USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1000 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 106 SER OG : rot 126:sc= 0.0471 USER MOD Set 1.2: A 136 SER OG : rot 180:sc= 0.0492 USER MOD Set 2.1: A 44 CYS SG : rot -72:sc= -1.66 USER MOD Set 2.2: A 99 CYS SG : rot 180:sc= -0.522 USER MOD Set 3.1: A 11 GLN : amide:sc= -1.28 K(o=-1.3,f=-5.7!) USER MOD Set 3.2: A 38 SER OG : rot -151:sc= 0.0212 USER MOD Single : A 1 GLY N :NH3+ -119:sc= 0.115 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -1.06 K(o=-1.1,f=0.63) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 HIS : no HD1:sc= -5.9! C(o=-5.9!,f=-4.1!) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.274 USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot -43:sc= -3.05! USER MOD Single : A 23 CYS SG : rot 180:sc= -0.856 USER MOD Single : A 24 GLN : amide:sc= -0.0319 X(o=-0.032,f=-0.23) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.61 USER MOD Single : A 37 THR OG1 : rot 50:sc= 1.21 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 HIS : no HD1:sc= -7! C(o=-7!,f=-5.9!) USER MOD Single : A 46 CYS SG : rot 180:sc= -0.316 USER MOD Single : A 47 TYR OH : rot -152:sc= -1.17 USER MOD Single : A 49 GLN : amide:sc= -0.304 K(o=-0.3,f=-2.8!) USER MOD Single : A 51 SER OG : rot 180:sc= -0.37 USER MOD Single : A 54 ASN : amide:sc= -6.69! C(o=-6.7!,f=-14!) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.0108 X(o=-0.011,f=-0.064) USER MOD Single : A 63 THR OG1 : rot 120:sc= 0.815 USER MOD Single : A 66 LYS NZ :NH3+ 158:sc= 0.335 (180deg=0.151) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.0664 K(o=-0.066,f=-0.73) USER MOD Single : A 71 HIS : no HE2:sc= -1.81 K(o=-1.8,f=-3.6!) USER MOD Single : A 72 THR OG1 : rot -114:sc= 0.0537 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot -152:sc= -2.72! USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.303 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.18 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0552 USER MOD Single : A 103 SER OG : rot -54:sc= 0.0914 USER MOD Single : A 105 HIS : no HD1:sc= -0.0311 X(o=-0.031,f=0) USER MOD Single : A 118 THR OG1 : rot 111:sc= 1.1 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -0.383 K(o=-0.38,f=-1.2) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 56:sc= 0.322 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.511 15.015 27.136 1.00 0.00 N ATOM 2 CA GLY A 1 24.372 16.075 26.151 1.00 0.00 C ATOM 3 C GLY A 1 25.356 15.882 24.996 1.00 0.00 C ATOM 4 O GLY A 1 26.192 14.980 25.031 1.00 0.00 O ATOM 0 H1 GLY A 1 23.615 14.492 27.212 1.00 0.00 H new ATOM 0 H2 GLY A 1 25.267 14.365 26.842 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.750 15.429 28.060 1.00 0.00 H new ATOM 0 HA2 GLY A 1 23.352 16.088 25.766 1.00 0.00 H new ATOM 0 HA3 GLY A 1 24.546 17.041 26.624 1.00 0.00 H new ATOM 8 N SER A 2 25.225 16.744 23.999 1.00 0.00 N ATOM 9 CA SER A 2 26.092 16.680 22.834 1.00 0.00 C ATOM 10 C SER A 2 25.905 15.343 22.116 1.00 0.00 C ATOM 11 O SER A 2 26.009 14.283 22.732 1.00 0.00 O ATOM 12 CB SER A 2 27.558 16.870 23.229 1.00 0.00 C ATOM 13 OG SER A 2 27.972 18.228 23.105 1.00 0.00 O ATOM 0 H SER A 2 24.531 17.491 23.973 1.00 0.00 H new ATOM 0 HA SER A 2 25.818 17.490 22.158 1.00 0.00 H new ATOM 0 HB2 SER A 2 27.702 16.539 24.258 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.188 16.240 22.600 1.00 0.00 H new ATOM 0 HG SER A 2 28.913 18.309 23.368 1.00 0.00 H new ATOM 19 N SER A 3 25.632 15.435 20.822 1.00 0.00 N ATOM 20 CA SER A 3 25.430 14.246 20.013 1.00 0.00 C ATOM 21 C SER A 3 25.845 14.520 18.566 1.00 0.00 C ATOM 22 O SER A 3 26.787 13.911 18.061 1.00 0.00 O ATOM 23 CB SER A 3 23.972 13.783 20.068 1.00 0.00 C ATOM 24 OG SER A 3 23.865 12.368 20.197 1.00 0.00 O ATOM 0 H SER A 3 25.546 16.316 20.314 1.00 0.00 H new ATOM 0 HA SER A 3 26.052 13.448 20.418 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.471 14.262 20.909 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.455 14.105 19.164 1.00 0.00 H new ATOM 0 HG SER A 3 22.919 12.113 20.230 1.00 0.00 H new ATOM 30 N GLY A 4 25.122 15.437 17.940 1.00 0.00 N ATOM 31 CA GLY A 4 25.404 15.799 16.562 1.00 0.00 C ATOM 32 C GLY A 4 24.109 15.974 15.765 1.00 0.00 C ATOM 33 O GLY A 4 23.016 15.857 16.317 1.00 0.00 O ATOM 0 H GLY A 4 24.341 15.940 18.362 1.00 0.00 H new ATOM 0 HA2 GLY A 4 25.979 16.724 16.536 1.00 0.00 H new ATOM 0 HA3 GLY A 4 26.019 15.028 16.098 1.00 0.00 H new ATOM 37 N SER A 5 24.275 16.250 14.480 1.00 0.00 N ATOM 38 CA SER A 5 23.133 16.442 13.602 1.00 0.00 C ATOM 39 C SER A 5 23.567 16.302 12.142 1.00 0.00 C ATOM 40 O SER A 5 24.760 16.243 11.848 1.00 0.00 O ATOM 41 CB SER A 5 22.483 17.808 13.834 1.00 0.00 C ATOM 42 OG SER A 5 21.129 17.836 13.394 1.00 0.00 O ATOM 0 H SER A 5 25.183 16.345 14.026 1.00 0.00 H new ATOM 0 HA SER A 5 22.393 15.675 13.830 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.525 18.054 14.895 1.00 0.00 H new ATOM 0 HB3 SER A 5 23.051 18.574 13.307 1.00 0.00 H new ATOM 0 HG SER A 5 20.749 18.724 13.561 1.00 0.00 H new ATOM 48 N SER A 6 22.575 16.253 11.265 1.00 0.00 N ATOM 49 CA SER A 6 22.839 16.122 9.842 1.00 0.00 C ATOM 50 C SER A 6 21.659 16.672 9.038 1.00 0.00 C ATOM 51 O SER A 6 20.508 16.327 9.302 1.00 0.00 O ATOM 52 CB SER A 6 23.105 14.663 9.464 1.00 0.00 C ATOM 53 OG SER A 6 23.591 14.537 8.131 1.00 0.00 O ATOM 0 H SER A 6 21.587 16.302 11.513 1.00 0.00 H new ATOM 0 HA SER A 6 23.732 16.700 9.605 1.00 0.00 H new ATOM 0 HB2 SER A 6 23.830 14.236 10.156 1.00 0.00 H new ATOM 0 HB3 SER A 6 22.185 14.087 9.571 1.00 0.00 H new ATOM 0 HG SER A 6 23.750 13.591 7.929 1.00 0.00 H new ATOM 59 N GLY A 7 21.986 17.518 8.073 1.00 0.00 N ATOM 60 CA GLY A 7 20.968 18.119 7.228 1.00 0.00 C ATOM 61 C GLY A 7 21.268 17.874 5.748 1.00 0.00 C ATOM 62 O GLY A 7 22.227 17.181 5.412 1.00 0.00 O ATOM 0 H GLY A 7 22.942 17.802 7.857 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.992 17.704 7.478 1.00 0.00 H new ATOM 0 HA3 GLY A 7 20.918 19.191 7.420 1.00 0.00 H new ATOM 66 N SER A 8 20.429 18.455 4.903 1.00 0.00 N ATOM 67 CA SER A 8 20.593 18.308 3.467 1.00 0.00 C ATOM 68 C SER A 8 19.677 19.289 2.732 1.00 0.00 C ATOM 69 O SER A 8 18.892 19.999 3.359 1.00 0.00 O ATOM 70 CB SER A 8 20.298 16.873 3.023 1.00 0.00 C ATOM 71 OG SER A 8 21.439 16.249 2.440 1.00 0.00 O ATOM 0 H SER A 8 19.634 19.028 5.185 1.00 0.00 H new ATOM 0 HA SER A 8 21.630 18.532 3.217 1.00 0.00 H new ATOM 0 HB2 SER A 8 19.965 16.289 3.881 1.00 0.00 H new ATOM 0 HB3 SER A 8 19.480 16.877 2.303 1.00 0.00 H new ATOM 0 HG SER A 8 21.210 15.335 2.172 1.00 0.00 H new ATOM 77 N TRP A 9 19.808 19.298 1.414 1.00 0.00 N ATOM 78 CA TRP A 9 19.002 20.180 0.588 1.00 0.00 C ATOM 79 C TRP A 9 19.183 19.758 -0.872 1.00 0.00 C ATOM 80 O TRP A 9 20.306 19.706 -1.372 1.00 0.00 O ATOM 81 CB TRP A 9 19.365 21.646 0.836 1.00 0.00 C ATOM 82 CG TRP A 9 18.247 22.631 0.488 1.00 0.00 C ATOM 83 CD1 TRP A 9 17.173 22.953 1.222 1.00 0.00 C ATOM 84 CD2 TRP A 9 18.136 23.414 -0.720 1.00 0.00 C ATOM 85 NE1 TRP A 9 16.381 23.883 0.579 1.00 0.00 N ATOM 86 CE2 TRP A 9 16.986 24.172 -0.639 1.00 0.00 C ATOM 87 CE3 TRP A 9 18.980 23.480 -1.842 1.00 0.00 C ATOM 88 CZ2 TRP A 9 16.574 25.050 -1.649 1.00 0.00 C ATOM 89 CZ3 TRP A 9 18.554 24.362 -2.843 1.00 0.00 C ATOM 90 CH2 TRP A 9 17.399 25.132 -2.777 1.00 0.00 C ATOM 0 H TRP A 9 20.461 18.708 0.897 1.00 0.00 H new ATOM 0 HA TRP A 9 17.947 20.093 0.847 1.00 0.00 H new ATOM 0 HB2 TRP A 9 19.632 21.771 1.885 1.00 0.00 H new ATOM 0 HB3 TRP A 9 20.250 21.895 0.250 1.00 0.00 H new ATOM 0 HD1 TRP A 9 16.955 22.537 2.194 1.00 0.00 H new ATOM 0 HE1 TRP A 9 15.512 24.284 0.932 1.00 0.00 H new ATOM 0 HE3 TRP A 9 19.885 22.897 -1.926 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 15.669 25.632 -1.562 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 19.166 24.450 -3.728 1.00 0.00 H new ATOM 0 HH2 TRP A 9 17.139 25.791 -3.592 1.00 0.00 H new ATOM 101 N ASN A 10 18.062 19.468 -1.514 1.00 0.00 N ATOM 102 CA ASN A 10 18.083 19.052 -2.906 1.00 0.00 C ATOM 103 C ASN A 10 16.716 18.474 -3.282 1.00 0.00 C ATOM 104 O ASN A 10 15.780 18.517 -2.486 1.00 0.00 O ATOM 105 CB ASN A 10 19.135 17.967 -3.141 1.00 0.00 C ATOM 106 CG ASN A 10 20.253 18.476 -4.053 1.00 0.00 C ATOM 107 OD1 ASN A 10 21.148 19.195 -3.639 1.00 0.00 O ATOM 108 ND2 ASN A 10 20.153 18.064 -5.313 1.00 0.00 N ATOM 0 H ASN A 10 17.133 19.513 -1.096 1.00 0.00 H new ATOM 0 HA ASN A 10 18.322 19.924 -3.515 1.00 0.00 H new ATOM 0 HB2 ASN A 10 19.555 17.650 -2.187 1.00 0.00 H new ATOM 0 HB3 ASN A 10 18.666 17.091 -3.589 1.00 0.00 H new ATOM 0 HD21 ASN A 10 20.851 18.349 -6.000 1.00 0.00 H new ATOM 0 HD22 ASN A 10 19.378 17.463 -5.593 1.00 0.00 H new ATOM 115 N GLN A 11 16.646 17.948 -4.496 1.00 0.00 N ATOM 116 CA GLN A 11 15.410 17.362 -4.987 1.00 0.00 C ATOM 117 C GLN A 11 14.757 16.508 -3.898 1.00 0.00 C ATOM 118 O GLN A 11 15.389 16.191 -2.891 1.00 0.00 O ATOM 119 CB GLN A 11 15.658 16.541 -6.253 1.00 0.00 C ATOM 120 CG GLN A 11 15.969 17.449 -7.445 1.00 0.00 C ATOM 121 CD GLN A 11 17.041 16.828 -8.342 1.00 0.00 C ATOM 122 OE1 GLN A 11 17.255 15.627 -8.359 1.00 0.00 O ATOM 123 NE2 GLN A 11 17.701 17.711 -9.086 1.00 0.00 N ATOM 0 H GLN A 11 17.425 17.915 -5.154 1.00 0.00 H new ATOM 0 HA GLN A 11 14.726 18.170 -5.246 1.00 0.00 H new ATOM 0 HB2 GLN A 11 16.488 15.854 -6.088 1.00 0.00 H new ATOM 0 HB3 GLN A 11 14.781 15.933 -6.474 1.00 0.00 H new ATOM 0 HG2 GLN A 11 15.061 17.620 -8.023 1.00 0.00 H new ATOM 0 HG3 GLN A 11 16.308 18.421 -7.087 1.00 0.00 H new ATOM 0 HE21 GLN A 11 17.472 18.703 -9.024 1.00 0.00 H new ATOM 0 HE22 GLN A 11 18.436 17.396 -9.719 1.00 0.00 H new ATOM 132 N ALA A 12 13.502 16.160 -4.137 1.00 0.00 N ATOM 133 CA ALA A 12 12.757 15.349 -3.189 1.00 0.00 C ATOM 134 C ALA A 12 12.165 14.139 -3.914 1.00 0.00 C ATOM 135 O ALA A 12 11.952 14.179 -5.125 1.00 0.00 O ATOM 136 CB ALA A 12 11.684 16.207 -2.515 1.00 0.00 C ATOM 0 H ALA A 12 12.982 16.425 -4.973 1.00 0.00 H new ATOM 0 HA ALA A 12 13.415 14.974 -2.405 1.00 0.00 H new ATOM 0 HB1 ALA A 12 11.125 15.599 -1.804 1.00 0.00 H new ATOM 0 HB2 ALA A 12 12.158 17.036 -1.989 1.00 0.00 H new ATOM 0 HB3 ALA A 12 11.003 16.599 -3.271 1.00 0.00 H new ATOM 142 N PRO A 13 11.910 13.063 -3.123 1.00 0.00 N ATOM 143 CA PRO A 13 11.348 11.843 -3.676 1.00 0.00 C ATOM 144 C PRO A 13 9.858 12.015 -3.981 1.00 0.00 C ATOM 145 O PRO A 13 9.127 12.621 -3.199 1.00 0.00 O ATOM 146 CB PRO A 13 11.621 10.774 -2.631 1.00 0.00 C ATOM 147 CG PRO A 13 11.907 11.519 -1.338 1.00 0.00 C ATOM 148 CD PRO A 13 12.150 12.979 -1.685 1.00 0.00 C ATOM 0 HA PRO A 13 11.795 11.569 -4.632 1.00 0.00 H new ATOM 0 HB2 PRO A 13 10.764 10.110 -2.518 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.469 10.153 -2.920 1.00 0.00 H new ATOM 0 HG2 PRO A 13 11.067 11.425 -0.650 1.00 0.00 H new ATOM 0 HG3 PRO A 13 12.778 11.095 -0.838 1.00 0.00 H new ATOM 0 HD2 PRO A 13 11.477 13.635 -1.132 1.00 0.00 H new ATOM 0 HD3 PRO A 13 13.167 13.282 -1.435 1.00 0.00 H new ATOM 156 N LYS A 14 9.453 11.471 -5.119 1.00 0.00 N ATOM 157 CA LYS A 14 8.064 11.557 -5.537 1.00 0.00 C ATOM 158 C LYS A 14 7.465 10.150 -5.592 1.00 0.00 C ATOM 159 O LYS A 14 8.166 9.184 -5.890 1.00 0.00 O ATOM 160 CB LYS A 14 7.947 12.328 -6.853 1.00 0.00 C ATOM 161 CG LYS A 14 7.416 13.743 -6.614 1.00 0.00 C ATOM 162 CD LYS A 14 6.650 14.254 -7.836 1.00 0.00 C ATOM 163 CE LYS A 14 7.533 15.160 -8.697 1.00 0.00 C ATOM 164 NZ LYS A 14 6.966 16.526 -8.762 1.00 0.00 N ATOM 0 H LYS A 14 10.062 10.969 -5.765 1.00 0.00 H new ATOM 0 HA LYS A 14 7.482 12.124 -4.811 1.00 0.00 H new ATOM 0 HB2 LYS A 14 8.922 12.379 -7.337 1.00 0.00 H new ATOM 0 HB3 LYS A 14 7.281 11.796 -7.533 1.00 0.00 H new ATOM 0 HG2 LYS A 14 6.762 13.748 -5.742 1.00 0.00 H new ATOM 0 HG3 LYS A 14 8.246 14.414 -6.393 1.00 0.00 H new ATOM 0 HD2 LYS A 14 6.301 13.409 -8.430 1.00 0.00 H new ATOM 0 HD3 LYS A 14 5.766 14.803 -7.512 1.00 0.00 H new ATOM 0 HE2 LYS A 14 8.540 15.197 -8.282 1.00 0.00 H new ATOM 0 HE3 LYS A 14 7.618 14.747 -9.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 7.577 17.128 -9.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 6.014 16.487 -9.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 6.908 16.924 -7.803 1.00 0.00 H new ATOM 178 N LEU A 15 6.174 10.079 -5.301 1.00 0.00 N ATOM 179 CA LEU A 15 5.473 8.807 -5.314 1.00 0.00 C ATOM 180 C LEU A 15 4.061 9.013 -5.867 1.00 0.00 C ATOM 181 O LEU A 15 3.238 9.680 -5.243 1.00 0.00 O ATOM 182 CB LEU A 15 5.502 8.164 -3.926 1.00 0.00 C ATOM 183 CG LEU A 15 4.381 7.167 -3.625 1.00 0.00 C ATOM 184 CD1 LEU A 15 4.272 6.115 -4.729 1.00 0.00 C ATOM 185 CD2 LEU A 15 4.568 6.533 -2.245 1.00 0.00 C ATOM 0 H LEU A 15 5.596 10.882 -5.055 1.00 0.00 H new ATOM 0 HA LEU A 15 5.976 8.102 -5.976 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.457 7.654 -3.804 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.466 8.957 -3.179 1.00 0.00 H new ATOM 0 HG LEU A 15 3.436 7.711 -3.605 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.468 5.419 -4.490 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.058 6.605 -5.679 1.00 0.00 H new ATOM 0 HD13 LEU A 15 5.213 5.570 -4.806 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.758 5.828 -2.056 1.00 0.00 H new ATOM 0 HD22 LEU A 15 5.522 6.007 -2.213 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.557 7.312 -1.482 1.00 0.00 H new ATOM 197 N HIS A 16 3.825 8.428 -7.032 1.00 0.00 N ATOM 198 CA HIS A 16 2.528 8.540 -7.676 1.00 0.00 C ATOM 199 C HIS A 16 1.578 7.487 -7.102 1.00 0.00 C ATOM 200 O HIS A 16 1.968 6.338 -6.898 1.00 0.00 O ATOM 201 CB HIS A 16 2.666 8.447 -9.197 1.00 0.00 C ATOM 202 CG HIS A 16 1.447 8.916 -9.955 1.00 0.00 C ATOM 203 ND1 HIS A 16 0.709 8.082 -10.777 1.00 0.00 N ATOM 204 CD2 HIS A 16 0.844 10.138 -10.005 1.00 0.00 C ATOM 205 CE1 HIS A 16 -0.290 8.782 -11.294 1.00 0.00 C ATOM 206 NE2 HIS A 16 -0.204 10.057 -10.815 1.00 0.00 N ATOM 0 H HIS A 16 4.510 7.875 -7.547 1.00 0.00 H new ATOM 0 HA HIS A 16 2.098 9.520 -7.468 1.00 0.00 H new ATOM 0 HB2 HIS A 16 3.526 9.039 -9.510 1.00 0.00 H new ATOM 0 HB3 HIS A 16 2.875 7.413 -9.470 1.00 0.00 H new ATOM 0 HD2 HIS A 16 1.165 11.022 -9.475 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -1.041 8.409 -11.975 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -0.840 10.821 -11.042 1.00 0.00 H new ATOM 214 N TYR A 17 0.348 7.916 -6.857 1.00 0.00 N ATOM 215 CA TYR A 17 -0.660 7.025 -6.310 1.00 0.00 C ATOM 216 C TYR A 17 -2.069 7.515 -6.652 1.00 0.00 C ATOM 217 O TYR A 17 -2.325 8.718 -6.665 1.00 0.00 O ATOM 218 CB TYR A 17 -0.476 7.059 -4.792 1.00 0.00 C ATOM 219 CG TYR A 17 -0.528 8.465 -4.191 1.00 0.00 C ATOM 220 CD1 TYR A 17 -1.730 9.139 -4.116 1.00 0.00 C ATOM 221 CD2 TYR A 17 0.627 9.060 -3.723 1.00 0.00 C ATOM 222 CE1 TYR A 17 -1.779 10.462 -3.550 1.00 0.00 C ATOM 223 CE2 TYR A 17 0.577 10.383 -3.157 1.00 0.00 C ATOM 224 CZ TYR A 17 -0.623 11.019 -3.099 1.00 0.00 C ATOM 225 OH TYR A 17 -0.670 12.269 -2.564 1.00 0.00 O ATOM 0 H TYR A 17 0.027 8.869 -7.028 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.549 6.022 -6.722 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.250 6.448 -4.329 1.00 0.00 H new ATOM 0 HB3 TYR A 17 0.482 6.603 -4.542 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -2.634 8.674 -4.482 1.00 0.00 H new ATOM 0 HD2 TYR A 17 1.568 8.533 -3.782 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -2.713 11.000 -3.485 1.00 0.00 H new ATOM 0 HE2 TYR A 17 1.473 10.859 -2.787 1.00 0.00 H new ATOM 0 HH TYR A 17 0.229 12.539 -2.283 1.00 0.00 H new ATOM 235 N CYS A 18 -2.945 6.558 -6.920 1.00 0.00 N ATOM 236 CA CYS A 18 -4.321 6.878 -7.261 1.00 0.00 C ATOM 237 C CYS A 18 -5.240 6.179 -6.256 1.00 0.00 C ATOM 238 O CYS A 18 -5.450 4.970 -6.339 1.00 0.00 O ATOM 239 CB CYS A 18 -4.652 6.489 -8.703 1.00 0.00 C ATOM 240 SG CYS A 18 -6.438 6.729 -9.022 1.00 0.00 S ATOM 0 H CYS A 18 -2.729 5.561 -6.908 1.00 0.00 H new ATOM 0 HA CYS A 18 -4.472 7.956 -7.201 1.00 0.00 H new ATOM 0 HB2 CYS A 18 -4.066 7.094 -9.395 1.00 0.00 H new ATOM 0 HB3 CYS A 18 -4.379 5.449 -8.879 1.00 0.00 H new ATOM 0 HG CYS A 18 -6.708 6.397 -10.250 1.00 0.00 H new ATOM 246 N LEU A 19 -5.762 6.970 -5.330 1.00 0.00 N ATOM 247 CA LEU A 19 -6.653 6.442 -4.311 1.00 0.00 C ATOM 248 C LEU A 19 -8.028 6.180 -4.928 1.00 0.00 C ATOM 249 O LEU A 19 -8.523 6.985 -5.715 1.00 0.00 O ATOM 250 CB LEU A 19 -6.690 7.373 -3.098 1.00 0.00 C ATOM 251 CG LEU A 19 -5.333 7.763 -2.509 1.00 0.00 C ATOM 252 CD1 LEU A 19 -5.458 8.109 -1.024 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.293 6.669 -2.757 1.00 0.00 C ATOM 0 H LEU A 19 -5.585 7.972 -5.264 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.283 5.486 -3.939 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.216 8.285 -3.381 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -7.279 6.894 -2.316 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.985 8.661 -3.020 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.479 8.383 -0.630 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -6.145 8.946 -0.902 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.839 7.245 -0.480 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.338 6.971 -2.328 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.623 5.741 -2.290 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.177 6.514 -3.830 1.00 0.00 H new ATOM 265 N ASP A 20 -8.606 5.050 -4.547 1.00 0.00 N ATOM 266 CA ASP A 20 -9.915 4.672 -5.053 1.00 0.00 C ATOM 267 C ASP A 20 -10.541 3.638 -4.115 1.00 0.00 C ATOM 268 O ASP A 20 -10.061 2.509 -4.021 1.00 0.00 O ATOM 269 CB ASP A 20 -9.807 4.043 -6.444 1.00 0.00 C ATOM 270 CG ASP A 20 -11.079 3.355 -6.943 1.00 0.00 C ATOM 271 OD1 ASP A 20 -11.261 2.171 -6.584 1.00 0.00 O ATOM 272 OD2 ASP A 20 -11.840 4.027 -7.672 1.00 0.00 O ATOM 0 H ASP A 20 -8.192 4.384 -3.894 1.00 0.00 H new ATOM 0 HA ASP A 20 -10.527 5.572 -5.110 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.528 4.819 -7.157 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -8.997 3.313 -6.435 1.00 0.00 H new ATOM 277 N TYR A 21 -11.602 4.061 -3.443 1.00 0.00 N ATOM 278 CA TYR A 21 -12.298 3.186 -2.516 1.00 0.00 C ATOM 279 C TYR A 21 -13.559 2.601 -3.155 1.00 0.00 C ATOM 280 O TYR A 21 -14.512 3.327 -3.434 1.00 0.00 O ATOM 281 CB TYR A 21 -12.702 4.064 -1.330 1.00 0.00 C ATOM 282 CG TYR A 21 -13.350 3.294 -0.177 1.00 0.00 C ATOM 283 CD1 TYR A 21 -12.566 2.556 0.686 1.00 0.00 C ATOM 284 CD2 TYR A 21 -14.718 3.338 -0.001 1.00 0.00 C ATOM 285 CE1 TYR A 21 -13.176 1.832 1.771 1.00 0.00 C ATOM 286 CE2 TYR A 21 -15.328 2.613 1.084 1.00 0.00 C ATOM 287 CZ TYR A 21 -14.526 1.896 1.916 1.00 0.00 C ATOM 288 OH TYR A 21 -15.102 1.211 2.941 1.00 0.00 O ATOM 0 H TYR A 21 -11.996 4.998 -3.522 1.00 0.00 H new ATOM 0 HA TYR A 21 -11.659 2.353 -2.222 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -11.818 4.581 -0.956 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -13.396 4.829 -1.678 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -11.495 2.521 0.548 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -15.331 3.916 -0.677 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -12.574 1.251 2.454 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -16.397 2.638 1.233 1.00 0.00 H new ATOM 0 HH TYR A 21 -14.699 0.320 3.007 1.00 0.00 H new ATOM 298 N ASP A 22 -13.523 1.293 -3.369 1.00 0.00 N ATOM 299 CA ASP A 22 -14.651 0.603 -3.970 1.00 0.00 C ATOM 300 C ASP A 22 -15.600 0.129 -2.867 1.00 0.00 C ATOM 301 O ASP A 22 -15.503 -1.008 -2.406 1.00 0.00 O ATOM 302 CB ASP A 22 -14.189 -0.626 -4.756 1.00 0.00 C ATOM 303 CG ASP A 22 -15.062 -0.989 -5.959 1.00 0.00 C ATOM 304 OD1 ASP A 22 -16.296 -1.052 -5.767 1.00 0.00 O ATOM 305 OD2 ASP A 22 -14.476 -1.196 -7.044 1.00 0.00 O ATOM 0 H ASP A 22 -12.731 0.694 -3.137 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.150 1.297 -4.646 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -13.170 -0.455 -5.104 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -14.155 -1.480 -4.079 1.00 0.00 H new ATOM 310 N CYS A 23 -16.496 1.023 -2.476 1.00 0.00 N ATOM 311 CA CYS A 23 -17.461 0.711 -1.436 1.00 0.00 C ATOM 312 C CYS A 23 -17.979 -0.710 -1.672 1.00 0.00 C ATOM 313 O CYS A 23 -18.247 -1.443 -0.722 1.00 0.00 O ATOM 314 CB CYS A 23 -18.599 1.733 -1.394 1.00 0.00 C ATOM 315 SG CYS A 23 -19.825 1.358 -2.700 1.00 0.00 S ATOM 0 H CYS A 23 -16.574 1.964 -2.861 1.00 0.00 H new ATOM 0 HA CYS A 23 -16.977 0.764 -0.461 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -19.080 1.714 -0.416 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -18.202 2.738 -1.535 1.00 0.00 H new ATOM 0 HG CYS A 23 -20.788 2.230 -2.654 1.00 0.00 H new ATOM 321 N GLN A 24 -18.104 -1.055 -2.945 1.00 0.00 N ATOM 322 CA GLN A 24 -18.585 -2.375 -3.318 1.00 0.00 C ATOM 323 C GLN A 24 -17.708 -3.458 -2.686 1.00 0.00 C ATOM 324 O GLN A 24 -18.218 -4.413 -2.104 1.00 0.00 O ATOM 325 CB GLN A 24 -18.636 -2.530 -4.840 1.00 0.00 C ATOM 326 CG GLN A 24 -19.225 -1.281 -5.498 1.00 0.00 C ATOM 327 CD GLN A 24 -20.406 -1.643 -6.402 1.00 0.00 C ATOM 328 OE1 GLN A 24 -21.279 -2.417 -6.046 1.00 0.00 O ATOM 329 NE2 GLN A 24 -20.384 -1.041 -7.588 1.00 0.00 N ATOM 0 H GLN A 24 -17.881 -0.444 -3.731 1.00 0.00 H new ATOM 0 HA GLN A 24 -19.601 -2.491 -2.939 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -17.632 -2.709 -5.225 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -19.237 -3.401 -5.101 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -19.552 -0.580 -4.730 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -18.456 -0.777 -6.083 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -19.623 -0.404 -7.822 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -21.128 -1.217 -8.263 1.00 0.00 H new ATOM 338 N LYS A 25 -16.403 -3.272 -2.823 1.00 0.00 N ATOM 339 CA LYS A 25 -15.450 -4.221 -2.273 1.00 0.00 C ATOM 340 C LYS A 25 -15.093 -3.808 -0.844 1.00 0.00 C ATOM 341 O LYS A 25 -14.615 -4.625 -0.059 1.00 0.00 O ATOM 342 CB LYS A 25 -14.237 -4.358 -3.195 1.00 0.00 C ATOM 343 CG LYS A 25 -14.647 -4.233 -4.663 1.00 0.00 C ATOM 344 CD LYS A 25 -13.631 -4.921 -5.577 1.00 0.00 C ATOM 345 CE LYS A 25 -14.336 -5.750 -6.653 1.00 0.00 C ATOM 346 NZ LYS A 25 -13.476 -5.882 -7.851 1.00 0.00 N ATOM 0 H LYS A 25 -15.983 -2.478 -3.307 1.00 0.00 H new ATOM 0 HA LYS A 25 -15.892 -5.216 -2.217 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.503 -3.590 -2.952 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -13.757 -5.322 -3.029 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -15.632 -4.677 -4.808 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -14.730 -3.180 -4.933 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -12.995 -4.172 -6.048 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.981 -5.565 -4.985 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.577 -6.738 -6.260 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -15.279 -5.277 -6.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.969 -6.447 -8.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.267 -4.938 -8.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.587 -6.354 -7.590 1.00 0.00 H new ATOM 360 N ALA A 26 -15.340 -2.540 -0.549 1.00 0.00 N ATOM 361 CA ALA A 26 -15.050 -2.009 0.772 1.00 0.00 C ATOM 362 C ALA A 26 -13.547 -2.108 1.039 1.00 0.00 C ATOM 363 O ALA A 26 -13.129 -2.371 2.165 1.00 0.00 O ATOM 364 CB ALA A 26 -15.879 -2.758 1.817 1.00 0.00 C ATOM 0 H ALA A 26 -15.738 -1.865 -1.202 1.00 0.00 H new ATOM 0 HA ALA A 26 -15.326 -0.956 0.831 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -15.661 -2.360 2.808 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -16.939 -2.631 1.600 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -15.628 -3.818 1.789 1.00 0.00 H new ATOM 370 N GLU A 27 -12.775 -1.893 -0.017 1.00 0.00 N ATOM 371 CA GLU A 27 -11.327 -1.956 0.090 1.00 0.00 C ATOM 372 C GLU A 27 -10.691 -0.760 -0.621 1.00 0.00 C ATOM 373 O GLU A 27 -11.085 -0.412 -1.733 1.00 0.00 O ATOM 374 CB GLU A 27 -10.793 -3.275 -0.471 1.00 0.00 C ATOM 375 CG GLU A 27 -11.191 -4.452 0.422 1.00 0.00 C ATOM 376 CD GLU A 27 -9.960 -5.245 0.865 1.00 0.00 C ATOM 377 OE1 GLU A 27 -8.862 -4.648 0.842 1.00 0.00 O ATOM 378 OE2 GLU A 27 -10.145 -6.430 1.216 1.00 0.00 O ATOM 0 H GLU A 27 -13.125 -1.675 -0.950 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.057 -1.913 1.145 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.182 -3.430 -1.478 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.707 -3.227 -0.552 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.726 -4.084 1.298 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -11.875 -5.107 -0.117 1.00 0.00 H new ATOM 385 N LEU A 28 -9.717 -0.163 0.050 1.00 0.00 N ATOM 386 CA LEU A 28 -9.022 0.987 -0.504 1.00 0.00 C ATOM 387 C LEU A 28 -8.005 0.511 -1.543 1.00 0.00 C ATOM 388 O LEU A 28 -7.385 -0.538 -1.375 1.00 0.00 O ATOM 389 CB LEU A 28 -8.409 1.832 0.614 1.00 0.00 C ATOM 390 CG LEU A 28 -7.980 3.249 0.226 1.00 0.00 C ATOM 391 CD1 LEU A 28 -6.647 3.232 -0.523 1.00 0.00 C ATOM 392 CD2 LEU A 28 -9.078 3.955 -0.573 1.00 0.00 C ATOM 0 H LEU A 28 -9.393 -0.454 0.972 1.00 0.00 H new ATOM 0 HA LEU A 28 -9.723 1.643 -1.020 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.132 1.902 1.427 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.539 1.305 1.006 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.828 3.823 1.140 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.365 4.251 -0.787 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.877 2.796 0.114 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.747 2.637 -1.430 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.748 4.960 -0.836 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.286 3.391 -1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.984 4.017 0.030 1.00 0.00 H new ATOM 404 N PHE A 29 -7.866 1.305 -2.594 1.00 0.00 N ATOM 405 CA PHE A 29 -6.934 0.978 -3.661 1.00 0.00 C ATOM 406 C PHE A 29 -5.986 2.147 -3.939 1.00 0.00 C ATOM 407 O PHE A 29 -6.401 3.305 -3.920 1.00 0.00 O ATOM 408 CB PHE A 29 -7.768 0.704 -4.914 1.00 0.00 C ATOM 409 CG PHE A 29 -8.617 -0.566 -4.831 1.00 0.00 C ATOM 410 CD1 PHE A 29 -9.795 -0.554 -4.153 1.00 0.00 C ATOM 411 CD2 PHE A 29 -8.193 -1.708 -5.436 1.00 0.00 C ATOM 412 CE1 PHE A 29 -10.583 -1.733 -4.076 1.00 0.00 C ATOM 413 CE2 PHE A 29 -8.980 -2.887 -5.360 1.00 0.00 C ATOM 414 CZ PHE A 29 -10.159 -2.874 -4.681 1.00 0.00 C ATOM 0 H PHE A 29 -8.383 2.174 -2.730 1.00 0.00 H new ATOM 0 HA PHE A 29 -6.331 0.116 -3.377 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -8.424 1.556 -5.095 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.101 0.627 -5.772 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -10.132 0.353 -3.673 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.257 -1.718 -5.975 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -11.519 -1.723 -3.537 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -8.643 -3.794 -5.841 1.00 0.00 H new ATOM 0 HZ PHE A 29 -10.758 -3.771 -4.623 1.00 0.00 H new ATOM 424 N VAL A 30 -4.732 1.802 -4.191 1.00 0.00 N ATOM 425 CA VAL A 30 -3.722 2.808 -4.472 1.00 0.00 C ATOM 426 C VAL A 30 -3.023 2.468 -5.790 1.00 0.00 C ATOM 427 O VAL A 30 -1.871 2.037 -5.793 1.00 0.00 O ATOM 428 CB VAL A 30 -2.753 2.921 -3.293 1.00 0.00 C ATOM 429 CG1 VAL A 30 -1.775 4.080 -3.496 1.00 0.00 C ATOM 430 CG2 VAL A 30 -3.511 3.068 -1.972 1.00 0.00 C ATOM 0 H VAL A 30 -4.392 0.840 -4.206 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.183 3.789 -4.592 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.174 1.999 -3.246 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.098 4.138 -2.644 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.199 3.915 -4.407 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.330 5.014 -3.582 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.799 3.146 -1.151 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.128 3.966 -2.004 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.147 2.196 -1.819 1.00 0.00 H new ATOM 440 N THR A 31 -3.750 2.675 -6.879 1.00 0.00 N ATOM 441 CA THR A 31 -3.214 2.396 -8.200 1.00 0.00 C ATOM 442 C THR A 31 -2.281 3.524 -8.646 1.00 0.00 C ATOM 443 O THR A 31 -1.988 4.435 -7.873 1.00 0.00 O ATOM 444 CB THR A 31 -4.392 2.170 -9.150 1.00 0.00 C ATOM 445 OG1 THR A 31 -5.221 3.312 -8.952 1.00 0.00 O ATOM 446 CG2 THR A 31 -5.270 0.993 -8.723 1.00 0.00 C ATOM 0 H THR A 31 -4.705 3.033 -6.873 1.00 0.00 H new ATOM 0 HA THR A 31 -2.603 1.493 -8.197 1.00 0.00 H new ATOM 0 HB THR A 31 -4.017 1.996 -10.159 1.00 0.00 H new ATOM 0 HG1 THR A 31 -6.009 3.249 -9.531 1.00 0.00 H new ATOM 0 HG21 THR A 31 -6.091 0.876 -9.430 1.00 0.00 H new ATOM 0 HG22 THR A 31 -4.673 0.081 -8.706 1.00 0.00 H new ATOM 0 HG23 THR A 31 -5.673 1.182 -7.728 1.00 0.00 H new ATOM 454 N ARG A 32 -1.840 3.426 -9.892 1.00 0.00 N ATOM 455 CA ARG A 32 -0.947 4.426 -10.451 1.00 0.00 C ATOM 456 C ARG A 32 0.278 4.606 -9.551 1.00 0.00 C ATOM 457 O ARG A 32 0.553 5.710 -9.084 1.00 0.00 O ATOM 458 CB ARG A 32 -1.657 5.772 -10.608 1.00 0.00 C ATOM 459 CG ARG A 32 -2.898 5.637 -11.492 1.00 0.00 C ATOM 460 CD ARG A 32 -2.541 5.813 -12.970 1.00 0.00 C ATOM 461 NE ARG A 32 -3.718 6.307 -13.719 1.00 0.00 N ATOM 462 CZ ARG A 32 -4.764 5.544 -14.064 1.00 0.00 C ATOM 463 NH1 ARG A 32 -4.786 4.247 -13.728 1.00 0.00 N ATOM 464 NH2 ARG A 32 -5.787 6.078 -14.744 1.00 0.00 N ATOM 0 H ARG A 32 -2.085 2.669 -10.530 1.00 0.00 H new ATOM 0 HA ARG A 32 -0.632 4.077 -11.434 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -1.944 6.152 -9.628 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -0.973 6.500 -11.044 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -3.354 4.659 -11.338 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.638 6.383 -11.202 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.714 6.515 -13.072 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -2.206 4.863 -13.387 1.00 0.00 H new ATOM 0 HE ARG A 32 -3.734 7.290 -13.990 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -4.007 3.841 -13.210 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -5.582 3.666 -13.990 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -5.770 7.065 -14.999 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -6.583 5.497 -15.007 1.00 0.00 H new ATOM 478 N LEU A 33 0.980 3.503 -9.334 1.00 0.00 N ATOM 479 CA LEU A 33 2.169 3.525 -8.499 1.00 0.00 C ATOM 480 C LEU A 33 3.387 3.859 -9.362 1.00 0.00 C ATOM 481 O LEU A 33 3.736 3.104 -10.268 1.00 0.00 O ATOM 482 CB LEU A 33 2.304 2.212 -7.725 1.00 0.00 C ATOM 483 CG LEU A 33 1.494 2.110 -6.431 1.00 0.00 C ATOM 484 CD1 LEU A 33 1.668 0.735 -5.782 1.00 0.00 C ATOM 485 CD2 LEU A 33 1.849 3.246 -5.470 1.00 0.00 C ATOM 0 H LEU A 33 0.748 2.589 -9.722 1.00 0.00 H new ATOM 0 HA LEU A 33 2.090 4.307 -7.743 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.007 1.394 -8.382 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.356 2.062 -7.484 1.00 0.00 H new ATOM 0 HG LEU A 33 0.438 2.218 -6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.082 0.689 -4.864 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.326 -0.038 -6.470 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.720 0.573 -5.549 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.259 3.149 -4.559 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.909 3.195 -5.223 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.632 4.204 -5.943 1.00 0.00 H new ATOM 497 N GLU A 34 4.002 4.990 -9.050 1.00 0.00 N ATOM 498 CA GLU A 34 5.174 5.433 -9.785 1.00 0.00 C ATOM 499 C GLU A 34 6.044 6.333 -8.906 1.00 0.00 C ATOM 500 O GLU A 34 5.727 7.504 -8.704 1.00 0.00 O ATOM 501 CB GLU A 34 4.773 6.151 -11.076 1.00 0.00 C ATOM 502 CG GLU A 34 3.819 5.290 -11.908 1.00 0.00 C ATOM 503 CD GLU A 34 3.539 5.939 -13.265 1.00 0.00 C ATOM 504 OE1 GLU A 34 4.384 6.757 -13.689 1.00 0.00 O ATOM 505 OE2 GLU A 34 2.486 5.602 -13.848 1.00 0.00 O ATOM 0 H GLU A 34 3.710 5.613 -8.297 1.00 0.00 H new ATOM 0 HA GLU A 34 5.757 4.555 -10.062 1.00 0.00 H new ATOM 0 HB2 GLU A 34 4.295 7.101 -10.835 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.664 6.382 -11.660 1.00 0.00 H new ATOM 0 HG2 GLU A 34 4.252 4.301 -12.056 1.00 0.00 H new ATOM 0 HG3 GLU A 34 2.883 5.151 -11.367 1.00 0.00 H new ATOM 512 N ALA A 35 7.124 5.751 -8.405 1.00 0.00 N ATOM 513 CA ALA A 35 8.042 6.485 -7.552 1.00 0.00 C ATOM 514 C ALA A 35 9.018 7.279 -8.423 1.00 0.00 C ATOM 515 O ALA A 35 9.501 6.776 -9.437 1.00 0.00 O ATOM 516 CB ALA A 35 8.758 5.511 -6.614 1.00 0.00 C ATOM 0 H ALA A 35 7.383 4.779 -8.574 1.00 0.00 H new ATOM 0 HA ALA A 35 7.500 7.198 -6.930 1.00 0.00 H new ATOM 0 HB1 ALA A 35 9.447 6.062 -5.974 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.023 4.994 -5.996 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.314 4.782 -7.203 1.00 0.00 H new ATOM 522 N VAL A 36 9.280 8.506 -7.997 1.00 0.00 N ATOM 523 CA VAL A 36 10.189 9.373 -8.725 1.00 0.00 C ATOM 524 C VAL A 36 11.332 9.798 -7.801 1.00 0.00 C ATOM 525 O VAL A 36 11.363 10.934 -7.329 1.00 0.00 O ATOM 526 CB VAL A 36 9.422 10.560 -9.313 1.00 0.00 C ATOM 527 CG1 VAL A 36 10.356 11.745 -9.567 1.00 0.00 C ATOM 528 CG2 VAL A 36 8.686 10.158 -10.593 1.00 0.00 C ATOM 0 H VAL A 36 8.878 8.920 -7.156 1.00 0.00 H new ATOM 0 HA VAL A 36 10.633 8.841 -9.567 1.00 0.00 H new ATOM 0 HB VAL A 36 8.676 10.872 -8.582 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.786 12.575 -9.985 1.00 0.00 H new ATOM 0 HG12 VAL A 36 10.813 12.056 -8.628 1.00 0.00 H new ATOM 0 HG13 VAL A 36 11.135 11.450 -10.270 1.00 0.00 H new ATOM 0 HG21 VAL A 36 8.149 11.020 -10.990 1.00 0.00 H new ATOM 0 HG22 VAL A 36 9.406 9.807 -11.332 1.00 0.00 H new ATOM 0 HG23 VAL A 36 7.977 9.360 -10.370 1.00 0.00 H new ATOM 538 N THR A 37 12.243 8.864 -7.571 1.00 0.00 N ATOM 539 CA THR A 37 13.385 9.128 -6.712 1.00 0.00 C ATOM 540 C THR A 37 14.566 9.640 -7.538 1.00 0.00 C ATOM 541 O THR A 37 15.317 8.851 -8.110 1.00 0.00 O ATOM 542 CB THR A 37 13.697 7.848 -5.934 1.00 0.00 C ATOM 543 OG1 THR A 37 14.023 6.898 -6.945 1.00 0.00 O ATOM 544 CG2 THR A 37 12.458 7.259 -5.255 1.00 0.00 C ATOM 0 H THR A 37 12.214 7.923 -7.965 1.00 0.00 H new ATOM 0 HA THR A 37 13.165 9.917 -5.993 1.00 0.00 H new ATOM 0 HB THR A 37 14.458 8.057 -5.182 1.00 0.00 H new ATOM 0 HG1 THR A 37 14.683 7.285 -7.557 1.00 0.00 H new ATOM 0 HG21 THR A 37 12.734 6.352 -4.717 1.00 0.00 H new ATOM 0 HG22 THR A 37 12.047 7.986 -4.554 1.00 0.00 H new ATOM 0 HG23 THR A 37 11.709 7.019 -6.010 1.00 0.00 H new ATOM 552 N SER A 38 14.695 10.958 -7.574 1.00 0.00 N ATOM 553 CA SER A 38 15.773 11.585 -8.320 1.00 0.00 C ATOM 554 C SER A 38 17.102 10.902 -7.994 1.00 0.00 C ATOM 555 O SER A 38 17.624 10.135 -8.801 1.00 0.00 O ATOM 556 CB SER A 38 15.856 13.082 -8.014 1.00 0.00 C ATOM 557 OG SER A 38 14.848 13.824 -8.696 1.00 0.00 O ATOM 0 H SER A 38 14.071 11.609 -7.098 1.00 0.00 H new ATOM 0 HA SER A 38 15.565 11.470 -9.384 1.00 0.00 H new ATOM 0 HB2 SER A 38 15.757 13.238 -6.940 1.00 0.00 H new ATOM 0 HB3 SER A 38 16.838 13.457 -8.301 1.00 0.00 H new ATOM 0 HG SER A 38 15.172 14.732 -8.871 1.00 0.00 H new ATOM 563 N ASN A 39 17.611 11.204 -6.808 1.00 0.00 N ATOM 564 CA ASN A 39 18.869 10.628 -6.365 1.00 0.00 C ATOM 565 C ASN A 39 18.586 9.394 -5.506 1.00 0.00 C ATOM 566 O ASN A 39 17.740 9.436 -4.614 1.00 0.00 O ATOM 567 CB ASN A 39 19.662 11.624 -5.517 1.00 0.00 C ATOM 568 CG ASN A 39 21.159 11.533 -5.819 1.00 0.00 C ATOM 569 OD1 ASN A 39 21.864 10.662 -5.337 1.00 0.00 O ATOM 570 ND2 ASN A 39 21.602 12.478 -6.643 1.00 0.00 N ATOM 0 H ASN A 39 17.175 11.840 -6.141 1.00 0.00 H new ATOM 0 HA ASN A 39 19.450 10.365 -7.249 1.00 0.00 H new ATOM 0 HB2 ASN A 39 19.309 12.636 -5.714 1.00 0.00 H new ATOM 0 HB3 ASN A 39 19.488 11.426 -4.459 1.00 0.00 H new ATOM 0 HD21 ASN A 39 22.587 12.503 -6.908 1.00 0.00 H new ATOM 0 HD22 ASN A 39 20.957 13.178 -7.011 1.00 0.00 H new ATOM 577 N HIS A 40 19.309 8.326 -5.805 1.00 0.00 N ATOM 578 CA HIS A 40 19.147 7.082 -5.071 1.00 0.00 C ATOM 579 C HIS A 40 20.067 6.013 -5.662 1.00 0.00 C ATOM 580 O HIS A 40 20.005 5.726 -6.856 1.00 0.00 O ATOM 581 CB HIS A 40 17.678 6.654 -5.047 1.00 0.00 C ATOM 582 CG HIS A 40 17.125 6.433 -3.660 1.00 0.00 C ATOM 583 ND1 HIS A 40 15.926 5.782 -3.426 1.00 0.00 N ATOM 584 CD2 HIS A 40 17.619 6.782 -2.437 1.00 0.00 C ATOM 585 CE1 HIS A 40 15.717 5.747 -2.118 1.00 0.00 C ATOM 586 NE2 HIS A 40 16.767 6.368 -1.507 1.00 0.00 N ATOM 0 H HIS A 40 20.009 8.296 -6.546 1.00 0.00 H new ATOM 0 HA HIS A 40 19.440 7.228 -4.031 1.00 0.00 H new ATOM 0 HB2 HIS A 40 17.080 7.415 -5.548 1.00 0.00 H new ATOM 0 HB3 HIS A 40 17.569 5.734 -5.621 1.00 0.00 H new ATOM 0 HD2 HIS A 40 18.546 7.306 -2.256 1.00 0.00 H new ATOM 0 HE1 HIS A 40 14.865 5.305 -1.623 1.00 0.00 H new ATOM 0 HE2 HIS A 40 16.879 6.494 -0.501 1.00 0.00 H new ATOM 594 N ASP A 41 20.900 5.451 -4.797 1.00 0.00 N ATOM 595 CA ASP A 41 21.833 4.420 -5.219 1.00 0.00 C ATOM 596 C ASP A 41 21.916 3.341 -4.137 1.00 0.00 C ATOM 597 O ASP A 41 22.007 3.652 -2.951 1.00 0.00 O ATOM 598 CB ASP A 41 23.236 4.995 -5.422 1.00 0.00 C ATOM 599 CG ASP A 41 23.530 5.499 -6.836 1.00 0.00 C ATOM 600 OD1 ASP A 41 23.115 6.641 -7.129 1.00 0.00 O ATOM 601 OD2 ASP A 41 24.163 4.731 -7.592 1.00 0.00 O ATOM 0 H ASP A 41 20.948 5.690 -3.807 1.00 0.00 H new ATOM 0 HA ASP A 41 21.474 4.006 -6.161 1.00 0.00 H new ATOM 0 HB2 ASP A 41 23.380 5.818 -4.722 1.00 0.00 H new ATOM 0 HB3 ASP A 41 23.967 4.228 -5.167 1.00 0.00 H new ATOM 606 N GLY A 42 21.881 2.095 -4.586 1.00 0.00 N ATOM 607 CA GLY A 42 21.951 0.968 -3.671 1.00 0.00 C ATOM 608 C GLY A 42 21.371 -0.295 -4.312 1.00 0.00 C ATOM 609 O GLY A 42 20.776 -0.233 -5.386 1.00 0.00 O ATOM 0 H GLY A 42 21.805 1.841 -5.571 1.00 0.00 H new ATOM 0 HA2 GLY A 42 22.988 0.792 -3.384 1.00 0.00 H new ATOM 0 HA3 GLY A 42 21.403 1.201 -2.758 1.00 0.00 H new ATOM 613 N GLY A 43 21.565 -1.411 -3.624 1.00 0.00 N ATOM 614 CA GLY A 43 21.068 -2.686 -4.112 1.00 0.00 C ATOM 615 C GLY A 43 19.698 -3.007 -3.512 1.00 0.00 C ATOM 616 O GLY A 43 19.066 -2.146 -2.902 1.00 0.00 O ATOM 0 H GLY A 43 22.059 -1.458 -2.733 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.996 -2.660 -5.199 1.00 0.00 H new ATOM 0 HA3 GLY A 43 21.774 -3.477 -3.858 1.00 0.00 H new ATOM 620 N CYS A 44 19.279 -4.249 -3.706 1.00 0.00 N ATOM 621 CA CYS A 44 17.995 -4.695 -3.191 1.00 0.00 C ATOM 622 C CYS A 44 16.890 -4.004 -3.993 1.00 0.00 C ATOM 623 O CYS A 44 16.989 -2.816 -4.296 1.00 0.00 O ATOM 624 CB CYS A 44 17.864 -4.428 -1.690 1.00 0.00 C ATOM 625 SG CYS A 44 18.125 -5.978 -0.753 1.00 0.00 S ATOM 0 H CYS A 44 19.806 -4.961 -4.213 1.00 0.00 H new ATOM 0 HA CYS A 44 17.907 -5.775 -3.310 1.00 0.00 H new ATOM 0 HB2 CYS A 44 18.593 -3.679 -1.381 1.00 0.00 H new ATOM 0 HB3 CYS A 44 16.877 -4.022 -1.469 1.00 0.00 H new ATOM 0 HG CYS A 44 17.096 -6.757 -0.907 1.00 0.00 H new ATOM 631 N ASP A 45 15.864 -4.777 -4.313 1.00 0.00 N ATOM 632 CA ASP A 45 14.741 -4.254 -5.074 1.00 0.00 C ATOM 633 C ASP A 45 13.926 -3.311 -4.188 1.00 0.00 C ATOM 634 O ASP A 45 14.098 -3.293 -2.970 1.00 0.00 O ATOM 635 CB ASP A 45 13.818 -5.382 -5.539 1.00 0.00 C ATOM 636 CG ASP A 45 14.418 -6.316 -6.593 1.00 0.00 C ATOM 637 OD1 ASP A 45 14.957 -5.780 -7.585 1.00 0.00 O ATOM 638 OD2 ASP A 45 14.324 -7.544 -6.382 1.00 0.00 O ATOM 0 H ASP A 45 15.786 -5.762 -4.060 1.00 0.00 H new ATOM 0 HA ASP A 45 15.137 -3.731 -5.944 1.00 0.00 H new ATOM 0 HB2 ASP A 45 13.529 -5.976 -4.672 1.00 0.00 H new ATOM 0 HB3 ASP A 45 12.906 -4.942 -5.942 1.00 0.00 H new ATOM 643 N CYS A 46 13.054 -2.550 -4.833 1.00 0.00 N ATOM 644 CA CYS A 46 12.211 -1.606 -4.119 1.00 0.00 C ATOM 645 C CYS A 46 10.749 -1.977 -4.377 1.00 0.00 C ATOM 646 O CYS A 46 10.444 -2.682 -5.338 1.00 0.00 O ATOM 647 CB CYS A 46 12.513 -0.161 -4.521 1.00 0.00 C ATOM 648 SG CYS A 46 11.867 0.169 -6.201 1.00 0.00 S ATOM 0 H CYS A 46 12.913 -2.568 -5.843 1.00 0.00 H new ATOM 0 HA CYS A 46 12.417 -1.667 -3.050 1.00 0.00 H new ATOM 0 HB2 CYS A 46 12.060 0.526 -3.807 1.00 0.00 H new ATOM 0 HB3 CYS A 46 13.588 0.015 -4.495 1.00 0.00 H new ATOM 0 HG CYS A 46 12.127 1.399 -6.532 1.00 0.00 H new ATOM 654 N TYR A 47 9.884 -1.485 -3.503 1.00 0.00 N ATOM 655 CA TYR A 47 8.462 -1.756 -3.624 1.00 0.00 C ATOM 656 C TYR A 47 7.643 -0.768 -2.791 1.00 0.00 C ATOM 657 O TYR A 47 8.122 -0.254 -1.782 1.00 0.00 O ATOM 658 CB TYR A 47 8.252 -3.167 -3.071 1.00 0.00 C ATOM 659 CG TYR A 47 8.791 -3.366 -1.652 1.00 0.00 C ATOM 660 CD1 TYR A 47 7.980 -3.114 -0.564 1.00 0.00 C ATOM 661 CD2 TYR A 47 10.088 -3.796 -1.461 1.00 0.00 C ATOM 662 CE1 TYR A 47 8.487 -3.301 0.770 1.00 0.00 C ATOM 663 CE2 TYR A 47 10.595 -3.983 -0.126 1.00 0.00 C ATOM 664 CZ TYR A 47 9.770 -3.726 0.923 1.00 0.00 C ATOM 665 OH TYR A 47 10.249 -3.903 2.184 1.00 0.00 O ATOM 0 H TYR A 47 10.141 -0.900 -2.708 1.00 0.00 H new ATOM 0 HA TYR A 47 8.141 -1.662 -4.661 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.186 -3.394 -3.079 1.00 0.00 H new ATOM 0 HB3 TYR A 47 8.736 -3.883 -3.736 1.00 0.00 H new ATOM 0 HD1 TYR A 47 6.965 -2.777 -0.714 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.723 -3.992 -2.312 1.00 0.00 H new ATOM 0 HE1 TYR A 47 7.863 -3.108 1.630 1.00 0.00 H new ATOM 0 HE2 TYR A 47 11.608 -4.320 0.038 1.00 0.00 H new ATOM 0 HH TYR A 47 11.220 -3.767 2.187 1.00 0.00 H new ATOM 675 N VAL A 48 6.421 -0.531 -3.245 1.00 0.00 N ATOM 676 CA VAL A 48 5.530 0.386 -2.555 1.00 0.00 C ATOM 677 C VAL A 48 4.684 -0.393 -1.546 1.00 0.00 C ATOM 678 O VAL A 48 4.325 -1.545 -1.790 1.00 0.00 O ATOM 679 CB VAL A 48 4.688 1.161 -3.570 1.00 0.00 C ATOM 680 CG1 VAL A 48 3.947 2.319 -2.897 1.00 0.00 C ATOM 681 CG2 VAL A 48 5.551 1.663 -4.730 1.00 0.00 C ATOM 0 H VAL A 48 6.027 -0.959 -4.083 1.00 0.00 H new ATOM 0 HA VAL A 48 6.102 1.126 -1.996 1.00 0.00 H new ATOM 0 HB VAL A 48 3.943 0.478 -3.978 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.356 2.854 -3.640 1.00 0.00 H new ATOM 0 HG12 VAL A 48 3.288 1.928 -2.122 1.00 0.00 H new ATOM 0 HG13 VAL A 48 4.669 3.001 -2.448 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.928 2.210 -5.437 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.329 2.323 -4.346 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.012 0.814 -5.235 1.00 0.00 H new ATOM 691 N GLN A 49 4.388 0.265 -0.435 1.00 0.00 N ATOM 692 CA GLN A 49 3.591 -0.351 0.611 1.00 0.00 C ATOM 693 C GLN A 49 2.524 0.625 1.110 1.00 0.00 C ATOM 694 O GLN A 49 2.823 1.783 1.397 1.00 0.00 O ATOM 695 CB GLN A 49 4.475 -0.833 1.763 1.00 0.00 C ATOM 696 CG GLN A 49 3.664 -1.645 2.774 1.00 0.00 C ATOM 697 CD GLN A 49 4.055 -1.282 4.208 1.00 0.00 C ATOM 698 OE1 GLN A 49 4.747 -0.311 4.463 1.00 0.00 O ATOM 699 NE2 GLN A 49 3.575 -2.116 5.127 1.00 0.00 N ATOM 0 H GLN A 49 4.686 1.220 -0.237 1.00 0.00 H new ATOM 0 HA GLN A 49 3.090 -1.224 0.192 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.289 -1.443 1.371 1.00 0.00 H new ATOM 0 HB3 GLN A 49 4.930 0.024 2.260 1.00 0.00 H new ATOM 0 HG2 GLN A 49 2.600 -1.460 2.625 1.00 0.00 H new ATOM 0 HG3 GLN A 49 3.828 -2.709 2.607 1.00 0.00 H new ATOM 0 HE21 GLN A 49 3.001 -2.911 4.845 1.00 0.00 H new ATOM 0 HE22 GLN A 49 3.781 -1.961 6.114 1.00 0.00 H new ATOM 708 N GLY A 50 1.301 0.121 1.199 1.00 0.00 N ATOM 709 CA GLY A 50 0.189 0.935 1.658 1.00 0.00 C ATOM 710 C GLY A 50 -0.439 0.342 2.922 1.00 0.00 C ATOM 711 O GLY A 50 -0.950 -0.777 2.899 1.00 0.00 O ATOM 0 H GLY A 50 1.057 -0.840 0.961 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.535 1.949 1.860 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -0.563 1.006 0.872 1.00 0.00 H new ATOM 715 N SER A 51 -0.380 1.118 3.994 1.00 0.00 N ATOM 716 CA SER A 51 -0.936 0.683 5.264 1.00 0.00 C ATOM 717 C SER A 51 -2.124 1.568 5.645 1.00 0.00 C ATOM 718 O SER A 51 -2.064 2.789 5.505 1.00 0.00 O ATOM 719 CB SER A 51 0.123 0.712 6.368 1.00 0.00 C ATOM 720 OG SER A 51 1.429 0.447 5.862 1.00 0.00 O ATOM 0 H SER A 51 0.044 2.045 4.009 1.00 0.00 H new ATOM 0 HA SER A 51 -1.278 -0.346 5.153 1.00 0.00 H new ATOM 0 HB2 SER A 51 0.114 1.688 6.854 1.00 0.00 H new ATOM 0 HB3 SER A 51 -0.127 -0.026 7.130 1.00 0.00 H new ATOM 0 HG SER A 51 2.077 0.476 6.597 1.00 0.00 H new ATOM 726 N VAL A 52 -3.177 0.918 6.119 1.00 0.00 N ATOM 727 CA VAL A 52 -4.378 1.631 6.521 1.00 0.00 C ATOM 728 C VAL A 52 -4.686 1.316 7.986 1.00 0.00 C ATOM 729 O VAL A 52 -4.502 0.185 8.434 1.00 0.00 O ATOM 730 CB VAL A 52 -5.533 1.284 5.579 1.00 0.00 C ATOM 731 CG1 VAL A 52 -6.812 0.990 6.365 1.00 0.00 C ATOM 732 CG2 VAL A 52 -5.761 2.399 4.557 1.00 0.00 C ATOM 0 H VAL A 52 -3.223 -0.094 6.234 1.00 0.00 H new ATOM 0 HA VAL A 52 -4.227 2.708 6.445 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.260 0.381 5.033 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -7.617 0.746 5.672 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -6.642 0.147 7.034 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.090 1.867 6.950 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.587 2.127 3.900 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -6.001 3.326 5.077 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -4.857 2.540 3.964 1.00 0.00 H new ATOM 742 N ALA A 53 -5.150 2.336 8.693 1.00 0.00 N ATOM 743 CA ALA A 53 -5.486 2.182 10.098 1.00 0.00 C ATOM 744 C ALA A 53 -6.959 2.537 10.308 1.00 0.00 C ATOM 745 O ALA A 53 -7.306 3.710 10.439 1.00 0.00 O ATOM 746 CB ALA A 53 -4.551 3.048 10.944 1.00 0.00 C ATOM 0 H ALA A 53 -5.301 3.273 8.319 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.348 1.148 10.414 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -4.803 2.933 11.998 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.519 2.736 10.781 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.664 4.093 10.656 1.00 0.00 H new ATOM 752 N ASN A 54 -7.786 1.502 10.334 1.00 0.00 N ATOM 753 CA ASN A 54 -9.214 1.691 10.526 1.00 0.00 C ATOM 754 C ASN A 54 -9.472 2.192 11.948 1.00 0.00 C ATOM 755 O ASN A 54 -8.574 2.174 12.789 1.00 0.00 O ATOM 756 CB ASN A 54 -9.973 0.374 10.344 1.00 0.00 C ATOM 757 CG ASN A 54 -9.134 -0.638 9.562 1.00 0.00 C ATOM 758 OD1 ASN A 54 -8.770 -1.694 10.054 1.00 0.00 O ATOM 759 ND2 ASN A 54 -8.849 -0.260 8.319 1.00 0.00 N ATOM 0 H ASN A 54 -7.495 0.531 10.225 1.00 0.00 H new ATOM 0 HA ASN A 54 -9.561 2.413 9.787 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -10.232 -0.039 11.319 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -10.909 0.559 9.818 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -8.295 -0.867 7.716 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -9.185 0.637 7.969 1.00 0.00 H new ATOM 766 N ARG A 55 -10.702 2.629 12.174 1.00 0.00 N ATOM 767 CA ARG A 55 -11.089 3.134 13.480 1.00 0.00 C ATOM 768 C ARG A 55 -10.325 2.397 14.582 1.00 0.00 C ATOM 769 O ARG A 55 -9.689 3.024 15.427 1.00 0.00 O ATOM 770 CB ARG A 55 -12.592 2.968 13.712 1.00 0.00 C ATOM 771 CG ARG A 55 -13.085 3.912 14.811 1.00 0.00 C ATOM 772 CD ARG A 55 -14.613 3.930 14.873 1.00 0.00 C ATOM 773 NE ARG A 55 -15.062 4.689 16.062 1.00 0.00 N ATOM 774 CZ ARG A 55 -14.919 4.261 17.324 1.00 0.00 C ATOM 775 NH1 ARG A 55 -14.338 3.079 17.569 1.00 0.00 N ATOM 776 NH2 ARG A 55 -15.357 5.016 18.341 1.00 0.00 N ATOM 0 H ARG A 55 -11.444 2.644 11.474 1.00 0.00 H new ATOM 0 HA ARG A 55 -10.844 4.196 13.511 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.131 3.169 12.786 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.809 1.936 13.989 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.682 3.597 15.774 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -12.713 4.919 14.624 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.017 4.384 13.968 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.996 2.910 14.916 1.00 0.00 H new ATOM 0 HE ARG A 55 -15.508 5.594 15.911 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.004 2.505 16.795 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -14.229 2.754 18.530 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -15.799 5.916 18.154 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -15.248 4.690 19.302 1.00 0.00 H new ATOM 790 N THR A 56 -10.414 1.076 14.537 1.00 0.00 N ATOM 791 CA THR A 56 -9.740 0.247 15.521 1.00 0.00 C ATOM 792 C THR A 56 -9.052 -0.937 14.839 1.00 0.00 C ATOM 793 O THR A 56 -8.684 -1.909 15.497 1.00 0.00 O ATOM 794 CB THR A 56 -10.769 -0.172 16.572 1.00 0.00 C ATOM 795 OG1 THR A 56 -11.906 -0.565 15.808 1.00 0.00 O ATOM 796 CG2 THR A 56 -11.271 1.011 17.404 1.00 0.00 C ATOM 0 H THR A 56 -10.943 0.559 13.834 1.00 0.00 H new ATOM 0 HA THR A 56 -8.946 0.798 16.025 1.00 0.00 H new ATOM 0 HB THR A 56 -10.329 -0.920 17.232 1.00 0.00 H new ATOM 0 HG1 THR A 56 -12.622 -0.854 16.412 1.00 0.00 H new ATOM 0 HG21 THR A 56 -11.999 0.659 18.135 1.00 0.00 H new ATOM 0 HG22 THR A 56 -10.431 1.474 17.922 1.00 0.00 H new ATOM 0 HG23 THR A 56 -11.741 1.744 16.748 1.00 0.00 H new ATOM 804 N GLY A 57 -8.899 -0.817 13.529 1.00 0.00 N ATOM 805 CA GLY A 57 -8.262 -1.866 12.750 1.00 0.00 C ATOM 806 C GLY A 57 -7.082 -1.313 11.948 1.00 0.00 C ATOM 807 O GLY A 57 -6.838 -0.108 11.947 1.00 0.00 O ATOM 0 H GLY A 57 -9.205 -0.009 12.987 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -7.916 -2.658 13.414 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -8.989 -2.313 12.072 1.00 0.00 H new ATOM 811 N SER A 58 -6.381 -2.222 11.286 1.00 0.00 N ATOM 812 CA SER A 58 -5.232 -1.840 10.482 1.00 0.00 C ATOM 813 C SER A 58 -4.998 -2.875 9.379 1.00 0.00 C ATOM 814 O SER A 58 -5.277 -4.059 9.565 1.00 0.00 O ATOM 815 CB SER A 58 -3.979 -1.694 11.347 1.00 0.00 C ATOM 816 OG SER A 58 -3.793 -2.811 12.211 1.00 0.00 O ATOM 0 H SER A 58 -6.586 -3.221 11.290 1.00 0.00 H new ATOM 0 HA SER A 58 -5.440 -0.872 10.025 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.106 -1.584 10.704 1.00 0.00 H new ATOM 0 HB3 SER A 58 -4.054 -0.784 11.942 1.00 0.00 H new ATOM 0 HG SER A 58 -2.982 -2.680 12.745 1.00 0.00 H new ATOM 822 N VAL A 59 -4.489 -2.391 8.256 1.00 0.00 N ATOM 823 CA VAL A 59 -4.214 -3.260 7.124 1.00 0.00 C ATOM 824 C VAL A 59 -2.944 -2.782 6.417 1.00 0.00 C ATOM 825 O VAL A 59 -2.514 -1.645 6.607 1.00 0.00 O ATOM 826 CB VAL A 59 -5.431 -3.312 6.198 1.00 0.00 C ATOM 827 CG1 VAL A 59 -6.416 -4.393 6.647 1.00 0.00 C ATOM 828 CG2 VAL A 59 -6.115 -1.946 6.114 1.00 0.00 C ATOM 0 H VAL A 59 -4.260 -1.409 8.105 1.00 0.00 H new ATOM 0 HA VAL A 59 -4.034 -4.281 7.460 1.00 0.00 H new ATOM 0 HB VAL A 59 -5.081 -3.573 5.199 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.272 -4.409 5.972 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.922 -5.365 6.630 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.757 -4.177 7.660 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.977 -2.011 5.450 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.445 -1.643 7.108 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.411 -1.210 5.725 1.00 0.00 H new ATOM 838 N GLU A 60 -2.380 -3.674 5.615 1.00 0.00 N ATOM 839 CA GLU A 60 -1.168 -3.358 4.879 1.00 0.00 C ATOM 840 C GLU A 60 -1.157 -4.091 3.536 1.00 0.00 C ATOM 841 O GLU A 60 -1.831 -5.107 3.374 1.00 0.00 O ATOM 842 CB GLU A 60 0.077 -3.697 5.700 1.00 0.00 C ATOM 843 CG GLU A 60 0.334 -2.635 6.770 1.00 0.00 C ATOM 844 CD GLU A 60 1.407 -3.100 7.757 1.00 0.00 C ATOM 845 OE1 GLU A 60 1.309 -4.267 8.194 1.00 0.00 O ATOM 846 OE2 GLU A 60 2.301 -2.277 8.053 1.00 0.00 O ATOM 0 H GLU A 60 -2.740 -4.615 5.459 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.153 -2.285 4.685 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -0.049 -4.671 6.172 1.00 0.00 H new ATOM 0 HB3 GLU A 60 0.942 -3.771 5.041 1.00 0.00 H new ATOM 0 HG2 GLU A 60 0.649 -1.705 6.296 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -0.591 -2.422 7.306 1.00 0.00 H new ATOM 853 N ALA A 61 -0.383 -3.548 2.608 1.00 0.00 N ATOM 854 CA ALA A 61 -0.275 -4.138 1.285 1.00 0.00 C ATOM 855 C ALA A 61 0.976 -3.596 0.590 1.00 0.00 C ATOM 856 O ALA A 61 1.521 -2.571 0.996 1.00 0.00 O ATOM 857 CB ALA A 61 -1.552 -3.853 0.492 1.00 0.00 C ATOM 0 H ALA A 61 0.175 -2.706 2.746 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.170 -5.221 1.356 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -1.470 -4.296 -0.501 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -2.407 -4.284 1.012 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -1.689 -2.776 0.398 1.00 0.00 H new ATOM 863 N GLN A 62 1.395 -4.309 -0.446 1.00 0.00 N ATOM 864 CA GLN A 62 2.571 -3.912 -1.201 1.00 0.00 C ATOM 865 C GLN A 62 2.531 -4.519 -2.604 1.00 0.00 C ATOM 866 O GLN A 62 1.752 -5.434 -2.867 1.00 0.00 O ATOM 867 CB GLN A 62 3.854 -4.311 -0.467 1.00 0.00 C ATOM 868 CG GLN A 62 3.768 -5.750 0.044 1.00 0.00 C ATOM 869 CD GLN A 62 4.458 -6.717 -0.920 1.00 0.00 C ATOM 870 OE1 GLN A 62 3.878 -7.198 -1.879 1.00 0.00 O ATOM 871 NE2 GLN A 62 5.727 -6.974 -0.613 1.00 0.00 N ATOM 0 H GLN A 62 0.941 -5.159 -0.780 1.00 0.00 H new ATOM 0 HA GLN A 62 2.568 -2.826 -1.296 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.707 -4.210 -1.138 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.024 -3.634 0.370 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.232 -5.819 1.028 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.723 -6.035 0.164 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.152 -6.537 0.205 1.00 0.00 H new ATOM 0 HE22 GLN A 62 6.274 -7.608 -1.196 1.00 0.00 H new ATOM 880 N THR A 63 3.380 -3.986 -3.470 1.00 0.00 N ATOM 881 CA THR A 63 3.451 -4.463 -4.840 1.00 0.00 C ATOM 882 C THR A 63 4.681 -5.354 -5.031 1.00 0.00 C ATOM 883 O THR A 63 5.456 -5.557 -4.098 1.00 0.00 O ATOM 884 CB THR A 63 3.433 -3.246 -5.767 1.00 0.00 C ATOM 885 OG1 THR A 63 4.499 -2.430 -5.290 1.00 0.00 O ATOM 886 CG2 THR A 63 2.186 -2.381 -5.572 1.00 0.00 C ATOM 0 H THR A 63 4.025 -3.228 -3.249 1.00 0.00 H new ATOM 0 HA THR A 63 2.593 -5.089 -5.086 1.00 0.00 H new ATOM 0 HB THR A 63 3.486 -3.579 -6.804 1.00 0.00 H new ATOM 0 HG1 THR A 63 5.154 -2.297 -6.006 1.00 0.00 H new ATOM 0 HG21 THR A 63 2.223 -1.531 -6.253 1.00 0.00 H new ATOM 0 HG22 THR A 63 1.296 -2.974 -5.779 1.00 0.00 H new ATOM 0 HG23 THR A 63 2.150 -2.021 -4.544 1.00 0.00 H new ATOM 894 N ALA A 64 4.821 -5.861 -6.247 1.00 0.00 N ATOM 895 CA ALA A 64 5.943 -6.725 -6.573 1.00 0.00 C ATOM 896 C ALA A 64 7.230 -5.898 -6.586 1.00 0.00 C ATOM 897 O ALA A 64 7.229 -4.748 -7.020 1.00 0.00 O ATOM 898 CB ALA A 64 5.682 -7.419 -7.912 1.00 0.00 C ATOM 0 H ALA A 64 4.176 -5.690 -7.019 1.00 0.00 H new ATOM 0 HA ALA A 64 6.059 -7.504 -5.820 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.524 -8.067 -8.156 1.00 0.00 H new ATOM 0 HB2 ALA A 64 4.773 -8.016 -7.841 1.00 0.00 H new ATOM 0 HB3 ALA A 64 5.563 -6.669 -8.694 1.00 0.00 H new ATOM 904 N LEU A 65 8.298 -6.518 -6.105 1.00 0.00 N ATOM 905 CA LEU A 65 9.590 -5.854 -6.056 1.00 0.00 C ATOM 906 C LEU A 65 10.065 -5.565 -7.481 1.00 0.00 C ATOM 907 O LEU A 65 9.942 -6.413 -8.364 1.00 0.00 O ATOM 908 CB LEU A 65 10.583 -6.675 -5.231 1.00 0.00 C ATOM 909 CG LEU A 65 10.440 -6.572 -3.711 1.00 0.00 C ATOM 910 CD1 LEU A 65 9.792 -7.832 -3.135 1.00 0.00 C ATOM 911 CD2 LEU A 65 11.787 -6.267 -3.053 1.00 0.00 C ATOM 0 H LEU A 65 8.295 -7.473 -5.746 1.00 0.00 H new ATOM 0 HA LEU A 65 9.506 -4.894 -5.547 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.482 -7.722 -5.515 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.593 -6.367 -5.503 1.00 0.00 H new ATOM 0 HG LEU A 65 9.776 -5.737 -3.486 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.702 -7.733 -2.053 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.802 -7.964 -3.571 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.410 -8.699 -3.370 1.00 0.00 H new ATOM 0 HD21 LEU A 65 11.657 -6.199 -1.973 1.00 0.00 H new ATOM 0 HD22 LEU A 65 12.494 -7.064 -3.284 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.171 -5.320 -3.433 1.00 0.00 H new ATOM 923 N LYS A 66 10.597 -4.365 -7.662 1.00 0.00 N ATOM 924 CA LYS A 66 11.090 -3.954 -8.965 1.00 0.00 C ATOM 925 C LYS A 66 12.525 -3.443 -8.824 1.00 0.00 C ATOM 926 O LYS A 66 13.010 -3.243 -7.712 1.00 0.00 O ATOM 927 CB LYS A 66 10.137 -2.943 -9.605 1.00 0.00 C ATOM 928 CG LYS A 66 8.849 -3.623 -10.072 1.00 0.00 C ATOM 929 CD LYS A 66 8.612 -3.383 -11.564 1.00 0.00 C ATOM 930 CE LYS A 66 7.166 -3.703 -11.948 1.00 0.00 C ATOM 931 NZ LYS A 66 6.909 -3.329 -13.357 1.00 0.00 N ATOM 0 H LYS A 66 10.697 -3.664 -6.928 1.00 0.00 H new ATOM 0 HA LYS A 66 11.119 -4.804 -9.647 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.898 -2.158 -8.887 1.00 0.00 H new ATOM 0 HB3 LYS A 66 10.626 -2.462 -10.452 1.00 0.00 H new ATOM 0 HG2 LYS A 66 8.908 -4.694 -9.877 1.00 0.00 H new ATOM 0 HG3 LYS A 66 8.004 -3.241 -9.500 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.836 -2.345 -11.809 1.00 0.00 H new ATOM 0 HD3 LYS A 66 9.293 -4.002 -12.148 1.00 0.00 H new ATOM 0 HE2 LYS A 66 6.973 -4.766 -11.807 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.482 -3.165 -11.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.093 -3.866 -13.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.706 -2.311 -13.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.747 -3.547 -13.933 1.00 0.00 H new ATOM 945 N LYS A 67 13.165 -3.246 -9.968 1.00 0.00 N ATOM 946 CA LYS A 67 14.535 -2.762 -9.986 1.00 0.00 C ATOM 947 C LYS A 67 14.546 -1.265 -9.670 1.00 0.00 C ATOM 948 O LYS A 67 13.774 -0.500 -10.245 1.00 0.00 O ATOM 949 CB LYS A 67 15.211 -3.116 -11.312 1.00 0.00 C ATOM 950 CG LYS A 67 16.477 -2.283 -11.521 1.00 0.00 C ATOM 951 CD LYS A 67 17.713 -3.179 -11.618 1.00 0.00 C ATOM 952 CE LYS A 67 18.103 -3.726 -10.244 1.00 0.00 C ATOM 953 NZ LYS A 67 19.094 -4.817 -10.382 1.00 0.00 N ATOM 0 H LYS A 67 12.760 -3.413 -10.889 1.00 0.00 H new ATOM 0 HA LYS A 67 15.124 -3.256 -9.213 1.00 0.00 H new ATOM 0 HB2 LYS A 67 15.463 -4.176 -11.324 1.00 0.00 H new ATOM 0 HB3 LYS A 67 14.518 -2.944 -12.135 1.00 0.00 H new ATOM 0 HG2 LYS A 67 16.381 -1.691 -12.431 1.00 0.00 H new ATOM 0 HG3 LYS A 67 16.596 -1.582 -10.695 1.00 0.00 H new ATOM 0 HD2 LYS A 67 17.514 -4.006 -12.300 1.00 0.00 H new ATOM 0 HD3 LYS A 67 18.545 -2.613 -12.037 1.00 0.00 H new ATOM 0 HE2 LYS A 67 18.518 -2.925 -9.632 1.00 0.00 H new ATOM 0 HE3 LYS A 67 17.217 -4.095 -9.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 19.348 -5.177 -9.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 18.685 -5.588 -10.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 19.946 -4.454 -10.855 1.00 0.00 H new ATOM 967 N ARG A 68 15.430 -0.892 -8.756 1.00 0.00 N ATOM 968 CA ARG A 68 15.552 0.499 -8.357 1.00 0.00 C ATOM 969 C ARG A 68 15.988 1.357 -9.547 1.00 0.00 C ATOM 970 O ARG A 68 17.167 1.386 -9.897 1.00 0.00 O ATOM 971 CB ARG A 68 16.567 0.660 -7.223 1.00 0.00 C ATOM 972 CG ARG A 68 15.972 1.464 -6.065 1.00 0.00 C ATOM 973 CD ARG A 68 16.430 0.903 -4.717 1.00 0.00 C ATOM 974 NE ARG A 68 16.669 2.010 -3.764 1.00 0.00 N ATOM 975 CZ ARG A 68 17.639 2.924 -3.902 1.00 0.00 C ATOM 976 NH1 ARG A 68 18.467 2.869 -4.954 1.00 0.00 N ATOM 977 NH2 ARG A 68 17.782 3.893 -2.987 1.00 0.00 N ATOM 0 H ARG A 68 16.069 -1.530 -8.281 1.00 0.00 H new ATOM 0 HA ARG A 68 14.575 0.829 -8.005 1.00 0.00 H new ATOM 0 HB2 ARG A 68 16.878 -0.322 -6.867 1.00 0.00 H new ATOM 0 HB3 ARG A 68 17.460 1.161 -7.597 1.00 0.00 H new ATOM 0 HG2 ARG A 68 16.273 2.508 -6.150 1.00 0.00 H new ATOM 0 HG3 ARG A 68 14.884 1.440 -6.122 1.00 0.00 H new ATOM 0 HD2 ARG A 68 15.674 0.226 -4.319 1.00 0.00 H new ATOM 0 HD3 ARG A 68 17.342 0.320 -4.847 1.00 0.00 H new ATOM 0 HE ARG A 68 16.057 2.082 -2.951 1.00 0.00 H new ATOM 0 HH11 ARG A 68 18.359 2.131 -5.650 1.00 0.00 H new ATOM 0 HH12 ARG A 68 19.205 3.565 -5.059 1.00 0.00 H new ATOM 0 HH21 ARG A 68 17.152 3.935 -2.186 1.00 0.00 H new ATOM 0 HH22 ARG A 68 18.520 4.589 -3.092 1.00 0.00 H new ATOM 991 N GLN A 69 15.013 2.034 -10.136 1.00 0.00 N ATOM 992 CA GLN A 69 15.281 2.890 -11.279 1.00 0.00 C ATOM 993 C GLN A 69 14.876 4.332 -10.969 1.00 0.00 C ATOM 994 O GLN A 69 14.283 4.604 -9.926 1.00 0.00 O ATOM 995 CB GLN A 69 14.563 2.376 -12.529 1.00 0.00 C ATOM 996 CG GLN A 69 14.867 0.895 -12.766 1.00 0.00 C ATOM 997 CD GLN A 69 15.682 0.702 -14.047 1.00 0.00 C ATOM 998 OE1 GLN A 69 16.467 1.545 -14.447 1.00 0.00 O ATOM 999 NE2 GLN A 69 15.451 -0.453 -14.665 1.00 0.00 N ATOM 0 H GLN A 69 14.036 2.007 -9.843 1.00 0.00 H new ATOM 0 HA GLN A 69 16.352 2.869 -11.480 1.00 0.00 H new ATOM 0 HB2 GLN A 69 13.488 2.517 -12.419 1.00 0.00 H new ATOM 0 HB3 GLN A 69 14.874 2.958 -13.397 1.00 0.00 H new ATOM 0 HG2 GLN A 69 15.418 0.492 -11.916 1.00 0.00 H new ATOM 0 HG3 GLN A 69 13.934 0.335 -12.836 1.00 0.00 H new ATOM 0 HE21 GLN A 69 14.780 -1.115 -14.275 1.00 0.00 H new ATOM 0 HE22 GLN A 69 15.945 -0.677 -15.529 1.00 0.00 H new ATOM 1008 N LEU A 70 15.214 5.220 -11.893 1.00 0.00 N ATOM 1009 CA LEU A 70 14.894 6.628 -11.731 1.00 0.00 C ATOM 1010 C LEU A 70 13.375 6.806 -11.751 1.00 0.00 C ATOM 1011 O LEU A 70 12.861 7.836 -11.316 1.00 0.00 O ATOM 1012 CB LEU A 70 15.626 7.468 -12.779 1.00 0.00 C ATOM 1013 CG LEU A 70 16.444 8.645 -12.244 1.00 0.00 C ATOM 1014 CD1 LEU A 70 15.530 9.747 -11.705 1.00 0.00 C ATOM 1015 CD2 LEU A 70 17.458 8.177 -11.198 1.00 0.00 C ATOM 0 H LEU A 70 15.706 4.991 -12.757 1.00 0.00 H new ATOM 0 HA LEU A 70 15.245 6.990 -10.765 1.00 0.00 H new ATOM 0 HB2 LEU A 70 16.293 6.813 -13.340 1.00 0.00 H new ATOM 0 HB3 LEU A 70 14.890 7.854 -13.485 1.00 0.00 H new ATOM 0 HG LEU A 70 17.010 9.073 -13.071 1.00 0.00 H new ATOM 0 HD11 LEU A 70 16.136 10.572 -11.331 1.00 0.00 H new ATOM 0 HD12 LEU A 70 14.882 10.106 -12.505 1.00 0.00 H new ATOM 0 HD13 LEU A 70 14.919 9.349 -10.895 1.00 0.00 H new ATOM 0 HD21 LEU A 70 18.026 9.033 -10.834 1.00 0.00 H new ATOM 0 HD22 LEU A 70 16.932 7.710 -10.365 1.00 0.00 H new ATOM 0 HD23 LEU A 70 18.139 7.455 -11.649 1.00 0.00 H new ATOM 1027 N HIS A 71 12.698 5.787 -12.259 1.00 0.00 N ATOM 1028 CA HIS A 71 11.247 5.818 -12.342 1.00 0.00 C ATOM 1029 C HIS A 71 10.702 4.389 -12.332 1.00 0.00 C ATOM 1030 O HIS A 71 10.645 3.736 -13.373 1.00 0.00 O ATOM 1031 CB HIS A 71 10.790 6.620 -13.562 1.00 0.00 C ATOM 1032 CG HIS A 71 9.322 6.974 -13.549 1.00 0.00 C ATOM 1033 ND1 HIS A 71 8.622 7.313 -14.694 1.00 0.00 N ATOM 1034 CD2 HIS A 71 8.429 7.037 -12.519 1.00 0.00 C ATOM 1035 CE1 HIS A 71 7.366 7.567 -14.357 1.00 0.00 C ATOM 1036 NE2 HIS A 71 7.249 7.396 -13.009 1.00 0.00 N ATOM 0 H HIS A 71 13.127 4.934 -12.618 1.00 0.00 H new ATOM 0 HA HIS A 71 10.840 6.330 -11.470 1.00 0.00 H new ATOM 0 HB2 HIS A 71 11.374 7.538 -13.620 1.00 0.00 H new ATOM 0 HB3 HIS A 71 11.007 6.047 -14.463 1.00 0.00 H new ATOM 0 HD1 HIS A 71 9.008 7.359 -15.637 1.00 0.00 H new ATOM 0 HD2 HIS A 71 8.646 6.830 -11.481 1.00 0.00 H new ATOM 0 HE1 HIS A 71 6.574 7.858 -15.031 1.00 0.00 H new ATOM 1044 N THR A 72 10.314 3.946 -11.146 1.00 0.00 N ATOM 1045 CA THR A 72 9.775 2.606 -10.987 1.00 0.00 C ATOM 1046 C THR A 72 8.246 2.638 -11.024 1.00 0.00 C ATOM 1047 O THR A 72 7.623 3.479 -10.377 1.00 0.00 O ATOM 1048 CB THR A 72 10.339 2.019 -9.691 1.00 0.00 C ATOM 1049 OG1 THR A 72 11.740 1.928 -9.933 1.00 0.00 O ATOM 1050 CG2 THR A 72 9.904 0.570 -9.466 1.00 0.00 C ATOM 0 H THR A 72 10.362 4.491 -10.285 1.00 0.00 H new ATOM 0 HA THR A 72 10.076 1.959 -11.811 1.00 0.00 H new ATOM 0 HB THR A 72 10.018 2.629 -8.846 1.00 0.00 H new ATOM 0 HG1 THR A 72 12.009 0.986 -9.946 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.332 0.202 -8.533 1.00 0.00 H new ATOM 0 HG22 THR A 72 8.817 0.521 -9.411 1.00 0.00 H new ATOM 0 HG23 THR A 72 10.253 -0.047 -10.293 1.00 0.00 H new ATOM 1058 N THR A 73 7.685 1.712 -11.788 1.00 0.00 N ATOM 1059 CA THR A 73 6.240 1.625 -11.918 1.00 0.00 C ATOM 1060 C THR A 73 5.778 0.174 -11.762 1.00 0.00 C ATOM 1061 O THR A 73 6.533 -0.755 -12.042 1.00 0.00 O ATOM 1062 CB THR A 73 5.847 2.247 -13.260 1.00 0.00 C ATOM 1063 OG1 THR A 73 6.626 1.532 -14.215 1.00 0.00 O ATOM 1064 CG2 THR A 73 6.325 3.694 -13.396 1.00 0.00 C ATOM 0 H THR A 73 8.204 1.016 -12.323 1.00 0.00 H new ATOM 0 HA THR A 73 5.737 2.181 -11.127 1.00 0.00 H new ATOM 0 HB THR A 73 4.764 2.211 -13.374 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.432 1.870 -15.114 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.020 4.088 -14.366 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.884 4.299 -12.604 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.412 3.727 -13.316 1.00 0.00 H new ATOM 1072 N TRP A 74 4.539 0.027 -11.316 1.00 0.00 N ATOM 1073 CA TRP A 74 3.967 -1.295 -11.120 1.00 0.00 C ATOM 1074 C TRP A 74 2.697 -1.391 -11.968 1.00 0.00 C ATOM 1075 O TRP A 74 2.246 -0.395 -12.531 1.00 0.00 O ATOM 1076 CB TRP A 74 3.717 -1.569 -9.636 1.00 0.00 C ATOM 1077 CG TRP A 74 4.985 -1.564 -8.779 1.00 0.00 C ATOM 1078 CD1 TRP A 74 5.650 -2.617 -8.285 1.00 0.00 C ATOM 1079 CD2 TRP A 74 5.718 -0.403 -8.334 1.00 0.00 C ATOM 1080 NE1 TRP A 74 6.754 -2.222 -7.557 1.00 0.00 N ATOM 1081 CE2 TRP A 74 6.796 -0.833 -7.588 1.00 0.00 C ATOM 1082 CE3 TRP A 74 5.477 0.964 -8.555 1.00 0.00 C ATOM 1083 CZ2 TRP A 74 7.719 0.041 -7.002 1.00 0.00 C ATOM 1084 CZ3 TRP A 74 6.409 1.825 -7.963 1.00 0.00 C ATOM 1085 CH2 TRP A 74 7.500 1.409 -7.208 1.00 0.00 C ATOM 0 H TRP A 74 3.916 0.801 -11.085 1.00 0.00 H new ATOM 0 HA TRP A 74 4.662 -2.069 -11.446 1.00 0.00 H new ATOM 0 HB2 TRP A 74 3.027 -0.819 -9.250 1.00 0.00 H new ATOM 0 HB3 TRP A 74 3.226 -2.537 -9.534 1.00 0.00 H new ATOM 0 HD1 TRP A 74 5.359 -3.646 -8.437 1.00 0.00 H new ATOM 0 HE1 TRP A 74 7.417 -2.836 -7.084 1.00 0.00 H new ATOM 0 HE3 TRP A 74 4.639 1.322 -9.135 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 8.555 -0.320 -6.422 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 6.271 2.887 -8.103 1.00 0.00 H new ATOM 0 HH2 TRP A 74 8.175 2.137 -6.783 1.00 0.00 H new ATOM 1096 N GLU A 75 2.157 -2.599 -12.032 1.00 0.00 N ATOM 1097 CA GLU A 75 0.948 -2.838 -12.802 1.00 0.00 C ATOM 1098 C GLU A 75 -0.276 -2.833 -11.884 1.00 0.00 C ATOM 1099 O GLU A 75 -1.302 -2.242 -12.216 1.00 0.00 O ATOM 1100 CB GLU A 75 1.045 -4.153 -13.579 1.00 0.00 C ATOM 1101 CG GLU A 75 2.093 -4.057 -14.690 1.00 0.00 C ATOM 1102 CD GLU A 75 2.593 -5.446 -15.092 1.00 0.00 C ATOM 1103 OE1 GLU A 75 1.809 -6.164 -15.749 1.00 0.00 O ATOM 1104 OE2 GLU A 75 3.750 -5.758 -14.733 1.00 0.00 O ATOM 0 H GLU A 75 2.534 -3.423 -11.563 1.00 0.00 H new ATOM 0 HA GLU A 75 0.837 -2.032 -13.527 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.305 -4.964 -12.898 1.00 0.00 H new ATOM 0 HB3 GLU A 75 0.074 -4.397 -14.010 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.664 -3.556 -15.558 1.00 0.00 H new ATOM 0 HG3 GLU A 75 2.932 -3.448 -14.352 1.00 0.00 H new ATOM 1111 N GLU A 76 -0.126 -3.498 -10.747 1.00 0.00 N ATOM 1112 CA GLU A 76 -1.206 -3.577 -9.779 1.00 0.00 C ATOM 1113 C GLU A 76 -1.066 -2.467 -8.735 1.00 0.00 C ATOM 1114 O GLU A 76 -0.028 -1.812 -8.656 1.00 0.00 O ATOM 1115 CB GLU A 76 -1.246 -4.954 -9.113 1.00 0.00 C ATOM 1116 CG GLU A 76 -0.017 -5.171 -8.229 1.00 0.00 C ATOM 1117 CD GLU A 76 0.052 -6.616 -7.731 1.00 0.00 C ATOM 1118 OE1 GLU A 76 -0.122 -7.517 -8.579 1.00 0.00 O ATOM 1119 OE2 GLU A 76 0.278 -6.787 -6.514 1.00 0.00 O ATOM 0 H GLU A 76 0.727 -3.987 -10.475 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.150 -3.437 -10.305 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.151 -5.045 -8.512 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.291 -5.730 -9.877 1.00 0.00 H new ATOM 0 HG2 GLU A 76 0.886 -4.933 -8.791 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.052 -4.491 -7.378 1.00 0.00 H new ATOM 1126 N GLY A 77 -2.126 -2.290 -7.960 1.00 0.00 N ATOM 1127 CA GLY A 77 -2.134 -1.270 -6.925 1.00 0.00 C ATOM 1128 C GLY A 77 -2.246 -1.901 -5.536 1.00 0.00 C ATOM 1129 O GLY A 77 -2.456 -3.107 -5.412 1.00 0.00 O ATOM 0 H GLY A 77 -2.985 -2.836 -8.028 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -1.222 -0.677 -6.987 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -2.969 -0.588 -7.087 1.00 0.00 H new ATOM 1133 N LEU A 78 -2.099 -1.058 -4.524 1.00 0.00 N ATOM 1134 CA LEU A 78 -2.181 -1.518 -3.148 1.00 0.00 C ATOM 1135 C LEU A 78 -3.651 -1.624 -2.737 1.00 0.00 C ATOM 1136 O LEU A 78 -4.400 -0.654 -2.843 1.00 0.00 O ATOM 1137 CB LEU A 78 -1.350 -0.617 -2.232 1.00 0.00 C ATOM 1138 CG LEU A 78 0.108 -0.404 -2.645 1.00 0.00 C ATOM 1139 CD1 LEU A 78 0.768 0.678 -1.788 1.00 0.00 C ATOM 1140 CD2 LEU A 78 0.887 -1.720 -2.605 1.00 0.00 C ATOM 0 H LEU A 78 -1.924 -0.059 -4.630 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.750 -2.515 -3.053 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.837 0.357 -2.174 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.364 -1.041 -1.228 1.00 0.00 H new ATOM 0 HG LEU A 78 0.123 -0.052 -3.676 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.803 0.810 -2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.229 1.618 -1.910 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.742 0.379 -0.740 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.920 -1.541 -2.903 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.866 -2.125 -1.593 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.431 -2.434 -3.291 1.00 0.00 H new ATOM 1152 N VAL A 79 -4.020 -2.810 -2.276 1.00 0.00 N ATOM 1153 CA VAL A 79 -5.386 -3.055 -1.849 1.00 0.00 C ATOM 1154 C VAL A 79 -5.418 -3.225 -0.329 1.00 0.00 C ATOM 1155 O VAL A 79 -4.633 -3.990 0.230 1.00 0.00 O ATOM 1156 CB VAL A 79 -5.961 -4.259 -2.597 1.00 0.00 C ATOM 1157 CG1 VAL A 79 -7.463 -4.399 -2.340 1.00 0.00 C ATOM 1158 CG2 VAL A 79 -5.667 -4.165 -4.096 1.00 0.00 C ATOM 0 H VAL A 79 -3.396 -3.612 -2.189 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.021 -2.204 -2.095 1.00 0.00 H new ATOM 0 HB VAL A 79 -5.472 -5.155 -2.215 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.846 -5.263 -2.884 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.638 -4.535 -1.273 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.976 -3.499 -2.680 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -6.087 -5.033 -4.604 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.116 -3.257 -4.499 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.589 -4.138 -4.254 1.00 0.00 H new ATOM 1168 N LEU A 80 -6.333 -2.501 0.297 1.00 0.00 N ATOM 1169 CA LEU A 80 -6.477 -2.562 1.742 1.00 0.00 C ATOM 1170 C LEU A 80 -7.964 -2.574 2.102 1.00 0.00 C ATOM 1171 O LEU A 80 -8.733 -1.751 1.607 1.00 0.00 O ATOM 1172 CB LEU A 80 -5.693 -1.429 2.407 1.00 0.00 C ATOM 1173 CG LEU A 80 -4.221 -1.308 2.007 1.00 0.00 C ATOM 1174 CD1 LEU A 80 -3.807 0.160 1.880 1.00 0.00 C ATOM 1175 CD2 LEU A 80 -3.323 -2.074 2.980 1.00 0.00 C ATOM 0 H LEU A 80 -6.983 -1.868 -0.170 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.047 -3.486 2.129 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.190 -0.486 2.178 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.746 -1.563 3.487 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.095 -1.765 1.025 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -2.757 0.218 1.595 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -4.417 0.646 1.118 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.952 0.663 2.836 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.282 -1.971 2.672 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.446 -1.669 3.984 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.600 -3.128 2.977 1.00 0.00 H new ATOM 1187 N PRO A 81 -8.334 -3.541 2.983 1.00 0.00 N ATOM 1188 CA PRO A 81 -9.715 -3.672 3.415 1.00 0.00 C ATOM 1189 C PRO A 81 -10.083 -2.573 4.414 1.00 0.00 C ATOM 1190 O PRO A 81 -9.487 -2.477 5.486 1.00 0.00 O ATOM 1191 CB PRO A 81 -9.813 -5.068 4.007 1.00 0.00 C ATOM 1192 CG PRO A 81 -8.385 -5.494 4.307 1.00 0.00 C ATOM 1193 CD PRO A 81 -7.451 -4.533 3.590 1.00 0.00 C ATOM 0 HA PRO A 81 -10.424 -3.551 2.596 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -10.419 -5.066 4.913 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -10.287 -5.757 3.308 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -8.199 -5.477 5.381 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -8.213 -6.516 3.970 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -6.752 -4.068 4.285 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -6.856 -5.048 2.836 1.00 0.00 H new ATOM 1201 N LEU A 82 -11.064 -1.770 4.027 1.00 0.00 N ATOM 1202 CA LEU A 82 -11.519 -0.681 4.875 1.00 0.00 C ATOM 1203 C LEU A 82 -13.027 -0.496 4.695 1.00 0.00 C ATOM 1204 O LEU A 82 -13.519 -0.440 3.569 1.00 0.00 O ATOM 1205 CB LEU A 82 -10.706 0.586 4.602 1.00 0.00 C ATOM 1206 CG LEU A 82 -11.208 1.863 5.279 1.00 0.00 C ATOM 1207 CD1 LEU A 82 -12.258 2.565 4.415 1.00 0.00 C ATOM 1208 CD2 LEU A 82 -11.728 1.570 6.687 1.00 0.00 C ATOM 0 H LEU A 82 -11.556 -1.852 3.137 1.00 0.00 H new ATOM 0 HA LEU A 82 -11.350 -0.919 5.925 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.678 0.410 4.919 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.683 0.754 3.525 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.366 2.547 5.383 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -12.598 3.470 4.919 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.820 2.829 3.452 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -13.105 1.897 4.257 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -12.078 2.495 7.145 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -12.552 0.858 6.630 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.925 1.148 7.291 1.00 0.00 H new ATOM 1220 N ALA A 83 -13.718 -0.406 5.822 1.00 0.00 N ATOM 1221 CA ALA A 83 -15.160 -0.228 5.803 1.00 0.00 C ATOM 1222 C ALA A 83 -15.485 1.238 5.507 1.00 0.00 C ATOM 1223 O ALA A 83 -14.689 2.127 5.807 1.00 0.00 O ATOM 1224 CB ALA A 83 -15.751 -0.699 7.133 1.00 0.00 C ATOM 0 H ALA A 83 -13.306 -0.453 6.754 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.610 -0.831 5.015 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -16.833 -0.565 7.118 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -15.518 -1.753 7.282 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -15.324 -0.115 7.948 1.00 0.00 H new ATOM 1230 N GLU A 84 -16.656 1.446 4.923 1.00 0.00 N ATOM 1231 CA GLU A 84 -17.096 2.788 4.584 1.00 0.00 C ATOM 1232 C GLU A 84 -17.450 3.567 5.853 1.00 0.00 C ATOM 1233 O GLU A 84 -17.519 4.795 5.833 1.00 0.00 O ATOM 1234 CB GLU A 84 -18.279 2.750 3.616 1.00 0.00 C ATOM 1235 CG GLU A 84 -18.425 4.080 2.874 1.00 0.00 C ATOM 1236 CD GLU A 84 -19.899 4.452 2.699 1.00 0.00 C ATOM 1237 OE1 GLU A 84 -20.603 3.676 2.017 1.00 0.00 O ATOM 1238 OE2 GLU A 84 -20.289 5.503 3.252 1.00 0.00 O ATOM 0 H GLU A 84 -17.314 0.707 4.676 1.00 0.00 H new ATOM 0 HA GLU A 84 -16.276 3.302 4.082 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -18.139 1.942 2.897 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -19.195 2.533 4.165 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -17.911 4.867 3.426 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -17.946 4.010 1.898 1.00 0.00 H new ATOM 1245 N GLU A 85 -17.665 2.821 6.926 1.00 0.00 N ATOM 1246 CA GLU A 85 -18.011 3.426 8.201 1.00 0.00 C ATOM 1247 C GLU A 85 -16.745 3.864 8.941 1.00 0.00 C ATOM 1248 O GLU A 85 -16.824 4.514 9.982 1.00 0.00 O ATOM 1249 CB GLU A 85 -18.842 2.466 9.056 1.00 0.00 C ATOM 1250 CG GLU A 85 -17.982 1.315 9.580 1.00 0.00 C ATOM 1251 CD GLU A 85 -18.831 0.066 9.830 1.00 0.00 C ATOM 1252 OE1 GLU A 85 -19.332 -0.488 8.829 1.00 0.00 O ATOM 1253 OE2 GLU A 85 -18.958 -0.305 11.017 1.00 0.00 O ATOM 0 H GLU A 85 -17.606 1.803 6.939 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.620 4.309 8.009 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -19.282 3.007 9.894 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -19.667 2.068 8.465 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -17.196 1.087 8.860 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -17.490 1.616 10.505 1.00 0.00 H new ATOM 1260 N GLU A 86 -15.608 3.490 8.375 1.00 0.00 N ATOM 1261 CA GLU A 86 -14.327 3.836 8.968 1.00 0.00 C ATOM 1262 C GLU A 86 -13.554 4.783 8.047 1.00 0.00 C ATOM 1263 O GLU A 86 -12.508 5.306 8.426 1.00 0.00 O ATOM 1264 CB GLU A 86 -13.508 2.581 9.275 1.00 0.00 C ATOM 1265 CG GLU A 86 -14.316 1.591 10.116 1.00 0.00 C ATOM 1266 CD GLU A 86 -13.605 1.285 11.436 1.00 0.00 C ATOM 1267 OE1 GLU A 86 -12.391 0.993 11.372 1.00 0.00 O ATOM 1268 OE2 GLU A 86 -14.292 1.349 12.479 1.00 0.00 O ATOM 0 H GLU A 86 -15.546 2.950 7.512 1.00 0.00 H new ATOM 0 HA GLU A 86 -14.513 4.349 9.912 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.201 2.106 8.343 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -12.598 2.858 9.807 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -15.305 2.002 10.318 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -14.463 0.668 9.556 1.00 0.00 H new ATOM 1275 N LEU A 87 -14.100 4.974 6.855 1.00 0.00 N ATOM 1276 CA LEU A 87 -13.475 5.849 5.878 1.00 0.00 C ATOM 1277 C LEU A 87 -12.962 7.107 6.580 1.00 0.00 C ATOM 1278 O LEU A 87 -11.802 7.485 6.416 1.00 0.00 O ATOM 1279 CB LEU A 87 -14.438 6.139 4.725 1.00 0.00 C ATOM 1280 CG LEU A 87 -14.396 5.156 3.552 1.00 0.00 C ATOM 1281 CD1 LEU A 87 -15.597 5.356 2.626 1.00 0.00 C ATOM 1282 CD2 LEU A 87 -13.068 5.260 2.799 1.00 0.00 C ATOM 0 H LEU A 87 -14.968 4.538 6.544 1.00 0.00 H new ATOM 0 HA LEU A 87 -12.611 5.360 5.427 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -15.453 6.157 5.122 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -14.227 7.138 4.344 1.00 0.00 H new ATOM 0 HG LEU A 87 -14.463 4.144 3.951 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -15.543 4.645 1.801 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -16.519 5.194 3.185 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -15.587 6.372 2.231 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -13.063 4.552 1.971 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -12.947 6.272 2.412 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -12.246 5.031 3.477 1.00 0.00 H new ATOM 1294 N PRO A 88 -13.873 7.738 7.369 1.00 0.00 N ATOM 1295 CA PRO A 88 -13.524 8.946 8.097 1.00 0.00 C ATOM 1296 C PRO A 88 -12.648 8.621 9.309 1.00 0.00 C ATOM 1297 O PRO A 88 -11.904 9.475 9.788 1.00 0.00 O ATOM 1298 CB PRO A 88 -14.854 9.575 8.477 1.00 0.00 C ATOM 1299 CG PRO A 88 -15.888 8.467 8.355 1.00 0.00 C ATOM 1300 CD PRO A 88 -15.254 7.320 7.587 1.00 0.00 C ATOM 0 HA PRO A 88 -12.927 9.638 7.503 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -14.823 9.971 9.492 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -15.095 10.409 7.817 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -16.209 8.134 9.342 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -16.776 8.829 7.836 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -15.301 6.390 8.154 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.768 7.144 6.642 1.00 0.00 H new ATOM 1308 N THR A 89 -12.767 7.385 9.770 1.00 0.00 N ATOM 1309 CA THR A 89 -11.995 6.937 10.918 1.00 0.00 C ATOM 1310 C THR A 89 -10.866 6.007 10.470 1.00 0.00 C ATOM 1311 O THR A 89 -10.432 5.142 11.229 1.00 0.00 O ATOM 1312 CB THR A 89 -12.960 6.287 11.911 1.00 0.00 C ATOM 1313 OG1 THR A 89 -13.136 4.964 11.410 1.00 0.00 O ATOM 1314 CG2 THR A 89 -14.362 6.897 11.852 1.00 0.00 C ATOM 0 H THR A 89 -13.386 6.680 9.370 1.00 0.00 H new ATOM 0 HA THR A 89 -11.506 7.773 11.418 1.00 0.00 H new ATOM 0 HB THR A 89 -12.563 6.388 12.921 1.00 0.00 H new ATOM 0 HG1 THR A 89 -14.017 4.628 11.676 1.00 0.00 H new ATOM 0 HG21 THR A 89 -15.006 6.399 12.577 1.00 0.00 H new ATOM 0 HG22 THR A 89 -14.306 7.960 12.086 1.00 0.00 H new ATOM 0 HG23 THR A 89 -14.774 6.767 10.851 1.00 0.00 H new ATOM 1322 N ALA A 90 -10.421 6.218 9.240 1.00 0.00 N ATOM 1323 CA ALA A 90 -9.349 5.410 8.683 1.00 0.00 C ATOM 1324 C ALA A 90 -8.470 6.284 7.788 1.00 0.00 C ATOM 1325 O ALA A 90 -8.955 7.227 7.164 1.00 0.00 O ATOM 1326 CB ALA A 90 -9.947 4.220 7.930 1.00 0.00 C ATOM 0 H ALA A 90 -10.783 6.937 8.613 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.717 5.011 9.476 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.144 3.613 7.512 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -10.539 3.615 8.617 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.585 4.583 7.124 1.00 0.00 H new ATOM 1332 N THR A 91 -7.190 5.941 7.753 1.00 0.00 N ATOM 1333 CA THR A 91 -6.238 6.683 6.944 1.00 0.00 C ATOM 1334 C THR A 91 -5.220 5.732 6.312 1.00 0.00 C ATOM 1335 O THR A 91 -4.936 4.668 6.860 1.00 0.00 O ATOM 1336 CB THR A 91 -5.600 7.755 7.830 1.00 0.00 C ATOM 1337 OG1 THR A 91 -6.706 8.520 8.302 1.00 0.00 O ATOM 1338 CG2 THR A 91 -4.769 8.759 7.028 1.00 0.00 C ATOM 0 H THR A 91 -6.790 5.159 8.272 1.00 0.00 H new ATOM 0 HA THR A 91 -6.731 7.181 6.110 1.00 0.00 H new ATOM 0 HB THR A 91 -4.969 7.277 8.579 1.00 0.00 H new ATOM 0 HG1 THR A 91 -6.382 9.237 8.886 1.00 0.00 H new ATOM 0 HG21 THR A 91 -4.339 9.498 7.704 1.00 0.00 H new ATOM 0 HG22 THR A 91 -3.968 8.234 6.507 1.00 0.00 H new ATOM 0 HG23 THR A 91 -5.407 9.261 6.301 1.00 0.00 H new ATOM 1346 N LEU A 92 -4.698 6.151 5.169 1.00 0.00 N ATOM 1347 CA LEU A 92 -3.717 5.349 4.456 1.00 0.00 C ATOM 1348 C LEU A 92 -2.338 5.997 4.594 1.00 0.00 C ATOM 1349 O LEU A 92 -2.219 7.221 4.573 1.00 0.00 O ATOM 1350 CB LEU A 92 -4.153 5.134 3.005 1.00 0.00 C ATOM 1351 CG LEU A 92 -3.085 4.583 2.059 1.00 0.00 C ATOM 1352 CD1 LEU A 92 -1.936 5.579 1.890 1.00 0.00 C ATOM 1353 CD2 LEU A 92 -2.592 3.212 2.526 1.00 0.00 C ATOM 0 H LEU A 92 -4.935 7.035 4.719 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.648 4.353 4.894 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -5.003 4.451 2.999 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.506 6.086 2.608 1.00 0.00 H new ATOM 0 HG LEU A 92 -3.538 4.444 1.077 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.190 5.163 1.213 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.321 6.512 1.477 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.477 5.773 2.860 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.833 2.844 1.835 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.162 3.300 3.524 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.429 2.514 2.552 1.00 0.00 H new ATOM 1365 N THR A 93 -1.331 5.147 4.731 1.00 0.00 N ATOM 1366 CA THR A 93 0.035 5.622 4.872 1.00 0.00 C ATOM 1367 C THR A 93 0.952 4.912 3.874 1.00 0.00 C ATOM 1368 O THR A 93 1.291 3.744 4.060 1.00 0.00 O ATOM 1369 CB THR A 93 0.455 5.426 6.330 1.00 0.00 C ATOM 1370 OG1 THR A 93 -0.266 6.430 7.038 1.00 0.00 O ATOM 1371 CG2 THR A 93 1.924 5.783 6.569 1.00 0.00 C ATOM 0 H THR A 93 -1.434 4.132 4.747 1.00 0.00 H new ATOM 0 HA THR A 93 0.111 6.684 4.637 1.00 0.00 H new ATOM 0 HB THR A 93 0.281 4.390 6.621 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.054 6.373 7.993 1.00 0.00 H new ATOM 0 HG21 THR A 93 2.170 5.626 7.619 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.558 5.149 5.949 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.091 6.828 6.309 1.00 0.00 H new ATOM 1379 N LEU A 94 1.327 5.647 2.838 1.00 0.00 N ATOM 1380 CA LEU A 94 2.198 5.102 1.810 1.00 0.00 C ATOM 1381 C LEU A 94 3.636 5.070 2.331 1.00 0.00 C ATOM 1382 O LEU A 94 4.073 5.995 3.015 1.00 0.00 O ATOM 1383 CB LEU A 94 2.035 5.879 0.502 1.00 0.00 C ATOM 1384 CG LEU A 94 1.312 5.144 -0.629 1.00 0.00 C ATOM 1385 CD1 LEU A 94 0.165 4.292 -0.084 1.00 0.00 C ATOM 1386 CD2 LEU A 94 0.838 6.124 -1.704 1.00 0.00 C ATOM 0 H LEU A 94 1.044 6.615 2.688 1.00 0.00 H new ATOM 0 HA LEU A 94 1.919 4.074 1.580 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.493 6.800 0.715 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.025 6.166 0.147 1.00 0.00 H new ATOM 0 HG LEU A 94 2.020 4.464 -1.103 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.332 3.781 -0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.560 3.555 0.615 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.552 4.933 0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.327 5.576 -2.496 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.151 6.846 -1.261 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.697 6.649 -2.122 1.00 0.00 H new ATOM 1398 N THR A 95 4.332 3.997 1.988 1.00 0.00 N ATOM 1399 CA THR A 95 5.712 3.832 2.412 1.00 0.00 C ATOM 1400 C THR A 95 6.506 3.059 1.358 1.00 0.00 C ATOM 1401 O THR A 95 6.023 2.066 0.816 1.00 0.00 O ATOM 1402 CB THR A 95 5.707 3.157 3.785 1.00 0.00 C ATOM 1403 OG1 THR A 95 4.325 2.973 4.077 1.00 0.00 O ATOM 1404 CG2 THR A 95 6.202 4.085 4.896 1.00 0.00 C ATOM 0 H THR A 95 3.966 3.232 1.421 1.00 0.00 H new ATOM 0 HA THR A 95 6.213 4.795 2.509 1.00 0.00 H new ATOM 0 HB THR A 95 6.332 2.265 3.752 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.230 2.539 4.951 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.178 3.557 5.849 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.223 4.398 4.680 1.00 0.00 H new ATOM 0 HG23 THR A 95 5.557 4.962 4.951 1.00 0.00 H new ATOM 1412 N LEU A 96 7.712 3.544 1.098 1.00 0.00 N ATOM 1413 CA LEU A 96 8.577 2.910 0.117 1.00 0.00 C ATOM 1414 C LEU A 96 9.721 2.196 0.840 1.00 0.00 C ATOM 1415 O LEU A 96 10.708 2.824 1.221 1.00 0.00 O ATOM 1416 CB LEU A 96 9.048 3.931 -0.920 1.00 0.00 C ATOM 1417 CG LEU A 96 10.160 3.466 -1.863 1.00 0.00 C ATOM 1418 CD1 LEU A 96 9.659 2.366 -2.801 1.00 0.00 C ATOM 1419 CD2 LEU A 96 10.758 4.646 -2.630 1.00 0.00 C ATOM 0 H LEU A 96 8.110 4.368 1.549 1.00 0.00 H new ATOM 0 HA LEU A 96 8.029 2.152 -0.442 1.00 0.00 H new ATOM 0 HB2 LEU A 96 8.190 4.230 -1.522 1.00 0.00 H new ATOM 0 HB3 LEU A 96 9.394 4.821 -0.394 1.00 0.00 H new ATOM 0 HG LEU A 96 10.960 3.036 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 96 10.469 2.054 -3.460 1.00 0.00 H new ATOM 0 HD12 LEU A 96 9.320 1.513 -2.213 1.00 0.00 H new ATOM 0 HD13 LEU A 96 8.831 2.747 -3.399 1.00 0.00 H new ATOM 0 HD21 LEU A 96 11.546 4.288 -3.293 1.00 0.00 H new ATOM 0 HD22 LEU A 96 9.979 5.129 -3.220 1.00 0.00 H new ATOM 0 HD23 LEU A 96 11.176 5.364 -1.925 1.00 0.00 H new ATOM 1431 N ARG A 97 9.551 0.892 1.006 1.00 0.00 N ATOM 1432 CA ARG A 97 10.556 0.085 1.676 1.00 0.00 C ATOM 1433 C ARG A 97 11.460 -0.597 0.647 1.00 0.00 C ATOM 1434 O ARG A 97 11.066 -0.788 -0.502 1.00 0.00 O ATOM 1435 CB ARG A 97 9.907 -0.980 2.561 1.00 0.00 C ATOM 1436 CG ARG A 97 9.494 -0.393 3.912 1.00 0.00 C ATOM 1437 CD ARG A 97 7.971 -0.376 4.059 1.00 0.00 C ATOM 1438 NE ARG A 97 7.601 -0.379 5.492 1.00 0.00 N ATOM 1439 CZ ARG A 97 7.582 -1.477 6.261 1.00 0.00 C ATOM 1440 NH1 ARG A 97 7.911 -2.666 5.738 1.00 0.00 N ATOM 1441 NH2 ARG A 97 7.233 -1.386 7.551 1.00 0.00 N ATOM 0 H ARG A 97 8.732 0.375 0.688 1.00 0.00 H new ATOM 0 HA ARG A 97 11.150 0.749 2.304 1.00 0.00 H new ATOM 0 HB2 ARG A 97 9.033 -1.393 2.057 1.00 0.00 H new ATOM 0 HB3 ARG A 97 10.604 -1.803 2.716 1.00 0.00 H new ATOM 0 HG2 ARG A 97 9.934 -0.980 4.718 1.00 0.00 H new ATOM 0 HG3 ARG A 97 9.884 0.621 4.007 1.00 0.00 H new ATOM 0 HD2 ARG A 97 7.560 0.508 3.571 1.00 0.00 H new ATOM 0 HD3 ARG A 97 7.540 -1.245 3.562 1.00 0.00 H new ATOM 0 HE ARG A 97 7.344 0.510 5.921 1.00 0.00 H new ATOM 0 HH11 ARG A 97 8.176 -2.735 4.755 1.00 0.00 H new ATOM 0 HH12 ARG A 97 7.897 -3.502 6.323 1.00 0.00 H new ATOM 0 HH21 ARG A 97 6.982 -0.481 7.949 1.00 0.00 H new ATOM 0 HH22 ARG A 97 7.219 -2.222 8.136 1.00 0.00 H new ATOM 1455 N THR A 98 12.656 -0.947 1.098 1.00 0.00 N ATOM 1456 CA THR A 98 13.619 -1.605 0.231 1.00 0.00 C ATOM 1457 C THR A 98 13.696 -3.098 0.555 1.00 0.00 C ATOM 1458 O THR A 98 13.529 -3.496 1.707 1.00 0.00 O ATOM 1459 CB THR A 98 14.959 -0.881 0.378 1.00 0.00 C ATOM 1460 OG1 THR A 98 15.139 -0.767 1.787 1.00 0.00 O ATOM 1461 CG2 THR A 98 14.899 0.568 -0.108 1.00 0.00 C ATOM 0 H THR A 98 12.980 -0.787 2.052 1.00 0.00 H new ATOM 0 HA THR A 98 13.315 -1.547 -0.814 1.00 0.00 H new ATOM 0 HB THR A 98 15.725 -1.419 -0.180 1.00 0.00 H new ATOM 0 HG1 THR A 98 15.986 -0.310 1.973 1.00 0.00 H new ATOM 0 HG21 THR A 98 15.876 1.035 0.019 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.622 0.587 -1.162 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.157 1.116 0.472 1.00 0.00 H new ATOM 1469 N CYS A 99 13.950 -3.883 -0.482 1.00 0.00 N ATOM 1470 CA CYS A 99 14.051 -5.324 -0.322 1.00 0.00 C ATOM 1471 C CYS A 99 14.862 -5.611 0.943 1.00 0.00 C ATOM 1472 O CYS A 99 15.669 -4.785 1.368 1.00 0.00 O ATOM 1473 CB CYS A 99 14.663 -5.989 -1.556 1.00 0.00 C ATOM 1474 SG CYS A 99 14.804 -7.794 -1.290 1.00 0.00 S ATOM 0 H CYS A 99 14.089 -3.549 -1.436 1.00 0.00 H new ATOM 0 HA CYS A 99 13.054 -5.752 -0.218 1.00 0.00 H new ATOM 0 HB2 CYS A 99 14.045 -5.789 -2.431 1.00 0.00 H new ATOM 0 HB3 CYS A 99 15.647 -5.565 -1.757 1.00 0.00 H new ATOM 0 HG CYS A 99 15.323 -8.349 -2.345 1.00 0.00 H new ATOM 1480 N ASP A 100 14.621 -6.785 1.509 1.00 0.00 N ATOM 1481 CA ASP A 100 15.320 -7.191 2.716 1.00 0.00 C ATOM 1482 C ASP A 100 16.823 -6.981 2.525 1.00 0.00 C ATOM 1483 O ASP A 100 17.470 -7.728 1.792 1.00 0.00 O ATOM 1484 CB ASP A 100 15.084 -8.673 3.017 1.00 0.00 C ATOM 1485 CG ASP A 100 15.597 -9.146 4.378 1.00 0.00 C ATOM 1486 OD1 ASP A 100 16.810 -9.434 4.459 1.00 0.00 O ATOM 1487 OD2 ASP A 100 14.764 -9.208 5.308 1.00 0.00 O ATOM 0 H ASP A 100 13.951 -7.468 1.154 1.00 0.00 H new ATOM 0 HA ASP A 100 14.942 -6.590 3.543 1.00 0.00 H new ATOM 0 HB2 ASP A 100 14.014 -8.874 2.959 1.00 0.00 H new ATOM 0 HB3 ASP A 100 15.563 -9.267 2.239 1.00 0.00 H new ATOM 1492 N ARG A 101 17.336 -5.962 3.198 1.00 0.00 N ATOM 1493 CA ARG A 101 18.751 -5.644 3.112 1.00 0.00 C ATOM 1494 C ARG A 101 19.359 -5.542 4.512 1.00 0.00 C ATOM 1495 O ARG A 101 20.297 -6.266 4.840 1.00 0.00 O ATOM 1496 CB ARG A 101 18.976 -4.326 2.369 1.00 0.00 C ATOM 1497 CG ARG A 101 20.469 -4.035 2.207 1.00 0.00 C ATOM 1498 CD ARG A 101 20.969 -4.482 0.831 1.00 0.00 C ATOM 1499 NE ARG A 101 21.443 -5.883 0.896 1.00 0.00 N ATOM 1500 CZ ARG A 101 22.225 -6.454 -0.030 1.00 0.00 C ATOM 1501 NH1 ARG A 101 22.626 -5.750 -1.096 1.00 0.00 N ATOM 1502 NH2 ARG A 101 22.606 -7.731 0.111 1.00 0.00 N ATOM 0 H ARG A 101 16.797 -5.345 3.806 1.00 0.00 H new ATOM 0 HA ARG A 101 19.237 -6.447 2.559 1.00 0.00 H new ATOM 0 HB2 ARG A 101 18.502 -4.372 1.388 1.00 0.00 H new ATOM 0 HB3 ARG A 101 18.500 -3.511 2.915 1.00 0.00 H new ATOM 0 HG2 ARG A 101 20.651 -2.968 2.335 1.00 0.00 H new ATOM 0 HG3 ARG A 101 21.030 -4.550 2.987 1.00 0.00 H new ATOM 0 HD2 ARG A 101 20.168 -4.394 0.097 1.00 0.00 H new ATOM 0 HD3 ARG A 101 21.778 -3.831 0.499 1.00 0.00 H new ATOM 0 HE ARG A 101 21.157 -6.448 1.695 1.00 0.00 H new ATOM 0 HH11 ARG A 101 22.336 -4.778 -1.204 1.00 0.00 H new ATOM 0 HH12 ARG A 101 23.221 -6.186 -1.800 1.00 0.00 H new ATOM 0 HH21 ARG A 101 22.301 -8.268 0.923 1.00 0.00 H new ATOM 0 HH22 ARG A 101 23.201 -8.166 -0.594 1.00 0.00 H new ATOM 1516 N PHE A 102 18.799 -4.636 5.301 1.00 0.00 N ATOM 1517 CA PHE A 102 19.273 -4.430 6.659 1.00 0.00 C ATOM 1518 C PHE A 102 18.104 -4.357 7.643 1.00 0.00 C ATOM 1519 O PHE A 102 18.154 -4.955 8.717 1.00 0.00 O ATOM 1520 CB PHE A 102 20.021 -3.095 6.673 1.00 0.00 C ATOM 1521 CG PHE A 102 21.247 -3.058 5.758 1.00 0.00 C ATOM 1522 CD1 PHE A 102 22.267 -3.936 5.953 1.00 0.00 C ATOM 1523 CD2 PHE A 102 21.316 -2.148 4.751 1.00 0.00 C ATOM 1524 CE1 PHE A 102 23.405 -3.902 5.104 1.00 0.00 C ATOM 1525 CE2 PHE A 102 22.454 -2.114 3.902 1.00 0.00 C ATOM 1526 CZ PHE A 102 23.474 -2.992 4.096 1.00 0.00 C ATOM 0 H PHE A 102 18.021 -4.036 5.025 1.00 0.00 H new ATOM 0 HA PHE A 102 19.914 -5.259 6.960 1.00 0.00 H new ATOM 0 HB2 PHE A 102 19.334 -2.303 6.375 1.00 0.00 H new ATOM 0 HB3 PHE A 102 20.336 -2.877 7.694 1.00 0.00 H new ATOM 0 HD1 PHE A 102 22.212 -4.659 6.753 1.00 0.00 H new ATOM 0 HD2 PHE A 102 20.506 -1.451 4.596 1.00 0.00 H new ATOM 0 HE1 PHE A 102 24.215 -4.599 5.259 1.00 0.00 H new ATOM 0 HE2 PHE A 102 22.509 -1.391 3.102 1.00 0.00 H new ATOM 0 HZ PHE A 102 24.339 -2.967 3.450 1.00 0.00 H new ATOM 1536 N SER A 103 17.080 -3.619 7.242 1.00 0.00 N ATOM 1537 CA SER A 103 15.900 -3.461 8.075 1.00 0.00 C ATOM 1538 C SER A 103 16.221 -2.561 9.270 1.00 0.00 C ATOM 1539 O SER A 103 15.853 -2.872 10.402 1.00 0.00 O ATOM 1540 CB SER A 103 15.379 -4.816 8.556 1.00 0.00 C ATOM 1541 OG SER A 103 14.063 -4.722 9.094 1.00 0.00 O ATOM 0 H SER A 103 17.043 -3.124 6.351 1.00 0.00 H new ATOM 0 HA SER A 103 15.118 -2.994 7.476 1.00 0.00 H new ATOM 0 HB2 SER A 103 15.381 -5.521 7.725 1.00 0.00 H new ATOM 0 HB3 SER A 103 16.053 -5.215 9.314 1.00 0.00 H new ATOM 0 HG SER A 103 14.043 -4.033 9.790 1.00 0.00 H new ATOM 1547 N ARG A 104 16.903 -1.463 8.978 1.00 0.00 N ATOM 1548 CA ARG A 104 17.278 -0.517 10.014 1.00 0.00 C ATOM 1549 C ARG A 104 16.127 0.454 10.288 1.00 0.00 C ATOM 1550 O ARG A 104 16.330 1.666 10.337 1.00 0.00 O ATOM 1551 CB ARG A 104 18.521 0.279 9.611 1.00 0.00 C ATOM 1552 CG ARG A 104 19.782 -0.579 9.728 1.00 0.00 C ATOM 1553 CD ARG A 104 20.756 -0.282 8.585 1.00 0.00 C ATOM 1554 NE ARG A 104 22.126 -0.690 8.968 1.00 0.00 N ATOM 1555 CZ ARG A 104 22.866 -0.063 9.893 1.00 0.00 C ATOM 1556 NH1 ARG A 104 22.373 1.005 10.534 1.00 0.00 N ATOM 1557 NH2 ARG A 104 24.099 -0.504 10.176 1.00 0.00 N ATOM 0 H ARG A 104 17.206 -1.208 8.038 1.00 0.00 H new ATOM 0 HA ARG A 104 17.502 -1.086 10.916 1.00 0.00 H new ATOM 0 HB2 ARG A 104 18.413 0.635 8.587 1.00 0.00 H new ATOM 0 HB3 ARG A 104 18.615 1.160 10.247 1.00 0.00 H new ATOM 0 HG2 ARG A 104 20.269 -0.388 10.684 1.00 0.00 H new ATOM 0 HG3 ARG A 104 19.510 -1.635 9.714 1.00 0.00 H new ATOM 0 HD2 ARG A 104 20.447 -0.815 7.686 1.00 0.00 H new ATOM 0 HD3 ARG A 104 20.738 0.782 8.348 1.00 0.00 H new ATOM 0 HE ARG A 104 22.533 -1.499 8.499 1.00 0.00 H new ATOM 0 HH11 ARG A 104 21.434 1.341 10.318 1.00 0.00 H new ATOM 0 HH12 ARG A 104 22.936 1.482 11.238 1.00 0.00 H new ATOM 0 HH21 ARG A 104 24.475 -1.317 9.687 1.00 0.00 H new ATOM 0 HH22 ARG A 104 24.662 -0.027 10.880 1.00 0.00 H new ATOM 1571 N HIS A 105 14.943 -0.116 10.459 1.00 0.00 N ATOM 1572 CA HIS A 105 13.759 0.683 10.727 1.00 0.00 C ATOM 1573 C HIS A 105 13.634 1.784 9.672 1.00 0.00 C ATOM 1574 O HIS A 105 14.502 1.926 8.811 1.00 0.00 O ATOM 1575 CB HIS A 105 13.785 1.231 12.155 1.00 0.00 C ATOM 1576 CG HIS A 105 13.602 0.177 13.221 1.00 0.00 C ATOM 1577 ND1 HIS A 105 12.598 0.238 14.171 1.00 0.00 N ATOM 1578 CD2 HIS A 105 14.305 -0.964 13.475 1.00 0.00 C ATOM 1579 CE1 HIS A 105 12.702 -0.823 14.957 1.00 0.00 C ATOM 1580 NE2 HIS A 105 13.760 -1.567 14.525 1.00 0.00 N ATOM 0 H HIS A 105 14.778 -1.122 10.417 1.00 0.00 H new ATOM 0 HA HIS A 105 12.870 0.057 10.656 1.00 0.00 H new ATOM 0 HB2 HIS A 105 14.735 1.740 12.321 1.00 0.00 H new ATOM 0 HB3 HIS A 105 13.000 1.980 12.260 1.00 0.00 H new ATOM 0 HD2 HIS A 105 15.160 -1.317 12.917 1.00 0.00 H new ATOM 0 HE1 HIS A 105 12.061 -1.058 15.794 1.00 0.00 H new ATOM 0 HE2 HIS A 105 14.080 -2.442 14.940 1.00 0.00 H new ATOM 1588 N SER A 106 12.548 2.536 9.773 1.00 0.00 N ATOM 1589 CA SER A 106 12.298 3.620 8.838 1.00 0.00 C ATOM 1590 C SER A 106 11.972 3.053 7.454 1.00 0.00 C ATOM 1591 O SER A 106 11.962 1.838 7.264 1.00 0.00 O ATOM 1592 CB SER A 106 13.500 4.564 8.755 1.00 0.00 C ATOM 1593 OG SER A 106 13.986 4.923 10.045 1.00 0.00 O ATOM 0 H SER A 106 11.831 2.416 10.488 1.00 0.00 H new ATOM 0 HA SER A 106 11.444 4.193 9.199 1.00 0.00 H new ATOM 0 HB2 SER A 106 14.298 4.086 8.187 1.00 0.00 H new ATOM 0 HB3 SER A 106 13.217 5.465 8.211 1.00 0.00 H new ATOM 0 HG SER A 106 14.942 4.717 10.103 1.00 0.00 H new ATOM 1599 N VAL A 107 11.714 3.960 6.524 1.00 0.00 N ATOM 1600 CA VAL A 107 11.389 3.566 5.164 1.00 0.00 C ATOM 1601 C VAL A 107 12.143 4.465 4.183 1.00 0.00 C ATOM 1602 O VAL A 107 12.706 5.486 4.577 1.00 0.00 O ATOM 1603 CB VAL A 107 9.873 3.597 4.959 1.00 0.00 C ATOM 1604 CG1 VAL A 107 9.150 2.892 6.108 1.00 0.00 C ATOM 1605 CG2 VAL A 107 9.371 5.033 4.794 1.00 0.00 C ATOM 0 H VAL A 107 11.723 4.967 6.685 1.00 0.00 H new ATOM 0 HA VAL A 107 11.709 2.541 4.977 1.00 0.00 H new ATOM 0 HB VAL A 107 9.648 3.056 4.040 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.074 2.928 5.938 1.00 0.00 H new ATOM 0 HG12 VAL A 107 9.474 1.853 6.159 1.00 0.00 H new ATOM 0 HG13 VAL A 107 9.386 3.392 7.047 1.00 0.00 H new ATOM 0 HG21 VAL A 107 8.291 5.026 4.650 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.614 5.608 5.687 1.00 0.00 H new ATOM 0 HG23 VAL A 107 9.850 5.489 3.927 1.00 0.00 H new ATOM 1615 N ALA A 108 12.131 4.054 2.923 1.00 0.00 N ATOM 1616 CA ALA A 108 12.807 4.809 1.882 1.00 0.00 C ATOM 1617 C ALA A 108 12.016 6.085 1.589 1.00 0.00 C ATOM 1618 O ALA A 108 12.493 6.964 0.872 1.00 0.00 O ATOM 1619 CB ALA A 108 12.977 3.930 0.642 1.00 0.00 C ATOM 0 H ALA A 108 11.663 3.207 2.600 1.00 0.00 H new ATOM 0 HA ALA A 108 13.803 5.107 2.209 1.00 0.00 H new ATOM 0 HB1 ALA A 108 13.484 4.497 -0.139 1.00 0.00 H new ATOM 0 HB2 ALA A 108 13.571 3.052 0.897 1.00 0.00 H new ATOM 0 HB3 ALA A 108 11.998 3.614 0.283 1.00 0.00 H new ATOM 1625 N GLY A 109 10.821 6.146 2.157 1.00 0.00 N ATOM 1626 CA GLY A 109 9.959 7.300 1.965 1.00 0.00 C ATOM 1627 C GLY A 109 8.513 6.973 2.342 1.00 0.00 C ATOM 1628 O GLY A 109 7.993 5.922 1.970 1.00 0.00 O ATOM 0 H GLY A 109 10.429 5.415 2.750 1.00 0.00 H new ATOM 0 HA2 GLY A 109 10.318 8.131 2.572 1.00 0.00 H new ATOM 0 HA3 GLY A 109 10.003 7.622 0.925 1.00 0.00 H new ATOM 1632 N GLU A 110 7.903 7.893 3.075 1.00 0.00 N ATOM 1633 CA GLU A 110 6.527 7.716 3.505 1.00 0.00 C ATOM 1634 C GLU A 110 5.631 8.785 2.876 1.00 0.00 C ATOM 1635 O GLU A 110 6.027 9.945 2.766 1.00 0.00 O ATOM 1636 CB GLU A 110 6.422 7.742 5.032 1.00 0.00 C ATOM 1637 CG GLU A 110 4.994 8.062 5.478 1.00 0.00 C ATOM 1638 CD GLU A 110 4.902 8.144 7.003 1.00 0.00 C ATOM 1639 OE1 GLU A 110 4.933 7.065 7.633 1.00 0.00 O ATOM 1640 OE2 GLU A 110 4.803 9.285 7.505 1.00 0.00 O ATOM 0 H GLU A 110 8.337 8.764 3.382 1.00 0.00 H new ATOM 0 HA GLU A 110 6.185 6.738 3.166 1.00 0.00 H new ATOM 0 HB2 GLU A 110 6.726 6.777 5.437 1.00 0.00 H new ATOM 0 HB3 GLU A 110 7.108 8.487 5.435 1.00 0.00 H new ATOM 0 HG2 GLU A 110 4.675 9.008 5.039 1.00 0.00 H new ATOM 0 HG3 GLU A 110 4.313 7.294 5.110 1.00 0.00 H new ATOM 1647 N LEU A 111 4.442 8.358 2.480 1.00 0.00 N ATOM 1648 CA LEU A 111 3.487 9.264 1.865 1.00 0.00 C ATOM 1649 C LEU A 111 2.146 9.157 2.594 1.00 0.00 C ATOM 1650 O LEU A 111 1.461 8.140 2.495 1.00 0.00 O ATOM 1651 CB LEU A 111 3.392 9.002 0.361 1.00 0.00 C ATOM 1652 CG LEU A 111 3.262 10.240 -0.529 1.00 0.00 C ATOM 1653 CD1 LEU A 111 2.245 11.227 0.049 1.00 0.00 C ATOM 1654 CD2 LEU A 111 4.626 10.894 -0.761 1.00 0.00 C ATOM 0 H LEU A 111 4.117 7.396 2.573 1.00 0.00 H new ATOM 0 HA LEU A 111 3.823 10.296 1.965 1.00 0.00 H new ATOM 0 HB2 LEU A 111 4.279 8.448 0.052 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.533 8.356 0.178 1.00 0.00 H new ATOM 0 HG LEU A 111 2.886 9.923 -1.502 1.00 0.00 H new ATOM 0 HD11 LEU A 111 2.172 12.098 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 111 1.270 10.745 0.121 1.00 0.00 H new ATOM 0 HD13 LEU A 111 2.568 11.543 1.041 1.00 0.00 H new ATOM 0 HD21 LEU A 111 4.505 11.771 -1.396 1.00 0.00 H new ATOM 0 HD22 LEU A 111 5.053 11.195 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 111 5.293 10.182 -1.248 1.00 0.00 H new ATOM 1666 N ARG A 112 1.811 10.220 3.309 1.00 0.00 N ATOM 1667 CA ARG A 112 0.564 10.259 4.054 1.00 0.00 C ATOM 1668 C ARG A 112 -0.600 10.602 3.123 1.00 0.00 C ATOM 1669 O ARG A 112 -0.448 11.405 2.204 1.00 0.00 O ATOM 1670 CB ARG A 112 0.628 11.291 5.182 1.00 0.00 C ATOM 1671 CG ARG A 112 -0.768 11.584 5.737 1.00 0.00 C ATOM 1672 CD ARG A 112 -1.297 10.397 6.544 1.00 0.00 C ATOM 1673 NE ARG A 112 -1.847 10.868 7.835 1.00 0.00 N ATOM 1674 CZ ARG A 112 -2.075 10.074 8.890 1.00 0.00 C ATOM 1675 NH1 ARG A 112 -1.801 8.764 8.813 1.00 0.00 N ATOM 1676 NH2 ARG A 112 -2.576 10.589 10.021 1.00 0.00 N ATOM 0 H ARG A 112 2.382 11.062 3.389 1.00 0.00 H new ATOM 0 HA ARG A 112 0.407 9.272 4.489 1.00 0.00 H new ATOM 0 HB2 ARG A 112 1.271 10.922 5.981 1.00 0.00 H new ATOM 0 HB3 ARG A 112 1.077 12.213 4.812 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.733 12.471 6.369 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.451 11.804 4.916 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.070 9.877 5.978 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -0.495 9.680 6.721 1.00 0.00 H new ATOM 0 HE ARG A 112 -2.066 11.860 7.927 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.419 8.373 7.952 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -1.974 8.159 9.616 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -2.784 11.586 10.079 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.749 9.984 10.824 1.00 0.00 H new ATOM 1690 N LEU A 113 -1.737 9.977 3.394 1.00 0.00 N ATOM 1691 CA LEU A 113 -2.926 10.206 2.591 1.00 0.00 C ATOM 1692 C LEU A 113 -4.163 10.131 3.488 1.00 0.00 C ATOM 1693 O LEU A 113 -4.060 9.795 4.667 1.00 0.00 O ATOM 1694 CB LEU A 113 -2.967 9.241 1.405 1.00 0.00 C ATOM 1695 CG LEU A 113 -1.704 9.184 0.543 1.00 0.00 C ATOM 1696 CD1 LEU A 113 -1.731 7.971 -0.390 1.00 0.00 C ATOM 1697 CD2 LEU A 113 -1.506 10.493 -0.225 1.00 0.00 C ATOM 0 H LEU A 113 -1.860 9.313 4.158 1.00 0.00 H new ATOM 0 HA LEU A 113 -2.906 11.206 2.157 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -3.170 8.239 1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -3.807 9.516 0.767 1.00 0.00 H new ATOM 0 HG LEU A 113 -0.845 9.064 1.203 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.822 7.954 -0.991 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.791 7.058 0.202 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -2.599 8.036 -1.046 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.602 10.427 -0.830 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -2.364 10.668 -0.874 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.411 11.318 0.481 1.00 0.00 H new ATOM 1709 N GLY A 114 -5.305 10.448 2.896 1.00 0.00 N ATOM 1710 CA GLY A 114 -6.561 10.421 3.626 1.00 0.00 C ATOM 1711 C GLY A 114 -7.655 9.732 2.809 1.00 0.00 C ATOM 1712 O GLY A 114 -7.715 9.885 1.590 1.00 0.00 O ATOM 0 H GLY A 114 -5.387 10.725 1.918 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.425 9.897 4.572 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -6.868 11.439 3.866 1.00 0.00 H new ATOM 1716 N LEU A 115 -8.495 8.988 3.514 1.00 0.00 N ATOM 1717 CA LEU A 115 -9.585 8.275 2.869 1.00 0.00 C ATOM 1718 C LEU A 115 -10.877 9.079 3.024 1.00 0.00 C ATOM 1719 O LEU A 115 -11.691 9.137 2.103 1.00 0.00 O ATOM 1720 CB LEU A 115 -9.682 6.845 3.406 1.00 0.00 C ATOM 1721 CG LEU A 115 -8.353 6.145 3.695 1.00 0.00 C ATOM 1722 CD1 LEU A 115 -8.582 4.716 4.189 1.00 0.00 C ATOM 1723 CD2 LEU A 115 -7.433 6.189 2.473 1.00 0.00 C ATOM 0 H LEU A 115 -8.443 8.863 4.525 1.00 0.00 H new ATOM 0 HA LEU A 115 -9.396 8.177 1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.268 6.862 4.325 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.237 6.244 2.685 1.00 0.00 H new ATOM 0 HG LEU A 115 -7.850 6.686 4.497 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.621 4.241 4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.172 4.738 5.106 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.117 4.149 3.427 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -6.495 5.684 2.705 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -7.917 5.687 1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -7.231 7.227 2.207 1.00 0.00 H new ATOM 1735 N ASP A 116 -11.026 9.680 4.195 1.00 0.00 N ATOM 1736 CA ASP A 116 -12.205 10.478 4.483 1.00 0.00 C ATOM 1737 C ASP A 116 -12.554 11.325 3.257 1.00 0.00 C ATOM 1738 O ASP A 116 -13.717 11.658 3.039 1.00 0.00 O ATOM 1739 CB ASP A 116 -11.956 11.427 5.657 1.00 0.00 C ATOM 1740 CG ASP A 116 -10.777 12.384 5.475 1.00 0.00 C ATOM 1741 OD1 ASP A 116 -9.646 11.872 5.331 1.00 0.00 O ATOM 1742 OD2 ASP A 116 -11.033 13.608 5.485 1.00 0.00 O ATOM 0 H ASP A 116 -10.349 9.630 4.956 1.00 0.00 H new ATOM 0 HA ASP A 116 -13.018 9.798 4.736 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -12.858 12.014 5.828 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -11.787 10.833 6.555 1.00 0.00 H new ATOM 1747 N GLY A 117 -11.524 11.648 2.489 1.00 0.00 N ATOM 1748 CA GLY A 117 -11.706 12.450 1.291 1.00 0.00 C ATOM 1749 C GLY A 117 -11.282 13.900 1.531 1.00 0.00 C ATOM 1750 O GLY A 117 -11.925 14.828 1.042 1.00 0.00 O ATOM 0 H GLY A 117 -10.560 11.369 2.673 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -11.121 12.027 0.474 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -12.751 12.419 0.984 1.00 0.00 H new ATOM 1754 N THR A 118 -10.203 14.050 2.284 1.00 0.00 N ATOM 1755 CA THR A 118 -9.685 15.372 2.596 1.00 0.00 C ATOM 1756 C THR A 118 -8.319 15.578 1.938 1.00 0.00 C ATOM 1757 O THR A 118 -8.227 16.164 0.861 1.00 0.00 O ATOM 1758 CB THR A 118 -9.656 15.521 4.118 1.00 0.00 C ATOM 1759 OG1 THR A 118 -11.004 15.828 4.463 1.00 0.00 O ATOM 1760 CG2 THR A 118 -8.867 16.752 4.570 1.00 0.00 C ATOM 0 H THR A 118 -9.672 13.278 2.688 1.00 0.00 H new ATOM 0 HA THR A 118 -10.327 16.155 2.191 1.00 0.00 H new ATOM 0 HB THR A 118 -9.220 14.626 4.562 1.00 0.00 H new ATOM 0 HG1 THR A 118 -11.398 15.072 4.947 1.00 0.00 H new ATOM 0 HG21 THR A 118 -8.877 16.811 5.658 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.838 16.673 4.221 1.00 0.00 H new ATOM 0 HG23 THR A 118 -9.323 17.650 4.153 1.00 0.00 H new ATOM 1768 N SER A 119 -7.292 15.085 2.615 1.00 0.00 N ATOM 1769 CA SER A 119 -5.935 15.208 2.110 1.00 0.00 C ATOM 1770 C SER A 119 -5.921 15.006 0.593 1.00 0.00 C ATOM 1771 O SER A 119 -5.650 15.941 -0.159 1.00 0.00 O ATOM 1772 CB SER A 119 -5.002 14.203 2.788 1.00 0.00 C ATOM 1773 OG SER A 119 -4.646 14.611 4.106 1.00 0.00 O ATOM 0 H SER A 119 -7.372 14.600 3.509 1.00 0.00 H new ATOM 0 HA SER A 119 -5.574 16.210 2.340 1.00 0.00 H new ATOM 0 HB2 SER A 119 -5.487 13.228 2.829 1.00 0.00 H new ATOM 0 HB3 SER A 119 -4.099 14.085 2.189 1.00 0.00 H new ATOM 0 HG SER A 119 -4.051 13.943 4.506 1.00 0.00 H new ATOM 1779 N VAL A 120 -6.215 13.779 0.189 1.00 0.00 N ATOM 1780 CA VAL A 120 -6.239 13.442 -1.224 1.00 0.00 C ATOM 1781 C VAL A 120 -7.608 12.859 -1.582 1.00 0.00 C ATOM 1782 O VAL A 120 -8.160 12.056 -0.832 1.00 0.00 O ATOM 1783 CB VAL A 120 -5.082 12.498 -1.557 1.00 0.00 C ATOM 1784 CG1 VAL A 120 -3.814 13.283 -1.898 1.00 0.00 C ATOM 1785 CG2 VAL A 120 -4.828 11.517 -0.410 1.00 0.00 C ATOM 0 H VAL A 120 -6.439 13.006 0.816 1.00 0.00 H new ATOM 0 HA VAL A 120 -6.097 14.336 -1.832 1.00 0.00 H new ATOM 0 HB VAL A 120 -5.364 11.920 -2.437 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.007 12.588 -2.131 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -4.003 13.922 -2.761 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -3.527 13.899 -1.046 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.001 10.857 -0.672 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.577 12.072 0.494 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -5.725 10.923 -0.234 1.00 0.00 H new ATOM 1795 N PRO A 121 -8.130 13.299 -2.758 1.00 0.00 N ATOM 1796 CA PRO A 121 -9.424 12.830 -3.224 1.00 0.00 C ATOM 1797 C PRO A 121 -9.328 11.400 -3.761 1.00 0.00 C ATOM 1798 O PRO A 121 -8.233 10.860 -3.907 1.00 0.00 O ATOM 1799 CB PRO A 121 -9.849 13.834 -4.283 1.00 0.00 C ATOM 1800 CG PRO A 121 -8.581 14.561 -4.700 1.00 0.00 C ATOM 1801 CD PRO A 121 -7.505 14.250 -3.672 1.00 0.00 C ATOM 0 HA PRO A 121 -10.164 12.776 -2.425 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.310 13.333 -5.134 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.587 14.531 -3.886 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.265 14.239 -5.692 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -8.757 15.635 -4.755 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.619 13.823 -4.143 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.185 15.151 -3.148 1.00 0.00 H new ATOM 1809 N LEU A 122 -10.490 10.828 -4.040 1.00 0.00 N ATOM 1810 CA LEU A 122 -10.551 9.471 -4.558 1.00 0.00 C ATOM 1811 C LEU A 122 -10.683 9.517 -6.082 1.00 0.00 C ATOM 1812 O LEU A 122 -11.154 10.508 -6.638 1.00 0.00 O ATOM 1813 CB LEU A 122 -11.666 8.684 -3.867 1.00 0.00 C ATOM 1814 CG LEU A 122 -11.430 8.337 -2.396 1.00 0.00 C ATOM 1815 CD1 LEU A 122 -12.711 7.812 -1.744 1.00 0.00 C ATOM 1816 CD2 LEU A 122 -10.266 7.357 -2.244 1.00 0.00 C ATOM 0 H LEU A 122 -11.397 11.279 -3.917 1.00 0.00 H new ATOM 0 HA LEU A 122 -9.629 8.935 -4.334 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.589 9.259 -3.940 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.824 7.757 -4.418 1.00 0.00 H new ATOM 0 HG LEU A 122 -11.152 9.250 -1.870 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.516 7.573 -0.699 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -13.488 8.574 -1.803 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.043 6.914 -2.266 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -10.119 7.127 -1.189 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.490 6.439 -2.788 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.358 7.805 -2.647 1.00 0.00 H new ATOM 1828 N GLY A 123 -10.258 8.432 -6.713 1.00 0.00 N ATOM 1829 CA GLY A 123 -10.323 8.336 -8.161 1.00 0.00 C ATOM 1830 C GLY A 123 -9.593 9.507 -8.822 1.00 0.00 C ATOM 1831 O GLY A 123 -9.822 9.804 -9.994 1.00 0.00 O ATOM 0 H GLY A 123 -9.868 7.612 -6.248 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -9.879 7.395 -8.487 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -11.365 8.325 -8.482 1.00 0.00 H new ATOM 1835 N ALA A 124 -8.730 10.141 -8.042 1.00 0.00 N ATOM 1836 CA ALA A 124 -7.965 11.273 -8.536 1.00 0.00 C ATOM 1837 C ALA A 124 -6.480 11.044 -8.250 1.00 0.00 C ATOM 1838 O ALA A 124 -6.025 11.231 -7.123 1.00 0.00 O ATOM 1839 CB ALA A 124 -8.490 12.561 -7.899 1.00 0.00 C ATOM 0 H ALA A 124 -8.544 9.892 -7.071 1.00 0.00 H new ATOM 0 HA ALA A 124 -8.081 11.372 -9.615 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -7.916 13.410 -8.270 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -9.541 12.693 -8.157 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -8.388 12.499 -6.816 1.00 0.00 H new ATOM 1845 N ALA A 125 -5.765 10.642 -9.291 1.00 0.00 N ATOM 1846 CA ALA A 125 -4.340 10.385 -9.165 1.00 0.00 C ATOM 1847 C ALA A 125 -3.616 11.695 -8.846 1.00 0.00 C ATOM 1848 O ALA A 125 -3.945 12.741 -9.402 1.00 0.00 O ATOM 1849 CB ALA A 125 -3.824 9.732 -10.449 1.00 0.00 C ATOM 0 H ALA A 125 -6.146 10.488 -10.225 1.00 0.00 H new ATOM 0 HA ALA A 125 -4.146 9.693 -8.346 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -2.755 9.539 -10.355 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -4.349 8.792 -10.615 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -3.999 10.400 -11.293 1.00 0.00 H new ATOM 1855 N GLN A 126 -2.645 11.593 -7.951 1.00 0.00 N ATOM 1856 CA GLN A 126 -1.872 12.757 -7.550 1.00 0.00 C ATOM 1857 C GLN A 126 -0.380 12.419 -7.522 1.00 0.00 C ATOM 1858 O GLN A 126 -0.002 11.253 -7.621 1.00 0.00 O ATOM 1859 CB GLN A 126 -2.340 13.286 -6.193 1.00 0.00 C ATOM 1860 CG GLN A 126 -3.840 13.589 -6.211 1.00 0.00 C ATOM 1861 CD GLN A 126 -4.098 15.056 -6.559 1.00 0.00 C ATOM 1862 OE1 GLN A 126 -3.515 15.617 -7.472 1.00 0.00 O ATOM 1863 NE2 GLN A 126 -5.004 15.645 -5.782 1.00 0.00 N ATOM 0 H GLN A 126 -2.375 10.723 -7.492 1.00 0.00 H new ATOM 0 HA GLN A 126 -2.032 13.546 -8.285 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.123 12.551 -5.418 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -1.786 14.190 -5.940 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -4.336 12.946 -6.938 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -4.273 13.361 -5.237 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -5.455 15.118 -5.035 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -5.247 16.624 -5.934 1.00 0.00 H new ATOM 1872 N TRP A 127 0.428 13.460 -7.386 1.00 0.00 N ATOM 1873 CA TRP A 127 1.870 13.289 -7.343 1.00 0.00 C ATOM 1874 C TRP A 127 2.369 13.814 -5.996 1.00 0.00 C ATOM 1875 O TRP A 127 2.711 14.989 -5.871 1.00 0.00 O ATOM 1876 CB TRP A 127 2.539 13.973 -8.537 1.00 0.00 C ATOM 1877 CG TRP A 127 2.715 13.066 -9.756 1.00 0.00 C ATOM 1878 CD1 TRP A 127 2.009 13.069 -10.895 1.00 0.00 C ATOM 1879 CD2 TRP A 127 3.693 12.017 -9.914 1.00 0.00 C ATOM 1880 NE1 TRP A 127 2.458 12.102 -11.771 1.00 0.00 N ATOM 1881 CE2 TRP A 127 3.515 11.442 -11.156 1.00 0.00 C ATOM 1882 CE3 TRP A 127 4.696 11.569 -9.036 1.00 0.00 C ATOM 1883 CZ2 TRP A 127 4.302 10.387 -11.632 1.00 0.00 C ATOM 1884 CZ3 TRP A 127 5.474 10.514 -9.527 1.00 0.00 C ATOM 1885 CH2 TRP A 127 5.307 9.924 -10.775 1.00 0.00 C ATOM 0 H TRP A 127 0.111 14.426 -7.304 1.00 0.00 H new ATOM 0 HA TRP A 127 2.136 12.235 -7.425 1.00 0.00 H new ATOM 0 HB2 TRP A 127 1.945 14.840 -8.825 1.00 0.00 H new ATOM 0 HB3 TRP A 127 3.517 14.344 -8.229 1.00 0.00 H new ATOM 0 HD1 TRP A 127 1.191 13.744 -11.101 1.00 0.00 H new ATOM 0 HE1 TRP A 127 2.083 11.907 -12.699 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.854 12.004 -8.060 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 4.142 9.953 -12.608 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 6.259 10.131 -8.892 1.00 0.00 H new ATOM 0 HH2 TRP A 127 5.950 9.112 -11.082 1.00 0.00 H new ATOM 1896 N GLY A 128 2.395 12.917 -5.020 1.00 0.00 N ATOM 1897 CA GLY A 128 2.847 13.276 -3.687 1.00 0.00 C ATOM 1898 C GLY A 128 4.357 13.073 -3.546 1.00 0.00 C ATOM 1899 O GLY A 128 4.965 12.346 -4.330 1.00 0.00 O ATOM 0 H GLY A 128 2.110 11.943 -5.126 1.00 0.00 H new ATOM 0 HA2 GLY A 128 2.596 14.317 -3.482 1.00 0.00 H new ATOM 0 HA3 GLY A 128 2.324 12.670 -2.947 1.00 0.00 H new ATOM 1903 N GLU A 129 4.919 13.728 -2.541 1.00 0.00 N ATOM 1904 CA GLU A 129 6.346 13.628 -2.287 1.00 0.00 C ATOM 1905 C GLU A 129 6.604 12.823 -1.012 1.00 0.00 C ATOM 1906 O GLU A 129 6.062 13.141 0.047 1.00 0.00 O ATOM 1907 CB GLU A 129 6.985 15.015 -2.199 1.00 0.00 C ATOM 1908 CG GLU A 129 7.940 15.255 -3.370 1.00 0.00 C ATOM 1909 CD GLU A 129 7.877 16.709 -3.840 1.00 0.00 C ATOM 1910 OE1 GLU A 129 7.030 16.986 -4.716 1.00 0.00 O ATOM 1911 OE2 GLU A 129 8.678 17.511 -3.313 1.00 0.00 O ATOM 0 H GLU A 129 4.412 14.330 -1.893 1.00 0.00 H new ATOM 0 HA GLU A 129 6.808 13.103 -3.123 1.00 0.00 H new ATOM 0 HB2 GLU A 129 6.207 15.778 -2.198 1.00 0.00 H new ATOM 0 HB3 GLU A 129 7.527 15.111 -1.258 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.959 15.010 -3.069 1.00 0.00 H new ATOM 0 HG3 GLU A 129 7.683 14.591 -4.195 1.00 0.00 H new ATOM 1918 N LEU A 130 7.430 11.798 -1.154 1.00 0.00 N ATOM 1919 CA LEU A 130 7.766 10.945 -0.026 1.00 0.00 C ATOM 1920 C LEU A 130 8.349 11.802 1.099 1.00 0.00 C ATOM 1921 O LEU A 130 9.238 12.619 0.865 1.00 0.00 O ATOM 1922 CB LEU A 130 8.685 9.805 -0.471 1.00 0.00 C ATOM 1923 CG LEU A 130 8.066 8.777 -1.420 1.00 0.00 C ATOM 1924 CD1 LEU A 130 9.151 7.961 -2.126 1.00 0.00 C ATOM 1925 CD2 LEU A 130 7.065 7.884 -0.684 1.00 0.00 C ATOM 0 H LEU A 130 7.877 11.538 -2.033 1.00 0.00 H new ATOM 0 HA LEU A 130 6.871 10.465 0.369 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.560 10.238 -0.957 1.00 0.00 H new ATOM 0 HB3 LEU A 130 9.040 9.283 0.418 1.00 0.00 H new ATOM 0 HG LEU A 130 7.512 9.313 -2.191 1.00 0.00 H new ATOM 0 HD11 LEU A 130 8.685 7.237 -2.795 1.00 0.00 H new ATOM 0 HD12 LEU A 130 9.791 8.629 -2.703 1.00 0.00 H new ATOM 0 HD13 LEU A 130 9.751 7.435 -1.384 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.640 7.162 -1.382 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.574 7.354 0.121 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.267 8.499 -0.267 1.00 0.00 H new ATOM 1937 N LYS A 131 7.826 11.585 2.297 1.00 0.00 N ATOM 1938 CA LYS A 131 8.284 12.327 3.459 1.00 0.00 C ATOM 1939 C LYS A 131 9.385 11.533 4.164 1.00 0.00 C ATOM 1940 O LYS A 131 9.266 11.214 5.346 1.00 0.00 O ATOM 1941 CB LYS A 131 7.104 12.682 4.367 1.00 0.00 C ATOM 1942 CG LYS A 131 6.221 13.753 3.724 1.00 0.00 C ATOM 1943 CD LYS A 131 6.931 15.108 3.702 1.00 0.00 C ATOM 1944 CE LYS A 131 7.364 15.477 2.282 1.00 0.00 C ATOM 1945 NZ LYS A 131 7.328 16.944 2.093 1.00 0.00 N ATOM 0 H LYS A 131 7.089 10.906 2.488 1.00 0.00 H new ATOM 0 HA LYS A 131 8.721 13.278 3.156 1.00 0.00 H new ATOM 0 HB2 LYS A 131 6.512 11.789 4.566 1.00 0.00 H new ATOM 0 HB3 LYS A 131 7.474 13.040 5.328 1.00 0.00 H new ATOM 0 HG2 LYS A 131 5.965 13.456 2.707 1.00 0.00 H new ATOM 0 HG3 LYS A 131 5.285 13.838 4.276 1.00 0.00 H new ATOM 0 HD2 LYS A 131 6.266 15.877 4.095 1.00 0.00 H new ATOM 0 HD3 LYS A 131 7.803 15.076 4.355 1.00 0.00 H new ATOM 0 HE2 LYS A 131 8.371 15.105 2.095 1.00 0.00 H new ATOM 0 HE3 LYS A 131 6.707 14.995 1.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 7.625 17.177 1.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 6.360 17.291 2.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 7.973 17.397 2.771 1.00 0.00 H new ATOM 1959 N THR A 132 10.433 11.237 3.409 1.00 0.00 N ATOM 1960 CA THR A 132 11.555 10.486 3.947 1.00 0.00 C ATOM 1961 C THR A 132 11.847 10.921 5.385 1.00 0.00 C ATOM 1962 O THR A 132 12.521 11.924 5.608 1.00 0.00 O ATOM 1963 CB THR A 132 12.744 10.671 3.003 1.00 0.00 C ATOM 1964 OG1 THR A 132 12.794 12.078 2.780 1.00 0.00 O ATOM 1965 CG2 THR A 132 12.486 10.083 1.614 1.00 0.00 C ATOM 0 H THR A 132 10.529 11.504 2.429 1.00 0.00 H new ATOM 0 HA THR A 132 11.328 9.421 4.002 1.00 0.00 H new ATOM 0 HB THR A 132 13.628 10.203 3.437 1.00 0.00 H new ATOM 0 HG1 THR A 132 12.865 12.543 3.640 1.00 0.00 H new ATOM 0 HG21 THR A 132 13.361 10.241 0.984 1.00 0.00 H new ATOM 0 HG22 THR A 132 12.291 9.014 1.702 1.00 0.00 H new ATOM 0 HG23 THR A 132 11.622 10.574 1.166 1.00 0.00 H new ATOM 1973 N SER A 133 11.325 10.143 6.322 1.00 0.00 N ATOM 1974 CA SER A 133 11.521 10.435 7.732 1.00 0.00 C ATOM 1975 C SER A 133 10.886 9.337 8.587 1.00 0.00 C ATOM 1976 O SER A 133 9.752 8.930 8.338 1.00 0.00 O ATOM 1977 CB SER A 133 10.935 11.800 8.098 1.00 0.00 C ATOM 1978 OG SER A 133 11.756 12.501 9.028 1.00 0.00 O ATOM 0 H SER A 133 10.767 9.311 6.132 1.00 0.00 H new ATOM 0 HA SER A 133 12.593 10.465 7.930 1.00 0.00 H new ATOM 0 HB2 SER A 133 10.818 12.398 7.195 1.00 0.00 H new ATOM 0 HB3 SER A 133 9.940 11.666 8.522 1.00 0.00 H new ATOM 0 HG SER A 133 11.349 13.368 9.235 1.00 0.00 H new ATOM 1984 N GLY A 134 11.644 8.889 9.577 1.00 0.00 N ATOM 1985 CA GLY A 134 11.169 7.847 10.470 1.00 0.00 C ATOM 1986 C GLY A 134 11.974 7.830 11.771 1.00 0.00 C ATOM 1987 O GLY A 134 13.105 8.313 11.812 1.00 0.00 O ATOM 0 H GLY A 134 12.584 9.229 9.780 1.00 0.00 H new ATOM 0 HA2 GLY A 134 10.114 8.007 10.693 1.00 0.00 H new ATOM 0 HA3 GLY A 134 11.247 6.878 9.977 1.00 0.00 H new ATOM 1991 N PRO A 135 11.345 7.254 12.830 1.00 0.00 N ATOM 1992 CA PRO A 135 11.990 7.168 14.129 1.00 0.00 C ATOM 1993 C PRO A 135 13.068 6.082 14.134 1.00 0.00 C ATOM 1994 O PRO A 135 13.028 5.167 14.956 1.00 0.00 O ATOM 1995 CB PRO A 135 10.864 6.892 15.111 1.00 0.00 C ATOM 1996 CG PRO A 135 9.702 6.374 14.278 1.00 0.00 C ATOM 1997 CD PRO A 135 10.006 6.671 12.819 1.00 0.00 C ATOM 0 HA PRO A 135 12.518 8.083 14.398 1.00 0.00 H new ATOM 0 HB2 PRO A 135 11.168 6.158 15.857 1.00 0.00 H new ATOM 0 HB3 PRO A 135 10.585 7.797 15.650 1.00 0.00 H new ATOM 0 HG2 PRO A 135 9.571 5.303 14.430 1.00 0.00 H new ATOM 0 HG3 PRO A 135 8.772 6.855 14.580 1.00 0.00 H new ATOM 0 HD2 PRO A 135 9.974 5.764 12.215 1.00 0.00 H new ATOM 0 HD3 PRO A 135 9.277 7.362 12.395 1.00 0.00 H new ATOM 2005 N SER A 136 14.006 6.219 13.209 1.00 0.00 N ATOM 2006 CA SER A 136 15.093 5.261 13.097 1.00 0.00 C ATOM 2007 C SER A 136 15.618 4.901 14.488 1.00 0.00 C ATOM 2008 O SER A 136 15.660 5.749 15.378 1.00 0.00 O ATOM 2009 CB SER A 136 16.225 5.811 12.227 1.00 0.00 C ATOM 2010 OG SER A 136 16.809 4.801 11.410 1.00 0.00 O ATOM 0 H SER A 136 14.036 6.979 12.530 1.00 0.00 H new ATOM 0 HA SER A 136 14.708 4.361 12.617 1.00 0.00 H new ATOM 0 HB2 SER A 136 15.840 6.611 11.595 1.00 0.00 H new ATOM 0 HB3 SER A 136 16.992 6.250 12.865 1.00 0.00 H new ATOM 0 HG SER A 136 17.526 5.192 10.869 1.00 0.00 H new ATOM 2016 N SER A 137 16.007 3.643 14.631 1.00 0.00 N ATOM 2017 CA SER A 137 16.528 3.160 15.899 1.00 0.00 C ATOM 2018 C SER A 137 17.092 1.748 15.729 1.00 0.00 C ATOM 2019 O SER A 137 16.709 1.029 14.808 1.00 0.00 O ATOM 2020 CB SER A 137 15.446 3.173 16.980 1.00 0.00 C ATOM 2021 OG SER A 137 14.621 2.013 16.924 1.00 0.00 O ATOM 0 H SER A 137 15.972 2.943 13.890 1.00 0.00 H new ATOM 0 HA SER A 137 17.328 3.828 16.217 1.00 0.00 H new ATOM 0 HB2 SER A 137 15.915 3.237 17.962 1.00 0.00 H new ATOM 0 HB3 SER A 137 14.828 4.063 16.864 1.00 0.00 H new ATOM 0 HG SER A 137 13.944 2.059 17.631 1.00 0.00 H new ATOM 2027 N GLY A 138 17.994 1.393 16.633 1.00 0.00 N ATOM 2028 CA GLY A 138 18.614 0.080 16.595 1.00 0.00 C ATOM 2029 C GLY A 138 19.719 -0.036 17.648 1.00 0.00 C ATOM 2030 O GLY A 138 19.615 0.543 18.728 1.00 0.00 O ATOM 0 H GLY A 138 18.310 1.992 17.396 1.00 0.00 H new ATOM 0 HA2 GLY A 138 17.860 -0.687 16.768 1.00 0.00 H new ATOM 0 HA3 GLY A 138 19.031 -0.101 15.604 1.00 0.00 H new TER 2034 GLY A 138