USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1136 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 68 ASN : amide:sc= 0 X(o=-0.022,f=-0.037) USER MOD Set 1.2: A 80 LYS NZ :NH3+ -162:sc= -0.022 (180deg=-0.296) USER MOD Set 2.1: A 26 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 GLY N :NH3+ -175:sc= 0 (180deg=-0.0196) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 164:sc= -0.0436 (180deg=-0.352) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 CYS SG : rot 180:sc= -0.282 USER MOD Single : A 16 GLN :FLIP amide:sc= -0.221 F(o=-1,f=-0.22) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 CYS SG : rot 133:sc= -4.44! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= -10.1! C(o=-10!,f=-9.7!) USER MOD Single : A 31 THR OG1 : rot -78:sc= 1.03 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 GLN :FLIP amide:sc= -7.24! C(o=-9.2!,f=-7.2!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 120:sc= -3.28! USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 55 ASN : amide:sc= -0.556 K(o=-0.56,f=-11!) USER MOD Single : A 56 ASN : amide:sc= -2.17 X(o=-2.2,f=-1.7) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 173:sc= -0.202 USER MOD Single : A 63 ASN : amide:sc= -0.0401 K(o=-0.04,f=-3.3) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 MET CE :methyl -120:sc= -2.52 (180deg=-3.56) USER MOD Single : A 74 SER OG : rot 180:sc= -0.0127 USER MOD Single : A 75 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 78 CYS SG : rot -160:sc= -1.59 USER MOD Single : A 81 ASN : amide:sc= -0.0178 K(o=-0.018,f=-3.3!) USER MOD Single : A 84 THR OG1 : rot 87:sc= 0 USER MOD Single : A 87 THR OG1 : rot 67:sc= 1.02 USER MOD Single : A 89 CYS SG : rot 124:sc= -0.0197 USER MOD Single : A 90 CYS SG : rot -22:sc= 0.205 USER MOD Single : A 92 THR OG1 : rot 163:sc= 0.44 USER MOD Single : A 95 MET CE :methyl 152:sc= -0.126 (180deg=-0.154) USER MOD Single : A 97 LYS NZ :NH3+ -157:sc= -0.111 (180deg=-0.622) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 71:sc= 0.278 USER MOD Single : A 120 SER OG : rot 76:sc= 0.0757 USER MOD Single : A 123 SER OG : rot -90:sc= 1.08 USER MOD Single : A 125 THR OG1 : rot -99:sc= 1.14 USER MOD Single : A 131 THR OG1 : rot -69:sc= 0.369 USER MOD Single : A 138 SER OG : rot 180:sc= -0.0714 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= -0.153 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.272 8.583 23.663 1.00 0.00 N ATOM 2 CA GLY A 1 8.075 9.402 23.603 1.00 0.00 C ATOM 3 C GLY A 1 8.127 10.424 22.485 1.00 0.00 C ATOM 4 O GLY A 1 7.141 10.632 21.779 1.00 0.00 O ATOM 0 H1 GLY A 1 9.153 7.846 24.387 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.434 8.136 22.738 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.089 9.179 23.907 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.206 8.760 23.464 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.942 9.916 24.555 1.00 0.00 H new ATOM 8 N SER A 2 9.280 11.065 22.324 1.00 0.00 N ATOM 9 CA SER A 2 9.455 12.075 21.287 1.00 0.00 C ATOM 10 C SER A 2 9.965 11.444 19.995 1.00 0.00 C ATOM 11 O SER A 2 10.632 10.410 20.017 1.00 0.00 O ATOM 12 CB SER A 2 10.429 13.157 21.758 1.00 0.00 C ATOM 13 OG SER A 2 9.820 14.011 22.711 1.00 0.00 O ATOM 0 H SER A 2 10.107 10.903 22.899 1.00 0.00 H new ATOM 0 HA SER A 2 8.484 12.530 21.091 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.312 12.691 22.195 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.768 13.743 20.904 1.00 0.00 H new ATOM 0 HG SER A 2 10.463 14.693 22.998 1.00 0.00 H new ATOM 19 N SER A 3 9.644 12.075 18.869 1.00 0.00 N ATOM 20 CA SER A 3 10.065 11.574 17.566 1.00 0.00 C ATOM 21 C SER A 3 11.545 11.860 17.327 1.00 0.00 C ATOM 22 O SER A 3 12.060 12.902 17.729 1.00 0.00 O ATOM 23 CB SER A 3 9.225 12.209 16.456 1.00 0.00 C ATOM 24 OG SER A 3 8.002 11.516 16.283 1.00 0.00 O ATOM 0 H SER A 3 9.094 12.933 18.833 1.00 0.00 H new ATOM 0 HA SER A 3 9.914 10.495 17.553 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.024 13.252 16.699 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.786 12.202 15.522 1.00 0.00 H new ATOM 0 HG SER A 3 7.483 11.942 15.569 1.00 0.00 H new ATOM 30 N GLY A 4 12.223 10.925 16.668 1.00 0.00 N ATOM 31 CA GLY A 4 13.636 11.094 16.385 1.00 0.00 C ATOM 32 C GLY A 4 14.097 10.255 15.210 1.00 0.00 C ATOM 33 O GLY A 4 14.345 9.058 15.353 1.00 0.00 O ATOM 0 H GLY A 4 11.819 10.054 16.325 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.839 12.145 16.179 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.215 10.825 17.269 1.00 0.00 H new ATOM 37 N SER A 5 14.211 10.884 14.045 1.00 0.00 N ATOM 38 CA SER A 5 14.640 10.186 12.838 1.00 0.00 C ATOM 39 C SER A 5 16.129 9.860 12.900 1.00 0.00 C ATOM 40 O SER A 5 16.945 10.701 13.275 1.00 0.00 O ATOM 41 CB SER A 5 14.342 11.033 11.600 1.00 0.00 C ATOM 42 OG SER A 5 14.864 10.428 10.430 1.00 0.00 O ATOM 0 H SER A 5 14.012 11.875 13.911 1.00 0.00 H new ATOM 0 HA SER A 5 14.084 9.251 12.771 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.265 11.164 11.496 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.773 12.026 11.723 1.00 0.00 H new ATOM 0 HG SER A 5 14.659 10.988 9.653 1.00 0.00 H new ATOM 48 N SER A 6 16.475 8.631 12.528 1.00 0.00 N ATOM 49 CA SER A 6 17.865 8.191 12.544 1.00 0.00 C ATOM 50 C SER A 6 18.014 6.836 11.859 1.00 0.00 C ATOM 51 O SER A 6 17.486 5.829 12.330 1.00 0.00 O ATOM 52 CB SER A 6 18.379 8.108 13.982 1.00 0.00 C ATOM 53 OG SER A 6 19.785 7.926 14.012 1.00 0.00 O ATOM 0 H SER A 6 15.812 7.923 12.212 1.00 0.00 H new ATOM 0 HA SER A 6 18.458 8.923 11.996 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.116 9.019 14.519 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.891 7.282 14.499 1.00 0.00 H new ATOM 0 HG SER A 6 20.089 7.878 14.942 1.00 0.00 H new ATOM 59 N GLY A 7 18.737 6.819 10.744 1.00 0.00 N ATOM 60 CA GLY A 7 18.942 5.583 10.011 1.00 0.00 C ATOM 61 C GLY A 7 18.075 5.492 8.772 1.00 0.00 C ATOM 62 O GLY A 7 17.462 6.478 8.362 1.00 0.00 O ATOM 0 H GLY A 7 19.185 7.639 10.335 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.990 5.505 9.723 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.727 4.737 10.664 1.00 0.00 H new ATOM 66 N MET A 8 18.024 4.307 8.172 1.00 0.00 N ATOM 67 CA MET A 8 17.225 4.092 6.971 1.00 0.00 C ATOM 68 C MET A 8 15.843 3.555 7.327 1.00 0.00 C ATOM 69 O MET A 8 15.661 2.350 7.497 1.00 0.00 O ATOM 70 CB MET A 8 17.936 3.121 6.027 1.00 0.00 C ATOM 71 CG MET A 8 17.140 2.801 4.772 1.00 0.00 C ATOM 72 SD MET A 8 18.007 1.668 3.670 1.00 0.00 S ATOM 73 CE MET A 8 17.968 0.160 4.635 1.00 0.00 C ATOM 0 H MET A 8 18.526 3.481 8.498 1.00 0.00 H new ATOM 0 HA MET A 8 17.103 5.052 6.468 1.00 0.00 H new ATOM 0 HB2 MET A 8 18.898 3.546 5.739 1.00 0.00 H new ATOM 0 HB3 MET A 8 18.144 2.194 6.562 1.00 0.00 H new ATOM 0 HG2 MET A 8 16.182 2.364 5.055 1.00 0.00 H new ATOM 0 HG3 MET A 8 16.923 3.726 4.238 1.00 0.00 H new ATOM 0 HE1 MET A 8 18.202 -0.689 3.993 1.00 0.00 H new ATOM 0 HE2 MET A 8 18.704 0.222 5.437 1.00 0.00 H new ATOM 0 HE3 MET A 8 16.975 0.028 5.064 1.00 0.00 H new ATOM 83 N GLU A 9 14.872 4.456 7.437 1.00 0.00 N ATOM 84 CA GLU A 9 13.507 4.071 7.774 1.00 0.00 C ATOM 85 C GLU A 9 13.048 2.893 6.919 1.00 0.00 C ATOM 86 O GLU A 9 13.624 2.589 5.875 1.00 0.00 O ATOM 87 CB GLU A 9 12.557 5.255 7.582 1.00 0.00 C ATOM 88 CG GLU A 9 12.373 6.097 8.833 1.00 0.00 C ATOM 89 CD GLU A 9 12.015 5.264 10.049 1.00 0.00 C ATOM 90 OE1 GLU A 9 12.943 4.753 10.711 1.00 0.00 O ATOM 91 OE2 GLU A 9 10.809 5.124 10.339 1.00 0.00 O ATOM 0 H GLU A 9 15.006 5.458 7.298 1.00 0.00 H new ATOM 0 HA GLU A 9 13.490 3.767 8.821 1.00 0.00 H new ATOM 0 HB2 GLU A 9 12.937 5.889 6.781 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.585 4.882 7.259 1.00 0.00 H new ATOM 0 HG2 GLU A 9 13.291 6.649 9.033 1.00 0.00 H new ATOM 0 HG3 GLU A 9 11.589 6.834 8.658 1.00 0.00 H new ATOM 98 N PRO A 10 11.985 2.212 7.373 1.00 0.00 N ATOM 99 CA PRO A 10 11.424 1.056 6.666 1.00 0.00 C ATOM 100 C PRO A 10 10.738 1.451 5.363 1.00 0.00 C ATOM 101 O PRO A 10 10.920 0.801 4.333 1.00 0.00 O ATOM 102 CB PRO A 10 10.404 0.494 7.659 1.00 0.00 C ATOM 103 CG PRO A 10 10.019 1.657 8.506 1.00 0.00 C ATOM 104 CD PRO A 10 11.248 2.518 8.611 1.00 0.00 C ATOM 0 HA PRO A 10 12.195 0.342 6.376 1.00 0.00 H new ATOM 0 HB2 PRO A 10 9.539 0.076 7.144 1.00 0.00 H new ATOM 0 HB3 PRO A 10 10.836 -0.307 8.259 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.193 2.209 8.058 1.00 0.00 H new ATOM 0 HG3 PRO A 10 9.687 1.329 9.491 1.00 0.00 H new ATOM 0 HD2 PRO A 10 10.993 3.576 8.676 1.00 0.00 H new ATOM 0 HD3 PRO A 10 11.834 2.276 9.498 1.00 0.00 H new ATOM 112 N TRP A 11 9.951 2.519 5.414 1.00 0.00 N ATOM 113 CA TRP A 11 9.238 3.000 4.236 1.00 0.00 C ATOM 114 C TRP A 11 10.214 3.445 3.153 1.00 0.00 C ATOM 115 O TRP A 11 9.975 3.236 1.964 1.00 0.00 O ATOM 116 CB TRP A 11 8.312 4.158 4.613 1.00 0.00 C ATOM 117 CG TRP A 11 9.047 5.390 5.046 1.00 0.00 C ATOM 118 CD1 TRP A 11 9.618 5.618 6.266 1.00 0.00 C ATOM 119 CD2 TRP A 11 9.289 6.563 4.262 1.00 0.00 C ATOM 120 NE1 TRP A 11 10.200 6.863 6.287 1.00 0.00 N ATOM 121 CE2 TRP A 11 10.013 7.462 5.070 1.00 0.00 C ATOM 122 CE3 TRP A 11 8.966 6.941 2.956 1.00 0.00 C ATOM 123 CZ2 TRP A 11 10.417 8.714 4.612 1.00 0.00 C ATOM 124 CZ3 TRP A 11 9.368 8.184 2.504 1.00 0.00 C ATOM 125 CH2 TRP A 11 10.087 9.058 3.330 1.00 0.00 C ATOM 0 H TRP A 11 9.790 3.069 6.258 1.00 0.00 H new ATOM 0 HA TRP A 11 8.639 2.178 3.843 1.00 0.00 H new ATOM 0 HB2 TRP A 11 7.681 4.402 3.759 1.00 0.00 H new ATOM 0 HB3 TRP A 11 7.650 3.837 5.417 1.00 0.00 H new ATOM 0 HD1 TRP A 11 9.613 4.922 7.092 1.00 0.00 H new ATOM 0 HE1 TRP A 11 10.692 7.274 7.081 1.00 0.00 H new ATOM 0 HE3 TRP A 11 8.412 6.274 2.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 10.971 9.389 5.247 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 9.124 8.487 1.497 1.00 0.00 H new ATOM 0 HH2 TRP A 11 10.387 10.022 2.947 1.00 0.00 H new ATOM 136 N LYS A 12 11.314 4.061 3.572 1.00 0.00 N ATOM 137 CA LYS A 12 12.329 4.535 2.637 1.00 0.00 C ATOM 138 C LYS A 12 12.452 3.593 1.444 1.00 0.00 C ATOM 139 O LYS A 12 12.087 3.947 0.323 1.00 0.00 O ATOM 140 CB LYS A 12 13.681 4.662 3.342 1.00 0.00 C ATOM 141 CG LYS A 12 13.699 5.711 4.440 1.00 0.00 C ATOM 142 CD LYS A 12 14.195 7.051 3.923 1.00 0.00 C ATOM 143 CE LYS A 12 13.044 7.931 3.459 1.00 0.00 C ATOM 144 NZ LYS A 12 13.444 8.819 2.333 1.00 0.00 N ATOM 0 H LYS A 12 11.526 4.244 4.553 1.00 0.00 H new ATOM 0 HA LYS A 12 12.022 5.516 2.273 1.00 0.00 H new ATOM 0 HB2 LYS A 12 13.950 3.696 3.770 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.444 4.908 2.604 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.696 5.827 4.850 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.340 5.375 5.255 1.00 0.00 H new ATOM 0 HD2 LYS A 12 14.751 7.562 4.709 1.00 0.00 H new ATOM 0 HD3 LYS A 12 14.887 6.890 3.096 1.00 0.00 H new ATOM 0 HE2 LYS A 12 12.209 7.303 3.147 1.00 0.00 H new ATOM 0 HE3 LYS A 12 12.692 8.538 4.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 12.632 9.402 2.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 14.224 9.436 2.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 13.756 8.239 1.528 1.00 0.00 H new ATOM 158 N GLN A 13 12.966 2.393 1.693 1.00 0.00 N ATOM 159 CA GLN A 13 13.136 1.401 0.639 1.00 0.00 C ATOM 160 C GLN A 13 11.813 1.127 -0.069 1.00 0.00 C ATOM 161 O GLN A 13 11.755 1.076 -1.299 1.00 0.00 O ATOM 162 CB GLN A 13 13.697 0.101 1.218 1.00 0.00 C ATOM 163 CG GLN A 13 12.853 -0.479 2.341 1.00 0.00 C ATOM 164 CD GLN A 13 13.486 -1.700 2.976 1.00 0.00 C ATOM 165 OE1 GLN A 13 12.988 -2.817 2.834 1.00 0.00 O ATOM 166 NE2 GLN A 13 14.592 -1.495 3.683 1.00 0.00 N ATOM 0 H GLN A 13 13.272 2.084 2.616 1.00 0.00 H new ATOM 0 HA GLN A 13 13.842 1.800 -0.090 1.00 0.00 H new ATOM 0 HB2 GLN A 13 13.781 -0.636 0.420 1.00 0.00 H new ATOM 0 HB3 GLN A 13 14.705 0.284 1.590 1.00 0.00 H new ATOM 0 HG2 GLN A 13 12.698 0.283 3.104 1.00 0.00 H new ATOM 0 HG3 GLN A 13 11.870 -0.745 1.952 1.00 0.00 H new ATOM 0 HE21 GLN A 13 14.971 -0.553 3.775 1.00 0.00 H new ATOM 0 HE22 GLN A 13 15.062 -2.280 4.134 1.00 0.00 H new ATOM 175 N CYS A 14 10.755 0.952 0.713 1.00 0.00 N ATOM 176 CA CYS A 14 9.432 0.682 0.161 1.00 0.00 C ATOM 177 C CYS A 14 9.124 1.624 -0.998 1.00 0.00 C ATOM 178 O CYS A 14 8.696 1.189 -2.067 1.00 0.00 O ATOM 179 CB CYS A 14 8.364 0.825 1.247 1.00 0.00 C ATOM 180 SG CYS A 14 6.709 0.316 0.726 1.00 0.00 S ATOM 0 H CYS A 14 10.787 0.992 1.732 1.00 0.00 H new ATOM 0 HA CYS A 14 9.424 -0.341 -0.214 1.00 0.00 H new ATOM 0 HB2 CYS A 14 8.659 0.232 2.112 1.00 0.00 H new ATOM 0 HB3 CYS A 14 8.327 1.865 1.571 1.00 0.00 H new ATOM 0 HG CYS A 14 5.877 0.472 1.712 1.00 0.00 H new ATOM 186 N ALA A 15 9.343 2.916 -0.778 1.00 0.00 N ATOM 187 CA ALA A 15 9.090 3.919 -1.805 1.00 0.00 C ATOM 188 C ALA A 15 9.554 3.434 -3.174 1.00 0.00 C ATOM 189 O ALA A 15 8.804 3.489 -4.148 1.00 0.00 O ATOM 190 CB ALA A 15 9.778 5.228 -1.445 1.00 0.00 C ATOM 0 H ALA A 15 9.695 3.293 0.102 1.00 0.00 H new ATOM 0 HA ALA A 15 8.014 4.088 -1.855 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.581 5.968 -2.221 1.00 0.00 H new ATOM 0 HB2 ALA A 15 9.394 5.591 -0.491 1.00 0.00 H new ATOM 0 HB3 ALA A 15 10.853 5.064 -1.365 1.00 0.00 H new ATOM 196 N GLN A 16 10.794 2.959 -3.239 1.00 0.00 N ATOM 197 CA GLN A 16 11.357 2.465 -4.490 1.00 0.00 C ATOM 198 C GLN A 16 10.434 1.436 -5.134 1.00 0.00 C ATOM 199 O GLN A 16 9.934 1.642 -6.240 1.00 0.00 O ATOM 200 CB GLN A 16 12.736 1.849 -4.245 1.00 0.00 C ATOM 201 CG GLN A 16 13.729 2.812 -3.614 1.00 0.00 C ATOM 202 CD GLN A 16 14.131 3.933 -4.552 1.00 0.00 C ATOM 203 OE1 GLN A 16 13.236 4.896 -4.741 1.00 0.00 O flip ATOM 204 NE2 GLN A 16 15.233 3.934 -5.100 1.00 0.00 N flip ATOM 0 H GLN A 16 11.427 2.906 -2.441 1.00 0.00 H new ATOM 0 HA GLN A 16 11.460 3.310 -5.171 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.626 0.978 -3.599 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.140 1.493 -5.193 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.292 3.238 -2.711 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.619 2.262 -3.309 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.890 3.173 -4.926 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.489 4.695 -5.728 1.00 0.00 H new ATOM 213 N TRP A 17 10.213 0.328 -4.435 1.00 0.00 N ATOM 214 CA TRP A 17 9.350 -0.734 -4.940 1.00 0.00 C ATOM 215 C TRP A 17 8.064 -0.159 -5.523 1.00 0.00 C ATOM 216 O TRP A 17 7.624 -0.564 -6.600 1.00 0.00 O ATOM 217 CB TRP A 17 9.020 -1.725 -3.822 1.00 0.00 C ATOM 218 CG TRP A 17 8.313 -2.954 -4.308 1.00 0.00 C ATOM 219 CD1 TRP A 17 8.845 -3.962 -5.060 1.00 0.00 C ATOM 220 CD2 TRP A 17 6.944 -3.302 -4.077 1.00 0.00 C ATOM 221 NE1 TRP A 17 7.889 -4.917 -5.310 1.00 0.00 N ATOM 222 CE2 TRP A 17 6.714 -4.536 -4.717 1.00 0.00 C ATOM 223 CE3 TRP A 17 5.890 -2.694 -3.390 1.00 0.00 C ATOM 224 CZ2 TRP A 17 5.474 -5.169 -4.690 1.00 0.00 C ATOM 225 CZ3 TRP A 17 4.660 -3.323 -3.364 1.00 0.00 C ATOM 226 CH2 TRP A 17 4.460 -4.551 -4.010 1.00 0.00 C ATOM 0 H TRP A 17 10.619 0.142 -3.518 1.00 0.00 H new ATOM 0 HA TRP A 17 9.884 -1.257 -5.733 1.00 0.00 H new ATOM 0 HB2 TRP A 17 9.943 -2.019 -3.323 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.399 -1.228 -3.077 1.00 0.00 H new ATOM 0 HD1 TRP A 17 9.867 -4.003 -5.407 1.00 0.00 H new ATOM 0 HE1 TRP A 17 8.031 -5.771 -5.849 1.00 0.00 H new ATOM 0 HE3 TRP A 17 6.034 -1.749 -2.888 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 5.318 -6.114 -5.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 3.839 -2.861 -2.837 1.00 0.00 H new ATOM 0 HH2 TRP A 17 3.487 -5.018 -3.970 1.00 0.00 H new ATOM 237 N LEU A 18 7.465 0.786 -4.807 1.00 0.00 N ATOM 238 CA LEU A 18 6.229 1.417 -5.255 1.00 0.00 C ATOM 239 C LEU A 18 6.404 2.038 -6.637 1.00 0.00 C ATOM 240 O LEU A 18 5.645 1.744 -7.561 1.00 0.00 O ATOM 241 CB LEU A 18 5.788 2.487 -4.255 1.00 0.00 C ATOM 242 CG LEU A 18 5.245 1.974 -2.920 1.00 0.00 C ATOM 243 CD1 LEU A 18 5.180 3.102 -1.902 1.00 0.00 C ATOM 244 CD2 LEU A 18 3.872 1.345 -3.109 1.00 0.00 C ATOM 0 H LEU A 18 7.815 1.132 -3.914 1.00 0.00 H new ATOM 0 HA LEU A 18 5.460 0.648 -5.318 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.638 3.139 -4.053 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.020 3.101 -4.725 1.00 0.00 H new ATOM 0 HG LEU A 18 5.924 1.210 -2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.791 2.719 -0.959 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.179 3.508 -1.745 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.523 3.889 -2.272 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.501 0.986 -2.149 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.183 2.089 -3.509 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.947 0.509 -3.805 1.00 0.00 H new ATOM 256 N ILE A 19 7.409 2.896 -6.771 1.00 0.00 N ATOM 257 CA ILE A 19 7.686 3.555 -8.042 1.00 0.00 C ATOM 258 C ILE A 19 7.818 2.539 -9.171 1.00 0.00 C ATOM 259 O ILE A 19 7.269 2.727 -10.257 1.00 0.00 O ATOM 260 CB ILE A 19 8.973 4.397 -7.970 1.00 0.00 C ATOM 261 CG1 ILE A 19 8.869 5.434 -6.850 1.00 0.00 C ATOM 262 CG2 ILE A 19 9.236 5.078 -9.306 1.00 0.00 C ATOM 263 CD1 ILE A 19 10.178 6.128 -6.545 1.00 0.00 C ATOM 0 H ILE A 19 8.045 3.151 -6.016 1.00 0.00 H new ATOM 0 HA ILE A 19 6.842 4.213 -8.247 1.00 0.00 H new ATOM 0 HB ILE A 19 9.810 3.735 -7.750 1.00 0.00 H new ATOM 0 HG12 ILE A 19 8.126 6.182 -7.127 1.00 0.00 H new ATOM 0 HG13 ILE A 19 8.507 4.945 -5.946 1.00 0.00 H new ATOM 0 HG21 ILE A 19 10.149 5.670 -9.239 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.349 4.322 -10.083 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.398 5.730 -9.553 1.00 0.00 H new ATOM 0 HD11 ILE A 19 10.029 6.849 -5.741 1.00 0.00 H new ATOM 0 HD12 ILE A 19 10.918 5.390 -6.237 1.00 0.00 H new ATOM 0 HD13 ILE A 19 10.531 6.646 -7.436 1.00 0.00 H new ATOM 275 N HIS A 20 8.549 1.461 -8.907 1.00 0.00 N ATOM 276 CA HIS A 20 8.751 0.413 -9.901 1.00 0.00 C ATOM 277 C HIS A 20 7.457 -0.355 -10.153 1.00 0.00 C ATOM 278 O HIS A 20 7.202 -0.811 -11.268 1.00 0.00 O ATOM 279 CB HIS A 20 9.847 -0.550 -9.442 1.00 0.00 C ATOM 280 CG HIS A 20 11.221 -0.147 -9.882 1.00 0.00 C ATOM 281 ND1 HIS A 20 11.824 -0.648 -11.016 1.00 0.00 N ATOM 282 CD2 HIS A 20 12.109 0.715 -9.334 1.00 0.00 C ATOM 283 CE1 HIS A 20 13.025 -0.113 -11.146 1.00 0.00 C ATOM 284 NE2 HIS A 20 13.222 0.718 -10.138 1.00 0.00 N ATOM 0 H HIS A 20 9.011 1.290 -8.014 1.00 0.00 H new ATOM 0 HA HIS A 20 9.059 0.886 -10.833 1.00 0.00 H new ATOM 0 HB2 HIS A 20 9.828 -0.617 -8.354 1.00 0.00 H new ATOM 0 HB3 HIS A 20 9.629 -1.546 -9.827 1.00 0.00 H new ATOM 0 HD2 HIS A 20 11.968 1.293 -8.432 1.00 0.00 H new ATOM 0 HE1 HIS A 20 13.726 -0.320 -11.941 1.00 0.00 H new ATOM 0 HE2 HIS A 20 14.064 1.272 -9.982 1.00 0.00 H new ATOM 293 N CYS A 21 6.645 -0.493 -9.111 1.00 0.00 N ATOM 294 CA CYS A 21 5.377 -1.207 -9.220 1.00 0.00 C ATOM 295 C CYS A 21 4.388 -0.430 -10.082 1.00 0.00 C ATOM 296 O CYS A 21 3.279 -0.895 -10.346 1.00 0.00 O ATOM 297 CB CYS A 21 4.783 -1.447 -7.831 1.00 0.00 C ATOM 298 SG CYS A 21 5.672 -2.679 -6.851 1.00 0.00 S ATOM 0 H CYS A 21 6.841 -0.121 -8.182 1.00 0.00 H new ATOM 0 HA CYS A 21 5.569 -2.168 -9.697 1.00 0.00 H new ATOM 0 HB2 CYS A 21 4.771 -0.504 -7.285 1.00 0.00 H new ATOM 0 HB3 CYS A 21 3.746 -1.765 -7.941 1.00 0.00 H new ATOM 0 HG CYS A 21 5.879 -2.215 -5.655 1.00 0.00 H new ATOM 304 N LYS A 22 4.795 0.758 -10.517 1.00 0.00 N ATOM 305 CA LYS A 22 3.946 1.601 -11.349 1.00 0.00 C ATOM 306 C LYS A 22 2.782 2.167 -10.541 1.00 0.00 C ATOM 307 O LYS A 22 1.628 2.099 -10.965 1.00 0.00 O ATOM 308 CB LYS A 22 3.412 0.804 -12.542 1.00 0.00 C ATOM 309 CG LYS A 22 4.477 -0.014 -13.251 1.00 0.00 C ATOM 310 CD LYS A 22 5.393 0.865 -14.085 1.00 0.00 C ATOM 311 CE LYS A 22 5.990 0.098 -15.255 1.00 0.00 C ATOM 312 NZ LYS A 22 6.285 0.990 -16.411 1.00 0.00 N ATOM 0 H LYS A 22 5.709 1.159 -10.306 1.00 0.00 H new ATOM 0 HA LYS A 22 4.549 2.431 -11.715 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.622 0.137 -12.198 1.00 0.00 H new ATOM 0 HB3 LYS A 22 2.960 1.493 -13.255 1.00 0.00 H new ATOM 0 HG2 LYS A 22 5.067 -0.561 -12.515 1.00 0.00 H new ATOM 0 HG3 LYS A 22 4.000 -0.756 -13.892 1.00 0.00 H new ATOM 0 HD2 LYS A 22 4.834 1.723 -14.459 1.00 0.00 H new ATOM 0 HD3 LYS A 22 6.194 1.255 -13.458 1.00 0.00 H new ATOM 0 HE2 LYS A 22 6.907 -0.397 -14.935 1.00 0.00 H new ATOM 0 HE3 LYS A 22 5.298 -0.684 -15.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 6.690 0.429 -17.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 5.406 1.443 -16.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 6.965 1.721 -16.120 1.00 0.00 H new ATOM 326 N VAL A 23 3.094 2.727 -9.377 1.00 0.00 N ATOM 327 CA VAL A 23 2.074 3.308 -8.511 1.00 0.00 C ATOM 328 C VAL A 23 2.393 4.763 -8.185 1.00 0.00 C ATOM 329 O VAL A 23 1.492 5.572 -7.959 1.00 0.00 O ATOM 330 CB VAL A 23 1.938 2.517 -7.196 1.00 0.00 C ATOM 331 CG1 VAL A 23 1.413 1.115 -7.468 1.00 0.00 C ATOM 332 CG2 VAL A 23 3.271 2.464 -6.466 1.00 0.00 C ATOM 0 H VAL A 23 4.044 2.791 -9.012 1.00 0.00 H new ATOM 0 HA VAL A 23 1.131 3.259 -9.056 1.00 0.00 H new ATOM 0 HB VAL A 23 1.220 3.030 -6.556 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.323 0.571 -6.528 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.435 1.179 -7.945 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.104 0.589 -8.127 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.156 1.902 -5.539 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.013 1.975 -7.098 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.601 3.477 -6.237 1.00 0.00 H new ATOM 342 N LEU A 24 3.681 5.089 -8.162 1.00 0.00 N ATOM 343 CA LEU A 24 4.120 6.448 -7.864 1.00 0.00 C ATOM 344 C LEU A 24 5.174 6.911 -8.865 1.00 0.00 C ATOM 345 O LEU A 24 5.925 6.114 -9.426 1.00 0.00 O ATOM 346 CB LEU A 24 4.682 6.523 -6.444 1.00 0.00 C ATOM 347 CG LEU A 24 3.719 6.138 -5.320 1.00 0.00 C ATOM 348 CD1 LEU A 24 4.474 5.945 -4.014 1.00 0.00 C ATOM 349 CD2 LEU A 24 2.635 7.193 -5.161 1.00 0.00 C ATOM 0 H LEU A 24 4.439 4.432 -8.346 1.00 0.00 H new ATOM 0 HA LEU A 24 3.256 7.108 -7.942 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.555 5.873 -6.386 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.029 7.541 -6.265 1.00 0.00 H new ATOM 0 HG LEU A 24 3.242 5.194 -5.583 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.773 5.671 -3.225 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.212 5.152 -4.134 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.979 6.873 -3.745 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.959 6.902 -4.357 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.093 8.152 -4.921 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.074 7.282 -6.092 1.00 0.00 H new ATOM 361 N PRO A 25 5.233 8.231 -9.094 1.00 0.00 N ATOM 362 CA PRO A 25 6.193 8.831 -10.026 1.00 0.00 C ATOM 363 C PRO A 25 7.626 8.757 -9.509 1.00 0.00 C ATOM 364 O PRO A 25 7.865 8.383 -8.361 1.00 0.00 O ATOM 365 CB PRO A 25 5.733 10.288 -10.120 1.00 0.00 C ATOM 366 CG PRO A 25 5.017 10.543 -8.839 1.00 0.00 C ATOM 367 CD PRO A 25 4.368 9.241 -8.461 1.00 0.00 C ATOM 0 HA PRO A 25 6.209 8.312 -10.985 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.580 10.963 -10.241 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.077 10.442 -10.977 1.00 0.00 H new ATOM 0 HG2 PRO A 25 5.709 10.873 -8.064 1.00 0.00 H new ATOM 0 HG3 PRO A 25 4.272 11.330 -8.958 1.00 0.00 H new ATOM 0 HD2 PRO A 25 4.326 9.112 -7.379 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.344 9.181 -8.830 1.00 0.00 H new ATOM 375 N THR A 26 8.578 9.117 -10.365 1.00 0.00 N ATOM 376 CA THR A 26 9.987 9.091 -9.995 1.00 0.00 C ATOM 377 C THR A 26 10.364 10.321 -9.177 1.00 0.00 C ATOM 378 O THR A 26 11.329 10.299 -8.415 1.00 0.00 O ATOM 379 CB THR A 26 10.893 9.018 -11.239 1.00 0.00 C ATOM 380 OG1 THR A 26 10.752 10.211 -12.018 1.00 0.00 O ATOM 381 CG2 THR A 26 10.546 7.806 -12.091 1.00 0.00 C ATOM 0 H THR A 26 8.398 9.430 -11.319 1.00 0.00 H new ATOM 0 HA THR A 26 10.139 8.196 -9.391 1.00 0.00 H new ATOM 0 HB THR A 26 11.926 8.923 -10.904 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.332 10.158 -12.806 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.199 7.776 -12.963 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.682 6.898 -11.504 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.508 7.875 -12.417 1.00 0.00 H new ATOM 389 N ASN A 27 9.596 11.393 -9.341 1.00 0.00 N ATOM 390 CA ASN A 27 9.849 12.633 -8.617 1.00 0.00 C ATOM 391 C ASN A 27 8.762 12.889 -7.578 1.00 0.00 C ATOM 392 O ASN A 27 8.534 14.028 -7.169 1.00 0.00 O ATOM 393 CB ASN A 27 9.926 13.810 -9.592 1.00 0.00 C ATOM 394 CG ASN A 27 11.135 13.728 -10.504 1.00 0.00 C ATOM 395 OD1 ASN A 27 11.024 13.340 -11.667 1.00 0.00 O ATOM 396 ND2 ASN A 27 12.298 14.094 -9.978 1.00 0.00 N ATOM 0 H ASN A 27 8.793 11.428 -9.969 1.00 0.00 H new ATOM 0 HA ASN A 27 10.804 12.534 -8.100 1.00 0.00 H new ATOM 0 HB2 ASN A 27 9.020 13.837 -10.197 1.00 0.00 H new ATOM 0 HB3 ASN A 27 9.962 14.743 -9.029 1.00 0.00 H new ATOM 0 HD21 ASN A 27 13.147 14.060 -10.543 1.00 0.00 H new ATOM 0 HD22 ASN A 27 12.343 14.409 -9.009 1.00 0.00 H new ATOM 403 N HIS A 28 8.093 11.821 -7.154 1.00 0.00 N ATOM 404 CA HIS A 28 7.030 11.929 -6.161 1.00 0.00 C ATOM 405 C HIS A 28 7.516 12.679 -4.924 1.00 0.00 C ATOM 406 O HIS A 28 8.700 12.994 -4.803 1.00 0.00 O ATOM 407 CB HIS A 28 6.530 10.540 -5.766 1.00 0.00 C ATOM 408 CG HIS A 28 5.088 10.515 -5.361 1.00 0.00 C ATOM 409 ND1 HIS A 28 4.639 9.898 -4.212 1.00 0.00 N ATOM 410 CD2 HIS A 28 3.992 11.039 -5.958 1.00 0.00 C ATOM 411 CE1 HIS A 28 3.329 10.041 -4.121 1.00 0.00 C ATOM 412 NE2 HIS A 28 2.912 10.730 -5.168 1.00 0.00 N ATOM 0 H HIS A 28 8.268 10.871 -7.483 1.00 0.00 H new ATOM 0 HA HIS A 28 6.208 12.490 -6.604 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.675 9.859 -6.604 1.00 0.00 H new ATOM 0 HB3 HIS A 28 7.137 10.165 -4.942 1.00 0.00 H new ATOM 0 HD2 HIS A 28 3.971 11.596 -6.883 1.00 0.00 H new ATOM 0 HE1 HIS A 28 2.705 9.660 -3.326 1.00 0.00 H new ATOM 0 HE2 HIS A 28 1.944 10.990 -5.359 1.00 0.00 H new ATOM 421 N ARG A 29 6.595 12.961 -4.009 1.00 0.00 N ATOM 422 CA ARG A 29 6.929 13.675 -2.783 1.00 0.00 C ATOM 423 C ARG A 29 7.540 12.729 -1.753 1.00 0.00 C ATOM 424 O ARG A 29 8.505 13.077 -1.072 1.00 0.00 O ATOM 425 CB ARG A 29 5.683 14.344 -2.201 1.00 0.00 C ATOM 426 CG ARG A 29 4.600 13.360 -1.789 1.00 0.00 C ATOM 427 CD ARG A 29 3.218 13.990 -1.861 1.00 0.00 C ATOM 428 NE ARG A 29 2.286 13.374 -0.920 1.00 0.00 N ATOM 429 CZ ARG A 29 1.133 13.927 -0.559 1.00 0.00 C ATOM 430 NH1 ARG A 29 0.773 15.102 -1.057 1.00 0.00 N ATOM 431 NH2 ARG A 29 0.338 13.304 0.302 1.00 0.00 N ATOM 0 H ARG A 29 5.611 12.706 -4.094 1.00 0.00 H new ATOM 0 HA ARG A 29 7.664 14.442 -3.028 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.971 14.938 -1.334 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.273 15.034 -2.938 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.636 12.485 -2.438 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.790 13.012 -0.774 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.294 15.057 -1.650 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.828 13.893 -2.874 1.00 0.00 H new ATOM 0 HE ARG A 29 2.534 12.470 -0.518 1.00 0.00 H new ATOM 0 HH11 ARG A 29 1.382 15.584 -1.719 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.113 15.524 -0.778 1.00 0.00 H new ATOM 0 HH21 ARG A 29 0.612 12.400 0.687 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -0.547 13.729 0.579 1.00 0.00 H new ATOM 445 N VAL A 30 6.971 11.533 -1.644 1.00 0.00 N ATOM 446 CA VAL A 30 7.460 10.537 -0.698 1.00 0.00 C ATOM 447 C VAL A 30 8.964 10.337 -0.839 1.00 0.00 C ATOM 448 O VAL A 30 9.674 10.158 0.151 1.00 0.00 O ATOM 449 CB VAL A 30 6.752 9.183 -0.893 1.00 0.00 C ATOM 450 CG1 VAL A 30 5.256 9.324 -0.658 1.00 0.00 C ATOM 451 CG2 VAL A 30 7.032 8.631 -2.282 1.00 0.00 C ATOM 0 H VAL A 30 6.171 11.230 -2.199 1.00 0.00 H new ATOM 0 HA VAL A 30 7.239 10.914 0.301 1.00 0.00 H new ATOM 0 HB VAL A 30 7.146 8.478 -0.161 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.773 8.357 -0.800 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.079 9.672 0.360 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.843 10.044 -1.365 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.524 7.674 -2.402 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.667 9.332 -3.033 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.106 8.490 -2.408 1.00 0.00 H new ATOM 461 N THR A 31 9.447 10.368 -2.078 1.00 0.00 N ATOM 462 CA THR A 31 10.867 10.189 -2.350 1.00 0.00 C ATOM 463 C THR A 31 11.705 11.218 -1.599 1.00 0.00 C ATOM 464 O THR A 31 12.736 10.885 -1.015 1.00 0.00 O ATOM 465 CB THR A 31 11.169 10.299 -3.856 1.00 0.00 C ATOM 466 OG1 THR A 31 10.987 11.650 -4.295 1.00 0.00 O ATOM 467 CG2 THR A 31 10.266 9.374 -4.658 1.00 0.00 C ATOM 0 H THR A 31 8.874 10.516 -2.909 1.00 0.00 H new ATOM 0 HA THR A 31 11.131 9.189 -2.006 1.00 0.00 H new ATOM 0 HB THR A 31 12.205 10.001 -4.019 1.00 0.00 H new ATOM 0 HG1 THR A 31 10.030 11.832 -4.404 1.00 0.00 H new ATOM 0 HG21 THR A 31 10.498 9.469 -5.719 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.428 8.343 -4.342 1.00 0.00 H new ATOM 0 HG23 THR A 31 9.224 9.646 -4.488 1.00 0.00 H new ATOM 475 N TRP A 32 11.254 12.467 -1.617 1.00 0.00 N ATOM 476 CA TRP A 32 11.963 13.545 -0.937 1.00 0.00 C ATOM 477 C TRP A 32 12.271 13.166 0.508 1.00 0.00 C ATOM 478 O TRP A 32 11.409 12.656 1.223 1.00 0.00 O ATOM 479 CB TRP A 32 11.136 14.831 -0.975 1.00 0.00 C ATOM 480 CG TRP A 32 11.206 15.543 -2.291 1.00 0.00 C ATOM 481 CD1 TRP A 32 10.744 15.091 -3.494 1.00 0.00 C ATOM 482 CD2 TRP A 32 11.774 16.835 -2.538 1.00 0.00 C ATOM 483 NE1 TRP A 32 10.990 16.023 -4.473 1.00 0.00 N ATOM 484 CE2 TRP A 32 11.620 17.102 -3.912 1.00 0.00 C ATOM 485 CE3 TRP A 32 12.395 17.792 -1.731 1.00 0.00 C ATOM 486 CZ2 TRP A 32 12.066 18.285 -4.494 1.00 0.00 C ATOM 487 CZ3 TRP A 32 12.837 18.965 -2.310 1.00 0.00 C ATOM 488 CH2 TRP A 32 12.671 19.205 -3.681 1.00 0.00 C ATOM 0 H TRP A 32 10.401 12.758 -2.095 1.00 0.00 H new ATOM 0 HA TRP A 32 12.905 13.713 -1.458 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.096 14.592 -0.754 1.00 0.00 H new ATOM 0 HB3 TRP A 32 11.483 15.501 -0.189 1.00 0.00 H new ATOM 0 HD1 TRP A 32 10.257 14.140 -3.653 1.00 0.00 H new ATOM 0 HE1 TRP A 32 10.743 15.927 -5.458 1.00 0.00 H new ATOM 0 HE3 TRP A 32 12.527 17.617 -0.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 11.939 18.471 -5.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 13.319 19.711 -1.696 1.00 0.00 H new ATOM 0 HH2 TRP A 32 13.027 20.133 -4.104 1.00 0.00 H new ATOM 499 N ASP A 33 13.505 13.420 0.931 1.00 0.00 N ATOM 500 CA ASP A 33 13.926 13.107 2.292 1.00 0.00 C ATOM 501 C ASP A 33 12.979 13.733 3.311 1.00 0.00 C ATOM 502 O ASP A 33 12.565 13.082 4.270 1.00 0.00 O ATOM 503 CB ASP A 33 15.354 13.600 2.533 1.00 0.00 C ATOM 504 CG ASP A 33 15.605 14.966 1.925 1.00 0.00 C ATOM 505 OD1 ASP A 33 15.633 15.065 0.681 1.00 0.00 O ATOM 506 OD2 ASP A 33 15.774 15.935 2.694 1.00 0.00 O ATOM 0 H ASP A 33 14.231 13.842 0.351 1.00 0.00 H new ATOM 0 HA ASP A 33 13.899 12.024 2.415 1.00 0.00 H new ATOM 0 HB2 ASP A 33 15.545 13.642 3.605 1.00 0.00 H new ATOM 0 HB3 ASP A 33 16.059 12.883 2.112 1.00 0.00 H new ATOM 511 N SER A 34 12.643 15.001 3.098 1.00 0.00 N ATOM 512 CA SER A 34 11.749 15.718 4.000 1.00 0.00 C ATOM 513 C SER A 34 10.480 14.912 4.261 1.00 0.00 C ATOM 514 O SER A 34 9.824 15.082 5.288 1.00 0.00 O ATOM 515 CB SER A 34 11.389 17.085 3.417 1.00 0.00 C ATOM 516 OG SER A 34 10.664 16.948 2.207 1.00 0.00 O ATOM 0 H SER A 34 12.977 15.554 2.308 1.00 0.00 H new ATOM 0 HA SER A 34 12.268 15.862 4.948 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.796 17.647 4.138 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.299 17.658 3.237 1.00 0.00 H new ATOM 0 HG SER A 34 10.444 17.836 1.855 1.00 0.00 H new ATOM 522 N ALA A 35 10.141 14.035 3.322 1.00 0.00 N ATOM 523 CA ALA A 35 8.952 13.201 3.449 1.00 0.00 C ATOM 524 C ALA A 35 9.117 12.177 4.567 1.00 0.00 C ATOM 525 O ALA A 35 10.236 11.835 4.947 1.00 0.00 O ATOM 526 CB ALA A 35 8.653 12.503 2.131 1.00 0.00 C ATOM 0 H ALA A 35 10.673 13.884 2.465 1.00 0.00 H new ATOM 0 HA ALA A 35 8.111 13.846 3.704 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.763 11.884 2.241 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.483 13.249 1.355 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.499 11.875 1.852 1.00 0.00 H new ATOM 532 N GLN A 36 7.995 11.692 5.089 1.00 0.00 N ATOM 533 CA GLN A 36 8.017 10.708 6.165 1.00 0.00 C ATOM 534 C GLN A 36 6.915 9.670 5.976 1.00 0.00 C ATOM 535 O GLN A 36 5.994 9.865 5.182 1.00 0.00 O ATOM 536 CB GLN A 36 7.855 11.399 7.520 1.00 0.00 C ATOM 537 CG GLN A 36 8.946 12.415 7.819 1.00 0.00 C ATOM 538 CD GLN A 36 8.521 13.442 8.849 1.00 0.00 C ATOM 539 OE1 GLN A 36 7.986 14.497 8.507 1.00 0.00 O ATOM 540 NE2 GLN A 36 8.756 13.139 10.120 1.00 0.00 N ATOM 0 H GLN A 36 7.060 11.964 4.785 1.00 0.00 H new ATOM 0 HA GLN A 36 8.980 10.198 6.137 1.00 0.00 H new ATOM 0 HB2 GLN A 36 6.887 11.899 7.550 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.849 10.643 8.305 1.00 0.00 H new ATOM 0 HG2 GLN A 36 9.834 11.894 8.176 1.00 0.00 H new ATOM 0 HG3 GLN A 36 9.225 12.925 6.897 1.00 0.00 H new ATOM 0 HE21 GLN A 36 9.202 12.253 10.359 1.00 0.00 H new ATOM 0 HE22 GLN A 36 8.491 13.792 10.857 1.00 0.00 H new ATOM 549 N VAL A 37 7.016 8.566 6.709 1.00 0.00 N ATOM 550 CA VAL A 37 6.028 7.498 6.623 1.00 0.00 C ATOM 551 C VAL A 37 4.631 8.059 6.384 1.00 0.00 C ATOM 552 O VAL A 37 3.887 7.563 5.538 1.00 0.00 O ATOM 553 CB VAL A 37 6.014 6.641 7.903 1.00 0.00 C ATOM 554 CG1 VAL A 37 7.145 5.624 7.877 1.00 0.00 C ATOM 555 CG2 VAL A 37 6.110 7.526 9.136 1.00 0.00 C ATOM 0 H VAL A 37 7.773 8.388 7.369 1.00 0.00 H new ATOM 0 HA VAL A 37 6.313 6.871 5.778 1.00 0.00 H new ATOM 0 HB VAL A 37 5.070 6.097 7.946 1.00 0.00 H new ATOM 0 HG11 VAL A 37 7.119 5.028 8.789 1.00 0.00 H new ATOM 0 HG12 VAL A 37 7.027 4.970 7.013 1.00 0.00 H new ATOM 0 HG13 VAL A 37 8.101 6.144 7.810 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.099 6.905 10.032 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.038 8.097 9.102 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.262 8.211 9.159 1.00 0.00 H new ATOM 565 N PHE A 38 4.281 9.098 7.136 1.00 0.00 N ATOM 566 CA PHE A 38 2.972 9.727 7.007 1.00 0.00 C ATOM 567 C PHE A 38 2.645 10.009 5.544 1.00 0.00 C ATOM 568 O PHE A 38 1.679 9.476 4.998 1.00 0.00 O ATOM 569 CB PHE A 38 2.927 11.028 7.811 1.00 0.00 C ATOM 570 CG PHE A 38 1.577 11.687 7.811 1.00 0.00 C ATOM 571 CD1 PHE A 38 0.421 10.928 7.899 1.00 0.00 C ATOM 572 CD2 PHE A 38 1.464 13.065 7.724 1.00 0.00 C ATOM 573 CE1 PHE A 38 -0.822 11.531 7.898 1.00 0.00 C ATOM 574 CE2 PHE A 38 0.223 13.674 7.723 1.00 0.00 C ATOM 575 CZ PHE A 38 -0.922 12.906 7.812 1.00 0.00 C ATOM 0 H PHE A 38 4.885 9.521 7.840 1.00 0.00 H new ATOM 0 HA PHE A 38 2.225 9.038 7.401 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.221 10.820 8.840 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.662 11.723 7.404 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.493 9.853 7.969 1.00 0.00 H new ATOM 0 HD2 PHE A 38 2.356 13.670 7.656 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.715 10.928 7.964 1.00 0.00 H new ATOM 0 HE2 PHE A 38 0.149 14.749 7.653 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.893 13.379 7.814 1.00 0.00 H new ATOM 585 N ASP A 39 3.457 10.852 4.915 1.00 0.00 N ATOM 586 CA ASP A 39 3.256 11.205 3.514 1.00 0.00 C ATOM 587 C ASP A 39 2.830 9.986 2.702 1.00 0.00 C ATOM 588 O ASP A 39 1.791 10.000 2.040 1.00 0.00 O ATOM 589 CB ASP A 39 4.536 11.803 2.928 1.00 0.00 C ATOM 590 CG ASP A 39 4.816 13.198 3.451 1.00 0.00 C ATOM 591 OD1 ASP A 39 5.177 13.324 4.639 1.00 0.00 O ATOM 592 OD2 ASP A 39 4.673 14.164 2.672 1.00 0.00 O ATOM 0 H ASP A 39 4.260 11.303 5.353 1.00 0.00 H new ATOM 0 HA ASP A 39 2.461 11.949 3.463 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.379 11.153 3.165 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.454 11.835 1.842 1.00 0.00 H new ATOM 597 N LEU A 40 3.640 8.935 2.755 1.00 0.00 N ATOM 598 CA LEU A 40 3.348 7.707 2.023 1.00 0.00 C ATOM 599 C LEU A 40 2.100 7.027 2.575 1.00 0.00 C ATOM 600 O LEU A 40 1.437 6.262 1.876 1.00 0.00 O ATOM 601 CB LEU A 40 4.540 6.750 2.097 1.00 0.00 C ATOM 602 CG LEU A 40 4.343 5.382 1.444 1.00 0.00 C ATOM 603 CD1 LEU A 40 4.071 5.535 -0.045 1.00 0.00 C ATOM 604 CD2 LEU A 40 5.561 4.500 1.676 1.00 0.00 C ATOM 0 H LEU A 40 4.504 8.908 3.297 1.00 0.00 H new ATOM 0 HA LEU A 40 3.165 7.969 0.981 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.398 7.233 1.630 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.793 6.597 3.146 1.00 0.00 H new ATOM 0 HG LEU A 40 3.478 4.903 1.904 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.933 4.551 -0.493 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.169 6.129 -0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.915 6.035 -0.520 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.403 3.530 1.204 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.442 4.975 1.244 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.712 4.362 2.747 1.00 0.00 H new ATOM 616 N ALA A 41 1.785 7.313 3.834 1.00 0.00 N ATOM 617 CA ALA A 41 0.614 6.733 4.480 1.00 0.00 C ATOM 618 C ALA A 41 -0.652 7.500 4.113 1.00 0.00 C ATOM 619 O ALA A 41 -1.756 6.961 4.180 1.00 0.00 O ATOM 620 CB ALA A 41 0.800 6.710 5.990 1.00 0.00 C ATOM 0 H ALA A 41 2.325 7.943 4.427 1.00 0.00 H new ATOM 0 HA ALA A 41 0.504 5.709 4.123 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -0.082 6.274 6.459 1.00 0.00 H new ATOM 0 HB2 ALA A 41 1.676 6.112 6.240 1.00 0.00 H new ATOM 0 HB3 ALA A 41 0.940 7.728 6.355 1.00 0.00 H new ATOM 626 N GLN A 42 -0.483 8.760 3.726 1.00 0.00 N ATOM 627 CA GLN A 42 -1.613 9.601 3.350 1.00 0.00 C ATOM 628 C GLN A 42 -2.127 9.234 1.962 1.00 0.00 C ATOM 629 O GLN A 42 -3.326 9.034 1.764 1.00 0.00 O ATOM 630 CB GLN A 42 -1.212 11.077 3.384 1.00 0.00 C ATOM 631 CG GLN A 42 -0.726 11.544 4.747 1.00 0.00 C ATOM 632 CD GLN A 42 -0.736 13.053 4.885 1.00 0.00 C ATOM 633 OE1 GLN A 42 0.433 13.634 5.130 1.00 0.00 O flip ATOM 634 NE2 GLN A 42 -1.783 13.691 4.773 1.00 0.00 N flip ATOM 0 H GLN A 42 0.425 9.221 3.665 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.413 9.433 4.070 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.426 11.248 2.649 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -2.066 11.684 3.084 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -1.356 11.108 5.522 1.00 0.00 H new ATOM 0 HG3 GLN A 42 0.286 11.175 4.914 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -2.659 13.204 4.585 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -1.774 14.706 4.869 1.00 0.00 H new ATOM 643 N THR A 43 -1.212 9.147 1.001 1.00 0.00 N ATOM 644 CA THR A 43 -1.572 8.806 -0.369 1.00 0.00 C ATOM 645 C THR A 43 -2.348 7.494 -0.423 1.00 0.00 C ATOM 646 O THR A 43 -3.120 7.256 -1.353 1.00 0.00 O ATOM 647 CB THR A 43 -0.325 8.689 -1.265 1.00 0.00 C ATOM 648 OG1 THR A 43 -0.705 8.753 -2.644 1.00 0.00 O ATOM 649 CG2 THR A 43 0.413 7.386 -0.998 1.00 0.00 C ATOM 0 H THR A 43 -0.215 9.308 1.147 1.00 0.00 H new ATOM 0 HA THR A 43 -2.203 9.614 -0.741 1.00 0.00 H new ATOM 0 HB THR A 43 0.341 9.520 -1.033 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.094 8.679 -3.207 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.290 7.326 -1.643 1.00 0.00 H new ATOM 0 HG22 THR A 43 0.727 7.353 0.045 1.00 0.00 H new ATOM 0 HG23 THR A 43 -0.248 6.544 -1.205 1.00 0.00 H new ATOM 657 N LEU A 44 -2.138 6.647 0.578 1.00 0.00 N ATOM 658 CA LEU A 44 -2.819 5.358 0.645 1.00 0.00 C ATOM 659 C LEU A 44 -3.949 5.392 1.669 1.00 0.00 C ATOM 660 O LEU A 44 -4.938 4.670 1.541 1.00 0.00 O ATOM 661 CB LEU A 44 -1.824 4.252 1.002 1.00 0.00 C ATOM 662 CG LEU A 44 -0.502 4.265 0.235 1.00 0.00 C ATOM 663 CD1 LEU A 44 0.509 3.342 0.898 1.00 0.00 C ATOM 664 CD2 LEU A 44 -0.723 3.863 -1.216 1.00 0.00 C ATOM 0 H LEU A 44 -1.502 6.829 1.354 1.00 0.00 H new ATOM 0 HA LEU A 44 -3.248 5.150 -0.335 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.603 4.319 2.067 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.307 3.289 0.837 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.104 5.279 0.253 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.444 3.364 0.338 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.690 3.675 1.920 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.118 2.324 0.912 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.229 3.878 -1.747 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.145 2.859 -1.255 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.412 4.564 -1.687 1.00 0.00 H new ATOM 676 N ARG A 45 -3.796 6.236 2.684 1.00 0.00 N ATOM 677 CA ARG A 45 -4.804 6.365 3.729 1.00 0.00 C ATOM 678 C ARG A 45 -6.209 6.258 3.145 1.00 0.00 C ATOM 679 O ARG A 45 -7.087 5.618 3.726 1.00 0.00 O ATOM 680 CB ARG A 45 -4.644 7.699 4.460 1.00 0.00 C ATOM 681 CG ARG A 45 -5.717 7.953 5.507 1.00 0.00 C ATOM 682 CD ARG A 45 -5.959 9.441 5.707 1.00 0.00 C ATOM 683 NE ARG A 45 -7.100 9.697 6.582 1.00 0.00 N ATOM 684 CZ ARG A 45 -7.753 10.853 6.619 1.00 0.00 C ATOM 685 NH1 ARG A 45 -7.380 11.854 5.834 1.00 0.00 N ATOM 686 NH2 ARG A 45 -8.781 11.009 7.442 1.00 0.00 N ATOM 0 H ARG A 45 -2.984 6.841 2.805 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.661 5.550 4.439 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.666 7.725 4.941 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.662 8.508 3.730 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.645 7.470 5.203 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.418 7.501 6.453 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.066 9.900 6.132 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -6.131 9.914 4.740 1.00 0.00 H new ATOM 0 HE ARG A 45 -7.413 8.947 7.198 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -6.590 11.737 5.200 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -7.883 12.741 5.864 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.071 10.241 8.047 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -9.282 11.897 7.470 1.00 0.00 H new ATOM 700 N ASP A 46 -6.416 6.888 1.994 1.00 0.00 N ATOM 701 CA ASP A 46 -7.714 6.863 1.331 1.00 0.00 C ATOM 702 C ASP A 46 -8.080 5.445 0.906 1.00 0.00 C ATOM 703 O ASP A 46 -9.142 4.934 1.260 1.00 0.00 O ATOM 704 CB ASP A 46 -7.706 7.788 0.113 1.00 0.00 C ATOM 705 CG ASP A 46 -6.488 7.579 -0.765 1.00 0.00 C ATOM 706 OD1 ASP A 46 -5.391 8.026 -0.372 1.00 0.00 O ATOM 707 OD2 ASP A 46 -6.633 6.968 -1.845 1.00 0.00 O ATOM 0 H ASP A 46 -5.701 7.423 1.501 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.463 7.215 2.040 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.608 7.617 -0.475 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -7.735 8.825 0.448 1.00 0.00 H new ATOM 712 N GLY A 47 -7.193 4.814 0.142 1.00 0.00 N ATOM 713 CA GLY A 47 -7.442 3.461 -0.320 1.00 0.00 C ATOM 714 C GLY A 47 -7.759 3.403 -1.801 1.00 0.00 C ATOM 715 O GLY A 47 -8.433 2.483 -2.264 1.00 0.00 O ATOM 0 H GLY A 47 -6.307 5.216 -0.165 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.568 2.844 -0.114 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.272 3.035 0.243 1.00 0.00 H new ATOM 719 N VAL A 48 -7.273 4.390 -2.547 1.00 0.00 N ATOM 720 CA VAL A 48 -7.509 4.448 -3.985 1.00 0.00 C ATOM 721 C VAL A 48 -6.303 3.930 -4.761 1.00 0.00 C ATOM 722 O VAL A 48 -6.450 3.266 -5.788 1.00 0.00 O ATOM 723 CB VAL A 48 -7.822 5.885 -4.445 1.00 0.00 C ATOM 724 CG1 VAL A 48 -7.970 5.941 -5.957 1.00 0.00 C ATOM 725 CG2 VAL A 48 -9.077 6.401 -3.758 1.00 0.00 C ATOM 0 H VAL A 48 -6.714 5.160 -2.180 1.00 0.00 H new ATOM 0 HA VAL A 48 -8.370 3.812 -4.190 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.989 6.529 -4.162 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.191 6.963 -6.263 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -7.042 5.614 -6.426 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.784 5.286 -6.267 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.284 7.417 -4.094 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -9.920 5.757 -4.009 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.928 6.399 -2.678 1.00 0.00 H new ATOM 735 N LEU A 49 -5.110 4.237 -4.264 1.00 0.00 N ATOM 736 CA LEU A 49 -3.877 3.801 -4.910 1.00 0.00 C ATOM 737 C LEU A 49 -3.582 2.339 -4.591 1.00 0.00 C ATOM 738 O LEU A 49 -3.255 1.552 -5.481 1.00 0.00 O ATOM 739 CB LEU A 49 -2.706 4.678 -4.462 1.00 0.00 C ATOM 740 CG LEU A 49 -1.338 4.321 -5.045 1.00 0.00 C ATOM 741 CD1 LEU A 49 -1.348 4.469 -6.559 1.00 0.00 C ATOM 742 CD2 LEU A 49 -0.252 5.191 -4.430 1.00 0.00 C ATOM 0 H LEU A 49 -4.970 4.786 -3.416 1.00 0.00 H new ATOM 0 HA LEU A 49 -4.006 3.900 -5.988 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.932 5.712 -4.724 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.639 4.632 -3.375 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.122 3.280 -4.803 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.366 4.211 -6.956 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.098 3.803 -6.985 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.586 5.500 -6.822 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.714 4.923 -4.857 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.463 6.239 -4.640 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.228 5.035 -3.351 1.00 0.00 H new ATOM 754 N LEU A 50 -3.702 1.981 -3.318 1.00 0.00 N ATOM 755 CA LEU A 50 -3.451 0.611 -2.881 1.00 0.00 C ATOM 756 C LEU A 50 -4.045 -0.392 -3.865 1.00 0.00 C ATOM 757 O LEU A 50 -3.386 -1.356 -4.257 1.00 0.00 O ATOM 758 CB LEU A 50 -4.039 0.384 -1.487 1.00 0.00 C ATOM 759 CG LEU A 50 -3.111 0.688 -0.310 1.00 0.00 C ATOM 760 CD1 LEU A 50 -3.869 0.593 1.005 1.00 0.00 C ATOM 761 CD2 LEU A 50 -1.920 -0.258 -0.311 1.00 0.00 C ATOM 0 H LEU A 50 -3.971 2.620 -2.570 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.372 0.460 -2.843 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.933 0.999 -1.387 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.357 -0.656 -1.414 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.739 1.707 -0.419 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.193 0.812 1.831 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.688 1.312 1.006 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.270 -0.414 1.122 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.271 -0.027 0.533 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.272 -1.286 -0.227 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.362 -0.140 -1.240 1.00 0.00 H new ATOM 773 N CYS A 51 -5.290 -0.157 -4.262 1.00 0.00 N ATOM 774 CA CYS A 51 -5.972 -1.039 -5.203 1.00 0.00 C ATOM 775 C CYS A 51 -5.244 -1.073 -6.542 1.00 0.00 C ATOM 776 O CYS A 51 -5.105 -2.130 -7.157 1.00 0.00 O ATOM 777 CB CYS A 51 -7.418 -0.582 -5.406 1.00 0.00 C ATOM 778 SG CYS A 51 -8.522 -0.996 -4.035 1.00 0.00 S ATOM 0 H CYS A 51 -5.848 0.637 -3.947 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.972 -2.046 -4.785 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -7.429 0.498 -5.554 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -7.806 -1.033 -6.319 1.00 0.00 H new ATOM 0 HG CYS A 51 -9.024 0.095 -3.538 1.00 0.00 H new ATOM 784 N GLN A 52 -4.783 0.091 -6.989 1.00 0.00 N ATOM 785 CA GLN A 52 -4.072 0.194 -8.258 1.00 0.00 C ATOM 786 C GLN A 52 -2.859 -0.731 -8.278 1.00 0.00 C ATOM 787 O GLN A 52 -2.661 -1.491 -9.227 1.00 0.00 O ATOM 788 CB GLN A 52 -3.630 1.638 -8.503 1.00 0.00 C ATOM 789 CG GLN A 52 -4.787 2.621 -8.587 1.00 0.00 C ATOM 790 CD GLN A 52 -4.486 3.799 -9.493 1.00 0.00 C ATOM 791 OE1 GLN A 52 -3.386 4.353 -9.466 1.00 0.00 O ATOM 792 NE2 GLN A 52 -5.464 4.190 -10.301 1.00 0.00 N ATOM 0 H GLN A 52 -4.889 0.975 -6.492 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.752 -0.111 -9.053 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.960 1.946 -7.700 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.058 1.682 -9.430 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.673 2.103 -8.953 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -5.022 2.987 -7.587 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -6.360 3.702 -10.291 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.320 4.978 -10.932 1.00 0.00 H new ATOM 801 N LEU A 53 -2.051 -0.663 -7.226 1.00 0.00 N ATOM 802 CA LEU A 53 -0.857 -1.494 -7.123 1.00 0.00 C ATOM 803 C LEU A 53 -1.112 -2.886 -7.693 1.00 0.00 C ATOM 804 O LEU A 53 -0.462 -3.303 -8.653 1.00 0.00 O ATOM 805 CB LEU A 53 -0.411 -1.602 -5.664 1.00 0.00 C ATOM 806 CG LEU A 53 0.672 -2.640 -5.368 1.00 0.00 C ATOM 807 CD1 LEU A 53 1.986 -2.241 -6.022 1.00 0.00 C ATOM 808 CD2 LEU A 53 0.851 -2.811 -3.866 1.00 0.00 C ATOM 0 H LEU A 53 -2.201 -0.041 -6.432 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.065 -1.023 -7.705 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.048 -0.626 -5.343 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.284 -1.834 -5.054 1.00 0.00 H new ATOM 0 HG LEU A 53 0.357 -3.596 -5.787 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.745 -2.991 -5.801 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.849 -2.171 -7.101 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.307 -1.274 -5.634 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.626 -3.553 -3.674 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.144 -1.859 -3.424 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.088 -3.143 -3.423 1.00 0.00 H new ATOM 820 N LEU A 54 -2.061 -3.599 -7.098 1.00 0.00 N ATOM 821 CA LEU A 54 -2.404 -4.943 -7.548 1.00 0.00 C ATOM 822 C LEU A 54 -2.789 -4.942 -9.024 1.00 0.00 C ATOM 823 O LEU A 54 -2.420 -5.845 -9.773 1.00 0.00 O ATOM 824 CB LEU A 54 -3.554 -5.505 -6.710 1.00 0.00 C ATOM 825 CG LEU A 54 -3.315 -5.570 -5.201 1.00 0.00 C ATOM 826 CD1 LEU A 54 -4.520 -6.172 -4.495 1.00 0.00 C ATOM 827 CD2 LEU A 54 -2.059 -6.372 -4.894 1.00 0.00 C ATOM 0 H LEU A 54 -2.607 -3.269 -6.302 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.526 -5.577 -7.421 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.440 -4.897 -6.891 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.779 -6.510 -7.066 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.173 -4.555 -4.831 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.332 -6.210 -3.422 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.399 -5.557 -4.687 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.694 -7.181 -4.869 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.905 -6.408 -3.816 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.172 -7.386 -5.278 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.200 -5.898 -5.368 1.00 0.00 H new ATOM 839 N ASN A 55 -3.532 -3.920 -9.436 1.00 0.00 N ATOM 840 CA ASN A 55 -3.966 -3.799 -10.823 1.00 0.00 C ATOM 841 C ASN A 55 -2.768 -3.648 -11.756 1.00 0.00 C ATOM 842 O ASN A 55 -2.848 -3.967 -12.942 1.00 0.00 O ATOM 843 CB ASN A 55 -4.906 -2.603 -10.983 1.00 0.00 C ATOM 844 CG ASN A 55 -6.236 -2.815 -10.286 1.00 0.00 C ATOM 845 OD1 ASN A 55 -6.622 -3.947 -9.992 1.00 0.00 O ATOM 846 ND2 ASN A 55 -6.943 -1.724 -10.017 1.00 0.00 N ATOM 0 H ASN A 55 -3.846 -3.163 -8.829 1.00 0.00 H new ATOM 0 HA ASN A 55 -4.501 -4.710 -11.091 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -4.426 -1.711 -10.580 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.080 -2.420 -12.043 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.845 -1.804 -9.548 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -6.584 -0.806 -10.279 1.00 0.00 H new ATOM 853 N ASN A 56 -1.659 -3.160 -11.211 1.00 0.00 N ATOM 854 CA ASN A 56 -0.444 -2.966 -11.995 1.00 0.00 C ATOM 855 C ASN A 56 0.298 -4.285 -12.182 1.00 0.00 C ATOM 856 O ASN A 56 0.752 -4.604 -13.282 1.00 0.00 O ATOM 857 CB ASN A 56 0.470 -1.946 -11.313 1.00 0.00 C ATOM 858 CG ASN A 56 0.170 -0.523 -11.743 1.00 0.00 C ATOM 859 OD1 ASN A 56 0.287 -0.180 -12.919 1.00 0.00 O ATOM 860 ND2 ASN A 56 -0.220 0.314 -10.788 1.00 0.00 N ATOM 0 H ASN A 56 -1.576 -2.892 -10.230 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.730 -2.588 -12.976 1.00 0.00 H new ATOM 0 HB2 ASN A 56 0.358 -2.027 -10.232 1.00 0.00 H new ATOM 0 HB3 ASN A 56 1.509 -2.181 -11.544 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -0.436 1.284 -11.017 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.303 -0.014 -9.826 1.00 0.00 H new ATOM 867 N LEU A 57 0.419 -5.049 -11.102 1.00 0.00 N ATOM 868 CA LEU A 57 1.106 -6.335 -11.147 1.00 0.00 C ATOM 869 C LEU A 57 0.268 -7.375 -11.884 1.00 0.00 C ATOM 870 O LEU A 57 0.732 -7.997 -12.839 1.00 0.00 O ATOM 871 CB LEU A 57 1.412 -6.821 -9.729 1.00 0.00 C ATOM 872 CG LEU A 57 2.002 -5.782 -8.776 1.00 0.00 C ATOM 873 CD1 LEU A 57 2.146 -6.362 -7.377 1.00 0.00 C ATOM 874 CD2 LEU A 57 3.346 -5.289 -9.291 1.00 0.00 C ATOM 0 H LEU A 57 0.050 -4.800 -10.184 1.00 0.00 H new ATOM 0 HA LEU A 57 2.042 -6.201 -11.689 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.490 -7.204 -9.291 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.106 -7.659 -9.796 1.00 0.00 H new ATOM 0 HG LEU A 57 1.320 -4.933 -8.727 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.568 -5.608 -6.712 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.167 -6.666 -7.007 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.807 -7.228 -7.409 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.751 -4.550 -8.600 1.00 0.00 H new ATOM 0 HD22 LEU A 57 4.036 -6.129 -9.370 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.215 -4.834 -10.273 1.00 0.00 H new ATOM 886 N ARG A 58 -0.970 -7.556 -11.435 1.00 0.00 N ATOM 887 CA ARG A 58 -1.874 -8.519 -12.052 1.00 0.00 C ATOM 888 C ARG A 58 -3.020 -7.809 -12.766 1.00 0.00 C ATOM 889 O ARG A 58 -3.286 -6.634 -12.517 1.00 0.00 O ATOM 890 CB ARG A 58 -2.430 -9.477 -10.998 1.00 0.00 C ATOM 891 CG ARG A 58 -2.710 -10.873 -11.530 1.00 0.00 C ATOM 892 CD ARG A 58 -3.899 -11.509 -10.828 1.00 0.00 C ATOM 893 NE ARG A 58 -5.153 -11.244 -11.527 1.00 0.00 N ATOM 894 CZ ARG A 58 -6.249 -11.980 -11.377 1.00 0.00 C ATOM 895 NH1 ARG A 58 -6.245 -13.020 -10.556 1.00 0.00 N ATOM 896 NH2 ARG A 58 -7.352 -11.675 -12.048 1.00 0.00 N ATOM 0 H ARG A 58 -1.370 -7.048 -10.646 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.309 -9.090 -12.789 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -1.721 -9.547 -10.173 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -3.352 -9.061 -10.591 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.903 -10.823 -12.602 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.828 -11.499 -11.394 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.744 -12.586 -10.757 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -3.965 -11.128 -9.809 1.00 0.00 H new ATOM 0 HE ARG A 58 -5.190 -10.450 -12.166 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -5.399 -13.257 -10.037 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -7.088 -13.583 -10.443 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -7.359 -10.875 -12.680 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -8.193 -12.241 -11.932 1.00 0.00 H new ATOM 910 N ALA A 59 -3.695 -8.531 -13.654 1.00 0.00 N ATOM 911 CA ALA A 59 -4.814 -7.971 -14.403 1.00 0.00 C ATOM 912 C ALA A 59 -6.147 -8.384 -13.788 1.00 0.00 C ATOM 913 O ALA A 59 -6.296 -9.503 -13.298 1.00 0.00 O ATOM 914 CB ALA A 59 -4.745 -8.407 -15.859 1.00 0.00 C ATOM 0 H ALA A 59 -3.487 -9.505 -13.873 1.00 0.00 H new ATOM 0 HA ALA A 59 -4.743 -6.884 -14.357 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.586 -7.982 -16.406 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.811 -8.057 -16.300 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.788 -9.495 -15.916 1.00 0.00 H new ATOM 920 N HIS A 60 -7.114 -7.472 -13.817 1.00 0.00 N ATOM 921 CA HIS A 60 -8.435 -7.741 -13.262 1.00 0.00 C ATOM 922 C HIS A 60 -8.354 -7.980 -11.757 1.00 0.00 C ATOM 923 O HIS A 60 -9.205 -8.656 -11.179 1.00 0.00 O ATOM 924 CB HIS A 60 -9.063 -8.954 -13.949 1.00 0.00 C ATOM 925 CG HIS A 60 -9.312 -8.752 -15.412 1.00 0.00 C ATOM 926 ND1 HIS A 60 -10.353 -7.990 -15.900 1.00 0.00 N ATOM 927 CD2 HIS A 60 -8.647 -9.215 -16.496 1.00 0.00 C ATOM 928 CE1 HIS A 60 -10.318 -7.995 -17.220 1.00 0.00 C ATOM 929 NE2 HIS A 60 -9.292 -8.731 -17.607 1.00 0.00 N ATOM 0 H HIS A 60 -7.007 -6.541 -14.219 1.00 0.00 H new ATOM 0 HA HIS A 60 -9.061 -6.867 -13.440 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -8.409 -9.816 -13.816 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -10.007 -9.191 -13.458 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -7.772 -9.848 -16.488 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -11.011 -7.484 -17.872 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -9.023 -8.911 -18.574 1.00 0.00 H new ATOM 938 N SER A 61 -7.325 -7.421 -11.129 1.00 0.00 N ATOM 939 CA SER A 61 -7.131 -7.577 -9.692 1.00 0.00 C ATOM 940 C SER A 61 -8.192 -6.805 -8.913 1.00 0.00 C ATOM 941 O SER A 61 -8.715 -7.290 -7.909 1.00 0.00 O ATOM 942 CB SER A 61 -5.735 -7.094 -9.289 1.00 0.00 C ATOM 943 OG SER A 61 -4.786 -7.380 -10.302 1.00 0.00 O ATOM 0 H SER A 61 -6.613 -6.856 -11.592 1.00 0.00 H new ATOM 0 HA SER A 61 -7.226 -8.636 -9.451 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.758 -6.021 -9.100 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.435 -7.575 -8.358 1.00 0.00 H new ATOM 0 HG SER A 61 -3.928 -6.965 -10.073 1.00 0.00 H new ATOM 949 N ILE A 62 -8.504 -5.602 -9.383 1.00 0.00 N ATOM 950 CA ILE A 62 -9.503 -4.764 -8.733 1.00 0.00 C ATOM 951 C ILE A 62 -10.166 -3.822 -9.732 1.00 0.00 C ATOM 952 O ILE A 62 -9.489 -3.096 -10.458 1.00 0.00 O ATOM 953 CB ILE A 62 -8.885 -3.933 -7.593 1.00 0.00 C ATOM 954 CG1 ILE A 62 -8.130 -4.842 -6.621 1.00 0.00 C ATOM 955 CG2 ILE A 62 -9.965 -3.148 -6.863 1.00 0.00 C ATOM 956 CD1 ILE A 62 -7.446 -4.092 -5.500 1.00 0.00 C ATOM 0 H ILE A 62 -8.079 -5.186 -10.212 1.00 0.00 H new ATOM 0 HA ILE A 62 -10.255 -5.435 -8.317 1.00 0.00 H new ATOM 0 HB ILE A 62 -8.177 -3.225 -8.023 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -8.828 -5.562 -6.193 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.384 -5.412 -7.174 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -9.512 -2.566 -6.060 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -10.462 -2.476 -7.563 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.696 -3.839 -6.442 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -6.931 -4.799 -4.850 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.723 -3.391 -5.919 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.190 -3.544 -4.922 1.00 0.00 H new ATOM 968 N ASN A 63 -11.494 -3.839 -9.762 1.00 0.00 N ATOM 969 CA ASN A 63 -12.250 -2.985 -10.671 1.00 0.00 C ATOM 970 C ASN A 63 -12.365 -1.568 -10.117 1.00 0.00 C ATOM 971 O ASN A 63 -13.067 -1.330 -9.133 1.00 0.00 O ATOM 972 CB ASN A 63 -13.645 -3.567 -10.910 1.00 0.00 C ATOM 973 CG ASN A 63 -14.361 -2.895 -12.066 1.00 0.00 C ATOM 974 OD1 ASN A 63 -13.860 -1.931 -12.645 1.00 0.00 O ATOM 975 ND2 ASN A 63 -15.539 -3.404 -12.407 1.00 0.00 N ATOM 0 H ASN A 63 -12.070 -4.435 -9.167 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.715 -2.943 -11.620 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.561 -4.635 -11.110 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -14.241 -3.458 -10.004 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -16.068 -2.995 -13.177 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -15.915 -4.204 -11.898 1.00 0.00 H new ATOM 982 N LEU A 64 -11.674 -0.631 -10.756 1.00 0.00 N ATOM 983 CA LEU A 64 -11.699 0.763 -10.328 1.00 0.00 C ATOM 984 C LEU A 64 -13.121 1.207 -10.000 1.00 0.00 C ATOM 985 O LEU A 64 -13.337 2.023 -9.105 1.00 0.00 O ATOM 986 CB LEU A 64 -11.111 1.662 -11.418 1.00 0.00 C ATOM 987 CG LEU A 64 -9.646 1.412 -11.776 1.00 0.00 C ATOM 988 CD1 LEU A 64 -9.258 2.199 -13.018 1.00 0.00 C ATOM 989 CD2 LEU A 64 -8.741 1.777 -10.607 1.00 0.00 C ATOM 0 H LEU A 64 -11.090 -0.811 -11.572 1.00 0.00 H new ATOM 0 HA LEU A 64 -11.093 0.851 -9.426 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.710 1.544 -12.321 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.215 2.700 -11.100 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.520 0.350 -11.989 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.212 2.008 -13.257 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.884 1.890 -13.855 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.400 3.264 -12.833 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.702 1.593 -10.880 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.870 2.831 -10.362 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.002 1.169 -9.741 1.00 0.00 H new ATOM 1001 N LYS A 65 -14.088 0.661 -10.729 1.00 0.00 N ATOM 1002 CA LYS A 65 -15.491 0.997 -10.514 1.00 0.00 C ATOM 1003 C LYS A 65 -15.964 0.508 -9.149 1.00 0.00 C ATOM 1004 O LYS A 65 -16.755 1.174 -8.482 1.00 0.00 O ATOM 1005 CB LYS A 65 -16.358 0.384 -11.616 1.00 0.00 C ATOM 1006 CG LYS A 65 -15.928 0.778 -13.019 1.00 0.00 C ATOM 1007 CD LYS A 65 -16.169 2.256 -13.280 1.00 0.00 C ATOM 1008 CE LYS A 65 -15.723 2.654 -14.679 1.00 0.00 C ATOM 1009 NZ LYS A 65 -16.513 3.800 -15.207 1.00 0.00 N ATOM 0 H LYS A 65 -13.926 -0.016 -11.474 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.588 2.082 -10.545 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.329 -0.702 -11.528 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.393 0.688 -11.464 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -14.870 0.551 -13.154 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.477 0.184 -13.750 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -17.229 2.480 -13.157 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -15.630 2.850 -12.542 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -14.666 2.919 -14.662 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -15.827 1.801 -15.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -16.179 4.041 -16.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -17.519 3.539 -15.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -16.394 4.622 -14.581 1.00 0.00 H new ATOM 1023 N GLU A 66 -15.474 -0.658 -8.740 1.00 0.00 N ATOM 1024 CA GLU A 66 -15.847 -1.235 -7.454 1.00 0.00 C ATOM 1025 C GLU A 66 -15.328 -0.378 -6.303 1.00 0.00 C ATOM 1026 O GLU A 66 -15.784 -0.505 -5.166 1.00 0.00 O ATOM 1027 CB GLU A 66 -15.303 -2.659 -7.331 1.00 0.00 C ATOM 1028 CG GLU A 66 -16.202 -3.711 -7.959 1.00 0.00 C ATOM 1029 CD GLU A 66 -16.090 -5.059 -7.274 1.00 0.00 C ATOM 1030 OE1 GLU A 66 -14.957 -5.570 -7.150 1.00 0.00 O ATOM 1031 OE2 GLU A 66 -17.135 -5.603 -6.861 1.00 0.00 O ATOM 0 H GLU A 66 -14.818 -1.221 -9.281 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.935 -1.265 -7.400 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.321 -2.705 -7.801 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.163 -2.896 -6.276 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -17.237 -3.371 -7.917 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.945 -3.821 -9.013 1.00 0.00 H new ATOM 1038 N ILE A 67 -14.371 0.492 -6.606 1.00 0.00 N ATOM 1039 CA ILE A 67 -13.789 1.369 -5.598 1.00 0.00 C ATOM 1040 C ILE A 67 -14.136 2.829 -5.872 1.00 0.00 C ATOM 1041 O ILE A 67 -13.939 3.326 -6.980 1.00 0.00 O ATOM 1042 CB ILE A 67 -12.257 1.220 -5.537 1.00 0.00 C ATOM 1043 CG1 ILE A 67 -11.652 1.384 -6.933 1.00 0.00 C ATOM 1044 CG2 ILE A 67 -11.880 -0.130 -4.945 1.00 0.00 C ATOM 1045 CD1 ILE A 67 -10.139 1.366 -6.941 1.00 0.00 C ATOM 0 H ILE A 67 -13.982 0.608 -7.542 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.213 1.071 -4.639 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.855 2.002 -4.893 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -12.020 0.585 -7.576 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.999 2.324 -7.362 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.794 -0.221 -4.908 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.285 -0.211 -3.936 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -12.290 -0.927 -5.566 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.779 1.487 -7.963 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.762 2.182 -6.324 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -9.784 0.416 -6.542 1.00 0.00 H new ATOM 1057 N ASN A 68 -14.652 3.510 -4.854 1.00 0.00 N ATOM 1058 CA ASN A 68 -15.025 4.914 -4.986 1.00 0.00 C ATOM 1059 C ASN A 68 -13.791 5.789 -5.182 1.00 0.00 C ATOM 1060 O ASN A 68 -13.016 6.008 -4.250 1.00 0.00 O ATOM 1061 CB ASN A 68 -15.799 5.375 -3.749 1.00 0.00 C ATOM 1062 CG ASN A 68 -17.077 4.586 -3.540 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -17.898 4.459 -4.449 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -17.252 4.051 -2.337 1.00 0.00 N ATOM 0 H ASN A 68 -14.821 3.113 -3.930 1.00 0.00 H new ATOM 0 HA ASN A 68 -15.662 5.014 -5.865 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -15.165 5.274 -2.868 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -16.041 6.433 -3.848 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -18.093 3.510 -2.137 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -16.545 4.182 -1.613 1.00 0.00 H new ATOM 1071 N LEU A 69 -13.614 6.287 -6.401 1.00 0.00 N ATOM 1072 CA LEU A 69 -12.474 7.140 -6.721 1.00 0.00 C ATOM 1073 C LEU A 69 -12.748 8.587 -6.323 1.00 0.00 C ATOM 1074 O LEU A 69 -13.833 9.113 -6.568 1.00 0.00 O ATOM 1075 CB LEU A 69 -12.156 7.060 -8.215 1.00 0.00 C ATOM 1076 CG LEU A 69 -11.625 5.717 -8.718 1.00 0.00 C ATOM 1077 CD1 LEU A 69 -11.842 5.585 -10.217 1.00 0.00 C ATOM 1078 CD2 LEU A 69 -10.150 5.565 -8.375 1.00 0.00 C ATOM 0 H LEU A 69 -14.245 6.115 -7.184 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.614 6.784 -6.154 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -13.061 7.302 -8.772 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -11.421 7.830 -8.451 1.00 0.00 H new ATOM 0 HG LEU A 69 -12.177 4.920 -8.220 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.458 4.623 -10.557 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.908 5.649 -10.437 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.316 6.388 -10.733 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.789 4.604 -8.740 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.583 6.368 -8.845 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -10.021 5.614 -7.294 1.00 0.00 H new ATOM 1090 N ARG A 70 -11.755 9.225 -5.712 1.00 0.00 N ATOM 1091 CA ARG A 70 -11.889 10.611 -5.281 1.00 0.00 C ATOM 1092 C ARG A 70 -12.789 10.715 -4.054 1.00 0.00 C ATOM 1093 O ARG A 70 -13.770 11.458 -4.034 1.00 0.00 O ATOM 1094 CB ARG A 70 -12.455 11.467 -6.416 1.00 0.00 C ATOM 1095 CG ARG A 70 -12.216 12.957 -6.233 1.00 0.00 C ATOM 1096 CD ARG A 70 -12.896 13.768 -7.325 1.00 0.00 C ATOM 1097 NE ARG A 70 -12.080 13.851 -8.533 1.00 0.00 N ATOM 1098 CZ ARG A 70 -10.975 14.582 -8.625 1.00 0.00 C ATOM 1099 NH1 ARG A 70 -10.556 15.291 -7.586 1.00 0.00 N ATOM 1100 NH2 ARG A 70 -10.286 14.606 -9.759 1.00 0.00 N ATOM 0 H ARG A 70 -10.849 8.804 -5.504 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.898 10.980 -5.015 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -12.007 11.149 -7.358 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -13.527 11.287 -6.496 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -12.591 13.270 -5.259 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -11.145 13.159 -6.242 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -13.857 13.315 -7.567 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -13.101 14.773 -6.956 1.00 0.00 H new ATOM 0 HE ARG A 70 -12.375 13.318 -9.351 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -11.083 15.276 -6.713 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -9.707 15.851 -7.660 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -10.605 14.063 -10.561 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -9.438 15.168 -9.828 1.00 0.00 H new ATOM 1114 N PRO A 71 -12.448 9.953 -3.003 1.00 0.00 N ATOM 1115 CA PRO A 71 -13.212 9.942 -1.752 1.00 0.00 C ATOM 1116 C PRO A 71 -13.071 11.247 -0.976 1.00 0.00 C ATOM 1117 O PRO A 71 -13.607 11.386 0.124 1.00 0.00 O ATOM 1118 CB PRO A 71 -12.591 8.784 -0.968 1.00 0.00 C ATOM 1119 CG PRO A 71 -11.207 8.662 -1.505 1.00 0.00 C ATOM 1120 CD PRO A 71 -11.290 9.045 -2.957 1.00 0.00 C ATOM 0 HA PRO A 71 -14.282 9.830 -1.928 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -12.584 8.990 0.102 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -13.154 7.862 -1.112 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.521 9.317 -0.968 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.832 7.645 -1.391 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -10.379 9.538 -3.296 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.437 8.173 -3.595 1.00 0.00 H new ATOM 1128 N GLN A 72 -12.349 12.200 -1.555 1.00 0.00 N ATOM 1129 CA GLN A 72 -12.139 13.494 -0.916 1.00 0.00 C ATOM 1130 C GLN A 72 -11.791 13.322 0.559 1.00 0.00 C ATOM 1131 O GLN A 72 -12.311 14.036 1.416 1.00 0.00 O ATOM 1132 CB GLN A 72 -13.387 14.366 -1.060 1.00 0.00 C ATOM 1133 CG GLN A 72 -13.612 14.878 -2.474 1.00 0.00 C ATOM 1134 CD GLN A 72 -14.734 15.895 -2.555 1.00 0.00 C ATOM 1135 OE1 GLN A 72 -15.886 15.592 -2.242 1.00 0.00 O ATOM 1136 NE2 GLN A 72 -14.402 17.110 -2.976 1.00 0.00 N ATOM 0 H GLN A 72 -11.899 12.101 -2.465 1.00 0.00 H new ATOM 0 HA GLN A 72 -11.302 13.985 -1.413 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -14.259 13.792 -0.747 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -13.306 15.217 -0.383 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -12.691 15.329 -2.844 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -13.841 14.037 -3.129 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -13.435 17.317 -3.225 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -15.114 17.836 -3.050 1.00 0.00 H new ATOM 1145 N MET A 73 -10.909 12.371 0.847 1.00 0.00 N ATOM 1146 CA MET A 73 -10.492 12.107 2.219 1.00 0.00 C ATOM 1147 C MET A 73 -11.702 11.960 3.137 1.00 0.00 C ATOM 1148 O MET A 73 -11.741 12.536 4.224 1.00 0.00 O ATOM 1149 CB MET A 73 -9.587 13.231 2.725 1.00 0.00 C ATOM 1150 CG MET A 73 -8.189 13.201 2.128 1.00 0.00 C ATOM 1151 SD MET A 73 -8.205 13.100 0.328 1.00 0.00 S ATOM 1152 CE MET A 73 -8.085 11.329 0.087 1.00 0.00 C ATOM 0 H MET A 73 -10.469 11.771 0.149 1.00 0.00 H new ATOM 0 HA MET A 73 -9.935 11.170 2.229 1.00 0.00 H new ATOM 0 HB2 MET A 73 -10.051 14.191 2.496 1.00 0.00 H new ATOM 0 HB3 MET A 73 -9.511 13.165 3.810 1.00 0.00 H new ATOM 0 HG2 MET A 73 -7.649 14.097 2.433 1.00 0.00 H new ATOM 0 HG3 MET A 73 -7.644 12.347 2.531 1.00 0.00 H new ATOM 0 HE1 MET A 73 -7.184 11.099 -0.482 1.00 0.00 H new ATOM 0 HE2 MET A 73 -8.038 10.832 1.056 1.00 0.00 H new ATOM 0 HE3 MET A 73 -8.959 10.976 -0.460 1.00 0.00 H new ATOM 1162 N SER A 74 -12.687 11.188 2.691 1.00 0.00 N ATOM 1163 CA SER A 74 -13.900 10.969 3.471 1.00 0.00 C ATOM 1164 C SER A 74 -13.693 9.861 4.499 1.00 0.00 C ATOM 1165 O SER A 74 -12.612 9.281 4.591 1.00 0.00 O ATOM 1166 CB SER A 74 -15.067 10.613 2.548 1.00 0.00 C ATOM 1167 OG SER A 74 -16.297 10.628 3.253 1.00 0.00 O ATOM 0 H SER A 74 -12.669 10.703 1.794 1.00 0.00 H new ATOM 0 HA SER A 74 -14.133 11.892 4.001 1.00 0.00 H new ATOM 0 HB2 SER A 74 -15.110 11.321 1.721 1.00 0.00 H new ATOM 0 HB3 SER A 74 -14.904 9.626 2.115 1.00 0.00 H new ATOM 0 HG SER A 74 -17.028 10.399 2.641 1.00 0.00 H new ATOM 1173 N GLN A 75 -14.738 9.574 5.268 1.00 0.00 N ATOM 1174 CA GLN A 75 -14.671 8.536 6.290 1.00 0.00 C ATOM 1175 C GLN A 75 -15.389 7.272 5.831 1.00 0.00 C ATOM 1176 O GLN A 75 -14.918 6.159 6.063 1.00 0.00 O ATOM 1177 CB GLN A 75 -15.284 9.039 7.598 1.00 0.00 C ATOM 1178 CG GLN A 75 -15.242 8.016 8.723 1.00 0.00 C ATOM 1179 CD GLN A 75 -15.914 8.512 9.988 1.00 0.00 C ATOM 1180 OE1 GLN A 75 -16.051 9.717 10.201 1.00 0.00 O ATOM 1181 NE2 GLN A 75 -16.338 7.583 10.836 1.00 0.00 N ATOM 0 H GLN A 75 -15.640 10.045 5.203 1.00 0.00 H new ATOM 0 HA GLN A 75 -13.622 8.294 6.458 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -14.755 9.938 7.915 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -16.320 9.326 7.417 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -15.729 7.099 8.393 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -14.204 7.765 8.942 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -16.204 6.595 10.619 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -16.798 7.857 11.704 1.00 0.00 H new ATOM 1190 N PHE A 76 -16.532 7.452 5.177 1.00 0.00 N ATOM 1191 CA PHE A 76 -17.317 6.325 4.686 1.00 0.00 C ATOM 1192 C PHE A 76 -16.711 5.757 3.406 1.00 0.00 C ATOM 1193 O PHE A 76 -16.641 4.541 3.224 1.00 0.00 O ATOM 1194 CB PHE A 76 -18.763 6.755 4.431 1.00 0.00 C ATOM 1195 CG PHE A 76 -19.760 5.649 4.623 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -20.116 5.231 5.895 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -20.343 5.027 3.530 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -21.033 4.212 6.073 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -21.261 4.008 3.702 1.00 0.00 C ATOM 1200 CZ PHE A 76 -21.607 3.601 4.976 1.00 0.00 C ATOM 0 H PHE A 76 -16.935 8.367 4.975 1.00 0.00 H new ATOM 0 HA PHE A 76 -17.306 5.547 5.450 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -19.012 7.578 5.101 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -18.846 7.136 3.413 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -19.672 5.707 6.757 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -20.077 5.342 2.532 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -21.300 3.894 7.070 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -21.707 3.531 2.842 1.00 0.00 H new ATOM 0 HZ PHE A 76 -22.325 2.806 5.114 1.00 0.00 H new ATOM 1210 N LEU A 77 -16.273 6.646 2.521 1.00 0.00 N ATOM 1211 CA LEU A 77 -15.673 6.236 1.256 1.00 0.00 C ATOM 1212 C LEU A 77 -14.294 5.623 1.482 1.00 0.00 C ATOM 1213 O LEU A 77 -14.078 4.441 1.214 1.00 0.00 O ATOM 1214 CB LEU A 77 -15.564 7.431 0.309 1.00 0.00 C ATOM 1215 CG LEU A 77 -16.824 8.284 0.156 1.00 0.00 C ATOM 1216 CD1 LEU A 77 -16.552 9.483 -0.738 1.00 0.00 C ATOM 1217 CD2 LEU A 77 -17.968 7.450 -0.401 1.00 0.00 C ATOM 0 H LEU A 77 -16.322 7.656 2.656 1.00 0.00 H new ATOM 0 HA LEU A 77 -16.317 5.481 0.804 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.755 8.073 0.658 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -15.277 7.063 -0.676 1.00 0.00 H new ATOM 0 HG LEU A 77 -17.113 8.650 1.141 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -17.460 10.078 -0.835 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -15.763 10.094 -0.298 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -16.237 9.138 -1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -18.856 8.073 -0.503 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -17.688 7.054 -1.377 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -18.180 6.624 0.278 1.00 0.00 H new ATOM 1229 N CYS A 78 -13.366 6.435 1.976 1.00 0.00 N ATOM 1230 CA CYS A 78 -12.008 5.973 2.240 1.00 0.00 C ATOM 1231 C CYS A 78 -12.020 4.606 2.916 1.00 0.00 C ATOM 1232 O CYS A 78 -11.490 3.631 2.381 1.00 0.00 O ATOM 1233 CB CYS A 78 -11.264 6.982 3.115 1.00 0.00 C ATOM 1234 SG CYS A 78 -10.820 8.513 2.262 1.00 0.00 S ATOM 0 H CYS A 78 -13.529 7.416 2.202 1.00 0.00 H new ATOM 0 HA CYS A 78 -11.491 5.881 1.285 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -11.884 7.226 3.977 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -10.356 6.515 3.497 1.00 0.00 H new ATOM 0 HG CYS A 78 -9.862 9.108 2.909 1.00 0.00 H new ATOM 1240 N LEU A 79 -12.626 4.541 4.096 1.00 0.00 N ATOM 1241 CA LEU A 79 -12.707 3.294 4.849 1.00 0.00 C ATOM 1242 C LEU A 79 -13.060 2.127 3.932 1.00 0.00 C ATOM 1243 O LEU A 79 -12.285 1.181 3.786 1.00 0.00 O ATOM 1244 CB LEU A 79 -13.747 3.414 5.964 1.00 0.00 C ATOM 1245 CG LEU A 79 -13.254 4.018 7.279 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -14.427 4.337 8.193 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -12.280 3.073 7.968 1.00 0.00 C ATOM 0 H LEU A 79 -13.069 5.338 4.553 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.730 3.102 5.292 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.576 4.020 5.597 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -14.145 2.421 6.170 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.731 4.948 7.056 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -14.057 4.766 9.124 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.087 5.052 7.702 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.979 3.422 8.409 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -11.939 3.519 8.902 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -12.778 2.127 8.178 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.424 2.895 7.317 1.00 0.00 H new ATOM 1259 N LYS A 80 -14.233 2.201 3.313 1.00 0.00 N ATOM 1260 CA LYS A 80 -14.689 1.154 2.407 1.00 0.00 C ATOM 1261 C LYS A 80 -13.600 0.793 1.401 1.00 0.00 C ATOM 1262 O LYS A 80 -13.171 -0.357 1.322 1.00 0.00 O ATOM 1263 CB LYS A 80 -15.951 1.604 1.668 1.00 0.00 C ATOM 1264 CG LYS A 80 -16.847 0.454 1.239 1.00 0.00 C ATOM 1265 CD LYS A 80 -16.278 -0.276 0.034 1.00 0.00 C ATOM 1266 CE LYS A 80 -16.469 0.525 -1.244 1.00 0.00 C ATOM 1267 NZ LYS A 80 -17.905 0.630 -1.625 1.00 0.00 N ATOM 0 H LYS A 80 -14.886 2.977 3.423 1.00 0.00 H new ATOM 0 HA LYS A 80 -14.919 0.269 3.001 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.519 2.276 2.312 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.661 2.176 0.787 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.965 -0.245 2.067 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -17.840 0.835 1.000 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.216 -0.466 0.190 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.764 -1.246 -0.068 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.055 1.524 -1.111 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -15.912 0.054 -2.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -17.980 0.903 -2.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.370 -0.289 -1.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.369 1.349 -1.034 1.00 0.00 H new ATOM 1281 N ASN A 81 -13.157 1.785 0.635 1.00 0.00 N ATOM 1282 CA ASN A 81 -12.117 1.572 -0.365 1.00 0.00 C ATOM 1283 C ASN A 81 -11.055 0.605 0.151 1.00 0.00 C ATOM 1284 O ASN A 81 -10.854 -0.471 -0.413 1.00 0.00 O ATOM 1285 CB ASN A 81 -11.468 2.903 -0.748 1.00 0.00 C ATOM 1286 CG ASN A 81 -12.456 3.870 -1.371 1.00 0.00 C ATOM 1287 OD1 ASN A 81 -13.584 3.499 -1.695 1.00 0.00 O ATOM 1288 ND2 ASN A 81 -12.035 5.119 -1.540 1.00 0.00 N ATOM 0 H ASN A 81 -13.502 2.744 0.688 1.00 0.00 H new ATOM 0 HA ASN A 81 -12.582 1.135 -1.249 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -11.028 3.358 0.139 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.653 2.719 -1.448 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -12.656 5.815 -1.953 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -11.091 5.382 -1.256 1.00 0.00 H new ATOM 1295 N ILE A 82 -10.379 0.997 1.226 1.00 0.00 N ATOM 1296 CA ILE A 82 -9.340 0.165 1.819 1.00 0.00 C ATOM 1297 C ILE A 82 -9.743 -1.306 1.814 1.00 0.00 C ATOM 1298 O ILE A 82 -9.092 -2.136 1.180 1.00 0.00 O ATOM 1299 CB ILE A 82 -9.031 0.596 3.265 1.00 0.00 C ATOM 1300 CG1 ILE A 82 -8.544 2.046 3.295 1.00 0.00 C ATOM 1301 CG2 ILE A 82 -7.994 -0.330 3.883 1.00 0.00 C ATOM 1302 CD1 ILE A 82 -8.665 2.695 4.656 1.00 0.00 C ATOM 0 H ILE A 82 -10.532 1.885 1.704 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.445 0.296 1.210 1.00 0.00 H new ATOM 0 HB ILE A 82 -9.947 0.528 3.853 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -7.502 2.078 2.978 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -9.115 2.628 2.572 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -7.786 -0.013 4.905 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -8.376 -1.351 3.891 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -7.076 -0.291 3.297 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -8.302 3.721 4.603 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -9.710 2.695 4.967 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -8.071 2.137 5.379 1.00 0.00 H new ATOM 1314 N ARG A 83 -10.822 -1.620 2.524 1.00 0.00 N ATOM 1315 CA ARG A 83 -11.314 -2.991 2.600 1.00 0.00 C ATOM 1316 C ARG A 83 -11.159 -3.700 1.258 1.00 0.00 C ATOM 1317 O ARG A 83 -10.634 -4.811 1.187 1.00 0.00 O ATOM 1318 CB ARG A 83 -12.781 -3.006 3.031 1.00 0.00 C ATOM 1319 CG ARG A 83 -12.974 -2.986 4.539 1.00 0.00 C ATOM 1320 CD ARG A 83 -14.293 -2.334 4.923 1.00 0.00 C ATOM 1321 NE ARG A 83 -14.609 -2.529 6.336 1.00 0.00 N ATOM 1322 CZ ARG A 83 -15.433 -1.744 7.020 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -16.021 -0.716 6.425 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -15.670 -1.987 8.303 1.00 0.00 N ATOM 0 H ARG A 83 -11.372 -0.944 3.054 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.719 -3.523 3.343 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.287 -2.144 2.597 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.261 -3.896 2.624 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.945 -4.005 4.924 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -12.150 -2.445 5.005 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.247 -1.267 4.706 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -15.094 -2.749 4.312 1.00 0.00 H new ATOM 0 HE ARG A 83 -14.173 -3.311 6.824 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -15.841 -0.526 5.439 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -16.654 -0.115 6.953 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -15.219 -2.777 8.764 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -16.303 -1.384 8.828 1.00 0.00 H new ATOM 1338 N THR A 84 -11.621 -3.050 0.194 1.00 0.00 N ATOM 1339 CA THR A 84 -11.536 -3.618 -1.145 1.00 0.00 C ATOM 1340 C THR A 84 -10.152 -4.199 -1.409 1.00 0.00 C ATOM 1341 O THR A 84 -10.006 -5.398 -1.645 1.00 0.00 O ATOM 1342 CB THR A 84 -11.852 -2.564 -2.223 1.00 0.00 C ATOM 1343 OG1 THR A 84 -13.132 -1.974 -1.971 1.00 0.00 O ATOM 1344 CG2 THR A 84 -11.840 -3.188 -3.610 1.00 0.00 C ATOM 0 H THR A 84 -12.058 -2.129 0.234 1.00 0.00 H new ATOM 0 HA THR A 84 -12.278 -4.415 -1.198 1.00 0.00 H new ATOM 0 HB THR A 84 -11.083 -1.793 -2.182 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.028 -1.217 -1.357 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.066 -2.424 -4.354 1.00 0.00 H new ATOM 0 HG22 THR A 84 -10.855 -3.610 -3.810 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.590 -3.977 -3.660 1.00 0.00 H new ATOM 1352 N PHE A 85 -9.137 -3.342 -1.366 1.00 0.00 N ATOM 1353 CA PHE A 85 -7.764 -3.771 -1.601 1.00 0.00 C ATOM 1354 C PHE A 85 -7.427 -5.001 -0.764 1.00 0.00 C ATOM 1355 O PHE A 85 -6.925 -6.000 -1.281 1.00 0.00 O ATOM 1356 CB PHE A 85 -6.790 -2.637 -1.275 1.00 0.00 C ATOM 1357 CG PHE A 85 -5.372 -3.098 -1.094 1.00 0.00 C ATOM 1358 CD1 PHE A 85 -4.555 -3.318 -2.192 1.00 0.00 C ATOM 1359 CD2 PHE A 85 -4.855 -3.311 0.174 1.00 0.00 C ATOM 1360 CE1 PHE A 85 -3.250 -3.743 -2.028 1.00 0.00 C ATOM 1361 CE2 PHE A 85 -3.551 -3.735 0.344 1.00 0.00 C ATOM 1362 CZ PHE A 85 -2.747 -3.950 -0.758 1.00 0.00 C ATOM 0 H PHE A 85 -9.240 -2.346 -1.171 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.668 -4.033 -2.655 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.824 -1.898 -2.076 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.120 -2.136 -0.365 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -4.943 -3.155 -3.187 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -5.479 -3.144 1.040 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -2.624 -3.913 -2.892 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -3.161 -3.898 1.338 1.00 0.00 H new ATOM 0 HZ PHE A 85 -1.727 -4.279 -0.627 1.00 0.00 H new ATOM 1372 N LEU A 86 -7.708 -4.922 0.532 1.00 0.00 N ATOM 1373 CA LEU A 86 -7.435 -6.029 1.443 1.00 0.00 C ATOM 1374 C LEU A 86 -8.138 -7.301 0.979 1.00 0.00 C ATOM 1375 O LEU A 86 -7.620 -8.406 1.147 1.00 0.00 O ATOM 1376 CB LEU A 86 -7.885 -5.671 2.860 1.00 0.00 C ATOM 1377 CG LEU A 86 -7.353 -4.352 3.421 1.00 0.00 C ATOM 1378 CD1 LEU A 86 -8.155 -3.928 4.641 1.00 0.00 C ATOM 1379 CD2 LEU A 86 -5.877 -4.478 3.769 1.00 0.00 C ATOM 0 H LEU A 86 -8.125 -4.104 0.976 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.360 -6.210 1.445 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.974 -5.636 2.876 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -7.582 -6.476 3.530 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.462 -3.584 2.655 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.762 -2.987 5.026 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.200 -3.797 4.362 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.079 -4.696 5.411 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.515 -3.530 4.167 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.745 -5.260 4.517 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.312 -4.735 2.873 1.00 0.00 H new ATOM 1391 N THR A 87 -9.320 -7.138 0.394 1.00 0.00 N ATOM 1392 CA THR A 87 -10.093 -8.273 -0.095 1.00 0.00 C ATOM 1393 C THR A 87 -9.426 -8.912 -1.308 1.00 0.00 C ATOM 1394 O THR A 87 -9.285 -10.132 -1.379 1.00 0.00 O ATOM 1395 CB THR A 87 -11.527 -7.855 -0.474 1.00 0.00 C ATOM 1396 OG1 THR A 87 -12.094 -7.051 0.568 1.00 0.00 O ATOM 1397 CG2 THR A 87 -12.402 -9.076 -0.712 1.00 0.00 C ATOM 0 H THR A 87 -9.763 -6.231 0.247 1.00 0.00 H new ATOM 0 HA THR A 87 -10.136 -8.999 0.717 1.00 0.00 H new ATOM 0 HB THR A 87 -11.481 -7.276 -1.396 1.00 0.00 H new ATOM 0 HG1 THR A 87 -11.611 -6.200 0.624 1.00 0.00 H new ATOM 0 HG21 THR A 87 -13.409 -8.756 -0.978 1.00 0.00 H new ATOM 0 HG22 THR A 87 -11.984 -9.670 -1.524 1.00 0.00 H new ATOM 0 HG23 THR A 87 -12.441 -9.678 0.196 1.00 0.00 H new ATOM 1405 N ALA A 88 -9.016 -8.079 -2.259 1.00 0.00 N ATOM 1406 CA ALA A 88 -8.360 -8.563 -3.467 1.00 0.00 C ATOM 1407 C ALA A 88 -7.085 -9.329 -3.131 1.00 0.00 C ATOM 1408 O ALA A 88 -6.747 -10.311 -3.793 1.00 0.00 O ATOM 1409 CB ALA A 88 -8.050 -7.402 -4.401 1.00 0.00 C ATOM 0 H ALA A 88 -9.127 -7.066 -2.216 1.00 0.00 H new ATOM 0 HA ALA A 88 -9.042 -9.248 -3.971 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.560 -7.778 -5.299 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.977 -6.899 -4.677 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.390 -6.696 -3.897 1.00 0.00 H new ATOM 1415 N CYS A 89 -6.382 -8.875 -2.100 1.00 0.00 N ATOM 1416 CA CYS A 89 -5.143 -9.517 -1.677 1.00 0.00 C ATOM 1417 C CYS A 89 -5.393 -10.964 -1.265 1.00 0.00 C ATOM 1418 O CYS A 89 -4.457 -11.754 -1.134 1.00 0.00 O ATOM 1419 CB CYS A 89 -4.514 -8.745 -0.516 1.00 0.00 C ATOM 1420 SG CYS A 89 -3.377 -7.436 -1.029 1.00 0.00 S ATOM 0 H CYS A 89 -6.649 -8.064 -1.541 1.00 0.00 H new ATOM 0 HA CYS A 89 -4.454 -9.513 -2.522 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -5.309 -8.305 0.087 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -3.979 -9.446 0.125 1.00 0.00 H new ATOM 0 HG CYS A 89 -3.759 -6.304 -0.517 1.00 0.00 H new ATOM 1426 N CYS A 90 -6.661 -11.304 -1.061 1.00 0.00 N ATOM 1427 CA CYS A 90 -7.035 -12.656 -0.661 1.00 0.00 C ATOM 1428 C CYS A 90 -7.831 -13.348 -1.763 1.00 0.00 C ATOM 1429 O CYS A 90 -7.896 -14.576 -1.816 1.00 0.00 O ATOM 1430 CB CYS A 90 -7.854 -12.620 0.631 1.00 0.00 C ATOM 1431 SG CYS A 90 -8.403 -14.245 1.202 1.00 0.00 S ATOM 0 H CYS A 90 -7.447 -10.662 -1.166 1.00 0.00 H new ATOM 0 HA CYS A 90 -6.121 -13.223 -0.487 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -7.256 -12.154 1.415 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -8.728 -11.986 0.477 1.00 0.00 H new ATOM 0 HG CYS A 90 -8.409 -15.077 0.203 1.00 0.00 H new ATOM 1437 N GLU A 91 -8.436 -12.552 -2.638 1.00 0.00 N ATOM 1438 CA GLU A 91 -9.230 -13.089 -3.737 1.00 0.00 C ATOM 1439 C GLU A 91 -8.393 -13.203 -5.008 1.00 0.00 C ATOM 1440 O GLU A 91 -8.292 -14.275 -5.606 1.00 0.00 O ATOM 1441 CB GLU A 91 -10.450 -12.203 -3.995 1.00 0.00 C ATOM 1442 CG GLU A 91 -11.431 -12.165 -2.835 1.00 0.00 C ATOM 1443 CD GLU A 91 -12.448 -13.289 -2.895 1.00 0.00 C ATOM 1444 OE1 GLU A 91 -12.750 -13.758 -4.012 1.00 0.00 O ATOM 1445 OE2 GLU A 91 -12.942 -13.698 -1.823 1.00 0.00 O ATOM 0 H GLU A 91 -8.392 -11.533 -2.608 1.00 0.00 H new ATOM 0 HA GLU A 91 -9.567 -14.086 -3.454 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.113 -11.189 -4.208 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -10.967 -12.561 -4.885 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -10.881 -12.227 -1.896 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -11.952 -11.208 -2.836 1.00 0.00 H new ATOM 1452 N THR A 92 -7.793 -12.090 -5.416 1.00 0.00 N ATOM 1453 CA THR A 92 -6.966 -12.063 -6.616 1.00 0.00 C ATOM 1454 C THR A 92 -5.660 -12.819 -6.401 1.00 0.00 C ATOM 1455 O THR A 92 -5.293 -13.683 -7.198 1.00 0.00 O ATOM 1456 CB THR A 92 -6.645 -10.618 -7.045 1.00 0.00 C ATOM 1457 OG1 THR A 92 -7.854 -9.924 -7.373 1.00 0.00 O ATOM 1458 CG2 THR A 92 -5.706 -10.605 -8.242 1.00 0.00 C ATOM 0 H THR A 92 -7.864 -11.195 -4.933 1.00 0.00 H new ATOM 0 HA THR A 92 -7.539 -12.550 -7.405 1.00 0.00 H new ATOM 0 HB THR A 92 -6.153 -10.116 -6.212 1.00 0.00 H new ATOM 0 HG1 THR A 92 -7.686 -8.958 -7.377 1.00 0.00 H new ATOM 0 HG21 THR A 92 -5.494 -9.574 -8.527 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.775 -11.108 -7.980 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.175 -11.123 -9.078 1.00 0.00 H new ATOM 1466 N PHE A 93 -4.962 -12.490 -5.319 1.00 0.00 N ATOM 1467 CA PHE A 93 -3.696 -13.138 -5.000 1.00 0.00 C ATOM 1468 C PHE A 93 -3.916 -14.339 -4.084 1.00 0.00 C ATOM 1469 O PHE A 93 -3.727 -15.485 -4.489 1.00 0.00 O ATOM 1470 CB PHE A 93 -2.742 -12.143 -4.335 1.00 0.00 C ATOM 1471 CG PHE A 93 -2.245 -11.076 -5.266 1.00 0.00 C ATOM 1472 CD1 PHE A 93 -3.131 -10.207 -5.882 1.00 0.00 C ATOM 1473 CD2 PHE A 93 -0.891 -10.941 -5.527 1.00 0.00 C ATOM 1474 CE1 PHE A 93 -2.677 -9.223 -6.740 1.00 0.00 C ATOM 1475 CE2 PHE A 93 -0.430 -9.959 -6.383 1.00 0.00 C ATOM 1476 CZ PHE A 93 -1.324 -9.099 -6.991 1.00 0.00 C ATOM 0 H PHE A 93 -5.252 -11.778 -4.648 1.00 0.00 H new ATOM 0 HA PHE A 93 -3.252 -13.489 -5.931 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.250 -11.672 -3.493 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -1.889 -12.686 -3.929 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -4.190 -10.300 -5.689 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -0.187 -11.611 -5.056 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.379 -8.552 -7.213 1.00 0.00 H new ATOM 0 HE2 PHE A 93 0.628 -9.864 -6.577 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.966 -8.331 -7.661 1.00 0.00 H new ATOM 1486 N GLY A 94 -4.317 -14.066 -2.846 1.00 0.00 N ATOM 1487 CA GLY A 94 -4.555 -15.133 -1.891 1.00 0.00 C ATOM 1488 C GLY A 94 -3.559 -15.122 -0.749 1.00 0.00 C ATOM 1489 O GLY A 94 -2.811 -16.081 -0.560 1.00 0.00 O ATOM 0 H GLY A 94 -4.481 -13.125 -2.487 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.564 -15.039 -1.490 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.504 -16.093 -2.404 1.00 0.00 H new ATOM 1493 N MET A 95 -3.548 -14.034 0.014 1.00 0.00 N ATOM 1494 CA MET A 95 -2.635 -13.903 1.144 1.00 0.00 C ATOM 1495 C MET A 95 -3.363 -14.146 2.462 1.00 0.00 C ATOM 1496 O MET A 95 -4.593 -14.172 2.507 1.00 0.00 O ATOM 1497 CB MET A 95 -1.994 -12.514 1.150 1.00 0.00 C ATOM 1498 CG MET A 95 -0.731 -12.423 0.309 1.00 0.00 C ATOM 1499 SD MET A 95 -0.094 -10.741 0.192 1.00 0.00 S ATOM 1500 CE MET A 95 0.620 -10.535 1.822 1.00 0.00 C ATOM 0 H MET A 95 -4.160 -13.231 -0.129 1.00 0.00 H new ATOM 0 HA MET A 95 -1.854 -14.655 1.037 1.00 0.00 H new ATOM 0 HB2 MET A 95 -2.718 -11.787 0.782 1.00 0.00 H new ATOM 0 HB3 MET A 95 -1.757 -12.237 2.177 1.00 0.00 H new ATOM 0 HG2 MET A 95 0.035 -13.068 0.740 1.00 0.00 H new ATOM 0 HG3 MET A 95 -0.938 -12.799 -0.693 1.00 0.00 H new ATOM 0 HE1 MET A 95 1.443 -9.822 1.771 1.00 0.00 H new ATOM 0 HE2 MET A 95 -0.141 -10.163 2.508 1.00 0.00 H new ATOM 0 HE3 MET A 95 0.993 -11.495 2.180 1.00 0.00 H new ATOM 1510 N ARG A 96 -2.595 -14.324 3.532 1.00 0.00 N ATOM 1511 CA ARG A 96 -3.168 -14.566 4.851 1.00 0.00 C ATOM 1512 C ARG A 96 -3.766 -13.287 5.428 1.00 0.00 C ATOM 1513 O ARG A 96 -3.063 -12.297 5.633 1.00 0.00 O ATOM 1514 CB ARG A 96 -2.102 -15.117 5.800 1.00 0.00 C ATOM 1515 CG ARG A 96 -1.881 -16.615 5.666 1.00 0.00 C ATOM 1516 CD ARG A 96 -3.078 -17.402 6.176 1.00 0.00 C ATOM 1517 NE ARG A 96 -2.724 -18.777 6.517 1.00 0.00 N ATOM 1518 CZ ARG A 96 -3.604 -19.681 6.932 1.00 0.00 C ATOM 1519 NH1 ARG A 96 -4.884 -19.357 7.056 1.00 0.00 N ATOM 1520 NH2 ARG A 96 -3.205 -20.912 7.224 1.00 0.00 N ATOM 0 H ARG A 96 -1.575 -14.305 3.512 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.965 -15.302 4.743 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -1.160 -14.601 5.613 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -2.390 -14.891 6.827 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -1.698 -16.865 4.621 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -0.990 -16.904 6.223 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.491 -16.906 7.054 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -3.859 -17.407 5.416 1.00 0.00 H new ATOM 0 HE ARG A 96 -1.747 -19.059 6.432 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -5.195 -18.412 6.832 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -5.558 -20.053 7.375 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -2.221 -21.165 7.130 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -3.882 -21.605 7.543 1.00 0.00 H new ATOM 1534 N LYS A 97 -5.069 -13.313 5.688 1.00 0.00 N ATOM 1535 CA LYS A 97 -5.763 -12.157 6.242 1.00 0.00 C ATOM 1536 C LYS A 97 -5.002 -11.585 7.434 1.00 0.00 C ATOM 1537 O LYS A 97 -4.980 -10.373 7.646 1.00 0.00 O ATOM 1538 CB LYS A 97 -7.182 -12.542 6.666 1.00 0.00 C ATOM 1539 CG LYS A 97 -8.104 -11.351 6.859 1.00 0.00 C ATOM 1540 CD LYS A 97 -8.774 -10.948 5.556 1.00 0.00 C ATOM 1541 CE LYS A 97 -9.940 -10.001 5.799 1.00 0.00 C ATOM 1542 NZ LYS A 97 -11.017 -10.643 6.602 1.00 0.00 N ATOM 0 H LYS A 97 -5.666 -14.123 5.523 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.817 -11.392 5.467 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.610 -13.204 5.913 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.133 -13.107 7.597 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.865 -11.595 7.600 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.535 -10.509 7.252 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -8.044 -10.469 4.903 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.129 -11.839 5.037 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -9.583 -9.110 6.316 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -10.347 -9.673 4.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.918 -10.155 6.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -11.106 -11.642 6.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -10.780 -10.581 7.613 1.00 0.00 H new ATOM 1556 N SER A 98 -4.378 -12.467 8.210 1.00 0.00 N ATOM 1557 CA SER A 98 -3.619 -12.050 9.383 1.00 0.00 C ATOM 1558 C SER A 98 -2.424 -11.191 8.979 1.00 0.00 C ATOM 1559 O SER A 98 -2.009 -10.300 9.718 1.00 0.00 O ATOM 1560 CB SER A 98 -3.140 -13.272 10.168 1.00 0.00 C ATOM 1561 OG SER A 98 -2.371 -12.887 11.294 1.00 0.00 O ATOM 0 H SER A 98 -4.384 -13.474 8.047 1.00 0.00 H new ATOM 0 HA SER A 98 -4.276 -11.454 10.017 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.999 -13.858 10.494 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.544 -13.914 9.519 1.00 0.00 H new ATOM 0 HG SER A 98 -2.078 -13.687 11.779 1.00 0.00 H new ATOM 1567 N GLU A 99 -1.876 -11.467 7.799 1.00 0.00 N ATOM 1568 CA GLU A 99 -0.729 -10.721 7.297 1.00 0.00 C ATOM 1569 C GLU A 99 -1.125 -9.293 6.933 1.00 0.00 C ATOM 1570 O GLU A 99 -0.367 -8.349 7.158 1.00 0.00 O ATOM 1571 CB GLU A 99 -0.130 -11.423 6.076 1.00 0.00 C ATOM 1572 CG GLU A 99 0.505 -12.766 6.397 1.00 0.00 C ATOM 1573 CD GLU A 99 0.926 -13.524 5.153 1.00 0.00 C ATOM 1574 OE1 GLU A 99 0.189 -13.470 4.146 1.00 0.00 O ATOM 1575 OE2 GLU A 99 1.995 -14.170 5.186 1.00 0.00 O ATOM 0 H GLU A 99 -2.208 -12.201 7.174 1.00 0.00 H new ATOM 0 HA GLU A 99 0.020 -10.681 8.088 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.912 -11.569 5.331 1.00 0.00 H new ATOM 0 HB3 GLU A 99 0.621 -10.774 5.626 1.00 0.00 H new ATOM 0 HG2 GLU A 99 1.375 -12.609 7.034 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -0.201 -13.371 6.965 1.00 0.00 H new ATOM 1582 N LEU A 100 -2.318 -9.143 6.368 1.00 0.00 N ATOM 1583 CA LEU A 100 -2.817 -7.831 5.971 1.00 0.00 C ATOM 1584 C LEU A 100 -2.945 -6.909 7.180 1.00 0.00 C ATOM 1585 O LEU A 100 -2.699 -7.318 8.315 1.00 0.00 O ATOM 1586 CB LEU A 100 -4.172 -7.968 5.274 1.00 0.00 C ATOM 1587 CG LEU A 100 -4.287 -9.094 4.247 1.00 0.00 C ATOM 1588 CD1 LEU A 100 -5.680 -9.120 3.637 1.00 0.00 C ATOM 1589 CD2 LEU A 100 -3.232 -8.936 3.162 1.00 0.00 C ATOM 0 H LEU A 100 -2.958 -9.914 6.175 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.101 -7.392 5.276 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.937 -8.119 6.036 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.399 -7.025 4.777 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.117 -10.043 4.756 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.743 -9.928 2.908 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.418 -9.281 4.423 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.878 -8.169 3.142 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.329 -9.746 2.440 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.371 -7.980 2.656 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.240 -8.968 3.612 1.00 0.00 H new ATOM 1601 N PHE A 101 -3.334 -5.663 6.928 1.00 0.00 N ATOM 1602 CA PHE A 101 -3.496 -4.683 7.996 1.00 0.00 C ATOM 1603 C PHE A 101 -4.965 -4.310 8.173 1.00 0.00 C ATOM 1604 O PHE A 101 -5.801 -4.623 7.327 1.00 0.00 O ATOM 1605 CB PHE A 101 -2.672 -3.429 7.695 1.00 0.00 C ATOM 1606 CG PHE A 101 -3.039 -2.768 6.397 1.00 0.00 C ATOM 1607 CD1 PHE A 101 -4.040 -1.811 6.349 1.00 0.00 C ATOM 1608 CD2 PHE A 101 -2.383 -3.105 5.223 1.00 0.00 C ATOM 1609 CE1 PHE A 101 -4.379 -1.201 5.157 1.00 0.00 C ATOM 1610 CE2 PHE A 101 -2.718 -2.498 4.028 1.00 0.00 C ATOM 1611 CZ PHE A 101 -3.718 -1.546 3.994 1.00 0.00 C ATOM 0 H PHE A 101 -3.543 -5.309 5.995 1.00 0.00 H new ATOM 0 HA PHE A 101 -3.139 -5.130 8.924 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.803 -2.714 8.507 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.615 -3.695 7.672 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -4.562 -1.539 7.255 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.602 -3.850 5.243 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -5.160 -0.455 5.134 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -2.198 -2.768 3.121 1.00 0.00 H new ATOM 0 HZ PHE A 101 -3.983 -1.072 3.060 1.00 0.00 H new ATOM 1621 N GLU A 102 -5.269 -3.639 9.280 1.00 0.00 N ATOM 1622 CA GLU A 102 -6.637 -3.225 9.569 1.00 0.00 C ATOM 1623 C GLU A 102 -6.993 -1.952 8.806 1.00 0.00 C ATOM 1624 O GLU A 102 -6.230 -0.986 8.799 1.00 0.00 O ATOM 1625 CB GLU A 102 -6.819 -3.000 11.072 1.00 0.00 C ATOM 1626 CG GLU A 102 -6.697 -4.270 11.896 1.00 0.00 C ATOM 1627 CD GLU A 102 -7.266 -4.115 13.293 1.00 0.00 C ATOM 1628 OE1 GLU A 102 -6.722 -3.300 14.068 1.00 0.00 O ATOM 1629 OE2 GLU A 102 -8.255 -4.808 13.612 1.00 0.00 O ATOM 0 H GLU A 102 -4.588 -3.371 9.990 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.307 -4.022 9.245 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.076 -2.281 11.416 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.798 -2.555 11.248 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -7.215 -5.082 11.385 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -5.647 -4.555 11.965 1.00 0.00 H new ATOM 1636 N ALA A 103 -8.157 -1.959 8.165 1.00 0.00 N ATOM 1637 CA ALA A 103 -8.615 -0.806 7.400 1.00 0.00 C ATOM 1638 C ALA A 103 -8.437 0.484 8.193 1.00 0.00 C ATOM 1639 O ALA A 103 -8.083 1.523 7.636 1.00 0.00 O ATOM 1640 CB ALA A 103 -10.072 -0.984 6.998 1.00 0.00 C ATOM 0 H ALA A 103 -8.800 -2.751 8.160 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.007 -0.734 6.498 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.401 -0.115 6.427 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.174 -1.880 6.386 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.687 -1.084 7.893 1.00 0.00 H new ATOM 1646 N PHE A 104 -8.686 0.411 9.497 1.00 0.00 N ATOM 1647 CA PHE A 104 -8.555 1.574 10.366 1.00 0.00 C ATOM 1648 C PHE A 104 -7.094 1.995 10.496 1.00 0.00 C ATOM 1649 O PHE A 104 -6.724 3.111 10.132 1.00 0.00 O ATOM 1650 CB PHE A 104 -9.135 1.271 11.750 1.00 0.00 C ATOM 1651 CG PHE A 104 -9.471 2.502 12.542 1.00 0.00 C ATOM 1652 CD1 PHE A 104 -10.516 3.326 12.155 1.00 0.00 C ATOM 1653 CD2 PHE A 104 -8.743 2.836 13.672 1.00 0.00 C ATOM 1654 CE1 PHE A 104 -10.829 4.460 12.882 1.00 0.00 C ATOM 1655 CE2 PHE A 104 -9.051 3.967 14.403 1.00 0.00 C ATOM 1656 CZ PHE A 104 -10.094 4.781 14.007 1.00 0.00 C ATOM 0 H PHE A 104 -8.979 -0.441 9.974 1.00 0.00 H new ATOM 0 HA PHE A 104 -9.113 2.396 9.917 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -10.035 0.667 11.634 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -8.419 0.671 12.312 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -11.093 3.080 11.276 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.925 2.205 13.985 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.646 5.094 12.571 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.477 4.214 15.283 1.00 0.00 H new ATOM 0 HZ PHE A 104 -10.335 5.667 14.576 1.00 0.00 H new ATOM 1666 N ASP A 105 -6.269 1.093 11.017 1.00 0.00 N ATOM 1667 CA ASP A 105 -4.849 1.369 11.195 1.00 0.00 C ATOM 1668 C ASP A 105 -4.323 2.256 10.070 1.00 0.00 C ATOM 1669 O ASP A 105 -3.552 3.187 10.308 1.00 0.00 O ATOM 1670 CB ASP A 105 -4.056 0.063 11.244 1.00 0.00 C ATOM 1671 CG ASP A 105 -4.401 -0.779 12.457 1.00 0.00 C ATOM 1672 OD1 ASP A 105 -5.474 -0.549 13.052 1.00 0.00 O ATOM 1673 OD2 ASP A 105 -3.597 -1.666 12.812 1.00 0.00 O ATOM 0 H ASP A 105 -6.560 0.165 11.323 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.722 1.897 12.140 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.252 -0.512 10.339 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.990 0.289 11.254 1.00 0.00 H new ATOM 1678 N LEU A 106 -4.743 1.961 8.845 1.00 0.00 N ATOM 1679 CA LEU A 106 -4.313 2.730 7.683 1.00 0.00 C ATOM 1680 C LEU A 106 -5.009 4.087 7.641 1.00 0.00 C ATOM 1681 O LEU A 106 -4.367 5.119 7.441 1.00 0.00 O ATOM 1682 CB LEU A 106 -4.606 1.955 6.397 1.00 0.00 C ATOM 1683 CG LEU A 106 -4.239 2.659 5.090 1.00 0.00 C ATOM 1684 CD1 LEU A 106 -2.754 2.505 4.799 1.00 0.00 C ATOM 1685 CD2 LEU A 106 -5.069 2.113 3.938 1.00 0.00 C ATOM 0 H LEU A 106 -5.381 1.195 8.631 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.239 2.895 7.764 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.070 1.007 6.438 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -5.670 1.719 6.373 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.459 3.721 5.198 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.512 3.012 3.865 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.176 2.945 5.612 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.508 1.447 4.711 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.794 2.626 3.016 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.881 1.045 3.829 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -6.127 2.277 4.142 1.00 0.00 H new ATOM 1697 N PHE A 107 -6.324 4.079 7.833 1.00 0.00 N ATOM 1698 CA PHE A 107 -7.106 5.309 7.819 1.00 0.00 C ATOM 1699 C PHE A 107 -6.616 6.278 8.890 1.00 0.00 C ATOM 1700 O PHE A 107 -6.220 7.405 8.590 1.00 0.00 O ATOM 1701 CB PHE A 107 -8.588 4.999 8.036 1.00 0.00 C ATOM 1702 CG PHE A 107 -9.495 6.154 7.722 1.00 0.00 C ATOM 1703 CD1 PHE A 107 -9.318 6.897 6.566 1.00 0.00 C ATOM 1704 CD2 PHE A 107 -10.526 6.497 8.583 1.00 0.00 C ATOM 1705 CE1 PHE A 107 -10.151 7.961 6.276 1.00 0.00 C ATOM 1706 CE2 PHE A 107 -11.362 7.560 8.298 1.00 0.00 C ATOM 1707 CZ PHE A 107 -11.175 8.292 7.142 1.00 0.00 C ATOM 0 H PHE A 107 -6.870 3.234 8.000 1.00 0.00 H new ATOM 0 HA PHE A 107 -6.979 5.779 6.844 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -8.868 4.148 7.414 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -8.740 4.700 9.073 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -8.520 6.642 5.884 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -10.678 5.927 9.487 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -10.001 8.534 5.373 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -12.160 7.818 8.978 1.00 0.00 H new ATOM 0 HZ PHE A 107 -11.828 9.122 6.915 1.00 0.00 H new ATOM 1717 N ASP A 108 -6.645 5.832 10.141 1.00 0.00 N ATOM 1718 CA ASP A 108 -6.204 6.658 11.259 1.00 0.00 C ATOM 1719 C ASP A 108 -4.681 6.686 11.345 1.00 0.00 C ATOM 1720 O ASP A 108 -4.113 7.213 12.302 1.00 0.00 O ATOM 1721 CB ASP A 108 -6.792 6.136 12.570 1.00 0.00 C ATOM 1722 CG ASP A 108 -6.975 7.234 13.600 1.00 0.00 C ATOM 1723 OD1 ASP A 108 -7.806 8.136 13.364 1.00 0.00 O ATOM 1724 OD2 ASP A 108 -6.286 7.191 14.642 1.00 0.00 O ATOM 0 H ASP A 108 -6.970 4.902 10.407 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.560 7.675 11.091 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -7.754 5.664 12.371 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.137 5.365 12.977 1.00 0.00 H new ATOM 1729 N VAL A 109 -4.025 6.114 10.340 1.00 0.00 N ATOM 1730 CA VAL A 109 -2.568 6.073 10.303 1.00 0.00 C ATOM 1731 C VAL A 109 -1.991 5.772 11.681 1.00 0.00 C ATOM 1732 O VAL A 109 -1.070 6.446 12.141 1.00 0.00 O ATOM 1733 CB VAL A 109 -1.983 7.403 9.793 1.00 0.00 C ATOM 1734 CG1 VAL A 109 -0.486 7.272 9.556 1.00 0.00 C ATOM 1735 CG2 VAL A 109 -2.695 7.847 8.524 1.00 0.00 C ATOM 0 H VAL A 109 -4.480 5.673 9.541 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.291 5.274 9.615 1.00 0.00 H new ATOM 0 HB VAL A 109 -2.141 8.165 10.556 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.090 8.222 9.196 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.008 7.004 10.490 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.302 6.497 8.812 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -2.269 8.789 8.178 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.571 7.087 7.752 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.756 7.984 8.731 1.00 0.00 H new ATOM 1745 N ARG A 110 -2.540 4.754 12.336 1.00 0.00 N ATOM 1746 CA ARG A 110 -2.080 4.363 13.664 1.00 0.00 C ATOM 1747 C ARG A 110 -0.721 3.672 13.587 1.00 0.00 C ATOM 1748 O ARG A 110 0.251 4.125 14.191 1.00 0.00 O ATOM 1749 CB ARG A 110 -3.099 3.435 14.327 1.00 0.00 C ATOM 1750 CG ARG A 110 -4.526 3.956 14.269 1.00 0.00 C ATOM 1751 CD ARG A 110 -5.432 3.206 15.232 1.00 0.00 C ATOM 1752 NE ARG A 110 -5.046 3.416 16.624 1.00 0.00 N ATOM 1753 CZ ARG A 110 -4.186 2.638 17.274 1.00 0.00 C ATOM 1754 NH1 ARG A 110 -3.627 1.605 16.659 1.00 0.00 N ATOM 1755 NH2 ARG A 110 -3.885 2.894 18.540 1.00 0.00 N ATOM 0 H ARG A 110 -3.303 4.185 11.969 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.976 5.266 14.266 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -3.058 2.459 13.843 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.818 3.286 15.369 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.537 5.019 14.511 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.910 3.856 13.254 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.462 3.532 15.089 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -5.400 2.141 15.004 1.00 0.00 H new ATOM 0 HE ARG A 110 -5.459 4.203 17.125 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -3.857 1.406 15.685 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -2.967 1.009 17.160 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -4.313 3.688 19.016 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -3.225 2.297 19.038 1.00 0.00 H new ATOM 1769 N ASP A 111 -0.663 2.575 12.841 1.00 0.00 N ATOM 1770 CA ASP A 111 0.576 1.821 12.684 1.00 0.00 C ATOM 1771 C ASP A 111 0.848 1.523 11.213 1.00 0.00 C ATOM 1772 O ASP A 111 0.341 0.545 10.663 1.00 0.00 O ATOM 1773 CB ASP A 111 0.507 0.516 13.478 1.00 0.00 C ATOM 1774 CG ASP A 111 0.619 0.741 14.973 1.00 0.00 C ATOM 1775 OD1 ASP A 111 1.347 1.670 15.381 1.00 0.00 O ATOM 1776 OD2 ASP A 111 -0.023 -0.012 15.735 1.00 0.00 O ATOM 0 H ASP A 111 -1.459 2.187 12.335 1.00 0.00 H new ATOM 0 HA ASP A 111 1.394 2.429 13.070 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.433 0.010 13.259 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.309 -0.147 13.152 1.00 0.00 H new ATOM 1781 N PHE A 112 1.651 2.373 10.581 1.00 0.00 N ATOM 1782 CA PHE A 112 1.989 2.202 9.173 1.00 0.00 C ATOM 1783 C PHE A 112 2.861 0.965 8.970 1.00 0.00 C ATOM 1784 O PHE A 112 2.676 0.213 8.014 1.00 0.00 O ATOM 1785 CB PHE A 112 2.713 3.442 8.646 1.00 0.00 C ATOM 1786 CG PHE A 112 2.862 3.460 7.152 1.00 0.00 C ATOM 1787 CD1 PHE A 112 1.753 3.342 6.330 1.00 0.00 C ATOM 1788 CD2 PHE A 112 4.112 3.595 6.568 1.00 0.00 C ATOM 1789 CE1 PHE A 112 1.887 3.357 4.955 1.00 0.00 C ATOM 1790 CE2 PHE A 112 4.252 3.611 5.193 1.00 0.00 C ATOM 1791 CZ PHE A 112 3.139 3.493 4.386 1.00 0.00 C ATOM 0 H PHE A 112 2.080 3.187 11.022 1.00 0.00 H new ATOM 0 HA PHE A 112 1.062 2.067 8.616 1.00 0.00 H new ATOM 0 HB2 PHE A 112 2.167 4.332 8.959 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.701 3.497 9.102 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.772 3.237 6.769 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.987 3.689 7.195 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.014 3.263 4.326 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.232 3.716 4.751 1.00 0.00 H new ATOM 0 HZ PHE A 112 3.246 3.507 3.311 1.00 0.00 H new ATOM 1801 N GLY A 113 3.812 0.763 9.876 1.00 0.00 N ATOM 1802 CA GLY A 113 4.698 -0.382 9.779 1.00 0.00 C ATOM 1803 C GLY A 113 3.968 -1.648 9.379 1.00 0.00 C ATOM 1804 O GLY A 113 4.504 -2.479 8.646 1.00 0.00 O ATOM 0 H GLY A 113 3.985 1.372 10.676 1.00 0.00 H new ATOM 0 HA2 GLY A 113 5.480 -0.171 9.050 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.191 -0.538 10.739 1.00 0.00 H new ATOM 1808 N LYS A 114 2.740 -1.799 9.864 1.00 0.00 N ATOM 1809 CA LYS A 114 1.933 -2.974 9.555 1.00 0.00 C ATOM 1810 C LYS A 114 1.601 -3.028 8.067 1.00 0.00 C ATOM 1811 O LYS A 114 1.593 -4.100 7.461 1.00 0.00 O ATOM 1812 CB LYS A 114 0.643 -2.963 10.377 1.00 0.00 C ATOM 1813 CG LYS A 114 0.827 -3.450 11.804 1.00 0.00 C ATOM 1814 CD LYS A 114 -0.454 -3.311 12.610 1.00 0.00 C ATOM 1815 CE LYS A 114 -0.182 -3.379 14.105 1.00 0.00 C ATOM 1816 NZ LYS A 114 0.167 -4.759 14.542 1.00 0.00 N ATOM 0 H LYS A 114 2.281 -1.122 10.473 1.00 0.00 H new ATOM 0 HA LYS A 114 2.512 -3.861 9.813 1.00 0.00 H new ATOM 0 HB2 LYS A 114 0.243 -1.949 10.397 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -0.099 -3.589 9.881 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.141 -4.494 11.796 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.623 -2.881 12.284 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.935 -2.363 12.369 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.149 -4.102 12.329 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.633 -2.701 14.357 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -1.062 -3.037 14.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.345 -4.764 15.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.621 -5.402 14.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 1.021 -5.076 14.041 1.00 0.00 H new ATOM 1830 N VAL A 115 1.327 -1.866 7.483 1.00 0.00 N ATOM 1831 CA VAL A 115 0.996 -1.782 6.066 1.00 0.00 C ATOM 1832 C VAL A 115 2.221 -2.046 5.199 1.00 0.00 C ATOM 1833 O VAL A 115 2.121 -2.658 4.135 1.00 0.00 O ATOM 1834 CB VAL A 115 0.414 -0.401 5.707 1.00 0.00 C ATOM 1835 CG1 VAL A 115 -0.014 -0.365 4.248 1.00 0.00 C ATOM 1836 CG2 VAL A 115 -0.752 -0.060 6.621 1.00 0.00 C ATOM 0 H VAL A 115 1.328 -0.970 7.970 1.00 0.00 H new ATOM 0 HA VAL A 115 0.245 -2.547 5.870 1.00 0.00 H new ATOM 0 HB VAL A 115 1.191 0.350 5.852 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.422 0.618 4.013 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.848 -0.562 3.611 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -0.775 -1.125 4.073 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.150 0.919 6.353 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -1.533 -0.812 6.511 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.410 -0.041 7.656 1.00 0.00 H new ATOM 1846 N ILE A 116 3.377 -1.582 5.660 1.00 0.00 N ATOM 1847 CA ILE A 116 4.623 -1.770 4.927 1.00 0.00 C ATOM 1848 C ILE A 116 4.961 -3.250 4.788 1.00 0.00 C ATOM 1849 O ILE A 116 5.188 -3.743 3.684 1.00 0.00 O ATOM 1850 CB ILE A 116 5.797 -1.049 5.618 1.00 0.00 C ATOM 1851 CG1 ILE A 116 5.474 0.434 5.805 1.00 0.00 C ATOM 1852 CG2 ILE A 116 7.073 -1.221 4.808 1.00 0.00 C ATOM 1853 CD1 ILE A 116 6.584 1.215 6.472 1.00 0.00 C ATOM 0 H ILE A 116 3.477 -1.073 6.538 1.00 0.00 H new ATOM 0 HA ILE A 116 4.475 -1.339 3.937 1.00 0.00 H new ATOM 0 HB ILE A 116 5.950 -1.494 6.601 1.00 0.00 H new ATOM 0 HG12 ILE A 116 5.263 0.877 4.832 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.566 0.527 6.401 1.00 0.00 H new ATOM 0 HG21 ILE A 116 7.894 -0.707 5.308 1.00 0.00 H new ATOM 0 HG22 ILE A 116 7.309 -2.282 4.721 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.932 -0.798 3.813 1.00 0.00 H new ATOM 0 HD11 ILE A 116 6.285 2.259 6.572 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.780 0.797 7.460 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.488 1.153 5.866 1.00 0.00 H new ATOM 1865 N GLU A 117 4.990 -3.953 5.916 1.00 0.00 N ATOM 1866 CA GLU A 117 5.299 -5.379 5.919 1.00 0.00 C ATOM 1867 C GLU A 117 4.427 -6.126 4.914 1.00 0.00 C ATOM 1868 O GLU A 117 4.929 -6.877 4.076 1.00 0.00 O ATOM 1869 CB GLU A 117 5.100 -5.963 7.319 1.00 0.00 C ATOM 1870 CG GLU A 117 5.840 -7.271 7.543 1.00 0.00 C ATOM 1871 CD GLU A 117 6.223 -7.483 8.994 1.00 0.00 C ATOM 1872 OE1 GLU A 117 7.028 -6.683 9.517 1.00 0.00 O ATOM 1873 OE2 GLU A 117 5.720 -8.447 9.607 1.00 0.00 O ATOM 0 H GLU A 117 4.804 -3.559 6.838 1.00 0.00 H new ATOM 0 HA GLU A 117 6.343 -5.500 5.628 1.00 0.00 H new ATOM 0 HB2 GLU A 117 5.434 -5.235 8.058 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.035 -6.124 7.489 1.00 0.00 H new ATOM 0 HG2 GLU A 117 5.214 -8.100 7.212 1.00 0.00 H new ATOM 0 HG3 GLU A 117 6.740 -7.285 6.928 1.00 0.00 H new ATOM 1880 N THR A 118 3.118 -5.916 5.004 1.00 0.00 N ATOM 1881 CA THR A 118 2.175 -6.571 4.105 1.00 0.00 C ATOM 1882 C THR A 118 2.738 -6.664 2.692 1.00 0.00 C ATOM 1883 O THR A 118 2.707 -7.727 2.069 1.00 0.00 O ATOM 1884 CB THR A 118 0.829 -5.823 4.062 1.00 0.00 C ATOM 1885 OG1 THR A 118 0.202 -5.869 5.348 1.00 0.00 O ATOM 1886 CG2 THR A 118 -0.095 -6.433 3.019 1.00 0.00 C ATOM 0 H THR A 118 2.686 -5.297 5.690 1.00 0.00 H new ATOM 0 HA THR A 118 2.011 -7.576 4.494 1.00 0.00 H new ATOM 0 HB THR A 118 1.023 -4.785 3.790 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.699 -5.303 5.975 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.039 -5.889 3.007 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.373 -6.370 2.037 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.282 -7.478 3.265 1.00 0.00 H new ATOM 1894 N LEU A 119 3.252 -5.547 2.190 1.00 0.00 N ATOM 1895 CA LEU A 119 3.823 -5.503 0.848 1.00 0.00 C ATOM 1896 C LEU A 119 5.047 -6.407 0.747 1.00 0.00 C ATOM 1897 O LEU A 119 5.177 -7.190 -0.193 1.00 0.00 O ATOM 1898 CB LEU A 119 4.203 -4.067 0.481 1.00 0.00 C ATOM 1899 CG LEU A 119 3.119 -3.010 0.696 1.00 0.00 C ATOM 1900 CD1 LEU A 119 3.649 -1.626 0.354 1.00 0.00 C ATOM 1901 CD2 LEU A 119 1.887 -3.332 -0.137 1.00 0.00 C ATOM 0 H LEU A 119 3.285 -4.660 2.692 1.00 0.00 H new ATOM 0 HA LEU A 119 3.070 -5.863 0.147 1.00 0.00 H new ATOM 0 HB2 LEU A 119 5.079 -3.784 1.064 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.499 -4.047 -0.568 1.00 0.00 H new ATOM 0 HG LEU A 119 2.834 -3.018 1.748 1.00 0.00 H new ATOM 0 HD11 LEU A 119 2.864 -0.886 0.513 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.501 -1.394 0.993 1.00 0.00 H new ATOM 0 HD13 LEU A 119 3.962 -1.604 -0.690 1.00 0.00 H new ATOM 0 HD21 LEU A 119 1.126 -2.569 0.029 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.157 -3.352 -1.193 1.00 0.00 H new ATOM 0 HD23 LEU A 119 1.494 -4.306 0.156 1.00 0.00 H new ATOM 1913 N SER A 120 5.942 -6.293 1.724 1.00 0.00 N ATOM 1914 CA SER A 120 7.157 -7.099 1.744 1.00 0.00 C ATOM 1915 C SER A 120 6.846 -8.559 1.424 1.00 0.00 C ATOM 1916 O SER A 120 7.608 -9.228 0.726 1.00 0.00 O ATOM 1917 CB SER A 120 7.837 -6.999 3.111 1.00 0.00 C ATOM 1918 OG SER A 120 8.996 -7.813 3.165 1.00 0.00 O ATOM 0 H SER A 120 5.848 -5.651 2.511 1.00 0.00 H new ATOM 0 HA SER A 120 7.832 -6.713 0.980 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.107 -5.962 3.311 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.139 -7.303 3.891 1.00 0.00 H new ATOM 0 HG SER A 120 9.721 -7.383 2.666 1.00 0.00 H new ATOM 1924 N ARG A 121 5.722 -9.045 1.941 1.00 0.00 N ATOM 1925 CA ARG A 121 5.311 -10.424 1.712 1.00 0.00 C ATOM 1926 C ARG A 121 4.664 -10.578 0.338 1.00 0.00 C ATOM 1927 O ARG A 121 5.113 -11.376 -0.486 1.00 0.00 O ATOM 1928 CB ARG A 121 4.334 -10.875 2.800 1.00 0.00 C ATOM 1929 CG ARG A 121 4.926 -10.842 4.200 1.00 0.00 C ATOM 1930 CD ARG A 121 3.851 -11.011 5.262 1.00 0.00 C ATOM 1931 NE ARG A 121 4.422 -11.185 6.595 1.00 0.00 N ATOM 1932 CZ ARG A 121 3.766 -10.908 7.717 1.00 0.00 C ATOM 1933 NH1 ARG A 121 2.524 -10.448 7.667 1.00 0.00 N ATOM 1934 NH2 ARG A 121 4.354 -11.093 8.893 1.00 0.00 N ATOM 0 H ARG A 121 5.080 -8.504 2.521 1.00 0.00 H new ATOM 0 HA ARG A 121 6.201 -11.052 1.748 1.00 0.00 H new ATOM 0 HB2 ARG A 121 3.452 -10.236 2.772 1.00 0.00 H new ATOM 0 HB3 ARG A 121 4.000 -11.889 2.579 1.00 0.00 H new ATOM 0 HG2 ARG A 121 5.668 -11.634 4.302 1.00 0.00 H new ATOM 0 HG3 ARG A 121 5.446 -9.897 4.354 1.00 0.00 H new ATOM 0 HD2 ARG A 121 3.197 -10.139 5.258 1.00 0.00 H new ATOM 0 HD3 ARG A 121 3.232 -11.874 5.017 1.00 0.00 H new ATOM 0 HE ARG A 121 5.376 -11.538 6.669 1.00 0.00 H new ATOM 0 HH11 ARG A 121 2.069 -10.306 6.765 1.00 0.00 H new ATOM 0 HH12 ARG A 121 2.023 -10.236 8.530 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.309 -11.448 8.935 1.00 0.00 H new ATOM 0 HH22 ARG A 121 3.850 -10.880 9.754 1.00 0.00 H new ATOM 1948 N LEU A 122 3.608 -9.809 0.098 1.00 0.00 N ATOM 1949 CA LEU A 122 2.898 -9.860 -1.176 1.00 0.00 C ATOM 1950 C LEU A 122 3.868 -10.091 -2.330 1.00 0.00 C ATOM 1951 O LEU A 122 3.615 -10.913 -3.211 1.00 0.00 O ATOM 1952 CB LEU A 122 2.121 -8.562 -1.401 1.00 0.00 C ATOM 1953 CG LEU A 122 1.701 -8.272 -2.842 1.00 0.00 C ATOM 1954 CD1 LEU A 122 0.634 -9.256 -3.296 1.00 0.00 C ATOM 1955 CD2 LEU A 122 1.200 -6.841 -2.974 1.00 0.00 C ATOM 0 H LEU A 122 3.224 -9.143 0.768 1.00 0.00 H new ATOM 0 HA LEU A 122 2.198 -10.694 -1.141 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.225 -8.586 -0.781 1.00 0.00 H new ATOM 0 HB3 LEU A 122 2.731 -7.731 -1.047 1.00 0.00 H new ATOM 0 HG LEU A 122 2.573 -8.391 -3.485 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.348 -9.034 -4.324 1.00 0.00 H new ATOM 0 HD12 LEU A 122 1.028 -10.271 -3.240 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.239 -9.170 -2.649 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.905 -6.652 -4.006 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.341 -6.694 -2.319 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.994 -6.150 -2.691 1.00 0.00 H new ATOM 1967 N SER A 123 4.980 -9.363 -2.318 1.00 0.00 N ATOM 1968 CA SER A 123 5.987 -9.488 -3.365 1.00 0.00 C ATOM 1969 C SER A 123 6.256 -10.955 -3.688 1.00 0.00 C ATOM 1970 O SER A 123 6.290 -11.349 -4.853 1.00 0.00 O ATOM 1971 CB SER A 123 7.286 -8.802 -2.937 1.00 0.00 C ATOM 1972 OG SER A 123 7.924 -9.522 -1.897 1.00 0.00 O ATOM 0 H SER A 123 5.206 -8.680 -1.595 1.00 0.00 H new ATOM 0 HA SER A 123 5.605 -9.000 -4.262 1.00 0.00 H new ATOM 0 HB2 SER A 123 7.957 -8.721 -3.792 1.00 0.00 H new ATOM 0 HB3 SER A 123 7.072 -7.787 -2.603 1.00 0.00 H new ATOM 0 HG SER A 123 7.609 -9.192 -1.030 1.00 0.00 H new ATOM 1978 N ARG A 124 6.446 -11.758 -2.646 1.00 0.00 N ATOM 1979 CA ARG A 124 6.714 -13.181 -2.817 1.00 0.00 C ATOM 1980 C ARG A 124 5.815 -13.777 -3.897 1.00 0.00 C ATOM 1981 O ARG A 124 6.230 -14.657 -4.651 1.00 0.00 O ATOM 1982 CB ARG A 124 6.504 -13.923 -1.497 1.00 0.00 C ATOM 1983 CG ARG A 124 5.042 -14.070 -1.106 1.00 0.00 C ATOM 1984 CD ARG A 124 4.444 -15.355 -1.657 1.00 0.00 C ATOM 1985 NE ARG A 124 4.808 -16.517 -0.850 1.00 0.00 N ATOM 1986 CZ ARG A 124 4.188 -17.689 -0.928 1.00 0.00 C ATOM 1987 NH1 ARG A 124 3.179 -17.854 -1.773 1.00 0.00 N ATOM 1988 NH2 ARG A 124 4.576 -18.700 -0.161 1.00 0.00 N ATOM 0 H ARG A 124 6.419 -11.447 -1.675 1.00 0.00 H new ATOM 0 HA ARG A 124 7.752 -13.295 -3.129 1.00 0.00 H new ATOM 0 HB2 ARG A 124 6.953 -14.914 -1.572 1.00 0.00 H new ATOM 0 HB3 ARG A 124 7.032 -13.393 -0.704 1.00 0.00 H new ATOM 0 HG2 ARG A 124 4.952 -14.062 -0.020 1.00 0.00 H new ATOM 0 HG3 ARG A 124 4.477 -13.216 -1.479 1.00 0.00 H new ATOM 0 HD2 ARG A 124 3.358 -15.264 -1.693 1.00 0.00 H new ATOM 0 HD3 ARG A 124 4.785 -15.504 -2.682 1.00 0.00 H new ATOM 0 HE ARG A 124 5.581 -16.423 -0.191 1.00 0.00 H new ATOM 0 HH11 ARG A 124 2.878 -17.080 -2.365 1.00 0.00 H new ATOM 0 HH12 ARG A 124 2.705 -18.755 -1.831 1.00 0.00 H new ATOM 0 HH21 ARG A 124 5.352 -18.578 0.490 1.00 0.00 H new ATOM 0 HH22 ARG A 124 4.099 -19.599 -0.222 1.00 0.00 H new ATOM 2002 N THR A 125 4.579 -13.291 -3.966 1.00 0.00 N ATOM 2003 CA THR A 125 3.621 -13.776 -4.951 1.00 0.00 C ATOM 2004 C THR A 125 4.246 -13.842 -6.340 1.00 0.00 C ATOM 2005 O THR A 125 5.099 -13.032 -6.703 1.00 0.00 O ATOM 2006 CB THR A 125 2.370 -12.879 -5.006 1.00 0.00 C ATOM 2007 OG1 THR A 125 2.734 -11.553 -5.406 1.00 0.00 O ATOM 2008 CG2 THR A 125 1.676 -12.833 -3.653 1.00 0.00 C ATOM 0 H THR A 125 4.218 -12.562 -3.351 1.00 0.00 H new ATOM 0 HA THR A 125 3.328 -14.779 -4.640 1.00 0.00 H new ATOM 0 HB THR A 125 1.680 -13.302 -5.736 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.809 -10.981 -4.614 1.00 0.00 H new ATOM 0 HG21 THR A 125 0.796 -12.193 -3.717 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.373 -13.840 -3.365 1.00 0.00 H new ATOM 0 HG23 THR A 125 2.361 -12.433 -2.906 1.00 0.00 H new ATOM 2016 N PRO A 126 3.814 -14.831 -7.137 1.00 0.00 N ATOM 2017 CA PRO A 126 4.318 -15.026 -8.500 1.00 0.00 C ATOM 2018 C PRO A 126 3.859 -13.926 -9.450 1.00 0.00 C ATOM 2019 O PRO A 126 4.184 -13.944 -10.638 1.00 0.00 O ATOM 2020 CB PRO A 126 3.718 -16.373 -8.910 1.00 0.00 C ATOM 2021 CG PRO A 126 2.491 -16.511 -8.076 1.00 0.00 C ATOM 2022 CD PRO A 126 2.800 -15.833 -6.770 1.00 0.00 C ATOM 0 HA PRO A 126 5.407 -14.999 -8.540 1.00 0.00 H new ATOM 0 HB2 PRO A 126 3.478 -16.392 -9.973 1.00 0.00 H new ATOM 0 HB3 PRO A 126 4.416 -17.190 -8.726 1.00 0.00 H new ATOM 0 HG2 PRO A 126 1.634 -16.047 -8.563 1.00 0.00 H new ATOM 0 HG3 PRO A 126 2.240 -17.560 -7.921 1.00 0.00 H new ATOM 0 HD2 PRO A 126 1.913 -15.368 -6.339 1.00 0.00 H new ATOM 0 HD3 PRO A 126 3.181 -16.538 -6.031 1.00 0.00 H new ATOM 2030 N ILE A 127 3.103 -12.970 -8.921 1.00 0.00 N ATOM 2031 CA ILE A 127 2.601 -11.861 -9.723 1.00 0.00 C ATOM 2032 C ILE A 127 3.512 -10.643 -9.608 1.00 0.00 C ATOM 2033 O ILE A 127 3.749 -9.938 -10.588 1.00 0.00 O ATOM 2034 CB ILE A 127 1.174 -11.463 -9.303 1.00 0.00 C ATOM 2035 CG1 ILE A 127 0.211 -12.632 -9.520 1.00 0.00 C ATOM 2036 CG2 ILE A 127 0.715 -10.240 -10.082 1.00 0.00 C ATOM 2037 CD1 ILE A 127 0.085 -13.542 -8.318 1.00 0.00 C ATOM 0 H ILE A 127 2.825 -12.941 -7.940 1.00 0.00 H new ATOM 0 HA ILE A 127 2.584 -12.202 -10.758 1.00 0.00 H new ATOM 0 HB ILE A 127 1.179 -11.213 -8.242 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.774 -12.239 -9.773 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.550 -13.217 -10.375 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.295 -9.971 -9.774 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.389 -9.407 -9.882 1.00 0.00 H new ATOM 0 HG23 ILE A 127 0.722 -10.464 -11.149 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.613 -14.348 -8.543 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.061 -13.964 -8.077 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.283 -12.971 -7.466 1.00 0.00 H new ATOM 2049 N ALA A 128 4.020 -10.403 -8.404 1.00 0.00 N ATOM 2050 CA ALA A 128 4.908 -9.273 -8.160 1.00 0.00 C ATOM 2051 C ALA A 128 6.278 -9.507 -8.786 1.00 0.00 C ATOM 2052 O ALA A 128 6.814 -8.637 -9.475 1.00 0.00 O ATOM 2053 CB ALA A 128 5.043 -9.020 -6.666 1.00 0.00 C ATOM 0 H ALA A 128 3.832 -10.976 -7.582 1.00 0.00 H new ATOM 0 HA ALA A 128 4.470 -8.391 -8.627 1.00 0.00 H new ATOM 0 HB1 ALA A 128 5.709 -8.173 -6.499 1.00 0.00 H new ATOM 0 HB2 ALA A 128 4.062 -8.799 -6.244 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.454 -9.906 -6.183 1.00 0.00 H new ATOM 2059 N LEU A 129 6.841 -10.685 -8.543 1.00 0.00 N ATOM 2060 CA LEU A 129 8.151 -11.033 -9.082 1.00 0.00 C ATOM 2061 C LEU A 129 8.107 -11.124 -10.604 1.00 0.00 C ATOM 2062 O LEU A 129 9.065 -10.762 -11.286 1.00 0.00 O ATOM 2063 CB LEU A 129 8.630 -12.362 -8.494 1.00 0.00 C ATOM 2064 CG LEU A 129 8.583 -12.477 -6.970 1.00 0.00 C ATOM 2065 CD1 LEU A 129 8.976 -13.879 -6.529 1.00 0.00 C ATOM 2066 CD2 LEU A 129 9.493 -11.440 -6.329 1.00 0.00 C ATOM 0 H LEU A 129 6.411 -11.416 -7.976 1.00 0.00 H new ATOM 0 HA LEU A 129 8.852 -10.246 -8.803 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.024 -13.163 -8.918 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.656 -12.532 -8.820 1.00 0.00 H new ATOM 0 HG LEU A 129 7.561 -12.287 -6.641 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.937 -13.943 -5.442 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.285 -14.603 -6.960 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.988 -14.097 -6.869 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.447 -11.536 -5.244 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.518 -11.598 -6.664 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.167 -10.441 -6.619 1.00 0.00 H new ATOM 2078 N ALA A 130 6.986 -11.608 -11.130 1.00 0.00 N ATOM 2079 CA ALA A 130 6.815 -11.742 -12.572 1.00 0.00 C ATOM 2080 C ALA A 130 7.330 -10.507 -13.303 1.00 0.00 C ATOM 2081 O ALA A 130 8.128 -10.612 -14.235 1.00 0.00 O ATOM 2082 CB ALA A 130 5.351 -11.985 -12.909 1.00 0.00 C ATOM 0 H ALA A 130 6.183 -11.914 -10.580 1.00 0.00 H new ATOM 0 HA ALA A 130 7.401 -12.599 -12.905 1.00 0.00 H new ATOM 0 HB1 ALA A 130 5.238 -12.083 -13.989 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.013 -12.901 -12.424 1.00 0.00 H new ATOM 0 HB3 ALA A 130 4.752 -11.145 -12.556 1.00 0.00 H new ATOM 2088 N THR A 131 6.869 -9.336 -12.875 1.00 0.00 N ATOM 2089 CA THR A 131 7.282 -8.081 -13.490 1.00 0.00 C ATOM 2090 C THR A 131 8.801 -7.955 -13.518 1.00 0.00 C ATOM 2091 O THR A 131 9.374 -7.447 -14.481 1.00 0.00 O ATOM 2092 CB THR A 131 6.692 -6.869 -12.745 1.00 0.00 C ATOM 2093 OG1 THR A 131 7.321 -6.726 -11.467 1.00 0.00 O ATOM 2094 CG2 THR A 131 5.190 -7.025 -12.561 1.00 0.00 C ATOM 0 H THR A 131 6.209 -9.231 -12.104 1.00 0.00 H new ATOM 0 HA THR A 131 6.902 -8.091 -14.512 1.00 0.00 H new ATOM 0 HB THR A 131 6.878 -5.977 -13.344 1.00 0.00 H new ATOM 0 HG1 THR A 131 7.047 -7.464 -10.883 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.796 -6.157 -12.032 1.00 0.00 H new ATOM 0 HG22 THR A 131 4.710 -7.104 -13.537 1.00 0.00 H new ATOM 0 HG23 THR A 131 4.986 -7.926 -11.982 1.00 0.00 H new ATOM 2102 N GLY A 132 9.448 -8.424 -12.455 1.00 0.00 N ATOM 2103 CA GLY A 132 10.896 -8.355 -12.379 1.00 0.00 C ATOM 2104 C GLY A 132 11.377 -7.220 -11.496 1.00 0.00 C ATOM 2105 O GLY A 132 12.528 -6.794 -11.594 1.00 0.00 O ATOM 0 H GLY A 132 8.996 -8.850 -11.646 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.282 -9.299 -11.994 1.00 0.00 H new ATOM 0 HA3 GLY A 132 11.304 -8.229 -13.382 1.00 0.00 H new ATOM 2109 N ILE A 133 10.494 -6.729 -10.634 1.00 0.00 N ATOM 2110 CA ILE A 133 10.835 -5.637 -9.731 1.00 0.00 C ATOM 2111 C ILE A 133 11.685 -6.132 -8.565 1.00 0.00 C ATOM 2112 O ILE A 133 11.396 -7.171 -7.971 1.00 0.00 O ATOM 2113 CB ILE A 133 9.573 -4.950 -9.176 1.00 0.00 C ATOM 2114 CG1 ILE A 133 8.781 -4.297 -10.310 1.00 0.00 C ATOM 2115 CG2 ILE A 133 9.950 -3.919 -8.123 1.00 0.00 C ATOM 2116 CD1 ILE A 133 7.350 -3.975 -9.940 1.00 0.00 C ATOM 0 H ILE A 133 9.537 -7.070 -10.542 1.00 0.00 H new ATOM 0 HA ILE A 133 11.406 -4.914 -10.313 1.00 0.00 H new ATOM 0 HB ILE A 133 8.943 -5.705 -8.706 1.00 0.00 H new ATOM 0 HG12 ILE A 133 9.285 -3.379 -10.613 1.00 0.00 H new ATOM 0 HG13 ILE A 133 8.784 -4.962 -11.174 1.00 0.00 H new ATOM 0 HG21 ILE A 133 9.047 -3.442 -7.741 1.00 0.00 H new ATOM 0 HG22 ILE A 133 10.475 -4.411 -7.304 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.598 -3.164 -8.568 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.849 -3.514 -10.791 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.830 -4.893 -9.666 1.00 0.00 H new ATOM 0 HD13 ILE A 133 7.339 -3.286 -9.096 1.00 0.00 H new ATOM 2128 N ARG A 134 12.732 -5.380 -8.243 1.00 0.00 N ATOM 2129 CA ARG A 134 13.624 -5.742 -7.148 1.00 0.00 C ATOM 2130 C ARG A 134 12.829 -6.198 -5.927 1.00 0.00 C ATOM 2131 O ARG A 134 11.997 -5.467 -5.389 1.00 0.00 O ATOM 2132 CB ARG A 134 14.516 -4.557 -6.775 1.00 0.00 C ATOM 2133 CG ARG A 134 13.741 -3.295 -6.433 1.00 0.00 C ATOM 2134 CD ARG A 134 14.592 -2.050 -6.622 1.00 0.00 C ATOM 2135 NE ARG A 134 15.094 -1.932 -7.988 1.00 0.00 N ATOM 2136 CZ ARG A 134 16.170 -1.226 -8.318 1.00 0.00 C ATOM 2137 NH1 ARG A 134 16.853 -0.578 -7.385 1.00 0.00 N ATOM 2138 NH2 ARG A 134 16.565 -1.168 -9.584 1.00 0.00 N ATOM 0 H ARG A 134 12.984 -4.517 -8.724 1.00 0.00 H new ATOM 0 HA ARG A 134 14.251 -6.569 -7.482 1.00 0.00 H new ATOM 0 HB2 ARG A 134 15.136 -4.834 -5.923 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.190 -4.345 -7.605 1.00 0.00 H new ATOM 0 HG2 ARG A 134 12.854 -3.230 -7.063 1.00 0.00 H new ATOM 0 HG3 ARG A 134 13.396 -3.348 -5.401 1.00 0.00 H new ATOM 0 HD2 ARG A 134 14.002 -1.167 -6.375 1.00 0.00 H new ATOM 0 HD3 ARG A 134 15.432 -2.077 -5.928 1.00 0.00 H new ATOM 0 HE ARG A 134 14.591 -2.418 -8.730 1.00 0.00 H new ATOM 0 HH11 ARG A 134 16.553 -0.621 -6.411 1.00 0.00 H new ATOM 0 HH12 ARG A 134 17.679 -0.037 -7.641 1.00 0.00 H new ATOM 0 HH21 ARG A 134 16.042 -1.666 -10.305 1.00 0.00 H new ATOM 0 HH22 ARG A 134 17.391 -0.626 -9.836 1.00 0.00 H new ATOM 2152 N PRO A 135 13.089 -7.435 -5.480 1.00 0.00 N ATOM 2153 CA PRO A 135 12.409 -8.016 -4.318 1.00 0.00 C ATOM 2154 C PRO A 135 12.823 -7.350 -3.011 1.00 0.00 C ATOM 2155 O PRO A 135 13.989 -7.002 -2.822 1.00 0.00 O ATOM 2156 CB PRO A 135 12.858 -9.480 -4.339 1.00 0.00 C ATOM 2157 CG PRO A 135 14.166 -9.464 -5.053 1.00 0.00 C ATOM 2158 CD PRO A 135 14.068 -8.362 -6.072 1.00 0.00 C ATOM 0 HA PRO A 135 11.328 -7.887 -4.372 1.00 0.00 H new ATOM 0 HB2 PRO A 135 12.963 -9.877 -3.329 1.00 0.00 H new ATOM 0 HB3 PRO A 135 12.133 -10.109 -4.855 1.00 0.00 H new ATOM 0 HG2 PRO A 135 14.987 -9.282 -4.359 1.00 0.00 H new ATOM 0 HG3 PRO A 135 14.360 -10.423 -5.533 1.00 0.00 H new ATOM 0 HD2 PRO A 135 15.031 -7.879 -6.235 1.00 0.00 H new ATOM 0 HD3 PRO A 135 13.732 -8.737 -7.039 1.00 0.00 H new ATOM 2166 N PHE A 136 11.862 -7.176 -2.110 1.00 0.00 N ATOM 2167 CA PHE A 136 12.127 -6.551 -0.819 1.00 0.00 C ATOM 2168 C PHE A 136 13.418 -7.089 -0.210 1.00 0.00 C ATOM 2169 O PHE A 136 14.423 -6.385 -0.100 1.00 0.00 O ATOM 2170 CB PHE A 136 10.958 -6.793 0.138 1.00 0.00 C ATOM 2171 CG PHE A 136 10.002 -5.638 0.221 1.00 0.00 C ATOM 2172 CD1 PHE A 136 9.428 -5.113 -0.926 1.00 0.00 C ATOM 2173 CD2 PHE A 136 9.677 -5.077 1.445 1.00 0.00 C ATOM 2174 CE1 PHE A 136 8.548 -4.050 -0.854 1.00 0.00 C ATOM 2175 CE2 PHE A 136 8.796 -4.014 1.524 1.00 0.00 C ATOM 2176 CZ PHE A 136 8.232 -3.500 0.373 1.00 0.00 C ATOM 0 H PHE A 136 10.892 -7.459 -2.250 1.00 0.00 H new ATOM 0 HA PHE A 136 12.240 -5.479 -0.978 1.00 0.00 H new ATOM 0 HB2 PHE A 136 10.414 -7.682 -0.183 1.00 0.00 H new ATOM 0 HB3 PHE A 136 11.351 -7.001 1.133 1.00 0.00 H new ATOM 0 HD1 PHE A 136 9.671 -5.540 -1.888 1.00 0.00 H new ATOM 0 HD2 PHE A 136 10.117 -5.474 2.348 1.00 0.00 H new ATOM 0 HE1 PHE A 136 8.108 -3.650 -1.756 1.00 0.00 H new ATOM 0 HE2 PHE A 136 8.549 -3.586 2.485 1.00 0.00 H new ATOM 0 HZ PHE A 136 7.545 -2.669 0.432 1.00 0.00 H new ATOM 2186 N PRO A 137 13.393 -8.367 0.197 1.00 0.00 N ATOM 2187 CA PRO A 137 14.552 -9.028 0.802 1.00 0.00 C ATOM 2188 C PRO A 137 15.673 -9.268 -0.204 1.00 0.00 C ATOM 2189 O PRO A 137 15.643 -8.747 -1.318 1.00 0.00 O ATOM 2190 CB PRO A 137 13.983 -10.361 1.296 1.00 0.00 C ATOM 2191 CG PRO A 137 12.804 -10.616 0.422 1.00 0.00 C ATOM 2192 CD PRO A 137 12.230 -9.265 0.096 1.00 0.00 C ATOM 0 HA PRO A 137 15.001 -8.423 1.589 1.00 0.00 H new ATOM 0 HB2 PRO A 137 14.719 -11.161 1.212 1.00 0.00 H new ATOM 0 HB3 PRO A 137 13.693 -10.303 2.345 1.00 0.00 H new ATOM 0 HG2 PRO A 137 13.098 -11.144 -0.485 1.00 0.00 H new ATOM 0 HG3 PRO A 137 12.069 -11.240 0.931 1.00 0.00 H new ATOM 0 HD2 PRO A 137 11.792 -9.245 -0.902 1.00 0.00 H new ATOM 0 HD3 PRO A 137 11.443 -8.983 0.795 1.00 0.00 H new ATOM 2200 N SER A 138 16.662 -10.061 0.197 1.00 0.00 N ATOM 2201 CA SER A 138 17.795 -10.367 -0.668 1.00 0.00 C ATOM 2202 C SER A 138 17.327 -11.025 -1.963 1.00 0.00 C ATOM 2203 O SER A 138 17.594 -10.529 -3.057 1.00 0.00 O ATOM 2204 CB SER A 138 18.783 -11.285 0.055 1.00 0.00 C ATOM 2205 OG SER A 138 18.130 -12.430 0.574 1.00 0.00 O ATOM 0 H SER A 138 16.701 -10.503 1.115 1.00 0.00 H new ATOM 0 HA SER A 138 18.295 -9.430 -0.916 1.00 0.00 H new ATOM 0 HB2 SER A 138 19.570 -11.592 -0.634 1.00 0.00 H new ATOM 0 HB3 SER A 138 19.265 -10.739 0.866 1.00 0.00 H new ATOM 0 HG SER A 138 18.783 -13.001 1.030 1.00 0.00 H new ATOM 2211 N GLY A 139 16.626 -12.148 -1.830 1.00 0.00 N ATOM 2212 CA GLY A 139 16.132 -12.856 -2.996 1.00 0.00 C ATOM 2213 C GLY A 139 16.081 -14.356 -2.784 1.00 0.00 C ATOM 2214 O GLY A 139 16.276 -14.855 -1.675 1.00 0.00 O ATOM 0 H GLY A 139 16.392 -12.579 -0.936 1.00 0.00 H new ATOM 0 HA2 GLY A 139 15.134 -12.493 -3.242 1.00 0.00 H new ATOM 0 HA3 GLY A 139 16.772 -12.634 -3.850 1.00 0.00 H new ATOM 2218 N PRO A 140 15.812 -15.102 -3.866 1.00 0.00 N ATOM 2219 CA PRO A 140 15.729 -16.565 -3.819 1.00 0.00 C ATOM 2220 C PRO A 140 17.088 -17.216 -3.587 1.00 0.00 C ATOM 2221 O PRO A 140 17.232 -18.086 -2.728 1.00 0.00 O ATOM 2222 CB PRO A 140 15.188 -16.934 -5.202 1.00 0.00 C ATOM 2223 CG PRO A 140 15.598 -15.805 -6.083 1.00 0.00 C ATOM 2224 CD PRO A 140 15.569 -14.574 -5.219 1.00 0.00 C ATOM 0 HA PRO A 140 15.104 -16.911 -2.996 1.00 0.00 H new ATOM 0 HB2 PRO A 140 15.604 -17.879 -5.550 1.00 0.00 H new ATOM 0 HB3 PRO A 140 14.104 -17.050 -5.185 1.00 0.00 H new ATOM 0 HG2 PRO A 140 16.595 -15.971 -6.492 1.00 0.00 H new ATOM 0 HG3 PRO A 140 14.919 -15.704 -6.929 1.00 0.00 H new ATOM 0 HD2 PRO A 140 16.335 -13.857 -5.514 1.00 0.00 H new ATOM 0 HD3 PRO A 140 14.610 -14.060 -5.284 1.00 0.00 H new ATOM 2232 N SER A 141 18.083 -16.788 -4.358 1.00 0.00 N ATOM 2233 CA SER A 141 19.430 -17.333 -4.239 1.00 0.00 C ATOM 2234 C SER A 141 19.441 -18.828 -4.544 1.00 0.00 C ATOM 2235 O SER A 141 20.081 -19.611 -3.842 1.00 0.00 O ATOM 2236 CB SER A 141 19.981 -17.083 -2.834 1.00 0.00 C ATOM 2237 OG SER A 141 21.398 -17.039 -2.842 1.00 0.00 O ATOM 0 H SER A 141 17.981 -16.066 -5.071 1.00 0.00 H new ATOM 0 HA SER A 141 20.065 -16.828 -4.966 1.00 0.00 H new ATOM 0 HB2 SER A 141 19.587 -16.143 -2.447 1.00 0.00 H new ATOM 0 HB3 SER A 141 19.642 -17.871 -2.162 1.00 0.00 H new ATOM 0 HG SER A 141 21.725 -16.877 -1.933 1.00 0.00 H new ATOM 2243 N SER A 142 18.729 -19.215 -5.597 1.00 0.00 N ATOM 2244 CA SER A 142 18.652 -20.616 -5.994 1.00 0.00 C ATOM 2245 C SER A 142 19.167 -20.806 -7.417 1.00 0.00 C ATOM 2246 O SER A 142 20.042 -21.635 -7.668 1.00 0.00 O ATOM 2247 CB SER A 142 17.212 -21.121 -5.889 1.00 0.00 C ATOM 2248 OG SER A 142 16.346 -20.367 -6.720 1.00 0.00 O ATOM 0 H SER A 142 18.197 -18.578 -6.191 1.00 0.00 H new ATOM 0 HA SER A 142 19.281 -21.194 -5.318 1.00 0.00 H new ATOM 0 HB2 SER A 142 17.170 -22.172 -6.174 1.00 0.00 H new ATOM 0 HB3 SER A 142 16.875 -21.057 -4.854 1.00 0.00 H new ATOM 0 HG SER A 142 15.432 -20.710 -6.637 1.00 0.00 H new ATOM 2254 N GLY A 143 18.618 -20.031 -8.347 1.00 0.00 N ATOM 2255 CA GLY A 143 19.033 -20.129 -9.735 1.00 0.00 C ATOM 2256 C GLY A 143 17.916 -20.604 -10.642 1.00 0.00 C ATOM 2257 O GLY A 143 17.848 -20.218 -11.809 1.00 0.00 O ATOM 0 H GLY A 143 17.893 -19.337 -8.165 1.00 0.00 H new ATOM 0 HA2 GLY A 143 19.384 -19.155 -10.076 1.00 0.00 H new ATOM 0 HA3 GLY A 143 19.876 -20.816 -9.811 1.00 0.00 H new TER 2261 GLY A 143