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= 0.586 K(o=0.99,f=0.15) USER MOD Set 1.2: A 80 LYS NZ :NH3+ -148:sc= 0.0157 (180deg=0) USER MOD Set 1.3: A 81 ASN : amide:sc= 0.391 K(o=0.99,f=0.15) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 43:sc= 1.2 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 24:sc= 0.264 USER MOD Single : A 8 MET CE :methyl -176:sc= -0.154 (180deg=-0.176) USER MOD Single : A 12 LYS NZ :NH3+ -143:sc= -0.286 (180deg=-1.49!) USER MOD Single : A 13 GLN : amide:sc= -0.027 X(o=-0.027,f=-0.027) USER MOD Single : A 14 CYS SG : rot 180:sc= -0.0242 USER MOD Single : A 16 GLN :FLIP amide:sc= -0.389 F(o=-1.8,f=-0.39) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 CYS SG : rot 142:sc= -3.01! USER MOD Single : A 22 LYS NZ :NH3+ -97:sc= 1.19 (180deg=0.415) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.0765 X(o=-0.076,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -11.7! C(o=-12!,f=-14!) USER MOD Single : A 31 THR OG1 : rot -67:sc= 1.04 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 : amide:sc= -0.138 K(o=-0.14,f=-0.91) USER MOD Single : A 43 THR OG1 : rot -33:sc= 0.00966 USER MOD Single : A 51 CYS SG : rot 120:sc= -4.7! USER MOD Single : A 52 GLN : amide:sc= -0.934 K(o=-0.93,f=-7.1!) USER MOD Single : A 55 ASN : amide:sc= -1.94! C(o=-1.9!,f=-16!) USER MOD Single : A 56 ASN : amide:sc= -0.156 X(o=-0.16,f=-0.091) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 163:sc= -0.292 USER MOD Single : A 63 ASN : amide:sc= 0.0736 K(o=0.074,f=-5.6!) 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 -151:sc= 0 (180deg=-0.175) USER MOD Single : A 74 SER OG : rot 96:sc= 0.225 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 78 CYS SG : rot 93:sc= -0.676 USER MOD Single : A 84 THR OG1 : rot 80:sc= 0.0132 USER MOD Single : A 87 THR OG1 : rot 71:sc= 0.36 USER MOD Single : A 89 CYS SG : rot 134:sc= 0.135 USER MOD Single : A 90 CYS SG : rot -77:sc= -0.128 USER MOD Single : A 92 THR OG1 : rot 165:sc= 0.439 USER MOD Single : A 95 MET CE :methyl 174:sc= -0.918 (180deg=-1.03) USER MOD Single : A 97 LYS NZ :NH3+ -153:sc= -0.0522 (180deg=-0.869) 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 72:sc= 0.12 USER MOD Single : A 120 SER OG : rot -36:sc= -0.366 USER MOD Single : A 123 SER OG : rot -90:sc= 0.45 USER MOD Single : A 125 THR OG1 : rot -49:sc= 0.666 USER MOD Single : A 131 THR OG1 : rot -60:sc= 0.209 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 11:sc= 0.888 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.062 12.103 19.129 1.00 0.00 N ATOM 2 CA GLY A 1 6.272 11.782 19.862 1.00 0.00 C ATOM 3 C GLY A 1 7.480 11.646 18.957 1.00 0.00 C ATOM 4 O GLY A 1 8.152 10.615 18.957 1.00 0.00 O ATOM 0 H1 GLY A 1 4.266 12.185 19.793 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.189 13.005 18.627 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.863 11.349 18.441 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.462 12.560 20.602 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.125 10.851 20.409 1.00 0.00 H new ATOM 8 N SER A 2 7.756 12.689 18.181 1.00 0.00 N ATOM 9 CA SER A 2 8.888 12.680 17.262 1.00 0.00 C ATOM 10 C SER A 2 10.209 12.654 18.026 1.00 0.00 C ATOM 11 O SER A 2 10.683 13.686 18.503 1.00 0.00 O ATOM 12 CB SER A 2 8.840 13.905 16.347 1.00 0.00 C ATOM 13 OG SER A 2 9.082 15.096 17.075 1.00 0.00 O ATOM 0 H SER A 2 7.211 13.551 18.170 1.00 0.00 H new ATOM 0 HA SER A 2 8.822 11.778 16.654 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.583 13.801 15.556 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.865 13.963 15.863 1.00 0.00 H new ATOM 0 HG SER A 2 9.827 14.954 17.696 1.00 0.00 H new ATOM 19 N SER A 3 10.797 11.468 18.139 1.00 0.00 N ATOM 20 CA SER A 3 12.060 11.305 18.849 1.00 0.00 C ATOM 21 C SER A 3 13.190 10.976 17.878 1.00 0.00 C ATOM 22 O SER A 3 12.989 10.273 16.889 1.00 0.00 O ATOM 23 CB SER A 3 11.940 10.202 19.902 1.00 0.00 C ATOM 24 OG SER A 3 12.848 10.414 20.969 1.00 0.00 O ATOM 0 H SER A 3 10.419 10.605 17.748 1.00 0.00 H new ATOM 0 HA SER A 3 12.293 12.247 19.346 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.921 10.173 20.288 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.134 9.233 19.442 1.00 0.00 H new ATOM 0 HG SER A 3 12.750 9.696 21.629 1.00 0.00 H new ATOM 30 N GLY A 4 14.381 11.492 18.169 1.00 0.00 N ATOM 31 CA GLY A 4 15.526 11.243 17.313 1.00 0.00 C ATOM 32 C GLY A 4 15.759 9.764 17.072 1.00 0.00 C ATOM 33 O GLY A 4 15.780 8.970 18.012 1.00 0.00 O ATOM 0 H GLY A 4 14.573 12.078 18.982 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.377 11.745 16.357 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.416 11.679 17.766 1.00 0.00 H new ATOM 37 N SER A 5 15.932 9.393 15.807 1.00 0.00 N ATOM 38 CA SER A 5 16.159 7.999 15.444 1.00 0.00 C ATOM 39 C SER A 5 17.458 7.847 14.658 1.00 0.00 C ATOM 40 O SER A 5 17.991 8.819 14.124 1.00 0.00 O ATOM 41 CB SER A 5 14.985 7.467 14.619 1.00 0.00 C ATOM 42 OG SER A 5 13.901 7.098 15.454 1.00 0.00 O ATOM 0 H SER A 5 15.919 10.038 15.017 1.00 0.00 H new ATOM 0 HA SER A 5 16.241 7.419 16.363 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.660 8.229 13.911 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.308 6.605 14.035 1.00 0.00 H new ATOM 0 HG SER A 5 13.163 6.763 14.903 1.00 0.00 H new ATOM 48 N SER A 6 17.961 6.618 14.592 1.00 0.00 N ATOM 49 CA SER A 6 19.200 6.337 13.875 1.00 0.00 C ATOM 50 C SER A 6 19.061 5.079 13.023 1.00 0.00 C ATOM 51 O SER A 6 18.744 4.004 13.531 1.00 0.00 O ATOM 52 CB SER A 6 20.358 6.175 14.860 1.00 0.00 C ATOM 53 OG SER A 6 20.096 5.138 15.789 1.00 0.00 O ATOM 0 H SER A 6 17.530 5.802 15.026 1.00 0.00 H new ATOM 0 HA SER A 6 19.409 7.180 13.216 1.00 0.00 H new ATOM 0 HB2 SER A 6 21.276 5.955 14.314 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.520 7.112 15.393 1.00 0.00 H new ATOM 0 HG SER A 6 19.454 4.507 15.402 1.00 0.00 H new ATOM 59 N GLY A 7 19.300 5.222 11.723 1.00 0.00 N ATOM 60 CA GLY A 7 19.197 4.091 10.821 1.00 0.00 C ATOM 61 C GLY A 7 18.210 4.334 9.696 1.00 0.00 C ATOM 62 O GLY A 7 17.556 5.375 9.650 1.00 0.00 O ATOM 0 H GLY A 7 19.563 6.102 11.279 1.00 0.00 H new ATOM 0 HA2 GLY A 7 20.179 3.876 10.399 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.892 3.208 11.383 1.00 0.00 H new ATOM 66 N MET A 8 18.103 3.371 8.787 1.00 0.00 N ATOM 67 CA MET A 8 17.188 3.486 7.657 1.00 0.00 C ATOM 68 C MET A 8 15.849 2.826 7.971 1.00 0.00 C ATOM 69 O MET A 8 15.804 1.714 8.495 1.00 0.00 O ATOM 70 CB MET A 8 17.803 2.849 6.409 1.00 0.00 C ATOM 71 CG MET A 8 16.871 2.842 5.208 1.00 0.00 C ATOM 72 SD MET A 8 17.626 2.104 3.747 1.00 0.00 S ATOM 73 CE MET A 8 17.366 3.402 2.539 1.00 0.00 C ATOM 0 H MET A 8 18.638 2.503 8.810 1.00 0.00 H new ATOM 0 HA MET A 8 17.015 4.546 7.469 1.00 0.00 H new ATOM 0 HB2 MET A 8 18.714 3.387 6.148 1.00 0.00 H new ATOM 0 HB3 MET A 8 18.093 1.824 6.640 1.00 0.00 H new ATOM 0 HG2 MET A 8 15.964 2.293 5.460 1.00 0.00 H new ATOM 0 HG3 MET A 8 16.571 3.865 4.980 1.00 0.00 H new ATOM 0 HE1 MET A 8 17.716 3.066 1.563 1.00 0.00 H new ATOM 0 HE2 MET A 8 16.303 3.638 2.482 1.00 0.00 H new ATOM 0 HE3 MET A 8 17.920 4.292 2.836 1.00 0.00 H new ATOM 83 N GLU A 9 14.762 3.520 7.648 1.00 0.00 N ATOM 84 CA GLU A 9 13.423 3.001 7.898 1.00 0.00 C ATOM 85 C GLU A 9 12.944 2.146 6.729 1.00 0.00 C ATOM 86 O GLU A 9 13.352 2.332 5.583 1.00 0.00 O ATOM 87 CB GLU A 9 12.442 4.151 8.139 1.00 0.00 C ATOM 88 CG GLU A 9 12.869 5.091 9.254 1.00 0.00 C ATOM 89 CD GLU A 9 12.153 6.427 9.196 1.00 0.00 C ATOM 90 OE1 GLU A 9 12.585 7.299 8.414 1.00 0.00 O ATOM 91 OE2 GLU A 9 11.160 6.599 9.933 1.00 0.00 O ATOM 0 H GLU A 9 14.783 4.442 7.213 1.00 0.00 H new ATOM 0 HA GLU A 9 13.464 2.376 8.790 1.00 0.00 H new ATOM 0 HB2 GLU A 9 12.330 4.721 7.217 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.462 3.738 8.379 1.00 0.00 H new ATOM 0 HG2 GLU A 9 12.673 4.619 10.217 1.00 0.00 H new ATOM 0 HG3 GLU A 9 13.945 5.256 9.193 1.00 0.00 H new ATOM 98 N PRO A 10 12.057 1.184 7.024 1.00 0.00 N ATOM 99 CA PRO A 10 11.503 0.280 6.012 1.00 0.00 C ATOM 100 C PRO A 10 10.556 0.994 5.053 1.00 0.00 C ATOM 101 O PRO A 10 10.147 0.433 4.037 1.00 0.00 O ATOM 102 CB PRO A 10 10.741 -0.757 6.841 1.00 0.00 C ATOM 103 CG PRO A 10 10.396 -0.051 8.106 1.00 0.00 C ATOM 104 CD PRO A 10 11.526 0.905 8.369 1.00 0.00 C ATOM 0 HA PRO A 10 12.280 -0.148 5.379 1.00 0.00 H new ATOM 0 HB2 PRO A 10 9.846 -1.099 6.322 1.00 0.00 H new ATOM 0 HB3 PRO A 10 11.354 -1.638 7.034 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.449 0.481 8.010 1.00 0.00 H new ATOM 0 HG3 PRO A 10 10.283 -0.757 8.929 1.00 0.00 H new ATOM 0 HD2 PRO A 10 11.178 1.814 8.860 1.00 0.00 H new ATOM 0 HD3 PRO A 10 12.284 0.463 9.016 1.00 0.00 H new ATOM 112 N TRP A 11 10.214 2.235 5.382 1.00 0.00 N ATOM 113 CA TRP A 11 9.315 3.026 4.549 1.00 0.00 C ATOM 114 C TRP A 11 10.087 3.747 3.449 1.00 0.00 C ATOM 115 O TRP A 11 9.526 4.095 2.409 1.00 0.00 O ATOM 116 CB TRP A 11 8.554 4.040 5.404 1.00 0.00 C ATOM 117 CG TRP A 11 9.278 5.342 5.566 1.00 0.00 C ATOM 118 CD1 TRP A 11 10.092 5.704 6.601 1.00 0.00 C ATOM 119 CD2 TRP A 11 9.250 6.456 4.667 1.00 0.00 C ATOM 120 NE1 TRP A 11 10.573 6.975 6.399 1.00 0.00 N ATOM 121 CE2 TRP A 11 10.072 7.458 5.219 1.00 0.00 C ATOM 122 CE3 TRP A 11 8.613 6.703 3.448 1.00 0.00 C ATOM 123 CZ2 TRP A 11 10.270 8.686 4.593 1.00 0.00 C ATOM 124 CZ3 TRP A 11 8.811 7.922 2.828 1.00 0.00 C ATOM 125 CH2 TRP A 11 9.634 8.901 3.401 1.00 0.00 C ATOM 0 H TRP A 11 10.545 2.715 6.219 1.00 0.00 H new ATOM 0 HA TRP A 11 8.601 2.348 4.082 1.00 0.00 H new ATOM 0 HB2 TRP A 11 7.580 4.228 4.952 1.00 0.00 H new ATOM 0 HB3 TRP A 11 8.371 3.609 6.388 1.00 0.00 H new ATOM 0 HD1 TRP A 11 10.324 5.082 7.453 1.00 0.00 H new ATOM 0 HE1 TRP A 11 11.201 7.478 7.026 1.00 0.00 H new ATOM 0 HE3 TRP A 11 7.977 5.955 2.998 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 10.903 9.442 5.033 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 8.323 8.124 1.886 1.00 0.00 H new ATOM 0 HH2 TRP A 11 9.769 9.844 2.892 1.00 0.00 H new ATOM 136 N LYS A 12 11.375 3.969 3.684 1.00 0.00 N ATOM 137 CA LYS A 12 12.225 4.647 2.713 1.00 0.00 C ATOM 138 C LYS A 12 12.425 3.786 1.470 1.00 0.00 C ATOM 139 O LYS A 12 12.168 4.228 0.350 1.00 0.00 O ATOM 140 CB LYS A 12 13.581 4.984 3.338 1.00 0.00 C ATOM 141 CG LYS A 12 13.604 6.320 4.058 1.00 0.00 C ATOM 142 CD LYS A 12 13.251 7.465 3.123 1.00 0.00 C ATOM 143 CE LYS A 12 13.962 8.749 3.520 1.00 0.00 C ATOM 144 NZ LYS A 12 13.921 9.765 2.433 1.00 0.00 N ATOM 0 H LYS A 12 11.854 3.689 4.540 1.00 0.00 H new ATOM 0 HA LYS A 12 11.729 5.571 2.417 1.00 0.00 H new ATOM 0 HB2 LYS A 12 13.853 4.197 4.042 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.341 4.989 2.556 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.900 6.298 4.890 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.594 6.488 4.483 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.522 7.199 2.101 1.00 0.00 H new ATOM 0 HD3 LYS A 12 12.173 7.626 3.135 1.00 0.00 H new ATOM 0 HE2 LYS A 12 13.498 9.158 4.417 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.999 8.527 3.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 14.820 10.287 2.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 13.775 9.290 1.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 13.139 10.429 2.607 1.00 0.00 H new ATOM 158 N GLN A 13 12.884 2.556 1.675 1.00 0.00 N ATOM 159 CA GLN A 13 13.118 1.634 0.570 1.00 0.00 C ATOM 160 C GLN A 13 11.806 1.250 -0.105 1.00 0.00 C ATOM 161 O GLN A 13 11.763 1.019 -1.314 1.00 0.00 O ATOM 162 CB GLN A 13 13.835 0.378 1.069 1.00 0.00 C ATOM 163 CG GLN A 13 14.902 0.661 2.114 1.00 0.00 C ATOM 164 CD GLN A 13 15.880 -0.486 2.275 1.00 0.00 C ATOM 165 OE1 GLN A 13 16.715 -0.732 1.404 1.00 0.00 O ATOM 166 NE2 GLN A 13 15.783 -1.195 3.394 1.00 0.00 N ATOM 0 H GLN A 13 13.101 2.175 2.596 1.00 0.00 H new ATOM 0 HA GLN A 13 13.749 2.137 -0.163 1.00 0.00 H new ATOM 0 HB2 GLN A 13 13.099 -0.307 1.490 1.00 0.00 H new ATOM 0 HB3 GLN A 13 14.295 -0.129 0.221 1.00 0.00 H new ATOM 0 HG2 GLN A 13 15.448 1.562 1.835 1.00 0.00 H new ATOM 0 HG3 GLN A 13 14.423 0.862 3.072 1.00 0.00 H new ATOM 0 HE21 GLN A 13 15.076 -0.956 4.089 1.00 0.00 H new ATOM 0 HE22 GLN A 13 16.416 -1.978 3.558 1.00 0.00 H new ATOM 175 N CYS A 14 10.738 1.184 0.683 1.00 0.00 N ATOM 176 CA CYS A 14 9.424 0.827 0.161 1.00 0.00 C ATOM 177 C CYS A 14 9.006 1.777 -0.956 1.00 0.00 C ATOM 178 O CYS A 14 8.519 1.346 -2.001 1.00 0.00 O ATOM 179 CB CYS A 14 8.384 0.849 1.282 1.00 0.00 C ATOM 180 SG CYS A 14 6.708 0.436 0.742 1.00 0.00 S ATOM 0 H CYS A 14 10.757 1.373 1.685 1.00 0.00 H new ATOM 0 HA CYS A 14 9.485 -0.181 -0.249 1.00 0.00 H new ATOM 0 HB2 CYS A 14 8.687 0.147 2.058 1.00 0.00 H new ATOM 0 HB3 CYS A 14 8.374 1.840 1.735 1.00 0.00 H new ATOM 0 HG CYS A 14 5.901 0.479 1.760 1.00 0.00 H new ATOM 186 N ALA A 15 9.198 3.072 -0.727 1.00 0.00 N ATOM 187 CA ALA A 15 8.841 4.083 -1.715 1.00 0.00 C ATOM 188 C ALA A 15 9.261 3.655 -3.116 1.00 0.00 C ATOM 189 O ALA A 15 8.470 3.718 -4.057 1.00 0.00 O ATOM 190 CB ALA A 15 9.478 5.418 -1.356 1.00 0.00 C ATOM 0 H ALA A 15 9.599 3.446 0.133 1.00 0.00 H new ATOM 0 HA ALA A 15 7.757 4.195 -1.708 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.204 6.164 -2.102 1.00 0.00 H new ATOM 0 HB2 ALA A 15 9.125 5.738 -0.376 1.00 0.00 H new ATOM 0 HB3 ALA A 15 10.562 5.309 -1.333 1.00 0.00 H new ATOM 196 N GLN A 16 10.510 3.219 -3.248 1.00 0.00 N ATOM 197 CA GLN A 16 11.034 2.781 -4.536 1.00 0.00 C ATOM 198 C GLN A 16 10.117 1.742 -5.173 1.00 0.00 C ATOM 199 O GLN A 16 9.496 1.998 -6.204 1.00 0.00 O ATOM 200 CB GLN A 16 12.440 2.202 -4.368 1.00 0.00 C ATOM 201 CG GLN A 16 13.439 3.189 -3.784 1.00 0.00 C ATOM 202 CD GLN A 16 13.523 4.475 -4.582 1.00 0.00 C ATOM 203 OE1 GLN A 16 12.540 5.349 -4.401 1.00 0.00 O flip ATOM 204 NE2 GLN A 16 14.461 4.680 -5.353 1.00 0.00 N flip ATOM 0 H GLN A 16 11.177 3.160 -2.479 1.00 0.00 H new ATOM 0 HA GLN A 16 11.082 3.649 -5.194 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.388 1.325 -3.722 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.802 1.862 -5.338 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.157 3.421 -2.757 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.424 2.724 -3.747 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.195 3.980 -5.461 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.504 5.550 -5.884 1.00 0.00 H new ATOM 213 N TRP A 17 10.037 0.571 -4.552 1.00 0.00 N ATOM 214 CA TRP A 17 9.195 -0.506 -5.059 1.00 0.00 C ATOM 215 C TRP A 17 7.896 0.044 -5.637 1.00 0.00 C ATOM 216 O TRP A 17 7.491 -0.325 -6.740 1.00 0.00 O ATOM 217 CB TRP A 17 8.887 -1.508 -3.944 1.00 0.00 C ATOM 218 CG TRP A 17 8.144 -2.719 -4.422 1.00 0.00 C ATOM 219 CD1 TRP A 17 8.628 -3.714 -5.223 1.00 0.00 C ATOM 220 CD2 TRP A 17 6.785 -3.061 -4.130 1.00 0.00 C ATOM 221 NE1 TRP A 17 7.651 -4.654 -5.447 1.00 0.00 N ATOM 222 CE2 TRP A 17 6.511 -4.277 -4.787 1.00 0.00 C ATOM 223 CE3 TRP A 17 5.773 -2.460 -3.377 1.00 0.00 C ATOM 224 CZ2 TRP A 17 5.268 -4.900 -4.712 1.00 0.00 C ATOM 225 CZ3 TRP A 17 4.540 -3.079 -3.304 1.00 0.00 C ATOM 226 CH2 TRP A 17 4.296 -4.289 -3.967 1.00 0.00 C ATOM 0 H TRP A 17 10.545 0.343 -3.697 1.00 0.00 H new ATOM 0 HA TRP A 17 9.739 -1.014 -5.855 1.00 0.00 H new ATOM 0 HB2 TRP A 17 9.822 -1.824 -3.481 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.300 -1.012 -3.171 1.00 0.00 H new ATOM 0 HD1 TRP A 17 9.631 -3.756 -5.622 1.00 0.00 H new ATOM 0 HE1 TRP A 17 7.757 -5.496 -6.013 1.00 0.00 H new ATOM 0 HE3 TRP A 17 5.951 -1.528 -2.861 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 5.078 -5.832 -5.223 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 3.750 -2.622 -2.726 1.00 0.00 H new ATOM 0 HH2 TRP A 17 3.322 -4.749 -3.889 1.00 0.00 H new ATOM 237 N LEU A 18 7.247 0.928 -4.887 1.00 0.00 N ATOM 238 CA LEU A 18 5.993 1.529 -5.327 1.00 0.00 C ATOM 239 C LEU A 18 6.154 2.187 -6.694 1.00 0.00 C ATOM 240 O LEU A 18 5.407 1.892 -7.627 1.00 0.00 O ATOM 241 CB LEU A 18 5.514 2.562 -4.305 1.00 0.00 C ATOM 242 CG LEU A 18 5.087 2.011 -2.944 1.00 0.00 C ATOM 243 CD1 LEU A 18 5.005 3.129 -1.917 1.00 0.00 C ATOM 244 CD2 LEU A 18 3.753 1.288 -3.055 1.00 0.00 C ATOM 0 H LEU A 18 7.568 1.244 -3.972 1.00 0.00 H new ATOM 0 HA LEU A 18 5.249 0.737 -5.411 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.314 3.285 -4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.673 3.106 -4.735 1.00 0.00 H new ATOM 0 HG LEU A 18 5.839 1.295 -2.612 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.700 2.718 -0.955 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.982 3.602 -1.816 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.275 3.870 -2.243 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.465 0.903 -2.077 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.991 1.982 -3.410 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.845 0.460 -3.758 1.00 0.00 H new ATOM 256 N ILE A 19 7.134 3.077 -6.804 1.00 0.00 N ATOM 257 CA ILE A 19 7.395 3.774 -8.058 1.00 0.00 C ATOM 258 C ILE A 19 7.579 2.788 -9.207 1.00 0.00 C ATOM 259 O ILE A 19 6.997 2.952 -10.279 1.00 0.00 O ATOM 260 CB ILE A 19 8.647 4.665 -7.956 1.00 0.00 C ATOM 261 CG1 ILE A 19 8.474 5.699 -6.841 1.00 0.00 C ATOM 262 CG2 ILE A 19 8.916 5.353 -9.286 1.00 0.00 C ATOM 263 CD1 ILE A 19 9.713 6.529 -6.591 1.00 0.00 C ATOM 0 H ILE A 19 7.760 3.333 -6.041 1.00 0.00 H new ATOM 0 HA ILE A 19 6.527 4.402 -8.257 1.00 0.00 H new ATOM 0 HB ILE A 19 9.504 4.037 -7.714 1.00 0.00 H new ATOM 0 HG12 ILE A 19 7.647 6.362 -7.096 1.00 0.00 H new ATOM 0 HG13 ILE A 19 8.198 5.186 -5.920 1.00 0.00 H new ATOM 0 HG21 ILE A 19 9.804 5.979 -9.199 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.077 4.601 -10.059 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.060 5.972 -9.555 1.00 0.00 H new ATOM 0 HD11 ILE A 19 9.518 7.240 -5.788 1.00 0.00 H new ATOM 0 HD12 ILE A 19 10.537 5.875 -6.305 1.00 0.00 H new ATOM 0 HD13 ILE A 19 9.978 7.070 -7.499 1.00 0.00 H new ATOM 275 N HIS A 20 8.391 1.761 -8.974 1.00 0.00 N ATOM 276 CA HIS A 20 8.649 0.746 -9.989 1.00 0.00 C ATOM 277 C HIS A 20 7.388 -0.060 -10.285 1.00 0.00 C ATOM 278 O HIS A 20 7.178 -0.510 -11.412 1.00 0.00 O ATOM 279 CB HIS A 20 9.770 -0.188 -9.532 1.00 0.00 C ATOM 280 CG HIS A 20 11.136 0.417 -9.641 1.00 0.00 C ATOM 281 ND1 HIS A 20 12.017 0.108 -10.656 1.00 0.00 N ATOM 282 CD2 HIS A 20 11.770 1.319 -8.856 1.00 0.00 C ATOM 283 CE1 HIS A 20 13.135 0.792 -10.489 1.00 0.00 C ATOM 284 NE2 HIS A 20 13.010 1.535 -9.405 1.00 0.00 N ATOM 0 H HIS A 20 8.881 1.610 -8.092 1.00 0.00 H new ATOM 0 HA HIS A 20 8.958 1.252 -10.904 1.00 0.00 H new ATOM 0 HB2 HIS A 20 9.591 -0.477 -8.496 1.00 0.00 H new ATOM 0 HB3 HIS A 20 9.737 -1.100 -10.128 1.00 0.00 H new ATOM 0 HD2 HIS A 20 11.374 1.782 -7.964 1.00 0.00 H new ATOM 0 HE1 HIS A 20 14.003 0.750 -11.130 1.00 0.00 H new ATOM 0 HE2 HIS A 20 13.720 2.167 -9.035 1.00 0.00 H new ATOM 293 N CYS A 21 6.554 -0.239 -9.267 1.00 0.00 N ATOM 294 CA CYS A 21 5.314 -0.993 -9.418 1.00 0.00 C ATOM 295 C CYS A 21 4.305 -0.216 -10.258 1.00 0.00 C ATOM 296 O CYS A 21 3.197 -0.689 -10.510 1.00 0.00 O ATOM 297 CB CYS A 21 4.717 -1.312 -8.047 1.00 0.00 C ATOM 298 SG CYS A 21 5.613 -2.586 -7.130 1.00 0.00 S ATOM 0 H CYS A 21 6.713 0.127 -8.328 1.00 0.00 H new ATOM 0 HA CYS A 21 5.545 -1.926 -9.931 1.00 0.00 H new ATOM 0 HB2 CYS A 21 4.694 -0.399 -7.451 1.00 0.00 H new ATOM 0 HB3 CYS A 21 3.684 -1.633 -8.178 1.00 0.00 H new ATOM 0 HG CYS A 21 5.638 -2.275 -5.868 1.00 0.00 H new ATOM 304 N LYS A 22 4.695 0.979 -10.687 1.00 0.00 N ATOM 305 CA LYS A 22 3.826 1.823 -11.498 1.00 0.00 C ATOM 306 C LYS A 22 2.653 2.347 -10.675 1.00 0.00 C ATOM 307 O LYS A 22 1.502 2.287 -11.107 1.00 0.00 O ATOM 308 CB LYS A 22 3.305 1.041 -12.707 1.00 0.00 C ATOM 309 CG LYS A 22 4.382 0.249 -13.428 1.00 0.00 C ATOM 310 CD LYS A 22 5.429 1.163 -14.043 1.00 0.00 C ATOM 311 CE LYS A 22 6.447 0.377 -14.854 1.00 0.00 C ATOM 312 NZ LYS A 22 7.546 -0.154 -14.001 1.00 0.00 N ATOM 0 H LYS A 22 5.609 1.385 -10.486 1.00 0.00 H new ATOM 0 HA LYS A 22 4.411 2.674 -11.847 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.522 0.358 -12.378 1.00 0.00 H new ATOM 0 HB3 LYS A 22 2.846 1.737 -13.409 1.00 0.00 H new ATOM 0 HG2 LYS A 22 4.861 -0.436 -12.728 1.00 0.00 H new ATOM 0 HG3 LYS A 22 3.926 -0.360 -14.208 1.00 0.00 H new ATOM 0 HD2 LYS A 22 4.941 1.898 -14.683 1.00 0.00 H new ATOM 0 HD3 LYS A 22 5.939 1.716 -13.254 1.00 0.00 H new ATOM 0 HE2 LYS A 22 5.948 -0.450 -15.360 1.00 0.00 H new ATOM 0 HE3 LYS A 22 6.867 1.018 -15.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 8.363 0.488 -14.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 7.218 -0.225 -13.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 7.826 -1.096 -14.342 1.00 0.00 H new ATOM 326 N VAL A 23 2.954 2.860 -9.486 1.00 0.00 N ATOM 327 CA VAL A 23 1.925 3.397 -8.603 1.00 0.00 C ATOM 328 C VAL A 23 2.257 4.822 -8.174 1.00 0.00 C ATOM 329 O VAL A 23 1.364 5.624 -7.899 1.00 0.00 O ATOM 330 CB VAL A 23 1.750 2.522 -7.348 1.00 0.00 C ATOM 331 CG1 VAL A 23 1.317 1.115 -7.734 1.00 0.00 C ATOM 332 CG2 VAL A 23 3.037 2.489 -6.538 1.00 0.00 C ATOM 0 H VAL A 23 3.901 2.915 -9.112 1.00 0.00 H new ATOM 0 HA VAL A 23 0.993 3.399 -9.168 1.00 0.00 H new ATOM 0 HB VAL A 23 0.968 2.960 -6.727 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.198 0.511 -6.834 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.368 1.160 -8.269 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.074 0.665 -8.376 1.00 0.00 H new ATOM 0 HG21 VAL A 23 2.895 1.866 -5.655 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.840 2.076 -7.148 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.299 3.501 -6.230 1.00 0.00 H new ATOM 342 N LEU A 24 3.548 5.130 -8.118 1.00 0.00 N ATOM 343 CA LEU A 24 4.001 6.459 -7.722 1.00 0.00 C ATOM 344 C LEU A 24 5.007 7.013 -8.725 1.00 0.00 C ATOM 345 O LEU A 24 5.800 6.280 -9.316 1.00 0.00 O ATOM 346 CB LEU A 24 4.627 6.412 -6.327 1.00 0.00 C ATOM 347 CG LEU A 24 3.664 6.157 -5.167 1.00 0.00 C ATOM 348 CD1 LEU A 24 4.430 5.769 -3.912 1.00 0.00 C ATOM 349 CD2 LEU A 24 2.803 7.385 -4.909 1.00 0.00 C ATOM 0 H LEU A 24 4.300 4.478 -8.342 1.00 0.00 H new ATOM 0 HA LEU A 24 3.134 7.120 -7.702 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.389 5.632 -6.319 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.137 7.358 -6.148 1.00 0.00 H new ATOM 0 HG LEU A 24 3.010 5.329 -5.439 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.728 5.592 -3.097 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.003 4.861 -4.101 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.109 6.576 -3.636 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.124 7.185 -4.080 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.442 8.232 -4.658 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.225 7.619 -5.803 1.00 0.00 H new ATOM 361 N PRO A 25 4.978 8.340 -8.922 1.00 0.00 N ATOM 362 CA PRO A 25 5.883 9.022 -9.851 1.00 0.00 C ATOM 363 C PRO A 25 7.326 9.029 -9.357 1.00 0.00 C ATOM 364 O PRO A 25 7.580 9.069 -8.152 1.00 0.00 O ATOM 365 CB PRO A 25 5.329 10.448 -9.903 1.00 0.00 C ATOM 366 CG PRO A 25 4.619 10.626 -8.606 1.00 0.00 C ATOM 367 CD PRO A 25 4.060 9.276 -8.252 1.00 0.00 C ATOM 0 HA PRO A 25 5.918 8.527 -10.822 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.129 11.179 -10.020 1.00 0.00 H new ATOM 0 HB3 PRO A 25 4.651 10.579 -10.747 1.00 0.00 H new ATOM 0 HG2 PRO A 25 5.301 10.981 -7.833 1.00 0.00 H new ATOM 0 HG3 PRO A 25 3.824 11.367 -8.695 1.00 0.00 H new ATOM 0 HD2 PRO A 25 4.042 9.119 -7.174 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.036 9.159 -8.608 1.00 0.00 H new ATOM 375 N THR A 26 8.268 8.989 -10.293 1.00 0.00 N ATOM 376 CA THR A 26 9.685 8.989 -9.952 1.00 0.00 C ATOM 377 C THR A 26 10.071 10.262 -9.208 1.00 0.00 C ATOM 378 O THR A 26 11.081 10.300 -8.507 1.00 0.00 O ATOM 379 CB THR A 26 10.565 8.856 -11.209 1.00 0.00 C ATOM 380 OG1 THR A 26 10.462 10.040 -12.008 1.00 0.00 O ATOM 381 CG2 THR A 26 10.153 7.645 -12.033 1.00 0.00 C ATOM 0 H THR A 26 8.075 8.956 -11.294 1.00 0.00 H new ATOM 0 HA THR A 26 9.855 8.128 -9.306 1.00 0.00 H new ATOM 0 HB THR A 26 11.598 8.723 -10.889 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.026 9.947 -12.804 1.00 0.00 H new ATOM 0 HG21 THR A 26 10.789 7.572 -12.915 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.261 6.742 -11.432 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.113 7.752 -12.343 1.00 0.00 H new ATOM 389 N ASN A 27 9.260 11.303 -9.366 1.00 0.00 N ATOM 390 CA ASN A 27 9.517 12.579 -8.708 1.00 0.00 C ATOM 391 C ASN A 27 8.472 12.857 -7.632 1.00 0.00 C ATOM 392 O ASN A 27 8.267 14.004 -7.231 1.00 0.00 O ATOM 393 CB ASN A 27 9.524 13.714 -9.734 1.00 0.00 C ATOM 394 CG ASN A 27 10.877 13.886 -10.397 1.00 0.00 C ATOM 395 OD1 ASN A 27 11.008 13.739 -11.613 1.00 0.00 O ATOM 396 ND2 ASN A 27 11.891 14.198 -9.599 1.00 0.00 N ATOM 0 H ASN A 27 8.420 11.288 -9.944 1.00 0.00 H new ATOM 0 HA ASN A 27 10.496 12.523 -8.232 1.00 0.00 H new ATOM 0 HB2 ASN A 27 8.771 13.515 -10.497 1.00 0.00 H new ATOM 0 HB3 ASN A 27 9.242 14.645 -9.243 1.00 0.00 H new ATOM 0 HD21 ASN A 27 12.825 14.326 -9.988 1.00 0.00 H new ATOM 0 HD22 ASN A 27 11.736 14.310 -8.597 1.00 0.00 H new ATOM 403 N HIS A 28 7.812 11.800 -7.168 1.00 0.00 N ATOM 404 CA HIS A 28 6.788 11.930 -6.138 1.00 0.00 C ATOM 405 C HIS A 28 7.316 12.720 -4.944 1.00 0.00 C ATOM 406 O HIS A 28 8.515 12.982 -4.842 1.00 0.00 O ATOM 407 CB HIS A 28 6.316 10.549 -5.682 1.00 0.00 C ATOM 408 CG HIS A 28 4.921 10.544 -5.136 1.00 0.00 C ATOM 409 ND1 HIS A 28 4.552 9.822 -4.021 1.00 0.00 N ATOM 410 CD2 HIS A 28 3.802 11.179 -5.558 1.00 0.00 C ATOM 411 CE1 HIS A 28 3.267 10.012 -3.781 1.00 0.00 C ATOM 412 NE2 HIS A 28 2.788 10.832 -4.700 1.00 0.00 N ATOM 0 H HIS A 28 7.968 10.845 -7.489 1.00 0.00 H new ATOM 0 HA HIS A 28 5.944 12.472 -6.565 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.371 9.859 -6.524 1.00 0.00 H new ATOM 0 HB3 HIS A 28 6.998 10.175 -4.918 1.00 0.00 H new ATOM 0 HD2 HIS A 28 3.722 11.836 -6.411 1.00 0.00 H new ATOM 0 HE1 HIS A 28 2.704 9.572 -2.971 1.00 0.00 H new ATOM 0 HE2 HIS A 28 1.822 11.155 -4.762 1.00 0.00 H new ATOM 421 N ARG A 29 6.413 13.096 -4.044 1.00 0.00 N ATOM 422 CA ARG A 29 6.788 13.858 -2.858 1.00 0.00 C ATOM 423 C ARG A 29 7.314 12.934 -1.763 1.00 0.00 C ATOM 424 O ARG A 29 7.984 13.379 -0.831 1.00 0.00 O ATOM 425 CB ARG A 29 5.590 14.653 -2.337 1.00 0.00 C ATOM 426 CG ARG A 29 4.402 13.786 -1.957 1.00 0.00 C ATOM 427 CD ARG A 29 3.225 14.627 -1.487 1.00 0.00 C ATOM 428 NE ARG A 29 3.261 14.862 -0.046 1.00 0.00 N ATOM 429 CZ ARG A 29 2.439 15.694 0.584 1.00 0.00 C ATOM 430 NH1 ARG A 29 1.521 16.366 -0.097 1.00 0.00 N ATOM 431 NH2 ARG A 29 2.533 15.855 1.897 1.00 0.00 N ATOM 0 H ARG A 29 5.417 12.886 -4.113 1.00 0.00 H new ATOM 0 HA ARG A 29 7.581 14.551 -3.137 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.900 15.232 -1.467 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.279 15.367 -3.100 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.101 13.184 -2.814 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.694 13.093 -1.168 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.231 15.583 -2.010 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.293 14.126 -1.749 1.00 0.00 H new ATOM 0 HE ARG A 29 3.955 14.360 0.507 1.00 0.00 H new ATOM 0 HH11 ARG A 29 1.445 16.245 -1.107 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.891 17.004 0.389 1.00 0.00 H new ATOM 0 HH21 ARG A 29 3.237 15.340 2.425 1.00 0.00 H new ATOM 0 HH22 ARG A 29 1.901 16.494 2.379 1.00 0.00 H new ATOM 445 N VAL A 30 7.005 11.647 -1.882 1.00 0.00 N ATOM 446 CA VAL A 30 7.447 10.661 -0.904 1.00 0.00 C ATOM 447 C VAL A 30 8.923 10.327 -1.087 1.00 0.00 C ATOM 448 O VAL A 30 9.561 9.766 -0.195 1.00 0.00 O ATOM 449 CB VAL A 30 6.623 9.364 -1.003 1.00 0.00 C ATOM 450 CG1 VAL A 30 5.134 9.675 -0.991 1.00 0.00 C ATOM 451 CG2 VAL A 30 7.003 8.585 -2.253 1.00 0.00 C ATOM 0 H VAL A 30 6.450 11.263 -2.647 1.00 0.00 H new ATOM 0 HA VAL A 30 7.298 11.104 0.081 1.00 0.00 H new ATOM 0 HB VAL A 30 6.848 8.745 -0.135 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.568 8.746 -1.062 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.877 10.187 -0.064 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.889 10.315 -1.839 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.411 7.671 -2.307 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.809 9.195 -3.135 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.062 8.329 -2.214 1.00 0.00 H new ATOM 461 N THR A 31 9.463 10.677 -2.251 1.00 0.00 N ATOM 462 CA THR A 31 10.865 10.414 -2.553 1.00 0.00 C ATOM 463 C THR A 31 11.767 11.487 -1.953 1.00 0.00 C ATOM 464 O THR A 31 12.991 11.360 -1.966 1.00 0.00 O ATOM 465 CB THR A 31 11.109 10.345 -4.072 1.00 0.00 C ATOM 466 OG1 THR A 31 10.921 11.639 -4.658 1.00 0.00 O ATOM 467 CG2 THR A 31 10.167 9.345 -4.726 1.00 0.00 C ATOM 0 H THR A 31 8.951 11.143 -3.000 1.00 0.00 H new ATOM 0 HA THR A 31 11.108 9.449 -2.109 1.00 0.00 H new ATOM 0 HB THR A 31 12.135 10.017 -4.239 1.00 0.00 H new ATOM 0 HG1 THR A 31 9.976 11.891 -4.599 1.00 0.00 H new ATOM 0 HG21 THR A 31 10.358 9.313 -5.799 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.333 8.356 -4.299 1.00 0.00 H new ATOM 0 HG23 THR A 31 9.135 9.648 -4.550 1.00 0.00 H new ATOM 475 N TRP A 32 11.154 12.542 -1.428 1.00 0.00 N ATOM 476 CA TRP A 32 11.903 13.637 -0.823 1.00 0.00 C ATOM 477 C TRP A 32 12.339 13.281 0.594 1.00 0.00 C ATOM 478 O TRP A 32 11.582 12.675 1.352 1.00 0.00 O ATOM 479 CB TRP A 32 11.058 14.912 -0.804 1.00 0.00 C ATOM 480 CG TRP A 32 10.751 15.442 -2.172 1.00 0.00 C ATOM 481 CD1 TRP A 32 10.072 14.798 -3.166 1.00 0.00 C ATOM 482 CD2 TRP A 32 11.115 16.723 -2.696 1.00 0.00 C ATOM 483 NE1 TRP A 32 9.991 15.603 -4.277 1.00 0.00 N ATOM 484 CE2 TRP A 32 10.623 16.790 -4.014 1.00 0.00 C ATOM 485 CE3 TRP A 32 11.807 17.822 -2.179 1.00 0.00 C ATOM 486 CZ2 TRP A 32 10.803 17.911 -4.820 1.00 0.00 C ATOM 487 CZ3 TRP A 32 11.985 18.934 -2.980 1.00 0.00 C ATOM 488 CH2 TRP A 32 11.484 18.972 -4.288 1.00 0.00 C ATOM 0 H TRP A 32 10.141 12.662 -1.409 1.00 0.00 H new ATOM 0 HA TRP A 32 12.795 13.810 -1.425 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.123 14.712 -0.282 1.00 0.00 H new ATOM 0 HB3 TRP A 32 11.583 15.679 -0.235 1.00 0.00 H new ATOM 0 HD1 TRP A 32 9.659 13.803 -3.090 1.00 0.00 H new ATOM 0 HE1 TRP A 32 9.534 15.357 -5.155 1.00 0.00 H new ATOM 0 HE3 TRP A 32 12.196 17.802 -1.172 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 10.419 17.942 -5.829 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 12.519 19.788 -2.591 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.638 19.856 -4.888 1.00 0.00 H new ATOM 499 N ASP A 33 13.563 13.660 0.945 1.00 0.00 N ATOM 500 CA ASP A 33 14.099 13.381 2.272 1.00 0.00 C ATOM 501 C ASP A 33 13.198 13.965 3.356 1.00 0.00 C ATOM 502 O ASP A 33 12.951 13.330 4.381 1.00 0.00 O ATOM 503 CB ASP A 33 15.512 13.950 2.405 1.00 0.00 C ATOM 504 CG ASP A 33 15.663 15.293 1.718 1.00 0.00 C ATOM 505 OD1 ASP A 33 15.186 16.303 2.278 1.00 0.00 O ATOM 506 OD2 ASP A 33 16.257 15.335 0.621 1.00 0.00 O ATOM 0 H ASP A 33 14.203 14.161 0.329 1.00 0.00 H new ATOM 0 HA ASP A 33 14.138 12.299 2.401 1.00 0.00 H new ATOM 0 HB2 ASP A 33 15.760 14.056 3.461 1.00 0.00 H new ATOM 0 HB3 ASP A 33 16.226 13.245 1.979 1.00 0.00 H new ATOM 511 N SER A 34 12.711 15.180 3.122 1.00 0.00 N ATOM 512 CA SER A 34 11.842 15.852 4.081 1.00 0.00 C ATOM 513 C SER A 34 10.594 15.020 4.359 1.00 0.00 C ATOM 514 O SER A 34 9.947 15.178 5.394 1.00 0.00 O ATOM 515 CB SER A 34 11.442 17.233 3.557 1.00 0.00 C ATOM 516 OG SER A 34 12.539 18.129 3.592 1.00 0.00 O ATOM 0 H SER A 34 12.903 15.718 2.277 1.00 0.00 H new ATOM 0 HA SER A 34 12.394 15.970 5.014 1.00 0.00 H new ATOM 0 HB2 SER A 34 11.073 17.145 2.535 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.624 17.631 4.158 1.00 0.00 H new ATOM 0 HG SER A 34 12.258 19.004 3.251 1.00 0.00 H new ATOM 522 N ALA A 35 10.261 14.134 3.426 1.00 0.00 N ATOM 523 CA ALA A 35 9.092 13.275 3.570 1.00 0.00 C ATOM 524 C ALA A 35 9.249 12.329 4.755 1.00 0.00 C ATOM 525 O ALA A 35 10.336 12.199 5.317 1.00 0.00 O ATOM 526 CB ALA A 35 8.855 12.487 2.290 1.00 0.00 C ATOM 0 H ALA A 35 10.784 13.992 2.562 1.00 0.00 H new ATOM 0 HA ALA A 35 8.226 13.910 3.758 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.979 11.850 2.412 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.689 13.178 1.463 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.727 11.868 2.077 1.00 0.00 H new ATOM 532 N GLN A 36 8.157 11.671 5.130 1.00 0.00 N ATOM 533 CA GLN A 36 8.174 10.738 6.250 1.00 0.00 C ATOM 534 C GLN A 36 7.074 9.692 6.105 1.00 0.00 C ATOM 535 O GLN A 36 6.140 9.863 5.321 1.00 0.00 O ATOM 536 CB GLN A 36 8.007 11.490 7.571 1.00 0.00 C ATOM 537 CG GLN A 36 9.172 12.411 7.899 1.00 0.00 C ATOM 538 CD GLN A 36 8.933 13.233 9.149 1.00 0.00 C ATOM 539 OE1 GLN A 36 8.069 14.110 9.174 1.00 0.00 O ATOM 540 NE2 GLN A 36 9.699 12.954 10.197 1.00 0.00 N ATOM 0 H GLN A 36 7.249 11.767 4.675 1.00 0.00 H new ATOM 0 HA GLN A 36 9.137 10.228 6.249 1.00 0.00 H new ATOM 0 HB2 GLN A 36 7.090 12.078 7.531 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.888 10.767 8.378 1.00 0.00 H new ATOM 0 HG2 GLN A 36 10.076 11.815 8.028 1.00 0.00 H new ATOM 0 HG3 GLN A 36 9.349 13.080 7.057 1.00 0.00 H new ATOM 0 HE21 GLN A 36 10.403 12.219 10.133 1.00 0.00 H new ATOM 0 HE22 GLN A 36 9.583 13.475 11.066 1.00 0.00 H new ATOM 549 N VAL A 37 7.190 8.608 6.865 1.00 0.00 N ATOM 550 CA VAL A 37 6.204 7.534 6.821 1.00 0.00 C ATOM 551 C VAL A 37 4.799 8.086 6.615 1.00 0.00 C ATOM 552 O VAL A 37 4.001 7.521 5.867 1.00 0.00 O ATOM 553 CB VAL A 37 6.230 6.695 8.113 1.00 0.00 C ATOM 554 CG1 VAL A 37 7.447 5.782 8.132 1.00 0.00 C ATOM 555 CG2 VAL A 37 6.213 7.600 9.335 1.00 0.00 C ATOM 0 H VAL A 37 7.957 8.450 7.519 1.00 0.00 H new ATOM 0 HA VAL A 37 6.468 6.897 5.977 1.00 0.00 H new ATOM 0 HB VAL A 37 5.337 6.071 8.139 1.00 0.00 H new ATOM 0 HG11 VAL A 37 7.449 5.197 9.052 1.00 0.00 H new ATOM 0 HG12 VAL A 37 7.411 5.110 7.275 1.00 0.00 H new ATOM 0 HG13 VAL A 37 8.354 6.384 8.083 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.232 6.991 10.239 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.087 8.251 9.318 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.308 8.207 9.325 1.00 0.00 H new ATOM 565 N PHE A 38 4.501 9.196 7.284 1.00 0.00 N ATOM 566 CA PHE A 38 3.190 9.826 7.175 1.00 0.00 C ATOM 567 C PHE A 38 2.854 10.134 5.718 1.00 0.00 C ATOM 568 O PHE A 38 1.887 9.606 5.168 1.00 0.00 O ATOM 569 CB PHE A 38 3.148 11.112 8.002 1.00 0.00 C ATOM 570 CG PHE A 38 1.775 11.458 8.504 1.00 0.00 C ATOM 571 CD1 PHE A 38 0.647 10.996 7.846 1.00 0.00 C ATOM 572 CD2 PHE A 38 1.613 12.244 9.632 1.00 0.00 C ATOM 573 CE1 PHE A 38 -0.618 11.314 8.304 1.00 0.00 C ATOM 574 CE2 PHE A 38 0.351 12.565 10.096 1.00 0.00 C ATOM 575 CZ PHE A 38 -0.766 12.098 9.431 1.00 0.00 C ATOM 0 H PHE A 38 5.150 9.677 7.907 1.00 0.00 H new ATOM 0 HA PHE A 38 2.447 9.129 7.562 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.822 11.010 8.853 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.523 11.937 7.396 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.757 10.381 6.965 1.00 0.00 H new ATOM 0 HD2 PHE A 38 2.483 12.611 10.156 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.490 10.950 7.781 1.00 0.00 H new ATOM 0 HE2 PHE A 38 0.239 13.180 10.977 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.753 12.346 9.792 1.00 0.00 H new ATOM 585 N ASP A 39 3.659 10.991 5.101 1.00 0.00 N ATOM 586 CA ASP A 39 3.449 11.370 3.708 1.00 0.00 C ATOM 587 C ASP A 39 3.054 10.159 2.869 1.00 0.00 C ATOM 588 O ASP A 39 2.013 10.159 2.211 1.00 0.00 O ATOM 589 CB ASP A 39 4.713 12.012 3.135 1.00 0.00 C ATOM 590 CG ASP A 39 5.086 13.295 3.851 1.00 0.00 C ATOM 591 OD1 ASP A 39 4.749 13.427 5.046 1.00 0.00 O ATOM 592 OD2 ASP A 39 5.714 14.169 3.216 1.00 0.00 O ATOM 0 H ASP A 39 4.463 11.437 5.543 1.00 0.00 H new ATOM 0 HA ASP A 39 2.636 12.095 3.674 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.540 11.306 3.206 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.563 12.221 2.076 1.00 0.00 H new ATOM 597 N LEU A 40 3.891 9.128 2.896 1.00 0.00 N ATOM 598 CA LEU A 40 3.630 7.910 2.137 1.00 0.00 C ATOM 599 C LEU A 40 2.400 7.186 2.676 1.00 0.00 C ATOM 600 O LEU A 40 1.729 6.457 1.947 1.00 0.00 O ATOM 601 CB LEU A 40 4.846 6.982 2.190 1.00 0.00 C ATOM 602 CG LEU A 40 4.640 5.574 1.630 1.00 0.00 C ATOM 603 CD1 LEU A 40 4.215 5.637 0.172 1.00 0.00 C ATOM 604 CD2 LEU A 40 5.910 4.750 1.782 1.00 0.00 C ATOM 0 H LEU A 40 4.757 9.111 3.435 1.00 0.00 H new ATOM 0 HA LEU A 40 3.439 8.190 1.101 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.662 7.453 1.642 1.00 0.00 H new ATOM 0 HB3 LEU A 40 5.167 6.895 3.228 1.00 0.00 H new ATOM 0 HG LEU A 40 3.846 5.090 2.198 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.073 4.626 -0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.280 6.191 0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.987 6.140 -0.411 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.746 3.751 1.378 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.723 5.232 1.239 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.172 4.676 2.838 1.00 0.00 H new ATOM 616 N ALA A 41 2.110 7.394 3.956 1.00 0.00 N ATOM 617 CA ALA A 41 0.959 6.765 4.590 1.00 0.00 C ATOM 618 C ALA A 41 -0.326 7.522 4.271 1.00 0.00 C ATOM 619 O ALA A 41 -1.425 7.027 4.516 1.00 0.00 O ATOM 620 CB ALA A 41 1.165 6.683 6.096 1.00 0.00 C ATOM 0 H ALA A 41 2.657 7.994 4.574 1.00 0.00 H new ATOM 0 HA ALA A 41 0.863 5.755 4.191 1.00 0.00 H new ATOM 0 HB1 ALA A 41 0.297 6.211 6.557 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.056 6.092 6.310 1.00 0.00 H new ATOM 0 HB3 ALA A 41 1.290 7.687 6.501 1.00 0.00 H new ATOM 626 N GLN A 42 -0.178 8.725 3.724 1.00 0.00 N ATOM 627 CA GLN A 42 -1.328 9.550 3.374 1.00 0.00 C ATOM 628 C GLN A 42 -1.833 9.214 1.974 1.00 0.00 C ATOM 629 O GLN A 42 -3.025 8.980 1.772 1.00 0.00 O ATOM 630 CB GLN A 42 -0.961 11.033 3.454 1.00 0.00 C ATOM 631 CG GLN A 42 -0.530 11.479 4.841 1.00 0.00 C ATOM 632 CD GLN A 42 -0.846 12.937 5.110 1.00 0.00 C ATOM 633 OE1 GLN A 42 -1.902 13.438 4.720 1.00 0.00 O ATOM 634 NE2 GLN A 42 0.069 13.628 5.779 1.00 0.00 N ATOM 0 H GLN A 42 0.726 9.149 3.514 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.125 9.341 4.088 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.155 11.238 2.749 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -1.818 11.628 3.140 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -1.027 10.860 5.588 1.00 0.00 H new ATOM 0 HG3 GLN A 42 0.542 11.317 4.954 1.00 0.00 H new ATOM 0 HE21 GLN A 42 0.930 13.173 6.083 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -0.089 14.614 5.989 1.00 0.00 H new ATOM 643 N THR A 43 -0.918 9.192 1.010 1.00 0.00 N ATOM 644 CA THR A 43 -1.270 8.886 -0.371 1.00 0.00 C ATOM 645 C THR A 43 -2.077 7.596 -0.459 1.00 0.00 C ATOM 646 O THR A 43 -2.778 7.356 -1.444 1.00 0.00 O ATOM 647 CB THR A 43 -0.015 8.755 -1.255 1.00 0.00 C ATOM 648 OG1 THR A 43 -0.387 8.764 -2.638 1.00 0.00 O ATOM 649 CG2 THR A 43 0.739 7.473 -0.936 1.00 0.00 C ATOM 0 H THR A 43 0.073 9.383 1.160 1.00 0.00 H new ATOM 0 HA THR A 43 -1.876 9.716 -0.734 1.00 0.00 H new ATOM 0 HB THR A 43 0.638 9.603 -1.049 1.00 0.00 H new ATOM 0 HG1 THR A 43 -1.265 8.342 -2.743 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.621 7.402 -1.572 1.00 0.00 H new ATOM 0 HG22 THR A 43 1.046 7.482 0.110 1.00 0.00 H new ATOM 0 HG23 THR A 43 0.091 6.615 -1.117 1.00 0.00 H new ATOM 657 N LEU A 44 -1.975 6.768 0.574 1.00 0.00 N ATOM 658 CA LEU A 44 -2.698 5.501 0.614 1.00 0.00 C ATOM 659 C LEU A 44 -3.846 5.559 1.616 1.00 0.00 C ATOM 660 O LEU A 44 -4.822 4.818 1.501 1.00 0.00 O ATOM 661 CB LEU A 44 -1.746 4.360 0.977 1.00 0.00 C ATOM 662 CG LEU A 44 -0.350 4.426 0.356 1.00 0.00 C ATOM 663 CD1 LEU A 44 0.631 3.585 1.157 1.00 0.00 C ATOM 664 CD2 LEU A 44 -0.390 3.966 -1.095 1.00 0.00 C ATOM 0 H LEU A 44 -1.399 6.951 1.396 1.00 0.00 H new ATOM 0 HA LEU A 44 -3.115 5.318 -0.376 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.638 4.335 2.061 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.209 3.419 0.681 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.011 5.462 0.379 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.619 3.644 0.700 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.681 3.960 2.179 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.297 2.547 1.167 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.612 4.019 -1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.750 2.938 -1.141 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.061 4.611 -1.663 1.00 0.00 H new ATOM 676 N ARG A 45 -3.722 6.447 2.598 1.00 0.00 N ATOM 677 CA ARG A 45 -4.750 6.603 3.620 1.00 0.00 C ATOM 678 C ARG A 45 -6.144 6.535 3.004 1.00 0.00 C ATOM 679 O ARG A 45 -7.091 6.066 3.636 1.00 0.00 O ATOM 680 CB ARG A 45 -4.570 7.932 4.356 1.00 0.00 C ATOM 681 CG ARG A 45 -5.713 8.265 5.301 1.00 0.00 C ATOM 682 CD ARG A 45 -5.893 9.767 5.450 1.00 0.00 C ATOM 683 NE ARG A 45 -7.146 10.104 6.119 1.00 0.00 N ATOM 684 CZ ARG A 45 -7.434 11.320 6.571 1.00 0.00 C ATOM 685 NH1 ARG A 45 -6.563 12.309 6.424 1.00 0.00 N ATOM 686 NH2 ARG A 45 -8.596 11.549 7.170 1.00 0.00 N ATOM 0 H ARG A 45 -2.921 7.068 2.707 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.646 5.784 4.332 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.639 7.901 4.922 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.471 8.733 3.623 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.636 7.822 4.927 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.520 7.822 6.278 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.058 10.178 6.017 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -5.871 10.234 4.465 1.00 0.00 H new ATOM 0 HE ARG A 45 -7.838 9.366 6.246 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -5.669 12.137 5.963 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -6.787 13.241 6.772 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.269 10.791 7.284 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -8.816 12.483 7.517 1.00 0.00 H new ATOM 700 N ASP A 46 -6.263 7.008 1.768 1.00 0.00 N ATOM 701 CA ASP A 46 -7.541 7.001 1.066 1.00 0.00 C ATOM 702 C ASP A 46 -7.891 5.595 0.589 1.00 0.00 C ATOM 703 O ASP A 46 -9.052 5.188 0.622 1.00 0.00 O ATOM 704 CB ASP A 46 -7.499 7.961 -0.124 1.00 0.00 C ATOM 705 CG ASP A 46 -7.744 9.400 0.285 1.00 0.00 C ATOM 706 OD1 ASP A 46 -8.903 9.736 0.606 1.00 0.00 O ATOM 707 OD2 ASP A 46 -6.777 10.191 0.282 1.00 0.00 O ATOM 0 H ASP A 46 -5.490 7.401 1.232 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.312 7.332 1.762 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -6.528 7.886 -0.614 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.249 7.661 -0.856 1.00 0.00 H new ATOM 712 N GLY A 47 -6.879 4.857 0.143 1.00 0.00 N ATOM 713 CA GLY A 47 -7.100 3.505 -0.336 1.00 0.00 C ATOM 714 C GLY A 47 -7.410 3.459 -1.819 1.00 0.00 C ATOM 715 O GLY A 47 -7.918 2.458 -2.324 1.00 0.00 O ATOM 0 H GLY A 47 -5.909 5.172 0.105 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.215 2.902 -0.134 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.924 3.057 0.218 1.00 0.00 H new ATOM 719 N VAL A 48 -7.105 4.547 -2.520 1.00 0.00 N ATOM 720 CA VAL A 48 -7.355 4.628 -3.954 1.00 0.00 C ATOM 721 C VAL A 48 -6.166 4.100 -4.749 1.00 0.00 C ATOM 722 O VAL A 48 -6.322 3.606 -5.867 1.00 0.00 O ATOM 723 CB VAL A 48 -7.651 6.074 -4.392 1.00 0.00 C ATOM 724 CG1 VAL A 48 -7.702 6.173 -5.909 1.00 0.00 C ATOM 725 CG2 VAL A 48 -8.952 6.563 -3.774 1.00 0.00 C ATOM 0 H VAL A 48 -6.684 5.385 -2.118 1.00 0.00 H new ATOM 0 HA VAL A 48 -8.229 4.009 -4.159 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.844 6.714 -4.037 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.912 7.202 -6.200 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -6.743 5.867 -6.326 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.488 5.521 -6.290 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.145 7.587 -4.095 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -9.772 5.921 -4.096 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.873 6.532 -2.687 1.00 0.00 H new ATOM 735 N LEU A 49 -4.977 4.208 -4.166 1.00 0.00 N ATOM 736 CA LEU A 49 -3.759 3.741 -4.820 1.00 0.00 C ATOM 737 C LEU A 49 -3.558 2.246 -4.593 1.00 0.00 C ATOM 738 O LEU A 49 -3.351 1.486 -5.540 1.00 0.00 O ATOM 739 CB LEU A 49 -2.548 4.515 -4.298 1.00 0.00 C ATOM 740 CG LEU A 49 -1.260 4.373 -5.109 1.00 0.00 C ATOM 741 CD1 LEU A 49 -1.513 4.695 -6.574 1.00 0.00 C ATOM 742 CD2 LEU A 49 -0.171 5.273 -4.544 1.00 0.00 C ATOM 0 H LEU A 49 -4.830 4.615 -3.242 1.00 0.00 H new ATOM 0 HA LEU A 49 -3.861 3.917 -5.891 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.810 5.572 -4.252 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.348 4.191 -3.277 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.922 3.339 -5.038 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.585 4.589 -7.135 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.260 4.009 -6.974 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.876 5.719 -6.664 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.738 5.158 -5.134 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.500 6.311 -4.583 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.030 4.995 -3.509 1.00 0.00 H new ATOM 754 N LEU A 50 -3.623 1.830 -3.333 1.00 0.00 N ATOM 755 CA LEU A 50 -3.450 0.425 -2.982 1.00 0.00 C ATOM 756 C LEU A 50 -4.086 -0.481 -4.032 1.00 0.00 C ATOM 757 O LEU A 50 -3.429 -1.367 -4.580 1.00 0.00 O ATOM 758 CB LEU A 50 -4.064 0.143 -1.609 1.00 0.00 C ATOM 759 CG LEU A 50 -3.148 0.364 -0.406 1.00 0.00 C ATOM 760 CD1 LEU A 50 -3.963 0.477 0.873 1.00 0.00 C ATOM 761 CD2 LEU A 50 -2.133 -0.765 -0.295 1.00 0.00 C ATOM 0 H LEU A 50 -3.794 2.445 -2.538 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.381 0.214 -2.946 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.945 0.774 -1.491 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.409 -0.891 -1.593 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.608 1.300 -0.552 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.293 0.634 1.719 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.650 1.319 0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.530 -0.441 1.025 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.489 -0.592 0.567 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.656 -1.714 -0.172 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.527 -0.799 -1.200 1.00 0.00 H new ATOM 773 N CYS A 51 -5.365 -0.252 -4.307 1.00 0.00 N ATOM 774 CA CYS A 51 -6.089 -1.046 -5.293 1.00 0.00 C ATOM 775 C CYS A 51 -5.336 -1.085 -6.619 1.00 0.00 C ATOM 776 O CYS A 51 -5.264 -2.126 -7.272 1.00 0.00 O ATOM 777 CB CYS A 51 -7.492 -0.478 -5.506 1.00 0.00 C ATOM 778 SG CYS A 51 -8.601 -0.703 -4.096 1.00 0.00 S ATOM 0 H CYS A 51 -5.922 0.477 -3.861 1.00 0.00 H new ATOM 0 HA CYS A 51 -6.172 -2.064 -4.913 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -7.412 0.587 -5.725 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -7.935 -0.951 -6.382 1.00 0.00 H new ATOM 0 HG CYS A 51 -8.997 0.458 -3.666 1.00 0.00 H new ATOM 784 N GLN A 52 -4.778 0.056 -7.011 1.00 0.00 N ATOM 785 CA GLN A 52 -4.033 0.152 -8.260 1.00 0.00 C ATOM 786 C GLN A 52 -2.835 -0.790 -8.254 1.00 0.00 C ATOM 787 O GLN A 52 -2.647 -1.581 -9.179 1.00 0.00 O ATOM 788 CB GLN A 52 -3.565 1.590 -8.490 1.00 0.00 C ATOM 789 CG GLN A 52 -4.683 2.616 -8.396 1.00 0.00 C ATOM 790 CD GLN A 52 -4.370 3.892 -9.153 1.00 0.00 C ATOM 791 OE1 GLN A 52 -3.464 4.640 -8.783 1.00 0.00 O ATOM 792 NE2 GLN A 52 -5.118 4.147 -10.220 1.00 0.00 N ATOM 0 H GLN A 52 -4.828 0.926 -6.482 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.698 -0.141 -9.073 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.796 1.835 -7.757 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.101 1.659 -9.474 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.603 2.182 -8.788 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.864 2.855 -7.348 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -5.858 3.499 -10.491 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.952 4.990 -10.769 1.00 0.00 H new ATOM 801 N LEU A 53 -2.024 -0.701 -7.204 1.00 0.00 N ATOM 802 CA LEU A 53 -0.842 -1.546 -7.077 1.00 0.00 C ATOM 803 C LEU A 53 -1.128 -2.961 -7.570 1.00 0.00 C ATOM 804 O LEU A 53 -0.446 -3.469 -8.461 1.00 0.00 O ATOM 805 CB LEU A 53 -0.375 -1.587 -5.621 1.00 0.00 C ATOM 806 CG LEU A 53 0.700 -2.622 -5.289 1.00 0.00 C ATOM 807 CD1 LEU A 53 2.051 -2.181 -5.829 1.00 0.00 C ATOM 808 CD2 LEU A 53 0.773 -2.853 -3.787 1.00 0.00 C ATOM 0 H LEU A 53 -2.164 -0.052 -6.429 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.052 -1.118 -7.695 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.004 -0.601 -5.354 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.242 -1.777 -4.988 1.00 0.00 H new ATOM 0 HG LEU A 53 0.430 -3.563 -5.768 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.803 -2.930 -5.583 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.991 -2.069 -6.912 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.328 -1.227 -5.380 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.544 -3.593 -3.570 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.018 -1.916 -3.286 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.190 -3.216 -3.427 1.00 0.00 H new ATOM 820 N LEU A 54 -2.142 -3.592 -6.987 1.00 0.00 N ATOM 821 CA LEU A 54 -2.520 -4.948 -7.369 1.00 0.00 C ATOM 822 C LEU A 54 -2.927 -5.007 -8.838 1.00 0.00 C ATOM 823 O LEU A 54 -2.581 -5.947 -9.550 1.00 0.00 O ATOM 824 CB LEU A 54 -3.669 -5.444 -6.489 1.00 0.00 C ATOM 825 CG LEU A 54 -3.473 -5.293 -4.980 1.00 0.00 C ATOM 826 CD1 LEU A 54 -4.674 -5.845 -4.228 1.00 0.00 C ATOM 827 CD2 LEU A 54 -2.196 -5.992 -4.536 1.00 0.00 C ATOM 0 H LEU A 54 -2.717 -3.186 -6.248 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.654 -5.595 -7.225 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.575 -4.908 -6.773 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.840 -6.498 -6.709 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.382 -4.232 -4.749 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.517 -5.729 -3.156 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.571 -5.300 -4.524 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.797 -6.902 -4.464 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.072 -5.874 -3.459 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.258 -7.052 -4.780 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.342 -5.550 -5.050 1.00 0.00 H new ATOM 839 N ASN A 55 -3.663 -3.993 -9.283 1.00 0.00 N ATOM 840 CA ASN A 55 -4.116 -3.929 -10.668 1.00 0.00 C ATOM 841 C ASN A 55 -2.931 -3.823 -11.624 1.00 0.00 C ATOM 842 O ASN A 55 -3.041 -4.152 -12.804 1.00 0.00 O ATOM 843 CB ASN A 55 -5.053 -2.736 -10.865 1.00 0.00 C ATOM 844 CG ASN A 55 -6.343 -2.878 -10.081 1.00 0.00 C ATOM 845 OD1 ASN A 55 -6.695 -3.970 -9.636 1.00 0.00 O ATOM 846 ND2 ASN A 55 -7.055 -1.770 -9.907 1.00 0.00 N ATOM 0 H ASN A 55 -3.958 -3.206 -8.705 1.00 0.00 H new ATOM 0 HA ASN A 55 -4.658 -4.849 -10.890 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -4.543 -1.823 -10.558 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.285 -2.631 -11.925 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.932 -1.804 -9.387 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -6.725 -0.886 -10.294 1.00 0.00 H new ATOM 853 N ASN A 56 -1.798 -3.361 -11.104 1.00 0.00 N ATOM 854 CA ASN A 56 -0.592 -3.211 -11.910 1.00 0.00 C ATOM 855 C ASN A 56 0.129 -4.547 -12.064 1.00 0.00 C ATOM 856 O ASN A 56 0.524 -4.929 -13.167 1.00 0.00 O ATOM 857 CB ASN A 56 0.346 -2.183 -11.276 1.00 0.00 C ATOM 858 CG ASN A 56 -0.010 -0.760 -11.661 1.00 0.00 C ATOM 859 OD1 ASN A 56 -0.066 -0.421 -12.843 1.00 0.00 O ATOM 860 ND2 ASN A 56 -0.253 0.080 -10.661 1.00 0.00 N ATOM 0 H ASN A 56 -1.690 -3.084 -10.128 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.888 -2.861 -12.899 1.00 0.00 H new ATOM 0 HB2 ASN A 56 0.310 -2.283 -10.191 1.00 0.00 H new ATOM 0 HB3 ASN A 56 1.371 -2.393 -11.581 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -0.498 1.050 -10.858 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.195 -0.245 -9.696 1.00 0.00 H new ATOM 867 N LEU A 57 0.296 -5.254 -10.952 1.00 0.00 N ATOM 868 CA LEU A 57 0.969 -6.549 -10.962 1.00 0.00 C ATOM 869 C LEU A 57 0.155 -7.579 -11.740 1.00 0.00 C ATOM 870 O LEU A 57 0.659 -8.209 -12.670 1.00 0.00 O ATOM 871 CB LEU A 57 1.198 -7.038 -9.531 1.00 0.00 C ATOM 872 CG LEU A 57 1.796 -6.018 -8.561 1.00 0.00 C ATOM 873 CD1 LEU A 57 1.926 -6.617 -7.170 1.00 0.00 C ATOM 874 CD2 LEU A 57 3.149 -5.534 -9.064 1.00 0.00 C ATOM 0 H LEU A 57 -0.025 -4.953 -10.032 1.00 0.00 H new ATOM 0 HA LEU A 57 1.933 -6.426 -11.456 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.244 -7.378 -9.127 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.857 -7.906 -9.566 1.00 0.00 H new ATOM 0 HG LEU A 57 1.124 -5.162 -8.504 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.353 -5.877 -6.494 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.942 -6.914 -6.808 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.577 -7.491 -7.209 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.560 -4.809 -8.362 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.829 -6.381 -9.151 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.028 -5.065 -10.040 1.00 0.00 H new ATOM 886 N ARG A 58 -1.105 -7.744 -11.353 1.00 0.00 N ATOM 887 CA ARG A 58 -1.989 -8.696 -12.014 1.00 0.00 C ATOM 888 C ARG A 58 -3.137 -7.977 -12.716 1.00 0.00 C ATOM 889 O ARG A 58 -3.451 -6.830 -12.397 1.00 0.00 O ATOM 890 CB ARG A 58 -2.545 -9.698 -11.000 1.00 0.00 C ATOM 891 CG ARG A 58 -2.874 -11.054 -11.601 1.00 0.00 C ATOM 892 CD ARG A 58 -3.735 -11.886 -10.662 1.00 0.00 C ATOM 893 NE ARG A 58 -3.690 -13.307 -10.994 1.00 0.00 N ATOM 894 CZ ARG A 58 -4.638 -14.172 -10.650 1.00 0.00 C ATOM 895 NH1 ARG A 58 -5.698 -13.762 -9.968 1.00 0.00 N ATOM 896 NH2 ARG A 58 -4.526 -15.450 -10.989 1.00 0.00 N ATOM 0 H ARG A 58 -1.537 -7.231 -10.585 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.407 -9.232 -12.763 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -1.818 -9.832 -10.199 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -3.445 -9.282 -10.548 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -3.395 -10.916 -12.548 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.950 -11.590 -11.820 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.396 -11.742 -9.636 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -4.766 -11.535 -10.709 1.00 0.00 H new ATOM 0 HE ARG A 58 -2.887 -13.655 -11.519 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -5.787 -12.780 -9.706 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -6.424 -14.428 -9.705 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -3.712 -15.769 -11.514 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -5.254 -16.113 -10.725 1.00 0.00 H new ATOM 910 N ALA A 59 -3.759 -8.658 -13.673 1.00 0.00 N ATOM 911 CA ALA A 59 -4.873 -8.085 -14.418 1.00 0.00 C ATOM 912 C ALA A 59 -6.209 -8.475 -13.796 1.00 0.00 C ATOM 913 O ALA A 59 -6.371 -9.590 -13.298 1.00 0.00 O ATOM 914 CB ALA A 59 -4.817 -8.526 -15.873 1.00 0.00 C ATOM 0 H ALA A 59 -3.510 -9.607 -13.950 1.00 0.00 H new ATOM 0 HA ALA A 59 -4.786 -6.999 -14.375 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.655 -8.091 -16.418 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.881 -8.191 -16.319 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.875 -9.613 -15.926 1.00 0.00 H new ATOM 920 N HIS A 60 -7.163 -7.551 -13.826 1.00 0.00 N ATOM 921 CA HIS A 60 -8.486 -7.799 -13.265 1.00 0.00 C ATOM 922 C HIS A 60 -8.395 -8.098 -11.772 1.00 0.00 C ATOM 923 O HIS A 60 -9.152 -8.913 -11.245 1.00 0.00 O ATOM 924 CB HIS A 60 -9.161 -8.963 -13.990 1.00 0.00 C ATOM 925 CG HIS A 60 -9.817 -8.568 -15.277 1.00 0.00 C ATOM 926 ND1 HIS A 60 -11.096 -8.057 -15.345 1.00 0.00 N ATOM 927 CD2 HIS A 60 -9.362 -8.610 -16.552 1.00 0.00 C ATOM 928 CE1 HIS A 60 -11.400 -7.803 -16.605 1.00 0.00 C ATOM 929 NE2 HIS A 60 -10.365 -8.130 -17.358 1.00 0.00 N ATOM 0 H HIS A 60 -7.045 -6.623 -14.233 1.00 0.00 H new ATOM 0 HA HIS A 60 -9.086 -6.899 -13.402 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -8.418 -9.734 -14.192 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -9.909 -9.406 -13.332 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -8.391 -8.956 -16.875 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -12.336 -7.397 -16.959 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -10.318 -8.041 -18.373 1.00 0.00 H new ATOM 938 N SER A 61 -7.463 -7.434 -11.095 1.00 0.00 N ATOM 939 CA SER A 61 -7.270 -7.632 -9.664 1.00 0.00 C ATOM 940 C SER A 61 -8.312 -6.857 -8.863 1.00 0.00 C ATOM 941 O SER A 61 -8.886 -7.376 -7.905 1.00 0.00 O ATOM 942 CB SER A 61 -5.864 -7.194 -9.252 1.00 0.00 C ATOM 943 OG SER A 61 -4.901 -7.603 -10.208 1.00 0.00 O ATOM 0 H SER A 61 -6.830 -6.754 -11.515 1.00 0.00 H new ATOM 0 HA SER A 61 -7.389 -8.694 -9.450 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.835 -6.110 -9.143 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.618 -7.619 -8.279 1.00 0.00 H new ATOM 0 HG SER A 61 -4.072 -7.098 -10.074 1.00 0.00 H new ATOM 949 N ILE A 62 -8.549 -5.612 -9.261 1.00 0.00 N ATOM 950 CA ILE A 62 -9.522 -4.765 -8.582 1.00 0.00 C ATOM 951 C ILE A 62 -10.226 -3.838 -9.566 1.00 0.00 C ATOM 952 O ILE A 62 -9.581 -3.122 -10.330 1.00 0.00 O ATOM 953 CB ILE A 62 -8.858 -3.918 -7.480 1.00 0.00 C ATOM 954 CG1 ILE A 62 -8.087 -4.815 -6.511 1.00 0.00 C ATOM 955 CG2 ILE A 62 -9.905 -3.102 -6.737 1.00 0.00 C ATOM 956 CD1 ILE A 62 -7.462 -4.062 -5.358 1.00 0.00 C ATOM 0 H ILE A 62 -8.081 -5.167 -10.050 1.00 0.00 H new ATOM 0 HA ILE A 62 -10.255 -5.430 -8.126 1.00 0.00 H new ATOM 0 HB ILE A 62 -8.153 -3.230 -7.946 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -8.762 -5.574 -6.115 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.304 -5.339 -7.059 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -9.421 -2.509 -5.961 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -10.413 -2.439 -7.437 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.632 -3.773 -6.280 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -6.932 -4.761 -4.712 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.761 -3.322 -5.744 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.242 -3.560 -4.786 1.00 0.00 H new ATOM 968 N ASN A 63 -11.555 -3.856 -9.541 1.00 0.00 N ATOM 969 CA ASN A 63 -12.348 -3.016 -10.430 1.00 0.00 C ATOM 970 C ASN A 63 -12.334 -1.563 -9.963 1.00 0.00 C ATOM 971 O ASN A 63 -12.954 -1.218 -8.955 1.00 0.00 O ATOM 972 CB ASN A 63 -13.788 -3.527 -10.500 1.00 0.00 C ATOM 973 CG ASN A 63 -14.589 -2.852 -11.596 1.00 0.00 C ATOM 974 OD1 ASN A 63 -14.156 -1.854 -12.173 1.00 0.00 O ATOM 975 ND2 ASN A 63 -15.765 -3.395 -11.890 1.00 0.00 N ATOM 0 H ASN A 63 -12.105 -4.444 -8.914 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.904 -3.064 -11.424 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.781 -4.604 -10.670 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -14.277 -3.359 -9.540 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -16.348 -2.985 -12.619 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -16.085 -4.222 -11.386 1.00 0.00 H new ATOM 982 N LEU A 64 -11.625 -0.717 -10.700 1.00 0.00 N ATOM 983 CA LEU A 64 -11.530 0.699 -10.362 1.00 0.00 C ATOM 984 C LEU A 64 -12.910 1.284 -10.075 1.00 0.00 C ATOM 985 O LEU A 64 -13.059 2.166 -9.229 1.00 0.00 O ATOM 986 CB LEU A 64 -10.863 1.472 -11.501 1.00 0.00 C ATOM 987 CG LEU A 64 -9.440 1.044 -11.859 1.00 0.00 C ATOM 988 CD1 LEU A 64 -8.990 1.711 -13.150 1.00 0.00 C ATOM 989 CD2 LEU A 64 -8.482 1.374 -10.724 1.00 0.00 C ATOM 0 H LEU A 64 -11.107 -0.986 -11.536 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.921 0.792 -9.463 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.485 1.376 -12.391 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.847 2.529 -11.236 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.434 -0.035 -12.011 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -7.975 1.394 -13.389 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.660 1.424 -13.961 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.013 2.794 -13.027 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.474 1.062 -10.997 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.492 2.448 -10.540 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.793 0.848 -9.821 1.00 0.00 H new ATOM 1001 N LYS A 65 -13.917 0.785 -10.784 1.00 0.00 N ATOM 1002 CA LYS A 65 -15.286 1.254 -10.605 1.00 0.00 C ATOM 1003 C LYS A 65 -15.812 0.881 -9.222 1.00 0.00 C ATOM 1004 O LYS A 65 -16.571 1.634 -8.614 1.00 0.00 O ATOM 1005 CB LYS A 65 -16.195 0.664 -11.685 1.00 0.00 C ATOM 1006 CG LYS A 65 -15.732 0.963 -13.100 1.00 0.00 C ATOM 1007 CD LYS A 65 -15.936 2.426 -13.456 1.00 0.00 C ATOM 1008 CE LYS A 65 -17.360 2.693 -13.919 1.00 0.00 C ATOM 1009 NZ LYS A 65 -17.533 2.409 -15.371 1.00 0.00 N ATOM 0 H LYS A 65 -13.811 0.055 -11.489 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.286 2.340 -10.694 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.251 -0.416 -11.551 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.204 1.054 -11.552 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -14.677 0.707 -13.200 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.281 0.337 -13.803 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -15.712 3.047 -12.589 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -15.237 2.711 -14.242 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -18.051 2.077 -13.343 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -17.618 3.733 -13.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -18.516 2.603 -15.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -16.892 3.015 -15.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -17.311 1.410 -15.558 1.00 0.00 H new ATOM 1023 N GLU A 66 -15.402 -0.285 -8.733 1.00 0.00 N ATOM 1024 CA GLU A 66 -15.832 -0.756 -7.422 1.00 0.00 C ATOM 1025 C GLU A 66 -15.284 0.140 -6.315 1.00 0.00 C ATOM 1026 O GLU A 66 -15.851 0.213 -5.224 1.00 0.00 O ATOM 1027 CB GLU A 66 -15.375 -2.199 -7.198 1.00 0.00 C ATOM 1028 CG GLU A 66 -16.297 -3.233 -7.822 1.00 0.00 C ATOM 1029 CD GLU A 66 -17.395 -3.681 -6.877 1.00 0.00 C ATOM 1030 OE1 GLU A 66 -17.128 -4.557 -6.029 1.00 0.00 O ATOM 1031 OE2 GLU A 66 -18.523 -3.155 -6.988 1.00 0.00 O ATOM 0 H GLU A 66 -14.773 -0.920 -9.225 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.921 -0.718 -7.391 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.373 -2.322 -7.610 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.305 -2.387 -6.127 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.746 -2.817 -8.724 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.711 -4.099 -8.129 1.00 0.00 H new ATOM 1038 N ILE A 67 -14.179 0.819 -6.604 1.00 0.00 N ATOM 1039 CA ILE A 67 -13.555 1.710 -5.634 1.00 0.00 C ATOM 1040 C ILE A 67 -13.813 3.171 -5.985 1.00 0.00 C ATOM 1041 O ILE A 67 -13.817 3.547 -7.156 1.00 0.00 O ATOM 1042 CB ILE A 67 -12.035 1.474 -5.549 1.00 0.00 C ATOM 1043 CG1 ILE A 67 -11.415 1.494 -6.948 1.00 0.00 C ATOM 1044 CG2 ILE A 67 -11.742 0.154 -4.853 1.00 0.00 C ATOM 1045 CD1 ILE A 67 -9.915 1.301 -6.947 1.00 0.00 C ATOM 0 H ILE A 67 -13.698 0.769 -7.502 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.003 1.487 -4.666 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.590 2.278 -4.963 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -11.874 0.710 -7.551 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.651 2.444 -7.427 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.664 0.002 -4.801 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.155 0.175 -3.844 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -12.197 -0.662 -5.414 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.544 1.326 -7.972 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.446 2.099 -6.371 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -9.672 0.338 -6.497 1.00 0.00 H new ATOM 1057 N ASN A 68 -14.025 3.991 -4.960 1.00 0.00 N ATOM 1058 CA ASN A 68 -14.282 5.413 -5.160 1.00 0.00 C ATOM 1059 C ASN A 68 -12.986 6.164 -5.452 1.00 0.00 C ATOM 1060 O ASN A 68 -12.314 6.643 -4.538 1.00 0.00 O ATOM 1061 CB ASN A 68 -14.962 6.008 -3.926 1.00 0.00 C ATOM 1062 CG ASN A 68 -16.077 5.125 -3.399 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -17.167 5.077 -3.968 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -15.808 4.422 -2.305 1.00 0.00 N ATOM 0 H ASN A 68 -14.024 3.695 -3.984 1.00 0.00 H new ATOM 0 HA ASN A 68 -14.945 5.520 -6.019 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -14.220 6.158 -3.142 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -15.366 6.989 -4.175 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -16.519 3.811 -1.903 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -14.890 4.493 -1.866 1.00 0.00 H new ATOM 1071 N LEU A 69 -12.642 6.264 -6.731 1.00 0.00 N ATOM 1072 CA LEU A 69 -11.428 6.958 -7.145 1.00 0.00 C ATOM 1073 C LEU A 69 -11.368 8.358 -6.543 1.00 0.00 C ATOM 1074 O LEU A 69 -10.291 8.867 -6.235 1.00 0.00 O ATOM 1075 CB LEU A 69 -11.360 7.044 -8.671 1.00 0.00 C ATOM 1076 CG LEU A 69 -11.000 5.749 -9.400 1.00 0.00 C ATOM 1077 CD1 LEU A 69 -11.589 5.745 -10.802 1.00 0.00 C ATOM 1078 CD2 LEU A 69 -9.490 5.568 -9.453 1.00 0.00 C ATOM 0 H LEU A 69 -13.187 5.873 -7.500 1.00 0.00 H new ATOM 0 HA LEU A 69 -10.573 6.389 -6.781 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.327 7.388 -9.039 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.627 7.805 -8.940 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.426 4.912 -8.846 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.323 4.816 -11.306 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.674 5.826 -10.741 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.193 6.590 -11.365 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.253 4.641 -9.975 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.041 6.408 -9.983 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.093 5.525 -8.439 1.00 0.00 H new ATOM 1090 N ARG A 70 -12.534 8.975 -6.376 1.00 0.00 N ATOM 1091 CA ARG A 70 -12.615 10.316 -5.809 1.00 0.00 C ATOM 1092 C ARG A 70 -13.374 10.302 -4.486 1.00 0.00 C ATOM 1093 O ARG A 70 -14.563 10.614 -4.421 1.00 0.00 O ATOM 1094 CB ARG A 70 -13.299 11.267 -6.792 1.00 0.00 C ATOM 1095 CG ARG A 70 -12.918 12.725 -6.594 1.00 0.00 C ATOM 1096 CD ARG A 70 -11.631 13.070 -7.326 1.00 0.00 C ATOM 1097 NE ARG A 70 -10.889 14.136 -6.658 1.00 0.00 N ATOM 1098 CZ ARG A 70 -9.680 14.537 -7.034 1.00 0.00 C ATOM 1099 NH1 ARG A 70 -9.080 13.965 -8.069 1.00 0.00 N ATOM 1100 NH2 ARG A 70 -9.069 15.514 -6.376 1.00 0.00 N ATOM 0 H ARG A 70 -13.435 8.567 -6.625 1.00 0.00 H new ATOM 0 HA ARG A 70 -11.600 10.666 -5.621 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -13.045 10.969 -7.809 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -14.380 11.166 -6.690 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -13.724 13.365 -6.953 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -12.798 12.929 -5.530 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -11.004 12.181 -7.395 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -11.865 13.376 -8.346 1.00 0.00 H new ATOM 0 HE ARG A 70 -11.323 14.598 -5.859 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -9.547 13.215 -8.579 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -8.151 14.275 -8.355 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -9.528 15.958 -5.580 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -8.140 15.821 -6.666 1.00 0.00 H new ATOM 1114 N PRO A 71 -12.672 9.931 -3.404 1.00 0.00 N ATOM 1115 CA PRO A 71 -13.260 9.868 -2.063 1.00 0.00 C ATOM 1116 C PRO A 71 -13.578 11.250 -1.503 1.00 0.00 C ATOM 1117 O PRO A 71 -14.422 11.392 -0.619 1.00 0.00 O ATOM 1118 CB PRO A 71 -12.169 9.192 -1.229 1.00 0.00 C ATOM 1119 CG PRO A 71 -10.899 9.498 -1.947 1.00 0.00 C ATOM 1120 CD PRO A 71 -11.251 9.546 -3.408 1.00 0.00 C ATOM 0 HA PRO A 71 -14.211 9.335 -2.060 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -12.151 9.580 -0.211 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.334 8.117 -1.158 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.482 10.449 -1.615 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.146 8.734 -1.752 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -10.640 10.271 -3.945 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.098 8.581 -3.890 1.00 0.00 H new ATOM 1128 N GLN A 72 -12.898 12.266 -2.025 1.00 0.00 N ATOM 1129 CA GLN A 72 -13.109 13.637 -1.576 1.00 0.00 C ATOM 1130 C GLN A 72 -12.998 13.736 -0.059 1.00 0.00 C ATOM 1131 O GLN A 72 -13.806 14.400 0.590 1.00 0.00 O ATOM 1132 CB GLN A 72 -14.480 14.140 -2.033 1.00 0.00 C ATOM 1133 CG GLN A 72 -14.685 14.064 -3.538 1.00 0.00 C ATOM 1134 CD GLN A 72 -15.743 15.030 -4.032 1.00 0.00 C ATOM 1135 OE1 GLN A 72 -16.941 14.789 -3.879 1.00 0.00 O ATOM 1136 NE2 GLN A 72 -15.306 16.133 -4.629 1.00 0.00 N ATOM 0 H GLN A 72 -12.197 12.165 -2.759 1.00 0.00 H new ATOM 0 HA GLN A 72 -12.334 14.262 -2.020 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -15.256 13.555 -1.539 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -14.605 15.173 -1.709 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -13.741 14.276 -4.041 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -14.970 13.048 -3.811 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -14.304 16.293 -4.735 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -15.972 16.820 -4.982 1.00 0.00 H new ATOM 1145 N MET A 73 -11.992 13.072 0.501 1.00 0.00 N ATOM 1146 CA MET A 73 -11.775 13.086 1.943 1.00 0.00 C ATOM 1147 C MET A 73 -13.002 12.561 2.682 1.00 0.00 C ATOM 1148 O MET A 73 -13.491 13.192 3.619 1.00 0.00 O ATOM 1149 CB MET A 73 -11.448 14.504 2.417 1.00 0.00 C ATOM 1150 CG MET A 73 -10.236 15.110 1.728 1.00 0.00 C ATOM 1151 SD MET A 73 -8.679 14.470 2.372 1.00 0.00 S ATOM 1152 CE MET A 73 -8.258 13.270 1.110 1.00 0.00 C ATOM 0 H MET A 73 -11.314 12.517 -0.022 1.00 0.00 H new ATOM 0 HA MET A 73 -10.931 12.433 2.165 1.00 0.00 H new ATOM 0 HB2 MET A 73 -12.313 15.145 2.244 1.00 0.00 H new ATOM 0 HB3 MET A 73 -11.274 14.488 3.493 1.00 0.00 H new ATOM 0 HG2 MET A 73 -10.292 14.908 0.658 1.00 0.00 H new ATOM 0 HG3 MET A 73 -10.257 16.193 1.850 1.00 0.00 H new ATOM 0 HE1 MET A 73 -7.671 12.466 1.554 1.00 0.00 H new ATOM 0 HE2 MET A 73 -9.171 12.858 0.680 1.00 0.00 H new ATOM 0 HE3 MET A 73 -7.675 13.755 0.327 1.00 0.00 H new ATOM 1162 N SER A 74 -13.494 11.403 2.255 1.00 0.00 N ATOM 1163 CA SER A 74 -14.666 10.795 2.874 1.00 0.00 C ATOM 1164 C SER A 74 -14.268 9.596 3.730 1.00 0.00 C ATOM 1165 O SER A 74 -13.635 8.658 3.246 1.00 0.00 O ATOM 1166 CB SER A 74 -15.668 10.361 1.803 1.00 0.00 C ATOM 1167 OG SER A 74 -16.491 11.445 1.405 1.00 0.00 O ATOM 0 H SER A 74 -13.099 10.867 1.483 1.00 0.00 H new ATOM 0 HA SER A 74 -15.133 11.540 3.518 1.00 0.00 H new ATOM 0 HB2 SER A 74 -15.133 9.969 0.938 1.00 0.00 H new ATOM 0 HB3 SER A 74 -16.288 9.551 2.188 1.00 0.00 H new ATOM 0 HG SER A 74 -16.120 11.858 0.597 1.00 0.00 H new ATOM 1173 N GLN A 75 -14.645 9.635 5.004 1.00 0.00 N ATOM 1174 CA GLN A 75 -14.327 8.553 5.927 1.00 0.00 C ATOM 1175 C GLN A 75 -15.009 7.257 5.502 1.00 0.00 C ATOM 1176 O GLN A 75 -14.366 6.213 5.387 1.00 0.00 O ATOM 1177 CB GLN A 75 -14.753 8.925 7.349 1.00 0.00 C ATOM 1178 CG GLN A 75 -14.805 7.739 8.298 1.00 0.00 C ATOM 1179 CD GLN A 75 -15.501 8.068 9.604 1.00 0.00 C ATOM 1180 OE1 GLN A 75 -16.640 8.536 9.613 1.00 0.00 O ATOM 1181 NE2 GLN A 75 -14.819 7.823 10.717 1.00 0.00 N ATOM 0 H GLN A 75 -15.171 10.404 5.420 1.00 0.00 H new ATOM 0 HA GLN A 75 -13.248 8.398 5.907 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -14.059 9.666 7.745 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -15.736 9.395 7.314 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -15.323 6.912 7.812 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -13.790 7.400 8.507 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -13.877 7.435 10.663 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -15.237 8.023 11.626 1.00 0.00 H new ATOM 1190 N PHE A 76 -16.316 7.330 5.271 1.00 0.00 N ATOM 1191 CA PHE A 76 -17.086 6.162 4.860 1.00 0.00 C ATOM 1192 C PHE A 76 -16.524 5.565 3.574 1.00 0.00 C ATOM 1193 O PHE A 76 -16.293 4.358 3.484 1.00 0.00 O ATOM 1194 CB PHE A 76 -18.556 6.538 4.662 1.00 0.00 C ATOM 1195 CG PHE A 76 -19.338 6.594 5.943 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -19.600 5.439 6.662 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -19.813 7.802 6.428 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -20.319 5.487 7.841 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -20.533 7.857 7.607 1.00 0.00 C ATOM 1200 CZ PHE A 76 -20.787 6.698 8.314 1.00 0.00 C ATOM 0 H PHE A 76 -16.864 8.186 5.362 1.00 0.00 H new ATOM 0 HA PHE A 76 -17.013 5.413 5.649 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -18.611 7.509 4.169 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -19.021 5.814 3.993 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -19.238 4.489 6.296 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -19.618 8.711 5.879 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -20.515 4.579 8.392 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -20.896 8.805 7.975 1.00 0.00 H new ATOM 0 HZ PHE A 76 -21.350 6.738 9.235 1.00 0.00 H new ATOM 1210 N LEU A 77 -16.307 6.418 2.579 1.00 0.00 N ATOM 1211 CA LEU A 77 -15.773 5.976 1.295 1.00 0.00 C ATOM 1212 C LEU A 77 -14.364 5.415 1.456 1.00 0.00 C ATOM 1213 O LEU A 77 -14.066 4.314 0.989 1.00 0.00 O ATOM 1214 CB LEU A 77 -15.760 7.137 0.299 1.00 0.00 C ATOM 1215 CG LEU A 77 -17.111 7.798 0.022 1.00 0.00 C ATOM 1216 CD1 LEU A 77 -16.952 8.946 -0.962 1.00 0.00 C ATOM 1217 CD2 LEU A 77 -18.107 6.776 -0.505 1.00 0.00 C ATOM 0 H LEU A 77 -16.492 7.419 2.636 1.00 0.00 H new ATOM 0 HA LEU A 77 -16.419 5.185 0.914 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -15.074 7.899 0.669 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -15.355 6.775 -0.646 1.00 0.00 H new ATOM 0 HG LEU A 77 -17.495 8.200 0.959 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -17.924 9.404 -1.147 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -16.273 9.690 -0.546 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -16.545 8.568 -1.900 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -19.063 7.264 -0.696 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -17.729 6.343 -1.431 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -18.244 5.987 0.234 1.00 0.00 H new ATOM 1229 N CYS A 78 -13.502 6.176 2.121 1.00 0.00 N ATOM 1230 CA CYS A 78 -12.124 5.753 2.346 1.00 0.00 C ATOM 1231 C CYS A 78 -12.076 4.356 2.956 1.00 0.00 C ATOM 1232 O CYS A 78 -11.603 3.408 2.327 1.00 0.00 O ATOM 1233 CB CYS A 78 -11.406 6.747 3.260 1.00 0.00 C ATOM 1234 SG CYS A 78 -10.888 8.269 2.433 1.00 0.00 S ATOM 0 H CYS A 78 -13.733 7.089 2.514 1.00 0.00 H new ATOM 0 HA CYS A 78 -11.617 5.726 1.382 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -12.065 7.003 4.089 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -10.529 6.262 3.688 1.00 0.00 H new ATOM 0 HG CYS A 78 -11.811 9.174 2.572 1.00 0.00 H new ATOM 1240 N LEU A 79 -12.566 4.236 4.185 1.00 0.00 N ATOM 1241 CA LEU A 79 -12.578 2.955 4.882 1.00 0.00 C ATOM 1242 C LEU A 79 -13.014 1.831 3.948 1.00 0.00 C ATOM 1243 O LEU A 79 -12.432 0.746 3.950 1.00 0.00 O ATOM 1244 CB LEU A 79 -13.511 3.019 6.092 1.00 0.00 C ATOM 1245 CG LEU A 79 -12.944 3.691 7.343 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -14.063 4.074 8.298 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -11.942 2.776 8.032 1.00 0.00 C ATOM 0 H LEU A 79 -12.960 5.010 4.719 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.564 2.746 5.224 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.417 3.549 5.799 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -13.806 2.002 6.352 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.427 4.601 7.040 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -13.640 4.551 9.182 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -14.743 4.767 7.803 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.610 3.179 8.595 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -11.549 3.270 8.920 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -12.436 1.848 8.322 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.123 2.553 7.348 1.00 0.00 H new ATOM 1259 N LYS A 80 -14.041 2.098 3.148 1.00 0.00 N ATOM 1260 CA LYS A 80 -14.554 1.111 2.205 1.00 0.00 C ATOM 1261 C LYS A 80 -13.479 0.705 1.203 1.00 0.00 C ATOM 1262 O LYS A 80 -13.207 -0.480 1.016 1.00 0.00 O ATOM 1263 CB LYS A 80 -15.772 1.669 1.465 1.00 0.00 C ATOM 1264 CG LYS A 80 -16.484 0.640 0.604 1.00 0.00 C ATOM 1265 CD LYS A 80 -15.718 0.359 -0.678 1.00 0.00 C ATOM 1266 CE LYS A 80 -16.653 -0.047 -1.808 1.00 0.00 C ATOM 1267 NZ LYS A 80 -17.200 1.136 -2.527 1.00 0.00 N ATOM 0 H LYS A 80 -14.535 2.990 3.134 1.00 0.00 H new ATOM 0 HA LYS A 80 -14.852 0.227 2.769 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.476 2.071 2.193 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.455 2.500 0.835 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.605 -0.286 1.167 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -17.484 0.998 0.360 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.157 1.247 -0.970 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -14.991 -0.434 -0.503 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.117 -0.684 -2.512 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.475 -0.639 -1.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.158 0.921 -2.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -17.239 1.949 -1.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -16.586 1.366 -3.334 1.00 0.00 H new ATOM 1281 N ASN A 81 -12.869 1.697 0.562 1.00 0.00 N ATOM 1282 CA ASN A 81 -11.822 1.442 -0.421 1.00 0.00 C ATOM 1283 C ASN A 81 -10.751 0.518 0.152 1.00 0.00 C ATOM 1284 O ASN A 81 -10.525 -0.579 -0.360 1.00 0.00 O ATOM 1285 CB ASN A 81 -11.186 2.759 -0.872 1.00 0.00 C ATOM 1286 CG ASN A 81 -12.203 3.723 -1.452 1.00 0.00 C ATOM 1287 OD1 ASN A 81 -13.322 3.335 -1.786 1.00 0.00 O ATOM 1288 ND2 ASN A 81 -11.817 4.988 -1.573 1.00 0.00 N ATOM 0 H ASN A 81 -13.082 2.684 0.706 1.00 0.00 H new ATOM 0 HA ASN A 81 -12.277 0.952 -1.281 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -10.688 3.228 -0.024 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.419 2.552 -1.618 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -12.458 5.683 -1.956 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -10.879 5.265 -1.283 1.00 0.00 H new ATOM 1295 N ILE A 82 -10.097 0.969 1.217 1.00 0.00 N ATOM 1296 CA ILE A 82 -9.052 0.182 1.860 1.00 0.00 C ATOM 1297 C ILE A 82 -9.437 -1.292 1.927 1.00 0.00 C ATOM 1298 O ILE A 82 -8.678 -2.162 1.499 1.00 0.00 O ATOM 1299 CB ILE A 82 -8.761 0.690 3.285 1.00 0.00 C ATOM 1300 CG1 ILE A 82 -8.273 2.139 3.243 1.00 0.00 C ATOM 1301 CG2 ILE A 82 -7.733 -0.202 3.965 1.00 0.00 C ATOM 1302 CD1 ILE A 82 -8.366 2.847 4.577 1.00 0.00 C ATOM 0 H ILE A 82 -10.272 1.875 1.653 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.154 0.294 1.253 1.00 0.00 H new ATOM 0 HB ILE A 82 -9.684 0.654 3.864 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -7.237 2.155 2.904 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -8.858 2.690 2.507 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -7.538 0.169 4.971 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -8.116 -1.221 4.022 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.807 -0.195 3.389 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -8.003 3.870 4.472 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -9.404 2.862 4.909 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.758 2.320 5.312 1.00 0.00 H new ATOM 1314 N ARG A 83 -10.620 -1.566 2.465 1.00 0.00 N ATOM 1315 CA ARG A 83 -11.107 -2.935 2.587 1.00 0.00 C ATOM 1316 C ARG A 83 -11.037 -3.658 1.246 1.00 0.00 C ATOM 1317 O ARG A 83 -10.559 -4.790 1.162 1.00 0.00 O ATOM 1318 CB ARG A 83 -12.544 -2.943 3.110 1.00 0.00 C ATOM 1319 CG ARG A 83 -12.643 -2.874 4.625 1.00 0.00 C ATOM 1320 CD ARG A 83 -13.923 -2.184 5.069 1.00 0.00 C ATOM 1321 NE ARG A 83 -15.045 -3.115 5.155 1.00 0.00 N ATOM 1322 CZ ARG A 83 -15.169 -4.029 6.112 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -14.247 -4.133 7.058 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -16.219 -4.840 6.123 1.00 0.00 N ATOM 0 H ARG A 83 -11.260 -0.858 2.824 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.467 -3.460 3.296 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.082 -2.098 2.681 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.043 -3.848 2.763 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.609 -3.882 5.039 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -11.782 -2.337 5.023 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -13.765 -1.717 6.041 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.167 -1.386 4.368 1.00 0.00 H new ATOM 0 HE ARG A 83 -15.773 -3.061 4.442 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -13.439 -3.510 7.053 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -14.345 -4.836 7.791 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -16.931 -4.762 5.397 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -16.314 -5.541 6.857 1.00 0.00 H new ATOM 1338 N THR A 84 -11.518 -2.997 0.197 1.00 0.00 N ATOM 1339 CA THR A 84 -11.512 -3.577 -1.140 1.00 0.00 C ATOM 1340 C THR A 84 -10.141 -4.146 -1.487 1.00 0.00 C ATOM 1341 O THR A 84 -10.035 -5.237 -2.047 1.00 0.00 O ATOM 1342 CB THR A 84 -11.907 -2.536 -2.205 1.00 0.00 C ATOM 1343 OG1 THR A 84 -13.157 -1.930 -1.858 1.00 0.00 O ATOM 1344 CG2 THR A 84 -12.015 -3.182 -3.578 1.00 0.00 C ATOM 0 H THR A 84 -11.917 -2.059 0.248 1.00 0.00 H new ATOM 0 HA THR A 84 -12.247 -4.382 -1.138 1.00 0.00 H new ATOM 0 HB THR A 84 -11.131 -1.772 -2.240 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.008 -1.236 -1.183 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.295 -2.428 -4.314 1.00 0.00 H new ATOM 0 HG22 THR A 84 -11.054 -3.617 -3.852 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.774 -3.964 -3.553 1.00 0.00 H new ATOM 1352 N PHE A 85 -9.094 -3.402 -1.149 1.00 0.00 N ATOM 1353 CA PHE A 85 -7.728 -3.833 -1.424 1.00 0.00 C ATOM 1354 C PHE A 85 -7.375 -5.075 -0.611 1.00 0.00 C ATOM 1355 O PHE A 85 -6.760 -6.012 -1.121 1.00 0.00 O ATOM 1356 CB PHE A 85 -6.742 -2.706 -1.111 1.00 0.00 C ATOM 1357 CG PHE A 85 -5.344 -3.189 -0.846 1.00 0.00 C ATOM 1358 CD1 PHE A 85 -4.970 -3.609 0.420 1.00 0.00 C ATOM 1359 CD2 PHE A 85 -4.405 -3.224 -1.864 1.00 0.00 C ATOM 1360 CE1 PHE A 85 -3.685 -4.054 0.667 1.00 0.00 C ATOM 1361 CE2 PHE A 85 -3.119 -3.669 -1.623 1.00 0.00 C ATOM 1362 CZ PHE A 85 -2.758 -4.083 -0.356 1.00 0.00 C ATOM 0 H PHE A 85 -9.165 -2.497 -0.684 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.659 -4.083 -2.483 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.724 -2.007 -1.947 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.098 -2.154 -0.241 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -5.691 -3.588 1.224 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -4.681 -2.900 -2.857 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -3.406 -4.379 1.659 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -2.396 -3.693 -2.425 1.00 0.00 H new ATOM 0 HZ PHE A 85 -1.753 -4.429 -0.166 1.00 0.00 H new ATOM 1372 N LEU A 86 -7.768 -5.074 0.658 1.00 0.00 N ATOM 1373 CA LEU A 86 -7.494 -6.200 1.545 1.00 0.00 C ATOM 1374 C LEU A 86 -8.162 -7.472 1.033 1.00 0.00 C ATOM 1375 O LEU A 86 -7.622 -8.570 1.172 1.00 0.00 O ATOM 1376 CB LEU A 86 -7.980 -5.889 2.961 1.00 0.00 C ATOM 1377 CG LEU A 86 -7.348 -4.672 3.637 1.00 0.00 C ATOM 1378 CD1 LEU A 86 -8.237 -4.162 4.760 1.00 0.00 C ATOM 1379 CD2 LEU A 86 -5.962 -5.014 4.164 1.00 0.00 C ATOM 0 H LEU A 86 -8.277 -4.306 1.096 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.416 -6.361 1.565 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -9.059 -5.741 2.929 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -7.796 -6.763 3.586 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.247 -3.880 2.895 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.770 -3.296 5.229 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.208 -3.876 4.354 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.372 -4.948 5.503 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.528 -4.136 4.642 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -6.038 -5.822 4.891 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.326 -5.329 3.337 1.00 0.00 H new ATOM 1391 N THR A 87 -9.340 -7.317 0.437 1.00 0.00 N ATOM 1392 CA THR A 87 -10.082 -8.452 -0.097 1.00 0.00 C ATOM 1393 C THR A 87 -9.410 -9.008 -1.347 1.00 0.00 C ATOM 1394 O THR A 87 -9.211 -10.216 -1.471 1.00 0.00 O ATOM 1395 CB THR A 87 -11.533 -8.065 -0.437 1.00 0.00 C ATOM 1396 OG1 THR A 87 -12.112 -7.333 0.649 1.00 0.00 O ATOM 1397 CG2 THR A 87 -12.370 -9.302 -0.724 1.00 0.00 C ATOM 0 H THR A 87 -9.801 -6.416 0.312 1.00 0.00 H new ATOM 0 HA THR A 87 -10.091 -9.217 0.679 1.00 0.00 H new ATOM 0 HB THR A 87 -11.519 -7.440 -1.330 1.00 0.00 H new ATOM 0 HG1 THR A 87 -11.701 -6.445 0.701 1.00 0.00 H new ATOM 0 HG21 THR A 87 -13.391 -9.003 -0.962 1.00 0.00 H new ATOM 0 HG22 THR A 87 -11.944 -9.842 -1.570 1.00 0.00 H new ATOM 0 HG23 THR A 87 -12.376 -9.949 0.153 1.00 0.00 H new ATOM 1405 N ALA A 88 -9.062 -8.119 -2.272 1.00 0.00 N ATOM 1406 CA ALA A 88 -8.410 -8.522 -3.512 1.00 0.00 C ATOM 1407 C ALA A 88 -7.097 -9.243 -3.232 1.00 0.00 C ATOM 1408 O ALA A 88 -6.609 -10.009 -4.064 1.00 0.00 O ATOM 1409 CB ALA A 88 -8.170 -7.309 -4.400 1.00 0.00 C ATOM 0 H ALA A 88 -9.221 -7.115 -2.186 1.00 0.00 H new ATOM 0 HA ALA A 88 -9.071 -9.215 -4.033 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.683 -7.624 -5.323 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -9.124 -6.837 -4.636 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.532 -6.596 -3.878 1.00 0.00 H new ATOM 1415 N CYS A 89 -6.529 -8.994 -2.058 1.00 0.00 N ATOM 1416 CA CYS A 89 -5.270 -9.619 -1.669 1.00 0.00 C ATOM 1417 C CYS A 89 -5.462 -11.109 -1.403 1.00 0.00 C ATOM 1418 O CYS A 89 -4.506 -11.885 -1.445 1.00 0.00 O ATOM 1419 CB CYS A 89 -4.700 -8.936 -0.425 1.00 0.00 C ATOM 1420 SG CYS A 89 -3.707 -7.467 -0.779 1.00 0.00 S ATOM 0 H CYS A 89 -6.920 -8.363 -1.358 1.00 0.00 H new ATOM 0 HA CYS A 89 -4.566 -9.503 -2.493 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -5.523 -8.655 0.232 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -4.087 -9.653 0.121 1.00 0.00 H new ATOM 0 HG CYS A 89 -4.061 -6.502 0.016 1.00 0.00 H new ATOM 1426 N CYS A 90 -6.701 -11.500 -1.129 1.00 0.00 N ATOM 1427 CA CYS A 90 -7.018 -12.897 -0.853 1.00 0.00 C ATOM 1428 C CYS A 90 -7.908 -13.479 -1.948 1.00 0.00 C ATOM 1429 O CYS A 90 -8.016 -14.696 -2.090 1.00 0.00 O ATOM 1430 CB CYS A 90 -7.709 -13.027 0.505 1.00 0.00 C ATOM 1431 SG CYS A 90 -6.756 -12.352 1.885 1.00 0.00 S ATOM 0 H CYS A 90 -7.502 -10.870 -1.092 1.00 0.00 H new ATOM 0 HA CYS A 90 -6.084 -13.458 -0.832 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -8.673 -12.520 0.460 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -7.912 -14.080 0.698 1.00 0.00 H new ATOM 0 HG CYS A 90 -5.804 -13.179 2.201 1.00 0.00 H new ATOM 1437 N GLU A 91 -8.543 -12.600 -2.716 1.00 0.00 N ATOM 1438 CA GLU A 91 -9.425 -13.027 -3.796 1.00 0.00 C ATOM 1439 C GLU A 91 -8.658 -13.149 -5.109 1.00 0.00 C ATOM 1440 O GLU A 91 -8.760 -14.157 -5.810 1.00 0.00 O ATOM 1441 CB GLU A 91 -10.583 -12.040 -3.959 1.00 0.00 C ATOM 1442 CG GLU A 91 -11.438 -11.892 -2.711 1.00 0.00 C ATOM 1443 CD GLU A 91 -12.552 -12.919 -2.642 1.00 0.00 C ATOM 1444 OE1 GLU A 91 -12.242 -14.128 -2.597 1.00 0.00 O ATOM 1445 OE2 GLU A 91 -13.733 -12.513 -2.633 1.00 0.00 O ATOM 0 H GLU A 91 -8.463 -11.589 -2.611 1.00 0.00 H new ATOM 0 HA GLU A 91 -9.826 -14.007 -3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.182 -11.064 -4.232 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -11.214 -12.367 -4.785 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -10.806 -11.988 -1.828 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -11.869 -10.891 -2.687 1.00 0.00 H new ATOM 1452 N THR A 92 -7.889 -12.115 -5.437 1.00 0.00 N ATOM 1453 CA THR A 92 -7.106 -12.105 -6.666 1.00 0.00 C ATOM 1454 C THR A 92 -5.814 -12.898 -6.502 1.00 0.00 C ATOM 1455 O THR A 92 -5.467 -13.720 -7.349 1.00 0.00 O ATOM 1456 CB THR A 92 -6.761 -10.668 -7.100 1.00 0.00 C ATOM 1457 OG1 THR A 92 -7.963 -9.921 -7.320 1.00 0.00 O ATOM 1458 CG2 THR A 92 -5.922 -10.673 -8.369 1.00 0.00 C ATOM 0 H THR A 92 -7.792 -11.274 -4.868 1.00 0.00 H new ATOM 0 HA THR A 92 -7.720 -12.572 -7.436 1.00 0.00 H new ATOM 0 HB THR A 92 -6.183 -10.200 -6.303 1.00 0.00 H new ATOM 0 HG1 THR A 92 -7.751 -8.965 -7.361 1.00 0.00 H new ATOM 0 HG21 THR A 92 -5.691 -9.647 -8.656 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.995 -11.218 -8.190 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.478 -11.158 -9.171 1.00 0.00 H new ATOM 1466 N PHE A 93 -5.107 -12.646 -5.405 1.00 0.00 N ATOM 1467 CA PHE A 93 -3.852 -13.336 -5.130 1.00 0.00 C ATOM 1468 C PHE A 93 -4.088 -14.565 -4.256 1.00 0.00 C ATOM 1469 O PHE A 93 -3.803 -15.691 -4.660 1.00 0.00 O ATOM 1470 CB PHE A 93 -2.865 -12.390 -4.443 1.00 0.00 C ATOM 1471 CG PHE A 93 -2.362 -11.295 -5.340 1.00 0.00 C ATOM 1472 CD1 PHE A 93 -3.220 -10.308 -5.797 1.00 0.00 C ATOM 1473 CD2 PHE A 93 -1.032 -11.252 -5.725 1.00 0.00 C ATOM 1474 CE1 PHE A 93 -2.761 -9.298 -6.622 1.00 0.00 C ATOM 1475 CE2 PHE A 93 -0.567 -10.245 -6.549 1.00 0.00 C ATOM 1476 CZ PHE A 93 -1.433 -9.267 -6.999 1.00 0.00 C ATOM 0 H PHE A 93 -5.382 -11.970 -4.693 1.00 0.00 H new ATOM 0 HA PHE A 93 -3.430 -13.663 -6.080 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.347 -11.944 -3.573 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.016 -12.967 -4.076 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -4.260 -10.328 -5.505 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -0.351 -12.014 -5.377 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.440 -8.534 -6.971 1.00 0.00 H new ATOM 0 HE2 PHE A 93 0.473 -10.222 -6.841 1.00 0.00 H new ATOM 0 HZ PHE A 93 -1.072 -8.480 -7.644 1.00 0.00 H new ATOM 1486 N GLY A 94 -4.612 -14.338 -3.055 1.00 0.00 N ATOM 1487 CA GLY A 94 -4.877 -15.435 -2.142 1.00 0.00 C ATOM 1488 C GLY A 94 -3.833 -15.544 -1.049 1.00 0.00 C ATOM 1489 O GLY A 94 -3.203 -16.589 -0.886 1.00 0.00 O ATOM 0 H GLY A 94 -4.858 -13.415 -2.698 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.859 -15.298 -1.690 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.911 -16.370 -2.702 1.00 0.00 H new ATOM 1493 N MET A 95 -3.647 -14.463 -0.299 1.00 0.00 N ATOM 1494 CA MET A 95 -2.671 -14.442 0.784 1.00 0.00 C ATOM 1495 C MET A 95 -3.352 -14.644 2.134 1.00 0.00 C ATOM 1496 O MET A 95 -4.569 -14.815 2.206 1.00 0.00 O ATOM 1497 CB MET A 95 -1.901 -13.120 0.781 1.00 0.00 C ATOM 1498 CG MET A 95 -0.727 -13.103 -0.185 1.00 0.00 C ATOM 1499 SD MET A 95 0.508 -11.862 0.246 1.00 0.00 S ATOM 1500 CE MET A 95 -0.472 -10.365 0.159 1.00 0.00 C ATOM 0 H MET A 95 -4.160 -13.590 -0.421 1.00 0.00 H new ATOM 0 HA MET A 95 -1.971 -15.262 0.624 1.00 0.00 H new ATOM 0 HB2 MET A 95 -2.585 -12.311 0.523 1.00 0.00 H new ATOM 0 HB3 MET A 95 -1.535 -12.920 1.788 1.00 0.00 H new ATOM 0 HG2 MET A 95 -0.258 -14.087 -0.199 1.00 0.00 H new ATOM 0 HG3 MET A 95 -1.094 -12.910 -1.193 1.00 0.00 H new ATOM 0 HE1 MET A 95 0.124 -9.520 0.503 1.00 0.00 H new ATOM 0 HE2 MET A 95 -0.784 -10.194 -0.871 1.00 0.00 H new ATOM 0 HE3 MET A 95 -1.353 -10.470 0.792 1.00 0.00 H new ATOM 1510 N ARG A 96 -2.560 -14.623 3.201 1.00 0.00 N ATOM 1511 CA ARG A 96 -3.088 -14.805 4.548 1.00 0.00 C ATOM 1512 C ARG A 96 -3.982 -13.634 4.944 1.00 0.00 C ATOM 1513 O ARG A 96 -3.831 -12.523 4.435 1.00 0.00 O ATOM 1514 CB ARG A 96 -1.942 -14.949 5.551 1.00 0.00 C ATOM 1515 CG ARG A 96 -1.118 -16.212 5.358 1.00 0.00 C ATOM 1516 CD ARG A 96 0.246 -16.093 6.019 1.00 0.00 C ATOM 1517 NE ARG A 96 1.057 -17.291 5.818 1.00 0.00 N ATOM 1518 CZ ARG A 96 0.953 -18.383 6.567 1.00 0.00 C ATOM 1519 NH1 ARG A 96 0.075 -18.429 7.560 1.00 0.00 N ATOM 1520 NH2 ARG A 96 1.726 -19.433 6.322 1.00 0.00 N ATOM 0 H ARG A 96 -1.551 -14.482 3.159 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.687 -15.716 4.558 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -1.287 -14.082 5.468 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -2.352 -14.944 6.561 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -1.653 -17.064 5.776 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -0.992 -16.406 4.293 1.00 0.00 H new ATOM 0 HD2 ARG A 96 0.771 -15.228 5.614 1.00 0.00 H new ATOM 0 HD3 ARG A 96 0.117 -15.917 7.087 1.00 0.00 H new ATOM 0 HE ARG A 96 1.741 -17.289 5.061 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -0.523 -17.625 7.750 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -0.003 -19.269 8.134 1.00 0.00 H new ATOM 0 HH21 ARG A 96 2.401 -19.402 5.558 1.00 0.00 H new ATOM 0 HH22 ARG A 96 1.645 -20.271 6.898 1.00 0.00 H new ATOM 1534 N LYS A 97 -4.913 -13.890 5.857 1.00 0.00 N ATOM 1535 CA LYS A 97 -5.832 -12.858 6.323 1.00 0.00 C ATOM 1536 C LYS A 97 -5.325 -12.222 7.614 1.00 0.00 C ATOM 1537 O LYS A 97 -5.760 -11.135 7.994 1.00 0.00 O ATOM 1538 CB LYS A 97 -7.225 -13.450 6.546 1.00 0.00 C ATOM 1539 CG LYS A 97 -8.351 -12.456 6.321 1.00 0.00 C ATOM 1540 CD LYS A 97 -9.670 -12.973 6.873 1.00 0.00 C ATOM 1541 CE LYS A 97 -9.869 -12.557 8.322 1.00 0.00 C ATOM 1542 NZ LYS A 97 -9.291 -13.551 9.269 1.00 0.00 N ATOM 0 H LYS A 97 -5.051 -14.804 6.289 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.891 -12.085 5.557 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.361 -14.299 5.876 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.289 -13.834 7.564 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.102 -11.508 6.799 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.455 -12.258 5.254 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -10.493 -12.593 6.268 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.696 -14.060 6.799 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -9.405 -11.585 8.488 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -10.934 -12.440 8.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.804 -13.509 10.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.378 -14.506 8.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.287 -13.334 9.430 1.00 0.00 H new ATOM 1556 N SER A 98 -4.403 -12.907 8.284 1.00 0.00 N ATOM 1557 CA SER A 98 -3.840 -12.410 9.533 1.00 0.00 C ATOM 1558 C SER A 98 -2.739 -11.387 9.264 1.00 0.00 C ATOM 1559 O SER A 98 -2.607 -10.399 9.985 1.00 0.00 O ATOM 1560 CB SER A 98 -3.283 -13.568 10.363 1.00 0.00 C ATOM 1561 OG SER A 98 -3.247 -13.238 11.740 1.00 0.00 O ATOM 0 H SER A 98 -4.031 -13.807 7.982 1.00 0.00 H new ATOM 0 HA SER A 98 -4.638 -11.922 10.093 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.899 -14.455 10.215 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.279 -13.816 10.019 1.00 0.00 H new ATOM 0 HG SER A 98 -2.889 -13.995 12.249 1.00 0.00 H new ATOM 1567 N GLU A 99 -1.953 -11.634 8.221 1.00 0.00 N ATOM 1568 CA GLU A 99 -0.864 -10.736 7.857 1.00 0.00 C ATOM 1569 C GLU A 99 -1.395 -9.346 7.517 1.00 0.00 C ATOM 1570 O GLU A 99 -0.862 -8.336 7.976 1.00 0.00 O ATOM 1571 CB GLU A 99 -0.083 -11.301 6.668 1.00 0.00 C ATOM 1572 CG GLU A 99 0.734 -12.536 7.008 1.00 0.00 C ATOM 1573 CD GLU A 99 0.124 -13.346 8.136 1.00 0.00 C ATOM 1574 OE1 GLU A 99 -0.906 -14.011 7.898 1.00 0.00 O ATOM 1575 OE2 GLU A 99 0.677 -13.316 9.255 1.00 0.00 O ATOM 0 H GLU A 99 -2.050 -12.448 7.614 1.00 0.00 H new ATOM 0 HA GLU A 99 -0.196 -10.651 8.714 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.782 -11.547 5.869 1.00 0.00 H new ATOM 0 HB3 GLU A 99 0.584 -10.530 6.282 1.00 0.00 H new ATOM 0 HG2 GLU A 99 0.823 -13.164 6.121 1.00 0.00 H new ATOM 0 HG3 GLU A 99 1.743 -12.234 7.287 1.00 0.00 H new ATOM 1582 N LEU A 100 -2.448 -9.304 6.708 1.00 0.00 N ATOM 1583 CA LEU A 100 -3.053 -8.039 6.305 1.00 0.00 C ATOM 1584 C LEU A 100 -3.065 -7.047 7.464 1.00 0.00 C ATOM 1585 O LEU A 100 -3.008 -7.438 8.630 1.00 0.00 O ATOM 1586 CB LEU A 100 -4.479 -8.270 5.802 1.00 0.00 C ATOM 1587 CG LEU A 100 -4.661 -9.415 4.804 1.00 0.00 C ATOM 1588 CD1 LEU A 100 -6.102 -9.479 4.323 1.00 0.00 C ATOM 1589 CD2 LEU A 100 -3.711 -9.253 3.627 1.00 0.00 C ATOM 0 H LEU A 100 -2.900 -10.131 6.318 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.453 -7.619 5.498 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.120 -8.459 6.663 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.833 -7.350 5.337 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.426 -10.352 5.309 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -6.213 -10.299 3.614 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.763 -9.643 5.174 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.365 -8.540 3.836 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.855 -10.076 2.927 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.915 -8.309 3.122 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.682 -9.258 3.987 1.00 0.00 H new ATOM 1601 N PHE A 101 -3.142 -5.762 7.135 1.00 0.00 N ATOM 1602 CA PHE A 101 -3.163 -4.714 8.149 1.00 0.00 C ATOM 1603 C PHE A 101 -4.595 -4.308 8.481 1.00 0.00 C ATOM 1604 O PHE A 101 -5.527 -4.618 7.740 1.00 0.00 O ATOM 1605 CB PHE A 101 -2.373 -3.494 7.668 1.00 0.00 C ATOM 1606 CG PHE A 101 -2.949 -2.855 6.437 1.00 0.00 C ATOM 1607 CD1 PHE A 101 -3.958 -1.911 6.537 1.00 0.00 C ATOM 1608 CD2 PHE A 101 -2.481 -3.199 5.179 1.00 0.00 C ATOM 1609 CE1 PHE A 101 -4.490 -1.321 5.406 1.00 0.00 C ATOM 1610 CE2 PHE A 101 -3.008 -2.612 4.044 1.00 0.00 C ATOM 1611 CZ PHE A 101 -4.015 -1.672 4.158 1.00 0.00 C ATOM 0 H PHE A 101 -3.191 -5.421 6.175 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.697 -5.107 9.052 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.338 -2.755 8.469 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.345 -3.794 7.465 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -4.333 -1.633 7.511 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.696 -3.934 5.084 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -5.276 -0.586 5.498 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -2.633 -2.887 3.069 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.429 -1.213 3.273 1.00 0.00 H new ATOM 1621 N GLU A 102 -4.762 -3.612 9.602 1.00 0.00 N ATOM 1622 CA GLU A 102 -6.081 -3.165 10.034 1.00 0.00 C ATOM 1623 C GLU A 102 -6.492 -1.893 9.298 1.00 0.00 C ATOM 1624 O GLU A 102 -5.806 -0.874 9.369 1.00 0.00 O ATOM 1625 CB GLU A 102 -6.092 -2.920 11.544 1.00 0.00 C ATOM 1626 CG GLU A 102 -6.225 -4.191 12.366 1.00 0.00 C ATOM 1627 CD GLU A 102 -6.311 -3.917 13.855 1.00 0.00 C ATOM 1628 OE1 GLU A 102 -7.045 -2.985 14.245 1.00 0.00 O ATOM 1629 OE2 GLU A 102 -5.645 -4.635 14.630 1.00 0.00 O ATOM 0 H GLU A 102 -4.001 -3.346 10.227 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.799 -3.950 9.796 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.172 -2.409 11.827 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.917 -2.251 11.789 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -7.116 -4.733 12.048 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -5.370 -4.838 12.168 1.00 0.00 H new ATOM 1636 N ALA A 103 -7.616 -1.962 8.592 1.00 0.00 N ATOM 1637 CA ALA A 103 -8.119 -0.816 7.844 1.00 0.00 C ATOM 1638 C ALA A 103 -7.927 0.478 8.627 1.00 0.00 C ATOM 1639 O ALA A 103 -7.453 1.477 8.087 1.00 0.00 O ATOM 1640 CB ALA A 103 -9.588 -1.014 7.501 1.00 0.00 C ATOM 0 H ALA A 103 -8.195 -2.799 8.522 1.00 0.00 H new ATOM 0 HA ALA A 103 -7.548 -0.738 6.919 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -9.951 -0.151 6.943 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -9.702 -1.913 6.895 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.165 -1.120 8.420 1.00 0.00 H new ATOM 1646 N PHE A 104 -8.298 0.453 9.903 1.00 0.00 N ATOM 1647 CA PHE A 104 -8.168 1.626 10.760 1.00 0.00 C ATOM 1648 C PHE A 104 -6.715 2.086 10.835 1.00 0.00 C ATOM 1649 O PHE A 104 -6.399 3.234 10.521 1.00 0.00 O ATOM 1650 CB PHE A 104 -8.690 1.318 12.165 1.00 0.00 C ATOM 1651 CG PHE A 104 -9.044 2.545 12.955 1.00 0.00 C ATOM 1652 CD1 PHE A 104 -10.075 3.375 12.546 1.00 0.00 C ATOM 1653 CD2 PHE A 104 -8.345 2.868 14.107 1.00 0.00 C ATOM 1654 CE1 PHE A 104 -10.403 4.505 13.271 1.00 0.00 C ATOM 1655 CE2 PHE A 104 -8.669 3.996 14.837 1.00 0.00 C ATOM 1656 CZ PHE A 104 -9.699 4.816 14.418 1.00 0.00 C ATOM 0 H PHE A 104 -8.691 -0.366 10.366 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.764 2.429 10.327 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -9.570 0.680 12.085 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -7.934 0.751 12.709 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -10.629 3.136 11.650 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.538 2.231 14.438 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.209 5.144 12.941 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.118 4.236 15.734 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.953 5.699 14.986 1.00 0.00 H new ATOM 1666 N ASP A 105 -5.835 1.182 11.253 1.00 0.00 N ATOM 1667 CA ASP A 105 -4.416 1.494 11.369 1.00 0.00 C ATOM 1668 C ASP A 105 -3.960 2.390 10.222 1.00 0.00 C ATOM 1669 O ASP A 105 -3.198 3.336 10.424 1.00 0.00 O ATOM 1670 CB ASP A 105 -3.589 0.207 11.387 1.00 0.00 C ATOM 1671 CG ASP A 105 -3.498 -0.404 12.771 1.00 0.00 C ATOM 1672 OD1 ASP A 105 -4.140 0.131 13.699 1.00 0.00 O ATOM 1673 OD2 ASP A 105 -2.787 -1.419 12.926 1.00 0.00 O ATOM 0 H ASP A 105 -6.080 0.228 11.517 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.263 2.029 12.306 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.033 -0.516 10.702 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.585 0.419 11.020 1.00 0.00 H new ATOM 1678 N LEU A 106 -4.431 2.086 9.018 1.00 0.00 N ATOM 1679 CA LEU A 106 -4.072 2.863 7.837 1.00 0.00 C ATOM 1680 C LEU A 106 -4.821 4.191 7.810 1.00 0.00 C ATOM 1681 O LEU A 106 -4.215 5.256 7.688 1.00 0.00 O ATOM 1682 CB LEU A 106 -4.375 2.068 6.566 1.00 0.00 C ATOM 1683 CG LEU A 106 -4.006 2.745 5.246 1.00 0.00 C ATOM 1684 CD1 LEU A 106 -2.495 2.813 5.085 1.00 0.00 C ATOM 1685 CD2 LEU A 106 -4.636 2.007 4.074 1.00 0.00 C ATOM 0 H LEU A 106 -5.063 1.307 8.834 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.003 3.071 7.882 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -3.847 1.116 6.623 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -5.441 1.841 6.549 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.396 3.763 5.261 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.251 3.298 4.140 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.067 3.386 5.908 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.083 1.804 5.092 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.363 2.503 3.143 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.277 0.978 4.056 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.721 2.011 4.182 1.00 0.00 H new ATOM 1697 N PHE A 107 -6.143 4.121 7.928 1.00 0.00 N ATOM 1698 CA PHE A 107 -6.976 5.318 7.919 1.00 0.00 C ATOM 1699 C PHE A 107 -6.452 6.353 8.910 1.00 0.00 C ATOM 1700 O PHE A 107 -6.008 7.433 8.519 1.00 0.00 O ATOM 1701 CB PHE A 107 -8.425 4.959 8.257 1.00 0.00 C ATOM 1702 CG PHE A 107 -9.389 6.091 8.040 1.00 0.00 C ATOM 1703 CD1 PHE A 107 -9.433 6.757 6.826 1.00 0.00 C ATOM 1704 CD2 PHE A 107 -10.250 6.488 9.049 1.00 0.00 C ATOM 1705 CE1 PHE A 107 -10.319 7.799 6.623 1.00 0.00 C ATOM 1706 CE2 PHE A 107 -11.138 7.529 8.853 1.00 0.00 C ATOM 1707 CZ PHE A 107 -11.173 8.184 7.638 1.00 0.00 C ATOM 0 H PHE A 107 -6.660 3.248 8.031 1.00 0.00 H new ATOM 0 HA PHE A 107 -6.939 5.748 6.918 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -8.732 4.109 7.648 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -8.479 4.641 9.298 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -8.768 6.459 6.029 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -10.228 5.978 10.001 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -10.343 8.311 5.672 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -11.803 7.830 9.649 1.00 0.00 H new ATOM 0 HZ PHE A 107 -11.867 8.996 7.481 1.00 0.00 H new ATOM 1717 N ASP A 108 -6.507 6.015 10.193 1.00 0.00 N ATOM 1718 CA ASP A 108 -6.038 6.914 11.241 1.00 0.00 C ATOM 1719 C ASP A 108 -4.517 7.029 11.218 1.00 0.00 C ATOM 1720 O ASP A 108 -3.933 7.828 11.950 1.00 0.00 O ATOM 1721 CB ASP A 108 -6.503 6.421 12.612 1.00 0.00 C ATOM 1722 CG ASP A 108 -6.607 7.543 13.627 1.00 0.00 C ATOM 1723 OD1 ASP A 108 -5.794 8.488 13.551 1.00 0.00 O ATOM 1724 OD2 ASP A 108 -7.501 7.476 14.495 1.00 0.00 O ATOM 0 H ASP A 108 -6.872 5.125 10.533 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.462 7.901 11.055 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -7.474 5.936 12.510 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.807 5.667 12.979 1.00 0.00 H new ATOM 1729 N VAL A 109 -3.881 6.225 10.372 1.00 0.00 N ATOM 1730 CA VAL A 109 -2.428 6.236 10.253 1.00 0.00 C ATOM 1731 C VAL A 109 -1.764 5.937 11.592 1.00 0.00 C ATOM 1732 O VAL A 109 -0.730 6.516 11.927 1.00 0.00 O ATOM 1733 CB VAL A 109 -1.918 7.593 9.731 1.00 0.00 C ATOM 1734 CG1 VAL A 109 -0.568 7.430 9.049 1.00 0.00 C ATOM 1735 CG2 VAL A 109 -2.932 8.213 8.782 1.00 0.00 C ATOM 0 H VAL A 109 -4.349 5.558 9.759 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.163 5.457 9.538 1.00 0.00 H new ATOM 0 HB VAL A 109 -1.790 8.265 10.580 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.224 8.399 8.687 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.154 7.032 9.762 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.665 6.742 8.209 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -2.556 9.171 8.423 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -3.093 7.546 7.935 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.875 8.367 9.307 1.00 0.00 H new ATOM 1745 N ARG A 110 -2.365 5.030 12.355 1.00 0.00 N ATOM 1746 CA ARG A 110 -1.833 4.654 13.659 1.00 0.00 C ATOM 1747 C ARG A 110 -0.528 3.877 13.510 1.00 0.00 C ATOM 1748 O ARG A 110 0.531 4.336 13.937 1.00 0.00 O ATOM 1749 CB ARG A 110 -2.855 3.814 14.428 1.00 0.00 C ATOM 1750 CG ARG A 110 -4.269 4.366 14.363 1.00 0.00 C ATOM 1751 CD ARG A 110 -5.060 4.021 15.615 1.00 0.00 C ATOM 1752 NE ARG A 110 -4.674 4.853 16.752 1.00 0.00 N ATOM 1753 CZ ARG A 110 -5.322 4.858 17.912 1.00 0.00 C ATOM 1754 NH1 ARG A 110 -6.380 4.079 18.087 1.00 0.00 N ATOM 1755 NH2 ARG A 110 -4.910 5.642 18.900 1.00 0.00 N ATOM 0 H ARG A 110 -3.221 4.542 12.092 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.630 5.567 14.218 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -2.852 2.799 14.030 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.547 3.748 15.472 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.233 5.449 14.241 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.778 3.963 13.487 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.125 4.148 15.418 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -4.905 2.971 15.864 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.863 5.463 16.650 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -6.698 3.474 17.330 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -6.876 4.085 18.978 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -4.095 6.242 18.769 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -5.408 5.645 19.790 1.00 0.00 H new ATOM 1769 N ASP A 111 -0.614 2.699 12.903 1.00 0.00 N ATOM 1770 CA ASP A 111 0.560 1.858 12.697 1.00 0.00 C ATOM 1771 C ASP A 111 0.781 1.587 11.212 1.00 0.00 C ATOM 1772 O ASP A 111 0.321 0.576 10.680 1.00 0.00 O ATOM 1773 CB ASP A 111 0.405 0.536 13.452 1.00 0.00 C ATOM 1774 CG ASP A 111 0.649 0.687 14.940 1.00 0.00 C ATOM 1775 OD1 ASP A 111 1.775 1.071 15.321 1.00 0.00 O ATOM 1776 OD2 ASP A 111 -0.286 0.423 15.724 1.00 0.00 O ATOM 0 H ASP A 111 -1.484 2.304 12.545 1.00 0.00 H new ATOM 0 HA ASP A 111 1.430 2.389 13.084 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.599 0.144 13.289 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.103 -0.196 13.045 1.00 0.00 H new ATOM 1781 N PHE A 112 1.486 2.497 10.549 1.00 0.00 N ATOM 1782 CA PHE A 112 1.766 2.358 9.124 1.00 0.00 C ATOM 1783 C PHE A 112 2.715 1.191 8.869 1.00 0.00 C ATOM 1784 O PHE A 112 2.552 0.443 7.905 1.00 0.00 O ATOM 1785 CB PHE A 112 2.370 3.651 8.573 1.00 0.00 C ATOM 1786 CG PHE A 112 2.548 3.641 7.082 1.00 0.00 C ATOM 1787 CD1 PHE A 112 1.455 3.509 6.241 1.00 0.00 C ATOM 1788 CD2 PHE A 112 3.809 3.765 6.520 1.00 0.00 C ATOM 1789 CE1 PHE A 112 1.616 3.499 4.869 1.00 0.00 C ATOM 1790 CE2 PHE A 112 3.976 3.756 5.148 1.00 0.00 C ATOM 1791 CZ PHE A 112 2.878 3.624 4.321 1.00 0.00 C ATOM 0 H PHE A 112 1.874 3.339 10.975 1.00 0.00 H new ATOM 0 HA PHE A 112 0.825 2.158 8.611 1.00 0.00 H new ATOM 0 HB2 PHE A 112 1.729 4.488 8.849 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.338 3.821 9.045 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.466 3.413 6.663 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.671 3.870 7.162 1.00 0.00 H new ATOM 0 HE1 PHE A 112 0.756 3.393 4.225 1.00 0.00 H new ATOM 0 HE2 PHE A 112 4.964 3.852 4.723 1.00 0.00 H new ATOM 0 HZ PHE A 112 3.006 3.618 3.249 1.00 0.00 H new ATOM 1801 N GLY A 113 3.710 1.042 9.739 1.00 0.00 N ATOM 1802 CA GLY A 113 4.671 -0.035 9.590 1.00 0.00 C ATOM 1803 C GLY A 113 4.009 -1.368 9.306 1.00 0.00 C ATOM 1804 O GLY A 113 4.580 -2.222 8.628 1.00 0.00 O ATOM 0 H GLY A 113 3.867 1.648 10.544 1.00 0.00 H new ATOM 0 HA2 GLY A 113 5.359 0.206 8.779 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.266 -0.115 10.500 1.00 0.00 H new ATOM 1808 N LYS A 114 2.800 -1.550 9.827 1.00 0.00 N ATOM 1809 CA LYS A 114 2.058 -2.789 9.627 1.00 0.00 C ATOM 1810 C LYS A 114 1.644 -2.946 8.168 1.00 0.00 C ATOM 1811 O LYS A 114 1.600 -4.057 7.640 1.00 0.00 O ATOM 1812 CB LYS A 114 0.819 -2.816 10.525 1.00 0.00 C ATOM 1813 CG LYS A 114 1.111 -3.250 11.951 1.00 0.00 C ATOM 1814 CD LYS A 114 -0.161 -3.349 12.776 1.00 0.00 C ATOM 1815 CE LYS A 114 -0.016 -4.356 13.907 1.00 0.00 C ATOM 1816 NZ LYS A 114 -1.047 -4.157 14.962 1.00 0.00 N ATOM 0 H LYS A 114 2.313 -0.854 10.392 1.00 0.00 H new ATOM 0 HA LYS A 114 2.711 -3.621 9.893 1.00 0.00 H new ATOM 0 HB2 LYS A 114 0.370 -1.823 10.541 1.00 0.00 H new ATOM 0 HB3 LYS A 114 0.081 -3.492 10.092 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.616 -4.216 11.942 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.793 -2.538 12.416 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.405 -2.370 13.188 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -0.991 -3.640 12.133 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -0.097 -5.366 13.506 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.977 -4.266 14.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -0.914 -4.862 15.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.954 -3.202 15.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.994 -4.268 14.547 1.00 0.00 H new ATOM 1830 N VAL A 115 1.342 -1.825 7.519 1.00 0.00 N ATOM 1831 CA VAL A 115 0.935 -1.838 6.119 1.00 0.00 C ATOM 1832 C VAL A 115 2.117 -2.138 5.205 1.00 0.00 C ATOM 1833 O VAL A 115 1.988 -2.879 4.230 1.00 0.00 O ATOM 1834 CB VAL A 115 0.308 -0.493 5.705 1.00 0.00 C ATOM 1835 CG1 VAL A 115 -0.331 -0.604 4.329 1.00 0.00 C ATOM 1836 CG2 VAL A 115 -0.710 -0.039 6.740 1.00 0.00 C ATOM 0 H VAL A 115 1.372 -0.897 7.941 1.00 0.00 H new ATOM 0 HA VAL A 115 0.190 -2.626 6.013 1.00 0.00 H new ATOM 0 HB VAL A 115 1.098 0.256 5.653 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.769 0.355 4.053 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.428 -0.881 3.597 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.110 -1.366 4.350 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.143 0.913 6.432 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -1.499 -0.786 6.826 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.218 0.082 7.705 1.00 0.00 H new ATOM 1846 N ILE A 116 3.269 -1.559 5.527 1.00 0.00 N ATOM 1847 CA ILE A 116 4.475 -1.767 4.736 1.00 0.00 C ATOM 1848 C ILE A 116 4.816 -3.249 4.631 1.00 0.00 C ATOM 1849 O ILE A 116 5.143 -3.746 3.553 1.00 0.00 O ATOM 1850 CB ILE A 116 5.679 -1.017 5.337 1.00 0.00 C ATOM 1851 CG1 ILE A 116 5.317 0.447 5.596 1.00 0.00 C ATOM 1852 CG2 ILE A 116 6.881 -1.115 4.410 1.00 0.00 C ATOM 1853 CD1 ILE A 116 6.497 1.295 6.018 1.00 0.00 C ATOM 0 H ILE A 116 3.392 -0.942 6.330 1.00 0.00 H new ATOM 0 HA ILE A 116 4.270 -1.372 3.741 1.00 0.00 H new ATOM 0 HB ILE A 116 5.940 -1.481 6.288 1.00 0.00 H new ATOM 0 HG12 ILE A 116 4.880 0.871 4.692 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.552 0.492 6.371 1.00 0.00 H new ATOM 0 HG21 ILE A 116 7.723 -0.580 4.849 1.00 0.00 H new ATOM 0 HG22 ILE A 116 7.149 -2.162 4.271 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.633 -0.673 3.445 1.00 0.00 H new ATOM 0 HD11 ILE A 116 6.167 2.320 6.184 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.921 0.896 6.940 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.254 1.280 5.234 1.00 0.00 H new ATOM 1865 N GLU A 117 4.734 -3.951 5.757 1.00 0.00 N ATOM 1866 CA GLU A 117 5.033 -5.378 5.790 1.00 0.00 C ATOM 1867 C GLU A 117 4.097 -6.152 4.866 1.00 0.00 C ATOM 1868 O GLU A 117 4.526 -7.044 4.133 1.00 0.00 O ATOM 1869 CB GLU A 117 4.915 -5.913 7.219 1.00 0.00 C ATOM 1870 CG GLU A 117 5.589 -7.260 7.422 1.00 0.00 C ATOM 1871 CD GLU A 117 7.086 -7.203 7.192 1.00 0.00 C ATOM 1872 OE1 GLU A 117 7.760 -6.394 7.864 1.00 0.00 O ATOM 1873 OE2 GLU A 117 7.584 -7.968 6.340 1.00 0.00 O ATOM 0 H GLU A 117 4.463 -3.555 6.657 1.00 0.00 H new ATOM 0 HA GLU A 117 6.056 -5.517 5.441 1.00 0.00 H new ATOM 0 HB2 GLU A 117 5.353 -5.189 7.906 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.860 -6.001 7.479 1.00 0.00 H new ATOM 0 HG2 GLU A 117 5.394 -7.611 8.435 1.00 0.00 H new ATOM 0 HG3 GLU A 117 5.148 -7.989 6.742 1.00 0.00 H new ATOM 1880 N THR A 118 2.814 -5.804 4.907 1.00 0.00 N ATOM 1881 CA THR A 118 1.816 -6.466 4.076 1.00 0.00 C ATOM 1882 C THR A 118 2.290 -6.577 2.631 1.00 0.00 C ATOM 1883 O THR A 118 1.992 -7.554 1.943 1.00 0.00 O ATOM 1884 CB THR A 118 0.472 -5.714 4.107 1.00 0.00 C ATOM 1885 OG1 THR A 118 0.003 -5.606 5.456 1.00 0.00 O ATOM 1886 CG2 THR A 118 -0.568 -6.431 3.259 1.00 0.00 C ATOM 0 H THR A 118 2.442 -5.068 5.507 1.00 0.00 H new ATOM 0 HA THR A 118 1.675 -7.466 4.487 1.00 0.00 H new ATOM 0 HB THR A 118 0.628 -4.717 3.696 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.554 -4.958 5.943 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.509 -5.882 3.296 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.221 -6.487 2.227 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.721 -7.439 3.645 1.00 0.00 H new ATOM 1894 N LEU A 119 3.029 -5.571 2.177 1.00 0.00 N ATOM 1895 CA LEU A 119 3.546 -5.556 0.813 1.00 0.00 C ATOM 1896 C LEU A 119 4.800 -6.417 0.696 1.00 0.00 C ATOM 1897 O LEU A 119 5.042 -7.041 -0.337 1.00 0.00 O ATOM 1898 CB LEU A 119 3.855 -4.122 0.380 1.00 0.00 C ATOM 1899 CG LEU A 119 2.845 -3.058 0.810 1.00 0.00 C ATOM 1900 CD1 LEU A 119 3.372 -1.665 0.501 1.00 0.00 C ATOM 1901 CD2 LEU A 119 1.505 -3.287 0.126 1.00 0.00 C ATOM 0 H LEU A 119 3.284 -4.755 2.733 1.00 0.00 H new ATOM 0 HA LEU A 119 2.781 -5.970 0.156 1.00 0.00 H new ATOM 0 HB2 LEU A 119 4.833 -3.847 0.776 1.00 0.00 H new ATOM 0 HB3 LEU A 119 3.934 -4.101 -0.707 1.00 0.00 H new ATOM 0 HG LEU A 119 2.699 -3.138 1.887 1.00 0.00 H new ATOM 0 HD11 LEU A 119 2.639 -0.921 0.814 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.307 -1.502 1.038 1.00 0.00 H new ATOM 0 HD13 LEU A 119 3.548 -1.572 -0.571 1.00 0.00 H new ATOM 0 HD21 LEU A 119 0.798 -2.520 0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 119 1.635 -3.235 -0.955 1.00 0.00 H new ATOM 0 HD23 LEU A 119 1.121 -4.270 0.398 1.00 0.00 H new ATOM 1913 N SER A 120 5.593 -6.446 1.762 1.00 0.00 N ATOM 1914 CA SER A 120 6.823 -7.229 1.778 1.00 0.00 C ATOM 1915 C SER A 120 6.545 -8.684 1.413 1.00 0.00 C ATOM 1916 O SER A 120 7.345 -9.329 0.735 1.00 0.00 O ATOM 1917 CB SER A 120 7.482 -7.154 3.157 1.00 0.00 C ATOM 1918 OG SER A 120 7.563 -5.814 3.611 1.00 0.00 O ATOM 0 H SER A 120 5.406 -5.937 2.626 1.00 0.00 H new ATOM 0 HA SER A 120 7.502 -6.810 1.035 1.00 0.00 H new ATOM 0 HB2 SER A 120 6.910 -7.749 3.870 1.00 0.00 H new ATOM 0 HB3 SER A 120 8.481 -7.586 3.110 1.00 0.00 H new ATOM 0 HG SER A 120 7.734 -5.221 2.850 1.00 0.00 H new ATOM 1924 N ARG A 121 5.406 -9.195 1.869 1.00 0.00 N ATOM 1925 CA ARG A 121 5.022 -10.574 1.592 1.00 0.00 C ATOM 1926 C ARG A 121 4.497 -10.717 0.166 1.00 0.00 C ATOM 1927 O ARG A 121 4.944 -11.583 -0.588 1.00 0.00 O ATOM 1928 CB ARG A 121 3.958 -11.040 2.587 1.00 0.00 C ATOM 1929 CG ARG A 121 4.369 -10.872 4.041 1.00 0.00 C ATOM 1930 CD ARG A 121 3.192 -11.086 4.981 1.00 0.00 C ATOM 1931 NE ARG A 121 1.933 -10.642 4.390 1.00 0.00 N ATOM 1932 CZ ARG A 121 1.185 -11.402 3.597 1.00 0.00 C ATOM 1933 NH1 ARG A 121 1.569 -12.636 3.301 1.00 0.00 N ATOM 1934 NH2 ARG A 121 0.051 -10.927 3.098 1.00 0.00 N ATOM 0 H ARG A 121 4.733 -8.675 2.432 1.00 0.00 H new ATOM 0 HA ARG A 121 5.908 -11.199 1.699 1.00 0.00 H new ATOM 0 HB2 ARG A 121 3.039 -10.481 2.411 1.00 0.00 H new ATOM 0 HB3 ARG A 121 3.733 -12.090 2.401 1.00 0.00 H new ATOM 0 HG2 ARG A 121 5.161 -11.581 4.281 1.00 0.00 H new ATOM 0 HG3 ARG A 121 4.779 -9.873 4.191 1.00 0.00 H new ATOM 0 HD2 ARG A 121 3.120 -12.143 5.237 1.00 0.00 H new ATOM 0 HD3 ARG A 121 3.367 -10.544 5.911 1.00 0.00 H new ATOM 0 HE ARG A 121 1.610 -9.697 4.597 1.00 0.00 H new ATOM 0 HH11 ARG A 121 2.440 -13.004 3.682 1.00 0.00 H new ATOM 0 HH12 ARG A 121 0.993 -13.217 2.692 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -0.247 -9.978 3.323 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -0.523 -11.511 2.489 1.00 0.00 H new ATOM 1948 N LEU A 122 3.547 -9.863 -0.197 1.00 0.00 N ATOM 1949 CA LEU A 122 2.960 -9.893 -1.532 1.00 0.00 C ATOM 1950 C LEU A 122 4.040 -10.060 -2.598 1.00 0.00 C ATOM 1951 O LEU A 122 3.924 -10.903 -3.486 1.00 0.00 O ATOM 1952 CB LEU A 122 2.166 -8.612 -1.791 1.00 0.00 C ATOM 1953 CG LEU A 122 1.841 -8.308 -3.254 1.00 0.00 C ATOM 1954 CD1 LEU A 122 1.163 -9.501 -3.910 1.00 0.00 C ATOM 1955 CD2 LEU A 122 0.963 -7.069 -3.359 1.00 0.00 C ATOM 0 H LEU A 122 3.166 -9.141 0.415 1.00 0.00 H new ATOM 0 HA LEU A 122 2.286 -10.748 -1.586 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.230 -8.670 -1.236 1.00 0.00 H new ATOM 0 HB3 LEU A 122 2.727 -7.772 -1.382 1.00 0.00 H new ATOM 0 HG LEU A 122 2.775 -8.113 -3.780 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.939 -9.266 -4.951 1.00 0.00 H new ATOM 0 HD12 LEU A 122 1.826 -10.365 -3.868 1.00 0.00 H new ATOM 0 HD13 LEU A 122 0.237 -9.729 -3.382 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.742 -6.868 -4.407 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.032 -7.236 -2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.486 -6.215 -2.928 1.00 0.00 H new ATOM 1967 N SER A 123 5.090 -9.251 -2.500 1.00 0.00 N ATOM 1968 CA SER A 123 6.189 -9.307 -3.456 1.00 0.00 C ATOM 1969 C SER A 123 6.552 -10.753 -3.782 1.00 0.00 C ATOM 1970 O SER A 123 6.885 -11.079 -4.921 1.00 0.00 O ATOM 1971 CB SER A 123 7.413 -8.574 -2.902 1.00 0.00 C ATOM 1972 OG SER A 123 8.228 -9.447 -2.140 1.00 0.00 O ATOM 0 H SER A 123 5.203 -8.549 -1.768 1.00 0.00 H new ATOM 0 HA SER A 123 5.865 -8.816 -4.374 1.00 0.00 H new ATOM 0 HB2 SER A 123 7.993 -8.155 -3.724 1.00 0.00 H new ATOM 0 HB3 SER A 123 7.090 -7.738 -2.281 1.00 0.00 H new ATOM 0 HG SER A 123 7.941 -9.429 -1.203 1.00 0.00 H new ATOM 1978 N ARG A 124 6.487 -11.614 -2.772 1.00 0.00 N ATOM 1979 CA ARG A 124 6.809 -13.025 -2.949 1.00 0.00 C ATOM 1980 C ARG A 124 5.956 -13.644 -4.053 1.00 0.00 C ATOM 1981 O ARG A 124 6.457 -14.385 -4.899 1.00 0.00 O ATOM 1982 CB ARG A 124 6.599 -13.787 -1.640 1.00 0.00 C ATOM 1983 CG ARG A 124 5.191 -14.336 -1.474 1.00 0.00 C ATOM 1984 CD ARG A 124 5.017 -15.024 -0.129 1.00 0.00 C ATOM 1985 NE ARG A 124 3.610 -15.256 0.189 1.00 0.00 N ATOM 1986 CZ ARG A 124 3.194 -16.178 1.050 1.00 0.00 C ATOM 1987 NH1 ARG A 124 4.071 -16.950 1.675 1.00 0.00 N ATOM 1988 NH2 ARG A 124 1.897 -16.328 1.286 1.00 0.00 N ATOM 0 H ARG A 124 6.214 -11.359 -1.823 1.00 0.00 H new ATOM 0 HA ARG A 124 7.857 -13.098 -3.239 1.00 0.00 H new ATOM 0 HB2 ARG A 124 7.310 -14.612 -1.592 1.00 0.00 H new ATOM 0 HB3 ARG A 124 6.822 -13.124 -0.804 1.00 0.00 H new ATOM 0 HG2 ARG A 124 4.470 -13.524 -1.565 1.00 0.00 H new ATOM 0 HG3 ARG A 124 4.978 -15.043 -2.276 1.00 0.00 H new ATOM 0 HD2 ARG A 124 5.549 -15.976 -0.137 1.00 0.00 H new ATOM 0 HD3 ARG A 124 5.469 -14.413 0.652 1.00 0.00 H new ATOM 0 HE ARG A 124 2.909 -14.679 -0.275 1.00 0.00 H new ATOM 0 HH11 ARG A 124 5.069 -16.837 1.496 1.00 0.00 H new ATOM 0 HH12 ARG A 124 3.748 -17.657 2.336 1.00 0.00 H new ATOM 0 HH21 ARG A 124 1.219 -15.735 0.806 1.00 0.00 H new ATOM 0 HH22 ARG A 124 1.577 -17.036 1.947 1.00 0.00 H new ATOM 2002 N THR A 125 4.663 -13.335 -4.037 1.00 0.00 N ATOM 2003 CA THR A 125 3.739 -13.861 -5.034 1.00 0.00 C ATOM 2004 C THR A 125 4.407 -13.968 -6.400 1.00 0.00 C ATOM 2005 O THR A 125 5.261 -13.160 -6.765 1.00 0.00 O ATOM 2006 CB THR A 125 2.483 -12.978 -5.157 1.00 0.00 C ATOM 2007 OG1 THR A 125 2.851 -11.657 -5.569 1.00 0.00 O ATOM 2008 CG2 THR A 125 1.735 -12.912 -3.834 1.00 0.00 C ATOM 0 H THR A 125 4.232 -12.723 -3.344 1.00 0.00 H new ATOM 0 HA THR A 125 3.444 -14.855 -4.698 1.00 0.00 H new ATOM 0 HB THR A 125 1.826 -13.422 -5.905 1.00 0.00 H new ATOM 0 HG1 THR A 125 3.583 -11.330 -5.005 1.00 0.00 H new ATOM 0 HG21 THR A 125 0.852 -12.283 -3.946 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.430 -13.916 -3.538 1.00 0.00 H new ATOM 0 HG23 THR A 125 2.386 -12.490 -3.068 1.00 0.00 H new ATOM 2016 N PRO A 126 4.011 -14.989 -7.175 1.00 0.00 N ATOM 2017 CA PRO A 126 4.558 -15.225 -8.514 1.00 0.00 C ATOM 2018 C PRO A 126 4.116 -14.164 -9.516 1.00 0.00 C ATOM 2019 O PRO A 126 4.457 -14.233 -10.697 1.00 0.00 O ATOM 2020 CB PRO A 126 3.985 -16.593 -8.895 1.00 0.00 C ATOM 2021 CG PRO A 126 2.735 -16.716 -8.094 1.00 0.00 C ATOM 2022 CD PRO A 126 2.997 -15.991 -6.803 1.00 0.00 C ATOM 0 HA PRO A 126 5.647 -15.187 -8.522 1.00 0.00 H new ATOM 0 HB2 PRO A 126 3.778 -16.652 -9.964 1.00 0.00 H new ATOM 0 HB3 PRO A 126 4.686 -17.395 -8.661 1.00 0.00 H new ATOM 0 HG2 PRO A 126 1.888 -16.278 -8.623 1.00 0.00 H new ATOM 0 HG3 PRO A 126 2.490 -17.762 -7.911 1.00 0.00 H new ATOM 0 HD2 PRO A 126 2.093 -15.523 -6.414 1.00 0.00 H new ATOM 0 HD3 PRO A 126 3.364 -16.666 -6.030 1.00 0.00 H new ATOM 2030 N ILE A 127 3.357 -13.185 -9.037 1.00 0.00 N ATOM 2031 CA ILE A 127 2.870 -12.109 -9.892 1.00 0.00 C ATOM 2032 C ILE A 127 3.719 -10.852 -9.731 1.00 0.00 C ATOM 2033 O ILE A 127 3.899 -10.087 -10.678 1.00 0.00 O ATOM 2034 CB ILE A 127 1.401 -11.765 -9.583 1.00 0.00 C ATOM 2035 CG1 ILE A 127 0.520 -13.006 -9.739 1.00 0.00 C ATOM 2036 CG2 ILE A 127 0.916 -10.646 -10.493 1.00 0.00 C ATOM 2037 CD1 ILE A 127 0.397 -13.823 -8.473 1.00 0.00 C ATOM 0 H ILE A 127 3.066 -13.114 -8.062 1.00 0.00 H new ATOM 0 HA ILE A 127 2.943 -12.465 -10.920 1.00 0.00 H new ATOM 0 HB ILE A 127 1.333 -11.422 -8.551 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.475 -12.697 -10.060 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.929 -13.635 -10.529 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.124 -10.414 -10.262 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.529 -9.758 -10.336 1.00 0.00 H new ATOM 0 HG23 ILE A 127 0.995 -10.963 -11.533 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.242 -14.687 -8.658 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.385 -14.162 -8.162 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.041 -13.210 -7.685 1.00 0.00 H new ATOM 2049 N ALA A 128 4.241 -10.647 -8.526 1.00 0.00 N ATOM 2050 CA ALA A 128 5.075 -9.486 -8.242 1.00 0.00 C ATOM 2051 C ALA A 128 6.498 -9.695 -8.749 1.00 0.00 C ATOM 2052 O ALA A 128 7.108 -8.784 -9.310 1.00 0.00 O ATOM 2053 CB ALA A 128 5.082 -9.194 -6.749 1.00 0.00 C ATOM 0 H ALA A 128 4.101 -11.270 -7.731 1.00 0.00 H new ATOM 0 HA ALA A 128 4.653 -8.629 -8.767 1.00 0.00 H new ATOM 0 HB1 ALA A 128 5.709 -8.324 -6.551 1.00 0.00 H new ATOM 0 HB2 ALA A 128 4.065 -8.992 -6.413 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.477 -10.056 -6.212 1.00 0.00 H new ATOM 2059 N LEU A 129 7.022 -10.899 -8.548 1.00 0.00 N ATOM 2060 CA LEU A 129 8.375 -11.227 -8.984 1.00 0.00 C ATOM 2061 C LEU A 129 8.455 -11.292 -10.506 1.00 0.00 C ATOM 2062 O LEU A 129 9.431 -10.841 -11.106 1.00 0.00 O ATOM 2063 CB LEU A 129 8.816 -12.562 -8.382 1.00 0.00 C ATOM 2064 CG LEU A 129 8.578 -12.732 -6.881 1.00 0.00 C ATOM 2065 CD1 LEU A 129 8.980 -14.128 -6.432 1.00 0.00 C ATOM 2066 CD2 LEU A 129 9.342 -11.676 -6.096 1.00 0.00 C ATOM 0 H LEU A 129 6.531 -11.664 -8.086 1.00 0.00 H new ATOM 0 HA LEU A 129 9.044 -10.440 -8.636 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.295 -13.364 -8.905 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.880 -12.692 -8.578 1.00 0.00 H new ATOM 0 HG LEU A 129 7.514 -12.602 -6.684 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.804 -14.231 -5.361 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.387 -14.868 -6.970 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.038 -14.287 -6.643 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.160 -11.813 -5.030 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.409 -11.773 -6.298 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.005 -10.684 -6.397 1.00 0.00 H new ATOM 2078 N ALA A 130 7.422 -11.853 -11.125 1.00 0.00 N ATOM 2079 CA ALA A 130 7.374 -11.973 -12.577 1.00 0.00 C ATOM 2080 C ALA A 130 7.855 -10.692 -13.249 1.00 0.00 C ATOM 2081 O ALA A 130 8.687 -10.728 -14.156 1.00 0.00 O ATOM 2082 CB ALA A 130 5.962 -12.312 -13.032 1.00 0.00 C ATOM 0 H ALA A 130 6.607 -12.232 -10.643 1.00 0.00 H new ATOM 0 HA ALA A 130 8.043 -12.781 -12.873 1.00 0.00 H new ATOM 0 HB1 ALA A 130 5.941 -12.399 -14.118 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.653 -13.258 -12.586 1.00 0.00 H new ATOM 0 HB3 ALA A 130 5.279 -11.523 -12.718 1.00 0.00 H new ATOM 2088 N THR A 131 7.325 -9.558 -12.800 1.00 0.00 N ATOM 2089 CA THR A 131 7.699 -8.265 -13.360 1.00 0.00 C ATOM 2090 C THR A 131 9.204 -8.041 -13.269 1.00 0.00 C ATOM 2091 O THR A 131 9.798 -7.396 -14.132 1.00 0.00 O ATOM 2092 CB THR A 131 6.975 -7.111 -12.640 1.00 0.00 C ATOM 2093 OG1 THR A 131 7.453 -6.996 -11.296 1.00 0.00 O ATOM 2094 CG2 THR A 131 5.471 -7.337 -12.632 1.00 0.00 C ATOM 0 H THR A 131 6.635 -9.509 -12.050 1.00 0.00 H new ATOM 0 HA THR A 131 7.399 -8.275 -14.408 1.00 0.00 H new ATOM 0 HB THR A 131 7.184 -6.187 -13.179 1.00 0.00 H new ATOM 0 HG1 THR A 131 7.283 -7.833 -10.816 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.981 -6.510 -12.118 1.00 0.00 H new ATOM 0 HG22 THR A 131 5.106 -7.394 -13.658 1.00 0.00 H new ATOM 0 HG23 THR A 131 5.246 -8.269 -12.114 1.00 0.00 H new ATOM 2102 N GLY A 132 9.816 -8.580 -12.219 1.00 0.00 N ATOM 2103 CA GLY A 132 11.247 -8.428 -12.036 1.00 0.00 C ATOM 2104 C GLY A 132 11.601 -7.192 -11.233 1.00 0.00 C ATOM 2105 O GLY A 132 12.720 -6.687 -11.321 1.00 0.00 O ATOM 0 H GLY A 132 9.346 -9.119 -11.492 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.641 -9.310 -11.532 1.00 0.00 H new ATOM 0 HA3 GLY A 132 11.731 -8.375 -13.011 1.00 0.00 H new ATOM 2109 N ILE A 133 10.645 -6.704 -10.450 1.00 0.00 N ATOM 2110 CA ILE A 133 10.862 -5.519 -9.629 1.00 0.00 C ATOM 2111 C ILE A 133 11.586 -5.872 -8.335 1.00 0.00 C ATOM 2112 O ILE A 133 11.249 -6.851 -7.670 1.00 0.00 O ATOM 2113 CB ILE A 133 9.533 -4.820 -9.286 1.00 0.00 C ATOM 2114 CG1 ILE A 133 8.804 -4.407 -10.567 1.00 0.00 C ATOM 2115 CG2 ILE A 133 9.784 -3.610 -8.399 1.00 0.00 C ATOM 2116 CD1 ILE A 133 7.320 -4.185 -10.372 1.00 0.00 C ATOM 0 H ILE A 133 9.713 -7.110 -10.367 1.00 0.00 H new ATOM 0 HA ILE A 133 11.480 -4.839 -10.215 1.00 0.00 H new ATOM 0 HB ILE A 133 8.901 -5.521 -8.740 1.00 0.00 H new ATOM 0 HG12 ILE A 133 9.253 -3.491 -10.952 1.00 0.00 H new ATOM 0 HG13 ILE A 133 8.952 -5.177 -11.324 1.00 0.00 H new ATOM 0 HG21 ILE A 133 8.835 -3.127 -8.165 1.00 0.00 H new ATOM 0 HG22 ILE A 133 10.265 -3.930 -7.475 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.432 -2.905 -8.920 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.868 -3.895 -11.320 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.858 -5.106 -10.016 1.00 0.00 H new ATOM 0 HD13 ILE A 133 7.164 -3.394 -9.639 1.00 0.00 H new ATOM 2128 N ARG A 134 12.583 -5.067 -7.982 1.00 0.00 N ATOM 2129 CA ARG A 134 13.355 -5.294 -6.766 1.00 0.00 C ATOM 2130 C ARG A 134 12.482 -5.905 -5.674 1.00 0.00 C ATOM 2131 O ARG A 134 11.776 -5.206 -4.947 1.00 0.00 O ATOM 2132 CB ARG A 134 13.965 -3.981 -6.272 1.00 0.00 C ATOM 2133 CG ARG A 134 15.166 -3.523 -7.083 1.00 0.00 C ATOM 2134 CD ARG A 134 16.432 -4.255 -6.666 1.00 0.00 C ATOM 2135 NE ARG A 134 17.087 -3.613 -5.530 1.00 0.00 N ATOM 2136 CZ ARG A 134 17.621 -2.397 -5.581 1.00 0.00 C ATOM 2137 NH1 ARG A 134 17.578 -1.697 -6.706 1.00 0.00 N ATOM 2138 NH2 ARG A 134 18.200 -1.880 -4.504 1.00 0.00 N ATOM 0 H ARG A 134 12.875 -4.252 -8.521 1.00 0.00 H new ATOM 0 HA ARG A 134 14.157 -5.994 -7.000 1.00 0.00 H new ATOM 0 HB2 ARG A 134 13.202 -3.203 -6.298 1.00 0.00 H new ATOM 0 HB3 ARG A 134 14.264 -4.099 -5.231 1.00 0.00 H new ATOM 0 HG2 ARG A 134 14.978 -3.695 -8.143 1.00 0.00 H new ATOM 0 HG3 ARG A 134 15.306 -2.450 -6.954 1.00 0.00 H new ATOM 0 HD2 ARG A 134 16.187 -5.285 -6.408 1.00 0.00 H new ATOM 0 HD3 ARG A 134 17.123 -4.293 -7.508 1.00 0.00 H new ATOM 0 HE ARG A 134 17.138 -4.125 -4.650 1.00 0.00 H new ATOM 0 HH11 ARG A 134 17.134 -2.091 -7.535 1.00 0.00 H new ATOM 0 HH12 ARG A 134 17.989 -0.764 -6.742 1.00 0.00 H new ATOM 0 HH21 ARG A 134 18.235 -2.416 -3.637 1.00 0.00 H new ATOM 0 HH22 ARG A 134 18.610 -0.947 -4.544 1.00 0.00 H new ATOM 2152 N PRO A 135 12.530 -7.240 -5.556 1.00 0.00 N ATOM 2153 CA PRO A 135 11.751 -7.974 -4.555 1.00 0.00 C ATOM 2154 C PRO A 135 12.253 -7.732 -3.136 1.00 0.00 C ATOM 2155 O PRO A 135 13.371 -7.256 -2.936 1.00 0.00 O ATOM 2156 CB PRO A 135 11.954 -9.439 -4.952 1.00 0.00 C ATOM 2157 CG PRO A 135 13.254 -9.457 -5.679 1.00 0.00 C ATOM 2158 CD PRO A 135 13.350 -8.135 -6.389 1.00 0.00 C ATOM 0 HA PRO A 135 10.707 -7.662 -4.543 1.00 0.00 H new ATOM 0 HB2 PRO A 135 11.981 -10.087 -4.076 1.00 0.00 H new ATOM 0 HB3 PRO A 135 11.141 -9.794 -5.585 1.00 0.00 H new ATOM 0 HG2 PRO A 135 14.086 -9.590 -4.987 1.00 0.00 H new ATOM 0 HG3 PRO A 135 13.293 -10.284 -6.388 1.00 0.00 H new ATOM 0 HD2 PRO A 135 14.381 -7.789 -6.456 1.00 0.00 H new ATOM 0 HD3 PRO A 135 12.968 -8.197 -7.408 1.00 0.00 H new ATOM 2166 N PHE A 136 11.422 -8.064 -2.154 1.00 0.00 N ATOM 2167 CA PHE A 136 11.782 -7.882 -0.753 1.00 0.00 C ATOM 2168 C PHE A 136 12.842 -8.894 -0.328 1.00 0.00 C ATOM 2169 O PHE A 136 13.020 -9.942 -0.950 1.00 0.00 O ATOM 2170 CB PHE A 136 10.545 -8.018 0.136 1.00 0.00 C ATOM 2171 CG PHE A 136 9.788 -6.733 0.312 1.00 0.00 C ATOM 2172 CD1 PHE A 136 9.096 -6.170 -0.748 1.00 0.00 C ATOM 2173 CD2 PHE A 136 9.770 -6.086 1.538 1.00 0.00 C ATOM 2174 CE1 PHE A 136 8.398 -4.987 -0.590 1.00 0.00 C ATOM 2175 CE2 PHE A 136 9.074 -4.903 1.702 1.00 0.00 C ATOM 2176 CZ PHE A 136 8.389 -4.353 0.637 1.00 0.00 C ATOM 0 H PHE A 136 10.494 -8.461 -2.303 1.00 0.00 H new ATOM 0 HA PHE A 136 12.195 -6.880 -0.637 1.00 0.00 H new ATOM 0 HB2 PHE A 136 9.879 -8.766 -0.294 1.00 0.00 H new ATOM 0 HB3 PHE A 136 10.850 -8.387 1.115 1.00 0.00 H new ATOM 0 HD1 PHE A 136 9.102 -6.661 -1.710 1.00 0.00 H new ATOM 0 HD2 PHE A 136 10.306 -6.511 2.374 1.00 0.00 H new ATOM 0 HE1 PHE A 136 7.861 -4.560 -1.424 1.00 0.00 H new ATOM 0 HE2 PHE A 136 9.066 -4.409 2.663 1.00 0.00 H new ATOM 0 HZ PHE A 136 7.847 -3.428 0.763 1.00 0.00 H new ATOM 2186 N PRO A 137 13.563 -8.576 0.757 1.00 0.00 N ATOM 2187 CA PRO A 137 14.617 -9.444 1.290 1.00 0.00 C ATOM 2188 C PRO A 137 14.058 -10.718 1.915 1.00 0.00 C ATOM 2189 O PRO A 137 13.340 -10.667 2.914 1.00 0.00 O ATOM 2190 CB PRO A 137 15.287 -8.574 2.357 1.00 0.00 C ATOM 2191 CG PRO A 137 14.233 -7.608 2.775 1.00 0.00 C ATOM 2192 CD PRO A 137 13.404 -7.344 1.548 1.00 0.00 C ATOM 0 HA PRO A 137 15.297 -9.785 0.510 1.00 0.00 H new ATOM 0 HB2 PRO A 137 15.630 -9.175 3.199 1.00 0.00 H new ATOM 0 HB3 PRO A 137 16.160 -8.059 1.957 1.00 0.00 H new ATOM 0 HG2 PRO A 137 13.622 -8.020 3.578 1.00 0.00 H new ATOM 0 HG3 PRO A 137 14.676 -6.686 3.153 1.00 0.00 H new ATOM 0 HD2 PRO A 137 12.360 -7.161 1.801 1.00 0.00 H new ATOM 0 HD3 PRO A 137 13.759 -6.469 1.004 1.00 0.00 H new ATOM 2200 N SER A 138 14.393 -11.858 1.321 1.00 0.00 N ATOM 2201 CA SER A 138 13.921 -13.146 1.817 1.00 0.00 C ATOM 2202 C SER A 138 14.847 -13.680 2.906 1.00 0.00 C ATOM 2203 O SER A 138 16.061 -13.757 2.722 1.00 0.00 O ATOM 2204 CB SER A 138 13.828 -14.155 0.672 1.00 0.00 C ATOM 2205 OG SER A 138 12.899 -13.728 -0.310 1.00 0.00 O ATOM 0 H SER A 138 14.989 -11.917 0.496 1.00 0.00 H new ATOM 0 HA SER A 138 12.929 -13.001 2.245 1.00 0.00 H new ATOM 0 HB2 SER A 138 14.810 -14.284 0.216 1.00 0.00 H new ATOM 0 HB3 SER A 138 13.528 -15.127 1.063 1.00 0.00 H new ATOM 0 HG SER A 138 12.859 -14.389 -1.032 1.00 0.00 H new ATOM 2211 N GLY A 139 14.263 -14.049 4.043 1.00 0.00 N ATOM 2212 CA GLY A 139 15.049 -14.571 5.145 1.00 0.00 C ATOM 2213 C GLY A 139 14.622 -13.999 6.483 1.00 0.00 C ATOM 2214 O GLY A 139 14.108 -12.884 6.570 1.00 0.00 O ATOM 0 H GLY A 139 13.260 -13.995 4.220 1.00 0.00 H new ATOM 0 HA2 GLY A 139 14.956 -15.657 5.171 1.00 0.00 H new ATOM 0 HA3 GLY A 139 16.102 -14.345 4.976 1.00 0.00 H new ATOM 2218 N PRO A 140 14.835 -14.774 7.557 1.00 0.00 N ATOM 2219 CA PRO A 140 14.475 -14.360 8.916 1.00 0.00 C ATOM 2220 C PRO A 140 15.362 -13.232 9.432 1.00 0.00 C ATOM 2221 O PRO A 140 14.940 -12.428 10.263 1.00 0.00 O ATOM 2222 CB PRO A 140 14.690 -15.630 9.743 1.00 0.00 C ATOM 2223 CG PRO A 140 15.700 -16.414 8.978 1.00 0.00 C ATOM 2224 CD PRO A 140 15.444 -16.115 7.527 1.00 0.00 C ATOM 0 HA PRO A 140 13.459 -13.969 8.967 1.00 0.00 H new ATOM 0 HB2 PRO A 140 15.048 -15.394 10.745 1.00 0.00 H new ATOM 0 HB3 PRO A 140 13.761 -16.188 9.860 1.00 0.00 H new ATOM 0 HG2 PRO A 140 16.713 -16.128 9.262 1.00 0.00 H new ATOM 0 HG3 PRO A 140 15.601 -17.481 9.180 1.00 0.00 H new ATOM 0 HD2 PRO A 140 16.366 -16.125 6.946 1.00 0.00 H new ATOM 0 HD3 PRO A 140 14.776 -16.850 7.077 1.00 0.00 H new ATOM 2232 N SER A 141 16.594 -13.179 8.935 1.00 0.00 N ATOM 2233 CA SER A 141 17.542 -12.151 9.349 1.00 0.00 C ATOM 2234 C SER A 141 16.907 -10.766 9.275 1.00 0.00 C ATOM 2235 O SER A 141 16.305 -10.399 8.266 1.00 0.00 O ATOM 2236 CB SER A 141 18.793 -12.199 8.470 1.00 0.00 C ATOM 2237 OG SER A 141 19.602 -11.053 8.673 1.00 0.00 O ATOM 0 H SER A 141 16.959 -13.836 8.245 1.00 0.00 H new ATOM 0 HA SER A 141 17.825 -12.347 10.383 1.00 0.00 H new ATOM 0 HB2 SER A 141 19.366 -13.098 8.697 1.00 0.00 H new ATOM 0 HB3 SER A 141 18.503 -12.262 7.421 1.00 0.00 H new ATOM 0 HG SER A 141 20.396 -11.108 8.101 1.00 0.00 H new ATOM 2243 N SER A 142 17.047 -10.000 10.353 1.00 0.00 N ATOM 2244 CA SER A 142 16.484 -8.656 10.414 1.00 0.00 C ATOM 2245 C SER A 142 17.455 -7.634 9.830 1.00 0.00 C ATOM 2246 O SER A 142 18.562 -7.454 10.335 1.00 0.00 O ATOM 2247 CB SER A 142 16.146 -8.287 11.859 1.00 0.00 C ATOM 2248 OG SER A 142 17.320 -8.011 12.603 1.00 0.00 O ATOM 0 H SER A 142 17.545 -10.287 11.195 1.00 0.00 H new ATOM 0 HA SER A 142 15.570 -8.644 9.820 1.00 0.00 H new ATOM 0 HB2 SER A 142 15.491 -7.416 11.871 1.00 0.00 H new ATOM 0 HB3 SER A 142 15.598 -9.105 12.328 1.00 0.00 H new ATOM 0 HG SER A 142 18.084 -7.939 11.994 1.00 0.00 H new ATOM 2254 N GLY A 143 17.030 -6.967 8.761 1.00 0.00 N ATOM 2255 CA GLY A 143 17.873 -5.971 8.125 1.00 0.00 C ATOM 2256 C GLY A 143 17.954 -6.155 6.622 1.00 0.00 C ATOM 2257 O GLY A 143 18.344 -7.218 6.140 1.00 0.00 O ATOM 0 H GLY A 143 16.118 -7.098 8.324 1.00 0.00 H new ATOM 0 HA2 GLY A 143 17.485 -4.977 8.346 1.00 0.00 H new ATOM 0 HA3 GLY A 143 18.876 -6.024 8.549 1.00 0.00 H new TER 2261 GLY A 143