USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1216 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 117 ASN : amide:sc= -0.33 K(o=-0.97,f=-3.6) USER MOD Set 1.2: A 121 ASN : amide:sc= -0.636 K(o=-0.97,f=-2.8!) USER MOD Set 2.1: A 78 ASN : amide:sc= -0.148 K(o=0.6,f=-0.92) USER MOD Set 2.2: A 104 ASN : amide:sc= 0.747 K(o=0.6,f=-0.81) USER MOD Set 3.1: A 68 TYR OH : rot 4:sc= 0.415 USER MOD Set 3.2: A 88 HIS : no HD1:sc= 0.702 K(o=1.1,f=-6.5) USER MOD Set 4.1: A 56 LYS NZ :NH3+ -139:sc= 0.0153 (180deg=0) USER MOD Set 4.2: A 126 ASN : amide:sc= 0.0149 K(o=0.03,f=-0.73) USER MOD Single : A 1 MET CE :methyl 163:sc= -0.0801 (180deg=-0.468) USER MOD Single : A 1 MET N :NH3+ 170:sc= 0.502 (180deg=0.345!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 171:sc=-0.000342 (180deg=-0.0958) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 81:sc= 0.677 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot -32:sc= 0.815 USER MOD Single : A 26 GLN : amide:sc= -0.5 X(o=-0.5,f=-0.023) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN :FLIP amide:sc=-0.00195 F(o=-0.51,f=-0.002) USER MOD Single : A 39 ASN : amide:sc= -0.0633 K(o=-0.063,f=-0.86) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 66:sc= 0.834 USER MOD Single : A 47 LYS NZ :NH3+ -121:sc= 1.01 (180deg=-0.049) USER MOD Single : A 50 ASN : amide:sc= -0.117 X(o=-0.12,f=-0.52) USER MOD Single : A 54 THR OG1 : rot -160:sc= -0.428 USER MOD Single : A 64 TYR OH : rot 95:sc= -0.62 USER MOD Single : A 65 SER OG : rot -76:sc= 0.915 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 70:sc= 0.6 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 89:sc= 0.38 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -0.445 K(o=-0.45,f=-1.5) USER MOD Single : A 102 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00392) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= -0.0391 X(o=-0.039,f=-0.34) USER MOD Single : A 109 THR OG1 : rot -73:sc= 0.0635 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 TYR OH : rot -30:sc= -0.349 USER MOD Single : A 133 THR OG1 : rot -0:sc= 0.231 USER MOD Single : A 136 TYR OH : rot -156:sc= 0.435 USER MOD Single : A 141 THR OG1 : rot 120:sc= -0.355 USER MOD Single : A 144 HIS : no HE2:sc= -0.0626 K(o=-0.063,f=-1.4) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 146 HIS : no HE2:sc= 0.0984 K(o=0.098,f=-1.6) USER MOD Single : A 147 HIS : no HD1:sc= -0.0432 X(o=-0.043,f=-0.048) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.197 8.857 -9.701 1.00 34.12 N ATOM 2 CA MET A 1 18.226 8.627 -10.807 1.00 54.22 C ATOM 3 C MET A 1 17.415 7.328 -10.597 1.00 62.40 C ATOM 4 O MET A 1 16.357 7.153 -11.216 1.00 12.10 O ATOM 5 CB MET A 1 18.962 8.588 -12.175 1.00 13.13 C ATOM 6 CG MET A 1 19.722 9.880 -12.530 1.00 53.34 C ATOM 7 SD MET A 1 21.098 10.235 -11.409 1.00 34.04 S ATOM 8 CE MET A 1 22.167 8.820 -11.681 1.00 25.31 C ATOM 0 H1 MET A 1 19.836 9.637 -9.956 1.00 34.12 H new ATOM 0 H2 MET A 1 18.681 9.102 -8.832 1.00 34.12 H new ATOM 0 H3 MET A 1 19.753 7.993 -9.542 1.00 34.12 H new ATOM 0 HA MET A 1 17.523 9.460 -10.805 1.00 54.22 H new ATOM 0 HB2 MET A 1 19.667 7.757 -12.170 1.00 13.13 H new ATOM 0 HB3 MET A 1 18.233 8.383 -12.959 1.00 13.13 H new ATOM 0 HG2 MET A 1 20.104 9.800 -13.548 1.00 53.34 H new ATOM 0 HG3 MET A 1 19.025 10.718 -12.515 1.00 53.34 H new ATOM 0 HE1 MET A 1 23.165 9.040 -11.303 1.00 25.31 H new ATOM 0 HE2 MET A 1 21.764 7.953 -11.157 1.00 25.31 H new ATOM 0 HE3 MET A 1 22.222 8.605 -12.748 1.00 25.31 H new ATOM 20 N LYS A 2 17.913 6.415 -9.729 1.00 65.02 N ATOM 21 CA LYS A 2 17.242 5.128 -9.453 1.00 71.33 C ATOM 22 C LYS A 2 15.991 5.343 -8.561 1.00 33.04 C ATOM 23 O LYS A 2 16.095 5.486 -7.337 1.00 4.21 O ATOM 24 CB LYS A 2 18.222 4.100 -8.801 1.00 70.12 C ATOM 25 CG LYS A 2 17.722 2.617 -8.761 1.00 50.34 C ATOM 26 CD LYS A 2 17.914 1.840 -10.100 1.00 11.53 C ATOM 27 CE LYS A 2 16.944 2.244 -11.230 1.00 10.21 C ATOM 28 NZ LYS A 2 17.380 1.735 -12.561 1.00 73.54 N ATOM 0 H LYS A 2 18.780 6.550 -9.208 1.00 65.02 H new ATOM 0 HA LYS A 2 16.917 4.711 -10.406 1.00 71.33 H new ATOM 0 HB2 LYS A 2 19.166 4.131 -9.344 1.00 70.12 H new ATOM 0 HB3 LYS A 2 18.431 4.421 -7.781 1.00 70.12 H new ATOM 0 HG2 LYS A 2 18.251 2.088 -7.968 1.00 50.34 H new ATOM 0 HG3 LYS A 2 16.664 2.609 -8.498 1.00 50.34 H new ATOM 0 HD2 LYS A 2 18.936 1.991 -10.447 1.00 11.53 H new ATOM 0 HD3 LYS A 2 17.797 0.774 -9.905 1.00 11.53 H new ATOM 0 HE2 LYS A 2 15.949 1.860 -11.005 1.00 10.21 H new ATOM 0 HE3 LYS A 2 16.866 3.331 -11.267 1.00 10.21 H new ATOM 0 HZ1 LYS A 2 16.697 2.032 -13.287 1.00 73.54 H new ATOM 0 HZ2 LYS A 2 18.318 2.121 -12.790 1.00 73.54 H new ATOM 0 HZ3 LYS A 2 17.429 0.696 -12.536 1.00 73.54 H new ATOM 42 N VAL A 3 14.818 5.386 -9.212 1.00 55.21 N ATOM 43 CA VAL A 3 13.507 5.630 -8.556 1.00 45.31 C ATOM 44 C VAL A 3 12.597 4.358 -8.606 1.00 2.45 C ATOM 45 O VAL A 3 11.589 4.266 -7.888 1.00 64.41 O ATOM 46 CB VAL A 3 12.801 6.862 -9.248 1.00 22.03 C ATOM 47 CG1 VAL A 3 12.405 6.565 -10.711 1.00 45.04 C ATOM 48 CG2 VAL A 3 11.594 7.366 -8.435 1.00 32.01 C ATOM 0 H VAL A 3 14.744 5.252 -10.220 1.00 55.21 H new ATOM 0 HA VAL A 3 13.676 5.858 -7.504 1.00 45.31 H new ATOM 0 HB VAL A 3 13.539 7.664 -9.271 1.00 22.03 H new ATOM 0 HG11 VAL A 3 11.923 7.442 -11.143 1.00 45.04 H new ATOM 0 HG12 VAL A 3 13.297 6.321 -11.287 1.00 45.04 H new ATOM 0 HG13 VAL A 3 11.714 5.722 -10.737 1.00 45.04 H new ATOM 0 HG21 VAL A 3 11.139 8.214 -8.947 1.00 32.01 H new ATOM 0 HG22 VAL A 3 10.861 6.565 -8.337 1.00 32.01 H new ATOM 0 HG23 VAL A 3 11.927 7.677 -7.445 1.00 32.01 H new ATOM 58 N PHE A 4 13.010 3.373 -9.446 1.00 11.34 N ATOM 59 CA PHE A 4 12.256 2.126 -9.734 1.00 45.32 C ATOM 60 C PHE A 4 10.900 2.413 -10.437 1.00 41.23 C ATOM 61 O PHE A 4 9.852 2.554 -9.801 1.00 2.25 O ATOM 62 CB PHE A 4 12.091 1.228 -8.469 1.00 11.54 C ATOM 63 CG PHE A 4 13.410 0.668 -7.929 1.00 64.21 C ATOM 64 CD1 PHE A 4 13.931 -0.529 -8.425 1.00 53.43 C ATOM 65 CD2 PHE A 4 14.131 1.337 -6.935 1.00 13.43 C ATOM 66 CE1 PHE A 4 15.120 -1.038 -7.945 1.00 31.14 C ATOM 67 CE2 PHE A 4 15.323 0.824 -6.455 1.00 1.25 C ATOM 68 CZ PHE A 4 15.817 -0.363 -6.961 1.00 3.44 C ATOM 0 H PHE A 4 13.894 3.426 -9.952 1.00 11.34 H new ATOM 0 HA PHE A 4 12.857 1.553 -10.440 1.00 45.32 H new ATOM 0 HB2 PHE A 4 11.606 1.808 -7.684 1.00 11.54 H new ATOM 0 HB3 PHE A 4 11.426 0.398 -8.709 1.00 11.54 H new ATOM 0 HD1 PHE A 4 13.395 -1.064 -9.195 1.00 53.43 H new ATOM 0 HD2 PHE A 4 13.752 2.267 -6.537 1.00 13.43 H new ATOM 0 HE1 PHE A 4 15.507 -1.966 -8.339 1.00 31.14 H new ATOM 0 HE2 PHE A 4 15.867 1.351 -5.685 1.00 1.25 H new ATOM 0 HZ PHE A 4 16.748 -0.763 -6.587 1.00 3.44 H new ATOM 78 N LYS A 5 10.967 2.519 -11.775 1.00 65.03 N ATOM 79 CA LYS A 5 9.803 2.751 -12.661 1.00 2.53 C ATOM 80 C LYS A 5 9.751 1.693 -13.788 1.00 43.34 C ATOM 81 O LYS A 5 10.712 0.936 -14.003 1.00 34.12 O ATOM 82 CB LYS A 5 9.886 4.169 -13.292 1.00 72.35 C ATOM 83 CG LYS A 5 11.194 4.437 -14.092 1.00 32.32 C ATOM 84 CD LYS A 5 11.116 5.686 -15.006 1.00 32.03 C ATOM 85 CE LYS A 5 10.689 6.964 -14.265 1.00 23.30 C ATOM 86 NZ LYS A 5 10.743 8.163 -15.148 1.00 11.30 N ATOM 0 H LYS A 5 11.847 2.445 -12.285 1.00 65.03 H new ATOM 0 HA LYS A 5 8.898 2.671 -12.059 1.00 2.53 H new ATOM 0 HB2 LYS A 5 9.033 4.309 -13.955 1.00 72.35 H new ATOM 0 HB3 LYS A 5 9.799 4.912 -12.500 1.00 72.35 H new ATOM 0 HG2 LYS A 5 12.020 4.561 -13.391 1.00 32.32 H new ATOM 0 HG3 LYS A 5 11.422 3.564 -14.703 1.00 32.32 H new ATOM 0 HD2 LYS A 5 12.090 5.851 -15.466 1.00 32.03 H new ATOM 0 HD3 LYS A 5 10.411 5.491 -15.814 1.00 32.03 H new ATOM 0 HE2 LYS A 5 9.676 6.840 -13.882 1.00 23.30 H new ATOM 0 HE3 LYS A 5 11.339 7.118 -13.403 1.00 23.30 H new ATOM 0 HZ1 LYS A 5 10.448 9.003 -14.611 1.00 11.30 H new ATOM 0 HZ2 LYS A 5 11.715 8.296 -15.493 1.00 11.30 H new ATOM 0 HZ3 LYS A 5 10.104 8.027 -15.957 1.00 11.30 H new ATOM 100 N ARG A 6 8.637 1.687 -14.534 1.00 72.33 N ATOM 101 CA ARG A 6 8.431 0.760 -15.668 1.00 31.53 C ATOM 102 C ARG A 6 8.315 1.550 -16.983 1.00 44.24 C ATOM 103 O ARG A 6 7.247 2.088 -17.313 1.00 61.11 O ATOM 104 CB ARG A 6 7.174 -0.101 -15.444 1.00 21.21 C ATOM 105 CG ARG A 6 6.996 -1.297 -16.415 1.00 1.24 C ATOM 106 CD ARG A 6 5.631 -1.998 -16.233 1.00 64.24 C ATOM 107 NE ARG A 6 5.241 -2.057 -14.814 1.00 24.42 N ATOM 108 CZ ARG A 6 5.117 -3.119 -14.071 1.00 11.14 C ATOM 109 NH1 ARG A 6 5.209 -4.323 -14.561 1.00 74.22 N ATOM 110 NH2 ARG A 6 4.863 -2.953 -12.829 1.00 71.34 N ATOM 0 H ARG A 6 7.853 2.320 -14.373 1.00 72.33 H new ATOM 0 HA ARG A 6 9.292 0.095 -15.734 1.00 31.53 H new ATOM 0 HB2 ARG A 6 7.196 -0.485 -14.424 1.00 21.21 H new ATOM 0 HB3 ARG A 6 6.297 0.541 -15.524 1.00 21.21 H new ATOM 0 HG2 ARG A 6 7.088 -0.945 -17.443 1.00 1.24 H new ATOM 0 HG3 ARG A 6 7.797 -2.018 -16.252 1.00 1.24 H new ATOM 0 HD2 ARG A 6 4.868 -1.464 -16.799 1.00 64.24 H new ATOM 0 HD3 ARG A 6 5.682 -3.008 -16.640 1.00 64.24 H new ATOM 0 HE ARG A 6 5.046 -1.164 -14.362 1.00 24.42 H new ATOM 0 HH11 ARG A 6 5.384 -4.456 -15.557 1.00 74.22 H new ATOM 0 HH12 ARG A 6 5.106 -5.132 -13.948 1.00 74.22 H new ATOM 0 HH21 ARG A 6 4.764 -2.011 -12.450 1.00 71.34 H new ATOM 0 HH22 ARG A 6 4.759 -3.762 -12.217 1.00 71.34 H new ATOM 124 N VAL A 7 9.448 1.691 -17.673 1.00 24.32 N ATOM 125 CA VAL A 7 9.488 2.242 -19.042 1.00 34.24 C ATOM 126 C VAL A 7 8.957 1.175 -20.028 1.00 42.22 C ATOM 127 O VAL A 7 9.213 -0.014 -19.822 1.00 65.52 O ATOM 128 CB VAL A 7 10.943 2.698 -19.450 1.00 22.23 C ATOM 129 CG1 VAL A 7 10.954 3.426 -20.816 1.00 31.53 C ATOM 130 CG2 VAL A 7 11.582 3.572 -18.342 1.00 51.22 C ATOM 0 H VAL A 7 10.363 1.430 -17.307 1.00 24.32 H new ATOM 0 HA VAL A 7 8.856 3.129 -19.078 1.00 34.24 H new ATOM 0 HB VAL A 7 11.549 1.799 -19.560 1.00 22.23 H new ATOM 0 HG11 VAL A 7 11.973 3.724 -21.061 1.00 31.53 H new ATOM 0 HG12 VAL A 7 10.576 2.756 -21.588 1.00 31.53 H new ATOM 0 HG13 VAL A 7 10.320 4.311 -20.762 1.00 31.53 H new ATOM 0 HG21 VAL A 7 12.584 3.873 -18.648 1.00 51.22 H new ATOM 0 HG22 VAL A 7 10.970 4.460 -18.181 1.00 51.22 H new ATOM 0 HG23 VAL A 7 11.642 3.000 -17.416 1.00 51.22 H new ATOM 140 N ALA A 8 8.194 1.617 -21.055 1.00 0.20 N ATOM 141 CA ALA A 8 7.480 0.744 -22.025 1.00 23.34 C ATOM 142 C ALA A 8 8.316 -0.390 -22.651 1.00 64.14 C ATOM 143 O ALA A 8 7.715 -1.378 -23.118 1.00 21.42 O ATOM 144 CB ALA A 8 6.808 1.590 -23.105 1.00 32.43 C ATOM 0 H ALA A 8 8.053 2.610 -21.239 1.00 0.20 H new ATOM 0 HA ALA A 8 6.730 0.222 -21.431 1.00 23.34 H new ATOM 0 HB1 ALA A 8 6.289 0.938 -23.808 1.00 32.43 H new ATOM 0 HB2 ALA A 8 6.091 2.268 -22.642 1.00 32.43 H new ATOM 0 HB3 ALA A 8 7.564 2.168 -23.637 1.00 32.43 H new ATOM 150 N GLY A 9 9.682 -0.314 -22.657 1.00 14.40 N ATOM 151 CA GLY A 9 10.514 -1.476 -22.960 1.00 34.04 C ATOM 152 C GLY A 9 10.791 -2.288 -21.684 1.00 40.01 C ATOM 153 O GLY A 9 9.895 -3.008 -21.220 1.00 25.33 O ATOM 0 H GLY A 9 10.206 0.538 -22.455 1.00 14.40 H new ATOM 0 HA2 GLY A 9 10.015 -2.105 -23.697 1.00 34.04 H new ATOM 0 HA3 GLY A 9 11.455 -1.151 -23.403 1.00 34.04 H new ATOM 157 N ILE A 10 12.040 -2.153 -21.127 1.00 24.33 N ATOM 158 CA ILE A 10 12.498 -2.797 -19.850 1.00 21.32 C ATOM 159 C ILE A 10 12.000 -4.272 -19.729 1.00 2.25 C ATOM 160 O ILE A 10 11.382 -4.694 -18.744 1.00 54.43 O ATOM 161 CB ILE A 10 12.123 -1.904 -18.584 1.00 52.24 C ATOM 162 CG1 ILE A 10 12.656 -0.442 -18.763 1.00 64.52 C ATOM 163 CG2 ILE A 10 12.648 -2.495 -17.241 1.00 44.31 C ATOM 164 CD1 ILE A 10 14.175 -0.284 -18.800 1.00 70.34 C ATOM 0 H ILE A 10 12.767 -1.584 -21.561 1.00 24.33 H new ATOM 0 HA ILE A 10 13.586 -2.853 -19.877 1.00 21.32 H new ATOM 0 HB ILE A 10 11.034 -1.897 -18.528 1.00 52.24 H new ATOM 0 HG12 ILE A 10 12.246 -0.037 -19.688 1.00 64.52 H new ATOM 0 HG13 ILE A 10 12.267 0.168 -17.948 1.00 64.52 H new ATOM 0 HG21 ILE A 10 12.360 -1.841 -16.418 1.00 44.31 H new ATOM 0 HG22 ILE A 10 12.217 -3.484 -17.086 1.00 44.31 H new ATOM 0 HG23 ILE A 10 13.734 -2.574 -17.278 1.00 44.31 H new ATOM 0 HD11 ILE A 10 14.428 0.768 -18.927 1.00 70.34 H new ATOM 0 HD12 ILE A 10 14.602 -0.650 -17.866 1.00 70.34 H new ATOM 0 HD13 ILE A 10 14.580 -0.858 -19.633 1.00 70.34 H new ATOM 176 N LYS A 11 12.225 -5.045 -20.808 1.00 22.42 N ATOM 177 CA LYS A 11 11.942 -6.502 -20.848 1.00 60.13 C ATOM 178 C LYS A 11 12.803 -7.367 -19.872 1.00 2.31 C ATOM 179 O LYS A 11 12.813 -8.600 -19.988 1.00 62.14 O ATOM 180 CB LYS A 11 12.093 -7.012 -22.307 1.00 12.40 C ATOM 181 CG LYS A 11 11.251 -6.231 -23.346 1.00 31.31 C ATOM 182 CD LYS A 11 9.737 -6.205 -23.003 1.00 3.22 C ATOM 183 CE LYS A 11 8.904 -5.457 -24.057 1.00 14.12 C ATOM 184 NZ LYS A 11 8.999 -6.085 -25.407 1.00 34.23 N ATOM 0 H LYS A 11 12.609 -4.681 -21.680 1.00 22.42 H new ATOM 0 HA LYS A 11 10.917 -6.623 -20.496 1.00 60.13 H new ATOM 0 HB2 LYS A 11 13.144 -6.956 -22.592 1.00 12.40 H new ATOM 0 HB3 LYS A 11 11.809 -8.064 -22.343 1.00 12.40 H new ATOM 0 HG2 LYS A 11 11.621 -5.208 -23.410 1.00 31.31 H new ATOM 0 HG3 LYS A 11 11.388 -6.682 -24.329 1.00 31.31 H new ATOM 0 HD2 LYS A 11 9.371 -7.228 -22.915 1.00 3.22 H new ATOM 0 HD3 LYS A 11 9.597 -5.731 -22.031 1.00 3.22 H new ATOM 0 HE2 LYS A 11 7.861 -5.434 -23.742 1.00 14.12 H new ATOM 0 HE3 LYS A 11 9.242 -4.422 -24.116 1.00 14.12 H new ATOM 0 HZ1 LYS A 11 8.307 -5.642 -26.045 1.00 34.23 H new ATOM 0 HZ2 LYS A 11 9.958 -5.949 -25.787 1.00 34.23 H new ATOM 0 HZ3 LYS A 11 8.798 -7.103 -25.331 1.00 34.23 H new ATOM 198 N ASP A 12 13.501 -6.733 -18.910 1.00 10.45 N ATOM 199 CA ASP A 12 14.206 -7.432 -17.833 1.00 1.41 C ATOM 200 C ASP A 12 13.217 -7.849 -16.717 1.00 3.41 C ATOM 201 O ASP A 12 12.649 -7.016 -16.005 1.00 0.44 O ATOM 202 CB ASP A 12 15.343 -6.557 -17.265 1.00 53.41 C ATOM 203 CG ASP A 12 16.398 -6.240 -18.328 1.00 4.23 C ATOM 204 OD1 ASP A 12 17.265 -7.097 -18.587 1.00 73.43 O ATOM 205 OD2 ASP A 12 16.356 -5.145 -18.918 1.00 61.05 O ATOM 0 H ASP A 12 13.588 -5.718 -18.863 1.00 10.45 H new ATOM 0 HA ASP A 12 14.653 -8.336 -18.246 1.00 1.41 H new ATOM 0 HB2 ASP A 12 14.927 -5.627 -16.876 1.00 53.41 H new ATOM 0 HB3 ASP A 12 15.814 -7.071 -16.427 1.00 53.41 H new ATOM 210 N LYS A 13 13.060 -9.169 -16.605 1.00 31.43 N ATOM 211 CA LYS A 13 12.220 -9.820 -15.574 1.00 55.44 C ATOM 212 C LYS A 13 12.898 -9.670 -14.189 1.00 4.24 C ATOM 213 O LYS A 13 12.223 -9.594 -13.155 1.00 70.44 O ATOM 214 CB LYS A 13 11.896 -11.307 -15.946 1.00 74.35 C ATOM 215 CG LYS A 13 10.742 -11.473 -16.984 1.00 70.32 C ATOM 216 CD LYS A 13 10.997 -10.723 -18.320 1.00 31.12 C ATOM 217 CE LYS A 13 9.795 -10.752 -19.284 1.00 60.33 C ATOM 218 NZ LYS A 13 9.459 -12.130 -19.727 1.00 73.12 N ATOM 0 H LYS A 13 13.515 -9.833 -17.232 1.00 31.43 H new ATOM 0 HA LYS A 13 11.253 -9.320 -15.526 1.00 55.44 H new ATOM 0 HB2 LYS A 13 12.797 -11.774 -16.344 1.00 74.35 H new ATOM 0 HB3 LYS A 13 11.632 -11.847 -15.037 1.00 74.35 H new ATOM 0 HG2 LYS A 13 10.602 -12.534 -17.193 1.00 70.32 H new ATOM 0 HG3 LYS A 13 9.813 -11.109 -16.544 1.00 70.32 H new ATOM 0 HD2 LYS A 13 11.252 -9.686 -18.102 1.00 31.12 H new ATOM 0 HD3 LYS A 13 11.861 -11.166 -18.816 1.00 31.12 H new ATOM 0 HE2 LYS A 13 8.928 -10.309 -18.793 1.00 60.33 H new ATOM 0 HE3 LYS A 13 10.017 -10.137 -20.156 1.00 60.33 H new ATOM 0 HZ1 LYS A 13 8.645 -12.098 -20.373 1.00 73.12 H new ATOM 0 HZ2 LYS A 13 10.276 -12.545 -20.219 1.00 73.12 H new ATOM 0 HZ3 LYS A 13 9.221 -12.712 -18.899 1.00 73.12 H new ATOM 232 N ALA A 14 14.251 -9.571 -14.213 1.00 53.13 N ATOM 233 CA ALA A 14 15.091 -9.284 -13.031 1.00 24.32 C ATOM 234 C ALA A 14 14.808 -7.867 -12.478 1.00 11.13 C ATOM 235 O ALA A 14 14.626 -7.693 -11.266 1.00 31.13 O ATOM 236 CB ALA A 14 16.583 -9.442 -13.392 1.00 41.25 C ATOM 0 H ALA A 14 14.793 -9.691 -15.068 1.00 53.13 H new ATOM 0 HA ALA A 14 14.841 -10.001 -12.249 1.00 24.32 H new ATOM 0 HB1 ALA A 14 17.194 -9.229 -12.515 1.00 41.25 H new ATOM 0 HB2 ALA A 14 16.771 -10.463 -13.725 1.00 41.25 H new ATOM 0 HB3 ALA A 14 16.840 -8.746 -14.191 1.00 41.25 H new ATOM 242 N ALA A 15 14.812 -6.854 -13.376 1.00 23.12 N ATOM 243 CA ALA A 15 14.390 -5.471 -13.043 1.00 41.31 C ATOM 244 C ALA A 15 12.984 -5.404 -12.403 1.00 72.10 C ATOM 245 O ALA A 15 12.811 -4.733 -11.384 1.00 5.53 O ATOM 246 CB ALA A 15 14.442 -4.584 -14.299 1.00 70.53 C ATOM 0 H ALA A 15 15.106 -6.970 -14.346 1.00 23.12 H new ATOM 0 HA ALA A 15 15.093 -5.100 -12.297 1.00 41.31 H new ATOM 0 HB1 ALA A 15 14.130 -3.572 -14.043 1.00 70.53 H new ATOM 0 HB2 ALA A 15 15.460 -4.563 -14.688 1.00 70.53 H new ATOM 0 HB3 ALA A 15 13.772 -4.988 -15.058 1.00 70.53 H new ATOM 252 N ILE A 16 11.990 -6.078 -13.030 1.00 33.43 N ATOM 253 CA ILE A 16 10.602 -6.157 -12.502 1.00 24.53 C ATOM 254 C ILE A 16 10.543 -6.679 -11.038 1.00 71.20 C ATOM 255 O ILE A 16 9.998 -5.994 -10.178 1.00 0.41 O ATOM 256 CB ILE A 16 9.676 -7.038 -13.441 1.00 2.30 C ATOM 257 CG1 ILE A 16 9.548 -6.399 -14.866 1.00 21.31 C ATOM 258 CG2 ILE A 16 8.268 -7.288 -12.827 1.00 2.33 C ATOM 259 CD1 ILE A 16 8.916 -5.008 -14.903 1.00 32.14 C ATOM 0 H ILE A 16 12.123 -6.579 -13.908 1.00 33.43 H new ATOM 0 HA ILE A 16 10.222 -5.135 -12.495 1.00 24.53 H new ATOM 0 HB ILE A 16 10.163 -8.009 -13.534 1.00 2.30 H new ATOM 0 HG12 ILE A 16 10.541 -6.341 -15.311 1.00 21.31 H new ATOM 0 HG13 ILE A 16 8.957 -7.066 -15.493 1.00 21.31 H new ATOM 0 HG21 ILE A 16 7.676 -7.896 -13.511 1.00 2.33 H new ATOM 0 HG22 ILE A 16 8.373 -7.810 -11.876 1.00 2.33 H new ATOM 0 HG23 ILE A 16 7.768 -6.334 -12.664 1.00 2.33 H new ATOM 0 HD11 ILE A 16 8.873 -4.655 -15.933 1.00 32.14 H new ATOM 0 HD12 ILE A 16 7.907 -5.056 -14.494 1.00 32.14 H new ATOM 0 HD13 ILE A 16 9.516 -4.320 -14.308 1.00 32.14 H new ATOM 271 N LYS A 17 11.134 -7.859 -10.751 1.00 4.35 N ATOM 272 CA LYS A 17 11.057 -8.484 -9.394 1.00 41.34 C ATOM 273 C LYS A 17 11.801 -7.652 -8.296 1.00 63.44 C ATOM 274 O LYS A 17 11.406 -7.669 -7.120 1.00 12.05 O ATOM 275 CB LYS A 17 11.562 -9.956 -9.439 1.00 3.43 C ATOM 276 CG LYS A 17 13.048 -10.132 -9.838 1.00 44.01 C ATOM 277 CD LYS A 17 13.446 -11.604 -10.133 1.00 72.23 C ATOM 278 CE LYS A 17 12.638 -12.228 -11.290 1.00 20.14 C ATOM 279 NZ LYS A 17 13.176 -13.551 -11.706 1.00 70.41 N ATOM 0 H LYS A 17 11.668 -8.402 -11.429 1.00 4.35 H new ATOM 0 HA LYS A 17 10.006 -8.489 -9.104 1.00 41.34 H new ATOM 0 HB2 LYS A 17 11.410 -10.405 -8.458 1.00 3.43 H new ATOM 0 HB3 LYS A 17 10.945 -10.514 -10.144 1.00 3.43 H new ATOM 0 HG2 LYS A 17 13.252 -9.526 -10.721 1.00 44.01 H new ATOM 0 HG3 LYS A 17 13.678 -9.749 -9.036 1.00 44.01 H new ATOM 0 HD2 LYS A 17 14.508 -11.646 -10.375 1.00 72.23 H new ATOM 0 HD3 LYS A 17 13.301 -12.201 -9.233 1.00 72.23 H new ATOM 0 HE2 LYS A 17 11.598 -12.341 -10.984 1.00 20.14 H new ATOM 0 HE3 LYS A 17 12.647 -11.550 -12.143 1.00 20.14 H new ATOM 0 HZ1 LYS A 17 12.601 -13.930 -12.485 1.00 70.41 H new ATOM 0 HZ2 LYS A 17 14.160 -13.441 -12.024 1.00 70.41 H new ATOM 0 HZ3 LYS A 17 13.144 -14.208 -10.900 1.00 70.41 H new ATOM 293 N THR A 18 12.879 -6.937 -8.688 1.00 73.21 N ATOM 294 CA THR A 18 13.603 -5.987 -7.789 1.00 61.15 C ATOM 295 C THR A 18 12.747 -4.717 -7.494 1.00 63.43 C ATOM 296 O THR A 18 12.660 -4.258 -6.349 1.00 1.31 O ATOM 297 CB THR A 18 14.982 -5.571 -8.421 1.00 25.45 C ATOM 298 OG1 THR A 18 15.745 -6.749 -8.742 1.00 65.31 O ATOM 299 CG2 THR A 18 15.820 -4.672 -7.487 1.00 41.42 C ATOM 0 H THR A 18 13.275 -6.995 -9.626 1.00 73.21 H new ATOM 0 HA THR A 18 13.784 -6.501 -6.845 1.00 61.15 H new ATOM 0 HB THR A 18 14.757 -4.997 -9.320 1.00 25.45 H new ATOM 0 HG1 THR A 18 15.433 -7.119 -9.594 1.00 65.31 H new ATOM 0 HG21 THR A 18 16.760 -4.416 -7.975 1.00 41.42 H new ATOM 0 HG22 THR A 18 15.266 -3.760 -7.267 1.00 41.42 H new ATOM 0 HG23 THR A 18 16.026 -5.204 -6.558 1.00 41.42 H new ATOM 307 N LEU A 19 12.203 -4.122 -8.573 1.00 63.34 N ATOM 308 CA LEU A 19 11.133 -3.071 -8.507 1.00 11.41 C ATOM 309 C LEU A 19 9.999 -3.437 -7.497 1.00 62.01 C ATOM 310 O LEU A 19 9.554 -2.577 -6.727 1.00 51.54 O ATOM 311 CB LEU A 19 10.576 -2.840 -9.954 1.00 11.11 C ATOM 312 CG LEU A 19 9.589 -1.633 -10.217 1.00 32.32 C ATOM 313 CD1 LEU A 19 9.612 -1.216 -11.705 1.00 41.11 C ATOM 314 CD2 LEU A 19 8.126 -1.940 -9.802 1.00 1.14 C ATOM 0 H LEU A 19 12.485 -4.348 -9.527 1.00 63.34 H new ATOM 0 HA LEU A 19 11.567 -2.145 -8.130 1.00 11.41 H new ATOM 0 HB2 LEU A 19 11.431 -2.716 -10.619 1.00 11.11 H new ATOM 0 HB3 LEU A 19 10.066 -3.754 -10.259 1.00 11.11 H new ATOM 0 HG LEU A 19 9.948 -0.816 -9.592 1.00 32.32 H new ATOM 0 HD11 LEU A 19 8.925 -0.384 -11.860 1.00 41.11 H new ATOM 0 HD12 LEU A 19 10.621 -0.910 -11.982 1.00 41.11 H new ATOM 0 HD13 LEU A 19 9.306 -2.059 -12.324 1.00 41.11 H new ATOM 0 HD21 LEU A 19 7.500 -1.072 -10.008 1.00 1.14 H new ATOM 0 HD22 LEU A 19 7.759 -2.795 -10.369 1.00 1.14 H new ATOM 0 HD23 LEU A 19 8.090 -2.169 -8.737 1.00 1.14 H new ATOM 326 N ILE A 20 9.551 -4.711 -7.506 1.00 14.43 N ATOM 327 CA ILE A 20 8.529 -5.231 -6.552 1.00 70.25 C ATOM 328 C ILE A 20 9.070 -5.246 -5.088 1.00 53.23 C ATOM 329 O ILE A 20 8.324 -4.986 -4.137 1.00 62.42 O ATOM 330 CB ILE A 20 8.054 -6.682 -6.966 1.00 30.02 C ATOM 331 CG1 ILE A 20 7.532 -6.693 -8.436 1.00 24.53 C ATOM 332 CG2 ILE A 20 6.973 -7.235 -6.003 1.00 10.35 C ATOM 333 CD1 ILE A 20 7.229 -8.071 -8.998 1.00 72.40 C ATOM 0 H ILE A 20 9.882 -5.411 -8.170 1.00 14.43 H new ATOM 0 HA ILE A 20 7.675 -4.556 -6.595 1.00 70.25 H new ATOM 0 HB ILE A 20 8.922 -7.338 -6.896 1.00 30.02 H new ATOM 0 HG12 ILE A 20 6.627 -6.088 -8.489 1.00 24.53 H new ATOM 0 HG13 ILE A 20 8.274 -6.212 -9.073 1.00 24.53 H new ATOM 0 HG21 ILE A 20 6.676 -8.233 -6.324 1.00 10.35 H new ATOM 0 HG22 ILE A 20 7.377 -7.285 -4.992 1.00 10.35 H new ATOM 0 HG23 ILE A 20 6.104 -6.576 -6.014 1.00 10.35 H new ATOM 0 HD11 ILE A 20 6.873 -7.975 -10.024 1.00 72.40 H new ATOM 0 HD12 ILE A 20 8.135 -8.677 -8.984 1.00 72.40 H new ATOM 0 HD13 ILE A 20 6.462 -8.551 -8.391 1.00 72.40 H new ATOM 345 N SER A 21 10.377 -5.545 -4.928 1.00 5.54 N ATOM 346 CA SER A 21 11.047 -5.585 -3.599 1.00 73.30 C ATOM 347 C SER A 21 11.134 -4.176 -2.945 1.00 43.32 C ATOM 348 O SER A 21 10.964 -4.051 -1.729 1.00 12.30 O ATOM 349 CB SER A 21 12.457 -6.215 -3.713 1.00 24.04 C ATOM 350 OG SER A 21 13.087 -6.350 -2.441 1.00 53.14 O ATOM 0 H SER A 21 10.998 -5.765 -5.707 1.00 5.54 H new ATOM 0 HA SER A 21 10.433 -6.210 -2.950 1.00 73.30 H new ATOM 0 HB2 SER A 21 12.379 -7.195 -4.185 1.00 24.04 H new ATOM 0 HB3 SER A 21 13.078 -5.597 -4.362 1.00 24.04 H new ATOM 0 HG SER A 21 13.973 -6.752 -2.556 1.00 53.14 H new ATOM 356 N ALA A 22 11.460 -3.130 -3.740 1.00 30.24 N ATOM 357 CA ALA A 22 11.360 -1.706 -3.296 1.00 64.42 C ATOM 358 C ALA A 22 9.893 -1.297 -2.977 1.00 63.41 C ATOM 359 O ALA A 22 9.621 -0.616 -1.988 1.00 22.54 O ATOM 360 CB ALA A 22 11.951 -0.792 -4.384 1.00 44.50 C ATOM 0 H ALA A 22 11.796 -3.239 -4.697 1.00 30.24 H new ATOM 0 HA ALA A 22 11.929 -1.595 -2.373 1.00 64.42 H new ATOM 0 HB1 ALA A 22 11.880 0.248 -4.064 1.00 44.50 H new ATOM 0 HB2 ALA A 22 12.997 -1.051 -4.548 1.00 44.50 H new ATOM 0 HB3 ALA A 22 11.395 -0.925 -5.312 1.00 44.50 H new ATOM 366 N ALA A 23 8.997 -1.693 -3.892 1.00 42.14 N ATOM 367 CA ALA A 23 7.518 -1.591 -3.690 1.00 13.24 C ATOM 368 C ALA A 23 7.066 -2.190 -2.312 1.00 24.41 C ATOM 369 O ALA A 23 6.084 -1.728 -1.731 1.00 31.24 O ATOM 370 CB ALA A 23 6.753 -2.240 -4.853 1.00 1.23 C ATOM 0 H ALA A 23 9.260 -2.093 -4.793 1.00 42.14 H new ATOM 0 HA ALA A 23 7.272 -0.529 -3.673 1.00 13.24 H new ATOM 0 HB1 ALA A 23 5.681 -2.150 -4.678 1.00 1.23 H new ATOM 0 HB2 ALA A 23 7.012 -1.737 -5.785 1.00 1.23 H new ATOM 0 HB3 ALA A 23 7.022 -3.294 -4.923 1.00 1.23 H new ATOM 376 N TYR A 24 7.794 -3.213 -1.800 1.00 73.10 N ATOM 377 CA TYR A 24 7.638 -3.697 -0.396 1.00 54.23 C ATOM 378 C TYR A 24 8.354 -2.767 0.626 1.00 72.14 C ATOM 379 O TYR A 24 7.777 -2.402 1.655 1.00 41.03 O ATOM 380 CB TYR A 24 8.194 -5.139 -0.225 1.00 51.12 C ATOM 381 CG TYR A 24 7.478 -6.215 -1.054 1.00 70.22 C ATOM 382 CD1 TYR A 24 6.083 -6.279 -1.095 1.00 14.24 C ATOM 383 CD2 TYR A 24 8.192 -7.174 -1.774 1.00 61.25 C ATOM 384 CE1 TYR A 24 5.433 -7.250 -1.825 1.00 64.01 C ATOM 385 CE2 TYR A 24 7.542 -8.146 -2.507 1.00 0.31 C ATOM 386 CZ TYR A 24 6.161 -8.181 -2.530 1.00 14.41 C ATOM 387 OH TYR A 24 5.504 -9.151 -3.268 1.00 25.12 O ATOM 0 H TYR A 24 8.497 -3.723 -2.335 1.00 73.10 H new ATOM 0 HA TYR A 24 6.567 -3.690 -0.194 1.00 54.23 H new ATOM 0 HB2 TYR A 24 9.250 -5.139 -0.493 1.00 51.12 H new ATOM 0 HB3 TYR A 24 8.133 -5.413 0.828 1.00 51.12 H new ATOM 0 HD1 TYR A 24 5.503 -5.553 -0.544 1.00 14.24 H new ATOM 0 HD2 TYR A 24 9.272 -7.155 -1.757 1.00 61.25 H new ATOM 0 HE1 TYR A 24 4.354 -7.280 -1.844 1.00 64.01 H new ATOM 0 HE2 TYR A 24 8.111 -8.877 -3.061 1.00 0.31 H new ATOM 0 HH TYR A 24 4.659 -9.380 -2.828 1.00 25.12 H new ATOM 397 N ARG A 25 9.618 -2.394 0.329 1.00 44.11 N ATOM 398 CA ARG A 25 10.521 -1.666 1.270 1.00 21.50 C ATOM 399 C ARG A 25 10.038 -0.202 1.548 1.00 22.12 C ATOM 400 O ARG A 25 10.496 0.441 2.495 1.00 44.21 O ATOM 401 CB ARG A 25 11.989 -1.698 0.685 1.00 54.34 C ATOM 402 CG ARG A 25 13.145 -1.892 1.715 1.00 34.13 C ATOM 403 CD ARG A 25 13.326 -0.710 2.688 1.00 62.21 C ATOM 404 NE ARG A 25 14.360 -0.958 3.701 1.00 15.24 N ATOM 405 CZ ARG A 25 14.538 -0.249 4.798 1.00 72.32 C ATOM 406 NH1 ARG A 25 13.772 0.767 5.086 1.00 1.13 N ATOM 407 NH2 ARG A 25 15.486 -0.574 5.605 1.00 71.34 N ATOM 0 H ARG A 25 10.051 -2.587 -0.574 1.00 44.11 H new ATOM 0 HA ARG A 25 10.502 -2.168 2.237 1.00 21.50 H new ATOM 0 HB2 ARG A 25 12.047 -2.503 -0.048 1.00 54.34 H new ATOM 0 HB3 ARG A 25 12.163 -0.765 0.149 1.00 54.34 H new ATOM 0 HG2 ARG A 25 12.955 -2.797 2.291 1.00 34.13 H new ATOM 0 HG3 ARG A 25 14.078 -2.049 1.173 1.00 34.13 H new ATOM 0 HD2 ARG A 25 13.586 0.184 2.121 1.00 62.21 H new ATOM 0 HD3 ARG A 25 12.378 -0.507 3.186 1.00 62.21 H new ATOM 0 HE ARG A 25 14.992 -1.743 3.543 1.00 15.24 H new ATOM 0 HH11 ARG A 25 13.014 1.029 4.456 1.00 1.13 H new ATOM 0 HH12 ARG A 25 13.931 1.299 5.941 1.00 1.13 H new ATOM 0 HH21 ARG A 25 16.087 -1.370 5.392 1.00 71.34 H new ATOM 0 HH22 ARG A 25 15.637 -0.035 6.458 1.00 71.34 H new ATOM 421 N GLN A 26 9.129 0.323 0.716 1.00 2.44 N ATOM 422 CA GLN A 26 8.532 1.667 0.918 1.00 32.32 C ATOM 423 C GLN A 26 7.171 1.582 1.662 1.00 41.12 C ATOM 424 O GLN A 26 6.853 2.450 2.485 1.00 71.43 O ATOM 425 CB GLN A 26 8.390 2.389 -0.456 1.00 50.44 C ATOM 426 CG GLN A 26 9.744 2.753 -1.119 1.00 25.35 C ATOM 427 CD GLN A 26 10.567 3.804 -0.355 1.00 44.43 C ATOM 428 OE1 GLN A 26 11.793 3.772 -0.358 1.00 41.20 O ATOM 429 NE2 GLN A 26 9.911 4.785 0.248 1.00 51.11 N ATOM 0 H GLN A 26 8.783 -0.161 -0.113 1.00 2.44 H new ATOM 0 HA GLN A 26 9.198 2.252 1.552 1.00 32.32 H new ATOM 0 HB2 GLN A 26 7.825 1.750 -1.134 1.00 50.44 H new ATOM 0 HB3 GLN A 26 7.808 3.300 -0.318 1.00 50.44 H new ATOM 0 HG2 GLN A 26 10.340 1.846 -1.219 1.00 25.35 H new ATOM 0 HG3 GLN A 26 9.553 3.122 -2.127 1.00 25.35 H new ATOM 0 HE21 GLN A 26 8.891 4.796 0.241 1.00 51.11 H new ATOM 0 HE22 GLN A 26 10.426 5.529 0.719 1.00 51.11 H new ATOM 438 N ILE A 27 6.385 0.517 1.384 1.00 44.14 N ATOM 439 CA ILE A 27 5.046 0.311 2.000 1.00 21.24 C ATOM 440 C ILE A 27 5.164 -0.450 3.344 1.00 44.12 C ATOM 441 O ILE A 27 4.905 0.117 4.402 1.00 13.43 O ATOM 442 CB ILE A 27 4.081 -0.431 0.996 1.00 13.11 C ATOM 443 CG1 ILE A 27 3.945 0.395 -0.327 1.00 22.33 C ATOM 444 CG2 ILE A 27 2.691 -0.721 1.622 1.00 70.35 C ATOM 445 CD1 ILE A 27 3.449 1.828 -0.147 1.00 40.23 C ATOM 0 H ILE A 27 6.654 -0.220 0.733 1.00 44.14 H new ATOM 0 HA ILE A 27 4.614 1.288 2.217 1.00 21.24 H new ATOM 0 HB ILE A 27 4.524 -1.399 0.764 1.00 13.11 H new ATOM 0 HG12 ILE A 27 4.916 0.422 -0.822 1.00 22.33 H new ATOM 0 HG13 ILE A 27 3.261 -0.129 -0.995 1.00 22.33 H new ATOM 0 HG21 ILE A 27 2.063 -1.232 0.893 1.00 70.35 H new ATOM 0 HG22 ILE A 27 2.813 -1.352 2.502 1.00 70.35 H new ATOM 0 HG23 ILE A 27 2.219 0.218 1.912 1.00 70.35 H new ATOM 0 HD11 ILE A 27 3.388 2.317 -1.119 1.00 40.23 H new ATOM 0 HD12 ILE A 27 2.462 1.816 0.315 1.00 40.23 H new ATOM 0 HD13 ILE A 27 4.142 2.375 0.492 1.00 40.23 H new ATOM 457 N PHE A 28 5.594 -1.727 3.296 1.00 14.51 N ATOM 458 CA PHE A 28 5.860 -2.549 4.515 1.00 22.22 C ATOM 459 C PHE A 28 7.085 -2.003 5.309 1.00 15.41 C ATOM 460 O PHE A 28 7.278 -2.339 6.484 1.00 65.04 O ATOM 461 CB PHE A 28 6.114 -4.032 4.124 1.00 25.43 C ATOM 462 CG PHE A 28 4.954 -4.724 3.402 1.00 72.44 C ATOM 463 CD1 PHE A 28 4.695 -4.465 2.055 1.00 63.41 C ATOM 464 CD2 PHE A 28 4.140 -5.649 4.061 1.00 12.34 C ATOM 465 CE1 PHE A 28 3.664 -5.100 1.394 1.00 22.14 C ATOM 466 CE2 PHE A 28 3.108 -6.281 3.394 1.00 3.42 C ATOM 467 CZ PHE A 28 2.870 -6.006 2.063 1.00 54.42 C ATOM 0 H PHE A 28 5.769 -2.223 2.422 1.00 14.51 H new ATOM 0 HA PHE A 28 4.978 -2.488 5.153 1.00 22.22 H new ATOM 0 HB2 PHE A 28 6.997 -4.077 3.486 1.00 25.43 H new ATOM 0 HB3 PHE A 28 6.346 -4.595 5.028 1.00 25.43 H new ATOM 0 HD1 PHE A 28 5.311 -3.756 1.522 1.00 63.41 H new ATOM 0 HD2 PHE A 28 4.319 -5.872 5.102 1.00 12.34 H new ATOM 0 HE1 PHE A 28 3.479 -4.887 0.352 1.00 22.14 H new ATOM 0 HE2 PHE A 28 2.486 -6.993 3.916 1.00 3.42 H new ATOM 0 HZ PHE A 28 2.061 -6.501 1.546 1.00 54.42 H new ATOM 477 N GLU A 29 7.899 -1.176 4.610 1.00 74.13 N ATOM 478 CA GLU A 29 9.107 -0.502 5.144 1.00 21.21 C ATOM 479 C GLU A 29 10.199 -1.517 5.594 1.00 73.32 C ATOM 480 O GLU A 29 11.007 -1.251 6.488 1.00 22.41 O ATOM 481 CB GLU A 29 8.724 0.514 6.268 1.00 15.14 C ATOM 482 CG GLU A 29 9.807 1.576 6.566 1.00 41.55 C ATOM 483 CD GLU A 29 9.451 2.490 7.745 1.00 21.33 C ATOM 484 OE1 GLU A 29 8.662 3.441 7.554 1.00 3.43 O ATOM 485 OE2 GLU A 29 9.965 2.273 8.867 1.00 25.50 O ATOM 0 H GLU A 29 7.728 -0.953 3.630 1.00 74.13 H new ATOM 0 HA GLU A 29 9.556 0.070 4.332 1.00 21.21 H new ATOM 0 HB2 GLU A 29 7.803 1.022 5.983 1.00 15.14 H new ATOM 0 HB3 GLU A 29 8.513 -0.038 7.184 1.00 15.14 H new ATOM 0 HG2 GLU A 29 10.751 1.073 6.777 1.00 41.55 H new ATOM 0 HG3 GLU A 29 9.963 2.186 5.676 1.00 41.55 H new ATOM 492 N ARG A 30 10.245 -2.666 4.908 1.00 61.22 N ATOM 493 CA ARG A 30 11.167 -3.771 5.245 1.00 22.23 C ATOM 494 C ARG A 30 11.518 -4.619 4.009 1.00 45.23 C ATOM 495 O ARG A 30 10.773 -4.655 3.018 1.00 64.13 O ATOM 496 CB ARG A 30 10.543 -4.679 6.345 1.00 34.12 C ATOM 497 CG ARG A 30 9.150 -5.254 5.985 1.00 42.11 C ATOM 498 CD ARG A 30 8.642 -6.289 7.005 1.00 34.01 C ATOM 499 NE ARG A 30 7.251 -6.706 6.744 1.00 52.22 N ATOM 500 CZ ARG A 30 6.507 -7.414 7.570 1.00 32.11 C ATOM 501 NH1 ARG A 30 6.995 -7.919 8.667 1.00 71.24 N ATOM 502 NH2 ARG A 30 5.267 -7.632 7.291 1.00 5.11 N ATOM 0 H ARG A 30 9.648 -2.861 4.104 1.00 61.22 H new ATOM 0 HA ARG A 30 12.088 -3.324 5.620 1.00 22.23 H new ATOM 0 HB2 ARG A 30 11.224 -5.507 6.545 1.00 34.12 H new ATOM 0 HB3 ARG A 30 10.458 -4.105 7.268 1.00 34.12 H new ATOM 0 HG2 ARG A 30 8.432 -4.436 5.918 1.00 42.11 H new ATOM 0 HG3 ARG A 30 9.198 -5.717 5.000 1.00 42.11 H new ATOM 0 HD2 ARG A 30 9.290 -7.165 6.982 1.00 34.01 H new ATOM 0 HD3 ARG A 30 8.709 -5.868 8.008 1.00 34.01 H new ATOM 0 HE ARG A 30 6.833 -6.425 5.857 1.00 52.22 H new ATOM 0 HH11 ARG A 30 7.976 -7.770 8.905 1.00 71.24 H new ATOM 0 HH12 ARG A 30 6.396 -8.463 9.288 1.00 71.24 H new ATOM 0 HH21 ARG A 30 4.864 -7.257 6.432 1.00 5.11 H new ATOM 0 HH22 ARG A 30 4.689 -8.180 7.929 1.00 5.11 H new ATOM 516 N ASP A 31 12.670 -5.292 4.099 1.00 41.53 N ATOM 517 CA ASP A 31 13.086 -6.316 3.142 1.00 54.30 C ATOM 518 C ASP A 31 12.288 -7.617 3.410 1.00 53.12 C ATOM 519 O ASP A 31 12.482 -8.273 4.445 1.00 33.11 O ATOM 520 CB ASP A 31 14.614 -6.558 3.280 1.00 14.12 C ATOM 521 CG ASP A 31 15.158 -7.577 2.264 1.00 4.34 C ATOM 522 OD1 ASP A 31 15.371 -7.199 1.096 1.00 51.34 O ATOM 523 OD2 ASP A 31 15.380 -8.754 2.627 1.00 65.21 O ATOM 0 H ASP A 31 13.345 -5.137 4.848 1.00 41.53 H new ATOM 0 HA ASP A 31 12.881 -5.988 2.123 1.00 54.30 H new ATOM 0 HB2 ASP A 31 15.139 -5.611 3.152 1.00 14.12 H new ATOM 0 HB3 ASP A 31 14.831 -6.909 4.289 1.00 14.12 H new ATOM 528 N ILE A 32 11.353 -7.946 2.507 1.00 65.04 N ATOM 529 CA ILE A 32 10.572 -9.199 2.586 1.00 71.14 C ATOM 530 C ILE A 32 11.307 -10.311 1.803 1.00 1.50 C ATOM 531 O ILE A 32 11.806 -10.069 0.694 1.00 31.22 O ATOM 532 CB ILE A 32 9.097 -9.017 2.043 1.00 72.43 C ATOM 533 CG1 ILE A 32 8.353 -7.914 2.866 1.00 73.51 C ATOM 534 CG2 ILE A 32 8.306 -10.357 2.057 1.00 3.31 C ATOM 535 CD1 ILE A 32 6.898 -7.687 2.482 1.00 22.54 C ATOM 0 H ILE A 32 11.115 -7.360 1.707 1.00 65.04 H new ATOM 0 HA ILE A 32 10.489 -9.482 3.635 1.00 71.14 H new ATOM 0 HB ILE A 32 9.158 -8.696 1.003 1.00 72.43 H new ATOM 0 HG12 ILE A 32 8.396 -8.181 3.922 1.00 73.51 H new ATOM 0 HG13 ILE A 32 8.892 -6.974 2.753 1.00 73.51 H new ATOM 0 HG21 ILE A 32 7.298 -10.189 1.677 1.00 3.31 H new ATOM 0 HG22 ILE A 32 8.815 -11.086 1.427 1.00 3.31 H new ATOM 0 HG23 ILE A 32 8.250 -10.736 3.078 1.00 3.31 H new ATOM 0 HD11 ILE A 32 6.474 -6.904 3.110 1.00 22.54 H new ATOM 0 HD12 ILE A 32 6.841 -7.384 1.437 1.00 22.54 H new ATOM 0 HD13 ILE A 32 6.336 -8.610 2.624 1.00 22.54 H new ATOM 547 N ALA A 33 11.388 -11.513 2.410 1.00 12.41 N ATOM 548 CA ALA A 33 11.984 -12.705 1.786 1.00 14.15 C ATOM 549 C ALA A 33 11.276 -13.046 0.438 1.00 45.40 C ATOM 550 O ALA A 33 10.071 -13.317 0.447 1.00 35.23 O ATOM 551 CB ALA A 33 11.891 -13.883 2.764 1.00 74.45 C ATOM 0 H ALA A 33 11.038 -11.681 3.353 1.00 12.41 H new ATOM 0 HA ALA A 33 13.031 -12.504 1.561 1.00 14.15 H new ATOM 0 HB1 ALA A 33 12.331 -14.770 2.308 1.00 74.45 H new ATOM 0 HB2 ALA A 33 12.431 -13.640 3.679 1.00 74.45 H new ATOM 0 HB3 ALA A 33 10.845 -14.078 3.001 1.00 74.45 H new ATOM 557 N PRO A 34 12.012 -13.018 -0.733 1.00 22.00 N ATOM 558 CA PRO A 34 11.420 -13.221 -2.098 1.00 51.10 C ATOM 559 C PRO A 34 10.475 -14.444 -2.215 1.00 42.12 C ATOM 560 O PRO A 34 9.428 -14.369 -2.866 1.00 74.03 O ATOM 561 CB PRO A 34 12.668 -13.408 -2.993 1.00 72.55 C ATOM 562 CG PRO A 34 13.726 -12.593 -2.310 1.00 61.32 C ATOM 563 CD PRO A 34 13.476 -12.759 -0.821 1.00 70.41 C ATOM 0 HA PRO A 34 10.780 -12.383 -2.374 1.00 51.10 H new ATOM 0 HB2 PRO A 34 12.955 -14.457 -3.064 1.00 72.55 H new ATOM 0 HB3 PRO A 34 12.487 -13.057 -4.009 1.00 72.55 H new ATOM 0 HG2 PRO A 34 14.723 -12.940 -2.581 1.00 61.32 H new ATOM 0 HG3 PRO A 34 13.663 -11.545 -2.603 1.00 61.32 H new ATOM 0 HD2 PRO A 34 14.054 -13.586 -0.408 1.00 70.41 H new ATOM 0 HD3 PRO A 34 13.758 -11.864 -0.266 1.00 70.41 H new ATOM 571 N TYR A 35 10.863 -15.554 -1.559 1.00 53.44 N ATOM 572 CA TYR A 35 10.081 -16.813 -1.551 1.00 52.23 C ATOM 573 C TYR A 35 8.735 -16.686 -0.776 1.00 61.13 C ATOM 574 O TYR A 35 7.718 -17.216 -1.221 1.00 11.21 O ATOM 575 CB TYR A 35 10.941 -18.001 -1.031 1.00 61.32 C ATOM 576 CG TYR A 35 11.671 -17.774 0.310 1.00 71.44 C ATOM 577 CD1 TYR A 35 12.921 -17.141 0.351 1.00 35.01 C ATOM 578 CD2 TYR A 35 11.123 -18.200 1.522 1.00 75.14 C ATOM 579 CE1 TYR A 35 13.584 -16.944 1.542 1.00 4.33 C ATOM 580 CE2 TYR A 35 11.788 -18.000 2.715 1.00 23.40 C ATOM 581 CZ TYR A 35 13.014 -17.374 2.719 1.00 42.33 C ATOM 582 OH TYR A 35 13.676 -17.172 3.905 1.00 13.44 O ATOM 0 H TYR A 35 11.727 -15.607 -1.019 1.00 53.44 H new ATOM 0 HA TYR A 35 9.810 -17.023 -2.586 1.00 52.23 H new ATOM 0 HB2 TYR A 35 10.295 -18.873 -0.927 1.00 61.32 H new ATOM 0 HB3 TYR A 35 11.685 -18.244 -1.790 1.00 61.32 H new ATOM 0 HD1 TYR A 35 13.373 -16.801 -0.569 1.00 35.01 H new ATOM 0 HD2 TYR A 35 10.163 -18.694 1.526 1.00 75.14 H new ATOM 0 HE1 TYR A 35 14.547 -16.454 1.553 1.00 4.33 H new ATOM 0 HE2 TYR A 35 11.348 -18.334 3.643 1.00 23.40 H new ATOM 0 HH TYR A 35 13.141 -17.531 4.643 1.00 13.44 H new ATOM 592 N ILE A 36 8.733 -15.965 0.361 1.00 11.13 N ATOM 593 CA ILE A 36 7.489 -15.661 1.131 1.00 31.32 C ATOM 594 C ILE A 36 6.563 -14.715 0.319 1.00 15.05 C ATOM 595 O ILE A 36 5.349 -14.933 0.219 1.00 53.34 O ATOM 596 CB ILE A 36 7.834 -15.016 2.537 1.00 55.44 C ATOM 597 CG1 ILE A 36 8.630 -16.034 3.420 1.00 11.22 C ATOM 598 CG2 ILE A 36 6.565 -14.501 3.276 1.00 41.23 C ATOM 599 CD1 ILE A 36 9.060 -15.517 4.790 1.00 13.11 C ATOM 0 H ILE A 36 9.579 -15.576 0.777 1.00 11.13 H new ATOM 0 HA ILE A 36 6.964 -16.600 1.306 1.00 31.32 H new ATOM 0 HB ILE A 36 8.463 -14.145 2.355 1.00 55.44 H new ATOM 0 HG12 ILE A 36 8.016 -16.923 3.563 1.00 11.22 H new ATOM 0 HG13 ILE A 36 9.520 -16.346 2.873 1.00 11.22 H new ATOM 0 HG21 ILE A 36 6.853 -14.068 4.234 1.00 41.23 H new ATOM 0 HG22 ILE A 36 6.073 -13.742 2.668 1.00 41.23 H new ATOM 0 HG23 ILE A 36 5.880 -15.332 3.444 1.00 41.23 H new ATOM 0 HD11 ILE A 36 9.603 -16.299 5.320 1.00 13.11 H new ATOM 0 HD12 ILE A 36 9.706 -14.648 4.665 1.00 13.11 H new ATOM 0 HD13 ILE A 36 8.178 -15.234 5.365 1.00 13.11 H new ATOM 611 N ALA A 37 7.183 -13.684 -0.280 1.00 1.43 N ATOM 612 CA ALA A 37 6.494 -12.651 -1.084 1.00 72.14 C ATOM 613 C ALA A 37 5.798 -13.236 -2.340 1.00 1.14 C ATOM 614 O ALA A 37 4.707 -12.796 -2.715 1.00 12.23 O ATOM 615 CB ALA A 37 7.508 -11.578 -1.494 1.00 3.43 C ATOM 0 H ALA A 37 8.191 -13.540 -0.221 1.00 1.43 H new ATOM 0 HA ALA A 37 5.708 -12.217 -0.466 1.00 72.14 H new ATOM 0 HB1 ALA A 37 7.008 -10.812 -2.087 1.00 3.43 H new ATOM 0 HB2 ALA A 37 7.937 -11.123 -0.601 1.00 3.43 H new ATOM 0 HB3 ALA A 37 8.302 -12.034 -2.085 1.00 3.43 H new ATOM 621 N GLN A 38 6.439 -14.245 -2.963 1.00 31.35 N ATOM 622 CA GLN A 38 5.904 -14.890 -4.193 1.00 32.42 C ATOM 623 C GLN A 38 4.836 -15.955 -3.835 1.00 54.01 C ATOM 624 O GLN A 38 4.016 -16.313 -4.670 1.00 21.11 O ATOM 625 CB GLN A 38 7.031 -15.503 -5.067 1.00 51.52 C ATOM 626 CG GLN A 38 7.754 -16.707 -4.440 1.00 52.04 C ATOM 627 CD GLN A 38 8.901 -17.281 -5.278 1.00 3.11 C ATOM 628 OE1 GLN A 38 9.610 -16.447 -6.024 1.00 42.44 O flip ATOM 629 NE2 GLN A 38 9.174 -18.473 -5.227 1.00 32.10 N flip ATOM 0 H GLN A 38 7.325 -14.634 -2.641 1.00 31.35 H new ATOM 0 HA GLN A 38 5.427 -14.110 -4.787 1.00 32.42 H new ATOM 0 HB2 GLN A 38 6.604 -15.811 -6.021 1.00 51.52 H new ATOM 0 HB3 GLN A 38 7.766 -14.728 -5.282 1.00 51.52 H new ATOM 0 HG2 GLN A 38 8.148 -16.410 -3.468 1.00 52.04 H new ATOM 0 HG3 GLN A 38 7.024 -17.497 -4.260 1.00 52.04 H new ATOM 0 HE21 GLN A 38 8.616 -19.100 -4.647 1.00 32.10 H new ATOM 0 HE22 GLN A 38 9.959 -18.840 -5.765 1.00 32.10 H new ATOM 638 N ASN A 39 4.898 -16.492 -2.594 1.00 41.10 N ATOM 639 CA ASN A 39 3.880 -17.436 -2.067 1.00 24.00 C ATOM 640 C ASN A 39 2.573 -16.701 -1.676 1.00 72.15 C ATOM 641 O ASN A 39 1.476 -17.256 -1.832 1.00 23.44 O ATOM 642 CB ASN A 39 4.443 -18.238 -0.853 1.00 13.23 C ATOM 643 CG ASN A 39 5.420 -19.350 -1.252 1.00 61.45 C ATOM 644 OD1 ASN A 39 5.300 -19.955 -2.310 1.00 1.04 O ATOM 645 ND2 ASN A 39 6.394 -19.636 -0.408 1.00 73.22 N ATOM 0 H ASN A 39 5.648 -16.287 -1.934 1.00 41.10 H new ATOM 0 HA ASN A 39 3.640 -18.139 -2.864 1.00 24.00 H new ATOM 0 HB2 ASN A 39 4.947 -17.549 -0.175 1.00 13.23 H new ATOM 0 HB3 ASN A 39 3.612 -18.677 -0.301 1.00 13.23 H new ATOM 0 HD21 ASN A 39 7.063 -20.372 -0.632 1.00 73.22 H new ATOM 0 HD22 ASN A 39 6.477 -19.121 0.468 1.00 73.22 H new ATOM 652 N GLU A 40 2.692 -15.463 -1.153 1.00 11.44 N ATOM 653 CA GLU A 40 1.511 -14.636 -0.798 1.00 63.11 C ATOM 654 C GLU A 40 0.921 -13.945 -2.051 1.00 72.44 C ATOM 655 O GLU A 40 -0.230 -14.166 -2.429 1.00 13.43 O ATOM 656 CB GLU A 40 1.938 -13.544 0.234 1.00 42.41 C ATOM 657 CG GLU A 40 2.335 -14.069 1.628 1.00 75.54 C ATOM 658 CD GLU A 40 1.133 -14.590 2.434 1.00 22.14 C ATOM 659 OE1 GLU A 40 0.348 -13.760 2.933 1.00 15.01 O ATOM 660 OE2 GLU A 40 0.952 -15.821 2.559 1.00 54.54 O ATOM 0 H GLU A 40 3.588 -15.012 -0.966 1.00 11.44 H new ATOM 0 HA GLU A 40 0.750 -15.288 -0.369 1.00 63.11 H new ATOM 0 HB2 GLU A 40 2.779 -12.988 -0.179 1.00 42.41 H new ATOM 0 HB3 GLU A 40 1.116 -12.838 0.351 1.00 42.41 H new ATOM 0 HG2 GLU A 40 3.065 -14.870 1.515 1.00 75.54 H new ATOM 0 HG3 GLU A 40 2.822 -13.270 2.187 1.00 75.54 H new ATOM 667 N PHE A 41 1.739 -13.093 -2.672 1.00 11.25 N ATOM 668 CA PHE A 41 1.365 -12.368 -3.912 1.00 71.41 C ATOM 669 C PHE A 41 1.642 -13.196 -5.203 1.00 72.44 C ATOM 670 O PHE A 41 2.099 -12.648 -6.197 1.00 72.14 O ATOM 671 CB PHE A 41 2.098 -10.991 -3.920 1.00 30.52 C ATOM 672 CG PHE A 41 1.888 -10.188 -2.624 1.00 41.14 C ATOM 673 CD1 PHE A 41 0.686 -9.521 -2.380 1.00 24.31 C ATOM 674 CD2 PHE A 41 2.879 -10.138 -1.636 1.00 72.12 C ATOM 675 CE1 PHE A 41 0.488 -8.825 -1.200 1.00 24.52 C ATOM 676 CE2 PHE A 41 2.677 -9.446 -0.456 1.00 33.35 C ATOM 677 CZ PHE A 41 1.482 -8.792 -0.238 1.00 45.13 C ATOM 0 H PHE A 41 2.679 -12.879 -2.340 1.00 11.25 H new ATOM 0 HA PHE A 41 0.287 -12.204 -3.914 1.00 71.41 H new ATOM 0 HB2 PHE A 41 3.165 -11.155 -4.070 1.00 30.52 H new ATOM 0 HB3 PHE A 41 1.744 -10.403 -4.766 1.00 30.52 H new ATOM 0 HD1 PHE A 41 -0.099 -9.548 -3.121 1.00 24.31 H new ATOM 0 HD2 PHE A 41 3.817 -10.648 -1.798 1.00 72.12 H new ATOM 0 HE1 PHE A 41 -0.444 -8.307 -1.030 1.00 24.52 H new ATOM 0 HE2 PHE A 41 3.454 -9.418 0.294 1.00 33.35 H new ATOM 0 HZ PHE A 41 1.322 -8.254 0.685 1.00 45.13 H new ATOM 687 N SER A 42 1.291 -14.507 -5.200 1.00 22.25 N ATOM 688 CA SER A 42 1.485 -15.394 -6.391 1.00 14.41 C ATOM 689 C SER A 42 0.541 -15.021 -7.548 1.00 62.41 C ATOM 690 O SER A 42 0.989 -14.792 -8.679 1.00 22.25 O ATOM 691 CB SER A 42 1.252 -16.881 -6.015 1.00 34.52 C ATOM 692 OG SER A 42 1.348 -17.734 -7.149 1.00 43.05 O ATOM 0 H SER A 42 0.875 -14.977 -4.396 1.00 22.25 H new ATOM 0 HA SER A 42 2.514 -15.251 -6.720 1.00 14.41 H new ATOM 0 HB2 SER A 42 1.985 -17.186 -5.268 1.00 34.52 H new ATOM 0 HB3 SER A 42 0.268 -16.991 -5.560 1.00 34.52 H new ATOM 0 HG SER A 42 1.197 -18.662 -6.874 1.00 43.05 H new ATOM 698 N GLY A 43 -0.763 -14.928 -7.241 1.00 11.13 N ATOM 699 CA GLY A 43 -1.778 -14.593 -8.243 1.00 62.21 C ATOM 700 C GLY A 43 -1.817 -13.098 -8.537 1.00 31.41 C ATOM 701 O GLY A 43 -2.081 -12.688 -9.665 1.00 2.05 O ATOM 0 H GLY A 43 -1.136 -15.081 -6.304 1.00 11.13 H new ATOM 0 HA2 GLY A 43 -1.572 -15.139 -9.164 1.00 62.21 H new ATOM 0 HA3 GLY A 43 -2.757 -14.919 -7.891 1.00 62.21 H new ATOM 705 N TRP A 44 -1.562 -12.287 -7.497 1.00 64.44 N ATOM 706 CA TRP A 44 -1.554 -10.812 -7.585 1.00 3.32 C ATOM 707 C TRP A 44 -0.392 -10.266 -8.465 1.00 24.33 C ATOM 708 O TRP A 44 -0.592 -9.323 -9.241 1.00 3.14 O ATOM 709 CB TRP A 44 -1.515 -10.219 -6.149 1.00 11.30 C ATOM 710 CG TRP A 44 -1.731 -8.722 -6.063 1.00 62.02 C ATOM 711 CD1 TRP A 44 -0.933 -7.814 -5.422 1.00 50.15 C ATOM 712 CD2 TRP A 44 -2.828 -7.964 -6.625 1.00 30.00 C ATOM 713 NE1 TRP A 44 -1.454 -6.557 -5.555 1.00 53.44 N ATOM 714 CE2 TRP A 44 -2.613 -6.623 -6.283 1.00 25.44 C ATOM 715 CE3 TRP A 44 -3.968 -8.291 -7.384 1.00 72.44 C ATOM 716 CZ2 TRP A 44 -3.482 -5.613 -6.669 1.00 74.30 C ATOM 717 CZ3 TRP A 44 -4.830 -7.278 -7.764 1.00 65.43 C ATOM 718 CH2 TRP A 44 -4.584 -5.950 -7.402 1.00 12.51 C ATOM 0 H TRP A 44 -1.353 -12.637 -6.562 1.00 64.44 H new ATOM 0 HA TRP A 44 -2.469 -10.494 -8.085 1.00 3.32 H new ATOM 0 HB2 TRP A 44 -2.277 -10.715 -5.548 1.00 11.30 H new ATOM 0 HB3 TRP A 44 -0.550 -10.457 -5.701 1.00 11.30 H new ATOM 0 HD1 TRP A 44 -0.025 -8.055 -4.889 1.00 50.15 H new ATOM 0 HE1 TRP A 44 -1.045 -5.705 -5.173 1.00 53.44 H new ATOM 0 HE3 TRP A 44 -4.166 -9.315 -7.665 1.00 72.44 H new ATOM 0 HZ2 TRP A 44 -3.292 -4.585 -6.397 1.00 74.30 H new ATOM 0 HZ3 TRP A 44 -5.706 -7.516 -8.349 1.00 65.43 H new ATOM 0 HH2 TRP A 44 -5.276 -5.179 -7.707 1.00 12.51 H new ATOM 729 N GLU A 45 0.810 -10.872 -8.359 1.00 75.02 N ATOM 730 CA GLU A 45 1.996 -10.475 -9.166 1.00 54.43 C ATOM 731 C GLU A 45 1.821 -10.912 -10.644 1.00 54.43 C ATOM 732 O GLU A 45 2.346 -10.265 -11.554 1.00 24.51 O ATOM 733 CB GLU A 45 3.281 -11.084 -8.526 1.00 71.21 C ATOM 734 CG GLU A 45 4.646 -10.507 -8.991 1.00 24.54 C ATOM 735 CD GLU A 45 5.156 -11.026 -10.354 1.00 13.41 C ATOM 736 OE1 GLU A 45 5.513 -12.228 -10.438 1.00 71.24 O ATOM 737 OE2 GLU A 45 5.222 -10.243 -11.340 1.00 43.41 O ATOM 0 H GLU A 45 0.991 -11.645 -7.718 1.00 75.02 H new ATOM 0 HA GLU A 45 2.095 -9.389 -9.166 1.00 54.43 H new ATOM 0 HB2 GLU A 45 3.212 -10.960 -7.445 1.00 71.21 H new ATOM 0 HB3 GLU A 45 3.282 -12.156 -8.724 1.00 71.21 H new ATOM 0 HG2 GLU A 45 4.563 -9.421 -9.043 1.00 24.54 H new ATOM 0 HG3 GLU A 45 5.395 -10.734 -8.232 1.00 24.54 H new ATOM 744 N SER A 46 1.054 -12.011 -10.869 1.00 34.33 N ATOM 745 CA SER A 46 0.728 -12.522 -12.234 1.00 74.14 C ATOM 746 C SER A 46 0.108 -11.422 -13.134 1.00 51.14 C ATOM 747 O SER A 46 0.301 -11.424 -14.350 1.00 25.03 O ATOM 748 CB SER A 46 -0.230 -13.737 -12.153 1.00 42.34 C ATOM 749 OG SER A 46 0.340 -14.800 -11.407 1.00 44.54 O ATOM 0 H SER A 46 0.645 -12.567 -10.118 1.00 34.33 H new ATOM 0 HA SER A 46 1.668 -12.836 -12.687 1.00 74.14 H new ATOM 0 HB2 SER A 46 -1.169 -13.431 -11.693 1.00 42.34 H new ATOM 0 HB3 SER A 46 -0.466 -14.083 -13.159 1.00 42.34 H new ATOM 0 HG SER A 46 0.446 -14.524 -10.473 1.00 44.54 H new ATOM 755 N LYS A 47 -0.631 -10.482 -12.511 1.00 34.55 N ATOM 756 CA LYS A 47 -1.151 -9.279 -13.199 1.00 51.11 C ATOM 757 C LYS A 47 -0.008 -8.290 -13.534 1.00 42.23 C ATOM 758 O LYS A 47 0.050 -7.750 -14.645 1.00 71.33 O ATOM 759 CB LYS A 47 -2.223 -8.532 -12.342 1.00 11.41 C ATOM 760 CG LYS A 47 -3.598 -9.220 -12.197 1.00 14.44 C ATOM 761 CD LYS A 47 -3.563 -10.464 -11.294 1.00 54.34 C ATOM 762 CE LYS A 47 -4.946 -11.084 -11.087 1.00 50.12 C ATOM 763 NZ LYS A 47 -4.876 -12.309 -10.254 1.00 35.13 N ATOM 0 H LYS A 47 -0.884 -10.533 -11.524 1.00 34.55 H new ATOM 0 HA LYS A 47 -1.617 -9.630 -14.120 1.00 51.11 H new ATOM 0 HB2 LYS A 47 -1.813 -8.377 -11.344 1.00 11.41 H new ATOM 0 HB3 LYS A 47 -2.380 -7.546 -12.778 1.00 11.41 H new ATOM 0 HG2 LYS A 47 -4.313 -8.505 -11.791 1.00 14.44 H new ATOM 0 HG3 LYS A 47 -3.959 -9.506 -13.185 1.00 14.44 H new ATOM 0 HD2 LYS A 47 -2.898 -11.208 -11.733 1.00 54.34 H new ATOM 0 HD3 LYS A 47 -3.142 -10.193 -10.326 1.00 54.34 H new ATOM 0 HE2 LYS A 47 -5.604 -10.357 -10.611 1.00 50.12 H new ATOM 0 HE3 LYS A 47 -5.385 -11.326 -12.055 1.00 50.12 H new ATOM 0 HZ1 LYS A 47 -5.255 -13.115 -10.790 1.00 35.13 H new ATOM 0 HZ2 LYS A 47 -3.886 -12.498 -9.998 1.00 35.13 H new ATOM 0 HZ3 LYS A 47 -5.438 -12.173 -9.389 1.00 35.13 H new ATOM 777 N LEU A 48 0.896 -8.069 -12.556 1.00 22.53 N ATOM 778 CA LEU A 48 1.907 -6.989 -12.624 1.00 44.00 C ATOM 779 C LEU A 48 2.939 -7.203 -13.767 1.00 34.21 C ATOM 780 O LEU A 48 3.126 -6.302 -14.597 1.00 61.22 O ATOM 781 CB LEU A 48 2.641 -6.821 -11.267 1.00 34.14 C ATOM 782 CG LEU A 48 3.452 -5.491 -11.119 1.00 2.40 C ATOM 783 CD1 LEU A 48 2.511 -4.268 -11.059 1.00 52.52 C ATOM 784 CD2 LEU A 48 4.404 -5.528 -9.912 1.00 10.24 C ATOM 0 H LEU A 48 0.947 -8.628 -11.704 1.00 22.53 H new ATOM 0 HA LEU A 48 1.359 -6.074 -12.847 1.00 44.00 H new ATOM 0 HB2 LEU A 48 1.906 -6.873 -10.464 1.00 34.14 H new ATOM 0 HB3 LEU A 48 3.321 -7.662 -11.132 1.00 34.14 H new ATOM 0 HG LEU A 48 4.073 -5.391 -12.009 1.00 2.40 H new ATOM 0 HD11 LEU A 48 3.103 -3.358 -10.956 1.00 52.52 H new ATOM 0 HD12 LEU A 48 1.923 -4.216 -11.975 1.00 52.52 H new ATOM 0 HD13 LEU A 48 1.843 -4.365 -10.203 1.00 52.52 H new ATOM 0 HD21 LEU A 48 4.947 -4.585 -9.848 1.00 10.24 H new ATOM 0 HD22 LEU A 48 3.828 -5.679 -8.999 1.00 10.24 H new ATOM 0 HD23 LEU A 48 5.113 -6.347 -10.033 1.00 10.24 H new ATOM 796 N GLY A 49 3.664 -8.356 -13.763 1.00 62.01 N ATOM 797 CA GLY A 49 4.514 -8.756 -14.909 1.00 25.11 C ATOM 798 C GLY A 49 3.825 -8.709 -16.286 1.00 61.24 C ATOM 799 O GLY A 49 4.376 -8.145 -17.232 1.00 71.04 O ATOM 0 H GLY A 49 3.674 -9.016 -12.985 1.00 62.01 H new ATOM 0 HA2 GLY A 49 5.389 -8.106 -14.936 1.00 25.11 H new ATOM 0 HA3 GLY A 49 4.875 -9.770 -14.736 1.00 25.11 H new ATOM 803 N ASN A 50 2.621 -9.310 -16.395 1.00 73.51 N ATOM 804 CA ASN A 50 1.747 -9.200 -17.613 1.00 63.50 C ATOM 805 C ASN A 50 1.147 -7.771 -17.880 1.00 4.20 C ATOM 806 O ASN A 50 0.215 -7.644 -18.685 1.00 13.22 O ATOM 807 CB ASN A 50 0.607 -10.262 -17.535 1.00 1.32 C ATOM 808 CG ASN A 50 1.122 -11.708 -17.508 1.00 0.34 C ATOM 809 OD1 ASN A 50 2.199 -12.012 -18.011 1.00 53.04 O ATOM 810 ND2 ASN A 50 0.351 -12.614 -16.932 1.00 62.35 N ATOM 0 H ASN A 50 2.218 -9.884 -15.655 1.00 73.51 H new ATOM 0 HA ASN A 50 2.401 -9.391 -18.464 1.00 63.50 H new ATOM 0 HB2 ASN A 50 0.011 -10.080 -16.641 1.00 1.32 H new ATOM 0 HB3 ASN A 50 -0.056 -10.136 -18.391 1.00 1.32 H new ATOM 0 HD21 ASN A 50 0.647 -13.589 -16.899 1.00 62.35 H new ATOM 0 HD22 ASN A 50 -0.540 -12.338 -16.520 1.00 62.35 H new ATOM 817 N GLY A 51 1.755 -6.707 -17.297 1.00 32.30 N ATOM 818 CA GLY A 51 1.274 -5.304 -17.408 1.00 41.23 C ATOM 819 C GLY A 51 -0.241 -5.026 -17.263 1.00 25.43 C ATOM 820 O GLY A 51 -0.702 -3.969 -17.714 1.00 1.11 O ATOM 0 H GLY A 51 2.599 -6.798 -16.732 1.00 32.30 H new ATOM 0 HA2 GLY A 51 1.792 -4.716 -16.651 1.00 41.23 H new ATOM 0 HA3 GLY A 51 1.589 -4.922 -18.379 1.00 41.23 H new ATOM 824 N GLU A 52 -1.008 -5.951 -16.657 1.00 51.14 N ATOM 825 CA GLU A 52 -2.468 -5.784 -16.418 1.00 44.13 C ATOM 826 C GLU A 52 -2.746 -4.576 -15.487 1.00 1.40 C ATOM 827 O GLU A 52 -3.500 -3.658 -15.818 1.00 12.13 O ATOM 828 CB GLU A 52 -3.034 -7.074 -15.766 1.00 31.35 C ATOM 829 CG GLU A 52 -2.965 -8.342 -16.639 1.00 62.40 C ATOM 830 CD GLU A 52 -4.003 -8.343 -17.773 1.00 24.30 C ATOM 831 OE1 GLU A 52 -5.195 -8.590 -17.494 1.00 71.32 O ATOM 832 OE2 GLU A 52 -3.644 -8.091 -18.939 1.00 2.34 O ATOM 0 H GLU A 52 -0.640 -6.839 -16.316 1.00 51.14 H new ATOM 0 HA GLU A 52 -2.954 -5.601 -17.376 1.00 44.13 H new ATOM 0 HB2 GLU A 52 -2.490 -7.261 -14.840 1.00 31.35 H new ATOM 0 HB3 GLU A 52 -4.075 -6.897 -15.494 1.00 31.35 H new ATOM 0 HG2 GLU A 52 -1.966 -8.429 -17.067 1.00 62.40 H new ATOM 0 HG3 GLU A 52 -3.120 -9.219 -16.010 1.00 62.40 H new ATOM 839 N ILE A 53 -2.089 -4.621 -14.320 1.00 32.14 N ATOM 840 CA ILE A 53 -2.211 -3.595 -13.265 1.00 71.51 C ATOM 841 C ILE A 53 -0.926 -2.752 -13.183 1.00 34.21 C ATOM 842 O ILE A 53 0.183 -3.280 -13.351 1.00 12.11 O ATOM 843 CB ILE A 53 -2.539 -4.232 -11.853 1.00 62.24 C ATOM 844 CG1 ILE A 53 -1.347 -5.083 -11.296 1.00 23.21 C ATOM 845 CG2 ILE A 53 -3.829 -5.080 -11.941 1.00 10.41 C ATOM 846 CD1 ILE A 53 -1.588 -5.702 -9.926 1.00 64.25 C ATOM 0 H ILE A 53 -1.450 -5.377 -14.075 1.00 32.14 H new ATOM 0 HA ILE A 53 -3.046 -2.949 -13.536 1.00 71.51 H new ATOM 0 HB ILE A 53 -2.697 -3.415 -11.149 1.00 62.24 H new ATOM 0 HG12 ILE A 53 -1.126 -5.881 -12.005 1.00 23.21 H new ATOM 0 HG13 ILE A 53 -0.461 -4.450 -11.242 1.00 23.21 H new ATOM 0 HG21 ILE A 53 -4.046 -5.514 -10.965 1.00 10.41 H new ATOM 0 HG22 ILE A 53 -4.661 -4.446 -12.250 1.00 10.41 H new ATOM 0 HG23 ILE A 53 -3.691 -5.878 -12.670 1.00 10.41 H new ATOM 0 HD11 ILE A 53 -0.709 -6.271 -9.624 1.00 64.25 H new ATOM 0 HD12 ILE A 53 -1.776 -4.913 -9.198 1.00 64.25 H new ATOM 0 HD13 ILE A 53 -2.451 -6.366 -9.973 1.00 64.25 H new ATOM 858 N THR A 54 -1.071 -1.434 -12.980 1.00 33.44 N ATOM 859 CA THR A 54 0.063 -0.545 -12.658 1.00 31.53 C ATOM 860 C THR A 54 0.620 -0.824 -11.250 1.00 73.45 C ATOM 861 O THR A 54 0.006 -1.552 -10.453 1.00 43.22 O ATOM 862 CB THR A 54 -0.370 0.960 -12.727 1.00 11.55 C ATOM 863 OG1 THR A 54 -1.381 1.235 -11.730 1.00 43.13 O ATOM 864 CG2 THR A 54 -0.903 1.344 -14.116 1.00 20.10 C ATOM 0 H THR A 54 -1.969 -0.954 -13.033 1.00 33.44 H new ATOM 0 HA THR A 54 0.837 -0.746 -13.398 1.00 31.53 H new ATOM 0 HB THR A 54 0.518 1.560 -12.530 1.00 11.55 H new ATOM 0 HG1 THR A 54 -1.866 2.051 -11.973 1.00 43.13 H new ATOM 0 HG21 THR A 54 -1.191 2.395 -14.117 1.00 20.10 H new ATOM 0 HG22 THR A 54 -0.126 1.180 -14.862 1.00 20.10 H new ATOM 0 HG23 THR A 54 -1.771 0.730 -14.355 1.00 20.10 H new ATOM 872 N VAL A 55 1.778 -0.217 -10.944 1.00 71.12 N ATOM 873 CA VAL A 55 2.373 -0.271 -9.592 1.00 31.22 C ATOM 874 C VAL A 55 1.430 0.383 -8.529 1.00 74.15 C ATOM 875 O VAL A 55 1.433 -0.026 -7.373 1.00 22.34 O ATOM 876 CB VAL A 55 3.819 0.376 -9.583 1.00 61.32 C ATOM 877 CG1 VAL A 55 4.446 0.452 -8.168 1.00 72.44 C ATOM 878 CG2 VAL A 55 4.762 -0.397 -10.537 1.00 22.44 C ATOM 0 H VAL A 55 2.326 0.320 -11.616 1.00 71.12 H new ATOM 0 HA VAL A 55 2.485 -1.319 -9.313 1.00 31.22 H new ATOM 0 HB VAL A 55 3.698 1.402 -9.931 1.00 61.32 H new ATOM 0 HG11 VAL A 55 5.435 0.905 -8.232 1.00 72.44 H new ATOM 0 HG12 VAL A 55 3.811 1.057 -7.521 1.00 72.44 H new ATOM 0 HG13 VAL A 55 4.533 -0.553 -7.754 1.00 72.44 H new ATOM 0 HG21 VAL A 55 5.751 0.060 -10.520 1.00 22.44 H new ATOM 0 HG22 VAL A 55 4.836 -1.435 -10.213 1.00 22.44 H new ATOM 0 HG23 VAL A 55 4.363 -0.361 -11.551 1.00 22.44 H new ATOM 888 N LYS A 56 0.540 1.303 -8.962 1.00 3.31 N ATOM 889 CA LYS A 56 -0.411 2.036 -8.085 1.00 54.32 C ATOM 890 C LYS A 56 -1.489 1.080 -7.515 1.00 31.01 C ATOM 891 O LYS A 56 -1.680 0.987 -6.294 1.00 52.54 O ATOM 892 CB LYS A 56 -1.048 3.153 -8.959 1.00 12.25 C ATOM 893 CG LYS A 56 -2.224 3.954 -8.370 1.00 41.51 C ATOM 894 CD LYS A 56 -2.713 5.040 -9.362 1.00 43.44 C ATOM 895 CE LYS A 56 -3.974 5.772 -8.898 1.00 1.32 C ATOM 896 NZ LYS A 56 -4.431 6.759 -9.909 1.00 21.14 N ATOM 0 H LYS A 56 0.458 1.564 -9.945 1.00 3.31 H new ATOM 0 HA LYS A 56 0.101 2.466 -7.224 1.00 54.32 H new ATOM 0 HB2 LYS A 56 -0.261 3.860 -9.221 1.00 12.25 H new ATOM 0 HB3 LYS A 56 -1.388 2.696 -9.888 1.00 12.25 H new ATOM 0 HG2 LYS A 56 -3.045 3.278 -8.132 1.00 41.51 H new ATOM 0 HG3 LYS A 56 -1.916 4.423 -7.435 1.00 41.51 H new ATOM 0 HD2 LYS A 56 -1.916 5.768 -9.513 1.00 43.44 H new ATOM 0 HD3 LYS A 56 -2.908 4.576 -10.329 1.00 43.44 H new ATOM 0 HE2 LYS A 56 -4.767 5.049 -8.709 1.00 1.32 H new ATOM 0 HE3 LYS A 56 -3.775 6.281 -7.955 1.00 1.32 H new ATOM 0 HZ1 LYS A 56 -4.739 7.629 -9.430 1.00 21.14 H new ATOM 0 HZ2 LYS A 56 -3.648 6.979 -10.558 1.00 21.14 H new ATOM 0 HZ3 LYS A 56 -5.226 6.361 -10.448 1.00 21.14 H new ATOM 910 N GLU A 57 -2.163 0.340 -8.425 1.00 70.25 N ATOM 911 CA GLU A 57 -3.183 -0.683 -8.069 1.00 64.52 C ATOM 912 C GLU A 57 -2.541 -1.905 -7.349 1.00 3.53 C ATOM 913 O GLU A 57 -3.194 -2.586 -6.562 1.00 24.01 O ATOM 914 CB GLU A 57 -3.945 -1.139 -9.341 1.00 60.23 C ATOM 915 CG GLU A 57 -5.202 -1.994 -9.055 1.00 12.12 C ATOM 916 CD GLU A 57 -5.939 -2.481 -10.317 1.00 24.31 C ATOM 917 OE1 GLU A 57 -6.023 -1.715 -11.307 1.00 72.10 O ATOM 918 OE2 GLU A 57 -6.443 -3.632 -10.330 1.00 32.03 O ATOM 0 H GLU A 57 -2.017 0.433 -9.430 1.00 70.25 H new ATOM 0 HA GLU A 57 -3.889 -0.228 -7.375 1.00 64.52 H new ATOM 0 HB2 GLU A 57 -4.241 -0.257 -9.909 1.00 60.23 H new ATOM 0 HB3 GLU A 57 -3.266 -1.712 -9.972 1.00 60.23 H new ATOM 0 HG2 GLU A 57 -4.910 -2.861 -8.462 1.00 12.12 H new ATOM 0 HG3 GLU A 57 -5.893 -1.410 -8.447 1.00 12.12 H new ATOM 925 N PHE A 58 -1.219 -2.083 -7.561 1.00 42.33 N ATOM 926 CA PHE A 58 -0.466 -3.237 -7.005 1.00 1.22 C ATOM 927 C PHE A 58 -0.225 -2.978 -5.504 1.00 43.33 C ATOM 928 O PHE A 58 -0.392 -3.856 -4.653 1.00 14.44 O ATOM 929 CB PHE A 58 0.880 -3.444 -7.749 1.00 3.34 C ATOM 930 CG PHE A 58 1.702 -4.647 -7.260 1.00 62.43 C ATOM 931 CD1 PHE A 58 1.335 -5.949 -7.610 1.00 74.34 C ATOM 932 CD2 PHE A 58 2.825 -4.482 -6.438 1.00 2.20 C ATOM 933 CE1 PHE A 58 2.065 -7.039 -7.174 1.00 71.45 C ATOM 934 CE2 PHE A 58 3.552 -5.576 -6.002 1.00 32.54 C ATOM 935 CZ PHE A 58 3.167 -6.854 -6.364 1.00 35.32 C ATOM 0 H PHE A 58 -0.647 -1.444 -8.113 1.00 42.33 H new ATOM 0 HA PHE A 58 -1.047 -4.149 -7.140 1.00 1.22 H new ATOM 0 HB2 PHE A 58 0.677 -3.568 -8.813 1.00 3.34 H new ATOM 0 HB3 PHE A 58 1.482 -2.542 -7.642 1.00 3.34 H new ATOM 0 HD1 PHE A 58 0.466 -6.107 -8.232 1.00 74.34 H new ATOM 0 HD2 PHE A 58 3.127 -3.489 -6.141 1.00 2.20 H new ATOM 0 HE1 PHE A 58 1.773 -8.036 -7.468 1.00 71.45 H new ATOM 0 HE2 PHE A 58 4.422 -5.431 -5.378 1.00 32.54 H new ATOM 0 HZ PHE A 58 3.729 -7.707 -6.013 1.00 35.32 H new ATOM 945 N ILE A 59 0.165 -1.724 -5.229 1.00 21.41 N ATOM 946 CA ILE A 59 0.379 -1.177 -3.879 1.00 64.34 C ATOM 947 C ILE A 59 -0.938 -1.091 -3.070 1.00 4.31 C ATOM 948 O ILE A 59 -0.914 -1.181 -1.832 1.00 40.21 O ATOM 949 CB ILE A 59 1.093 0.218 -4.004 1.00 42.52 C ATOM 950 CG1 ILE A 59 2.558 0.009 -4.497 1.00 64.51 C ATOM 951 CG2 ILE A 59 1.062 1.039 -2.700 1.00 35.23 C ATOM 952 CD1 ILE A 59 3.282 1.285 -4.833 1.00 30.40 C ATOM 0 H ILE A 59 0.346 -1.040 -5.964 1.00 21.41 H new ATOM 0 HA ILE A 59 1.022 -1.855 -3.317 1.00 64.34 H new ATOM 0 HB ILE A 59 0.536 0.804 -4.735 1.00 42.52 H new ATOM 0 HG12 ILE A 59 3.117 -0.521 -3.726 1.00 64.51 H new ATOM 0 HG13 ILE A 59 2.545 -0.632 -5.379 1.00 64.51 H new ATOM 0 HG21 ILE A 59 1.572 1.990 -2.856 1.00 35.23 H new ATOM 0 HG22 ILE A 59 0.027 1.225 -2.412 1.00 35.23 H new ATOM 0 HG23 ILE A 59 1.565 0.484 -1.908 1.00 35.23 H new ATOM 0 HD11 ILE A 59 4.293 1.052 -5.167 1.00 30.40 H new ATOM 0 HD12 ILE A 59 2.749 1.808 -5.627 1.00 30.40 H new ATOM 0 HD13 ILE A 59 3.329 1.920 -3.948 1.00 30.40 H new ATOM 964 N GLU A 60 -2.085 -0.924 -3.760 1.00 30.11 N ATOM 965 CA GLU A 60 -3.406 -1.102 -3.132 1.00 61.03 C ATOM 966 C GLU A 60 -3.524 -2.534 -2.553 1.00 13.52 C ATOM 967 O GLU A 60 -3.847 -2.695 -1.388 1.00 11.41 O ATOM 968 CB GLU A 60 -4.545 -0.812 -4.148 1.00 65.14 C ATOM 969 CG GLU A 60 -5.963 -0.890 -3.540 1.00 12.11 C ATOM 970 CD GLU A 60 -7.097 -0.574 -4.528 1.00 52.44 C ATOM 971 OE1 GLU A 60 -7.106 -1.160 -5.635 1.00 60.24 O ATOM 972 OE2 GLU A 60 -8.007 0.220 -4.184 1.00 25.43 O ATOM 0 H GLU A 60 -2.121 -0.668 -4.747 1.00 30.11 H new ATOM 0 HA GLU A 60 -3.507 -0.388 -2.315 1.00 61.03 H new ATOM 0 HB2 GLU A 60 -4.396 0.181 -4.571 1.00 65.14 H new ATOM 0 HB3 GLU A 60 -4.474 -1.523 -4.971 1.00 65.14 H new ATOM 0 HG2 GLU A 60 -6.117 -1.891 -3.137 1.00 12.11 H new ATOM 0 HG3 GLU A 60 -6.024 -0.196 -2.702 1.00 12.11 H new ATOM 979 N GLY A 61 -3.213 -3.556 -3.384 1.00 21.31 N ATOM 980 CA GLY A 61 -3.139 -4.965 -2.928 1.00 51.42 C ATOM 981 C GLY A 61 -2.123 -5.225 -1.792 1.00 74.01 C ATOM 982 O GLY A 61 -2.325 -6.126 -0.970 1.00 53.22 O ATOM 0 H GLY A 61 -3.009 -3.431 -4.376 1.00 21.31 H new ATOM 0 HA2 GLY A 61 -4.128 -5.276 -2.590 1.00 51.42 H new ATOM 0 HA3 GLY A 61 -2.880 -5.595 -3.779 1.00 51.42 H new ATOM 986 N LEU A 62 -1.028 -4.432 -1.754 1.00 35.15 N ATOM 987 CA LEU A 62 -0.012 -4.496 -0.663 1.00 72.23 C ATOM 988 C LEU A 62 -0.563 -3.869 0.650 1.00 21.33 C ATOM 989 O LEU A 62 -0.219 -4.301 1.754 1.00 50.22 O ATOM 990 CB LEU A 62 1.305 -3.778 -1.088 1.00 13.04 C ATOM 991 CG LEU A 62 1.997 -4.286 -2.397 1.00 2.12 C ATOM 992 CD1 LEU A 62 3.344 -3.568 -2.633 1.00 43.31 C ATOM 993 CD2 LEU A 62 2.168 -5.817 -2.405 1.00 34.14 C ATOM 0 H LEU A 62 -0.819 -3.734 -2.468 1.00 35.15 H new ATOM 0 HA LEU A 62 0.209 -5.547 -0.478 1.00 72.23 H new ATOM 0 HB2 LEU A 62 1.089 -2.716 -1.208 1.00 13.04 H new ATOM 0 HB3 LEU A 62 2.020 -3.867 -0.270 1.00 13.04 H new ATOM 0 HG LEU A 62 1.335 -4.036 -3.226 1.00 2.12 H new ATOM 0 HD11 LEU A 62 3.800 -3.942 -3.549 1.00 43.31 H new ATOM 0 HD12 LEU A 62 3.173 -2.495 -2.725 1.00 43.31 H new ATOM 0 HD13 LEU A 62 4.010 -3.759 -1.792 1.00 43.31 H new ATOM 0 HD21 LEU A 62 2.652 -6.124 -3.332 1.00 34.14 H new ATOM 0 HD22 LEU A 62 2.783 -6.119 -1.557 1.00 34.14 H new ATOM 0 HD23 LEU A 62 1.190 -6.293 -2.332 1.00 34.14 H new ATOM 1005 N GLY A 63 -1.409 -2.838 0.492 1.00 63.34 N ATOM 1006 CA GLY A 63 -2.130 -2.216 1.618 1.00 34.44 C ATOM 1007 C GLY A 63 -3.416 -2.974 1.980 1.00 1.41 C ATOM 1008 O GLY A 63 -4.041 -2.710 3.009 1.00 60.54 O ATOM 0 H GLY A 63 -1.613 -2.413 -0.413 1.00 63.34 H new ATOM 0 HA2 GLY A 63 -1.476 -2.179 2.489 1.00 34.44 H new ATOM 0 HA3 GLY A 63 -2.378 -1.186 1.362 1.00 34.44 H new ATOM 1012 N TYR A 64 -3.821 -3.901 1.092 1.00 11.11 N ATOM 1013 CA TYR A 64 -4.950 -4.833 1.307 1.00 2.35 C ATOM 1014 C TYR A 64 -4.450 -6.215 1.798 1.00 40.25 C ATOM 1015 O TYR A 64 -5.226 -7.172 1.849 1.00 24.41 O ATOM 1016 CB TYR A 64 -5.782 -4.994 -0.008 1.00 72.12 C ATOM 1017 CG TYR A 64 -6.753 -3.842 -0.368 1.00 4.20 C ATOM 1018 CD1 TYR A 64 -6.547 -2.520 0.047 1.00 0.41 C ATOM 1019 CD2 TYR A 64 -7.885 -4.096 -1.154 1.00 23.32 C ATOM 1020 CE1 TYR A 64 -7.424 -1.512 -0.305 1.00 34.12 C ATOM 1021 CE2 TYR A 64 -8.759 -3.089 -1.509 1.00 70.12 C ATOM 1022 CZ TYR A 64 -8.525 -1.802 -1.084 1.00 53.35 C ATOM 1023 OH TYR A 64 -9.388 -0.795 -1.452 1.00 34.05 O ATOM 0 H TYR A 64 -3.366 -4.028 0.188 1.00 11.11 H new ATOM 0 HA TYR A 64 -5.591 -4.411 2.081 1.00 2.35 H new ATOM 0 HB2 TYR A 64 -5.086 -5.122 -0.837 1.00 72.12 H new ATOM 0 HB3 TYR A 64 -6.361 -5.915 0.067 1.00 72.12 H new ATOM 0 HD1 TYR A 64 -5.686 -2.284 0.654 1.00 0.41 H new ATOM 0 HD2 TYR A 64 -8.078 -5.104 -1.490 1.00 23.32 H new ATOM 0 HE1 TYR A 64 -7.248 -0.500 0.029 1.00 34.12 H new ATOM 0 HE2 TYR A 64 -9.623 -3.310 -2.118 1.00 70.12 H new ATOM 0 HH TYR A 64 -9.144 -0.464 -2.341 1.00 34.05 H new ATOM 1033 N SER A 65 -3.164 -6.309 2.187 1.00 31.31 N ATOM 1034 CA SER A 65 -2.583 -7.572 2.695 1.00 1.02 C ATOM 1035 C SER A 65 -2.549 -7.535 4.231 1.00 2.21 C ATOM 1036 O SER A 65 -2.004 -6.590 4.818 1.00 53.02 O ATOM 1037 CB SER A 65 -1.154 -7.829 2.143 1.00 44.41 C ATOM 1038 OG SER A 65 -0.181 -6.975 2.730 1.00 51.33 O ATOM 0 H SER A 65 -2.507 -5.529 2.160 1.00 31.31 H new ATOM 0 HA SER A 65 -3.215 -8.390 2.349 1.00 1.02 H new ATOM 0 HB2 SER A 65 -0.879 -8.868 2.326 1.00 44.41 H new ATOM 0 HB3 SER A 65 -1.154 -7.685 1.063 1.00 44.41 H new ATOM 0 HG SER A 65 -0.257 -6.078 2.343 1.00 51.33 H new ATOM 1044 N ASN A 66 -3.117 -8.572 4.883 1.00 4.33 N ATOM 1045 CA ASN A 66 -3.144 -8.693 6.365 1.00 65.31 C ATOM 1046 C ASN A 66 -1.723 -8.680 6.996 1.00 50.11 C ATOM 1047 O ASN A 66 -1.593 -8.525 8.201 1.00 31.14 O ATOM 1048 CB ASN A 66 -3.921 -9.972 6.786 1.00 11.03 C ATOM 1049 CG ASN A 66 -3.288 -11.269 6.273 1.00 62.44 C ATOM 1050 OD1 ASN A 66 -3.602 -11.742 5.186 1.00 41.01 O ATOM 1051 ND2 ASN A 66 -2.384 -11.841 7.044 1.00 61.53 N ATOM 0 H ASN A 66 -3.570 -9.349 4.403 1.00 4.33 H new ATOM 0 HA ASN A 66 -3.662 -7.814 6.749 1.00 65.31 H new ATOM 0 HB2 ASN A 66 -3.979 -10.011 7.874 1.00 11.03 H new ATOM 0 HB3 ASN A 66 -4.944 -9.905 6.415 1.00 11.03 H new ATOM 0 HD21 ASN A 66 -1.925 -12.700 6.741 1.00 61.53 H new ATOM 0 HD22 ASN A 66 -2.143 -11.424 7.943 1.00 61.53 H new ATOM 1058 N LEU A 67 -0.683 -8.891 6.161 1.00 11.44 N ATOM 1059 CA LEU A 67 0.733 -8.825 6.572 1.00 50.21 C ATOM 1060 C LEU A 67 1.148 -7.376 6.988 1.00 44.23 C ATOM 1061 O LEU A 67 1.628 -7.176 8.109 1.00 44.31 O ATOM 1062 CB LEU A 67 1.624 -9.358 5.417 1.00 20.50 C ATOM 1063 CG LEU A 67 3.142 -9.540 5.737 1.00 24.01 C ATOM 1064 CD1 LEU A 67 3.367 -10.532 6.901 1.00 3.30 C ATOM 1065 CD2 LEU A 67 3.932 -9.962 4.474 1.00 73.50 C ATOM 0 H LEU A 67 -0.806 -9.114 5.173 1.00 11.44 H new ATOM 0 HA LEU A 67 0.873 -9.452 7.452 1.00 50.21 H new ATOM 0 HB2 LEU A 67 1.225 -10.320 5.094 1.00 20.50 H new ATOM 0 HB3 LEU A 67 1.533 -8.675 4.572 1.00 20.50 H new ATOM 0 HG LEU A 67 3.525 -8.573 6.061 1.00 24.01 H new ATOM 0 HD11 LEU A 67 4.435 -10.631 7.093 1.00 3.30 H new ATOM 0 HD12 LEU A 67 2.870 -10.160 7.797 1.00 3.30 H new ATOM 0 HD13 LEU A 67 2.954 -11.505 6.635 1.00 3.30 H new ATOM 0 HD21 LEU A 67 4.986 -10.081 4.727 1.00 73.50 H new ATOM 0 HD22 LEU A 67 3.540 -10.907 4.098 1.00 73.50 H new ATOM 0 HD23 LEU A 67 3.828 -9.195 3.706 1.00 73.50 H new ATOM 1077 N TYR A 68 1.029 -6.371 6.071 1.00 11.03 N ATOM 1078 CA TYR A 68 1.094 -4.918 6.436 1.00 73.02 C ATOM 1079 C TYR A 68 0.183 -4.518 7.621 1.00 5.22 C ATOM 1080 O TYR A 68 0.625 -3.827 8.551 1.00 32.21 O ATOM 1081 CB TYR A 68 0.715 -4.079 5.177 1.00 1.51 C ATOM 1082 CG TYR A 68 0.809 -2.552 5.352 1.00 0.35 C ATOM 1083 CD1 TYR A 68 2.051 -1.925 5.455 1.00 71.32 C ATOM 1084 CD2 TYR A 68 -0.335 -1.742 5.415 1.00 23.11 C ATOM 1085 CE1 TYR A 68 2.150 -0.560 5.613 1.00 4.01 C ATOM 1086 CE2 TYR A 68 -0.233 -0.371 5.574 1.00 44.53 C ATOM 1087 CZ TYR A 68 1.014 0.213 5.670 1.00 72.51 C ATOM 1088 OH TYR A 68 1.137 1.577 5.822 1.00 35.12 O ATOM 0 H TYR A 68 0.888 -6.538 5.075 1.00 11.03 H new ATOM 0 HA TYR A 68 2.113 -4.717 6.768 1.00 73.02 H new ATOM 0 HB2 TYR A 68 1.366 -4.375 4.354 1.00 1.51 H new ATOM 0 HB3 TYR A 68 -0.304 -4.333 4.885 1.00 1.51 H new ATOM 0 HD1 TYR A 68 2.951 -2.520 5.410 1.00 71.32 H new ATOM 0 HD2 TYR A 68 -1.312 -2.196 5.338 1.00 23.11 H new ATOM 0 HE1 TYR A 68 3.122 -0.096 5.692 1.00 4.01 H new ATOM 0 HE2 TYR A 68 -1.124 0.238 5.623 1.00 44.53 H new ATOM 0 HH TYR A 68 2.085 1.824 5.801 1.00 35.12 H new ATOM 1098 N LEU A 69 -1.089 -4.938 7.560 1.00 23.50 N ATOM 1099 CA LEU A 69 -2.084 -4.700 8.635 1.00 2.13 C ATOM 1100 C LEU A 69 -1.704 -5.362 9.961 1.00 52.41 C ATOM 1101 O LEU A 69 -2.202 -4.959 11.027 1.00 44.45 O ATOM 1102 CB LEU A 69 -3.525 -5.076 8.204 1.00 44.21 C ATOM 1103 CG LEU A 69 -4.203 -4.067 7.230 1.00 52.35 C ATOM 1104 CD1 LEU A 69 -4.046 -2.618 7.739 1.00 30.43 C ATOM 1105 CD2 LEU A 69 -3.688 -4.203 5.790 1.00 11.20 C ATOM 0 H LEU A 69 -1.465 -5.454 6.765 1.00 23.50 H new ATOM 0 HA LEU A 69 -2.070 -3.624 8.810 1.00 2.13 H new ATOM 0 HB2 LEU A 69 -3.502 -6.057 7.730 1.00 44.21 H new ATOM 0 HB3 LEU A 69 -4.143 -5.168 9.097 1.00 44.21 H new ATOM 0 HG LEU A 69 -5.265 -4.313 7.209 1.00 52.35 H new ATOM 0 HD11 LEU A 69 -4.528 -1.933 7.041 1.00 30.43 H new ATOM 0 HD12 LEU A 69 -4.512 -2.524 8.720 1.00 30.43 H new ATOM 0 HD13 LEU A 69 -2.987 -2.372 7.816 1.00 30.43 H new ATOM 0 HD21 LEU A 69 -4.193 -3.477 5.153 1.00 11.20 H new ATOM 0 HD22 LEU A 69 -2.614 -4.019 5.769 1.00 11.20 H new ATOM 0 HD23 LEU A 69 -3.891 -5.210 5.425 1.00 11.20 H new ATOM 1117 N LYS A 70 -0.839 -6.380 9.899 1.00 60.11 N ATOM 1118 CA LYS A 70 -0.401 -7.079 11.100 1.00 0.03 C ATOM 1119 C LYS A 70 0.618 -6.201 11.829 1.00 3.21 C ATOM 1120 O LYS A 70 0.555 -6.097 13.060 1.00 21.54 O ATOM 1121 CB LYS A 70 0.207 -8.464 10.775 1.00 44.41 C ATOM 1122 CG LYS A 70 0.755 -9.228 12.011 1.00 73.04 C ATOM 1123 CD LYS A 70 1.053 -10.714 11.720 1.00 42.44 C ATOM 1124 CE LYS A 70 -0.213 -11.498 11.332 1.00 5.32 C ATOM 1125 NZ LYS A 70 0.042 -12.955 11.218 1.00 3.24 N ATOM 0 H LYS A 70 -0.433 -6.733 9.032 1.00 60.11 H new ATOM 0 HA LYS A 70 -1.267 -7.260 11.737 1.00 0.03 H new ATOM 0 HB2 LYS A 70 -0.554 -9.077 10.292 1.00 44.41 H new ATOM 0 HB3 LYS A 70 1.015 -8.333 10.056 1.00 44.41 H new ATOM 0 HG2 LYS A 70 1.667 -8.741 12.357 1.00 73.04 H new ATOM 0 HG3 LYS A 70 0.031 -9.161 12.823 1.00 73.04 H new ATOM 0 HD2 LYS A 70 1.783 -10.785 10.914 1.00 42.44 H new ATOM 0 HD3 LYS A 70 1.505 -11.171 12.600 1.00 42.44 H new ATOM 0 HE2 LYS A 70 -0.989 -11.324 12.078 1.00 5.32 H new ATOM 0 HE3 LYS A 70 -0.594 -11.122 10.382 1.00 5.32 H new ATOM 0 HZ1 LYS A 70 -0.839 -13.442 10.955 1.00 3.24 H new ATOM 0 HZ2 LYS A 70 0.763 -13.125 10.488 1.00 3.24 H new ATOM 0 HZ3 LYS A 70 0.381 -13.321 12.131 1.00 3.24 H new ATOM 1139 N GLU A 71 1.573 -5.544 11.097 1.00 64.41 N ATOM 1140 CA GLU A 71 2.557 -4.663 11.750 1.00 21.43 C ATOM 1141 C GLU A 71 1.941 -3.293 12.131 1.00 20.44 C ATOM 1142 O GLU A 71 1.858 -2.965 13.306 1.00 74.43 O ATOM 1143 CB GLU A 71 3.783 -4.398 10.792 1.00 44.34 C ATOM 1144 CG GLU A 71 4.195 -5.556 9.852 1.00 34.23 C ATOM 1145 CD GLU A 71 4.552 -6.877 10.563 1.00 75.00 C ATOM 1146 OE1 GLU A 71 5.500 -6.887 11.384 1.00 61.44 O ATOM 1147 OE2 GLU A 71 3.926 -7.921 10.261 1.00 74.03 O ATOM 0 H GLU A 71 1.669 -5.614 10.084 1.00 64.41 H new ATOM 0 HA GLU A 71 2.882 -5.174 12.656 1.00 21.43 H new ATOM 0 HB2 GLU A 71 3.553 -3.527 10.178 1.00 44.34 H new ATOM 0 HB3 GLU A 71 4.644 -4.136 11.407 1.00 44.34 H new ATOM 0 HG2 GLU A 71 3.379 -5.745 9.154 1.00 34.23 H new ATOM 0 HG3 GLU A 71 5.053 -5.236 9.260 1.00 34.23 H new ATOM 1154 N PHE A 72 1.515 -2.493 11.118 1.00 3.24 N ATOM 1155 CA PHE A 72 0.976 -1.121 11.353 1.00 34.41 C ATOM 1156 C PHE A 72 -0.578 -1.029 11.318 1.00 33.42 C ATOM 1157 O PHE A 72 -1.140 -0.318 10.474 1.00 13.31 O ATOM 1158 CB PHE A 72 1.612 -0.162 10.289 1.00 41.11 C ATOM 1159 CG PHE A 72 3.128 -0.335 10.092 1.00 74.21 C ATOM 1160 CD1 PHE A 72 4.022 -0.030 11.114 1.00 61.54 C ATOM 1161 CD2 PHE A 72 3.651 -0.800 8.882 1.00 54.44 C ATOM 1162 CE1 PHE A 72 5.385 -0.175 10.939 1.00 41.11 C ATOM 1163 CE2 PHE A 72 5.014 -0.950 8.706 1.00 65.14 C ATOM 1164 CZ PHE A 72 5.883 -0.636 9.733 1.00 10.23 C ATOM 0 H PHE A 72 1.533 -2.769 10.136 1.00 3.24 H new ATOM 0 HA PHE A 72 1.249 -0.828 12.367 1.00 34.41 H new ATOM 0 HB2 PHE A 72 1.115 -0.322 9.332 1.00 41.11 H new ATOM 0 HB3 PHE A 72 1.413 0.868 10.584 1.00 41.11 H new ATOM 0 HD1 PHE A 72 3.644 0.326 12.061 1.00 61.54 H new ATOM 0 HD2 PHE A 72 2.980 -1.046 8.072 1.00 54.44 H new ATOM 0 HE1 PHE A 72 6.062 0.072 11.744 1.00 41.11 H new ATOM 0 HE2 PHE A 72 5.400 -1.313 7.765 1.00 65.14 H new ATOM 0 HZ PHE A 72 6.948 -0.750 9.595 1.00 10.23 H new ATOM 1174 N TYR A 73 -1.258 -1.750 12.244 1.00 41.12 N ATOM 1175 CA TYR A 73 -2.720 -1.572 12.501 1.00 14.32 C ATOM 1176 C TYR A 73 -3.193 -2.366 13.736 1.00 4.35 C ATOM 1177 O TYR A 73 -3.759 -1.794 14.669 1.00 64.24 O ATOM 1178 CB TYR A 73 -3.595 -1.946 11.267 1.00 2.41 C ATOM 1179 CG TYR A 73 -5.113 -1.768 11.481 1.00 53.35 C ATOM 1180 CD1 TYR A 73 -5.635 -0.551 11.938 1.00 10.35 C ATOM 1181 CD2 TYR A 73 -6.019 -2.807 11.231 1.00 4.01 C ATOM 1182 CE1 TYR A 73 -6.988 -0.377 12.141 1.00 3.12 C ATOM 1183 CE2 TYR A 73 -7.377 -2.633 11.435 1.00 24.12 C ATOM 1184 CZ TYR A 73 -7.855 -1.416 11.892 1.00 5.13 C ATOM 1185 OH TYR A 73 -9.208 -1.234 12.089 1.00 53.22 O ATOM 0 H TYR A 73 -0.822 -2.463 12.829 1.00 41.12 H new ATOM 0 HA TYR A 73 -2.854 -0.509 12.700 1.00 14.32 H new ATOM 0 HB2 TYR A 73 -3.286 -1.334 10.420 1.00 2.41 H new ATOM 0 HB3 TYR A 73 -3.398 -2.984 10.999 1.00 2.41 H new ATOM 0 HD1 TYR A 73 -4.962 0.270 12.136 1.00 10.35 H new ATOM 0 HD2 TYR A 73 -5.652 -3.758 10.874 1.00 4.01 H new ATOM 0 HE1 TYR A 73 -7.366 0.571 12.494 1.00 3.12 H new ATOM 0 HE2 TYR A 73 -8.062 -3.444 11.238 1.00 24.12 H new ATOM 0 HH TYR A 73 -9.685 -2.061 11.868 1.00 53.22 H new ATOM 1195 N THR A 74 -2.972 -3.693 13.716 1.00 51.02 N ATOM 1196 CA THR A 74 -3.437 -4.618 14.789 1.00 61.23 C ATOM 1197 C THR A 74 -2.857 -4.257 16.209 1.00 2.14 C ATOM 1198 O THR A 74 -3.617 -4.255 17.186 1.00 11.43 O ATOM 1199 CB THR A 74 -3.136 -6.118 14.409 1.00 11.53 C ATOM 1200 OG1 THR A 74 -3.702 -6.408 13.113 1.00 24.25 O ATOM 1201 CG2 THR A 74 -3.703 -7.122 15.438 1.00 53.54 C ATOM 0 H THR A 74 -2.469 -4.162 12.963 1.00 51.02 H new ATOM 0 HA THR A 74 -4.517 -4.491 14.863 1.00 61.23 H new ATOM 0 HB THR A 74 -2.052 -6.233 14.399 1.00 11.53 H new ATOM 0 HG1 THR A 74 -3.193 -5.937 12.421 1.00 24.25 H new ATOM 0 HG21 THR A 74 -3.465 -8.138 15.124 1.00 53.54 H new ATOM 0 HG22 THR A 74 -3.259 -6.931 16.415 1.00 53.54 H new ATOM 0 HG23 THR A 74 -4.785 -7.006 15.502 1.00 53.54 H new ATOM 1209 N PRO A 75 -1.521 -3.927 16.366 1.00 53.11 N ATOM 1210 CA PRO A 75 -0.972 -3.413 17.648 1.00 55.14 C ATOM 1211 C PRO A 75 -0.871 -1.861 17.715 1.00 73.30 C ATOM 1212 O PRO A 75 -0.170 -1.326 18.579 1.00 44.03 O ATOM 1213 CB PRO A 75 0.427 -4.071 17.661 1.00 24.10 C ATOM 1214 CG PRO A 75 0.855 -4.065 16.218 1.00 4.32 C ATOM 1215 CD PRO A 75 -0.420 -4.085 15.375 1.00 31.41 C ATOM 0 HA PRO A 75 -1.605 -3.651 18.503 1.00 55.14 H new ATOM 0 HB2 PRO A 75 1.124 -3.511 18.285 1.00 24.10 H new ATOM 0 HB3 PRO A 75 0.386 -5.085 18.059 1.00 24.10 H new ATOM 0 HG2 PRO A 75 1.451 -3.180 15.996 1.00 4.32 H new ATOM 0 HG3 PRO A 75 1.478 -4.932 15.997 1.00 4.32 H new ATOM 0 HD2 PRO A 75 -0.425 -3.277 14.643 1.00 31.41 H new ATOM 0 HD3 PRO A 75 -0.515 -5.019 14.820 1.00 31.41 H new ATOM 1223 N TYR A 76 -1.578 -1.141 16.817 1.00 72.24 N ATOM 1224 CA TYR A 76 -1.499 0.348 16.726 1.00 45.45 C ATOM 1225 C TYR A 76 -2.895 1.019 16.727 1.00 10.02 C ATOM 1226 O TYR A 76 -3.851 0.474 16.170 1.00 71.03 O ATOM 1227 CB TYR A 76 -0.690 0.774 15.464 1.00 43.51 C ATOM 1228 CG TYR A 76 0.821 0.582 15.639 1.00 71.34 C ATOM 1229 CD1 TYR A 76 1.573 1.508 16.356 1.00 12.12 C ATOM 1230 CD2 TYR A 76 1.479 -0.534 15.139 1.00 25.20 C ATOM 1231 CE1 TYR A 76 2.922 1.335 16.553 1.00 53.04 C ATOM 1232 CE2 TYR A 76 2.832 -0.716 15.342 1.00 45.31 C ATOM 1233 CZ TYR A 76 3.550 0.221 16.047 1.00 21.44 C ATOM 1234 OH TYR A 76 4.899 0.038 16.259 1.00 12.44 O ATOM 0 H TYR A 76 -2.214 -1.561 16.139 1.00 72.24 H new ATOM 0 HA TYR A 76 -0.980 0.694 17.619 1.00 45.45 H new ATOM 0 HB2 TYR A 76 -1.029 0.193 14.606 1.00 43.51 H new ATOM 0 HB3 TYR A 76 -0.896 1.821 15.241 1.00 43.51 H new ATOM 0 HD1 TYR A 76 1.086 2.381 16.766 1.00 12.12 H new ATOM 0 HD2 TYR A 76 0.922 -1.273 14.581 1.00 25.20 H new ATOM 0 HE1 TYR A 76 3.488 2.072 17.104 1.00 53.04 H new ATOM 0 HE2 TYR A 76 3.325 -1.592 14.948 1.00 45.31 H new ATOM 0 HH TYR A 76 5.186 -0.798 15.837 1.00 12.44 H new ATOM 1244 N PRO A 77 -3.040 2.225 17.372 1.00 22.11 N ATOM 1245 CA PRO A 77 -4.311 2.989 17.343 1.00 50.21 C ATOM 1246 C PRO A 77 -4.556 3.693 15.976 1.00 62.04 C ATOM 1247 O PRO A 77 -3.601 4.055 15.284 1.00 64.23 O ATOM 1248 CB PRO A 77 -4.116 4.015 18.487 1.00 45.22 C ATOM 1249 CG PRO A 77 -2.642 4.281 18.467 1.00 61.52 C ATOM 1250 CD PRO A 77 -2.001 2.932 18.185 1.00 51.15 C ATOM 0 HA PRO A 77 -5.187 2.353 17.470 1.00 50.21 H new ATOM 0 HB2 PRO A 77 -4.691 4.925 18.313 1.00 45.22 H new ATOM 0 HB3 PRO A 77 -4.439 3.612 19.447 1.00 45.22 H new ATOM 0 HG2 PRO A 77 -2.383 5.009 17.698 1.00 61.52 H new ATOM 0 HG3 PRO A 77 -2.302 4.688 19.419 1.00 61.52 H new ATOM 0 HD2 PRO A 77 -1.064 3.037 17.638 1.00 51.15 H new ATOM 0 HD3 PRO A 77 -1.774 2.393 19.105 1.00 51.15 H new ATOM 1258 N ASN A 78 -5.850 3.760 15.584 1.00 40.41 N ATOM 1259 CA ASN A 78 -6.369 4.577 14.434 1.00 13.21 C ATOM 1260 C ASN A 78 -5.469 5.781 13.990 1.00 22.54 C ATOM 1261 O ASN A 78 -4.994 5.776 12.853 1.00 41.31 O ATOM 1262 CB ASN A 78 -7.786 5.108 14.809 1.00 62.40 C ATOM 1263 CG ASN A 78 -8.461 5.911 13.692 1.00 32.35 C ATOM 1264 OD1 ASN A 78 -8.232 7.104 13.535 1.00 54.13 O ATOM 1265 ND2 ASN A 78 -9.297 5.271 12.914 1.00 63.52 N ATOM 0 H ASN A 78 -6.587 3.241 16.061 1.00 40.41 H new ATOM 0 HA ASN A 78 -6.382 3.905 13.576 1.00 13.21 H new ATOM 0 HB2 ASN A 78 -8.423 4.263 15.072 1.00 62.40 H new ATOM 0 HB3 ASN A 78 -7.706 5.735 15.697 1.00 62.40 H new ATOM 0 HD21 ASN A 78 -9.772 5.766 12.159 1.00 63.52 H new ATOM 0 HD22 ASN A 78 -9.473 4.277 13.062 1.00 63.52 H new ATOM 1272 N THR A 79 -5.200 6.769 14.874 1.00 5.10 N ATOM 1273 CA THR A 79 -4.452 8.016 14.505 1.00 1.53 C ATOM 1274 C THR A 79 -2.966 7.746 14.118 1.00 4.31 C ATOM 1275 O THR A 79 -2.359 8.532 13.381 1.00 64.34 O ATOM 1276 CB THR A 79 -4.528 9.088 15.650 1.00 23.33 C ATOM 1277 OG1 THR A 79 -5.900 9.248 16.071 1.00 74.11 O ATOM 1278 CG2 THR A 79 -3.976 10.464 15.225 1.00 24.12 C ATOM 0 H THR A 79 -5.486 6.736 15.853 1.00 5.10 H new ATOM 0 HA THR A 79 -4.948 8.409 13.617 1.00 1.53 H new ATOM 0 HB THR A 79 -3.906 8.721 16.466 1.00 23.33 H new ATOM 0 HG1 THR A 79 -5.947 9.916 16.787 1.00 74.11 H new ATOM 0 HG21 THR A 79 -4.056 11.161 16.059 1.00 24.12 H new ATOM 0 HG22 THR A 79 -2.930 10.363 14.936 1.00 24.12 H new ATOM 0 HG23 THR A 79 -4.551 10.842 14.380 1.00 24.12 H new ATOM 1286 N LYS A 80 -2.408 6.593 14.538 1.00 52.25 N ATOM 1287 CA LYS A 80 -0.982 6.258 14.292 1.00 43.30 C ATOM 1288 C LYS A 80 -0.898 5.516 12.932 1.00 3.22 C ATOM 1289 O LYS A 80 0.073 5.642 12.187 1.00 73.42 O ATOM 1290 CB LYS A 80 -0.463 5.326 15.417 1.00 22.43 C ATOM 1291 CG LYS A 80 0.997 4.836 15.259 1.00 33.21 C ATOM 1292 CD LYS A 80 2.055 5.950 15.457 1.00 34.41 C ATOM 1293 CE LYS A 80 3.495 5.419 15.326 1.00 52.22 C ATOM 1294 NZ LYS A 80 4.508 6.479 15.560 1.00 43.15 N ATOM 0 H LYS A 80 -2.920 5.874 15.050 1.00 52.25 H new ATOM 0 HA LYS A 80 -0.376 7.164 14.276 1.00 43.30 H new ATOM 0 HB2 LYS A 80 -0.550 5.851 16.368 1.00 22.43 H new ATOM 0 HB3 LYS A 80 -1.116 4.455 15.473 1.00 22.43 H new ATOM 0 HG2 LYS A 80 1.183 4.039 15.979 1.00 33.21 H new ATOM 0 HG3 LYS A 80 1.120 4.403 14.266 1.00 33.21 H new ATOM 0 HD2 LYS A 80 1.892 6.737 14.721 1.00 34.41 H new ATOM 0 HD3 LYS A 80 1.925 6.401 16.441 1.00 34.41 H new ATOM 0 HE2 LYS A 80 3.648 4.609 16.039 1.00 52.22 H new ATOM 0 HE3 LYS A 80 3.636 4.998 14.331 1.00 52.22 H new ATOM 0 HZ1 LYS A 80 5.462 6.076 15.462 1.00 43.15 H new ATOM 0 HZ2 LYS A 80 4.381 7.241 14.864 1.00 43.15 H new ATOM 0 HZ3 LYS A 80 4.392 6.864 16.519 1.00 43.15 H new ATOM 1308 N VAL A 81 -1.972 4.746 12.644 1.00 23.25 N ATOM 1309 CA VAL A 81 -2.165 4.015 11.372 1.00 12.11 C ATOM 1310 C VAL A 81 -2.426 5.016 10.216 1.00 42.54 C ATOM 1311 O VAL A 81 -2.106 4.746 9.057 1.00 42.22 O ATOM 1312 CB VAL A 81 -3.364 3.001 11.498 1.00 14.33 C ATOM 1313 CG1 VAL A 81 -3.555 2.158 10.214 1.00 42.22 C ATOM 1314 CG2 VAL A 81 -3.179 2.097 12.739 1.00 42.44 C ATOM 0 H VAL A 81 -2.741 4.613 13.300 1.00 23.25 H new ATOM 0 HA VAL A 81 -1.258 3.452 11.151 1.00 12.11 H new ATOM 0 HB VAL A 81 -4.275 3.585 11.627 1.00 14.33 H new ATOM 0 HG11 VAL A 81 -4.393 1.474 10.349 1.00 42.22 H new ATOM 0 HG12 VAL A 81 -3.758 2.819 9.372 1.00 42.22 H new ATOM 0 HG13 VAL A 81 -2.648 1.586 10.016 1.00 42.22 H new ATOM 0 HG21 VAL A 81 -4.016 1.402 12.811 1.00 42.44 H new ATOM 0 HG22 VAL A 81 -2.249 1.536 12.645 1.00 42.44 H new ATOM 0 HG23 VAL A 81 -3.141 2.714 13.637 1.00 42.44 H new ATOM 1324 N ILE A 82 -3.023 6.177 10.562 1.00 41.04 N ATOM 1325 CA ILE A 82 -3.155 7.325 9.643 1.00 45.15 C ATOM 1326 C ILE A 82 -1.762 7.899 9.304 1.00 30.14 C ATOM 1327 O ILE A 82 -1.481 8.179 8.137 1.00 44.32 O ATOM 1328 CB ILE A 82 -4.090 8.448 10.242 1.00 75.34 C ATOM 1329 CG1 ILE A 82 -5.521 7.875 10.494 1.00 74.22 C ATOM 1330 CG2 ILE A 82 -4.141 9.715 9.335 1.00 4.41 C ATOM 1331 CD1 ILE A 82 -6.453 8.805 11.245 1.00 41.22 C ATOM 0 H ILE A 82 -3.426 6.343 11.484 1.00 41.04 H new ATOM 0 HA ILE A 82 -3.623 6.967 8.726 1.00 45.15 H new ATOM 0 HB ILE A 82 -3.665 8.764 11.195 1.00 75.34 H new ATOM 0 HG12 ILE A 82 -5.973 7.628 9.533 1.00 74.22 H new ATOM 0 HG13 ILE A 82 -5.431 6.944 11.053 1.00 74.22 H new ATOM 0 HG21 ILE A 82 -4.796 10.460 9.787 1.00 4.41 H new ATOM 0 HG22 ILE A 82 -3.138 10.129 9.231 1.00 4.41 H new ATOM 0 HG23 ILE A 82 -4.525 9.443 8.352 1.00 4.41 H new ATOM 0 HD11 ILE A 82 -7.422 8.323 11.373 1.00 41.22 H new ATOM 0 HD12 ILE A 82 -6.029 9.033 12.223 1.00 41.22 H new ATOM 0 HD13 ILE A 82 -6.579 9.728 10.680 1.00 41.22 H new ATOM 1343 N GLU A 83 -0.876 8.033 10.318 1.00 71.32 N ATOM 1344 CA GLU A 83 0.482 8.575 10.104 1.00 54.13 C ATOM 1345 C GLU A 83 1.366 7.568 9.318 1.00 70.33 C ATOM 1346 O GLU A 83 1.754 7.843 8.187 1.00 75.32 O ATOM 1347 CB GLU A 83 1.134 8.883 11.482 1.00 0.32 C ATOM 1348 CG GLU A 83 0.462 10.001 12.298 1.00 13.43 C ATOM 1349 CD GLU A 83 0.604 11.392 11.655 1.00 10.22 C ATOM 1350 OE1 GLU A 83 1.741 11.772 11.285 1.00 51.34 O ATOM 1351 OE2 GLU A 83 -0.397 12.128 11.559 1.00 72.21 O ATOM 0 H GLU A 83 -1.077 7.775 11.284 1.00 71.32 H new ATOM 0 HA GLU A 83 0.404 9.490 9.516 1.00 54.13 H new ATOM 0 HB2 GLU A 83 1.131 7.970 12.078 1.00 0.32 H new ATOM 0 HB3 GLU A 83 2.177 9.153 11.318 1.00 0.32 H new ATOM 0 HG2 GLU A 83 -0.596 9.769 12.416 1.00 13.43 H new ATOM 0 HG3 GLU A 83 0.897 10.024 13.297 1.00 13.43 H new ATOM 1358 N LEU A 84 1.654 6.395 9.933 1.00 5.13 N ATOM 1359 CA LEU A 84 2.309 5.228 9.266 1.00 62.11 C ATOM 1360 C LEU A 84 1.689 4.799 7.902 1.00 32.31 C ATOM 1361 O LEU A 84 2.412 4.316 7.035 1.00 21.34 O ATOM 1362 CB LEU A 84 2.335 4.023 10.268 1.00 41.24 C ATOM 1363 CG LEU A 84 3.240 4.209 11.533 1.00 53.13 C ATOM 1364 CD1 LEU A 84 3.043 3.062 12.549 1.00 23.25 C ATOM 1365 CD2 LEU A 84 4.729 4.352 11.144 1.00 70.34 C ATOM 0 H LEU A 84 1.439 6.224 10.915 1.00 5.13 H new ATOM 0 HA LEU A 84 3.317 5.552 9.007 1.00 62.11 H new ATOM 0 HB2 LEU A 84 1.315 3.828 10.599 1.00 41.24 H new ATOM 0 HB3 LEU A 84 2.671 3.136 9.731 1.00 41.24 H new ATOM 0 HG LEU A 84 2.929 5.135 12.017 1.00 53.13 H new ATOM 0 HD11 LEU A 84 3.687 3.226 13.413 1.00 23.25 H new ATOM 0 HD12 LEU A 84 2.002 3.037 12.872 1.00 23.25 H new ATOM 0 HD13 LEU A 84 3.300 2.112 12.080 1.00 23.25 H new ATOM 0 HD21 LEU A 84 5.330 4.480 12.045 1.00 70.34 H new ATOM 0 HD22 LEU A 84 5.054 3.456 10.615 1.00 70.34 H new ATOM 0 HD23 LEU A 84 4.854 5.221 10.498 1.00 70.34 H new ATOM 1377 N GLY A 85 0.375 4.990 7.714 1.00 73.05 N ATOM 1378 CA GLY A 85 -0.293 4.591 6.458 1.00 23.15 C ATOM 1379 C GLY A 85 -0.074 5.598 5.324 1.00 14.25 C ATOM 1380 O GLY A 85 0.442 5.249 4.257 1.00 34.55 O ATOM 0 H GLY A 85 -0.244 5.413 8.405 1.00 73.05 H new ATOM 0 HA2 GLY A 85 0.079 3.615 6.148 1.00 23.15 H new ATOM 0 HA3 GLY A 85 -1.362 4.481 6.639 1.00 23.15 H new ATOM 1384 N THR A 86 -0.454 6.860 5.576 1.00 0.11 N ATOM 1385 CA THR A 86 -0.292 7.987 4.616 1.00 32.51 C ATOM 1386 C THR A 86 1.192 8.240 4.232 1.00 73.32 C ATOM 1387 O THR A 86 1.502 8.489 3.070 1.00 55.31 O ATOM 1388 CB THR A 86 -0.928 9.294 5.208 1.00 34.13 C ATOM 1389 OG1 THR A 86 -2.328 9.074 5.481 1.00 0.32 O ATOM 1390 CG2 THR A 86 -0.787 10.527 4.296 1.00 33.31 C ATOM 0 H THR A 86 -0.887 7.140 6.456 1.00 0.11 H new ATOM 0 HA THR A 86 -0.813 7.705 3.701 1.00 32.51 H new ATOM 0 HB THR A 86 -0.374 9.510 6.121 1.00 34.13 H new ATOM 0 HG1 THR A 86 -2.433 8.731 6.393 1.00 0.32 H new ATOM 0 HG21 THR A 86 -1.251 11.389 4.775 1.00 33.31 H new ATOM 0 HG22 THR A 86 0.269 10.733 4.123 1.00 33.31 H new ATOM 0 HG23 THR A 86 -1.279 10.333 3.343 1.00 33.31 H new ATOM 1398 N LYS A 87 2.106 8.127 5.206 1.00 22.11 N ATOM 1399 CA LYS A 87 3.562 8.400 5.028 1.00 53.23 C ATOM 1400 C LYS A 87 4.300 7.314 4.184 1.00 75.15 C ATOM 1401 O LYS A 87 5.482 7.470 3.853 1.00 64.53 O ATOM 1402 CB LYS A 87 4.184 8.535 6.440 1.00 23.00 C ATOM 1403 CG LYS A 87 5.525 9.297 6.535 1.00 42.35 C ATOM 1404 CD LYS A 87 5.919 9.578 8.008 1.00 60.22 C ATOM 1405 CE LYS A 87 4.830 10.369 8.775 1.00 23.23 C ATOM 1406 NZ LYS A 87 5.175 10.561 10.207 1.00 2.32 N ATOM 0 H LYS A 87 1.865 7.841 6.155 1.00 22.11 H new ATOM 0 HA LYS A 87 3.680 9.321 4.457 1.00 53.23 H new ATOM 0 HB2 LYS A 87 3.461 9.036 7.084 1.00 23.00 H new ATOM 0 HB3 LYS A 87 4.332 7.534 6.844 1.00 23.00 H new ATOM 0 HG2 LYS A 87 6.310 8.715 6.053 1.00 42.35 H new ATOM 0 HG3 LYS A 87 5.448 10.239 5.992 1.00 42.35 H new ATOM 0 HD2 LYS A 87 6.103 8.632 8.518 1.00 60.22 H new ATOM 0 HD3 LYS A 87 6.853 10.139 8.030 1.00 60.22 H new ATOM 0 HE2 LYS A 87 4.691 11.342 8.304 1.00 23.23 H new ATOM 0 HE3 LYS A 87 3.880 9.840 8.700 1.00 23.23 H new ATOM 0 HZ1 LYS A 87 4.417 11.095 10.678 1.00 2.32 H new ATOM 0 HZ2 LYS A 87 5.282 9.634 10.666 1.00 2.32 H new ATOM 0 HZ3 LYS A 87 6.068 11.089 10.281 1.00 2.32 H new ATOM 1420 N HIS A 88 3.587 6.218 3.834 1.00 32.22 N ATOM 1421 CA HIS A 88 4.184 5.111 3.030 1.00 71.31 C ATOM 1422 C HIS A 88 3.722 5.278 1.555 1.00 5.13 C ATOM 1423 O HIS A 88 4.443 4.954 0.611 1.00 44.03 O ATOM 1424 CB HIS A 88 3.800 3.717 3.601 1.00 43.11 C ATOM 1425 CG HIS A 88 4.498 3.362 4.892 1.00 14.31 C ATOM 1426 ND1 HIS A 88 4.022 2.412 5.766 1.00 24.14 N ATOM 1427 CD2 HIS A 88 5.658 3.812 5.438 1.00 43.33 C ATOM 1428 CE1 HIS A 88 4.848 2.290 6.784 1.00 75.34 C ATOM 1429 NE2 HIS A 88 5.845 3.126 6.610 1.00 43.13 N ATOM 0 H HIS A 88 2.610 6.072 4.089 1.00 32.22 H new ATOM 0 HA HIS A 88 5.271 5.166 3.079 1.00 71.31 H new ATOM 0 HB2 HIS A 88 2.723 3.688 3.764 1.00 43.11 H new ATOM 0 HB3 HIS A 88 4.030 2.956 2.856 1.00 43.11 H new ATOM 0 HD2 HIS A 88 6.310 4.568 5.026 1.00 43.33 H new ATOM 0 HE1 HIS A 88 4.726 1.617 7.620 1.00 75.34 H new ATOM 0 HE2 HIS A 88 6.634 3.246 7.246 1.00 43.13 H new ATOM 1438 N PHE A 89 2.480 5.806 1.405 1.00 42.40 N ATOM 1439 CA PHE A 89 1.791 6.000 0.107 1.00 2.40 C ATOM 1440 C PHE A 89 1.980 7.457 -0.392 1.00 20.31 C ATOM 1441 O PHE A 89 2.652 7.689 -1.399 1.00 74.11 O ATOM 1442 CB PHE A 89 0.275 5.670 0.257 1.00 54.14 C ATOM 1443 CG PHE A 89 -0.053 4.188 0.514 1.00 51.13 C ATOM 1444 CD1 PHE A 89 0.377 3.541 1.677 1.00 13.44 C ATOM 1445 CD2 PHE A 89 -0.789 3.444 -0.409 1.00 53.02 C ATOM 1446 CE1 PHE A 89 0.084 2.211 1.907 1.00 40.34 C ATOM 1447 CE2 PHE A 89 -1.081 2.115 -0.175 1.00 22.14 C ATOM 1448 CZ PHE A 89 -0.645 1.497 0.980 1.00 62.32 C ATOM 0 H PHE A 89 1.920 6.114 2.200 1.00 42.40 H new ATOM 0 HA PHE A 89 2.228 5.325 -0.629 1.00 2.40 H new ATOM 0 HB2 PHE A 89 -0.129 6.262 1.078 1.00 54.14 H new ATOM 0 HB3 PHE A 89 -0.241 5.987 -0.649 1.00 54.14 H new ATOM 0 HD1 PHE A 89 0.949 4.092 2.409 1.00 13.44 H new ATOM 0 HD2 PHE A 89 -1.135 3.914 -1.318 1.00 53.02 H new ATOM 0 HE1 PHE A 89 0.426 1.731 2.812 1.00 40.34 H new ATOM 0 HE2 PHE A 89 -1.654 1.556 -0.900 1.00 22.14 H new ATOM 0 HZ PHE A 89 -0.874 0.457 1.157 1.00 62.32 H new ATOM 1458 N LEU A 90 1.388 8.445 0.336 1.00 65.51 N ATOM 1459 CA LEU A 90 1.549 9.892 0.006 1.00 34.23 C ATOM 1460 C LEU A 90 2.963 10.415 0.387 1.00 11.21 C ATOM 1461 O LEU A 90 3.343 11.527 -0.005 1.00 34.24 O ATOM 1462 CB LEU A 90 0.447 10.760 0.689 1.00 75.34 C ATOM 1463 CG LEU A 90 -1.043 10.434 0.320 1.00 71.43 C ATOM 1464 CD1 LEU A 90 -2.021 11.465 0.934 1.00 51.35 C ATOM 1465 CD2 LEU A 90 -1.245 10.328 -1.206 1.00 70.20 C ATOM 0 H LEU A 90 0.799 8.268 1.150 1.00 65.51 H new ATOM 0 HA LEU A 90 1.435 9.984 -1.074 1.00 34.23 H new ATOM 0 HB2 LEU A 90 0.558 10.662 1.769 1.00 75.34 H new ATOM 0 HB3 LEU A 90 0.637 11.805 0.443 1.00 75.34 H new ATOM 0 HG LEU A 90 -1.269 9.459 0.752 1.00 71.43 H new ATOM 0 HD11 LEU A 90 -3.043 11.207 0.657 1.00 51.35 H new ATOM 0 HD12 LEU A 90 -1.926 11.455 2.020 1.00 51.35 H new ATOM 0 HD13 LEU A 90 -1.784 12.460 0.558 1.00 51.35 H new ATOM 0 HD21 LEU A 90 -2.289 10.101 -1.420 1.00 70.20 H new ATOM 0 HD22 LEU A 90 -0.976 11.274 -1.675 1.00 70.20 H new ATOM 0 HD23 LEU A 90 -0.613 9.533 -1.602 1.00 70.20 H new ATOM 1477 N GLY A 91 3.710 9.627 1.190 1.00 44.31 N ATOM 1478 CA GLY A 91 5.149 9.858 1.436 1.00 35.03 C ATOM 1479 C GLY A 91 5.488 10.986 2.423 1.00 50.12 C ATOM 1480 O GLY A 91 6.602 11.024 2.957 1.00 53.25 O ATOM 0 H GLY A 91 3.335 8.817 1.683 1.00 44.31 H new ATOM 0 HA2 GLY A 91 5.588 8.932 1.808 1.00 35.03 H new ATOM 0 HA3 GLY A 91 5.630 10.078 0.483 1.00 35.03 H new ATOM 1484 N ARG A 92 4.537 11.907 2.668 1.00 33.00 N ATOM 1485 CA ARG A 92 4.755 13.094 3.536 1.00 74.13 C ATOM 1486 C ARG A 92 3.833 13.025 4.778 1.00 5.14 C ATOM 1487 O ARG A 92 3.124 12.025 4.968 1.00 4.31 O ATOM 1488 CB ARG A 92 4.561 14.418 2.708 1.00 64.21 C ATOM 1489 CG ARG A 92 3.129 15.029 2.607 1.00 43.20 C ATOM 1490 CD ARG A 92 2.065 14.136 1.932 1.00 74.54 C ATOM 1491 NE ARG A 92 0.797 14.871 1.729 1.00 32.41 N ATOM 1492 CZ ARG A 92 -0.256 14.849 2.529 1.00 54.51 C ATOM 1493 NH1 ARG A 92 -0.297 14.097 3.590 1.00 41.43 N ATOM 1494 NH2 ARG A 92 -1.273 15.592 2.256 1.00 15.20 N ATOM 0 H ARG A 92 3.597 11.856 2.275 1.00 33.00 H new ATOM 0 HA ARG A 92 5.782 13.096 3.901 1.00 74.13 H new ATOM 0 HB2 ARG A 92 5.216 15.176 3.137 1.00 64.21 H new ATOM 0 HB3 ARG A 92 4.913 14.230 1.694 1.00 64.21 H new ATOM 0 HG2 ARG A 92 2.787 15.273 3.613 1.00 43.20 H new ATOM 0 HG3 ARG A 92 3.192 15.967 2.055 1.00 43.20 H new ATOM 0 HD2 ARG A 92 2.440 13.782 0.972 1.00 74.54 H new ATOM 0 HD3 ARG A 92 1.883 13.255 2.548 1.00 74.54 H new ATOM 0 HE ARG A 92 0.728 15.450 0.892 1.00 32.41 H new ATOM 0 HH11 ARG A 92 0.498 13.502 3.825 1.00 41.43 H new ATOM 0 HH12 ARG A 92 -1.124 14.102 4.187 1.00 41.43 H new ATOM 0 HH21 ARG A 92 -1.261 16.190 1.429 1.00 15.20 H new ATOM 0 HH22 ARG A 92 -2.090 15.582 2.866 1.00 15.20 H new ATOM 1508 N ALA A 93 3.811 14.081 5.619 1.00 61.12 N ATOM 1509 CA ALA A 93 2.954 14.135 6.821 1.00 40.10 C ATOM 1510 C ALA A 93 1.584 14.788 6.474 1.00 21.21 C ATOM 1511 O ALA A 93 1.509 15.570 5.522 1.00 12.10 O ATOM 1512 CB ALA A 93 3.687 14.955 7.904 1.00 21.20 C ATOM 0 H ALA A 93 4.383 14.915 5.485 1.00 61.12 H new ATOM 0 HA ALA A 93 2.761 13.128 7.190 1.00 40.10 H new ATOM 0 HB1 ALA A 93 3.070 15.007 8.801 1.00 21.20 H new ATOM 0 HB2 ALA A 93 4.636 14.475 8.144 1.00 21.20 H new ATOM 0 HB3 ALA A 93 3.874 15.963 7.533 1.00 21.20 H new ATOM 1518 N PRO A 94 0.474 14.457 7.211 1.00 1.21 N ATOM 1519 CA PRO A 94 -0.847 15.151 7.054 1.00 71.21 C ATOM 1520 C PRO A 94 -0.783 16.715 7.124 1.00 34.13 C ATOM 1521 O PRO A 94 0.092 17.277 7.795 1.00 72.11 O ATOM 1522 CB PRO A 94 -1.680 14.563 8.212 1.00 2.41 C ATOM 1523 CG PRO A 94 -1.116 13.181 8.402 1.00 44.14 C ATOM 1524 CD PRO A 94 0.379 13.332 8.190 1.00 54.52 C ATOM 0 HA PRO A 94 -1.267 14.981 6.063 1.00 71.21 H new ATOM 0 HB2 PRO A 94 -1.583 15.162 9.118 1.00 2.41 H new ATOM 0 HB3 PRO A 94 -2.741 14.530 7.964 1.00 2.41 H new ATOM 0 HG2 PRO A 94 -1.336 12.799 9.399 1.00 44.14 H new ATOM 0 HG3 PRO A 94 -1.546 12.478 7.689 1.00 44.14 H new ATOM 0 HD2 PRO A 94 0.896 13.564 9.121 1.00 54.52 H new ATOM 0 HD3 PRO A 94 0.824 12.418 7.797 1.00 54.52 H new ATOM 1532 N ILE A 95 -1.760 17.405 6.467 1.00 71.33 N ATOM 1533 CA ILE A 95 -1.688 18.878 6.223 1.00 51.54 C ATOM 1534 C ILE A 95 -2.066 19.703 7.482 1.00 21.32 C ATOM 1535 O ILE A 95 -1.214 20.424 8.016 1.00 40.21 O ATOM 1536 CB ILE A 95 -2.538 19.326 4.965 1.00 4.30 C ATOM 1537 CG1 ILE A 95 -1.917 18.719 3.659 1.00 74.21 C ATOM 1538 CG2 ILE A 95 -2.644 20.877 4.860 1.00 11.24 C ATOM 1539 CD1 ILE A 95 -2.609 19.118 2.367 1.00 3.14 C ATOM 0 H ILE A 95 -2.604 16.967 6.098 1.00 71.33 H new ATOM 0 HA ILE A 95 -0.644 19.093 5.996 1.00 51.54 H new ATOM 0 HB ILE A 95 -3.552 18.945 5.089 1.00 4.30 H new ATOM 0 HG12 ILE A 95 -0.871 19.019 3.600 1.00 74.21 H new ATOM 0 HG13 ILE A 95 -1.932 17.632 3.740 1.00 74.21 H new ATOM 0 HG21 ILE A 95 -3.235 21.143 3.984 1.00 11.24 H new ATOM 0 HG22 ILE A 95 -3.126 21.270 5.755 1.00 11.24 H new ATOM 0 HG23 ILE A 95 -1.646 21.304 4.768 1.00 11.24 H new ATOM 0 HD11 ILE A 95 -2.104 18.647 1.523 1.00 3.14 H new ATOM 0 HD12 ILE A 95 -3.649 18.793 2.396 1.00 3.14 H new ATOM 0 HD13 ILE A 95 -2.571 20.201 2.253 1.00 3.14 H new ATOM 1551 N ASP A 96 -3.322 19.617 7.979 1.00 43.32 N ATOM 1552 CA ASP A 96 -3.764 20.266 9.240 1.00 72.41 C ATOM 1553 C ASP A 96 -4.101 19.076 10.199 1.00 11.11 C ATOM 1554 O ASP A 96 -3.446 18.024 10.065 1.00 75.11 O ATOM 1555 CB ASP A 96 -4.982 21.167 8.862 1.00 71.40 C ATOM 1556 CG ASP A 96 -5.633 21.890 10.037 1.00 41.32 C ATOM 1557 OD1 ASP A 96 -5.017 22.821 10.584 1.00 71.54 O ATOM 1558 OD2 ASP A 96 -6.754 21.512 10.440 1.00 14.30 O ATOM 0 H ASP A 96 -4.063 19.092 7.515 1.00 43.32 H new ATOM 0 HA ASP A 96 -3.039 20.911 9.737 1.00 72.41 H new ATOM 0 HB2 ASP A 96 -4.655 21.909 8.134 1.00 71.40 H new ATOM 0 HB3 ASP A 96 -5.734 20.549 8.372 1.00 71.40 H new ATOM 1563 N GLN A 97 -5.088 19.120 11.141 1.00 52.35 N ATOM 1564 CA GLN A 97 -5.548 17.910 11.855 1.00 13.55 C ATOM 1565 C GLN A 97 -6.826 17.379 11.158 1.00 30.11 C ATOM 1566 O GLN A 97 -7.194 16.220 11.313 1.00 10.13 O ATOM 1567 CB GLN A 97 -5.871 18.308 13.335 1.00 73.51 C ATOM 1568 CG GLN A 97 -6.436 17.181 14.235 1.00 3.44 C ATOM 1569 CD GLN A 97 -5.459 16.026 14.483 1.00 53.45 C ATOM 1570 OE1 GLN A 97 -4.245 16.212 14.537 1.00 72.15 O ATOM 1571 NE2 GLN A 97 -5.975 14.823 14.637 1.00 52.02 N ATOM 0 H GLN A 97 -5.571 19.976 11.415 1.00 52.35 H new ATOM 0 HA GLN A 97 -4.783 17.134 11.842 1.00 13.55 H new ATOM 0 HB2 GLN A 97 -4.959 18.690 13.795 1.00 73.51 H new ATOM 0 HB3 GLN A 97 -6.589 19.128 13.321 1.00 73.51 H new ATOM 0 HG2 GLN A 97 -6.726 17.609 15.195 1.00 3.44 H new ATOM 0 HG3 GLN A 97 -7.341 16.784 13.776 1.00 3.44 H new ATOM 0 HE21 GLN A 97 -6.985 14.691 14.588 1.00 52.02 H new ATOM 0 HE22 GLN A 97 -5.364 14.024 14.805 1.00 52.02 H new ATOM 1580 N ALA A 98 -7.475 18.254 10.352 1.00 3.32 N ATOM 1581 CA ALA A 98 -8.734 17.936 9.647 1.00 65.34 C ATOM 1582 C ALA A 98 -8.532 16.827 8.592 1.00 33.45 C ATOM 1583 O ALA A 98 -9.471 16.094 8.279 1.00 42.25 O ATOM 1584 CB ALA A 98 -9.314 19.203 9.005 1.00 51.33 C ATOM 0 H ALA A 98 -7.137 19.200 10.174 1.00 3.32 H new ATOM 0 HA ALA A 98 -9.445 17.557 10.381 1.00 65.34 H new ATOM 0 HB1 ALA A 98 -10.242 18.957 8.488 1.00 51.33 H new ATOM 0 HB2 ALA A 98 -9.515 19.944 9.779 1.00 51.33 H new ATOM 0 HB3 ALA A 98 -8.598 19.610 8.291 1.00 51.33 H new ATOM 1590 N GLU A 99 -7.304 16.725 8.040 1.00 54.21 N ATOM 1591 CA GLU A 99 -6.930 15.634 7.112 1.00 72.42 C ATOM 1592 C GLU A 99 -6.817 14.279 7.862 1.00 52.33 C ATOM 1593 O GLU A 99 -7.295 13.248 7.373 1.00 2.24 O ATOM 1594 CB GLU A 99 -5.614 15.976 6.361 1.00 74.13 C ATOM 1595 CG GLU A 99 -5.272 14.972 5.242 1.00 10.35 C ATOM 1596 CD GLU A 99 -4.069 15.383 4.379 1.00 31.44 C ATOM 1597 OE1 GLU A 99 -4.243 16.174 3.435 1.00 55.21 O ATOM 1598 OE2 GLU A 99 -2.954 14.907 4.625 1.00 73.32 O ATOM 0 H GLU A 99 -6.551 17.388 8.222 1.00 54.21 H new ATOM 0 HA GLU A 99 -7.721 15.534 6.369 1.00 72.42 H new ATOM 0 HB2 GLU A 99 -5.698 16.974 5.931 1.00 74.13 H new ATOM 0 HB3 GLU A 99 -4.792 16.006 7.077 1.00 74.13 H new ATOM 0 HG2 GLU A 99 -5.069 13.999 5.690 1.00 10.35 H new ATOM 0 HG3 GLU A 99 -6.143 14.851 4.598 1.00 10.35 H new ATOM 1605 N ILE A 100 -6.201 14.308 9.068 1.00 74.24 N ATOM 1606 CA ILE A 100 -6.171 13.149 10.005 1.00 21.51 C ATOM 1607 C ILE A 100 -7.613 12.736 10.405 1.00 61.31 C ATOM 1608 O ILE A 100 -7.940 11.565 10.449 1.00 2.10 O ATOM 1609 CB ILE A 100 -5.345 13.489 11.311 1.00 2.01 C ATOM 1610 CG1 ILE A 100 -3.886 13.889 10.944 1.00 13.52 C ATOM 1611 CG2 ILE A 100 -5.369 12.317 12.325 1.00 71.31 C ATOM 1612 CD1 ILE A 100 -2.980 14.220 12.121 1.00 21.12 C ATOM 0 H ILE A 100 -5.711 15.130 9.422 1.00 74.24 H new ATOM 0 HA ILE A 100 -5.685 12.322 9.487 1.00 21.51 H new ATOM 0 HB ILE A 100 -5.822 14.341 11.796 1.00 2.01 H new ATOM 0 HG12 ILE A 100 -3.435 13.073 10.380 1.00 13.52 H new ATOM 0 HG13 ILE A 100 -3.921 14.753 10.281 1.00 13.52 H new ATOM 0 HG21 ILE A 100 -4.791 12.588 13.208 1.00 71.31 H new ATOM 0 HG22 ILE A 100 -6.399 12.108 12.615 1.00 71.31 H new ATOM 0 HG23 ILE A 100 -4.934 11.429 11.866 1.00 71.31 H new ATOM 0 HD11 ILE A 100 -1.989 14.485 11.754 1.00 21.12 H new ATOM 0 HD12 ILE A 100 -3.397 15.060 12.677 1.00 21.12 H new ATOM 0 HD13 ILE A 100 -2.904 13.353 12.777 1.00 21.12 H new ATOM 1624 N ARG A 101 -8.458 13.756 10.601 1.00 2.31 N ATOM 1625 CA ARG A 101 -9.873 13.581 11.010 1.00 43.12 C ATOM 1626 C ARG A 101 -10.724 13.035 9.833 1.00 25.55 C ATOM 1627 O ARG A 101 -11.712 12.322 10.045 1.00 35.33 O ATOM 1628 CB ARG A 101 -10.472 14.888 11.601 1.00 24.00 C ATOM 1629 CG ARG A 101 -9.880 15.290 12.976 1.00 4.23 C ATOM 1630 CD ARG A 101 -10.631 16.465 13.632 1.00 61.35 C ATOM 1631 NE ARG A 101 -10.567 17.708 12.831 1.00 34.04 N ATOM 1632 CZ ARG A 101 -11.579 18.533 12.619 1.00 32.53 C ATOM 1633 NH1 ARG A 101 -12.782 18.256 13.031 1.00 62.52 N ATOM 1634 NH2 ARG A 101 -11.386 19.632 11.972 1.00 4.20 N ATOM 0 H ARG A 101 -8.187 14.732 10.482 1.00 2.31 H new ATOM 0 HA ARG A 101 -9.898 12.840 11.809 1.00 43.12 H new ATOM 0 HB2 ARG A 101 -10.308 15.702 10.895 1.00 24.00 H new ATOM 0 HB3 ARG A 101 -11.550 14.767 11.703 1.00 24.00 H new ATOM 0 HG2 ARG A 101 -9.908 14.429 13.644 1.00 4.23 H new ATOM 0 HG3 ARG A 101 -8.832 15.561 12.849 1.00 4.23 H new ATOM 0 HD2 ARG A 101 -11.675 16.186 13.778 1.00 61.35 H new ATOM 0 HD3 ARG A 101 -10.210 16.653 14.620 1.00 61.35 H new ATOM 0 HE ARG A 101 -9.670 17.948 12.408 1.00 34.04 H new ATOM 0 HH11 ARG A 101 -12.962 17.385 13.531 1.00 62.52 H new ATOM 0 HH12 ARG A 101 -13.545 18.910 12.854 1.00 62.52 H new ATOM 0 HH21 ARG A 101 -10.455 19.863 11.625 1.00 4.20 H new ATOM 0 HH22 ARG A 101 -12.164 20.270 11.807 1.00 4.20 H new ATOM 1648 N LYS A 102 -10.323 13.390 8.596 1.00 73.45 N ATOM 1649 CA LYS A 102 -10.970 12.915 7.353 1.00 42.23 C ATOM 1650 C LYS A 102 -10.727 11.384 7.168 1.00 13.23 C ATOM 1651 O LYS A 102 -11.681 10.630 6.961 1.00 54.02 O ATOM 1652 CB LYS A 102 -10.436 13.769 6.151 1.00 3.43 C ATOM 1653 CG LYS A 102 -11.109 13.548 4.760 1.00 11.34 C ATOM 1654 CD LYS A 102 -10.530 12.362 3.951 1.00 72.33 C ATOM 1655 CE LYS A 102 -9.049 12.542 3.578 1.00 73.25 C ATOM 1656 NZ LYS A 102 -8.839 13.666 2.625 1.00 52.51 N ATOM 0 H LYS A 102 -9.537 14.018 8.429 1.00 73.45 H new ATOM 0 HA LYS A 102 -12.051 13.048 7.405 1.00 42.23 H new ATOM 0 HB2 LYS A 102 -10.541 14.822 6.413 1.00 3.43 H new ATOM 0 HB3 LYS A 102 -9.369 13.572 6.045 1.00 3.43 H new ATOM 0 HG2 LYS A 102 -12.176 13.384 4.908 1.00 11.34 H new ATOM 0 HG3 LYS A 102 -11.005 14.459 4.171 1.00 11.34 H new ATOM 0 HD2 LYS A 102 -10.642 11.447 4.532 1.00 72.33 H new ATOM 0 HD3 LYS A 102 -11.114 12.234 3.039 1.00 72.33 H new ATOM 0 HE2 LYS A 102 -8.468 12.722 4.483 1.00 73.25 H new ATOM 0 HE3 LYS A 102 -8.673 11.619 3.136 1.00 73.25 H new ATOM 0 HZ1 LYS A 102 -7.828 13.738 2.390 1.00 52.51 H new ATOM 0 HZ2 LYS A 102 -9.385 13.492 1.757 1.00 52.51 H new ATOM 0 HZ3 LYS A 102 -9.157 14.555 3.061 1.00 52.51 H new ATOM 1670 N TYR A 103 -9.447 10.941 7.254 1.00 74.22 N ATOM 1671 CA TYR A 103 -9.078 9.493 7.196 1.00 30.20 C ATOM 1672 C TYR A 103 -9.624 8.697 8.421 1.00 22.34 C ATOM 1673 O TYR A 103 -10.026 7.556 8.287 1.00 51.52 O ATOM 1674 CB TYR A 103 -7.536 9.329 7.093 1.00 24.25 C ATOM 1675 CG TYR A 103 -6.928 9.803 5.758 1.00 62.20 C ATOM 1676 CD1 TYR A 103 -7.267 9.172 4.554 1.00 10.44 C ATOM 1677 CD2 TYR A 103 -6.025 10.872 5.695 1.00 43.03 C ATOM 1678 CE1 TYR A 103 -6.735 9.588 3.349 1.00 3.24 C ATOM 1679 CE2 TYR A 103 -5.492 11.290 4.489 1.00 33.32 C ATOM 1680 CZ TYR A 103 -5.849 10.645 3.320 1.00 44.33 C ATOM 1681 OH TYR A 103 -5.326 11.064 2.114 1.00 75.33 O ATOM 0 H TYR A 103 -8.647 11.564 7.364 1.00 74.22 H new ATOM 0 HA TYR A 103 -9.544 9.078 6.303 1.00 30.20 H new ATOM 0 HB2 TYR A 103 -7.070 9.884 7.907 1.00 24.25 H new ATOM 0 HB3 TYR A 103 -7.285 8.278 7.239 1.00 24.25 H new ATOM 0 HD1 TYR A 103 -7.959 8.343 4.568 1.00 10.44 H new ATOM 0 HD2 TYR A 103 -5.740 11.379 6.605 1.00 43.03 H new ATOM 0 HE1 TYR A 103 -7.012 9.088 2.433 1.00 3.24 H new ATOM 0 HE2 TYR A 103 -4.799 12.118 4.461 1.00 33.32 H new ATOM 0 HH TYR A 103 -4.719 11.819 2.265 1.00 75.33 H new ATOM 1691 N ASN A 104 -9.503 9.306 9.607 1.00 75.23 N ATOM 1692 CA ASN A 104 -10.203 8.857 10.859 1.00 61.40 C ATOM 1693 C ASN A 104 -11.710 8.518 10.623 1.00 22.21 C ATOM 1694 O ASN A 104 -12.198 7.492 11.108 1.00 23.41 O ATOM 1695 CB ASN A 104 -10.058 9.945 11.959 1.00 43.41 C ATOM 1696 CG ASN A 104 -10.895 9.704 13.217 1.00 64.13 C ATOM 1697 OD1 ASN A 104 -12.006 10.209 13.347 1.00 30.31 O ATOM 1698 ND2 ASN A 104 -10.387 8.918 14.137 1.00 61.21 N ATOM 0 H ASN A 104 -8.918 10.130 9.746 1.00 75.23 H new ATOM 0 HA ASN A 104 -9.724 7.934 11.185 1.00 61.40 H new ATOM 0 HB2 ASN A 104 -9.009 10.013 12.246 1.00 43.41 H new ATOM 0 HB3 ASN A 104 -10.336 10.910 11.534 1.00 43.41 H new ATOM 0 HD21 ASN A 104 -10.918 8.715 14.984 1.00 61.21 H new ATOM 0 HD22 ASN A 104 -9.461 8.511 14.005 1.00 61.21 H new ATOM 1705 N GLN A 105 -12.419 9.385 9.874 1.00 73.41 N ATOM 1706 CA GLN A 105 -13.855 9.191 9.546 1.00 31.34 C ATOM 1707 C GLN A 105 -14.060 8.022 8.534 1.00 11.21 C ATOM 1708 O GLN A 105 -14.984 7.222 8.677 1.00 11.32 O ATOM 1709 CB GLN A 105 -14.442 10.516 8.980 1.00 43.53 C ATOM 1710 CG GLN A 105 -15.975 10.515 8.794 1.00 3.12 C ATOM 1711 CD GLN A 105 -16.754 10.335 10.107 1.00 44.41 C ATOM 1712 OE1 GLN A 105 -16.316 10.753 11.178 1.00 50.44 O ATOM 1713 NE2 GLN A 105 -17.916 9.720 10.038 1.00 13.43 N ATOM 0 H GLN A 105 -12.020 10.237 9.479 1.00 73.41 H new ATOM 0 HA GLN A 105 -14.384 8.922 10.461 1.00 31.34 H new ATOM 0 HB2 GLN A 105 -14.171 11.333 9.649 1.00 43.53 H new ATOM 0 HB3 GLN A 105 -13.973 10.724 8.018 1.00 43.53 H new ATOM 0 HG2 GLN A 105 -16.277 11.453 8.328 1.00 3.12 H new ATOM 0 HG3 GLN A 105 -16.249 9.715 8.106 1.00 3.12 H new ATOM 0 HE21 GLN A 105 -18.261 9.381 9.140 1.00 13.43 H new ATOM 0 HE22 GLN A 105 -18.471 9.583 10.883 1.00 13.43 H new ATOM 1722 N ILE A 106 -13.206 7.999 7.495 1.00 3.11 N ATOM 1723 CA ILE A 106 -13.132 6.882 6.505 1.00 51.11 C ATOM 1724 C ILE A 106 -12.951 5.503 7.223 1.00 74.50 C ATOM 1725 O ILE A 106 -13.692 4.557 6.972 1.00 35.33 O ATOM 1726 CB ILE A 106 -11.974 7.104 5.453 1.00 21.50 C ATOM 1727 CG1 ILE A 106 -12.204 8.415 4.628 1.00 54.10 C ATOM 1728 CG2 ILE A 106 -11.823 5.880 4.517 1.00 55.25 C ATOM 1729 CD1 ILE A 106 -11.106 8.741 3.622 1.00 42.54 C ATOM 0 H ILE A 106 -12.542 8.750 7.308 1.00 3.11 H new ATOM 0 HA ILE A 106 -14.079 6.874 5.965 1.00 51.11 H new ATOM 0 HB ILE A 106 -11.042 7.216 6.008 1.00 21.50 H new ATOM 0 HG12 ILE A 106 -13.151 8.330 4.095 1.00 54.10 H new ATOM 0 HG13 ILE A 106 -12.302 9.251 5.321 1.00 54.10 H new ATOM 0 HG21 ILE A 106 -11.019 6.064 3.805 1.00 55.25 H new ATOM 0 HG22 ILE A 106 -11.588 4.996 5.109 1.00 55.25 H new ATOM 0 HG23 ILE A 106 -12.756 5.718 3.977 1.00 55.25 H new ATOM 0 HD11 ILE A 106 -11.354 9.665 3.100 1.00 42.54 H new ATOM 0 HD12 ILE A 106 -10.158 8.863 4.145 1.00 42.54 H new ATOM 0 HD13 ILE A 106 -11.020 7.928 2.901 1.00 42.54 H new ATOM 1741 N LEU A 107 -11.925 5.422 8.081 1.00 30.03 N ATOM 1742 CA LEU A 107 -11.653 4.271 8.984 1.00 72.12 C ATOM 1743 C LEU A 107 -12.885 3.876 9.860 1.00 3.52 C ATOM 1744 O LEU A 107 -13.172 2.686 10.040 1.00 70.02 O ATOM 1745 CB LEU A 107 -10.410 4.609 9.886 1.00 24.32 C ATOM 1746 CG LEU A 107 -9.281 3.527 9.985 1.00 54.43 C ATOM 1747 CD1 LEU A 107 -9.786 2.182 10.551 1.00 21.11 C ATOM 1748 CD2 LEU A 107 -8.580 3.340 8.636 1.00 60.12 C ATOM 0 H LEU A 107 -11.237 6.169 8.177 1.00 30.03 H new ATOM 0 HA LEU A 107 -11.439 3.402 8.361 1.00 72.12 H new ATOM 0 HB2 LEU A 107 -9.963 5.531 9.513 1.00 24.32 H new ATOM 0 HB3 LEU A 107 -10.770 4.815 10.894 1.00 24.32 H new ATOM 0 HG LEU A 107 -8.550 3.902 10.701 1.00 54.43 H new ATOM 0 HD11 LEU A 107 -8.959 1.473 10.596 1.00 21.11 H new ATOM 0 HD12 LEU A 107 -10.186 2.336 11.553 1.00 21.11 H new ATOM 0 HD13 LEU A 107 -10.569 1.786 9.904 1.00 21.11 H new ATOM 0 HD21 LEU A 107 -7.801 2.584 8.733 1.00 60.12 H new ATOM 0 HD22 LEU A 107 -9.307 3.019 7.890 1.00 60.12 H new ATOM 0 HD23 LEU A 107 -8.133 4.284 8.324 1.00 60.12 H new ATOM 1760 N ALA A 108 -13.590 4.884 10.403 1.00 64.14 N ATOM 1761 CA ALA A 108 -14.763 4.667 11.286 1.00 71.31 C ATOM 1762 C ALA A 108 -15.966 4.063 10.518 1.00 1.40 C ATOM 1763 O ALA A 108 -16.526 3.041 10.922 1.00 3.31 O ATOM 1764 CB ALA A 108 -15.163 5.991 11.955 1.00 20.03 C ATOM 0 H ALA A 108 -13.370 5.868 10.247 1.00 64.14 H new ATOM 0 HA ALA A 108 -14.476 3.945 12.051 1.00 71.31 H new ATOM 0 HB1 ALA A 108 -16.025 5.826 12.602 1.00 20.03 H new ATOM 0 HB2 ALA A 108 -14.329 6.365 12.549 1.00 20.03 H new ATOM 0 HB3 ALA A 108 -15.419 6.723 11.189 1.00 20.03 H new ATOM 1770 N THR A 109 -16.373 4.743 9.441 1.00 22.42 N ATOM 1771 CA THR A 109 -17.457 4.286 8.543 1.00 54.15 C ATOM 1772 C THR A 109 -17.131 2.945 7.825 1.00 73.44 C ATOM 1773 O THR A 109 -17.813 1.934 8.027 1.00 22.13 O ATOM 1774 CB THR A 109 -17.786 5.391 7.473 1.00 20.43 C ATOM 1775 OG1 THR A 109 -16.619 5.681 6.673 1.00 11.23 O ATOM 1776 CG2 THR A 109 -18.284 6.689 8.137 1.00 54.13 C ATOM 0 H THR A 109 -15.961 5.633 9.160 1.00 22.42 H new ATOM 0 HA THR A 109 -18.326 4.109 9.177 1.00 54.15 H new ATOM 0 HB THR A 109 -18.580 5.001 6.836 1.00 20.43 H new ATOM 0 HG1 THR A 109 -15.977 6.195 7.206 1.00 11.23 H new ATOM 0 HG21 THR A 109 -18.502 7.431 7.368 1.00 54.13 H new ATOM 0 HG22 THR A 109 -19.189 6.482 8.708 1.00 54.13 H new ATOM 0 HG23 THR A 109 -17.514 7.075 8.805 1.00 54.13 H new ATOM 1784 N GLN A 110 -16.080 2.954 7.000 1.00 71.12 N ATOM 1785 CA GLN A 110 -15.762 1.856 6.056 1.00 3.35 C ATOM 1786 C GLN A 110 -14.668 0.899 6.601 1.00 15.12 C ATOM 1787 O GLN A 110 -14.863 -0.326 6.636 1.00 64.22 O ATOM 1788 CB GLN A 110 -15.334 2.500 4.715 1.00 4.32 C ATOM 1789 CG GLN A 110 -16.418 3.419 4.105 1.00 0.11 C ATOM 1790 CD GLN A 110 -15.897 4.304 2.980 1.00 52.43 C ATOM 1791 OE1 GLN A 110 -15.909 3.928 1.812 1.00 1.43 O ATOM 1792 NE2 GLN A 110 -15.430 5.492 3.324 1.00 43.52 N ATOM 0 H GLN A 110 -15.415 3.726 6.961 1.00 71.12 H new ATOM 0 HA GLN A 110 -16.646 1.233 5.916 1.00 3.35 H new ATOM 0 HB2 GLN A 110 -14.423 3.078 4.872 1.00 4.32 H new ATOM 0 HB3 GLN A 110 -15.092 1.712 4.002 1.00 4.32 H new ATOM 0 HG2 GLN A 110 -17.234 2.804 3.725 1.00 0.11 H new ATOM 0 HG3 GLN A 110 -16.833 4.050 4.891 1.00 0.11 H new ATOM 0 HE21 GLN A 110 -15.433 5.777 4.303 1.00 43.52 H new ATOM 0 HE22 GLN A 110 -15.067 6.123 2.610 1.00 43.52 H new ATOM 1801 N GLY A 111 -13.526 1.470 7.024 1.00 1.03 N ATOM 1802 CA GLY A 111 -12.387 0.691 7.552 1.00 34.13 C ATOM 1803 C GLY A 111 -11.063 0.999 6.844 1.00 62.52 C ATOM 1804 O GLY A 111 -10.855 2.120 6.363 1.00 3.32 O ATOM 0 H GLY A 111 -13.365 2.477 7.011 1.00 1.03 H new ATOM 0 HA2 GLY A 111 -12.278 0.896 8.617 1.00 34.13 H new ATOM 0 HA3 GLY A 111 -12.606 -0.372 7.453 1.00 34.13 H new ATOM 1808 N ILE A 112 -10.181 -0.016 6.750 1.00 15.12 N ATOM 1809 CA ILE A 112 -8.812 0.119 6.209 1.00 41.31 C ATOM 1810 C ILE A 112 -8.798 0.133 4.668 1.00 21.41 C ATOM 1811 O ILE A 112 -7.968 0.824 4.070 1.00 31.22 O ATOM 1812 CB ILE A 112 -7.895 -1.061 6.735 1.00 12.04 C ATOM 1813 CG1 ILE A 112 -7.448 -0.806 8.208 1.00 35.43 C ATOM 1814 CG2 ILE A 112 -6.668 -1.324 5.819 1.00 64.54 C ATOM 1815 CD1 ILE A 112 -6.468 0.348 8.389 1.00 70.24 C ATOM 0 H ILE A 112 -10.401 -0.965 7.051 1.00 15.12 H new ATOM 0 HA ILE A 112 -8.421 1.075 6.558 1.00 41.31 H new ATOM 0 HB ILE A 112 -8.503 -1.965 6.708 1.00 12.04 H new ATOM 0 HG12 ILE A 112 -8.334 -0.610 8.813 1.00 35.43 H new ATOM 0 HG13 ILE A 112 -6.991 -1.716 8.597 1.00 35.43 H new ATOM 0 HG21 ILE A 112 -6.077 -2.143 6.229 1.00 64.54 H new ATOM 0 HG22 ILE A 112 -7.011 -1.590 4.819 1.00 64.54 H new ATOM 0 HG23 ILE A 112 -6.055 -0.425 5.765 1.00 64.54 H new ATOM 0 HD11 ILE A 112 -6.215 0.449 9.445 1.00 70.24 H new ATOM 0 HD12 ILE A 112 -5.562 0.149 7.816 1.00 70.24 H new ATOM 0 HD13 ILE A 112 -6.925 1.272 8.036 1.00 70.24 H new ATOM 1827 N ARG A 113 -9.694 -0.647 4.030 1.00 40.34 N ATOM 1828 CA ARG A 113 -9.672 -0.816 2.557 1.00 14.14 C ATOM 1829 C ARG A 113 -9.845 0.556 1.853 1.00 13.23 C ATOM 1830 O ARG A 113 -8.943 1.030 1.175 1.00 1.41 O ATOM 1831 CB ARG A 113 -10.810 -1.784 2.116 1.00 11.03 C ATOM 1832 CG ARG A 113 -10.837 -3.154 2.824 1.00 33.43 C ATOM 1833 CD ARG A 113 -9.629 -4.043 2.491 1.00 45.25 C ATOM 1834 NE ARG A 113 -9.744 -5.362 3.135 1.00 64.01 N ATOM 1835 CZ ARG A 113 -8.905 -6.361 2.994 1.00 65.21 C ATOM 1836 NH1 ARG A 113 -7.863 -6.263 2.233 1.00 54.02 N ATOM 1837 NH2 ARG A 113 -9.111 -7.465 3.624 1.00 23.03 N ATOM 0 H ARG A 113 -10.435 -1.166 4.502 1.00 40.34 H new ATOM 0 HA ARG A 113 -8.710 -1.239 2.269 1.00 14.14 H new ATOM 0 HB2 ARG A 113 -11.767 -1.290 2.284 1.00 11.03 H new ATOM 0 HB3 ARG A 113 -10.723 -1.952 1.043 1.00 11.03 H new ATOM 0 HG2 ARG A 113 -10.875 -2.996 3.902 1.00 33.43 H new ATOM 0 HG3 ARG A 113 -11.751 -3.679 2.547 1.00 33.43 H new ATOM 0 HD2 ARG A 113 -9.553 -4.168 1.411 1.00 45.25 H new ATOM 0 HD3 ARG A 113 -8.712 -3.554 2.820 1.00 45.25 H new ATOM 0 HE ARG A 113 -10.547 -5.513 3.745 1.00 64.01 H new ATOM 0 HH11 ARG A 113 -7.680 -5.396 1.728 1.00 54.02 H new ATOM 0 HH12 ARG A 113 -7.224 -7.053 2.139 1.00 54.02 H new ATOM 0 HH21 ARG A 113 -9.925 -7.562 4.231 1.00 23.03 H new ATOM 0 HH22 ARG A 113 -8.460 -8.243 3.516 1.00 23.03 H new ATOM 1851 N ALA A 114 -11.038 1.144 2.035 1.00 62.22 N ATOM 1852 CA ALA A 114 -11.302 2.573 1.725 1.00 12.34 C ATOM 1853 C ALA A 114 -10.276 3.609 2.295 1.00 4.41 C ATOM 1854 O ALA A 114 -10.224 4.722 1.774 1.00 4.21 O ATOM 1855 CB ALA A 114 -12.717 2.932 2.173 1.00 30.35 C ATOM 0 H ALA A 114 -11.852 0.649 2.401 1.00 62.22 H new ATOM 0 HA ALA A 114 -11.185 2.654 0.644 1.00 12.34 H new ATOM 0 HB1 ALA A 114 -12.915 3.980 1.948 1.00 30.35 H new ATOM 0 HB2 ALA A 114 -13.436 2.305 1.645 1.00 30.35 H new ATOM 0 HB3 ALA A 114 -12.811 2.768 3.246 1.00 30.35 H new ATOM 1861 N PHE A 115 -9.480 3.279 3.349 1.00 52.41 N ATOM 1862 CA PHE A 115 -8.376 4.166 3.815 1.00 32.13 C ATOM 1863 C PHE A 115 -7.192 4.109 2.819 1.00 15.13 C ATOM 1864 O PHE A 115 -6.816 5.140 2.253 1.00 21.23 O ATOM 1865 CB PHE A 115 -7.919 3.767 5.244 1.00 62.12 C ATOM 1866 CG PHE A 115 -6.589 4.383 5.720 1.00 35.05 C ATOM 1867 CD1 PHE A 115 -6.476 5.753 5.959 1.00 2.45 C ATOM 1868 CD2 PHE A 115 -5.453 3.585 5.914 1.00 34.05 C ATOM 1869 CE1 PHE A 115 -5.277 6.305 6.375 1.00 23.23 C ATOM 1870 CE2 PHE A 115 -4.257 4.139 6.334 1.00 14.00 C ATOM 1871 CZ PHE A 115 -4.169 5.499 6.559 1.00 35.43 C ATOM 0 H PHE A 115 -9.579 2.417 3.886 1.00 52.41 H new ATOM 0 HA PHE A 115 -8.744 5.191 3.856 1.00 32.13 H new ATOM 0 HB2 PHE A 115 -8.701 4.051 5.948 1.00 62.12 H new ATOM 0 HB3 PHE A 115 -7.831 2.681 5.287 1.00 62.12 H new ATOM 0 HD1 PHE A 115 -7.336 6.391 5.817 1.00 2.45 H new ATOM 0 HD2 PHE A 115 -5.512 2.522 5.733 1.00 34.05 H new ATOM 0 HE1 PHE A 115 -5.207 7.367 6.556 1.00 23.23 H new ATOM 0 HE2 PHE A 115 -3.393 3.509 6.486 1.00 14.00 H new ATOM 0 HZ PHE A 115 -3.233 5.933 6.879 1.00 35.43 H new ATOM 1881 N ILE A 116 -6.569 2.912 2.652 1.00 35.34 N ATOM 1882 CA ILE A 116 -5.560 2.640 1.599 1.00 13.22 C ATOM 1883 C ILE A 116 -5.999 3.135 0.202 1.00 25.20 C ATOM 1884 O ILE A 116 -5.291 3.925 -0.405 1.00 73.24 O ATOM 1885 CB ILE A 116 -5.262 1.086 1.556 1.00 60.42 C ATOM 1886 CG1 ILE A 116 -4.738 0.563 2.940 1.00 75.13 C ATOM 1887 CG2 ILE A 116 -4.303 0.699 0.403 1.00 14.22 C ATOM 1888 CD1 ILE A 116 -3.465 1.219 3.464 1.00 52.12 C ATOM 0 H ILE A 116 -6.755 2.106 3.249 1.00 35.34 H new ATOM 0 HA ILE A 116 -4.658 3.196 1.856 1.00 13.22 H new ATOM 0 HB ILE A 116 -6.211 0.591 1.352 1.00 60.42 H new ATOM 0 HG12 ILE A 116 -5.526 0.702 3.680 1.00 75.13 H new ATOM 0 HG13 ILE A 116 -4.563 -0.510 2.858 1.00 75.13 H new ATOM 0 HG21 ILE A 116 -4.131 -0.377 0.418 1.00 14.22 H new ATOM 0 HG22 ILE A 116 -4.748 0.982 -0.551 1.00 14.22 H new ATOM 0 HG23 ILE A 116 -3.354 1.220 0.529 1.00 14.22 H new ATOM 0 HD11 ILE A 116 -3.198 0.779 4.425 1.00 52.12 H new ATOM 0 HD12 ILE A 116 -2.654 1.059 2.754 1.00 52.12 H new ATOM 0 HD13 ILE A 116 -3.632 2.289 3.589 1.00 52.12 H new ATOM 1900 N ASN A 117 -7.135 2.615 -0.304 1.00 50.11 N ATOM 1901 CA ASN A 117 -7.819 3.142 -1.518 1.00 21.51 C ATOM 1902 C ASN A 117 -7.840 4.704 -1.594 1.00 72.25 C ATOM 1903 O ASN A 117 -7.478 5.260 -2.628 1.00 34.31 O ATOM 1904 CB ASN A 117 -9.264 2.577 -1.556 1.00 0.01 C ATOM 1905 CG ASN A 117 -10.045 2.914 -2.822 1.00 23.34 C ATOM 1906 OD1 ASN A 117 -9.485 3.060 -3.899 1.00 14.40 O ATOM 1907 ND2 ASN A 117 -11.353 3.029 -2.705 1.00 64.15 N ATOM 0 H ASN A 117 -7.611 1.815 0.114 1.00 50.11 H new ATOM 0 HA ASN A 117 -7.250 2.813 -2.388 1.00 21.51 H new ATOM 0 HB2 ASN A 117 -9.219 1.493 -1.450 1.00 0.01 H new ATOM 0 HB3 ASN A 117 -9.812 2.959 -0.695 1.00 0.01 H new ATOM 0 HD21 ASN A 117 -11.921 3.244 -3.524 1.00 64.15 H new ATOM 0 HD22 ASN A 117 -11.797 2.903 -1.795 1.00 64.15 H new ATOM 1914 N ALA A 118 -8.190 5.394 -0.482 1.00 54.32 N ATOM 1915 CA ALA A 118 -8.200 6.889 -0.424 1.00 14.34 C ATOM 1916 C ALA A 118 -6.784 7.512 -0.615 1.00 75.50 C ATOM 1917 O ALA A 118 -6.669 8.679 -0.987 1.00 34.32 O ATOM 1918 CB ALA A 118 -8.816 7.379 0.896 1.00 23.21 C ATOM 0 H ALA A 118 -8.470 4.946 0.390 1.00 54.32 H new ATOM 0 HA ALA A 118 -8.815 7.225 -1.259 1.00 14.34 H new ATOM 0 HB1 ALA A 118 -8.813 8.469 0.916 1.00 23.21 H new ATOM 0 HB2 ALA A 118 -9.841 7.017 0.975 1.00 23.21 H new ATOM 0 HB3 ALA A 118 -8.231 6.999 1.734 1.00 23.21 H new ATOM 1924 N LEU A 119 -5.723 6.729 -0.329 1.00 51.33 N ATOM 1925 CA LEU A 119 -4.306 7.131 -0.539 1.00 61.44 C ATOM 1926 C LEU A 119 -3.832 6.793 -1.987 1.00 64.10 C ATOM 1927 O LEU A 119 -3.019 7.519 -2.571 1.00 63.11 O ATOM 1928 CB LEU A 119 -3.400 6.387 0.485 1.00 41.44 C ATOM 1929 CG LEU A 119 -3.738 6.593 1.993 1.00 71.32 C ATOM 1930 CD1 LEU A 119 -2.943 5.617 2.888 1.00 64.13 C ATOM 1931 CD2 LEU A 119 -3.502 8.054 2.414 1.00 53.54 C ATOM 0 H LEU A 119 -5.821 5.790 0.058 1.00 51.33 H new ATOM 0 HA LEU A 119 -4.232 8.209 -0.395 1.00 61.44 H new ATOM 0 HB2 LEU A 119 -3.446 5.320 0.268 1.00 41.44 H new ATOM 0 HB3 LEU A 119 -2.370 6.702 0.320 1.00 41.44 H new ATOM 0 HG LEU A 119 -4.796 6.371 2.130 1.00 71.32 H new ATOM 0 HD11 LEU A 119 -3.203 5.788 3.933 1.00 64.13 H new ATOM 0 HD12 LEU A 119 -3.190 4.591 2.616 1.00 64.13 H new ATOM 0 HD13 LEU A 119 -1.875 5.783 2.748 1.00 64.13 H new ATOM 0 HD21 LEU A 119 -3.745 8.172 3.470 1.00 53.54 H new ATOM 0 HD22 LEU A 119 -2.456 8.315 2.251 1.00 53.54 H new ATOM 0 HD23 LEU A 119 -4.137 8.711 1.820 1.00 53.54 H new ATOM 1943 N VAL A 120 -4.351 5.673 -2.540 1.00 21.31 N ATOM 1944 CA VAL A 120 -3.996 5.162 -3.891 1.00 14.23 C ATOM 1945 C VAL A 120 -4.546 6.087 -5.002 1.00 71.22 C ATOM 1946 O VAL A 120 -3.782 6.665 -5.786 1.00 45.00 O ATOM 1947 CB VAL A 120 -4.550 3.691 -4.084 1.00 75.43 C ATOM 1948 CG1 VAL A 120 -4.307 3.141 -5.511 1.00 33.42 C ATOM 1949 CG2 VAL A 120 -3.953 2.740 -3.025 1.00 23.12 C ATOM 0 H VAL A 120 -5.036 5.090 -2.059 1.00 21.31 H new ATOM 0 HA VAL A 120 -2.909 5.147 -3.969 1.00 14.23 H new ATOM 0 HB VAL A 120 -5.630 3.742 -3.947 1.00 75.43 H new ATOM 0 HG11 VAL A 120 -4.707 2.130 -5.584 1.00 33.42 H new ATOM 0 HG12 VAL A 120 -4.805 3.782 -6.238 1.00 33.42 H new ATOM 0 HG13 VAL A 120 -3.237 3.123 -5.717 1.00 33.42 H new ATOM 0 HG21 VAL A 120 -4.347 1.735 -3.176 1.00 23.12 H new ATOM 0 HG22 VAL A 120 -2.867 2.723 -3.122 1.00 23.12 H new ATOM 0 HG23 VAL A 120 -4.223 3.090 -2.029 1.00 23.12 H new ATOM 1959 N ASN A 121 -5.885 6.239 -5.032 1.00 60.34 N ATOM 1960 CA ASN A 121 -6.587 7.068 -6.044 1.00 25.10 C ATOM 1961 C ASN A 121 -6.473 8.588 -5.746 1.00 60.50 C ATOM 1962 O ASN A 121 -6.942 9.408 -6.548 1.00 14.10 O ATOM 1963 CB ASN A 121 -8.075 6.618 -6.168 1.00 22.50 C ATOM 1964 CG ASN A 121 -8.881 6.725 -4.864 1.00 1.43 C ATOM 1965 OD1 ASN A 121 -8.739 7.663 -4.083 1.00 45.41 O ATOM 1966 ND2 ASN A 121 -9.706 5.736 -4.585 1.00 41.42 N ATOM 0 H ASN A 121 -6.512 5.795 -4.361 1.00 60.34 H new ATOM 0 HA ASN A 121 -6.094 6.909 -7.003 1.00 25.10 H new ATOM 0 HB2 ASN A 121 -8.562 7.223 -6.933 1.00 22.50 H new ATOM 0 HB3 ASN A 121 -8.102 5.585 -6.514 1.00 22.50 H new ATOM 0 HD21 ASN A 121 -10.235 5.744 -3.713 1.00 41.42 H new ATOM 0 HD22 ASN A 121 -9.816 4.963 -5.241 1.00 41.42 H new ATOM 1973 N SER A 122 -5.869 8.946 -4.579 1.00 74.43 N ATOM 1974 CA SER A 122 -5.555 10.349 -4.215 1.00 25.22 C ATOM 1975 C SER A 122 -4.740 11.042 -5.319 1.00 73.12 C ATOM 1976 O SER A 122 -3.852 10.420 -5.929 1.00 75.10 O ATOM 1977 CB SER A 122 -4.762 10.403 -2.890 1.00 22.42 C ATOM 1978 OG SER A 122 -4.529 11.738 -2.467 1.00 21.55 O ATOM 0 H SER A 122 -5.589 8.269 -3.869 1.00 74.43 H new ATOM 0 HA SER A 122 -6.503 10.874 -4.094 1.00 25.22 H new ATOM 0 HB2 SER A 122 -5.312 9.867 -2.116 1.00 22.42 H new ATOM 0 HB3 SER A 122 -3.808 9.890 -3.016 1.00 22.42 H new ATOM 0 HG SER A 122 -4.027 11.732 -1.625 1.00 21.55 H new ATOM 1984 N GLN A 123 -5.004 12.344 -5.543 1.00 63.44 N ATOM 1985 CA GLN A 123 -4.394 13.096 -6.650 1.00 61.01 C ATOM 1986 C GLN A 123 -2.890 13.320 -6.354 1.00 42.24 C ATOM 1987 O GLN A 123 -2.061 13.353 -7.260 1.00 5.23 O ATOM 1988 CB GLN A 123 -5.153 14.448 -6.839 1.00 52.54 C ATOM 1989 CG GLN A 123 -4.762 15.247 -8.100 1.00 62.25 C ATOM 1990 CD GLN A 123 -5.623 16.498 -8.317 1.00 42.22 C ATOM 1991 OE1 GLN A 123 -6.675 16.449 -8.951 1.00 25.54 O ATOM 1992 NE2 GLN A 123 -5.189 17.628 -7.798 1.00 33.15 N ATOM 0 H GLN A 123 -5.639 12.896 -4.967 1.00 63.44 H new ATOM 0 HA GLN A 123 -4.473 12.532 -7.580 1.00 61.01 H new ATOM 0 HB2 GLN A 123 -6.223 14.244 -6.874 1.00 52.54 H new ATOM 0 HB3 GLN A 123 -4.976 15.072 -5.963 1.00 52.54 H new ATOM 0 HG2 GLN A 123 -3.716 15.543 -8.024 1.00 62.25 H new ATOM 0 HG3 GLN A 123 -4.847 14.600 -8.973 1.00 62.25 H new ATOM 0 HE21 GLN A 123 -4.313 17.646 -7.275 1.00 33.15 H new ATOM 0 HE22 GLN A 123 -5.729 18.485 -7.919 1.00 33.15 H new ATOM 2001 N GLU A 124 -2.567 13.391 -5.045 1.00 22.42 N ATOM 2002 CA GLU A 124 -1.205 13.661 -4.542 1.00 74.24 C ATOM 2003 C GLU A 124 -0.232 12.505 -4.878 1.00 44.33 C ATOM 2004 O GLU A 124 0.858 12.747 -5.396 1.00 42.23 O ATOM 2005 CB GLU A 124 -1.242 13.918 -3.008 1.00 64.44 C ATOM 2006 CG GLU A 124 -2.358 14.888 -2.542 1.00 21.12 C ATOM 2007 CD GLU A 124 -2.421 16.201 -3.355 1.00 43.24 C ATOM 2008 OE1 GLU A 124 -1.539 17.069 -3.170 1.00 74.50 O ATOM 2009 OE2 GLU A 124 -3.352 16.370 -4.182 1.00 72.15 O ATOM 0 H GLU A 124 -3.252 13.261 -4.301 1.00 22.42 H new ATOM 0 HA GLU A 124 -0.834 14.555 -5.043 1.00 74.24 H new ATOM 0 HB2 GLU A 124 -1.371 12.964 -2.496 1.00 64.44 H new ATOM 0 HB3 GLU A 124 -0.277 14.319 -2.697 1.00 64.44 H new ATOM 0 HG2 GLU A 124 -3.320 14.381 -2.613 1.00 21.12 H new ATOM 0 HG3 GLU A 124 -2.201 15.129 -1.491 1.00 21.12 H new ATOM 2016 N TYR A 125 -0.640 11.246 -4.588 1.00 3.01 N ATOM 2017 CA TYR A 125 0.150 10.047 -4.972 1.00 34.50 C ATOM 2018 C TYR A 125 0.319 9.972 -6.506 1.00 42.21 C ATOM 2019 O TYR A 125 1.434 9.784 -7.014 1.00 21.02 O ATOM 2020 CB TYR A 125 -0.514 8.732 -4.450 1.00 12.53 C ATOM 2021 CG TYR A 125 0.212 7.442 -4.904 1.00 15.24 C ATOM 2022 CD1 TYR A 125 1.380 7.012 -4.270 1.00 30.25 C ATOM 2023 CD2 TYR A 125 -0.246 6.686 -5.991 1.00 2.32 C ATOM 2024 CE1 TYR A 125 2.062 5.888 -4.701 1.00 62.52 C ATOM 2025 CE2 TYR A 125 0.431 5.560 -6.415 1.00 42.23 C ATOM 2026 CZ TYR A 125 1.583 5.166 -5.772 1.00 4.11 C ATOM 2027 OH TYR A 125 2.267 4.054 -6.214 1.00 12.32 O ATOM 0 H TYR A 125 -1.506 11.033 -4.093 1.00 3.01 H new ATOM 0 HA TYR A 125 1.132 10.143 -4.508 1.00 34.50 H new ATOM 0 HB2 TYR A 125 -0.542 8.758 -3.361 1.00 12.53 H new ATOM 0 HB3 TYR A 125 -1.548 8.696 -4.794 1.00 12.53 H new ATOM 0 HD1 TYR A 125 1.759 7.569 -3.426 1.00 30.25 H new ATOM 0 HD2 TYR A 125 -1.145 6.990 -6.507 1.00 2.32 H new ATOM 0 HE1 TYR A 125 2.967 5.578 -4.200 1.00 62.52 H new ATOM 0 HE2 TYR A 125 0.057 4.988 -7.251 1.00 42.23 H new ATOM 0 HH TYR A 125 3.224 4.167 -6.038 1.00 12.32 H new ATOM 2037 N ASN A 126 -0.810 10.143 -7.218 1.00 51.13 N ATOM 2038 CA ASN A 126 -0.889 9.964 -8.679 1.00 35.35 C ATOM 2039 C ASN A 126 -0.029 11.012 -9.448 1.00 5.13 C ATOM 2040 O ASN A 126 0.434 10.734 -10.558 1.00 74.25 O ATOM 2041 CB ASN A 126 -2.377 10.021 -9.136 1.00 62.11 C ATOM 2042 CG ASN A 126 -2.603 9.458 -10.548 1.00 11.12 C ATOM 2043 OD1 ASN A 126 -1.941 8.513 -10.967 1.00 64.20 O ATOM 2044 ND2 ASN A 126 -3.547 10.007 -11.281 1.00 43.52 N ATOM 0 H ASN A 126 -1.698 10.411 -6.793 1.00 51.13 H new ATOM 0 HA ASN A 126 -0.476 8.984 -8.920 1.00 35.35 H new ATOM 0 HB2 ASN A 126 -2.989 9.462 -8.428 1.00 62.11 H new ATOM 0 HB3 ASN A 126 -2.719 11.055 -9.106 1.00 62.11 H new ATOM 0 HD21 ASN A 126 -3.740 9.648 -12.216 1.00 43.52 H new ATOM 0 HD22 ASN A 126 -4.086 10.792 -10.914 1.00 43.52 H new ATOM 2051 N GLU A 127 0.194 12.211 -8.858 1.00 13.21 N ATOM 2052 CA GLU A 127 1.030 13.274 -9.476 1.00 33.32 C ATOM 2053 C GLU A 127 2.520 13.183 -9.040 1.00 54.11 C ATOM 2054 O GLU A 127 3.415 13.138 -9.892 1.00 40.42 O ATOM 2055 CB GLU A 127 0.463 14.677 -9.117 1.00 50.15 C ATOM 2056 CG GLU A 127 -0.931 14.995 -9.704 1.00 43.30 C ATOM 2057 CD GLU A 127 -1.016 15.011 -11.249 1.00 60.12 C ATOM 2058 OE1 GLU A 127 -0.023 15.366 -11.925 1.00 35.43 O ATOM 2059 OE2 GLU A 127 -2.096 14.690 -11.795 1.00 32.54 O ATOM 0 H GLU A 127 -0.195 12.469 -7.951 1.00 13.21 H new ATOM 0 HA GLU A 127 0.994 13.124 -10.555 1.00 33.32 H new ATOM 0 HB2 GLU A 127 0.410 14.763 -8.032 1.00 50.15 H new ATOM 0 HB3 GLU A 127 1.166 15.435 -9.463 1.00 50.15 H new ATOM 0 HG2 GLU A 127 -1.641 14.260 -9.326 1.00 43.30 H new ATOM 0 HG3 GLU A 127 -1.250 15.968 -9.330 1.00 43.30 H new ATOM 2066 N VAL A 128 2.773 13.177 -7.707 1.00 53.15 N ATOM 2067 CA VAL A 128 4.152 13.222 -7.132 1.00 64.42 C ATOM 2068 C VAL A 128 4.968 11.948 -7.482 1.00 2.22 C ATOM 2069 O VAL A 128 6.090 12.032 -7.999 1.00 3.14 O ATOM 2070 CB VAL A 128 4.121 13.417 -5.557 1.00 61.34 C ATOM 2071 CG1 VAL A 128 5.547 13.442 -4.944 1.00 64.33 C ATOM 2072 CG2 VAL A 128 3.336 14.694 -5.172 1.00 34.12 C ATOM 0 H VAL A 128 2.037 13.141 -7.001 1.00 53.15 H new ATOM 0 HA VAL A 128 4.645 14.083 -7.584 1.00 64.42 H new ATOM 0 HB VAL A 128 3.603 12.554 -5.138 1.00 61.34 H new ATOM 0 HG11 VAL A 128 5.477 13.577 -3.865 1.00 64.33 H new ATOM 0 HG12 VAL A 128 6.052 12.501 -5.160 1.00 64.33 H new ATOM 0 HG13 VAL A 128 6.115 14.266 -5.377 1.00 64.33 H new ATOM 0 HG21 VAL A 128 3.330 14.804 -4.088 1.00 34.12 H new ATOM 0 HG22 VAL A 128 3.813 15.564 -5.622 1.00 34.12 H new ATOM 0 HG23 VAL A 128 2.311 14.614 -5.534 1.00 34.12 H new ATOM 2082 N PHE A 129 4.387 10.776 -7.191 1.00 21.11 N ATOM 2083 CA PHE A 129 5.063 9.468 -7.372 1.00 3.35 C ATOM 2084 C PHE A 129 4.725 8.851 -8.738 1.00 31.21 C ATOM 2085 O PHE A 129 5.599 8.310 -9.419 1.00 50.20 O ATOM 2086 CB PHE A 129 4.665 8.511 -6.223 1.00 25.01 C ATOM 2087 CG PHE A 129 4.950 9.101 -4.847 1.00 63.25 C ATOM 2088 CD1 PHE A 129 6.251 9.160 -4.358 1.00 24.01 C ATOM 2089 CD2 PHE A 129 3.928 9.629 -4.065 1.00 51.24 C ATOM 2090 CE1 PHE A 129 6.521 9.714 -3.127 1.00 24.43 C ATOM 2091 CE2 PHE A 129 4.198 10.189 -2.841 1.00 63.11 C ATOM 2092 CZ PHE A 129 5.494 10.230 -2.369 1.00 14.40 C ATOM 0 H PHE A 129 3.438 10.700 -6.824 1.00 21.11 H new ATOM 0 HA PHE A 129 6.141 9.628 -7.344 1.00 3.35 H new ATOM 0 HB2 PHE A 129 3.603 8.276 -6.301 1.00 25.01 H new ATOM 0 HB3 PHE A 129 5.208 7.572 -6.332 1.00 25.01 H new ATOM 0 HD1 PHE A 129 7.061 8.765 -4.953 1.00 24.01 H new ATOM 0 HD2 PHE A 129 2.910 9.598 -4.425 1.00 51.24 H new ATOM 0 HE1 PHE A 129 7.535 9.744 -2.757 1.00 24.43 H new ATOM 0 HE2 PHE A 129 3.395 10.598 -2.246 1.00 63.11 H new ATOM 0 HZ PHE A 129 5.703 10.667 -1.404 1.00 14.40 H new ATOM 2102 N GLY A 130 3.448 8.956 -9.130 1.00 0.40 N ATOM 2103 CA GLY A 130 2.967 8.421 -10.409 1.00 72.21 C ATOM 2104 C GLY A 130 2.202 7.103 -10.268 1.00 10.43 C ATOM 2105 O GLY A 130 2.238 6.450 -9.212 1.00 61.33 O ATOM 0 H GLY A 130 2.725 9.411 -8.573 1.00 0.40 H new ATOM 0 HA2 GLY A 130 2.320 9.159 -10.883 1.00 72.21 H new ATOM 0 HA3 GLY A 130 3.817 8.269 -11.074 1.00 72.21 H new ATOM 2109 N GLU A 131 1.507 6.715 -11.351 1.00 41.53 N ATOM 2110 CA GLU A 131 0.685 5.487 -11.394 1.00 24.20 C ATOM 2111 C GLU A 131 1.551 4.211 -11.526 1.00 51.13 C ATOM 2112 O GLU A 131 1.195 3.161 -11.001 1.00 53.04 O ATOM 2113 CB GLU A 131 -0.337 5.569 -12.558 1.00 64.53 C ATOM 2114 CG GLU A 131 0.303 5.662 -13.954 1.00 51.52 C ATOM 2115 CD GLU A 131 -0.733 5.801 -15.076 1.00 74.11 C ATOM 2116 OE1 GLU A 131 -1.240 4.768 -15.566 1.00 12.42 O ATOM 2117 OE2 GLU A 131 -1.055 6.949 -15.465 1.00 13.34 O ATOM 0 H GLU A 131 1.497 7.243 -12.224 1.00 41.53 H new ATOM 0 HA GLU A 131 0.149 5.418 -10.447 1.00 24.20 H new ATOM 0 HB2 GLU A 131 -0.981 4.690 -12.524 1.00 64.53 H new ATOM 0 HB3 GLU A 131 -0.976 6.439 -12.405 1.00 64.53 H new ATOM 0 HG2 GLU A 131 0.979 6.517 -13.982 1.00 51.52 H new ATOM 0 HG3 GLU A 131 0.907 4.772 -14.132 1.00 51.52 H new ATOM 2124 N ASP A 132 2.692 4.287 -12.226 1.00 40.34 N ATOM 2125 CA ASP A 132 3.545 3.095 -12.445 1.00 13.41 C ATOM 2126 C ASP A 132 5.012 3.400 -12.054 1.00 15.55 C ATOM 2127 O ASP A 132 5.943 3.347 -12.875 1.00 41.11 O ATOM 2128 CB ASP A 132 3.391 2.576 -13.912 1.00 12.12 C ATOM 2129 CG ASP A 132 3.648 1.062 -14.035 1.00 33.23 C ATOM 2130 OD1 ASP A 132 4.710 0.602 -13.596 1.00 31.33 O ATOM 2131 OD2 ASP A 132 2.779 0.324 -14.551 1.00 72.24 O ATOM 0 H ASP A 132 3.048 5.145 -12.647 1.00 40.34 H new ATOM 0 HA ASP A 132 3.214 2.285 -11.794 1.00 13.41 H new ATOM 0 HB2 ASP A 132 2.386 2.800 -14.269 1.00 12.12 H new ATOM 0 HB3 ASP A 132 4.086 3.112 -14.558 1.00 12.12 H new ATOM 2136 N THR A 133 5.176 3.746 -10.770 1.00 34.12 N ATOM 2137 CA THR A 133 6.484 4.004 -10.123 1.00 42.03 C ATOM 2138 C THR A 133 6.357 3.719 -8.604 1.00 11.31 C ATOM 2139 O THR A 133 5.287 3.938 -8.017 1.00 50.41 O ATOM 2140 CB THR A 133 6.973 5.490 -10.350 1.00 32.52 C ATOM 2141 OG1 THR A 133 7.126 5.766 -11.758 1.00 60.53 O ATOM 2142 CG2 THR A 133 8.309 5.806 -9.644 1.00 73.45 C ATOM 0 H THR A 133 4.389 3.859 -10.131 1.00 34.12 H new ATOM 0 HA THR A 133 7.225 3.345 -10.575 1.00 42.03 H new ATOM 0 HB THR A 133 6.201 6.124 -9.913 1.00 32.52 H new ATOM 0 HG1 THR A 133 6.899 4.965 -12.275 1.00 60.53 H new ATOM 0 HG21 THR A 133 8.588 6.841 -9.840 1.00 73.45 H new ATOM 0 HG22 THR A 133 8.197 5.657 -8.570 1.00 73.45 H new ATOM 0 HG23 THR A 133 9.087 5.143 -10.023 1.00 73.45 H new ATOM 2150 N VAL A 134 7.437 3.209 -7.987 1.00 62.12 N ATOM 2151 CA VAL A 134 7.506 2.961 -6.528 1.00 70.05 C ATOM 2152 C VAL A 134 7.505 4.316 -5.741 1.00 43.54 C ATOM 2153 O VAL A 134 8.232 5.244 -6.134 1.00 62.02 O ATOM 2154 CB VAL A 134 8.796 2.109 -6.185 1.00 44.24 C ATOM 2155 CG1 VAL A 134 9.002 1.922 -4.662 1.00 32.41 C ATOM 2156 CG2 VAL A 134 8.747 0.736 -6.906 1.00 42.33 C ATOM 0 H VAL A 134 8.291 2.955 -8.483 1.00 62.12 H new ATOM 0 HA VAL A 134 6.626 2.394 -6.223 1.00 70.05 H new ATOM 0 HB VAL A 134 9.655 2.672 -6.549 1.00 44.24 H new ATOM 0 HG11 VAL A 134 9.901 1.331 -4.486 1.00 32.41 H new ATOM 0 HG12 VAL A 134 9.111 2.897 -4.187 1.00 32.41 H new ATOM 0 HG13 VAL A 134 8.140 1.406 -4.239 1.00 32.41 H new ATOM 0 HG21 VAL A 134 9.641 0.163 -6.659 1.00 42.33 H new ATOM 0 HG22 VAL A 134 7.863 0.186 -6.582 1.00 42.33 H new ATOM 0 HG23 VAL A 134 8.702 0.892 -7.984 1.00 42.33 H new ATOM 2166 N PRO A 135 6.685 4.465 -4.633 1.00 34.34 N ATOM 2167 CA PRO A 135 6.640 5.708 -3.824 1.00 0.33 C ATOM 2168 C PRO A 135 7.978 5.955 -3.087 1.00 44.22 C ATOM 2169 O PRO A 135 8.164 5.546 -1.937 1.00 42.43 O ATOM 2170 CB PRO A 135 5.450 5.485 -2.848 1.00 32.44 C ATOM 2171 CG PRO A 135 5.348 3.993 -2.736 1.00 14.25 C ATOM 2172 CD PRO A 135 5.746 3.454 -4.098 1.00 22.44 C ATOM 0 HA PRO A 135 6.499 6.602 -4.432 1.00 0.33 H new ATOM 0 HB2 PRO A 135 5.637 5.946 -1.878 1.00 32.44 H new ATOM 0 HB3 PRO A 135 4.529 5.920 -3.236 1.00 32.44 H new ATOM 0 HG2 PRO A 135 6.007 3.612 -1.956 1.00 14.25 H new ATOM 0 HG3 PRO A 135 4.335 3.688 -2.474 1.00 14.25 H new ATOM 0 HD2 PRO A 135 6.220 2.476 -4.015 1.00 22.44 H new ATOM 0 HD3 PRO A 135 4.879 3.334 -4.747 1.00 22.44 H new ATOM 2180 N TYR A 136 8.907 6.600 -3.811 1.00 24.23 N ATOM 2181 CA TYR A 136 10.283 6.870 -3.357 1.00 52.05 C ATOM 2182 C TYR A 136 10.337 7.689 -2.047 1.00 33.34 C ATOM 2183 O TYR A 136 9.370 8.364 -1.659 1.00 14.00 O ATOM 2184 CB TYR A 136 11.073 7.601 -4.480 1.00 21.10 C ATOM 2185 CG TYR A 136 10.409 8.901 -4.990 1.00 25.21 C ATOM 2186 CD1 TYR A 136 10.612 10.128 -4.347 1.00 33.43 C ATOM 2187 CD2 TYR A 136 9.580 8.895 -6.119 1.00 13.33 C ATOM 2188 CE1 TYR A 136 10.013 11.285 -4.806 1.00 1.03 C ATOM 2189 CE2 TYR A 136 8.984 10.047 -6.582 1.00 11.03 C ATOM 2190 CZ TYR A 136 9.201 11.239 -5.923 1.00 41.32 C ATOM 2191 OH TYR A 136 8.596 12.388 -6.375 1.00 31.13 O ATOM 0 H TYR A 136 8.720 6.956 -4.748 1.00 24.23 H new ATOM 0 HA TYR A 136 10.744 5.906 -3.142 1.00 52.05 H new ATOM 0 HB2 TYR A 136 12.070 7.839 -4.109 1.00 21.10 H new ATOM 0 HB3 TYR A 136 11.200 6.919 -5.321 1.00 21.10 H new ATOM 0 HD1 TYR A 136 11.249 10.171 -3.476 1.00 33.43 H new ATOM 0 HD2 TYR A 136 9.404 7.965 -6.639 1.00 13.33 H new ATOM 0 HE1 TYR A 136 10.179 12.221 -4.294 1.00 1.03 H new ATOM 0 HE2 TYR A 136 8.350 10.017 -7.456 1.00 11.03 H new ATOM 0 HH TYR A 136 7.795 12.155 -6.889 1.00 31.13 H new ATOM 2201 N ARG A 137 11.503 7.632 -1.398 1.00 23.44 N ATOM 2202 CA ARG A 137 11.784 8.382 -0.166 1.00 64.33 C ATOM 2203 C ARG A 137 11.796 9.904 -0.468 1.00 72.31 C ATOM 2204 O ARG A 137 12.497 10.353 -1.379 1.00 14.44 O ATOM 2205 CB ARG A 137 13.154 7.921 0.418 1.00 53.32 C ATOM 2206 CG ARG A 137 13.383 8.259 1.907 1.00 25.12 C ATOM 2207 CD ARG A 137 12.416 7.502 2.835 1.00 32.41 C ATOM 2208 NE ARG A 137 12.779 7.657 4.251 1.00 51.44 N ATOM 2209 CZ ARG A 137 12.266 6.974 5.253 1.00 41.44 C ATOM 2210 NH1 ARG A 137 11.318 6.098 5.068 1.00 52.41 N ATOM 2211 NH2 ARG A 137 12.707 7.174 6.448 1.00 13.45 N ATOM 0 H ARG A 137 12.286 7.060 -1.714 1.00 23.44 H new ATOM 0 HA ARG A 137 11.005 8.186 0.571 1.00 64.33 H new ATOM 0 HB2 ARG A 137 13.241 6.842 0.290 1.00 53.32 H new ATOM 0 HB3 ARG A 137 13.952 8.377 -0.168 1.00 53.32 H new ATOM 0 HG2 ARG A 137 14.410 8.014 2.179 1.00 25.12 H new ATOM 0 HG3 ARG A 137 13.261 9.332 2.056 1.00 25.12 H new ATOM 0 HD2 ARG A 137 11.401 7.868 2.678 1.00 32.41 H new ATOM 0 HD3 ARG A 137 12.417 6.444 2.574 1.00 32.41 H new ATOM 0 HE ARG A 137 13.489 8.353 4.477 1.00 51.44 H new ATOM 0 HH11 ARG A 137 10.956 5.928 4.129 1.00 52.41 H new ATOM 0 HH12 ARG A 137 10.938 5.582 5.862 1.00 52.41 H new ATOM 0 HH21 ARG A 137 13.447 7.857 6.611 1.00 13.45 H new ATOM 0 HH22 ARG A 137 12.316 6.650 7.230 1.00 13.45 H new ATOM 2225 N ARG A 138 11.031 10.688 0.314 1.00 13.31 N ATOM 2226 CA ARG A 138 10.914 12.170 0.145 1.00 43.22 C ATOM 2227 C ARG A 138 12.112 12.940 0.774 1.00 2.25 C ATOM 2228 O ARG A 138 12.002 14.123 1.120 1.00 43.12 O ATOM 2229 CB ARG A 138 9.568 12.639 0.771 1.00 12.20 C ATOM 2230 CG ARG A 138 8.302 12.084 0.080 1.00 12.42 C ATOM 2231 CD ARG A 138 8.186 12.514 -1.398 1.00 1.22 C ATOM 2232 NE ARG A 138 8.245 13.977 -1.566 1.00 25.22 N ATOM 2233 CZ ARG A 138 7.228 14.808 -1.455 1.00 5.01 C ATOM 2234 NH1 ARG A 138 6.013 14.382 -1.234 1.00 22.24 N ATOM 2235 NH2 ARG A 138 7.440 16.075 -1.571 1.00 41.42 N ATOM 0 H ARG A 138 10.472 10.323 1.085 1.00 13.31 H new ATOM 0 HA ARG A 138 10.934 12.396 -0.921 1.00 43.22 H new ATOM 0 HB2 ARG A 138 9.550 12.345 1.820 1.00 12.20 H new ATOM 0 HB3 ARG A 138 9.531 13.728 0.744 1.00 12.20 H new ATOM 0 HG2 ARG A 138 8.311 10.996 0.137 1.00 12.42 H new ATOM 0 HG3 ARG A 138 7.420 12.424 0.622 1.00 12.42 H new ATOM 0 HD2 ARG A 138 8.990 12.053 -1.971 1.00 1.22 H new ATOM 0 HD3 ARG A 138 7.248 12.142 -1.809 1.00 1.22 H new ATOM 0 HE ARG A 138 9.154 14.383 -1.788 1.00 25.22 H new ATOM 0 HH11 ARG A 138 5.832 13.382 -1.143 1.00 22.24 H new ATOM 0 HH12 ARG A 138 5.246 15.049 -1.153 1.00 22.24 H new ATOM 0 HH21 ARG A 138 8.384 16.420 -1.746 1.00 41.42 H new ATOM 0 HH22 ARG A 138 6.664 16.732 -1.488 1.00 41.42 H new ATOM 2249 N PHE A 139 13.265 12.266 0.849 1.00 14.05 N ATOM 2250 CA PHE A 139 14.475 12.738 1.549 1.00 52.25 C ATOM 2251 C PHE A 139 15.719 12.545 0.634 1.00 51.14 C ATOM 2252 O PHE A 139 15.644 11.793 -0.353 1.00 33.35 O ATOM 2253 CB PHE A 139 14.621 11.947 2.887 1.00 4.53 C ATOM 2254 CG PHE A 139 13.473 12.197 3.869 1.00 64.42 C ATOM 2255 CD1 PHE A 139 13.466 13.332 4.682 1.00 45.24 C ATOM 2256 CD2 PHE A 139 12.389 11.318 3.959 1.00 24.24 C ATOM 2257 CE1 PHE A 139 12.420 13.576 5.552 1.00 5.13 C ATOM 2258 CE2 PHE A 139 11.347 11.561 4.829 1.00 54.42 C ATOM 2259 CZ PHE A 139 11.363 12.691 5.624 1.00 72.14 C ATOM 0 H PHE A 139 13.390 11.352 0.414 1.00 14.05 H new ATOM 0 HA PHE A 139 14.394 13.800 1.778 1.00 52.25 H new ATOM 0 HB2 PHE A 139 14.675 10.881 2.666 1.00 4.53 H new ATOM 0 HB3 PHE A 139 15.562 12.222 3.362 1.00 4.53 H new ATOM 0 HD1 PHE A 139 14.289 14.029 4.630 1.00 45.24 H new ATOM 0 HD2 PHE A 139 12.368 10.435 3.337 1.00 24.24 H new ATOM 0 HE1 PHE A 139 12.430 14.458 6.175 1.00 5.13 H new ATOM 0 HE2 PHE A 139 10.520 10.869 4.889 1.00 54.42 H new ATOM 0 HZ PHE A 139 10.546 12.882 6.304 1.00 72.14 H new ATOM 2269 N PRO A 140 16.881 13.230 0.920 1.00 14.30 N ATOM 2270 CA PRO A 140 18.138 13.068 0.119 1.00 34.53 C ATOM 2271 C PRO A 140 18.903 11.733 0.402 1.00 31.10 C ATOM 2272 O PRO A 140 20.122 11.732 0.627 1.00 23.55 O ATOM 2273 CB PRO A 140 18.962 14.312 0.550 1.00 54.15 C ATOM 2274 CG PRO A 140 18.538 14.561 1.966 1.00 14.42 C ATOM 2275 CD PRO A 140 17.054 14.256 1.996 1.00 3.52 C ATOM 0 HA PRO A 140 17.943 13.008 -0.952 1.00 34.53 H new ATOM 0 HB2 PRO A 140 20.033 14.123 0.482 1.00 54.15 H new ATOM 0 HB3 PRO A 140 18.749 15.171 -0.086 1.00 54.15 H new ATOM 0 HG2 PRO A 140 19.085 13.922 2.659 1.00 14.42 H new ATOM 0 HG3 PRO A 140 18.734 15.592 2.260 1.00 14.42 H new ATOM 0 HD2 PRO A 140 16.743 13.873 2.968 1.00 3.52 H new ATOM 0 HD3 PRO A 140 16.458 15.147 1.799 1.00 3.52 H new ATOM 2283 N THR A 141 18.184 10.596 0.337 1.00 65.54 N ATOM 2284 CA THR A 141 18.753 9.240 0.573 1.00 4.33 C ATOM 2285 C THR A 141 18.670 8.349 -0.698 1.00 63.24 C ATOM 2286 O THR A 141 19.151 7.212 -0.691 1.00 35.23 O ATOM 2287 CB THR A 141 17.993 8.514 1.735 1.00 62.32 C ATOM 2288 OG1 THR A 141 16.615 8.320 1.367 1.00 74.22 O ATOM 2289 CG2 THR A 141 18.055 9.299 3.061 1.00 74.31 C ATOM 0 H THR A 141 17.188 10.584 0.119 1.00 65.54 H new ATOM 0 HA THR A 141 19.800 9.383 0.840 1.00 4.33 H new ATOM 0 HB THR A 141 18.487 7.555 1.892 1.00 62.32 H new ATOM 0 HG1 THR A 141 16.408 7.362 1.366 1.00 74.22 H new ATOM 0 HG21 THR A 141 17.513 8.753 3.833 1.00 74.31 H new ATOM 0 HG22 THR A 141 19.095 9.420 3.364 1.00 74.31 H new ATOM 0 HG23 THR A 141 17.601 10.280 2.924 1.00 74.31 H new ATOM 2297 N LEU A 142 18.079 8.890 -1.792 1.00 65.24 N ATOM 2298 CA LEU A 142 17.731 8.114 -3.020 1.00 3.42 C ATOM 2299 C LEU A 142 18.958 7.514 -3.759 1.00 3.22 C ATOM 2300 O LEU A 142 18.836 6.472 -4.423 1.00 13.40 O ATOM 2301 CB LEU A 142 16.914 9.004 -4.002 1.00 21.14 C ATOM 2302 CG LEU A 142 15.519 9.493 -3.495 1.00 2.20 C ATOM 2303 CD1 LEU A 142 14.803 10.359 -4.557 1.00 50.53 C ATOM 2304 CD2 LEU A 142 14.637 8.302 -3.059 1.00 73.40 C ATOM 0 H LEU A 142 17.828 9.877 -1.853 1.00 65.24 H new ATOM 0 HA LEU A 142 17.133 7.269 -2.679 1.00 3.42 H new ATOM 0 HB2 LEU A 142 17.514 9.879 -4.250 1.00 21.14 H new ATOM 0 HB3 LEU A 142 16.766 8.446 -4.927 1.00 21.14 H new ATOM 0 HG LEU A 142 15.689 10.121 -2.621 1.00 2.20 H new ATOM 0 HD11 LEU A 142 13.836 10.682 -4.171 1.00 50.53 H new ATOM 0 HD12 LEU A 142 15.413 11.233 -4.785 1.00 50.53 H new ATOM 0 HD13 LEU A 142 14.654 9.773 -5.464 1.00 50.53 H new ATOM 0 HD21 LEU A 142 13.673 8.672 -2.711 1.00 73.40 H new ATOM 0 HD22 LEU A 142 14.485 7.633 -3.906 1.00 73.40 H new ATOM 0 HD23 LEU A 142 15.130 7.760 -2.252 1.00 73.40 H new ATOM 2316 N GLU A 143 20.131 8.159 -3.626 1.00 50.22 N ATOM 2317 CA GLU A 143 21.392 7.759 -4.321 1.00 51.41 C ATOM 2318 C GLU A 143 21.952 6.386 -3.814 1.00 41.44 C ATOM 2319 O GLU A 143 22.892 5.856 -4.412 1.00 0.33 O ATOM 2320 CB GLU A 143 22.445 8.899 -4.139 1.00 51.24 C ATOM 2321 CG GLU A 143 23.817 8.692 -4.831 1.00 44.14 C ATOM 2322 CD GLU A 143 24.875 9.732 -4.424 1.00 51.50 C ATOM 2323 OE1 GLU A 143 25.074 9.941 -3.207 1.00 11.14 O ATOM 2324 OE2 GLU A 143 25.532 10.333 -5.303 1.00 43.51 O ATOM 0 H GLU A 143 20.243 8.980 -3.031 1.00 50.22 H new ATOM 0 HA GLU A 143 21.173 7.617 -5.379 1.00 51.41 H new ATOM 0 HB2 GLU A 143 22.011 9.827 -4.513 1.00 51.24 H new ATOM 0 HB3 GLU A 143 22.619 9.036 -3.072 1.00 51.24 H new ATOM 0 HG2 GLU A 143 24.188 7.695 -4.592 1.00 44.14 H new ATOM 0 HG3 GLU A 143 23.679 8.730 -5.912 1.00 44.14 H new ATOM 2331 N HIS A 144 21.343 5.822 -2.728 1.00 45.34 N ATOM 2332 CA HIS A 144 21.747 4.524 -2.097 1.00 54.23 C ATOM 2333 C HIS A 144 22.251 3.445 -3.112 1.00 43.40 C ATOM 2334 O HIS A 144 21.499 2.969 -3.979 1.00 53.01 O ATOM 2335 CB HIS A 144 20.585 3.963 -1.208 1.00 72.44 C ATOM 2336 CG HIS A 144 19.197 3.973 -1.832 1.00 20.12 C ATOM 2337 ND1 HIS A 144 18.151 4.703 -1.307 1.00 33.45 N ATOM 2338 CD2 HIS A 144 18.676 3.328 -2.912 1.00 52.34 C ATOM 2339 CE1 HIS A 144 17.066 4.510 -2.022 1.00 74.25 C ATOM 2340 NE2 HIS A 144 17.355 3.684 -3.003 1.00 12.22 N ATOM 0 H HIS A 144 20.549 6.260 -2.260 1.00 45.34 H new ATOM 0 HA HIS A 144 22.608 4.751 -1.469 1.00 54.23 H new ATOM 0 HB2 HIS A 144 20.829 2.937 -0.932 1.00 72.44 H new ATOM 0 HB3 HIS A 144 20.550 4.542 -0.285 1.00 72.44 H new ATOM 0 HD1 HIS A 144 18.211 5.304 -0.485 1.00 33.45 H new ATOM 0 HD2 HIS A 144 19.205 2.659 -3.575 1.00 52.34 H new ATOM 0 HE1 HIS A 144 16.100 4.955 -1.835 1.00 74.25 H new ATOM 2349 N HIS A 145 23.555 3.115 -3.004 1.00 63.43 N ATOM 2350 CA HIS A 145 24.242 2.177 -3.905 1.00 3.30 C ATOM 2351 C HIS A 145 23.656 0.749 -3.768 1.00 44.35 C ATOM 2352 O HIS A 145 23.557 0.206 -2.665 1.00 33.04 O ATOM 2353 CB HIS A 145 25.765 2.183 -3.623 1.00 54.23 C ATOM 2354 CG HIS A 145 26.554 1.281 -4.539 1.00 10.32 C ATOM 2355 ND1 HIS A 145 26.791 -0.047 -4.258 1.00 63.31 N ATOM 2356 CD2 HIS A 145 27.139 1.514 -5.738 1.00 62.14 C ATOM 2357 CE1 HIS A 145 27.476 -0.588 -5.238 1.00 63.20 C ATOM 2358 NE2 HIS A 145 27.702 0.333 -6.148 1.00 51.41 N ATOM 0 H HIS A 145 24.163 3.498 -2.280 1.00 63.43 H new ATOM 0 HA HIS A 145 24.081 2.503 -4.933 1.00 3.30 H new ATOM 0 HB2 HIS A 145 26.140 3.202 -3.720 1.00 54.23 H new ATOM 0 HB3 HIS A 145 25.936 1.877 -2.591 1.00 54.23 H new ATOM 0 HD2 HIS A 145 27.158 2.453 -6.271 1.00 62.14 H new ATOM 0 HE1 HIS A 145 27.800 -1.617 -5.288 1.00 63.20 H new ATOM 0 HE2 HIS A 145 28.214 0.192 -7.019 1.00 51.41 H new ATOM 2367 N HIS A 146 23.301 0.163 -4.915 1.00 51.03 N ATOM 2368 CA HIS A 146 22.582 -1.124 -5.005 1.00 71.35 C ATOM 2369 C HIS A 146 23.378 -2.147 -5.857 1.00 1.54 C ATOM 2370 O HIS A 146 23.927 -1.803 -6.912 1.00 3.41 O ATOM 2371 CB HIS A 146 21.161 -0.868 -5.589 1.00 70.12 C ATOM 2372 CG HIS A 146 21.146 0.031 -6.807 1.00 53.43 C ATOM 2373 ND1 HIS A 146 21.291 1.400 -6.721 1.00 34.15 N ATOM 2374 CD2 HIS A 146 21.033 -0.243 -8.132 1.00 53.04 C ATOM 2375 CE1 HIS A 146 21.271 1.923 -7.926 1.00 31.33 C ATOM 2376 NE2 HIS A 146 21.117 0.953 -8.802 1.00 74.42 N ATOM 0 H HIS A 146 23.506 0.572 -5.827 1.00 51.03 H new ATOM 0 HA HIS A 146 22.481 -1.558 -4.010 1.00 71.35 H new ATOM 0 HB2 HIS A 146 20.710 -1.825 -5.851 1.00 70.12 H new ATOM 0 HB3 HIS A 146 20.536 -0.423 -4.815 1.00 70.12 H new ATOM 0 HD1 HIS A 146 21.398 1.926 -5.854 1.00 34.15 H new ATOM 0 HD2 HIS A 146 20.902 -1.219 -8.576 1.00 53.04 H new ATOM 0 HE1 HIS A 146 21.365 2.973 -8.159 1.00 31.33 H new ATOM 2385 N HIS A 147 23.442 -3.399 -5.366 1.00 13.21 N ATOM 2386 CA HIS A 147 24.130 -4.515 -6.054 1.00 25.54 C ATOM 2387 C HIS A 147 23.322 -5.026 -7.274 1.00 20.34 C ATOM 2388 O HIS A 147 22.138 -4.702 -7.442 1.00 62.14 O ATOM 2389 CB HIS A 147 24.393 -5.685 -5.062 1.00 13.34 C ATOM 2390 CG HIS A 147 23.139 -6.333 -4.528 1.00 50.41 C ATOM 2391 ND1 HIS A 147 22.549 -7.437 -5.114 1.00 34.02 N ATOM 2392 CD2 HIS A 147 22.354 -6.014 -3.473 1.00 33.53 C ATOM 2393 CE1 HIS A 147 21.460 -7.756 -4.446 1.00 33.42 C ATOM 2394 NE2 HIS A 147 21.325 -6.913 -3.447 1.00 13.23 N ATOM 0 H HIS A 147 23.018 -3.669 -4.479 1.00 13.21 H new ATOM 0 HA HIS A 147 25.083 -4.133 -6.421 1.00 25.54 H new ATOM 0 HB2 HIS A 147 24.996 -6.443 -5.562 1.00 13.34 H new ATOM 0 HB3 HIS A 147 24.981 -5.311 -4.224 1.00 13.34 H new ATOM 0 HD2 HIS A 147 22.511 -5.200 -2.780 1.00 33.53 H new ATOM 0 HE1 HIS A 147 20.792 -8.572 -4.679 1.00 33.42 H new ATOM 0 HE2 HIS A 147 20.571 -6.927 -2.760 1.00 13.23 H new ATOM 2403 N HIS A 148 23.983 -5.850 -8.102 1.00 54.12 N ATOM 2404 CA HIS A 148 23.363 -6.476 -9.295 1.00 4.23 C ATOM 2405 C HIS A 148 22.705 -7.831 -8.926 1.00 74.12 C ATOM 2406 O HIS A 148 23.314 -8.647 -8.213 1.00 44.11 O ATOM 2407 CB HIS A 148 24.424 -6.675 -10.413 1.00 3.40 C ATOM 2408 CG HIS A 148 25.100 -5.399 -10.842 1.00 1.42 C ATOM 2409 ND1 HIS A 148 24.597 -4.574 -11.824 1.00 42.45 N ATOM 2410 CD2 HIS A 148 26.233 -4.795 -10.404 1.00 14.14 C ATOM 2411 CE1 HIS A 148 25.382 -3.527 -11.966 1.00 53.54 C ATOM 2412 NE2 HIS A 148 26.380 -3.636 -11.117 1.00 40.44 N ATOM 0 H HIS A 148 24.962 -6.105 -7.969 1.00 54.12 H new ATOM 0 HA HIS A 148 22.585 -5.809 -9.666 1.00 4.23 H new ATOM 0 HB2 HIS A 148 25.181 -7.376 -10.062 1.00 3.40 H new ATOM 0 HB3 HIS A 148 23.945 -7.131 -11.279 1.00 3.40 H new ATOM 0 HD2 HIS A 148 26.897 -5.161 -9.635 1.00 14.14 H new ATOM 0 HE1 HIS A 148 25.232 -2.715 -12.662 1.00 53.54 H new ATOM 0 HE2 HIS A 148 27.141 -2.965 -11.007 1.00 40.44 H new ATOM 2421 N HIS A 149 21.460 -8.048 -9.407 1.00 34.14 N ATOM 2422 CA HIS A 149 20.700 -9.307 -9.191 1.00 43.14 C ATOM 2423 C HIS A 149 19.447 -9.322 -10.092 1.00 5.10 C ATOM 2424 O HIS A 149 18.872 -10.377 -10.387 1.00 13.02 O ATOM 2425 CB HIS A 149 20.301 -9.476 -7.689 1.00 34.42 C ATOM 2426 CG HIS A 149 19.834 -10.867 -7.317 1.00 21.13 C ATOM 2427 ND1 HIS A 149 20.712 -11.893 -7.041 1.00 42.25 N ATOM 2428 CD2 HIS A 149 18.591 -11.406 -7.181 1.00 73.00 C ATOM 2429 CE1 HIS A 149 20.044 -12.989 -6.764 1.00 45.03 C ATOM 2430 NE2 HIS A 149 18.758 -12.722 -6.838 1.00 32.24 N ATOM 0 H HIS A 149 20.951 -7.356 -9.957 1.00 34.14 H new ATOM 0 HA HIS A 149 21.341 -10.147 -9.458 1.00 43.14 H new ATOM 0 HB2 HIS A 149 21.157 -9.215 -7.067 1.00 34.42 H new ATOM 0 HB3 HIS A 149 19.509 -8.765 -7.454 1.00 34.42 H new ATOM 0 HD2 HIS A 149 17.651 -10.893 -7.318 1.00 73.00 H new ATOM 0 HE1 HIS A 149 20.477 -13.947 -6.517 1.00 45.03 H new ATOM 0 HE2 HIS A 149 18.005 -13.389 -6.667 1.00 32.24 H new TER 2439 HIS A 149