USER MOD reduce.3.24.130724 H: found=0, std=0, add=850, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 848 hydrogens (43 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 64 LYS NZ :NH3+ -117:sc= 0.385 (180deg=-1.47) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 167:sc= 0 (180deg=-0.149) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -3.96! C(o=-4!,f=-8.3!) USER MOD Single : A 79 HIS : no HD1:sc= -1.75! K(o=-1.7!,f=-0.81) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= -0.885 USER MOD Single : A 98 SER OG : rot -6:sc= 0.118 USER MOD Single : A 100 LYS NZ :NH3+ -172:sc= 0.123 (180deg=0.104) USER MOD Single : A 103 ASN : amide:sc=-0.00124 X(o=-0.0012,f=0) USER MOD Single : A 106 GLN : amide:sc= -2.85! C(o=-2.8!,f=-7.6!) USER MOD Single : A 107 HIS : no HD1:sc= -0.226 K(o=-0.23,f=-3.1!) USER MOD Single : A 109 LYS NZ :NH3+ 179:sc= 0.698 (180deg=0.697) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -1.22 X(o=-1.2,f=-1.3) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= -2.4! C(o=-2.4!,f=-3.6!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 HIS : no HE2:sc= -1.74 K(o=-1.7,f=-2.8!) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 122:sc= 0.655 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 145 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 GLN : amide:sc= -0.749 K(o=-0.75,f=-3!) USER MOD Single : A 156 GLN : amide:sc= -0.248 K(o=-0.25,f=-2.3!) USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 159 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N TRP A 60 1.179 -2.258 0.390 1.00 51.04 N ATOM 2 CA TRP A 60 1.947 -1.941 -0.809 1.00 3.21 C ATOM 3 C TRP A 60 2.540 -3.203 -1.426 1.00 31.15 C ATOM 4 O TRP A 60 3.333 -3.133 -2.365 1.00 21.54 O ATOM 5 CB TRP A 60 3.063 -0.948 -0.477 1.00 31.53 C ATOM 6 CG TRP A 60 3.777 -1.264 0.802 1.00 23.35 C ATOM 7 CD1 TRP A 60 3.734 -0.547 1.964 1.00 31.40 C ATOM 8 CD2 TRP A 60 4.643 -2.378 1.048 1.00 0.11 C ATOM 9 NE1 TRP A 60 4.521 -1.148 2.917 1.00 34.20 N ATOM 10 CE2 TRP A 60 5.088 -2.273 2.380 1.00 25.34 C ATOM 11 CE3 TRP A 60 5.084 -3.454 0.273 1.00 34.12 C ATOM 12 CZ2 TRP A 60 5.953 -3.204 2.951 1.00 11.30 C ATOM 13 CZ3 TRP A 60 5.942 -4.376 0.841 1.00 32.40 C ATOM 14 CH2 TRP A 60 6.369 -4.247 2.169 1.00 35.24 C ATOM 0 HA TRP A 60 1.271 -1.488 -1.534 1.00 3.21 H new ATOM 0 HB2 TRP A 60 3.784 -0.936 -1.294 1.00 31.53 H new ATOM 0 HB3 TRP A 60 2.640 0.054 -0.411 1.00 31.53 H new ATOM 0 HD1 TRP A 60 3.165 0.359 2.112 1.00 31.40 H new ATOM 0 HE1 TRP A 60 4.660 -0.811 3.870 1.00 34.20 H new ATOM 0 HE3 TRP A 60 4.760 -3.563 -0.751 1.00 34.12 H new ATOM 0 HZ2 TRP A 60 6.283 -3.106 3.975 1.00 11.30 H new ATOM 0 HZ3 TRP A 60 6.290 -5.211 0.251 1.00 32.40 H new ATOM 0 HH2 TRP A 60 7.040 -4.985 2.584 1.00 35.24 H new ATOM 25 N PHE A 61 2.150 -4.356 -0.892 1.00 62.22 N ATOM 26 CA PHE A 61 2.644 -5.635 -1.390 1.00 41.44 C ATOM 27 C PHE A 61 1.521 -6.433 -2.046 1.00 23.32 C ATOM 28 O PHE A 61 0.388 -6.443 -1.564 1.00 62.12 O ATOM 29 CB PHE A 61 3.264 -6.445 -0.250 1.00 73.42 C ATOM 30 CG PHE A 61 3.139 -7.931 -0.434 1.00 51.23 C ATOM 31 CD1 PHE A 61 3.613 -8.542 -1.584 1.00 21.13 C ATOM 32 CD2 PHE A 61 2.547 -8.716 0.542 1.00 52.20 C ATOM 33 CE1 PHE A 61 3.500 -9.909 -1.756 1.00 42.11 C ATOM 34 CE2 PHE A 61 2.432 -10.083 0.375 1.00 15.13 C ATOM 35 CZ PHE A 61 2.908 -10.680 -0.776 1.00 33.14 C ATOM 0 H PHE A 61 1.494 -4.431 -0.115 1.00 62.22 H new ATOM 0 HA PHE A 61 3.409 -5.434 -2.140 1.00 41.44 H new ATOM 0 HB2 PHE A 61 4.319 -6.185 -0.162 1.00 73.42 H new ATOM 0 HB3 PHE A 61 2.787 -6.162 0.688 1.00 73.42 H new ATOM 0 HD1 PHE A 61 4.076 -7.943 -2.355 1.00 21.13 H new ATOM 0 HD2 PHE A 61 2.171 -8.255 1.443 1.00 52.20 H new ATOM 0 HE1 PHE A 61 3.875 -10.373 -2.656 1.00 42.11 H new ATOM 0 HE2 PHE A 61 1.970 -10.684 1.144 1.00 15.13 H new ATOM 0 HZ PHE A 61 2.817 -11.748 -0.909 1.00 33.14 H new ATOM 45 N PHE A 62 1.844 -7.102 -3.148 1.00 3.11 N ATOM 46 CA PHE A 62 0.864 -7.903 -3.871 1.00 55.45 C ATOM 47 C PHE A 62 1.413 -9.294 -4.172 1.00 51.04 C ATOM 48 O PHE A 62 2.616 -9.472 -4.357 1.00 41.33 O ATOM 49 CB PHE A 62 0.466 -7.206 -5.175 1.00 4.14 C ATOM 50 CG PHE A 62 -0.432 -6.020 -4.970 1.00 53.14 C ATOM 51 CD1 PHE A 62 0.053 -4.858 -4.392 1.00 34.00 C ATOM 52 CD2 PHE A 62 -1.762 -6.067 -5.357 1.00 32.14 C ATOM 53 CE1 PHE A 62 -0.772 -3.765 -4.203 1.00 44.40 C ATOM 54 CE2 PHE A 62 -2.591 -4.977 -5.171 1.00 1.24 C ATOM 55 CZ PHE A 62 -2.095 -3.825 -4.592 1.00 14.40 C ATOM 0 H PHE A 62 2.777 -7.105 -3.560 1.00 3.11 H new ATOM 0 HA PHE A 62 -0.018 -8.009 -3.239 1.00 55.45 H new ATOM 0 HB2 PHE A 62 1.368 -6.883 -5.695 1.00 4.14 H new ATOM 0 HB3 PHE A 62 -0.036 -7.924 -5.823 1.00 4.14 H new ATOM 0 HD1 PHE A 62 1.087 -4.806 -4.086 1.00 34.00 H new ATOM 0 HD2 PHE A 62 -2.155 -6.966 -5.809 1.00 32.14 H new ATOM 0 HE1 PHE A 62 -0.382 -2.865 -3.751 1.00 44.40 H new ATOM 0 HE2 PHE A 62 -3.625 -5.026 -5.478 1.00 1.24 H new ATOM 0 HZ PHE A 62 -2.741 -2.973 -4.444 1.00 14.40 H new ATOM 65 N GLY A 63 0.521 -10.279 -4.219 1.00 53.22 N ATOM 66 CA GLY A 63 0.934 -11.642 -4.497 1.00 42.21 C ATOM 67 C GLY A 63 0.495 -12.113 -5.869 1.00 40.33 C ATOM 68 O GLY A 63 -0.694 -12.319 -6.112 1.00 52.45 O ATOM 0 H GLY A 63 -0.481 -10.157 -4.069 1.00 53.22 H new ATOM 0 HA2 GLY A 63 2.019 -11.712 -4.422 1.00 42.21 H new ATOM 0 HA3 GLY A 63 0.519 -12.306 -3.739 1.00 42.21 H new ATOM 72 N LYS A 64 1.456 -12.282 -6.771 1.00 25.34 N ATOM 73 CA LYS A 64 1.164 -12.731 -8.127 1.00 21.33 C ATOM 74 C LYS A 64 0.417 -11.654 -8.907 1.00 62.52 C ATOM 75 O LYS A 64 -0.812 -11.664 -8.975 1.00 33.22 O ATOM 76 CB LYS A 64 0.336 -14.018 -8.093 1.00 24.15 C ATOM 77 CG LYS A 64 0.738 -14.970 -6.980 1.00 22.54 C ATOM 78 CD LYS A 64 1.859 -15.899 -7.418 1.00 14.35 C ATOM 79 CE LYS A 64 3.124 -15.666 -6.607 1.00 22.14 C ATOM 80 NZ LYS A 64 3.862 -16.935 -6.354 1.00 1.42 N ATOM 0 H LYS A 64 2.445 -12.114 -6.587 1.00 25.34 H new ATOM 0 HA LYS A 64 2.111 -12.929 -8.630 1.00 21.33 H new ATOM 0 HB2 LYS A 64 -0.717 -13.760 -7.977 1.00 24.15 H new ATOM 0 HB3 LYS A 64 0.435 -14.529 -9.051 1.00 24.15 H new ATOM 0 HG2 LYS A 64 1.058 -14.398 -6.109 1.00 22.54 H new ATOM 0 HG3 LYS A 64 -0.126 -15.560 -6.675 1.00 22.54 H new ATOM 0 HD2 LYS A 64 1.539 -16.935 -7.306 1.00 14.35 H new ATOM 0 HD3 LYS A 64 2.070 -15.743 -8.476 1.00 14.35 H new ATOM 0 HE2 LYS A 64 3.772 -14.968 -7.137 1.00 22.14 H new ATOM 0 HE3 LYS A 64 2.865 -15.200 -5.656 1.00 22.14 H new ATOM 0 HZ1 LYS A 64 3.892 -17.121 -5.331 1.00 1.42 H new ATOM 0 HZ2 LYS A 64 3.378 -17.720 -6.834 1.00 1.42 H new ATOM 0 HZ3 LYS A 64 4.832 -16.851 -6.720 1.00 1.42 H new ATOM 94 N ILE A 65 1.167 -10.729 -9.496 1.00 24.04 N ATOM 95 CA ILE A 65 0.575 -9.648 -10.273 1.00 45.33 C ATOM 96 C ILE A 65 1.491 -9.230 -11.419 1.00 53.13 C ATOM 97 O ILE A 65 2.691 -9.020 -11.243 1.00 51.51 O ATOM 98 CB ILE A 65 0.279 -8.419 -9.394 1.00 0.42 C ATOM 99 CG1 ILE A 65 1.566 -7.906 -8.745 1.00 65.01 C ATOM 100 CG2 ILE A 65 -0.754 -8.764 -8.332 1.00 54.11 C ATOM 101 CD1 ILE A 65 1.925 -6.493 -9.148 1.00 13.43 C ATOM 0 H ILE A 65 2.186 -10.707 -9.450 1.00 24.04 H new ATOM 0 HA ILE A 65 -0.362 -10.028 -10.679 1.00 45.33 H new ATOM 0 HB ILE A 65 -0.127 -7.629 -10.026 1.00 0.42 H new ATOM 0 HG12 ILE A 65 1.459 -7.950 -7.661 1.00 65.01 H new ATOM 0 HG13 ILE A 65 2.388 -8.571 -9.011 1.00 65.01 H new ATOM 0 HG21 ILE A 65 -0.953 -7.885 -7.719 1.00 54.11 H new ATOM 0 HG22 ILE A 65 -1.677 -9.087 -8.814 1.00 54.11 H new ATOM 0 HG23 ILE A 65 -0.373 -9.568 -7.702 1.00 54.11 H new ATOM 0 HD11 ILE A 65 2.848 -6.196 -8.650 1.00 13.43 H new ATOM 0 HD12 ILE A 65 2.064 -6.447 -10.228 1.00 13.43 H new ATOM 0 HD13 ILE A 65 1.122 -5.816 -8.857 1.00 13.43 H new ATOM 113 N PRO A 66 0.912 -9.105 -12.623 1.00 2.41 N ATOM 114 CA PRO A 66 1.657 -8.708 -13.822 1.00 31.43 C ATOM 115 C PRO A 66 2.099 -7.250 -13.774 1.00 2.13 C ATOM 116 O PRO A 66 1.427 -6.407 -13.180 1.00 12.21 O ATOM 117 CB PRO A 66 0.649 -8.924 -14.953 1.00 72.52 C ATOM 118 CG PRO A 66 -0.685 -8.803 -14.300 1.00 61.55 C ATOM 119 CD PRO A 66 -0.514 -9.340 -12.906 1.00 43.41 C ATOM 0 HA PRO A 66 2.578 -9.280 -13.938 1.00 31.43 H new ATOM 0 HB2 PRO A 66 0.773 -8.181 -15.741 1.00 72.52 H new ATOM 0 HB3 PRO A 66 0.776 -9.903 -15.415 1.00 72.52 H new ATOM 0 HG2 PRO A 66 -1.017 -7.765 -14.280 1.00 61.55 H new ATOM 0 HG3 PRO A 66 -1.440 -9.369 -14.846 1.00 61.55 H new ATOM 0 HD2 PRO A 66 -1.156 -8.821 -12.194 1.00 43.41 H new ATOM 0 HD3 PRO A 66 -0.766 -10.399 -12.850 1.00 43.41 H new ATOM 127 N ARG A 67 3.233 -6.959 -14.403 1.00 23.23 N ATOM 128 CA ARG A 67 3.765 -5.602 -14.431 1.00 23.13 C ATOM 129 C ARG A 67 2.682 -4.602 -14.825 1.00 5.34 C ATOM 130 O ARG A 67 2.711 -3.445 -14.406 1.00 54.22 O ATOM 131 CB ARG A 67 4.938 -5.511 -15.408 1.00 63.44 C ATOM 132 CG ARG A 67 4.743 -6.333 -16.672 1.00 54.34 C ATOM 133 CD ARG A 67 5.825 -7.390 -16.823 1.00 20.22 C ATOM 134 NE ARG A 67 7.139 -6.889 -16.428 1.00 53.20 N ATOM 135 CZ ARG A 67 7.909 -6.147 -17.216 1.00 24.31 C ATOM 136 NH1 ARG A 67 7.500 -5.822 -18.434 1.00 72.53 N ATOM 137 NH2 ARG A 67 9.093 -5.729 -16.785 1.00 54.41 N ATOM 0 H ARG A 67 3.801 -7.645 -14.900 1.00 23.23 H new ATOM 0 HA ARG A 67 4.116 -5.356 -13.429 1.00 23.13 H new ATOM 0 HB2 ARG A 67 5.090 -4.467 -15.683 1.00 63.44 H new ATOM 0 HB3 ARG A 67 5.846 -5.844 -14.905 1.00 63.44 H new ATOM 0 HG2 ARG A 67 3.765 -6.813 -16.647 1.00 54.34 H new ATOM 0 HG3 ARG A 67 4.753 -5.674 -17.540 1.00 54.34 H new ATOM 0 HD2 ARG A 67 5.571 -8.258 -16.215 1.00 20.22 H new ATOM 0 HD3 ARG A 67 5.862 -7.726 -17.859 1.00 20.22 H new ATOM 0 HE ARG A 67 7.484 -7.122 -15.497 1.00 53.20 H new ATOM 0 HH11 ARG A 67 6.591 -6.142 -18.769 1.00 72.53 H new ATOM 0 HH12 ARG A 67 8.094 -5.252 -19.036 1.00 72.53 H new ATOM 0 HH21 ARG A 67 9.412 -5.978 -15.849 1.00 54.41 H new ATOM 0 HH22 ARG A 67 9.684 -5.159 -17.390 1.00 54.41 H new ATOM 151 N ALA A 68 1.730 -5.056 -15.632 1.00 72.12 N ATOM 152 CA ALA A 68 0.637 -4.202 -16.081 1.00 44.12 C ATOM 153 C ALA A 68 -0.237 -3.768 -14.910 1.00 33.11 C ATOM 154 O ALA A 68 -0.538 -2.585 -14.751 1.00 14.10 O ATOM 155 CB ALA A 68 -0.199 -4.922 -17.129 1.00 0.32 C ATOM 0 H ALA A 68 1.693 -6.011 -15.989 1.00 72.12 H new ATOM 0 HA ALA A 68 1.068 -3.307 -16.529 1.00 44.12 H new ATOM 0 HB1 ALA A 68 -1.011 -4.273 -17.455 1.00 0.32 H new ATOM 0 HB2 ALA A 68 0.428 -5.176 -17.984 1.00 0.32 H new ATOM 0 HB3 ALA A 68 -0.614 -5.834 -16.700 1.00 0.32 H new ATOM 161 N LYS A 69 -0.644 -4.733 -14.092 1.00 5.13 N ATOM 162 CA LYS A 69 -1.484 -4.452 -12.934 1.00 2.43 C ATOM 163 C LYS A 69 -0.818 -3.434 -12.013 1.00 22.44 C ATOM 164 O LYS A 69 -1.441 -2.457 -11.598 1.00 23.41 O ATOM 165 CB LYS A 69 -1.773 -5.741 -12.162 1.00 72.24 C ATOM 166 CG LYS A 69 -3.254 -6.003 -11.949 1.00 51.00 C ATOM 167 CD LYS A 69 -3.839 -6.843 -13.072 1.00 13.11 C ATOM 168 CE LYS A 69 -4.829 -7.870 -12.542 1.00 43.34 C ATOM 169 NZ LYS A 69 -6.233 -7.380 -12.623 1.00 63.12 N ATOM 0 H LYS A 69 -0.405 -5.718 -14.210 1.00 5.13 H new ATOM 0 HA LYS A 69 -2.424 -4.032 -13.292 1.00 2.43 H new ATOM 0 HB2 LYS A 69 -1.337 -6.583 -12.701 1.00 72.24 H new ATOM 0 HB3 LYS A 69 -1.278 -5.693 -11.192 1.00 72.24 H new ATOM 0 HG2 LYS A 69 -3.401 -6.513 -10.997 1.00 51.00 H new ATOM 0 HG3 LYS A 69 -3.787 -5.054 -11.887 1.00 51.00 H new ATOM 0 HD2 LYS A 69 -4.337 -6.194 -13.792 1.00 13.11 H new ATOM 0 HD3 LYS A 69 -3.035 -7.352 -13.604 1.00 13.11 H new ATOM 0 HE2 LYS A 69 -4.733 -8.794 -13.112 1.00 43.34 H new ATOM 0 HE3 LYS A 69 -4.586 -8.108 -11.506 1.00 43.34 H new ATOM 0 HZ1 LYS A 69 -6.877 -8.108 -12.253 1.00 63.12 H new ATOM 0 HZ2 LYS A 69 -6.331 -6.512 -12.059 1.00 63.12 H new ATOM 0 HZ3 LYS A 69 -6.473 -7.177 -13.614 1.00 63.12 H new ATOM 183 N ALA A 70 0.452 -3.670 -11.698 1.00 33.03 N ATOM 184 CA ALA A 70 1.203 -2.772 -10.829 1.00 35.42 C ATOM 185 C ALA A 70 1.182 -1.345 -11.365 1.00 43.01 C ATOM 186 O ALA A 70 0.789 -0.415 -10.663 1.00 13.53 O ATOM 187 CB ALA A 70 2.635 -3.261 -10.677 1.00 45.10 C ATOM 0 H ALA A 70 0.982 -4.475 -12.032 1.00 33.03 H new ATOM 0 HA ALA A 70 0.726 -2.770 -9.849 1.00 35.42 H new ATOM 0 HB1 ALA A 70 3.184 -2.581 -10.026 1.00 45.10 H new ATOM 0 HB2 ALA A 70 2.634 -4.260 -10.241 1.00 45.10 H new ATOM 0 HB3 ALA A 70 3.114 -3.293 -11.655 1.00 45.10 H new ATOM 193 N GLU A 71 1.610 -1.180 -12.613 1.00 72.41 N ATOM 194 CA GLU A 71 1.642 0.135 -13.242 1.00 34.04 C ATOM 195 C GLU A 71 0.300 0.845 -13.086 1.00 32.00 C ATOM 196 O GLU A 71 0.246 2.065 -12.937 1.00 52.20 O ATOM 197 CB GLU A 71 1.994 0.007 -14.725 1.00 44.50 C ATOM 198 CG GLU A 71 3.374 -0.580 -14.974 1.00 55.43 C ATOM 199 CD GLU A 71 3.502 -1.202 -16.351 1.00 64.01 C ATOM 200 OE1 GLU A 71 2.465 -1.378 -17.023 1.00 13.21 O ATOM 201 OE2 GLU A 71 4.642 -1.513 -16.756 1.00 61.04 O ATOM 0 H GLU A 71 1.939 -1.940 -13.208 1.00 72.41 H new ATOM 0 HA GLU A 71 2.408 0.729 -12.744 1.00 34.04 H new ATOM 0 HB2 GLU A 71 1.248 -0.619 -15.214 1.00 44.50 H new ATOM 0 HB3 GLU A 71 1.938 0.991 -15.190 1.00 44.50 H new ATOM 0 HG2 GLU A 71 4.124 0.203 -14.862 1.00 55.43 H new ATOM 0 HG3 GLU A 71 3.586 -1.335 -14.217 1.00 55.43 H new ATOM 208 N GLU A 72 -0.780 0.071 -13.122 1.00 74.03 N ATOM 209 CA GLU A 72 -2.122 0.626 -12.987 1.00 0.02 C ATOM 210 C GLU A 72 -2.374 1.097 -11.557 1.00 40.24 C ATOM 211 O GLU A 72 -2.944 2.165 -11.336 1.00 44.43 O ATOM 212 CB GLU A 72 -3.171 -0.414 -13.385 1.00 30.20 C ATOM 213 CG GLU A 72 -3.272 -0.634 -14.885 1.00 44.01 C ATOM 214 CD GLU A 72 -4.133 0.408 -15.571 1.00 12.51 C ATOM 215 OE1 GLU A 72 -5.343 0.471 -15.269 1.00 11.34 O ATOM 216 OE2 GLU A 72 -3.597 1.162 -16.410 1.00 64.22 O ATOM 0 H GLU A 72 -0.752 -0.941 -13.243 1.00 74.03 H new ATOM 0 HA GLU A 72 -2.201 1.484 -13.654 1.00 0.02 H new ATOM 0 HB2 GLU A 72 -2.932 -1.362 -12.903 1.00 30.20 H new ATOM 0 HB3 GLU A 72 -4.144 -0.100 -13.006 1.00 30.20 H new ATOM 0 HG2 GLU A 72 -2.272 -0.617 -15.319 1.00 44.01 H new ATOM 0 HG3 GLU A 72 -3.685 -1.624 -15.076 1.00 44.01 H new ATOM 223 N MET A 73 -1.946 0.292 -10.591 1.00 23.30 N ATOM 224 CA MET A 73 -2.124 0.626 -9.183 1.00 12.12 C ATOM 225 C MET A 73 -1.381 1.911 -8.831 1.00 23.33 C ATOM 226 O MET A 73 -1.793 2.654 -7.939 1.00 23.11 O ATOM 227 CB MET A 73 -1.632 -0.521 -8.298 1.00 11.31 C ATOM 228 CG MET A 73 -2.388 -1.822 -8.513 1.00 15.44 C ATOM 229 SD MET A 73 -4.169 -1.632 -8.304 1.00 74.12 S ATOM 230 CE MET A 73 -4.719 -1.703 -10.007 1.00 70.44 C ATOM 0 H MET A 73 -1.473 -0.596 -10.757 1.00 23.30 H new ATOM 0 HA MET A 73 -3.188 0.782 -9.004 1.00 12.12 H new ATOM 0 HB2 MET A 73 -0.573 -0.690 -8.492 1.00 11.31 H new ATOM 0 HB3 MET A 73 -1.722 -0.227 -7.252 1.00 11.31 H new ATOM 0 HG2 MET A 73 -2.182 -2.196 -9.516 1.00 15.44 H new ATOM 0 HG3 MET A 73 -2.021 -2.571 -7.811 1.00 15.44 H new ATOM 0 HE1 MET A 73 -5.801 -1.832 -10.035 1.00 70.44 H new ATOM 0 HE2 MET A 73 -4.451 -0.777 -10.515 1.00 70.44 H new ATOM 0 HE3 MET A 73 -4.241 -2.544 -10.509 1.00 70.44 H new ATOM 240 N LEU A 74 -0.284 2.166 -9.535 1.00 40.23 N ATOM 241 CA LEU A 74 0.517 3.362 -9.297 1.00 25.42 C ATOM 242 C LEU A 74 -0.046 4.556 -10.060 1.00 65.04 C ATOM 243 O LEU A 74 -0.188 5.647 -9.509 1.00 4.13 O ATOM 244 CB LEU A 74 1.970 3.116 -9.710 1.00 11.55 C ATOM 245 CG LEU A 74 2.597 1.812 -9.217 1.00 33.23 C ATOM 246 CD1 LEU A 74 3.843 1.481 -10.022 1.00 62.45 C ATOM 247 CD2 LEU A 74 2.927 1.905 -7.734 1.00 50.42 C ATOM 0 H LEU A 74 0.071 1.561 -10.275 1.00 40.23 H new ATOM 0 HA LEU A 74 0.481 3.587 -8.231 1.00 25.42 H new ATOM 0 HB2 LEU A 74 2.025 3.133 -10.798 1.00 11.55 H new ATOM 0 HB3 LEU A 74 2.575 3.947 -9.347 1.00 11.55 H new ATOM 0 HG LEU A 74 1.874 1.008 -9.358 1.00 33.23 H new ATOM 0 HD11 LEU A 74 4.275 0.550 -9.657 1.00 62.45 H new ATOM 0 HD12 LEU A 74 3.578 1.370 -11.073 1.00 62.45 H new ATOM 0 HD13 LEU A 74 4.570 2.286 -9.914 1.00 62.45 H new ATOM 0 HD21 LEU A 74 3.372 0.968 -7.401 1.00 50.42 H new ATOM 0 HD22 LEU A 74 3.631 2.720 -7.568 1.00 50.42 H new ATOM 0 HD23 LEU A 74 2.014 2.094 -7.169 1.00 50.42 H new ATOM 259 N SER A 75 -0.366 4.341 -11.332 1.00 73.22 N ATOM 260 CA SER A 75 -0.913 5.400 -12.172 1.00 43.04 C ATOM 261 C SER A 75 -2.199 5.960 -11.573 1.00 1.13 C ATOM 262 O SER A 75 -2.408 7.173 -11.544 1.00 11.10 O ATOM 263 CB SER A 75 -1.182 4.873 -13.583 1.00 44.24 C ATOM 264 OG SER A 75 -0.343 5.508 -14.533 1.00 70.11 O ATOM 0 H SER A 75 -0.256 3.443 -11.803 1.00 73.22 H new ATOM 0 HA SER A 75 -0.178 6.203 -12.225 1.00 43.04 H new ATOM 0 HB2 SER A 75 -1.017 3.796 -13.610 1.00 44.24 H new ATOM 0 HB3 SER A 75 -2.226 5.042 -13.845 1.00 44.24 H new ATOM 0 HG SER A 75 -0.533 5.153 -15.426 1.00 70.11 H new ATOM 270 N LYS A 76 -3.059 5.067 -11.094 1.00 42.33 N ATOM 271 CA LYS A 76 -4.325 5.469 -10.493 1.00 50.54 C ATOM 272 C LYS A 76 -4.094 6.421 -9.324 1.00 13.11 C ATOM 273 O LYS A 76 -4.961 7.228 -8.989 1.00 33.31 O ATOM 274 CB LYS A 76 -5.101 4.239 -10.018 1.00 51.11 C ATOM 275 CG LYS A 76 -4.489 3.567 -8.801 1.00 73.45 C ATOM 276 CD LYS A 76 -5.497 2.681 -8.088 1.00 61.33 C ATOM 277 CE LYS A 76 -5.803 1.426 -8.892 1.00 54.30 C ATOM 278 NZ LYS A 76 -7.229 1.376 -9.319 1.00 32.51 N ATOM 0 H LYS A 76 -2.902 4.059 -11.111 1.00 42.33 H new ATOM 0 HA LYS A 76 -4.910 5.989 -11.252 1.00 50.54 H new ATOM 0 HB2 LYS A 76 -6.124 4.533 -9.784 1.00 51.11 H new ATOM 0 HB3 LYS A 76 -5.155 3.517 -10.833 1.00 51.11 H new ATOM 0 HG2 LYS A 76 -3.630 2.969 -9.107 1.00 73.45 H new ATOM 0 HG3 LYS A 76 -4.119 4.327 -8.112 1.00 73.45 H new ATOM 0 HD2 LYS A 76 -5.109 2.401 -7.109 1.00 61.33 H new ATOM 0 HD3 LYS A 76 -6.418 3.239 -7.918 1.00 61.33 H new ATOM 0 HE2 LYS A 76 -5.159 1.391 -9.771 1.00 54.30 H new ATOM 0 HE3 LYS A 76 -5.572 0.545 -8.293 1.00 54.30 H new ATOM 0 HZ1 LYS A 76 -7.398 0.506 -9.864 1.00 32.51 H new ATOM 0 HZ2 LYS A 76 -7.843 1.383 -8.480 1.00 32.51 H new ATOM 0 HZ3 LYS A 76 -7.443 2.203 -9.912 1.00 32.51 H new ATOM 292 N GLN A 77 -2.920 6.322 -8.708 1.00 75.55 N ATOM 293 CA GLN A 77 -2.577 7.175 -7.577 1.00 61.30 C ATOM 294 C GLN A 77 -2.582 8.645 -7.982 1.00 73.15 C ATOM 295 O GLN A 77 -2.844 8.979 -9.138 1.00 51.21 O ATOM 296 CB GLN A 77 -1.204 6.792 -7.021 1.00 34.22 C ATOM 297 CG GLN A 77 -1.062 5.309 -6.720 1.00 31.52 C ATOM 298 CD GLN A 77 -2.113 4.806 -5.749 1.00 50.55 C ATOM 299 OE1 GLN A 77 -2.824 5.594 -5.124 1.00 70.23 O ATOM 300 NE2 GLN A 77 -2.217 3.489 -5.618 1.00 51.24 N ATOM 0 H GLN A 77 -2.191 5.660 -8.973 1.00 75.55 H new ATOM 0 HA GLN A 77 -3.330 7.028 -6.802 1.00 61.30 H new ATOM 0 HB2 GLN A 77 -0.437 7.084 -7.738 1.00 34.22 H new ATOM 0 HB3 GLN A 77 -1.020 7.359 -6.108 1.00 34.22 H new ATOM 0 HG2 GLN A 77 -1.133 4.745 -7.650 1.00 31.52 H new ATOM 0 HG3 GLN A 77 -0.071 5.119 -6.307 1.00 31.52 H new ATOM 0 HE21 GLN A 77 -1.607 2.873 -6.156 1.00 51.24 H new ATOM 0 HE22 GLN A 77 -2.907 3.093 -4.980 1.00 51.24 H new ATOM 309 N ARG A 78 -2.292 9.519 -7.024 1.00 60.13 N ATOM 310 CA ARG A 78 -2.265 10.954 -7.282 1.00 30.35 C ATOM 311 C ARG A 78 -0.872 11.524 -7.034 1.00 3.42 C ATOM 312 O ARG A 78 -0.460 12.487 -7.681 1.00 45.34 O ATOM 313 CB ARG A 78 -3.286 11.671 -6.397 1.00 53.21 C ATOM 314 CG ARG A 78 -4.605 10.927 -6.262 1.00 43.03 C ATOM 315 CD ARG A 78 -5.322 10.817 -7.599 1.00 4.11 C ATOM 316 NE ARG A 78 -6.773 10.856 -7.446 1.00 75.31 N ATOM 317 CZ ARG A 78 -7.623 10.619 -8.439 1.00 75.40 C ATOM 318 NH1 ARG A 78 -7.169 10.327 -9.650 1.00 1.11 N ATOM 319 NH2 ARG A 78 -8.931 10.672 -8.221 1.00 54.55 N ATOM 0 H ARG A 78 -2.072 9.259 -6.062 1.00 60.13 H new ATOM 0 HA ARG A 78 -2.524 11.115 -8.328 1.00 30.35 H new ATOM 0 HB2 ARG A 78 -2.857 11.815 -5.405 1.00 53.21 H new ATOM 0 HB3 ARG A 78 -3.478 12.662 -6.808 1.00 53.21 H new ATOM 0 HG2 ARG A 78 -4.422 9.929 -5.863 1.00 43.03 H new ATOM 0 HG3 ARG A 78 -5.244 11.444 -5.547 1.00 43.03 H new ATOM 0 HD2 ARG A 78 -5.004 11.632 -8.249 1.00 4.11 H new ATOM 0 HD3 ARG A 78 -5.034 9.887 -8.089 1.00 4.11 H new ATOM 0 HE ARG A 78 -7.155 11.077 -6.527 1.00 75.31 H new ATOM 0 HH11 ARG A 78 -6.164 10.284 -9.821 1.00 1.11 H new ATOM 0 HH12 ARG A 78 -7.824 10.146 -10.410 1.00 1.11 H new ATOM 0 HH21 ARG A 78 -9.284 10.895 -7.290 1.00 54.55 H new ATOM 0 HH22 ARG A 78 -9.583 10.490 -8.984 1.00 54.55 H new ATOM 333 N HIS A 79 -0.151 10.924 -6.092 1.00 2.20 N ATOM 334 CA HIS A 79 1.197 11.373 -5.759 1.00 35.45 C ATOM 335 C HIS A 79 2.190 10.957 -6.839 1.00 44.10 C ATOM 336 O HIS A 79 1.811 10.370 -7.852 1.00 71.33 O ATOM 337 CB HIS A 79 1.627 10.802 -4.407 1.00 32.12 C ATOM 338 CG HIS A 79 0.479 10.462 -3.507 1.00 55.32 C ATOM 339 ND1 HIS A 79 0.511 9.418 -2.608 1.00 35.42 N ATOM 340 CD2 HIS A 79 -0.739 11.037 -3.371 1.00 12.34 C ATOM 341 CE1 HIS A 79 -0.638 9.363 -1.958 1.00 55.51 C ATOM 342 NE2 HIS A 79 -1.414 10.336 -2.402 1.00 73.10 N ATOM 0 H HIS A 79 -0.477 10.126 -5.546 1.00 2.20 H new ATOM 0 HA HIS A 79 1.187 12.461 -5.699 1.00 35.45 H new ATOM 0 HB2 HIS A 79 2.225 9.906 -4.574 1.00 32.12 H new ATOM 0 HB3 HIS A 79 2.270 11.525 -3.905 1.00 32.12 H new ATOM 0 HD2 HIS A 79 -1.111 11.888 -3.922 1.00 12.34 H new ATOM 0 HE1 HIS A 79 -0.898 8.645 -1.194 1.00 55.51 H new ATOM 0 HE2 HIS A 79 -2.361 10.534 -2.078 1.00 73.10 H new ATOM 350 N ASP A 80 3.463 11.267 -6.616 1.00 72.30 N ATOM 351 CA ASP A 80 4.511 10.925 -7.570 1.00 43.34 C ATOM 352 C ASP A 80 5.610 10.107 -6.900 1.00 64.54 C ATOM 353 O ASP A 80 6.333 10.606 -6.039 1.00 70.01 O ATOM 354 CB ASP A 80 5.105 12.194 -8.184 1.00 3.35 C ATOM 355 CG ASP A 80 4.040 13.146 -8.691 1.00 73.30 C ATOM 356 OD1 ASP A 80 3.395 13.815 -7.856 1.00 43.24 O ATOM 357 OD2 ASP A 80 3.851 13.221 -9.923 1.00 14.41 O ATOM 0 H ASP A 80 3.793 11.754 -5.783 1.00 72.30 H new ATOM 0 HA ASP A 80 4.065 10.322 -8.361 1.00 43.34 H new ATOM 0 HB2 ASP A 80 5.717 12.702 -7.439 1.00 3.35 H new ATOM 0 HB3 ASP A 80 5.765 11.921 -9.007 1.00 3.35 H new ATOM 362 N GLY A 81 5.730 8.845 -7.302 1.00 33.52 N ATOM 363 CA GLY A 81 6.742 7.976 -6.729 1.00 52.40 C ATOM 364 C GLY A 81 6.143 6.787 -6.005 1.00 22.10 C ATOM 365 O GLY A 81 6.794 6.174 -5.159 1.00 45.35 O ATOM 0 H GLY A 81 5.144 8.409 -8.014 1.00 33.52 H new ATOM 0 HA2 GLY A 81 7.402 7.621 -7.521 1.00 52.40 H new ATOM 0 HA3 GLY A 81 7.357 8.548 -6.034 1.00 52.40 H new ATOM 369 N ALA A 82 4.898 6.460 -6.336 1.00 22.01 N ATOM 370 CA ALA A 82 4.212 5.336 -5.711 1.00 71.14 C ATOM 371 C ALA A 82 4.961 4.030 -5.957 1.00 11.43 C ATOM 372 O ALA A 82 5.257 3.678 -7.099 1.00 34.24 O ATOM 373 CB ALA A 82 2.785 5.234 -6.231 1.00 25.22 C ATOM 0 H ALA A 82 4.344 6.957 -7.033 1.00 22.01 H new ATOM 0 HA ALA A 82 4.184 5.511 -4.636 1.00 71.14 H new ATOM 0 HB1 ALA A 82 2.284 4.390 -5.756 1.00 25.22 H new ATOM 0 HB2 ALA A 82 2.247 6.153 -5.999 1.00 25.22 H new ATOM 0 HB3 ALA A 82 2.801 5.085 -7.311 1.00 25.22 H new ATOM 379 N PHE A 83 5.266 3.317 -4.878 1.00 32.12 N ATOM 380 CA PHE A 83 5.982 2.051 -4.976 1.00 63.41 C ATOM 381 C PHE A 83 5.043 0.874 -4.728 1.00 63.30 C ATOM 382 O PHE A 83 4.042 1.002 -4.023 1.00 34.23 O ATOM 383 CB PHE A 83 7.138 2.015 -3.974 1.00 43.33 C ATOM 384 CG PHE A 83 6.690 1.903 -2.545 1.00 72.43 C ATOM 385 CD1 PHE A 83 6.380 3.036 -1.811 1.00 5.00 C ATOM 386 CD2 PHE A 83 6.578 0.663 -1.936 1.00 42.11 C ATOM 387 CE1 PHE A 83 5.967 2.936 -0.496 1.00 21.12 C ATOM 388 CE2 PHE A 83 6.165 0.557 -0.622 1.00 20.34 C ATOM 389 CZ PHE A 83 5.860 1.694 0.100 1.00 43.51 C ATOM 0 H PHE A 83 5.028 3.595 -3.926 1.00 32.12 H new ATOM 0 HA PHE A 83 6.383 1.967 -5.986 1.00 63.41 H new ATOM 0 HB2 PHE A 83 7.787 1.171 -4.210 1.00 43.33 H new ATOM 0 HB3 PHE A 83 7.736 2.919 -4.089 1.00 43.33 H new ATOM 0 HD1 PHE A 83 6.462 4.009 -2.272 1.00 5.00 H new ATOM 0 HD2 PHE A 83 6.816 -0.230 -2.495 1.00 42.11 H new ATOM 0 HE1 PHE A 83 5.728 3.827 0.065 1.00 21.12 H new ATOM 0 HE2 PHE A 83 6.081 -0.415 -0.159 1.00 20.34 H new ATOM 0 HZ PHE A 83 5.539 1.613 1.128 1.00 43.51 H new ATOM 399 N LEU A 84 5.374 -0.272 -5.313 1.00 33.30 N ATOM 400 CA LEU A 84 4.561 -1.473 -5.157 1.00 35.32 C ATOM 401 C LEU A 84 5.401 -2.730 -5.360 1.00 32.12 C ATOM 402 O LEU A 84 5.949 -2.954 -6.439 1.00 60.14 O ATOM 403 CB LEU A 84 3.397 -1.458 -6.150 1.00 20.12 C ATOM 404 CG LEU A 84 2.688 -2.794 -6.374 1.00 23.31 C ATOM 405 CD1 LEU A 84 1.199 -2.579 -6.592 1.00 52.51 C ATOM 406 CD2 LEU A 84 3.301 -3.531 -7.556 1.00 21.42 C ATOM 0 H LEU A 84 6.199 -0.395 -5.899 1.00 33.30 H new ATOM 0 HA LEU A 84 4.164 -1.483 -4.142 1.00 35.32 H new ATOM 0 HB2 LEU A 84 2.661 -0.732 -5.805 1.00 20.12 H new ATOM 0 HB3 LEU A 84 3.770 -1.102 -7.110 1.00 20.12 H new ATOM 0 HG LEU A 84 2.818 -3.406 -5.482 1.00 23.31 H new ATOM 0 HD11 LEU A 84 0.712 -3.541 -6.750 1.00 52.51 H new ATOM 0 HD12 LEU A 84 0.769 -2.094 -5.716 1.00 52.51 H new ATOM 0 HD13 LEU A 84 1.047 -1.948 -7.467 1.00 52.51 H new ATOM 0 HD21 LEU A 84 2.784 -4.480 -7.701 1.00 21.42 H new ATOM 0 HD22 LEU A 84 3.202 -2.923 -8.455 1.00 21.42 H new ATOM 0 HD23 LEU A 84 4.357 -3.719 -7.360 1.00 21.42 H new ATOM 418 N ILE A 85 5.496 -3.547 -4.316 1.00 74.13 N ATOM 419 CA ILE A 85 6.266 -4.783 -4.382 1.00 10.34 C ATOM 420 C ILE A 85 5.375 -5.968 -4.735 1.00 75.30 C ATOM 421 O ILE A 85 4.334 -6.182 -4.114 1.00 35.25 O ATOM 422 CB ILE A 85 6.981 -5.072 -3.048 1.00 53.34 C ATOM 423 CG1 ILE A 85 7.803 -3.857 -2.612 1.00 20.42 C ATOM 424 CG2 ILE A 85 7.869 -6.300 -3.179 1.00 35.22 C ATOM 425 CD1 ILE A 85 8.643 -4.108 -1.379 1.00 15.13 C ATOM 0 H ILE A 85 5.050 -3.375 -3.415 1.00 74.13 H new ATOM 0 HA ILE A 85 7.013 -4.648 -5.164 1.00 10.34 H new ATOM 0 HB ILE A 85 6.229 -5.271 -2.285 1.00 53.34 H new ATOM 0 HG12 ILE A 85 8.456 -3.557 -3.432 1.00 20.42 H new ATOM 0 HG13 ILE A 85 7.129 -3.022 -2.419 1.00 20.42 H new ATOM 0 HG21 ILE A 85 8.367 -6.492 -2.229 1.00 35.22 H new ATOM 0 HG22 ILE A 85 7.260 -7.162 -3.450 1.00 35.22 H new ATOM 0 HG23 ILE A 85 8.617 -6.127 -3.953 1.00 35.22 H new ATOM 0 HD11 ILE A 85 9.199 -3.205 -1.127 1.00 15.13 H new ATOM 0 HD12 ILE A 85 7.994 -4.379 -0.546 1.00 15.13 H new ATOM 0 HD13 ILE A 85 9.342 -4.921 -1.574 1.00 15.13 H new ATOM 437 N ARG A 86 5.791 -6.737 -5.736 1.00 20.22 N ATOM 438 CA ARG A 86 5.031 -7.902 -6.172 1.00 34.23 C ATOM 439 C ARG A 86 5.864 -9.174 -6.045 1.00 44.05 C ATOM 440 O ARG A 86 7.091 -9.117 -5.966 1.00 60.55 O ATOM 441 CB ARG A 86 4.569 -7.724 -7.619 1.00 71.02 C ATOM 442 CG ARG A 86 5.690 -7.346 -8.574 1.00 33.40 C ATOM 443 CD ARG A 86 5.470 -5.966 -9.173 1.00 74.23 C ATOM 444 NE ARG A 86 6.704 -5.400 -9.712 1.00 35.31 N ATOM 445 CZ ARG A 86 7.168 -5.673 -10.926 1.00 41.42 C ATOM 446 NH1 ARG A 86 6.505 -6.498 -11.724 1.00 35.02 N ATOM 447 NH2 ARG A 86 8.299 -5.118 -11.345 1.00 74.21 N ATOM 0 H ARG A 86 6.651 -6.574 -6.260 1.00 20.22 H new ATOM 0 HA ARG A 86 4.157 -7.996 -5.528 1.00 34.23 H new ATOM 0 HB2 ARG A 86 4.109 -8.651 -7.961 1.00 71.02 H new ATOM 0 HB3 ARG A 86 3.799 -6.954 -7.653 1.00 71.02 H new ATOM 0 HG2 ARG A 86 6.643 -7.366 -8.045 1.00 33.40 H new ATOM 0 HG3 ARG A 86 5.753 -8.085 -9.373 1.00 33.40 H new ATOM 0 HD2 ARG A 86 4.724 -6.029 -9.965 1.00 74.23 H new ATOM 0 HD3 ARG A 86 5.069 -5.299 -8.410 1.00 74.23 H new ATOM 0 HE ARG A 86 7.238 -4.760 -9.124 1.00 35.31 H new ATOM 0 HH11 ARG A 86 5.635 -6.926 -11.406 1.00 35.02 H new ATOM 0 HH12 ARG A 86 6.865 -6.705 -12.656 1.00 35.02 H new ATOM 0 HH21 ARG A 86 8.812 -4.482 -10.734 1.00 74.21 H new ATOM 0 HH22 ARG A 86 8.655 -5.328 -12.277 1.00 74.21 H new ATOM 461 N GLU A 87 5.189 -10.319 -6.027 1.00 0.13 N ATOM 462 CA GLU A 87 5.868 -11.604 -5.909 1.00 2.25 C ATOM 463 C GLU A 87 5.736 -12.410 -7.198 1.00 12.25 C ATOM 464 O GLU A 87 4.650 -12.516 -7.767 1.00 35.54 O ATOM 465 CB GLU A 87 5.297 -12.402 -4.734 1.00 42.53 C ATOM 466 CG GLU A 87 6.334 -13.241 -4.007 1.00 62.13 C ATOM 467 CD GLU A 87 5.876 -13.666 -2.626 1.00 23.14 C ATOM 468 OE1 GLU A 87 5.646 -12.779 -1.777 1.00 64.23 O ATOM 469 OE2 GLU A 87 5.748 -14.886 -2.393 1.00 73.52 O ATOM 0 H GLU A 87 4.173 -10.383 -6.093 1.00 0.13 H new ATOM 0 HA GLU A 87 6.926 -11.412 -5.728 1.00 2.25 H new ATOM 0 HB2 GLU A 87 4.839 -11.712 -4.026 1.00 42.53 H new ATOM 0 HB3 GLU A 87 4.505 -13.055 -5.100 1.00 42.53 H new ATOM 0 HG2 GLU A 87 6.559 -14.128 -4.600 1.00 62.13 H new ATOM 0 HG3 GLU A 87 7.260 -12.672 -3.920 1.00 62.13 H new ATOM 476 N SER A 88 6.850 -12.975 -7.652 1.00 54.23 N ATOM 477 CA SER A 88 6.860 -13.768 -8.876 1.00 50.52 C ATOM 478 C SER A 88 5.985 -15.009 -8.727 1.00 41.50 C ATOM 479 O SER A 88 5.953 -15.634 -7.668 1.00 24.20 O ATOM 480 CB SER A 88 8.290 -14.178 -9.231 1.00 45.31 C ATOM 481 OG SER A 88 8.588 -13.873 -10.583 1.00 33.51 O ATOM 0 H SER A 88 7.757 -12.899 -7.191 1.00 54.23 H new ATOM 0 HA SER A 88 6.455 -13.154 -9.681 1.00 50.52 H new ATOM 0 HB2 SER A 88 8.992 -13.663 -8.576 1.00 45.31 H new ATOM 0 HB3 SER A 88 8.418 -15.247 -9.059 1.00 45.31 H new ATOM 0 HG SER A 88 9.508 -14.143 -10.784 1.00 33.51 H new ATOM 487 N GLU A 89 5.277 -15.358 -9.796 1.00 53.54 N ATOM 488 CA GLU A 89 4.400 -16.523 -9.784 1.00 65.03 C ATOM 489 C GLU A 89 5.204 -17.809 -9.953 1.00 31.41 C ATOM 490 O GLU A 89 4.875 -18.841 -9.367 1.00 54.23 O ATOM 491 CB GLU A 89 3.354 -16.413 -10.895 1.00 34.31 C ATOM 492 CG GLU A 89 3.904 -15.858 -12.198 1.00 2.04 C ATOM 493 CD GLU A 89 2.936 -16.015 -13.354 1.00 51.50 C ATOM 494 OE1 GLU A 89 1.774 -15.577 -13.219 1.00 62.21 O ATOM 495 OE2 GLU A 89 3.341 -16.574 -14.394 1.00 72.54 O ATOM 0 H GLU A 89 5.293 -14.851 -10.681 1.00 53.54 H new ATOM 0 HA GLU A 89 3.893 -16.555 -8.820 1.00 65.03 H new ATOM 0 HB2 GLU A 89 2.929 -17.399 -11.081 1.00 34.31 H new ATOM 0 HB3 GLU A 89 2.539 -15.774 -10.553 1.00 34.31 H new ATOM 0 HG2 GLU A 89 4.140 -14.802 -12.068 1.00 2.04 H new ATOM 0 HG3 GLU A 89 4.838 -16.366 -12.439 1.00 2.04 H new ATOM 502 N SER A 90 6.259 -17.740 -10.758 1.00 41.22 N ATOM 503 CA SER A 90 7.108 -18.899 -11.008 1.00 73.12 C ATOM 504 C SER A 90 8.324 -18.891 -10.087 1.00 41.45 C ATOM 505 O SER A 90 9.134 -19.817 -10.102 1.00 71.13 O ATOM 506 CB SER A 90 7.560 -18.921 -12.470 1.00 1.25 C ATOM 507 OG SER A 90 6.636 -19.627 -13.279 1.00 60.20 O ATOM 0 H SER A 90 6.547 -16.893 -11.249 1.00 41.22 H new ATOM 0 HA SER A 90 6.525 -19.797 -10.802 1.00 73.12 H new ATOM 0 HB2 SER A 90 7.664 -17.900 -12.837 1.00 1.25 H new ATOM 0 HB3 SER A 90 8.543 -19.387 -12.543 1.00 1.25 H new ATOM 0 HG SER A 90 6.947 -19.625 -14.208 1.00 60.20 H new ATOM 513 N ALA A 91 8.445 -17.837 -9.287 1.00 0.31 N ATOM 514 CA ALA A 91 9.561 -17.707 -8.358 1.00 34.13 C ATOM 515 C ALA A 91 9.071 -17.344 -6.960 1.00 23.22 C ATOM 516 O ALA A 91 8.980 -16.173 -6.592 1.00 44.45 O ATOM 517 CB ALA A 91 10.548 -16.665 -8.861 1.00 0.43 C ATOM 0 H ALA A 91 7.784 -17.061 -9.263 1.00 0.31 H new ATOM 0 HA ALA A 91 10.067 -18.671 -8.299 1.00 34.13 H new ATOM 0 HB1 ALA A 91 11.376 -16.579 -8.157 1.00 0.43 H new ATOM 0 HB2 ALA A 91 10.930 -16.967 -9.836 1.00 0.43 H new ATOM 0 HB3 ALA A 91 10.046 -15.702 -8.951 1.00 0.43 H new ATOM 523 N PRO A 92 8.748 -18.371 -6.160 1.00 75.21 N ATOM 524 CA PRO A 92 8.262 -18.185 -4.790 1.00 13.33 C ATOM 525 C PRO A 92 9.350 -17.672 -3.853 1.00 44.54 C ATOM 526 O PRO A 92 10.392 -18.305 -3.690 1.00 61.45 O ATOM 527 CB PRO A 92 7.819 -19.591 -4.376 1.00 5.52 C ATOM 528 CG PRO A 92 8.631 -20.508 -5.224 1.00 54.12 C ATOM 529 CD PRO A 92 8.831 -19.794 -6.532 1.00 43.50 C ATOM 0 HA PRO A 92 7.468 -17.440 -4.738 1.00 13.33 H new ATOM 0 HB2 PRO A 92 8.001 -19.767 -3.316 1.00 5.52 H new ATOM 0 HB3 PRO A 92 6.752 -19.736 -4.545 1.00 5.52 H new ATOM 0 HG2 PRO A 92 9.587 -20.732 -4.751 1.00 54.12 H new ATOM 0 HG3 PRO A 92 8.118 -21.458 -5.373 1.00 54.12 H new ATOM 0 HD2 PRO A 92 9.795 -20.037 -6.979 1.00 43.50 H new ATOM 0 HD3 PRO A 92 8.065 -20.065 -7.259 1.00 43.50 H new ATOM 537 N GLY A 93 9.102 -16.519 -3.239 1.00 54.44 N ATOM 538 CA GLY A 93 10.070 -15.940 -2.327 1.00 23.34 C ATOM 539 C GLY A 93 10.786 -14.745 -2.922 1.00 45.44 C ATOM 540 O GLY A 93 11.437 -13.982 -2.207 1.00 73.12 O ATOM 0 H GLY A 93 8.247 -15.976 -3.357 1.00 54.44 H new ATOM 0 HA2 GLY A 93 9.564 -15.637 -1.410 1.00 23.34 H new ATOM 0 HA3 GLY A 93 10.803 -16.698 -2.051 1.00 23.34 H new ATOM 544 N ASP A 94 10.669 -14.581 -4.235 1.00 41.24 N ATOM 545 CA ASP A 94 11.311 -13.469 -4.928 1.00 23.52 C ATOM 546 C ASP A 94 10.465 -12.204 -4.826 1.00 24.12 C ATOM 547 O ASP A 94 9.257 -12.232 -5.061 1.00 42.21 O ATOM 548 CB ASP A 94 11.547 -13.824 -6.397 1.00 14.41 C ATOM 549 CG ASP A 94 12.365 -12.773 -7.122 1.00 33.02 C ATOM 550 OD1 ASP A 94 12.203 -11.575 -6.809 1.00 4.42 O ATOM 551 OD2 ASP A 94 13.167 -13.149 -8.002 1.00 30.25 O ATOM 0 H ASP A 94 10.135 -15.204 -4.841 1.00 41.24 H new ATOM 0 HA ASP A 94 12.272 -13.281 -4.449 1.00 23.52 H new ATOM 0 HB2 ASP A 94 12.059 -14.784 -6.458 1.00 14.41 H new ATOM 0 HB3 ASP A 94 10.586 -13.942 -6.898 1.00 14.41 H new ATOM 556 N PHE A 95 11.108 -11.096 -4.473 1.00 10.24 N ATOM 557 CA PHE A 95 10.414 -9.820 -4.337 1.00 65.13 C ATOM 558 C PHE A 95 10.921 -8.814 -5.366 1.00 43.31 C ATOM 559 O PHE A 95 12.106 -8.794 -5.700 1.00 71.42 O ATOM 560 CB PHE A 95 10.601 -9.261 -2.925 1.00 65.13 C ATOM 561 CG PHE A 95 9.741 -9.935 -1.895 1.00 22.11 C ATOM 562 CD1 PHE A 95 8.391 -9.641 -1.801 1.00 15.20 C ATOM 563 CD2 PHE A 95 10.283 -10.863 -1.020 1.00 3.30 C ATOM 564 CE1 PHE A 95 7.596 -10.259 -0.854 1.00 71.52 C ATOM 565 CE2 PHE A 95 9.494 -11.485 -0.072 1.00 13.24 C ATOM 566 CZ PHE A 95 8.149 -11.182 0.012 1.00 14.03 C ATOM 0 H PHE A 95 12.108 -11.056 -4.276 1.00 10.24 H new ATOM 0 HA PHE A 95 9.352 -9.991 -4.514 1.00 65.13 H new ATOM 0 HB2 PHE A 95 11.647 -9.365 -2.637 1.00 65.13 H new ATOM 0 HB3 PHE A 95 10.377 -8.194 -2.932 1.00 65.13 H new ATOM 0 HD1 PHE A 95 7.954 -8.920 -2.476 1.00 15.20 H new ATOM 0 HD2 PHE A 95 11.334 -11.103 -1.080 1.00 3.30 H new ATOM 0 HE1 PHE A 95 6.545 -10.021 -0.791 1.00 71.52 H new ATOM 0 HE2 PHE A 95 9.928 -12.208 0.603 1.00 13.24 H new ATOM 0 HZ PHE A 95 7.531 -11.666 0.754 1.00 14.03 H new ATOM 576 N SER A 96 10.015 -7.979 -5.865 1.00 70.21 N ATOM 577 CA SER A 96 10.368 -6.973 -6.859 1.00 41.42 C ATOM 578 C SER A 96 9.591 -5.681 -6.624 1.00 5.32 C ATOM 579 O SER A 96 8.360 -5.679 -6.598 1.00 11.41 O ATOM 580 CB SER A 96 10.091 -7.498 -8.269 1.00 35.10 C ATOM 581 OG SER A 96 8.776 -8.017 -8.370 1.00 72.11 O ATOM 0 H SER A 96 9.031 -7.980 -5.597 1.00 70.21 H new ATOM 0 HA SER A 96 11.432 -6.760 -6.761 1.00 41.42 H new ATOM 0 HB2 SER A 96 10.225 -6.694 -8.993 1.00 35.10 H new ATOM 0 HB3 SER A 96 10.813 -8.276 -8.519 1.00 35.10 H new ATOM 0 HG SER A 96 8.623 -8.345 -9.281 1.00 72.11 H new ATOM 587 N LEU A 97 10.320 -4.583 -6.452 1.00 72.04 N ATOM 588 CA LEU A 97 9.701 -3.283 -6.219 1.00 11.21 C ATOM 589 C LEU A 97 9.398 -2.579 -7.538 1.00 32.22 C ATOM 590 O LEU A 97 10.120 -2.744 -8.521 1.00 51.10 O ATOM 591 CB LEU A 97 10.615 -2.408 -5.359 1.00 51.12 C ATOM 592 CG LEU A 97 10.131 -0.980 -5.103 1.00 34.31 C ATOM 593 CD1 LEU A 97 9.206 -0.939 -3.896 1.00 54.05 C ATOM 594 CD2 LEU A 97 11.313 -0.044 -4.903 1.00 3.21 C ATOM 0 H LEU A 97 11.340 -4.567 -6.470 1.00 72.04 H new ATOM 0 HA LEU A 97 8.761 -3.445 -5.691 1.00 11.21 H new ATOM 0 HB2 LEU A 97 10.756 -2.900 -4.397 1.00 51.12 H new ATOM 0 HB3 LEU A 97 11.593 -2.358 -5.838 1.00 51.12 H new ATOM 0 HG LEU A 97 9.571 -0.644 -5.976 1.00 34.31 H new ATOM 0 HD11 LEU A 97 8.871 0.085 -3.729 1.00 54.05 H new ATOM 0 HD12 LEU A 97 8.342 -1.578 -4.078 1.00 54.05 H new ATOM 0 HD13 LEU A 97 9.741 -1.294 -3.015 1.00 54.05 H new ATOM 0 HD21 LEU A 97 10.950 0.968 -4.722 1.00 3.21 H new ATOM 0 HD22 LEU A 97 11.900 -0.377 -4.047 1.00 3.21 H new ATOM 0 HD23 LEU A 97 11.938 -0.051 -5.796 1.00 3.21 H new ATOM 606 N SER A 98 8.326 -1.793 -7.551 1.00 3.24 N ATOM 607 CA SER A 98 7.927 -1.065 -8.749 1.00 54.32 C ATOM 608 C SER A 98 7.466 0.347 -8.399 1.00 60.00 C ATOM 609 O SER A 98 6.354 0.546 -7.910 1.00 51.31 O ATOM 610 CB SER A 98 6.808 -1.813 -9.477 1.00 13.25 C ATOM 611 OG SER A 98 6.907 -1.639 -10.879 1.00 75.45 O ATOM 0 H SER A 98 7.719 -1.644 -6.745 1.00 3.24 H new ATOM 0 HA SER A 98 8.794 -0.993 -9.406 1.00 54.32 H new ATOM 0 HB2 SER A 98 6.858 -2.875 -9.235 1.00 13.25 H new ATOM 0 HB3 SER A 98 5.840 -1.452 -9.130 1.00 13.25 H new ATOM 0 HG SER A 98 7.621 -0.998 -11.080 1.00 75.45 H new ATOM 617 N VAL A 99 8.330 1.325 -8.653 1.00 21.31 N ATOM 618 CA VAL A 99 8.013 2.719 -8.366 1.00 62.32 C ATOM 619 C VAL A 99 7.532 3.442 -9.619 1.00 64.12 C ATOM 620 O VAL A 99 7.875 3.062 -10.739 1.00 42.11 O ATOM 621 CB VAL A 99 9.232 3.465 -7.792 1.00 63.31 C ATOM 622 CG1 VAL A 99 9.641 4.607 -8.710 1.00 72.42 C ATOM 623 CG2 VAL A 99 8.932 3.977 -6.392 1.00 13.14 C ATOM 0 H VAL A 99 9.255 1.177 -9.057 1.00 21.31 H new ATOM 0 HA VAL A 99 7.216 2.716 -7.623 1.00 62.32 H new ATOM 0 HB VAL A 99 10.066 2.766 -7.728 1.00 63.31 H new ATOM 0 HG11 VAL A 99 10.504 5.122 -8.288 1.00 72.42 H new ATOM 0 HG12 VAL A 99 9.900 4.210 -9.691 1.00 72.42 H new ATOM 0 HG13 VAL A 99 8.813 5.308 -8.810 1.00 72.42 H new ATOM 0 HG21 VAL A 99 9.804 4.502 -6.002 1.00 13.14 H new ATOM 0 HG22 VAL A 99 8.084 4.661 -6.429 1.00 13.14 H new ATOM 0 HG23 VAL A 99 8.693 3.136 -5.741 1.00 13.14 H new ATOM 633 N LYS A 100 6.736 4.487 -9.423 1.00 41.33 N ATOM 634 CA LYS A 100 6.208 5.267 -10.537 1.00 22.23 C ATOM 635 C LYS A 100 7.111 6.457 -10.844 1.00 1.31 C ATOM 636 O LYS A 100 7.561 7.158 -9.937 1.00 65.20 O ATOM 637 CB LYS A 100 4.793 5.755 -10.219 1.00 2.24 C ATOM 638 CG LYS A 100 4.217 6.681 -11.276 1.00 3.32 C ATOM 639 CD LYS A 100 2.711 6.822 -11.133 1.00 41.31 C ATOM 640 CE LYS A 100 2.345 7.804 -10.030 1.00 62.14 C ATOM 641 NZ LYS A 100 1.219 8.692 -10.430 1.00 35.13 N ATOM 0 H LYS A 100 6.442 4.814 -8.503 1.00 41.33 H new ATOM 0 HA LYS A 100 6.175 4.623 -11.416 1.00 22.23 H new ATOM 0 HB2 LYS A 100 4.137 4.892 -10.107 1.00 2.24 H new ATOM 0 HB3 LYS A 100 4.803 6.274 -9.260 1.00 2.24 H new ATOM 0 HG2 LYS A 100 4.685 7.662 -11.195 1.00 3.32 H new ATOM 0 HG3 LYS A 100 4.455 6.295 -12.267 1.00 3.32 H new ATOM 0 HD2 LYS A 100 2.285 7.159 -12.078 1.00 41.31 H new ATOM 0 HD3 LYS A 100 2.272 5.848 -10.915 1.00 41.31 H new ATOM 0 HE2 LYS A 100 2.071 7.254 -9.130 1.00 62.14 H new ATOM 0 HE3 LYS A 100 3.215 8.411 -9.780 1.00 62.14 H new ATOM 0 HZ1 LYS A 100 1.088 9.432 -9.711 1.00 35.13 H new ATOM 0 HZ2 LYS A 100 1.434 9.134 -11.347 1.00 35.13 H new ATOM 0 HZ3 LYS A 100 0.347 8.131 -10.512 1.00 35.13 H new ATOM 655 N PHE A 101 7.371 6.682 -12.128 1.00 33.53 N ATOM 656 CA PHE A 101 8.219 7.788 -12.554 1.00 65.12 C ATOM 657 C PHE A 101 7.558 8.578 -13.680 1.00 3.23 C ATOM 658 O PHE A 101 7.690 8.236 -14.854 1.00 30.31 O ATOM 659 CB PHE A 101 9.582 7.265 -13.015 1.00 12.33 C ATOM 660 CG PHE A 101 10.498 6.899 -11.882 1.00 13.51 C ATOM 661 CD1 PHE A 101 10.839 7.836 -10.919 1.00 71.23 C ATOM 662 CD2 PHE A 101 11.018 5.619 -11.780 1.00 12.20 C ATOM 663 CE1 PHE A 101 11.681 7.502 -9.875 1.00 42.33 C ATOM 664 CE2 PHE A 101 11.860 5.280 -10.738 1.00 61.11 C ATOM 665 CZ PHE A 101 12.193 6.223 -9.785 1.00 63.23 C ATOM 0 H PHE A 101 7.006 6.112 -12.891 1.00 33.53 H new ATOM 0 HA PHE A 101 8.361 8.453 -11.702 1.00 65.12 H new ATOM 0 HB2 PHE A 101 9.432 6.390 -13.647 1.00 12.33 H new ATOM 0 HB3 PHE A 101 10.064 8.024 -13.631 1.00 12.33 H new ATOM 0 HD1 PHE A 101 10.442 8.838 -10.985 1.00 71.23 H new ATOM 0 HD2 PHE A 101 10.763 4.878 -12.523 1.00 12.20 H new ATOM 0 HE1 PHE A 101 11.938 8.241 -9.130 1.00 42.33 H new ATOM 0 HE2 PHE A 101 12.258 4.278 -10.669 1.00 61.11 H new ATOM 0 HZ PHE A 101 12.853 5.960 -8.971 1.00 63.23 H new ATOM 675 N GLY A 102 6.846 9.638 -13.311 1.00 54.40 N ATOM 676 CA GLY A 102 6.174 10.461 -14.300 1.00 75.20 C ATOM 677 C GLY A 102 5.320 9.644 -15.250 1.00 44.02 C ATOM 678 O GLY A 102 4.286 9.106 -14.859 1.00 72.40 O ATOM 0 H GLY A 102 6.722 9.942 -12.345 1.00 54.40 H new ATOM 0 HA2 GLY A 102 5.548 11.195 -13.793 1.00 75.20 H new ATOM 0 HA3 GLY A 102 6.917 11.017 -14.871 1.00 75.20 H new ATOM 682 N ASN A 103 5.754 9.553 -16.503 1.00 64.01 N ATOM 683 CA ASN A 103 5.022 8.798 -17.513 1.00 34.32 C ATOM 684 C ASN A 103 5.684 7.447 -17.769 1.00 51.42 C ATOM 685 O ASN A 103 5.543 6.870 -18.847 1.00 51.04 O ATOM 686 CB ASN A 103 4.941 9.594 -18.817 1.00 13.44 C ATOM 687 CG ASN A 103 3.591 10.259 -19.005 1.00 74.23 C ATOM 688 OD1 ASN A 103 3.112 10.977 -18.128 1.00 11.52 O ATOM 689 ND2 ASN A 103 2.970 10.020 -20.155 1.00 15.44 N ATOM 0 H ASN A 103 6.609 9.993 -16.843 1.00 64.01 H new ATOM 0 HA ASN A 103 4.013 8.623 -17.139 1.00 34.32 H new ATOM 0 HB2 ASN A 103 5.722 10.354 -18.824 1.00 13.44 H new ATOM 0 HB3 ASN A 103 5.136 8.929 -19.658 1.00 13.44 H new ATOM 0 HD21 ASN A 103 2.058 10.439 -20.339 1.00 15.44 H new ATOM 0 HD22 ASN A 103 3.405 9.418 -20.854 1.00 15.44 H new ATOM 696 N ASP A 104 6.406 6.950 -16.771 1.00 73.12 N ATOM 697 CA ASP A 104 7.089 5.667 -16.887 1.00 72.42 C ATOM 698 C ASP A 104 7.204 4.987 -15.526 1.00 51.32 C ATOM 699 O ASP A 104 7.481 5.637 -14.518 1.00 21.11 O ATOM 700 CB ASP A 104 8.479 5.858 -17.495 1.00 22.01 C ATOM 701 CG ASP A 104 8.763 4.874 -18.613 1.00 52.31 C ATOM 702 OD1 ASP A 104 8.154 3.784 -18.613 1.00 20.41 O ATOM 703 OD2 ASP A 104 9.593 5.195 -19.489 1.00 13.41 O ATOM 0 H ASP A 104 6.533 7.416 -15.873 1.00 73.12 H new ATOM 0 HA ASP A 104 6.499 5.028 -17.543 1.00 72.42 H new ATOM 0 HB2 ASP A 104 8.568 6.874 -17.878 1.00 22.01 H new ATOM 0 HB3 ASP A 104 9.232 5.744 -16.715 1.00 22.01 H new ATOM 708 N VAL A 105 6.988 3.676 -15.505 1.00 30.21 N ATOM 709 CA VAL A 105 7.067 2.908 -14.268 1.00 4.00 C ATOM 710 C VAL A 105 8.306 2.019 -14.252 1.00 11.15 C ATOM 711 O VAL A 105 8.509 1.206 -15.152 1.00 64.33 O ATOM 712 CB VAL A 105 5.817 2.031 -14.071 1.00 32.15 C ATOM 713 CG1 VAL A 105 5.878 1.307 -12.734 1.00 70.54 C ATOM 714 CG2 VAL A 105 4.554 2.873 -14.172 1.00 43.33 C ATOM 0 H VAL A 105 6.757 3.123 -16.331 1.00 30.21 H new ATOM 0 HA VAL A 105 7.129 3.628 -13.452 1.00 4.00 H new ATOM 0 HB VAL A 105 5.792 1.282 -14.863 1.00 32.15 H new ATOM 0 HG11 VAL A 105 4.986 0.692 -12.612 1.00 70.54 H new ATOM 0 HG12 VAL A 105 6.763 0.672 -12.704 1.00 70.54 H new ATOM 0 HG13 VAL A 105 5.928 2.038 -11.927 1.00 70.54 H new ATOM 0 HG21 VAL A 105 3.680 2.237 -14.030 1.00 43.33 H new ATOM 0 HG22 VAL A 105 4.569 3.645 -13.403 1.00 43.33 H new ATOM 0 HG23 VAL A 105 4.506 3.341 -15.155 1.00 43.33 H new ATOM 724 N GLN A 106 9.130 2.180 -13.221 1.00 14.40 N ATOM 725 CA GLN A 106 10.349 1.392 -13.088 1.00 30.03 C ATOM 726 C GLN A 106 10.244 0.420 -11.917 1.00 14.31 C ATOM 727 O GLN A 106 9.283 0.461 -11.148 1.00 31.25 O ATOM 728 CB GLN A 106 11.557 2.311 -12.896 1.00 60.43 C ATOM 729 CG GLN A 106 11.766 3.288 -14.042 1.00 32.21 C ATOM 730 CD GLN A 106 12.208 2.603 -15.320 1.00 24.11 C ATOM 731 OE1 GLN A 106 11.971 1.410 -15.513 1.00 10.20 O ATOM 732 NE2 GLN A 106 12.856 3.356 -16.202 1.00 31.34 N ATOM 0 H GLN A 106 8.975 2.849 -12.466 1.00 14.40 H new ATOM 0 HA GLN A 106 10.481 0.816 -14.004 1.00 30.03 H new ATOM 0 HB2 GLN A 106 11.433 2.872 -11.970 1.00 60.43 H new ATOM 0 HB3 GLN A 106 12.453 1.701 -12.782 1.00 60.43 H new ATOM 0 HG2 GLN A 106 10.838 3.829 -14.227 1.00 32.21 H new ATOM 0 HG3 GLN A 106 12.514 4.027 -13.753 1.00 32.21 H new ATOM 0 HE21 GLN A 106 13.031 4.341 -16.001 1.00 31.34 H new ATOM 0 HE22 GLN A 106 13.179 2.950 -17.080 1.00 31.34 H new ATOM 741 N HIS A 107 11.237 -0.453 -11.788 1.00 24.12 N ATOM 742 CA HIS A 107 11.256 -1.436 -10.710 1.00 44.30 C ATOM 743 C HIS A 107 12.688 -1.755 -10.291 1.00 3.21 C ATOM 744 O HIS A 107 13.635 -1.506 -11.038 1.00 73.22 O ATOM 745 CB HIS A 107 10.543 -2.716 -11.146 1.00 11.12 C ATOM 746 CG HIS A 107 10.546 -2.928 -12.628 1.00 73.05 C ATOM 747 ND1 HIS A 107 11.651 -3.370 -13.323 1.00 65.34 N ATOM 748 CD2 HIS A 107 9.568 -2.758 -13.549 1.00 0.40 C ATOM 749 CE1 HIS A 107 11.354 -3.461 -14.607 1.00 65.14 C ATOM 750 NE2 HIS A 107 10.096 -3.095 -14.771 1.00 31.41 N ATOM 0 H HIS A 107 12.039 -0.500 -12.416 1.00 24.12 H new ATOM 0 HA HIS A 107 10.732 -1.011 -9.854 1.00 44.30 H new ATOM 0 HB2 HIS A 107 11.020 -3.570 -10.664 1.00 11.12 H new ATOM 0 HB3 HIS A 107 9.512 -2.686 -10.794 1.00 11.12 H new ATOM 0 HD2 HIS A 107 8.560 -2.420 -13.358 1.00 0.40 H new ATOM 0 HE1 HIS A 107 12.026 -3.781 -15.390 1.00 65.14 H new ATOM 0 HE2 HIS A 107 9.598 -3.067 -15.660 1.00 31.41 H new ATOM 758 N PHE A 108 12.840 -2.306 -9.091 1.00 53.12 N ATOM 759 CA PHE A 108 14.156 -2.657 -8.572 1.00 23.30 C ATOM 760 C PHE A 108 14.168 -4.088 -8.042 1.00 71.21 C ATOM 761 O PHE A 108 13.455 -4.418 -7.094 1.00 54.51 O ATOM 762 CB PHE A 108 14.566 -1.687 -7.462 1.00 33.01 C ATOM 763 CG PHE A 108 14.508 -0.244 -7.875 1.00 71.34 C ATOM 764 CD1 PHE A 108 13.334 0.481 -7.746 1.00 24.14 C ATOM 765 CD2 PHE A 108 15.627 0.387 -8.394 1.00 70.34 C ATOM 766 CE1 PHE A 108 13.278 1.809 -8.125 1.00 32.12 C ATOM 767 CE2 PHE A 108 15.577 1.714 -8.775 1.00 15.41 C ATOM 768 CZ PHE A 108 14.400 2.426 -8.641 1.00 43.01 C ATOM 0 H PHE A 108 12.067 -2.519 -8.460 1.00 53.12 H new ATOM 0 HA PHE A 108 14.872 -2.585 -9.391 1.00 23.30 H new ATOM 0 HB2 PHE A 108 13.915 -1.837 -6.601 1.00 33.01 H new ATOM 0 HB3 PHE A 108 15.580 -1.924 -7.140 1.00 33.01 H new ATOM 0 HD1 PHE A 108 12.453 0.003 -7.345 1.00 24.14 H new ATOM 0 HD2 PHE A 108 16.549 -0.165 -8.502 1.00 70.34 H new ATOM 0 HE1 PHE A 108 12.357 2.363 -8.018 1.00 32.12 H new ATOM 0 HE2 PHE A 108 16.457 2.194 -9.177 1.00 15.41 H new ATOM 0 HZ PHE A 108 14.358 3.463 -8.939 1.00 43.01 H new ATOM 778 N LYS A 109 14.983 -4.935 -8.661 1.00 73.45 N ATOM 779 CA LYS A 109 15.090 -6.331 -8.254 1.00 34.31 C ATOM 780 C LYS A 109 15.666 -6.444 -6.846 1.00 60.42 C ATOM 781 O LYS A 109 16.827 -6.108 -6.611 1.00 14.22 O ATOM 782 CB LYS A 109 15.967 -7.106 -9.240 1.00 22.15 C ATOM 783 CG LYS A 109 15.176 -7.901 -10.264 1.00 12.13 C ATOM 784 CD LYS A 109 15.779 -9.277 -10.489 1.00 32.35 C ATOM 785 CE LYS A 109 15.334 -10.262 -9.418 1.00 25.20 C ATOM 786 NZ LYS A 109 14.185 -11.093 -9.872 1.00 23.53 N ATOM 0 H LYS A 109 15.580 -4.679 -9.447 1.00 73.45 H new ATOM 0 HA LYS A 109 14.089 -6.761 -8.254 1.00 34.31 H new ATOM 0 HB2 LYS A 109 16.619 -6.405 -9.762 1.00 22.15 H new ATOM 0 HB3 LYS A 109 16.611 -7.786 -8.683 1.00 22.15 H new ATOM 0 HG2 LYS A 109 14.145 -8.006 -9.927 1.00 12.13 H new ATOM 0 HG3 LYS A 109 15.149 -7.356 -11.207 1.00 12.13 H new ATOM 0 HD2 LYS A 109 15.485 -9.648 -11.471 1.00 32.35 H new ATOM 0 HD3 LYS A 109 16.867 -9.204 -10.488 1.00 32.35 H new ATOM 0 HE2 LYS A 109 16.169 -10.911 -9.152 1.00 25.20 H new ATOM 0 HE3 LYS A 109 15.054 -9.717 -8.517 1.00 25.20 H new ATOM 0 HZ1 LYS A 109 13.923 -11.763 -9.121 1.00 23.53 H new ATOM 0 HZ2 LYS A 109 13.374 -10.477 -10.086 1.00 23.53 H new ATOM 0 HZ3 LYS A 109 14.454 -11.620 -10.727 1.00 23.53 H new ATOM 800 N VAL A 110 14.848 -6.922 -5.913 1.00 42.32 N ATOM 801 CA VAL A 110 15.278 -7.082 -4.529 1.00 51.22 C ATOM 802 C VAL A 110 16.190 -8.293 -4.374 1.00 24.14 C ATOM 803 O VAL A 110 15.856 -9.396 -4.809 1.00 21.15 O ATOM 804 CB VAL A 110 14.073 -7.235 -3.582 1.00 22.23 C ATOM 805 CG1 VAL A 110 14.530 -7.703 -2.208 1.00 41.23 C ATOM 806 CG2 VAL A 110 13.306 -5.926 -3.480 1.00 54.22 C ATOM 0 H VAL A 110 13.884 -7.205 -6.091 1.00 42.32 H new ATOM 0 HA VAL A 110 15.829 -6.180 -4.261 1.00 51.22 H new ATOM 0 HB VAL A 110 13.404 -7.991 -3.993 1.00 22.23 H new ATOM 0 HG11 VAL A 110 13.665 -7.806 -1.552 1.00 41.23 H new ATOM 0 HG12 VAL A 110 15.032 -8.666 -2.300 1.00 41.23 H new ATOM 0 HG13 VAL A 110 15.221 -6.973 -1.786 1.00 41.23 H new ATOM 0 HG21 VAL A 110 12.458 -6.053 -2.807 1.00 54.22 H new ATOM 0 HG22 VAL A 110 13.964 -5.148 -3.093 1.00 54.22 H new ATOM 0 HG23 VAL A 110 12.945 -5.638 -4.467 1.00 54.22 H new ATOM 816 N LEU A 111 17.344 -8.081 -3.750 1.00 62.44 N ATOM 817 CA LEU A 111 18.307 -9.157 -3.536 1.00 54.41 C ATOM 818 C LEU A 111 18.291 -9.620 -2.083 1.00 11.21 C ATOM 819 O LEU A 111 18.051 -8.828 -1.171 1.00 71.02 O ATOM 820 CB LEU A 111 19.713 -8.693 -3.920 1.00 72.03 C ATOM 821 CG LEU A 111 20.337 -9.379 -5.136 1.00 52.12 C ATOM 822 CD1 LEU A 111 20.260 -8.475 -6.357 1.00 33.21 C ATOM 823 CD2 LEU A 111 21.780 -9.767 -4.848 1.00 12.43 C ATOM 0 H LEU A 111 17.636 -7.175 -3.384 1.00 62.44 H new ATOM 0 HA LEU A 111 18.023 -9.998 -4.169 1.00 54.41 H new ATOM 0 HB2 LEU A 111 19.681 -7.620 -4.110 1.00 72.03 H new ATOM 0 HB3 LEU A 111 20.371 -8.846 -3.064 1.00 72.03 H new ATOM 0 HG LEU A 111 19.772 -10.288 -5.346 1.00 52.12 H new ATOM 0 HD11 LEU A 111 20.709 -8.980 -7.212 1.00 33.21 H new ATOM 0 HD12 LEU A 111 19.217 -8.248 -6.576 1.00 33.21 H new ATOM 0 HD13 LEU A 111 20.799 -7.549 -6.159 1.00 33.21 H new ATOM 0 HD21 LEU A 111 22.208 -10.254 -5.724 1.00 12.43 H new ATOM 0 HD22 LEU A 111 22.357 -8.873 -4.612 1.00 12.43 H new ATOM 0 HD23 LEU A 111 21.810 -10.453 -4.001 1.00 12.43 H new ATOM 835 N ARG A 112 18.550 -10.907 -1.875 1.00 2.54 N ATOM 836 CA ARG A 112 18.567 -11.475 -0.532 1.00 52.11 C ATOM 837 C ARG A 112 19.735 -12.442 -0.366 1.00 4.14 C ATOM 838 O ARG A 112 20.370 -12.839 -1.343 1.00 52.22 O ATOM 839 CB ARG A 112 17.249 -12.196 -0.244 1.00 71.44 C ATOM 840 CG ARG A 112 16.063 -11.623 -1.002 1.00 73.34 C ATOM 841 CD ARG A 112 15.736 -12.452 -2.235 1.00 0.11 C ATOM 842 NE ARG A 112 16.262 -11.848 -3.456 1.00 5.31 N ATOM 843 CZ ARG A 112 16.422 -12.512 -4.595 1.00 22.31 C ATOM 844 NH1 ARG A 112 16.097 -13.796 -4.669 1.00 5.34 N ATOM 845 NH2 ARG A 112 16.907 -11.893 -5.663 1.00 43.14 N ATOM 0 H ARG A 112 18.751 -11.576 -2.619 1.00 2.54 H new ATOM 0 HA ARG A 112 18.690 -10.659 0.180 1.00 52.11 H new ATOM 0 HB2 ARG A 112 17.358 -13.250 -0.500 1.00 71.44 H new ATOM 0 HB3 ARG A 112 17.044 -12.147 0.825 1.00 71.44 H new ATOM 0 HG2 ARG A 112 15.194 -11.587 -0.346 1.00 73.34 H new ATOM 0 HG3 ARG A 112 16.281 -10.597 -1.299 1.00 73.34 H new ATOM 0 HD2 ARG A 112 16.150 -13.454 -2.119 1.00 0.11 H new ATOM 0 HD3 ARG A 112 14.655 -12.562 -2.322 1.00 0.11 H new ATOM 0 HE ARG A 112 16.521 -10.862 -3.433 1.00 5.31 H new ATOM 0 HH11 ARG A 112 15.723 -14.275 -3.850 1.00 5.34 H new ATOM 0 HH12 ARG A 112 16.221 -14.304 -5.545 1.00 5.34 H new ATOM 0 HH21 ARG A 112 17.158 -10.906 -5.610 1.00 43.14 H new ATOM 0 HH22 ARG A 112 17.029 -12.404 -6.537 1.00 43.14 H new ATOM 859 N ASP A 113 20.014 -12.816 0.878 1.00 20.21 N ATOM 860 CA ASP A 113 21.106 -13.737 1.173 1.00 13.01 C ATOM 861 C ASP A 113 20.577 -15.147 1.418 1.00 54.33 C ATOM 862 O ASP A 113 19.406 -15.433 1.171 1.00 13.31 O ATOM 863 CB ASP A 113 21.892 -13.255 2.393 1.00 21.13 C ATOM 864 CG ASP A 113 23.322 -12.885 2.051 1.00 12.43 C ATOM 865 OD1 ASP A 113 23.566 -12.462 0.902 1.00 10.21 O ATOM 866 OD2 ASP A 113 24.197 -13.018 2.933 1.00 72.24 O ATOM 0 H ASP A 113 19.499 -12.496 1.698 1.00 20.21 H new ATOM 0 HA ASP A 113 21.770 -13.763 0.309 1.00 13.01 H new ATOM 0 HB2 ASP A 113 21.390 -12.390 2.827 1.00 21.13 H new ATOM 0 HB3 ASP A 113 21.894 -14.037 3.153 1.00 21.13 H new ATOM 871 N GLY A 114 21.449 -16.025 1.904 1.00 53.13 N ATOM 872 CA GLY A 114 21.051 -17.394 2.172 1.00 30.52 C ATOM 873 C GLY A 114 20.613 -17.600 3.609 1.00 54.14 C ATOM 874 O GLY A 114 20.824 -18.668 4.182 1.00 14.13 O ATOM 0 H GLY A 114 22.424 -15.812 2.117 1.00 53.13 H new ATOM 0 HA2 GLY A 114 20.235 -17.669 1.504 1.00 30.52 H new ATOM 0 HA3 GLY A 114 21.884 -18.061 1.950 1.00 30.52 H new ATOM 878 N ALA A 115 20.002 -16.574 4.192 1.00 50.42 N ATOM 879 CA ALA A 115 19.533 -16.647 5.570 1.00 53.41 C ATOM 880 C ALA A 115 18.139 -16.044 5.708 1.00 75.43 C ATOM 881 O ALA A 115 17.286 -16.582 6.413 1.00 23.23 O ATOM 882 CB ALA A 115 20.509 -15.940 6.498 1.00 2.31 C ATOM 0 H ALA A 115 19.820 -15.682 3.731 1.00 50.42 H new ATOM 0 HA ALA A 115 19.476 -17.698 5.853 1.00 53.41 H new ATOM 0 HB1 ALA A 115 20.146 -16.002 7.524 1.00 2.31 H new ATOM 0 HB2 ALA A 115 21.487 -16.417 6.429 1.00 2.31 H new ATOM 0 HB3 ALA A 115 20.595 -14.893 6.207 1.00 2.31 H new ATOM 888 N GLY A 116 17.913 -14.923 5.029 1.00 61.41 N ATOM 889 CA GLY A 116 16.621 -14.266 5.090 1.00 33.31 C ATOM 890 C GLY A 116 16.741 -12.764 5.250 1.00 2.21 C ATOM 891 O GLY A 116 15.909 -12.132 5.901 1.00 53.01 O ATOM 0 H GLY A 116 18.602 -14.458 4.438 1.00 61.41 H new ATOM 0 HA2 GLY A 116 16.061 -14.488 4.182 1.00 33.31 H new ATOM 0 HA3 GLY A 116 16.049 -14.673 5.924 1.00 33.31 H new ATOM 895 N LYS A 117 17.782 -12.189 4.656 1.00 14.24 N ATOM 896 CA LYS A 117 18.010 -10.751 4.736 1.00 51.14 C ATOM 897 C LYS A 117 17.872 -10.102 3.362 1.00 14.53 C ATOM 898 O LYS A 117 18.380 -10.618 2.367 1.00 51.12 O ATOM 899 CB LYS A 117 19.400 -10.465 5.309 1.00 73.20 C ATOM 900 CG LYS A 117 19.394 -10.173 6.799 1.00 4.24 C ATOM 901 CD LYS A 117 19.217 -11.442 7.616 1.00 2.10 C ATOM 902 CE LYS A 117 18.704 -11.137 9.015 1.00 74.41 C ATOM 903 NZ LYS A 117 19.289 -12.054 10.032 1.00 1.44 N ATOM 0 H LYS A 117 18.481 -12.697 4.114 1.00 14.24 H new ATOM 0 HA LYS A 117 17.256 -10.325 5.398 1.00 51.14 H new ATOM 0 HB2 LYS A 117 20.046 -11.322 5.118 1.00 73.20 H new ATOM 0 HB3 LYS A 117 19.833 -9.615 4.782 1.00 73.20 H new ATOM 0 HG2 LYS A 117 20.328 -9.687 7.079 1.00 4.24 H new ATOM 0 HG3 LYS A 117 18.589 -9.475 7.031 1.00 4.24 H new ATOM 0 HD2 LYS A 117 18.519 -12.108 7.109 1.00 2.10 H new ATOM 0 HD3 LYS A 117 20.169 -11.969 7.683 1.00 2.10 H new ATOM 0 HE2 LYS A 117 18.946 -10.106 9.274 1.00 74.41 H new ATOM 0 HE3 LYS A 117 17.618 -11.223 9.030 1.00 74.41 H new ATOM 0 HZ1 LYS A 117 18.915 -11.814 10.972 1.00 1.44 H new ATOM 0 HZ2 LYS A 117 19.037 -13.036 9.800 1.00 1.44 H new ATOM 0 HZ3 LYS A 117 20.324 -11.953 10.036 1.00 1.44 H new ATOM 917 N TYR A 118 17.183 -8.967 3.316 1.00 14.13 N ATOM 918 CA TYR A 118 16.977 -8.248 2.065 1.00 41.33 C ATOM 919 C TYR A 118 17.969 -7.096 1.929 1.00 73.21 C ATOM 920 O TYR A 118 18.436 -6.543 2.925 1.00 63.44 O ATOM 921 CB TYR A 118 15.546 -7.714 1.988 1.00 75.54 C ATOM 922 CG TYR A 118 14.491 -8.780 2.182 1.00 70.53 C ATOM 923 CD1 TYR A 118 14.196 -9.685 1.169 1.00 35.33 C ATOM 924 CD2 TYR A 118 13.789 -8.882 3.377 1.00 65.55 C ATOM 925 CE1 TYR A 118 13.232 -10.661 1.342 1.00 44.43 C ATOM 926 CE2 TYR A 118 12.826 -9.855 3.558 1.00 32.43 C ATOM 927 CZ TYR A 118 12.551 -10.742 2.538 1.00 13.10 C ATOM 928 OH TYR A 118 11.590 -11.712 2.715 1.00 45.44 O ATOM 0 H TYR A 118 16.758 -8.525 4.131 1.00 14.13 H new ATOM 0 HA TYR A 118 17.142 -8.946 1.244 1.00 41.33 H new ATOM 0 HB2 TYR A 118 15.414 -6.942 2.746 1.00 75.54 H new ATOM 0 HB3 TYR A 118 15.396 -7.238 1.019 1.00 75.54 H new ATOM 0 HD1 TYR A 118 14.729 -9.625 0.231 1.00 35.33 H new ATOM 0 HD2 TYR A 118 14.000 -8.189 4.178 1.00 65.55 H new ATOM 0 HE1 TYR A 118 13.014 -11.356 0.545 1.00 44.43 H new ATOM 0 HE2 TYR A 118 12.291 -9.921 4.494 1.00 32.43 H new ATOM 0 HH TYR A 118 11.206 -11.632 3.613 1.00 45.44 H new ATOM 938 N PHE A 119 18.285 -6.739 0.688 1.00 34.44 N ATOM 939 CA PHE A 119 19.221 -5.654 0.420 1.00 12.01 C ATOM 940 C PHE A 119 19.241 -5.308 -1.066 1.00 11.00 C ATOM 941 O PHE A 119 18.684 -6.033 -1.892 1.00 11.24 O ATOM 942 CB PHE A 119 20.627 -6.038 0.885 1.00 70.32 C ATOM 943 CG PHE A 119 20.918 -7.507 0.765 1.00 74.04 C ATOM 944 CD1 PHE A 119 20.607 -8.195 -0.397 1.00 20.40 C ATOM 945 CD2 PHE A 119 21.501 -8.199 1.814 1.00 73.33 C ATOM 946 CE1 PHE A 119 20.873 -9.547 -0.511 1.00 44.10 C ATOM 947 CE2 PHE A 119 21.770 -9.551 1.705 1.00 11.42 C ATOM 948 CZ PHE A 119 21.455 -10.225 0.542 1.00 33.50 C ATOM 0 H PHE A 119 17.906 -7.185 -0.147 1.00 34.44 H new ATOM 0 HA PHE A 119 18.890 -4.776 0.975 1.00 12.01 H new ATOM 0 HB2 PHE A 119 21.359 -5.482 0.300 1.00 70.32 H new ATOM 0 HB3 PHE A 119 20.753 -5.735 1.924 1.00 70.32 H new ATOM 0 HD1 PHE A 119 20.152 -7.669 -1.223 1.00 20.40 H new ATOM 0 HD2 PHE A 119 21.748 -7.677 2.727 1.00 73.33 H new ATOM 0 HE1 PHE A 119 20.626 -10.072 -1.422 1.00 44.10 H new ATOM 0 HE2 PHE A 119 22.226 -10.079 2.529 1.00 11.42 H new ATOM 0 HZ PHE A 119 21.663 -11.281 0.456 1.00 33.50 H new ATOM 958 N LEU A 120 19.886 -4.196 -1.399 1.00 53.54 N ATOM 959 CA LEU A 120 19.979 -3.751 -2.786 1.00 31.51 C ATOM 960 C LEU A 120 21.433 -3.524 -3.188 1.00 75.13 C ATOM 961 O LEU A 120 22.119 -4.449 -3.622 1.00 75.54 O ATOM 962 CB LEU A 120 19.175 -2.465 -2.985 1.00 65.11 C ATOM 963 CG LEU A 120 17.738 -2.641 -3.475 1.00 14.12 C ATOM 964 CD1 LEU A 120 16.751 -2.218 -2.397 1.00 43.23 C ATOM 965 CD2 LEU A 120 17.508 -1.846 -4.752 1.00 63.21 C ATOM 0 H LEU A 120 20.353 -3.585 -0.728 1.00 53.54 H new ATOM 0 HA LEU A 120 19.564 -4.533 -3.422 1.00 31.51 H new ATOM 0 HB2 LEU A 120 19.151 -1.925 -2.038 1.00 65.11 H new ATOM 0 HB3 LEU A 120 19.706 -1.835 -3.698 1.00 65.11 H new ATOM 0 HG LEU A 120 17.576 -3.696 -3.694 1.00 14.12 H new ATOM 0 HD11 LEU A 120 15.733 -2.350 -2.764 1.00 43.23 H new ATOM 0 HD12 LEU A 120 16.899 -2.831 -1.508 1.00 43.23 H new ATOM 0 HD13 LEU A 120 16.913 -1.170 -2.146 1.00 43.23 H new ATOM 0 HD21 LEU A 120 16.480 -1.983 -5.086 1.00 63.21 H new ATOM 0 HD22 LEU A 120 17.689 -0.788 -4.560 1.00 63.21 H new ATOM 0 HD23 LEU A 120 18.191 -2.196 -5.526 1.00 63.21 H new ATOM 977 N TRP A 121 21.896 -2.288 -3.039 1.00 74.43 N ATOM 978 CA TRP A 121 23.269 -1.940 -3.385 1.00 60.13 C ATOM 979 C TRP A 121 24.226 -2.312 -2.258 1.00 35.41 C ATOM 980 O TRP A 121 25.219 -3.005 -2.477 1.00 63.30 O ATOM 981 CB TRP A 121 23.377 -0.445 -3.689 1.00 54.03 C ATOM 982 CG TRP A 121 22.362 0.034 -4.683 1.00 34.33 C ATOM 983 CD1 TRP A 121 21.176 0.654 -4.409 1.00 31.21 C ATOM 984 CD2 TRP A 121 22.442 -0.070 -6.108 1.00 63.54 C ATOM 985 NE1 TRP A 121 20.515 0.941 -5.579 1.00 13.34 N ATOM 986 CE2 TRP A 121 21.271 0.508 -6.635 1.00 71.03 C ATOM 987 CE3 TRP A 121 23.391 -0.594 -6.991 1.00 73.01 C ATOM 988 CZ2 TRP A 121 21.025 0.575 -8.004 1.00 70.21 C ATOM 989 CZ3 TRP A 121 23.145 -0.527 -8.349 1.00 71.13 C ATOM 990 CH2 TRP A 121 21.971 0.054 -8.845 1.00 55.43 C ATOM 0 H TRP A 121 21.341 -1.511 -2.681 1.00 74.43 H new ATOM 0 HA TRP A 121 23.547 -2.506 -4.274 1.00 60.13 H new ATOM 0 HB2 TRP A 121 23.260 0.116 -2.762 1.00 54.03 H new ATOM 0 HB3 TRP A 121 24.376 -0.230 -4.068 1.00 54.03 H new ATOM 0 HD1 TRP A 121 20.812 0.885 -3.419 1.00 31.21 H new ATOM 0 HE1 TRP A 121 19.608 1.402 -5.649 1.00 13.34 H new ATOM 0 HE3 TRP A 121 24.300 -1.043 -6.618 1.00 73.01 H new ATOM 0 HZ2 TRP A 121 20.120 1.022 -8.388 1.00 70.21 H new ATOM 0 HZ3 TRP A 121 23.871 -0.930 -9.040 1.00 71.13 H new ATOM 0 HH2 TRP A 121 21.809 0.092 -9.912 1.00 55.43 H new ATOM 1001 N VAL A 122 23.920 -1.848 -1.050 1.00 74.34 N ATOM 1002 CA VAL A 122 24.752 -2.134 0.112 1.00 21.00 C ATOM 1003 C VAL A 122 23.908 -2.256 1.376 1.00 61.13 C ATOM 1004 O VAL A 122 24.177 -3.095 2.236 1.00 14.31 O ATOM 1005 CB VAL A 122 25.817 -1.041 0.322 1.00 15.14 C ATOM 1006 CG1 VAL A 122 25.159 0.321 0.482 1.00 11.41 C ATOM 1007 CG2 VAL A 122 26.684 -1.368 1.528 1.00 2.24 C ATOM 0 H VAL A 122 23.102 -1.272 -0.851 1.00 74.34 H new ATOM 0 HA VAL A 122 25.250 -3.084 -0.081 1.00 21.00 H new ATOM 0 HB VAL A 122 26.458 -1.007 -0.559 1.00 15.14 H new ATOM 0 HG11 VAL A 122 25.927 1.081 0.629 1.00 11.41 H new ATOM 0 HG12 VAL A 122 24.584 0.555 -0.414 1.00 11.41 H new ATOM 0 HG13 VAL A 122 24.494 0.305 1.346 1.00 11.41 H new ATOM 0 HG21 VAL A 122 27.431 -0.586 1.662 1.00 2.24 H new ATOM 0 HG22 VAL A 122 26.059 -1.430 2.419 1.00 2.24 H new ATOM 0 HG23 VAL A 122 27.184 -2.323 1.368 1.00 2.24 H new ATOM 1017 N VAL A 123 22.885 -1.414 1.481 1.00 2.23 N ATOM 1018 CA VAL A 123 22.000 -1.428 2.640 1.00 54.15 C ATOM 1019 C VAL A 123 21.211 -2.730 2.712 1.00 32.53 C ATOM 1020 O VAL A 123 20.783 -3.269 1.691 1.00 42.52 O ATOM 1021 CB VAL A 123 21.014 -0.245 2.607 1.00 50.21 C ATOM 1022 CG1 VAL A 123 20.025 -0.405 1.463 1.00 73.14 C ATOM 1023 CG2 VAL A 123 20.287 -0.121 3.937 1.00 2.54 C ATOM 0 H VAL A 123 22.649 -0.714 0.778 1.00 2.23 H new ATOM 0 HA VAL A 123 22.633 -1.340 3.523 1.00 54.15 H new ATOM 0 HB VAL A 123 21.580 0.672 2.441 1.00 50.21 H new ATOM 0 HG11 VAL A 123 19.337 0.440 1.456 1.00 73.14 H new ATOM 0 HG12 VAL A 123 20.565 -0.441 0.517 1.00 73.14 H new ATOM 0 HG13 VAL A 123 19.463 -1.330 1.595 1.00 73.14 H new ATOM 0 HG21 VAL A 123 19.594 0.720 3.896 1.00 2.54 H new ATOM 0 HG22 VAL A 123 19.733 -1.038 4.136 1.00 2.54 H new ATOM 0 HG23 VAL A 123 21.012 0.045 4.734 1.00 2.54 H new ATOM 1033 N LYS A 124 21.021 -3.233 3.927 1.00 34.34 N ATOM 1034 CA LYS A 124 20.281 -4.473 4.136 1.00 43.41 C ATOM 1035 C LYS A 124 19.403 -4.379 5.379 1.00 32.54 C ATOM 1036 O LYS A 124 19.551 -3.464 6.189 1.00 54.31 O ATOM 1037 CB LYS A 124 21.248 -5.651 4.269 1.00 63.31 C ATOM 1038 CG LYS A 124 21.855 -5.787 5.655 1.00 50.13 C ATOM 1039 CD LYS A 124 22.982 -6.806 5.673 1.00 72.22 C ATOM 1040 CE LYS A 124 23.679 -6.843 7.024 1.00 13.33 C ATOM 1041 NZ LYS A 124 23.295 -8.045 7.814 1.00 71.50 N ATOM 0 H LYS A 124 21.369 -2.801 4.783 1.00 34.34 H new ATOM 0 HA LYS A 124 19.638 -4.634 3.270 1.00 43.41 H new ATOM 0 HB2 LYS A 124 20.721 -6.572 4.020 1.00 63.31 H new ATOM 0 HB3 LYS A 124 22.050 -5.536 3.540 1.00 63.31 H new ATOM 0 HG2 LYS A 124 22.233 -4.819 5.984 1.00 50.13 H new ATOM 0 HG3 LYS A 124 21.082 -6.085 6.364 1.00 50.13 H new ATOM 0 HD2 LYS A 124 22.584 -7.794 5.441 1.00 72.22 H new ATOM 0 HD3 LYS A 124 23.706 -6.563 4.895 1.00 72.22 H new ATOM 0 HE2 LYS A 124 24.759 -6.836 6.876 1.00 13.33 H new ATOM 0 HE3 LYS A 124 23.428 -5.944 7.587 1.00 13.33 H new ATOM 0 HZ1 LYS A 124 23.791 -8.033 8.728 1.00 71.50 H new ATOM 0 HZ2 LYS A 124 22.268 -8.039 7.978 1.00 71.50 H new ATOM 0 HZ3 LYS A 124 23.557 -8.904 7.289 1.00 71.50 H new ATOM 1055 N PHE A 125 18.489 -5.333 5.526 1.00 63.42 N ATOM 1056 CA PHE A 125 17.587 -5.359 6.671 1.00 3.13 C ATOM 1057 C PHE A 125 17.052 -6.768 6.911 1.00 40.41 C ATOM 1058 O PHE A 125 17.363 -7.696 6.166 1.00 55.12 O ATOM 1059 CB PHE A 125 16.424 -4.389 6.453 1.00 31.40 C ATOM 1060 CG PHE A 125 16.783 -2.954 6.713 1.00 72.24 C ATOM 1061 CD1 PHE A 125 17.131 -2.533 7.986 1.00 52.21 C ATOM 1062 CD2 PHE A 125 16.773 -2.027 5.683 1.00 12.45 C ATOM 1063 CE1 PHE A 125 17.461 -1.213 8.228 1.00 53.44 C ATOM 1064 CE2 PHE A 125 17.102 -0.705 5.919 1.00 22.10 C ATOM 1065 CZ PHE A 125 17.448 -0.298 7.193 1.00 54.13 C ATOM 0 H PHE A 125 18.354 -6.099 4.866 1.00 63.42 H new ATOM 0 HA PHE A 125 18.149 -5.049 7.552 1.00 3.13 H new ATOM 0 HB2 PHE A 125 16.068 -4.486 5.427 1.00 31.40 H new ATOM 0 HB3 PHE A 125 15.598 -4.672 7.105 1.00 31.40 H new ATOM 0 HD1 PHE A 125 17.145 -3.244 8.799 1.00 52.21 H new ATOM 0 HD2 PHE A 125 16.505 -2.341 4.685 1.00 12.45 H new ATOM 0 HE1 PHE A 125 17.729 -0.897 9.225 1.00 53.44 H new ATOM 0 HE2 PHE A 125 17.089 0.009 5.108 1.00 22.10 H new ATOM 0 HZ PHE A 125 17.708 0.734 7.380 1.00 54.13 H new ATOM 1075 N ASN A 126 16.246 -6.918 7.957 1.00 41.00 N ATOM 1076 CA ASN A 126 15.668 -8.213 8.296 1.00 31.25 C ATOM 1077 C ASN A 126 14.346 -8.427 7.566 1.00 14.12 C ATOM 1078 O ASN A 126 14.082 -9.509 7.042 1.00 41.24 O ATOM 1079 CB ASN A 126 15.452 -8.318 9.808 1.00 73.25 C ATOM 1080 CG ASN A 126 14.582 -7.199 10.346 1.00 11.13 C ATOM 1081 OD1 ASN A 126 13.366 -7.346 10.467 1.00 34.33 O ATOM 1082 ND2 ASN A 126 15.203 -6.072 10.672 1.00 3.45 N ATOM 0 H ASN A 126 15.979 -6.159 8.584 1.00 41.00 H new ATOM 0 HA ASN A 126 16.366 -8.988 7.980 1.00 31.25 H new ATOM 0 HB2 ASN A 126 14.990 -9.278 10.041 1.00 73.25 H new ATOM 0 HB3 ASN A 126 16.418 -8.298 10.313 1.00 73.25 H new ATOM 0 HD21 ASN A 126 14.670 -5.284 11.039 1.00 3.45 H new ATOM 0 HD22 ASN A 126 16.213 -5.994 10.555 1.00 3.45 H new ATOM 1089 N SER A 127 13.518 -7.387 7.536 1.00 33.42 N ATOM 1090 CA SER A 127 12.221 -7.462 6.873 1.00 1.21 C ATOM 1091 C SER A 127 12.146 -6.472 5.715 1.00 71.05 C ATOM 1092 O SER A 127 12.965 -5.558 5.609 1.00 13.12 O ATOM 1093 CB SER A 127 11.097 -7.181 7.872 1.00 32.31 C ATOM 1094 OG SER A 127 10.036 -8.108 7.719 1.00 32.14 O ATOM 0 H SER A 127 13.722 -6.483 7.963 1.00 33.42 H new ATOM 0 HA SER A 127 12.101 -8.470 6.476 1.00 1.21 H new ATOM 0 HB2 SER A 127 11.487 -7.235 8.888 1.00 32.31 H new ATOM 0 HB3 SER A 127 10.723 -6.168 7.728 1.00 32.31 H new ATOM 0 HG SER A 127 9.331 -7.908 8.370 1.00 32.14 H new ATOM 1100 N LEU A 128 11.158 -6.661 4.847 1.00 51.12 N ATOM 1101 CA LEU A 128 10.974 -5.785 3.694 1.00 31.45 C ATOM 1102 C LEU A 128 10.518 -4.397 4.132 1.00 31.35 C ATOM 1103 O LEU A 128 11.156 -3.395 3.815 1.00 1.20 O ATOM 1104 CB LEU A 128 9.953 -6.389 2.729 1.00 51.05 C ATOM 1105 CG LEU A 128 10.500 -7.395 1.715 1.00 24.05 C ATOM 1106 CD1 LEU A 128 9.362 -8.121 1.016 1.00 60.23 C ATOM 1107 CD2 LEU A 128 11.394 -6.697 0.701 1.00 62.34 C ATOM 0 H LEU A 128 10.472 -7.412 4.919 1.00 51.12 H new ATOM 0 HA LEU A 128 11.933 -5.688 3.185 1.00 31.45 H new ATOM 0 HB2 LEU A 128 9.176 -6.880 3.315 1.00 51.05 H new ATOM 0 HB3 LEU A 128 9.475 -5.576 2.182 1.00 51.05 H new ATOM 0 HG LEU A 128 11.099 -8.132 2.250 1.00 24.05 H new ATOM 0 HD11 LEU A 128 9.771 -8.832 0.298 1.00 60.23 H new ATOM 0 HD12 LEU A 128 8.763 -8.654 1.754 1.00 60.23 H new ATOM 0 HD13 LEU A 128 8.736 -7.398 0.494 1.00 60.23 H new ATOM 0 HD21 LEU A 128 11.774 -7.428 -0.013 1.00 62.34 H new ATOM 0 HD22 LEU A 128 10.819 -5.938 0.171 1.00 62.34 H new ATOM 0 HD23 LEU A 128 12.230 -6.225 1.217 1.00 62.34 H new ATOM 1119 N ASN A 129 9.410 -4.348 4.865 1.00 2.14 N ATOM 1120 CA ASN A 129 8.869 -3.083 5.349 1.00 45.31 C ATOM 1121 C ASN A 129 9.991 -2.132 5.756 1.00 41.21 C ATOM 1122 O ASN A 129 9.959 -0.945 5.433 1.00 40.01 O ATOM 1123 CB ASN A 129 7.934 -3.324 6.536 1.00 45.03 C ATOM 1124 CG ASN A 129 7.726 -2.075 7.370 1.00 34.34 C ATOM 1125 OD1 ASN A 129 8.042 -0.967 6.939 1.00 52.52 O ATOM 1126 ND2 ASN A 129 7.191 -2.250 8.573 1.00 33.42 N ATOM 0 H ASN A 129 8.870 -5.169 5.137 1.00 2.14 H new ATOM 0 HA ASN A 129 8.304 -2.624 4.538 1.00 45.31 H new ATOM 0 HB2 ASN A 129 6.970 -3.678 6.170 1.00 45.03 H new ATOM 0 HB3 ASN A 129 8.346 -4.113 7.165 1.00 45.03 H new ATOM 0 HD21 ASN A 129 7.027 -1.447 9.180 1.00 33.42 H new ATOM 0 HD22 ASN A 129 6.944 -3.188 8.890 1.00 33.42 H new ATOM 1133 N GLU A 130 10.981 -2.663 6.466 1.00 23.02 N ATOM 1134 CA GLU A 130 12.113 -1.861 6.917 1.00 34.12 C ATOM 1135 C GLU A 130 12.826 -1.213 5.734 1.00 24.41 C ATOM 1136 O GLU A 130 13.193 -0.038 5.783 1.00 73.31 O ATOM 1137 CB GLU A 130 13.096 -2.726 7.709 1.00 52.31 C ATOM 1138 CG GLU A 130 13.089 -2.444 9.202 1.00 52.30 C ATOM 1139 CD GLU A 130 11.899 -3.065 9.907 1.00 11.04 C ATOM 1140 OE1 GLU A 130 10.836 -3.204 9.266 1.00 22.21 O ATOM 1141 OE2 GLU A 130 12.030 -3.411 11.100 1.00 72.42 O ATOM 0 H GLU A 130 11.023 -3.644 6.741 1.00 23.02 H new ATOM 0 HA GLU A 130 11.732 -1.072 7.565 1.00 34.12 H new ATOM 0 HB2 GLU A 130 12.856 -3.777 7.545 1.00 52.31 H new ATOM 0 HB3 GLU A 130 14.102 -2.565 7.322 1.00 52.31 H new ATOM 0 HG2 GLU A 130 14.009 -2.826 9.645 1.00 52.30 H new ATOM 0 HG3 GLU A 130 13.081 -1.366 9.364 1.00 52.30 H new ATOM 1148 N LEU A 131 13.021 -1.988 4.672 1.00 2.34 N ATOM 1149 CA LEU A 131 13.692 -1.491 3.476 1.00 53.12 C ATOM 1150 C LEU A 131 12.870 -0.394 2.807 1.00 11.41 C ATOM 1151 O LEU A 131 13.417 0.594 2.315 1.00 33.41 O ATOM 1152 CB LEU A 131 13.933 -2.636 2.490 1.00 0.42 C ATOM 1153 CG LEU A 131 15.395 -2.999 2.229 1.00 60.14 C ATOM 1154 CD1 LEU A 131 15.773 -4.267 2.980 1.00 55.55 C ATOM 1155 CD2 LEU A 131 15.644 -3.166 0.737 1.00 63.52 C ATOM 0 H LEU A 131 12.724 -2.962 4.615 1.00 2.34 H new ATOM 0 HA LEU A 131 14.651 -1.069 3.776 1.00 53.12 H new ATOM 0 HB2 LEU A 131 13.420 -3.523 2.861 1.00 0.42 H new ATOM 0 HB3 LEU A 131 13.469 -2.374 1.539 1.00 0.42 H new ATOM 0 HG LEU A 131 16.022 -2.185 2.593 1.00 60.14 H new ATOM 0 HD11 LEU A 131 16.817 -4.510 2.782 1.00 55.55 H new ATOM 0 HD12 LEU A 131 15.633 -4.112 4.050 1.00 55.55 H new ATOM 0 HD13 LEU A 131 15.140 -5.089 2.647 1.00 55.55 H new ATOM 0 HD21 LEU A 131 16.690 -3.424 0.569 1.00 63.52 H new ATOM 0 HD22 LEU A 131 15.007 -3.961 0.349 1.00 63.52 H new ATOM 0 HD23 LEU A 131 15.414 -2.233 0.223 1.00 63.52 H new ATOM 1167 N VAL A 132 11.553 -0.572 2.795 1.00 73.04 N ATOM 1168 CA VAL A 132 10.655 0.404 2.190 1.00 53.34 C ATOM 1169 C VAL A 132 10.703 1.732 2.937 1.00 41.45 C ATOM 1170 O VAL A 132 10.633 2.801 2.329 1.00 35.11 O ATOM 1171 CB VAL A 132 9.202 -0.107 2.168 1.00 70.21 C ATOM 1172 CG1 VAL A 132 8.246 1.014 1.791 1.00 43.43 C ATOM 1173 CG2 VAL A 132 9.065 -1.280 1.209 1.00 30.42 C ATOM 0 H VAL A 132 11.084 -1.383 3.198 1.00 73.04 H new ATOM 0 HA VAL A 132 10.995 0.554 1.165 1.00 53.34 H new ATOM 0 HB VAL A 132 8.942 -0.452 3.169 1.00 70.21 H new ATOM 0 HG11 VAL A 132 7.225 0.633 1.781 1.00 43.43 H new ATOM 0 HG12 VAL A 132 8.325 1.820 2.520 1.00 43.43 H new ATOM 0 HG13 VAL A 132 8.502 1.393 0.801 1.00 43.43 H new ATOM 0 HG21 VAL A 132 8.032 -1.629 1.206 1.00 30.42 H new ATOM 0 HG22 VAL A 132 9.344 -0.963 0.204 1.00 30.42 H new ATOM 0 HG23 VAL A 132 9.720 -2.090 1.529 1.00 30.42 H new ATOM 1183 N ASP A 133 10.824 1.658 4.257 1.00 24.23 N ATOM 1184 CA ASP A 133 10.884 2.855 5.088 1.00 22.44 C ATOM 1185 C ASP A 133 12.144 3.661 4.790 1.00 42.10 C ATOM 1186 O ASP A 133 12.070 4.800 4.327 1.00 35.24 O ATOM 1187 CB ASP A 133 10.845 2.475 6.570 1.00 44.24 C ATOM 1188 CG ASP A 133 10.249 3.570 7.432 1.00 34.11 C ATOM 1189 OD1 ASP A 133 10.752 4.711 7.375 1.00 4.54 O ATOM 1190 OD2 ASP A 133 9.277 3.285 8.163 1.00 3.33 O ATOM 0 H ASP A 133 10.883 0.782 4.775 1.00 24.23 H new ATOM 0 HA ASP A 133 10.016 3.473 4.856 1.00 22.44 H new ATOM 0 HB2 ASP A 133 10.262 1.562 6.693 1.00 44.24 H new ATOM 0 HB3 ASP A 133 11.856 2.256 6.913 1.00 44.24 H new ATOM 1195 N TYR A 134 13.300 3.064 5.059 1.00 51.05 N ATOM 1196 CA TYR A 134 14.576 3.728 4.822 1.00 3.02 C ATOM 1197 C TYR A 134 14.664 4.247 3.390 1.00 34.21 C ATOM 1198 O TYR A 134 14.866 5.440 3.161 1.00 72.44 O ATOM 1199 CB TYR A 134 15.734 2.767 5.100 1.00 52.50 C ATOM 1200 CG TYR A 134 17.050 3.218 4.508 1.00 1.31 C ATOM 1201 CD1 TYR A 134 17.697 4.351 4.986 1.00 3.21 C ATOM 1202 CD2 TYR A 134 17.646 2.512 3.470 1.00 1.44 C ATOM 1203 CE1 TYR A 134 18.900 4.767 4.448 1.00 13.40 C ATOM 1204 CE2 TYR A 134 18.849 2.920 2.927 1.00 11.33 C ATOM 1205 CZ TYR A 134 19.472 4.048 3.419 1.00 13.42 C ATOM 1206 OH TYR A 134 20.669 4.459 2.880 1.00 63.11 O ATOM 0 H TYR A 134 13.379 2.122 5.441 1.00 51.05 H new ATOM 0 HA TYR A 134 14.646 4.578 5.501 1.00 3.02 H new ATOM 0 HB2 TYR A 134 15.850 2.653 6.178 1.00 52.50 H new ATOM 0 HB3 TYR A 134 15.483 1.784 4.701 1.00 52.50 H new ATOM 0 HD1 TYR A 134 17.252 4.916 5.792 1.00 3.21 H new ATOM 0 HD2 TYR A 134 17.160 1.629 3.081 1.00 1.44 H new ATOM 0 HE1 TYR A 134 19.390 5.650 4.831 1.00 13.40 H new ATOM 0 HE2 TYR A 134 19.299 2.359 2.122 1.00 11.33 H new ATOM 0 HH TYR A 134 20.935 3.843 2.166 1.00 63.11 H new ATOM 1216 N HIS A 135 14.509 3.341 2.429 1.00 11.32 N ATOM 1217 CA HIS A 135 14.569 3.706 1.018 1.00 13.12 C ATOM 1218 C HIS A 135 13.539 4.783 0.692 1.00 51.45 C ATOM 1219 O HIS A 135 13.734 5.586 -0.221 1.00 45.12 O ATOM 1220 CB HIS A 135 14.333 2.476 0.141 1.00 11.03 C ATOM 1221 CG HIS A 135 15.167 2.459 -1.103 1.00 35.21 C ATOM 1222 ND1 HIS A 135 16.463 2.926 -1.147 1.00 1.13 N ATOM 1223 CD2 HIS A 135 14.882 2.025 -2.353 1.00 41.22 C ATOM 1224 CE1 HIS A 135 16.939 2.782 -2.370 1.00 45.44 C ATOM 1225 NE2 HIS A 135 16.000 2.237 -3.122 1.00 11.40 N ATOM 0 H HIS A 135 14.341 2.350 2.602 1.00 11.32 H new ATOM 0 HA HIS A 135 15.563 4.104 0.813 1.00 13.12 H new ATOM 0 HB2 HIS A 135 14.545 1.579 0.723 1.00 11.03 H new ATOM 0 HB3 HIS A 135 13.280 2.435 -0.137 1.00 11.03 H new ATOM 0 HD1 HIS A 135 16.974 3.321 -0.358 1.00 1.13 H new ATOM 0 HD2 HIS A 135 13.949 1.593 -2.684 1.00 41.22 H new ATOM 0 HE1 HIS A 135 17.929 3.062 -2.700 1.00 45.44 H new ATOM 1233 N ARG A 136 12.442 4.794 1.442 1.00 3.12 N ATOM 1234 CA ARG A 136 11.381 5.771 1.231 1.00 42.21 C ATOM 1235 C ARG A 136 11.811 7.153 1.714 1.00 52.42 C ATOM 1236 O ARG A 136 11.314 8.172 1.233 1.00 2.01 O ATOM 1237 CB ARG A 136 10.107 5.338 1.959 1.00 44.01 C ATOM 1238 CG ARG A 136 9.113 6.468 2.171 1.00 30.20 C ATOM 1239 CD ARG A 136 9.266 7.093 3.549 1.00 53.12 C ATOM 1240 NE ARG A 136 8.144 7.967 3.880 1.00 10.55 N ATOM 1241 CZ ARG A 136 6.934 7.522 4.200 1.00 23.44 C ATOM 1242 NH1 ARG A 136 6.691 6.219 4.232 1.00 23.41 N ATOM 1243 NH2 ARG A 136 5.965 8.380 4.490 1.00 73.11 N ATOM 0 H ARG A 136 12.265 4.137 2.202 1.00 3.12 H new ATOM 0 HA ARG A 136 11.179 5.825 0.161 1.00 42.21 H new ATOM 0 HB2 ARG A 136 9.625 4.544 1.389 1.00 44.01 H new ATOM 0 HB3 ARG A 136 10.377 4.917 2.927 1.00 44.01 H new ATOM 0 HG2 ARG A 136 9.259 7.231 1.406 1.00 30.20 H new ATOM 0 HG3 ARG A 136 8.098 6.088 2.053 1.00 30.20 H new ATOM 0 HD2 ARG A 136 9.345 6.305 4.298 1.00 53.12 H new ATOM 0 HD3 ARG A 136 10.194 7.664 3.587 1.00 53.12 H new ATOM 0 HE ARG A 136 8.298 8.975 3.865 1.00 10.55 H new ATOM 0 HH11 ARG A 136 7.434 5.556 4.011 1.00 23.41 H new ATOM 0 HH12 ARG A 136 5.761 5.880 4.478 1.00 23.41 H new ATOM 0 HH21 ARG A 136 6.148 9.383 4.467 1.00 73.11 H new ATOM 0 HH22 ARG A 136 5.036 8.037 4.736 1.00 73.11 H new ATOM 1257 N SER A 137 12.736 7.180 2.667 1.00 4.23 N ATOM 1258 CA SER A 137 13.230 8.437 3.219 1.00 71.24 C ATOM 1259 C SER A 137 14.527 8.858 2.535 1.00 62.32 C ATOM 1260 O SER A 137 14.981 9.993 2.682 1.00 62.00 O ATOM 1261 CB SER A 137 13.455 8.304 4.726 1.00 34.50 C ATOM 1262 OG SER A 137 13.277 9.548 5.380 1.00 2.01 O ATOM 0 H SER A 137 13.159 6.346 3.074 1.00 4.23 H new ATOM 0 HA SER A 137 12.478 9.205 3.038 1.00 71.24 H new ATOM 0 HB2 SER A 137 12.761 7.571 5.137 1.00 34.50 H new ATOM 0 HB3 SER A 137 14.462 7.931 4.915 1.00 34.50 H new ATOM 0 HG SER A 137 13.425 9.436 6.342 1.00 2.01 H new ATOM 1268 N THR A 138 15.121 7.934 1.785 1.00 33.34 N ATOM 1269 CA THR A 138 16.366 8.207 1.079 1.00 20.43 C ATOM 1270 C THR A 138 16.197 8.022 -0.424 1.00 43.15 C ATOM 1271 O THR A 138 15.336 7.267 -0.874 1.00 34.31 O ATOM 1272 CB THR A 138 17.504 7.293 1.573 1.00 75.43 C ATOM 1273 OG1 THR A 138 18.758 7.750 1.056 1.00 4.05 O ATOM 1274 CG2 THR A 138 17.267 5.853 1.142 1.00 55.12 C ATOM 0 H THR A 138 14.759 6.990 1.651 1.00 33.34 H new ATOM 0 HA THR A 138 16.627 9.245 1.288 1.00 20.43 H new ATOM 0 HB THR A 138 17.524 7.331 2.662 1.00 75.43 H new ATOM 0 HG1 THR A 138 19.476 7.165 1.376 1.00 4.05 H new ATOM 0 HG21 THR A 138 18.083 5.226 1.502 1.00 55.12 H new ATOM 0 HG22 THR A 138 16.325 5.498 1.561 1.00 55.12 H new ATOM 0 HG23 THR A 138 17.223 5.801 0.054 1.00 55.12 H new ATOM 1282 N SER A 139 17.026 8.716 -1.198 1.00 11.41 N ATOM 1283 CA SER A 139 16.966 8.631 -2.652 1.00 51.14 C ATOM 1284 C SER A 139 16.782 7.186 -3.105 1.00 31.34 C ATOM 1285 O SER A 139 17.057 6.249 -2.355 1.00 64.43 O ATOM 1286 CB SER A 139 18.238 9.213 -3.271 1.00 43.03 C ATOM 1287 OG SER A 139 19.395 8.590 -2.740 1.00 11.54 O ATOM 0 H SER A 139 17.747 9.343 -0.842 1.00 11.41 H new ATOM 0 HA SER A 139 16.107 9.211 -2.990 1.00 51.14 H new ATOM 0 HB2 SER A 139 18.214 9.080 -4.353 1.00 43.03 H new ATOM 0 HB3 SER A 139 18.280 10.286 -3.083 1.00 43.03 H new ATOM 0 HG SER A 139 20.194 8.978 -3.153 1.00 11.54 H new ATOM 1293 N VAL A 140 16.314 7.013 -4.337 1.00 33.23 N ATOM 1294 CA VAL A 140 16.093 5.682 -4.891 1.00 41.50 C ATOM 1295 C VAL A 140 16.705 5.558 -6.282 1.00 12.40 C ATOM 1296 O VAL A 140 17.469 4.633 -6.555 1.00 3.02 O ATOM 1297 CB VAL A 140 14.591 5.350 -4.971 1.00 64.40 C ATOM 1298 CG1 VAL A 140 13.852 6.406 -5.778 1.00 65.15 C ATOM 1299 CG2 VAL A 140 14.384 3.967 -5.570 1.00 72.20 C ATOM 0 H VAL A 140 16.081 7.778 -4.970 1.00 33.23 H new ATOM 0 HA VAL A 140 16.578 4.974 -4.219 1.00 41.50 H new ATOM 0 HB VAL A 140 14.182 5.349 -3.961 1.00 64.40 H new ATOM 0 HG11 VAL A 140 12.793 6.154 -5.823 1.00 65.15 H new ATOM 0 HG12 VAL A 140 13.974 7.379 -5.302 1.00 65.15 H new ATOM 0 HG13 VAL A 140 14.260 6.443 -6.788 1.00 65.15 H new ATOM 0 HG21 VAL A 140 13.317 3.748 -5.619 1.00 72.20 H new ATOM 0 HG22 VAL A 140 14.807 3.938 -6.574 1.00 72.20 H new ATOM 0 HG23 VAL A 140 14.879 3.223 -4.946 1.00 72.20 H new ATOM 1309 N SER A 141 16.363 6.497 -7.159 1.00 1.34 N ATOM 1310 CA SER A 141 16.876 6.492 -8.524 1.00 21.44 C ATOM 1311 C SER A 141 18.196 7.252 -8.611 1.00 70.11 C ATOM 1312 O SER A 141 18.360 8.306 -7.997 1.00 15.23 O ATOM 1313 CB SER A 141 15.853 7.111 -9.478 1.00 3.32 C ATOM 1314 OG SER A 141 15.414 6.166 -10.438 1.00 14.22 O ATOM 0 H SER A 141 15.733 7.271 -6.948 1.00 1.34 H new ATOM 0 HA SER A 141 17.053 5.457 -8.816 1.00 21.44 H new ATOM 0 HB2 SER A 141 14.999 7.481 -8.910 1.00 3.32 H new ATOM 0 HB3 SER A 141 16.296 7.969 -9.984 1.00 3.32 H new ATOM 0 HG SER A 141 14.442 6.061 -10.373 1.00 14.22 H new ATOM 1320 N ARG A 142 19.135 6.709 -9.379 1.00 73.41 N ATOM 1321 CA ARG A 142 20.441 7.334 -9.547 1.00 30.11 C ATOM 1322 C ARG A 142 20.418 8.342 -10.692 1.00 61.01 C ATOM 1323 O ARG A 142 21.412 8.520 -11.395 1.00 72.33 O ATOM 1324 CB ARG A 142 21.509 6.271 -9.810 1.00 71.32 C ATOM 1325 CG ARG A 142 21.376 5.042 -8.926 1.00 21.13 C ATOM 1326 CD ARG A 142 22.737 4.475 -8.551 1.00 52.33 C ATOM 1327 NE ARG A 142 22.884 4.313 -7.107 1.00 54.03 N ATOM 1328 CZ ARG A 142 24.032 4.004 -6.516 1.00 30.24 C ATOM 1329 NH1 ARG A 142 25.128 3.825 -7.240 1.00 72.01 N ATOM 1330 NH2 ARG A 142 24.086 3.874 -5.196 1.00 72.52 N ATOM 0 H ARG A 142 19.015 5.837 -9.895 1.00 73.41 H new ATOM 0 HA ARG A 142 20.684 7.863 -8.625 1.00 30.11 H new ATOM 0 HB2 ARG A 142 21.455 5.964 -10.855 1.00 71.32 H new ATOM 0 HB3 ARG A 142 22.494 6.712 -9.658 1.00 71.32 H new ATOM 0 HG2 ARG A 142 20.827 5.301 -8.021 1.00 21.13 H new ATOM 0 HG3 ARG A 142 20.794 4.280 -9.445 1.00 21.13 H new ATOM 0 HD2 ARG A 142 22.875 3.511 -9.040 1.00 52.33 H new ATOM 0 HD3 ARG A 142 23.520 5.136 -8.923 1.00 52.33 H new ATOM 0 HE ARG A 142 22.060 4.444 -6.521 1.00 54.03 H new ATOM 0 HH11 ARG A 142 25.091 3.925 -8.254 1.00 72.01 H new ATOM 0 HH12 ARG A 142 26.008 3.588 -6.783 1.00 72.01 H new ATOM 0 HH21 ARG A 142 23.245 4.012 -4.635 1.00 72.52 H new ATOM 0 HH22 ARG A 142 24.968 3.637 -4.743 1.00 72.52 H new ATOM 1344 N ASN A 143 19.277 8.999 -10.873 1.00 72.51 N ATOM 1345 CA ASN A 143 19.124 9.988 -11.934 1.00 20.14 C ATOM 1346 C ASN A 143 18.548 11.289 -11.384 1.00 53.45 C ATOM 1347 O ASN A 143 19.102 12.366 -11.604 1.00 23.13 O ATOM 1348 CB ASN A 143 18.219 9.444 -13.041 1.00 24.40 C ATOM 1349 CG ASN A 143 18.481 10.106 -14.380 1.00 3.44 C ATOM 1350 OD1 ASN A 143 17.713 10.960 -14.823 1.00 73.32 O ATOM 1351 ND2 ASN A 143 19.571 9.715 -15.030 1.00 50.31 N ATOM 0 H ASN A 143 18.445 8.864 -10.299 1.00 72.51 H new ATOM 0 HA ASN A 143 20.110 10.194 -12.350 1.00 20.14 H new ATOM 0 HB2 ASN A 143 18.371 8.369 -13.135 1.00 24.40 H new ATOM 0 HB3 ASN A 143 17.176 9.596 -12.762 1.00 24.40 H new ATOM 0 HD21 ASN A 143 19.800 10.126 -15.935 1.00 50.31 H new ATOM 0 HD22 ASN A 143 20.179 9.004 -14.624 1.00 50.31 H new ATOM 1358 N GLN A 144 17.432 11.181 -10.670 1.00 3.22 N ATOM 1359 CA GLN A 144 16.781 12.350 -10.090 1.00 20.45 C ATOM 1360 C GLN A 144 16.592 12.177 -8.586 1.00 75.41 C ATOM 1361 O GLN A 144 16.976 11.156 -8.017 1.00 20.33 O ATOM 1362 CB GLN A 144 15.428 12.592 -10.761 1.00 45.25 C ATOM 1363 CG GLN A 144 15.541 13.144 -12.173 1.00 51.15 C ATOM 1364 CD GLN A 144 14.398 14.074 -12.529 1.00 50.41 C ATOM 1365 OE1 GLN A 144 14.261 15.155 -11.956 1.00 12.43 O ATOM 1366 NE2 GLN A 144 13.570 13.658 -13.480 1.00 53.41 N ATOM 0 H GLN A 144 16.960 10.297 -10.479 1.00 3.22 H new ATOM 0 HA GLN A 144 17.423 13.214 -10.261 1.00 20.45 H new ATOM 0 HB2 GLN A 144 14.873 11.654 -10.789 1.00 45.25 H new ATOM 0 HB3 GLN A 144 14.849 13.287 -10.153 1.00 45.25 H new ATOM 0 HG2 GLN A 144 16.485 13.679 -12.275 1.00 51.15 H new ATOM 0 HG3 GLN A 144 15.565 12.316 -12.882 1.00 51.15 H new ATOM 0 HE21 GLN A 144 13.721 12.754 -13.928 1.00 53.41 H new ATOM 0 HE22 GLN A 144 12.783 14.242 -13.762 1.00 53.41 H new ATOM 1375 N GLN A 145 15.997 13.181 -7.950 1.00 42.01 N ATOM 1376 CA GLN A 145 15.758 13.139 -6.512 1.00 42.44 C ATOM 1377 C GLN A 145 14.286 12.877 -6.213 1.00 10.23 C ATOM 1378 O GLN A 145 13.487 13.809 -6.114 1.00 42.24 O ATOM 1379 CB GLN A 145 16.197 14.453 -5.863 1.00 20.12 C ATOM 1380 CG GLN A 145 17.674 14.490 -5.503 1.00 55.32 C ATOM 1381 CD GLN A 145 18.067 15.766 -4.784 1.00 70.42 C ATOM 1382 OE1 GLN A 145 18.016 16.855 -5.356 1.00 10.14 O ATOM 1383 NE2 GLN A 145 18.463 15.637 -3.523 1.00 75.31 N ATOM 0 H GLN A 145 15.672 14.033 -8.407 1.00 42.01 H new ATOM 0 HA GLN A 145 16.346 12.321 -6.094 1.00 42.44 H new ATOM 0 HB2 GLN A 145 15.977 15.276 -6.543 1.00 20.12 H new ATOM 0 HB3 GLN A 145 15.607 14.618 -4.961 1.00 20.12 H new ATOM 0 HG2 GLN A 145 17.912 13.634 -4.872 1.00 55.32 H new ATOM 0 HG3 GLN A 145 18.268 14.391 -6.411 1.00 55.32 H new ATOM 0 HE21 GLN A 145 18.490 14.714 -3.089 1.00 75.31 H new ATOM 0 HE22 GLN A 145 18.740 16.460 -2.989 1.00 75.31 H new ATOM 1392 N ILE A 146 13.934 11.604 -6.069 1.00 63.10 N ATOM 1393 CA ILE A 146 12.558 11.220 -5.780 1.00 2.01 C ATOM 1394 C ILE A 146 12.498 10.200 -4.648 1.00 3.45 C ATOM 1395 O ILE A 146 13.396 9.372 -4.495 1.00 43.14 O ATOM 1396 CB ILE A 146 11.865 10.631 -7.023 1.00 11.42 C ATOM 1397 CG1 ILE A 146 12.042 11.564 -8.222 1.00 43.54 C ATOM 1398 CG2 ILE A 146 10.388 10.394 -6.743 1.00 44.21 C ATOM 1399 CD1 ILE A 146 11.627 10.943 -9.538 1.00 12.44 C ATOM 0 H ILE A 146 14.583 10.821 -6.148 1.00 63.10 H new ATOM 0 HA ILE A 146 12.035 12.127 -5.477 1.00 2.01 H new ATOM 0 HB ILE A 146 12.328 9.673 -7.260 1.00 11.42 H new ATOM 0 HG12 ILE A 146 11.458 12.469 -8.057 1.00 43.54 H new ATOM 0 HG13 ILE A 146 13.087 11.866 -8.286 1.00 43.54 H new ATOM 0 HG21 ILE A 146 9.912 9.978 -7.631 1.00 44.21 H new ATOM 0 HG22 ILE A 146 10.283 9.695 -5.913 1.00 44.21 H new ATOM 0 HG23 ILE A 146 9.910 11.339 -6.485 1.00 44.21 H new ATOM 0 HD11 ILE A 146 11.780 11.661 -10.343 1.00 12.44 H new ATOM 0 HD12 ILE A 146 12.228 10.053 -9.726 1.00 12.44 H new ATOM 0 HD13 ILE A 146 10.574 10.666 -9.494 1.00 12.44 H new ATOM 1411 N PHE A 147 11.433 10.266 -3.856 1.00 30.42 N ATOM 1412 CA PHE A 147 11.255 9.347 -2.737 1.00 54.40 C ATOM 1413 C PHE A 147 10.071 8.416 -2.982 1.00 23.44 C ATOM 1414 O PHE A 147 9.145 8.751 -3.721 1.00 34.23 O ATOM 1415 CB PHE A 147 11.044 10.128 -1.438 1.00 32.31 C ATOM 1416 CG PHE A 147 12.187 11.040 -1.094 1.00 74.32 C ATOM 1417 CD1 PHE A 147 13.497 10.634 -1.290 1.00 10.14 C ATOM 1418 CD2 PHE A 147 11.951 12.303 -0.575 1.00 75.42 C ATOM 1419 CE1 PHE A 147 14.551 11.471 -0.975 1.00 0.02 C ATOM 1420 CE2 PHE A 147 13.000 13.144 -0.259 1.00 24.11 C ATOM 1421 CZ PHE A 147 14.302 12.727 -0.458 1.00 2.22 C ATOM 0 H PHE A 147 10.681 10.946 -3.968 1.00 30.42 H new ATOM 0 HA PHE A 147 12.158 8.743 -2.647 1.00 54.40 H new ATOM 0 HB2 PHE A 147 10.132 10.718 -1.523 1.00 32.31 H new ATOM 0 HB3 PHE A 147 10.893 9.423 -0.620 1.00 32.31 H new ATOM 0 HD1 PHE A 147 13.697 9.652 -1.693 1.00 10.14 H new ATOM 0 HD2 PHE A 147 10.935 12.633 -0.416 1.00 75.42 H new ATOM 0 HE1 PHE A 147 15.568 11.143 -1.133 1.00 0.02 H new ATOM 0 HE2 PHE A 147 12.803 14.127 0.143 1.00 24.11 H new ATOM 0 HZ PHE A 147 15.124 13.382 -0.210 1.00 2.22 H new ATOM 1431 N LEU A 148 10.110 7.244 -2.356 1.00 53.14 N ATOM 1432 CA LEU A 148 9.041 6.262 -2.506 1.00 23.15 C ATOM 1433 C LEU A 148 7.788 6.703 -1.756 1.00 70.33 C ATOM 1434 O LEU A 148 7.753 6.693 -0.526 1.00 34.43 O ATOM 1435 CB LEU A 148 9.502 4.896 -1.993 1.00 0.32 C ATOM 1436 CG LEU A 148 10.943 4.506 -2.323 1.00 41.55 C ATOM 1437 CD1 LEU A 148 11.309 3.193 -1.649 1.00 51.34 C ATOM 1438 CD2 LEU A 148 11.136 4.407 -3.830 1.00 25.04 C ATOM 0 H LEU A 148 10.869 6.951 -1.741 1.00 53.14 H new ATOM 0 HA LEU A 148 8.799 6.183 -3.566 1.00 23.15 H new ATOM 0 HB2 LEU A 148 9.381 4.877 -0.910 1.00 0.32 H new ATOM 0 HB3 LEU A 148 8.838 4.134 -2.401 1.00 0.32 H new ATOM 0 HG LEU A 148 11.606 5.283 -1.942 1.00 41.55 H new ATOM 0 HD11 LEU A 148 12.338 2.932 -1.896 1.00 51.34 H new ATOM 0 HD12 LEU A 148 11.210 3.299 -0.569 1.00 51.34 H new ATOM 0 HD13 LEU A 148 10.641 2.406 -1.999 1.00 51.34 H new ATOM 0 HD21 LEU A 148 12.167 4.129 -4.047 1.00 25.04 H new ATOM 0 HD22 LEU A 148 10.463 3.651 -4.234 1.00 25.04 H new ATOM 0 HD23 LEU A 148 10.916 5.371 -4.289 1.00 25.04 H new ATOM 1450 N ARG A 149 6.761 7.087 -2.507 1.00 12.32 N ATOM 1451 CA ARG A 149 5.505 7.531 -1.914 1.00 31.44 C ATOM 1452 C ARG A 149 4.652 6.338 -1.491 1.00 61.34 C ATOM 1453 O ARG A 149 4.545 5.350 -2.219 1.00 11.23 O ATOM 1454 CB ARG A 149 4.728 8.402 -2.903 1.00 24.51 C ATOM 1455 CG ARG A 149 5.396 9.736 -3.194 1.00 34.23 C ATOM 1456 CD ARG A 149 5.221 10.710 -2.039 1.00 33.41 C ATOM 1457 NE ARG A 149 6.413 11.525 -1.825 1.00 24.44 N ATOM 1458 CZ ARG A 149 6.661 12.183 -0.698 1.00 12.21 C ATOM 1459 NH1 ARG A 149 5.803 12.123 0.311 1.00 21.33 N ATOM 1460 NH2 ARG A 149 7.769 12.904 -0.579 1.00 34.12 N ATOM 0 H ARG A 149 6.774 7.100 -3.527 1.00 12.32 H new ATOM 0 HA ARG A 149 5.740 8.121 -1.028 1.00 31.44 H new ATOM 0 HB2 ARG A 149 4.605 7.855 -3.838 1.00 24.51 H new ATOM 0 HB3 ARG A 149 3.729 8.584 -2.507 1.00 24.51 H new ATOM 0 HG2 ARG A 149 6.458 9.579 -3.381 1.00 34.23 H new ATOM 0 HG3 ARG A 149 4.972 10.166 -4.102 1.00 34.23 H new ATOM 0 HD2 ARG A 149 4.369 11.360 -2.239 1.00 33.41 H new ATOM 0 HD3 ARG A 149 4.993 10.156 -1.129 1.00 33.41 H new ATOM 0 HE ARG A 149 7.093 11.593 -2.582 1.00 24.44 H new ATOM 0 HH11 ARG A 149 4.950 11.571 0.223 1.00 21.33 H new ATOM 0 HH12 ARG A 149 5.996 12.629 1.175 1.00 21.33 H new ATOM 0 HH21 ARG A 149 8.431 12.953 -1.353 1.00 34.12 H new ATOM 0 HH22 ARG A 149 7.958 13.409 0.287 1.00 34.12 H new ATOM 1474 N ASP A 150 4.048 6.437 -0.312 1.00 65.32 N ATOM 1475 CA ASP A 150 3.205 5.367 0.207 1.00 33.50 C ATOM 1476 C ASP A 150 1.984 5.157 -0.683 1.00 14.01 C ATOM 1477 O ASP A 150 1.076 5.989 -0.714 1.00 62.20 O ATOM 1478 CB ASP A 150 2.761 5.685 1.636 1.00 44.33 C ATOM 1479 CG ASP A 150 2.104 4.500 2.316 1.00 42.51 C ATOM 1480 OD1 ASP A 150 1.110 3.978 1.769 1.00 42.11 O ATOM 1481 OD2 ASP A 150 2.584 4.095 3.395 1.00 63.12 O ATOM 0 H ASP A 150 4.127 7.248 0.302 1.00 65.32 H new ATOM 0 HA ASP A 150 3.791 4.448 0.213 1.00 33.50 H new ATOM 0 HB2 ASP A 150 3.625 6.002 2.220 1.00 44.33 H new ATOM 0 HB3 ASP A 150 2.064 6.523 1.619 1.00 44.33 H new ATOM 1486 N ILE A 151 1.969 4.042 -1.405 1.00 74.12 N ATOM 1487 CA ILE A 151 0.859 3.724 -2.295 1.00 62.25 C ATOM 1488 C ILE A 151 -0.462 3.688 -1.536 1.00 35.24 C ATOM 1489 O ILE A 151 -0.499 3.357 -0.351 1.00 12.31 O ATOM 1490 CB ILE A 151 1.071 2.370 -2.998 1.00 65.21 C ATOM 1491 CG1 ILE A 151 0.313 2.336 -4.327 1.00 24.43 C ATOM 1492 CG2 ILE A 151 0.623 1.229 -2.097 1.00 1.34 C ATOM 1493 CD1 ILE A 151 0.237 0.956 -4.943 1.00 41.54 C ATOM 0 H ILE A 151 2.712 3.344 -1.391 1.00 74.12 H new ATOM 0 HA ILE A 151 0.822 4.513 -3.046 1.00 62.25 H new ATOM 0 HB ILE A 151 2.134 2.248 -3.205 1.00 65.21 H new ATOM 0 HG12 ILE A 151 -0.698 2.711 -4.169 1.00 24.43 H new ATOM 0 HG13 ILE A 151 0.798 3.013 -5.030 1.00 24.43 H new ATOM 0 HG21 ILE A 151 0.779 0.279 -2.608 1.00 1.34 H new ATOM 0 HG22 ILE A 151 1.203 1.244 -1.174 1.00 1.34 H new ATOM 0 HG23 ILE A 151 -0.435 1.345 -1.862 1.00 1.34 H new ATOM 0 HD11 ILE A 151 -0.314 1.007 -5.882 1.00 41.54 H new ATOM 0 HD12 ILE A 151 1.245 0.586 -5.133 1.00 41.54 H new ATOM 0 HD13 ILE A 151 -0.275 0.280 -4.258 1.00 41.54 H new ATOM 1505 N GLU A 152 -1.546 4.029 -2.227 1.00 23.43 N ATOM 1506 CA GLU A 152 -2.870 4.034 -1.616 1.00 50.04 C ATOM 1507 C GLU A 152 -3.697 2.847 -2.101 1.00 74.02 C ATOM 1508 O GLU A 152 -4.328 2.907 -3.156 1.00 54.51 O ATOM 1509 CB GLU A 152 -3.598 5.341 -1.936 1.00 2.51 C ATOM 1510 CG GLU A 152 -3.198 6.497 -1.034 1.00 32.25 C ATOM 1511 CD GLU A 152 -4.395 7.255 -0.492 1.00 25.11 C ATOM 1512 OE1 GLU A 152 -5.190 7.768 -1.306 1.00 14.24 O ATOM 1513 OE2 GLU A 152 -4.535 7.334 0.747 1.00 44.33 O ATOM 0 H GLU A 152 -1.533 4.305 -3.209 1.00 23.43 H new ATOM 0 HA GLU A 152 -2.745 3.951 -0.536 1.00 50.04 H new ATOM 0 HB2 GLU A 152 -3.399 5.614 -2.972 1.00 2.51 H new ATOM 0 HB3 GLU A 152 -4.672 5.179 -1.850 1.00 2.51 H new ATOM 0 HG2 GLU A 152 -2.607 6.116 -0.201 1.00 32.25 H new ATOM 0 HG3 GLU A 152 -2.560 7.183 -1.590 1.00 32.25 H new ATOM 1520 N GLN A 153 -3.688 1.770 -1.323 1.00 70.51 N ATOM 1521 CA GLN A 153 -4.436 0.568 -1.674 1.00 13.12 C ATOM 1522 C GLN A 153 -5.747 0.926 -2.366 1.00 35.04 C ATOM 1523 O GLN A 153 -6.323 1.986 -2.118 1.00 33.54 O ATOM 1524 CB GLN A 153 -4.717 -0.267 -0.423 1.00 50.50 C ATOM 1525 CG GLN A 153 -5.000 -1.731 -0.719 1.00 44.53 C ATOM 1526 CD GLN A 153 -3.864 -2.405 -1.463 1.00 23.32 C ATOM 1527 OE1 GLN A 153 -2.777 -1.843 -1.602 1.00 52.14 O ATOM 1528 NE2 GLN A 153 -4.109 -3.618 -1.945 1.00 31.03 N ATOM 0 H GLN A 153 -3.172 1.705 -0.446 1.00 70.51 H new ATOM 0 HA GLN A 153 -3.830 -0.018 -2.365 1.00 13.12 H new ATOM 0 HB2 GLN A 153 -3.861 -0.200 0.248 1.00 50.50 H new ATOM 0 HB3 GLN A 153 -5.570 0.160 0.104 1.00 50.50 H new ATOM 0 HG2 GLN A 153 -5.180 -2.259 0.217 1.00 44.53 H new ATOM 0 HG3 GLN A 153 -5.913 -1.809 -1.309 1.00 44.53 H new ATOM 0 HE21 GLN A 153 -5.024 -4.046 -1.807 1.00 31.03 H new ATOM 0 HE22 GLN A 153 -3.382 -4.121 -2.453 1.00 31.03 H new ATOM 1537 N VAL A 154 -6.214 0.035 -3.235 1.00 15.40 N ATOM 1538 CA VAL A 154 -7.458 0.257 -3.963 1.00 34.14 C ATOM 1539 C VAL A 154 -8.480 0.985 -3.096 1.00 20.52 C ATOM 1540 O VAL A 154 -8.644 0.695 -1.910 1.00 42.04 O ATOM 1541 CB VAL A 154 -8.068 -1.071 -4.450 1.00 22.23 C ATOM 1542 CG1 VAL A 154 -8.274 -2.024 -3.282 1.00 62.33 C ATOM 1543 CG2 VAL A 154 -9.378 -0.819 -5.181 1.00 21.34 C ATOM 0 H VAL A 154 -5.750 -0.847 -3.452 1.00 15.40 H new ATOM 0 HA VAL A 154 -7.213 0.875 -4.827 1.00 34.14 H new ATOM 0 HB VAL A 154 -7.372 -1.536 -5.149 1.00 22.23 H new ATOM 0 HG11 VAL A 154 -8.706 -2.957 -3.645 1.00 62.33 H new ATOM 0 HG12 VAL A 154 -7.315 -2.229 -2.806 1.00 62.33 H new ATOM 0 HG13 VAL A 154 -8.949 -1.570 -2.557 1.00 62.33 H new ATOM 0 HG21 VAL A 154 -9.795 -1.768 -5.518 1.00 21.34 H new ATOM 0 HG22 VAL A 154 -10.083 -0.332 -4.507 1.00 21.34 H new ATOM 0 HG23 VAL A 154 -9.196 -0.176 -6.042 1.00 21.34 H new ATOM 1553 N PRO A 155 -9.185 1.953 -3.699 1.00 73.32 N ATOM 1554 CA PRO A 155 -10.205 2.742 -3.001 1.00 64.22 C ATOM 1555 C PRO A 155 -11.442 1.918 -2.659 1.00 43.35 C ATOM 1556 O PRO A 155 -11.707 0.892 -3.285 1.00 2.20 O ATOM 1557 CB PRO A 155 -10.555 3.840 -4.009 1.00 23.23 C ATOM 1558 CG PRO A 155 -10.223 3.254 -5.338 1.00 12.02 C ATOM 1559 CD PRO A 155 -9.042 2.351 -5.110 1.00 14.34 C ATOM 0 HA PRO A 155 -9.844 3.121 -2.045 1.00 64.22 H new ATOM 0 HB2 PRO A 155 -11.609 4.112 -3.948 1.00 23.23 H new ATOM 0 HB3 PRO A 155 -9.981 4.747 -3.822 1.00 23.23 H new ATOM 0 HG2 PRO A 155 -11.069 2.696 -5.741 1.00 12.02 H new ATOM 0 HG3 PRO A 155 -9.983 4.035 -6.060 1.00 12.02 H new ATOM 0 HD2 PRO A 155 -9.062 1.488 -5.775 1.00 14.34 H new ATOM 0 HD3 PRO A 155 -8.100 2.869 -5.288 1.00 14.34 H new ATOM 1567 N GLN A 156 -12.195 2.375 -1.664 1.00 43.32 N ATOM 1568 CA GLN A 156 -13.404 1.680 -1.240 1.00 61.51 C ATOM 1569 C GLN A 156 -14.546 2.664 -1.011 1.00 33.30 C ATOM 1570 O GLN A 156 -14.565 3.386 -0.015 1.00 25.23 O ATOM 1571 CB GLN A 156 -13.137 0.883 0.038 1.00 35.41 C ATOM 1572 CG GLN A 156 -13.653 -0.546 -0.017 1.00 73.32 C ATOM 1573 CD GLN A 156 -12.573 -1.543 -0.387 1.00 25.13 C ATOM 1574 OE1 GLN A 156 -11.382 -1.272 -0.228 1.00 62.50 O ATOM 1575 NE2 GLN A 156 -12.983 -2.705 -0.883 1.00 4.42 N ATOM 0 H GLN A 156 -11.989 3.223 -1.137 1.00 43.32 H new ATOM 0 HA GLN A 156 -13.696 0.993 -2.034 1.00 61.51 H new ATOM 0 HB2 GLN A 156 -12.064 0.866 0.228 1.00 35.41 H new ATOM 0 HB3 GLN A 156 -13.602 1.396 0.880 1.00 35.41 H new ATOM 0 HG2 GLN A 156 -14.073 -0.814 0.953 1.00 73.32 H new ATOM 0 HG3 GLN A 156 -14.463 -0.608 -0.743 1.00 73.32 H new ATOM 0 HE21 GLN A 156 -13.980 -2.887 -0.998 1.00 4.42 H new ATOM 0 HE22 GLN A 156 -12.301 -3.415 -1.149 1.00 4.42 H new ATOM 1584 N GLN A 157 -15.497 2.686 -1.940 1.00 4.31 N ATOM 1585 CA GLN A 157 -16.642 3.583 -1.839 1.00 2.12 C ATOM 1586 C GLN A 157 -17.057 3.774 -0.384 1.00 3.23 C ATOM 1587 O GLN A 157 -17.443 2.830 0.306 1.00 2.43 O ATOM 1588 CB GLN A 157 -17.818 3.036 -2.649 1.00 70.12 C ATOM 1589 CG GLN A 157 -17.949 3.661 -4.029 1.00 33.41 C ATOM 1590 CD GLN A 157 -17.752 2.655 -5.146 1.00 71.10 C ATOM 1591 OE1 GLN A 157 -18.696 1.987 -5.570 1.00 11.42 O ATOM 1592 NE2 GLN A 157 -16.521 2.541 -5.630 1.00 42.20 N ATOM 0 H GLN A 157 -15.497 2.093 -2.770 1.00 4.31 H new ATOM 0 HA GLN A 157 -16.350 4.552 -2.245 1.00 2.12 H new ATOM 0 HB2 GLN A 157 -17.704 1.957 -2.757 1.00 70.12 H new ATOM 0 HB3 GLN A 157 -18.741 3.205 -2.094 1.00 70.12 H new ATOM 0 HG2 GLN A 157 -18.934 4.117 -4.125 1.00 33.41 H new ATOM 0 HG3 GLN A 157 -17.216 4.461 -4.132 1.00 33.41 H new ATOM 0 HE21 GLN A 157 -15.768 3.114 -5.249 1.00 42.20 H new ATOM 0 HE22 GLN A 157 -16.328 1.880 -6.383 1.00 42.20 H new ATOM 1601 N PRO A 158 -16.976 5.024 0.096 1.00 42.20 N ATOM 1602 CA PRO A 158 -17.339 5.368 1.474 1.00 41.41 C ATOM 1603 C PRO A 158 -18.840 5.266 1.720 1.00 12.35 C ATOM 1604 O PRO A 158 -19.618 5.030 0.795 1.00 22.01 O ATOM 1605 CB PRO A 158 -16.872 6.820 1.612 1.00 62.42 C ATOM 1606 CG PRO A 158 -16.882 7.355 0.221 1.00 32.44 C ATOM 1607 CD PRO A 158 -16.524 6.198 -0.670 1.00 71.11 C ATOM 0 HA PRO A 158 -16.886 4.689 2.197 1.00 41.41 H new ATOM 0 HB2 PRO A 158 -17.538 7.390 2.260 1.00 62.42 H new ATOM 0 HB3 PRO A 158 -15.876 6.875 2.050 1.00 62.42 H new ATOM 0 HG2 PRO A 158 -17.862 7.756 -0.036 1.00 32.44 H new ATOM 0 HG3 PRO A 158 -16.165 8.169 0.111 1.00 32.44 H new ATOM 0 HD2 PRO A 158 -17.025 6.265 -1.636 1.00 71.11 H new ATOM 0 HD3 PRO A 158 -15.453 6.160 -0.868 1.00 71.11 H new ATOM 1615 N THR A 159 -19.243 5.446 2.975 1.00 40.24 N ATOM 1616 CA THR A 159 -20.651 5.374 3.343 1.00 72.40 C ATOM 1617 C THR A 159 -21.391 6.645 2.942 1.00 4.03 C ATOM 1618 O THR A 159 -22.422 6.557 2.277 1.00 3.23 O ATOM 1619 CB THR A 159 -20.825 5.148 4.857 1.00 70.33 C ATOM 1620 OG1 THR A 159 -20.161 3.942 5.251 1.00 35.35 O ATOM 1621 CG2 THR A 159 -22.298 5.066 5.226 1.00 15.00 C ATOM 0 H THR A 159 -18.613 5.643 3.753 1.00 40.24 H new ATOM 0 HA THR A 159 -21.075 4.526 2.805 1.00 72.40 H new ATOM 0 HB THR A 159 -20.382 5.994 5.382 1.00 70.33 H new ATOM 0 HG1 THR A 159 -20.275 3.806 6.215 1.00 35.35 H new ATOM 0 HG21 THR A 159 -22.396 4.906 6.300 1.00 15.00 H new ATOM 0 HG22 THR A 159 -22.794 5.997 4.951 1.00 15.00 H new ATOM 0 HG23 THR A 159 -22.761 4.236 4.692 1.00 15.00 H new TER 1629 THR A 159 HETATM 1630 CBR DTF A 174 21.893 -8.421 -9.932 1.00 33.14 C HETATM 1631 CAU DTF A 174 22.462 -7.158 -9.707 1.00 62.32 C HETATM 1632 CAL DTF A 174 23.191 -6.896 -8.554 1.00 63.14 C HETATM 1633 CAK DTF A 174 23.397 -7.897 -7.615 1.00 10.30 C HETATM 1634 CAS DTF A 174 22.857 -9.163 -7.798 1.00 62.24 C HETATM 1635 CBQ DTF A 174 22.092 -9.443 -8.934 1.00 73.34 C HETATM 1636 CAT DTF A 174 21.520 -10.700 -9.110 1.00 64.02 C HETATM 1637 CAM DTF A 174 20.779 -10.981 -10.249 1.00 64.45 C HETATM 1638 CAP DTF A 174 20.594 -10.013 -11.227 1.00 65.03 C HETATM 1639 CBP DTF A 174 21.133 -8.729 -11.088 1.00 55.10 C HETATM 1640 CBE DTF A 174 20.907 -7.746 -12.273 1.00 23.41 C HETATM 1641 CBT DTF A 174 20.022 -6.489 -11.960 1.00 64.12 C HETATM 1642 CAY DTF A 174 18.527 -6.831 -12.232 1.00 32.40 C HETATM 1643 CAI DTF A 174 17.506 -5.715 -12.110 1.00 20.22 C HETATM 1644 CAJ DTF A 174 16.454 -5.600 -12.928 1.00 31.20 C HETATM 1645 CBB DTF A 174 20.633 -5.218 -12.642 1.00 72.05 C HETATM 1646 NBG DTF A 174 20.130 -3.904 -12.162 1.00 24.21 N HETATM 1647 C DTF A 174 20.282 -3.451 -10.897 1.00 42.33 C HETATM 1648 O DTF A 174 20.956 -4.071 -10.070 1.00 63.40 O HETATM 1649 CA DTF A 174 19.616 -2.081 -10.484 1.00 41.24 C HETATM 1650 CB DTF A 174 19.247 -1.918 -8.979 1.00 62.22 C HETATM 1651 CG DTF A 174 18.341 -2.981 -8.344 1.00 55.20 C HETATM 1652 OD1 DTF A 174 17.122 -2.959 -8.466 1.00 54.24 O HETATM 1653 ND2 DTF A 174 18.897 -3.924 -7.631 1.00 44.13 N HETATM 1654 N DTF A 174 18.390 -1.677 -11.239 1.00 63.11 N HETATM 1655 CBM DTF A 174 18.318 -0.585 -12.024 1.00 64.01 C HETATM 1656 OAE DTF A 174 19.307 0.146 -12.149 1.00 3.01 O HETATM 1657 CBV DTF A 174 16.927 -0.216 -12.729 1.00 0.23 C HETATM 1658 CAZ DTF A 174 17.166 0.691 -13.995 1.00 23.22 C HETATM 1659 CAW DTF A 174 15.941 1.454 -14.574 1.00 25.33 C HETATM 1660 CAV DTF A 174 15.102 2.169 -13.488 1.00 2.43 C HETATM 1661 CAX DTF A 174 14.789 1.291 -12.257 1.00 23.23 C HETATM 1662 CBA DTF A 174 16.075 0.613 -11.697 1.00 64.12 C HETATM 1663 NBI DTF A 174 16.032 -1.374 -13.072 1.00 14.13 N HETATM 1664 CBK DTF A 174 16.382 -2.441 -13.789 1.00 62.30 C HETATM 1665 OAC DTF A 174 17.486 -2.586 -14.310 1.00 11.43 O HETATM 1666 CBC DTF A 174 15.301 -3.520 -13.888 1.00 14.32 C HETATM 1667 CBS DTF A 174 15.321 -4.589 -12.754 1.00 15.12 C HETATM 1668 CBO DTF A 174 13.970 -5.349 -12.625 1.00 33.24 C HETATM 1669 CAR DTF A 174 13.314 -5.394 -11.385 1.00 51.45 C HETATM 1670 CAO DTF A 174 12.130 -6.113 -11.236 1.00 44.21 C HETATM 1671 CAQ DTF A 174 13.390 -6.014 -13.718 1.00 74.05 C HETATM 1672 CAN DTF A 174 12.210 -6.732 -13.567 1.00 71.44 C HETATM 1673 CBN DTF A 174 11.584 -6.800 -12.321 1.00 44.03 C HETATM 1674 CBF DTF A 174 10.337 -7.666 -12.141 1.00 33.21 C HETATM 1675 PBW DTF A 174 9.225 -7.637 -13.482 1.00 24.24 P HETATM 1676 OAG DTF A 174 9.804 -8.439 -14.665 1.00 31.12 O HETATM 1677 OAH DTF A 174 8.929 -6.200 -13.970 1.00 21.33 O HETATM 1678 OAF DTF A 174 7.852 -8.308 -13.040 1.00 22.21 O HETATM 0 HBT1 DTF A 174 20.029 -6.216 -10.905 1.00 64.12 H new HETATM 0 HBS1 DTF A 174 15.491 -4.027 -11.836 1.00 15.12 H new HETATM 0 HBF2 DTF A 174 10.649 -8.696 -11.969 1.00 33.21 H new HETATM 0 HBF1 DTF A 174 9.811 -7.338 -11.244 1.00 33.21 H new HETATM 0 HBE2 DTF A 174 21.880 -7.403 -12.626 1.00 23.41 H new HETATM 0 HBE1 DTF A 174 20.446 -8.296 -13.093 1.00 23.41 H new HETATM 0 HBC2 DTF A 174 14.325 -3.034 -13.890 1.00 14.32 H new HETATM 0 HBC1 DTF A 174 15.405 -4.029 -14.846 1.00 14.32 H new HETATM 0 HBB2 DTF A 174 21.714 -5.242 -12.503 1.00 72.05 H new HETATM 0 HBB1 DTF A 174 20.448 -5.284 -13.714 1.00 72.05 H new HETATM 0 HBA2 DTF A 174 15.786 -0.049 -10.881 1.00 64.12 H new HETATM 0 HBA1 DTF A 174 16.712 1.387 -11.269 1.00 64.12 H new HETATM 0 HAZ2 DTF A 174 17.931 1.425 -13.743 1.00 23.22 H new HETATM 0 HAZ1 DTF A 174 17.576 0.063 -14.786 1.00 23.22 H new HETATM 0 HAY2 DTF A 174 18.456 -7.239 -13.240 1.00 32.40 H new HETATM 0 HAY1 DTF A 174 18.236 -7.626 -11.545 1.00 32.40 H new HETATM 0 HAX2 DTF A 174 14.331 1.903 -11.480 1.00 23.23 H new HETATM 0 HAX1 DTF A 174 14.062 0.526 -12.530 1.00 23.23 H new HETATM 0 HAW2 DTF A 174 16.289 2.190 -15.299 1.00 25.33 H new HETATM 0 HAW1 DTF A 174 15.305 0.752 -15.113 1.00 25.33 H new HETATM 0 HAV2 DTF A 174 15.636 3.061 -13.159 1.00 2.43 H new HETATM 0 HAV1 DTF A 174 14.164 2.504 -13.930 1.00 2.43 H new HETATM 0 HAU1 DTF A 174 22.330 -6.370 -10.449 1.00 62.32 H new HETATM 0 HAT1 DTF A 174 21.655 -11.468 -8.348 1.00 64.02 H new HETATM 0 HAS1 DTF A 174 23.030 -9.941 -7.054 1.00 62.24 H new HETATM 0 HAR1 DTF A 174 13.734 -4.862 -10.532 1.00 51.45 H new HETATM 0 HAQ1 DTF A 174 13.871 -5.966 -14.695 1.00 74.05 H new HETATM 0 HAP1 DTF A 174 20.018 -10.258 -12.120 1.00 65.03 H new HETATM 0 HAO1 DTF A 174 11.628 -6.139 -10.269 1.00 44.21 H new HETATM 0 HAN1 DTF A 174 11.772 -7.244 -14.424 1.00 71.44 H new HETATM 0 HAM1 DTF A 174 20.339 -11.970 -10.377 1.00 64.45 H new HETATM 0 HAL1 DTF A 174 23.603 -5.901 -8.386 1.00 63.14 H new HETATM 0 HAK1 DTF A 174 23.989 -7.687 -6.724 1.00 10.30 H new HETATM 0 HAJ1 DTF A 174 16.401 -6.277 -13.781 1.00 31.20 H new HETATM 0 HAI1 DTF A 174 17.636 -4.974 -11.321 1.00 20.22 H new HETATM 0 HB2 DTF A 174 20.175 -1.885 -8.409 1.00 62.22 H new HETATM 0 HB1 DTF A 174 18.763 -0.949 -8.856 1.00 62.22 H new HETATM 0 HAE DTF A 174 19.909 -3.941 -7.508 1.00 44.13 H new HETATM 0 HAD DTF A 174 18.319 -4.644 -7.197 1.00 44.13 H new HETATM 0 HAC DTF A 174 15.073 -1.340 -12.726 1.00 14.13 H new HETATM 0 HAB DTF A 174 17.559 -2.263 -11.154 1.00 63.11 H new HETATM 0 HAA DTF A 174 19.640 -3.307 -12.828 1.00 24.21 H new HETATM 0 HA1 DTF A 174 20.451 -1.432 -10.746 1.00 41.24 H new