USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1149 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 52 THR OG1 : rot -122:sc= 1.03 USER MOD Set 1.2: A 156 GLN : amide:sc= 1.78 K(o=2.8,f=-1.5) USER MOD Set 2.1: A 60 SER OG : rot -34:sc= 0.807 USER MOD Set 2.2: A 149 HIS : no HE2:sc= 0.972 K(o=1.8,f=-12!) USER MOD Set 3.1: A 120 LYS NZ :NH3+ -160:sc= 2.33 (180deg=0.517) USER MOD Set 3.2: A 122 SER OG : rot 46:sc= 1.01 USER MOD Set 4.1: A 86 LYS NZ :NH3+ 145:sc= 2.07 (180deg=0) USER MOD Set 4.2: A 87 SER OG : rot -104:sc= 2.26 USER MOD Set 4.3: A 145 ASN : amide:sc= 1.31 K(o=5.6,f=-5.4!) USER MOD Set 5.1: A 40 THR OG1 : rot -127:sc= 0.0918 USER MOD Set 5.2: A 106 HIS : no HE2:sc= -1.61 K(o=-1.5,f=-6.6!) USER MOD Set 6.1: A 14 GLN : amide:sc= 0.785 K(o=2.5,f=1.7) USER MOD Set 6.2: A 41 SER OG : rot 64:sc= 1.76 USER MOD Set 7.1: A 11 GLN : amide:sc= 1.11 K(o=2.3,f=-8.5!) USER MOD Set 7.2: A 27 LYS NZ :NH3+ -116:sc= 1.17 (180deg=-1.04) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 139:sc= 0.225 (180deg=0.00336) USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 3 SER OG : rot 180:sc= -0.0285 USER MOD Single : A 4 HIS : no HE2:sc= 1.01 K(o=1,f=-3.1!) USER MOD Single : A 5 SER OG : rot 180:sc= -0.037 USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.0168 USER MOD Single : A 12 THR OG1 : rot -100:sc= 1.1 USER MOD Single : A 16 GLN : amide:sc= -0.461 X(o=-0.46,f=-0.18) USER MOD Single : A 18 SER OG : rot -69:sc= 1.27 USER MOD Single : A 20 HIS : no HE2:sc=-0.00417 X(o=-0.0042,f=-0.27) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 172:sc= 1.27 (180deg=1.07) USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 39 HIS : no HE2:sc= 0.445 K(o=0.45,f=-4.8!) USER MOD Single : A 44 LYS NZ :NH3+ -151:sc= 0.93 (180deg=-2.28!) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -18:sc= 0.725 USER MOD Single : A 66 LYS NZ :NH3+ -126:sc= 1.03 (180deg=-1.25!) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0.0599 USER MOD Single : A 69 TYR OH : rot 180:sc= 0.199 USER MOD Single : A 70 THR OG1 : rot 12:sc= 1.21 USER MOD Single : A 76 LYS NZ :NH3+ -161:sc= 0.0293 (180deg=-0.0714) USER MOD Single : A 77 GLN : amide:sc= -4.91! C(o=-4.9!,f=-0.65!) USER MOD Single : A 79 ASN : amide:sc= -0.511 K(o=-0.51,f=-6.3!) USER MOD Single : A 81 LYS NZ :NH3+ 171:sc= 0.696 (180deg=0.166) USER MOD Single : A 84 HIS : no HE2:sc= -1.99 K(o=-2,f=-3.8) USER MOD Single : A 91 ASN : amide:sc= 0.419 K(o=0.42,f=-7.8!) USER MOD Single : A 100 LYS NZ :NH3+ 168:sc= 0.535 (180deg=-0.625!) USER MOD Single : A 104 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0447) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 11:sc= 0.656 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0.629 K(o=0.63,f=-0.083) USER MOD Single : A 117 GLN : amide:sc= -1.2 X(o=-1.2,f=-0.75) USER MOD Single : A 123 TYR OH : rot -7:sc= 1.25 USER MOD Single : A 124 SER OG : rot 28:sc= 0.383 USER MOD Single : A 131 LYS NZ :NH3+ -141:sc= -0.013 (180deg=-1.08) USER MOD Single : A 133 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.0076) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ -115:sc= -0.0936 (180deg=-1.18) USER MOD Single : A 143 THR OG1 : rot -119:sc= -1.22 USER MOD Single : A 155 LYS NZ :NH3+ 164:sc= 1.85 (180deg=0.858) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -40.210 -52.534 -20.192 1.00 52.57 N ATOM 2 CA MET A 1 -40.131 -51.100 -19.871 1.00 51.88 C ATOM 3 C MET A 1 -38.703 -50.834 -19.412 1.00 50.19 C ATOM 4 O MET A 1 -38.086 -51.765 -18.901 1.00 50.00 O ATOM 5 CB MET A 1 -41.154 -50.748 -18.781 1.00 52.85 C ATOM 6 CG MET A 1 -41.184 -49.254 -18.427 1.00 53.00 C ATOM 7 SD MET A 1 -42.475 -48.815 -17.237 1.00 54.42 S ATOM 8 CE MET A 1 -42.171 -47.042 -17.079 1.00 54.38 C ATOM 0 H1 MET A 1 -41.112 -52.918 -19.845 1.00 52.57 H new ATOM 0 H2 MET A 1 -40.152 -52.663 -21.222 1.00 52.57 H new ATOM 0 H3 MET A 1 -39.422 -53.036 -19.735 1.00 52.57 H new ATOM 0 HA MET A 1 -40.368 -50.479 -20.735 1.00 51.88 H new ATOM 0 HB2 MET A 1 -42.146 -51.054 -19.113 1.00 52.85 H new ATOM 0 HB3 MET A 1 -40.927 -51.322 -17.882 1.00 52.85 H new ATOM 0 HG2 MET A 1 -40.214 -48.966 -18.021 1.00 53.00 H new ATOM 0 HG3 MET A 1 -41.331 -48.676 -19.339 1.00 53.00 H new ATOM 0 HE1 MET A 1 -42.885 -46.612 -16.377 1.00 54.38 H new ATOM 0 HE2 MET A 1 -41.158 -46.878 -16.712 1.00 54.38 H new ATOM 0 HE3 MET A 1 -42.286 -46.565 -18.052 1.00 54.38 H new ATOM 20 N GLN A 2 -38.183 -49.623 -19.616 1.00 49.05 N ATOM 21 CA GLN A 2 -36.839 -49.224 -19.237 1.00 47.38 C ATOM 22 C GLN A 2 -36.834 -47.695 -19.217 1.00 46.27 C ATOM 23 O GLN A 2 -37.686 -47.082 -19.858 1.00 46.70 O ATOM 24 CB GLN A 2 -35.835 -49.792 -20.254 1.00 46.97 C ATOM 25 CG GLN A 2 -34.369 -49.485 -19.912 1.00 46.01 C ATOM 26 CD GLN A 2 -33.395 -50.170 -20.870 1.00 45.95 C ATOM 27 OE1 GLN A 2 -33.797 -50.882 -21.784 1.00 46.75 O ATOM 28 NE2 GLN A 2 -32.098 -49.957 -20.671 1.00 45.09 N ATOM 0 H GLN A 2 -38.708 -48.873 -20.065 1.00 49.05 H new ATOM 0 HA GLN A 2 -36.549 -49.607 -18.258 1.00 47.38 H new ATOM 0 HB2 GLN A 2 -35.966 -50.872 -20.316 1.00 46.97 H new ATOM 0 HB3 GLN A 2 -36.061 -49.386 -21.240 1.00 46.97 H new ATOM 0 HG2 GLN A 2 -34.209 -48.407 -19.943 1.00 46.01 H new ATOM 0 HG3 GLN A 2 -34.161 -49.809 -18.892 1.00 46.01 H new ATOM 0 HE21 GLN A 2 -31.791 -49.360 -19.903 1.00 45.09 H new ATOM 0 HE22 GLN A 2 -31.410 -50.390 -21.286 1.00 45.09 H new ATOM 37 N SER A 3 -35.900 -47.093 -18.481 1.00 44.94 N ATOM 38 CA SER A 3 -35.597 -45.672 -18.522 1.00 43.68 C ATOM 39 C SER A 3 -34.225 -45.494 -17.872 1.00 41.88 C ATOM 40 O SER A 3 -33.624 -46.481 -17.441 1.00 41.81 O ATOM 41 CB SER A 3 -36.684 -44.849 -17.816 1.00 44.44 C ATOM 42 OG SER A 3 -36.410 -43.468 -17.969 1.00 43.96 O ATOM 0 H SER A 3 -35.316 -47.604 -17.819 1.00 44.94 H new ATOM 0 HA SER A 3 -35.576 -45.306 -19.549 1.00 43.68 H new ATOM 0 HB2 SER A 3 -37.662 -45.084 -18.235 1.00 44.44 H new ATOM 0 HB3 SER A 3 -36.720 -45.108 -16.758 1.00 44.44 H new ATOM 0 HG SER A 3 -37.106 -42.945 -17.519 1.00 43.96 H new ATOM 48 N HIS A 4 -33.750 -44.251 -17.806 1.00 40.52 N ATOM 49 CA HIS A 4 -32.487 -43.827 -17.219 1.00 38.70 C ATOM 50 C HIS A 4 -32.484 -42.299 -17.192 1.00 37.60 C ATOM 51 O HIS A 4 -33.334 -41.670 -17.819 1.00 38.24 O ATOM 52 CB HIS A 4 -31.288 -44.365 -18.028 1.00 38.01 C ATOM 53 CG HIS A 4 -30.486 -45.407 -17.290 1.00 38.01 C ATOM 54 ND1 HIS A 4 -30.974 -46.589 -16.785 1.00 39.14 N ATOM 55 CD2 HIS A 4 -29.153 -45.344 -16.978 1.00 37.01 C ATOM 56 CE1 HIS A 4 -29.957 -47.227 -16.184 1.00 38.85 C ATOM 57 NE2 HIS A 4 -28.826 -46.508 -16.276 1.00 37.58 N ATOM 0 H HIS A 4 -34.275 -43.464 -18.187 1.00 40.52 H new ATOM 0 HA HIS A 4 -32.389 -44.226 -16.210 1.00 38.70 H new ATOM 0 HB2 HIS A 4 -31.652 -44.792 -18.962 1.00 38.01 H new ATOM 0 HB3 HIS A 4 -30.634 -43.533 -18.291 1.00 38.01 H new ATOM 0 HD1 HIS A 4 -31.936 -46.921 -16.854 1.00 39.14 H new ATOM 0 HD2 HIS A 4 -28.477 -44.540 -17.229 1.00 37.01 H new ATOM 0 HE1 HIS A 4 -30.037 -48.186 -15.694 1.00 38.85 H new ATOM 65 N SER A 5 -31.525 -41.709 -16.476 1.00 36.01 N ATOM 66 CA SER A 5 -31.236 -40.285 -16.482 1.00 34.73 C ATOM 67 C SER A 5 -29.880 -40.106 -15.799 1.00 33.03 C ATOM 68 O SER A 5 -29.266 -41.092 -15.390 1.00 33.09 O ATOM 69 CB SER A 5 -32.345 -39.487 -15.779 1.00 35.33 C ATOM 70 OG SER A 5 -32.082 -38.099 -15.885 1.00 34.86 O ATOM 0 H SER A 5 -30.909 -42.234 -15.855 1.00 36.01 H new ATOM 0 HA SER A 5 -31.198 -39.900 -17.501 1.00 34.73 H new ATOM 0 HB2 SER A 5 -33.311 -39.718 -16.227 1.00 35.33 H new ATOM 0 HB3 SER A 5 -32.403 -39.776 -14.730 1.00 35.33 H new ATOM 0 HG SER A 5 -32.793 -37.596 -15.436 1.00 34.86 H new ATOM 76 N ALA A 6 -29.433 -38.857 -15.670 1.00 31.64 N ATOM 77 CA ALA A 6 -28.198 -38.465 -15.012 1.00 29.95 C ATOM 78 C ALA A 6 -28.240 -36.954 -14.803 1.00 28.98 C ATOM 79 O ALA A 6 -28.966 -36.259 -15.512 1.00 29.44 O ATOM 80 CB ALA A 6 -26.987 -38.857 -15.868 1.00 29.14 C ATOM 0 H ALA A 6 -29.949 -38.059 -16.040 1.00 31.64 H new ATOM 0 HA ALA A 6 -28.102 -38.975 -14.053 1.00 29.95 H new ATOM 0 HB1 ALA A 6 -26.070 -38.556 -15.361 1.00 29.14 H new ATOM 0 HB2 ALA A 6 -26.981 -39.937 -16.018 1.00 29.14 H new ATOM 0 HB3 ALA A 6 -27.048 -38.357 -16.835 1.00 29.14 H new ATOM 86 N LEU A 7 -27.471 -36.451 -13.836 1.00 27.74 N ATOM 87 CA LEU A 7 -27.296 -35.042 -13.549 1.00 26.66 C ATOM 88 C LEU A 7 -25.834 -34.857 -13.152 1.00 25.02 C ATOM 89 O LEU A 7 -25.183 -35.821 -12.753 1.00 24.97 O ATOM 90 CB LEU A 7 -28.205 -34.637 -12.381 1.00 27.27 C ATOM 91 CG LEU A 7 -29.708 -34.608 -12.706 1.00 28.05 C ATOM 92 CD1 LEU A 7 -30.492 -34.333 -11.418 1.00 28.22 C ATOM 93 CD2 LEU A 7 -30.054 -33.526 -13.738 1.00 28.47 C ATOM 0 H LEU A 7 -26.933 -37.048 -13.208 1.00 27.74 H new ATOM 0 HA LEU A 7 -27.552 -34.427 -14.411 1.00 26.66 H new ATOM 0 HB2 LEU A 7 -28.041 -35.329 -11.555 1.00 27.27 H new ATOM 0 HB3 LEU A 7 -27.905 -33.649 -12.033 1.00 27.27 H new ATOM 0 HG LEU A 7 -29.977 -35.576 -13.130 1.00 28.05 H new ATOM 0 HD11 LEU A 7 -31.559 -34.311 -11.639 1.00 28.22 H new ATOM 0 HD12 LEU A 7 -30.288 -35.121 -10.693 1.00 28.22 H new ATOM 0 HD13 LEU A 7 -30.187 -33.372 -11.005 1.00 28.22 H new ATOM 0 HD21 LEU A 7 -31.126 -33.542 -13.937 1.00 28.47 H new ATOM 0 HD22 LEU A 7 -29.772 -32.548 -13.348 1.00 28.47 H new ATOM 0 HD23 LEU A 7 -29.510 -33.718 -14.663 1.00 28.47 H new ATOM 105 N THR A 8 -25.323 -33.630 -13.251 1.00 23.80 N ATOM 106 CA THR A 8 -23.991 -33.250 -12.811 1.00 22.22 C ATOM 107 C THR A 8 -23.972 -31.724 -12.724 1.00 21.16 C ATOM 108 O THR A 8 -24.888 -31.073 -13.225 1.00 21.68 O ATOM 109 CB THR A 8 -22.913 -33.823 -13.748 1.00 21.81 C ATOM 110 OG1 THR A 8 -21.620 -33.455 -13.307 1.00 20.54 O ATOM 111 CG2 THR A 8 -23.095 -33.401 -15.211 1.00 21.99 C ATOM 0 H THR A 8 -25.846 -32.852 -13.653 1.00 23.80 H new ATOM 0 HA THR A 8 -23.758 -33.668 -11.832 1.00 22.22 H new ATOM 0 HB THR A 8 -23.026 -34.906 -13.708 1.00 21.81 H new ATOM 0 HG1 THR A 8 -20.948 -33.830 -13.914 1.00 20.54 H new ATOM 0 HG21 THR A 8 -22.302 -33.839 -15.817 1.00 21.99 H new ATOM 0 HG22 THR A 8 -24.063 -33.749 -15.572 1.00 21.99 H new ATOM 0 HG23 THR A 8 -23.050 -32.314 -15.285 1.00 21.99 H new ATOM 119 N ALA A 9 -22.942 -31.164 -12.088 1.00 19.83 N ATOM 120 CA ALA A 9 -22.744 -29.735 -11.916 1.00 18.72 C ATOM 121 C ALA A 9 -21.297 -29.526 -11.477 1.00 17.28 C ATOM 122 O ALA A 9 -20.577 -30.499 -11.256 1.00 17.43 O ATOM 123 CB ALA A 9 -23.722 -29.190 -10.868 1.00 19.14 C ATOM 0 H ALA A 9 -22.198 -31.719 -11.665 1.00 19.83 H new ATOM 0 HA ALA A 9 -22.934 -29.199 -12.846 1.00 18.72 H new ATOM 0 HB1 ALA A 9 -23.565 -28.118 -10.747 1.00 19.14 H new ATOM 0 HB2 ALA A 9 -24.745 -29.372 -11.196 1.00 19.14 H new ATOM 0 HB3 ALA A 9 -23.551 -29.692 -9.915 1.00 19.14 H new ATOM 129 N PHE A 10 -20.871 -28.270 -11.342 1.00 16.07 N ATOM 130 CA PHE A 10 -19.585 -27.895 -10.778 1.00 14.73 C ATOM 131 C PHE A 10 -19.695 -26.439 -10.330 1.00 13.87 C ATOM 132 O PHE A 10 -20.763 -25.840 -10.454 1.00 14.44 O ATOM 133 CB PHE A 10 -18.444 -28.125 -11.784 1.00 14.27 C ATOM 134 CG PHE A 10 -18.403 -27.169 -12.963 1.00 14.20 C ATOM 135 CD1 PHE A 10 -19.322 -27.312 -14.018 1.00 15.01 C ATOM 136 CD2 PHE A 10 -17.403 -26.178 -13.040 1.00 13.71 C ATOM 137 CE1 PHE A 10 -19.251 -26.465 -15.138 1.00 15.40 C ATOM 138 CE2 PHE A 10 -17.315 -25.351 -14.173 1.00 14.10 C ATOM 139 CZ PHE A 10 -18.245 -25.487 -15.217 1.00 14.97 C ATOM 0 H PHE A 10 -21.430 -27.467 -11.631 1.00 16.07 H new ATOM 0 HA PHE A 10 -19.338 -28.520 -9.920 1.00 14.73 H new ATOM 0 HB2 PHE A 10 -17.495 -28.057 -11.251 1.00 14.27 H new ATOM 0 HB3 PHE A 10 -18.522 -29.142 -12.167 1.00 14.27 H new ATOM 0 HD1 PHE A 10 -20.085 -28.075 -13.968 1.00 15.01 H new ATOM 0 HD2 PHE A 10 -16.703 -26.054 -12.227 1.00 13.71 H new ATOM 0 HE1 PHE A 10 -19.970 -26.566 -15.938 1.00 15.40 H new ATOM 0 HE2 PHE A 10 -16.532 -24.610 -14.241 1.00 14.10 H new ATOM 0 HZ PHE A 10 -18.187 -24.840 -16.080 1.00 14.97 H new ATOM 149 N GLN A 11 -18.609 -25.881 -9.795 1.00 12.75 N ATOM 150 CA GLN A 11 -18.502 -24.488 -9.402 1.00 11.84 C ATOM 151 C GLN A 11 -17.088 -24.045 -9.761 1.00 10.42 C ATOM 152 O GLN A 11 -16.192 -24.889 -9.825 1.00 10.46 O ATOM 153 CB GLN A 11 -18.684 -24.357 -7.884 1.00 12.18 C ATOM 154 CG GLN A 11 -20.064 -24.781 -7.373 1.00 13.48 C ATOM 155 CD GLN A 11 -20.160 -24.642 -5.854 1.00 13.94 C ATOM 156 OE1 GLN A 11 -19.150 -24.677 -5.148 1.00 13.67 O ATOM 157 NE2 GLN A 11 -21.370 -24.483 -5.329 1.00 14.95 N ATOM 0 H GLN A 11 -17.754 -26.410 -9.620 1.00 12.75 H new ATOM 0 HA GLN A 11 -19.261 -23.885 -9.901 1.00 11.84 H new ATOM 0 HB2 GLN A 11 -17.925 -24.960 -7.386 1.00 12.18 H new ATOM 0 HB3 GLN A 11 -18.507 -23.320 -7.597 1.00 12.18 H new ATOM 0 HG2 GLN A 11 -20.833 -24.170 -7.846 1.00 13.48 H new ATOM 0 HG3 GLN A 11 -20.258 -25.815 -7.659 1.00 13.48 H new ATOM 0 HE21 GLN A 11 -22.190 -24.457 -5.935 1.00 14.95 H new ATOM 0 HE22 GLN A 11 -21.479 -24.386 -4.319 1.00 14.95 H new ATOM 166 N THR A 12 -16.871 -22.741 -9.933 1.00 9.49 N ATOM 167 CA THR A 12 -15.534 -22.179 -9.974 1.00 8.21 C ATOM 168 C THR A 12 -15.574 -20.688 -9.666 1.00 7.10 C ATOM 169 O THR A 12 -16.477 -19.968 -10.085 1.00 7.67 O ATOM 170 CB THR A 12 -14.806 -22.494 -11.285 1.00 8.95 C ATOM 171 OG1 THR A 12 -13.599 -21.770 -11.357 1.00 8.83 O ATOM 172 CG2 THR A 12 -15.652 -22.213 -12.529 1.00 9.79 C ATOM 0 H THR A 12 -17.616 -22.054 -10.047 1.00 9.49 H new ATOM 0 HA THR A 12 -14.944 -22.661 -9.194 1.00 8.21 H new ATOM 0 HB THR A 12 -14.603 -23.565 -11.275 1.00 8.95 H new ATOM 0 HG1 THR A 12 -13.725 -20.979 -11.921 1.00 8.83 H new ATOM 0 HG21 THR A 12 -15.077 -22.457 -13.423 1.00 9.79 H new ATOM 0 HG22 THR A 12 -16.555 -22.823 -12.500 1.00 9.79 H new ATOM 0 HG23 THR A 12 -15.927 -21.158 -12.551 1.00 9.79 H new ATOM 180 N GLU A 13 -14.573 -20.276 -8.899 1.00 5.92 N ATOM 181 CA GLU A 13 -14.320 -18.959 -8.367 1.00 4.97 C ATOM 182 C GLU A 13 -14.228 -17.920 -9.496 1.00 5.53 C ATOM 183 O GLU A 13 -14.742 -16.810 -9.368 1.00 5.73 O ATOM 184 CB GLU A 13 -13.016 -19.032 -7.552 1.00 4.17 C ATOM 185 CG GLU A 13 -13.098 -19.656 -6.136 1.00 4.38 C ATOM 186 CD GLU A 13 -13.503 -21.120 -5.939 1.00 6.18 C ATOM 187 OE1 GLU A 13 -13.345 -21.599 -4.792 1.00 7.04 O ATOM 188 OE2 GLU A 13 -13.976 -21.762 -6.900 1.00 7.21 O ATOM 0 H GLU A 13 -13.847 -20.931 -8.609 1.00 5.92 H new ATOM 0 HA GLU A 13 -15.140 -18.640 -7.724 1.00 4.97 H new ATOM 0 HB2 GLU A 13 -12.288 -19.601 -8.130 1.00 4.17 H new ATOM 0 HB3 GLU A 13 -12.623 -18.020 -7.453 1.00 4.17 H new ATOM 0 HG2 GLU A 13 -12.118 -19.532 -5.676 1.00 4.38 H new ATOM 0 HG3 GLU A 13 -13.799 -19.051 -5.561 1.00 4.38 H new ATOM 195 N GLN A 14 -13.534 -18.270 -10.585 1.00 6.40 N ATOM 196 CA GLN A 14 -13.332 -17.432 -11.766 1.00 7.74 C ATOM 197 C GLN A 14 -13.548 -18.291 -13.015 1.00 8.63 C ATOM 198 O GLN A 14 -13.827 -19.482 -12.883 1.00 8.59 O ATOM 199 CB GLN A 14 -11.929 -16.799 -11.714 1.00 8.47 C ATOM 200 CG GLN A 14 -11.874 -15.739 -10.607 1.00 8.91 C ATOM 201 CD GLN A 14 -10.473 -15.200 -10.365 1.00 9.88 C ATOM 202 OE1 GLN A 14 -9.724 -15.768 -9.578 1.00 10.24 O ATOM 203 NE2 GLN A 14 -10.123 -14.078 -10.986 1.00 10.72 N ATOM 0 H GLN A 14 -13.081 -19.180 -10.668 1.00 6.40 H new ATOM 0 HA GLN A 14 -14.049 -16.611 -11.795 1.00 7.74 H new ATOM 0 HB2 GLN A 14 -11.180 -17.569 -11.529 1.00 8.47 H new ATOM 0 HB3 GLN A 14 -11.690 -16.345 -12.676 1.00 8.47 H new ATOM 0 HG2 GLN A 14 -12.534 -14.913 -10.871 1.00 8.91 H new ATOM 0 HG3 GLN A 14 -12.256 -16.169 -9.681 1.00 8.91 H new ATOM 0 HE21 GLN A 14 -10.771 -13.631 -11.635 1.00 10.72 H new ATOM 0 HE22 GLN A 14 -9.207 -13.664 -10.813 1.00 10.72 H new ATOM 212 N ILE A 15 -13.458 -17.693 -14.210 1.00 9.81 N ATOM 213 CA ILE A 15 -13.773 -18.321 -15.491 1.00 11.02 C ATOM 214 C ILE A 15 -12.670 -18.003 -16.505 1.00 11.85 C ATOM 215 O ILE A 15 -12.089 -16.920 -16.448 1.00 12.15 O ATOM 216 CB ILE A 15 -15.136 -17.792 -15.991 1.00 11.85 C ATOM 217 CG1 ILE A 15 -16.283 -18.021 -14.987 1.00 11.76 C ATOM 218 CG2 ILE A 15 -15.521 -18.376 -17.359 1.00 13.32 C ATOM 219 CD1 ILE A 15 -16.709 -19.487 -14.858 1.00 12.55 C ATOM 0 H ILE A 15 -13.153 -16.725 -14.310 1.00 9.81 H new ATOM 0 HA ILE A 15 -13.832 -19.403 -15.371 1.00 11.02 H new ATOM 0 HB ILE A 15 -14.997 -16.716 -16.095 1.00 11.85 H new ATOM 0 HG12 ILE A 15 -15.975 -17.655 -14.008 1.00 11.76 H new ATOM 0 HG13 ILE A 15 -17.145 -17.428 -15.293 1.00 11.76 H new ATOM 0 HG21 ILE A 15 -16.486 -17.974 -17.668 1.00 13.32 H new ATOM 0 HG22 ILE A 15 -14.764 -18.107 -18.096 1.00 13.32 H new ATOM 0 HG23 ILE A 15 -15.587 -19.462 -17.286 1.00 13.32 H new ATOM 0 HD11 ILE A 15 -17.520 -19.568 -14.134 1.00 12.55 H new ATOM 0 HD12 ILE A 15 -17.049 -19.854 -15.826 1.00 12.55 H new ATOM 0 HD13 ILE A 15 -15.861 -20.084 -14.522 1.00 12.55 H new ATOM 231 N GLN A 16 -12.426 -18.930 -17.439 1.00 12.66 N ATOM 232 CA GLN A 16 -11.638 -18.790 -18.657 1.00 13.90 C ATOM 233 C GLN A 16 -10.181 -19.163 -18.387 1.00 13.81 C ATOM 234 O GLN A 16 -9.293 -18.326 -18.518 1.00 14.44 O ATOM 235 CB GLN A 16 -11.841 -17.420 -19.338 1.00 15.34 C ATOM 236 CG GLN A 16 -11.673 -17.457 -20.867 1.00 16.88 C ATOM 237 CD GLN A 16 -10.237 -17.693 -21.332 1.00 18.02 C ATOM 238 OE1 GLN A 16 -9.514 -16.746 -21.620 1.00 19.31 O ATOM 239 NE2 GLN A 16 -9.824 -18.952 -21.457 1.00 17.86 N ATOM 0 H GLN A 16 -12.808 -19.871 -17.350 1.00 12.66 H new ATOM 0 HA GLN A 16 -12.003 -19.501 -19.398 1.00 13.90 H new ATOM 0 HB2 GLN A 16 -12.838 -17.050 -19.100 1.00 15.34 H new ATOM 0 HB3 GLN A 16 -11.129 -16.708 -18.920 1.00 15.34 H new ATOM 0 HG2 GLN A 16 -12.309 -18.244 -21.272 1.00 16.88 H new ATOM 0 HG3 GLN A 16 -12.028 -16.514 -21.284 1.00 16.88 H new ATOM 0 HE21 GLN A 16 -10.448 -19.720 -21.210 1.00 17.86 H new ATOM 0 HE22 GLN A 16 -8.884 -19.149 -21.800 1.00 17.86 H new ATOM 248 N ASP A 17 -9.954 -20.432 -18.031 1.00 13.46 N ATOM 249 CA ASP A 17 -8.648 -21.071 -17.832 1.00 13.77 C ATOM 250 C ASP A 17 -7.962 -20.572 -16.555 1.00 12.87 C ATOM 251 O ASP A 17 -7.680 -21.361 -15.651 1.00 12.26 O ATOM 252 CB ASP A 17 -7.753 -20.959 -19.073 1.00 15.56 C ATOM 253 CG ASP A 17 -6.487 -21.792 -18.912 1.00 16.27 C ATOM 254 OD1 ASP A 17 -5.400 -21.228 -19.146 1.00 17.25 O ATOM 255 OD2 ASP A 17 -6.634 -22.988 -18.578 1.00 16.04 O ATOM 0 H ASP A 17 -10.724 -21.080 -17.864 1.00 13.46 H new ATOM 0 HA ASP A 17 -8.828 -22.137 -17.689 1.00 13.77 H new ATOM 0 HB2 ASP A 17 -8.303 -21.293 -19.953 1.00 15.56 H new ATOM 0 HB3 ASP A 17 -7.487 -19.915 -19.240 1.00 15.56 H new ATOM 260 N SER A 18 -7.819 -19.249 -16.427 1.00 13.00 N ATOM 261 CA SER A 18 -7.591 -18.516 -15.187 1.00 12.23 C ATOM 262 C SER A 18 -8.281 -19.176 -13.993 1.00 10.46 C ATOM 263 O SER A 18 -7.704 -19.291 -12.912 1.00 10.08 O ATOM 264 CB SER A 18 -8.166 -17.108 -15.374 1.00 12.70 C ATOM 265 OG SER A 18 -7.582 -16.518 -16.514 1.00 14.07 O ATOM 0 H SER A 18 -7.863 -18.629 -17.236 1.00 13.00 H new ATOM 0 HA SER A 18 -6.521 -18.499 -14.979 1.00 12.23 H new ATOM 0 HB2 SER A 18 -9.249 -17.156 -15.489 1.00 12.70 H new ATOM 0 HB3 SER A 18 -7.966 -16.500 -14.492 1.00 12.70 H new ATOM 0 HG SER A 18 -6.636 -16.330 -16.337 1.00 14.07 H new ATOM 271 N GLU A 19 -9.529 -19.608 -14.212 1.00 9.73 N ATOM 272 CA GLU A 19 -10.342 -20.359 -13.273 1.00 8.47 C ATOM 273 C GLU A 19 -9.528 -21.377 -12.483 1.00 8.38 C ATOM 274 O GLU A 19 -9.601 -21.395 -11.256 1.00 7.65 O ATOM 275 CB GLU A 19 -11.500 -21.012 -14.034 1.00 8.87 C ATOM 276 CG GLU A 19 -11.134 -22.039 -15.109 1.00 10.17 C ATOM 277 CD GLU A 19 -12.305 -22.230 -16.060 1.00 10.47 C ATOM 278 OE1 GLU A 19 -12.284 -21.546 -17.110 1.00 11.03 O ATOM 279 OE2 GLU A 19 -13.217 -23.000 -15.696 1.00 10.48 O ATOM 0 H GLU A 19 -10.013 -19.431 -15.092 1.00 9.73 H new ATOM 0 HA GLU A 19 -10.745 -19.672 -12.528 1.00 8.47 H new ATOM 0 HB2 GLU A 19 -12.151 -21.499 -13.308 1.00 8.87 H new ATOM 0 HB3 GLU A 19 -12.084 -20.222 -14.505 1.00 8.87 H new ATOM 0 HG2 GLU A 19 -10.256 -21.704 -15.661 1.00 10.17 H new ATOM 0 HG3 GLU A 19 -10.873 -22.989 -14.643 1.00 10.17 H new ATOM 286 N HIS A 20 -8.743 -22.202 -13.178 1.00 9.56 N ATOM 287 CA HIS A 20 -7.961 -23.274 -12.590 1.00 10.18 C ATOM 288 C HIS A 20 -7.107 -22.745 -11.437 1.00 10.08 C ATOM 289 O HIS A 20 -7.108 -23.315 -10.345 1.00 9.99 O ATOM 290 CB HIS A 20 -7.114 -23.926 -13.687 1.00 11.80 C ATOM 291 CG HIS A 20 -6.340 -25.136 -13.234 1.00 12.84 C ATOM 292 ND1 HIS A 20 -5.012 -25.386 -13.493 1.00 14.05 N ATOM 293 CD2 HIS A 20 -6.844 -26.222 -12.570 1.00 13.07 C ATOM 294 CE1 HIS A 20 -4.723 -26.595 -12.979 1.00 14.92 C ATOM 295 NE2 HIS A 20 -5.806 -27.142 -12.405 1.00 14.43 N ATOM 0 H HIS A 20 -8.636 -22.136 -14.190 1.00 9.56 H new ATOM 0 HA HIS A 20 -8.620 -24.032 -12.167 1.00 10.18 H new ATOM 0 HB2 HIS A 20 -7.767 -24.214 -14.511 1.00 11.80 H new ATOM 0 HB3 HIS A 20 -6.415 -23.187 -14.078 1.00 11.80 H new ATOM 0 HD1 HIS A 20 -4.366 -24.768 -13.984 1.00 14.05 H new ATOM 0 HD2 HIS A 20 -7.863 -26.345 -12.234 1.00 13.07 H new ATOM 0 HE1 HIS A 20 -3.750 -27.063 -13.022 1.00 14.92 H new ATOM 303 N SER A 21 -6.405 -21.636 -11.677 1.00 10.56 N ATOM 304 CA SER A 21 -5.613 -20.956 -10.669 1.00 10.93 C ATOM 305 C SER A 21 -6.523 -20.294 -9.634 1.00 9.52 C ATOM 306 O SER A 21 -6.346 -20.506 -8.437 1.00 9.67 O ATOM 307 CB SER A 21 -4.697 -19.939 -11.356 1.00 12.26 C ATOM 308 OG SER A 21 -3.966 -20.590 -12.378 1.00 13.22 O ATOM 0 H SER A 21 -6.375 -21.185 -12.591 1.00 10.56 H new ATOM 0 HA SER A 21 -4.992 -21.675 -10.135 1.00 10.93 H new ATOM 0 HB2 SER A 21 -5.288 -19.125 -11.776 1.00 12.26 H new ATOM 0 HB3 SER A 21 -4.015 -19.496 -10.630 1.00 12.26 H new ATOM 0 HG SER A 21 -3.379 -19.944 -12.823 1.00 13.22 H new ATOM 314 N GLY A 22 -7.498 -19.503 -10.090 1.00 8.53 N ATOM 315 CA GLY A 22 -8.397 -18.734 -9.238 1.00 7.38 C ATOM 316 C GLY A 22 -9.019 -19.588 -8.135 1.00 6.56 C ATOM 317 O GLY A 22 -8.863 -19.303 -6.950 1.00 6.92 O ATOM 0 H GLY A 22 -7.685 -19.380 -11.085 1.00 8.53 H new ATOM 0 HA2 GLY A 22 -7.849 -17.906 -8.788 1.00 7.38 H new ATOM 0 HA3 GLY A 22 -9.189 -18.298 -9.848 1.00 7.38 H new ATOM 321 N LYS A 23 -9.704 -20.666 -8.524 1.00 6.18 N ATOM 322 CA LYS A 23 -10.308 -21.625 -7.603 1.00 6.45 C ATOM 323 C LYS A 23 -9.297 -22.505 -6.857 1.00 7.85 C ATOM 324 O LYS A 23 -9.690 -23.340 -6.046 1.00 8.78 O ATOM 325 CB LYS A 23 -11.410 -22.432 -8.294 1.00 6.64 C ATOM 326 CG LYS A 23 -10.968 -23.254 -9.503 1.00 7.88 C ATOM 327 CD LYS A 23 -11.473 -24.686 -9.350 1.00 9.27 C ATOM 328 CE LYS A 23 -11.203 -25.518 -10.605 1.00 10.73 C ATOM 329 NZ LYS A 23 -11.549 -26.933 -10.375 1.00 11.92 N ATOM 0 H LYS A 23 -9.856 -20.899 -9.505 1.00 6.18 H new ATOM 0 HA LYS A 23 -10.775 -21.036 -6.814 1.00 6.45 H new ATOM 0 HB2 LYS A 23 -11.855 -23.106 -7.562 1.00 6.64 H new ATOM 0 HB3 LYS A 23 -12.194 -21.744 -8.612 1.00 6.64 H new ATOM 0 HG2 LYS A 23 -11.360 -22.814 -10.420 1.00 7.88 H new ATOM 0 HG3 LYS A 23 -9.881 -23.246 -9.585 1.00 7.88 H new ATOM 0 HD2 LYS A 23 -10.989 -25.153 -8.493 1.00 9.27 H new ATOM 0 HD3 LYS A 23 -12.543 -24.674 -9.144 1.00 9.27 H new ATOM 0 HE2 LYS A 23 -11.785 -25.127 -11.439 1.00 10.73 H new ATOM 0 HE3 LYS A 23 -10.152 -25.436 -10.883 1.00 10.73 H new ATOM 0 HZ1 LYS A 23 -11.489 -27.455 -11.272 1.00 11.92 H new ATOM 0 HZ2 LYS A 23 -10.885 -27.346 -9.689 1.00 11.92 H new ATOM 0 HZ3 LYS A 23 -12.517 -26.997 -10.001 1.00 11.92 H new ATOM 343 N MET A 24 -8.014 -22.392 -7.197 1.00 8.55 N ATOM 344 CA MET A 24 -6.926 -23.198 -6.659 1.00 10.16 C ATOM 345 C MET A 24 -7.185 -24.690 -6.868 1.00 11.08 C ATOM 346 O MET A 24 -7.194 -25.479 -5.923 1.00 11.84 O ATOM 347 CB MET A 24 -6.634 -22.823 -5.197 1.00 10.61 C ATOM 348 CG MET A 24 -6.155 -21.372 -5.082 1.00 10.19 C ATOM 349 SD MET A 24 -5.686 -20.880 -3.404 1.00 11.48 S ATOM 350 CE MET A 24 -5.010 -19.238 -3.736 1.00 11.80 C ATOM 0 H MET A 24 -7.694 -21.708 -7.883 1.00 8.55 H new ATOM 0 HA MET A 24 -6.016 -22.974 -7.216 1.00 10.16 H new ATOM 0 HB2 MET A 24 -7.534 -22.960 -4.597 1.00 10.61 H new ATOM 0 HB3 MET A 24 -5.875 -23.492 -4.792 1.00 10.61 H new ATOM 0 HG2 MET A 24 -5.300 -21.229 -5.743 1.00 10.19 H new ATOM 0 HG3 MET A 24 -6.946 -20.710 -5.436 1.00 10.19 H new ATOM 0 HE1 MET A 24 -4.671 -18.788 -2.803 1.00 11.80 H new ATOM 0 HE2 MET A 24 -4.169 -19.323 -4.424 1.00 11.80 H new ATOM 0 HE3 MET A 24 -5.781 -18.610 -4.182 1.00 11.80 H new ATOM 360 N VAL A 25 -7.331 -25.075 -8.141 1.00 11.37 N ATOM 361 CA VAL A 25 -7.314 -26.449 -8.622 1.00 12.61 C ATOM 362 C VAL A 25 -8.544 -27.238 -8.162 1.00 12.79 C ATOM 363 O VAL A 25 -9.394 -27.578 -8.987 1.00 13.02 O ATOM 364 CB VAL A 25 -5.976 -27.139 -8.284 1.00 14.20 C ATOM 365 CG1 VAL A 25 -5.933 -28.563 -8.856 1.00 15.58 C ATOM 366 CG2 VAL A 25 -4.794 -26.342 -8.854 1.00 14.51 C ATOM 0 H VAL A 25 -7.470 -24.401 -8.894 1.00 11.37 H new ATOM 0 HA VAL A 25 -7.381 -26.425 -9.710 1.00 12.61 H new ATOM 0 HB VAL A 25 -5.898 -27.183 -7.198 1.00 14.20 H new ATOM 0 HG11 VAL A 25 -4.980 -29.028 -8.604 1.00 15.58 H new ATOM 0 HG12 VAL A 25 -6.747 -29.151 -8.431 1.00 15.58 H new ATOM 0 HG13 VAL A 25 -6.042 -28.523 -9.940 1.00 15.58 H new ATOM 0 HG21 VAL A 25 -3.861 -26.846 -8.604 1.00 14.51 H new ATOM 0 HG22 VAL A 25 -4.890 -26.273 -9.938 1.00 14.51 H new ATOM 0 HG23 VAL A 25 -4.791 -25.340 -8.426 1.00 14.51 H new ATOM 376 N ALA A 26 -8.650 -27.544 -6.868 1.00 13.06 N ATOM 377 CA ALA A 26 -9.783 -28.262 -6.305 1.00 13.62 C ATOM 378 C ALA A 26 -10.934 -27.274 -6.095 1.00 12.71 C ATOM 379 O ALA A 26 -11.666 -27.008 -7.049 1.00 12.15 O ATOM 380 CB ALA A 26 -9.350 -29.011 -5.041 1.00 15.05 C ATOM 0 H ALA A 26 -7.941 -27.295 -6.178 1.00 13.06 H new ATOM 0 HA ALA A 26 -10.150 -29.031 -6.985 1.00 13.62 H new ATOM 0 HB1 ALA A 26 -10.203 -29.546 -4.625 1.00 15.05 H new ATOM 0 HB2 ALA A 26 -8.563 -29.722 -5.291 1.00 15.05 H new ATOM 0 HB3 ALA A 26 -8.975 -28.298 -4.306 1.00 15.05 H new ATOM 386 N LYS A 27 -11.070 -26.726 -4.879 1.00 12.96 N ATOM 387 CA LYS A 27 -11.905 -25.588 -4.509 1.00 12.71 C ATOM 388 C LYS A 27 -11.783 -25.370 -3.000 1.00 13.24 C ATOM 389 O LYS A 27 -11.314 -26.262 -2.287 1.00 13.74 O ATOM 390 CB LYS A 27 -13.385 -25.771 -4.911 1.00 12.56 C ATOM 391 CG LYS A 27 -13.699 -24.824 -6.072 1.00 12.37 C ATOM 392 CD LYS A 27 -15.176 -24.672 -6.449 1.00 12.76 C ATOM 393 CE LYS A 27 -15.975 -23.889 -5.396 1.00 13.59 C ATOM 394 NZ LYS A 27 -16.561 -24.761 -4.362 1.00 14.82 N ATOM 0 H LYS A 27 -10.561 -27.097 -4.076 1.00 12.96 H new ATOM 0 HA LYS A 27 -11.551 -24.714 -5.056 1.00 12.71 H new ATOM 0 HB2 LYS A 27 -13.572 -26.804 -5.205 1.00 12.56 H new ATOM 0 HB3 LYS A 27 -14.036 -25.558 -4.063 1.00 12.56 H new ATOM 0 HG2 LYS A 27 -13.307 -23.838 -5.824 1.00 12.37 H new ATOM 0 HG3 LYS A 27 -13.156 -25.171 -6.951 1.00 12.37 H new ATOM 0 HD2 LYS A 27 -15.252 -24.163 -7.410 1.00 12.76 H new ATOM 0 HD3 LYS A 27 -15.619 -25.660 -6.576 1.00 12.76 H new ATOM 0 HE2 LYS A 27 -15.322 -23.157 -4.921 1.00 13.59 H new ATOM 0 HE3 LYS A 27 -16.771 -23.332 -5.890 1.00 13.59 H new ATOM 0 HZ1 LYS A 27 -17.599 -24.711 -4.413 1.00 14.82 H new ATOM 0 HZ2 LYS A 27 -16.254 -25.742 -4.520 1.00 14.82 H new ATOM 0 HZ3 LYS A 27 -16.245 -24.446 -3.423 1.00 14.82 H new ATOM 408 N ARG A 28 -12.248 -24.216 -2.501 1.00 13.47 N ATOM 409 CA ARG A 28 -12.404 -24.029 -1.062 1.00 14.35 C ATOM 410 C ARG A 28 -13.195 -25.208 -0.479 1.00 14.72 C ATOM 411 O ARG A 28 -14.162 -25.648 -1.100 1.00 14.92 O ATOM 412 CB ARG A 28 -13.112 -22.706 -0.737 1.00 15.07 C ATOM 413 CG ARG A 28 -12.299 -21.478 -1.166 1.00 15.32 C ATOM 414 CD ARG A 28 -12.766 -20.184 -0.477 1.00 16.61 C ATOM 415 NE ARG A 28 -14.041 -19.662 -0.997 1.00 16.95 N ATOM 416 CZ ARG A 28 -15.278 -19.964 -0.568 1.00 17.87 C ATOM 417 NH1 ARG A 28 -15.451 -20.859 0.412 1.00 18.52 N ATOM 418 NH2 ARG A 28 -16.347 -19.373 -1.103 1.00 18.37 N ATOM 0 H ARG A 28 -12.518 -23.412 -3.068 1.00 13.47 H new ATOM 0 HA ARG A 28 -11.412 -23.990 -0.612 1.00 14.35 H new ATOM 0 HB2 ARG A 28 -14.082 -22.686 -1.234 1.00 15.07 H new ATOM 0 HB3 ARG A 28 -13.302 -22.654 0.335 1.00 15.07 H new ATOM 0 HG2 ARG A 28 -11.247 -21.647 -0.937 1.00 15.32 H new ATOM 0 HG3 ARG A 28 -12.375 -21.357 -2.247 1.00 15.32 H new ATOM 0 HD2 ARG A 28 -12.869 -20.369 0.592 1.00 16.61 H new ATOM 0 HD3 ARG A 28 -11.996 -19.422 -0.596 1.00 16.61 H new ATOM 0 HE ARG A 28 -13.978 -18.998 -1.768 1.00 16.95 H new ATOM 0 HH11 ARG A 28 -14.642 -21.314 0.836 1.00 18.52 H new ATOM 0 HH12 ARG A 28 -16.391 -21.086 0.735 1.00 18.52 H new ATOM 0 HH21 ARG A 28 -16.230 -18.684 -1.846 1.00 18.37 H new ATOM 0 HH22 ARG A 28 -17.281 -19.610 -0.769 1.00 18.37 H new ATOM 432 N GLN A 29 -12.744 -25.705 0.681 1.00 15.17 N ATOM 433 CA GLN A 29 -13.165 -26.920 1.385 1.00 15.91 C ATOM 434 C GLN A 29 -12.168 -28.059 1.140 1.00 15.72 C ATOM 435 O GLN A 29 -11.927 -28.867 2.035 1.00 16.82 O ATOM 436 CB GLN A 29 -14.608 -27.352 1.069 1.00 16.35 C ATOM 437 CG GLN A 29 -15.109 -28.450 2.020 1.00 17.51 C ATOM 438 CD GLN A 29 -16.538 -28.886 1.702 1.00 18.31 C ATOM 439 OE1 GLN A 29 -17.136 -28.453 0.722 1.00 17.99 O ATOM 440 NE2 GLN A 29 -17.103 -29.758 2.532 1.00 19.59 N ATOM 0 H GLN A 29 -12.008 -25.221 1.196 1.00 15.17 H new ATOM 0 HA GLN A 29 -13.165 -26.675 2.447 1.00 15.91 H new ATOM 0 HB2 GLN A 29 -15.267 -26.487 1.137 1.00 16.35 H new ATOM 0 HB3 GLN A 29 -14.660 -27.712 0.042 1.00 16.35 H new ATOM 0 HG2 GLN A 29 -14.446 -29.313 1.956 1.00 17.51 H new ATOM 0 HG3 GLN A 29 -15.062 -28.087 3.047 1.00 17.51 H new ATOM 0 HE21 GLN A 29 -16.584 -30.103 3.340 1.00 19.59 H new ATOM 0 HE22 GLN A 29 -18.055 -30.082 2.361 1.00 19.59 H new ATOM 449 N PHE A 30 -11.588 -28.138 -0.058 1.00 14.60 N ATOM 450 CA PHE A 30 -10.791 -29.281 -0.476 1.00 14.64 C ATOM 451 C PHE A 30 -9.312 -28.956 -0.312 1.00 14.01 C ATOM 452 O PHE A 30 -8.821 -28.033 -0.957 1.00 13.48 O ATOM 453 CB PHE A 30 -11.122 -29.606 -1.930 1.00 14.25 C ATOM 454 CG PHE A 30 -12.569 -30.010 -2.127 1.00 15.16 C ATOM 455 CD1 PHE A 30 -12.952 -31.349 -1.927 1.00 16.41 C ATOM 456 CD2 PHE A 30 -13.556 -29.022 -2.304 1.00 15.10 C ATOM 457 CE1 PHE A 30 -14.312 -31.702 -1.926 1.00 17.43 C ATOM 458 CE2 PHE A 30 -14.917 -29.371 -2.277 1.00 16.25 C ATOM 459 CZ PHE A 30 -15.296 -30.711 -2.092 1.00 17.34 C ATOM 0 H PHE A 30 -11.661 -27.406 -0.765 1.00 14.60 H new ATOM 0 HA PHE A 30 -11.019 -30.150 0.141 1.00 14.64 H new ATOM 0 HB2 PHE A 30 -10.905 -28.736 -2.550 1.00 14.25 H new ATOM 0 HB3 PHE A 30 -10.474 -30.413 -2.274 1.00 14.25 H new ATOM 0 HD1 PHE A 30 -12.199 -32.108 -1.774 1.00 16.41 H new ATOM 0 HD2 PHE A 30 -13.267 -27.993 -2.461 1.00 15.10 H new ATOM 0 HE1 PHE A 30 -14.602 -32.734 -1.798 1.00 17.43 H new ATOM 0 HE2 PHE A 30 -15.672 -28.608 -2.399 1.00 16.25 H new ATOM 0 HZ PHE A 30 -16.342 -30.980 -2.077 1.00 17.34 H new ATOM 469 N ARG A 31 -8.614 -29.689 0.565 1.00 14.35 N ATOM 470 CA ARG A 31 -7.228 -29.459 0.980 1.00 14.12 C ATOM 471 C ARG A 31 -7.112 -28.195 1.836 1.00 13.17 C ATOM 472 O ARG A 31 -6.545 -28.247 2.922 1.00 13.51 O ATOM 473 CB ARG A 31 -6.246 -29.466 -0.209 1.00 14.11 C ATOM 474 CG ARG A 31 -4.780 -29.211 0.188 1.00 14.46 C ATOM 475 CD ARG A 31 -4.173 -30.262 1.127 1.00 15.98 C ATOM 476 NE ARG A 31 -4.110 -31.586 0.488 1.00 16.48 N ATOM 477 CZ ARG A 31 -3.513 -32.667 1.019 1.00 17.77 C ATOM 478 NH1 ARG A 31 -2.983 -32.598 2.246 1.00 18.66 N ATOM 479 NH2 ARG A 31 -3.448 -33.807 0.322 1.00 18.40 N ATOM 0 H ARG A 31 -9.024 -30.500 1.027 1.00 14.35 H new ATOM 0 HA ARG A 31 -6.932 -30.300 1.607 1.00 14.12 H new ATOM 0 HB2 ARG A 31 -6.312 -30.429 -0.716 1.00 14.11 H new ATOM 0 HB3 ARG A 31 -6.555 -28.706 -0.927 1.00 14.11 H new ATOM 0 HG2 ARG A 31 -4.176 -29.163 -0.718 1.00 14.46 H new ATOM 0 HG3 ARG A 31 -4.713 -28.234 0.668 1.00 14.46 H new ATOM 0 HD2 ARG A 31 -3.171 -29.952 1.422 1.00 15.98 H new ATOM 0 HD3 ARG A 31 -4.769 -30.325 2.038 1.00 15.98 H new ATOM 0 HE ARG A 31 -4.552 -31.691 -0.425 1.00 16.48 H new ATOM 0 HH11 ARG A 31 -3.033 -31.727 2.775 1.00 18.66 H new ATOM 0 HH12 ARG A 31 -2.529 -33.416 2.652 1.00 18.66 H new ATOM 0 HH21 ARG A 31 -3.852 -33.857 -0.613 1.00 18.40 H new ATOM 0 HH22 ARG A 31 -2.995 -34.627 0.726 1.00 18.40 H new ATOM 493 N ILE A 32 -7.640 -27.073 1.339 1.00 12.24 N ATOM 494 CA ILE A 32 -7.618 -25.777 1.998 1.00 11.48 C ATOM 495 C ILE A 32 -6.157 -25.370 2.231 1.00 11.33 C ATOM 496 O ILE A 32 -5.767 -24.962 3.322 1.00 12.28 O ATOM 497 CB ILE A 32 -8.486 -25.767 3.278 1.00 12.36 C ATOM 498 CG1 ILE A 32 -9.816 -26.520 3.082 1.00 13.02 C ATOM 499 CG2 ILE A 32 -8.775 -24.317 3.703 1.00 11.82 C ATOM 500 CD1 ILE A 32 -10.703 -26.496 4.332 1.00 14.10 C ATOM 0 H ILE A 32 -8.110 -27.048 0.434 1.00 12.24 H new ATOM 0 HA ILE A 32 -8.075 -25.023 1.357 1.00 11.48 H new ATOM 0 HB ILE A 32 -7.923 -26.281 4.057 1.00 12.36 H new ATOM 0 HG12 ILE A 32 -10.360 -26.076 2.248 1.00 13.02 H new ATOM 0 HG13 ILE A 32 -9.606 -27.555 2.811 1.00 13.02 H new ATOM 0 HG21 ILE A 32 -9.387 -24.317 4.605 1.00 11.82 H new ATOM 0 HG22 ILE A 32 -7.835 -23.802 3.902 1.00 11.82 H new ATOM 0 HG23 ILE A 32 -9.308 -23.803 2.903 1.00 11.82 H new ATOM 0 HD11 ILE A 32 -11.625 -27.042 4.134 1.00 14.10 H new ATOM 0 HD12 ILE A 32 -10.175 -26.965 5.162 1.00 14.10 H new ATOM 0 HD13 ILE A 32 -10.940 -25.464 4.590 1.00 14.10 H new ATOM 512 N GLY A 33 -5.338 -25.492 1.182 1.00 10.52 N ATOM 513 CA GLY A 33 -3.944 -25.076 1.223 1.00 10.63 C ATOM 514 C GLY A 33 -3.849 -23.573 1.480 1.00 9.68 C ATOM 515 O GLY A 33 -3.011 -23.124 2.257 1.00 10.27 O ATOM 0 H GLY A 33 -5.628 -25.882 0.285 1.00 10.52 H new ATOM 0 HA2 GLY A 33 -3.417 -25.620 2.007 1.00 10.63 H new ATOM 0 HA3 GLY A 33 -3.455 -25.323 0.280 1.00 10.63 H new ATOM 519 N ASP A 34 -4.728 -22.811 0.823 1.00 8.49 N ATOM 520 CA ASP A 34 -4.919 -21.386 1.018 1.00 7.85 C ATOM 521 C ASP A 34 -6.356 -21.066 0.594 1.00 6.69 C ATOM 522 O ASP A 34 -7.026 -21.921 0.011 1.00 6.54 O ATOM 523 CB ASP A 34 -3.875 -20.612 0.197 1.00 8.35 C ATOM 524 CG ASP A 34 -3.923 -19.114 0.441 1.00 8.72 C ATOM 525 OD1 ASP A 34 -4.504 -18.685 1.466 1.00 9.34 O ATOM 526 OD2 ASP A 34 -3.390 -18.348 -0.391 1.00 8.99 O ATOM 0 H ASP A 34 -5.349 -23.195 0.111 1.00 8.49 H new ATOM 0 HA ASP A 34 -4.779 -21.089 2.057 1.00 7.85 H new ATOM 0 HB2 ASP A 34 -2.880 -20.983 0.442 1.00 8.35 H new ATOM 0 HB3 ASP A 34 -4.036 -20.808 -0.863 1.00 8.35 H new ATOM 531 N ILE A 35 -6.832 -19.861 0.899 1.00 6.43 N ATOM 532 CA ILE A 35 -8.119 -19.348 0.445 1.00 5.64 C ATOM 533 C ILE A 35 -7.952 -18.838 -0.992 1.00 4.08 C ATOM 534 O ILE A 35 -6.877 -18.373 -1.356 1.00 4.14 O ATOM 535 CB ILE A 35 -8.603 -18.247 1.412 1.00 6.60 C ATOM 536 CG1 ILE A 35 -8.646 -18.720 2.879 1.00 8.45 C ATOM 537 CG2 ILE A 35 -9.965 -17.668 1.001 1.00 6.39 C ATOM 538 CD1 ILE A 35 -9.542 -19.939 3.130 1.00 9.33 C ATOM 0 H ILE A 35 -6.320 -19.200 1.483 1.00 6.43 H new ATOM 0 HA ILE A 35 -8.881 -20.128 0.444 1.00 5.64 H new ATOM 0 HB ILE A 35 -7.860 -17.452 1.341 1.00 6.60 H new ATOM 0 HG12 ILE A 35 -7.632 -18.958 3.200 1.00 8.45 H new ATOM 0 HG13 ILE A 35 -8.993 -17.896 3.503 1.00 8.45 H new ATOM 0 HG21 ILE A 35 -10.262 -16.897 1.712 1.00 6.39 H new ATOM 0 HG22 ILE A 35 -9.890 -17.233 0.005 1.00 6.39 H new ATOM 0 HG23 ILE A 35 -10.711 -18.463 0.994 1.00 6.39 H new ATOM 0 HD11 ILE A 35 -9.512 -20.201 4.188 1.00 9.33 H new ATOM 0 HD12 ILE A 35 -10.567 -19.702 2.844 1.00 9.33 H new ATOM 0 HD13 ILE A 35 -9.185 -20.781 2.537 1.00 9.33 H new ATOM 550 N ALA A 36 -9.007 -18.920 -1.808 1.00 3.65 N ATOM 551 CA ALA A 36 -8.953 -18.544 -3.216 1.00 3.24 C ATOM 552 C ALA A 36 -8.702 -17.042 -3.404 1.00 2.71 C ATOM 553 O ALA A 36 -7.579 -16.632 -3.687 1.00 3.16 O ATOM 554 CB ALA A 36 -10.233 -19.001 -3.914 1.00 4.44 C ATOM 0 H ALA A 36 -9.923 -19.251 -1.506 1.00 3.65 H new ATOM 0 HA ALA A 36 -8.104 -19.048 -3.677 1.00 3.24 H new ATOM 0 HB1 ALA A 36 -10.194 -18.720 -4.967 1.00 4.44 H new ATOM 0 HB2 ALA A 36 -10.326 -20.084 -3.830 1.00 4.44 H new ATOM 0 HB3 ALA A 36 -11.094 -18.525 -3.444 1.00 4.44 H new ATOM 560 N GLY A 37 -9.748 -16.219 -3.260 1.00 2.79 N ATOM 561 CA GLY A 37 -9.675 -14.776 -3.491 1.00 2.44 C ATOM 562 C GLY A 37 -10.777 -14.299 -4.438 1.00 2.00 C ATOM 563 O GLY A 37 -10.512 -13.521 -5.358 1.00 2.35 O ATOM 0 H GLY A 37 -10.674 -16.541 -2.978 1.00 2.79 H new ATOM 0 HA2 GLY A 37 -9.760 -14.250 -2.540 1.00 2.44 H new ATOM 0 HA3 GLY A 37 -8.701 -14.523 -3.909 1.00 2.44 H new ATOM 567 N GLU A 38 -12.016 -14.749 -4.201 1.00 2.03 N ATOM 568 CA GLU A 38 -13.141 -14.487 -5.084 1.00 1.76 C ATOM 569 C GLU A 38 -13.335 -13.002 -5.367 1.00 1.50 C ATOM 570 O GLU A 38 -13.039 -12.572 -6.474 1.00 1.44 O ATOM 571 CB GLU A 38 -14.405 -15.129 -4.512 1.00 2.13 C ATOM 572 CG GLU A 38 -14.242 -16.651 -4.518 1.00 2.75 C ATOM 573 CD GLU A 38 -14.369 -17.243 -3.132 1.00 3.52 C ATOM 574 OE1 GLU A 38 -15.518 -17.481 -2.711 1.00 4.56 O ATOM 575 OE2 GLU A 38 -13.323 -17.487 -2.491 1.00 4.09 O ATOM 0 H GLU A 38 -12.259 -15.308 -3.383 1.00 2.03 H new ATOM 0 HA GLU A 38 -12.922 -14.941 -6.050 1.00 1.76 H new ATOM 0 HB2 GLU A 38 -14.580 -14.774 -3.497 1.00 2.13 H new ATOM 0 HB3 GLU A 38 -15.274 -14.842 -5.105 1.00 2.13 H new ATOM 0 HG2 GLU A 38 -14.995 -17.093 -5.171 1.00 2.75 H new ATOM 0 HG3 GLU A 38 -13.268 -16.909 -4.934 1.00 2.75 H new ATOM 582 N HIS A 39 -13.830 -12.216 -4.404 1.00 1.53 N ATOM 583 CA HIS A 39 -14.130 -10.806 -4.619 1.00 1.50 C ATOM 584 C HIS A 39 -12.938 -10.109 -5.269 1.00 1.56 C ATOM 585 O HIS A 39 -13.049 -9.546 -6.355 1.00 1.77 O ATOM 586 CB HIS A 39 -14.466 -10.134 -3.284 1.00 1.81 C ATOM 587 CG HIS A 39 -15.905 -10.250 -2.843 1.00 2.35 C ATOM 588 ND1 HIS A 39 -16.315 -10.306 -1.534 1.00 3.26 N ATOM 589 CD2 HIS A 39 -17.017 -10.003 -3.604 1.00 3.28 C ATOM 590 CE1 HIS A 39 -17.642 -10.115 -1.504 1.00 4.04 C ATOM 591 NE2 HIS A 39 -18.114 -9.900 -2.743 1.00 4.15 N ATOM 0 H HIS A 39 -14.031 -12.543 -3.459 1.00 1.53 H new ATOM 0 HA HIS A 39 -14.990 -10.725 -5.284 1.00 1.50 H new ATOM 0 HB2 HIS A 39 -13.831 -10.565 -2.510 1.00 1.81 H new ATOM 0 HB3 HIS A 39 -14.210 -9.077 -3.354 1.00 1.81 H new ATOM 0 HD1 HIS A 39 -15.715 -10.465 -0.725 1.00 3.26 H new ATOM 0 HD2 HIS A 39 -17.042 -9.905 -4.679 1.00 3.28 H new ATOM 0 HE1 HIS A 39 -18.246 -10.132 -0.609 1.00 4.04 H new ATOM 599 N THR A 40 -11.802 -10.174 -4.580 1.00 1.67 N ATOM 600 CA THR A 40 -10.587 -9.483 -4.956 1.00 1.97 C ATOM 601 C THR A 40 -10.208 -9.692 -6.424 1.00 1.98 C ATOM 602 O THR A 40 -10.074 -8.721 -7.171 1.00 2.20 O ATOM 603 CB THR A 40 -9.479 -9.795 -3.936 1.00 2.32 C ATOM 604 OG1 THR A 40 -8.285 -9.180 -4.338 1.00 2.67 O ATOM 605 CG2 THR A 40 -9.212 -11.281 -3.680 1.00 3.41 C ATOM 0 H THR A 40 -11.706 -10.723 -3.726 1.00 1.67 H new ATOM 0 HA THR A 40 -10.756 -8.407 -4.908 1.00 1.97 H new ATOM 0 HB THR A 40 -9.848 -9.398 -2.990 1.00 2.32 H new ATOM 0 HG1 THR A 40 -7.566 -9.846 -4.363 1.00 2.67 H new ATOM 0 HG21 THR A 40 -8.413 -11.386 -2.946 1.00 3.41 H new ATOM 0 HG22 THR A 40 -10.118 -11.753 -3.301 1.00 3.41 H new ATOM 0 HG23 THR A 40 -8.914 -11.763 -4.611 1.00 3.41 H new ATOM 613 N SER A 41 -10.020 -10.943 -6.838 1.00 1.88 N ATOM 614 CA SER A 41 -9.669 -11.250 -8.217 1.00 1.95 C ATOM 615 C SER A 41 -10.869 -11.095 -9.160 1.00 1.94 C ATOM 616 O SER A 41 -10.783 -10.433 -10.192 1.00 2.03 O ATOM 617 CB SER A 41 -8.994 -12.621 -8.315 1.00 2.09 C ATOM 618 OG SER A 41 -8.243 -12.682 -9.513 1.00 2.34 O ATOM 0 H SER A 41 -10.106 -11.761 -6.234 1.00 1.88 H new ATOM 0 HA SER A 41 -8.937 -10.517 -8.555 1.00 1.95 H new ATOM 0 HB2 SER A 41 -8.344 -12.783 -7.455 1.00 2.09 H new ATOM 0 HB3 SER A 41 -9.744 -13.412 -8.301 1.00 2.09 H new ATOM 0 HG SER A 41 -7.522 -12.020 -9.481 1.00 2.34 H new ATOM 624 N PHE A 42 -11.994 -11.739 -8.832 1.00 1.95 N ATOM 625 CA PHE A 42 -13.104 -11.899 -9.765 1.00 2.25 C ATOM 626 C PHE A 42 -13.806 -10.583 -10.094 1.00 2.12 C ATOM 627 O PHE A 42 -14.482 -10.536 -11.120 1.00 2.21 O ATOM 628 CB PHE A 42 -14.086 -13.019 -9.331 1.00 2.84 C ATOM 629 CG PHE A 42 -15.444 -12.624 -8.753 1.00 2.88 C ATOM 630 CD1 PHE A 42 -15.578 -11.531 -7.880 1.00 3.43 C ATOM 631 CD2 PHE A 42 -16.601 -13.325 -9.146 1.00 3.49 C ATOM 632 CE1 PHE A 42 -16.844 -10.999 -7.590 1.00 3.76 C ATOM 633 CE2 PHE A 42 -17.872 -12.874 -8.744 1.00 3.51 C ATOM 634 CZ PHE A 42 -17.997 -11.696 -7.987 1.00 3.32 C ATOM 0 H PHE A 42 -12.156 -12.160 -7.917 1.00 1.95 H new ATOM 0 HA PHE A 42 -12.662 -12.232 -10.704 1.00 2.25 H new ATOM 0 HB2 PHE A 42 -14.268 -13.653 -10.199 1.00 2.84 H new ATOM 0 HB3 PHE A 42 -13.578 -13.634 -8.589 1.00 2.84 H new ATOM 0 HD1 PHE A 42 -14.699 -11.096 -7.428 1.00 3.43 H new ATOM 0 HD2 PHE A 42 -16.512 -14.211 -9.757 1.00 3.49 H new ATOM 0 HE1 PHE A 42 -16.931 -10.059 -7.065 1.00 3.76 H new ATOM 0 HE2 PHE A 42 -18.754 -13.434 -9.018 1.00 3.51 H new ATOM 0 HZ PHE A 42 -18.975 -11.329 -7.712 1.00 3.32 H new ATOM 644 N ASP A 43 -13.691 -9.559 -9.224 1.00 2.07 N ATOM 645 CA ASP A 43 -14.553 -8.376 -9.206 1.00 2.30 C ATOM 646 C ASP A 43 -14.941 -7.943 -10.615 1.00 2.20 C ATOM 647 O ASP A 43 -16.128 -7.871 -10.942 1.00 3.02 O ATOM 648 CB ASP A 43 -13.877 -7.220 -8.453 1.00 2.24 C ATOM 649 CG ASP A 43 -14.665 -5.931 -8.557 1.00 2.25 C ATOM 650 OD1 ASP A 43 -15.896 -5.950 -8.313 1.00 3.06 O ATOM 651 OD2 ASP A 43 -14.083 -4.917 -8.997 1.00 2.33 O ATOM 0 H ASP A 43 -12.975 -9.539 -8.498 1.00 2.07 H new ATOM 0 HA ASP A 43 -15.468 -8.646 -8.678 1.00 2.30 H new ATOM 0 HB2 ASP A 43 -13.763 -7.490 -7.403 1.00 2.24 H new ATOM 0 HB3 ASP A 43 -12.875 -7.065 -8.853 1.00 2.24 H new ATOM 656 N LYS A 44 -13.903 -7.690 -11.411 1.00 1.49 N ATOM 657 CA LYS A 44 -13.927 -7.424 -12.845 1.00 1.56 C ATOM 658 C LYS A 44 -12.483 -7.146 -13.273 1.00 1.51 C ATOM 659 O LYS A 44 -12.192 -6.121 -13.889 1.00 1.86 O ATOM 660 CB LYS A 44 -14.896 -6.274 -13.189 1.00 2.06 C ATOM 661 CG LYS A 44 -14.625 -4.998 -12.377 1.00 2.79 C ATOM 662 CD LYS A 44 -15.842 -4.062 -12.365 1.00 3.13 C ATOM 663 CE LYS A 44 -16.832 -4.406 -11.249 1.00 4.51 C ATOM 664 NZ LYS A 44 -16.302 -3.986 -9.938 1.00 5.60 N ATOM 0 H LYS A 44 -12.953 -7.664 -11.040 1.00 1.49 H new ATOM 0 HA LYS A 44 -14.309 -8.282 -13.399 1.00 1.56 H new ATOM 0 HB2 LYS A 44 -14.817 -6.045 -14.252 1.00 2.06 H new ATOM 0 HB3 LYS A 44 -15.920 -6.602 -13.009 1.00 2.06 H new ATOM 0 HG2 LYS A 44 -14.363 -5.267 -11.354 1.00 2.79 H new ATOM 0 HG3 LYS A 44 -13.767 -4.474 -12.799 1.00 2.79 H new ATOM 0 HD2 LYS A 44 -15.504 -3.033 -12.243 1.00 3.13 H new ATOM 0 HD3 LYS A 44 -16.350 -4.119 -13.328 1.00 3.13 H new ATOM 0 HE2 LYS A 44 -17.786 -3.913 -11.437 1.00 4.51 H new ATOM 0 HE3 LYS A 44 -17.024 -5.479 -11.243 1.00 4.51 H new ATOM 0 HZ1 LYS A 44 -16.678 -4.609 -9.196 1.00 5.60 H new ATOM 0 HZ2 LYS A 44 -15.264 -4.047 -9.948 1.00 5.60 H new ATOM 0 HZ3 LYS A 44 -16.590 -3.005 -9.745 1.00 5.60 H new ATOM 678 N LEU A 45 -11.564 -8.027 -12.861 1.00 1.37 N ATOM 679 CA LEU A 45 -10.131 -7.767 -12.850 1.00 1.44 C ATOM 680 C LEU A 45 -9.367 -9.006 -13.357 1.00 1.43 C ATOM 681 O LEU A 45 -9.896 -10.113 -13.278 1.00 2.16 O ATOM 682 CB LEU A 45 -9.728 -7.379 -11.417 1.00 1.63 C ATOM 683 CG LEU A 45 -10.216 -5.984 -10.970 1.00 1.53 C ATOM 684 CD1 LEU A 45 -9.912 -5.779 -9.482 1.00 1.56 C ATOM 685 CD2 LEU A 45 -9.567 -4.884 -11.812 1.00 2.26 C ATOM 0 H LEU A 45 -11.807 -8.957 -12.520 1.00 1.37 H new ATOM 0 HA LEU A 45 -9.876 -6.945 -13.520 1.00 1.44 H new ATOM 0 HB2 LEU A 45 -10.122 -8.126 -10.728 1.00 1.63 H new ATOM 0 HB3 LEU A 45 -8.641 -7.413 -11.337 1.00 1.63 H new ATOM 0 HG LEU A 45 -11.294 -5.926 -11.120 1.00 1.53 H new ATOM 0 HD11 LEU A 45 -10.259 -4.793 -9.172 1.00 1.56 H new ATOM 0 HD12 LEU A 45 -10.424 -6.544 -8.897 1.00 1.56 H new ATOM 0 HD13 LEU A 45 -8.837 -5.854 -9.316 1.00 1.56 H new ATOM 0 HD21 LEU A 45 -9.926 -3.911 -11.478 1.00 2.26 H new ATOM 0 HD22 LEU A 45 -8.484 -4.930 -11.698 1.00 2.26 H new ATOM 0 HD23 LEU A 45 -9.828 -5.027 -12.861 1.00 2.26 H new ATOM 697 N PRO A 46 -8.164 -8.827 -13.935 1.00 1.07 N ATOM 698 CA PRO A 46 -7.412 -9.888 -14.604 1.00 1.28 C ATOM 699 C PRO A 46 -6.523 -10.684 -13.642 1.00 1.29 C ATOM 700 O PRO A 46 -6.425 -10.360 -12.463 1.00 1.44 O ATOM 701 CB PRO A 46 -6.530 -9.138 -15.610 1.00 1.78 C ATOM 702 CG PRO A 46 -6.215 -7.833 -14.879 1.00 1.94 C ATOM 703 CD PRO A 46 -7.533 -7.534 -14.172 1.00 1.46 C ATOM 0 HA PRO A 46 -8.085 -10.618 -15.055 1.00 1.28 H new ATOM 0 HB2 PRO A 46 -5.625 -9.696 -15.849 1.00 1.78 H new ATOM 0 HB3 PRO A 46 -7.052 -8.959 -16.550 1.00 1.78 H new ATOM 0 HG2 PRO A 46 -5.392 -7.950 -14.174 1.00 1.94 H new ATOM 0 HG3 PRO A 46 -5.933 -7.038 -15.569 1.00 1.94 H new ATOM 0 HD2 PRO A 46 -7.362 -7.006 -13.234 1.00 1.46 H new ATOM 0 HD3 PRO A 46 -8.169 -6.896 -14.786 1.00 1.46 H new ATOM 711 N GLU A 47 -5.764 -11.645 -14.179 1.00 1.81 N ATOM 712 CA GLU A 47 -4.600 -12.254 -13.534 1.00 2.32 C ATOM 713 C GLU A 47 -3.350 -11.409 -13.846 1.00 2.02 C ATOM 714 O GLU A 47 -2.348 -11.884 -14.370 1.00 2.81 O ATOM 715 CB GLU A 47 -4.474 -13.715 -13.995 1.00 3.18 C ATOM 716 CG GLU A 47 -4.613 -13.898 -15.515 1.00 3.43 C ATOM 717 CD GLU A 47 -4.272 -15.325 -15.912 1.00 4.51 C ATOM 718 OE1 GLU A 47 -5.126 -16.195 -15.632 1.00 5.32 O ATOM 719 OE2 GLU A 47 -3.178 -15.517 -16.480 1.00 5.03 O ATOM 0 H GLU A 47 -5.950 -12.032 -15.104 1.00 1.81 H new ATOM 0 HA GLU A 47 -4.713 -12.270 -12.450 1.00 2.32 H new ATOM 0 HB2 GLU A 47 -3.507 -14.104 -13.678 1.00 3.18 H new ATOM 0 HB3 GLU A 47 -5.237 -14.312 -13.495 1.00 3.18 H new ATOM 0 HG2 GLU A 47 -5.631 -13.662 -15.824 1.00 3.43 H new ATOM 0 HG3 GLU A 47 -3.953 -13.202 -16.033 1.00 3.43 H new ATOM 726 N GLY A 48 -3.460 -10.107 -13.582 1.00 1.67 N ATOM 727 CA GLY A 48 -2.604 -9.081 -14.159 1.00 2.16 C ATOM 728 C GLY A 48 -1.121 -9.123 -13.775 1.00 1.56 C ATOM 729 O GLY A 48 -0.325 -8.472 -14.453 1.00 2.99 O ATOM 0 H GLY A 48 -4.164 -9.732 -12.946 1.00 1.67 H new ATOM 0 HA2 GLY A 48 -2.676 -9.149 -15.244 1.00 2.16 H new ATOM 0 HA3 GLY A 48 -3.001 -8.107 -13.874 1.00 2.16 H new ATOM 733 N GLY A 49 -0.707 -9.801 -12.698 1.00 1.19 N ATOM 734 CA GLY A 49 0.715 -9.931 -12.385 1.00 0.99 C ATOM 735 C GLY A 49 1.277 -8.700 -11.671 1.00 1.09 C ATOM 736 O GLY A 49 1.949 -8.825 -10.650 1.00 1.73 O ATOM 0 H GLY A 49 -1.331 -10.263 -12.037 1.00 1.19 H new ATOM 0 HA2 GLY A 49 0.866 -10.810 -11.758 1.00 0.99 H new ATOM 0 HA3 GLY A 49 1.272 -10.097 -13.307 1.00 0.99 H new ATOM 740 N ARG A 50 1.026 -7.502 -12.207 1.00 0.80 N ATOM 741 CA ARG A 50 1.394 -6.238 -11.585 1.00 0.87 C ATOM 742 C ARG A 50 0.274 -5.224 -11.804 1.00 0.92 C ATOM 743 O ARG A 50 -0.565 -5.393 -12.686 1.00 1.31 O ATOM 744 CB ARG A 50 2.743 -5.738 -12.131 1.00 0.96 C ATOM 745 CG ARG A 50 2.691 -5.395 -13.627 1.00 1.86 C ATOM 746 CD ARG A 50 4.076 -5.021 -14.176 1.00 2.41 C ATOM 747 NE ARG A 50 4.014 -4.834 -15.636 1.00 4.20 N ATOM 748 CZ ARG A 50 3.726 -3.699 -16.296 1.00 6.07 C ATOM 749 NH1 ARG A 50 3.748 -2.503 -15.694 1.00 6.61 N ATOM 750 NH2 ARG A 50 3.409 -3.767 -17.595 1.00 7.79 N ATOM 0 H ARG A 50 0.552 -7.387 -13.103 1.00 0.80 H new ATOM 0 HA ARG A 50 1.521 -6.378 -10.512 1.00 0.87 H new ATOM 0 HB2 ARG A 50 3.051 -4.855 -11.571 1.00 0.96 H new ATOM 0 HB3 ARG A 50 3.502 -6.502 -11.965 1.00 0.96 H new ATOM 0 HG2 ARG A 50 2.298 -6.247 -14.182 1.00 1.86 H new ATOM 0 HG3 ARG A 50 2.001 -4.566 -13.786 1.00 1.86 H new ATOM 0 HD2 ARG A 50 4.428 -4.106 -13.700 1.00 2.41 H new ATOM 0 HD3 ARG A 50 4.795 -5.804 -13.933 1.00 2.41 H new ATOM 0 HE ARG A 50 4.211 -5.655 -16.208 1.00 4.20 H new ATOM 0 HH11 ARG A 50 3.989 -2.434 -14.705 1.00 6.61 H new ATOM 0 HH12 ARG A 50 3.524 -1.661 -16.224 1.00 6.61 H new ATOM 0 HH21 ARG A 50 3.389 -4.670 -18.068 1.00 7.79 H new ATOM 0 HH22 ARG A 50 3.188 -2.916 -18.111 1.00 7.79 H new ATOM 764 N ALA A 51 0.284 -4.173 -10.985 1.00 1.23 N ATOM 765 CA ALA A 51 -0.705 -3.110 -10.950 1.00 1.28 C ATOM 766 C ALA A 51 -0.468 -2.069 -12.039 1.00 0.81 C ATOM 767 O ALA A 51 0.438 -2.195 -12.859 1.00 1.67 O ATOM 768 CB ALA A 51 -0.708 -2.484 -9.556 1.00 2.35 C ATOM 0 H ALA A 51 1.023 -4.038 -10.295 1.00 1.23 H new ATOM 0 HA ALA A 51 -1.688 -3.534 -11.155 1.00 1.28 H new ATOM 0 HB1 ALA A 51 -1.447 -1.684 -9.518 1.00 2.35 H new ATOM 0 HB2 ALA A 51 -0.958 -3.244 -8.816 1.00 2.35 H new ATOM 0 HB3 ALA A 51 0.279 -2.076 -9.338 1.00 2.35 H new ATOM 774 N THR A 52 -1.319 -1.043 -12.053 1.00 0.65 N ATOM 775 CA THR A 52 -1.075 0.185 -12.785 1.00 0.77 C ATOM 776 C THR A 52 -1.457 1.360 -11.877 1.00 1.06 C ATOM 777 O THR A 52 -2.632 1.696 -11.774 1.00 1.31 O ATOM 778 CB THR A 52 -1.843 0.148 -14.124 1.00 1.10 C ATOM 779 OG1 THR A 52 -1.856 1.419 -14.739 1.00 1.62 O ATOM 780 CG2 THR A 52 -3.273 -0.406 -14.018 1.00 1.33 C ATOM 0 H THR A 52 -2.205 -1.048 -11.548 1.00 0.65 H new ATOM 0 HA THR A 52 -0.024 0.305 -13.049 1.00 0.77 H new ATOM 0 HB THR A 52 -1.292 -0.555 -14.748 1.00 1.10 H new ATOM 0 HG1 THR A 52 -2.783 1.703 -14.884 1.00 1.62 H new ATOM 0 HG21 THR A 52 -3.741 -0.397 -15.003 1.00 1.33 H new ATOM 0 HG22 THR A 52 -3.240 -1.428 -13.641 1.00 1.33 H new ATOM 0 HG23 THR A 52 -3.854 0.214 -13.335 1.00 1.33 H new ATOM 788 N TYR A 53 -0.491 1.957 -11.166 1.00 1.64 N ATOM 789 CA TYR A 53 -0.692 3.239 -10.491 1.00 2.30 C ATOM 790 C TYR A 53 0.610 3.995 -10.225 1.00 2.05 C ATOM 791 O TYR A 53 1.700 3.519 -10.527 1.00 2.66 O ATOM 792 CB TYR A 53 -1.578 3.126 -9.242 1.00 2.84 C ATOM 793 CG TYR A 53 -1.230 2.056 -8.235 1.00 2.48 C ATOM 794 CD1 TYR A 53 -1.929 0.838 -8.273 1.00 2.52 C ATOM 795 CD2 TYR A 53 -0.394 2.349 -7.142 1.00 3.56 C ATOM 796 CE1 TYR A 53 -1.780 -0.094 -7.237 1.00 2.76 C ATOM 797 CE2 TYR A 53 -0.276 1.431 -6.083 1.00 4.17 C ATOM 798 CZ TYR A 53 -0.951 0.199 -6.141 1.00 3.49 C ATOM 799 OH TYR A 53 -0.717 -0.757 -5.200 1.00 4.45 O ATOM 0 H TYR A 53 0.443 1.566 -11.045 1.00 1.64 H new ATOM 0 HA TYR A 53 -1.247 3.853 -11.200 1.00 2.30 H new ATOM 0 HB2 TYR A 53 -1.562 4.088 -8.730 1.00 2.84 H new ATOM 0 HB3 TYR A 53 -2.603 2.958 -9.571 1.00 2.84 H new ATOM 0 HD1 TYR A 53 -2.584 0.619 -9.104 1.00 2.52 H new ATOM 0 HD2 TYR A 53 0.157 3.278 -7.116 1.00 3.56 H new ATOM 0 HE1 TYR A 53 -2.303 -1.038 -7.281 1.00 2.76 H new ATOM 0 HE2 TYR A 53 0.333 1.673 -5.225 1.00 4.17 H new ATOM 0 HH TYR A 53 -0.123 -0.397 -4.509 1.00 4.45 H new ATOM 809 N ARG A 54 0.477 5.201 -9.676 1.00 1.58 N ATOM 810 CA ARG A 54 1.524 6.064 -9.173 1.00 1.40 C ATOM 811 C ARG A 54 0.981 6.590 -7.841 1.00 1.18 C ATOM 812 O ARG A 54 -0.082 7.214 -7.839 1.00 1.31 O ATOM 813 CB ARG A 54 1.755 7.194 -10.189 1.00 1.84 C ATOM 814 CG ARG A 54 2.174 6.624 -11.553 1.00 1.81 C ATOM 815 CD ARG A 54 2.467 7.725 -12.574 1.00 2.31 C ATOM 816 NE ARG A 54 1.235 8.298 -13.164 1.00 3.28 N ATOM 817 CZ ARG A 54 1.214 9.320 -14.035 1.00 4.26 C ATOM 818 NH1 ARG A 54 2.350 9.944 -14.365 1.00 4.37 N ATOM 819 NH2 ARG A 54 0.057 9.702 -14.576 1.00 5.54 N ATOM 0 H ARG A 54 -0.443 5.627 -9.566 1.00 1.58 H new ATOM 0 HA ARG A 54 2.483 5.566 -9.029 1.00 1.40 H new ATOM 0 HB2 ARG A 54 0.844 7.781 -10.300 1.00 1.84 H new ATOM 0 HB3 ARG A 54 2.527 7.869 -9.819 1.00 1.84 H new ATOM 0 HG2 ARG A 54 3.060 6.002 -11.428 1.00 1.81 H new ATOM 0 HG3 ARG A 54 1.382 5.979 -11.934 1.00 1.81 H new ATOM 0 HD2 ARG A 54 3.038 8.519 -12.093 1.00 2.31 H new ATOM 0 HD3 ARG A 54 3.092 7.320 -13.370 1.00 2.31 H new ATOM 0 HE ARG A 54 0.342 7.888 -12.890 1.00 3.28 H new ATOM 0 HH11 ARG A 54 3.234 9.644 -13.955 1.00 4.37 H new ATOM 0 HH12 ARG A 54 2.332 10.720 -15.027 1.00 4.37 H new ATOM 0 HH21 ARG A 54 -0.806 9.219 -14.328 1.00 5.54 H new ATOM 0 HH22 ARG A 54 0.035 10.478 -15.238 1.00 5.54 H new ATOM 833 N GLY A 55 1.619 6.252 -6.711 1.00 0.98 N ATOM 834 CA GLY A 55 1.016 6.412 -5.396 1.00 1.00 C ATOM 835 C GLY A 55 1.764 7.376 -4.488 1.00 0.72 C ATOM 836 O GLY A 55 2.990 7.458 -4.497 1.00 0.91 O ATOM 0 H GLY A 55 2.562 5.863 -6.691 1.00 0.98 H new ATOM 0 HA2 GLY A 55 -0.009 6.764 -5.517 1.00 1.00 H new ATOM 0 HA3 GLY A 55 0.963 5.438 -4.910 1.00 1.00 H new ATOM 840 N THR A 56 0.988 8.081 -3.669 1.00 0.53 N ATOM 841 CA THR A 56 1.435 8.971 -2.620 1.00 0.71 C ATOM 842 C THR A 56 1.041 8.334 -1.290 1.00 0.57 C ATOM 843 O THR A 56 -0.093 7.880 -1.125 1.00 0.74 O ATOM 844 CB THR A 56 0.796 10.358 -2.801 1.00 1.12 C ATOM 845 OG1 THR A 56 -0.619 10.306 -2.772 1.00 2.46 O ATOM 846 CG2 THR A 56 1.235 10.989 -4.125 1.00 1.63 C ATOM 0 H THR A 56 -0.029 8.038 -3.730 1.00 0.53 H new ATOM 0 HA THR A 56 2.515 9.115 -2.651 1.00 0.71 H new ATOM 0 HB THR A 56 1.138 10.965 -1.963 1.00 1.12 H new ATOM 0 HG1 THR A 56 -0.916 9.386 -2.934 1.00 2.46 H new ATOM 0 HG21 THR A 56 0.771 11.969 -4.232 1.00 1.63 H new ATOM 0 HG22 THR A 56 2.320 11.098 -4.134 1.00 1.63 H new ATOM 0 HG23 THR A 56 0.927 10.350 -4.952 1.00 1.63 H new ATOM 854 N ALA A 57 1.993 8.272 -0.363 1.00 0.70 N ATOM 855 CA ALA A 57 1.775 7.869 1.011 1.00 0.66 C ATOM 856 C ALA A 57 2.143 9.077 1.863 1.00 0.79 C ATOM 857 O ALA A 57 3.232 9.117 2.427 1.00 1.06 O ATOM 858 CB ALA A 57 2.643 6.644 1.306 1.00 0.69 C ATOM 0 H ALA A 57 2.965 8.509 -0.560 1.00 0.70 H new ATOM 0 HA ALA A 57 0.746 7.579 1.222 1.00 0.66 H new ATOM 0 HB1 ALA A 57 2.489 6.329 2.338 1.00 0.69 H new ATOM 0 HB2 ALA A 57 2.367 5.832 0.634 1.00 0.69 H new ATOM 0 HB3 ALA A 57 3.693 6.897 1.157 1.00 0.69 H new ATOM 864 N PHE A 58 1.265 10.079 1.910 1.00 0.76 N ATOM 865 CA PHE A 58 1.569 11.383 2.493 1.00 0.89 C ATOM 866 C PHE A 58 1.487 11.305 4.006 1.00 0.79 C ATOM 867 O PHE A 58 0.607 10.656 4.566 1.00 0.69 O ATOM 868 CB PHE A 58 0.703 12.485 1.883 1.00 1.11 C ATOM 869 CG PHE A 58 -0.763 12.448 2.261 1.00 1.16 C ATOM 870 CD1 PHE A 58 -1.711 11.847 1.414 1.00 2.11 C ATOM 871 CD2 PHE A 58 -1.178 13.049 3.463 1.00 2.00 C ATOM 872 CE1 PHE A 58 -3.072 11.853 1.767 1.00 2.31 C ATOM 873 CE2 PHE A 58 -2.534 13.040 3.825 1.00 2.03 C ATOM 874 CZ PHE A 58 -3.486 12.460 2.968 1.00 1.53 C ATOM 0 H PHE A 58 0.317 10.007 1.542 1.00 0.76 H new ATOM 0 HA PHE A 58 2.594 11.659 2.247 1.00 0.89 H new ATOM 0 HB2 PHE A 58 1.112 13.451 2.180 1.00 1.11 H new ATOM 0 HB3 PHE A 58 0.782 12.426 0.797 1.00 1.11 H new ATOM 0 HD1 PHE A 58 -1.394 11.381 0.493 1.00 2.11 H new ATOM 0 HD2 PHE A 58 -0.451 13.519 4.109 1.00 2.00 H new ATOM 0 HE1 PHE A 58 -3.800 11.392 1.116 1.00 2.31 H new ATOM 0 HE2 PHE A 58 -2.846 13.478 4.761 1.00 2.03 H new ATOM 0 HZ PHE A 58 -4.533 12.480 3.231 1.00 1.53 H new ATOM 884 N GLY A 59 2.442 11.943 4.668 1.00 0.90 N ATOM 885 CA GLY A 59 2.628 11.774 6.096 1.00 0.77 C ATOM 886 C GLY A 59 1.573 12.558 6.871 1.00 0.98 C ATOM 887 O GLY A 59 1.004 13.517 6.350 1.00 1.31 O ATOM 0 H GLY A 59 3.103 12.586 4.232 1.00 0.90 H new ATOM 0 HA2 GLY A 59 2.566 10.717 6.354 1.00 0.77 H new ATOM 0 HA3 GLY A 59 3.624 12.113 6.381 1.00 0.77 H new ATOM 891 N SER A 60 1.356 12.200 8.142 1.00 1.04 N ATOM 892 CA SER A 60 0.550 12.984 9.078 1.00 1.46 C ATOM 893 C SER A 60 0.928 14.470 9.015 1.00 1.66 C ATOM 894 O SER A 60 0.071 15.327 9.204 1.00 2.18 O ATOM 895 CB SER A 60 0.736 12.458 10.513 1.00 1.50 C ATOM 896 OG SER A 60 -0.357 12.818 11.342 1.00 2.19 O ATOM 0 H SER A 60 1.740 11.348 8.551 1.00 1.04 H new ATOM 0 HA SER A 60 -0.497 12.880 8.792 1.00 1.46 H new ATOM 0 HB2 SER A 60 0.838 11.373 10.494 1.00 1.50 H new ATOM 0 HB3 SER A 60 1.659 12.858 10.932 1.00 1.50 H new ATOM 0 HG SER A 60 -0.695 13.698 11.074 1.00 2.19 H new ATOM 902 N ASP A 61 2.219 14.739 8.784 1.00 1.49 N ATOM 903 CA ASP A 61 2.816 16.064 8.687 1.00 1.95 C ATOM 904 C ASP A 61 3.428 16.274 7.289 1.00 1.75 C ATOM 905 O ASP A 61 4.450 16.939 7.159 1.00 1.77 O ATOM 906 CB ASP A 61 3.900 16.130 9.777 1.00 2.35 C ATOM 907 CG ASP A 61 4.367 17.549 10.081 1.00 3.17 C ATOM 908 OD1 ASP A 61 5.557 17.679 10.444 1.00 2.97 O ATOM 909 OD2 ASP A 61 3.519 18.464 10.012 1.00 4.47 O ATOM 0 H ASP A 61 2.905 13.996 8.654 1.00 1.49 H new ATOM 0 HA ASP A 61 2.073 16.849 8.829 1.00 1.95 H new ATOM 0 HB2 ASP A 61 3.514 15.679 10.691 1.00 2.35 H new ATOM 0 HB3 ASP A 61 4.756 15.533 9.464 1.00 2.35 H new ATOM 914 N ASP A 62 2.866 15.621 6.257 1.00 1.61 N ATOM 915 CA ASP A 62 3.548 15.229 5.043 1.00 1.51 C ATOM 916 C ASP A 62 5.066 15.366 4.967 1.00 1.65 C ATOM 917 O ASP A 62 5.608 16.229 4.278 1.00 2.10 O ATOM 918 CB ASP A 62 2.832 15.617 3.750 1.00 1.74 C ATOM 919 CG ASP A 62 3.331 14.726 2.616 1.00 1.74 C ATOM 920 OD1 ASP A 62 3.098 15.094 1.447 1.00 2.47 O ATOM 921 OD2 ASP A 62 3.872 13.642 2.941 1.00 2.72 O ATOM 0 H ASP A 62 1.883 15.348 6.261 1.00 1.61 H new ATOM 0 HA ASP A 62 3.452 14.148 5.143 1.00 1.51 H new ATOM 0 HB2 ASP A 62 1.754 15.506 3.869 1.00 1.74 H new ATOM 0 HB3 ASP A 62 3.020 16.665 3.516 1.00 1.74 H new ATOM 926 N ALA A 63 5.731 14.391 5.586 1.00 1.37 N ATOM 927 CA ALA A 63 7.042 13.944 5.157 1.00 1.49 C ATOM 928 C ALA A 63 6.895 12.479 4.751 1.00 1.24 C ATOM 929 O ALA A 63 7.603 11.604 5.245 1.00 1.27 O ATOM 930 CB ALA A 63 7.980 14.100 6.347 1.00 1.60 C ATOM 0 H ALA A 63 5.370 13.893 6.399 1.00 1.37 H new ATOM 0 HA ALA A 63 7.440 14.512 4.317 1.00 1.49 H new ATOM 0 HB1 ALA A 63 8.981 13.773 6.066 1.00 1.60 H new ATOM 0 HB2 ALA A 63 8.011 15.146 6.651 1.00 1.60 H new ATOM 0 HB3 ALA A 63 7.619 13.492 7.177 1.00 1.60 H new ATOM 936 N GLY A 64 5.956 12.223 3.845 1.00 1.20 N ATOM 937 CA GLY A 64 5.473 10.903 3.501 1.00 1.08 C ATOM 938 C GLY A 64 6.308 10.255 2.392 1.00 0.93 C ATOM 939 O GLY A 64 7.315 10.810 1.958 1.00 1.13 O ATOM 0 H GLY A 64 5.497 12.963 3.313 1.00 1.20 H new ATOM 0 HA2 GLY A 64 5.492 10.268 4.387 1.00 1.08 H new ATOM 0 HA3 GLY A 64 4.434 10.970 3.180 1.00 1.08 H new ATOM 943 N GLY A 65 5.920 9.042 1.990 1.00 1.00 N ATOM 944 CA GLY A 65 6.543 8.238 0.957 1.00 1.03 C ATOM 945 C GLY A 65 5.833 8.339 -0.400 1.00 0.84 C ATOM 946 O GLY A 65 4.728 8.874 -0.509 1.00 0.95 O ATOM 0 H GLY A 65 5.115 8.575 2.407 1.00 1.00 H new ATOM 0 HA2 GLY A 65 7.581 8.549 0.840 1.00 1.03 H new ATOM 0 HA3 GLY A 65 6.556 7.196 1.276 1.00 1.03 H new ATOM 950 N LYS A 66 6.451 7.752 -1.429 1.00 0.86 N ATOM 951 CA LYS A 66 5.903 7.562 -2.770 1.00 0.86 C ATOM 952 C LYS A 66 5.644 6.072 -2.994 1.00 0.82 C ATOM 953 O LYS A 66 6.601 5.335 -3.214 1.00 1.31 O ATOM 954 CB LYS A 66 6.951 7.995 -3.794 1.00 1.27 C ATOM 955 CG LYS A 66 7.097 9.508 -3.920 1.00 1.37 C ATOM 956 CD LYS A 66 8.039 9.843 -5.094 1.00 1.74 C ATOM 957 CE LYS A 66 9.511 9.451 -4.869 1.00 2.29 C ATOM 958 NZ LYS A 66 9.836 8.040 -5.182 1.00 3.21 N ATOM 0 H LYS A 66 7.396 7.378 -1.342 1.00 0.86 H new ATOM 0 HA LYS A 66 4.985 8.140 -2.874 1.00 0.86 H new ATOM 0 HB2 LYS A 66 7.915 7.568 -3.517 1.00 1.27 H new ATOM 0 HB3 LYS A 66 6.687 7.582 -4.768 1.00 1.27 H new ATOM 0 HG2 LYS A 66 6.121 9.965 -4.083 1.00 1.37 H new ATOM 0 HG3 LYS A 66 7.493 9.923 -2.993 1.00 1.37 H new ATOM 0 HD2 LYS A 66 7.675 9.339 -5.989 1.00 1.74 H new ATOM 0 HD3 LYS A 66 7.988 10.914 -5.289 1.00 1.74 H new ATOM 0 HE2 LYS A 66 10.141 10.098 -5.479 1.00 2.29 H new ATOM 0 HE3 LYS A 66 9.768 9.645 -3.828 1.00 2.29 H new ATOM 0 HZ1 LYS A 66 10.292 7.598 -4.358 1.00 3.21 H new ATOM 0 HZ2 LYS A 66 8.962 7.525 -5.412 1.00 3.21 H new ATOM 0 HZ3 LYS A 66 10.482 8.005 -5.996 1.00 3.21 H new ATOM 972 N LEU A 67 4.390 5.627 -2.961 1.00 0.90 N ATOM 973 CA LEU A 67 4.051 4.216 -3.099 1.00 0.92 C ATOM 974 C LEU A 67 4.088 3.820 -4.579 1.00 0.83 C ATOM 975 O LEU A 67 3.337 4.374 -5.385 1.00 1.09 O ATOM 976 CB LEU A 67 2.661 3.969 -2.490 1.00 1.17 C ATOM 977 CG LEU A 67 2.350 2.469 -2.350 1.00 1.35 C ATOM 978 CD1 LEU A 67 2.904 1.939 -1.024 1.00 1.52 C ATOM 979 CD2 LEU A 67 0.841 2.216 -2.382 1.00 1.52 C ATOM 0 H LEU A 67 3.581 6.236 -2.838 1.00 0.90 H new ATOM 0 HA LEU A 67 4.776 3.601 -2.567 1.00 0.92 H new ATOM 0 HB2 LEU A 67 2.605 4.444 -1.510 1.00 1.17 H new ATOM 0 HB3 LEU A 67 1.903 4.439 -3.116 1.00 1.17 H new ATOM 0 HG LEU A 67 2.819 1.953 -3.188 1.00 1.35 H new ATOM 0 HD11 LEU A 67 2.679 0.876 -0.934 1.00 1.52 H new ATOM 0 HD12 LEU A 67 3.984 2.085 -0.997 1.00 1.52 H new ATOM 0 HD13 LEU A 67 2.444 2.478 -0.196 1.00 1.52 H new ATOM 0 HD21 LEU A 67 0.649 1.148 -2.281 1.00 1.52 H new ATOM 0 HD22 LEU A 67 0.365 2.749 -1.559 1.00 1.52 H new ATOM 0 HD23 LEU A 67 0.433 2.570 -3.328 1.00 1.52 H new ATOM 991 N THR A 68 4.932 2.856 -4.953 1.00 0.65 N ATOM 992 CA THR A 68 4.905 2.305 -6.300 1.00 0.67 C ATOM 993 C THR A 68 3.783 1.280 -6.458 1.00 0.90 C ATOM 994 O THR A 68 3.328 0.666 -5.494 1.00 1.14 O ATOM 995 CB THR A 68 6.283 1.729 -6.644 1.00 0.78 C ATOM 996 OG1 THR A 68 6.785 1.007 -5.538 1.00 1.85 O ATOM 997 CG2 THR A 68 7.238 2.878 -6.984 1.00 1.49 C ATOM 0 H THR A 68 5.638 2.445 -4.342 1.00 0.65 H new ATOM 0 HA THR A 68 4.687 3.101 -7.012 1.00 0.67 H new ATOM 0 HB THR A 68 6.196 1.059 -7.500 1.00 0.78 H new ATOM 0 HG1 THR A 68 7.665 0.638 -5.760 1.00 1.85 H new ATOM 0 HG21 THR A 68 8.220 2.474 -7.230 1.00 1.49 H new ATOM 0 HG22 THR A 68 6.850 3.433 -7.838 1.00 1.49 H new ATOM 0 HG23 THR A 68 7.324 3.545 -6.126 1.00 1.49 H new ATOM 1005 N TYR A 69 3.338 1.083 -7.702 1.00 0.91 N ATOM 1006 CA TYR A 69 2.324 0.106 -8.023 1.00 0.91 C ATOM 1007 C TYR A 69 2.943 -1.285 -8.009 1.00 0.86 C ATOM 1008 O TYR A 69 3.933 -1.533 -8.691 1.00 0.97 O ATOM 1009 CB TYR A 69 1.728 0.458 -9.389 1.00 0.92 C ATOM 1010 CG TYR A 69 2.587 0.130 -10.605 1.00 0.93 C ATOM 1011 CD1 TYR A 69 2.523 -1.163 -11.150 1.00 2.29 C ATOM 1012 CD2 TYR A 69 3.533 1.041 -11.116 1.00 1.57 C ATOM 1013 CE1 TYR A 69 3.330 -1.528 -12.234 1.00 2.63 C ATOM 1014 CE2 TYR A 69 4.354 0.673 -12.201 1.00 1.49 C ATOM 1015 CZ TYR A 69 4.242 -0.611 -12.764 1.00 1.50 C ATOM 1016 OH TYR A 69 5.005 -0.993 -13.831 1.00 1.96 O ATOM 0 H TYR A 69 3.680 1.604 -8.509 1.00 0.91 H new ATOM 0 HA TYR A 69 1.521 0.114 -7.286 1.00 0.91 H new ATOM 0 HB2 TYR A 69 0.776 -0.063 -9.492 1.00 0.92 H new ATOM 0 HB3 TYR A 69 1.510 1.526 -9.402 1.00 0.92 H new ATOM 0 HD1 TYR A 69 1.841 -1.886 -10.727 1.00 2.29 H new ATOM 0 HD2 TYR A 69 3.629 2.022 -10.676 1.00 1.57 H new ATOM 0 HE1 TYR A 69 3.248 -2.517 -12.660 1.00 2.63 H new ATOM 0 HE2 TYR A 69 5.069 1.377 -12.600 1.00 1.49 H new ATOM 0 HH TYR A 69 5.593 -0.254 -14.094 1.00 1.96 H new ATOM 1026 N THR A 70 2.389 -2.184 -7.200 1.00 0.77 N ATOM 1027 CA THR A 70 2.682 -3.606 -7.253 1.00 0.72 C ATOM 1028 C THR A 70 1.507 -4.337 -6.601 1.00 0.76 C ATOM 1029 O THR A 70 1.496 -4.461 -5.379 1.00 0.79 O ATOM 1030 CB THR A 70 4.008 -3.902 -6.515 1.00 0.75 C ATOM 1031 OG1 THR A 70 5.127 -3.438 -7.243 1.00 0.91 O ATOM 1032 CG2 THR A 70 4.263 -5.402 -6.316 1.00 0.92 C ATOM 0 H THR A 70 1.712 -1.936 -6.478 1.00 0.77 H new ATOM 0 HA THR A 70 2.805 -3.945 -8.282 1.00 0.72 H new ATOM 0 HB THR A 70 3.897 -3.394 -5.557 1.00 0.75 H new ATOM 0 HG1 THR A 70 4.825 -2.856 -7.971 1.00 0.91 H new ATOM 0 HG21 THR A 70 5.208 -5.544 -5.793 1.00 0.92 H new ATOM 0 HG22 THR A 70 3.454 -5.834 -5.727 1.00 0.92 H new ATOM 0 HG23 THR A 70 4.308 -5.895 -7.287 1.00 0.92 H new ATOM 1040 N ILE A 71 0.523 -4.823 -7.368 1.00 0.84 N ATOM 1041 CA ILE A 71 -0.353 -5.876 -6.911 1.00 0.77 C ATOM 1042 C ILE A 71 -0.458 -6.887 -8.047 1.00 0.79 C ATOM 1043 O ILE A 71 -0.568 -6.461 -9.195 1.00 1.02 O ATOM 1044 CB ILE A 71 -1.726 -5.311 -6.484 1.00 0.84 C ATOM 1045 CG1 ILE A 71 -2.911 -5.556 -7.434 1.00 1.07 C ATOM 1046 CG2 ILE A 71 -1.746 -3.850 -5.989 1.00 1.10 C ATOM 1047 CD1 ILE A 71 -3.152 -4.612 -8.609 1.00 1.74 C ATOM 0 H ILE A 71 0.324 -4.492 -8.312 1.00 0.84 H new ATOM 0 HA ILE A 71 0.044 -6.365 -6.022 1.00 0.77 H new ATOM 0 HB ILE A 71 -1.886 -5.950 -5.616 1.00 0.84 H new ATOM 0 HG12 ILE A 71 -2.797 -6.560 -7.842 1.00 1.07 H new ATOM 0 HG13 ILE A 71 -3.817 -5.559 -6.829 1.00 1.07 H new ATOM 0 HG21 ILE A 71 -2.765 -3.571 -5.719 1.00 1.10 H new ATOM 0 HG22 ILE A 71 -1.100 -3.753 -5.116 1.00 1.10 H new ATOM 0 HG23 ILE A 71 -1.387 -3.193 -6.781 1.00 1.10 H new ATOM 0 HD11 ILE A 71 -4.029 -4.941 -9.166 1.00 1.74 H new ATOM 0 HD12 ILE A 71 -3.317 -3.601 -8.236 1.00 1.74 H new ATOM 0 HD13 ILE A 71 -2.282 -4.618 -9.265 1.00 1.74 H new ATOM 1059 N ASP A 72 -0.487 -8.189 -7.746 1.00 0.70 N ATOM 1060 CA ASP A 72 -1.008 -9.158 -8.701 1.00 0.85 C ATOM 1061 C ASP A 72 -2.492 -9.360 -8.423 1.00 0.95 C ATOM 1062 O ASP A 72 -2.871 -9.974 -7.423 1.00 1.00 O ATOM 1063 CB ASP A 72 -0.272 -10.496 -8.675 1.00 0.96 C ATOM 1064 CG ASP A 72 -0.835 -11.441 -9.737 1.00 2.68 C ATOM 1065 OD1 ASP A 72 -0.341 -12.583 -9.782 1.00 3.27 O ATOM 1066 OD2 ASP A 72 -1.747 -11.014 -10.491 1.00 4.24 O ATOM 0 H ASP A 72 -0.161 -8.586 -6.865 1.00 0.70 H new ATOM 0 HA ASP A 72 -0.850 -8.756 -9.702 1.00 0.85 H new ATOM 0 HB2 ASP A 72 0.792 -10.335 -8.851 1.00 0.96 H new ATOM 0 HB3 ASP A 72 -0.367 -10.950 -7.689 1.00 0.96 H new ATOM 1071 N PHE A 73 -3.312 -8.837 -9.332 1.00 1.17 N ATOM 1072 CA PHE A 73 -4.752 -9.004 -9.394 1.00 1.15 C ATOM 1073 C PHE A 73 -5.201 -10.469 -9.306 1.00 1.11 C ATOM 1074 O PHE A 73 -6.347 -10.717 -8.936 1.00 1.27 O ATOM 1075 CB PHE A 73 -5.245 -8.399 -10.701 1.00 1.25 C ATOM 1076 CG PHE A 73 -4.983 -6.923 -10.911 1.00 1.38 C ATOM 1077 CD1 PHE A 73 -6.026 -6.016 -10.680 1.00 2.86 C ATOM 1078 CD2 PHE A 73 -3.829 -6.496 -11.597 1.00 1.65 C ATOM 1079 CE1 PHE A 73 -5.946 -4.706 -11.176 1.00 3.04 C ATOM 1080 CE2 PHE A 73 -3.767 -5.195 -12.123 1.00 1.75 C ATOM 1081 CZ PHE A 73 -4.822 -4.295 -11.910 1.00 1.84 C ATOM 0 H PHE A 73 -2.961 -8.250 -10.089 1.00 1.17 H new ATOM 0 HA PHE A 73 -5.181 -8.500 -8.528 1.00 1.15 H new ATOM 0 HB2 PHE A 73 -4.785 -8.946 -11.524 1.00 1.25 H new ATOM 0 HB3 PHE A 73 -6.320 -8.566 -10.769 1.00 1.25 H new ATOM 0 HD1 PHE A 73 -6.895 -6.327 -10.118 1.00 2.86 H new ATOM 0 HD2 PHE A 73 -2.993 -7.168 -11.718 1.00 1.65 H new ATOM 0 HE1 PHE A 73 -6.752 -4.011 -10.992 1.00 3.04 H new ATOM 0 HE2 PHE A 73 -2.904 -4.886 -12.694 1.00 1.75 H new ATOM 0 HZ PHE A 73 -4.770 -3.292 -12.308 1.00 1.84 H new ATOM 1091 N ALA A 74 -4.334 -11.441 -9.619 1.00 1.11 N ATOM 1092 CA ALA A 74 -4.657 -12.857 -9.459 1.00 1.23 C ATOM 1093 C ALA A 74 -5.144 -13.193 -8.041 1.00 1.10 C ATOM 1094 O ALA A 74 -5.911 -14.136 -7.869 1.00 1.21 O ATOM 1095 CB ALA A 74 -3.445 -13.716 -9.822 1.00 1.40 C ATOM 0 H ALA A 74 -3.399 -11.266 -9.987 1.00 1.11 H new ATOM 0 HA ALA A 74 -5.479 -13.080 -10.139 1.00 1.23 H new ATOM 0 HB1 ALA A 74 -3.696 -14.770 -9.699 1.00 1.40 H new ATOM 0 HB2 ALA A 74 -3.163 -13.528 -10.858 1.00 1.40 H new ATOM 0 HB3 ALA A 74 -2.611 -13.463 -9.168 1.00 1.40 H new ATOM 1101 N ALA A 75 -4.713 -12.427 -7.030 1.00 1.05 N ATOM 1102 CA ALA A 75 -5.229 -12.570 -5.662 1.00 1.08 C ATOM 1103 C ALA A 75 -5.236 -11.253 -4.871 1.00 1.06 C ATOM 1104 O ALA A 75 -6.202 -11.011 -4.149 1.00 1.59 O ATOM 1105 CB ALA A 75 -4.537 -13.717 -4.917 1.00 1.18 C ATOM 0 H ALA A 75 -4.006 -11.699 -7.134 1.00 1.05 H new ATOM 0 HA ALA A 75 -6.281 -12.842 -5.754 1.00 1.08 H new ATOM 0 HB1 ALA A 75 -4.944 -13.794 -3.909 1.00 1.18 H new ATOM 0 HB2 ALA A 75 -4.709 -14.653 -5.449 1.00 1.18 H new ATOM 0 HB3 ALA A 75 -3.466 -13.522 -4.862 1.00 1.18 H new ATOM 1111 N LYS A 76 -4.240 -10.374 -5.088 1.00 0.87 N ATOM 1112 CA LYS A 76 -4.123 -8.990 -4.641 1.00 0.91 C ATOM 1113 C LYS A 76 -3.217 -8.797 -3.427 1.00 0.90 C ATOM 1114 O LYS A 76 -3.517 -8.064 -2.487 1.00 1.08 O ATOM 1115 CB LYS A 76 -5.489 -8.380 -4.482 1.00 1.08 C ATOM 1116 CG LYS A 76 -5.518 -6.861 -4.618 1.00 1.69 C ATOM 1117 CD LYS A 76 -6.190 -6.536 -5.955 1.00 2.03 C ATOM 1118 CE LYS A 76 -6.452 -5.035 -6.110 1.00 2.95 C ATOM 1119 NZ LYS A 76 -6.992 -4.726 -7.448 1.00 4.19 N ATOM 0 H LYS A 76 -3.424 -10.650 -5.634 1.00 0.87 H new ATOM 0 HA LYS A 76 -3.602 -8.440 -5.425 1.00 0.91 H new ATOM 0 HB2 LYS A 76 -6.156 -8.813 -5.228 1.00 1.08 H new ATOM 0 HB3 LYS A 76 -5.884 -8.653 -3.504 1.00 1.08 H new ATOM 0 HG2 LYS A 76 -6.069 -6.412 -3.792 1.00 1.69 H new ATOM 0 HG3 LYS A 76 -4.508 -6.453 -4.587 1.00 1.69 H new ATOM 0 HD2 LYS A 76 -5.558 -6.881 -6.773 1.00 2.03 H new ATOM 0 HD3 LYS A 76 -7.132 -7.079 -6.030 1.00 2.03 H new ATOM 0 HE2 LYS A 76 -7.155 -4.704 -5.345 1.00 2.95 H new ATOM 0 HE3 LYS A 76 -5.526 -4.483 -5.952 1.00 2.95 H new ATOM 0 HZ1 LYS A 76 -6.861 -3.714 -7.650 1.00 4.19 H new ATOM 0 HZ2 LYS A 76 -6.490 -5.289 -8.164 1.00 4.19 H new ATOM 0 HZ3 LYS A 76 -8.006 -4.956 -7.475 1.00 4.19 H new ATOM 1133 N GLN A 77 -2.016 -9.337 -3.559 1.00 0.97 N ATOM 1134 CA GLN A 77 -0.853 -9.086 -2.733 1.00 0.88 C ATOM 1135 C GLN A 77 -0.322 -7.700 -3.094 1.00 0.99 C ATOM 1136 O GLN A 77 0.722 -7.554 -3.726 1.00 1.82 O ATOM 1137 CB GLN A 77 0.180 -10.213 -2.897 1.00 1.21 C ATOM 1138 CG GLN A 77 0.348 -10.740 -4.335 1.00 1.11 C ATOM 1139 CD GLN A 77 -0.665 -11.841 -4.673 1.00 1.20 C ATOM 1140 OE1 GLN A 77 -0.578 -12.935 -4.128 1.00 1.89 O ATOM 1141 NE2 GLN A 77 -1.641 -11.582 -5.548 1.00 1.11 N ATOM 0 H GLN A 77 -1.818 -10.010 -4.300 1.00 0.97 H new ATOM 0 HA GLN A 77 -1.104 -9.087 -1.672 1.00 0.88 H new ATOM 0 HB2 GLN A 77 1.146 -9.854 -2.543 1.00 1.21 H new ATOM 0 HB3 GLN A 77 -0.107 -11.044 -2.253 1.00 1.21 H new ATOM 0 HG2 GLN A 77 0.233 -9.915 -5.038 1.00 1.11 H new ATOM 0 HG3 GLN A 77 1.359 -11.128 -4.462 1.00 1.11 H new ATOM 0 HE21 GLN A 77 -1.698 -10.665 -5.992 1.00 1.11 H new ATOM 0 HE22 GLN A 77 -2.329 -12.301 -5.772 1.00 1.11 H new ATOM 1150 N GLY A 78 -1.121 -6.687 -2.763 1.00 0.97 N ATOM 1151 CA GLY A 78 -0.878 -5.312 -3.146 1.00 1.14 C ATOM 1152 C GLY A 78 0.123 -4.640 -2.222 1.00 0.98 C ATOM 1153 O GLY A 78 -0.258 -4.153 -1.158 1.00 1.10 O ATOM 0 H GLY A 78 -1.970 -6.810 -2.210 1.00 0.97 H new ATOM 0 HA2 GLY A 78 -0.506 -5.280 -4.170 1.00 1.14 H new ATOM 0 HA3 GLY A 78 -1.817 -4.758 -3.130 1.00 1.14 H new ATOM 1157 N ASN A 79 1.400 -4.619 -2.611 1.00 0.95 N ATOM 1158 CA ASN A 79 2.506 -4.269 -1.740 1.00 1.07 C ATOM 1159 C ASN A 79 3.627 -3.728 -2.610 1.00 1.41 C ATOM 1160 O ASN A 79 4.228 -4.481 -3.370 1.00 2.11 O ATOM 1161 CB ASN A 79 2.978 -5.510 -0.972 1.00 1.17 C ATOM 1162 CG ASN A 79 1.835 -6.151 -0.201 1.00 1.50 C ATOM 1163 OD1 ASN A 79 1.294 -7.170 -0.619 1.00 2.86 O ATOM 1164 ND2 ASN A 79 1.409 -5.529 0.889 1.00 1.04 N ATOM 0 H ASN A 79 1.692 -4.851 -3.561 1.00 0.95 H new ATOM 0 HA ASN A 79 2.199 -3.518 -1.012 1.00 1.07 H new ATOM 0 HB2 ASN A 79 3.399 -6.234 -1.670 1.00 1.17 H new ATOM 0 HB3 ASN A 79 3.774 -5.232 -0.282 1.00 1.17 H new ATOM 0 HD21 ASN A 79 0.610 -5.896 1.406 1.00 1.04 H new ATOM 0 HD22 ASN A 79 1.880 -4.684 1.211 1.00 1.04 H new ATOM 1171 N GLY A 80 3.882 -2.423 -2.528 1.00 1.11 N ATOM 1172 CA GLY A 80 4.916 -1.746 -3.288 1.00 1.32 C ATOM 1173 C GLY A 80 5.589 -0.762 -2.347 1.00 0.92 C ATOM 1174 O GLY A 80 4.933 -0.230 -1.456 1.00 0.99 O ATOM 0 H GLY A 80 3.359 -1.798 -1.915 1.00 1.11 H new ATOM 0 HA2 GLY A 80 5.639 -2.462 -3.678 1.00 1.32 H new ATOM 0 HA3 GLY A 80 4.487 -1.227 -4.145 1.00 1.32 H new ATOM 1178 N LYS A 81 6.896 -0.574 -2.500 1.00 0.77 N ATOM 1179 CA LYS A 81 7.703 0.148 -1.524 1.00 0.58 C ATOM 1180 C LYS A 81 7.563 1.666 -1.642 1.00 0.66 C ATOM 1181 O LYS A 81 7.081 2.173 -2.657 1.00 0.98 O ATOM 1182 CB LYS A 81 9.161 -0.332 -1.589 1.00 0.76 C ATOM 1183 CG LYS A 81 9.913 -0.231 -2.927 1.00 1.27 C ATOM 1184 CD LYS A 81 11.099 -1.209 -2.825 1.00 1.88 C ATOM 1185 CE LYS A 81 11.943 -1.384 -4.094 1.00 2.71 C ATOM 1186 NZ LYS A 81 12.870 -0.263 -4.346 1.00 4.09 N ATOM 0 H LYS A 81 7.424 -0.917 -3.302 1.00 0.77 H new ATOM 0 HA LYS A 81 7.320 -0.085 -0.530 1.00 0.58 H new ATOM 0 HB2 LYS A 81 9.728 0.232 -0.848 1.00 0.76 H new ATOM 0 HB3 LYS A 81 9.179 -1.376 -1.278 1.00 0.76 H new ATOM 0 HG2 LYS A 81 9.262 -0.494 -3.761 1.00 1.27 H new ATOM 0 HG3 LYS A 81 10.261 0.787 -3.103 1.00 1.27 H new ATOM 0 HD2 LYS A 81 11.754 -0.871 -2.022 1.00 1.88 H new ATOM 0 HD3 LYS A 81 10.714 -2.186 -2.532 1.00 1.88 H new ATOM 0 HE2 LYS A 81 12.516 -2.308 -4.015 1.00 2.71 H new ATOM 0 HE3 LYS A 81 11.278 -1.494 -4.950 1.00 2.71 H new ATOM 0 HZ1 LYS A 81 13.512 -0.512 -5.125 1.00 4.09 H new ATOM 0 HZ2 LYS A 81 12.327 0.586 -4.603 1.00 4.09 H new ATOM 0 HZ3 LYS A 81 13.425 -0.072 -3.488 1.00 4.09 H new ATOM 1200 N ILE A 82 8.002 2.378 -0.594 1.00 0.71 N ATOM 1201 CA ILE A 82 8.196 3.828 -0.629 1.00 0.97 C ATOM 1202 C ILE A 82 9.680 4.145 -0.589 1.00 0.96 C ATOM 1203 O ILE A 82 10.444 3.499 0.127 1.00 1.47 O ATOM 1204 CB ILE A 82 7.433 4.599 0.460 1.00 1.28 C ATOM 1205 CG1 ILE A 82 7.903 4.332 1.893 1.00 2.28 C ATOM 1206 CG2 ILE A 82 5.927 4.363 0.363 1.00 2.53 C ATOM 1207 CD1 ILE A 82 8.746 5.478 2.450 1.00 3.89 C ATOM 0 H ILE A 82 8.233 1.957 0.306 1.00 0.71 H new ATOM 0 HA ILE A 82 7.765 4.175 -1.568 1.00 0.97 H new ATOM 0 HB ILE A 82 7.663 5.644 0.254 1.00 1.28 H new ATOM 0 HG12 ILE A 82 7.036 4.177 2.535 1.00 2.28 H new ATOM 0 HG13 ILE A 82 8.485 3.411 1.916 1.00 2.28 H new ATOM 0 HG21 ILE A 82 5.420 4.923 1.148 1.00 2.53 H new ATOM 0 HG22 ILE A 82 5.568 4.697 -0.611 1.00 2.53 H new ATOM 0 HG23 ILE A 82 5.717 3.300 0.482 1.00 2.53 H new ATOM 0 HD11 ILE A 82 9.055 5.241 3.468 1.00 3.89 H new ATOM 0 HD12 ILE A 82 9.629 5.617 1.826 1.00 3.89 H new ATOM 0 HD13 ILE A 82 8.156 6.395 2.454 1.00 3.89 H new ATOM 1219 N GLU A 83 10.088 5.111 -1.415 1.00 1.08 N ATOM 1220 CA GLU A 83 11.483 5.280 -1.764 1.00 1.13 C ATOM 1221 C GLU A 83 11.778 6.713 -2.210 1.00 1.30 C ATOM 1222 O GLU A 83 11.566 7.072 -3.372 1.00 1.93 O ATOM 1223 CB GLU A 83 11.829 4.228 -2.821 1.00 1.39 C ATOM 1224 CG GLU A 83 13.262 3.731 -2.653 1.00 1.22 C ATOM 1225 CD GLU A 83 13.420 2.425 -3.416 1.00 1.71 C ATOM 1226 OE1 GLU A 83 12.772 2.284 -4.479 1.00 2.72 O ATOM 1227 OE2 GLU A 83 14.072 1.489 -2.905 1.00 1.99 O ATOM 0 H GLU A 83 9.461 5.787 -1.852 1.00 1.08 H new ATOM 0 HA GLU A 83 12.122 5.124 -0.895 1.00 1.13 H new ATOM 0 HB2 GLU A 83 11.138 3.389 -2.743 1.00 1.39 H new ATOM 0 HB3 GLU A 83 11.703 4.653 -3.817 1.00 1.39 H new ATOM 0 HG2 GLU A 83 13.966 4.474 -3.027 1.00 1.22 H new ATOM 0 HG3 GLU A 83 13.488 3.581 -1.597 1.00 1.22 H new ATOM 1234 N HIS A 84 12.152 7.554 -1.246 1.00 0.94 N ATOM 1235 CA HIS A 84 12.923 8.779 -1.464 1.00 1.02 C ATOM 1236 C HIS A 84 13.535 9.351 -0.180 1.00 0.95 C ATOM 1237 O HIS A 84 14.376 10.244 -0.262 1.00 1.65 O ATOM 1238 CB HIS A 84 12.073 9.862 -2.132 1.00 1.59 C ATOM 1239 CG HIS A 84 10.812 10.201 -1.379 1.00 2.11 C ATOM 1240 ND1 HIS A 84 10.517 11.413 -0.796 1.00 3.75 N ATOM 1241 CD2 HIS A 84 9.701 9.409 -1.270 1.00 2.27 C ATOM 1242 CE1 HIS A 84 9.244 11.354 -0.367 1.00 4.68 C ATOM 1243 NE2 HIS A 84 8.703 10.160 -0.659 1.00 3.88 N ATOM 0 H HIS A 84 11.921 7.398 -0.265 1.00 0.94 H new ATOM 0 HA HIS A 84 13.741 8.487 -2.123 1.00 1.02 H new ATOM 0 HB2 HIS A 84 12.673 10.765 -2.241 1.00 1.59 H new ATOM 0 HB3 HIS A 84 11.807 9.533 -3.137 1.00 1.59 H new ATOM 0 HD1 HIS A 84 11.148 12.209 -0.706 1.00 3.75 H new ATOM 0 HD2 HIS A 84 9.615 8.384 -1.600 1.00 2.27 H new ATOM 0 HE1 HIS A 84 8.728 12.155 0.142 1.00 4.68 H new ATOM 1251 N LEU A 85 13.082 8.913 1.000 1.00 0.86 N ATOM 1252 CA LEU A 85 13.410 9.586 2.245 1.00 0.87 C ATOM 1253 C LEU A 85 14.915 9.635 2.487 1.00 0.98 C ATOM 1254 O LEU A 85 15.628 8.663 2.240 1.00 1.31 O ATOM 1255 CB LEU A 85 12.662 8.909 3.402 1.00 0.88 C ATOM 1256 CG LEU A 85 11.174 9.254 3.329 1.00 1.03 C ATOM 1257 CD1 LEU A 85 10.266 8.213 3.982 1.00 1.82 C ATOM 1258 CD2 LEU A 85 10.882 10.613 3.962 1.00 1.62 C ATOM 0 H LEU A 85 12.486 8.093 1.111 1.00 0.86 H new ATOM 0 HA LEU A 85 13.084 10.624 2.179 1.00 0.87 H new ATOM 0 HB2 LEU A 85 12.797 7.829 3.352 1.00 0.88 H new ATOM 0 HB3 LEU A 85 13.075 9.238 4.356 1.00 0.88 H new ATOM 0 HG LEU A 85 10.949 9.275 2.263 1.00 1.03 H new ATOM 0 HD11 LEU A 85 9.227 8.528 3.890 1.00 1.82 H new ATOM 0 HD12 LEU A 85 10.399 7.252 3.486 1.00 1.82 H new ATOM 0 HD13 LEU A 85 10.524 8.116 5.037 1.00 1.82 H new ATOM 0 HD21 LEU A 85 9.815 10.825 3.892 1.00 1.62 H new ATOM 0 HD22 LEU A 85 11.181 10.598 5.010 1.00 1.62 H new ATOM 0 HD23 LEU A 85 11.441 11.387 3.436 1.00 1.62 H new ATOM 1270 N LYS A 86 15.373 10.774 3.029 1.00 1.06 N ATOM 1271 CA LYS A 86 16.775 11.067 3.294 1.00 1.34 C ATOM 1272 C LYS A 86 17.421 10.013 4.195 1.00 1.26 C ATOM 1273 O LYS A 86 18.639 9.873 4.234 1.00 1.61 O ATOM 1274 CB LYS A 86 16.931 12.488 3.867 1.00 1.70 C ATOM 1275 CG LYS A 86 15.966 12.921 4.989 1.00 1.65 C ATOM 1276 CD LYS A 86 15.887 11.927 6.158 1.00 2.41 C ATOM 1277 CE LYS A 86 15.572 12.529 7.532 1.00 3.09 C ATOM 1278 NZ LYS A 86 15.569 11.488 8.587 1.00 4.30 N ATOM 0 H LYS A 86 14.751 11.536 3.301 1.00 1.06 H new ATOM 0 HA LYS A 86 17.310 11.027 2.345 1.00 1.34 H new ATOM 0 HB2 LYS A 86 17.949 12.587 4.244 1.00 1.70 H new ATOM 0 HB3 LYS A 86 16.826 13.194 3.044 1.00 1.70 H new ATOM 0 HG2 LYS A 86 16.280 13.892 5.371 1.00 1.65 H new ATOM 0 HG3 LYS A 86 14.969 13.052 4.568 1.00 1.65 H new ATOM 0 HD2 LYS A 86 15.125 11.183 5.926 1.00 2.41 H new ATOM 0 HD3 LYS A 86 16.838 11.398 6.224 1.00 2.41 H new ATOM 0 HE2 LYS A 86 16.310 13.294 7.774 1.00 3.09 H new ATOM 0 HE3 LYS A 86 14.600 13.022 7.502 1.00 3.09 H new ATOM 0 HZ1 LYS A 86 15.940 11.889 9.472 1.00 4.30 H new ATOM 0 HZ2 LYS A 86 14.597 11.152 8.740 1.00 4.30 H new ATOM 0 HZ3 LYS A 86 16.168 10.691 8.290 1.00 4.30 H new ATOM 1292 N SER A 87 16.585 9.326 4.972 1.00 0.99 N ATOM 1293 CA SER A 87 16.985 8.363 5.966 1.00 1.13 C ATOM 1294 C SER A 87 16.875 7.021 5.257 1.00 0.95 C ATOM 1295 O SER A 87 15.745 6.643 4.945 1.00 0.92 O ATOM 1296 CB SER A 87 16.003 8.461 7.142 1.00 1.52 C ATOM 1297 OG SER A 87 16.603 9.084 8.262 1.00 1.98 O ATOM 0 H SER A 87 15.573 9.438 4.915 1.00 0.99 H new ATOM 0 HA SER A 87 17.989 8.515 6.362 1.00 1.13 H new ATOM 0 HB2 SER A 87 15.122 9.026 6.837 1.00 1.52 H new ATOM 0 HB3 SER A 87 15.662 7.463 7.418 1.00 1.52 H new ATOM 0 HG SER A 87 16.830 8.405 8.932 1.00 1.98 H new ATOM 1303 N PRO A 88 17.979 6.319 4.954 1.00 1.02 N ATOM 1304 CA PRO A 88 17.913 5.068 4.218 1.00 1.13 C ATOM 1305 C PRO A 88 16.876 4.147 4.858 1.00 1.28 C ATOM 1306 O PRO A 88 15.978 3.656 4.171 1.00 1.60 O ATOM 1307 CB PRO A 88 19.331 4.487 4.224 1.00 1.38 C ATOM 1308 CG PRO A 88 20.027 5.206 5.379 1.00 1.43 C ATOM 1309 CD PRO A 88 19.335 6.568 5.420 1.00 1.22 C ATOM 0 HA PRO A 88 17.589 5.202 3.186 1.00 1.13 H new ATOM 0 HB2 PRO A 88 19.318 3.408 4.377 1.00 1.38 H new ATOM 0 HB3 PRO A 88 19.840 4.669 3.277 1.00 1.38 H new ATOM 0 HG2 PRO A 88 19.907 4.666 6.318 1.00 1.43 H new ATOM 0 HG3 PRO A 88 21.098 5.305 5.203 1.00 1.43 H new ATOM 0 HD2 PRO A 88 19.336 6.980 6.429 1.00 1.22 H new ATOM 0 HD3 PRO A 88 19.845 7.289 4.781 1.00 1.22 H new ATOM 1317 N GLU A 89 16.942 4.011 6.186 1.00 1.28 N ATOM 1318 CA GLU A 89 16.081 3.172 6.992 1.00 1.51 C ATOM 1319 C GLU A 89 14.593 3.491 6.798 1.00 1.42 C ATOM 1320 O GLU A 89 13.748 2.616 6.987 1.00 1.80 O ATOM 1321 CB GLU A 89 16.547 3.233 8.463 1.00 1.79 C ATOM 1322 CG GLU A 89 16.161 4.466 9.310 1.00 2.11 C ATOM 1323 CD GLU A 89 16.836 5.787 8.952 1.00 2.39 C ATOM 1324 OE1 GLU A 89 16.483 6.805 9.598 1.00 2.95 O ATOM 1325 OE2 GLU A 89 17.641 5.798 7.997 1.00 3.20 O ATOM 0 H GLU A 89 17.634 4.511 6.745 1.00 1.28 H new ATOM 0 HA GLU A 89 16.173 2.139 6.656 1.00 1.51 H new ATOM 0 HB2 GLU A 89 16.160 2.349 8.970 1.00 1.79 H new ATOM 0 HB3 GLU A 89 17.634 3.154 8.469 1.00 1.79 H new ATOM 0 HG2 GLU A 89 15.082 4.605 9.236 1.00 2.11 H new ATOM 0 HG3 GLU A 89 16.382 4.244 10.354 1.00 2.11 H new ATOM 1332 N LEU A 90 14.256 4.731 6.433 1.00 1.16 N ATOM 1333 CA LEU A 90 12.881 5.158 6.240 1.00 1.09 C ATOM 1334 C LEU A 90 12.314 4.793 4.881 1.00 0.88 C ATOM 1335 O LEU A 90 11.116 4.972 4.680 1.00 0.95 O ATOM 1336 CB LEU A 90 12.769 6.669 6.437 1.00 1.09 C ATOM 1337 CG LEU A 90 12.168 7.041 7.786 1.00 1.50 C ATOM 1338 CD1 LEU A 90 10.672 6.708 7.861 1.00 2.19 C ATOM 1339 CD2 LEU A 90 12.924 6.405 8.950 1.00 2.29 C ATOM 0 H LEU A 90 14.941 5.468 6.263 1.00 1.16 H new ATOM 0 HA LEU A 90 12.293 4.623 6.986 1.00 1.09 H new ATOM 0 HB2 LEU A 90 13.758 7.118 6.348 1.00 1.09 H new ATOM 0 HB3 LEU A 90 12.155 7.091 5.641 1.00 1.09 H new ATOM 0 HG LEU A 90 12.273 8.122 7.878 1.00 1.50 H new ATOM 0 HD11 LEU A 90 10.285 6.990 8.840 1.00 2.19 H new ATOM 0 HD12 LEU A 90 10.137 7.259 7.087 1.00 2.19 H new ATOM 0 HD13 LEU A 90 10.529 5.638 7.709 1.00 2.19 H new ATOM 0 HD21 LEU A 90 12.458 6.699 9.891 1.00 2.29 H new ATOM 0 HD22 LEU A 90 12.893 5.320 8.854 1.00 2.29 H new ATOM 0 HD23 LEU A 90 13.961 6.741 8.938 1.00 2.29 H new ATOM 1351 N ASN A 91 13.125 4.313 3.940 1.00 0.81 N ATOM 1352 CA ASN A 91 12.619 3.913 2.634 1.00 0.81 C ATOM 1353 C ASN A 91 11.899 2.573 2.785 1.00 0.99 C ATOM 1354 O ASN A 91 12.412 1.520 2.413 1.00 1.67 O ATOM 1355 CB ASN A 91 13.748 3.927 1.602 1.00 1.05 C ATOM 1356 CG ASN A 91 14.229 5.363 1.399 1.00 1.13 C ATOM 1357 OD1 ASN A 91 13.721 6.086 0.545 1.00 2.15 O ATOM 1358 ND2 ASN A 91 15.163 5.817 2.228 1.00 0.82 N ATOM 0 H ASN A 91 14.131 4.193 4.059 1.00 0.81 H new ATOM 0 HA ASN A 91 11.885 4.621 2.251 1.00 0.81 H new ATOM 0 HB2 ASN A 91 14.573 3.299 1.940 1.00 1.05 H new ATOM 0 HB3 ASN A 91 13.398 3.512 0.657 1.00 1.05 H new ATOM 0 HD21 ASN A 91 15.474 6.786 2.164 1.00 0.82 H new ATOM 0 HD22 ASN A 91 15.569 5.196 2.928 1.00 0.82 H new ATOM 1365 N VAL A 92 10.723 2.639 3.412 1.00 0.61 N ATOM 1366 CA VAL A 92 9.920 1.514 3.847 1.00 0.62 C ATOM 1367 C VAL A 92 9.545 0.654 2.651 1.00 0.61 C ATOM 1368 O VAL A 92 8.767 1.068 1.791 1.00 0.74 O ATOM 1369 CB VAL A 92 8.678 2.033 4.597 1.00 0.63 C ATOM 1370 CG1 VAL A 92 7.554 1.002 4.731 1.00 1.00 C ATOM 1371 CG2 VAL A 92 9.074 2.435 6.013 1.00 0.96 C ATOM 0 H VAL A 92 10.288 3.533 3.639 1.00 0.61 H new ATOM 0 HA VAL A 92 10.490 0.888 4.533 1.00 0.62 H new ATOM 0 HB VAL A 92 8.307 2.869 4.004 1.00 0.63 H new ATOM 0 HG11 VAL A 92 6.717 1.445 5.270 1.00 1.00 H new ATOM 0 HG12 VAL A 92 7.224 0.693 3.739 1.00 1.00 H new ATOM 0 HG13 VAL A 92 7.920 0.134 5.279 1.00 1.00 H new ATOM 0 HG21 VAL A 92 8.197 2.803 6.546 1.00 0.96 H new ATOM 0 HG22 VAL A 92 9.480 1.570 6.537 1.00 0.96 H new ATOM 0 HG23 VAL A 92 9.828 3.221 5.971 1.00 0.96 H new ATOM 1381 N ASP A 93 10.047 -0.577 2.637 1.00 0.81 N ATOM 1382 CA ASP A 93 9.451 -1.603 1.815 1.00 0.74 C ATOM 1383 C ASP A 93 8.272 -2.198 2.590 1.00 0.72 C ATOM 1384 O ASP A 93 8.137 -1.989 3.794 1.00 0.79 O ATOM 1385 CB ASP A 93 10.512 -2.655 1.468 1.00 0.80 C ATOM 1386 CG ASP A 93 10.202 -3.374 0.162 1.00 1.16 C ATOM 1387 OD1 ASP A 93 11.169 -3.646 -0.583 1.00 1.89 O ATOM 1388 OD2 ASP A 93 9.000 -3.595 -0.096 1.00 2.08 O ATOM 0 H ASP A 93 10.855 -0.878 3.181 1.00 0.81 H new ATOM 0 HA ASP A 93 9.080 -1.200 0.873 1.00 0.74 H new ATOM 0 HB2 ASP A 93 11.487 -2.174 1.394 1.00 0.80 H new ATOM 0 HB3 ASP A 93 10.577 -3.384 2.276 1.00 0.80 H new ATOM 1393 N LEU A 94 7.417 -2.943 1.907 1.00 0.86 N ATOM 1394 CA LEU A 94 6.349 -3.736 2.492 1.00 1.11 C ATOM 1395 C LEU A 94 6.248 -5.079 1.772 1.00 1.13 C ATOM 1396 O LEU A 94 6.226 -5.137 0.545 1.00 1.07 O ATOM 1397 CB LEU A 94 5.005 -2.987 2.545 1.00 1.27 C ATOM 1398 CG LEU A 94 4.709 -1.975 1.426 1.00 1.35 C ATOM 1399 CD1 LEU A 94 3.191 -1.860 1.249 1.00 1.69 C ATOM 1400 CD2 LEU A 94 5.229 -0.572 1.782 1.00 2.21 C ATOM 0 H LEU A 94 7.450 -3.014 0.890 1.00 0.86 H new ATOM 0 HA LEU A 94 6.603 -3.926 3.535 1.00 1.11 H new ATOM 0 HB2 LEU A 94 4.207 -3.729 2.546 1.00 1.27 H new ATOM 0 HB3 LEU A 94 4.952 -2.460 3.497 1.00 1.27 H new ATOM 0 HG LEU A 94 5.202 -2.328 0.521 1.00 1.35 H new ATOM 0 HD11 LEU A 94 2.970 -1.144 0.457 1.00 1.69 H new ATOM 0 HD12 LEU A 94 2.781 -2.834 0.982 1.00 1.69 H new ATOM 0 HD13 LEU A 94 2.741 -1.520 2.182 1.00 1.69 H new ATOM 0 HD21 LEU A 94 5.002 0.117 0.969 1.00 2.21 H new ATOM 0 HD22 LEU A 94 4.746 -0.226 2.696 1.00 2.21 H new ATOM 0 HD23 LEU A 94 6.308 -0.612 1.934 1.00 2.21 H new ATOM 1412 N ALA A 95 6.197 -6.162 2.553 1.00 1.58 N ATOM 1413 CA ALA A 95 6.231 -7.527 2.051 1.00 1.77 C ATOM 1414 C ALA A 95 4.859 -7.926 1.504 1.00 1.45 C ATOM 1415 O ALA A 95 3.900 -7.165 1.597 1.00 1.41 O ATOM 1416 CB ALA A 95 6.673 -8.462 3.181 1.00 2.40 C ATOM 0 H ALA A 95 6.130 -6.107 3.569 1.00 1.58 H new ATOM 0 HA ALA A 95 6.945 -7.603 1.231 1.00 1.77 H new ATOM 0 HB1 ALA A 95 6.701 -9.488 2.814 1.00 2.40 H new ATOM 0 HB2 ALA A 95 7.666 -8.172 3.526 1.00 2.40 H new ATOM 0 HB3 ALA A 95 5.967 -8.392 4.008 1.00 2.40 H new ATOM 1422 N ALA A 96 4.760 -9.130 0.935 1.00 1.34 N ATOM 1423 CA ALA A 96 3.559 -9.556 0.235 1.00 1.19 C ATOM 1424 C ALA A 96 2.479 -9.921 1.256 1.00 0.96 C ATOM 1425 O ALA A 96 2.721 -10.727 2.151 1.00 1.30 O ATOM 1426 CB ALA A 96 3.887 -10.754 -0.661 1.00 1.40 C ATOM 0 H ALA A 96 5.505 -9.826 0.949 1.00 1.34 H new ATOM 0 HA ALA A 96 3.187 -8.746 -0.392 1.00 1.19 H new ATOM 0 HB1 ALA A 96 2.987 -11.073 -1.186 1.00 1.40 H new ATOM 0 HB2 ALA A 96 4.648 -10.468 -1.387 1.00 1.40 H new ATOM 0 HB3 ALA A 96 4.260 -11.575 -0.049 1.00 1.40 H new ATOM 1432 N ALA A 97 1.298 -9.317 1.118 1.00 0.76 N ATOM 1433 CA ALA A 97 0.155 -9.503 1.993 1.00 0.67 C ATOM 1434 C ALA A 97 -1.107 -9.326 1.165 1.00 0.73 C ATOM 1435 O ALA A 97 -1.356 -8.251 0.623 1.00 1.24 O ATOM 1436 CB ALA A 97 0.154 -8.491 3.134 1.00 1.04 C ATOM 0 H ALA A 97 1.111 -8.660 0.361 1.00 0.76 H new ATOM 0 HA ALA A 97 0.203 -10.500 2.432 1.00 0.67 H new ATOM 0 HB1 ALA A 97 -0.716 -8.660 3.769 1.00 1.04 H new ATOM 0 HB2 ALA A 97 1.063 -8.608 3.725 1.00 1.04 H new ATOM 0 HB3 ALA A 97 0.114 -7.481 2.725 1.00 1.04 H new ATOM 1442 N ASP A 98 -1.875 -10.405 1.063 1.00 0.71 N ATOM 1443 CA ASP A 98 -3.082 -10.478 0.257 1.00 0.86 C ATOM 1444 C ASP A 98 -4.280 -9.985 1.071 1.00 0.92 C ATOM 1445 O ASP A 98 -4.139 -9.647 2.247 1.00 1.28 O ATOM 1446 CB ASP A 98 -3.252 -11.907 -0.266 1.00 1.32 C ATOM 1447 CG ASP A 98 -4.174 -11.940 -1.477 1.00 3.17 C ATOM 1448 OD1 ASP A 98 -3.625 -12.014 -2.592 1.00 4.70 O ATOM 1449 OD2 ASP A 98 -5.405 -11.859 -1.260 1.00 3.94 O ATOM 0 H ASP A 98 -1.667 -11.275 1.553 1.00 0.71 H new ATOM 0 HA ASP A 98 -3.008 -9.824 -0.612 1.00 0.86 H new ATOM 0 HB2 ASP A 98 -2.279 -12.318 -0.534 1.00 1.32 H new ATOM 0 HB3 ASP A 98 -3.659 -12.540 0.522 1.00 1.32 H new ATOM 1454 N ILE A 99 -5.450 -9.921 0.440 1.00 0.92 N ATOM 1455 CA ILE A 99 -6.687 -9.423 1.010 1.00 1.15 C ATOM 1456 C ILE A 99 -7.755 -10.509 1.155 1.00 1.40 C ATOM 1457 O ILE A 99 -8.678 -10.288 1.930 1.00 3.13 O ATOM 1458 CB ILE A 99 -7.186 -8.183 0.239 1.00 1.22 C ATOM 1459 CG1 ILE A 99 -8.268 -8.389 -0.840 1.00 0.90 C ATOM 1460 CG2 ILE A 99 -6.038 -7.434 -0.437 1.00 2.15 C ATOM 1461 CD1 ILE A 99 -9.397 -7.391 -0.611 1.00 1.33 C ATOM 0 H ILE A 99 -5.560 -10.230 -0.526 1.00 0.92 H new ATOM 0 HA ILE A 99 -6.472 -9.104 2.030 1.00 1.15 H new ATOM 0 HB ILE A 99 -7.655 -7.621 1.047 1.00 1.22 H new ATOM 0 HG12 ILE A 99 -7.840 -8.251 -1.833 1.00 0.90 H new ATOM 0 HG13 ILE A 99 -8.652 -9.408 -0.797 1.00 0.90 H new ATOM 0 HG21 ILE A 99 -6.432 -6.568 -0.969 1.00 2.15 H new ATOM 0 HG22 ILE A 99 -5.325 -7.103 0.318 1.00 2.15 H new ATOM 0 HG23 ILE A 99 -5.537 -8.096 -1.143 1.00 2.15 H new ATOM 0 HD11 ILE A 99 -10.166 -7.531 -1.371 1.00 1.33 H new ATOM 0 HD12 ILE A 99 -9.829 -7.551 0.377 1.00 1.33 H new ATOM 0 HD13 ILE A 99 -9.004 -6.376 -0.675 1.00 1.33 H new ATOM 1473 N LYS A 100 -7.662 -11.627 0.408 1.00 1.41 N ATOM 1474 CA LYS A 100 -8.719 -12.632 0.204 1.00 1.72 C ATOM 1475 C LYS A 100 -10.047 -12.414 0.964 1.00 1.42 C ATOM 1476 O LYS A 100 -11.033 -12.061 0.316 1.00 2.06 O ATOM 1477 CB LYS A 100 -8.174 -14.066 0.328 1.00 2.90 C ATOM 1478 CG LYS A 100 -7.203 -14.443 -0.803 1.00 4.72 C ATOM 1479 CD LYS A 100 -5.764 -14.615 -0.305 1.00 5.79 C ATOM 1480 CE LYS A 100 -5.596 -15.843 0.591 1.00 6.50 C ATOM 1481 NZ LYS A 100 -4.187 -16.227 0.770 1.00 8.08 N ATOM 0 H LYS A 100 -6.805 -11.863 -0.093 1.00 1.41 H new ATOM 0 HA LYS A 100 -9.028 -12.475 -0.829 1.00 1.72 H new ATOM 0 HB2 LYS A 100 -7.665 -14.173 1.286 1.00 2.90 H new ATOM 0 HB3 LYS A 100 -9.009 -14.767 0.330 1.00 2.90 H new ATOM 0 HG2 LYS A 100 -7.536 -15.370 -1.270 1.00 4.72 H new ATOM 0 HG3 LYS A 100 -7.228 -13.671 -1.572 1.00 4.72 H new ATOM 0 HD2 LYS A 100 -5.095 -14.700 -1.161 1.00 5.79 H new ATOM 0 HD3 LYS A 100 -5.465 -13.724 0.246 1.00 5.79 H new ATOM 0 HE2 LYS A 100 -6.040 -15.640 1.566 1.00 6.50 H new ATOM 0 HE3 LYS A 100 -6.144 -16.680 0.159 1.00 6.50 H new ATOM 0 HZ1 LYS A 100 -4.112 -16.927 1.536 1.00 8.08 H new ATOM 0 HZ2 LYS A 100 -3.825 -16.640 -0.113 1.00 8.08 H new ATOM 0 HZ3 LYS A 100 -3.626 -15.386 1.014 1.00 8.08 H new ATOM 1495 N PRO A 101 -10.133 -12.634 2.292 1.00 1.75 N ATOM 1496 CA PRO A 101 -11.319 -12.296 3.070 1.00 2.33 C ATOM 1497 C PRO A 101 -11.514 -10.772 3.126 1.00 2.15 C ATOM 1498 O PRO A 101 -11.158 -10.127 4.111 1.00 3.33 O ATOM 1499 CB PRO A 101 -11.074 -12.901 4.457 1.00 3.74 C ATOM 1500 CG PRO A 101 -9.555 -12.825 4.594 1.00 3.90 C ATOM 1501 CD PRO A 101 -9.085 -13.133 3.173 1.00 2.68 C ATOM 0 HA PRO A 101 -12.234 -12.691 2.629 1.00 2.33 H new ATOM 0 HB2 PRO A 101 -11.580 -12.336 5.240 1.00 3.74 H new ATOM 0 HB3 PRO A 101 -11.435 -13.927 4.520 1.00 3.74 H new ATOM 0 HG2 PRO A 101 -9.225 -11.841 4.927 1.00 3.90 H new ATOM 0 HG3 PRO A 101 -9.175 -13.549 5.314 1.00 3.90 H new ATOM 0 HD2 PRO A 101 -8.132 -12.647 2.962 1.00 2.68 H new ATOM 0 HD3 PRO A 101 -8.934 -14.204 3.034 1.00 2.68 H new ATOM 1509 N ASP A 102 -12.092 -10.204 2.063 1.00 1.66 N ATOM 1510 CA ASP A 102 -12.379 -8.782 1.941 1.00 2.21 C ATOM 1511 C ASP A 102 -13.652 -8.406 2.717 1.00 2.22 C ATOM 1512 O ASP A 102 -13.975 -9.016 3.736 1.00 3.14 O ATOM 1513 CB ASP A 102 -12.469 -8.427 0.449 1.00 2.92 C ATOM 1514 CG ASP A 102 -13.812 -8.805 -0.148 1.00 4.07 C ATOM 1515 OD1 ASP A 102 -14.500 -7.868 -0.617 1.00 4.91 O ATOM 1516 OD2 ASP A 102 -14.176 -9.993 -0.044 1.00 5.04 O ATOM 0 H ASP A 102 -12.379 -10.740 1.244 1.00 1.66 H new ATOM 0 HA ASP A 102 -11.575 -8.197 2.387 1.00 2.21 H new ATOM 0 HB2 ASP A 102 -12.304 -7.357 0.321 1.00 2.92 H new ATOM 0 HB3 ASP A 102 -11.675 -8.939 -0.094 1.00 2.92 H new ATOM 1521 N GLY A 103 -14.396 -7.401 2.240 1.00 2.59 N ATOM 1522 CA GLY A 103 -15.666 -7.027 2.833 1.00 3.51 C ATOM 1523 C GLY A 103 -16.582 -6.286 1.863 1.00 2.88 C ATOM 1524 O GLY A 103 -17.234 -5.339 2.298 1.00 3.70 O ATOM 0 H GLY A 103 -14.128 -6.833 1.436 1.00 2.59 H new ATOM 0 HA2 GLY A 103 -16.173 -7.924 3.189 1.00 3.51 H new ATOM 0 HA3 GLY A 103 -15.483 -6.398 3.704 1.00 3.51 H new ATOM 1528 N LYS A 104 -16.649 -6.728 0.594 1.00 1.85 N ATOM 1529 CA LYS A 104 -17.618 -6.371 -0.451 1.00 1.54 C ATOM 1530 C LYS A 104 -16.882 -5.899 -1.708 1.00 1.62 C ATOM 1531 O LYS A 104 -16.649 -4.704 -1.874 1.00 2.50 O ATOM 1532 CB LYS A 104 -18.685 -5.355 0.002 1.00 1.90 C ATOM 1533 CG LYS A 104 -19.721 -5.027 -1.080 1.00 2.97 C ATOM 1534 CD LYS A 104 -20.783 -4.099 -0.472 1.00 3.87 C ATOM 1535 CE LYS A 104 -21.680 -3.447 -1.533 1.00 5.71 C ATOM 1536 NZ LYS A 104 -20.957 -2.432 -2.328 1.00 6.83 N ATOM 0 H LYS A 104 -15.967 -7.402 0.247 1.00 1.85 H new ATOM 0 HA LYS A 104 -18.178 -7.277 -0.681 1.00 1.54 H new ATOM 0 HB2 LYS A 104 -19.200 -5.748 0.878 1.00 1.90 H new ATOM 0 HB3 LYS A 104 -18.190 -4.434 0.310 1.00 1.90 H new ATOM 0 HG2 LYS A 104 -19.240 -4.546 -1.932 1.00 2.97 H new ATOM 0 HG3 LYS A 104 -20.184 -5.941 -1.451 1.00 2.97 H new ATOM 0 HD2 LYS A 104 -21.403 -4.668 0.221 1.00 3.87 H new ATOM 0 HD3 LYS A 104 -20.289 -3.320 0.108 1.00 3.87 H new ATOM 0 HE2 LYS A 104 -22.071 -4.217 -2.199 1.00 5.71 H new ATOM 0 HE3 LYS A 104 -22.537 -2.982 -1.046 1.00 5.71 H new ATOM 0 HZ1 LYS A 104 -21.630 -1.924 -2.937 1.00 6.83 H new ATOM 0 HZ2 LYS A 104 -20.491 -1.757 -1.688 1.00 6.83 H new ATOM 0 HZ3 LYS A 104 -20.241 -2.900 -2.919 1.00 6.83 H new ATOM 1550 N ARG A 105 -16.578 -6.830 -2.618 1.00 1.68 N ATOM 1551 CA ARG A 105 -15.870 -6.556 -3.865 1.00 1.87 C ATOM 1552 C ARG A 105 -14.601 -5.740 -3.610 1.00 1.55 C ATOM 1553 O ARG A 105 -14.368 -4.725 -4.263 1.00 2.16 O ATOM 1554 CB ARG A 105 -16.798 -5.918 -4.913 1.00 2.44 C ATOM 1555 CG ARG A 105 -17.783 -6.965 -5.454 1.00 3.61 C ATOM 1556 CD ARG A 105 -18.741 -6.365 -6.491 1.00 4.28 C ATOM 1557 NE ARG A 105 -19.431 -7.421 -7.256 1.00 5.72 N ATOM 1558 CZ ARG A 105 -18.985 -7.982 -8.396 1.00 6.98 C ATOM 1559 NH1 ARG A 105 -17.817 -7.612 -8.917 1.00 7.20 N ATOM 1560 NH2 ARG A 105 -19.714 -8.916 -9.017 1.00 8.37 N ATOM 0 H ARG A 105 -16.824 -7.813 -2.503 1.00 1.68 H new ATOM 0 HA ARG A 105 -15.546 -7.506 -4.289 1.00 1.87 H new ATOM 0 HB2 ARG A 105 -17.346 -5.088 -4.467 1.00 2.44 H new ATOM 0 HB3 ARG A 105 -16.207 -5.507 -5.731 1.00 2.44 H new ATOM 0 HG2 ARG A 105 -17.228 -7.787 -5.905 1.00 3.61 H new ATOM 0 HG3 ARG A 105 -18.358 -7.384 -4.628 1.00 3.61 H new ATOM 0 HD2 ARG A 105 -19.477 -5.737 -5.989 1.00 4.28 H new ATOM 0 HD3 ARG A 105 -18.185 -5.722 -7.174 1.00 4.28 H new ATOM 0 HE ARG A 105 -20.323 -7.755 -6.890 1.00 5.72 H new ATOM 0 HH11 ARG A 105 -17.254 -6.900 -8.452 1.00 7.20 H new ATOM 0 HH12 ARG A 105 -17.485 -8.041 -9.781 1.00 7.20 H new ATOM 0 HH21 ARG A 105 -20.611 -9.205 -8.627 1.00 8.37 H new ATOM 0 HH22 ARG A 105 -19.373 -9.339 -9.880 1.00 8.37 H new ATOM 1574 N HIS A 106 -13.777 -6.220 -2.675 1.00 1.57 N ATOM 1575 CA HIS A 106 -12.488 -5.645 -2.336 1.00 1.60 C ATOM 1576 C HIS A 106 -12.657 -4.320 -1.599 1.00 1.55 C ATOM 1577 O HIS A 106 -12.453 -3.242 -2.155 1.00 2.77 O ATOM 1578 CB HIS A 106 -11.542 -5.561 -3.542 1.00 2.10 C ATOM 1579 CG HIS A 106 -10.148 -5.120 -3.160 1.00 3.23 C ATOM 1580 ND1 HIS A 106 -9.829 -4.006 -2.411 1.00 4.05 N ATOM 1581 CD2 HIS A 106 -8.978 -5.763 -3.456 1.00 4.54 C ATOM 1582 CE1 HIS A 106 -8.498 -4.002 -2.232 1.00 5.20 C ATOM 1583 NE2 HIS A 106 -7.935 -5.036 -2.873 1.00 5.52 N ATOM 0 H HIS A 106 -14.003 -7.046 -2.120 1.00 1.57 H new ATOM 0 HA HIS A 106 -11.994 -6.326 -1.643 1.00 1.60 H new ATOM 0 HB2 HIS A 106 -11.490 -6.536 -4.027 1.00 2.10 H new ATOM 0 HB3 HIS A 106 -11.952 -4.863 -4.272 1.00 2.10 H new ATOM 0 HD1 HIS A 106 -10.486 -3.311 -2.057 1.00 4.05 H new ATOM 0 HD2 HIS A 106 -8.877 -6.669 -4.035 1.00 4.54 H new ATOM 0 HE1 HIS A 106 -7.957 -3.268 -1.653 1.00 5.20 H new ATOM 1591 N ALA A 107 -12.913 -4.422 -0.297 1.00 1.13 N ATOM 1592 CA ALA A 107 -12.888 -3.286 0.605 1.00 1.74 C ATOM 1593 C ALA A 107 -11.466 -2.721 0.669 1.00 1.54 C ATOM 1594 O ALA A 107 -11.199 -1.654 0.123 1.00 1.70 O ATOM 1595 CB ALA A 107 -13.417 -3.704 1.982 1.00 2.67 C ATOM 0 H ALA A 107 -13.145 -5.304 0.160 1.00 1.13 H new ATOM 0 HA ALA A 107 -13.541 -2.494 0.238 1.00 1.74 H new ATOM 0 HB1 ALA A 107 -13.396 -2.847 2.655 1.00 2.67 H new ATOM 0 HB2 ALA A 107 -14.441 -4.064 1.884 1.00 2.67 H new ATOM 0 HB3 ALA A 107 -12.790 -4.499 2.387 1.00 2.67 H new ATOM 1601 N VAL A 108 -10.544 -3.442 1.316 1.00 1.36 N ATOM 1602 CA VAL A 108 -9.176 -2.992 1.527 1.00 1.28 C ATOM 1603 C VAL A 108 -8.218 -4.170 1.582 1.00 1.24 C ATOM 1604 O VAL A 108 -8.627 -5.301 1.837 1.00 1.32 O ATOM 1605 CB VAL A 108 -9.041 -2.193 2.836 1.00 1.34 C ATOM 1606 CG1 VAL A 108 -9.550 -0.765 2.675 1.00 1.53 C ATOM 1607 CG2 VAL A 108 -9.720 -2.883 4.026 1.00 1.36 C ATOM 0 H VAL A 108 -10.735 -4.363 1.710 1.00 1.36 H new ATOM 0 HA VAL A 108 -8.924 -2.349 0.684 1.00 1.28 H new ATOM 0 HB VAL A 108 -7.975 -2.153 3.058 1.00 1.34 H new ATOM 0 HG11 VAL A 108 -9.439 -0.231 3.619 1.00 1.53 H new ATOM 0 HG12 VAL A 108 -8.973 -0.258 1.901 1.00 1.53 H new ATOM 0 HG13 VAL A 108 -10.602 -0.784 2.390 1.00 1.53 H new ATOM 0 HG21 VAL A 108 -9.592 -2.274 4.921 1.00 1.36 H new ATOM 0 HG22 VAL A 108 -10.783 -3.004 3.818 1.00 1.36 H new ATOM 0 HG23 VAL A 108 -9.268 -3.862 4.186 1.00 1.36 H new ATOM 1617 N ILE A 109 -6.934 -3.854 1.417 1.00 1.25 N ATOM 1618 CA ILE A 109 -5.814 -4.711 1.744 1.00 1.20 C ATOM 1619 C ILE A 109 -5.607 -4.657 3.262 1.00 0.97 C ATOM 1620 O ILE A 109 -6.114 -3.753 3.926 1.00 1.11 O ATOM 1621 CB ILE A 109 -4.568 -4.243 0.944 1.00 1.42 C ATOM 1622 CG1 ILE A 109 -4.741 -4.400 -0.570 1.00 1.87 C ATOM 1623 CG2 ILE A 109 -3.256 -4.922 1.370 1.00 1.84 C ATOM 1624 CD1 ILE A 109 -3.915 -3.398 -1.375 1.00 2.67 C ATOM 0 H ILE A 109 -6.642 -2.954 1.035 1.00 1.25 H new ATOM 0 HA ILE A 109 -5.997 -5.749 1.466 1.00 1.20 H new ATOM 0 HB ILE A 109 -4.490 -3.184 1.190 1.00 1.42 H new ATOM 0 HG12 ILE A 109 -4.456 -5.412 -0.859 1.00 1.87 H new ATOM 0 HG13 ILE A 109 -5.794 -4.280 -0.824 1.00 1.87 H new ATOM 0 HG21 ILE A 109 -2.435 -4.540 0.763 1.00 1.84 H new ATOM 0 HG22 ILE A 109 -3.060 -4.709 2.421 1.00 1.84 H new ATOM 0 HG23 ILE A 109 -3.341 -5.999 1.228 1.00 1.84 H new ATOM 0 HD11 ILE A 109 -4.081 -3.561 -2.440 1.00 2.67 H new ATOM 0 HD12 ILE A 109 -4.216 -2.384 -1.112 1.00 2.67 H new ATOM 0 HD13 ILE A 109 -2.857 -3.533 -1.148 1.00 2.67 H new ATOM 1636 N SER A 110 -4.870 -5.622 3.815 1.00 0.94 N ATOM 1637 CA SER A 110 -4.414 -5.601 5.196 1.00 0.88 C ATOM 1638 C SER A 110 -2.941 -6.013 5.189 1.00 0.88 C ATOM 1639 O SER A 110 -2.613 -7.174 5.427 1.00 1.09 O ATOM 1640 CB SER A 110 -5.302 -6.520 6.047 1.00 1.11 C ATOM 1641 OG SER A 110 -5.109 -6.269 7.426 1.00 1.43 O ATOM 0 H SER A 110 -4.571 -6.452 3.303 1.00 0.94 H new ATOM 0 HA SER A 110 -4.494 -4.611 5.645 1.00 0.88 H new ATOM 0 HB2 SER A 110 -6.349 -6.364 5.787 1.00 1.11 H new ATOM 0 HB3 SER A 110 -5.071 -7.562 5.827 1.00 1.11 H new ATOM 0 HG SER A 110 -5.685 -6.864 7.950 1.00 1.43 H new ATOM 1647 N GLY A 111 -2.061 -5.073 4.836 1.00 0.85 N ATOM 1648 CA GLY A 111 -0.627 -5.314 4.732 1.00 0.92 C ATOM 1649 C GLY A 111 0.129 -4.743 5.929 1.00 0.85 C ATOM 1650 O GLY A 111 -0.451 -4.094 6.801 1.00 0.89 O ATOM 0 H GLY A 111 -2.331 -4.115 4.613 1.00 0.85 H new ATOM 0 HA2 GLY A 111 -0.442 -6.386 4.662 1.00 0.92 H new ATOM 0 HA3 GLY A 111 -0.248 -4.865 3.814 1.00 0.92 H new ATOM 1654 N SER A 112 1.439 -4.986 5.994 1.00 1.06 N ATOM 1655 CA SER A 112 2.320 -4.431 7.009 1.00 0.99 C ATOM 1656 C SER A 112 3.716 -4.263 6.416 1.00 0.60 C ATOM 1657 O SER A 112 3.987 -4.790 5.334 1.00 0.68 O ATOM 1658 CB SER A 112 2.277 -5.277 8.289 1.00 1.38 C ATOM 1659 OG SER A 112 1.024 -5.112 8.935 1.00 2.48 O ATOM 0 H SER A 112 1.922 -5.587 5.326 1.00 1.06 H new ATOM 0 HA SER A 112 1.982 -3.440 7.313 1.00 0.99 H new ATOM 0 HB2 SER A 112 2.435 -6.328 8.046 1.00 1.38 H new ATOM 0 HB3 SER A 112 3.084 -4.980 8.959 1.00 1.38 H new ATOM 0 HG SER A 112 0.410 -4.632 8.341 1.00 2.48 H new ATOM 1665 N VAL A 113 4.519 -3.391 7.034 1.00 0.59 N ATOM 1666 CA VAL A 113 5.617 -2.710 6.364 1.00 0.62 C ATOM 1667 C VAL A 113 6.915 -2.810 7.163 1.00 0.69 C ATOM 1668 O VAL A 113 6.900 -2.862 8.392 1.00 0.77 O ATOM 1669 CB VAL A 113 5.236 -1.243 6.069 1.00 0.65 C ATOM 1670 CG1 VAL A 113 3.746 -1.050 5.741 1.00 0.80 C ATOM 1671 CG2 VAL A 113 5.604 -0.323 7.238 1.00 0.71 C ATOM 0 H VAL A 113 4.420 -3.141 8.018 1.00 0.59 H new ATOM 0 HA VAL A 113 5.799 -3.210 5.413 1.00 0.62 H new ATOM 0 HB VAL A 113 5.812 -0.975 5.184 1.00 0.65 H new ATOM 0 HG11 VAL A 113 3.550 0.004 5.545 1.00 0.80 H new ATOM 0 HG12 VAL A 113 3.488 -1.637 4.860 1.00 0.80 H new ATOM 0 HG13 VAL A 113 3.142 -1.380 6.586 1.00 0.80 H new ATOM 0 HG21 VAL A 113 5.322 0.702 6.997 1.00 0.71 H new ATOM 0 HG22 VAL A 113 5.074 -0.644 8.135 1.00 0.71 H new ATOM 0 HG23 VAL A 113 6.678 -0.372 7.415 1.00 0.71 H new ATOM 1681 N LEU A 114 8.046 -2.767 6.461 1.00 0.78 N ATOM 1682 CA LEU A 114 9.356 -2.880 7.071 1.00 0.94 C ATOM 1683 C LEU A 114 9.729 -1.545 7.707 1.00 0.87 C ATOM 1684 O LEU A 114 10.238 -0.624 7.071 1.00 1.11 O ATOM 1685 CB LEU A 114 10.380 -3.301 6.023 1.00 1.50 C ATOM 1686 CG LEU A 114 11.785 -3.574 6.583 1.00 0.97 C ATOM 1687 CD1 LEU A 114 11.829 -4.899 7.353 1.00 1.39 C ATOM 1688 CD2 LEU A 114 12.784 -3.633 5.424 1.00 2.34 C ATOM 0 H LEU A 114 8.072 -2.652 5.448 1.00 0.78 H new ATOM 0 HA LEU A 114 9.342 -3.643 7.850 1.00 0.94 H new ATOM 0 HB2 LEU A 114 10.021 -4.200 5.522 1.00 1.50 H new ATOM 0 HB3 LEU A 114 10.449 -2.520 5.266 1.00 1.50 H new ATOM 0 HG LEU A 114 12.044 -2.769 7.270 1.00 0.97 H new ATOM 0 HD11 LEU A 114 12.836 -5.064 7.737 1.00 1.39 H new ATOM 0 HD12 LEU A 114 11.126 -4.860 8.185 1.00 1.39 H new ATOM 0 HD13 LEU A 114 11.557 -5.717 6.686 1.00 1.39 H new ATOM 0 HD21 LEU A 114 13.783 -3.826 5.814 1.00 2.34 H new ATOM 0 HD22 LEU A 114 12.501 -4.433 4.740 1.00 2.34 H new ATOM 0 HD23 LEU A 114 12.780 -2.682 4.892 1.00 2.34 H new ATOM 1700 N TYR A 115 9.549 -1.502 9.015 1.00 1.62 N ATOM 1701 CA TYR A 115 9.996 -0.442 9.898 1.00 2.38 C ATOM 1702 C TYR A 115 11.494 -0.673 10.053 1.00 2.51 C ATOM 1703 O TYR A 115 11.959 -1.325 10.985 1.00 3.02 O ATOM 1704 CB TYR A 115 9.192 -0.504 11.214 1.00 3.21 C ATOM 1705 CG TYR A 115 9.837 -0.065 12.524 1.00 3.96 C ATOM 1706 CD1 TYR A 115 9.472 -0.713 13.720 1.00 5.59 C ATOM 1707 CD2 TYR A 115 10.813 0.949 12.563 1.00 3.63 C ATOM 1708 CE1 TYR A 115 10.087 -0.368 14.935 1.00 6.66 C ATOM 1709 CE2 TYR A 115 11.456 1.267 13.772 1.00 4.80 C ATOM 1710 CZ TYR A 115 11.087 0.618 14.958 1.00 6.23 C ATOM 1711 OH TYR A 115 11.689 0.964 16.130 1.00 7.50 O ATOM 0 H TYR A 115 9.061 -2.245 9.515 1.00 1.62 H new ATOM 0 HA TYR A 115 9.828 0.567 9.520 1.00 2.38 H new ATOM 0 HB2 TYR A 115 8.296 0.101 11.075 1.00 3.21 H new ATOM 0 HB3 TYR A 115 8.863 -1.535 11.344 1.00 3.21 H new ATOM 0 HD1 TYR A 115 8.713 -1.481 13.703 1.00 5.59 H new ATOM 0 HD2 TYR A 115 11.069 1.485 11.661 1.00 3.63 H new ATOM 0 HE1 TYR A 115 9.791 -0.860 15.850 1.00 6.66 H new ATOM 0 HE2 TYR A 115 12.236 2.013 13.787 1.00 4.80 H new ATOM 0 HH TYR A 115 12.357 1.661 15.961 1.00 7.50 H new ATOM 1721 N ASN A 116 12.243 -0.136 9.090 1.00 2.31 N ATOM 1722 CA ASN A 116 13.697 -0.133 9.061 1.00 2.72 C ATOM 1723 C ASN A 116 14.203 -1.556 8.846 1.00 1.78 C ATOM 1724 O ASN A 116 14.602 -1.919 7.740 1.00 1.60 O ATOM 1725 CB ASN A 116 14.306 0.527 10.322 1.00 4.01 C ATOM 1726 CG ASN A 116 13.778 1.924 10.660 1.00 5.82 C ATOM 1727 OD1 ASN A 116 13.813 2.343 11.811 1.00 7.39 O ATOM 1728 ND2 ASN A 116 13.260 2.674 9.695 1.00 6.22 N ATOM 0 H ASN A 116 11.832 0.326 8.279 1.00 2.31 H new ATOM 0 HA ASN A 116 14.029 0.481 8.224 1.00 2.72 H new ATOM 0 HB2 ASN A 116 14.124 -0.126 11.175 1.00 4.01 H new ATOM 0 HB3 ASN A 116 15.386 0.589 10.192 1.00 4.01 H new ATOM 0 HD21 ASN A 116 12.891 3.600 9.911 1.00 6.22 H new ATOM 0 HD22 ASN A 116 13.231 2.324 8.737 1.00 6.22 H new ATOM 1735 N GLN A 117 14.212 -2.343 9.920 1.00 1.72 N ATOM 1736 CA GLN A 117 14.668 -3.720 9.990 1.00 1.38 C ATOM 1737 C GLN A 117 13.812 -4.459 11.037 1.00 1.67 C ATOM 1738 O GLN A 117 14.295 -5.341 11.743 1.00 1.82 O ATOM 1739 CB GLN A 117 16.172 -3.755 10.324 1.00 1.62 C ATOM 1740 CG GLN A 117 17.090 -3.172 9.230 1.00 1.86 C ATOM 1741 CD GLN A 117 17.385 -1.672 9.363 1.00 1.74 C ATOM 1742 OE1 GLN A 117 17.978 -1.241 10.345 1.00 2.36 O ATOM 1743 NE2 GLN A 117 17.009 -0.862 8.373 1.00 2.01 N ATOM 0 H GLN A 117 13.877 -2.008 10.823 1.00 1.72 H new ATOM 0 HA GLN A 117 14.548 -4.224 9.031 1.00 1.38 H new ATOM 0 HB2 GLN A 117 16.337 -3.204 11.250 1.00 1.62 H new ATOM 0 HB3 GLN A 117 16.464 -4.788 10.512 1.00 1.62 H new ATOM 0 HG2 GLN A 117 18.035 -3.715 9.242 1.00 1.86 H new ATOM 0 HG3 GLN A 117 16.631 -3.352 8.258 1.00 1.86 H new ATOM 0 HE21 GLN A 117 16.516 -1.240 7.564 1.00 2.01 H new ATOM 0 HE22 GLN A 117 17.214 0.136 8.425 1.00 2.01 H new ATOM 1752 N ALA A 118 12.538 -4.071 11.149 1.00 2.05 N ATOM 1753 CA ALA A 118 11.537 -4.560 12.088 1.00 2.37 C ATOM 1754 C ALA A 118 10.172 -4.309 11.442 1.00 2.06 C ATOM 1755 O ALA A 118 10.125 -3.745 10.350 1.00 2.37 O ATOM 1756 CB ALA A 118 11.658 -3.804 13.415 1.00 2.81 C ATOM 0 H ALA A 118 12.155 -3.351 10.536 1.00 2.05 H new ATOM 0 HA ALA A 118 11.671 -5.620 12.302 1.00 2.37 H new ATOM 0 HB1 ALA A 118 10.907 -4.173 14.114 1.00 2.81 H new ATOM 0 HB2 ALA A 118 12.652 -3.961 13.834 1.00 2.81 H new ATOM 0 HB3 ALA A 118 11.501 -2.739 13.243 1.00 2.81 H new ATOM 1762 N GLU A 119 9.069 -4.722 12.076 1.00 1.84 N ATOM 1763 CA GLU A 119 7.727 -4.510 11.545 1.00 1.65 C ATOM 1764 C GLU A 119 6.806 -3.912 12.614 1.00 1.63 C ATOM 1765 O GLU A 119 6.269 -4.630 13.455 1.00 2.03 O ATOM 1766 CB GLU A 119 7.186 -5.825 10.966 1.00 2.03 C ATOM 1767 CG GLU A 119 5.860 -5.610 10.219 1.00 2.15 C ATOM 1768 CD GLU A 119 5.433 -6.842 9.435 1.00 2.90 C ATOM 1769 OE1 GLU A 119 5.646 -7.955 9.958 1.00 3.22 O ATOM 1770 OE2 GLU A 119 4.890 -6.638 8.327 1.00 3.90 O ATOM 0 H GLU A 119 9.086 -5.212 12.971 1.00 1.84 H new ATOM 0 HA GLU A 119 7.767 -3.784 10.733 1.00 1.65 H new ATOM 0 HB2 GLU A 119 7.922 -6.254 10.286 1.00 2.03 H new ATOM 0 HB3 GLU A 119 7.038 -6.545 11.771 1.00 2.03 H new ATOM 0 HG2 GLU A 119 5.080 -5.349 10.935 1.00 2.15 H new ATOM 0 HG3 GLU A 119 5.962 -4.766 9.537 1.00 2.15 H new ATOM 1777 N LYS A 120 6.593 -2.593 12.561 1.00 1.33 N ATOM 1778 CA LYS A 120 5.445 -1.925 13.107 1.00 1.37 C ATOM 1779 C LYS A 120 5.134 -0.714 12.229 1.00 1.00 C ATOM 1780 O LYS A 120 5.146 0.443 12.655 1.00 1.09 O ATOM 1781 CB LYS A 120 5.654 -1.568 14.569 1.00 1.72 C ATOM 1782 CG LYS A 120 4.391 -0.954 15.177 1.00 3.32 C ATOM 1783 CD LYS A 120 3.081 -1.657 14.803 1.00 3.92 C ATOM 1784 CE LYS A 120 2.342 -1.151 13.542 1.00 5.04 C ATOM 1785 NZ LYS A 120 0.869 -1.206 13.665 1.00 6.18 N ATOM 0 H LYS A 120 7.250 -1.952 12.116 1.00 1.33 H new ATOM 0 HA LYS A 120 4.580 -2.588 13.098 1.00 1.37 H new ATOM 0 HB2 LYS A 120 5.932 -2.462 15.128 1.00 1.72 H new ATOM 0 HB3 LYS A 120 6.482 -0.865 14.659 1.00 1.72 H new ATOM 0 HG2 LYS A 120 4.490 -0.958 16.262 1.00 3.32 H new ATOM 0 HG3 LYS A 120 4.327 0.089 14.866 1.00 3.32 H new ATOM 0 HD2 LYS A 120 3.294 -2.717 14.667 1.00 3.92 H new ATOM 0 HD3 LYS A 120 2.400 -1.574 15.650 1.00 3.92 H new ATOM 0 HE2 LYS A 120 2.645 -0.124 13.340 1.00 5.04 H new ATOM 0 HE3 LYS A 120 2.651 -1.749 12.684 1.00 5.04 H new ATOM 0 HZ1 LYS A 120 0.441 -1.187 12.718 1.00 6.18 H new ATOM 0 HZ2 LYS A 120 0.594 -2.083 14.152 1.00 6.18 H new ATOM 0 HZ3 LYS A 120 0.536 -0.387 14.212 1.00 6.18 H new ATOM 1799 N GLY A 121 4.743 -1.027 11.001 1.00 0.97 N ATOM 1800 CA GLY A 121 3.743 -0.246 10.313 1.00 0.97 C ATOM 1801 C GLY A 121 2.774 -1.234 9.686 1.00 0.90 C ATOM 1802 O GLY A 121 3.187 -2.320 9.283 1.00 1.00 O ATOM 0 H GLY A 121 5.107 -1.817 10.468 1.00 0.97 H new ATOM 0 HA2 GLY A 121 3.225 0.417 11.006 1.00 0.97 H new ATOM 0 HA3 GLY A 121 4.201 0.384 9.551 1.00 0.97 H new ATOM 1806 N SER A 122 1.491 -0.886 9.691 1.00 0.79 N ATOM 1807 CA SER A 122 0.383 -1.705 9.242 1.00 0.69 C ATOM 1808 C SER A 122 -0.472 -0.830 8.340 1.00 0.76 C ATOM 1809 O SER A 122 -0.812 0.279 8.755 1.00 1.15 O ATOM 1810 CB SER A 122 -0.387 -2.195 10.466 1.00 0.62 C ATOM 1811 OG SER A 122 -0.573 -1.131 11.387 1.00 0.74 O ATOM 0 H SER A 122 1.185 0.027 10.028 1.00 0.79 H new ATOM 0 HA SER A 122 0.707 -2.585 8.686 1.00 0.69 H new ATOM 0 HB2 SER A 122 -1.354 -2.594 10.160 1.00 0.62 H new ATOM 0 HB3 SER A 122 0.157 -3.009 10.945 1.00 0.62 H new ATOM 0 HG SER A 122 -0.872 -0.331 10.906 1.00 0.74 H new ATOM 1817 N TYR A 123 -0.780 -1.295 7.125 1.00 0.65 N ATOM 1818 CA TYR A 123 -1.439 -0.482 6.117 1.00 0.67 C ATOM 1819 C TYR A 123 -2.626 -1.200 5.495 1.00 0.72 C ATOM 1820 O TYR A 123 -2.638 -2.427 5.398 1.00 0.84 O ATOM 1821 CB TYR A 123 -0.418 0.018 5.078 1.00 0.85 C ATOM 1822 CG TYR A 123 -0.576 -0.442 3.638 1.00 0.77 C ATOM 1823 CD1 TYR A 123 -0.319 -1.779 3.282 1.00 2.10 C ATOM 1824 CD2 TYR A 123 -0.876 0.500 2.634 1.00 2.15 C ATOM 1825 CE1 TYR A 123 -0.412 -2.182 1.936 1.00 2.54 C ATOM 1826 CE2 TYR A 123 -0.905 0.109 1.286 1.00 2.23 C ATOM 1827 CZ TYR A 123 -0.697 -1.233 0.939 1.00 1.74 C ATOM 1828 OH TYR A 123 -0.775 -1.596 -0.372 1.00 2.32 O ATOM 0 H TYR A 123 -0.576 -2.247 6.820 1.00 0.65 H new ATOM 0 HA TYR A 123 -1.857 0.399 6.603 1.00 0.67 H new ATOM 0 HB2 TYR A 123 -0.443 1.108 5.084 1.00 0.85 H new ATOM 0 HB3 TYR A 123 0.574 -0.280 5.416 1.00 0.85 H new ATOM 0 HD1 TYR A 123 -0.050 -2.497 4.042 1.00 2.10 H new ATOM 0 HD2 TYR A 123 -1.084 1.525 2.902 1.00 2.15 H new ATOM 0 HE1 TYR A 123 -0.265 -3.218 1.670 1.00 2.54 H new ATOM 0 HE2 TYR A 123 -1.088 0.843 0.515 1.00 2.23 H new ATOM 0 HH TYR A 123 -0.497 -2.531 -0.470 1.00 2.32 H new ATOM 1838 N SER A 124 -3.620 -0.427 5.064 1.00 0.73 N ATOM 1839 CA SER A 124 -4.832 -0.952 4.477 1.00 0.81 C ATOM 1840 C SER A 124 -5.267 0.001 3.372 1.00 0.83 C ATOM 1841 O SER A 124 -5.520 1.178 3.645 1.00 0.95 O ATOM 1842 CB SER A 124 -5.907 -1.078 5.560 1.00 0.90 C ATOM 1843 OG SER A 124 -6.034 0.153 6.250 1.00 1.58 O ATOM 0 H SER A 124 -3.598 0.591 5.117 1.00 0.73 H new ATOM 0 HA SER A 124 -4.669 -1.943 4.053 1.00 0.81 H new ATOM 0 HB2 SER A 124 -6.860 -1.354 5.110 1.00 0.90 H new ATOM 0 HB3 SER A 124 -5.643 -1.872 6.258 1.00 0.90 H new ATOM 0 HG SER A 124 -5.781 0.889 5.655 1.00 1.58 H new ATOM 1849 N LEU A 125 -5.308 -0.513 2.142 1.00 0.96 N ATOM 1850 CA LEU A 125 -5.514 0.265 0.928 1.00 1.08 C ATOM 1851 C LEU A 125 -6.592 -0.382 0.065 1.00 1.17 C ATOM 1852 O LEU A 125 -6.602 -1.598 -0.094 1.00 1.28 O ATOM 1853 CB LEU A 125 -4.150 0.405 0.244 1.00 1.26 C ATOM 1854 CG LEU A 125 -4.089 1.085 -1.131 1.00 1.44 C ATOM 1855 CD1 LEU A 125 -4.307 0.137 -2.310 1.00 1.54 C ATOM 1856 CD2 LEU A 125 -4.915 2.357 -1.258 1.00 1.48 C ATOM 0 H LEU A 125 -5.195 -1.511 1.962 1.00 0.96 H new ATOM 0 HA LEU A 125 -5.889 1.267 1.135 1.00 1.08 H new ATOM 0 HB2 LEU A 125 -3.496 0.959 0.918 1.00 1.26 H new ATOM 0 HB3 LEU A 125 -3.727 -0.594 0.139 1.00 1.26 H new ATOM 0 HG LEU A 125 -3.050 1.411 -1.190 1.00 1.44 H new ATOM 0 HD11 LEU A 125 -4.248 0.697 -3.243 1.00 1.54 H new ATOM 0 HD12 LEU A 125 -3.539 -0.636 -2.302 1.00 1.54 H new ATOM 0 HD13 LEU A 125 -5.290 -0.327 -2.227 1.00 1.54 H new ATOM 0 HD21 LEU A 125 -4.807 2.762 -2.264 1.00 1.48 H new ATOM 0 HD22 LEU A 125 -5.964 2.130 -1.069 1.00 1.48 H new ATOM 0 HD23 LEU A 125 -4.566 3.091 -0.532 1.00 1.48 H new ATOM 1868 N GLY A 126 -7.516 0.430 -0.448 1.00 1.18 N ATOM 1869 CA GLY A 126 -8.712 0.013 -1.179 1.00 1.24 C ATOM 1870 C GLY A 126 -8.714 0.635 -2.567 1.00 1.43 C ATOM 1871 O GLY A 126 -8.138 1.705 -2.759 1.00 1.80 O ATOM 0 H GLY A 126 -7.448 1.444 -0.361 1.00 1.18 H new ATOM 0 HA2 GLY A 126 -8.740 -1.074 -1.258 1.00 1.24 H new ATOM 0 HA3 GLY A 126 -9.606 0.316 -0.634 1.00 1.24 H new ATOM 1875 N ILE A 127 -9.329 -0.049 -3.539 1.00 1.35 N ATOM 1876 CA ILE A 127 -9.225 0.299 -4.949 1.00 1.29 C ATOM 1877 C ILE A 127 -10.578 0.736 -5.498 1.00 1.28 C ATOM 1878 O ILE A 127 -11.624 0.236 -5.085 1.00 1.43 O ATOM 1879 CB ILE A 127 -8.553 -0.830 -5.774 1.00 1.39 C ATOM 1880 CG1 ILE A 127 -9.476 -1.696 -6.651 1.00 1.71 C ATOM 1881 CG2 ILE A 127 -7.644 -1.709 -4.904 1.00 2.50 C ATOM 1882 CD1 ILE A 127 -10.396 -2.635 -5.873 1.00 3.30 C ATOM 0 H ILE A 127 -9.916 -0.864 -3.361 1.00 1.35 H new ATOM 0 HA ILE A 127 -8.561 1.158 -5.045 1.00 1.29 H new ATOM 0 HB ILE A 127 -7.953 -0.275 -6.495 1.00 1.39 H new ATOM 0 HG12 ILE A 127 -10.088 -1.040 -7.270 1.00 1.71 H new ATOM 0 HG13 ILE A 127 -8.861 -2.289 -7.327 1.00 1.71 H new ATOM 0 HG21 ILE A 127 -7.193 -2.487 -5.520 1.00 2.50 H new ATOM 0 HG22 ILE A 127 -6.859 -1.095 -4.462 1.00 2.50 H new ATOM 0 HG23 ILE A 127 -8.234 -2.170 -4.111 1.00 2.50 H new ATOM 0 HD11 ILE A 127 -11.009 -3.205 -6.571 1.00 3.30 H new ATOM 0 HD12 ILE A 127 -9.795 -3.320 -5.275 1.00 3.30 H new ATOM 0 HD13 ILE A 127 -11.041 -2.051 -5.217 1.00 3.30 H new ATOM 1894 N PHE A 128 -10.564 1.644 -6.473 1.00 1.23 N ATOM 1895 CA PHE A 128 -11.753 1.948 -7.241 1.00 1.34 C ATOM 1896 C PHE A 128 -12.030 0.749 -8.152 1.00 1.25 C ATOM 1897 O PHE A 128 -11.464 0.642 -9.247 1.00 1.85 O ATOM 1898 CB PHE A 128 -11.544 3.262 -8.003 1.00 2.68 C ATOM 1899 CG PHE A 128 -12.801 3.989 -8.452 1.00 3.65 C ATOM 1900 CD1 PHE A 128 -12.870 5.386 -8.292 1.00 4.50 C ATOM 1901 CD2 PHE A 128 -13.896 3.301 -9.012 1.00 4.51 C ATOM 1902 CE1 PHE A 128 -14.004 6.094 -8.727 1.00 5.62 C ATOM 1903 CE2 PHE A 128 -15.025 4.010 -9.457 1.00 5.60 C ATOM 1904 CZ PHE A 128 -15.077 5.407 -9.321 1.00 5.97 C ATOM 0 H PHE A 128 -9.738 2.178 -6.744 1.00 1.23 H new ATOM 0 HA PHE A 128 -12.628 2.101 -6.609 1.00 1.34 H new ATOM 0 HB2 PHE A 128 -10.967 3.936 -7.370 1.00 2.68 H new ATOM 0 HB3 PHE A 128 -10.937 3.054 -8.884 1.00 2.68 H new ATOM 0 HD1 PHE A 128 -12.048 5.916 -7.833 1.00 4.50 H new ATOM 0 HD2 PHE A 128 -13.868 2.225 -9.100 1.00 4.51 H new ATOM 0 HE1 PHE A 128 -14.051 7.166 -8.605 1.00 5.62 H new ATOM 0 HE2 PHE A 128 -15.853 3.480 -9.904 1.00 5.60 H new ATOM 0 HZ PHE A 128 -15.940 5.953 -9.672 1.00 5.97 H new ATOM 1914 N GLY A 129 -12.910 -0.152 -7.704 1.00 1.85 N ATOM 1915 CA GLY A 129 -13.324 -1.343 -8.433 1.00 3.18 C ATOM 1916 C GLY A 129 -14.229 -1.024 -9.627 1.00 2.23 C ATOM 1917 O GLY A 129 -15.310 -1.598 -9.763 1.00 3.21 O ATOM 0 H GLY A 129 -13.365 -0.065 -6.795 1.00 1.85 H new ATOM 0 HA2 GLY A 129 -12.439 -1.874 -8.785 1.00 3.18 H new ATOM 0 HA3 GLY A 129 -13.849 -2.015 -7.754 1.00 3.18 H new ATOM 1921 N GLY A 130 -13.769 -0.143 -10.517 1.00 1.29 N ATOM 1922 CA GLY A 130 -14.228 -0.043 -11.891 1.00 1.95 C ATOM 1923 C GLY A 130 -13.299 -0.915 -12.728 1.00 1.79 C ATOM 1924 O GLY A 130 -13.754 -1.805 -13.441 1.00 2.61 O ATOM 0 H GLY A 130 -13.045 0.538 -10.288 1.00 1.29 H new ATOM 0 HA2 GLY A 130 -15.260 -0.381 -11.980 1.00 1.95 H new ATOM 0 HA3 GLY A 130 -14.201 0.991 -12.234 1.00 1.95 H new ATOM 1928 N LYS A 131 -11.985 -0.699 -12.583 1.00 1.30 N ATOM 1929 CA LYS A 131 -10.966 -1.618 -13.082 1.00 1.46 C ATOM 1930 C LYS A 131 -9.606 -1.421 -12.392 1.00 1.45 C ATOM 1931 O LYS A 131 -8.582 -1.713 -13.002 1.00 2.07 O ATOM 1932 CB LYS A 131 -10.864 -1.517 -14.617 1.00 1.91 C ATOM 1933 CG LYS A 131 -10.504 -0.104 -15.099 1.00 2.01 C ATOM 1934 CD LYS A 131 -10.179 -0.015 -16.599 1.00 2.52 C ATOM 1935 CE LYS A 131 -11.370 -0.297 -17.530 1.00 3.79 C ATOM 1936 NZ LYS A 131 -11.610 -1.740 -17.746 1.00 5.66 N ATOM 0 H LYS A 131 -11.603 0.122 -12.114 1.00 1.30 H new ATOM 0 HA LYS A 131 -11.277 -2.632 -12.829 1.00 1.46 H new ATOM 0 HB2 LYS A 131 -10.111 -2.220 -14.973 1.00 1.91 H new ATOM 0 HB3 LYS A 131 -11.814 -1.816 -15.060 1.00 1.91 H new ATOM 0 HG2 LYS A 131 -11.335 0.566 -14.878 1.00 2.01 H new ATOM 0 HG3 LYS A 131 -9.646 0.254 -14.531 1.00 2.01 H new ATOM 0 HD2 LYS A 131 -9.794 0.981 -16.815 1.00 2.52 H new ATOM 0 HD3 LYS A 131 -9.381 -0.722 -16.827 1.00 2.52 H new ATOM 0 HE2 LYS A 131 -12.268 0.155 -17.108 1.00 3.79 H new ATOM 0 HE3 LYS A 131 -11.193 0.184 -18.492 1.00 3.79 H new ATOM 0 HZ1 LYS A 131 -11.877 -1.903 -18.738 1.00 5.66 H new ATOM 0 HZ2 LYS A 131 -10.743 -2.272 -17.529 1.00 5.66 H new ATOM 0 HZ3 LYS A 131 -12.379 -2.061 -17.124 1.00 5.66 H new ATOM 1950 N ALA A 132 -9.586 -0.933 -11.142 1.00 1.01 N ATOM 1951 CA ALA A 132 -8.377 -0.499 -10.443 1.00 0.91 C ATOM 1952 C ALA A 132 -7.794 0.727 -11.153 1.00 1.11 C ATOM 1953 O ALA A 132 -7.048 0.618 -12.125 1.00 1.67 O ATOM 1954 CB ALA A 132 -7.340 -1.607 -10.268 1.00 1.23 C ATOM 0 H ALA A 132 -10.431 -0.829 -10.581 1.00 1.01 H new ATOM 0 HA ALA A 132 -8.663 -0.226 -9.427 1.00 0.91 H new ATOM 0 HB1 ALA A 132 -6.471 -1.212 -9.742 1.00 1.23 H new ATOM 0 HB2 ALA A 132 -7.774 -2.423 -9.691 1.00 1.23 H new ATOM 0 HB3 ALA A 132 -7.034 -1.977 -11.247 1.00 1.23 H new ATOM 1960 N GLN A 133 -8.199 1.907 -10.692 1.00 0.96 N ATOM 1961 CA GLN A 133 -8.125 3.140 -11.463 1.00 1.19 C ATOM 1962 C GLN A 133 -7.365 4.130 -10.602 1.00 1.25 C ATOM 1963 O GLN A 133 -6.250 4.540 -10.936 1.00 1.58 O ATOM 1964 CB GLN A 133 -9.543 3.622 -11.805 1.00 1.30 C ATOM 1965 CG GLN A 133 -10.242 2.604 -12.718 1.00 1.76 C ATOM 1966 CD GLN A 133 -11.716 2.917 -12.940 1.00 1.85 C ATOM 1967 OE1 GLN A 133 -12.174 2.997 -14.074 1.00 2.54 O ATOM 1968 NE2 GLN A 133 -12.483 3.041 -11.862 1.00 2.63 N ATOM 0 H GLN A 133 -8.593 2.033 -9.760 1.00 0.96 H new ATOM 0 HA GLN A 133 -7.611 3.010 -12.415 1.00 1.19 H new ATOM 0 HB2 GLN A 133 -10.120 3.757 -10.890 1.00 1.30 H new ATOM 0 HB3 GLN A 133 -9.496 4.593 -12.299 1.00 1.30 H new ATOM 0 HG2 GLN A 133 -9.733 2.578 -13.681 1.00 1.76 H new ATOM 0 HG3 GLN A 133 -10.149 1.609 -12.282 1.00 1.76 H new ATOM 0 HE21 GLN A 133 -12.071 2.969 -10.932 1.00 2.63 H new ATOM 0 HE22 GLN A 133 -13.484 3.208 -11.965 1.00 2.63 H new ATOM 1977 N GLU A 134 -7.976 4.415 -9.451 1.00 1.17 N ATOM 1978 CA GLU A 134 -7.414 5.176 -8.361 1.00 1.31 C ATOM 1979 C GLU A 134 -7.670 4.349 -7.108 1.00 1.16 C ATOM 1980 O GLU A 134 -8.496 3.430 -7.140 1.00 1.45 O ATOM 1981 CB GLU A 134 -8.021 6.588 -8.312 1.00 1.93 C ATOM 1982 CG GLU A 134 -8.153 7.157 -9.735 1.00 2.23 C ATOM 1983 CD GLU A 134 -8.101 8.672 -9.819 1.00 3.24 C ATOM 1984 OE1 GLU A 134 -8.538 9.326 -8.852 1.00 3.05 O ATOM 1985 OE2 GLU A 134 -7.584 9.146 -10.859 1.00 4.61 O ATOM 0 H GLU A 134 -8.926 4.099 -9.255 1.00 1.17 H new ATOM 0 HA GLU A 134 -6.343 5.347 -8.473 1.00 1.31 H new ATOM 0 HB2 GLU A 134 -9.000 6.555 -7.833 1.00 1.93 H new ATOM 0 HB3 GLU A 134 -7.392 7.242 -7.708 1.00 1.93 H new ATOM 0 HG2 GLU A 134 -7.355 6.745 -10.352 1.00 2.23 H new ATOM 0 HG3 GLU A 134 -9.095 6.815 -10.163 1.00 2.23 H new ATOM 1992 N VAL A 135 -6.923 4.618 -6.043 1.00 1.18 N ATOM 1993 CA VAL A 135 -6.934 3.833 -4.820 1.00 1.27 C ATOM 1994 C VAL A 135 -6.787 4.794 -3.644 1.00 1.34 C ATOM 1995 O VAL A 135 -6.187 5.859 -3.805 1.00 1.79 O ATOM 1996 CB VAL A 135 -5.804 2.784 -4.841 1.00 1.20 C ATOM 1997 CG1 VAL A 135 -5.805 1.919 -6.108 1.00 1.23 C ATOM 1998 CG2 VAL A 135 -4.441 3.469 -4.795 1.00 1.29 C ATOM 0 H VAL A 135 -6.278 5.408 -6.008 1.00 1.18 H new ATOM 0 HA VAL A 135 -7.871 3.285 -4.725 1.00 1.27 H new ATOM 0 HB VAL A 135 -5.982 2.154 -3.969 1.00 1.20 H new ATOM 0 HG11 VAL A 135 -4.986 1.202 -6.060 1.00 1.23 H new ATOM 0 HG12 VAL A 135 -6.752 1.384 -6.182 1.00 1.23 H new ATOM 0 HG13 VAL A 135 -5.678 2.556 -6.983 1.00 1.23 H new ATOM 0 HG21 VAL A 135 -3.654 2.715 -4.810 1.00 1.29 H new ATOM 0 HG22 VAL A 135 -4.333 4.124 -5.660 1.00 1.29 H new ATOM 0 HG23 VAL A 135 -4.361 4.058 -3.882 1.00 1.29 H new ATOM 2008 N ALA A 136 -7.326 4.415 -2.483 1.00 1.05 N ATOM 2009 CA ALA A 136 -7.379 5.244 -1.289 1.00 1.14 C ATOM 2010 C ALA A 136 -7.230 4.341 -0.059 1.00 1.12 C ATOM 2011 O ALA A 136 -7.804 3.251 -0.024 1.00 1.29 O ATOM 2012 CB ALA A 136 -8.696 6.022 -1.293 1.00 1.54 C ATOM 0 H ALA A 136 -7.748 3.496 -2.350 1.00 1.05 H new ATOM 0 HA ALA A 136 -6.567 5.970 -1.265 1.00 1.14 H new ATOM 0 HB1 ALA A 136 -8.751 6.649 -0.403 1.00 1.54 H new ATOM 0 HB2 ALA A 136 -8.745 6.650 -2.183 1.00 1.54 H new ATOM 0 HB3 ALA A 136 -9.532 5.322 -1.296 1.00 1.54 H new ATOM 2018 N GLY A 137 -6.375 4.728 0.894 1.00 0.97 N ATOM 2019 CA GLY A 137 -6.015 3.903 2.037 1.00 1.01 C ATOM 2020 C GLY A 137 -5.464 4.721 3.195 1.00 0.88 C ATOM 2021 O GLY A 137 -5.247 5.928 3.073 1.00 0.83 O ATOM 0 H GLY A 137 -5.911 5.636 0.887 1.00 0.97 H new ATOM 0 HA2 GLY A 137 -6.892 3.350 2.372 1.00 1.01 H new ATOM 0 HA3 GLY A 137 -5.272 3.167 1.730 1.00 1.01 H new ATOM 2025 N SER A 138 -5.159 4.017 4.286 1.00 0.90 N ATOM 2026 CA SER A 138 -4.429 4.558 5.419 1.00 0.87 C ATOM 2027 C SER A 138 -3.302 3.593 5.776 1.00 0.75 C ATOM 2028 O SER A 138 -3.489 2.377 5.693 1.00 0.79 O ATOM 2029 CB SER A 138 -5.381 4.723 6.607 1.00 0.97 C ATOM 2030 OG SER A 138 -6.465 5.560 6.249 1.00 1.77 O ATOM 0 H SER A 138 -5.420 3.038 4.403 1.00 0.90 H new ATOM 0 HA SER A 138 -4.010 5.533 5.170 1.00 0.87 H new ATOM 0 HB2 SER A 138 -5.753 3.748 6.923 1.00 0.97 H new ATOM 0 HB3 SER A 138 -4.846 5.150 7.455 1.00 0.97 H new ATOM 0 HG SER A 138 -7.069 5.658 7.014 1.00 1.77 H new ATOM 2036 N ALA A 139 -2.151 4.129 6.194 1.00 0.78 N ATOM 2037 CA ALA A 139 -1.122 3.376 6.892 1.00 0.72 C ATOM 2038 C ALA A 139 -0.879 3.962 8.279 1.00 0.65 C ATOM 2039 O ALA A 139 -0.904 5.182 8.453 1.00 0.67 O ATOM 2040 CB ALA A 139 0.179 3.332 6.085 1.00 0.80 C ATOM 0 H ALA A 139 -1.912 5.110 6.052 1.00 0.78 H new ATOM 0 HA ALA A 139 -1.475 2.351 7.007 1.00 0.72 H new ATOM 0 HB1 ALA A 139 0.929 2.762 6.634 1.00 0.80 H new ATOM 0 HB2 ALA A 139 -0.006 2.856 5.122 1.00 0.80 H new ATOM 0 HB3 ALA A 139 0.542 4.347 5.924 1.00 0.80 H new ATOM 2046 N GLU A 140 -0.616 3.076 9.242 1.00 0.71 N ATOM 2047 CA GLU A 140 0.100 3.406 10.465 1.00 0.69 C ATOM 2048 C GLU A 140 1.547 2.980 10.227 1.00 0.78 C ATOM 2049 O GLU A 140 1.756 1.828 9.858 1.00 1.36 O ATOM 2050 CB GLU A 140 -0.498 2.654 11.667 1.00 0.95 C ATOM 2051 CG GLU A 140 0.342 2.889 12.934 1.00 1.84 C ATOM 2052 CD GLU A 140 -0.286 2.302 14.188 1.00 2.07 C ATOM 2053 OE1 GLU A 140 -0.928 3.082 14.927 1.00 2.43 O ATOM 2054 OE2 GLU A 140 -0.087 1.085 14.403 1.00 3.03 O ATOM 0 H GLU A 140 -0.900 2.098 9.189 1.00 0.71 H new ATOM 0 HA GLU A 140 0.028 4.469 10.695 1.00 0.69 H new ATOM 0 HB2 GLU A 140 -1.522 2.988 11.837 1.00 0.95 H new ATOM 0 HB3 GLU A 140 -0.543 1.587 11.448 1.00 0.95 H new ATOM 0 HG2 GLU A 140 1.331 2.452 12.792 1.00 1.84 H new ATOM 0 HG3 GLU A 140 0.484 3.961 13.074 1.00 1.84 H new ATOM 2061 N VAL A 141 2.535 3.854 10.443 1.00 0.66 N ATOM 2062 CA VAL A 141 3.950 3.492 10.443 1.00 0.73 C ATOM 2063 C VAL A 141 4.665 4.300 11.521 1.00 0.79 C ATOM 2064 O VAL A 141 4.749 5.516 11.402 1.00 1.18 O ATOM 2065 CB VAL A 141 4.610 3.764 9.075 1.00 0.91 C ATOM 2066 CG1 VAL A 141 5.994 3.102 9.025 1.00 1.45 C ATOM 2067 CG2 VAL A 141 3.775 3.262 7.889 1.00 2.10 C ATOM 0 H VAL A 141 2.369 4.844 10.625 1.00 0.66 H new ATOM 0 HA VAL A 141 4.031 2.424 10.644 1.00 0.73 H new ATOM 0 HB VAL A 141 4.691 4.847 8.981 1.00 0.91 H new ATOM 0 HG11 VAL A 141 6.456 3.297 8.057 1.00 1.45 H new ATOM 0 HG12 VAL A 141 6.622 3.512 9.816 1.00 1.45 H new ATOM 0 HG13 VAL A 141 5.888 2.026 9.166 1.00 1.45 H new ATOM 0 HG21 VAL A 141 4.295 3.485 6.958 1.00 2.10 H new ATOM 0 HG22 VAL A 141 3.631 2.185 7.976 1.00 2.10 H new ATOM 0 HG23 VAL A 141 2.805 3.759 7.890 1.00 2.10 H new ATOM 2077 N LYS A 142 5.220 3.655 12.552 1.00 0.73 N ATOM 2078 CA LYS A 142 6.140 4.347 13.448 1.00 1.15 C ATOM 2079 C LYS A 142 7.550 3.862 13.137 1.00 1.66 C ATOM 2080 O LYS A 142 7.768 2.655 13.060 1.00 2.12 O ATOM 2081 CB LYS A 142 5.752 4.148 14.920 1.00 1.48 C ATOM 2082 CG LYS A 142 5.988 2.723 15.437 1.00 1.61 C ATOM 2083 CD LYS A 142 5.282 2.419 16.768 1.00 2.26 C ATOM 2084 CE LYS A 142 5.768 3.273 17.953 1.00 3.87 C ATOM 2085 NZ LYS A 142 5.162 4.621 17.983 1.00 4.84 N ATOM 0 H LYS A 142 5.051 2.675 12.781 1.00 0.73 H new ATOM 0 HA LYS A 142 6.091 5.423 13.284 1.00 1.15 H new ATOM 0 HB2 LYS A 142 6.322 4.846 15.533 1.00 1.48 H new ATOM 0 HB3 LYS A 142 4.699 4.400 15.045 1.00 1.48 H new ATOM 0 HG2 LYS A 142 5.645 2.013 14.685 1.00 1.61 H new ATOM 0 HG3 LYS A 142 7.059 2.565 15.561 1.00 1.61 H new ATOM 0 HD2 LYS A 142 4.210 2.572 16.641 1.00 2.26 H new ATOM 0 HD3 LYS A 142 5.427 1.366 17.010 1.00 2.26 H new ATOM 0 HE2 LYS A 142 5.537 2.756 18.885 1.00 3.87 H new ATOM 0 HE3 LYS A 142 6.853 3.370 17.903 1.00 3.87 H new ATOM 0 HZ1 LYS A 142 5.901 5.337 17.835 1.00 4.84 H new ATOM 0 HZ2 LYS A 142 4.450 4.698 17.229 1.00 4.84 H new ATOM 0 HZ3 LYS A 142 4.708 4.777 18.906 1.00 4.84 H new ATOM 2099 N THR A 143 8.503 4.782 12.984 1.00 1.72 N ATOM 2100 CA THR A 143 9.913 4.417 13.018 1.00 2.12 C ATOM 2101 C THR A 143 10.659 5.444 13.862 1.00 2.09 C ATOM 2102 O THR A 143 10.064 6.442 14.274 1.00 1.87 O ATOM 2103 CB THR A 143 10.522 4.300 11.608 1.00 2.32 C ATOM 2104 OG1 THR A 143 10.900 5.572 11.137 1.00 2.84 O ATOM 2105 CG2 THR A 143 9.601 3.643 10.573 1.00 3.01 C ATOM 0 H THR A 143 8.324 5.775 12.837 1.00 1.72 H new ATOM 0 HA THR A 143 10.010 3.428 13.467 1.00 2.12 H new ATOM 0 HB THR A 143 11.386 3.646 11.720 1.00 2.32 H new ATOM 0 HG1 THR A 143 10.400 5.780 10.320 1.00 2.84 H new ATOM 0 HG21 THR A 143 10.108 3.601 9.609 1.00 3.01 H new ATOM 0 HG22 THR A 143 9.353 2.632 10.897 1.00 3.01 H new ATOM 0 HG23 THR A 143 8.686 4.228 10.476 1.00 3.01 H new ATOM 2113 N VAL A 144 11.966 5.226 14.049 1.00 2.41 N ATOM 2114 CA VAL A 144 12.883 6.170 14.680 1.00 2.47 C ATOM 2115 C VAL A 144 12.674 7.587 14.135 1.00 2.08 C ATOM 2116 O VAL A 144 12.827 8.557 14.872 1.00 2.14 O ATOM 2117 CB VAL A 144 14.336 5.691 14.480 1.00 2.85 C ATOM 2118 CG1 VAL A 144 15.347 6.676 15.085 1.00 3.07 C ATOM 2119 CG2 VAL A 144 14.557 4.319 15.136 1.00 3.19 C ATOM 0 H VAL A 144 12.423 4.363 13.756 1.00 2.41 H new ATOM 0 HA VAL A 144 12.677 6.208 15.750 1.00 2.47 H new ATOM 0 HB VAL A 144 14.494 5.624 13.404 1.00 2.85 H new ATOM 0 HG11 VAL A 144 16.359 6.304 14.924 1.00 3.07 H new ATOM 0 HG12 VAL A 144 15.238 7.649 14.606 1.00 3.07 H new ATOM 0 HG13 VAL A 144 15.163 6.775 16.155 1.00 3.07 H new ATOM 0 HG21 VAL A 144 15.589 4.004 14.981 1.00 3.19 H new ATOM 0 HG22 VAL A 144 14.356 4.390 16.205 1.00 3.19 H new ATOM 0 HG23 VAL A 144 13.883 3.589 14.688 1.00 3.19 H new ATOM 2129 N ASN A 145 12.309 7.716 12.854 1.00 1.86 N ATOM 2130 CA ASN A 145 11.847 8.984 12.305 1.00 1.58 C ATOM 2131 C ASN A 145 10.753 8.729 11.271 1.00 1.56 C ATOM 2132 O ASN A 145 10.881 9.138 10.121 1.00 1.79 O ATOM 2133 CB ASN A 145 13.008 9.856 11.792 1.00 1.73 C ATOM 2134 CG ASN A 145 13.865 9.225 10.695 1.00 2.41 C ATOM 2135 OD1 ASN A 145 13.893 9.708 9.562 1.00 3.65 O ATOM 2136 ND2 ASN A 145 14.637 8.202 11.052 1.00 2.35 N ATOM 0 H ASN A 145 12.327 6.950 12.180 1.00 1.86 H new ATOM 0 HA ASN A 145 11.401 9.577 13.103 1.00 1.58 H new ATOM 0 HB2 ASN A 145 12.598 10.793 11.416 1.00 1.73 H new ATOM 0 HB3 ASN A 145 13.652 10.106 12.635 1.00 1.73 H new ATOM 0 HD21 ASN A 145 15.281 7.790 10.377 1.00 2.35 H new ATOM 0 HD22 ASN A 145 14.585 7.830 12.000 1.00 2.35 H new ATOM 2143 N GLY A 146 9.667 8.073 11.700 1.00 1.49 N ATOM 2144 CA GLY A 146 8.540 7.708 10.857 1.00 1.57 C ATOM 2145 C GLY A 146 7.249 8.251 11.450 1.00 1.17 C ATOM 2146 O GLY A 146 6.984 8.077 12.638 1.00 1.21 O ATOM 0 H GLY A 146 9.553 7.777 12.670 1.00 1.49 H new ATOM 0 HA2 GLY A 146 8.683 8.105 9.852 1.00 1.57 H new ATOM 0 HA3 GLY A 146 8.480 6.624 10.766 1.00 1.57 H new ATOM 2150 N ILE A 147 6.468 8.920 10.604 1.00 1.03 N ATOM 2151 CA ILE A 147 5.234 9.597 10.961 1.00 0.88 C ATOM 2152 C ILE A 147 4.108 8.576 11.083 1.00 0.91 C ATOM 2153 O ILE A 147 3.839 7.851 10.131 1.00 1.24 O ATOM 2154 CB ILE A 147 4.876 10.656 9.893 1.00 1.08 C ATOM 2155 CG1 ILE A 147 5.139 10.163 8.462 1.00 1.36 C ATOM 2156 CG2 ILE A 147 5.534 12.006 10.209 1.00 1.68 C ATOM 2157 CD1 ILE A 147 6.465 10.621 7.862 1.00 1.64 C ATOM 0 H ILE A 147 6.691 9.006 9.612 1.00 1.03 H new ATOM 0 HA ILE A 147 5.368 10.101 11.918 1.00 0.88 H new ATOM 0 HB ILE A 147 3.799 10.819 9.938 1.00 1.08 H new ATOM 0 HG12 ILE A 147 5.111 9.073 8.457 1.00 1.36 H new ATOM 0 HG13 ILE A 147 4.328 10.506 7.820 1.00 1.36 H new ATOM 0 HG21 ILE A 147 5.264 12.731 9.441 1.00 1.68 H new ATOM 0 HG22 ILE A 147 5.188 12.361 11.180 1.00 1.68 H new ATOM 0 HG23 ILE A 147 6.617 11.887 10.231 1.00 1.68 H new ATOM 0 HD11 ILE A 147 6.563 10.225 6.851 1.00 1.64 H new ATOM 0 HD12 ILE A 147 6.493 11.710 7.829 1.00 1.64 H new ATOM 0 HD13 ILE A 147 7.288 10.256 8.476 1.00 1.64 H new ATOM 2169 N ARG A 148 3.446 8.550 12.245 1.00 0.94 N ATOM 2170 CA ARG A 148 2.448 7.539 12.571 1.00 1.08 C ATOM 2171 C ARG A 148 1.427 7.410 11.444 1.00 1.05 C ATOM 2172 O ARG A 148 1.388 6.393 10.761 1.00 1.53 O ATOM 2173 CB ARG A 148 1.762 7.806 13.923 1.00 1.14 C ATOM 2174 CG ARG A 148 0.810 6.635 14.210 1.00 1.25 C ATOM 2175 CD ARG A 148 -0.014 6.770 15.489 1.00 1.46 C ATOM 2176 NE ARG A 148 -0.984 5.662 15.538 1.00 1.64 N ATOM 2177 CZ ARG A 148 -2.324 5.710 15.576 1.00 1.83 C ATOM 2178 NH1 ARG A 148 -2.999 6.866 15.575 1.00 2.05 N ATOM 2179 NH2 ARG A 148 -2.980 4.548 15.594 1.00 2.62 N ATOM 0 H ARG A 148 3.592 9.236 12.986 1.00 0.94 H new ATOM 0 HA ARG A 148 2.971 6.588 12.673 1.00 1.08 H new ATOM 0 HB2 ARG A 148 2.504 7.897 14.716 1.00 1.14 H new ATOM 0 HB3 ARG A 148 1.212 8.746 13.892 1.00 1.14 H new ATOM 0 HG2 ARG A 148 0.128 6.526 13.367 1.00 1.25 H new ATOM 0 HG3 ARG A 148 1.395 5.717 14.268 1.00 1.25 H new ATOM 0 HD2 ARG A 148 0.636 6.743 16.363 1.00 1.46 H new ATOM 0 HD3 ARG A 148 -0.532 7.729 15.506 1.00 1.46 H new ATOM 0 HE ARG A 148 -0.579 4.726 15.544 1.00 1.64 H new ATOM 0 HH11 ARG A 148 -2.494 7.752 15.545 1.00 2.05 H new ATOM 0 HH12 ARG A 148 -4.019 6.861 15.605 1.00 2.05 H new ATOM 0 HH21 ARG A 148 -2.462 3.670 15.579 1.00 2.62 H new ATOM 0 HH22 ARG A 148 -4.000 4.538 15.623 1.00 2.62 H new ATOM 2193 N HIS A 149 0.558 8.410 11.301 1.00 0.81 N ATOM 2194 CA HIS A 149 -0.490 8.368 10.298 1.00 0.99 C ATOM 2195 C HIS A 149 0.152 8.654 8.948 1.00 1.01 C ATOM 2196 O HIS A 149 0.931 9.601 8.836 1.00 1.57 O ATOM 2197 CB HIS A 149 -1.584 9.401 10.602 1.00 1.04 C ATOM 2198 CG HIS A 149 -1.862 9.577 12.071 1.00 1.04 C ATOM 2199 ND1 HIS A 149 -1.574 10.702 12.810 1.00 2.39 N ATOM 2200 CD2 HIS A 149 -2.275 8.602 12.937 1.00 1.22 C ATOM 2201 CE1 HIS A 149 -1.829 10.412 14.098 1.00 2.44 C ATOM 2202 NE2 HIS A 149 -2.249 9.138 14.231 1.00 1.25 N ATOM 0 H HIS A 149 0.564 9.257 11.870 1.00 0.81 H new ATOM 0 HA HIS A 149 -0.965 7.387 10.296 1.00 0.99 H new ATOM 0 HB2 HIS A 149 -1.291 10.362 10.180 1.00 1.04 H new ATOM 0 HB3 HIS A 149 -2.504 9.100 10.101 1.00 1.04 H new ATOM 0 HD1 HIS A 149 -1.231 11.591 12.448 1.00 2.39 H new ATOM 0 HD2 HIS A 149 -2.569 7.598 12.670 1.00 1.22 H new ATOM 0 HE1 HIS A 149 -1.713 11.107 14.917 1.00 2.44 H new ATOM 2210 N ILE A 150 -0.178 7.861 7.932 1.00 0.67 N ATOM 2211 CA ILE A 150 0.200 8.153 6.564 1.00 0.58 C ATOM 2212 C ILE A 150 -1.046 7.941 5.699 1.00 0.64 C ATOM 2213 O ILE A 150 -1.597 6.840 5.665 1.00 0.81 O ATOM 2214 CB ILE A 150 1.399 7.286 6.150 1.00 0.60 C ATOM 2215 CG1 ILE A 150 2.561 7.407 7.156 1.00 1.04 C ATOM 2216 CG2 ILE A 150 1.865 7.670 4.748 1.00 1.17 C ATOM 2217 CD1 ILE A 150 3.857 6.741 6.687 1.00 1.23 C ATOM 0 H ILE A 150 -0.714 7.000 8.040 1.00 0.67 H new ATOM 0 HA ILE A 150 0.535 9.183 6.439 1.00 0.58 H new ATOM 0 HB ILE A 150 1.075 6.245 6.146 1.00 0.60 H new ATOM 0 HG12 ILE A 150 2.755 8.462 7.348 1.00 1.04 H new ATOM 0 HG13 ILE A 150 2.257 6.962 8.103 1.00 1.04 H new ATOM 0 HG21 ILE A 150 2.715 7.050 4.464 1.00 1.17 H new ATOM 0 HG22 ILE A 150 1.051 7.516 4.039 1.00 1.17 H new ATOM 0 HG23 ILE A 150 2.162 8.719 4.738 1.00 1.17 H new ATOM 0 HD11 ILE A 150 4.627 6.868 7.448 1.00 1.23 H new ATOM 0 HD12 ILE A 150 3.681 5.678 6.523 1.00 1.23 H new ATOM 0 HD13 ILE A 150 4.187 7.202 5.756 1.00 1.23 H new ATOM 2229 N GLY A 151 -1.519 9.001 5.043 1.00 0.65 N ATOM 2230 CA GLY A 151 -2.661 8.956 4.149 1.00 0.77 C ATOM 2231 C GLY A 151 -2.205 8.403 2.805 1.00 0.63 C ATOM 2232 O GLY A 151 -1.225 8.882 2.234 1.00 0.74 O ATOM 0 H GLY A 151 -1.106 9.930 5.124 1.00 0.65 H new ATOM 0 HA2 GLY A 151 -3.446 8.328 4.570 1.00 0.77 H new ATOM 0 HA3 GLY A 151 -3.083 9.953 4.024 1.00 0.77 H new ATOM 2236 N LEU A 152 -2.884 7.365 2.317 1.00 0.61 N ATOM 2237 CA LEU A 152 -2.469 6.619 1.143 1.00 0.72 C ATOM 2238 C LEU A 152 -3.434 6.953 0.008 1.00 0.56 C ATOM 2239 O LEU A 152 -4.641 6.773 0.166 1.00 0.62 O ATOM 2240 CB LEU A 152 -2.503 5.131 1.517 1.00 1.12 C ATOM 2241 CG LEU A 152 -1.626 4.198 0.681 1.00 0.70 C ATOM 2242 CD1 LEU A 152 -1.960 4.290 -0.813 1.00 0.70 C ATOM 2243 CD2 LEU A 152 -0.137 4.446 0.936 1.00 0.85 C ATOM 0 H LEU A 152 -3.748 7.019 2.736 1.00 0.61 H new ATOM 0 HA LEU A 152 -1.462 6.873 0.812 1.00 0.72 H new ATOM 0 HB2 LEU A 152 -2.205 5.035 2.561 1.00 1.12 H new ATOM 0 HB3 LEU A 152 -3.534 4.785 1.446 1.00 1.12 H new ATOM 0 HG LEU A 152 -1.848 3.180 1.000 1.00 0.70 H new ATOM 0 HD11 LEU A 152 -1.315 3.612 -1.372 1.00 0.70 H new ATOM 0 HD12 LEU A 152 -3.002 4.012 -0.971 1.00 0.70 H new ATOM 0 HD13 LEU A 152 -1.800 5.311 -1.159 1.00 0.70 H new ATOM 0 HD21 LEU A 152 0.455 3.765 0.325 1.00 0.85 H new ATOM 0 HD22 LEU A 152 0.110 5.475 0.676 1.00 0.85 H new ATOM 0 HD23 LEU A 152 0.085 4.275 1.989 1.00 0.85 H new ATOM 2255 N ALA A 153 -2.931 7.424 -1.136 1.00 0.64 N ATOM 2256 CA ALA A 153 -3.753 7.644 -2.318 1.00 0.72 C ATOM 2257 C ALA A 153 -2.910 7.410 -3.566 1.00 0.60 C ATOM 2258 O ALA A 153 -1.785 7.903 -3.625 1.00 0.68 O ATOM 2259 CB ALA A 153 -4.323 9.065 -2.299 1.00 0.98 C ATOM 0 H ALA A 153 -1.947 7.661 -1.264 1.00 0.64 H new ATOM 0 HA ALA A 153 -4.589 6.945 -2.324 1.00 0.72 H new ATOM 0 HB1 ALA A 153 -4.937 9.223 -3.186 1.00 0.98 H new ATOM 0 HB2 ALA A 153 -4.934 9.200 -1.406 1.00 0.98 H new ATOM 0 HB3 ALA A 153 -3.505 9.785 -2.291 1.00 0.98 H new ATOM 2265 N ALA A 154 -3.427 6.673 -4.556 1.00 0.81 N ATOM 2266 CA ALA A 154 -2.744 6.502 -5.836 1.00 0.79 C ATOM 2267 C ALA A 154 -3.718 6.627 -6.987 1.00 0.92 C ATOM 2268 O ALA A 154 -4.924 6.463 -6.806 1.00 1.17 O ATOM 2269 CB ALA A 154 -2.031 5.141 -5.950 1.00 1.26 C ATOM 0 H ALA A 154 -4.320 6.185 -4.491 1.00 0.81 H new ATOM 0 HA ALA A 154 -1.995 7.292 -5.884 1.00 0.79 H new ATOM 0 HB1 ALA A 154 -1.540 5.067 -6.921 1.00 1.26 H new ATOM 0 HB2 ALA A 154 -1.286 5.053 -5.159 1.00 1.26 H new ATOM 0 HB3 ALA A 154 -2.762 4.338 -5.851 1.00 1.26 H new ATOM 2275 N LYS A 155 -3.155 6.832 -8.175 1.00 0.97 N ATOM 2276 CA LYS A 155 -3.843 6.650 -9.434 1.00 1.29 C ATOM 2277 C LYS A 155 -2.793 6.362 -10.488 1.00 1.45 C ATOM 2278 O LYS A 155 -1.647 6.772 -10.316 1.00 1.70 O ATOM 2279 CB LYS A 155 -4.663 7.894 -9.792 1.00 1.49 C ATOM 2280 CG LYS A 155 -3.799 9.158 -9.954 1.00 2.02 C ATOM 2281 CD LYS A 155 -4.634 10.399 -10.308 1.00 2.01 C ATOM 2282 CE LYS A 155 -4.854 10.589 -11.819 1.00 3.52 C ATOM 2283 NZ LYS A 155 -5.507 9.431 -12.455 1.00 4.61 N ATOM 0 H LYS A 155 -2.187 7.136 -8.283 1.00 0.97 H new ATOM 0 HA LYS A 155 -4.546 5.820 -9.369 1.00 1.29 H new ATOM 0 HB2 LYS A 155 -5.206 7.710 -10.719 1.00 1.49 H new ATOM 0 HB3 LYS A 155 -5.408 8.067 -9.016 1.00 1.49 H new ATOM 0 HG2 LYS A 155 -3.254 9.343 -9.029 1.00 2.02 H new ATOM 0 HG3 LYS A 155 -3.056 8.989 -10.734 1.00 2.02 H new ATOM 0 HD2 LYS A 155 -5.604 10.326 -9.816 1.00 2.01 H new ATOM 0 HD3 LYS A 155 -4.140 11.284 -9.908 1.00 2.01 H new ATOM 0 HE2 LYS A 155 -5.463 11.478 -11.983 1.00 3.52 H new ATOM 0 HE3 LYS A 155 -3.893 10.767 -12.301 1.00 3.52 H new ATOM 0 HZ1 LYS A 155 -5.872 9.708 -13.389 1.00 4.61 H new ATOM 0 HZ2 LYS A 155 -4.816 8.662 -12.568 1.00 4.61 H new ATOM 0 HZ3 LYS A 155 -6.294 9.105 -11.858 1.00 4.61 H new ATOM 2297 N GLN A 156 -3.164 5.686 -11.569 1.00 1.59 N ATOM 2298 CA GLN A 156 -2.372 5.804 -12.780 1.00 1.84 C ATOM 2299 C GLN A 156 -2.497 7.243 -13.283 1.00 2.52 C ATOM 2300 O GLN A 156 -3.632 7.778 -13.258 1.00 2.72 O ATOM 2301 CB GLN A 156 -2.747 4.720 -13.797 1.00 2.26 C ATOM 2302 CG GLN A 156 -4.249 4.548 -14.072 1.00 2.79 C ATOM 2303 CD GLN A 156 -4.676 3.088 -13.943 1.00 3.40 C ATOM 2304 OE1 GLN A 156 -4.517 2.310 -14.880 1.00 4.77 O ATOM 2305 NE2 GLN A 156 -5.210 2.702 -12.789 1.00 2.96 N ATOM 0 H GLN A 156 -3.977 5.073 -11.631 1.00 1.59 H new ATOM 0 HA GLN A 156 -1.315 5.619 -12.588 1.00 1.84 H new ATOM 0 HB2 GLN A 156 -2.248 4.945 -14.740 1.00 2.26 H new ATOM 0 HB3 GLN A 156 -2.350 3.767 -13.446 1.00 2.26 H new ATOM 0 HG2 GLN A 156 -4.821 5.159 -13.373 1.00 2.79 H new ATOM 0 HG3 GLN A 156 -4.481 4.909 -15.074 1.00 2.79 H new ATOM 0 HE21 GLN A 156 -5.328 3.375 -12.031 1.00 2.96 H new ATOM 0 HE22 GLN A 156 -5.502 1.733 -12.661 1.00 2.96 H new TER 2314 GLN A 156