USER MOD reduce.3.24.130724 H: found=0, std=0, add=1118, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1129 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 63 THR OG1 : rot 98:sc= 0.964 USER MOD Set 1.2: A 151 LYS NZ :NH3+ 161:sc= 0.0379 (180deg=0.00469) USER MOD Set 2.1: A 130 THR OG1 : rot 180:sc= 0.997 USER MOD Set 2.2: A 134 TYR OH : rot -21:sc= 1.1 USER MOD Set 3.1: A 78 ASN : amide:sc= -1.29 K(o=-0.69,f=-4.2!) USER MOD Set 3.2: A 112 SER OG : rot 120:sc= 0.597 USER MOD Set 4.1: A 80 ASN : amide:sc= 0.623 K(o=-0.73,f=-4.6!) USER MOD Set 4.2: A 85 HIS : no HE2:sc= -1.38 K(o=-0.73,f=-6!) USER MOD Set 4.3: A 138 CYS SG : rot -137:sc= 0.222 USER MOD Set 4.4: A 143 HIS : no HD1:sc= 0.00799 K(o=-0.73,f=-2.7) USER MOD Set 4.5: A 148 MET CE :methyl 159:sc= -0.198 (180deg=-0.793) USER MOD Set 5.1: A 71 THR OG1 : rot -74:sc= 1.29 USER MOD Set 5.2: A 128 HIS : no HE2:sc= 1.02 K(o=2.3,f=-4.9!) USER MOD Set 6.1: A 39 HIS : +bothHN:sc= 1.14 K(o=2.9,f=-7.6!) USER MOD Set 6.2: A 75 THR OG1 : rot -76:sc= 1.74 USER MOD Set 7.1: A 27 SER OG : rot 172:sc= 0.582 USER MOD Set 7.2: A 32 THR OG1 : rot -115:sc= 2.01 USER MOD Set 8.1: A 25 LYS NZ :NH3+ 148:sc= 0.793 (180deg=0) USER MOD Set 8.2: A 34 SER OG : rot -110:sc= 0.601 USER MOD Set 9.1: A 11 THR OG1 : rot -61:sc= 1.03 USER MOD Set 9.2: A 14 GLN : amide:sc= 0.463 K(o=1.5,f=0.00077) USER MOD Single : A 5 THR OG1 : rot -32:sc= 0.15 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0786) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 173:sc= -0.129 (180deg=-0.244) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 157:sc= 1.43 USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.0686 USER MOD Single : A 33 TYR OH : rot 66:sc= 1.18 USER MOD Single : A 36 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0407) USER MOD Single : A 37 THR OG1 : rot 66:sc= 1.06 USER MOD Single : A 53 SER OG : rot 54:sc= 1.1 USER MOD Single : A 57 HIS : no HE2:sc= -1.85 X(o=-1.8,f=-1.9) USER MOD Single : A 59 LYS NZ :NH3+ -140:sc= 0.753 (180deg=-0.00296) USER MOD Single : A 60 LYS NZ :NH3+ -119:sc= -0.0659 (180deg=-1.05) USER MOD Single : A 61 ASN : amide:sc= 0.29 K(o=0.29,f=-7.4!) USER MOD Single : A 79 THR OG1 : rot 20:sc= -0.717 USER MOD Single : A 81 LYS NZ :NH3+ 161:sc= 1.65 (180deg=1.27) USER MOD Single : A 86 SER OG : rot 113:sc= 1.79 USER MOD Single : A 90 THR OG1 : rot 109:sc= 1.49 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -103:sc= 0.0554 (180deg=-0.586) USER MOD Single : A 96 TYR OH : rot -2:sc= 1.22 USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot -155:sc= 0.912 USER MOD Single : A 116 LYS NZ :NH3+ -174:sc=-0.00246 (180deg=-0.112) USER MOD Single : A 119 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0307) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 124:sc= 1.57 USER MOD Single : A 126 THR OG1 : rot -84:sc= 0.976 USER MOD Single : A 133 THR OG1 : rot 180:sc= -0.24 USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 TYR OH : rot 28:sc= 1.22 USER MOD Single : A 139 GLN : amide:sc= -0.058 K(o=-0.058,f=-0.96) USER MOD Single : A 146 THR OG1 : rot -76:sc= 0.696 USER MOD Single : A 155 LYS NZ :NH3+ -138:sc= -0.012 (180deg=-0.296) USER MOD ----------------------------------------------------------------- ATOM 54 N THR A 5 -4.242 -4.022 12.227 1.00 0.00 N ATOM 55 CA THR A 5 -5.663 -4.000 11.928 1.00 0.00 C ATOM 56 C THR A 5 -6.222 -2.607 12.224 1.00 0.00 C ATOM 57 O THR A 5 -7.331 -2.486 12.743 1.00 0.00 O ATOM 58 CB THR A 5 -6.359 -5.088 12.759 1.00 0.00 C ATOM 59 OG1 THR A 5 -6.113 -4.861 14.133 1.00 0.00 O ATOM 60 CG2 THR A 5 -5.849 -6.485 12.389 1.00 0.00 C ATOM 0 HA THR A 5 -5.842 -4.210 10.873 1.00 0.00 H new ATOM 0 HB THR A 5 -7.427 -5.041 12.549 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.231 -4.449 14.244 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.362 -7.232 12.995 1.00 0.00 H new ATOM 0 HG22 THR A 5 -6.046 -6.677 11.334 1.00 0.00 H new ATOM 0 HG23 THR A 5 -4.776 -6.542 12.574 1.00 0.00 H new ATOM 68 N THR A 6 -5.472 -1.545 11.911 1.00 0.00 N ATOM 69 CA THR A 6 -5.907 -0.173 12.144 1.00 0.00 C ATOM 70 C THR A 6 -6.862 0.233 11.019 1.00 0.00 C ATOM 71 O THR A 6 -6.588 1.165 10.267 1.00 0.00 O ATOM 72 CB THR A 6 -4.678 0.751 12.281 1.00 0.00 C ATOM 73 OG1 THR A 6 -3.755 0.164 13.180 1.00 0.00 O ATOM 74 CG2 THR A 6 -5.114 2.101 12.854 1.00 0.00 C ATOM 0 H THR A 6 -4.546 -1.618 11.489 1.00 0.00 H new ATOM 0 HA THR A 6 -6.455 -0.083 13.082 1.00 0.00 H new ATOM 0 HB THR A 6 -4.221 0.890 11.301 1.00 0.00 H new ATOM 0 HG1 THR A 6 -2.971 0.745 13.270 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.246 2.753 12.950 1.00 0.00 H new ATOM 0 HG22 THR A 6 -5.841 2.562 12.186 1.00 0.00 H new ATOM 0 HG23 THR A 6 -5.566 1.951 13.835 1.00 0.00 H new ATOM 82 N TRP A 7 -7.969 -0.500 10.896 1.00 0.00 N ATOM 83 CA TRP A 7 -8.956 -0.390 9.829 1.00 0.00 C ATOM 84 C TRP A 7 -10.167 0.421 10.277 1.00 0.00 C ATOM 85 O TRP A 7 -10.721 0.164 11.344 1.00 0.00 O ATOM 86 CB TRP A 7 -9.416 -1.790 9.389 1.00 0.00 C ATOM 87 CG TRP A 7 -8.435 -2.579 8.576 1.00 0.00 C ATOM 88 CD1 TRP A 7 -7.859 -3.749 8.934 1.00 0.00 C ATOM 89 CD2 TRP A 7 -7.926 -2.279 7.241 1.00 0.00 C ATOM 90 NE1 TRP A 7 -6.994 -4.160 7.941 1.00 0.00 N ATOM 91 CE2 TRP A 7 -6.965 -3.272 6.892 1.00 0.00 C ATOM 92 CE3 TRP A 7 -8.168 -1.260 6.292 1.00 0.00 C ATOM 93 CZ2 TRP A 7 -6.278 -3.258 5.671 1.00 0.00 C ATOM 94 CZ3 TRP A 7 -7.380 -1.162 5.133 1.00 0.00 C ATOM 95 CH2 TRP A 7 -6.498 -2.196 4.785 1.00 0.00 C ATOM 0 H TRP A 7 -8.211 -1.222 11.574 1.00 0.00 H new ATOM 0 HA TRP A 7 -8.485 0.124 8.991 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -9.665 -2.366 10.280 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -10.334 -1.684 8.811 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -8.047 -4.280 9.855 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -6.443 -5.018 7.980 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -8.965 -0.551 6.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -5.591 -4.052 5.418 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -7.454 -0.286 4.506 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -5.988 -2.173 3.833 1.00 0.00 H new ATOM 106 N LYS A 8 -10.577 1.381 9.447 1.00 0.00 N ATOM 107 CA LYS A 8 -11.789 2.177 9.596 1.00 0.00 C ATOM 108 C LYS A 8 -12.306 2.421 8.173 1.00 0.00 C ATOM 109 O LYS A 8 -11.777 1.824 7.235 1.00 0.00 O ATOM 110 CB LYS A 8 -11.467 3.509 10.301 1.00 0.00 C ATOM 111 CG LYS A 8 -10.837 3.386 11.697 1.00 0.00 C ATOM 112 CD LYS A 8 -11.822 2.839 12.741 1.00 0.00 C ATOM 113 CE LYS A 8 -11.119 2.555 14.075 1.00 0.00 C ATOM 114 NZ LYS A 8 -10.506 3.766 14.651 1.00 0.00 N ATOM 0 H LYS A 8 -10.045 1.634 8.614 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.537 1.669 10.205 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -10.791 4.081 9.666 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -12.388 4.086 10.387 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -9.968 2.730 11.643 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -10.479 4.364 12.018 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -12.626 3.558 12.897 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -12.281 1.924 12.367 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -11.839 2.143 14.782 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -10.350 1.797 13.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -10.117 3.545 15.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.742 4.098 14.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -11.227 4.510 14.741 1.00 0.00 H new ATOM 128 N GLU A 9 -13.314 3.284 7.982 1.00 0.00 N ATOM 129 CA GLU A 9 -13.746 3.689 6.648 1.00 0.00 C ATOM 130 C GLU A 9 -13.985 5.197 6.609 1.00 0.00 C ATOM 131 O GLU A 9 -14.656 5.737 7.484 1.00 0.00 O ATOM 132 CB GLU A 9 -14.992 2.943 6.146 1.00 0.00 C ATOM 133 CG GLU A 9 -15.038 1.460 6.564 1.00 0.00 C ATOM 134 CD GLU A 9 -16.029 0.635 5.755 1.00 0.00 C ATOM 135 OE1 GLU A 9 -16.877 1.187 5.061 1.00 0.00 O ATOM 136 OE2 GLU A 9 -15.888 -0.713 5.857 1.00 0.00 O ATOM 0 H GLU A 9 -13.843 3.713 8.741 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.936 3.418 5.970 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -15.882 3.446 6.524 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -15.028 3.006 5.058 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -14.043 1.028 6.455 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -15.300 1.396 7.620 1.00 0.00 H new ATOM 144 N ALA A 10 -13.404 5.859 5.609 1.00 0.00 N ATOM 145 CA ALA A 10 -13.651 7.249 5.277 1.00 0.00 C ATOM 146 C ALA A 10 -14.821 7.238 4.281 1.00 0.00 C ATOM 147 O ALA A 10 -15.569 6.261 4.224 1.00 0.00 O ATOM 148 CB ALA A 10 -12.368 7.842 4.678 1.00 0.00 C ATOM 0 H ALA A 10 -12.724 5.419 4.989 1.00 0.00 H new ATOM 0 HA ALA A 10 -13.911 7.865 6.138 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -12.536 8.888 4.422 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -11.560 7.772 5.406 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -12.096 7.288 3.780 1.00 0.00 H new ATOM 154 N THR A 11 -14.968 8.274 3.454 1.00 0.00 N ATOM 155 CA THR A 11 -15.972 8.324 2.400 1.00 0.00 C ATOM 156 C THR A 11 -15.359 8.945 1.139 1.00 0.00 C ATOM 157 O THR A 11 -14.278 9.528 1.211 1.00 0.00 O ATOM 158 CB THR A 11 -17.211 9.082 2.893 1.00 0.00 C ATOM 159 OG1 THR A 11 -16.856 10.409 3.220 1.00 0.00 O ATOM 160 CG2 THR A 11 -17.858 8.444 4.127 1.00 0.00 C ATOM 0 H THR A 11 -14.385 9.109 3.501 1.00 0.00 H new ATOM 0 HA THR A 11 -16.299 7.317 2.141 1.00 0.00 H new ATOM 0 HB THR A 11 -17.935 9.049 2.079 1.00 0.00 H new ATOM 0 HG1 THR A 11 -16.187 10.402 3.936 1.00 0.00 H new ATOM 0 HG21 THR A 11 -18.729 9.028 4.425 1.00 0.00 H new ATOM 0 HG22 THR A 11 -18.168 7.426 3.890 1.00 0.00 H new ATOM 0 HG23 THR A 11 -17.138 8.423 4.945 1.00 0.00 H new ATOM 168 N LEU A 12 -16.035 8.830 -0.011 1.00 0.00 N ATOM 169 CA LEU A 12 -15.498 9.242 -1.312 1.00 0.00 C ATOM 170 C LEU A 12 -14.680 10.546 -1.311 1.00 0.00 C ATOM 171 O LEU A 12 -13.530 10.517 -1.754 1.00 0.00 O ATOM 172 CB LEU A 12 -16.593 9.223 -2.390 1.00 0.00 C ATOM 173 CG LEU A 12 -16.029 9.390 -3.813 1.00 0.00 C ATOM 174 CD1 LEU A 12 -16.767 8.459 -4.781 1.00 0.00 C ATOM 175 CD2 LEU A 12 -16.172 10.835 -4.311 1.00 0.00 C ATOM 0 H LEU A 12 -16.978 8.445 -0.064 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.753 8.488 -1.566 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -17.141 8.283 -2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -17.307 10.022 -2.191 1.00 0.00 H new ATOM 0 HG LEU A 12 -14.970 9.136 -3.777 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -16.362 8.583 -5.785 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -16.636 7.425 -4.462 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -17.829 8.706 -4.785 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -15.763 10.915 -5.318 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -17.226 11.113 -4.324 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -15.628 11.505 -3.645 1.00 0.00 H new ATOM 187 N PRO A 13 -15.201 11.689 -0.827 1.00 0.00 N ATOM 188 CA PRO A 13 -14.452 12.940 -0.871 1.00 0.00 C ATOM 189 C PRO A 13 -13.122 12.832 -0.120 1.00 0.00 C ATOM 190 O PRO A 13 -12.124 13.446 -0.493 1.00 0.00 O ATOM 191 CB PRO A 13 -15.360 13.998 -0.229 1.00 0.00 C ATOM 192 CG PRO A 13 -16.759 13.395 -0.344 1.00 0.00 C ATOM 193 CD PRO A 13 -16.485 11.902 -0.178 1.00 0.00 C ATOM 0 HA PRO A 13 -14.194 13.201 -1.897 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -15.088 14.182 0.810 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -15.292 14.953 -0.750 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -17.430 13.774 0.427 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -17.221 13.619 -1.306 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -16.449 11.621 0.874 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -17.268 11.302 -0.642 1.00 0.00 H new ATOM 201 N GLN A 14 -13.109 12.038 0.953 1.00 0.00 N ATOM 202 CA GLN A 14 -11.938 11.864 1.784 1.00 0.00 C ATOM 203 C GLN A 14 -10.821 11.188 0.996 1.00 0.00 C ATOM 204 O GLN A 14 -9.653 11.486 1.225 1.00 0.00 O ATOM 205 CB GLN A 14 -12.296 11.115 3.065 1.00 0.00 C ATOM 206 CG GLN A 14 -13.449 11.832 3.791 1.00 0.00 C ATOM 207 CD GLN A 14 -13.820 11.152 5.100 1.00 0.00 C ATOM 208 OE1 GLN A 14 -14.838 10.470 5.172 1.00 0.00 O ATOM 209 NE2 GLN A 14 -12.997 11.302 6.131 1.00 0.00 N ATOM 0 H GLN A 14 -13.918 11.500 1.263 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.563 12.842 2.087 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -12.585 10.091 2.828 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -11.425 11.057 3.718 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -13.164 12.865 3.989 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -14.322 11.862 3.140 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -12.159 11.876 6.036 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -13.202 10.843 7.018 1.00 0.00 H new ATOM 218 N VAL A 15 -11.154 10.310 0.043 1.00 0.00 N ATOM 219 CA VAL A 15 -10.126 9.698 -0.794 1.00 0.00 C ATOM 220 C VAL A 15 -9.325 10.808 -1.486 1.00 0.00 C ATOM 221 O VAL A 15 -8.096 10.847 -1.407 1.00 0.00 O ATOM 222 CB VAL A 15 -10.744 8.731 -1.818 1.00 0.00 C ATOM 223 CG1 VAL A 15 -9.646 7.941 -2.543 1.00 0.00 C ATOM 224 CG2 VAL A 15 -11.713 7.741 -1.164 1.00 0.00 C ATOM 0 H VAL A 15 -12.108 10.014 -0.163 1.00 0.00 H new ATOM 0 HA VAL A 15 -9.456 9.107 -0.170 1.00 0.00 H new ATOM 0 HB VAL A 15 -11.300 9.342 -2.529 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -10.102 7.262 -3.264 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.984 8.633 -3.064 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -9.071 7.367 -1.817 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -12.125 7.078 -1.925 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -11.181 7.150 -0.418 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -12.523 8.289 -0.683 1.00 0.00 H new ATOM 234 N LYS A 16 -10.042 11.735 -2.128 1.00 0.00 N ATOM 235 CA LYS A 16 -9.443 12.890 -2.777 1.00 0.00 C ATOM 236 C LYS A 16 -8.648 13.700 -1.750 1.00 0.00 C ATOM 237 O LYS A 16 -7.484 14.027 -1.984 1.00 0.00 O ATOM 238 CB LYS A 16 -10.521 13.740 -3.465 1.00 0.00 C ATOM 239 CG LYS A 16 -11.329 12.923 -4.482 1.00 0.00 C ATOM 240 CD LYS A 16 -12.353 13.821 -5.186 1.00 0.00 C ATOM 241 CE LYS A 16 -13.163 13.006 -6.199 1.00 0.00 C ATOM 242 NZ LYS A 16 -14.189 13.834 -6.858 1.00 0.00 N ATOM 0 H LYS A 16 -11.058 11.699 -2.209 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.754 12.556 -3.553 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -11.194 14.152 -2.713 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.051 14.585 -3.969 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -10.659 12.478 -5.217 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -11.839 12.103 -3.978 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -13.022 14.269 -4.451 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -11.842 14.640 -5.692 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.493 12.588 -6.950 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -13.640 12.166 -5.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -14.720 13.253 -7.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -14.842 14.213 -6.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -13.730 14.621 -7.360 1.00 0.00 H new ATOM 256 N ALA A 17 -9.275 13.997 -0.604 1.00 0.00 N ATOM 257 CA ALA A 17 -8.636 14.739 0.474 1.00 0.00 C ATOM 258 C ALA A 17 -7.256 14.161 0.799 1.00 0.00 C ATOM 259 O ALA A 17 -6.265 14.883 0.723 1.00 0.00 O ATOM 260 CB ALA A 17 -9.530 14.788 1.717 1.00 0.00 C ATOM 0 H ALA A 17 -10.238 13.727 -0.405 1.00 0.00 H new ATOM 0 HA ALA A 17 -8.491 15.764 0.134 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -9.027 15.348 2.505 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -10.472 15.277 1.469 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -9.728 13.774 2.063 1.00 0.00 H new ATOM 266 N MET A 18 -7.174 12.870 1.142 1.00 0.00 N ATOM 267 CA MET A 18 -5.892 12.252 1.450 1.00 0.00 C ATOM 268 C MET A 18 -4.958 12.258 0.238 1.00 0.00 C ATOM 269 O MET A 18 -3.786 12.589 0.404 1.00 0.00 O ATOM 270 CB MET A 18 -6.048 10.835 2.022 1.00 0.00 C ATOM 271 CG MET A 18 -6.421 10.831 3.516 1.00 0.00 C ATOM 272 SD MET A 18 -8.167 11.001 3.956 1.00 0.00 S ATOM 273 CE MET A 18 -8.788 9.421 3.332 1.00 0.00 C ATOM 0 H MET A 18 -7.976 12.243 1.211 1.00 0.00 H new ATOM 0 HA MET A 18 -5.434 12.862 2.229 1.00 0.00 H new ATOM 0 HB2 MET A 18 -6.816 10.304 1.459 1.00 0.00 H new ATOM 0 HB3 MET A 18 -5.115 10.288 1.884 1.00 0.00 H new ATOM 0 HG2 MET A 18 -6.057 9.899 3.948 1.00 0.00 H new ATOM 0 HG3 MET A 18 -5.875 11.641 3.999 1.00 0.00 H new ATOM 0 HE1 MET A 18 -9.830 9.297 3.628 1.00 0.00 H new ATOM 0 HE2 MET A 18 -8.716 9.406 2.245 1.00 0.00 H new ATOM 0 HE3 MET A 18 -8.193 8.607 3.747 1.00 0.00 H new ATOM 283 N LEU A 19 -5.436 11.902 -0.964 1.00 0.00 N ATOM 284 CA LEU A 19 -4.602 11.895 -2.170 1.00 0.00 C ATOM 285 C LEU A 19 -3.821 13.203 -2.316 1.00 0.00 C ATOM 286 O LEU A 19 -2.605 13.177 -2.521 1.00 0.00 O ATOM 287 CB LEU A 19 -5.442 11.617 -3.428 1.00 0.00 C ATOM 288 CG LEU A 19 -5.818 10.136 -3.601 1.00 0.00 C ATOM 289 CD1 LEU A 19 -6.948 10.011 -4.630 1.00 0.00 C ATOM 290 CD2 LEU A 19 -4.629 9.310 -4.105 1.00 0.00 C ATOM 0 H LEU A 19 -6.401 11.614 -1.124 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.881 11.085 -2.062 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.354 12.212 -3.385 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.887 11.947 -4.306 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.129 9.760 -2.626 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -7.214 8.961 -4.752 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.819 10.568 -4.284 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -6.616 10.415 -5.586 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.930 8.268 -4.216 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.300 9.697 -5.069 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.810 9.376 -3.389 1.00 0.00 H new ATOM 302 N GLU A 20 -4.504 14.341 -2.160 1.00 0.00 N ATOM 303 CA GLU A 20 -3.864 15.650 -2.247 1.00 0.00 C ATOM 304 C GLU A 20 -2.677 15.816 -1.284 1.00 0.00 C ATOM 305 O GLU A 20 -1.841 16.687 -1.513 1.00 0.00 O ATOM 306 CB GLU A 20 -4.898 16.763 -2.018 1.00 0.00 C ATOM 307 CG GLU A 20 -5.968 16.831 -3.122 1.00 0.00 C ATOM 308 CD GLU A 20 -5.382 17.136 -4.493 1.00 0.00 C ATOM 309 OE1 GLU A 20 -5.665 16.422 -5.448 1.00 0.00 O ATOM 310 OE2 GLU A 20 -4.554 18.210 -4.564 1.00 0.00 O ATOM 0 H GLU A 20 -5.506 14.378 -1.972 1.00 0.00 H new ATOM 0 HA GLU A 20 -3.455 15.728 -3.254 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -5.386 16.604 -1.057 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -4.383 17.722 -1.960 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -6.502 15.882 -3.163 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -6.700 17.597 -2.866 1.00 0.00 H new ATOM 318 N LYS A 21 -2.595 15.025 -0.208 1.00 0.00 N ATOM 319 CA LYS A 21 -1.540 15.146 0.790 1.00 0.00 C ATOM 320 C LYS A 21 -0.387 14.165 0.544 1.00 0.00 C ATOM 321 O LYS A 21 0.477 14.030 1.411 1.00 0.00 O ATOM 322 CB LYS A 21 -2.119 14.926 2.197 1.00 0.00 C ATOM 323 CG LYS A 21 -3.402 15.710 2.502 1.00 0.00 C ATOM 324 CD LYS A 21 -3.325 17.210 2.202 1.00 0.00 C ATOM 325 CE LYS A 21 -2.208 17.901 2.991 1.00 0.00 C ATOM 326 NZ LYS A 21 -2.186 19.350 2.727 1.00 0.00 N ATOM 0 H LYS A 21 -3.264 14.281 -0.009 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.134 16.154 0.708 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -2.321 13.863 2.328 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.361 15.199 2.932 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -4.220 15.280 1.924 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -3.651 15.577 3.555 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -3.159 17.357 1.135 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -4.280 17.677 2.443 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -2.350 17.725 4.057 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -1.246 17.465 2.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.420 19.791 3.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -2.026 19.516 1.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -3.096 19.768 3.007 1.00 0.00 H new ATOM 340 N ASP A 22 -0.361 13.431 -0.573 1.00 0.00 N ATOM 341 CA ASP A 22 0.727 12.484 -0.813 1.00 0.00 C ATOM 342 C ASP A 22 2.025 13.237 -1.131 1.00 0.00 C ATOM 343 O ASP A 22 2.113 13.892 -2.167 1.00 0.00 O ATOM 344 CB ASP A 22 0.372 11.514 -1.942 1.00 0.00 C ATOM 345 CG ASP A 22 1.363 10.360 -1.971 1.00 0.00 C ATOM 346 OD1 ASP A 22 0.980 9.225 -1.699 1.00 0.00 O ATOM 347 OD2 ASP A 22 2.649 10.665 -2.287 1.00 0.00 O ATOM 0 H ASP A 22 -1.065 13.473 -1.309 1.00 0.00 H new ATOM 0 HA ASP A 22 0.878 11.898 0.094 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -0.639 11.132 -1.799 1.00 0.00 H new ATOM 0 HB3 ASP A 22 0.383 12.037 -2.898 1.00 0.00 H new ATOM 353 N THR A 23 3.040 13.128 -0.272 1.00 0.00 N ATOM 354 CA THR A 23 4.291 13.870 -0.370 1.00 0.00 C ATOM 355 C THR A 23 5.326 13.226 -1.313 1.00 0.00 C ATOM 356 O THR A 23 6.503 13.581 -1.265 1.00 0.00 O ATOM 357 CB THR A 23 4.833 14.013 1.063 1.00 0.00 C ATOM 358 OG1 THR A 23 4.643 12.799 1.774 1.00 0.00 O ATOM 359 CG2 THR A 23 4.079 15.112 1.818 1.00 0.00 C ATOM 0 H THR A 23 3.010 12.502 0.533 1.00 0.00 H new ATOM 0 HA THR A 23 4.098 14.843 -0.821 1.00 0.00 H new ATOM 0 HB THR A 23 5.892 14.263 0.995 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.281 12.751 2.516 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.477 15.198 2.829 1.00 0.00 H new ATOM 0 HG22 THR A 23 4.203 16.062 1.298 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.020 14.860 1.865 1.00 0.00 H new ATOM 367 N GLY A 24 4.923 12.280 -2.164 1.00 0.00 N ATOM 368 CA GLY A 24 5.833 11.534 -3.020 1.00 0.00 C ATOM 369 C GLY A 24 6.053 12.244 -4.354 1.00 0.00 C ATOM 370 O GLY A 24 5.140 12.348 -5.170 1.00 0.00 O ATOM 0 H GLY A 24 3.945 12.012 -2.275 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.789 11.406 -2.513 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.431 10.537 -3.199 1.00 0.00 H new ATOM 374 N LYS A 25 7.287 12.683 -4.595 1.00 0.00 N ATOM 375 CA LYS A 25 7.706 13.382 -5.796 1.00 0.00 C ATOM 376 C LYS A 25 7.913 12.362 -6.920 1.00 0.00 C ATOM 377 O LYS A 25 8.711 11.431 -6.789 1.00 0.00 O ATOM 378 CB LYS A 25 9.009 14.134 -5.490 1.00 0.00 C ATOM 379 CG LYS A 25 8.800 15.219 -4.418 1.00 0.00 C ATOM 380 CD LYS A 25 9.996 15.342 -3.466 1.00 0.00 C ATOM 381 CE LYS A 25 11.303 15.684 -4.192 1.00 0.00 C ATOM 382 NZ LYS A 25 12.388 15.934 -3.228 1.00 0.00 N ATOM 0 H LYS A 25 8.048 12.553 -3.929 1.00 0.00 H new ATOM 0 HA LYS A 25 6.949 14.098 -6.115 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.766 13.427 -5.150 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.388 14.593 -6.403 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.628 16.179 -4.906 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.904 14.988 -3.842 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.786 16.112 -2.724 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.121 14.404 -2.925 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.581 14.864 -4.855 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.157 16.564 -4.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 13.294 15.634 -3.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 12.428 16.949 -3.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 12.209 15.396 -2.356 1.00 0.00 H new ATOM 396 N VAL A 26 7.173 12.533 -8.018 1.00 0.00 N ATOM 397 CA VAL A 26 7.253 11.684 -9.197 1.00 0.00 C ATOM 398 C VAL A 26 8.690 11.674 -9.726 1.00 0.00 C ATOM 399 O VAL A 26 9.249 12.725 -10.026 1.00 0.00 O ATOM 400 CB VAL A 26 6.254 12.179 -10.258 1.00 0.00 C ATOM 401 CG1 VAL A 26 6.372 11.360 -11.550 1.00 0.00 C ATOM 402 CG2 VAL A 26 4.820 12.082 -9.720 1.00 0.00 C ATOM 0 H VAL A 26 6.488 13.283 -8.109 1.00 0.00 H new ATOM 0 HA VAL A 26 6.986 10.659 -8.941 1.00 0.00 H new ATOM 0 HB VAL A 26 6.490 13.219 -10.482 1.00 0.00 H new ATOM 0 HG11 VAL A 26 5.655 11.731 -12.283 1.00 0.00 H new ATOM 0 HG12 VAL A 26 7.381 11.455 -11.950 1.00 0.00 H new ATOM 0 HG13 VAL A 26 6.163 10.312 -11.337 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.122 12.435 -10.479 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.594 11.045 -9.473 1.00 0.00 H new ATOM 0 HG23 VAL A 26 4.725 12.697 -8.825 1.00 0.00 H new ATOM 412 N SER A 27 9.280 10.481 -9.819 1.00 0.00 N ATOM 413 CA SER A 27 10.664 10.247 -10.192 1.00 0.00 C ATOM 414 C SER A 27 10.694 9.144 -11.258 1.00 0.00 C ATOM 415 O SER A 27 11.142 8.024 -11.010 1.00 0.00 O ATOM 416 CB SER A 27 11.443 9.856 -8.929 1.00 0.00 C ATOM 417 OG SER A 27 11.239 10.804 -7.893 1.00 0.00 O ATOM 0 H SER A 27 8.777 9.615 -9.626 1.00 0.00 H new ATOM 0 HA SER A 27 11.130 11.137 -10.614 1.00 0.00 H new ATOM 0 HB2 SER A 27 11.125 8.869 -8.592 1.00 0.00 H new ATOM 0 HB3 SER A 27 12.506 9.787 -9.160 1.00 0.00 H new ATOM 0 HG SER A 27 11.642 10.474 -7.063 1.00 0.00 H new ATOM 423 N GLY A 28 10.192 9.458 -12.455 1.00 0.00 N ATOM 424 CA GLY A 28 10.041 8.480 -13.523 1.00 0.00 C ATOM 425 C GLY A 28 8.965 7.479 -13.109 1.00 0.00 C ATOM 426 O GLY A 28 7.825 7.877 -12.895 1.00 0.00 O ATOM 0 H GLY A 28 9.881 10.396 -12.706 1.00 0.00 H new ATOM 0 HA2 GLY A 28 9.762 8.974 -14.454 1.00 0.00 H new ATOM 0 HA3 GLY A 28 10.986 7.968 -13.705 1.00 0.00 H new ATOM 430 N ASP A 29 9.325 6.199 -12.964 1.00 0.00 N ATOM 431 CA ASP A 29 8.420 5.175 -12.436 1.00 0.00 C ATOM 432 C ASP A 29 8.357 5.284 -10.913 1.00 0.00 C ATOM 433 O ASP A 29 7.339 4.979 -10.296 1.00 0.00 O ATOM 434 CB ASP A 29 8.936 3.771 -12.783 1.00 0.00 C ATOM 435 CG ASP A 29 8.176 2.697 -12.007 1.00 0.00 C ATOM 436 OD1 ASP A 29 8.657 2.230 -10.973 1.00 0.00 O ATOM 437 OD2 ASP A 29 6.979 2.326 -12.526 1.00 0.00 O ATOM 0 H ASP A 29 10.250 5.845 -13.209 1.00 0.00 H new ATOM 0 HA ASP A 29 7.436 5.330 -12.878 1.00 0.00 H new ATOM 0 HB2 ASP A 29 8.828 3.595 -13.853 1.00 0.00 H new ATOM 0 HB3 ASP A 29 10.000 3.705 -12.555 1.00 0.00 H new ATOM 443 N THR A 30 9.481 5.670 -10.318 1.00 0.00 N ATOM 444 CA THR A 30 9.662 5.696 -8.887 1.00 0.00 C ATOM 445 C THR A 30 8.988 6.945 -8.317 1.00 0.00 C ATOM 446 O THR A 30 8.773 7.926 -9.026 1.00 0.00 O ATOM 447 CB THR A 30 11.182 5.624 -8.638 1.00 0.00 C ATOM 448 OG1 THR A 30 11.714 4.521 -9.348 1.00 0.00 O ATOM 449 CG2 THR A 30 11.638 5.535 -7.185 1.00 0.00 C ATOM 0 H THR A 30 10.304 5.978 -10.836 1.00 0.00 H new ATOM 0 HA THR A 30 9.193 4.856 -8.375 1.00 0.00 H new ATOM 0 HB THR A 30 11.560 6.584 -8.989 1.00 0.00 H new ATOM 0 HG1 THR A 30 12.681 4.470 -9.196 1.00 0.00 H new ATOM 0 HG21 THR A 30 12.726 5.490 -7.147 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.292 6.414 -6.641 1.00 0.00 H new ATOM 0 HG23 THR A 30 11.222 4.637 -6.727 1.00 0.00 H new ATOM 457 N VAL A 31 8.623 6.899 -7.039 1.00 0.00 N ATOM 458 CA VAL A 31 8.085 8.012 -6.277 1.00 0.00 C ATOM 459 C VAL A 31 9.093 8.232 -5.142 1.00 0.00 C ATOM 460 O VAL A 31 9.527 7.263 -4.518 1.00 0.00 O ATOM 461 CB VAL A 31 6.657 7.659 -5.815 1.00 0.00 C ATOM 462 CG1 VAL A 31 6.157 8.643 -4.760 1.00 0.00 C ATOM 463 CG2 VAL A 31 5.665 7.678 -6.996 1.00 0.00 C ATOM 0 H VAL A 31 8.699 6.046 -6.486 1.00 0.00 H new ATOM 0 HA VAL A 31 7.974 8.940 -6.838 1.00 0.00 H new ATOM 0 HB VAL A 31 6.707 6.656 -5.391 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.148 8.367 -4.455 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.818 8.615 -3.894 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.147 9.650 -5.177 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.667 7.425 -6.637 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.649 8.673 -7.442 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.977 6.950 -7.745 1.00 0.00 H new ATOM 473 N THR A 32 9.505 9.480 -4.897 1.00 0.00 N ATOM 474 CA THR A 32 10.562 9.799 -3.947 1.00 0.00 C ATOM 475 C THR A 32 10.029 10.730 -2.871 1.00 0.00 C ATOM 476 O THR A 32 9.460 11.770 -3.183 1.00 0.00 O ATOM 477 CB THR A 32 11.749 10.423 -4.692 1.00 0.00 C ATOM 478 OG1 THR A 32 12.212 9.512 -5.670 1.00 0.00 O ATOM 479 CG2 THR A 32 12.912 10.756 -3.753 1.00 0.00 C ATOM 0 H THR A 32 9.108 10.299 -5.358 1.00 0.00 H new ATOM 0 HA THR A 32 10.907 8.888 -3.458 1.00 0.00 H new ATOM 0 HB THR A 32 11.401 11.351 -5.146 1.00 0.00 H new ATOM 0 HG1 THR A 32 13.123 9.228 -5.447 1.00 0.00 H new ATOM 0 HG21 THR A 32 13.728 11.195 -4.326 1.00 0.00 H new ATOM 0 HG22 THR A 32 12.577 11.466 -2.996 1.00 0.00 H new ATOM 0 HG23 THR A 32 13.260 9.844 -3.267 1.00 0.00 H new ATOM 487 N TYR A 33 10.211 10.357 -1.608 1.00 0.00 N ATOM 488 CA TYR A 33 9.794 11.171 -0.478 1.00 0.00 C ATOM 489 C TYR A 33 10.980 11.971 0.061 1.00 0.00 C ATOM 490 O TYR A 33 12.103 11.839 -0.425 1.00 0.00 O ATOM 491 CB TYR A 33 9.189 10.241 0.564 1.00 0.00 C ATOM 492 CG TYR A 33 7.811 9.757 0.161 1.00 0.00 C ATOM 493 CD1 TYR A 33 6.702 10.573 0.435 1.00 0.00 C ATOM 494 CD2 TYR A 33 7.644 8.580 -0.595 1.00 0.00 C ATOM 495 CE1 TYR A 33 5.414 10.149 0.082 1.00 0.00 C ATOM 496 CE2 TYR A 33 6.359 8.208 -1.034 1.00 0.00 C ATOM 497 CZ TYR A 33 5.243 8.983 -0.676 1.00 0.00 C ATOM 498 OH TYR A 33 3.995 8.649 -1.105 1.00 0.00 O ATOM 0 H TYR A 33 10.654 9.478 -1.342 1.00 0.00 H new ATOM 0 HA TYR A 33 9.042 11.903 -0.772 1.00 0.00 H new ATOM 0 HB2 TYR A 33 9.846 9.384 0.710 1.00 0.00 H new ATOM 0 HB3 TYR A 33 9.126 10.760 1.520 1.00 0.00 H new ATOM 0 HD1 TYR A 33 6.842 11.529 0.918 1.00 0.00 H new ATOM 0 HD2 TYR A 33 8.498 7.965 -0.837 1.00 0.00 H new ATOM 0 HE1 TYR A 33 4.553 10.721 0.394 1.00 0.00 H new ATOM 0 HE2 TYR A 33 6.231 7.327 -1.646 1.00 0.00 H new ATOM 0 HH TYR A 33 3.679 9.320 -1.746 1.00 0.00 H new ATOM 508 N SER A 34 10.742 12.835 1.051 1.00 0.00 N ATOM 509 CA SER A 34 11.750 13.736 1.591 1.00 0.00 C ATOM 510 C SER A 34 11.372 14.142 3.019 1.00 0.00 C ATOM 511 O SER A 34 10.255 13.877 3.470 1.00 0.00 O ATOM 512 CB SER A 34 11.888 14.961 0.674 1.00 0.00 C ATOM 513 OG SER A 34 12.296 14.584 -0.630 1.00 0.00 O ATOM 0 H SER A 34 9.832 12.926 1.502 1.00 0.00 H new ATOM 0 HA SER A 34 12.716 13.232 1.632 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.935 15.488 0.621 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.613 15.656 1.098 1.00 0.00 H new ATOM 0 HG SER A 34 13.216 14.885 -0.785 1.00 0.00 H new ATOM 519 N GLY A 35 12.323 14.768 3.725 1.00 0.00 N ATOM 520 CA GLY A 35 12.150 15.333 5.059 1.00 0.00 C ATOM 521 C GLY A 35 11.408 14.398 6.012 1.00 0.00 C ATOM 522 O GLY A 35 10.508 14.832 6.724 1.00 0.00 O ATOM 0 H GLY A 35 13.268 14.897 3.364 1.00 0.00 H new ATOM 0 HA2 GLY A 35 13.129 15.568 5.478 1.00 0.00 H new ATOM 0 HA3 GLY A 35 11.603 16.273 4.981 1.00 0.00 H new ATOM 526 N LYS A 36 11.764 13.107 5.991 1.00 0.00 N ATOM 527 CA LYS A 36 11.182 12.047 6.792 1.00 0.00 C ATOM 528 C LYS A 36 9.643 11.959 6.759 1.00 0.00 C ATOM 529 O LYS A 36 9.063 11.193 7.533 1.00 0.00 O ATOM 530 CB LYS A 36 11.749 12.158 8.212 1.00 0.00 C ATOM 531 CG LYS A 36 13.229 11.755 8.267 1.00 0.00 C ATOM 532 CD LYS A 36 13.714 11.737 9.723 1.00 0.00 C ATOM 533 CE LYS A 36 15.085 11.064 9.861 1.00 0.00 C ATOM 534 NZ LYS A 36 16.113 11.713 9.029 1.00 0.00 N ATOM 0 H LYS A 36 12.506 12.766 5.379 1.00 0.00 H new ATOM 0 HA LYS A 36 11.471 11.097 6.343 1.00 0.00 H new ATOM 0 HB2 LYS A 36 11.637 13.182 8.569 1.00 0.00 H new ATOM 0 HB3 LYS A 36 11.174 11.521 8.884 1.00 0.00 H new ATOM 0 HG2 LYS A 36 13.363 10.771 7.818 1.00 0.00 H new ATOM 0 HG3 LYS A 36 13.827 12.456 7.684 1.00 0.00 H new ATOM 0 HD2 LYS A 36 13.772 12.758 10.099 1.00 0.00 H new ATOM 0 HD3 LYS A 36 12.987 11.210 10.341 1.00 0.00 H new ATOM 0 HE2 LYS A 36 15.396 11.090 10.905 1.00 0.00 H new ATOM 0 HE3 LYS A 36 15.002 10.014 9.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 17.048 11.326 9.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 15.910 11.535 8.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 16.107 12.738 9.207 1.00 0.00 H new ATOM 548 N THR A 37 8.981 12.669 5.840 1.00 0.00 N ATOM 549 CA THR A 37 7.530 12.771 5.787 1.00 0.00 C ATOM 550 C THR A 37 7.022 11.878 4.659 1.00 0.00 C ATOM 551 O THR A 37 6.641 12.356 3.592 1.00 0.00 O ATOM 552 CB THR A 37 7.138 14.247 5.614 1.00 0.00 C ATOM 553 OG1 THR A 37 7.731 15.015 6.644 1.00 0.00 O ATOM 554 CG2 THR A 37 5.622 14.449 5.718 1.00 0.00 C ATOM 0 H THR A 37 9.451 13.195 5.103 1.00 0.00 H new ATOM 0 HA THR A 37 7.067 12.425 6.711 1.00 0.00 H new ATOM 0 HB THR A 37 7.480 14.558 4.627 1.00 0.00 H new ATOM 0 HG1 THR A 37 8.705 15.007 6.538 1.00 0.00 H new ATOM 0 HG21 THR A 37 5.386 15.505 5.590 1.00 0.00 H new ATOM 0 HG22 THR A 37 5.124 13.869 4.941 1.00 0.00 H new ATOM 0 HG23 THR A 37 5.277 14.116 6.697 1.00 0.00 H new ATOM 562 N VAL A 38 7.031 10.567 4.894 1.00 0.00 N ATOM 563 CA VAL A 38 6.567 9.593 3.921 1.00 0.00 C ATOM 564 C VAL A 38 5.072 9.349 4.119 1.00 0.00 C ATOM 565 O VAL A 38 4.681 8.550 4.970 1.00 0.00 O ATOM 566 CB VAL A 38 7.406 8.313 4.006 1.00 0.00 C ATOM 567 CG1 VAL A 38 6.808 7.225 3.103 1.00 0.00 C ATOM 568 CG2 VAL A 38 8.840 8.551 3.537 1.00 0.00 C ATOM 0 H VAL A 38 7.361 10.155 5.767 1.00 0.00 H new ATOM 0 HA VAL A 38 6.699 9.977 2.909 1.00 0.00 H new ATOM 0 HB VAL A 38 7.404 8.003 5.051 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.413 6.321 3.173 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.790 7.005 3.424 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.796 7.575 2.071 1.00 0.00 H new ATOM 0 HG21 VAL A 38 9.406 7.622 3.611 1.00 0.00 H new ATOM 0 HG22 VAL A 38 8.832 8.890 2.501 1.00 0.00 H new ATOM 0 HG23 VAL A 38 9.306 9.311 4.164 1.00 0.00 H new ATOM 578 N HIS A 39 4.236 10.035 3.331 1.00 0.00 N ATOM 579 CA HIS A 39 2.799 9.809 3.319 1.00 0.00 C ATOM 580 C HIS A 39 2.440 9.043 2.044 1.00 0.00 C ATOM 581 O HIS A 39 2.424 9.620 0.955 1.00 0.00 O ATOM 582 CB HIS A 39 2.051 11.142 3.427 1.00 0.00 C ATOM 583 CG HIS A 39 0.558 10.967 3.519 1.00 0.00 C ATOM 584 ND1 HIS A 39 -0.389 11.797 2.954 1.00 0.00 N ATOM 585 CD2 HIS A 39 -0.096 9.947 4.152 1.00 0.00 C ATOM 586 CE1 HIS A 39 -1.602 11.282 3.232 1.00 0.00 C ATOM 587 NE2 HIS A 39 -1.442 10.161 3.959 1.00 0.00 N ATOM 0 H HIS A 39 4.544 10.762 2.685 1.00 0.00 H new ATOM 0 HA HIS A 39 2.497 9.211 4.179 1.00 0.00 H new ATOM 0 HB2 HIS A 39 2.404 11.681 4.306 1.00 0.00 H new ATOM 0 HB3 HIS A 39 2.287 11.758 2.559 1.00 0.00 H new ATOM 0 HD1 HIS A 39 -0.204 12.647 2.422 1.00 0.00 H new ATOM 0 HD2 HIS A 39 0.356 9.132 4.698 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -2.548 11.700 2.922 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -2.194 9.568 4.309 1.00 0.00 H new ATOM 596 N VAL A 40 2.200 7.736 2.164 1.00 0.00 N ATOM 597 CA VAL A 40 1.909 6.858 1.038 1.00 0.00 C ATOM 598 C VAL A 40 0.399 6.664 0.967 1.00 0.00 C ATOM 599 O VAL A 40 -0.162 5.913 1.761 1.00 0.00 O ATOM 600 CB VAL A 40 2.679 5.532 1.193 1.00 0.00 C ATOM 601 CG1 VAL A 40 2.308 4.520 0.102 1.00 0.00 C ATOM 602 CG2 VAL A 40 4.187 5.788 1.110 1.00 0.00 C ATOM 0 H VAL A 40 2.203 7.254 3.063 1.00 0.00 H new ATOM 0 HA VAL A 40 2.241 7.296 0.097 1.00 0.00 H new ATOM 0 HB VAL A 40 2.407 5.120 2.165 1.00 0.00 H new ATOM 0 HG11 VAL A 40 2.874 3.601 0.251 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.241 4.302 0.156 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.544 4.937 -0.877 1.00 0.00 H new ATOM 0 HG21 VAL A 40 4.723 4.845 1.221 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.428 6.231 0.144 1.00 0.00 H new ATOM 0 HG23 VAL A 40 4.485 6.470 1.906 1.00 0.00 H new ATOM 612 N VAL A 41 -0.255 7.347 0.024 1.00 0.00 N ATOM 613 CA VAL A 41 -1.679 7.200 -0.224 1.00 0.00 C ATOM 614 C VAL A 41 -1.870 6.060 -1.227 1.00 0.00 C ATOM 615 O VAL A 41 -1.831 6.262 -2.444 1.00 0.00 O ATOM 616 CB VAL A 41 -2.311 8.532 -0.653 1.00 0.00 C ATOM 617 CG1 VAL A 41 -3.838 8.388 -0.665 1.00 0.00 C ATOM 618 CG2 VAL A 41 -1.943 9.642 0.339 1.00 0.00 C ATOM 0 H VAL A 41 0.199 8.022 -0.591 1.00 0.00 H new ATOM 0 HA VAL A 41 -2.210 6.932 0.690 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.939 8.789 -1.645 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.290 9.332 -0.969 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.124 7.606 -1.368 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.186 8.124 0.333 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.398 10.580 0.021 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.309 9.379 1.331 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.860 9.757 0.371 1.00 0.00 H new ATOM 628 N ALA A 42 -2.028 4.851 -0.688 1.00 0.00 N ATOM 629 CA ALA A 42 -2.211 3.621 -1.439 1.00 0.00 C ATOM 630 C ALA A 42 -3.700 3.296 -1.547 1.00 0.00 C ATOM 631 O ALA A 42 -4.506 3.768 -0.750 1.00 0.00 O ATOM 632 CB ALA A 42 -1.433 2.492 -0.757 1.00 0.00 C ATOM 0 H ALA A 42 -2.031 4.702 0.321 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.824 3.738 -2.451 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.568 1.567 -1.318 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.374 2.747 -0.727 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -1.803 2.357 0.259 1.00 0.00 H new ATOM 638 N ALA A 43 -4.074 2.471 -2.520 1.00 0.00 N ATOM 639 CA ALA A 43 -5.436 2.021 -2.731 1.00 0.00 C ATOM 640 C ALA A 43 -5.405 0.685 -3.463 1.00 0.00 C ATOM 641 O ALA A 43 -4.355 0.276 -3.965 1.00 0.00 O ATOM 642 CB ALA A 43 -6.212 3.072 -3.526 1.00 0.00 C ATOM 0 H ALA A 43 -3.416 2.089 -3.200 1.00 0.00 H new ATOM 0 HA ALA A 43 -5.942 1.886 -1.775 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.235 2.729 -3.682 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -6.225 4.011 -2.972 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.730 3.227 -4.492 1.00 0.00 H new ATOM 648 N ALA A 44 -6.545 -0.010 -3.495 1.00 0.00 N ATOM 649 CA ALA A 44 -6.632 -1.329 -4.097 1.00 0.00 C ATOM 650 C ALA A 44 -8.008 -1.563 -4.714 1.00 0.00 C ATOM 651 O ALA A 44 -9.004 -1.629 -3.996 1.00 0.00 O ATOM 652 CB ALA A 44 -6.350 -2.389 -3.035 1.00 0.00 C ATOM 0 H ALA A 44 -7.424 0.329 -3.105 1.00 0.00 H new ATOM 0 HA ALA A 44 -5.891 -1.397 -4.893 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -6.415 -3.380 -3.484 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.350 -2.239 -2.628 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -7.084 -2.305 -2.233 1.00 0.00 H new ATOM 658 N VAL A 45 -8.040 -1.712 -6.038 1.00 0.00 N ATOM 659 CA VAL A 45 -9.203 -2.089 -6.825 1.00 0.00 C ATOM 660 C VAL A 45 -10.397 -1.165 -6.560 1.00 0.00 C ATOM 661 O VAL A 45 -11.504 -1.616 -6.266 1.00 0.00 O ATOM 662 CB VAL A 45 -9.508 -3.589 -6.631 1.00 0.00 C ATOM 663 CG1 VAL A 45 -10.439 -4.122 -7.729 1.00 0.00 C ATOM 664 CG2 VAL A 45 -8.225 -4.435 -6.673 1.00 0.00 C ATOM 0 H VAL A 45 -7.212 -1.565 -6.615 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.980 -1.950 -7.883 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.986 -3.673 -5.655 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -10.632 -5.181 -7.560 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -11.381 -3.574 -7.705 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -9.967 -3.990 -8.702 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.477 -5.486 -6.533 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.735 -4.305 -7.638 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -7.552 -4.115 -5.878 1.00 0.00 H new ATOM 674 N LEU A 46 -10.184 0.147 -6.697 1.00 0.00 N ATOM 675 CA LEU A 46 -11.287 1.098 -6.615 1.00 0.00 C ATOM 676 C LEU A 46 -12.022 1.056 -7.959 1.00 0.00 C ATOM 677 O LEU A 46 -11.381 0.741 -8.961 1.00 0.00 O ATOM 678 CB LEU A 46 -10.781 2.519 -6.338 1.00 0.00 C ATOM 679 CG LEU A 46 -9.861 2.640 -5.116 1.00 0.00 C ATOM 680 CD1 LEU A 46 -9.595 4.129 -4.853 1.00 0.00 C ATOM 681 CD2 LEU A 46 -10.485 1.997 -3.873 1.00 0.00 C ATOM 0 H LEU A 46 -9.269 0.567 -6.863 1.00 0.00 H new ATOM 0 HA LEU A 46 -11.950 0.828 -5.793 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -10.246 2.878 -7.217 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -11.639 3.176 -6.197 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.930 2.113 -5.324 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.942 4.234 -3.987 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -9.115 4.573 -5.725 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -10.539 4.639 -4.660 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -9.804 2.103 -3.028 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -11.429 2.491 -3.643 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -10.666 0.939 -4.063 1.00 0.00 H new ATOM 693 N PRO A 47 -13.335 1.350 -8.013 1.00 0.00 N ATOM 694 CA PRO A 47 -14.134 1.256 -9.231 1.00 0.00 C ATOM 695 C PRO A 47 -13.454 1.906 -10.443 1.00 0.00 C ATOM 696 O PRO A 47 -13.418 3.129 -10.553 1.00 0.00 O ATOM 697 CB PRO A 47 -15.477 1.913 -8.892 1.00 0.00 C ATOM 698 CG PRO A 47 -15.615 1.635 -7.397 1.00 0.00 C ATOM 699 CD PRO A 47 -14.175 1.774 -6.902 1.00 0.00 C ATOM 0 HA PRO A 47 -14.264 0.217 -9.532 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -15.471 2.982 -9.107 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -16.297 1.477 -9.463 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -16.282 2.347 -6.911 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -16.016 0.640 -7.204 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -13.957 2.803 -6.616 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -14.002 1.155 -6.022 1.00 0.00 H new ATOM 748 N PHE A 51 -8.478 -5.790 -10.706 1.00 0.00 N ATOM 749 CA PHE A 51 -7.720 -6.692 -9.859 1.00 0.00 C ATOM 750 C PHE A 51 -6.402 -7.032 -10.562 1.00 0.00 C ATOM 751 O PHE A 51 -6.400 -7.180 -11.783 1.00 0.00 O ATOM 752 CB PHE A 51 -8.474 -8.011 -9.627 1.00 0.00 C ATOM 753 CG PHE A 51 -9.368 -8.080 -8.406 1.00 0.00 C ATOM 754 CD1 PHE A 51 -10.699 -7.631 -8.478 1.00 0.00 C ATOM 755 CD2 PHE A 51 -8.941 -8.824 -7.288 1.00 0.00 C ATOM 756 CE1 PHE A 51 -11.606 -7.956 -7.455 1.00 0.00 C ATOM 757 CE2 PHE A 51 -9.859 -9.188 -6.290 1.00 0.00 C ATOM 758 CZ PHE A 51 -11.198 -8.777 -6.390 1.00 0.00 C ATOM 0 HA PHE A 51 -7.556 -6.199 -8.901 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.085 -8.213 -10.507 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -7.740 -8.814 -9.557 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -11.024 -7.037 -9.319 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.905 -9.115 -7.199 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -12.616 -7.575 -7.487 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.536 -9.782 -5.448 1.00 0.00 H new ATOM 0 HZ PHE A 51 -11.916 -9.092 -5.647 1.00 0.00 H new ATOM 768 N PRO A 52 -5.300 -7.232 -9.826 1.00 0.00 N ATOM 769 CA PRO A 52 -5.125 -7.053 -8.393 1.00 0.00 C ATOM 770 C PRO A 52 -4.206 -5.840 -8.210 1.00 0.00 C ATOM 771 O PRO A 52 -3.168 -5.936 -7.572 1.00 0.00 O ATOM 772 CB PRO A 52 -4.455 -8.361 -7.975 1.00 0.00 C ATOM 773 CG PRO A 52 -3.539 -8.690 -9.157 1.00 0.00 C ATOM 774 CD PRO A 52 -4.151 -7.953 -10.352 1.00 0.00 C ATOM 0 HA PRO A 52 -6.028 -6.868 -7.811 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -3.890 -8.244 -7.050 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -5.187 -9.150 -7.804 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -2.518 -8.357 -8.969 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -3.496 -9.764 -9.336 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -3.431 -7.268 -10.800 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -4.452 -8.653 -11.131 1.00 0.00 H new ATOM 782 N SER A 53 -4.542 -4.684 -8.783 1.00 0.00 N ATOM 783 CA SER A 53 -3.584 -3.587 -8.784 1.00 0.00 C ATOM 784 C SER A 53 -3.496 -2.802 -7.474 1.00 0.00 C ATOM 785 O SER A 53 -4.485 -2.215 -7.042 1.00 0.00 O ATOM 786 CB SER A 53 -3.906 -2.640 -9.948 1.00 0.00 C ATOM 787 OG SER A 53 -5.202 -2.078 -9.820 1.00 0.00 O ATOM 0 H SER A 53 -5.435 -4.489 -9.235 1.00 0.00 H new ATOM 0 HA SER A 53 -2.602 -4.044 -8.904 1.00 0.00 H new ATOM 0 HB2 SER A 53 -3.165 -1.842 -9.984 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.836 -3.183 -10.890 1.00 0.00 H new ATOM 0 HG SER A 53 -5.290 -1.657 -8.940 1.00 0.00 H new ATOM 793 N PHE A 54 -2.309 -2.740 -6.858 1.00 0.00 N ATOM 794 CA PHE A 54 -2.081 -1.796 -5.772 1.00 0.00 C ATOM 795 C PHE A 54 -1.857 -0.480 -6.495 1.00 0.00 C ATOM 796 O PHE A 54 -0.884 -0.367 -7.249 1.00 0.00 O ATOM 797 CB PHE A 54 -0.793 -2.073 -4.983 1.00 0.00 C ATOM 798 CG PHE A 54 -0.849 -3.094 -3.870 1.00 0.00 C ATOM 799 CD1 PHE A 54 -1.927 -3.108 -2.961 1.00 0.00 C ATOM 800 CD2 PHE A 54 0.317 -3.821 -3.573 1.00 0.00 C ATOM 801 CE1 PHE A 54 -1.875 -3.926 -1.821 1.00 0.00 C ATOM 802 CE2 PHE A 54 0.383 -4.611 -2.416 1.00 0.00 C ATOM 803 CZ PHE A 54 -0.714 -4.660 -1.543 1.00 0.00 C ATOM 0 H PHE A 54 -1.507 -3.325 -7.092 1.00 0.00 H new ATOM 0 HA PHE A 54 -2.910 -1.834 -5.065 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -0.029 -2.393 -5.692 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.455 -1.130 -4.554 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.793 -2.489 -3.142 1.00 0.00 H new ATOM 0 HD2 PHE A 54 1.166 -3.771 -4.239 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -2.727 -3.989 -1.160 1.00 0.00 H new ATOM 0 HE2 PHE A 54 1.275 -5.179 -2.198 1.00 0.00 H new ATOM 0 HZ PHE A 54 -0.664 -5.267 -0.651 1.00 0.00 H new ATOM 813 N GLU A 55 -2.742 0.494 -6.293 1.00 0.00 N ATOM 814 CA GLU A 55 -2.563 1.806 -6.874 1.00 0.00 C ATOM 815 C GLU A 55 -2.003 2.738 -5.803 1.00 0.00 C ATOM 816 O GLU A 55 -2.404 2.628 -4.649 1.00 0.00 O ATOM 817 CB GLU A 55 -3.841 2.306 -7.539 1.00 0.00 C ATOM 818 CG GLU A 55 -4.648 1.197 -8.240 1.00 0.00 C ATOM 819 CD GLU A 55 -5.783 0.617 -7.398 1.00 0.00 C ATOM 820 OE1 GLU A 55 -6.202 1.227 -6.419 1.00 0.00 O ATOM 821 OE2 GLU A 55 -6.325 -0.553 -7.832 1.00 0.00 O ATOM 0 H GLU A 55 -3.587 0.391 -5.731 1.00 0.00 H new ATOM 0 HA GLU A 55 -1.838 1.768 -7.687 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -4.470 2.781 -6.786 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.584 3.073 -8.269 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -5.065 1.596 -9.165 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -3.969 0.391 -8.518 1.00 0.00 H new ATOM 829 N VAL A 56 -1.040 3.595 -6.149 1.00 0.00 N ATOM 830 CA VAL A 56 -0.356 4.443 -5.173 1.00 0.00 C ATOM 831 C VAL A 56 -0.235 5.873 -5.712 1.00 0.00 C ATOM 832 O VAL A 56 0.652 6.171 -6.511 1.00 0.00 O ATOM 833 CB VAL A 56 0.990 3.815 -4.779 1.00 0.00 C ATOM 834 CG1 VAL A 56 1.705 4.656 -3.716 1.00 0.00 C ATOM 835 CG2 VAL A 56 0.819 2.389 -4.231 1.00 0.00 C ATOM 0 H VAL A 56 -0.715 3.720 -7.108 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.942 4.510 -4.256 1.00 0.00 H new ATOM 0 HB VAL A 56 1.588 3.781 -5.690 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.654 4.186 -3.458 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.890 5.656 -4.107 1.00 0.00 H new ATOM 0 HG13 VAL A 56 1.080 4.725 -2.826 1.00 0.00 H new ATOM 0 HG21 VAL A 56 1.795 1.982 -3.965 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.182 2.413 -3.347 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.359 1.759 -4.993 1.00 0.00 H new ATOM 845 N HIS A 57 -1.137 6.738 -5.233 1.00 0.00 N ATOM 846 CA HIS A 57 -1.406 8.125 -5.607 1.00 0.00 C ATOM 847 C HIS A 57 -1.244 8.475 -7.096 1.00 0.00 C ATOM 848 O HIS A 57 -2.232 8.778 -7.759 1.00 0.00 O ATOM 849 CB HIS A 57 -0.749 9.129 -4.643 1.00 0.00 C ATOM 850 CG HIS A 57 0.637 9.607 -4.997 1.00 0.00 C ATOM 851 ND1 HIS A 57 0.937 10.868 -5.478 1.00 0.00 N ATOM 852 CD2 HIS A 57 1.804 8.900 -4.904 1.00 0.00 C ATOM 853 CE1 HIS A 57 2.265 10.928 -5.673 1.00 0.00 C ATOM 854 NE2 HIS A 57 2.810 9.745 -5.336 1.00 0.00 N ATOM 0 H HIS A 57 -1.767 6.444 -4.487 1.00 0.00 H new ATOM 0 HA HIS A 57 -2.483 8.229 -5.478 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -1.399 10.000 -4.566 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -0.708 8.673 -3.654 1.00 0.00 H new ATOM 0 HD1 HIS A 57 0.269 11.619 -5.654 1.00 0.00 H new ATOM 0 HD2 HIS A 57 1.918 7.882 -4.561 1.00 0.00 H new ATOM 0 HE1 HIS A 57 2.807 11.787 -6.041 1.00 0.00 H new ATOM 863 N ASP A 58 -0.011 8.482 -7.607 1.00 0.00 N ATOM 864 CA ASP A 58 0.329 8.887 -8.966 1.00 0.00 C ATOM 865 C ASP A 58 0.572 7.689 -9.882 1.00 0.00 C ATOM 866 O ASP A 58 0.440 7.811 -11.097 1.00 0.00 O ATOM 867 CB ASP A 58 1.559 9.801 -8.953 1.00 0.00 C ATOM 868 CG ASP A 58 1.879 10.287 -10.360 1.00 0.00 C ATOM 869 OD1 ASP A 58 2.853 9.838 -10.954 1.00 0.00 O ATOM 870 OD2 ASP A 58 1.046 11.233 -10.866 1.00 0.00 O ATOM 0 H ASP A 58 0.804 8.195 -7.065 1.00 0.00 H new ATOM 0 HA ASP A 58 -0.526 9.433 -9.366 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.378 10.655 -8.300 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.415 9.263 -8.545 1.00 0.00 H new ATOM 876 N LYS A 59 0.971 6.555 -9.305 1.00 0.00 N ATOM 877 CA LYS A 59 1.380 5.360 -10.021 1.00 0.00 C ATOM 878 C LYS A 59 0.564 4.160 -9.542 1.00 0.00 C ATOM 879 O LYS A 59 -0.392 4.298 -8.779 1.00 0.00 O ATOM 880 CB LYS A 59 2.855 5.098 -9.691 1.00 0.00 C ATOM 881 CG LYS A 59 3.806 6.273 -9.920 1.00 0.00 C ATOM 882 CD LYS A 59 3.830 6.713 -11.384 1.00 0.00 C ATOM 883 CE LYS A 59 5.027 7.642 -11.572 1.00 0.00 C ATOM 884 NZ LYS A 59 5.018 8.261 -12.906 1.00 0.00 N ATOM 0 H LYS A 59 1.018 6.446 -8.292 1.00 0.00 H new ATOM 0 HA LYS A 59 1.227 5.499 -11.091 1.00 0.00 H new ATOM 0 HB2 LYS A 59 2.926 4.796 -8.646 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.198 4.255 -10.291 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.503 7.112 -9.294 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.812 5.991 -9.610 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.911 5.848 -12.042 1.00 0.00 H new ATOM 0 HD3 LYS A 59 2.904 7.226 -11.644 1.00 0.00 H new ATOM 0 HE2 LYS A 59 5.011 8.419 -10.808 1.00 0.00 H new ATOM 0 HE3 LYS A 59 5.951 7.080 -11.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.988 8.293 -13.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.418 7.701 -13.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 4.641 9.228 -12.837 1.00 0.00 H new ATOM 898 N LYS A 60 0.980 2.967 -9.964 1.00 0.00 N ATOM 899 CA LYS A 60 0.459 1.701 -9.497 1.00 0.00 C ATOM 900 C LYS A 60 1.666 0.798 -9.286 1.00 0.00 C ATOM 901 O LYS A 60 2.575 0.800 -10.113 1.00 0.00 O ATOM 902 CB LYS A 60 -0.529 1.103 -10.501 1.00 0.00 C ATOM 903 CG LYS A 60 -1.663 2.064 -10.878 1.00 0.00 C ATOM 904 CD LYS A 60 -2.831 1.386 -11.614 1.00 0.00 C ATOM 905 CE LYS A 60 -2.441 0.796 -12.978 1.00 0.00 C ATOM 906 NZ LYS A 60 -1.851 -0.550 -12.861 1.00 0.00 N ATOM 0 H LYS A 60 1.714 2.861 -10.664 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.101 1.821 -8.570 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.010 0.815 -11.404 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.957 0.193 -10.081 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -2.042 2.537 -9.972 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -1.260 2.857 -11.508 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -3.233 0.591 -10.986 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -3.630 2.113 -11.758 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -3.324 0.748 -13.616 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -1.729 1.460 -13.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -0.880 -0.537 -13.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -1.835 -0.836 -11.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -2.421 -1.228 -13.406 1.00 0.00 H new ATOM 920 N ASN A 61 1.705 0.105 -8.144 1.00 0.00 N ATOM 921 CA ASN A 61 2.830 -0.724 -7.725 1.00 0.00 C ATOM 922 C ASN A 61 4.187 0.005 -7.858 1.00 0.00 C ATOM 923 O ASN A 61 5.155 -0.596 -8.331 1.00 0.00 O ATOM 924 CB ASN A 61 2.853 -2.002 -8.579 1.00 0.00 C ATOM 925 CG ASN A 61 1.723 -3.004 -8.377 1.00 0.00 C ATOM 926 OD1 ASN A 61 2.004 -4.192 -8.261 1.00 0.00 O ATOM 927 ND2 ASN A 61 0.442 -2.621 -8.396 1.00 0.00 N ATOM 0 H ASN A 61 0.937 0.107 -7.473 1.00 0.00 H new ATOM 0 HA ASN A 61 2.692 -0.961 -6.670 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.856 -1.706 -9.628 1.00 0.00 H new ATOM 0 HB3 ASN A 61 3.796 -2.516 -8.390 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.300 -3.317 -8.314 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.206 -1.633 -8.492 1.00 0.00 H new ATOM 934 N PRO A 62 4.313 1.295 -7.497 1.00 0.00 N ATOM 935 CA PRO A 62 5.538 2.020 -7.767 1.00 0.00 C ATOM 936 C PRO A 62 6.693 1.577 -6.885 1.00 0.00 C ATOM 937 O PRO A 62 6.543 0.885 -5.875 1.00 0.00 O ATOM 938 CB PRO A 62 5.238 3.491 -7.489 1.00 0.00 C ATOM 939 CG PRO A 62 4.146 3.404 -6.430 1.00 0.00 C ATOM 940 CD PRO A 62 3.341 2.184 -6.880 1.00 0.00 C ATOM 0 HA PRO A 62 5.844 1.834 -8.797 1.00 0.00 H new ATOM 0 HB2 PRO A 62 6.116 4.024 -7.125 1.00 0.00 H new ATOM 0 HB3 PRO A 62 4.897 4.013 -8.383 1.00 0.00 H new ATOM 0 HG2 PRO A 62 4.560 3.270 -5.431 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.534 4.306 -6.403 1.00 0.00 H new ATOM 0 HD2 PRO A 62 2.848 1.703 -6.035 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.560 2.466 -7.586 1.00 0.00 H new ATOM 948 N THR A 63 7.853 2.071 -7.289 1.00 0.00 N ATOM 949 CA THR A 63 9.105 1.956 -6.590 1.00 0.00 C ATOM 950 C THR A 63 9.186 3.172 -5.658 1.00 0.00 C ATOM 951 O THR A 63 8.968 4.292 -6.114 1.00 0.00 O ATOM 952 CB THR A 63 10.194 1.953 -7.671 1.00 0.00 C ATOM 953 OG1 THR A 63 9.867 1.044 -8.710 1.00 0.00 O ATOM 954 CG2 THR A 63 11.537 1.556 -7.088 1.00 0.00 C ATOM 0 H THR A 63 7.941 2.590 -8.163 1.00 0.00 H new ATOM 0 HA THR A 63 9.217 1.055 -5.987 1.00 0.00 H new ATOM 0 HB THR A 63 10.256 2.965 -8.072 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.453 1.531 -9.453 1.00 0.00 H new ATOM 0 HG21 THR A 63 12.291 1.562 -7.875 1.00 0.00 H new ATOM 0 HG22 THR A 63 11.819 2.265 -6.309 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.467 0.556 -6.660 1.00 0.00 H new ATOM 962 N LEU A 64 9.440 2.982 -4.362 1.00 0.00 N ATOM 963 CA LEU A 64 9.481 4.065 -3.382 1.00 0.00 C ATOM 964 C LEU A 64 10.928 4.354 -2.978 1.00 0.00 C ATOM 965 O LEU A 64 11.645 3.430 -2.601 1.00 0.00 O ATOM 966 CB LEU A 64 8.658 3.682 -2.140 1.00 0.00 C ATOM 967 CG LEU A 64 7.172 4.059 -2.232 1.00 0.00 C ATOM 968 CD1 LEU A 64 6.474 3.444 -3.446 1.00 0.00 C ATOM 969 CD2 LEU A 64 6.458 3.598 -0.956 1.00 0.00 C ATOM 0 H LEU A 64 9.625 2.062 -3.961 1.00 0.00 H new ATOM 0 HA LEU A 64 9.053 4.961 -3.830 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.740 2.607 -1.980 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.092 4.168 -1.266 1.00 0.00 H new ATOM 0 HG LEU A 64 7.120 5.142 -2.344 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.427 3.747 -3.456 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.960 3.789 -4.359 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.537 2.357 -3.390 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.402 3.862 -1.014 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.556 2.517 -0.854 1.00 0.00 H new ATOM 0 HD23 LEU A 64 6.907 4.086 -0.091 1.00 0.00 H new ATOM 981 N GLU A 65 11.355 5.621 -3.052 1.00 0.00 N ATOM 982 CA GLU A 65 12.646 6.090 -2.544 1.00 0.00 C ATOM 983 C GLU A 65 12.366 6.850 -1.247 1.00 0.00 C ATOM 984 O GLU A 65 11.656 7.859 -1.261 1.00 0.00 O ATOM 985 CB GLU A 65 13.354 6.961 -3.585 1.00 0.00 C ATOM 986 CG GLU A 65 14.036 6.063 -4.625 1.00 0.00 C ATOM 987 CD GLU A 65 14.743 6.817 -5.748 1.00 0.00 C ATOM 988 OE1 GLU A 65 15.469 6.176 -6.500 1.00 0.00 O ATOM 989 OE2 GLU A 65 14.546 8.160 -5.848 1.00 0.00 O ATOM 0 H GLU A 65 10.799 6.363 -3.476 1.00 0.00 H new ATOM 0 HA GLU A 65 13.319 5.256 -2.344 1.00 0.00 H new ATOM 0 HB2 GLU A 65 12.636 7.620 -4.073 1.00 0.00 H new ATOM 0 HB3 GLU A 65 14.093 7.599 -3.099 1.00 0.00 H new ATOM 0 HG2 GLU A 65 14.762 5.428 -4.118 1.00 0.00 H new ATOM 0 HG3 GLU A 65 13.287 5.403 -5.063 1.00 0.00 H new ATOM 997 N ILE A 66 12.914 6.352 -0.134 1.00 0.00 N ATOM 998 CA ILE A 66 12.608 6.819 1.208 1.00 0.00 C ATOM 999 C ILE A 66 13.836 7.271 2.016 1.00 0.00 C ATOM 1000 O ILE A 66 14.866 6.592 2.007 1.00 0.00 O ATOM 1001 CB ILE A 66 11.909 5.647 1.926 1.00 0.00 C ATOM 1002 CG1 ILE A 66 10.480 5.503 1.370 1.00 0.00 C ATOM 1003 CG2 ILE A 66 11.919 5.837 3.451 1.00 0.00 C ATOM 1004 CD1 ILE A 66 9.645 4.478 2.135 1.00 0.00 C ATOM 0 H ILE A 66 13.598 5.595 -0.149 1.00 0.00 H new ATOM 0 HA ILE A 66 11.981 7.707 1.132 1.00 0.00 H new ATOM 0 HB ILE A 66 12.456 4.724 1.733 1.00 0.00 H new ATOM 0 HG12 ILE A 66 9.981 6.472 1.408 1.00 0.00 H new ATOM 0 HG13 ILE A 66 10.531 5.212 0.321 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.418 4.993 3.926 1.00 0.00 H new ATOM 0 HG22 ILE A 66 12.949 5.894 3.804 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.397 6.759 3.706 1.00 0.00 H new ATOM 0 HD11 ILE A 66 8.648 4.421 1.697 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.124 3.501 2.075 1.00 0.00 H new ATOM 0 HD13 ILE A 66 9.566 4.780 3.179 1.00 0.00 H new ATOM 1016 N PRO A 67 13.722 8.387 2.762 1.00 0.00 N ATOM 1017 CA PRO A 67 14.719 8.781 3.745 1.00 0.00 C ATOM 1018 C PRO A 67 14.704 7.776 4.910 1.00 0.00 C ATOM 1019 O PRO A 67 13.661 7.535 5.516 1.00 0.00 O ATOM 1020 CB PRO A 67 14.309 10.176 4.238 1.00 0.00 C ATOM 1021 CG PRO A 67 13.415 10.712 3.123 1.00 0.00 C ATOM 1022 CD PRO A 67 12.748 9.454 2.576 1.00 0.00 C ATOM 0 HA PRO A 67 15.724 8.797 3.324 1.00 0.00 H new ATOM 0 HB2 PRO A 67 13.776 10.123 5.187 1.00 0.00 H new ATOM 0 HB3 PRO A 67 15.178 10.815 4.396 1.00 0.00 H new ATOM 0 HG2 PRO A 67 12.682 11.424 3.502 1.00 0.00 H new ATOM 0 HG3 PRO A 67 13.993 11.227 2.356 1.00 0.00 H new ATOM 0 HD2 PRO A 67 11.822 9.237 3.108 1.00 0.00 H new ATOM 0 HD3 PRO A 67 12.491 9.572 1.523 1.00 0.00 H new ATOM 1030 N ALA A 68 15.850 7.183 5.239 1.00 0.00 N ATOM 1031 CA ALA A 68 16.000 6.300 6.388 1.00 0.00 C ATOM 1032 C ALA A 68 15.422 6.935 7.653 1.00 0.00 C ATOM 1033 O ALA A 68 15.663 8.111 7.928 1.00 0.00 O ATOM 1034 CB ALA A 68 17.476 5.940 6.576 1.00 0.00 C ATOM 0 H ALA A 68 16.711 7.306 4.706 1.00 0.00 H new ATOM 0 HA ALA A 68 15.438 5.385 6.200 1.00 0.00 H new ATOM 0 HB1 ALA A 68 17.583 5.280 7.437 1.00 0.00 H new ATOM 0 HB2 ALA A 68 17.844 5.435 5.683 1.00 0.00 H new ATOM 0 HB3 ALA A 68 18.054 6.849 6.743 1.00 0.00 H new ATOM 1040 N GLY A 69 14.634 6.167 8.409 1.00 0.00 N ATOM 1041 CA GLY A 69 13.968 6.670 9.599 1.00 0.00 C ATOM 1042 C GLY A 69 12.789 7.595 9.283 1.00 0.00 C ATOM 1043 O GLY A 69 12.291 8.260 10.188 1.00 0.00 O ATOM 0 H GLY A 69 14.444 5.185 8.210 1.00 0.00 H new ATOM 0 HA2 GLY A 69 13.612 5.828 10.192 1.00 0.00 H new ATOM 0 HA3 GLY A 69 14.691 7.209 10.212 1.00 0.00 H new ATOM 1047 N ALA A 70 12.323 7.660 8.030 1.00 0.00 N ATOM 1048 CA ALA A 70 11.118 8.413 7.718 1.00 0.00 C ATOM 1049 C ALA A 70 9.917 7.802 8.431 1.00 0.00 C ATOM 1050 O ALA A 70 9.859 6.588 8.606 1.00 0.00 O ATOM 1051 CB ALA A 70 10.848 8.412 6.216 1.00 0.00 C ATOM 0 H ALA A 70 12.761 7.204 7.229 1.00 0.00 H new ATOM 0 HA ALA A 70 11.270 9.438 8.055 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.942 8.981 6.009 1.00 0.00 H new ATOM 0 HB2 ALA A 70 11.690 8.867 5.695 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.719 7.386 5.870 1.00 0.00 H new ATOM 1057 N THR A 71 8.935 8.629 8.798 1.00 0.00 N ATOM 1058 CA THR A 71 7.702 8.123 9.379 1.00 0.00 C ATOM 1059 C THR A 71 6.778 7.701 8.237 1.00 0.00 C ATOM 1060 O THR A 71 5.994 8.498 7.719 1.00 0.00 O ATOM 1061 CB THR A 71 7.098 9.154 10.339 1.00 0.00 C ATOM 1062 OG1 THR A 71 8.082 9.514 11.292 1.00 0.00 O ATOM 1063 CG2 THR A 71 5.915 8.551 11.099 1.00 0.00 C ATOM 0 H THR A 71 8.974 9.644 8.702 1.00 0.00 H new ATOM 0 HA THR A 71 7.880 7.242 9.995 1.00 0.00 H new ATOM 0 HB THR A 71 6.763 10.016 9.762 1.00 0.00 H new ATOM 0 HG1 THR A 71 8.195 8.785 11.937 1.00 0.00 H new ATOM 0 HG21 THR A 71 5.499 9.297 11.776 1.00 0.00 H new ATOM 0 HG22 THR A 71 5.149 8.237 10.390 1.00 0.00 H new ATOM 0 HG23 THR A 71 6.253 7.689 11.674 1.00 0.00 H new ATOM 1071 N VAL A 72 6.885 6.431 7.845 1.00 0.00 N ATOM 1072 CA VAL A 72 6.183 5.853 6.717 1.00 0.00 C ATOM 1073 C VAL A 72 4.754 5.586 7.140 1.00 0.00 C ATOM 1074 O VAL A 72 4.474 4.591 7.801 1.00 0.00 O ATOM 1075 CB VAL A 72 6.901 4.581 6.238 1.00 0.00 C ATOM 1076 CG1 VAL A 72 6.140 3.920 5.082 1.00 0.00 C ATOM 1077 CG2 VAL A 72 8.283 4.973 5.719 1.00 0.00 C ATOM 0 H VAL A 72 7.485 5.760 8.325 1.00 0.00 H new ATOM 0 HA VAL A 72 6.174 6.539 5.870 1.00 0.00 H new ATOM 0 HB VAL A 72 6.963 3.883 7.073 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.670 3.023 4.763 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.137 3.650 5.414 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.071 4.617 4.247 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.808 4.082 5.374 1.00 0.00 H new ATOM 0 HG22 VAL A 72 8.175 5.674 4.891 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.853 5.443 6.521 1.00 0.00 H new ATOM 1087 N ASP A 73 3.871 6.511 6.768 1.00 0.00 N ATOM 1088 CA ASP A 73 2.447 6.443 7.019 1.00 0.00 C ATOM 1089 C ASP A 73 1.787 5.892 5.763 1.00 0.00 C ATOM 1090 O ASP A 73 1.680 6.599 4.757 1.00 0.00 O ATOM 1091 CB ASP A 73 1.929 7.834 7.385 1.00 0.00 C ATOM 1092 CG ASP A 73 2.514 8.290 8.711 1.00 0.00 C ATOM 1093 OD1 ASP A 73 2.067 7.812 9.752 1.00 0.00 O ATOM 1094 OD2 ASP A 73 3.524 9.201 8.649 1.00 0.00 O ATOM 0 H ASP A 73 4.145 7.356 6.266 1.00 0.00 H new ATOM 0 HA ASP A 73 2.214 5.786 7.857 1.00 0.00 H new ATOM 0 HB2 ASP A 73 2.193 8.544 6.601 1.00 0.00 H new ATOM 0 HB3 ASP A 73 0.841 7.818 7.448 1.00 0.00 H new ATOM 1100 N VAL A 74 1.388 4.622 5.812 1.00 0.00 N ATOM 1101 CA VAL A 74 0.748 3.944 4.699 1.00 0.00 C ATOM 1102 C VAL A 74 -0.755 4.167 4.824 1.00 0.00 C ATOM 1103 O VAL A 74 -1.462 3.405 5.487 1.00 0.00 O ATOM 1104 CB VAL A 74 1.142 2.461 4.667 1.00 0.00 C ATOM 1105 CG1 VAL A 74 0.567 1.777 3.418 1.00 0.00 C ATOM 1106 CG2 VAL A 74 2.667 2.300 4.673 1.00 0.00 C ATOM 0 H VAL A 74 1.504 4.033 6.637 1.00 0.00 H new ATOM 0 HA VAL A 74 1.081 4.351 3.744 1.00 0.00 H new ATOM 0 HB VAL A 74 0.731 1.990 5.560 1.00 0.00 H new ATOM 0 HG11 VAL A 74 0.857 0.726 3.413 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -0.520 1.854 3.429 1.00 0.00 H new ATOM 0 HG13 VAL A 74 0.956 2.265 2.524 1.00 0.00 H new ATOM 0 HG21 VAL A 74 2.921 1.240 4.650 1.00 0.00 H new ATOM 0 HG22 VAL A 74 3.088 2.793 3.797 1.00 0.00 H new ATOM 0 HG23 VAL A 74 3.077 2.752 5.576 1.00 0.00 H new ATOM 1116 N THR A 75 -1.229 5.235 4.185 1.00 0.00 N ATOM 1117 CA THR A 75 -2.634 5.564 4.079 1.00 0.00 C ATOM 1118 C THR A 75 -3.234 4.692 2.977 1.00 0.00 C ATOM 1119 O THR A 75 -3.260 5.080 1.812 1.00 0.00 O ATOM 1120 CB THR A 75 -2.789 7.066 3.813 1.00 0.00 C ATOM 1121 OG1 THR A 75 -2.317 7.777 4.939 1.00 0.00 O ATOM 1122 CG2 THR A 75 -4.242 7.489 3.577 1.00 0.00 C ATOM 0 H THR A 75 -0.623 5.909 3.717 1.00 0.00 H new ATOM 0 HA THR A 75 -3.172 5.359 5.005 1.00 0.00 H new ATOM 0 HB THR A 75 -2.221 7.288 2.910 1.00 0.00 H new ATOM 0 HG1 THR A 75 -2.980 7.727 5.659 1.00 0.00 H new ATOM 0 HG21 THR A 75 -4.283 8.563 3.395 1.00 0.00 H new ATOM 0 HG22 THR A 75 -4.639 6.959 2.712 1.00 0.00 H new ATOM 0 HG23 THR A 75 -4.839 7.247 4.456 1.00 0.00 H new ATOM 1130 N PHE A 76 -3.688 3.494 3.333 1.00 0.00 N ATOM 1131 CA PHE A 76 -4.419 2.647 2.407 1.00 0.00 C ATOM 1132 C PHE A 76 -5.857 3.103 2.317 1.00 0.00 C ATOM 1133 O PHE A 76 -6.454 3.318 3.360 1.00 0.00 O ATOM 1134 CB PHE A 76 -4.598 1.219 2.950 1.00 0.00 C ATOM 1135 CG PHE A 76 -3.592 0.139 2.618 1.00 0.00 C ATOM 1136 CD1 PHE A 76 -3.345 -0.077 1.245 1.00 0.00 C ATOM 1137 CD2 PHE A 76 -3.570 -0.974 3.483 1.00 0.00 C ATOM 1138 CE1 PHE A 76 -3.403 -1.376 0.714 1.00 0.00 C ATOM 1139 CE2 PHE A 76 -3.592 -2.277 2.956 1.00 0.00 C ATOM 1140 CZ PHE A 76 -3.649 -2.462 1.566 1.00 0.00 C ATOM 0 H PHE A 76 -3.560 3.090 4.261 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.854 2.690 1.476 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.645 1.292 4.037 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.572 0.866 2.612 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -3.111 0.758 0.602 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -3.536 -0.825 4.552 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.259 -1.537 -0.344 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.565 -3.131 3.617 1.00 0.00 H new ATOM 0 HZ PHE A 76 -3.881 -3.434 1.156 1.00 0.00 H new ATOM 1150 N ILE A 77 -6.416 3.119 1.110 1.00 0.00 N ATOM 1151 CA ILE A 77 -7.842 3.200 0.851 1.00 0.00 C ATOM 1152 C ILE A 77 -8.088 1.866 0.135 1.00 0.00 C ATOM 1153 O ILE A 77 -8.315 1.798 -1.074 1.00 0.00 O ATOM 1154 CB ILE A 77 -8.251 4.450 0.049 1.00 0.00 C ATOM 1155 CG1 ILE A 77 -8.067 5.726 0.889 1.00 0.00 C ATOM 1156 CG2 ILE A 77 -9.744 4.371 -0.295 1.00 0.00 C ATOM 1157 CD1 ILE A 77 -6.719 6.395 0.635 1.00 0.00 C ATOM 0 H ILE A 77 -5.862 3.074 0.255 1.00 0.00 H new ATOM 0 HA ILE A 77 -8.456 3.326 1.743 1.00 0.00 H new ATOM 0 HB ILE A 77 -7.627 4.486 -0.844 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -8.868 6.429 0.659 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -8.154 5.478 1.947 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -10.034 5.255 -0.862 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -9.933 3.479 -0.892 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -10.327 4.323 0.625 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -6.636 7.291 1.250 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.916 5.704 0.890 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -6.641 6.669 -0.417 1.00 0.00 H new ATOM 1169 N ASN A 78 -7.951 0.762 0.875 1.00 0.00 N ATOM 1170 CA ASN A 78 -8.020 -0.581 0.308 1.00 0.00 C ATOM 1171 C ASN A 78 -9.486 -0.998 0.219 1.00 0.00 C ATOM 1172 O ASN A 78 -9.911 -2.013 0.771 1.00 0.00 O ATOM 1173 CB ASN A 78 -7.099 -1.532 1.087 1.00 0.00 C ATOM 1174 CG ASN A 78 -6.921 -2.883 0.413 1.00 0.00 C ATOM 1175 OD1 ASN A 78 -5.904 -3.111 -0.229 1.00 0.00 O ATOM 1176 ND2 ASN A 78 -7.867 -3.801 0.568 1.00 0.00 N ATOM 0 H ASN A 78 -7.790 0.778 1.882 1.00 0.00 H new ATOM 0 HA ASN A 78 -7.638 -0.615 -0.712 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -6.123 -1.063 1.208 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -7.506 -1.683 2.087 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -7.756 -4.723 0.147 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -8.705 -3.584 1.108 1.00 0.00 H new ATOM 1183 N THR A 79 -10.274 -0.174 -0.475 1.00 0.00 N ATOM 1184 CA THR A 79 -11.706 -0.363 -0.614 1.00 0.00 C ATOM 1185 C THR A 79 -11.994 -1.300 -1.779 1.00 0.00 C ATOM 1186 O THR A 79 -12.520 -0.889 -2.812 1.00 0.00 O ATOM 1187 CB THR A 79 -12.413 0.996 -0.715 1.00 0.00 C ATOM 1188 OG1 THR A 79 -12.214 1.666 0.510 1.00 0.00 O ATOM 1189 CG2 THR A 79 -13.917 0.849 -0.997 1.00 0.00 C ATOM 0 H THR A 79 -9.924 0.652 -0.960 1.00 0.00 H new ATOM 0 HA THR A 79 -12.113 -0.846 0.274 1.00 0.00 H new ATOM 0 HB THR A 79 -11.994 1.558 -1.550 1.00 0.00 H new ATOM 0 HG1 THR A 79 -11.446 1.274 0.976 1.00 0.00 H new ATOM 0 HG21 THR A 79 -14.374 1.837 -1.060 1.00 0.00 H new ATOM 0 HG22 THR A 79 -14.061 0.322 -1.940 1.00 0.00 H new ATOM 0 HG23 THR A 79 -14.385 0.284 -0.191 1.00 0.00 H new ATOM 1197 N ASN A 80 -11.651 -2.573 -1.592 1.00 0.00 N ATOM 1198 CA ASN A 80 -12.023 -3.607 -2.541 1.00 0.00 C ATOM 1199 C ASN A 80 -13.281 -4.302 -2.030 1.00 0.00 C ATOM 1200 O ASN A 80 -13.586 -4.269 -0.839 1.00 0.00 O ATOM 1201 CB ASN A 80 -10.890 -4.603 -2.763 1.00 0.00 C ATOM 1202 CG ASN A 80 -11.281 -5.607 -3.845 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -11.983 -5.275 -4.795 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -10.866 -6.854 -3.709 1.00 0.00 N ATOM 0 H ASN A 80 -11.116 -2.908 -0.791 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.224 -3.151 -3.510 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -9.983 -4.075 -3.056 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.668 -5.126 -1.833 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -11.129 -7.557 -4.400 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -10.283 -7.114 -2.913 1.00 0.00 H new ATOM 1211 N LYS A 81 -14.022 -4.915 -2.946 1.00 0.00 N ATOM 1212 CA LYS A 81 -15.265 -5.598 -2.671 1.00 0.00 C ATOM 1213 C LYS A 81 -14.923 -7.073 -2.427 1.00 0.00 C ATOM 1214 O LYS A 81 -14.289 -7.715 -3.268 1.00 0.00 O ATOM 1215 CB LYS A 81 -16.205 -5.417 -3.873 1.00 0.00 C ATOM 1216 CG LYS A 81 -16.877 -4.032 -3.951 1.00 0.00 C ATOM 1217 CD LYS A 81 -15.954 -2.801 -3.983 1.00 0.00 C ATOM 1218 CE LYS A 81 -15.006 -2.765 -5.191 1.00 0.00 C ATOM 1219 NZ LYS A 81 -14.102 -1.601 -5.120 1.00 0.00 N ATOM 0 H LYS A 81 -13.759 -4.947 -3.931 1.00 0.00 H new ATOM 0 HA LYS A 81 -15.774 -5.198 -1.794 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -15.640 -5.586 -4.790 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -16.980 -6.182 -3.831 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -17.501 -4.009 -4.845 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -17.544 -3.932 -3.094 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -16.567 -1.900 -3.988 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -15.362 -2.779 -3.068 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.420 -3.683 -5.225 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -15.587 -2.723 -6.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.282 -1.760 -5.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.610 -0.748 -5.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -13.776 -1.474 -4.141 1.00 0.00 H new ATOM 1233 N GLY A 82 -15.317 -7.617 -1.274 1.00 0.00 N ATOM 1234 CA GLY A 82 -15.151 -9.027 -0.949 1.00 0.00 C ATOM 1235 C GLY A 82 -13.705 -9.376 -0.589 1.00 0.00 C ATOM 1236 O GLY A 82 -13.401 -9.693 0.561 1.00 0.00 O ATOM 0 H GLY A 82 -15.766 -7.080 -0.532 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -15.803 -9.284 -0.114 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -15.468 -9.633 -1.798 1.00 0.00 H new ATOM 1240 N PHE A 83 -12.801 -9.324 -1.567 1.00 0.00 N ATOM 1241 CA PHE A 83 -11.421 -9.751 -1.377 1.00 0.00 C ATOM 1242 C PHE A 83 -10.631 -8.660 -0.657 1.00 0.00 C ATOM 1243 O PHE A 83 -9.904 -7.885 -1.285 1.00 0.00 O ATOM 1244 CB PHE A 83 -10.775 -10.144 -2.709 1.00 0.00 C ATOM 1245 CG PHE A 83 -11.270 -11.452 -3.295 1.00 0.00 C ATOM 1246 CD1 PHE A 83 -12.466 -11.495 -4.036 1.00 0.00 C ATOM 1247 CD2 PHE A 83 -10.520 -12.630 -3.112 1.00 0.00 C ATOM 1248 CE1 PHE A 83 -12.885 -12.698 -4.630 1.00 0.00 C ATOM 1249 CE2 PHE A 83 -10.942 -13.834 -3.703 1.00 0.00 C ATOM 1250 CZ PHE A 83 -12.119 -13.866 -4.469 1.00 0.00 C ATOM 0 H PHE A 83 -13.006 -8.986 -2.507 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.411 -10.642 -0.749 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -10.953 -9.348 -3.432 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -9.696 -10.211 -2.568 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -13.063 -10.602 -4.148 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -9.619 -12.608 -2.517 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -13.796 -12.725 -5.210 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -10.361 -14.734 -3.568 1.00 0.00 H new ATOM 0 HZ PHE A 83 -12.436 -14.788 -4.934 1.00 0.00 H new ATOM 1260 N GLY A 84 -10.784 -8.628 0.667 1.00 0.00 N ATOM 1261 CA GLY A 84 -10.061 -7.777 1.600 1.00 0.00 C ATOM 1262 C GLY A 84 -8.546 -7.885 1.437 1.00 0.00 C ATOM 1263 O GLY A 84 -7.906 -8.608 2.188 1.00 0.00 O ATOM 0 H GLY A 84 -11.456 -9.232 1.140 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.366 -6.741 1.453 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -10.334 -8.048 2.620 1.00 0.00 H new ATOM 1267 N HIS A 85 -7.944 -7.197 0.463 1.00 0.00 N ATOM 1268 CA HIS A 85 -6.493 -7.269 0.297 1.00 0.00 C ATOM 1269 C HIS A 85 -5.761 -6.840 1.572 1.00 0.00 C ATOM 1270 O HIS A 85 -6.325 -6.189 2.453 1.00 0.00 O ATOM 1271 CB HIS A 85 -5.998 -6.433 -0.884 1.00 0.00 C ATOM 1272 CG HIS A 85 -6.712 -6.670 -2.181 1.00 0.00 C ATOM 1273 ND1 HIS A 85 -6.329 -7.553 -3.185 1.00 0.00 N ATOM 1274 CD2 HIS A 85 -7.765 -5.924 -2.622 1.00 0.00 C ATOM 1275 CE1 HIS A 85 -7.168 -7.334 -4.205 1.00 0.00 C ATOM 1276 NE2 HIS A 85 -8.039 -6.363 -3.893 1.00 0.00 N ATOM 0 H HIS A 85 -8.426 -6.598 -0.207 1.00 0.00 H new ATOM 0 HA HIS A 85 -6.265 -8.315 0.090 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -6.090 -5.378 -0.625 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -4.937 -6.634 -1.031 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -5.566 -8.229 -3.151 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -8.280 -5.144 -2.080 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.147 -7.864 -5.146 1.00 0.00 H new ATOM 1284 N SER A 86 -4.486 -7.214 1.638 1.00 0.00 N ATOM 1285 CA SER A 86 -3.564 -6.876 2.699 1.00 0.00 C ATOM 1286 C SER A 86 -2.384 -6.140 2.062 1.00 0.00 C ATOM 1287 O SER A 86 -2.207 -6.239 0.849 1.00 0.00 O ATOM 1288 CB SER A 86 -3.120 -8.193 3.346 1.00 0.00 C ATOM 1289 OG SER A 86 -2.390 -9.008 2.441 1.00 0.00 O ATOM 0 H SER A 86 -4.055 -7.789 0.914 1.00 0.00 H new ATOM 0 HA SER A 86 -4.007 -6.236 3.462 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.504 -7.979 4.219 1.00 0.00 H new ATOM 0 HB3 SER A 86 -3.996 -8.737 3.699 1.00 0.00 H new ATOM 0 HG SER A 86 -1.458 -9.072 2.737 1.00 0.00 H new ATOM 1295 N PHE A 87 -1.601 -5.394 2.848 1.00 0.00 N ATOM 1296 CA PHE A 87 -0.352 -4.769 2.418 1.00 0.00 C ATOM 1297 C PHE A 87 0.681 -5.189 3.442 1.00 0.00 C ATOM 1298 O PHE A 87 0.580 -4.770 4.596 1.00 0.00 O ATOM 1299 CB PHE A 87 -0.459 -3.247 2.377 1.00 0.00 C ATOM 1300 CG PHE A 87 0.680 -2.512 1.693 1.00 0.00 C ATOM 1301 CD1 PHE A 87 1.873 -2.245 2.390 1.00 0.00 C ATOM 1302 CD2 PHE A 87 0.483 -1.955 0.413 1.00 0.00 C ATOM 1303 CE1 PHE A 87 2.830 -1.375 1.837 1.00 0.00 C ATOM 1304 CE2 PHE A 87 1.451 -1.105 -0.146 1.00 0.00 C ATOM 1305 CZ PHE A 87 2.615 -0.798 0.575 1.00 0.00 C ATOM 0 H PHE A 87 -1.826 -5.205 3.825 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.092 -5.082 1.407 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -1.389 -2.983 1.873 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -0.536 -2.881 3.401 1.00 0.00 H new ATOM 0 HD1 PHE A 87 2.054 -2.708 3.349 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -0.416 -2.183 -0.140 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.733 -1.150 2.385 1.00 0.00 H new ATOM 0 HE2 PHE A 87 1.300 -0.688 -1.131 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.345 -0.119 0.160 1.00 0.00 H new ATOM 1315 N ASP A 88 1.624 -6.042 3.053 1.00 0.00 N ATOM 1316 CA ASP A 88 2.588 -6.647 3.953 1.00 0.00 C ATOM 1317 C ASP A 88 3.988 -6.391 3.413 1.00 0.00 C ATOM 1318 O ASP A 88 4.240 -6.622 2.231 1.00 0.00 O ATOM 1319 CB ASP A 88 2.244 -8.131 4.112 1.00 0.00 C ATOM 1320 CG ASP A 88 0.809 -8.278 4.597 1.00 0.00 C ATOM 1321 OD1 ASP A 88 -0.043 -8.738 3.841 1.00 0.00 O ATOM 1322 OD2 ASP A 88 0.550 -7.811 5.844 1.00 0.00 O ATOM 0 H ASP A 88 1.738 -6.335 2.083 1.00 0.00 H new ATOM 0 HA ASP A 88 2.553 -6.208 4.950 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.371 -8.647 3.160 1.00 0.00 H new ATOM 0 HB3 ASP A 88 2.927 -8.598 4.821 1.00 0.00 H new ATOM 1328 N ILE A 89 4.864 -5.873 4.277 1.00 0.00 N ATOM 1329 CA ILE A 89 6.206 -5.418 3.961 1.00 0.00 C ATOM 1330 C ILE A 89 7.237 -6.416 4.492 1.00 0.00 C ATOM 1331 O ILE A 89 7.165 -6.864 5.639 1.00 0.00 O ATOM 1332 CB ILE A 89 6.445 -4.005 4.532 1.00 0.00 C ATOM 1333 CG1 ILE A 89 5.304 -3.046 4.138 1.00 0.00 C ATOM 1334 CG2 ILE A 89 7.796 -3.481 4.033 1.00 0.00 C ATOM 1335 CD1 ILE A 89 5.545 -1.602 4.597 1.00 0.00 C ATOM 0 H ILE A 89 4.638 -5.757 5.265 1.00 0.00 H new ATOM 0 HA ILE A 89 6.317 -5.360 2.878 1.00 0.00 H new ATOM 0 HB ILE A 89 6.460 -4.060 5.621 1.00 0.00 H new ATOM 0 HG12 ILE A 89 5.183 -3.061 3.055 1.00 0.00 H new ATOM 0 HG13 ILE A 89 4.370 -3.406 4.568 1.00 0.00 H new ATOM 0 HG21 ILE A 89 7.970 -2.482 4.434 1.00 0.00 H new ATOM 0 HG22 ILE A 89 8.591 -4.149 4.366 1.00 0.00 H new ATOM 0 HG23 ILE A 89 7.790 -3.439 2.944 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.706 -0.978 4.289 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.637 -1.576 5.683 1.00 0.00 H new ATOM 0 HD13 ILE A 89 6.463 -1.225 4.146 1.00 0.00 H new ATOM 1347 N THR A 90 8.219 -6.748 3.657 1.00 0.00 N ATOM 1348 CA THR A 90 9.323 -7.629 4.000 1.00 0.00 C ATOM 1349 C THR A 90 10.464 -7.322 3.031 1.00 0.00 C ATOM 1350 O THR A 90 10.547 -6.189 2.571 1.00 0.00 O ATOM 1351 CB THR A 90 8.834 -9.085 4.016 1.00 0.00 C ATOM 1352 OG1 THR A 90 9.894 -9.986 4.277 1.00 0.00 O ATOM 1353 CG2 THR A 90 8.135 -9.503 2.716 1.00 0.00 C ATOM 0 H THR A 90 8.266 -6.400 2.699 1.00 0.00 H new ATOM 0 HA THR A 90 9.710 -7.464 5.005 1.00 0.00 H new ATOM 0 HB THR A 90 8.102 -9.132 4.822 1.00 0.00 H new ATOM 0 HG1 THR A 90 9.790 -10.362 5.176 1.00 0.00 H new ATOM 0 HG21 THR A 90 7.814 -10.542 2.793 1.00 0.00 H new ATOM 0 HG22 THR A 90 7.266 -8.866 2.549 1.00 0.00 H new ATOM 0 HG23 THR A 90 8.827 -9.398 1.881 1.00 0.00 H new ATOM 1361 N LYS A 91 11.344 -8.277 2.722 1.00 0.00 N ATOM 1362 CA LYS A 91 12.500 -8.038 1.857 1.00 0.00 C ATOM 1363 C LYS A 91 12.591 -9.019 0.682 1.00 0.00 C ATOM 1364 O LYS A 91 13.591 -9.027 -0.032 1.00 0.00 O ATOM 1365 CB LYS A 91 13.790 -8.037 2.692 1.00 0.00 C ATOM 1366 CG LYS A 91 13.743 -6.973 3.798 1.00 0.00 C ATOM 1367 CD LYS A 91 15.120 -6.688 4.409 1.00 0.00 C ATOM 1368 CE LYS A 91 15.712 -7.918 5.104 1.00 0.00 C ATOM 1369 NZ LYS A 91 16.968 -7.585 5.797 1.00 0.00 N ATOM 0 H LYS A 91 11.275 -9.236 3.064 1.00 0.00 H new ATOM 0 HA LYS A 91 12.367 -7.055 1.406 1.00 0.00 H new ATOM 0 HB2 LYS A 91 13.937 -9.021 3.138 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.645 -7.851 2.042 1.00 0.00 H new ATOM 0 HG2 LYS A 91 13.334 -6.049 3.389 1.00 0.00 H new ATOM 0 HG3 LYS A 91 13.063 -7.302 4.584 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.800 -6.353 3.626 1.00 0.00 H new ATOM 0 HD3 LYS A 91 15.035 -5.873 5.128 1.00 0.00 H new ATOM 0 HE2 LYS A 91 14.993 -8.316 5.820 1.00 0.00 H new ATOM 0 HE3 LYS A 91 15.896 -8.701 4.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 17.346 -8.437 6.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.661 -7.228 5.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 16.785 -6.855 6.515 1.00 0.00 H new ATOM 1383 N LYS A 92 11.558 -9.834 0.450 1.00 0.00 N ATOM 1384 CA LYS A 92 11.517 -10.685 -0.731 1.00 0.00 C ATOM 1385 C LYS A 92 11.451 -9.795 -1.972 1.00 0.00 C ATOM 1386 O LYS A 92 10.523 -9.002 -2.102 1.00 0.00 O ATOM 1387 CB LYS A 92 10.286 -11.606 -0.682 1.00 0.00 C ATOM 1388 CG LYS A 92 10.554 -12.921 0.057 1.00 0.00 C ATOM 1389 CD LYS A 92 11.504 -13.895 -0.666 1.00 0.00 C ATOM 1390 CE LYS A 92 11.031 -14.321 -2.067 1.00 0.00 C ATOM 1391 NZ LYS A 92 11.537 -13.440 -3.138 1.00 0.00 N ATOM 0 H LYS A 92 10.747 -9.919 1.063 1.00 0.00 H new ATOM 0 HA LYS A 92 12.411 -11.308 -0.765 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.465 -11.081 -0.193 1.00 0.00 H new ATOM 0 HB3 LYS A 92 9.963 -11.826 -1.699 1.00 0.00 H new ATOM 0 HG2 LYS A 92 10.972 -12.690 1.037 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.602 -13.425 0.227 1.00 0.00 H new ATOM 0 HD2 LYS A 92 12.485 -13.429 -0.753 1.00 0.00 H new ATOM 0 HD3 LYS A 92 11.628 -14.786 -0.051 1.00 0.00 H new ATOM 0 HE2 LYS A 92 11.358 -15.343 -2.260 1.00 0.00 H new ATOM 0 HE3 LYS A 92 9.941 -14.325 -2.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 10.778 -12.800 -3.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.337 -12.881 -2.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 11.853 -14.018 -3.943 1.00 0.00 H new ATOM 1405 N GLY A 93 12.418 -9.918 -2.880 1.00 0.00 N ATOM 1406 CA GLY A 93 12.377 -9.214 -4.153 1.00 0.00 C ATOM 1407 C GLY A 93 11.465 -9.952 -5.138 1.00 0.00 C ATOM 1408 O GLY A 93 11.096 -11.100 -4.886 1.00 0.00 O ATOM 0 H GLY A 93 13.243 -10.504 -2.753 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.014 -8.197 -4.003 1.00 0.00 H new ATOM 0 HA3 GLY A 93 13.383 -9.136 -4.566 1.00 0.00 H new ATOM 1412 N PRO A 94 11.091 -9.310 -6.254 1.00 0.00 N ATOM 1413 CA PRO A 94 10.336 -9.952 -7.318 1.00 0.00 C ATOM 1414 C PRO A 94 11.227 -10.980 -8.035 1.00 0.00 C ATOM 1415 O PRO A 94 12.452 -10.891 -7.942 1.00 0.00 O ATOM 1416 CB PRO A 94 9.935 -8.810 -8.262 1.00 0.00 C ATOM 1417 CG PRO A 94 11.056 -7.787 -8.073 1.00 0.00 C ATOM 1418 CD PRO A 94 11.408 -7.934 -6.593 1.00 0.00 C ATOM 0 HA PRO A 94 9.462 -10.492 -6.953 1.00 0.00 H new ATOM 0 HB2 PRO A 94 9.869 -9.148 -9.296 1.00 0.00 H new ATOM 0 HB3 PRO A 94 8.962 -8.394 -8.000 1.00 0.00 H new ATOM 0 HG2 PRO A 94 11.911 -8.001 -8.715 1.00 0.00 H new ATOM 0 HG3 PRO A 94 10.725 -6.776 -8.311 1.00 0.00 H new ATOM 0 HD2 PRO A 94 12.462 -7.719 -6.417 1.00 0.00 H new ATOM 0 HD3 PRO A 94 10.834 -7.237 -5.982 1.00 0.00 H new ATOM 1426 N PRO A 95 10.649 -11.930 -8.786 1.00 0.00 N ATOM 1427 CA PRO A 95 9.222 -12.161 -8.942 1.00 0.00 C ATOM 1428 C PRO A 95 8.662 -12.873 -7.708 1.00 0.00 C ATOM 1429 O PRO A 95 9.364 -13.642 -7.053 1.00 0.00 O ATOM 1430 CB PRO A 95 9.103 -13.047 -10.185 1.00 0.00 C ATOM 1431 CG PRO A 95 10.391 -13.871 -10.142 1.00 0.00 C ATOM 1432 CD PRO A 95 11.412 -12.882 -9.575 1.00 0.00 C ATOM 0 HA PRO A 95 8.659 -11.234 -9.048 1.00 0.00 H new ATOM 0 HB2 PRO A 95 8.217 -13.680 -10.146 1.00 0.00 H new ATOM 0 HB3 PRO A 95 9.032 -12.455 -11.098 1.00 0.00 H new ATOM 0 HG2 PRO A 95 10.286 -14.751 -9.508 1.00 0.00 H new ATOM 0 HG3 PRO A 95 10.678 -14.224 -11.133 1.00 0.00 H new ATOM 0 HD2 PRO A 95 12.152 -13.394 -8.960 1.00 0.00 H new ATOM 0 HD3 PRO A 95 11.955 -12.379 -10.375 1.00 0.00 H new ATOM 1440 N TYR A 96 7.392 -12.616 -7.392 1.00 0.00 N ATOM 1441 CA TYR A 96 6.708 -13.285 -6.296 1.00 0.00 C ATOM 1442 C TYR A 96 6.051 -14.560 -6.807 1.00 0.00 C ATOM 1443 O TYR A 96 5.708 -14.669 -7.984 1.00 0.00 O ATOM 1444 CB TYR A 96 5.697 -12.340 -5.654 1.00 0.00 C ATOM 1445 CG TYR A 96 6.354 -11.089 -5.118 1.00 0.00 C ATOM 1446 CD1 TYR A 96 7.107 -11.172 -3.934 1.00 0.00 C ATOM 1447 CD2 TYR A 96 6.433 -9.932 -5.917 1.00 0.00 C ATOM 1448 CE1 TYR A 96 7.929 -10.105 -3.546 1.00 0.00 C ATOM 1449 CE2 TYR A 96 7.299 -8.888 -5.551 1.00 0.00 C ATOM 1450 CZ TYR A 96 8.058 -8.979 -4.375 1.00 0.00 C ATOM 1451 OH TYR A 96 8.950 -7.995 -4.082 1.00 0.00 O ATOM 0 H TYR A 96 6.814 -11.939 -7.890 1.00 0.00 H new ATOM 0 HA TYR A 96 7.427 -13.564 -5.526 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.940 -12.066 -6.388 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.183 -12.856 -4.843 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.052 -12.060 -3.322 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.830 -9.847 -6.809 1.00 0.00 H new ATOM 0 HE1 TYR A 96 8.464 -10.149 -2.609 1.00 0.00 H new ATOM 0 HE2 TYR A 96 7.381 -8.012 -6.178 1.00 0.00 H new ATOM 0 HH TYR A 96 9.404 -8.206 -3.240 1.00 0.00 H new ATOM 1461 N ALA A 97 5.884 -15.531 -5.912 1.00 0.00 N ATOM 1462 CA ALA A 97 5.252 -16.796 -6.232 1.00 0.00 C ATOM 1463 C ALA A 97 3.733 -16.631 -6.207 1.00 0.00 C ATOM 1464 O ALA A 97 3.200 -15.813 -5.460 1.00 0.00 O ATOM 1465 CB ALA A 97 5.713 -17.863 -5.235 1.00 0.00 C ATOM 0 H ALA A 97 6.187 -15.456 -4.941 1.00 0.00 H new ATOM 0 HA ALA A 97 5.542 -17.116 -7.233 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.238 -18.814 -5.475 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.796 -17.973 -5.294 1.00 0.00 H new ATOM 0 HB3 ALA A 97 5.433 -17.562 -4.225 1.00 0.00 H new ATOM 1471 N VAL A 98 3.037 -17.417 -7.030 1.00 0.00 N ATOM 1472 CA VAL A 98 1.581 -17.457 -7.041 1.00 0.00 C ATOM 1473 C VAL A 98 1.083 -17.887 -5.658 1.00 0.00 C ATOM 1474 O VAL A 98 0.133 -17.314 -5.126 1.00 0.00 O ATOM 1475 CB VAL A 98 1.101 -18.393 -8.164 1.00 0.00 C ATOM 1476 CG1 VAL A 98 -0.413 -18.634 -8.116 1.00 0.00 C ATOM 1477 CG2 VAL A 98 1.465 -17.807 -9.536 1.00 0.00 C ATOM 0 H VAL A 98 3.472 -18.043 -7.707 1.00 0.00 H new ATOM 0 HA VAL A 98 1.166 -16.471 -7.248 1.00 0.00 H new ATOM 0 HB VAL A 98 1.604 -19.348 -8.012 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -0.701 -19.301 -8.929 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -0.679 -19.089 -7.162 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -0.936 -17.684 -8.223 1.00 0.00 H new ATOM 0 HG21 VAL A 98 1.120 -18.479 -10.322 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.987 -16.834 -9.655 1.00 0.00 H new ATOM 0 HG23 VAL A 98 2.547 -17.691 -9.607 1.00 0.00 H new ATOM 1487 N MET A 99 1.746 -18.881 -5.061 1.00 0.00 N ATOM 1488 CA MET A 99 1.453 -19.310 -3.706 1.00 0.00 C ATOM 1489 C MET A 99 2.119 -18.303 -2.759 1.00 0.00 C ATOM 1490 O MET A 99 3.296 -17.991 -2.941 1.00 0.00 O ATOM 1491 CB MET A 99 1.991 -20.729 -3.469 1.00 0.00 C ATOM 1492 CG MET A 99 1.273 -21.793 -4.315 1.00 0.00 C ATOM 1493 SD MET A 99 1.718 -21.870 -6.072 1.00 0.00 S ATOM 1494 CE MET A 99 0.645 -23.218 -6.611 1.00 0.00 C ATOM 0 H MET A 99 2.498 -19.405 -5.509 1.00 0.00 H new ATOM 0 HA MET A 99 0.378 -19.341 -3.529 1.00 0.00 H new ATOM 0 HB2 MET A 99 3.057 -20.750 -3.697 1.00 0.00 H new ATOM 0 HB3 MET A 99 1.885 -20.980 -2.414 1.00 0.00 H new ATOM 0 HG2 MET A 99 1.468 -22.769 -3.871 1.00 0.00 H new ATOM 0 HG3 MET A 99 0.200 -21.618 -4.243 1.00 0.00 H new ATOM 0 HE1 MET A 99 0.793 -23.398 -7.676 1.00 0.00 H new ATOM 0 HE2 MET A 99 0.889 -24.122 -6.053 1.00 0.00 H new ATOM 0 HE3 MET A 99 -0.396 -22.949 -6.430 1.00 0.00 H new ATOM 1504 N PRO A 100 1.399 -17.767 -1.763 1.00 0.00 N ATOM 1505 CA PRO A 100 1.926 -16.733 -0.893 1.00 0.00 C ATOM 1506 C PRO A 100 2.913 -17.345 0.101 1.00 0.00 C ATOM 1507 O PRO A 100 2.571 -17.641 1.245 1.00 0.00 O ATOM 1508 CB PRO A 100 0.696 -16.103 -0.236 1.00 0.00 C ATOM 1509 CG PRO A 100 -0.296 -17.261 -0.168 1.00 0.00 C ATOM 1510 CD PRO A 100 0.007 -18.045 -1.447 1.00 0.00 C ATOM 0 HA PRO A 100 2.496 -15.966 -1.417 1.00 0.00 H new ATOM 0 HB2 PRO A 100 0.925 -15.711 0.755 1.00 0.00 H new ATOM 0 HB3 PRO A 100 0.306 -15.273 -0.825 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -0.146 -17.869 0.724 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.327 -16.909 -0.145 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -0.154 -19.113 -1.298 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.648 -17.734 -2.261 1.00 0.00 H new ATOM 1518 N VAL A 101 4.172 -17.484 -0.322 1.00 0.00 N ATOM 1519 CA VAL A 101 5.234 -17.954 0.553 1.00 0.00 C ATOM 1520 C VAL A 101 5.597 -16.764 1.444 1.00 0.00 C ATOM 1521 O VAL A 101 6.529 -15.999 1.174 1.00 0.00 O ATOM 1522 CB VAL A 101 6.427 -18.487 -0.266 1.00 0.00 C ATOM 1523 CG1 VAL A 101 7.521 -19.035 0.662 1.00 0.00 C ATOM 1524 CG2 VAL A 101 5.987 -19.627 -1.196 1.00 0.00 C ATOM 0 H VAL A 101 4.476 -17.275 -1.273 1.00 0.00 H new ATOM 0 HA VAL A 101 4.921 -18.798 1.168 1.00 0.00 H new ATOM 0 HB VAL A 101 6.812 -17.653 -0.852 1.00 0.00 H new ATOM 0 HG11 VAL A 101 8.353 -19.406 0.064 1.00 0.00 H new ATOM 0 HG12 VAL A 101 7.873 -18.240 1.319 1.00 0.00 H new ATOM 0 HG13 VAL A 101 7.115 -19.849 1.262 1.00 0.00 H new ATOM 0 HG21 VAL A 101 6.846 -19.986 -1.763 1.00 0.00 H new ATOM 0 HG22 VAL A 101 5.577 -20.444 -0.602 1.00 0.00 H new ATOM 0 HG23 VAL A 101 5.225 -19.261 -1.884 1.00 0.00 H new ATOM 1534 N ILE A 102 4.845 -16.625 2.538 1.00 0.00 N ATOM 1535 CA ILE A 102 4.941 -15.467 3.404 1.00 0.00 C ATOM 1536 C ILE A 102 6.201 -15.539 4.261 1.00 0.00 C ATOM 1537 O ILE A 102 6.229 -16.020 5.391 1.00 0.00 O ATOM 1538 CB ILE A 102 3.677 -15.273 4.254 1.00 0.00 C ATOM 1539 CG1 ILE A 102 3.199 -16.554 4.966 1.00 0.00 C ATOM 1540 CG2 ILE A 102 2.555 -14.701 3.381 1.00 0.00 C ATOM 1541 CD1 ILE A 102 2.251 -16.239 6.127 1.00 0.00 C ATOM 0 H ILE A 102 4.157 -17.314 2.841 1.00 0.00 H new ATOM 0 HA ILE A 102 5.019 -14.584 2.769 1.00 0.00 H new ATOM 0 HB ILE A 102 3.940 -14.573 5.047 1.00 0.00 H new ATOM 0 HG12 ILE A 102 2.694 -17.201 4.249 1.00 0.00 H new ATOM 0 HG13 ILE A 102 4.062 -17.105 5.340 1.00 0.00 H new ATOM 0 HG21 ILE A 102 1.658 -14.564 3.985 1.00 0.00 H new ATOM 0 HG22 ILE A 102 2.867 -13.741 2.971 1.00 0.00 H new ATOM 0 HG23 ILE A 102 2.341 -15.392 2.565 1.00 0.00 H new ATOM 0 HD11 ILE A 102 1.937 -17.168 6.603 1.00 0.00 H new ATOM 0 HD12 ILE A 102 2.765 -15.613 6.857 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.376 -15.711 5.749 1.00 0.00 H new ATOM 1553 N ASP A 103 7.263 -15.015 3.661 1.00 0.00 N ATOM 1554 CA ASP A 103 8.546 -14.812 4.304 1.00 0.00 C ATOM 1555 C ASP A 103 8.320 -13.812 5.447 1.00 0.00 C ATOM 1556 O ASP A 103 7.374 -13.030 5.354 1.00 0.00 O ATOM 1557 CB ASP A 103 9.541 -14.267 3.273 1.00 0.00 C ATOM 1558 CG ASP A 103 10.104 -15.356 2.368 1.00 0.00 C ATOM 1559 OD1 ASP A 103 11.281 -15.672 2.506 1.00 0.00 O ATOM 1560 OD2 ASP A 103 9.278 -15.893 1.425 1.00 0.00 O ATOM 0 H ASP A 103 7.250 -14.713 2.687 1.00 0.00 H new ATOM 0 HA ASP A 103 8.956 -15.740 4.702 1.00 0.00 H new ATOM 0 HB2 ASP A 103 9.048 -13.511 2.662 1.00 0.00 H new ATOM 0 HB3 ASP A 103 10.361 -13.771 3.792 1.00 0.00 H new ATOM 1566 N PRO A 104 9.147 -13.823 6.507 1.00 0.00 N ATOM 1567 CA PRO A 104 8.971 -12.988 7.688 1.00 0.00 C ATOM 1568 C PRO A 104 8.498 -11.565 7.374 1.00 0.00 C ATOM 1569 O PRO A 104 9.256 -10.755 6.839 1.00 0.00 O ATOM 1570 CB PRO A 104 10.323 -13.016 8.403 1.00 0.00 C ATOM 1571 CG PRO A 104 10.809 -14.433 8.103 1.00 0.00 C ATOM 1572 CD PRO A 104 10.320 -14.671 6.672 1.00 0.00 C ATOM 0 HA PRO A 104 8.171 -13.376 8.318 1.00 0.00 H new ATOM 0 HB2 PRO A 104 11.006 -12.260 8.016 1.00 0.00 H new ATOM 0 HB3 PRO A 104 10.223 -12.837 9.473 1.00 0.00 H new ATOM 0 HG2 PRO A 104 11.894 -14.511 8.177 1.00 0.00 H new ATOM 0 HG3 PRO A 104 10.389 -15.159 8.799 1.00 0.00 H new ATOM 0 HD2 PRO A 104 11.093 -14.415 5.947 1.00 0.00 H new ATOM 0 HD3 PRO A 104 10.070 -15.720 6.514 1.00 0.00 H new ATOM 1580 N ILE A 105 7.239 -11.268 7.706 1.00 0.00 N ATOM 1581 CA ILE A 105 6.659 -9.955 7.495 1.00 0.00 C ATOM 1582 C ILE A 105 7.164 -9.052 8.609 1.00 0.00 C ATOM 1583 O ILE A 105 7.059 -9.400 9.784 1.00 0.00 O ATOM 1584 CB ILE A 105 5.124 -10.038 7.449 1.00 0.00 C ATOM 1585 CG1 ILE A 105 4.627 -10.887 6.264 1.00 0.00 C ATOM 1586 CG2 ILE A 105 4.481 -8.644 7.407 1.00 0.00 C ATOM 1587 CD1 ILE A 105 5.164 -10.452 4.893 1.00 0.00 C ATOM 0 H ILE A 105 6.598 -11.939 8.129 1.00 0.00 H new ATOM 0 HA ILE A 105 6.961 -9.541 6.533 1.00 0.00 H new ATOM 0 HB ILE A 105 4.815 -10.531 8.371 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.908 -11.926 6.436 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.538 -10.851 6.240 1.00 0.00 H new ATOM 0 HG21 ILE A 105 3.396 -8.745 7.375 1.00 0.00 H new ATOM 0 HG22 ILE A 105 4.768 -8.084 8.297 1.00 0.00 H new ATOM 0 HG23 ILE A 105 4.822 -8.112 6.519 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.761 -11.106 4.120 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.861 -9.424 4.693 1.00 0.00 H new ATOM 0 HD13 ILE A 105 6.252 -10.516 4.891 1.00 0.00 H new ATOM 1599 N VAL A 106 7.736 -7.911 8.229 1.00 0.00 N ATOM 1600 CA VAL A 106 8.244 -6.940 9.174 1.00 0.00 C ATOM 1601 C VAL A 106 7.041 -6.102 9.595 1.00 0.00 C ATOM 1602 O VAL A 106 6.462 -6.324 10.656 1.00 0.00 O ATOM 1603 CB VAL A 106 9.396 -6.150 8.521 1.00 0.00 C ATOM 1604 CG1 VAL A 106 9.926 -5.046 9.445 1.00 0.00 C ATOM 1605 CG2 VAL A 106 10.547 -7.110 8.184 1.00 0.00 C ATOM 0 H VAL A 106 7.857 -7.641 7.253 1.00 0.00 H new ATOM 0 HA VAL A 106 8.684 -7.377 10.070 1.00 0.00 H new ATOM 0 HB VAL A 106 9.006 -5.682 7.617 1.00 0.00 H new ATOM 0 HG11 VAL A 106 10.736 -4.513 8.948 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.121 -4.348 9.677 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.297 -5.491 10.368 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.362 -6.553 7.722 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.904 -7.585 9.098 1.00 0.00 H new ATOM 0 HG23 VAL A 106 10.193 -7.874 7.492 1.00 0.00 H new ATOM 1615 N ALA A 107 6.687 -5.112 8.777 1.00 0.00 N ATOM 1616 CA ALA A 107 5.465 -4.338 8.952 1.00 0.00 C ATOM 1617 C ALA A 107 4.398 -4.960 8.062 1.00 0.00 C ATOM 1618 O ALA A 107 4.740 -5.489 7.008 1.00 0.00 O ATOM 1619 CB ALA A 107 5.721 -2.868 8.621 1.00 0.00 C ATOM 0 H ALA A 107 7.244 -4.825 7.972 1.00 0.00 H new ATOM 0 HA ALA A 107 5.122 -4.363 9.986 1.00 0.00 H new ATOM 0 HB1 ALA A 107 4.801 -2.299 8.755 1.00 0.00 H new ATOM 0 HB2 ALA A 107 6.491 -2.474 9.285 1.00 0.00 H new ATOM 0 HB3 ALA A 107 6.054 -2.781 7.587 1.00 0.00 H new ATOM 1625 N GLY A 108 3.115 -4.890 8.416 1.00 0.00 N ATOM 1626 CA GLY A 108 2.100 -5.374 7.502 1.00 0.00 C ATOM 1627 C GLY A 108 0.703 -5.241 8.077 1.00 0.00 C ATOM 1628 O GLY A 108 0.544 -5.135 9.292 1.00 0.00 O ATOM 0 H GLY A 108 2.769 -4.515 9.299 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.161 -4.818 6.566 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.296 -6.420 7.265 1.00 0.00 H new ATOM 1632 N THR A 109 -0.297 -5.233 7.196 1.00 0.00 N ATOM 1633 CA THR A 109 -1.702 -5.126 7.547 1.00 0.00 C ATOM 1634 C THR A 109 -2.407 -6.456 7.337 1.00 0.00 C ATOM 1635 O THR A 109 -2.062 -7.202 6.419 1.00 0.00 O ATOM 1636 CB THR A 109 -2.369 -4.052 6.682 1.00 0.00 C ATOM 1637 OG1 THR A 109 -1.978 -4.199 5.330 1.00 0.00 O ATOM 1638 CG2 THR A 109 -1.964 -2.663 7.156 1.00 0.00 C ATOM 0 H THR A 109 -0.141 -5.303 6.190 1.00 0.00 H new ATOM 0 HA THR A 109 -1.778 -4.850 8.599 1.00 0.00 H new ATOM 0 HB THR A 109 -3.449 -4.171 6.770 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.060 -3.337 4.870 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.446 -1.911 6.532 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.274 -2.527 8.192 1.00 0.00 H new ATOM 0 HG23 THR A 109 -0.882 -2.555 7.084 1.00 0.00 H new ATOM 1646 N GLY A 110 -3.381 -6.751 8.198 1.00 0.00 N ATOM 1647 CA GLY A 110 -4.253 -7.900 8.027 1.00 0.00 C ATOM 1648 C GLY A 110 -5.362 -7.491 7.048 1.00 0.00 C ATOM 1649 O GLY A 110 -5.597 -6.296 6.866 1.00 0.00 O ATOM 0 H GLY A 110 -3.583 -6.198 9.031 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.694 -8.752 7.640 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -4.678 -8.205 8.983 1.00 0.00 H new ATOM 1653 N PHE A 111 -6.012 -8.463 6.399 1.00 0.00 N ATOM 1654 CA PHE A 111 -7.007 -8.264 5.340 1.00 0.00 C ATOM 1655 C PHE A 111 -7.991 -7.120 5.619 1.00 0.00 C ATOM 1656 O PHE A 111 -8.540 -7.028 6.717 1.00 0.00 O ATOM 1657 CB PHE A 111 -7.773 -9.575 5.115 1.00 0.00 C ATOM 1658 CG PHE A 111 -6.867 -10.776 4.894 1.00 0.00 C ATOM 1659 CD1 PHE A 111 -6.051 -10.832 3.748 1.00 0.00 C ATOM 1660 CD2 PHE A 111 -6.742 -11.767 5.886 1.00 0.00 C ATOM 1661 CE1 PHE A 111 -5.112 -11.866 3.596 1.00 0.00 C ATOM 1662 CE2 PHE A 111 -5.809 -12.807 5.728 1.00 0.00 C ATOM 1663 CZ PHE A 111 -4.991 -12.855 4.586 1.00 0.00 C ATOM 0 H PHE A 111 -5.853 -9.449 6.605 1.00 0.00 H new ATOM 0 HA PHE A 111 -6.460 -7.975 4.443 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -8.412 -9.766 5.977 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -8.428 -9.460 4.252 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -6.147 -10.077 2.982 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -7.363 -11.728 6.769 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -4.484 -11.900 2.718 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -5.721 -13.571 6.486 1.00 0.00 H new ATOM 0 HZ PHE A 111 -4.271 -13.651 4.470 1.00 0.00 H new ATOM 1673 N SER A 112 -8.220 -6.255 4.626 1.00 0.00 N ATOM 1674 CA SER A 112 -9.096 -5.098 4.780 1.00 0.00 C ATOM 1675 C SER A 112 -10.567 -5.506 4.938 1.00 0.00 C ATOM 1676 O SER A 112 -10.946 -6.600 4.519 1.00 0.00 O ATOM 1677 CB SER A 112 -8.890 -4.140 3.590 1.00 0.00 C ATOM 1678 OG SER A 112 -9.713 -4.468 2.479 1.00 0.00 O ATOM 0 H SER A 112 -7.804 -6.340 3.699 1.00 0.00 H new ATOM 0 HA SER A 112 -8.829 -4.579 5.700 1.00 0.00 H new ATOM 0 HB2 SER A 112 -9.104 -3.120 3.908 1.00 0.00 H new ATOM 0 HB3 SER A 112 -7.844 -4.166 3.284 1.00 0.00 H new ATOM 0 HG SER A 112 -10.301 -3.711 2.273 1.00 0.00 H new ATOM 1684 N PRO A 113 -11.414 -4.635 5.513 1.00 0.00 N ATOM 1685 CA PRO A 113 -12.848 -4.863 5.549 1.00 0.00 C ATOM 1686 C PRO A 113 -13.414 -4.682 4.132 1.00 0.00 C ATOM 1687 O PRO A 113 -12.665 -4.411 3.189 1.00 0.00 O ATOM 1688 CB PRO A 113 -13.394 -3.821 6.536 1.00 0.00 C ATOM 1689 CG PRO A 113 -12.405 -2.661 6.408 1.00 0.00 C ATOM 1690 CD PRO A 113 -11.078 -3.383 6.173 1.00 0.00 C ATOM 0 HA PRO A 113 -13.125 -5.867 5.869 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -14.408 -3.515 6.278 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -13.428 -4.210 7.554 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -12.660 -2.000 5.580 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -12.380 -2.048 7.309 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -10.411 -2.782 5.554 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -10.561 -3.565 7.115 1.00 0.00 H new ATOM 1698 N VAL A 114 -14.740 -4.818 4.003 1.00 0.00 N ATOM 1699 CA VAL A 114 -15.493 -4.675 2.761 1.00 0.00 C ATOM 1700 C VAL A 114 -16.474 -3.501 2.908 1.00 0.00 C ATOM 1701 O VAL A 114 -17.531 -3.653 3.521 1.00 0.00 O ATOM 1702 CB VAL A 114 -16.221 -5.998 2.456 1.00 0.00 C ATOM 1703 CG1 VAL A 114 -17.120 -5.862 1.220 1.00 0.00 C ATOM 1704 CG2 VAL A 114 -15.202 -7.124 2.227 1.00 0.00 C ATOM 0 H VAL A 114 -15.338 -5.040 4.799 1.00 0.00 H new ATOM 0 HA VAL A 114 -14.828 -4.459 1.924 1.00 0.00 H new ATOM 0 HB VAL A 114 -16.846 -6.241 3.315 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -17.621 -6.811 1.028 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.866 -5.087 1.396 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -16.513 -5.592 0.356 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -15.729 -8.054 2.012 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -14.560 -6.868 1.384 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -14.593 -7.251 3.122 1.00 0.00 H new ATOM 1714 N PRO A 115 -16.118 -2.320 2.387 1.00 0.00 N ATOM 1715 CA PRO A 115 -16.974 -1.140 2.341 1.00 0.00 C ATOM 1716 C PRO A 115 -18.239 -1.339 1.506 1.00 0.00 C ATOM 1717 O PRO A 115 -18.394 -2.355 0.829 1.00 0.00 O ATOM 1718 CB PRO A 115 -16.107 -0.050 1.713 1.00 0.00 C ATOM 1719 CG PRO A 115 -14.706 -0.476 2.136 1.00 0.00 C ATOM 1720 CD PRO A 115 -14.777 -1.980 1.962 1.00 0.00 C ATOM 0 HA PRO A 115 -17.328 -0.896 3.343 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -16.214 -0.018 0.629 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -16.363 0.941 2.088 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -13.935 -0.027 1.510 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -14.485 -0.193 3.165 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -14.601 -2.270 0.926 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -14.026 -2.488 2.567 1.00 0.00 H new ATOM 1728 N LYS A 116 -19.126 -0.338 1.536 1.00 0.00 N ATOM 1729 CA LYS A 116 -20.352 -0.300 0.757 1.00 0.00 C ATOM 1730 C LYS A 116 -20.649 1.146 0.348 1.00 0.00 C ATOM 1731 O LYS A 116 -20.139 2.093 0.952 1.00 0.00 O ATOM 1732 CB LYS A 116 -21.523 -0.882 1.569 1.00 0.00 C ATOM 1733 CG LYS A 116 -21.256 -2.326 2.014 1.00 0.00 C ATOM 1734 CD LYS A 116 -22.518 -2.963 2.607 1.00 0.00 C ATOM 1735 CE LYS A 116 -22.208 -4.322 3.249 1.00 0.00 C ATOM 1736 NZ LYS A 116 -21.586 -5.257 2.294 1.00 0.00 N ATOM 0 H LYS A 116 -19.000 0.487 2.122 1.00 0.00 H new ATOM 0 HA LYS A 116 -20.227 -0.907 -0.139 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -21.700 -0.260 2.446 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -22.432 -0.851 0.968 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -20.913 -2.915 1.163 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -20.456 -2.340 2.754 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -22.948 -2.296 3.354 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -23.266 -3.090 1.824 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -21.542 -4.177 4.100 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -23.129 -4.758 3.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -21.487 -6.192 2.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -22.185 -5.338 1.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -20.647 -4.902 2.022 1.00 0.00 H new ATOM 1750 N ASP A 117 -21.512 1.302 -0.661 1.00 0.00 N ATOM 1751 CA ASP A 117 -21.985 2.575 -1.192 1.00 0.00 C ATOM 1752 C ASP A 117 -20.819 3.546 -1.409 1.00 0.00 C ATOM 1753 O ASP A 117 -19.938 3.261 -2.216 1.00 0.00 O ATOM 1754 CB ASP A 117 -23.122 3.138 -0.315 1.00 0.00 C ATOM 1755 CG ASP A 117 -24.359 2.248 -0.273 1.00 0.00 C ATOM 1756 OD1 ASP A 117 -24.405 1.210 -0.926 1.00 0.00 O ATOM 1757 OD2 ASP A 117 -25.365 2.688 0.524 1.00 0.00 O ATOM 0 H ASP A 117 -21.916 0.503 -1.150 1.00 0.00 H new ATOM 0 HA ASP A 117 -22.419 2.418 -2.179 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -22.751 3.278 0.700 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -23.405 4.122 -0.689 1.00 0.00 H new ATOM 1763 N GLY A 118 -20.810 4.683 -0.707 1.00 0.00 N ATOM 1764 CA GLY A 118 -19.788 5.711 -0.854 1.00 0.00 C ATOM 1765 C GLY A 118 -18.807 5.731 0.319 1.00 0.00 C ATOM 1766 O GLY A 118 -18.116 6.738 0.502 1.00 0.00 O ATOM 0 H GLY A 118 -21.522 4.913 -0.014 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -19.239 5.543 -1.780 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -20.267 6.686 -0.940 1.00 0.00 H new ATOM 1770 N LYS A 119 -18.752 4.652 1.114 1.00 0.00 N ATOM 1771 CA LYS A 119 -17.789 4.515 2.198 1.00 0.00 C ATOM 1772 C LYS A 119 -16.487 3.944 1.634 1.00 0.00 C ATOM 1773 O LYS A 119 -16.509 3.210 0.648 1.00 0.00 O ATOM 1774 CB LYS A 119 -18.340 3.612 3.306 1.00 0.00 C ATOM 1775 CG LYS A 119 -19.695 4.101 3.830 1.00 0.00 C ATOM 1776 CD LYS A 119 -20.130 3.231 5.016 1.00 0.00 C ATOM 1777 CE LYS A 119 -21.529 3.605 5.518 1.00 0.00 C ATOM 1778 NZ LYS A 119 -21.586 4.991 6.019 1.00 0.00 N ATOM 0 H LYS A 119 -19.378 3.853 1.017 1.00 0.00 H new ATOM 0 HA LYS A 119 -17.598 5.494 2.637 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -18.444 2.596 2.926 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -17.627 3.573 4.129 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -19.623 5.144 4.138 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -20.442 4.054 3.037 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -20.119 2.182 4.720 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -19.412 3.340 5.829 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -22.249 3.483 4.709 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -21.824 2.920 6.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -22.520 5.169 6.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -20.848 5.131 6.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -21.430 5.652 5.231 1.00 0.00 H new ATOM 1792 N PHE A 120 -15.360 4.284 2.261 1.00 0.00 N ATOM 1793 CA PHE A 120 -14.022 3.969 1.777 1.00 0.00 C ATOM 1794 C PHE A 120 -13.147 3.419 2.894 1.00 0.00 C ATOM 1795 O PHE A 120 -12.515 4.174 3.626 1.00 0.00 O ATOM 1796 CB PHE A 120 -13.430 5.235 1.159 1.00 0.00 C ATOM 1797 CG PHE A 120 -13.831 5.357 -0.299 1.00 0.00 C ATOM 1798 CD1 PHE A 120 -15.103 5.856 -0.620 1.00 0.00 C ATOM 1799 CD2 PHE A 120 -13.096 4.679 -1.289 1.00 0.00 C ATOM 1800 CE1 PHE A 120 -15.592 5.771 -1.933 1.00 0.00 C ATOM 1801 CE2 PHE A 120 -13.539 4.678 -2.624 1.00 0.00 C ATOM 1802 CZ PHE A 120 -14.779 5.250 -2.949 1.00 0.00 C ATOM 0 H PHE A 120 -15.356 4.799 3.141 1.00 0.00 H new ATOM 0 HA PHE A 120 -14.073 3.187 1.019 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -13.774 6.110 1.710 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -12.343 5.213 1.242 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -15.710 6.309 0.150 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -12.188 4.158 -1.023 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -16.593 6.107 -2.160 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -12.927 4.238 -3.397 1.00 0.00 H new ATOM 0 HZ PHE A 120 -15.105 5.289 -3.978 1.00 0.00 H new ATOM 1812 N GLY A 121 -13.117 2.093 3.000 1.00 0.00 N ATOM 1813 CA GLY A 121 -12.267 1.330 3.893 1.00 0.00 C ATOM 1814 C GLY A 121 -10.829 1.809 3.776 1.00 0.00 C ATOM 1815 O GLY A 121 -10.245 1.721 2.690 1.00 0.00 O ATOM 0 H GLY A 121 -13.719 1.496 2.433 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -12.613 1.440 4.921 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -12.327 0.270 3.648 1.00 0.00 H new ATOM 1819 N TYR A 122 -10.283 2.320 4.884 1.00 0.00 N ATOM 1820 CA TYR A 122 -8.944 2.865 4.947 1.00 0.00 C ATOM 1821 C TYR A 122 -8.223 2.472 6.226 1.00 0.00 C ATOM 1822 O TYR A 122 -8.835 2.097 7.227 1.00 0.00 O ATOM 1823 CB TYR A 122 -8.907 4.386 4.701 1.00 0.00 C ATOM 1824 CG TYR A 122 -9.307 5.347 5.811 1.00 0.00 C ATOM 1825 CD1 TYR A 122 -10.386 5.081 6.672 1.00 0.00 C ATOM 1826 CD2 TYR A 122 -8.595 6.555 5.956 1.00 0.00 C ATOM 1827 CE1 TYR A 122 -10.771 6.022 7.644 1.00 0.00 C ATOM 1828 CE2 TYR A 122 -8.968 7.490 6.936 1.00 0.00 C ATOM 1829 CZ TYR A 122 -10.063 7.228 7.774 1.00 0.00 C ATOM 1830 OH TYR A 122 -10.458 8.163 8.682 1.00 0.00 O ATOM 0 H TYR A 122 -10.778 2.362 5.775 1.00 0.00 H new ATOM 0 HA TYR A 122 -8.393 2.411 4.123 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -7.890 4.641 4.402 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -9.552 4.592 3.846 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -10.923 4.148 6.587 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -7.756 6.763 5.309 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -11.611 5.817 8.291 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -8.412 8.410 7.044 1.00 0.00 H new ATOM 0 HH TYR A 122 -9.856 8.935 8.640 1.00 0.00 H new ATOM 1840 N THR A 123 -6.900 2.572 6.143 1.00 0.00 N ATOM 1841 CA THR A 123 -5.948 2.296 7.196 1.00 0.00 C ATOM 1842 C THR A 123 -4.827 3.303 7.058 1.00 0.00 C ATOM 1843 O THR A 123 -4.526 3.721 5.944 1.00 0.00 O ATOM 1844 CB THR A 123 -5.442 0.853 7.057 1.00 0.00 C ATOM 1845 OG1 THR A 123 -6.235 -0.005 7.823 1.00 0.00 O ATOM 1846 CG2 THR A 123 -3.997 0.590 7.446 1.00 0.00 C ATOM 0 H THR A 123 -6.442 2.867 5.281 1.00 0.00 H new ATOM 0 HA THR A 123 -6.396 2.387 8.185 1.00 0.00 H new ATOM 0 HB THR A 123 -5.507 0.670 5.984 1.00 0.00 H new ATOM 0 HG1 THR A 123 -6.601 -0.711 7.250 1.00 0.00 H new ATOM 0 HG21 THR A 123 -3.768 -0.466 7.301 1.00 0.00 H new ATOM 0 HG22 THR A 123 -3.337 1.194 6.823 1.00 0.00 H new ATOM 0 HG23 THR A 123 -3.848 0.853 8.493 1.00 0.00 H new ATOM 1854 N ASP A 124 -4.223 3.679 8.185 1.00 0.00 N ATOM 1855 CA ASP A 124 -3.106 4.603 8.255 1.00 0.00 C ATOM 1856 C ASP A 124 -2.075 3.990 9.194 1.00 0.00 C ATOM 1857 O ASP A 124 -1.856 4.522 10.281 1.00 0.00 O ATOM 1858 CB ASP A 124 -3.590 5.963 8.779 1.00 0.00 C ATOM 1859 CG ASP A 124 -4.590 6.617 7.841 1.00 0.00 C ATOM 1860 OD1 ASP A 124 -4.185 7.340 6.936 1.00 0.00 O ATOM 1861 OD2 ASP A 124 -5.900 6.344 8.079 1.00 0.00 O ATOM 0 H ASP A 124 -4.512 3.334 9.100 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.665 4.769 7.272 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.047 5.831 9.760 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -2.734 6.624 8.913 1.00 0.00 H new ATOM 1867 N PHE A 125 -1.484 2.850 8.820 1.00 0.00 N ATOM 1868 CA PHE A 125 -0.467 2.250 9.674 1.00 0.00 C ATOM 1869 C PHE A 125 0.835 3.035 9.501 1.00 0.00 C ATOM 1870 O PHE A 125 1.077 3.595 8.430 1.00 0.00 O ATOM 1871 CB PHE A 125 -0.285 0.749 9.420 1.00 0.00 C ATOM 1872 CG PHE A 125 0.500 0.335 8.188 1.00 0.00 C ATOM 1873 CD1 PHE A 125 1.888 0.109 8.277 1.00 0.00 C ATOM 1874 CD2 PHE A 125 -0.182 -0.004 7.005 1.00 0.00 C ATOM 1875 CE1 PHE A 125 2.576 -0.491 7.208 1.00 0.00 C ATOM 1876 CE2 PHE A 125 0.498 -0.646 5.955 1.00 0.00 C ATOM 1877 CZ PHE A 125 1.874 -0.902 6.064 1.00 0.00 C ATOM 0 H PHE A 125 -1.687 2.342 7.959 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.793 2.315 10.712 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.206 0.318 10.292 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -1.275 0.297 9.356 1.00 0.00 H new ATOM 0 HD1 PHE A 125 2.425 0.397 9.169 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -1.231 0.230 6.903 1.00 0.00 H new ATOM 0 HE1 PHE A 125 3.645 -0.636 7.267 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -0.038 -0.942 5.065 1.00 0.00 H new ATOM 0 HZ PHE A 125 2.393 -1.415 5.268 1.00 0.00 H new ATOM 1887 N THR A 126 1.665 3.075 10.546 1.00 0.00 N ATOM 1888 CA THR A 126 2.904 3.844 10.571 1.00 0.00 C ATOM 1889 C THR A 126 4.096 2.900 10.751 1.00 0.00 C ATOM 1890 O THR A 126 3.991 1.924 11.490 1.00 0.00 O ATOM 1891 CB THR A 126 2.832 4.893 11.689 1.00 0.00 C ATOM 1892 OG1 THR A 126 1.657 5.667 11.550 1.00 0.00 O ATOM 1893 CG2 THR A 126 4.036 5.836 11.650 1.00 0.00 C ATOM 0 H THR A 126 1.489 2.564 11.411 1.00 0.00 H new ATOM 0 HA THR A 126 3.039 4.369 9.625 1.00 0.00 H new ATOM 0 HB THR A 126 2.829 4.358 12.639 1.00 0.00 H new ATOM 0 HG1 THR A 126 1.818 6.394 10.913 1.00 0.00 H new ATOM 0 HG21 THR A 126 3.953 6.566 12.455 1.00 0.00 H new ATOM 0 HG22 THR A 126 4.953 5.260 11.775 1.00 0.00 H new ATOM 0 HG23 THR A 126 4.061 6.354 10.692 1.00 0.00 H new ATOM 1901 N TRP A 127 5.223 3.188 10.090 1.00 0.00 N ATOM 1902 CA TRP A 127 6.458 2.416 10.181 1.00 0.00 C ATOM 1903 C TRP A 127 7.670 3.351 10.073 1.00 0.00 C ATOM 1904 O TRP A 127 7.534 4.484 9.618 1.00 0.00 O ATOM 1905 CB TRP A 127 6.429 1.341 9.079 1.00 0.00 C ATOM 1906 CG TRP A 127 7.637 0.466 8.897 1.00 0.00 C ATOM 1907 CD1 TRP A 127 8.321 -0.154 9.882 1.00 0.00 C ATOM 1908 CD2 TRP A 127 8.298 0.071 7.658 1.00 0.00 C ATOM 1909 NE1 TRP A 127 9.375 -0.865 9.347 1.00 0.00 N ATOM 1910 CE2 TRP A 127 9.405 -0.771 7.970 1.00 0.00 C ATOM 1911 CE3 TRP A 127 8.075 0.344 6.295 1.00 0.00 C ATOM 1912 CZ2 TRP A 127 10.241 -1.307 6.977 1.00 0.00 C ATOM 1913 CZ3 TRP A 127 8.926 -0.157 5.298 1.00 0.00 C ATOM 1914 CH2 TRP A 127 9.988 -1.004 5.630 1.00 0.00 C ATOM 0 H TRP A 127 5.299 3.987 9.461 1.00 0.00 H new ATOM 0 HA TRP A 127 6.544 1.916 11.146 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.576 0.691 9.273 1.00 0.00 H new ATOM 0 HB3 TRP A 127 6.238 1.844 8.131 1.00 0.00 H new ATOM 0 HD1 TRP A 127 8.079 -0.101 10.933 1.00 0.00 H new ATOM 0 HE1 TRP A 127 10.049 -1.395 9.900 1.00 0.00 H new ATOM 0 HE3 TRP A 127 7.230 0.953 6.010 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 11.069 -1.945 7.247 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 8.759 0.114 4.266 1.00 0.00 H new ATOM 0 HH2 TRP A 127 10.611 -1.423 4.854 1.00 0.00 H new ATOM 1925 N HIS A 128 8.845 2.884 10.513 1.00 0.00 N ATOM 1926 CA HIS A 128 10.120 3.593 10.464 1.00 0.00 C ATOM 1927 C HIS A 128 11.179 2.674 9.841 1.00 0.00 C ATOM 1928 O HIS A 128 11.783 1.880 10.559 1.00 0.00 O ATOM 1929 CB HIS A 128 10.518 4.034 11.878 1.00 0.00 C ATOM 1930 CG HIS A 128 9.639 5.142 12.397 1.00 0.00 C ATOM 1931 ND1 HIS A 128 8.518 4.995 13.193 1.00 0.00 N ATOM 1932 CD2 HIS A 128 9.737 6.457 12.039 1.00 0.00 C ATOM 1933 CE1 HIS A 128 7.950 6.209 13.320 1.00 0.00 C ATOM 1934 NE2 HIS A 128 8.672 7.109 12.624 1.00 0.00 N ATOM 0 H HIS A 128 8.932 1.958 10.932 1.00 0.00 H new ATOM 0 HA HIS A 128 10.034 4.488 9.847 1.00 0.00 H new ATOM 0 HB2 HIS A 128 10.460 3.180 12.553 1.00 0.00 H new ATOM 0 HB3 HIS A 128 11.556 4.367 11.874 1.00 0.00 H new ATOM 0 HD1 HIS A 128 8.183 4.126 13.608 1.00 0.00 H new ATOM 0 HD2 HIS A 128 10.501 6.900 11.418 1.00 0.00 H new ATOM 0 HE1 HIS A 128 7.058 6.427 13.889 1.00 0.00 H new ATOM 1943 N PRO A 129 11.389 2.730 8.515 1.00 0.00 N ATOM 1944 CA PRO A 129 12.298 1.836 7.817 1.00 0.00 C ATOM 1945 C PRO A 129 13.770 2.151 8.123 1.00 0.00 C ATOM 1946 O PRO A 129 14.146 3.321 8.239 1.00 0.00 O ATOM 1947 CB PRO A 129 12.060 2.053 6.323 1.00 0.00 C ATOM 1948 CG PRO A 129 10.761 2.833 6.237 1.00 0.00 C ATOM 1949 CD PRO A 129 10.659 3.556 7.576 1.00 0.00 C ATOM 0 HA PRO A 129 12.109 0.811 8.135 1.00 0.00 H new ATOM 0 HB2 PRO A 129 12.882 2.606 5.869 1.00 0.00 H new ATOM 0 HB3 PRO A 129 11.985 1.103 5.794 1.00 0.00 H new ATOM 0 HG2 PRO A 129 10.776 3.538 5.406 1.00 0.00 H new ATOM 0 HG3 PRO A 129 9.910 2.170 6.078 1.00 0.00 H new ATOM 0 HD2 PRO A 129 11.088 4.556 7.516 1.00 0.00 H new ATOM 0 HD3 PRO A 129 9.619 3.673 7.881 1.00 0.00 H new ATOM 1957 N THR A 130 14.608 1.114 8.182 1.00 0.00 N ATOM 1958 CA THR A 130 16.056 1.220 8.306 1.00 0.00 C ATOM 1959 C THR A 130 16.679 1.183 6.902 1.00 0.00 C ATOM 1960 O THR A 130 16.062 0.674 5.966 1.00 0.00 O ATOM 1961 CB THR A 130 16.553 0.062 9.181 1.00 0.00 C ATOM 1962 OG1 THR A 130 15.957 -1.147 8.753 1.00 0.00 O ATOM 1963 CG2 THR A 130 16.166 0.293 10.644 1.00 0.00 C ATOM 0 H THR A 130 14.283 0.148 8.143 1.00 0.00 H new ATOM 0 HA THR A 130 16.347 2.158 8.778 1.00 0.00 H new ATOM 0 HB THR A 130 17.638 0.007 9.091 1.00 0.00 H new ATOM 0 HG1 THR A 130 16.277 -1.885 9.313 1.00 0.00 H new ATOM 0 HG21 THR A 130 16.526 -0.538 11.251 1.00 0.00 H new ATOM 0 HG22 THR A 130 16.615 1.222 10.997 1.00 0.00 H new ATOM 0 HG23 THR A 130 15.081 0.360 10.727 1.00 0.00 H new ATOM 1971 N ALA A 131 17.879 1.752 6.730 1.00 0.00 N ATOM 1972 CA ALA A 131 18.499 1.870 5.413 1.00 0.00 C ATOM 1973 C ALA A 131 18.724 0.507 4.746 1.00 0.00 C ATOM 1974 O ALA A 131 19.015 -0.482 5.415 1.00 0.00 O ATOM 1975 CB ALA A 131 19.798 2.676 5.494 1.00 0.00 C ATOM 0 H ALA A 131 18.438 2.137 7.491 1.00 0.00 H new ATOM 0 HA ALA A 131 17.800 2.412 4.776 1.00 0.00 H new ATOM 0 HB1 ALA A 131 20.242 2.751 4.501 1.00 0.00 H new ATOM 0 HB2 ALA A 131 19.583 3.676 5.872 1.00 0.00 H new ATOM 0 HB3 ALA A 131 20.495 2.176 6.167 1.00 0.00 H new ATOM 1981 N GLY A 132 18.599 0.482 3.418 1.00 0.00 N ATOM 1982 CA GLY A 132 18.727 -0.677 2.555 1.00 0.00 C ATOM 1983 C GLY A 132 17.502 -0.758 1.657 1.00 0.00 C ATOM 1984 O GLY A 132 17.210 0.198 0.932 1.00 0.00 O ATOM 0 H GLY A 132 18.392 1.330 2.890 1.00 0.00 H new ATOM 0 HA2 GLY A 132 19.632 -0.601 1.952 1.00 0.00 H new ATOM 0 HA3 GLY A 132 18.817 -1.584 3.152 1.00 0.00 H new ATOM 1988 N THR A 133 16.799 -1.891 1.650 1.00 0.00 N ATOM 1989 CA THR A 133 15.673 -2.091 0.755 1.00 0.00 C ATOM 1990 C THR A 133 14.699 -3.096 1.363 1.00 0.00 C ATOM 1991 O THR A 133 15.118 -4.040 2.032 1.00 0.00 O ATOM 1992 CB THR A 133 16.171 -2.542 -0.631 1.00 0.00 C ATOM 1993 OG1 THR A 133 17.135 -1.632 -1.125 1.00 0.00 O ATOM 1994 CG2 THR A 133 15.040 -2.632 -1.663 1.00 0.00 C ATOM 0 H THR A 133 16.996 -2.685 2.260 1.00 0.00 H new ATOM 0 HA THR A 133 15.140 -1.149 0.622 1.00 0.00 H new ATOM 0 HB THR A 133 16.600 -3.534 -0.493 1.00 0.00 H new ATOM 0 HG1 THR A 133 17.445 -1.930 -2.006 1.00 0.00 H new ATOM 0 HG21 THR A 133 15.447 -2.954 -2.622 1.00 0.00 H new ATOM 0 HG22 THR A 133 14.295 -3.352 -1.325 1.00 0.00 H new ATOM 0 HG23 THR A 133 14.573 -1.654 -1.777 1.00 0.00 H new ATOM 2002 N TYR A 134 13.410 -2.866 1.123 1.00 0.00 N ATOM 2003 CA TYR A 134 12.300 -3.729 1.475 1.00 0.00 C ATOM 2004 C TYR A 134 11.386 -3.802 0.251 1.00 0.00 C ATOM 2005 O TYR A 134 11.628 -3.120 -0.746 1.00 0.00 O ATOM 2006 CB TYR A 134 11.563 -3.167 2.698 1.00 0.00 C ATOM 2007 CG TYR A 134 12.373 -3.154 3.974 1.00 0.00 C ATOM 2008 CD1 TYR A 134 13.160 -2.029 4.281 1.00 0.00 C ATOM 2009 CD2 TYR A 134 12.161 -4.146 4.949 1.00 0.00 C ATOM 2010 CE1 TYR A 134 13.698 -1.879 5.568 1.00 0.00 C ATOM 2011 CE2 TYR A 134 12.773 -4.033 6.206 1.00 0.00 C ATOM 2012 CZ TYR A 134 13.545 -2.904 6.515 1.00 0.00 C ATOM 2013 OH TYR A 134 14.041 -2.770 7.775 1.00 0.00 O ATOM 0 H TYR A 134 13.101 -2.018 0.648 1.00 0.00 H new ATOM 0 HA TYR A 134 12.641 -4.729 1.744 1.00 0.00 H new ATOM 0 HB2 TYR A 134 11.244 -2.149 2.476 1.00 0.00 H new ATOM 0 HB3 TYR A 134 10.660 -3.755 2.863 1.00 0.00 H new ATOM 0 HD1 TYR A 134 13.350 -1.281 3.526 1.00 0.00 H new ATOM 0 HD2 TYR A 134 11.528 -4.993 4.730 1.00 0.00 H new ATOM 0 HE1 TYR A 134 14.229 -0.976 5.830 1.00 0.00 H new ATOM 0 HE2 TYR A 134 12.649 -4.818 6.938 1.00 0.00 H new ATOM 0 HH TYR A 134 14.749 -2.093 7.777 1.00 0.00 H new ATOM 2023 N TYR A 135 10.344 -4.626 0.322 1.00 0.00 N ATOM 2024 CA TYR A 135 9.348 -4.802 -0.714 1.00 0.00 C ATOM 2025 C TYR A 135 7.988 -4.968 -0.044 1.00 0.00 C ATOM 2026 O TYR A 135 7.932 -5.479 1.077 1.00 0.00 O ATOM 2027 CB TYR A 135 9.680 -6.020 -1.575 1.00 0.00 C ATOM 2028 CG TYR A 135 10.975 -5.905 -2.357 1.00 0.00 C ATOM 2029 CD1 TYR A 135 12.195 -6.268 -1.759 1.00 0.00 C ATOM 2030 CD2 TYR A 135 10.965 -5.431 -3.681 1.00 0.00 C ATOM 2031 CE1 TYR A 135 13.402 -6.129 -2.462 1.00 0.00 C ATOM 2032 CE2 TYR A 135 12.172 -5.302 -4.390 1.00 0.00 C ATOM 2033 CZ TYR A 135 13.390 -5.635 -3.777 1.00 0.00 C ATOM 2034 OH TYR A 135 14.551 -5.526 -4.481 1.00 0.00 O ATOM 0 H TYR A 135 10.170 -5.210 1.140 1.00 0.00 H new ATOM 0 HA TYR A 135 9.333 -3.932 -1.370 1.00 0.00 H new ATOM 0 HB2 TYR A 135 9.735 -6.899 -0.933 1.00 0.00 H new ATOM 0 HB3 TYR A 135 8.862 -6.188 -2.275 1.00 0.00 H new ATOM 0 HD1 TYR A 135 12.203 -6.657 -0.751 1.00 0.00 H new ATOM 0 HD2 TYR A 135 10.030 -5.166 -4.153 1.00 0.00 H new ATOM 0 HE1 TYR A 135 14.336 -6.401 -1.994 1.00 0.00 H new ATOM 0 HE2 TYR A 135 12.162 -4.946 -5.409 1.00 0.00 H new ATOM 0 HH TYR A 135 14.360 -5.168 -5.373 1.00 0.00 H new ATOM 2044 N TYR A 136 6.917 -4.540 -0.721 1.00 0.00 N ATOM 2045 CA TYR A 136 5.542 -4.706 -0.261 1.00 0.00 C ATOM 2046 C TYR A 136 4.800 -5.668 -1.181 1.00 0.00 C ATOM 2047 O TYR A 136 5.053 -5.663 -2.386 1.00 0.00 O ATOM 2048 CB TYR A 136 4.820 -3.355 -0.155 1.00 0.00 C ATOM 2049 CG TYR A 136 4.751 -2.503 -1.414 1.00 0.00 C ATOM 2050 CD1 TYR A 136 5.736 -1.527 -1.641 1.00 0.00 C ATOM 2051 CD2 TYR A 136 3.612 -2.539 -2.242 1.00 0.00 C ATOM 2052 CE1 TYR A 136 5.556 -0.550 -2.634 1.00 0.00 C ATOM 2053 CE2 TYR A 136 3.434 -1.567 -3.246 1.00 0.00 C ATOM 2054 CZ TYR A 136 4.385 -0.546 -3.410 1.00 0.00 C ATOM 2055 OH TYR A 136 4.266 0.311 -4.462 1.00 0.00 O ATOM 0 H TYR A 136 6.987 -4.061 -1.619 1.00 0.00 H new ATOM 0 HA TYR A 136 5.560 -5.133 0.742 1.00 0.00 H new ATOM 0 HB2 TYR A 136 3.801 -3.542 0.183 1.00 0.00 H new ATOM 0 HB3 TYR A 136 5.311 -2.770 0.623 1.00 0.00 H new ATOM 0 HD1 TYR A 136 6.638 -1.528 -1.047 1.00 0.00 H new ATOM 0 HD2 TYR A 136 2.873 -3.314 -2.107 1.00 0.00 H new ATOM 0 HE1 TYR A 136 6.317 0.198 -2.801 1.00 0.00 H new ATOM 0 HE2 TYR A 136 2.567 -1.607 -3.889 1.00 0.00 H new ATOM 0 HH TYR A 136 5.155 0.511 -4.823 1.00 0.00 H new ATOM 2065 N VAL A 137 3.902 -6.485 -0.613 1.00 0.00 N ATOM 2066 CA VAL A 137 3.069 -7.445 -1.331 1.00 0.00 C ATOM 2067 C VAL A 137 1.720 -7.628 -0.623 1.00 0.00 C ATOM 2068 O VAL A 137 1.580 -7.283 0.549 1.00 0.00 O ATOM 2069 CB VAL A 137 3.770 -8.813 -1.439 1.00 0.00 C ATOM 2070 CG1 VAL A 137 5.058 -8.757 -2.261 1.00 0.00 C ATOM 2071 CG2 VAL A 137 4.090 -9.426 -0.067 1.00 0.00 C ATOM 0 H VAL A 137 3.734 -6.492 0.393 1.00 0.00 H new ATOM 0 HA VAL A 137 2.903 -7.049 -2.333 1.00 0.00 H new ATOM 0 HB VAL A 137 3.049 -9.449 -1.954 1.00 0.00 H new ATOM 0 HG11 VAL A 137 5.507 -9.749 -2.302 1.00 0.00 H new ATOM 0 HG12 VAL A 137 4.830 -8.420 -3.272 1.00 0.00 H new ATOM 0 HG13 VAL A 137 5.757 -8.062 -1.796 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.583 -10.388 -0.205 1.00 0.00 H new ATOM 0 HG22 VAL A 137 4.749 -8.757 0.486 1.00 0.00 H new ATOM 0 HG23 VAL A 137 3.165 -9.569 0.492 1.00 0.00 H new ATOM 2081 N CYS A 138 0.740 -8.184 -1.339 1.00 0.00 N ATOM 2082 CA CYS A 138 -0.560 -8.610 -0.819 1.00 0.00 C ATOM 2083 C CYS A 138 -0.522 -10.132 -0.664 1.00 0.00 C ATOM 2084 O CYS A 138 -0.016 -10.822 -1.546 1.00 0.00 O ATOM 2085 CB CYS A 138 -1.661 -8.193 -1.791 1.00 0.00 C ATOM 2086 SG CYS A 138 -3.262 -8.996 -1.582 1.00 0.00 S ATOM 0 H CYS A 138 0.836 -8.357 -2.340 1.00 0.00 H new ATOM 0 HA CYS A 138 -0.768 -8.144 0.144 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -1.805 -7.116 -1.703 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -1.312 -8.386 -2.805 1.00 0.00 H new ATOM 0 HG CYS A 138 -3.741 -9.319 -2.747 1.00 0.00 H new ATOM 2091 N GLN A 139 -1.044 -10.662 0.448 1.00 0.00 N ATOM 2092 CA GLN A 139 -0.932 -12.083 0.790 1.00 0.00 C ATOM 2093 C GLN A 139 -1.949 -12.981 0.088 1.00 0.00 C ATOM 2094 O GLN A 139 -1.780 -14.197 0.072 1.00 0.00 O ATOM 2095 CB GLN A 139 -1.032 -12.244 2.310 1.00 0.00 C ATOM 2096 CG GLN A 139 0.263 -11.756 2.966 1.00 0.00 C ATOM 2097 CD GLN A 139 0.160 -11.703 4.489 1.00 0.00 C ATOM 2098 OE1 GLN A 139 -0.918 -11.538 5.048 1.00 0.00 O ATOM 2099 NE2 GLN A 139 1.287 -11.833 5.183 1.00 0.00 N ATOM 0 H GLN A 139 -1.558 -10.114 1.138 1.00 0.00 H new ATOM 0 HA GLN A 139 0.041 -12.416 0.429 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -1.881 -11.676 2.691 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -1.209 -13.289 2.564 1.00 0.00 H new ATOM 0 HG2 GLN A 139 1.082 -12.417 2.683 1.00 0.00 H new ATOM 0 HG3 GLN A 139 0.508 -10.764 2.586 1.00 0.00 H new ATOM 0 HE21 GLN A 139 2.173 -11.970 4.696 1.00 0.00 H new ATOM 0 HE22 GLN A 139 1.265 -11.796 6.202 1.00 0.00 H new ATOM 2108 N ILE A 140 -3.018 -12.419 -0.474 1.00 0.00 N ATOM 2109 CA ILE A 140 -3.986 -13.219 -1.213 1.00 0.00 C ATOM 2110 C ILE A 140 -3.262 -13.814 -2.438 1.00 0.00 C ATOM 2111 O ILE A 140 -2.586 -13.059 -3.138 1.00 0.00 O ATOM 2112 CB ILE A 140 -5.207 -12.357 -1.581 1.00 0.00 C ATOM 2113 CG1 ILE A 140 -5.825 -11.774 -0.293 1.00 0.00 C ATOM 2114 CG2 ILE A 140 -6.239 -13.181 -2.366 1.00 0.00 C ATOM 2115 CD1 ILE A 140 -7.077 -10.929 -0.527 1.00 0.00 C ATOM 0 H ILE A 140 -3.232 -11.423 -0.431 1.00 0.00 H new ATOM 0 HA ILE A 140 -4.374 -14.043 -0.614 1.00 0.00 H new ATOM 0 HB ILE A 140 -4.888 -11.536 -2.224 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -6.074 -12.594 0.381 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -5.077 -11.163 0.212 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -7.093 -12.552 -2.615 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -5.784 -13.556 -3.283 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -6.573 -14.021 -1.757 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -7.449 -10.557 0.428 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.832 -10.087 -1.174 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -7.845 -11.540 -1.002 1.00 0.00 H new ATOM 2127 N PRO A 141 -3.354 -15.137 -2.686 1.00 0.00 N ATOM 2128 CA PRO A 141 -2.624 -15.819 -3.748 1.00 0.00 C ATOM 2129 C PRO A 141 -2.674 -15.117 -5.107 1.00 0.00 C ATOM 2130 O PRO A 141 -3.647 -14.437 -5.436 1.00 0.00 O ATOM 2131 CB PRO A 141 -3.238 -17.216 -3.842 1.00 0.00 C ATOM 2132 CG PRO A 141 -3.715 -17.491 -2.418 1.00 0.00 C ATOM 2133 CD PRO A 141 -4.102 -16.106 -1.894 1.00 0.00 C ATOM 0 HA PRO A 141 -1.563 -15.833 -3.497 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -4.063 -17.245 -4.554 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -2.507 -17.955 -4.170 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -4.563 -18.176 -2.404 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -2.930 -17.944 -1.813 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -5.175 -15.941 -1.992 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -3.860 -16.011 -0.835 1.00 0.00 H new ATOM 2141 N GLY A 142 -1.620 -15.283 -5.909 1.00 0.00 N ATOM 2142 CA GLY A 142 -1.545 -14.779 -7.274 1.00 0.00 C ATOM 2143 C GLY A 142 -1.258 -13.280 -7.339 1.00 0.00 C ATOM 2144 O GLY A 142 -0.457 -12.838 -8.160 1.00 0.00 O ATOM 0 H GLY A 142 -0.780 -15.782 -5.618 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -0.765 -15.317 -7.812 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -2.485 -14.986 -7.785 1.00 0.00 H new ATOM 2148 N HIS A 143 -1.913 -12.490 -6.490 1.00 0.00 N ATOM 2149 CA HIS A 143 -1.863 -11.035 -6.506 1.00 0.00 C ATOM 2150 C HIS A 143 -0.421 -10.510 -6.531 1.00 0.00 C ATOM 2151 O HIS A 143 -0.057 -9.732 -7.415 1.00 0.00 O ATOM 2152 CB HIS A 143 -2.657 -10.486 -5.314 1.00 0.00 C ATOM 2153 CG HIS A 143 -4.148 -10.761 -5.311 1.00 0.00 C ATOM 2154 ND1 HIS A 143 -5.063 -10.116 -4.479 1.00 0.00 N ATOM 2155 CD2 HIS A 143 -4.832 -11.630 -6.117 1.00 0.00 C ATOM 2156 CE1 HIS A 143 -6.267 -10.623 -4.782 1.00 0.00 C ATOM 2157 NE2 HIS A 143 -6.156 -11.538 -5.759 1.00 0.00 N ATOM 0 H HIS A 143 -2.511 -12.859 -5.751 1.00 0.00 H new ATOM 0 HA HIS A 143 -2.325 -10.678 -7.426 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -2.232 -10.901 -4.400 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -2.509 -9.407 -5.273 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -4.413 -12.264 -6.884 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -7.194 -10.336 -4.308 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -6.923 -12.073 -6.166 1.00 0.00 H new ATOM 2165 N ALA A 144 0.406 -10.954 -5.578 1.00 0.00 N ATOM 2166 CA ALA A 144 1.814 -10.570 -5.511 1.00 0.00 C ATOM 2167 C ALA A 144 2.533 -10.874 -6.828 1.00 0.00 C ATOM 2168 O ALA A 144 3.281 -10.043 -7.330 1.00 0.00 O ATOM 2169 CB ALA A 144 2.515 -11.287 -4.353 1.00 0.00 C ATOM 0 H ALA A 144 0.115 -11.589 -4.834 1.00 0.00 H new ATOM 0 HA ALA A 144 1.856 -9.495 -5.337 1.00 0.00 H new ATOM 0 HB1 ALA A 144 3.563 -10.987 -4.320 1.00 0.00 H new ATOM 0 HB2 ALA A 144 2.032 -11.019 -3.413 1.00 0.00 H new ATOM 0 HB3 ALA A 144 2.450 -12.365 -4.500 1.00 0.00 H new ATOM 2175 N ALA A 145 2.325 -12.077 -7.370 1.00 0.00 N ATOM 2176 CA ALA A 145 2.991 -12.530 -8.585 1.00 0.00 C ATOM 2177 C ALA A 145 2.558 -11.701 -9.795 1.00 0.00 C ATOM 2178 O ALA A 145 3.379 -11.360 -10.642 1.00 0.00 O ATOM 2179 CB ALA A 145 2.701 -14.019 -8.809 1.00 0.00 C ATOM 0 H ALA A 145 1.685 -12.765 -6.973 1.00 0.00 H new ATOM 0 HA ALA A 145 4.066 -12.393 -8.465 1.00 0.00 H new ATOM 0 HB1 ALA A 145 3.200 -14.354 -9.718 1.00 0.00 H new ATOM 0 HB2 ALA A 145 3.070 -14.593 -7.959 1.00 0.00 H new ATOM 0 HB3 ALA A 145 1.626 -14.169 -8.909 1.00 0.00 H new ATOM 2185 N THR A 146 1.262 -11.400 -9.884 1.00 0.00 N ATOM 2186 CA THR A 146 0.681 -10.731 -11.037 1.00 0.00 C ATOM 2187 C THR A 146 0.926 -9.221 -11.011 1.00 0.00 C ATOM 2188 O THR A 146 1.500 -8.687 -11.959 1.00 0.00 O ATOM 2189 CB THR A 146 -0.814 -11.062 -11.135 1.00 0.00 C ATOM 2190 OG1 THR A 146 -1.433 -10.899 -9.879 1.00 0.00 O ATOM 2191 CG2 THR A 146 -1.034 -12.504 -11.600 1.00 0.00 C ATOM 0 H THR A 146 0.586 -11.617 -9.151 1.00 0.00 H new ATOM 0 HA THR A 146 1.179 -11.104 -11.932 1.00 0.00 H new ATOM 0 HB THR A 146 -1.252 -10.379 -11.863 1.00 0.00 H new ATOM 0 HG1 THR A 146 -1.211 -11.660 -9.303 1.00 0.00 H new ATOM 0 HG21 THR A 146 -2.103 -12.708 -11.659 1.00 0.00 H new ATOM 0 HG22 THR A 146 -0.583 -12.642 -12.583 1.00 0.00 H new ATOM 0 HG23 THR A 146 -0.573 -13.190 -10.889 1.00 0.00 H new ATOM 2199 N GLY A 147 0.474 -8.511 -9.973 1.00 0.00 N ATOM 2200 CA GLY A 147 0.588 -7.056 -9.989 1.00 0.00 C ATOM 2201 C GLY A 147 0.085 -6.364 -8.727 1.00 0.00 C ATOM 2202 O GLY A 147 -0.501 -5.281 -8.816 1.00 0.00 O ATOM 0 H GLY A 147 0.040 -8.906 -9.139 1.00 0.00 H new ATOM 0 HA2 GLY A 147 1.634 -6.789 -10.141 1.00 0.00 H new ATOM 0 HA3 GLY A 147 0.033 -6.671 -10.844 1.00 0.00 H new ATOM 2206 N MET A 148 0.336 -6.966 -7.559 1.00 0.00 N ATOM 2207 CA MET A 148 0.025 -6.367 -6.271 1.00 0.00 C ATOM 2208 C MET A 148 1.286 -6.356 -5.401 1.00 0.00 C ATOM 2209 O MET A 148 1.347 -7.034 -4.373 1.00 0.00 O ATOM 2210 CB MET A 148 -1.129 -7.150 -5.625 1.00 0.00 C ATOM 2211 CG MET A 148 -1.973 -6.264 -4.717 1.00 0.00 C ATOM 2212 SD MET A 148 -3.715 -6.748 -4.615 1.00 0.00 S ATOM 2213 CE MET A 148 -4.430 -5.112 -4.488 1.00 0.00 C ATOM 0 H MET A 148 0.764 -7.889 -7.488 1.00 0.00 H new ATOM 0 HA MET A 148 -0.299 -5.333 -6.387 1.00 0.00 H new ATOM 0 HB2 MET A 148 -1.760 -7.578 -6.404 1.00 0.00 H new ATOM 0 HB3 MET A 148 -0.726 -7.983 -5.048 1.00 0.00 H new ATOM 0 HG2 MET A 148 -1.545 -6.278 -3.715 1.00 0.00 H new ATOM 0 HG3 MET A 148 -1.914 -5.236 -5.075 1.00 0.00 H new ATOM 0 HE1 MET A 148 -5.478 -5.149 -4.784 1.00 0.00 H new ATOM 0 HE2 MET A 148 -4.356 -4.762 -3.459 1.00 0.00 H new ATOM 0 HE3 MET A 148 -3.892 -4.428 -5.144 1.00 0.00 H new ATOM 2223 N PHE A 149 2.306 -5.601 -5.822 1.00 0.00 N ATOM 2224 CA PHE A 149 3.589 -5.518 -5.138 1.00 0.00 C ATOM 2225 C PHE A 149 4.259 -4.158 -5.376 1.00 0.00 C ATOM 2226 O PHE A 149 3.659 -3.272 -5.977 1.00 0.00 O ATOM 2227 CB PHE A 149 4.481 -6.683 -5.599 1.00 0.00 C ATOM 2228 CG PHE A 149 4.926 -6.604 -7.051 1.00 0.00 C ATOM 2229 CD1 PHE A 149 4.112 -7.141 -8.064 1.00 0.00 C ATOM 2230 CD2 PHE A 149 6.165 -6.025 -7.389 1.00 0.00 C ATOM 2231 CE1 PHE A 149 4.559 -7.159 -9.396 1.00 0.00 C ATOM 2232 CE2 PHE A 149 6.607 -6.033 -8.724 1.00 0.00 C ATOM 2233 CZ PHE A 149 5.806 -6.603 -9.727 1.00 0.00 C ATOM 0 H PHE A 149 2.257 -5.023 -6.661 1.00 0.00 H new ATOM 0 HA PHE A 149 3.431 -5.601 -4.063 1.00 0.00 H new ATOM 0 HB2 PHE A 149 5.366 -6.720 -4.963 1.00 0.00 H new ATOM 0 HB3 PHE A 149 3.941 -7.618 -5.449 1.00 0.00 H new ATOM 0 HD1 PHE A 149 3.140 -7.541 -7.817 1.00 0.00 H new ATOM 0 HD2 PHE A 149 6.777 -5.574 -6.621 1.00 0.00 H new ATOM 0 HE1 PHE A 149 3.944 -7.601 -10.166 1.00 0.00 H new ATOM 0 HE2 PHE A 149 7.563 -5.600 -8.978 1.00 0.00 H new ATOM 0 HZ PHE A 149 6.148 -6.614 -10.751 1.00 0.00 H new ATOM 2243 N GLY A 150 5.496 -3.986 -4.899 1.00 0.00 N ATOM 2244 CA GLY A 150 6.329 -2.810 -5.130 1.00 0.00 C ATOM 2245 C GLY A 150 7.547 -2.885 -4.224 1.00 0.00 C ATOM 2246 O GLY A 150 7.662 -3.797 -3.401 1.00 0.00 O ATOM 0 H GLY A 150 5.957 -4.689 -4.322 1.00 0.00 H new ATOM 0 HA2 GLY A 150 6.638 -2.766 -6.174 1.00 0.00 H new ATOM 0 HA3 GLY A 150 5.763 -1.901 -4.926 1.00 0.00 H new ATOM 2250 N LYS A 151 8.459 -1.932 -4.410 1.00 0.00 N ATOM 2251 CA LYS A 151 9.776 -1.901 -3.807 1.00 0.00 C ATOM 2252 C LYS A 151 9.921 -0.649 -2.945 1.00 0.00 C ATOM 2253 O LYS A 151 9.357 0.391 -3.281 1.00 0.00 O ATOM 2254 CB LYS A 151 10.841 -1.929 -4.918 1.00 0.00 C ATOM 2255 CG LYS A 151 10.451 -2.723 -6.184 1.00 0.00 C ATOM 2256 CD LYS A 151 9.727 -1.856 -7.231 1.00 0.00 C ATOM 2257 CE LYS A 151 8.944 -2.688 -8.252 1.00 0.00 C ATOM 2258 NZ LYS A 151 8.072 -1.824 -9.072 1.00 0.00 N ATOM 0 H LYS A 151 8.285 -1.128 -5.013 1.00 0.00 H new ATOM 0 HA LYS A 151 9.912 -2.772 -3.167 1.00 0.00 H new ATOM 0 HB2 LYS A 151 11.068 -0.903 -5.208 1.00 0.00 H new ATOM 0 HB3 LYS A 151 11.758 -2.355 -4.510 1.00 0.00 H new ATOM 0 HG2 LYS A 151 11.349 -3.150 -6.631 1.00 0.00 H new ATOM 0 HG3 LYS A 151 9.808 -3.556 -5.901 1.00 0.00 H new ATOM 0 HD2 LYS A 151 9.044 -1.176 -6.723 1.00 0.00 H new ATOM 0 HD3 LYS A 151 10.458 -1.241 -7.755 1.00 0.00 H new ATOM 0 HE2 LYS A 151 9.637 -3.229 -8.896 1.00 0.00 H new ATOM 0 HE3 LYS A 151 8.341 -3.434 -7.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 7.804 -2.327 -9.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 7.216 -1.584 -8.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 8.581 -0.952 -9.320 1.00 0.00 H new ATOM 2272 N ILE A 152 10.675 -0.751 -1.850 1.00 0.00 N ATOM 2273 CA ILE A 152 10.902 0.308 -0.881 1.00 0.00 C ATOM 2274 C ILE A 152 12.412 0.441 -0.685 1.00 0.00 C ATOM 2275 O ILE A 152 12.987 -0.305 0.102 1.00 0.00 O ATOM 2276 CB ILE A 152 10.222 -0.062 0.453 1.00 0.00 C ATOM 2277 CG1 ILE A 152 8.772 -0.532 0.269 1.00 0.00 C ATOM 2278 CG2 ILE A 152 10.300 1.110 1.431 1.00 0.00 C ATOM 2279 CD1 ILE A 152 8.023 -0.709 1.591 1.00 0.00 C ATOM 0 H ILE A 152 11.163 -1.614 -1.609 1.00 0.00 H new ATOM 0 HA ILE A 152 10.484 1.252 -1.230 1.00 0.00 H new ATOM 0 HB ILE A 152 10.769 -0.908 0.870 1.00 0.00 H new ATOM 0 HG12 ILE A 152 8.239 0.190 -0.349 1.00 0.00 H new ATOM 0 HG13 ILE A 152 8.770 -1.478 -0.272 1.00 0.00 H new ATOM 0 HG21 ILE A 152 9.816 0.835 2.368 1.00 0.00 H new ATOM 0 HG22 ILE A 152 11.345 1.357 1.621 1.00 0.00 H new ATOM 0 HG23 ILE A 152 9.795 1.976 1.003 1.00 0.00 H new ATOM 0 HD11 ILE A 152 7.005 -1.042 1.390 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.534 -1.453 2.202 1.00 0.00 H new ATOM 0 HD13 ILE A 152 7.995 0.242 2.124 1.00 0.00 H new ATOM 2291 N VAL A 153 13.072 1.363 -1.386 1.00 0.00 N ATOM 2292 CA VAL A 153 14.485 1.632 -1.164 1.00 0.00 C ATOM 2293 C VAL A 153 14.591 2.684 -0.067 1.00 0.00 C ATOM 2294 O VAL A 153 13.908 3.707 -0.129 1.00 0.00 O ATOM 2295 CB VAL A 153 15.173 2.144 -2.432 1.00 0.00 C ATOM 2296 CG1 VAL A 153 16.697 2.122 -2.209 1.00 0.00 C ATOM 2297 CG2 VAL A 153 14.829 1.289 -3.660 1.00 0.00 C ATOM 0 H VAL A 153 12.645 1.936 -2.114 1.00 0.00 H new ATOM 0 HA VAL A 153 14.983 0.706 -0.876 1.00 0.00 H new ATOM 0 HB VAL A 153 14.820 3.157 -2.626 1.00 0.00 H new ATOM 0 HG11 VAL A 153 17.201 2.484 -3.105 1.00 0.00 H new ATOM 0 HG12 VAL A 153 16.951 2.764 -1.365 1.00 0.00 H new ATOM 0 HG13 VAL A 153 17.019 1.102 -1.999 1.00 0.00 H new ATOM 0 HG21 VAL A 153 15.339 1.689 -4.536 1.00 0.00 H new ATOM 0 HG22 VAL A 153 15.151 0.262 -3.490 1.00 0.00 H new ATOM 0 HG23 VAL A 153 13.752 1.308 -3.827 1.00 0.00 H new ATOM 2307 N VAL A 154 15.453 2.446 0.919 1.00 0.00 N ATOM 2308 CA VAL A 154 15.611 3.308 2.072 1.00 0.00 C ATOM 2309 C VAL A 154 17.072 3.753 2.120 1.00 0.00 C ATOM 2310 O VAL A 154 17.946 2.895 2.197 1.00 0.00 O ATOM 2311 CB VAL A 154 15.223 2.517 3.329 1.00 0.00 C ATOM 2312 CG1 VAL A 154 15.216 3.469 4.526 1.00 0.00 C ATOM 2313 CG2 VAL A 154 13.845 1.854 3.202 1.00 0.00 C ATOM 0 H VAL A 154 16.069 1.633 0.933 1.00 0.00 H new ATOM 0 HA VAL A 154 14.972 4.189 2.014 1.00 0.00 H new ATOM 0 HB VAL A 154 15.956 1.721 3.463 1.00 0.00 H new ATOM 0 HG11 VAL A 154 14.942 2.919 5.426 1.00 0.00 H new ATOM 0 HG12 VAL A 154 16.209 3.901 4.653 1.00 0.00 H new ATOM 0 HG13 VAL A 154 14.493 4.266 4.353 1.00 0.00 H new ATOM 0 HG21 VAL A 154 13.619 1.307 4.117 1.00 0.00 H new ATOM 0 HG22 VAL A 154 13.086 2.620 3.039 1.00 0.00 H new ATOM 0 HG23 VAL A 154 13.850 1.163 2.359 1.00 0.00 H new ATOM 2323 N LYS A 155 17.369 5.056 2.073 1.00 0.00 N ATOM 2324 CA LYS A 155 18.749 5.540 2.187 1.00 0.00 C ATOM 2325 C LYS A 155 18.798 6.867 2.937 1.00 0.00 C ATOM 2326 O LYS A 155 17.763 7.457 3.239 1.00 0.00 O ATOM 2327 CB LYS A 155 19.408 5.710 0.810 1.00 0.00 C ATOM 2328 CG LYS A 155 19.587 4.423 -0.009 1.00 0.00 C ATOM 2329 CD LYS A 155 20.639 3.483 0.604 1.00 0.00 C ATOM 2330 CE LYS A 155 20.849 2.226 -0.249 1.00 0.00 C ATOM 2331 NZ LYS A 155 19.606 1.448 -0.399 1.00 0.00 N ATOM 0 H LYS A 155 16.674 5.793 1.957 1.00 0.00 H new ATOM 0 HA LYS A 155 19.304 4.786 2.746 1.00 0.00 H new ATOM 0 HB2 LYS A 155 18.810 6.410 0.226 1.00 0.00 H new ATOM 0 HB3 LYS A 155 20.387 6.168 0.951 1.00 0.00 H new ATOM 0 HG2 LYS A 155 18.632 3.902 -0.076 1.00 0.00 H new ATOM 0 HG3 LYS A 155 19.882 4.680 -1.026 1.00 0.00 H new ATOM 0 HD2 LYS A 155 21.585 4.015 0.706 1.00 0.00 H new ATOM 0 HD3 LYS A 155 20.326 3.193 1.607 1.00 0.00 H new ATOM 0 HE2 LYS A 155 21.218 2.513 -1.234 1.00 0.00 H new ATOM 0 HE3 LYS A 155 21.615 1.601 0.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 19.817 0.434 -0.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 18.927 1.733 0.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 19.195 1.627 -1.338 1.00 0.00 H new