.13 H new ATOM 0 HG23 VAL A 94 21.751 12.178 -12.330 1.00 42.13 H new ATOM 1516 N LYS A 95 24.959 13.834 -11.909 1.00 10.34 N ATOM 1517 CA LYS A 95 25.096 14.499 -10.619 1.00 11.44 C ATOM 1518 C LYS A 95 23.843 15.300 -10.282 1.00 73.24 C ATOM 1519 O LYS A 95 23.319 15.215 -9.172 1.00 32.35 O ATOM 1520 CB LYS A 95 26.317 15.422 -10.625 1.00 44.22 C ATOM 1521 CG LYS A 95 27.610 14.718 -11.003 1.00 74.22 C ATOM 1522 CD LYS A 95 28.569 14.642 -9.827 1.00 15.42 C ATOM 1523 CE LYS A 95 29.732 13.707 -10.116 1.00 1.34 C ATOM 1524 NZ LYS A 95 29.362 12.280 -9.906 1.00 22.20 N ATOM 0 H LYS A 95 25.379 14.338 -12.690 1.00 10.34 H new ATOM 0 HA LYS A 95 25.231 13.732 -9.857 1.00 11.44 H new ATOM 0 HB2 LYS A 95 26.141 16.240 -11.324 1.00 44.22 H new ATOM 0 HB3 LYS A 95 26.431 15.867 -9.636 1.00 44.22 H new ATOM 0 HG2 LYS A 95 27.387 13.712 -11.357 1.00 74.22 H new ATOM 0 HG3 LYS A 95 28.086 15.248 -11.828 1.00 74.22 H new ATOM 0 HD2 LYS A 95 28.949 15.638 -9.601 1.00 15.42 H new ATOM 0 HD3 LYS A 95 28.034 14.297 -8.942 1.00 15.42 H new ATOM 0 HE2 LYS A 95 30.065 13.848 -11.144 1.00 1.34 H new ATOM 0 HE3 LYS A 95 30.573 13.963 -9.471 1.00 1.34 H new ATOM 0 HZ1 LYS A 95 30.182 11.675 -10.113 1.00 22.20 H new ATOM 0 HZ2 LYS A 95 29.069 12.139 -8.918 1.00 22.20 H new ATOM 0 HZ3 LYS A 95 28.577 12.028 -10.540 1.00 22.20 H new ATOM 1538 N ASP A 96 23.366 16.076 -11.250 1.00 11.23 N ATOM 1539 CA ASP A 96 22.171 16.891 -11.056 1.00 43.35 C ATOM 1540 C ASP A 96 21.373 16.998 -12.352 1.00 54.42 C ATOM 1541 O ASP A 96 21.688 16.343 -13.345 1.00 62.34 O ATOM 1542 CB ASP A 96 22.554 18.286 -10.561 1.00 40.44 C ATOM 1543 CG ASP A 96 23.487 19.004 -11.517 1.00 31.24 C ATOM 1544 OD1 ASP A 96 23.035 19.376 -12.620 1.00 42.11 O ATOM 1545 OD2 ASP A 96 24.668 19.195 -11.160 1.00 52.31 O ATOM 0 H ASP A 96 23.787 16.158 -12.175 1.00 11.23 H new ATOM 0 HA ASP A 96 21.547 16.407 -10.304 1.00 43.35 H new ATOM 0 HB2 ASP A 96 21.651 18.881 -10.424 1.00 40.44 H new ATOM 0 HB3 ASP A 96 23.032 18.203 -9.585 1.00 40.44 H new ATOM 1550 N THR A 97 20.335 17.830 -12.334 1.00 24.43 N ATOM 1551 CA THR A 97 19.489 18.022 -13.505 1.00 40.12 C ATOM 1552 C THR A 97 20.269 18.664 -14.647 1.00 54.12 C ATOM 1553 O THR A 97 20.255 18.171 -15.774 1.00 71.31 O ATOM 1554 CB THR A 97 18.266 18.899 -13.178 1.00 23.05 C ATOM 1555 OG1 THR A 97 17.799 18.613 -11.855 1.00 12.12 O ATOM 1556 CG2 THR A 97 17.146 18.661 -14.179 1.00 12.45 C ATOM 0 H THR A 97 20.061 18.381 -11.521 1.00 24.43 H new ATOM 0 HA THR A 97 19.146 17.034 -13.812 1.00 40.12 H new ATOM 0 HB THR A 97 18.569 19.944 -13.238 1.00 23.05 H new ATOM 0 HG1 THR A 97 17.450 19.433 -11.447 1.00 12.12 H new ATOM 0 HG21 THR A 97 16.293 19.291 -13.927 1.00 12.45 H new ATOM 0 HG22 THR A 97 17.496 18.907 -15.182 1.00 12.45 H new ATOM 0 HG23 THR A 97 16.845 17.614 -14.146 1.00 12.45 H new ATOM 1564 N GLU A 98 20.949 19.767 -14.347 1.00 34.20 N ATOM 1565 CA GLU A 98 21.735 20.475 -15.350 1.00 53.02 C ATOM 1566 C GLU A 98 22.672 19.519 -16.083 1.00 34.24 C ATOM 1567 O GLU A 98 22.924 19.674 -17.277 1.00 24.13 O ATOM 1568 CB GLU A 98 22.542 21.598 -14.697 1.00 42.14 C ATOM 1569 CG GLU A 98 22.023 22.990 -15.020 1.00 65.43 C ATOM 1570 CD GLU A 98 20.516 23.092 -14.897 1.00 73.34 C ATOM 1571 OE1 GLU A 98 19.972 22.648 -13.864 1.00 51.41 O ATOM 1572 OE2 GLU A 98 19.879 23.617 -15.835 1.00 11.54 O ATOM 0 H GLU A 98 20.971 20.189 -13.418 1.00 34.20 H new ATOM 0 HA GLU A 98 21.046 20.907 -16.076 1.00 53.02 H new ATOM 0 HB2 GLU A 98 22.534 21.458 -13.616 1.00 42.14 H new ATOM 0 HB3 GLU A 98 23.580 21.523 -15.020 1.00 42.14 H new ATOM 0 HG2 GLU A 98 22.488 23.712 -14.349 1.00 65.43 H new ATOM 0 HG3 GLU A 98 22.320 23.259 -16.034 1.00 65.43 H new ATOM 1579 N GLY A 99 23.184 18.531 -15.356 1.00 71.35 N ATOM 1580 CA GLY A 99 24.088 17.564 -15.953 1.00 50.03 C ATOM 1581 C GLY A 99 23.354 16.459 -16.686 1.00 41.35 C ATOM 1582 O GLY A 99 23.819 15.974 -17.718 1.00 23.20 O ATOM 0 H GLY A 99 22.990 18.383 -14.366 1.00 71.35 H new ATOM 0 HA2 GLY A 99 24.755 18.075 -16.647 1.00 50.03 H new ATOM 0 HA3 GLY A 99 24.713 17.126 -15.174 1.00 50.03 H new ATOM 1586 N ALA A 100 22.203 16.060 -16.155 1.00 1.44 N ATOM 1587 CA ALA A 100 21.404 15.006 -16.765 1.00 50.13 C ATOM 1588 C ALA A 100 20.812 15.466 -18.094 1.00 41.32 C ATOM 1589 O ALA A 100 20.462 14.649 -18.945 1.00 72.42 O ATOM 1590 CB ALA A 100 20.297 14.566 -15.818 1.00 45.01 C ATOM 0 H ALA A 100 21.803 16.452 -15.302 1.00 1.44 H new ATOM 0 HA ALA A 100 22.058 14.157 -16.961 1.00 50.13 H new ATOM 0 HB1 ALA A 100 19.708 13.778 -16.288 1.00 45.01 H new ATOM 0 HB2 ALA A 100 20.737 14.189 -14.895 1.00 45.01 H new ATOM 0 HB3 ALA A 100 19.652 15.415 -15.593 1.00 45.01 H new ATOM 1596 N LYS A 101 20.703 16.779 -18.265 1.00 23.13 N ATOM 1597 CA LYS A 101 20.155 17.349 -19.489 1.00 43.03 C ATOM 1598 C LYS A 101 21.202 17.365 -20.598 1.00 61.21 C ATOM 1599 O LYS A 101 20.981 16.821 -21.680 1.00 23.13 O ATOM 1600 CB LYS A 101 19.647 18.770 -19.233 1.00 31.44 C ATOM 1601 CG LYS A 101 18.630 19.246 -20.256 1.00 5.24 C ATOM 1602 CD LYS A 101 18.794 20.727 -20.557 1.00 33.53 C ATOM 1603 CE LYS A 101 17.975 21.143 -21.768 1.00 74.12 C ATOM 1604 NZ LYS A 101 18.647 22.218 -22.549 1.00 11.24 N ATOM 0 H LYS A 101 20.988 17.469 -17.570 1.00 23.13 H new ATOM 0 HA LYS A 101 19.321 16.724 -19.809 1.00 43.03 H new ATOM 0 HB2 LYS A 101 19.199 18.813 -18.240 1.00 31.44 H new ATOM 0 HB3 LYS A 101 20.495 19.455 -19.230 1.00 31.44 H new ATOM 0 HG2 LYS A 101 18.742 18.672 -21.176 1.00 5.24 H new ATOM 0 HG3 LYS A 101 17.623 19.059 -19.884 1.00 5.24 H new ATOM 0 HD2 LYS A 101 18.487 21.312 -19.690 1.00 33.53 H new ATOM 0 HD3 LYS A 101 19.846 20.949 -20.734 1.00 33.53 H new ATOM 0 HE2 LYS A 101 17.810 20.277 -22.409 1.00 74.12 H new ATOM 0 HE3 LYS A 101 16.995 21.490 -21.442 1.00 74.12 H new ATOM 0 HZ1 LYS A 101 18.057 22.474 -23.366 1.00 11.24 H new ATOM 0 HZ2 LYS A 101 18.782 23.053 -21.945 1.00 11.24 H new ATOM 0 HZ3 LYS A 101 19.572 21.879 -22.882 1.00 11.24 H new ATOM 1618 N GLN A 102 22.341 17.991 -20.321 1.00 3.05 N ATOM 1619 CA GLN A 102 23.423 18.077 -21.296 1.00 72.33 C ATOM 1620 C GLN A 102 23.779 16.696 -21.836 1.00 71.25 C ATOM 1621 O GLN A 102 24.049 16.535 -23.027 1.00 12.34 O ATOM 1622 CB GLN A 102 24.657 18.724 -20.666 1.00 35.25 C ATOM 1623 CG GLN A 102 24.837 20.186 -21.044 1.00 24.43 C ATOM 1624 CD GLN A 102 24.691 21.119 -19.859 1.00 32.25 C ATOM 1625 OE1 GLN A 102 25.569 21.189 -18.998 1.00 15.22 O ATOM 1626 NE2 GLN A 102 23.578 21.841 -19.807 1.00 34.21 N ATOM 0 H GLN A 102 22.539 18.446 -19.430 1.00 3.05 H new ATOM 0 HA GLN A 102 23.081 18.696 -22.126 1.00 72.33 H new ATOM 0 HB2 GLN A 102 24.585 18.644 -19.581 1.00 35.25 H new ATOM 0 HB3 GLN A 102 25.544 18.167 -20.969 1.00 35.25 H new ATOM 0 HG2 GLN A 102 25.822 20.323 -21.490 1.00 24.43 H new ATOM 0 HG3 GLN A 102 24.103 20.453 -21.804 1.00 24.43 H new ATOM 0 HE21 GLN A 102 22.877 21.751 -20.542 1.00 34.21 H new ATOM 0 HE22 GLN A 102 23.424 22.486 -19.032 1.00 34.21 H new ATOM 1635 N ILE A 103 23.777 15.702 -20.954 1.00 62.12 N ATOM 1636 CA ILE A 103 24.099 14.335 -21.344 1.00 24.24 C ATOM 1637 C ILE A 103 23.081 13.793 -22.341 1.00 23.31 C ATOM 1638 O ILE A 103 23.440 13.114 -23.303 1.00 53.54 O ATOM 1639 CB ILE A 103 24.152 13.399 -20.121 1.00 35.10 C ATOM 1640 CG1 ILE A 103 25.360 13.737 -19.245 1.00 61.32 C ATOM 1641 CG2 ILE A 103 24.205 11.946 -20.569 1.00 12.31 C ATOM 1642 CD1 ILE A 103 25.434 12.915 -17.977 1.00 1.42 C ATOM 0 H ILE A 103 23.556 15.818 -19.965 1.00 62.12 H new ATOM 0 HA ILE A 103 25.083 14.364 -21.813 1.00 24.24 H new ATOM 0 HB ILE A 103 23.247 13.544 -19.531 1.00 35.10 H new ATOM 0 HG12 ILE A 103 26.272 13.583 -19.822 1.00 61.32 H new ATOM 0 HG13 ILE A 103 25.324 14.794 -18.982 1.00 61.32 H new ATOM 0 HG21 ILE A 103 24.242 11.297 -19.694 1.00 12.31 H new ATOM 0 HG22 ILE A 103 23.316 11.714 -21.156 1.00 12.31 H new ATOM 0 HG23 ILE A 103 25.095 11.785 -21.178 1.00 12.31 H new ATOM 0 HD11 ILE A 103 26.314 13.207 -17.405 1.00 1.42 H new ATOM 0 HD12 ILE A 103 24.539 13.087 -17.379 1.00 1.42 H new ATOM 0 HD13 ILE A 103 25.502 11.858 -18.232 1.00 1.42 H new ATOM 1654 N VAL A 104 21.809 14.098 -22.105 1.00 41.20 N ATOM 1655 CA VAL A 104 20.739 13.644 -22.984 1.00 54.45 C ATOM 1656 C VAL A 104 20.881 14.245 -24.379 1.00 21.54 C ATOM 1657 O VAL A 104 21.016 13.522 -25.366 1.00 64.24 O ATOM 1658 CB VAL A 104 19.354 14.012 -22.419 1.00 51.32 C ATOM 1659 CG1 VAL A 104 18.260 13.672 -23.420 1.00 4.51 C ATOM 1660 CG2 VAL A 104 19.115 13.304 -21.094 1.00 54.33 C ATOM 0 H VAL A 104 21.495 14.658 -21.312 1.00 41.20 H new ATOM 0 HA VAL A 104 20.821 12.559 -23.048 1.00 54.45 H new ATOM 0 HB VAL A 104 19.327 15.087 -22.241 1.00 51.32 H new ATOM 0 HG11 VAL A 104 17.289 13.939 -23.003 1.00 4.51 H new ATOM 0 HG12 VAL A 104 18.424 14.229 -24.342 1.00 4.51 H new ATOM 0 HG13 VAL A 104 18.281 12.603 -23.633 1.00 4.51 H new ATOM 0 HG21 VAL A 104 18.132 13.575 -20.709 1.00 54.33 H new ATOM 0 HG22 VAL A 104 19.161 12.225 -21.244 1.00 54.33 H new ATOM 0 HG23 VAL A 104 19.880 13.604 -20.378 1.00 54.33 H new ATOM 1670 N ARG A 105 20.851 15.571 -24.453 1.00 32.20 N ATOM 1671 CA ARG A 105 20.976 16.269 -25.726 1.00 53.34 C ATOM 1672 C ARG A 105 22.210 15.793 -26.488 1.00 12.41 C ATOM 1673 O ARG A 105 22.156 15.564 -27.697 1.00 14.54 O ATOM 1674 CB ARG A 105 21.055 17.779 -25.500 1.00 12.25 C ATOM 1675 CG ARG A 105 21.287 18.576 -26.773 1.00 51.12 C ATOM 1676 CD ARG A 105 20.299 19.725 -26.900 1.00 23.22 C ATOM 1677 NE ARG A 105 20.820 20.805 -27.735 1.00 21.13 N ATOM 1678 CZ ARG A 105 20.231 21.989 -27.856 1.00 74.54 C ATOM 1679 NH1 ARG A 105 19.107 22.244 -27.199 1.00 51.21 N ATOM 1680 NH2 ARG A 105 20.765 22.921 -28.635 1.00 74.22 N ATOM 0 H ARG A 105 20.741 16.184 -23.645 1.00 32.20 H new ATOM 0 HA ARG A 105 20.092 16.044 -26.322 1.00 53.34 H new ATOM 0 HB2 ARG A 105 20.129 18.117 -25.034 1.00 12.25 H new ATOM 0 HB3 ARG A 105 21.861 17.991 -24.797 1.00 12.25 H new ATOM 0 HG2 ARG A 105 22.304 18.967 -26.778 1.00 51.12 H new ATOM 0 HG3 ARG A 105 21.194 17.918 -27.637 1.00 51.12 H new ATOM 0 HD2 ARG A 105 19.366 19.356 -27.326 1.00 23.22 H new ATOM 0 HD3 ARG A 105 20.065 20.114 -25.909 1.00 23.22 H new ATOM 0 HE ARG A 105 21.683 20.641 -28.253 1.00 21.13 H new ATOM 0 HH11 ARG A 105 18.694 21.530 -26.599 1.00 51.21 H new ATOM 0 HH12 ARG A 105 18.656 23.154 -27.293 1.00 51.21 H new ATOM 0 HH21 ARG A 105 21.629 22.728 -29.142 1.00 74.22 H new ATOM 0 HH22 ARG A 105 20.311 23.830 -28.727 1.00 74.22 H new ATOM 1694 N ARG A 106 23.320 15.647 -25.773 1.00 65.01 N ATOM 1695 CA ARG A 106 24.568 15.200 -26.381 1.00 13.42 C ATOM 1696 C ARG A 106 24.350 13.928 -27.195 1.00 43.23 C ATOM 1697 O ARG A 106 24.831 13.810 -28.323 1.00 14.31 O ATOM 1698 CB ARG A 106 25.626 14.956 -25.304 1.00 65.45 C ATOM 1699 CG ARG A 106 26.516 16.158 -25.039 1.00 31.11 C ATOM 1700 CD ARG A 106 27.808 15.754 -24.345 1.00 74.14 C ATOM 1701 NE ARG A 106 28.716 16.885 -24.178 1.00 13.42 N ATOM 1702 CZ ARG A 106 30.003 16.756 -23.878 1.00 23.32 C ATOM 1703 NH1 ARG A 106 30.532 15.551 -23.714 1.00 34.35 N ATOM 1704 NH2 ARG A 106 30.766 17.832 -23.742 1.00 13.43 N ATOM 0 H ARG A 106 23.381 15.832 -24.772 1.00 65.01 H new ATOM 0 HA ARG A 106 24.918 15.984 -27.052 1.00 13.42 H new ATOM 0 HB2 ARG A 106 25.129 14.672 -24.377 1.00 65.45 H new ATOM 0 HB3 ARG A 106 26.249 14.113 -25.603 1.00 65.45 H new ATOM 0 HG2 ARG A 106 26.748 16.655 -25.981 1.00 31.11 H new ATOM 0 HG3 ARG A 106 25.981 16.879 -24.422 1.00 31.11 H new ATOM 0 HD2 ARG A 106 27.577 15.327 -23.369 1.00 74.14 H new ATOM 0 HD3 ARG A 106 28.303 14.975 -24.925 1.00 74.14 H new ATOM 0 HE ARG A 106 28.341 17.826 -24.298 1.00 13.42 H new ATOM 0 HH11 ARG A 106 29.950 14.720 -23.818 1.00 34.35 H new ATOM 0 HH12 ARG A 106 31.521 15.455 -23.484 1.00 34.35 H new ATOM 0 HH21 ARG A 106 30.364 18.761 -23.868 1.00 13.43 H new ATOM 0 HH22 ARG A 106 31.754 17.730 -23.511 1.00 13.43 H new ATOM 1718 N HIS A 107 23.624 12.978 -26.616 1.00 4.03 N ATOM 1719 CA HIS A 107 23.342 11.713 -27.287 1.00 5.01 C ATOM 1720 C HIS A 107 22.337 11.912 -28.417 1.00 63.41 C ATOM 1721 O HIS A 107 22.339 11.084 -29.329 1.00 60.40 O ATOM 1722 CB HIS A 107 22.807 10.688 -26.287 1.00 62.31 C ATOM 1723 CG HIS A 107 23.858 10.144 -25.367 1.00 14.25 C ATOM 1724 ND1 HIS A 107 25.127 9.810 -25.787 1.00 63.13 N ATOM 1725 CD2 HIS A 107 23.821 9.880 -24.040 1.00 31.42 C ATOM 1726 CE1 HIS A 107 25.826 9.362 -24.759 1.00 53.11 C ATOM 1727 NE2 HIS A 107 25.055 9.394 -23.687 1.00 23.12 N ATOM 0 H HIS A 107 23.220 13.059 -25.683 1.00 4.03 H new ATOM 0 HA HIS A 107 24.273 11.340 -27.713 1.00 5.01 H new ATOM 0 HB2 HIS A 107 22.019 11.150 -25.692 1.00 62.31 H new ATOM 0 HB3 HIS A 107 22.352 9.862 -26.834 1.00 62.31 H new ATOM 0 HD2 HIS A 107 22.977 10.025 -23.381 1.00 31.42 H new ATOM 0 HE1 HIS A 107 26.852 9.027 -24.790 1.00 53.11 H new ATOM 0 HE2 HIS A 107 25.332 9.104 -22.749 1.00 23.12 H new ATOM 1735 N LEU A 108 21.507 12.949 -28.383 1.00 60.45 N ATOM 1736 CA LEU A 108 20.528 13.179 -29.440 1.00 45.13 C ATOM 1737 C LEU A 108 21.183 13.828 -30.656 1.00 73.34 C ATOM 1738 O LEU A 108 20.918 13.444 -31.795 1.00 41.53 O ATOM 1739 CB LEU A 108 19.391 14.064 -28.926 1.00 12.01 C ATOM 1740 CG LEU A 108 18.515 13.459 -27.828 1.00 22.01 C ATOM 1741 CD1 LEU A 108 17.652 14.532 -27.183 1.00 4.11 C ATOM 1742 CD2 LEU A 108 17.648 12.343 -28.392 1.00 73.15 C ATOM 0 H LEU A 108 21.492 13.643 -27.636 1.00 60.45 H new ATOM 0 HA LEU A 108 20.121 12.214 -29.741 1.00 45.13 H new ATOM 0 HB2 LEU A 108 19.821 14.992 -28.550 1.00 12.01 H new ATOM 0 HB3 LEU A 108 18.752 14.327 -29.769 1.00 12.01 H new ATOM 0 HG LEU A 108 19.165 13.035 -27.063 1.00 22.01 H new ATOM 0 HD11 LEU A 108 17.035 14.083 -26.404 1.00 4.11 H new ATOM 0 HD12 LEU A 108 18.291 15.298 -26.744 1.00 4.11 H new ATOM 0 HD13 LEU A 108 17.010 14.985 -27.938 1.00 4.11 H new ATOM 0 HD21 LEU A 108 17.031 11.924 -27.597 1.00 73.15 H new ATOM 0 HD22 LEU A 108 17.006 12.743 -29.177 1.00 73.15 H new ATOM 0 HD23 LEU A 108 18.285 11.562 -28.807 1.00 73.15 H new ATOM 1754 N VAL A 109 22.040 14.812 -30.405 1.00 34.01 N ATOM 1755 CA VAL A 109 22.735 15.513 -31.478 1.00 51.24 C ATOM 1756 C VAL A 109 23.645 14.566 -32.253 1.00 12.54 C ATOM 1757 O VAL A 109 23.853 14.732 -33.454 1.00 54.34 O ATOM 1758 CB VAL A 109 23.574 16.684 -30.933 1.00 53.24 C ATOM 1759 CG1 VAL A 109 24.304 17.390 -32.066 1.00 11.42 C ATOM 1760 CG2 VAL A 109 22.692 17.658 -30.167 1.00 44.30 C ATOM 0 H VAL A 109 22.270 15.142 -29.468 1.00 34.01 H new ATOM 0 HA VAL A 109 21.970 15.906 -32.147 1.00 51.24 H new ATOM 0 HB VAL A 109 24.320 16.286 -30.245 1.00 53.24 H new ATOM 0 HG11 VAL A 109 24.892 18.214 -31.662 1.00 11.42 H new ATOM 0 HG12 VAL A 109 24.966 16.684 -32.568 1.00 11.42 H new ATOM 0 HG13 VAL A 109 23.578 17.778 -32.781 1.00 11.42 H new ATOM 0 HG21 VAL A 109 23.300 18.479 -29.789 1.00 44.30 H new ATOM 0 HG22 VAL A 109 21.923 18.052 -30.831 1.00 44.30 H new ATOM 0 HG23 VAL A 109 22.220 17.141 -29.331 1.00 44.30 H new ATOM 1770 N ALA A 110 24.186 13.573 -31.556 1.00 43.13 N ATOM 1771 CA ALA A 110 25.073 12.598 -32.179 1.00 31.41 C ATOM 1772 C ALA A 110 24.292 11.630 -33.062 1.00 24.14 C ATOM 1773 O ALA A 110 24.806 11.139 -34.066 1.00 1.43 O ATOM 1774 CB ALA A 110 25.849 11.835 -31.114 1.00 54.42 C ATOM 0 H ALA A 110 24.026 13.422 -30.560 1.00 43.13 H new ATOM 0 HA ALA A 110 25.778 13.137 -32.812 1.00 31.41 H new ATOM 0 HB1 ALA A 110 26.507 11.110 -31.593 1.00 54.42 H new ATOM 0 HB2 ALA A 110 26.445 12.534 -30.527 1.00 54.42 H new ATOM 0 HB3 ALA A 110 25.151 11.314 -30.459 1.00 54.42 H new ATOM 1780 N GLU A 111 23.048 11.361 -32.679 1.00 53.23 N ATOM 1781 CA GLU A 111 22.196 10.451 -33.437 1.00 65.32 C ATOM 1782 C GLU A 111 21.554 11.165 -34.622 1.00 1.31 C ATOM 1783 O GLU A 111 21.229 10.545 -35.635 1.00 12.23 O ATOM 1784 CB GLU A 111 21.113 9.860 -32.533 1.00 74.45 C ATOM 1785 CG GLU A 111 21.228 8.357 -32.347 1.00 32.11 C ATOM 1786 CD GLU A 111 20.699 7.893 -31.003 1.00 1.54 C ATOM 1787 OE1 GLU A 111 19.623 8.376 -30.591 1.00 22.23 O ATOM 1788 OE2 GLU A 111 21.362 7.051 -30.363 1.00 71.24 O ATOM 0 H GLU A 111 22.608 11.759 -31.850 1.00 53.23 H new ATOM 0 HA GLU A 111 22.820 9.643 -33.819 1.00 65.32 H new ATOM 0 HB2 GLU A 111 21.163 10.343 -31.557 1.00 74.45 H new ATOM 0 HB3 GLU A 111 20.134 10.092 -32.954 1.00 74.45 H new ATOM 0 HG2 GLU A 111 20.679 7.853 -33.143 1.00 32.11 H new ATOM 0 HG3 GLU A 111 22.273 8.062 -32.444 1.00 32.11 H new ATOM 1795 N THR A 112 21.373 12.476 -34.487 1.00 71.43 N ATOM 1796 CA THR A 112 20.767 13.276 -35.544 1.00 42.24 C ATOM 1797 C THR A 112 21.824 13.802 -36.510 1.00 34.42 C ATOM 1798 O THR A 112 21.537 14.061 -37.678 1.00 1.31 O ATOM 1799 CB THR A 112 19.979 14.466 -34.967 1.00 0.33 C ATOM 1800 OG1 THR A 112 19.098 14.015 -33.931 1.00 44.12 O ATOM 1801 CG2 THR A 112 19.176 15.163 -36.054 1.00 71.24 C ATOM 0 H THR A 112 21.638 13.005 -33.656 1.00 71.43 H new ATOM 0 HA THR A 112 20.080 12.621 -36.081 1.00 42.24 H new ATOM 0 HB THR A 112 20.693 15.178 -34.552 1.00 0.33 H new ATOM 0 HG1 THR A 112 19.620 13.785 -33.134 1.00 44.12 H new ATOM 0 HG21 THR A 112 18.628 16.000 -35.621 1.00 71.24 H new ATOM 0 HG22 THR A 112 19.852 15.532 -36.826 1.00 71.24 H new ATOM 0 HG23 THR A 112 18.472 14.458 -36.495 1.00 71.24 H new ATOM 1809 N GLY A 113 23.048 13.955 -36.015 1.00 23.05 N ATOM 1810 CA GLY A 113 24.129 14.448 -36.848 1.00 33.15 C ATOM 1811 C GLY A 113 24.943 13.328 -37.463 1.00 44.33 C ATOM 1812 O GLY A 113 26.110 13.516 -37.813 1.00 55.40 O ATOM 0 H GLY A 113 23.310 13.746 -35.052 1.00 23.05 H new ATOM 0 HA2 GLY A 113 23.717 15.072 -37.641 1.00 33.15 H new ATOM 0 HA3 GLY A 113 24.783 15.083 -36.251 1.00 33.15 H new ATOM 1816 N THR A 114 24.330 12.155 -37.596 1.00 4.50 N ATOM 1817 CA THR A 114 25.007 11.000 -38.171 1.00 14.32 C ATOM 1818 C THR A 114 24.487 10.699 -39.571 1.00 50.23 C ATOM 1819 O THR A 114 25.221 10.196 -40.421 1.00 40.24 O ATOM 1820 CB THR A 114 24.829 9.749 -37.289 1.00 71.23 C ATOM 1821 OG1 THR A 114 25.624 8.673 -37.799 1.00 45.22 O ATOM 1822 CG2 THR A 114 23.369 9.327 -37.239 1.00 34.32 C ATOM 0 H THR A 114 23.366 11.981 -37.313 1.00 4.50 H new ATOM 0 HA THR A 114 26.067 11.249 -38.226 1.00 14.32 H new ATOM 0 HB THR A 114 25.156 9.994 -36.278 1.00 71.23 H new ATOM 0 HG1 THR A 114 25.507 7.882 -37.232 1.00 45.22 H new ATOM 0 HG21 THR A 114 23.267 8.442 -36.611 1.00 34.32 H new ATOM 0 HG22 THR A 114 22.770 10.137 -36.824 1.00 34.32 H new ATOM 0 HG23 THR A 114 23.022 9.099 -38.247 1.00 34.32 H new ATOM 1830 N ALA A 115 23.217 11.011 -39.805 1.00 71.14 N ATOM 1831 CA ALA A 115 22.599 10.777 -41.105 1.00 61.42 C ATOM 1832 C ALA A 115 23.322 11.548 -42.204 1.00 11.30 C ATOM 1833 O ALA A 115 23.298 11.155 -43.370 1.00 14.33 O ATOM 1834 CB ALA A 115 21.128 11.161 -41.068 1.00 14.24 C ATOM 0 H ALA A 115 22.595 11.427 -39.111 1.00 71.14 H new ATOM 0 HA ALA A 115 22.679 9.714 -41.331 1.00 61.42 H new ATOM 0 HB1 ALA A 115 20.680 10.981 -42.045 1.00 14.24 H new ATOM 0 HB2 ALA A 115 20.614 10.561 -40.317 1.00 14.24 H new ATOM 0 HB3 ALA A 115 21.034 12.217 -40.815 1.00 14.24 H new ATOM 1840 N GLU A 116 23.965 12.648 -41.823 1.00 41.10 N ATOM 1841 CA GLU A 116 24.694 13.475 -42.778 1.00 14.11 C ATOM 1842 C GLU A 116 26.183 13.139 -42.764 1.00 12.01 C ATOM 1843 O GLU A 116 27.023 13.977 -43.091 1.00 53.14 O ATOM 1844 CB GLU A 116 24.491 14.958 -42.461 1.00 60.34 C ATOM 1845 CG GLU A 116 24.645 15.866 -43.670 1.00 71.32 C ATOM 1846 CD GLU A 116 23.388 15.929 -44.516 1.00 12.13 C ATOM 1847 OE1 GLU A 116 22.578 14.982 -44.445 1.00 73.03 O ATOM 1848 OE2 GLU A 116 23.215 16.925 -45.248 1.00 64.13 O ATOM 0 H GLU A 116 23.996 12.987 -40.861 1.00 41.10 H new ATOM 0 HA GLU A 116 24.302 13.267 -43.774 1.00 14.11 H new ATOM 0 HB2 GLU A 116 23.497 15.097 -42.037 1.00 60.34 H new ATOM 0 HB3 GLU A 116 25.208 15.259 -41.697 1.00 60.34 H new ATOM 0 HG2 GLU A 116 24.904 16.870 -43.335 1.00 71.32 H new ATOM 0 HG3 GLU A 116 25.474 15.511 -44.283 1.00 71.32 H new ATOM 1855 N LYS A 117 26.502 11.908 -42.380 1.00 31.20 N ATOM 1856 CA LYS A 117 27.888 11.459 -42.322 1.00 53.01 C ATOM 1857 C LYS A 117 28.029 10.055 -42.900 1.00 43.12 C ATOM 1858 O LYS A 117 28.855 9.817 -43.781 1.00 52.04 O ATOM 1859 CB LYS A 117 28.393 11.481 -40.878 1.00 12.21 C ATOM 1860 CG LYS A 117 28.934 12.832 -40.443 1.00 71.15 C ATOM 1861 CD LYS A 117 29.445 12.793 -39.013 1.00 15.53 C ATOM 1862 CE LYS A 117 29.809 14.183 -38.514 1.00 5.31 C ATOM 1863 NZ LYS A 117 31.079 14.674 -39.119 1.00 0.13 N ATOM 0 H LYS A 117 25.819 11.203 -42.104 1.00 31.20 H new ATOM 0 HA LYS A 117 28.490 12.142 -42.921 1.00 53.01 H new ATOM 0 HB2 LYS A 117 27.579 11.194 -40.213 1.00 12.21 H new ATOM 0 HB3 LYS A 117 29.176 10.732 -40.765 1.00 12.21 H new ATOM 0 HG2 LYS A 117 29.741 13.134 -41.111 1.00 71.15 H new ATOM 0 HG3 LYS A 117 28.150 13.584 -40.530 1.00 71.15 H new ATOM 0 HD2 LYS A 117 28.683 12.360 -38.365 1.00 15.53 H new ATOM 0 HD3 LYS A 117 30.319 12.144 -38.955 1.00 15.53 H new ATOM 0 HE2 LYS A 117 29.002 14.877 -38.750 1.00 5.31 H new ATOM 0 HE3 LYS A 117 29.907 14.165 -37.429 1.00 5.31 H new ATOM 0 HZ1 LYS A 117 31.293 15.624 -38.754 1.00 0.13 H new ATOM 0 HZ2 LYS A 117 31.854 14.026 -38.873 1.00 0.13 H new ATOM 0 HZ3 LYS A 117 30.978 14.715 -40.153 1.00 0.13 H new ATOM 1877 N MET A 118 27.218 9.129 -42.399 1.00 51.34 N ATOM 1878 CA MET A 118 27.252 7.748 -42.869 1.00 14.34 C ATOM 1879 C MET A 118 26.200 7.516 -43.948 1.00 74.23 C ATOM 1880 O MET A 118 25.218 8.250 -44.062 1.00 4.22 O ATOM 1881 CB MET A 118 27.025 6.785 -41.703 1.00 33.24 C ATOM 1882 CG MET A 118 28.313 6.277 -41.074 1.00 72.21 C ATOM 1883 SD MET A 118 28.733 7.147 -39.552 1.00 13.24 S ATOM 1884 CE MET A 118 30.504 6.892 -39.494 1.00 2.25 C ATOM 0 H MET A 118 26.530 9.309 -41.668 1.00 51.34 H new ATOM 0 HA MET A 118 28.236 7.560 -43.299 1.00 14.34 H new ATOM 0 HB2 MET A 118 26.430 7.286 -40.939 1.00 33.24 H new ATOM 0 HB3 MET A 118 26.441 5.934 -42.054 1.00 33.24 H new ATOM 0 HG2 MET A 118 28.215 5.212 -40.864 1.00 72.21 H new ATOM 0 HG3 MET A 118 29.129 6.387 -41.788 1.00 72.21 H new ATOM 0 HE1 MET A 118 30.912 7.373 -38.605 1.00 2.25 H new ATOM 0 HE2 MET A 118 30.717 5.824 -39.458 1.00 2.25 H new ATOM 0 HE3 MET A 118 30.963 7.324 -40.383 1.00 2.25 H new ATOM 1894 N PRO A 119 26.407 6.469 -44.762 1.00 14.01 N ATOM 1895 CA PRO A 119 25.486 6.115 -45.846 1.00 52.22 C ATOM 1896 C PRO A 119 24.159 5.575 -45.327 1.00 70.42 C ATOM 1897 O PRO A 119 24.126 4.786 -44.382 1.00 53.14 O ATOM 1898 CB PRO A 119 26.243 5.029 -46.614 1.00 52.11 C ATOM 1899 CG PRO A 119 27.168 4.431 -45.611 1.00 32.21 C ATOM 1900 CD PRO A 119 27.555 5.551 -44.684 1.00 72.35 C ATOM 0 HA PRO A 119 25.221 6.980 -46.454 1.00 52.22 H new ATOM 0 HB2 PRO A 119 25.561 4.281 -47.018 1.00 52.11 H new ATOM 0 HB3 PRO A 119 26.791 5.449 -47.457 1.00 52.11 H new ATOM 0 HG2 PRO A 119 26.682 3.623 -45.065 1.00 32.21 H new ATOM 0 HG3 PRO A 119 28.046 4.005 -46.096 1.00 32.21 H new ATOM 0 HD2 PRO A 119 27.716 5.194 -43.667 1.00 72.35 H new ATOM 0 HD3 PRO A 119 28.479 6.035 -45.002 1.00 72.35 H new ATOM 1908 N SER A 120 23.065 6.002 -45.950 1.00 1.41 N ATOM 1909 CA SER A 120 21.735 5.563 -45.548 1.00 52.02 C ATOM 1910 C SER A 120 21.052 4.797 -46.676 1.00 74.13 C ATOM 1911 O SER A 120 21.301 5.050 -47.856 1.00 24.43 O ATOM 1912 CB SER A 120 20.879 6.764 -45.141 1.00 31.12 C ATOM 1913 OG SER A 120 21.690 7.858 -44.749 1.00 54.24 O ATOM 0 H SER A 120 23.074 6.652 -46.736 1.00 1.41 H new ATOM 0 HA SER A 120 21.843 4.896 -44.692 1.00 52.02 H new ATOM 0 HB2 SER A 120 20.242 7.060 -45.974 1.00 31.12 H new ATOM 0 HB3 SER A 120 20.220 6.483 -44.320 1.00 31.12 H new ATOM 0 HG SER A 120 21.120 8.614 -44.495 1.00 54.24 H new ATOM 1919 N THR A 121 20.187 3.857 -46.307 1.00 64.11 N ATOM 1920 CA THR A 121 19.468 3.052 -47.286 1.00 32.33 C ATOM 1921 C THR A 121 17.964 3.099 -47.039 1.00 64.42 C ATOM 1922 O THR A 121 17.504 2.898 -45.915 1.00 62.03 O ATOM 1923 CB THR A 121 19.936 1.584 -47.259 1.00 72.23 C ATOM 1924 OG1 THR A 121 20.117 1.152 -45.906 1.00 13.21 O ATOM 1925 CG2 THR A 121 21.237 1.416 -48.029 1.00 51.11 C ATOM 0 H THR A 121 19.968 3.635 -45.336 1.00 64.11 H new ATOM 0 HA THR A 121 19.686 3.477 -48.266 1.00 32.33 H new ATOM 0 HB THR A 121 19.169 0.973 -47.735 1.00 72.23 H new ATOM 0 HG1 THR A 121 20.413 0.218 -45.898 1.00 13.21 H new ATOM 0 HG21 THR A 121 21.547 0.372 -47.996 1.00 51.11 H new ATOM 0 HG22 THR A 121 21.088 1.717 -49.066 1.00 51.11 H new ATOM 0 HG23 THR A 121 22.010 2.039 -47.578 1.00 51.11 H new ATOM 1933 N SER A 122 17.204 3.364 -48.096 1.00 53.43 N ATOM 1934 CA SER A 122 15.752 3.441 -47.993 1.00 14.31 C ATOM 1935 C SER A 122 15.117 2.074 -48.233 1.00 42.24 C ATOM 1936 O SER A 122 15.764 1.157 -48.738 1.00 0.52 O ATOM 1937 CB SER A 122 15.200 4.455 -48.997 1.00 5.22 C ATOM 1938 OG SER A 122 13.933 4.940 -48.589 1.00 71.20 O ATOM 0 H SER A 122 17.570 3.529 -49.034 1.00 53.43 H new ATOM 0 HA SER A 122 15.502 3.767 -46.984 1.00 14.31 H new ATOM 0 HB2 SER A 122 15.896 5.288 -49.098 1.00 5.22 H new ATOM 0 HB3 SER A 122 15.116 3.990 -49.979 1.00 5.22 H new ATOM 0 HG SER A 122 13.603 5.587 -49.247 1.00 71.20 H new ATOM 1944 N ARG A 123 13.846 1.947 -47.868 1.00 20.24 N ATOM 1945 CA ARG A 123 13.123 0.692 -48.041 1.00 50.23 C ATOM 1946 C ARG A 123 12.586 0.567 -49.464 1.00 61.03 C ATOM 1947 O ARG A 123 12.241 1.555 -50.112 1.00 43.23 O ATOM 1948 CB ARG A 123 11.970 0.600 -47.039 1.00 50.45 C ATOM 1949 CG ARG A 123 10.903 1.664 -47.239 1.00 43.53 C ATOM 1950 CD ARG A 123 9.505 1.091 -47.068 1.00 1.32 C ATOM 1951 NE ARG A 123 8.531 1.757 -47.929 1.00 21.15 N ATOM 1952 CZ ARG A 123 7.353 1.232 -48.248 1.00 63.03 C ATOM 1953 NH1 ARG A 123 7.006 0.040 -47.782 1.00 33.04 N ATOM 1954 NH2 ARG A 123 6.521 1.898 -49.037 1.00 40.42 N ATOM 0 H ARG A 123 13.295 2.697 -47.451 1.00 20.24 H new ATOM 0 HA ARG A 123 13.818 -0.127 -47.860 1.00 50.23 H new ATOM 0 HB2 ARG A 123 11.509 -0.384 -47.118 1.00 50.45 H new ATOM 0 HB3 ARG A 123 12.370 0.684 -46.029 1.00 50.45 H new ATOM 0 HG2 ARG A 123 11.056 2.473 -46.524 1.00 43.53 H new ATOM 0 HG3 ARG A 123 11.001 2.096 -48.235 1.00 43.53 H new ATOM 0 HD2 ARG A 123 9.520 0.025 -47.295 1.00 1.32 H new ATOM 0 HD3 ARG A 123 9.197 1.191 -46.027 1.00 1.32 H new ATOM 0 HE ARG A 123 8.768 2.675 -48.306 1.00 21.15 H new ATOM 0 HH11 ARG A 123 7.644 -0.477 -47.177 1.00 33.04 H new ATOM 0 HH12 ARG A 123 6.101 -0.360 -48.029 1.00 33.04 H new ATOM 0 HH21 ARG A 123 6.785 2.814 -49.399 1.00 40.42 H new ATOM 0 HH22 ARG A 123 5.617 1.494 -49.281 1.00 40.42 H new ATOM 1968 N PRO A 124 12.514 -0.676 -49.961 1.00 50.34 N ATOM 1969 CA PRO A 124 12.021 -0.961 -51.313 1.00 15.02 C ATOM 1970 C PRO A 124 10.521 -0.715 -51.445 1.00 50.41 C ATOM 1971 O PRO A 124 9.837 -0.435 -50.460 1.00 72.21 O ATOM 1972 CB PRO A 124 12.337 -2.446 -51.501 1.00 2.21 C ATOM 1973 CG PRO A 124 12.379 -3.003 -50.120 1.00 13.23 C ATOM 1974 CD PRO A 124 12.909 -1.900 -49.245 1.00 72.50 C ATOM 0 HA PRO A 124 12.483 -0.316 -52.060 1.00 15.02 H new ATOM 0 HB2 PRO A 124 11.575 -2.940 -52.104 1.00 2.21 H new ATOM 0 HB3 PRO A 124 13.289 -2.586 -52.013 1.00 2.21 H new ATOM 0 HG2 PRO A 124 11.387 -3.316 -49.795 1.00 13.23 H new ATOM 0 HG3 PRO A 124 13.022 -3.882 -50.073 1.00 13.23 H new ATOM 0 HD2 PRO A 124 12.477 -1.938 -48.245 1.00 72.50 H new ATOM 0 HD3 PRO A 124 13.991 -1.965 -49.127 1.00 72.50 H new ATOM 1982 N THR A 125 10.015 -0.821 -52.670 1.00 10.02 N ATOM 1983 CA THR A 125 8.597 -0.610 -52.932 1.00 54.14 C ATOM 1984 C THR A 125 7.892 -1.927 -53.236 1.00 52.41 C ATOM 1985 O THR A 125 8.533 -2.921 -53.574 1.00 60.20 O ATOM 1986 CB THR A 125 8.382 0.359 -54.110 1.00 74.15 C ATOM 1987 OG1 THR A 125 9.541 1.181 -54.286 1.00 55.03 O ATOM 1988 CG2 THR A 125 7.161 1.236 -53.873 1.00 3.32 C ATOM 0 H THR A 125 10.567 -1.052 -53.496 1.00 10.02 H new ATOM 0 HA THR A 125 8.170 -0.173 -52.029 1.00 54.14 H new ATOM 0 HB THR A 125 8.216 -0.230 -55.012 1.00 74.15 H new ATOM 0 HG1 THR A 125 9.397 1.793 -55.038 1.00 55.03 H new ATOM 0 HG21 THR A 125 7.029 1.912 -54.718 1.00 3.32 H new ATOM 0 HG22 THR A 125 6.276 0.608 -53.769 1.00 3.32 H new ATOM 0 HG23 THR A 125 7.302 1.817 -52.962 1.00 3.32 H new ATOM 1996 N ALA A 126 6.568 -1.926 -53.114 1.00 64.33 N ATOM 1997 CA ALA A 126 5.776 -3.121 -53.379 1.00 2.32 C ATOM 1998 C ALA A 126 5.361 -3.190 -54.844 1.00 42.12 C ATOM 1999 O ALA A 126 5.142 -2.172 -55.502 1.00 21.12 O ATOM 2000 CB ALA A 126 4.550 -3.151 -52.479 1.00 21.31 C ATOM 0 H ALA A 126 6.022 -1.111 -52.834 1.00 64.33 H new ATOM 0 HA ALA A 126 6.394 -3.992 -53.162 1.00 2.32 H new ATOM 0 HB1 ALA A 126 3.968 -4.048 -52.687 1.00 21.31 H new ATOM 0 HB2 ALA A 126 4.865 -3.157 -51.435 1.00 21.31 H new ATOM 0 HB3 ALA A 126 3.938 -2.269 -52.668 1.00 21.31 H new ATOM 2006 N PRO A 127 5.249 -4.419 -55.371 1.00 42.13 N ATOM 2007 CA PRO A 127 4.860 -4.650 -56.765 1.00 75.20 C ATOM 2008 C PRO A 127 3.398 -4.300 -57.025 1.00 12.23 C ATOM 2009 O PRO A 127 2.686 -3.863 -56.121 1.00 53.54 O ATOM 2010 CB PRO A 127 5.092 -6.151 -56.955 1.00 34.43 C ATOM 2011 CG PRO A 127 4.973 -6.728 -55.586 1.00 14.42 C ATOM 2012 CD PRO A 127 5.496 -5.676 -54.647 1.00 32.44 C ATOM 0 HA PRO A 127 5.429 -4.026 -57.455 1.00 75.20 H new ATOM 0 HB2 PRO A 127 4.355 -6.583 -57.632 1.00 34.43 H new ATOM 0 HB3 PRO A 127 6.074 -6.349 -57.384 1.00 34.43 H new ATOM 0 HG2 PRO A 127 3.937 -6.976 -55.356 1.00 14.42 H new ATOM 0 HG3 PRO A 127 5.549 -7.650 -55.499 1.00 14.42 H new ATOM 0 HD2 PRO A 127 4.975 -5.697 -53.690 1.00 32.44 H new ATOM 0 HD3 PRO A 127 6.556 -5.817 -54.436 1.00 32.44 H new ATOM 2020 N SER A 128 2.958 -4.495 -58.263 1.00 52.02 N ATOM 2021 CA SER A 128 1.581 -4.197 -58.641 1.00 44.55 C ATOM 2022 C SER A 128 1.186 -4.964 -59.899 1.00 40.24 C ATOM 2023 O SER A 128 1.983 -5.114 -60.825 1.00 41.12 O ATOM 2024 CB SER A 128 1.408 -2.695 -58.871 1.00 11.43 C ATOM 2025 OG SER A 128 2.311 -1.949 -58.073 1.00 31.23 O ATOM 0 H SER A 128 3.535 -4.858 -59.022 1.00 52.02 H new ATOM 0 HA SER A 128 0.929 -4.510 -57.825 1.00 44.55 H new ATOM 0 HB2 SER A 128 1.572 -2.464 -59.924 1.00 11.43 H new ATOM 0 HB3 SER A 128 0.384 -2.404 -58.636 1.00 11.43 H new ATOM 0 HG SER A 128 2.181 -0.992 -58.240 1.00 31.23 H new ATOM 2031 N SER A 129 -0.052 -5.447 -59.925 1.00 64.42 N ATOM 2032 CA SER A 129 -0.554 -6.203 -61.067 1.00 54.01 C ATOM 2033 C SER A 129 -2.026 -6.556 -60.879 1.00 73.43 C ATOM 2034 O SER A 129 -2.544 -6.533 -59.764 1.00 0.12 O ATOM 2035 CB SER A 129 0.267 -7.479 -61.263 1.00 22.01 C ATOM 2036 OG SER A 129 1.269 -7.294 -62.248 1.00 60.23 O ATOM 0 H SER A 129 -0.726 -5.328 -59.169 1.00 64.42 H new ATOM 0 HA SER A 129 -0.458 -5.578 -61.955 1.00 54.01 H new ATOM 0 HB2 SER A 129 0.729 -7.766 -60.319 1.00 22.01 H new ATOM 0 HB3 SER A 129 -0.391 -8.297 -61.558 1.00 22.01 H new ATOM 0 HG SER A 129 1.793 -6.493 -62.036 1.00 60.23 H new ATOM 2042 N GLU A 130 -2.695 -6.882 -61.982 1.00 20.43 N ATOM 2043 CA GLU A 130 -4.108 -7.240 -61.939 1.00 51.42 C ATOM 2044 C GLU A 130 -4.290 -8.690 -61.500 1.00 41.15 C ATOM 2045 O GLU A 130 -4.863 -8.965 -60.446 1.00 32.23 O ATOM 2046 CB GLU A 130 -4.753 -7.026 -63.311 1.00 23.34 C ATOM 2047 CG GLU A 130 -5.841 -5.965 -63.312 1.00 43.13 C ATOM 2048 CD GLU A 130 -6.357 -5.662 -64.706 1.00 25.12 C ATOM 2049 OE1 GLU A 130 -5.809 -6.224 -65.677 1.00 70.23 O ATOM 2050 OE2 GLU A 130 -7.309 -4.862 -64.824 1.00 63.44 O ATOM 0 H GLU A 130 -2.281 -6.905 -62.914 1.00 20.43 H new ATOM 0 HA GLU A 130 -4.598 -6.594 -61.210 1.00 51.42 H new ATOM 0 HB2 GLU A 130 -3.981 -6.743 -64.026 1.00 23.34 H new ATOM 0 HB3 GLU A 130 -5.177 -7.969 -63.655 1.00 23.34 H new ATOM 0 HG2 GLU A 130 -6.669 -6.298 -62.686 1.00 43.13 H new ATOM 0 HG3 GLU A 130 -5.452 -5.050 -62.865 1.00 43.13 H new ATOM 2057 N LYS A 131 -3.798 -9.615 -62.318 1.00 33.52 N ATOM 2058 CA LYS A 131 -3.905 -11.038 -62.015 1.00 41.14 C ATOM 2059 C LYS A 131 -2.528 -11.644 -61.760 1.00 12.42 C ATOM 2060 O LYS A 131 -1.514 -11.125 -62.225 1.00 14.25 O ATOM 2061 CB LYS A 131 -4.593 -11.774 -63.168 1.00 25.25 C ATOM 2062 CG LYS A 131 -3.716 -11.934 -64.397 1.00 42.44 C ATOM 2063 CD LYS A 131 -4.493 -11.668 -65.675 1.00 32.34 C ATOM 2064 CE LYS A 131 -4.136 -10.316 -66.273 1.00 53.32 C ATOM 2065 NZ LYS A 131 -4.314 -10.301 -67.752 1.00 4.55 N ATOM 0 H LYS A 131 -3.322 -9.405 -63.195 1.00 33.52 H new ATOM 0 HA LYS A 131 -4.504 -11.149 -61.111 1.00 41.14 H new ATOM 0 HB2 LYS A 131 -4.905 -12.760 -62.824 1.00 25.25 H new ATOM 0 HB3 LYS A 131 -5.497 -11.232 -63.445 1.00 25.25 H new ATOM 0 HG2 LYS A 131 -2.871 -11.248 -64.334 1.00 42.44 H new ATOM 0 HG3 LYS A 131 -3.305 -12.943 -64.423 1.00 42.44 H new ATOM 0 HD2 LYS A 131 -4.283 -12.454 -66.400 1.00 32.34 H new ATOM 0 HD3 LYS A 131 -5.562 -11.704 -65.466 1.00 32.34 H new ATOM 0 HE2 LYS A 131 -4.760 -9.544 -65.824 1.00 53.32 H new ATOM 0 HE3 LYS A 131 -3.102 -10.072 -66.029 1.00 53.32 H new ATOM 0 HZ1 LYS A 131 -4.061 -9.363 -68.123 1.00 4.55 H new ATOM 0 HZ2 LYS A 131 -3.700 -11.021 -68.183 1.00 4.55 H new ATOM 0 HZ3 LYS A 131 -5.306 -10.509 -67.984 1.00 4.55 H new ATOM 2079 N GLY A 132 -2.501 -12.748 -61.019 1.00 32.42 N ATOM 2080 CA GLY A 132 -1.243 -13.407 -60.717 1.00 35.32 C ATOM 2081 C GLY A 132 -1.428 -14.638 -59.850 1.00 51.23 C ATOM 2082 O GLY A 132 -2.163 -14.606 -58.865 1.00 33.32 O ATOM 0 H GLY A 132 -3.327 -13.197 -60.623 1.00 32.42 H new ATOM 0 HA2 GLY A 132 -0.753 -13.692 -61.648 1.00 35.32 H new ATOM 0 HA3 GLY A 132 -0.581 -12.705 -60.210 1.00 35.32 H new ATOM 2086 N GLY A 133 -0.759 -15.726 -60.220 1.00 14.12 N ATOM 2087 CA GLY A 133 -0.868 -16.957 -59.460 1.00 1.20 C ATOM 2088 C GLY A 133 0.295 -17.155 -58.509 1.00 64.32 C ATOM 2089 O GLY A 133 0.688 -18.286 -58.225 1.00 72.53 O ATOM 0 H GLY A 133 -0.144 -15.777 -61.032 1.00 14.12 H new ATOM 0 HA2 GLY A 133 -1.799 -16.950 -58.894 1.00 1.20 H new ATOM 0 HA3 GLY A 133 -0.919 -17.801 -60.147 1.00 1.20 H new ATOM 2093 N ASN A 134 0.850 -16.053 -58.016 1.00 34.44 N ATOM 2094 CA ASN A 134 1.977 -16.112 -57.092 1.00 41.21 C ATOM 2095 C ASN A 134 1.804 -15.105 -55.959 1.00 14.24 C ATOM 2096 O ASN A 134 2.715 -14.335 -55.654 1.00 21.54 O ATOM 2097 CB ASN A 134 3.287 -15.840 -57.836 1.00 14.22 C ATOM 2098 CG ASN A 134 3.649 -16.956 -58.794 1.00 62.24 C ATOM 2099 OD1 ASN A 134 3.257 -18.108 -58.603 1.00 12.25 O ATOM 2100 ND2 ASN A 134 4.404 -16.622 -59.835 1.00 52.14 N ATOM 0 H ASN A 134 0.538 -15.108 -58.241 1.00 34.44 H new ATOM 0 HA ASN A 134 2.012 -17.113 -56.662 1.00 41.21 H new ATOM 0 HB2 ASN A 134 3.200 -14.904 -58.388 1.00 14.22 H new ATOM 0 HB3 ASN A 134 4.092 -15.710 -57.113 1.00 14.22 H new ATOM 0 HD21 ASN A 134 4.680 -17.332 -60.513 1.00 52.14 H new ATOM 0 HD22 ASN A 134 4.707 -15.656 -59.956 1.00 52.14 H new ATOM 2107 N TYR A 135 0.630 -15.118 -55.338 1.00 12.12 N ATOM 2108 CA TYR A 135 0.336 -14.206 -54.239 1.00 4.42 C ATOM 2109 C TYR A 135 1.273 -14.453 -53.061 1.00 51.02 C ATOM 2110 O TYR A 135 2.242 -13.722 -52.862 1.00 63.21 O ATOM 2111 CB TYR A 135 -1.117 -14.364 -53.791 1.00 54.11 C ATOM 2112 CG TYR A 135 -2.078 -13.452 -54.520 1.00 73.22 C ATOM 2113 CD1 TYR A 135 -2.693 -13.857 -55.698 1.00 43.23 C ATOM 2114 CD2 TYR A 135 -2.373 -12.186 -54.029 1.00 15.14 C ATOM 2115 CE1 TYR A 135 -3.571 -13.026 -56.368 1.00 70.44 C ATOM 2116 CE2 TYR A 135 -3.252 -11.349 -54.691 1.00 25.43 C ATOM 2117 CZ TYR A 135 -3.847 -11.775 -55.861 1.00 13.44 C ATOM 2118 OH TYR A 135 -4.723 -10.945 -56.523 1.00 42.04 O ATOM 0 H TYR A 135 -0.134 -15.750 -55.577 1.00 12.12 H new ATOM 0 HA TYR A 135 0.490 -13.187 -54.595 1.00 4.42 H new ATOM 0 HB2 TYR A 135 -1.425 -15.399 -53.943 1.00 54.11 H new ATOM 0 HB3 TYR A 135 -1.182 -14.166 -52.721 1.00 54.11 H new ATOM 0 HD1 TYR A 135 -2.481 -14.838 -56.097 1.00 43.23 H new ATOM 0 HD2 TYR A 135 -1.907 -11.850 -53.114 1.00 15.14 H new ATOM 0 HE1 TYR A 135 -4.038 -13.356 -57.284 1.00 70.44 H new ATOM 0 HE2 TYR A 135 -3.472 -10.368 -54.295 1.00 25.43 H new ATOM 0 HH TYR A 135 -4.808 -10.101 -56.033 1.00 42.04 H new TER 2128 TYR A 135