USER MOD reduce.3.24.130724 H: found=0, std=0, add=1205, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1208 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 135 LYS NZ :NH3+ -111:sc= 0.963 (180deg=-1.89!) USER MOD Set 1.2: A 148 SER OG : rot 180:sc= 0.802 USER MOD Set 2.1: A 119 LYS NZ :NH3+ -102:sc= 0.92 (180deg=-1) USER MOD Set 2.2: A 121 TYR OH : rot -118:sc= -0.0758 USER MOD Set 3.1: A 80 TYR OH : rot -133:sc= -3.71! USER MOD Set 3.2: A 82 THR OG1 : rot 180:sc= -2.73! USER MOD Set 3.3: A 108 ASN : amide:sc= -0.891 X(o=-7.3,f=-6.9) USER MOD Set 4.1: A 30 GLN : amide:sc= -16.1! C(o=-22!,f=-13!) USER MOD Set 4.2: A 136 GLN : amide:sc= -5.71! K(o=-22!,f=-12) USER MOD Set 5.1: A 25 ASN : amide:sc= -6.6! C(o=-8.8!,f=-9.7!) USER MOD Set 5.2: A 31 SER OG : rot -11:sc= -1.2! USER MOD Set 5.3: A 153 GLN : amide:sc= -0.956 K(o=-8.8,f=-10) USER MOD Single : A 9 ASN : amide:sc=-0.00451 K(o=-0.0045,f=0.52) USER MOD Single : A 11 LYS NZ :NH3+ 162:sc= -0.0768 (180deg=-0.378) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -11.4! C(o=-11!,f=-10!) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= 0.955 K(o=0.96,f=-0.094) USER MOD Single : A 36 ASN : amide:sc= -0.117 K(o=-0.12,f=-7.7!) USER MOD Single : A 38 GLN : amide:sc= -0.541 K(o=-0.54,f=-0.0043) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=-0.083) USER MOD Single : A 53 LYS NZ :NH3+ -149:sc= 1.22 (180deg=0.976) USER MOD Single : A 56 MET CE :methyl -144:sc= -0.252 (180deg=-0.922) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= 0.672 (180deg=-0.137) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 167:sc= -0.0229 (180deg=-0.218) USER MOD Single : A 67 LYS NZ :NH3+ -131:sc= 1.17 (180deg=0.156) USER MOD Single : A 69 THR OG1 : rot 17:sc= 0.536 USER MOD Single : A 75 SER OG : rot -170:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ -170:sc= -0.0207 (180deg=-0.165) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.142 K(o=-0.14,f=-1.1) USER MOD Single : A 84 GLN : amide:sc= -2.18 K(o=-2.2,f=-3.4!) USER MOD Single : A 88 GLN : amide:sc= -0.17 K(o=-0.17,f=-0.75) USER MOD Single : A 93 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.229) USER MOD Single : A 95 MET CE :methyl 150:sc= -0.0341 (180deg=-1.54!) USER MOD Single : A 100 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00566) USER MOD Single : A 101 THR OG1 : rot -43:sc= 0.64 USER MOD Single : A 103 THR OG1 : rot -140:sc= -3.07! USER MOD Single : A 105 SER OG : rot 72:sc= 1.33 USER MOD Single : A 107 THR OG1 : rot -39:sc= -0.11 USER MOD Single : A 115 THR OG1 : rot 32:sc= 0.498 USER MOD Single : A 116 HIS : no HD1:sc= -0.0351 X(o=-0.035,f=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -7.34! C(o=-7.3!,f=-7.4!) USER MOD Single : A 123 THR OG1 : rot 118:sc= 1.11 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= -0.427 K(o=-0.43,f=0.085) USER MOD Single : A 129 ASN : amide:sc= 0.174 X(o=0.17,f=0) USER MOD Single : A 134 THR OG1 : rot 131:sc= 0.311 USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 CYS SG : rot -144:sc= 0.865! USER MOD Single : A 150 THR OG1 : rot 158:sc= -0.358 USER MOD Single : A 157 ASN : amide:sc= -2.2 K(o=-2.2,f=-4.5!) USER MOD Single : A 158 GLN : amide:sc= -3.91! K(o=-3.9!,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 9 25.387 1.772 -5.442 1.00 4.20 N ATOM 2 CA ASN A 9 25.465 0.296 -5.525 1.00 4.32 C ATOM 3 C ASN A 9 24.082 -0.313 -5.382 1.00 4.11 C ATOM 4 O ASN A 9 23.084 0.407 -5.303 1.00 4.02 O ATOM 5 CB ASN A 9 26.382 -0.252 -4.425 1.00 4.41 C ATOM 6 CG ASN A 9 27.847 0.031 -4.681 1.00 4.99 C ATOM 7 OD1 ASN A 9 28.205 1.035 -5.300 1.00 5.29 O ATOM 8 ND2 ASN A 9 28.707 -0.864 -4.219 1.00 5.50 N ATOM 0 HA ASN A 9 25.875 0.028 -6.499 1.00 4.32 H new ATOM 0 HB2 ASN A 9 26.095 0.185 -3.469 1.00 4.41 H new ATOM 0 HB3 ASN A 9 26.235 -1.329 -4.340 1.00 4.41 H new ATOM 0 HD21 ASN A 9 29.707 -0.736 -4.371 1.00 5.50 H new ATOM 0 HD22 ASN A 9 28.369 -1.682 -3.711 1.00 5.50 H new ATOM 17 N VAL A 10 24.026 -1.634 -5.328 1.00 4.35 N ATOM 18 CA VAL A 10 22.764 -2.335 -5.185 1.00 4.25 C ATOM 19 C VAL A 10 22.473 -2.633 -3.721 1.00 3.43 C ATOM 20 O VAL A 10 23.288 -3.250 -3.030 1.00 3.52 O ATOM 21 CB VAL A 10 22.770 -3.659 -5.982 1.00 5.19 C ATOM 22 CG1 VAL A 10 21.447 -4.392 -5.834 1.00 5.29 C ATOM 23 CG2 VAL A 10 23.069 -3.397 -7.450 1.00 6.05 C ATOM 0 H VAL A 10 24.843 -2.242 -5.381 1.00 4.35 H new ATOM 0 HA VAL A 10 21.984 -1.685 -5.582 1.00 4.25 H new ATOM 0 HB VAL A 10 23.557 -4.293 -5.573 1.00 5.19 H new ATOM 0 HG11 VAL A 10 21.479 -5.320 -6.405 1.00 5.29 H new ATOM 0 HG12 VAL A 10 21.273 -4.619 -4.782 1.00 5.29 H new ATOM 0 HG13 VAL A 10 20.639 -3.764 -6.208 1.00 5.29 H new ATOM 0 HG21 VAL A 10 23.069 -4.341 -7.995 1.00 6.05 H new ATOM 0 HG22 VAL A 10 22.306 -2.738 -7.865 1.00 6.05 H new ATOM 0 HG23 VAL A 10 24.047 -2.924 -7.543 1.00 6.05 H new ATOM 33 N LYS A 11 21.318 -2.184 -3.246 1.00 3.01 N ATOM 34 CA LYS A 11 20.872 -2.525 -1.904 1.00 2.38 C ATOM 35 C LYS A 11 19.811 -3.632 -1.962 1.00 2.30 C ATOM 36 O LYS A 11 19.095 -3.762 -2.943 1.00 2.75 O ATOM 37 CB LYS A 11 20.388 -1.293 -1.127 1.00 2.57 C ATOM 38 CG LYS A 11 21.504 -0.499 -0.458 1.00 3.33 C ATOM 39 CD LYS A 11 22.406 0.194 -1.467 1.00 4.00 C ATOM 40 CE LYS A 11 21.699 1.344 -2.170 1.00 4.63 C ATOM 41 NZ LYS A 11 21.285 2.409 -1.218 1.00 5.11 N ATOM 0 H LYS A 11 20.677 -1.586 -3.768 1.00 3.01 H new ATOM 0 HA LYS A 11 21.727 -2.911 -1.349 1.00 2.38 H new ATOM 0 HB2 LYS A 11 19.848 -0.636 -1.809 1.00 2.57 H new ATOM 0 HB3 LYS A 11 19.678 -1.614 -0.365 1.00 2.57 H new ATOM 0 HG2 LYS A 11 21.068 0.246 0.207 1.00 3.33 H new ATOM 0 HG3 LYS A 11 22.102 -1.168 0.161 1.00 3.33 H new ATOM 0 HD2 LYS A 11 23.294 0.571 -0.960 1.00 4.00 H new ATOM 0 HD3 LYS A 11 22.745 -0.530 -2.208 1.00 4.00 H new ATOM 0 HE2 LYS A 11 22.361 1.769 -2.924 1.00 4.63 H new ATOM 0 HE3 LYS A 11 20.821 0.964 -2.693 1.00 4.63 H new ATOM 0 HZ1 LYS A 11 21.092 3.287 -1.741 1.00 5.11 H new ATOM 0 HZ2 LYS A 11 20.425 2.110 -0.715 1.00 5.11 H new ATOM 0 HZ3 LYS A 11 22.048 2.576 -0.531 1.00 5.11 H new ATOM 55 N TYR A 12 19.828 -4.485 -0.948 1.00 2.26 N ATOM 56 CA TYR A 12 18.998 -5.702 -0.849 1.00 2.39 C ATOM 57 C TYR A 12 17.952 -5.597 0.279 1.00 1.68 C ATOM 58 O TYR A 12 18.358 -5.322 1.386 1.00 2.15 O ATOM 59 CB TYR A 12 19.891 -6.925 -0.590 1.00 3.48 C ATOM 60 CG TYR A 12 21.344 -6.714 -0.965 1.00 4.09 C ATOM 61 CD1 TYR A 12 21.785 -6.973 -2.257 1.00 4.67 C ATOM 62 CD2 TYR A 12 22.271 -6.269 -0.032 1.00 4.36 C ATOM 63 CE1 TYR A 12 23.109 -6.798 -2.608 1.00 5.39 C ATOM 64 CE2 TYR A 12 23.598 -6.086 -0.379 1.00 5.04 C ATOM 65 CZ TYR A 12 24.009 -6.300 -1.638 1.00 5.50 C ATOM 66 OH TYR A 12 25.329 -6.183 -2.015 1.00 6.30 O ATOM 0 H TYR A 12 20.436 -4.355 -0.139 1.00 2.26 H new ATOM 0 HA TYR A 12 18.469 -5.811 -1.796 1.00 2.39 H new ATOM 0 HB2 TYR A 12 19.833 -7.188 0.466 1.00 3.48 H new ATOM 0 HB3 TYR A 12 19.500 -7.774 -1.152 1.00 3.48 H new ATOM 0 HD1 TYR A 12 21.080 -7.317 -2.999 1.00 4.67 H new ATOM 0 HD2 TYR A 12 21.952 -6.063 0.979 1.00 4.36 H new ATOM 0 HE1 TYR A 12 23.450 -7.037 -3.604 1.00 5.39 H new ATOM 0 HE2 TYR A 12 24.309 -5.768 0.370 1.00 5.04 H new ATOM 0 HH TYR A 12 25.853 -5.829 -1.266 1.00 6.30 H new ATOM 76 N ASN A 13 16.618 -5.703 0.067 1.00 1.23 N ATOM 77 CA ASN A 13 15.800 -5.900 1.242 1.00 1.00 C ATOM 78 C ASN A 13 15.131 -7.278 1.296 1.00 0.86 C ATOM 79 O ASN A 13 14.124 -7.510 0.666 1.00 1.29 O ATOM 80 CB ASN A 13 14.745 -4.773 1.371 1.00 1.76 C ATOM 81 CG ASN A 13 13.843 -4.526 0.148 1.00 2.67 C ATOM 82 OD1 ASN A 13 13.244 -3.463 0.034 1.00 3.27 O ATOM 83 ND2 ASN A 13 13.724 -5.474 -0.760 1.00 3.42 N ATOM 0 H ASN A 13 16.137 -5.658 -0.831 1.00 1.23 H new ATOM 0 HA ASN A 13 16.477 -5.857 2.095 1.00 1.00 H new ATOM 0 HB2 ASN A 13 14.106 -5.001 2.224 1.00 1.76 H new ATOM 0 HB3 ASN A 13 15.266 -3.844 1.602 1.00 1.76 H new ATOM 0 HD21 ASN A 13 13.126 -5.329 -1.573 1.00 3.42 H new ATOM 0 HD22 ASN A 13 14.230 -6.353 -0.649 1.00 3.42 H new ATOM 90 N PHE A 14 15.683 -8.197 2.068 1.00 0.97 N ATOM 91 CA PHE A 14 14.917 -9.319 2.625 1.00 1.06 C ATOM 92 C PHE A 14 14.369 -8.989 4.015 1.00 0.93 C ATOM 93 O PHE A 14 15.160 -8.693 4.909 1.00 1.27 O ATOM 94 CB PHE A 14 15.780 -10.585 2.685 1.00 1.64 C ATOM 95 CG PHE A 14 15.029 -11.794 3.169 1.00 2.26 C ATOM 96 CD1 PHE A 14 14.071 -12.392 2.367 1.00 3.13 C ATOM 97 CD2 PHE A 14 15.279 -12.330 4.423 1.00 2.47 C ATOM 98 CE1 PHE A 14 13.374 -13.499 2.806 1.00 4.16 C ATOM 99 CE2 PHE A 14 14.585 -13.441 4.866 1.00 3.36 C ATOM 100 CZ PHE A 14 13.632 -14.025 4.057 1.00 4.21 C ATOM 0 H PHE A 14 16.669 -8.195 2.331 1.00 0.97 H new ATOM 0 HA PHE A 14 14.070 -9.499 1.963 1.00 1.06 H new ATOM 0 HB2 PHE A 14 16.183 -10.789 1.693 1.00 1.64 H new ATOM 0 HB3 PHE A 14 16.630 -10.406 3.344 1.00 1.64 H new ATOM 0 HD1 PHE A 14 13.867 -11.987 1.387 1.00 3.13 H new ATOM 0 HD2 PHE A 14 16.023 -11.875 5.060 1.00 2.47 H new ATOM 0 HE1 PHE A 14 12.627 -13.954 2.172 1.00 4.16 H new ATOM 0 HE2 PHE A 14 14.789 -13.851 5.844 1.00 3.36 H new ATOM 0 HZ PHE A 14 13.088 -14.892 4.401 1.00 4.21 H new ATOM 110 N MET A 15 13.061 -9.009 4.236 1.00 0.73 N ATOM 111 CA MET A 15 12.569 -9.114 5.614 1.00 0.74 C ATOM 112 C MET A 15 11.819 -10.426 5.818 1.00 0.70 C ATOM 113 O MET A 15 12.321 -11.355 6.449 1.00 0.79 O ATOM 114 CB MET A 15 11.705 -7.922 6.015 1.00 0.84 C ATOM 115 CG MET A 15 11.805 -7.545 7.488 1.00 1.48 C ATOM 116 SD MET A 15 11.411 -8.905 8.604 1.00 2.32 S ATOM 117 CE MET A 15 11.598 -8.101 10.194 1.00 2.91 C ATOM 0 H MET A 15 12.342 -8.957 3.515 1.00 0.73 H new ATOM 0 HA MET A 15 13.441 -9.105 6.269 1.00 0.74 H new ATOM 0 HB2 MET A 15 11.991 -7.061 5.411 1.00 0.84 H new ATOM 0 HB3 MET A 15 10.665 -8.146 5.779 1.00 0.84 H new ATOM 0 HG2 MET A 15 12.815 -7.194 7.698 1.00 1.48 H new ATOM 0 HG3 MET A 15 11.130 -6.713 7.689 1.00 1.48 H new ATOM 0 HE1 MET A 15 11.387 -8.815 10.990 1.00 2.91 H new ATOM 0 HE2 MET A 15 12.619 -7.733 10.298 1.00 2.91 H new ATOM 0 HE3 MET A 15 10.902 -7.265 10.263 1.00 2.91 H new ATOM 127 N ARG A 16 10.617 -10.493 5.239 1.00 0.61 N ATOM 128 CA ARG A 16 9.721 -11.631 5.410 1.00 0.61 C ATOM 129 C ARG A 16 8.576 -11.556 4.403 1.00 0.56 C ATOM 130 O ARG A 16 8.161 -10.468 4.001 1.00 0.52 O ATOM 131 CB ARG A 16 9.125 -11.627 6.824 1.00 0.63 C ATOM 132 CG ARG A 16 7.874 -10.762 6.971 1.00 0.72 C ATOM 133 CD ARG A 16 8.041 -9.661 8.004 1.00 1.06 C ATOM 134 NE ARG A 16 8.567 -10.169 9.271 1.00 1.64 N ATOM 135 CZ ARG A 16 8.043 -9.881 10.461 1.00 2.09 C ATOM 136 NH1 ARG A 16 6.942 -9.147 10.552 1.00 2.43 N ATOM 137 NH2 ARG A 16 8.599 -10.352 11.568 1.00 2.73 N ATOM 0 H ARG A 16 10.241 -9.758 4.640 1.00 0.61 H new ATOM 0 HA ARG A 16 10.296 -12.543 5.251 1.00 0.61 H new ATOM 0 HB2 ARG A 16 8.881 -12.651 7.107 1.00 0.63 H new ATOM 0 HB3 ARG A 16 9.882 -11.275 7.525 1.00 0.63 H new ATOM 0 HG2 ARG A 16 7.630 -10.316 6.007 1.00 0.72 H new ATOM 0 HG3 ARG A 16 7.031 -11.394 7.252 1.00 0.72 H new ATOM 0 HD2 ARG A 16 8.713 -8.897 7.613 1.00 1.06 H new ATOM 0 HD3 ARG A 16 7.079 -9.180 8.179 1.00 1.06 H new ATOM 0 HE ARG A 16 9.383 -10.780 9.241 1.00 1.64 H new ATOM 0 HH11 ARG A 16 6.490 -8.799 9.707 1.00 2.43 H new ATOM 0 HH12 ARG A 16 6.547 -8.931 11.467 1.00 2.43 H new ATOM 0 HH21 ARG A 16 9.432 -10.938 11.511 1.00 2.73 H new ATOM 0 HH22 ARG A 16 8.194 -10.129 12.477 1.00 2.73 H new ATOM 151 N ILE A 17 8.074 -12.707 3.990 1.00 0.62 N ATOM 152 CA ILE A 17 6.854 -12.755 3.196 1.00 0.61 C ATOM 153 C ILE A 17 5.642 -12.660 4.125 1.00 0.57 C ATOM 154 O ILE A 17 5.411 -13.556 4.935 1.00 0.64 O ATOM 155 CB ILE A 17 6.752 -14.042 2.336 1.00 0.73 C ATOM 156 CG1 ILE A 17 7.922 -14.150 1.345 1.00 1.68 C ATOM 157 CG2 ILE A 17 5.431 -14.068 1.578 1.00 1.41 C ATOM 158 CD1 ILE A 17 9.225 -14.618 1.962 1.00 2.26 C ATOM 0 H ILE A 17 8.488 -13.618 4.189 1.00 0.62 H new ATOM 0 HA ILE A 17 6.877 -11.910 2.508 1.00 0.61 H new ATOM 0 HB ILE A 17 6.798 -14.896 3.012 1.00 0.73 H new ATOM 0 HG12 ILE A 17 7.644 -14.839 0.547 1.00 1.68 H new ATOM 0 HG13 ILE A 17 8.082 -13.176 0.883 1.00 1.68 H new ATOM 0 HG21 ILE A 17 5.373 -14.977 0.979 1.00 1.41 H new ATOM 0 HG22 ILE A 17 4.604 -14.048 2.288 1.00 1.41 H new ATOM 0 HG23 ILE A 17 5.369 -13.198 0.924 1.00 1.41 H new ATOM 0 HD11 ILE A 17 9.996 -14.666 1.193 1.00 2.26 H new ATOM 0 HD12 ILE A 17 9.531 -13.918 2.740 1.00 2.26 H new ATOM 0 HD13 ILE A 17 9.086 -15.607 2.398 1.00 2.26 H new ATOM 170 N ILE A 18 4.890 -11.570 4.028 1.00 0.49 N ATOM 171 CA ILE A 18 3.731 -11.357 4.898 1.00 0.48 C ATOM 172 C ILE A 18 2.460 -11.969 4.287 1.00 0.48 C ATOM 173 O ILE A 18 2.467 -13.111 3.826 1.00 0.52 O ATOM 174 CB ILE A 18 3.491 -9.854 5.208 1.00 0.44 C ATOM 175 CG1 ILE A 18 4.813 -9.132 5.452 1.00 0.44 C ATOM 176 CG2 ILE A 18 2.596 -9.693 6.439 1.00 0.50 C ATOM 177 CD1 ILE A 18 4.638 -7.671 5.816 1.00 0.94 C ATOM 0 H ILE A 18 5.058 -10.819 3.358 1.00 0.49 H new ATOM 0 HA ILE A 18 3.957 -11.861 5.838 1.00 0.48 H new ATOM 0 HB ILE A 18 2.997 -9.413 4.342 1.00 0.44 H new ATOM 0 HG12 ILE A 18 5.353 -9.637 6.253 1.00 0.44 H new ATOM 0 HG13 ILE A 18 5.430 -9.205 4.556 1.00 0.44 H new ATOM 0 HG21 ILE A 18 2.440 -8.633 6.639 1.00 0.50 H new ATOM 0 HG22 ILE A 18 1.635 -10.173 6.255 1.00 0.50 H new ATOM 0 HG23 ILE A 18 3.075 -10.158 7.300 1.00 0.50 H new ATOM 0 HD11 ILE A 18 5.616 -7.216 5.976 1.00 0.94 H new ATOM 0 HD12 ILE A 18 4.125 -7.153 5.005 1.00 0.94 H new ATOM 0 HD13 ILE A 18 4.047 -7.592 6.728 1.00 0.94 H new ATOM 189 N LYS A 19 1.382 -11.197 4.283 1.00 0.45 N ATOM 190 CA LYS A 19 0.054 -11.696 3.951 1.00 0.46 C ATOM 191 C LYS A 19 -0.346 -11.230 2.553 1.00 0.42 C ATOM 192 O LYS A 19 0.175 -10.236 2.063 1.00 0.49 O ATOM 193 CB LYS A 19 -0.948 -11.170 4.991 1.00 0.54 C ATOM 194 CG LYS A 19 -2.354 -11.743 4.877 1.00 1.13 C ATOM 195 CD LYS A 19 -2.398 -13.212 5.260 1.00 1.85 C ATOM 196 CE LYS A 19 -3.826 -13.738 5.298 1.00 2.57 C ATOM 197 NZ LYS A 19 -3.880 -15.172 5.684 1.00 2.68 N ATOM 0 H LYS A 19 1.404 -10.203 4.511 1.00 0.45 H new ATOM 0 HA LYS A 19 0.057 -12.786 3.963 1.00 0.46 H new ATOM 0 HB2 LYS A 19 -0.563 -11.388 5.987 1.00 0.54 H new ATOM 0 HB3 LYS A 19 -1.006 -10.085 4.902 1.00 0.54 H new ATOM 0 HG2 LYS A 19 -3.029 -11.179 5.521 1.00 1.13 H new ATOM 0 HG3 LYS A 19 -2.713 -11.623 3.855 1.00 1.13 H new ATOM 0 HD2 LYS A 19 -1.815 -13.793 4.545 1.00 1.85 H new ATOM 0 HD3 LYS A 19 -1.933 -13.348 6.236 1.00 1.85 H new ATOM 0 HE2 LYS A 19 -4.411 -13.150 6.005 1.00 2.57 H new ATOM 0 HE3 LYS A 19 -4.286 -13.608 4.319 1.00 2.57 H new ATOM 0 HZ1 LYS A 19 -4.870 -15.491 5.698 1.00 2.68 H new ATOM 0 HZ2 LYS A 19 -3.344 -15.737 4.995 1.00 2.68 H new ATOM 0 HZ3 LYS A 19 -3.464 -15.293 6.630 1.00 2.68 H new ATOM 211 N TYR A 20 -1.293 -11.924 1.942 1.00 0.37 N ATOM 212 CA TYR A 20 -1.690 -11.649 0.566 1.00 0.41 C ATOM 213 C TYR A 20 -3.155 -11.977 0.347 1.00 0.31 C ATOM 214 O TYR A 20 -3.760 -12.694 1.146 1.00 0.33 O ATOM 215 CB TYR A 20 -0.831 -12.460 -0.413 1.00 0.67 C ATOM 216 CG TYR A 20 -0.734 -13.936 -0.088 1.00 1.13 C ATOM 217 CD1 TYR A 20 -1.693 -14.832 -0.546 1.00 1.34 C ATOM 218 CD2 TYR A 20 0.314 -14.435 0.676 1.00 1.45 C ATOM 219 CE1 TYR A 20 -1.609 -16.179 -0.256 1.00 1.82 C ATOM 220 CE2 TYR A 20 0.404 -15.781 0.971 1.00 1.93 C ATOM 221 CZ TYR A 20 -0.555 -16.645 0.517 1.00 2.10 C ATOM 222 OH TYR A 20 -0.465 -17.992 0.790 1.00 2.59 O ATOM 0 H TYR A 20 -1.806 -12.689 2.380 1.00 0.37 H new ATOM 0 HA TYR A 20 -1.538 -10.585 0.382 1.00 0.41 H new ATOM 0 HB2 TYR A 20 -1.242 -12.348 -1.416 1.00 0.67 H new ATOM 0 HB3 TYR A 20 0.174 -12.038 -0.431 1.00 0.67 H new ATOM 0 HD1 TYR A 20 -2.519 -14.468 -1.139 1.00 1.34 H new ATOM 0 HD2 TYR A 20 1.071 -13.759 1.045 1.00 1.45 H new ATOM 0 HE1 TYR A 20 -2.357 -16.864 -0.627 1.00 1.82 H new ATOM 0 HE2 TYR A 20 1.230 -16.151 1.559 1.00 1.93 H new ATOM 0 HH TYR A 20 0.327 -18.162 1.341 1.00 2.59 H new ATOM 232 N GLU A 21 -3.715 -11.425 -0.730 1.00 0.33 N ATOM 233 CA GLU A 21 -5.082 -11.727 -1.138 1.00 0.32 C ATOM 234 C GLU A 21 -6.072 -11.348 -0.042 1.00 0.28 C ATOM 235 O GLU A 21 -7.045 -12.050 0.237 1.00 0.30 O ATOM 236 CB GLU A 21 -5.172 -13.215 -1.498 1.00 0.35 C ATOM 237 CG GLU A 21 -6.438 -13.629 -2.226 1.00 0.98 C ATOM 238 CD GLU A 21 -6.353 -15.049 -2.742 1.00 1.16 C ATOM 239 OE1 GLU A 21 -6.620 -15.988 -1.966 1.00 1.73 O ATOM 240 OE2 GLU A 21 -5.992 -15.233 -3.926 1.00 1.53 O ATOM 0 H GLU A 21 -3.236 -10.761 -1.338 1.00 0.33 H new ATOM 0 HA GLU A 21 -5.346 -11.136 -2.015 1.00 0.32 H new ATOM 0 HB2 GLU A 21 -4.314 -13.475 -2.118 1.00 0.35 H new ATOM 0 HB3 GLU A 21 -5.091 -13.800 -0.582 1.00 0.35 H new ATOM 0 HG2 GLU A 21 -7.290 -13.538 -1.553 1.00 0.98 H new ATOM 0 HG3 GLU A 21 -6.616 -12.950 -3.060 1.00 0.98 H new ATOM 247 N PHE A 22 -5.782 -10.230 0.587 1.00 0.26 N ATOM 248 CA PHE A 22 -6.672 -9.629 1.544 1.00 0.26 C ATOM 249 C PHE A 22 -7.306 -8.454 0.851 1.00 0.24 C ATOM 250 O PHE A 22 -6.738 -7.922 -0.103 1.00 0.27 O ATOM 251 CB PHE A 22 -5.917 -9.181 2.807 1.00 0.32 C ATOM 252 CG PHE A 22 -4.761 -8.249 2.548 1.00 1.08 C ATOM 253 CD1 PHE A 22 -4.967 -6.885 2.394 1.00 1.98 C ATOM 254 CD2 PHE A 22 -3.467 -8.739 2.465 1.00 1.15 C ATOM 255 CE1 PHE A 22 -3.907 -6.031 2.161 1.00 2.89 C ATOM 256 CE2 PHE A 22 -2.403 -7.889 2.233 1.00 2.05 C ATOM 257 CZ PHE A 22 -2.624 -6.534 2.080 1.00 2.92 C ATOM 0 H PHE A 22 -4.915 -9.712 0.445 1.00 0.26 H new ATOM 0 HA PHE A 22 -7.424 -10.344 1.877 1.00 0.26 H new ATOM 0 HB2 PHE A 22 -6.620 -8.689 3.480 1.00 0.32 H new ATOM 0 HB3 PHE A 22 -5.545 -10.065 3.325 1.00 0.32 H new ATOM 0 HD1 PHE A 22 -5.969 -6.487 2.457 1.00 1.98 H new ATOM 0 HD2 PHE A 22 -3.289 -9.798 2.583 1.00 1.15 H new ATOM 0 HE1 PHE A 22 -4.081 -4.972 2.042 1.00 2.89 H new ATOM 0 HE2 PHE A 22 -1.399 -8.283 2.171 1.00 2.05 H new ATOM 0 HZ PHE A 22 -1.793 -5.868 1.897 1.00 2.92 H new ATOM 267 N ILE A 23 -8.435 -8.018 1.321 1.00 0.22 N ATOM 268 CA ILE A 23 -9.104 -6.924 0.677 1.00 0.21 C ATOM 269 C ILE A 23 -8.757 -5.672 1.411 1.00 0.19 C ATOM 270 O ILE A 23 -8.778 -5.629 2.636 1.00 0.22 O ATOM 271 CB ILE A 23 -10.631 -7.094 0.672 1.00 0.28 C ATOM 272 CG1 ILE A 23 -11.016 -8.393 -0.037 1.00 0.36 C ATOM 273 CG2 ILE A 23 -11.298 -5.899 0.001 1.00 0.36 C ATOM 274 CD1 ILE A 23 -10.476 -8.489 -1.450 1.00 0.84 C ATOM 0 H ILE A 23 -8.910 -8.397 2.140 1.00 0.22 H new ATOM 0 HA ILE A 23 -8.777 -6.886 -0.362 1.00 0.21 H new ATOM 0 HB ILE A 23 -10.980 -7.146 1.703 1.00 0.28 H new ATOM 0 HG12 ILE A 23 -10.647 -9.239 0.544 1.00 0.36 H new ATOM 0 HG13 ILE A 23 -12.103 -8.475 -0.065 1.00 0.36 H new ATOM 0 HG21 ILE A 23 -12.379 -6.036 0.006 1.00 0.36 H new ATOM 0 HG22 ILE A 23 -11.045 -4.989 0.544 1.00 0.36 H new ATOM 0 HG23 ILE A 23 -10.947 -5.817 -1.028 1.00 0.36 H new ATOM 0 HD11 ILE A 23 -10.786 -9.435 -1.895 1.00 0.84 H new ATOM 0 HD12 ILE A 23 -10.866 -7.663 -2.045 1.00 0.84 H new ATOM 0 HD13 ILE A 23 -9.387 -8.438 -1.428 1.00 0.84 H new ATOM 286 N LEU A 24 -8.414 -4.660 0.669 1.00 0.18 N ATOM 287 CA LEU A 24 -7.975 -3.441 1.304 1.00 0.19 C ATOM 288 C LEU A 24 -9.112 -2.456 1.364 1.00 0.20 C ATOM 289 O LEU A 24 -9.686 -2.069 0.349 1.00 0.23 O ATOM 290 CB LEU A 24 -6.775 -2.835 0.573 1.00 0.23 C ATOM 291 CG LEU A 24 -6.021 -1.765 1.370 1.00 0.53 C ATOM 292 CD1 LEU A 24 -4.574 -1.678 0.915 1.00 1.32 C ATOM 293 CD2 LEU A 24 -6.684 -0.399 1.253 1.00 1.41 C ATOM 0 H LEU A 24 -8.426 -4.646 -0.351 1.00 0.18 H new ATOM 0 HA LEU A 24 -7.657 -3.679 2.319 1.00 0.19 H new ATOM 0 HB2 LEU A 24 -6.081 -3.635 0.315 1.00 0.23 H new ATOM 0 HB3 LEU A 24 -7.119 -2.397 -0.364 1.00 0.23 H new ATOM 0 HG LEU A 24 -6.050 -2.064 2.418 1.00 0.53 H new ATOM 0 HD11 LEU A 24 -4.056 -0.913 1.493 1.00 1.32 H new ATOM 0 HD12 LEU A 24 -4.086 -2.641 1.068 1.00 1.32 H new ATOM 0 HD13 LEU A 24 -4.540 -1.418 -0.143 1.00 1.32 H new ATOM 0 HD21 LEU A 24 -6.118 0.331 1.832 1.00 1.41 H new ATOM 0 HD22 LEU A 24 -6.706 -0.094 0.207 1.00 1.41 H new ATOM 0 HD23 LEU A 24 -7.703 -0.455 1.636 1.00 1.41 H new ATOM 305 N ASN A 25 -9.432 -2.085 2.583 1.00 0.19 N ATOM 306 CA ASN A 25 -10.466 -1.133 2.883 1.00 0.19 C ATOM 307 C ASN A 25 -9.924 -0.221 3.957 1.00 0.18 C ATOM 308 O ASN A 25 -9.168 -0.670 4.791 1.00 0.22 O ATOM 309 CB ASN A 25 -11.682 -1.934 3.349 1.00 0.29 C ATOM 310 CG ASN A 25 -12.910 -1.120 3.652 1.00 0.92 C ATOM 311 OD1 ASN A 25 -13.679 -0.782 2.758 1.00 1.74 O ATOM 312 ND2 ASN A 25 -13.147 -0.872 4.923 1.00 1.72 N ATOM 0 H ASN A 25 -8.965 -2.450 3.413 1.00 0.19 H new ATOM 0 HA ASN A 25 -10.764 -0.520 2.033 1.00 0.19 H new ATOM 0 HB2 ASN A 25 -11.931 -2.665 2.580 1.00 0.29 H new ATOM 0 HB3 ASN A 25 -11.407 -2.493 4.243 1.00 0.29 H new ATOM 0 HD21 ASN A 25 -13.998 -0.381 5.197 1.00 1.72 H new ATOM 0 HD22 ASN A 25 -12.480 -1.171 5.634 1.00 1.72 H new ATOM 319 N ASP A 26 -10.262 1.041 3.934 1.00 0.16 N ATOM 320 CA ASP A 26 -9.819 1.950 4.961 1.00 0.17 C ATOM 321 C ASP A 26 -10.808 2.054 6.100 1.00 0.18 C ATOM 322 O ASP A 26 -11.801 1.335 6.155 1.00 0.20 O ATOM 323 CB ASP A 26 -9.694 3.362 4.398 1.00 0.19 C ATOM 324 CG ASP A 26 -10.738 3.764 3.397 1.00 0.40 C ATOM 325 OD1 ASP A 26 -11.383 2.893 2.785 1.00 0.66 O ATOM 326 OD2 ASP A 26 -10.943 4.977 3.263 1.00 1.04 O ATOM 0 H ASP A 26 -10.845 1.465 3.213 1.00 0.16 H new ATOM 0 HA ASP A 26 -8.867 1.556 5.317 1.00 0.17 H new ATOM 0 HB2 ASP A 26 -9.724 4.067 5.228 1.00 0.19 H new ATOM 0 HB3 ASP A 26 -8.714 3.461 3.931 1.00 0.19 H new ATOM 331 N ALA A 27 -10.476 2.926 7.045 1.00 0.21 N ATOM 332 CA ALA A 27 -11.354 3.248 8.156 1.00 0.25 C ATOM 333 C ALA A 27 -12.537 4.036 7.648 1.00 0.24 C ATOM 334 O ALA A 27 -13.565 4.133 8.316 1.00 0.28 O ATOM 335 CB ALA A 27 -10.626 4.040 9.226 1.00 0.32 C ATOM 0 H ALA A 27 -9.589 3.429 7.060 1.00 0.21 H new ATOM 0 HA ALA A 27 -11.695 2.315 8.606 1.00 0.25 H new ATOM 0 HB1 ALA A 27 -11.312 4.264 10.043 1.00 0.32 H new ATOM 0 HB2 ALA A 27 -9.789 3.454 9.606 1.00 0.32 H new ATOM 0 HB3 ALA A 27 -10.253 4.971 8.799 1.00 0.32 H new ATOM 341 N LEU A 28 -12.383 4.609 6.455 1.00 0.21 N ATOM 342 CA LEU A 28 -13.529 5.240 5.788 1.00 0.24 C ATOM 343 C LEU A 28 -14.402 4.149 5.245 1.00 0.23 C ATOM 344 O LEU A 28 -15.569 4.341 4.894 1.00 0.29 O ATOM 345 CB LEU A 28 -13.109 6.138 4.636 1.00 0.25 C ATOM 346 CG LEU A 28 -12.336 7.369 5.015 1.00 0.31 C ATOM 347 CD1 LEU A 28 -12.131 8.243 3.788 1.00 0.48 C ATOM 348 CD2 LEU A 28 -13.055 8.136 6.120 1.00 0.48 C ATOM 0 H LEU A 28 -11.504 4.652 5.940 1.00 0.21 H new ATOM 0 HA LEU A 28 -14.049 5.861 6.518 1.00 0.24 H new ATOM 0 HB2 LEU A 28 -12.505 5.551 3.944 1.00 0.25 H new ATOM 0 HB3 LEU A 28 -14.004 6.446 4.095 1.00 0.25 H new ATOM 0 HG LEU A 28 -11.360 7.073 5.399 1.00 0.31 H new ATOM 0 HD11 LEU A 28 -11.570 9.135 4.066 1.00 0.48 H new ATOM 0 HD12 LEU A 28 -11.576 7.686 3.033 1.00 0.48 H new ATOM 0 HD13 LEU A 28 -13.100 8.535 3.384 1.00 0.48 H new ATOM 0 HD21 LEU A 28 -12.479 9.024 6.380 1.00 0.48 H new ATOM 0 HD22 LEU A 28 -14.044 8.434 5.772 1.00 0.48 H new ATOM 0 HD23 LEU A 28 -13.156 7.499 6.999 1.00 0.48 H new ATOM 360 N ASN A 29 -13.769 3.000 5.186 1.00 0.20 N ATOM 361 CA ASN A 29 -14.312 1.799 4.625 1.00 0.23 C ATOM 362 C ASN A 29 -14.760 2.054 3.224 1.00 0.24 C ATOM 363 O ASN A 29 -15.957 2.170 2.963 1.00 0.28 O ATOM 364 CB ASN A 29 -15.522 1.271 5.391 1.00 0.29 C ATOM 365 CG ASN A 29 -15.387 1.299 6.909 1.00 0.60 C ATOM 366 OD1 ASN A 29 -16.375 1.475 7.619 1.00 1.32 O ATOM 367 ND2 ASN A 29 -14.181 1.099 7.418 1.00 1.30 N ATOM 0 H ASN A 29 -12.822 2.879 5.545 1.00 0.20 H new ATOM 0 HA ASN A 29 -13.514 1.058 4.675 1.00 0.23 H new ATOM 0 HB2 ASN A 29 -16.396 1.858 5.108 1.00 0.29 H new ATOM 0 HB3 ASN A 29 -15.712 0.245 5.077 1.00 0.29 H new ATOM 0 HD21 ASN A 29 -14.050 1.088 8.429 1.00 1.30 H new ATOM 0 HD22 ASN A 29 -13.383 0.956 6.799 1.00 1.30 H new ATOM 374 N GLN A 30 -13.834 2.159 2.315 1.00 0.23 N ATOM 375 CA GLN A 30 -14.185 1.923 0.959 1.00 0.24 C ATOM 376 C GLN A 30 -13.052 1.153 0.326 1.00 0.22 C ATOM 377 O GLN A 30 -11.932 1.636 0.201 1.00 0.28 O ATOM 378 CB GLN A 30 -14.602 3.223 0.229 1.00 0.36 C ATOM 379 CG GLN A 30 -13.496 4.112 -0.294 1.00 0.98 C ATOM 380 CD GLN A 30 -12.637 4.717 0.775 1.00 1.41 C ATOM 381 OE1 GLN A 30 -11.464 4.984 0.561 1.00 2.21 O ATOM 382 NE2 GLN A 30 -13.212 4.950 1.928 1.00 1.84 N ATOM 0 H GLN A 30 -12.858 2.400 2.487 1.00 0.23 H new ATOM 0 HA GLN A 30 -15.084 1.312 0.880 1.00 0.24 H new ATOM 0 HB2 GLN A 30 -15.239 2.948 -0.612 1.00 0.36 H new ATOM 0 HB3 GLN A 30 -15.213 3.812 0.913 1.00 0.36 H new ATOM 0 HG2 GLN A 30 -12.865 3.531 -0.966 1.00 0.98 H new ATOM 0 HG3 GLN A 30 -13.938 4.913 -0.886 1.00 0.98 H new ATOM 0 HE21 GLN A 30 -14.194 4.712 2.065 1.00 1.84 H new ATOM 0 HE22 GLN A 30 -12.678 5.370 2.689 1.00 1.84 H new ATOM 391 N SER A 31 -13.348 -0.079 -0.030 1.00 0.23 N ATOM 392 CA SER A 31 -12.329 -0.985 -0.462 1.00 0.26 C ATOM 393 C SER A 31 -11.756 -0.494 -1.776 1.00 0.21 C ATOM 394 O SER A 31 -12.483 -0.257 -2.736 1.00 0.21 O ATOM 395 CB SER A 31 -12.932 -2.376 -0.586 1.00 0.36 C ATOM 396 OG SER A 31 -13.701 -2.687 0.567 1.00 1.23 O ATOM 0 H SER A 31 -14.291 -0.468 -0.025 1.00 0.23 H new ATOM 0 HA SER A 31 -11.514 -1.033 0.260 1.00 0.26 H new ATOM 0 HB2 SER A 31 -13.560 -2.429 -1.475 1.00 0.36 H new ATOM 0 HB3 SER A 31 -12.139 -3.113 -0.712 1.00 0.36 H new ATOM 0 HG SER A 31 -13.532 -2.018 1.263 1.00 1.23 H new ATOM 402 N ILE A 32 -10.452 -0.336 -1.805 1.00 0.21 N ATOM 403 CA ILE A 32 -9.804 0.320 -2.913 1.00 0.20 C ATOM 404 C ILE A 32 -9.799 -0.566 -4.176 1.00 0.21 C ATOM 405 O ILE A 32 -9.090 -1.566 -4.237 1.00 0.24 O ATOM 406 CB ILE A 32 -8.360 0.751 -2.574 1.00 0.24 C ATOM 407 CG1 ILE A 32 -7.626 1.222 -3.830 1.00 1.11 C ATOM 408 CG2 ILE A 32 -7.595 -0.382 -1.914 1.00 1.23 C ATOM 409 CD1 ILE A 32 -8.314 2.358 -4.546 1.00 1.72 C ATOM 0 H ILE A 32 -9.820 -0.655 -1.071 1.00 0.21 H new ATOM 0 HA ILE A 32 -10.388 1.217 -3.116 1.00 0.20 H new ATOM 0 HB ILE A 32 -8.417 1.582 -1.871 1.00 0.24 H new ATOM 0 HG12 ILE A 32 -6.619 1.535 -3.555 1.00 1.11 H new ATOM 0 HG13 ILE A 32 -7.523 0.381 -4.516 1.00 1.11 H new ATOM 0 HG21 ILE A 32 -6.581 -0.052 -1.686 1.00 1.23 H new ATOM 0 HG22 ILE A 32 -8.098 -0.672 -0.992 1.00 1.23 H new ATOM 0 HG23 ILE A 32 -7.555 -1.236 -2.590 1.00 1.23 H new ATOM 0 HD11 ILE A 32 -7.735 2.637 -5.426 1.00 1.72 H new ATOM 0 HD12 ILE A 32 -9.312 2.044 -4.853 1.00 1.72 H new ATOM 0 HD13 ILE A 32 -8.393 3.215 -3.877 1.00 1.72 H new ATOM 421 N ILE A 33 -10.630 -0.235 -5.157 1.00 0.21 N ATOM 422 CA ILE A 33 -10.725 -1.038 -6.383 1.00 0.24 C ATOM 423 C ILE A 33 -9.908 -0.393 -7.518 1.00 0.24 C ATOM 424 O ILE A 33 -9.646 0.813 -7.509 1.00 0.24 O ATOM 425 CB ILE A 33 -12.193 -1.168 -6.857 1.00 0.28 C ATOM 426 CG1 ILE A 33 -13.143 -1.308 -5.666 1.00 0.80 C ATOM 427 CG2 ILE A 33 -12.346 -2.366 -7.784 1.00 0.77 C ATOM 428 CD1 ILE A 33 -14.605 -1.395 -6.054 1.00 0.91 C ATOM 0 H ILE A 33 -11.246 0.577 -5.134 1.00 0.21 H new ATOM 0 HA ILE A 33 -10.329 -2.026 -6.149 1.00 0.24 H new ATOM 0 HB ILE A 33 -12.452 -0.260 -7.401 1.00 0.28 H new ATOM 0 HG12 ILE A 33 -12.873 -2.201 -5.102 1.00 0.80 H new ATOM 0 HG13 ILE A 33 -13.004 -0.456 -5.001 1.00 0.80 H new ATOM 0 HG21 ILE A 33 -13.383 -2.444 -8.109 1.00 0.77 H new ATOM 0 HG22 ILE A 33 -11.702 -2.237 -8.654 1.00 0.77 H new ATOM 0 HG23 ILE A 33 -12.062 -3.275 -7.254 1.00 0.77 H new ATOM 0 HD11 ILE A 33 -15.215 -1.493 -5.156 1.00 0.91 H new ATOM 0 HD12 ILE A 33 -14.893 -0.492 -6.592 1.00 0.91 H new ATOM 0 HD13 ILE A 33 -14.760 -2.263 -6.694 1.00 0.91 H new ATOM 440 N ARG A 34 -9.510 -1.211 -8.485 1.00 0.31 N ATOM 441 CA ARG A 34 -8.740 -0.756 -9.644 1.00 0.35 C ATOM 442 C ARG A 34 -9.662 -0.190 -10.717 1.00 0.36 C ATOM 443 O ARG A 34 -10.470 -0.913 -11.299 1.00 0.42 O ATOM 444 CB ARG A 34 -7.930 -1.930 -10.212 1.00 0.48 C ATOM 445 CG ARG A 34 -7.271 -1.665 -11.560 1.00 1.04 C ATOM 446 CD ARG A 34 -6.682 -2.948 -12.134 1.00 1.16 C ATOM 447 NE ARG A 34 -6.248 -2.800 -13.523 1.00 1.48 N ATOM 448 CZ ARG A 34 -7.020 -3.072 -14.577 1.00 1.79 C ATOM 449 NH1 ARG A 34 -8.273 -3.469 -14.402 1.00 2.09 N ATOM 450 NH2 ARG A 34 -6.536 -2.951 -15.805 1.00 2.47 N ATOM 0 H ARG A 34 -9.711 -2.211 -8.491 1.00 0.31 H new ATOM 0 HA ARG A 34 -8.061 0.036 -9.326 1.00 0.35 H new ATOM 0 HB2 ARG A 34 -7.156 -2.200 -9.493 1.00 0.48 H new ATOM 0 HB3 ARG A 34 -8.589 -2.793 -10.310 1.00 0.48 H new ATOM 0 HG2 ARG A 34 -8.004 -1.253 -12.254 1.00 1.04 H new ATOM 0 HG3 ARG A 34 -6.486 -0.918 -11.446 1.00 1.04 H new ATOM 0 HD2 ARG A 34 -5.833 -3.258 -11.524 1.00 1.16 H new ATOM 0 HD3 ARG A 34 -7.425 -3.743 -12.073 1.00 1.16 H new ATOM 0 HE ARG A 34 -5.299 -2.469 -13.696 1.00 1.48 H new ATOM 0 HH11 ARG A 34 -8.650 -3.567 -13.459 1.00 2.09 H new ATOM 0 HH12 ARG A 34 -8.860 -3.676 -15.210 1.00 2.09 H new ATOM 0 HH21 ARG A 34 -5.572 -2.650 -15.946 1.00 2.47 H new ATOM 0 HH22 ARG A 34 -7.128 -3.159 -16.609 1.00 2.47 H new ATOM 464 N ALA A 35 -9.543 1.106 -10.973 1.00 0.37 N ATOM 465 CA ALA A 35 -10.312 1.739 -12.034 1.00 0.46 C ATOM 466 C ALA A 35 -9.495 1.719 -13.312 1.00 0.53 C ATOM 467 O ALA A 35 -10.007 1.490 -14.408 1.00 0.63 O ATOM 468 CB ALA A 35 -10.685 3.164 -11.655 1.00 0.54 C ATOM 0 H ALA A 35 -8.924 1.736 -10.463 1.00 0.37 H new ATOM 0 HA ALA A 35 -11.240 1.187 -12.187 1.00 0.46 H new ATOM 0 HB1 ALA A 35 -11.259 3.617 -12.463 1.00 0.54 H new ATOM 0 HB2 ALA A 35 -11.285 3.153 -10.745 1.00 0.54 H new ATOM 0 HB3 ALA A 35 -9.778 3.744 -11.485 1.00 0.54 H new ATOM 474 N ASN A 36 -8.209 1.952 -13.130 1.00 0.53 N ATOM 475 CA ASN A 36 -7.233 1.921 -14.200 1.00 0.66 C ATOM 476 C ASN A 36 -5.924 1.423 -13.603 1.00 0.65 C ATOM 477 O ASN A 36 -5.762 1.438 -12.384 1.00 0.55 O ATOM 478 CB ASN A 36 -7.067 3.329 -14.794 1.00 0.76 C ATOM 479 CG ASN A 36 -6.121 3.371 -15.980 1.00 1.43 C ATOM 480 OD1 ASN A 36 -4.915 3.530 -15.814 1.00 2.25 O ATOM 481 ND2 ASN A 36 -6.658 3.247 -17.183 1.00 1.93 N ATOM 0 H ASN A 36 -7.808 2.172 -12.218 1.00 0.53 H new ATOM 0 HA ASN A 36 -7.551 1.260 -15.006 1.00 0.66 H new ATOM 0 HB2 ASN A 36 -8.043 3.703 -15.103 1.00 0.76 H new ATOM 0 HB3 ASN A 36 -6.698 4.002 -14.020 1.00 0.76 H new ATOM 0 HD21 ASN A 36 -6.065 3.282 -18.012 1.00 1.93 H new ATOM 0 HD22 ASN A 36 -7.665 3.116 -17.281 1.00 1.93 H new ATOM 488 N ASP A 37 -4.998 0.979 -14.438 1.00 0.81 N ATOM 489 CA ASP A 37 -3.713 0.481 -13.946 1.00 0.88 C ATOM 490 C ASP A 37 -2.825 1.623 -13.474 1.00 0.79 C ATOM 491 O ASP A 37 -1.728 1.396 -12.972 1.00 0.88 O ATOM 492 CB ASP A 37 -2.981 -0.318 -15.024 1.00 1.10 C ATOM 493 CG ASP A 37 -3.692 -1.604 -15.370 1.00 1.76 C ATOM 494 OD1 ASP A 37 -3.740 -2.512 -14.513 1.00 2.51 O ATOM 495 OD2 ASP A 37 -4.201 -1.726 -16.501 1.00 2.10 O ATOM 0 H ASP A 37 -5.106 0.951 -15.452 1.00 0.81 H new ATOM 0 HA ASP A 37 -3.926 -0.175 -13.102 1.00 0.88 H new ATOM 0 HB2 ASP A 37 -2.883 0.293 -15.922 1.00 1.10 H new ATOM 0 HB3 ASP A 37 -1.971 -0.545 -14.681 1.00 1.10 H new ATOM 500 N GLN A 38 -3.303 2.844 -13.655 1.00 0.68 N ATOM 501 CA GLN A 38 -2.567 4.033 -13.243 1.00 0.60 C ATOM 502 C GLN A 38 -3.354 4.815 -12.197 1.00 0.44 C ATOM 503 O GLN A 38 -2.775 5.546 -11.396 1.00 0.39 O ATOM 504 CB GLN A 38 -2.274 4.947 -14.442 1.00 0.71 C ATOM 505 CG GLN A 38 -0.971 4.655 -15.183 1.00 1.53 C ATOM 506 CD GLN A 38 -0.956 3.322 -15.910 1.00 2.01 C ATOM 507 OE1 GLN A 38 -1.398 3.219 -17.054 1.00 2.57 O ATOM 508 NE2 GLN A 38 -0.413 2.299 -15.269 1.00 2.58 N ATOM 0 H GLN A 38 -4.205 3.040 -14.088 1.00 0.68 H new ATOM 0 HA GLN A 38 -1.622 3.700 -12.814 1.00 0.60 H new ATOM 0 HB2 GLN A 38 -3.100 4.868 -15.149 1.00 0.71 H new ATOM 0 HB3 GLN A 38 -2.251 5.980 -14.093 1.00 0.71 H new ATOM 0 HG2 GLN A 38 -0.789 5.452 -15.904 1.00 1.53 H new ATOM 0 HG3 GLN A 38 -0.147 4.677 -14.470 1.00 1.53 H new ATOM 0 HE21 GLN A 38 -0.057 2.422 -14.321 1.00 2.58 H new ATOM 0 HE22 GLN A 38 -0.351 1.388 -15.723 1.00 2.58 H new ATOM 517 N TYR A 39 -4.676 4.652 -12.206 1.00 0.43 N ATOM 518 CA TYR A 39 -5.545 5.403 -11.309 1.00 0.41 C ATOM 519 C TYR A 39 -6.432 4.467 -10.499 1.00 0.34 C ATOM 520 O TYR A 39 -7.101 3.592 -11.052 1.00 0.36 O ATOM 521 CB TYR A 39 -6.404 6.401 -12.089 1.00 0.64 C ATOM 522 CG TYR A 39 -5.652 7.647 -12.504 1.00 0.92 C ATOM 523 CD1 TYR A 39 -4.926 7.687 -13.687 1.00 1.31 C ATOM 524 CD2 TYR A 39 -5.667 8.782 -11.705 1.00 1.50 C ATOM 525 CE1 TYR A 39 -4.236 8.825 -14.062 1.00 1.97 C ATOM 526 CE2 TYR A 39 -4.981 9.924 -12.073 1.00 2.23 C ATOM 527 CZ TYR A 39 -4.268 9.940 -13.251 1.00 2.39 C ATOM 528 OH TYR A 39 -3.579 11.075 -13.619 1.00 3.17 O ATOM 0 H TYR A 39 -5.166 4.006 -12.825 1.00 0.43 H new ATOM 0 HA TYR A 39 -4.909 5.958 -10.620 1.00 0.41 H new ATOM 0 HB2 TYR A 39 -6.799 5.911 -12.979 1.00 0.64 H new ATOM 0 HB3 TYR A 39 -7.259 6.689 -11.477 1.00 0.64 H new ATOM 0 HD1 TYR A 39 -4.900 6.815 -14.324 1.00 1.31 H new ATOM 0 HD2 TYR A 39 -6.224 8.773 -10.780 1.00 1.50 H new ATOM 0 HE1 TYR A 39 -3.675 8.841 -14.985 1.00 1.97 H new ATOM 0 HE2 TYR A 39 -5.004 10.799 -11.440 1.00 2.23 H new ATOM 0 HH TYR A 39 -3.706 11.769 -12.939 1.00 3.17 H new ATOM 538 N LEU A 40 -6.450 4.668 -9.192 1.00 0.31 N ATOM 539 CA LEU A 40 -7.204 3.805 -8.298 1.00 0.28 C ATOM 540 C LEU A 40 -8.208 4.609 -7.484 1.00 0.25 C ATOM 541 O LEU A 40 -7.876 5.653 -6.926 1.00 0.29 O ATOM 542 CB LEU A 40 -6.243 3.057 -7.373 1.00 0.30 C ATOM 543 CG LEU A 40 -6.370 1.536 -7.409 1.00 0.51 C ATOM 544 CD1 LEU A 40 -6.142 1.016 -8.817 1.00 1.21 C ATOM 545 CD2 LEU A 40 -5.385 0.894 -6.446 1.00 1.31 C ATOM 0 H LEU A 40 -5.949 5.424 -8.725 1.00 0.31 H new ATOM 0 HA LEU A 40 -7.760 3.083 -8.896 1.00 0.28 H new ATOM 0 HB2 LEU A 40 -5.221 3.328 -7.638 1.00 0.30 H new ATOM 0 HB3 LEU A 40 -6.408 3.397 -6.350 1.00 0.30 H new ATOM 0 HG LEU A 40 -7.381 1.271 -7.099 1.00 0.51 H new ATOM 0 HD11 LEU A 40 -6.236 -0.070 -8.824 1.00 1.21 H new ATOM 0 HD12 LEU A 40 -6.883 1.449 -9.489 1.00 1.21 H new ATOM 0 HD13 LEU A 40 -5.143 1.295 -9.151 1.00 1.21 H new ATOM 0 HD21 LEU A 40 -5.491 -0.190 -6.486 1.00 1.31 H new ATOM 0 HD22 LEU A 40 -4.369 1.170 -6.727 1.00 1.31 H new ATOM 0 HD23 LEU A 40 -5.588 1.241 -5.433 1.00 1.31 H new ATOM 557 N THR A 41 -9.437 4.113 -7.423 1.00 0.24 N ATOM 558 CA THR A 41 -10.489 4.762 -6.661 1.00 0.22 C ATOM 559 C THR A 41 -11.105 3.744 -5.715 1.00 0.19 C ATOM 560 O THR A 41 -11.383 2.604 -6.089 1.00 0.21 O ATOM 561 CB THR A 41 -11.575 5.366 -7.587 1.00 0.27 C ATOM 562 OG1 THR A 41 -12.586 6.026 -6.813 1.00 1.36 O ATOM 563 CG2 THR A 41 -12.220 4.299 -8.462 1.00 1.28 C ATOM 0 H THR A 41 -9.728 3.258 -7.896 1.00 0.24 H new ATOM 0 HA THR A 41 -10.056 5.586 -6.094 1.00 0.22 H new ATOM 0 HB THR A 41 -11.083 6.091 -8.235 1.00 0.27 H new ATOM 0 HG1 THR A 41 -13.263 6.403 -7.413 1.00 1.36 H new ATOM 0 HG21 THR A 41 -12.976 4.759 -9.098 1.00 1.28 H new ATOM 0 HG22 THR A 41 -11.458 3.830 -9.085 1.00 1.28 H new ATOM 0 HG23 THR A 41 -12.687 3.544 -7.830 1.00 1.28 H new ATOM 571 N ALA A 42 -11.283 4.157 -4.489 1.00 0.19 N ATOM 572 CA ALA A 42 -11.759 3.281 -3.447 1.00 0.20 C ATOM 573 C ALA A 42 -13.281 3.339 -3.320 1.00 0.20 C ATOM 574 O ALA A 42 -13.886 4.399 -3.495 1.00 0.27 O ATOM 575 CB ALA A 42 -11.055 3.627 -2.153 1.00 0.26 C ATOM 0 H ALA A 42 -11.102 5.113 -4.182 1.00 0.19 H new ATOM 0 HA ALA A 42 -11.522 2.248 -3.702 1.00 0.20 H new ATOM 0 HB1 ALA A 42 -11.409 2.969 -1.359 1.00 0.26 H new ATOM 0 HB2 ALA A 42 -9.980 3.499 -2.278 1.00 0.26 H new ATOM 0 HB3 ALA A 42 -11.268 4.663 -1.888 1.00 0.26 H new ATOM 581 N ALA A 43 -13.896 2.194 -3.042 1.00 0.20 N ATOM 582 CA ALA A 43 -15.357 2.111 -2.915 1.00 0.29 C ATOM 583 C ALA A 43 -15.763 1.015 -1.922 1.00 0.35 C ATOM 584 O ALA A 43 -15.263 -0.105 -1.994 1.00 0.40 O ATOM 585 CB ALA A 43 -15.985 1.843 -4.274 1.00 0.38 C ATOM 0 H ALA A 43 -13.411 1.308 -2.899 1.00 0.20 H new ATOM 0 HA ALA A 43 -15.720 3.066 -2.534 1.00 0.29 H new ATOM 0 HB1 ALA A 43 -17.068 1.783 -4.169 1.00 0.38 H new ATOM 0 HB2 ALA A 43 -15.731 2.653 -4.958 1.00 0.38 H new ATOM 0 HB3 ALA A 43 -15.606 0.901 -4.670 1.00 0.38 H new ATOM 591 N ALA A 44 -16.683 1.341 -1.002 1.00 0.63 N ATOM 592 CA ALA A 44 -17.074 0.417 0.058 1.00 0.65 C ATOM 593 C ALA A 44 -17.653 -0.878 -0.485 1.00 0.46 C ATOM 594 O ALA A 44 -18.651 -0.884 -1.206 1.00 0.79 O ATOM 595 CB ALA A 44 -18.084 1.079 0.979 1.00 1.13 C ATOM 0 H ALA A 44 -17.167 2.239 -0.976 1.00 0.63 H new ATOM 0 HA ALA A 44 -16.170 0.166 0.612 1.00 0.65 H new ATOM 0 HB1 ALA A 44 -18.370 0.382 1.767 1.00 1.13 H new ATOM 0 HB2 ALA A 44 -17.641 1.969 1.425 1.00 1.13 H new ATOM 0 HB3 ALA A 44 -18.968 1.362 0.407 1.00 1.13 H new ATOM 601 N LEU A 45 -17.001 -1.966 -0.128 1.00 0.47 N ATOM 602 CA LEU A 45 -17.469 -3.298 -0.409 1.00 0.66 C ATOM 603 C LEU A 45 -18.538 -3.742 0.575 1.00 0.62 C ATOM 604 O LEU A 45 -18.619 -3.248 1.699 1.00 0.88 O ATOM 605 CB LEU A 45 -16.304 -4.278 -0.415 1.00 1.23 C ATOM 606 CG LEU A 45 -15.958 -4.829 -1.795 1.00 2.25 C ATOM 607 CD1 LEU A 45 -17.148 -5.579 -2.362 1.00 2.87 C ATOM 608 CD2 LEU A 45 -15.536 -3.706 -2.735 1.00 2.93 C ATOM 0 H LEU A 45 -16.114 -1.943 0.375 1.00 0.47 H new ATOM 0 HA LEU A 45 -17.925 -3.285 -1.399 1.00 0.66 H new ATOM 0 HB2 LEU A 45 -15.425 -3.783 -0.003 1.00 1.23 H new ATOM 0 HB3 LEU A 45 -16.541 -5.111 0.248 1.00 1.23 H new ATOM 0 HG LEU A 45 -15.119 -5.518 -1.697 1.00 2.25 H new ATOM 0 HD11 LEU A 45 -16.896 -5.970 -3.347 1.00 2.87 H new ATOM 0 HD12 LEU A 45 -17.407 -6.405 -1.699 1.00 2.87 H new ATOM 0 HD13 LEU A 45 -17.998 -4.902 -2.447 1.00 2.87 H new ATOM 0 HD21 LEU A 45 -15.294 -4.122 -3.713 1.00 2.93 H new ATOM 0 HD22 LEU A 45 -16.352 -2.991 -2.837 1.00 2.93 H new ATOM 0 HD23 LEU A 45 -14.660 -3.201 -2.328 1.00 2.93 H new ATOM 620 N HIS A 46 -19.350 -4.685 0.135 1.00 0.61 N ATOM 621 CA HIS A 46 -20.331 -5.329 0.995 1.00 0.80 C ATOM 622 C HIS A 46 -20.254 -6.834 0.746 1.00 0.76 C ATOM 623 O HIS A 46 -20.733 -7.634 1.545 1.00 0.94 O ATOM 624 CB HIS A 46 -21.755 -4.832 0.705 1.00 1.06 C ATOM 625 CG HIS A 46 -21.891 -3.342 0.611 1.00 1.87 C ATOM 626 ND1 HIS A 46 -21.837 -2.501 1.702 1.00 2.69 N ATOM 627 CD2 HIS A 46 -22.071 -2.543 -0.465 1.00 2.79 C ATOM 628 CE1 HIS A 46 -21.979 -1.253 1.299 1.00 3.63 C ATOM 629 NE2 HIS A 46 -22.120 -1.250 -0.011 1.00 3.71 N ATOM 0 H HIS A 46 -19.350 -5.027 -0.826 1.00 0.61 H new ATOM 0 HA HIS A 46 -20.108 -5.088 2.034 1.00 0.80 H new ATOM 0 HB2 HIS A 46 -22.096 -5.274 -0.231 1.00 1.06 H new ATOM 0 HB3 HIS A 46 -22.419 -5.195 1.490 1.00 1.06 H new ATOM 0 HD2 HIS A 46 -22.160 -2.864 -1.492 1.00 2.79 H new ATOM 0 HE1 HIS A 46 -21.980 -0.381 1.936 1.00 3.63 H new ATOM 0 HE2 HIS A 46 -22.245 -0.421 -0.592 1.00 3.71 H new ATOM 638 N ASN A 47 -19.634 -7.208 -0.373 1.00 0.66 N ATOM 639 CA ASN A 47 -19.220 -8.594 -0.603 1.00 0.71 C ATOM 640 C ASN A 47 -17.788 -8.777 -0.099 1.00 0.76 C ATOM 641 O ASN A 47 -17.238 -9.880 -0.108 1.00 0.88 O ATOM 642 CB ASN A 47 -19.238 -8.910 -2.097 1.00 0.74 C ATOM 643 CG ASN A 47 -19.523 -10.373 -2.391 1.00 1.42 C ATOM 644 OD1 ASN A 47 -19.280 -11.246 -1.562 1.00 2.21 O ATOM 645 ND2 ASN A 47 -20.030 -10.656 -3.582 1.00 1.94 N ATOM 0 H ASN A 47 -19.407 -6.570 -1.136 1.00 0.66 H new ATOM 0 HA ASN A 47 -19.907 -9.257 -0.077 1.00 0.71 H new ATOM 0 HB2 ASN A 47 -19.993 -8.293 -2.584 1.00 0.74 H new ATOM 0 HB3 ASN A 47 -18.276 -8.638 -2.532 1.00 0.74 H new ATOM 0 HD21 ASN A 47 -20.231 -11.624 -3.834 1.00 1.94 H new ATOM 0 HD22 ASN A 47 -20.220 -9.906 -4.247 1.00 1.94 H new ATOM 652 N LEU A 48 -17.215 -7.664 0.353 1.00 0.77 N ATOM 653 CA LEU A 48 -15.842 -7.581 0.837 1.00 0.89 C ATOM 654 C LEU A 48 -14.813 -7.843 -0.277 1.00 0.81 C ATOM 655 O LEU A 48 -14.083 -6.933 -0.666 1.00 0.78 O ATOM 656 CB LEU A 48 -15.658 -8.484 2.058 1.00 1.15 C ATOM 657 CG LEU A 48 -16.580 -8.110 3.234 1.00 1.37 C ATOM 658 CD1 LEU A 48 -16.431 -9.071 4.398 1.00 1.71 C ATOM 659 CD2 LEU A 48 -16.307 -6.687 3.694 1.00 1.66 C ATOM 0 H LEU A 48 -17.707 -6.772 0.393 1.00 0.77 H new ATOM 0 HA LEU A 48 -15.651 -6.558 1.160 1.00 0.89 H new ATOM 0 HB2 LEU A 48 -15.849 -9.518 1.769 1.00 1.15 H new ATOM 0 HB3 LEU A 48 -14.620 -8.432 2.387 1.00 1.15 H new ATOM 0 HG LEU A 48 -17.607 -8.180 2.875 1.00 1.37 H new ATOM 0 HD11 LEU A 48 -17.099 -8.771 5.206 1.00 1.71 H new ATOM 0 HD12 LEU A 48 -16.686 -10.079 4.072 1.00 1.71 H new ATOM 0 HD13 LEU A 48 -15.401 -9.054 4.754 1.00 1.71 H new ATOM 0 HD21 LEU A 48 -16.968 -6.440 4.525 1.00 1.66 H new ATOM 0 HD22 LEU A 48 -15.270 -6.602 4.017 1.00 1.66 H new ATOM 0 HD23 LEU A 48 -16.488 -5.997 2.870 1.00 1.66 H new ATOM 671 N ASP A 49 -14.763 -9.051 -0.813 1.00 0.83 N ATOM 672 CA ASP A 49 -13.806 -9.374 -1.880 1.00 0.83 C ATOM 673 C ASP A 49 -14.348 -8.984 -3.262 1.00 0.75 C ATOM 674 O ASP A 49 -15.000 -9.779 -3.941 1.00 0.83 O ATOM 675 CB ASP A 49 -13.438 -10.863 -1.853 1.00 1.00 C ATOM 676 CG ASP A 49 -12.615 -11.300 -3.057 1.00 1.20 C ATOM 677 OD1 ASP A 49 -11.423 -10.944 -3.138 1.00 1.87 O ATOM 678 OD2 ASP A 49 -13.162 -12.007 -3.933 1.00 1.53 O ATOM 0 H ASP A 49 -15.366 -9.826 -0.535 1.00 0.83 H new ATOM 0 HA ASP A 49 -12.905 -8.789 -1.696 1.00 0.83 H new ATOM 0 HB2 ASP A 49 -12.878 -11.076 -0.942 1.00 1.00 H new ATOM 0 HB3 ASP A 49 -14.352 -11.456 -1.811 1.00 1.00 H new ATOM 683 N GLU A 50 -14.125 -7.734 -3.635 1.00 0.66 N ATOM 684 CA GLU A 50 -14.436 -7.241 -4.978 1.00 0.72 C ATOM 685 C GLU A 50 -13.436 -6.156 -5.348 1.00 0.62 C ATOM 686 O GLU A 50 -13.096 -5.961 -6.515 1.00 0.68 O ATOM 687 CB GLU A 50 -15.873 -6.719 -5.068 1.00 0.94 C ATOM 688 CG GLU A 50 -16.225 -6.049 -6.391 1.00 1.25 C ATOM 689 CD GLU A 50 -16.107 -6.975 -7.586 1.00 1.93 C ATOM 690 OE1 GLU A 50 -16.996 -7.832 -7.775 1.00 2.66 O ATOM 691 OE2 GLU A 50 -15.143 -6.828 -8.367 1.00 2.35 O ATOM 0 H GLU A 50 -13.723 -7.028 -3.019 1.00 0.66 H new ATOM 0 HA GLU A 50 -14.357 -8.066 -5.686 1.00 0.72 H new ATOM 0 HB2 GLU A 50 -16.558 -7.551 -4.904 1.00 0.94 H new ATOM 0 HB3 GLU A 50 -16.038 -6.006 -4.260 1.00 0.94 H new ATOM 0 HG2 GLU A 50 -17.244 -5.667 -6.336 1.00 1.25 H new ATOM 0 HG3 GLU A 50 -15.570 -5.190 -6.540 1.00 1.25 H new ATOM 698 N ALA A 51 -12.928 -5.480 -4.328 1.00 0.52 N ATOM 699 CA ALA A 51 -11.878 -4.504 -4.520 1.00 0.43 C ATOM 700 C ALA A 51 -10.566 -5.237 -4.704 1.00 0.32 C ATOM 701 O ALA A 51 -10.455 -6.412 -4.346 1.00 0.33 O ATOM 702 CB ALA A 51 -11.790 -3.584 -3.324 1.00 0.50 C ATOM 0 H ALA A 51 -13.230 -5.593 -3.360 1.00 0.52 H new ATOM 0 HA ALA A 51 -12.096 -3.900 -5.401 1.00 0.43 H new ATOM 0 HB1 ALA A 51 -10.995 -2.855 -3.483 1.00 0.50 H new ATOM 0 HB2 ALA A 51 -12.739 -3.064 -3.195 1.00 0.50 H new ATOM 0 HB3 ALA A 51 -11.572 -4.169 -2.430 1.00 0.50 H new ATOM 708 N VAL A 52 -9.579 -4.565 -5.262 1.00 0.28 N ATOM 709 CA VAL A 52 -8.343 -5.227 -5.593 1.00 0.26 C ATOM 710 C VAL A 52 -7.583 -5.580 -4.338 1.00 0.22 C ATOM 711 O VAL A 52 -7.400 -4.769 -3.430 1.00 0.23 O ATOM 712 CB VAL A 52 -7.445 -4.422 -6.556 1.00 0.29 C ATOM 713 CG1 VAL A 52 -8.071 -4.382 -7.937 1.00 0.38 C ATOM 714 CG2 VAL A 52 -7.193 -3.013 -6.041 1.00 0.31 C ATOM 0 H VAL A 52 -9.612 -3.572 -5.492 1.00 0.28 H new ATOM 0 HA VAL A 52 -8.620 -6.137 -6.126 1.00 0.26 H new ATOM 0 HB VAL A 52 -6.479 -4.924 -6.617 1.00 0.29 H new ATOM 0 HG11 VAL A 52 -7.431 -3.812 -8.610 1.00 0.38 H new ATOM 0 HG12 VAL A 52 -8.182 -5.398 -8.316 1.00 0.38 H new ATOM 0 HG13 VAL A 52 -9.050 -3.907 -7.879 1.00 0.38 H new ATOM 0 HG21 VAL A 52 -6.557 -2.477 -6.745 1.00 0.31 H new ATOM 0 HG22 VAL A 52 -8.143 -2.488 -5.937 1.00 0.31 H new ATOM 0 HG23 VAL A 52 -6.698 -3.063 -5.071 1.00 0.31 H new ATOM 724 N LYS A 53 -7.186 -6.821 -4.305 1.00 0.22 N ATOM 725 CA LYS A 53 -6.554 -7.413 -3.141 1.00 0.22 C ATOM 726 C LYS A 53 -5.057 -7.361 -3.258 1.00 0.18 C ATOM 727 O LYS A 53 -4.466 -7.740 -4.269 1.00 0.24 O ATOM 728 CB LYS A 53 -7.042 -8.851 -2.918 1.00 0.35 C ATOM 729 CG LYS A 53 -7.391 -9.614 -4.185 1.00 0.78 C ATOM 730 CD LYS A 53 -7.832 -11.031 -3.854 1.00 1.12 C ATOM 731 CE LYS A 53 -8.552 -11.693 -5.013 1.00 1.37 C ATOM 732 NZ LYS A 53 -9.873 -11.065 -5.272 1.00 1.59 N ATOM 0 H LYS A 53 -7.290 -7.464 -5.090 1.00 0.22 H new ATOM 0 HA LYS A 53 -6.842 -6.826 -2.269 1.00 0.22 H new ATOM 0 HB2 LYS A 53 -6.270 -9.402 -2.381 1.00 0.35 H new ATOM 0 HB3 LYS A 53 -7.921 -8.825 -2.274 1.00 0.35 H new ATOM 0 HG2 LYS A 53 -8.187 -9.096 -4.720 1.00 0.78 H new ATOM 0 HG3 LYS A 53 -6.527 -9.642 -4.848 1.00 0.78 H new ATOM 0 HD2 LYS A 53 -6.961 -11.627 -3.582 1.00 1.12 H new ATOM 0 HD3 LYS A 53 -8.489 -11.011 -2.984 1.00 1.12 H new ATOM 0 HE2 LYS A 53 -7.936 -11.626 -5.910 1.00 1.37 H new ATOM 0 HE3 LYS A 53 -8.689 -12.753 -4.798 1.00 1.37 H new ATOM 0 HZ1 LYS A 53 -10.530 -11.780 -5.645 1.00 1.59 H new ATOM 0 HZ2 LYS A 53 -10.252 -10.676 -4.385 1.00 1.59 H new ATOM 0 HZ3 LYS A 53 -9.763 -10.299 -5.967 1.00 1.59 H new ATOM 746 N PHE A 54 -4.463 -6.867 -2.195 1.00 0.18 N ATOM 747 CA PHE A 54 -3.072 -6.576 -2.154 1.00 0.19 C ATOM 748 C PHE A 54 -2.332 -7.671 -1.432 1.00 0.20 C ATOM 749 O PHE A 54 -2.927 -8.563 -0.819 1.00 0.23 O ATOM 750 CB PHE A 54 -2.830 -5.235 -1.452 1.00 0.25 C ATOM 751 CG PHE A 54 -3.288 -4.034 -2.233 1.00 1.22 C ATOM 752 CD1 PHE A 54 -4.613 -3.637 -2.211 1.00 1.57 C ATOM 753 CD2 PHE A 54 -2.386 -3.296 -2.983 1.00 1.95 C ATOM 754 CE1 PHE A 54 -5.030 -2.527 -2.921 1.00 2.60 C ATOM 755 CE2 PHE A 54 -2.797 -2.187 -3.696 1.00 2.98 C ATOM 756 CZ PHE A 54 -4.121 -1.801 -3.664 1.00 3.31 C ATOM 0 H PHE A 54 -4.954 -6.657 -1.326 1.00 0.18 H new ATOM 0 HA PHE A 54 -2.701 -6.512 -3.177 1.00 0.19 H new ATOM 0 HB2 PHE A 54 -3.342 -5.245 -0.490 1.00 0.25 H new ATOM 0 HB3 PHE A 54 -1.765 -5.134 -1.245 1.00 0.25 H new ATOM 0 HD1 PHE A 54 -5.330 -4.201 -1.632 1.00 1.57 H new ATOM 0 HD2 PHE A 54 -1.348 -3.592 -3.010 1.00 1.95 H new ATOM 0 HE1 PHE A 54 -6.067 -2.228 -2.894 1.00 2.60 H new ATOM 0 HE2 PHE A 54 -2.083 -1.623 -4.278 1.00 2.98 H new ATOM 0 HZ PHE A 54 -4.445 -0.933 -4.219 1.00 3.31 H new ATOM 766 N ASP A 55 -1.039 -7.586 -1.529 1.00 0.21 N ATOM 767 CA ASP A 55 -0.144 -8.469 -0.824 1.00 0.22 C ATOM 768 C ASP A 55 1.006 -7.657 -0.282 1.00 0.23 C ATOM 769 O ASP A 55 1.594 -6.839 -0.992 1.00 0.27 O ATOM 770 CB ASP A 55 0.386 -9.559 -1.757 1.00 0.24 C ATOM 771 CG ASP A 55 1.701 -10.155 -1.280 1.00 1.33 C ATOM 772 OD1 ASP A 55 1.681 -10.963 -0.329 1.00 1.89 O ATOM 773 OD2 ASP A 55 2.757 -9.815 -1.836 1.00 1.93 O ATOM 0 H ASP A 55 -0.564 -6.893 -2.107 1.00 0.21 H new ATOM 0 HA ASP A 55 -0.682 -8.952 -0.008 1.00 0.22 H new ATOM 0 HB2 ASP A 55 -0.357 -10.352 -1.841 1.00 0.24 H new ATOM 0 HB3 ASP A 55 0.522 -9.142 -2.755 1.00 0.24 H new ATOM 778 N MET A 56 1.278 -7.864 0.990 1.00 0.24 N ATOM 779 CA MET A 56 2.338 -7.178 1.671 1.00 0.25 C ATOM 780 C MET A 56 3.468 -8.136 1.927 1.00 0.25 C ATOM 781 O MET A 56 3.264 -9.275 2.341 1.00 0.30 O ATOM 782 CB MET A 56 1.852 -6.601 3.000 1.00 0.33 C ATOM 783 CG MET A 56 0.744 -5.578 2.859 1.00 0.97 C ATOM 784 SD MET A 56 0.170 -4.960 4.454 1.00 1.19 S ATOM 785 CE MET A 56 -0.402 -6.471 5.231 1.00 1.85 C ATOM 0 H MET A 56 0.762 -8.519 1.578 1.00 0.24 H new ATOM 0 HA MET A 56 2.678 -6.356 1.041 1.00 0.25 H new ATOM 0 HB2 MET A 56 1.501 -7.417 3.632 1.00 0.33 H new ATOM 0 HB3 MET A 56 2.695 -6.140 3.514 1.00 0.33 H new ATOM 0 HG2 MET A 56 1.099 -4.743 2.255 1.00 0.97 H new ATOM 0 HG3 MET A 56 -0.093 -6.025 2.323 1.00 0.97 H new ATOM 0 HE1 MET A 56 -1.285 -6.259 5.834 1.00 1.85 H new ATOM 0 HE2 MET A 56 -0.654 -7.202 4.463 1.00 1.85 H new ATOM 0 HE3 MET A 56 0.385 -6.872 5.870 1.00 1.85 H new ATOM 795 N GLY A 57 4.651 -7.666 1.675 1.00 0.26 N ATOM 796 CA GLY A 57 5.825 -8.389 2.030 1.00 0.32 C ATOM 797 C GLY A 57 6.788 -7.436 2.649 1.00 0.31 C ATOM 798 O GLY A 57 7.091 -6.410 2.054 1.00 0.35 O ATOM 0 H GLY A 57 4.826 -6.771 1.218 1.00 0.26 H new ATOM 0 HA2 GLY A 57 5.582 -9.191 2.727 1.00 0.32 H new ATOM 0 HA3 GLY A 57 6.265 -8.856 1.149 1.00 0.32 H new ATOM 802 N ALA A 58 7.261 -7.725 3.830 1.00 0.37 N ATOM 803 CA ALA A 58 8.135 -6.792 4.478 1.00 0.38 C ATOM 804 C ALA A 58 9.518 -7.073 3.992 1.00 0.42 C ATOM 805 O ALA A 58 9.900 -8.229 3.810 1.00 0.61 O ATOM 806 CB ALA A 58 8.054 -6.909 5.990 1.00 0.51 C ATOM 0 H ALA A 58 7.061 -8.578 4.352 1.00 0.37 H new ATOM 0 HA ALA A 58 7.841 -5.771 4.235 1.00 0.38 H new ATOM 0 HB1 ALA A 58 8.730 -6.187 6.448 1.00 0.51 H new ATOM 0 HB2 ALA A 58 7.034 -6.708 6.316 1.00 0.51 H new ATOM 0 HB3 ALA A 58 8.340 -7.916 6.293 1.00 0.51 H new ATOM 812 N TYR A 59 10.267 -6.043 3.726 1.00 0.45 N ATOM 813 CA TYR A 59 11.605 -6.258 3.243 1.00 0.61 C ATOM 814 C TYR A 59 12.568 -5.322 3.929 1.00 0.72 C ATOM 815 O TYR A 59 12.188 -4.232 4.344 1.00 0.81 O ATOM 816 CB TYR A 59 11.633 -6.179 1.724 1.00 0.93 C ATOM 817 CG TYR A 59 10.953 -7.374 1.080 1.00 1.64 C ATOM 818 CD1 TYR A 59 11.560 -8.627 1.076 1.00 2.54 C ATOM 819 CD2 TYR A 59 9.698 -7.261 0.506 1.00 2.01 C ATOM 820 CE1 TYR A 59 10.939 -9.724 0.513 1.00 3.70 C ATOM 821 CE2 TYR A 59 9.068 -8.355 -0.054 1.00 3.08 C ATOM 822 CZ TYR A 59 9.691 -9.583 -0.050 1.00 3.92 C ATOM 823 OH TYR A 59 9.063 -10.672 -0.615 1.00 5.11 O ATOM 0 H TYR A 59 9.987 -5.068 3.831 1.00 0.45 H new ATOM 0 HA TYR A 59 11.939 -7.264 3.497 1.00 0.61 H new ATOM 0 HB2 TYR A 59 11.140 -5.263 1.399 1.00 0.93 H new ATOM 0 HB3 TYR A 59 12.667 -6.123 1.383 1.00 0.93 H new ATOM 0 HD1 TYR A 59 12.537 -8.743 1.522 1.00 2.54 H new ATOM 0 HD2 TYR A 59 9.203 -6.301 0.496 1.00 2.01 H new ATOM 0 HE1 TYR A 59 11.429 -10.686 0.514 1.00 3.70 H new ATOM 0 HE2 TYR A 59 8.088 -8.247 -0.495 1.00 3.08 H new ATOM 0 HH TYR A 59 8.189 -10.400 -0.966 1.00 5.11 H new ATOM 833 N LYS A 60 13.807 -5.764 4.083 1.00 0.92 N ATOM 834 CA LYS A 60 14.683 -5.117 5.038 1.00 1.13 C ATOM 835 C LYS A 60 16.126 -4.988 4.592 1.00 1.50 C ATOM 836 O LYS A 60 16.747 -5.934 4.105 1.00 1.77 O ATOM 837 CB LYS A 60 14.629 -5.808 6.398 1.00 1.30 C ATOM 838 CG LYS A 60 15.501 -5.122 7.435 1.00 1.66 C ATOM 839 CD LYS A 60 14.797 -4.986 8.770 1.00 2.14 C ATOM 840 CE LYS A 60 15.574 -4.079 9.705 1.00 2.79 C ATOM 841 NZ LYS A 60 15.825 -2.738 9.103 1.00 3.47 N ATOM 0 H LYS A 60 14.217 -6.546 3.573 1.00 0.92 H new ATOM 0 HA LYS A 60 14.294 -4.102 5.116 1.00 1.13 H new ATOM 0 HB2 LYS A 60 13.598 -5.828 6.751 1.00 1.30 H new ATOM 0 HB3 LYS A 60 14.948 -6.844 6.288 1.00 1.30 H new ATOM 0 HG2 LYS A 60 16.422 -5.690 7.567 1.00 1.66 H new ATOM 0 HG3 LYS A 60 15.785 -4.134 7.073 1.00 1.66 H new ATOM 0 HD2 LYS A 60 13.795 -4.584 8.617 1.00 2.14 H new ATOM 0 HD3 LYS A 60 14.680 -5.969 9.225 1.00 2.14 H new ATOM 0 HE2 LYS A 60 15.021 -3.960 10.637 1.00 2.79 H new ATOM 0 HE3 LYS A 60 16.526 -4.547 9.956 1.00 2.79 H new ATOM 0 HZ1 LYS A 60 16.075 -2.062 9.853 1.00 3.47 H new ATOM 0 HZ2 LYS A 60 16.608 -2.804 8.422 1.00 3.47 H new ATOM 0 HZ3 LYS A 60 14.967 -2.411 8.614 1.00 3.47 H new ATOM 855 N SER A 61 16.614 -3.784 4.742 1.00 1.67 N ATOM 856 CA SER A 61 18.026 -3.502 4.822 1.00 2.15 C ATOM 857 C SER A 61 18.171 -2.580 6.017 1.00 2.02 C ATOM 858 O SER A 61 17.170 -2.013 6.452 1.00 1.72 O ATOM 859 CB SER A 61 18.516 -2.829 3.535 1.00 2.67 C ATOM 860 OG SER A 61 17.737 -1.684 3.230 1.00 3.06 O ATOM 0 H SER A 61 16.028 -2.952 4.814 1.00 1.67 H new ATOM 0 HA SER A 61 18.624 -4.406 4.936 1.00 2.15 H new ATOM 0 HB2 SER A 61 19.562 -2.542 3.646 1.00 2.67 H new ATOM 0 HB3 SER A 61 18.466 -3.538 2.708 1.00 2.67 H new ATOM 0 HG SER A 61 18.070 -1.272 2.406 1.00 3.06 H new ATOM 866 N SER A 62 19.349 -2.430 6.596 1.00 2.37 N ATOM 867 CA SER A 62 19.468 -1.498 7.706 1.00 2.25 C ATOM 868 C SER A 62 19.741 -0.108 7.152 1.00 2.37 C ATOM 869 O SER A 62 20.606 0.629 7.626 1.00 2.59 O ATOM 870 CB SER A 62 20.586 -1.941 8.649 1.00 2.65 C ATOM 871 OG SER A 62 20.387 -3.284 9.069 1.00 2.99 O ATOM 0 H SER A 62 20.205 -2.918 6.332 1.00 2.37 H new ATOM 0 HA SER A 62 18.540 -1.479 8.277 1.00 2.25 H new ATOM 0 HB2 SER A 62 21.549 -1.851 8.147 1.00 2.65 H new ATOM 0 HB3 SER A 62 20.617 -1.284 9.518 1.00 2.65 H new ATOM 0 HG SER A 62 21.114 -3.550 9.670 1.00 2.99 H new ATOM 877 N LYS A 63 18.973 0.216 6.122 1.00 2.37 N ATOM 878 CA LYS A 63 18.989 1.510 5.488 1.00 2.64 C ATOM 879 C LYS A 63 17.572 2.094 5.469 1.00 2.48 C ATOM 880 O LYS A 63 17.180 2.752 4.504 1.00 2.87 O ATOM 881 CB LYS A 63 19.569 1.359 4.071 1.00 3.20 C ATOM 882 CG LYS A 63 19.743 2.659 3.303 1.00 3.62 C ATOM 883 CD LYS A 63 20.610 3.656 4.050 1.00 4.18 C ATOM 884 CE LYS A 63 20.779 4.933 3.246 1.00 4.77 C ATOM 885 NZ LYS A 63 19.486 5.637 3.040 1.00 5.27 N ATOM 0 H LYS A 63 18.309 -0.434 5.700 1.00 2.37 H new ATOM 0 HA LYS A 63 19.619 2.204 6.045 1.00 2.64 H new ATOM 0 HB2 LYS A 63 20.538 0.865 4.143 1.00 3.20 H new ATOM 0 HB3 LYS A 63 18.917 0.700 3.497 1.00 3.20 H new ATOM 0 HG2 LYS A 63 20.190 2.448 2.332 1.00 3.62 H new ATOM 0 HG3 LYS A 63 18.765 3.101 3.114 1.00 3.62 H new ATOM 0 HD2 LYS A 63 20.159 3.886 5.015 1.00 4.18 H new ATOM 0 HD3 LYS A 63 21.587 3.216 4.252 1.00 4.18 H new ATOM 0 HE2 LYS A 63 21.475 5.596 3.761 1.00 4.77 H new ATOM 0 HE3 LYS A 63 21.221 4.696 2.278 1.00 4.77 H new ATOM 0 HZ1 LYS A 63 19.667 6.598 2.686 1.00 5.27 H new ATOM 0 HZ2 LYS A 63 18.913 5.115 2.347 1.00 5.27 H new ATOM 0 HZ3 LYS A 63 18.972 5.691 3.943 1.00 5.27 H new ATOM 899 N ASP A 64 16.774 1.824 6.506 1.00 2.02 N ATOM 900 CA ASP A 64 15.379 2.270 6.487 1.00 2.02 C ATOM 901 C ASP A 64 15.320 3.773 6.786 1.00 2.36 C ATOM 902 O ASP A 64 16.034 4.563 6.166 1.00 2.81 O ATOM 903 CB ASP A 64 14.576 1.511 7.562 1.00 1.53 C ATOM 904 CG ASP A 64 15.147 0.149 7.929 1.00 1.63 C ATOM 905 OD1 ASP A 64 16.207 0.110 8.599 1.00 1.89 O ATOM 906 OD2 ASP A 64 14.520 -0.881 7.605 1.00 1.88 O ATOM 0 H ASP A 64 17.057 1.316 7.344 1.00 2.02 H new ATOM 0 HA ASP A 64 14.952 2.071 5.504 1.00 2.02 H new ATOM 0 HB2 ASP A 64 14.526 2.125 8.461 1.00 1.53 H new ATOM 0 HB3 ASP A 64 13.553 1.379 7.209 1.00 1.53 H new ATOM 911 N ASP A 65 14.504 4.185 7.749 1.00 2.27 N ATOM 912 CA ASP A 65 14.675 5.496 8.362 1.00 2.65 C ATOM 913 C ASP A 65 14.735 5.355 9.879 1.00 2.35 C ATOM 914 O ASP A 65 15.806 5.255 10.476 1.00 2.28 O ATOM 915 CB ASP A 65 13.524 6.419 7.936 1.00 3.22 C ATOM 916 CG ASP A 65 13.497 7.734 8.686 1.00 3.59 C ATOM 917 OD1 ASP A 65 14.300 8.630 8.359 1.00 4.06 O ATOM 918 OD2 ASP A 65 12.653 7.876 9.596 1.00 3.75 O ATOM 0 H ASP A 65 13.727 3.638 8.119 1.00 2.27 H new ATOM 0 HA ASP A 65 15.612 5.939 8.026 1.00 2.65 H new ATOM 0 HB2 ASP A 65 13.606 6.620 6.868 1.00 3.22 H new ATOM 0 HB3 ASP A 65 12.577 5.902 8.091 1.00 3.22 H new ATOM 923 N ALA A 66 13.548 5.320 10.474 1.00 2.40 N ATOM 924 CA ALA A 66 13.317 4.830 11.823 1.00 2.34 C ATOM 925 C ALA A 66 12.142 3.867 11.759 1.00 2.24 C ATOM 926 O ALA A 66 11.496 3.550 12.760 1.00 2.63 O ATOM 927 CB ALA A 66 13.030 5.983 12.773 1.00 2.98 C ATOM 0 H ALA A 66 12.696 5.642 10.015 1.00 2.40 H new ATOM 0 HA ALA A 66 14.202 4.321 12.204 1.00 2.34 H new ATOM 0 HB1 ALA A 66 12.860 5.594 13.777 1.00 2.98 H new ATOM 0 HB2 ALA A 66 13.881 6.663 12.787 1.00 2.98 H new ATOM 0 HB3 ALA A 66 12.143 6.519 12.437 1.00 2.98 H new ATOM 933 N LYS A 67 11.882 3.417 10.541 1.00 1.96 N ATOM 934 CA LYS A 67 10.641 2.759 10.178 1.00 1.89 C ATOM 935 C LYS A 67 10.891 1.729 9.092 1.00 1.44 C ATOM 936 O LYS A 67 11.725 1.937 8.218 1.00 1.95 O ATOM 937 CB LYS A 67 9.598 3.790 9.727 1.00 2.82 C ATOM 938 CG LYS A 67 10.167 5.035 9.057 1.00 3.45 C ATOM 939 CD LYS A 67 9.050 5.952 8.577 1.00 4.32 C ATOM 940 CE LYS A 67 9.553 7.347 8.230 1.00 5.01 C ATOM 941 NZ LYS A 67 10.028 8.084 9.434 1.00 5.31 N ATOM 0 H LYS A 67 12.540 3.501 9.766 1.00 1.96 H new ATOM 0 HA LYS A 67 10.248 2.243 11.054 1.00 1.89 H new ATOM 0 HB2 LYS A 67 8.908 3.307 9.035 1.00 2.82 H new ATOM 0 HB3 LYS A 67 9.015 4.098 10.595 1.00 2.82 H new ATOM 0 HG2 LYS A 67 10.806 5.571 9.759 1.00 3.45 H new ATOM 0 HG3 LYS A 67 10.793 4.745 8.213 1.00 3.45 H new ATOM 0 HD2 LYS A 67 8.574 5.512 7.701 1.00 4.32 H new ATOM 0 HD3 LYS A 67 8.286 6.026 9.351 1.00 4.32 H new ATOM 0 HE2 LYS A 67 10.366 7.270 7.508 1.00 5.01 H new ATOM 0 HE3 LYS A 67 8.753 7.912 7.751 1.00 5.01 H new ATOM 0 HZ1 LYS A 67 9.604 9.034 9.449 1.00 5.31 H new ATOM 0 HZ2 LYS A 67 9.748 7.566 10.291 1.00 5.31 H new ATOM 0 HZ3 LYS A 67 11.064 8.168 9.403 1.00 5.31 H new ATOM 955 N ILE A 68 10.154 0.636 9.158 1.00 0.88 N ATOM 956 CA ILE A 68 10.431 -0.547 8.371 1.00 0.76 C ATOM 957 C ILE A 68 9.464 -0.651 7.223 1.00 0.43 C ATOM 958 O ILE A 68 8.319 -0.195 7.313 1.00 0.37 O ATOM 959 CB ILE A 68 10.393 -1.858 9.190 1.00 0.97 C ATOM 960 CG1 ILE A 68 9.096 -1.990 10.010 1.00 1.07 C ATOM 961 CG2 ILE A 68 11.619 -1.955 10.090 1.00 1.51 C ATOM 962 CD1 ILE A 68 9.069 -1.184 11.297 1.00 1.66 C ATOM 0 H ILE A 68 9.340 0.545 9.765 1.00 0.88 H new ATOM 0 HA ILE A 68 11.450 -0.429 8.003 1.00 0.76 H new ATOM 0 HB ILE A 68 10.409 -2.689 8.484 1.00 0.97 H new ATOM 0 HG12 ILE A 68 8.256 -1.681 9.387 1.00 1.07 H new ATOM 0 HG13 ILE A 68 8.943 -3.041 10.253 1.00 1.07 H new ATOM 0 HG21 ILE A 68 11.579 -2.883 10.661 1.00 1.51 H new ATOM 0 HG22 ILE A 68 12.521 -1.944 9.478 1.00 1.51 H new ATOM 0 HG23 ILE A 68 11.635 -1.108 10.776 1.00 1.51 H new ATOM 0 HD11 ILE A 68 8.117 -1.341 11.805 1.00 1.66 H new ATOM 0 HD12 ILE A 68 9.884 -1.507 11.945 1.00 1.66 H new ATOM 0 HD13 ILE A 68 9.187 -0.125 11.066 1.00 1.66 H new ATOM 974 N THR A 69 9.926 -1.264 6.154 1.00 0.47 N ATOM 975 CA THR A 69 9.250 -1.182 4.893 1.00 0.38 C ATOM 976 C THR A 69 8.577 -2.498 4.530 1.00 0.34 C ATOM 977 O THR A 69 9.161 -3.578 4.657 1.00 0.46 O ATOM 978 CB THR A 69 10.260 -0.799 3.792 1.00 0.55 C ATOM 979 OG1 THR A 69 11.305 -1.773 3.717 1.00 1.50 O ATOM 980 CG2 THR A 69 10.884 0.554 4.085 1.00 1.23 C ATOM 0 H THR A 69 10.776 -1.828 6.142 1.00 0.47 H new ATOM 0 HA THR A 69 8.475 -0.420 4.975 1.00 0.38 H new ATOM 0 HB THR A 69 9.721 -0.757 2.846 1.00 0.55 H new ATOM 0 HG1 THR A 69 11.023 -2.591 4.176 1.00 1.50 H new ATOM 0 HG21 THR A 69 11.593 0.806 3.297 1.00 1.23 H new ATOM 0 HG22 THR A 69 10.103 1.313 4.127 1.00 1.23 H new ATOM 0 HG23 THR A 69 11.404 0.515 5.042 1.00 1.23 H new ATOM 988 N VAL A 70 7.344 -2.383 4.078 1.00 0.27 N ATOM 989 CA VAL A 70 6.591 -3.499 3.552 1.00 0.28 C ATOM 990 C VAL A 70 6.222 -3.153 2.124 1.00 0.26 C ATOM 991 O VAL A 70 6.292 -1.979 1.744 1.00 0.29 O ATOM 992 CB VAL A 70 5.307 -3.790 4.364 1.00 0.33 C ATOM 993 CG1 VAL A 70 5.653 -4.201 5.785 1.00 0.98 C ATOM 994 CG2 VAL A 70 4.376 -2.586 4.366 1.00 1.06 C ATOM 0 H VAL A 70 6.833 -1.500 4.067 1.00 0.27 H new ATOM 0 HA VAL A 70 7.203 -4.399 3.612 1.00 0.28 H new ATOM 0 HB VAL A 70 4.786 -4.618 3.883 1.00 0.33 H new ATOM 0 HG11 VAL A 70 4.736 -4.401 6.339 1.00 0.98 H new ATOM 0 HG12 VAL A 70 6.268 -5.101 5.764 1.00 0.98 H new ATOM 0 HG13 VAL A 70 6.203 -3.396 6.273 1.00 0.98 H new ATOM 0 HG21 VAL A 70 3.482 -2.819 4.944 1.00 1.06 H new ATOM 0 HG22 VAL A 70 4.886 -1.733 4.814 1.00 1.06 H new ATOM 0 HG23 VAL A 70 4.093 -2.343 3.342 1.00 1.06 H new ATOM 1004 N ILE A 71 5.848 -4.152 1.347 1.00 0.25 N ATOM 1005 CA ILE A 71 5.579 -3.972 -0.068 1.00 0.28 C ATOM 1006 C ILE A 71 4.086 -4.062 -0.331 1.00 0.28 C ATOM 1007 O ILE A 71 3.438 -4.993 0.130 1.00 0.33 O ATOM 1008 CB ILE A 71 6.324 -5.051 -0.894 1.00 0.39 C ATOM 1009 CG1 ILE A 71 7.738 -4.584 -1.273 1.00 1.29 C ATOM 1010 CG2 ILE A 71 5.543 -5.430 -2.146 1.00 1.34 C ATOM 1011 CD1 ILE A 71 8.608 -4.180 -0.102 1.00 2.12 C ATOM 0 H ILE A 71 5.722 -5.109 1.677 1.00 0.25 H new ATOM 0 HA ILE A 71 5.934 -2.986 -0.369 1.00 0.28 H new ATOM 0 HB ILE A 71 6.410 -5.936 -0.263 1.00 0.39 H new ATOM 0 HG12 ILE A 71 8.236 -5.386 -1.818 1.00 1.29 H new ATOM 0 HG13 ILE A 71 7.655 -3.738 -1.955 1.00 1.29 H new ATOM 0 HG21 ILE A 71 6.093 -6.189 -2.702 1.00 1.34 H new ATOM 0 HG22 ILE A 71 4.568 -5.825 -1.861 1.00 1.34 H new ATOM 0 HG23 ILE A 71 5.408 -4.548 -2.772 1.00 1.34 H new ATOM 0 HD11 ILE A 71 9.586 -3.866 -0.467 1.00 2.12 H new ATOM 0 HD12 ILE A 71 8.138 -3.355 0.433 1.00 2.12 H new ATOM 0 HD13 ILE A 71 8.728 -5.028 0.572 1.00 2.12 H new ATOM 1023 N LEU A 72 3.534 -3.082 -1.030 1.00 0.28 N ATOM 1024 CA LEU A 72 2.132 -3.160 -1.421 1.00 0.29 C ATOM 1025 C LEU A 72 2.002 -3.436 -2.917 1.00 0.27 C ATOM 1026 O LEU A 72 2.462 -2.650 -3.751 1.00 0.30 O ATOM 1027 CB LEU A 72 1.377 -1.884 -1.042 1.00 0.33 C ATOM 1028 CG LEU A 72 -0.125 -2.067 -0.793 1.00 0.37 C ATOM 1029 CD1 LEU A 72 -0.355 -2.934 0.434 1.00 0.79 C ATOM 1030 CD2 LEU A 72 -0.805 -0.718 -0.624 1.00 0.88 C ATOM 0 H LEU A 72 4.022 -2.239 -1.334 1.00 0.28 H new ATOM 0 HA LEU A 72 1.682 -3.990 -0.876 1.00 0.29 H new ATOM 0 HB2 LEU A 72 1.830 -1.465 -0.143 1.00 0.33 H new ATOM 0 HB3 LEU A 72 1.511 -1.151 -1.838 1.00 0.33 H new ATOM 0 HG LEU A 72 -0.561 -2.566 -1.658 1.00 0.37 H new ATOM 0 HD11 LEU A 72 -1.426 -3.055 0.598 1.00 0.79 H new ATOM 0 HD12 LEU A 72 0.101 -3.912 0.279 1.00 0.79 H new ATOM 0 HD13 LEU A 72 0.094 -2.458 1.305 1.00 0.79 H new ATOM 0 HD21 LEU A 72 -1.870 -0.867 -0.448 1.00 0.88 H new ATOM 0 HD22 LEU A 72 -0.367 -0.194 0.225 1.00 0.88 H new ATOM 0 HD23 LEU A 72 -0.666 -0.125 -1.528 1.00 0.88 H new ATOM 1042 N ARG A 73 1.396 -4.567 -3.239 1.00 0.24 N ATOM 1043 CA ARG A 73 1.088 -4.934 -4.617 1.00 0.24 C ATOM 1044 C ARG A 73 -0.318 -5.484 -4.674 1.00 0.21 C ATOM 1045 O ARG A 73 -0.804 -5.988 -3.678 1.00 0.24 O ATOM 1046 CB ARG A 73 2.025 -6.028 -5.105 1.00 0.28 C ATOM 1047 CG ARG A 73 1.817 -7.348 -4.375 1.00 0.43 C ATOM 1048 CD ARG A 73 2.282 -8.522 -5.223 1.00 0.58 C ATOM 1049 NE ARG A 73 2.435 -9.740 -4.433 1.00 0.91 N ATOM 1050 CZ ARG A 73 2.517 -10.965 -4.944 1.00 1.04 C ATOM 1051 NH1 ARG A 73 2.454 -11.155 -6.257 1.00 1.27 N ATOM 1052 NH2 ARG A 73 2.671 -12.002 -4.132 1.00 1.67 N ATOM 0 H ARG A 73 1.102 -5.261 -2.552 1.00 0.24 H new ATOM 0 HA ARG A 73 1.198 -4.047 -5.241 1.00 0.24 H new ATOM 0 HB2 ARG A 73 1.874 -6.181 -6.174 1.00 0.28 H new ATOM 0 HB3 ARG A 73 3.057 -5.703 -4.973 1.00 0.28 H new ATOM 0 HG2 ARG A 73 2.365 -7.336 -3.433 1.00 0.43 H new ATOM 0 HG3 ARG A 73 0.762 -7.469 -4.129 1.00 0.43 H new ATOM 0 HD2 ARG A 73 1.564 -8.697 -6.024 1.00 0.58 H new ATOM 0 HD3 ARG A 73 3.233 -8.274 -5.695 1.00 0.58 H new ATOM 0 HE ARG A 73 2.482 -9.645 -3.419 1.00 0.91 H new ATOM 0 HH11 ARG A 73 2.342 -10.357 -6.883 1.00 1.27 H new ATOM 0 HH12 ARG A 73 2.518 -12.098 -6.639 1.00 1.27 H new ATOM 0 HH21 ARG A 73 2.726 -11.857 -3.124 1.00 1.67 H new ATOM 0 HH22 ARG A 73 2.735 -12.945 -4.516 1.00 1.67 H new ATOM 1066 N ILE A 74 -0.980 -5.396 -5.812 1.00 0.22 N ATOM 1067 CA ILE A 74 -2.188 -6.167 -5.998 1.00 0.24 C ATOM 1068 C ILE A 74 -1.808 -7.569 -6.458 1.00 0.27 C ATOM 1069 O ILE A 74 -1.040 -7.734 -7.395 1.00 0.30 O ATOM 1070 CB ILE A 74 -3.161 -5.514 -7.000 1.00 0.31 C ATOM 1071 CG1 ILE A 74 -2.481 -5.242 -8.345 1.00 1.14 C ATOM 1072 CG2 ILE A 74 -3.725 -4.230 -6.420 1.00 1.30 C ATOM 1073 CD1 ILE A 74 -3.418 -4.685 -9.396 1.00 1.81 C ATOM 0 H ILE A 74 -0.708 -4.812 -6.603 1.00 0.22 H new ATOM 0 HA ILE A 74 -2.714 -6.210 -5.044 1.00 0.24 H new ATOM 0 HB ILE A 74 -3.979 -6.212 -7.179 1.00 0.31 H new ATOM 0 HG12 ILE A 74 -1.661 -4.540 -8.193 1.00 1.14 H new ATOM 0 HG13 ILE A 74 -2.043 -6.169 -8.715 1.00 1.14 H new ATOM 0 HG21 ILE A 74 -4.411 -3.778 -7.136 1.00 1.30 H new ATOM 0 HG22 ILE A 74 -4.259 -4.452 -5.496 1.00 1.30 H new ATOM 0 HG23 ILE A 74 -2.910 -3.537 -6.210 1.00 1.30 H new ATOM 0 HD11 ILE A 74 -2.868 -4.517 -10.322 1.00 1.81 H new ATOM 0 HD12 ILE A 74 -4.225 -5.395 -9.577 1.00 1.81 H new ATOM 0 HD13 ILE A 74 -3.837 -3.741 -9.047 1.00 1.81 H new ATOM 1085 N SER A 75 -2.296 -8.569 -5.742 1.00 0.30 N ATOM 1086 CA SER A 75 -2.039 -9.974 -6.055 1.00 0.38 C ATOM 1087 C SER A 75 -2.314 -10.304 -7.524 1.00 0.44 C ATOM 1088 O SER A 75 -1.771 -11.270 -8.063 1.00 0.50 O ATOM 1089 CB SER A 75 -2.892 -10.865 -5.152 1.00 0.47 C ATOM 1090 OG SER A 75 -2.553 -10.676 -3.788 1.00 1.16 O ATOM 0 H SER A 75 -2.886 -8.433 -4.921 1.00 0.30 H new ATOM 0 HA SER A 75 -0.981 -10.162 -5.875 1.00 0.38 H new ATOM 0 HB2 SER A 75 -3.947 -10.638 -5.303 1.00 0.47 H new ATOM 0 HB3 SER A 75 -2.748 -11.910 -5.425 1.00 0.47 H new ATOM 0 HG SER A 75 -2.993 -11.362 -3.244 1.00 1.16 H new ATOM 1096 N LYS A 76 -3.171 -9.511 -8.156 1.00 0.45 N ATOM 1097 CA LYS A 76 -3.648 -9.810 -9.496 1.00 0.54 C ATOM 1098 C LYS A 76 -2.678 -9.351 -10.589 1.00 0.55 C ATOM 1099 O LYS A 76 -2.233 -10.140 -11.416 1.00 0.61 O ATOM 1100 CB LYS A 76 -4.970 -9.077 -9.683 1.00 0.60 C ATOM 1101 CG LYS A 76 -5.751 -9.511 -10.911 1.00 1.21 C ATOM 1102 CD LYS A 76 -6.164 -10.970 -10.808 1.00 1.70 C ATOM 1103 CE LYS A 76 -6.974 -11.416 -12.014 1.00 2.16 C ATOM 1104 NZ LYS A 76 -8.258 -10.676 -12.138 1.00 2.51 N ATOM 0 H LYS A 76 -3.550 -8.652 -7.757 1.00 0.45 H new ATOM 0 HA LYS A 76 -3.750 -10.891 -9.590 1.00 0.54 H new ATOM 0 HB2 LYS A 76 -5.588 -9.233 -8.799 1.00 0.60 H new ATOM 0 HB3 LYS A 76 -4.774 -8.007 -9.750 1.00 0.60 H new ATOM 0 HG2 LYS A 76 -6.637 -8.886 -11.022 1.00 1.21 H new ATOM 0 HG3 LYS A 76 -5.143 -9.364 -11.804 1.00 1.21 H new ATOM 0 HD2 LYS A 76 -5.275 -11.594 -10.717 1.00 1.70 H new ATOM 0 HD3 LYS A 76 -6.751 -11.118 -9.902 1.00 1.70 H new ATOM 0 HE2 LYS A 76 -6.384 -11.270 -12.919 1.00 2.16 H new ATOM 0 HE3 LYS A 76 -7.179 -12.484 -11.936 1.00 2.16 H new ATOM 0 HZ1 LYS A 76 -8.849 -11.125 -12.867 1.00 2.51 H new ATOM 0 HZ2 LYS A 76 -8.759 -10.694 -11.227 1.00 2.51 H new ATOM 0 HZ3 LYS A 76 -8.066 -9.690 -12.407 1.00 2.51 H new ATOM 1118 N THR A 77 -2.371 -8.069 -10.591 1.00 0.51 N ATOM 1119 CA THR A 77 -1.480 -7.479 -11.589 1.00 0.53 C ATOM 1120 C THR A 77 -0.200 -6.989 -10.912 1.00 0.47 C ATOM 1121 O THR A 77 -0.133 -6.966 -9.689 1.00 0.46 O ATOM 1122 CB THR A 77 -2.197 -6.324 -12.315 1.00 0.62 C ATOM 1123 OG1 THR A 77 -3.582 -6.664 -12.486 1.00 1.45 O ATOM 1124 CG2 THR A 77 -1.581 -6.065 -13.680 1.00 1.29 C ATOM 0 H THR A 77 -2.727 -7.403 -9.906 1.00 0.51 H new ATOM 0 HA THR A 77 -1.212 -8.233 -12.329 1.00 0.53 H new ATOM 0 HB THR A 77 -2.093 -5.422 -11.711 1.00 0.62 H new ATOM 0 HG1 THR A 77 -4.044 -5.932 -12.946 1.00 1.45 H new ATOM 0 HG21 THR A 77 -2.108 -5.245 -14.167 1.00 1.29 H new ATOM 0 HG22 THR A 77 -0.530 -5.801 -13.561 1.00 1.29 H new ATOM 0 HG23 THR A 77 -1.662 -6.963 -14.292 1.00 1.29 H new ATOM 1132 N GLN A 78 0.814 -6.574 -11.662 1.00 0.50 N ATOM 1133 CA GLN A 78 2.021 -6.110 -11.002 1.00 0.49 C ATOM 1134 C GLN A 78 2.040 -4.584 -10.972 1.00 0.46 C ATOM 1135 O GLN A 78 2.863 -3.909 -11.604 1.00 0.48 O ATOM 1136 CB GLN A 78 3.256 -6.666 -11.721 1.00 0.59 C ATOM 1137 CG GLN A 78 4.574 -6.358 -11.024 1.00 1.49 C ATOM 1138 CD GLN A 78 4.603 -6.820 -9.580 1.00 2.14 C ATOM 1139 OE1 GLN A 78 4.968 -7.956 -9.288 1.00 2.69 O ATOM 1140 NE2 GLN A 78 4.244 -5.931 -8.667 1.00 2.90 N ATOM 0 H GLN A 78 0.826 -6.549 -12.682 1.00 0.50 H new ATOM 0 HA GLN A 78 2.036 -6.471 -9.974 1.00 0.49 H new ATOM 0 HB2 GLN A 78 3.152 -7.747 -11.816 1.00 0.59 H new ATOM 0 HB3 GLN A 78 3.288 -6.259 -12.732 1.00 0.59 H new ATOM 0 HG2 GLN A 78 5.387 -6.837 -11.569 1.00 1.49 H new ATOM 0 HG3 GLN A 78 4.755 -5.284 -11.060 1.00 1.49 H new ATOM 0 HE21 GLN A 78 3.947 -4.998 -8.953 1.00 2.90 H new ATOM 0 HE22 GLN A 78 4.264 -6.179 -7.678 1.00 2.90 H new ATOM 1149 N LEU A 79 1.155 -4.071 -10.133 1.00 0.46 N ATOM 1150 CA LEU A 79 1.086 -2.658 -9.829 1.00 0.45 C ATOM 1151 C LEU A 79 1.796 -2.420 -8.518 1.00 0.42 C ATOM 1152 O LEU A 79 1.400 -2.965 -7.482 1.00 0.54 O ATOM 1153 CB LEU A 79 -0.369 -2.170 -9.746 1.00 0.59 C ATOM 1154 CG LEU A 79 -1.022 -1.763 -11.075 1.00 0.95 C ATOM 1155 CD1 LEU A 79 -1.032 -2.918 -12.063 1.00 1.95 C ATOM 1156 CD2 LEU A 79 -2.440 -1.269 -10.827 1.00 1.61 C ATOM 0 H LEU A 79 0.459 -4.632 -9.641 1.00 0.46 H new ATOM 0 HA LEU A 79 1.567 -2.095 -10.629 1.00 0.45 H new ATOM 0 HB2 LEU A 79 -0.971 -2.960 -9.296 1.00 0.59 H new ATOM 0 HB3 LEU A 79 -0.406 -1.316 -9.070 1.00 0.59 H new ATOM 0 HG LEU A 79 -0.431 -0.957 -11.510 1.00 0.95 H new ATOM 0 HD11 LEU A 79 -1.501 -2.597 -12.993 1.00 1.95 H new ATOM 0 HD12 LEU A 79 -0.008 -3.235 -12.263 1.00 1.95 H new ATOM 0 HD13 LEU A 79 -1.594 -3.752 -11.642 1.00 1.95 H new ATOM 0 HD21 LEU A 79 -2.896 -0.982 -11.774 1.00 1.61 H new ATOM 0 HD22 LEU A 79 -3.027 -2.064 -10.367 1.00 1.61 H new ATOM 0 HD23 LEU A 79 -2.414 -0.406 -10.161 1.00 1.61 H new ATOM 1168 N TYR A 80 2.852 -1.643 -8.564 1.00 0.34 N ATOM 1169 CA TYR A 80 3.657 -1.407 -7.401 1.00 0.38 C ATOM 1170 C TYR A 80 3.363 0.012 -6.938 1.00 0.34 C ATOM 1171 O TYR A 80 3.153 0.901 -7.752 1.00 0.45 O ATOM 1172 CB TYR A 80 5.113 -1.725 -7.822 1.00 0.60 C ATOM 1173 CG TYR A 80 6.251 -0.843 -7.345 1.00 1.27 C ATOM 1174 CD1 TYR A 80 6.162 0.534 -7.482 1.00 2.27 C ATOM 1175 CD2 TYR A 80 7.356 -1.362 -6.693 1.00 1.56 C ATOM 1176 CE1 TYR A 80 7.142 1.365 -6.988 1.00 3.30 C ATOM 1177 CE2 TYR A 80 8.346 -0.539 -6.208 1.00 2.49 C ATOM 1178 CZ TYR A 80 8.421 0.711 -6.596 1.00 3.33 C ATOM 1179 OH TYR A 80 9.205 1.644 -5.848 1.00 4.39 O ATOM 0 H TYR A 80 3.171 -1.162 -9.405 1.00 0.34 H new ATOM 0 HA TYR A 80 3.450 -2.034 -6.534 1.00 0.38 H new ATOM 0 HB2 TYR A 80 5.331 -2.741 -7.493 1.00 0.60 H new ATOM 0 HB3 TYR A 80 5.142 -1.730 -8.912 1.00 0.60 H new ATOM 0 HD1 TYR A 80 5.308 0.962 -7.986 1.00 2.27 H new ATOM 0 HD2 TYR A 80 7.443 -2.431 -6.563 1.00 1.56 H new ATOM 0 HE1 TYR A 80 6.992 2.430 -6.890 1.00 3.30 H new ATOM 0 HE2 TYR A 80 9.067 -0.925 -5.503 1.00 2.49 H new ATOM 0 HH TYR A 80 10.125 1.642 -6.185 1.00 4.39 H new ATOM 1189 N VAL A 81 3.313 0.222 -5.647 1.00 0.32 N ATOM 1190 CA VAL A 81 2.810 1.482 -5.118 1.00 0.32 C ATOM 1191 C VAL A 81 3.907 2.527 -5.026 1.00 0.32 C ATOM 1192 O VAL A 81 4.889 2.328 -4.335 1.00 0.36 O ATOM 1193 CB VAL A 81 2.156 1.287 -3.740 1.00 0.36 C ATOM 1194 CG1 VAL A 81 1.587 2.596 -3.221 1.00 0.46 C ATOM 1195 CG2 VAL A 81 1.069 0.229 -3.816 1.00 0.38 C ATOM 0 H VAL A 81 3.610 -0.452 -4.941 1.00 0.32 H new ATOM 0 HA VAL A 81 2.053 1.839 -5.816 1.00 0.32 H new ATOM 0 HB VAL A 81 2.923 0.950 -3.043 1.00 0.36 H new ATOM 0 HG11 VAL A 81 1.130 2.432 -2.245 1.00 0.46 H new ATOM 0 HG12 VAL A 81 2.388 3.329 -3.128 1.00 0.46 H new ATOM 0 HG13 VAL A 81 0.834 2.967 -3.917 1.00 0.46 H new ATOM 0 HG21 VAL A 81 0.615 0.102 -2.833 1.00 0.38 H new ATOM 0 HG22 VAL A 81 0.307 0.541 -4.530 1.00 0.38 H new ATOM 0 HG23 VAL A 81 1.504 -0.717 -4.140 1.00 0.38 H new ATOM 1205 N THR A 82 3.752 3.632 -5.739 1.00 0.32 N ATOM 1206 CA THR A 82 4.747 4.688 -5.687 1.00 0.32 C ATOM 1207 C THR A 82 4.287 5.788 -4.755 1.00 0.31 C ATOM 1208 O THR A 82 3.105 6.131 -4.679 1.00 0.32 O ATOM 1209 CB THR A 82 5.047 5.287 -7.082 1.00 0.32 C ATOM 1210 OG1 THR A 82 6.403 5.709 -7.184 1.00 1.22 O ATOM 1211 CG2 THR A 82 4.175 6.481 -7.388 1.00 1.37 C ATOM 0 H THR A 82 2.958 3.818 -6.352 1.00 0.32 H new ATOM 0 HA THR A 82 5.668 4.240 -5.315 1.00 0.32 H new ATOM 0 HB THR A 82 4.841 4.490 -7.796 1.00 0.32 H new ATOM 0 HG1 THR A 82 6.563 6.081 -8.076 1.00 1.22 H new ATOM 0 HG21 THR A 82 4.421 6.868 -8.377 1.00 1.37 H new ATOM 0 HG22 THR A 82 3.127 6.181 -7.366 1.00 1.37 H new ATOM 0 HG23 THR A 82 4.346 7.257 -6.642 1.00 1.37 H new ATOM 1219 N ALA A 83 5.229 6.298 -4.018 1.00 0.33 N ATOM 1220 CA ALA A 83 4.976 7.409 -3.122 1.00 0.32 C ATOM 1221 C ALA A 83 5.531 8.698 -3.710 1.00 0.27 C ATOM 1222 O ALA A 83 6.739 8.818 -3.916 1.00 0.31 O ATOM 1223 CB ALA A 83 5.576 7.126 -1.754 1.00 0.41 C ATOM 0 H ALA A 83 6.193 5.964 -4.014 1.00 0.33 H new ATOM 0 HA ALA A 83 3.900 7.531 -3.001 1.00 0.32 H new ATOM 0 HB1 ALA A 83 5.380 7.967 -1.089 1.00 0.41 H new ATOM 0 HB2 ALA A 83 5.127 6.224 -1.339 1.00 0.41 H new ATOM 0 HB3 ALA A 83 6.652 6.984 -1.851 1.00 0.41 H new ATOM 1229 N GLN A 84 4.654 9.654 -3.999 1.00 0.25 N ATOM 1230 CA GLN A 84 5.098 10.925 -4.548 1.00 0.26 C ATOM 1231 C GLN A 84 5.251 11.972 -3.438 1.00 0.25 C ATOM 1232 O GLN A 84 6.196 11.879 -2.670 1.00 0.28 O ATOM 1233 CB GLN A 84 4.279 11.396 -5.766 1.00 0.33 C ATOM 1234 CG GLN A 84 2.872 11.885 -5.501 1.00 0.77 C ATOM 1235 CD GLN A 84 2.342 12.648 -6.697 1.00 1.32 C ATOM 1236 OE1 GLN A 84 2.646 13.828 -6.872 1.00 2.05 O ATOM 1237 NE2 GLN A 84 1.516 12.006 -7.497 1.00 2.02 N ATOM 0 H GLN A 84 3.646 9.573 -3.864 1.00 0.25 H new ATOM 0 HA GLN A 84 6.092 10.771 -4.968 1.00 0.26 H new ATOM 0 HB2 GLN A 84 4.830 12.199 -6.255 1.00 0.33 H new ATOM 0 HB3 GLN A 84 4.223 10.571 -6.476 1.00 0.33 H new ATOM 0 HG2 GLN A 84 2.221 11.038 -5.285 1.00 0.77 H new ATOM 0 HG3 GLN A 84 2.863 12.527 -4.620 1.00 0.77 H new ATOM 0 HE21 GLN A 84 1.289 11.028 -7.318 1.00 2.02 H new ATOM 0 HE22 GLN A 84 1.103 12.487 -8.296 1.00 2.02 H new ATOM 1246 N ASP A 85 4.401 12.990 -3.358 1.00 0.24 N ATOM 1247 CA ASP A 85 4.565 13.986 -2.296 1.00 0.28 C ATOM 1248 C ASP A 85 3.232 14.501 -1.748 1.00 0.26 C ATOM 1249 O ASP A 85 2.503 15.219 -2.432 1.00 0.27 O ATOM 1250 CB ASP A 85 5.419 15.156 -2.787 1.00 0.34 C ATOM 1251 CG ASP A 85 5.581 16.238 -1.736 1.00 0.44 C ATOM 1252 OD1 ASP A 85 6.313 16.012 -0.744 1.00 0.53 O ATOM 1253 OD2 ASP A 85 4.987 17.327 -1.909 1.00 0.56 O ATOM 0 H ASP A 85 3.616 13.149 -3.990 1.00 0.24 H new ATOM 0 HA ASP A 85 5.073 13.482 -1.474 1.00 0.28 H new ATOM 0 HB2 ASP A 85 6.402 14.787 -3.078 1.00 0.34 H new ATOM 0 HB3 ASP A 85 4.963 15.586 -3.679 1.00 0.34 H new ATOM 1258 N GLU A 86 2.936 14.093 -0.508 1.00 0.27 N ATOM 1259 CA GLU A 86 1.814 14.617 0.288 1.00 0.29 C ATOM 1260 C GLU A 86 0.507 14.539 -0.507 1.00 0.22 C ATOM 1261 O GLU A 86 0.316 13.548 -1.189 1.00 0.19 O ATOM 1262 CB GLU A 86 2.204 16.020 0.769 1.00 0.40 C ATOM 1263 CG GLU A 86 1.146 16.829 1.516 1.00 0.51 C ATOM 1264 CD GLU A 86 1.076 16.519 2.992 1.00 0.78 C ATOM 1265 OE1 GLU A 86 2.138 16.289 3.603 1.00 1.04 O ATOM 1266 OE2 GLU A 86 -0.042 16.460 3.543 1.00 1.62 O ATOM 0 H GLU A 86 3.476 13.379 -0.020 1.00 0.27 H new ATOM 0 HA GLU A 86 1.620 14.013 1.175 1.00 0.29 H new ATOM 0 HB2 GLU A 86 3.074 15.923 1.419 1.00 0.40 H new ATOM 0 HB3 GLU A 86 2.518 16.598 -0.100 1.00 0.40 H new ATOM 0 HG2 GLU A 86 1.355 17.891 1.386 1.00 0.51 H new ATOM 0 HG3 GLU A 86 0.171 16.638 1.067 1.00 0.51 H new ATOM 1273 N ASP A 87 -0.368 15.552 -0.480 1.00 0.22 N ATOM 1274 CA ASP A 87 -1.645 15.443 -1.171 1.00 0.20 C ATOM 1275 C ASP A 87 -1.442 15.536 -2.664 1.00 0.23 C ATOM 1276 O ASP A 87 -1.718 16.551 -3.302 1.00 0.30 O ATOM 1277 CB ASP A 87 -2.659 16.490 -0.708 1.00 0.28 C ATOM 1278 CG ASP A 87 -4.041 16.229 -1.292 1.00 0.33 C ATOM 1279 OD1 ASP A 87 -4.725 15.298 -0.823 1.00 0.56 O ATOM 1280 OD2 ASP A 87 -4.457 16.948 -2.221 1.00 0.61 O ATOM 0 H ASP A 87 -0.214 16.437 0.004 1.00 0.22 H new ATOM 0 HA ASP A 87 -2.059 14.467 -0.919 1.00 0.20 H new ATOM 0 HB2 ASP A 87 -2.717 16.485 0.380 1.00 0.28 H new ATOM 0 HB3 ASP A 87 -2.319 17.482 -1.005 1.00 0.28 H new ATOM 1285 N GLN A 88 -0.957 14.439 -3.187 1.00 0.19 N ATOM 1286 CA GLN A 88 -0.846 14.198 -4.601 1.00 0.24 C ATOM 1287 C GLN A 88 -0.925 12.700 -4.750 1.00 0.21 C ATOM 1288 O GLN A 88 -0.171 11.979 -4.095 1.00 0.19 O ATOM 1289 CB GLN A 88 0.471 14.740 -5.163 1.00 0.32 C ATOM 1290 CG GLN A 88 0.562 16.259 -5.228 1.00 1.03 C ATOM 1291 CD GLN A 88 -0.492 16.882 -6.128 1.00 1.28 C ATOM 1292 OE1 GLN A 88 -0.940 16.276 -7.101 1.00 1.89 O ATOM 1293 NE2 GLN A 88 -0.889 18.104 -5.810 1.00 1.93 N ATOM 0 H GLN A 88 -0.617 13.663 -2.619 1.00 0.19 H new ATOM 0 HA GLN A 88 -1.633 14.707 -5.158 1.00 0.24 H new ATOM 0 HB2 GLN A 88 1.292 14.367 -4.550 1.00 0.32 H new ATOM 0 HB3 GLN A 88 0.614 14.338 -6.166 1.00 0.32 H new ATOM 0 HG2 GLN A 88 0.459 16.666 -4.222 1.00 1.03 H new ATOM 0 HG3 GLN A 88 1.551 16.543 -5.587 1.00 1.03 H new ATOM 0 HE21 GLN A 88 -0.493 18.573 -4.995 1.00 1.93 H new ATOM 0 HE22 GLN A 88 -1.591 18.577 -6.380 1.00 1.93 H new ATOM 1302 N PRO A 89 -1.840 12.203 -5.580 1.00 0.24 N ATOM 1303 CA PRO A 89 -2.274 10.814 -5.494 1.00 0.24 C ATOM 1304 C PRO A 89 -1.143 9.826 -5.703 1.00 0.21 C ATOM 1305 O PRO A 89 -0.187 10.082 -6.439 1.00 0.22 O ATOM 1306 CB PRO A 89 -3.306 10.687 -6.624 1.00 0.33 C ATOM 1307 CG PRO A 89 -3.722 12.085 -6.931 1.00 0.58 C ATOM 1308 CD PRO A 89 -2.521 12.939 -6.654 1.00 0.33 C ATOM 0 HA PRO A 89 -2.668 10.582 -4.505 1.00 0.24 H new ATOM 0 HB2 PRO A 89 -2.874 10.203 -7.500 1.00 0.33 H new ATOM 0 HB3 PRO A 89 -4.158 10.082 -6.314 1.00 0.33 H new ATOM 0 HG2 PRO A 89 -4.038 12.180 -7.970 1.00 0.58 H new ATOM 0 HG3 PRO A 89 -4.567 12.386 -6.312 1.00 0.58 H new ATOM 0 HD2 PRO A 89 -1.889 13.046 -7.535 1.00 0.33 H new ATOM 0 HD3 PRO A 89 -2.803 13.944 -6.340 1.00 0.33 H new ATOM 1316 N VAL A 90 -1.272 8.696 -5.035 1.00 0.23 N ATOM 1317 CA VAL A 90 -0.342 7.599 -5.183 1.00 0.24 C ATOM 1318 C VAL A 90 -0.358 7.108 -6.618 1.00 0.24 C ATOM 1319 O VAL A 90 -1.421 6.832 -7.174 1.00 0.28 O ATOM 1320 CB VAL A 90 -0.728 6.442 -4.245 1.00 0.36 C ATOM 1321 CG1 VAL A 90 0.145 5.229 -4.491 1.00 1.31 C ATOM 1322 CG2 VAL A 90 -0.643 6.884 -2.794 1.00 1.10 C ATOM 0 H VAL A 90 -2.027 8.515 -4.374 1.00 0.23 H new ATOM 0 HA VAL A 90 0.657 7.949 -4.924 1.00 0.24 H new ATOM 0 HB VAL A 90 -1.759 6.160 -4.459 1.00 0.36 H new ATOM 0 HG11 VAL A 90 -0.149 4.426 -3.815 1.00 1.31 H new ATOM 0 HG12 VAL A 90 0.025 4.897 -5.522 1.00 1.31 H new ATOM 0 HG13 VAL A 90 1.188 5.489 -4.313 1.00 1.31 H new ATOM 0 HG21 VAL A 90 -0.919 6.054 -2.144 1.00 1.10 H new ATOM 0 HG22 VAL A 90 0.376 7.198 -2.568 1.00 1.10 H new ATOM 0 HG23 VAL A 90 -1.325 7.718 -2.627 1.00 1.10 H new ATOM 1332 N LEU A 91 0.816 6.995 -7.224 1.00 0.22 N ATOM 1333 CA LEU A 91 0.884 6.691 -8.626 1.00 0.24 C ATOM 1334 C LEU A 91 1.148 5.215 -8.757 1.00 0.26 C ATOM 1335 O LEU A 91 1.883 4.640 -7.953 1.00 0.33 O ATOM 1336 CB LEU A 91 1.972 7.516 -9.318 1.00 0.30 C ATOM 1337 CG LEU A 91 1.917 9.026 -9.059 1.00 0.31 C ATOM 1338 CD1 LEU A 91 3.126 9.709 -9.677 1.00 0.42 C ATOM 1339 CD2 LEU A 91 0.631 9.610 -9.622 1.00 0.34 C ATOM 0 H LEU A 91 1.719 7.110 -6.763 1.00 0.22 H new ATOM 0 HA LEU A 91 -0.055 6.949 -9.115 1.00 0.24 H new ATOM 0 HB2 LEU A 91 2.945 7.145 -8.997 1.00 0.30 H new ATOM 0 HB3 LEU A 91 1.905 7.346 -10.393 1.00 0.30 H new ATOM 0 HG LEU A 91 1.933 9.198 -7.983 1.00 0.31 H new ATOM 0 HD11 LEU A 91 3.075 10.781 -9.486 1.00 0.42 H new ATOM 0 HD12 LEU A 91 4.037 9.305 -9.236 1.00 0.42 H new ATOM 0 HD13 LEU A 91 3.134 9.532 -10.752 1.00 0.42 H new ATOM 0 HD21 LEU A 91 0.605 10.683 -9.431 1.00 0.34 H new ATOM 0 HD22 LEU A 91 0.590 9.431 -10.696 1.00 0.34 H new ATOM 0 HD23 LEU A 91 -0.225 9.135 -9.142 1.00 0.34 H new ATOM 1351 N LEU A 92 0.552 4.580 -9.732 1.00 0.27 N ATOM 1352 CA LEU A 92 0.660 3.151 -9.809 1.00 0.28 C ATOM 1353 C LEU A 92 1.808 2.818 -10.726 1.00 0.29 C ATOM 1354 O LEU A 92 1.724 2.889 -11.954 1.00 0.31 O ATOM 1355 CB LEU A 92 -0.646 2.532 -10.296 1.00 0.32 C ATOM 1356 CG LEU A 92 -1.846 2.774 -9.378 1.00 0.76 C ATOM 1357 CD1 LEU A 92 -3.098 2.143 -9.955 1.00 1.15 C ATOM 1358 CD2 LEU A 92 -1.575 2.230 -7.984 1.00 1.30 C ATOM 0 H LEU A 92 -0.001 5.019 -10.468 1.00 0.27 H new ATOM 0 HA LEU A 92 0.852 2.734 -8.820 1.00 0.28 H new ATOM 0 HB2 LEU A 92 -0.875 2.930 -11.285 1.00 0.32 H new ATOM 0 HB3 LEU A 92 -0.503 1.457 -10.410 1.00 0.32 H new ATOM 0 HG LEU A 92 -2.004 3.850 -9.304 1.00 0.76 H new ATOM 0 HD11 LEU A 92 -3.939 2.327 -9.287 1.00 1.15 H new ATOM 0 HD12 LEU A 92 -3.308 2.579 -10.932 1.00 1.15 H new ATOM 0 HD13 LEU A 92 -2.948 1.069 -10.062 1.00 1.15 H new ATOM 0 HD21 LEU A 92 -2.441 2.413 -7.348 1.00 1.30 H new ATOM 0 HD22 LEU A 92 -1.387 1.158 -8.042 1.00 1.30 H new ATOM 0 HD23 LEU A 92 -0.703 2.729 -7.562 1.00 1.30 H new ATOM 1370 N LYS A 93 2.902 2.490 -10.064 1.00 0.31 N ATOM 1371 CA LYS A 93 4.187 2.315 -10.671 1.00 0.37 C ATOM 1372 C LYS A 93 4.334 0.848 -11.032 1.00 0.38 C ATOM 1373 O LYS A 93 4.312 -0.008 -10.160 1.00 0.39 O ATOM 1374 CB LYS A 93 5.245 2.748 -9.634 1.00 0.46 C ATOM 1375 CG LYS A 93 6.558 3.231 -10.198 1.00 1.29 C ATOM 1376 CD LYS A 93 7.153 2.318 -11.255 1.00 2.11 C ATOM 1377 CE LYS A 93 8.049 3.100 -12.204 1.00 2.85 C ATOM 1378 NZ LYS A 93 9.000 3.993 -11.484 1.00 3.26 N ATOM 0 H LYS A 93 2.909 2.335 -9.056 1.00 0.31 H new ATOM 0 HA LYS A 93 4.308 2.910 -11.576 1.00 0.37 H new ATOM 0 HB2 LYS A 93 4.821 3.542 -9.020 1.00 0.46 H new ATOM 0 HB3 LYS A 93 5.444 1.905 -8.972 1.00 0.46 H new ATOM 0 HG2 LYS A 93 6.413 4.222 -10.629 1.00 1.29 H new ATOM 0 HG3 LYS A 93 7.273 3.339 -9.383 1.00 1.29 H new ATOM 0 HD2 LYS A 93 7.728 1.526 -10.775 1.00 2.11 H new ATOM 0 HD3 LYS A 93 6.353 1.836 -11.817 1.00 2.11 H new ATOM 0 HE2 LYS A 93 8.610 2.403 -12.826 1.00 2.85 H new ATOM 0 HE3 LYS A 93 7.430 3.698 -12.873 1.00 2.85 H new ATOM 0 HZ1 LYS A 93 9.736 4.319 -12.142 1.00 3.26 H new ATOM 0 HZ2 LYS A 93 8.486 4.814 -11.105 1.00 3.26 H new ATOM 0 HZ3 LYS A 93 9.442 3.470 -10.701 1.00 3.26 H new ATOM 1392 N GLU A 94 4.486 0.540 -12.306 1.00 0.43 N ATOM 1393 CA GLU A 94 4.424 -0.842 -12.718 1.00 0.47 C ATOM 1394 C GLU A 94 5.844 -1.371 -12.759 1.00 0.52 C ATOM 1395 O GLU A 94 6.575 -1.230 -13.740 1.00 0.62 O ATOM 1396 CB GLU A 94 3.742 -0.902 -14.090 1.00 0.56 C ATOM 1397 CG GLU A 94 3.123 -2.245 -14.452 1.00 1.38 C ATOM 1398 CD GLU A 94 4.087 -3.206 -15.112 1.00 1.76 C ATOM 1399 OE1 GLU A 94 4.824 -2.781 -16.029 1.00 2.05 O ATOM 1400 OE2 GLU A 94 4.075 -4.402 -14.753 1.00 2.33 O ATOM 0 H GLU A 94 4.649 1.213 -13.055 1.00 0.43 H new ATOM 0 HA GLU A 94 3.845 -1.458 -12.030 1.00 0.47 H new ATOM 0 HB2 GLU A 94 2.963 -0.141 -14.123 1.00 0.56 H new ATOM 0 HB3 GLU A 94 4.475 -0.641 -14.853 1.00 0.56 H new ATOM 0 HG2 GLU A 94 2.727 -2.707 -13.548 1.00 1.38 H new ATOM 0 HG3 GLU A 94 2.279 -2.077 -15.120 1.00 1.38 H new ATOM 1407 N MET A 95 6.221 -1.948 -11.631 1.00 0.50 N ATOM 1408 CA MET A 95 7.573 -2.424 -11.396 1.00 0.59 C ATOM 1409 C MET A 95 7.532 -3.927 -11.150 1.00 0.66 C ATOM 1410 O MET A 95 6.874 -4.385 -10.216 1.00 0.65 O ATOM 1411 CB MET A 95 8.195 -1.653 -10.219 1.00 0.60 C ATOM 1412 CG MET A 95 9.712 -1.764 -10.115 1.00 1.21 C ATOM 1413 SD MET A 95 10.287 -3.390 -9.599 1.00 1.67 S ATOM 1414 CE MET A 95 12.058 -3.124 -9.603 1.00 2.39 C ATOM 0 H MET A 95 5.590 -2.101 -10.844 1.00 0.50 H new ATOM 0 HA MET A 95 8.203 -2.244 -12.267 1.00 0.59 H new ATOM 0 HB2 MET A 95 7.927 -0.600 -10.310 1.00 0.60 H new ATOM 0 HB3 MET A 95 7.753 -2.016 -9.291 1.00 0.60 H new ATOM 0 HG2 MET A 95 10.152 -1.523 -11.083 1.00 1.21 H new ATOM 0 HG3 MET A 95 10.074 -1.019 -9.406 1.00 1.21 H new ATOM 0 HE1 MET A 95 12.524 -3.763 -8.853 1.00 2.39 H new ATOM 0 HE2 MET A 95 12.460 -3.367 -10.587 1.00 2.39 H new ATOM 0 HE3 MET A 95 12.270 -2.080 -9.372 1.00 2.39 H new ATOM 1424 N PRO A 96 8.218 -4.707 -11.991 1.00 0.82 N ATOM 1425 CA PRO A 96 8.083 -6.168 -12.007 1.00 0.95 C ATOM 1426 C PRO A 96 8.701 -6.879 -10.801 1.00 0.93 C ATOM 1427 O PRO A 96 9.882 -6.699 -10.491 1.00 0.98 O ATOM 1428 CB PRO A 96 8.805 -6.559 -13.295 1.00 1.19 C ATOM 1429 CG PRO A 96 9.828 -5.497 -13.491 1.00 1.26 C ATOM 1430 CD PRO A 96 9.192 -4.230 -12.994 1.00 0.99 C ATOM 0 HA PRO A 96 7.035 -6.466 -11.959 1.00 0.95 H new ATOM 0 HB2 PRO A 96 9.267 -7.542 -13.207 1.00 1.19 H new ATOM 0 HB3 PRO A 96 8.115 -6.605 -14.138 1.00 1.19 H new ATOM 0 HG2 PRO A 96 10.739 -5.723 -12.936 1.00 1.26 H new ATOM 0 HG3 PRO A 96 10.107 -5.410 -14.541 1.00 1.26 H new ATOM 0 HD2 PRO A 96 9.927 -3.558 -12.552 1.00 0.99 H new ATOM 0 HD3 PRO A 96 8.703 -3.683 -13.800 1.00 0.99 H new ATOM 1438 N GLU A 97 7.876 -7.703 -10.152 1.00 0.98 N ATOM 1439 CA GLU A 97 8.288 -8.590 -9.069 1.00 1.06 C ATOM 1440 C GLU A 97 8.672 -7.867 -7.779 1.00 0.90 C ATOM 1441 O GLU A 97 9.351 -6.841 -7.775 1.00 0.88 O ATOM 1442 CB GLU A 97 9.413 -9.509 -9.526 1.00 1.32 C ATOM 1443 CG GLU A 97 8.922 -10.678 -10.362 1.00 1.84 C ATOM 1444 CD GLU A 97 7.864 -11.488 -9.641 1.00 2.42 C ATOM 1445 OE1 GLU A 97 8.214 -12.231 -8.695 1.00 3.15 O ATOM 1446 OE2 GLU A 97 6.679 -11.404 -10.026 1.00 2.74 O ATOM 0 H GLU A 97 6.882 -7.772 -10.371 1.00 0.98 H new ATOM 0 HA GLU A 97 7.408 -9.184 -8.823 1.00 1.06 H new ATOM 0 HB2 GLU A 97 10.133 -8.932 -10.106 1.00 1.32 H new ATOM 0 HB3 GLU A 97 9.941 -9.891 -8.652 1.00 1.32 H new ATOM 0 HG2 GLU A 97 8.515 -10.305 -11.302 1.00 1.84 H new ATOM 0 HG3 GLU A 97 9.764 -11.323 -10.613 1.00 1.84 H new ATOM 1453 N ILE A 98 8.217 -8.453 -6.678 1.00 1.08 N ATOM 1454 CA ILE A 98 8.466 -7.942 -5.339 1.00 1.17 C ATOM 1455 C ILE A 98 9.933 -8.141 -4.958 1.00 1.10 C ATOM 1456 O ILE A 98 10.458 -9.253 -5.045 1.00 1.29 O ATOM 1457 CB ILE A 98 7.559 -8.661 -4.319 1.00 1.61 C ATOM 1458 CG1 ILE A 98 6.101 -8.628 -4.787 1.00 2.25 C ATOM 1459 CG2 ILE A 98 7.691 -8.030 -2.948 1.00 2.35 C ATOM 1460 CD1 ILE A 98 5.590 -7.236 -5.100 1.00 3.20 C ATOM 0 H ILE A 98 7.658 -9.306 -6.692 1.00 1.08 H new ATOM 0 HA ILE A 98 8.240 -6.876 -5.328 1.00 1.17 H new ATOM 0 HB ILE A 98 7.878 -9.701 -4.248 1.00 1.61 H new ATOM 0 HG12 ILE A 98 6.001 -9.250 -5.676 1.00 2.25 H new ATOM 0 HG13 ILE A 98 5.471 -9.071 -4.015 1.00 2.25 H new ATOM 0 HG21 ILE A 98 7.043 -8.552 -2.243 1.00 2.35 H new ATOM 0 HG22 ILE A 98 8.725 -8.103 -2.612 1.00 2.35 H new ATOM 0 HG23 ILE A 98 7.399 -6.981 -3.001 1.00 2.35 H new ATOM 0 HD11 ILE A 98 4.551 -7.294 -5.425 1.00 3.20 H new ATOM 0 HD12 ILE A 98 5.657 -6.615 -4.207 1.00 3.20 H new ATOM 0 HD13 ILE A 98 6.194 -6.797 -5.894 1.00 3.20 H new ATOM 1472 N PRO A 99 10.614 -7.061 -4.547 1.00 1.08 N ATOM 1473 CA PRO A 99 12.061 -7.067 -4.317 1.00 1.14 C ATOM 1474 C PRO A 99 12.511 -7.828 -3.063 1.00 1.08 C ATOM 1475 O PRO A 99 11.857 -7.815 -2.028 1.00 1.15 O ATOM 1476 CB PRO A 99 12.416 -5.576 -4.175 1.00 1.38 C ATOM 1477 CG PRO A 99 11.189 -4.821 -4.568 1.00 1.61 C ATOM 1478 CD PRO A 99 10.034 -5.736 -4.297 1.00 1.28 C ATOM 0 HA PRO A 99 12.564 -7.584 -5.134 1.00 1.14 H new ATOM 0 HB2 PRO A 99 12.708 -5.340 -3.152 1.00 1.38 H new ATOM 0 HB3 PRO A 99 13.258 -5.313 -4.815 1.00 1.38 H new ATOM 0 HG2 PRO A 99 11.098 -3.899 -3.994 1.00 1.61 H new ATOM 0 HG3 PRO A 99 11.225 -4.540 -5.620 1.00 1.61 H new ATOM 0 HD2 PRO A 99 9.670 -5.639 -3.274 1.00 1.28 H new ATOM 0 HD3 PRO A 99 9.190 -5.531 -4.956 1.00 1.28 H new ATOM 1486 N LYS A 100 13.660 -8.473 -3.206 1.00 1.10 N ATOM 1487 CA LYS A 100 14.408 -9.110 -2.115 1.00 1.07 C ATOM 1488 C LYS A 100 15.609 -8.222 -1.789 1.00 1.03 C ATOM 1489 O LYS A 100 16.360 -8.428 -0.830 1.00 0.99 O ATOM 1490 CB LYS A 100 14.838 -10.530 -2.503 1.00 1.15 C ATOM 1491 CG LYS A 100 15.570 -10.624 -3.833 1.00 1.99 C ATOM 1492 CD LYS A 100 15.733 -12.074 -4.257 1.00 2.34 C ATOM 1493 CE LYS A 100 16.396 -12.202 -5.620 1.00 3.09 C ATOM 1494 NZ LYS A 100 17.825 -11.793 -5.594 1.00 3.70 N ATOM 0 H LYS A 100 14.118 -8.574 -4.112 1.00 1.10 H new ATOM 0 HA LYS A 100 13.779 -9.210 -1.230 1.00 1.07 H new ATOM 0 HB2 LYS A 100 15.482 -10.928 -1.719 1.00 1.15 H new ATOM 0 HB3 LYS A 100 13.954 -11.166 -2.543 1.00 1.15 H new ATOM 0 HG2 LYS A 100 15.018 -10.077 -4.597 1.00 1.99 H new ATOM 0 HG3 LYS A 100 16.549 -10.153 -3.749 1.00 1.99 H new ATOM 0 HD2 LYS A 100 16.329 -12.604 -3.514 1.00 2.34 H new ATOM 0 HD3 LYS A 100 14.755 -12.555 -4.284 1.00 2.34 H new ATOM 0 HE2 LYS A 100 16.322 -13.234 -5.962 1.00 3.09 H new ATOM 0 HE3 LYS A 100 15.858 -11.588 -6.342 1.00 3.09 H new ATOM 0 HZ1 LYS A 100 18.242 -11.930 -6.537 1.00 3.70 H new ATOM 0 HZ2 LYS A 100 17.894 -10.790 -5.327 1.00 3.70 H new ATOM 0 HZ3 LYS A 100 18.339 -12.373 -4.900 1.00 3.70 H new ATOM 1508 N THR A 101 15.784 -7.283 -2.693 1.00 1.10 N ATOM 1509 CA THR A 101 16.905 -6.398 -2.785 1.00 1.11 C ATOM 1510 C THR A 101 16.362 -4.983 -3.053 1.00 1.16 C ATOM 1511 O THR A 101 15.696 -4.769 -4.060 1.00 1.30 O ATOM 1512 CB THR A 101 17.849 -6.884 -3.920 1.00 1.30 C ATOM 1513 OG1 THR A 101 19.043 -6.099 -3.995 1.00 1.73 O ATOM 1514 CG2 THR A 101 17.159 -6.890 -5.280 1.00 1.92 C ATOM 0 H THR A 101 15.097 -7.113 -3.428 1.00 1.10 H new ATOM 0 HA THR A 101 17.485 -6.385 -1.863 1.00 1.11 H new ATOM 0 HB THR A 101 18.118 -7.909 -3.664 1.00 1.30 H new ATOM 0 HG1 THR A 101 18.817 -5.150 -3.898 1.00 1.73 H new ATOM 0 HG21 THR A 101 17.858 -7.237 -6.041 1.00 1.92 H new ATOM 0 HG22 THR A 101 16.297 -7.557 -5.248 1.00 1.92 H new ATOM 0 HG23 THR A 101 16.828 -5.881 -5.524 1.00 1.92 H new ATOM 1522 N ILE A 102 16.564 -4.021 -2.142 1.00 1.14 N ATOM 1523 CA ILE A 102 16.000 -2.696 -2.398 1.00 1.18 C ATOM 1524 C ILE A 102 17.073 -1.771 -2.898 1.00 1.22 C ATOM 1525 O ILE A 102 17.887 -1.283 -2.137 1.00 1.37 O ATOM 1526 CB ILE A 102 15.329 -2.066 -1.153 1.00 1.31 C ATOM 1527 CG1 ILE A 102 14.817 -0.657 -1.480 1.00 2.08 C ATOM 1528 CG2 ILE A 102 16.275 -2.039 0.047 1.00 1.98 C ATOM 1529 CD1 ILE A 102 14.079 0.006 -0.335 1.00 2.69 C ATOM 0 H ILE A 102 17.083 -4.126 -1.270 1.00 1.14 H new ATOM 0 HA ILE A 102 15.224 -2.832 -3.151 1.00 1.18 H new ATOM 0 HB ILE A 102 14.479 -2.691 -0.879 1.00 1.31 H new ATOM 0 HG12 ILE A 102 15.662 -0.031 -1.766 1.00 2.08 H new ATOM 0 HG13 ILE A 102 14.154 -0.713 -2.344 1.00 2.08 H new ATOM 0 HG21 ILE A 102 15.767 -1.590 0.901 1.00 1.98 H new ATOM 0 HG22 ILE A 102 16.574 -3.057 0.297 1.00 1.98 H new ATOM 0 HG23 ILE A 102 17.159 -1.451 -0.200 1.00 1.98 H new ATOM 0 HD11 ILE A 102 13.748 0.998 -0.642 1.00 2.69 H new ATOM 0 HD12 ILE A 102 13.213 -0.597 -0.062 1.00 2.69 H new ATOM 0 HD13 ILE A 102 14.744 0.095 0.524 1.00 2.69 H new ATOM 1541 N THR A 103 17.060 -1.478 -4.166 1.00 1.15 N ATOM 1542 CA THR A 103 18.133 -0.707 -4.705 1.00 1.20 C ATOM 1543 C THR A 103 17.581 0.479 -5.454 1.00 1.08 C ATOM 1544 O THR A 103 16.849 0.338 -6.423 1.00 1.05 O ATOM 1545 CB THR A 103 19.080 -1.565 -5.582 1.00 1.39 C ATOM 1546 OG1 THR A 103 20.266 -0.825 -5.877 1.00 1.58 O ATOM 1547 CG2 THR A 103 18.425 -2.025 -6.879 1.00 1.57 C ATOM 0 H THR A 103 16.336 -1.755 -4.829 1.00 1.15 H new ATOM 0 HA THR A 103 18.743 -0.337 -3.881 1.00 1.20 H new ATOM 0 HB THR A 103 19.325 -2.460 -5.010 1.00 1.39 H new ATOM 0 HG1 THR A 103 20.530 -0.988 -6.807 1.00 1.58 H new ATOM 0 HG21 THR A 103 19.134 -2.622 -7.453 1.00 1.57 H new ATOM 0 HG22 THR A 103 17.546 -2.628 -6.649 1.00 1.57 H new ATOM 0 HG23 THR A 103 18.126 -1.155 -7.464 1.00 1.57 H new ATOM 1555 N GLY A 104 18.045 1.640 -5.025 1.00 1.08 N ATOM 1556 CA GLY A 104 17.454 2.931 -5.393 1.00 1.03 C ATOM 1557 C GLY A 104 15.964 2.908 -5.766 1.00 0.92 C ATOM 1558 O GLY A 104 15.129 3.286 -4.954 1.00 0.84 O ATOM 0 H GLY A 104 18.851 1.722 -4.405 1.00 1.08 H new ATOM 0 HA2 GLY A 104 17.589 3.621 -4.560 1.00 1.03 H new ATOM 0 HA3 GLY A 104 18.013 3.337 -6.236 1.00 1.03 H new ATOM 1562 N SER A 105 15.642 2.476 -6.977 1.00 0.96 N ATOM 1563 CA SER A 105 14.337 2.704 -7.600 1.00 0.92 C ATOM 1564 C SER A 105 13.136 2.017 -6.919 1.00 0.81 C ATOM 1565 O SER A 105 12.003 2.436 -7.130 1.00 0.77 O ATOM 1566 CB SER A 105 14.418 2.275 -9.065 1.00 1.05 C ATOM 1567 OG SER A 105 15.190 1.089 -9.208 1.00 1.47 O ATOM 0 H SER A 105 16.286 1.949 -7.567 1.00 0.96 H new ATOM 0 HA SER A 105 14.137 3.770 -7.490 1.00 0.92 H new ATOM 0 HB2 SER A 105 13.414 2.108 -9.455 1.00 1.05 H new ATOM 0 HB3 SER A 105 14.861 3.075 -9.658 1.00 1.05 H new ATOM 0 HG SER A 105 14.689 0.327 -8.849 1.00 1.47 H new ATOM 1573 N GLU A 106 13.343 0.986 -6.115 1.00 0.79 N ATOM 1574 CA GLU A 106 12.216 0.272 -5.500 1.00 0.72 C ATOM 1575 C GLU A 106 11.694 1.029 -4.289 1.00 0.56 C ATOM 1576 O GLU A 106 10.809 0.562 -3.576 1.00 0.51 O ATOM 1577 CB GLU A 106 12.598 -1.159 -5.102 1.00 0.82 C ATOM 1578 CG GLU A 106 12.974 -2.055 -6.272 1.00 1.28 C ATOM 1579 CD GLU A 106 14.314 -1.700 -6.877 1.00 1.74 C ATOM 1580 OE1 GLU A 106 15.356 -2.078 -6.292 1.00 2.39 O ATOM 1581 OE2 GLU A 106 14.325 -1.064 -7.949 1.00 2.11 O ATOM 0 H GLU A 106 14.264 0.623 -5.870 1.00 0.79 H new ATOM 0 HA GLU A 106 11.426 0.212 -6.248 1.00 0.72 H new ATOM 0 HB2 GLU A 106 13.436 -1.119 -4.406 1.00 0.82 H new ATOM 0 HB3 GLU A 106 11.762 -1.610 -4.568 1.00 0.82 H new ATOM 0 HG2 GLU A 106 12.995 -3.092 -5.937 1.00 1.28 H new ATOM 0 HG3 GLU A 106 12.204 -1.984 -7.040 1.00 1.28 H new ATOM 1588 N THR A 107 12.241 2.206 -4.077 1.00 0.55 N ATOM 1589 CA THR A 107 11.954 2.991 -2.912 1.00 0.49 C ATOM 1590 C THR A 107 10.536 3.555 -2.940 1.00 0.37 C ATOM 1591 O THR A 107 10.082 4.105 -1.940 1.00 0.38 O ATOM 1592 CB THR A 107 12.963 4.152 -2.761 1.00 0.62 C ATOM 1593 OG1 THR A 107 12.787 4.800 -1.497 1.00 1.41 O ATOM 1594 CG2 THR A 107 12.801 5.175 -3.879 1.00 1.27 C ATOM 0 H THR A 107 12.903 2.643 -4.719 1.00 0.55 H new ATOM 0 HA THR A 107 12.043 2.322 -2.056 1.00 0.49 H new ATOM 0 HB THR A 107 13.966 3.728 -2.820 1.00 0.62 H new ATOM 0 HG1 THR A 107 11.831 4.861 -1.291 1.00 1.41 H new ATOM 0 HG21 THR A 107 13.525 5.979 -3.744 1.00 1.27 H new ATOM 0 HG22 THR A 107 12.970 4.692 -4.841 1.00 1.27 H new ATOM 0 HG23 THR A 107 11.792 5.587 -3.852 1.00 1.27 H new ATOM 1602 N ASN A 108 9.831 3.464 -4.072 1.00 0.34 N ATOM 1603 CA ASN A 108 8.526 4.027 -4.134 1.00 0.29 C ATOM 1604 C ASN A 108 7.553 3.215 -3.297 1.00 0.25 C ATOM 1605 O ASN A 108 6.689 3.777 -2.624 1.00 0.27 O ATOM 1606 CB ASN A 108 8.083 4.084 -5.591 1.00 0.40 C ATOM 1607 CG ASN A 108 9.066 4.846 -6.463 1.00 0.58 C ATOM 1608 OD1 ASN A 108 9.059 6.078 -6.504 1.00 1.39 O ATOM 1609 ND2 ASN A 108 9.899 4.123 -7.185 1.00 1.22 N ATOM 0 H ASN A 108 10.153 3.012 -4.928 1.00 0.34 H new ATOM 0 HA ASN A 108 8.542 5.037 -3.725 1.00 0.29 H new ATOM 0 HB2 ASN A 108 7.971 3.070 -5.974 1.00 0.40 H new ATOM 0 HB3 ASN A 108 7.103 4.558 -5.652 1.00 0.40 H new ATOM 0 HD21 ASN A 108 10.567 4.582 -7.804 1.00 1.22 H new ATOM 0 HD22 ASN A 108 9.875 3.105 -7.124 1.00 1.22 H new ATOM 1616 N LEU A 109 7.716 1.894 -3.309 1.00 0.25 N ATOM 1617 CA LEU A 109 6.814 1.020 -2.577 1.00 0.26 C ATOM 1618 C LEU A 109 7.305 0.671 -1.160 1.00 0.21 C ATOM 1619 O LEU A 109 7.069 -0.431 -0.671 1.00 0.23 O ATOM 1620 CB LEU A 109 6.460 -0.226 -3.431 1.00 0.41 C ATOM 1621 CG LEU A 109 7.039 -1.588 -3.023 1.00 0.54 C ATOM 1622 CD1 LEU A 109 6.427 -2.679 -3.882 1.00 0.83 C ATOM 1623 CD2 LEU A 109 8.559 -1.608 -3.146 1.00 0.95 C ATOM 0 H LEU A 109 8.459 1.412 -3.814 1.00 0.25 H new ATOM 0 HA LEU A 109 5.892 1.575 -2.404 1.00 0.26 H new ATOM 0 HB2 LEU A 109 5.374 -0.319 -3.445 1.00 0.41 H new ATOM 0 HB3 LEU A 109 6.776 -0.026 -4.455 1.00 0.41 H new ATOM 0 HG LEU A 109 6.791 -1.766 -1.977 1.00 0.54 H new ATOM 0 HD11 LEU A 109 6.839 -3.645 -3.591 1.00 0.83 H new ATOM 0 HD12 LEU A 109 5.346 -2.689 -3.742 1.00 0.83 H new ATOM 0 HD13 LEU A 109 6.656 -2.488 -4.930 1.00 0.83 H new ATOM 0 HD21 LEU A 109 8.935 -2.587 -2.849 1.00 0.95 H new ATOM 0 HD22 LEU A 109 8.843 -1.408 -4.179 1.00 0.95 H new ATOM 0 HD23 LEU A 109 8.987 -0.843 -2.498 1.00 0.95 H new ATOM 1635 N LEU A 110 7.923 1.596 -0.441 1.00 0.20 N ATOM 1636 CA LEU A 110 8.234 1.276 0.930 1.00 0.21 C ATOM 1637 C LEU A 110 7.187 1.890 1.841 1.00 0.23 C ATOM 1638 O LEU A 110 6.761 3.030 1.650 1.00 0.31 O ATOM 1639 CB LEU A 110 9.663 1.701 1.314 1.00 0.28 C ATOM 1640 CG LEU A 110 10.205 3.002 0.710 1.00 0.81 C ATOM 1641 CD1 LEU A 110 9.436 4.215 1.206 1.00 1.71 C ATOM 1642 CD2 LEU A 110 11.678 3.146 1.046 1.00 1.64 C ATOM 0 H LEU A 110 8.203 2.522 -0.765 1.00 0.20 H new ATOM 0 HA LEU A 110 8.207 0.193 1.051 1.00 0.21 H new ATOM 0 HB2 LEU A 110 9.706 1.791 2.399 1.00 0.28 H new ATOM 0 HB3 LEU A 110 10.340 0.894 1.034 1.00 0.28 H new ATOM 0 HG LEU A 110 10.078 2.951 -0.371 1.00 0.81 H new ATOM 0 HD11 LEU A 110 9.850 5.117 0.756 1.00 1.71 H new ATOM 0 HD12 LEU A 110 8.386 4.119 0.928 1.00 1.71 H new ATOM 0 HD13 LEU A 110 9.519 4.280 2.291 1.00 1.71 H new ATOM 0 HD21 LEU A 110 12.061 4.071 0.616 1.00 1.64 H new ATOM 0 HD22 LEU A 110 11.804 3.170 2.128 1.00 1.64 H new ATOM 0 HD23 LEU A 110 12.229 2.300 0.636 1.00 1.64 H new ATOM 1654 N PHE A 111 6.786 1.129 2.843 1.00 0.22 N ATOM 1655 CA PHE A 111 5.630 1.489 3.651 1.00 0.25 C ATOM 1656 C PHE A 111 5.849 1.171 5.109 1.00 0.23 C ATOM 1657 O PHE A 111 6.172 0.042 5.470 1.00 0.27 O ATOM 1658 CB PHE A 111 4.373 0.772 3.154 1.00 0.42 C ATOM 1659 CG PHE A 111 4.099 1.013 1.706 1.00 0.91 C ATOM 1660 CD1 PHE A 111 3.814 2.286 1.247 1.00 1.64 C ATOM 1661 CD2 PHE A 111 4.152 -0.028 0.800 1.00 1.18 C ATOM 1662 CE1 PHE A 111 3.590 2.515 -0.090 1.00 2.38 C ATOM 1663 CE2 PHE A 111 3.923 0.195 -0.539 1.00 1.90 C ATOM 1664 CZ PHE A 111 3.644 1.468 -0.983 1.00 2.46 C ATOM 0 H PHE A 111 7.241 0.259 3.118 1.00 0.22 H new ATOM 0 HA PHE A 111 5.493 2.566 3.550 1.00 0.25 H new ATOM 0 HB2 PHE A 111 4.481 -0.299 3.325 1.00 0.42 H new ATOM 0 HB3 PHE A 111 3.516 1.104 3.741 1.00 0.42 H new ATOM 0 HD1 PHE A 111 3.767 3.108 1.946 1.00 1.64 H new ATOM 0 HD2 PHE A 111 4.375 -1.027 1.145 1.00 1.18 H new ATOM 0 HE1 PHE A 111 3.372 3.514 -0.439 1.00 2.38 H new ATOM 0 HE2 PHE A 111 3.962 -0.626 -1.239 1.00 1.90 H new ATOM 0 HZ PHE A 111 3.467 1.646 -2.033 1.00 2.46 H new ATOM 1674 N PHE A 112 5.687 2.186 5.931 1.00 0.21 N ATOM 1675 CA PHE A 112 5.839 2.043 7.372 1.00 0.25 C ATOM 1676 C PHE A 112 4.534 1.549 7.944 1.00 0.25 C ATOM 1677 O PHE A 112 3.553 2.291 8.008 1.00 0.26 O ATOM 1678 CB PHE A 112 6.246 3.359 8.041 1.00 0.30 C ATOM 1679 CG PHE A 112 6.310 3.286 9.545 1.00 0.57 C ATOM 1680 CD1 PHE A 112 6.745 2.133 10.171 1.00 0.79 C ATOM 1681 CD2 PHE A 112 5.923 4.365 10.330 1.00 0.95 C ATOM 1682 CE1 PHE A 112 6.799 2.053 11.549 1.00 1.21 C ATOM 1683 CE2 PHE A 112 5.974 4.290 11.707 1.00 1.43 C ATOM 1684 CZ PHE A 112 6.445 3.171 12.319 1.00 1.50 C ATOM 0 H PHE A 112 5.448 3.130 5.627 1.00 0.21 H new ATOM 0 HA PHE A 112 6.638 1.328 7.569 1.00 0.25 H new ATOM 0 HB2 PHE A 112 7.221 3.662 7.660 1.00 0.30 H new ATOM 0 HB3 PHE A 112 5.536 4.135 7.755 1.00 0.30 H new ATOM 0 HD1 PHE A 112 7.046 1.284 9.575 1.00 0.79 H new ATOM 0 HD2 PHE A 112 5.578 5.273 9.857 1.00 0.95 H new ATOM 0 HE1 PHE A 112 7.111 1.138 12.030 1.00 1.21 H new ATOM 0 HE2 PHE A 112 5.638 5.126 12.303 1.00 1.43 H new ATOM 0 HZ PHE A 112 6.546 3.143 13.394 1.00 1.50 H new ATOM 1694 N TRP A 113 4.521 0.293 8.345 1.00 0.31 N ATOM 1695 CA TRP A 113 3.259 -0.360 8.672 1.00 0.35 C ATOM 1696 C TRP A 113 2.929 -0.218 10.157 1.00 0.33 C ATOM 1697 O TRP A 113 3.567 -0.802 11.035 1.00 0.37 O ATOM 1698 CB TRP A 113 3.281 -1.840 8.247 1.00 0.48 C ATOM 1699 CG TRP A 113 4.364 -2.667 8.884 1.00 1.08 C ATOM 1700 CD1 TRP A 113 5.713 -2.516 8.734 1.00 2.30 C ATOM 1701 CD2 TRP A 113 4.182 -3.791 9.757 1.00 1.17 C ATOM 1702 NE1 TRP A 113 6.378 -3.469 9.465 1.00 3.02 N ATOM 1703 CE2 TRP A 113 5.462 -4.262 10.102 1.00 2.29 C ATOM 1704 CE3 TRP A 113 3.065 -4.442 10.284 1.00 1.12 C ATOM 1705 CZ2 TRP A 113 5.656 -5.351 10.948 1.00 2.67 C ATOM 1706 CZ3 TRP A 113 3.255 -5.524 11.124 1.00 1.47 C ATOM 1707 CH2 TRP A 113 4.543 -5.969 11.449 1.00 2.02 C ATOM 0 H TRP A 113 5.351 -0.291 8.452 1.00 0.31 H new ATOM 0 HA TRP A 113 2.469 0.140 8.111 1.00 0.35 H new ATOM 0 HB2 TRP A 113 2.316 -2.286 8.486 1.00 0.48 H new ATOM 0 HB3 TRP A 113 3.395 -1.890 7.164 1.00 0.48 H new ATOM 0 HD1 TRP A 113 6.187 -1.758 8.129 1.00 2.30 H new ATOM 0 HE1 TRP A 113 7.391 -3.570 9.524 1.00 3.02 H new ATOM 0 HE3 TRP A 113 2.068 -4.106 10.039 1.00 1.12 H new ATOM 0 HZ2 TRP A 113 6.648 -5.695 11.199 1.00 2.67 H new ATOM 0 HZ3 TRP A 113 2.397 -6.034 11.536 1.00 1.47 H new ATOM 0 HH2 TRP A 113 4.660 -6.817 12.108 1.00 2.02 H new ATOM 1718 N GLU A 114 1.929 0.613 10.404 1.00 0.32 N ATOM 1719 CA GLU A 114 1.446 0.916 11.741 1.00 0.37 C ATOM 1720 C GLU A 114 0.129 0.197 12.007 1.00 0.39 C ATOM 1721 O GLU A 114 -0.889 0.518 11.394 1.00 0.42 O ATOM 1722 CB GLU A 114 1.271 2.426 11.902 1.00 0.43 C ATOM 1723 CG GLU A 114 2.572 3.194 11.752 1.00 0.96 C ATOM 1724 CD GLU A 114 2.390 4.690 11.888 1.00 1.50 C ATOM 1725 OE1 GLU A 114 1.897 5.137 12.946 1.00 2.32 O ATOM 1726 OE2 GLU A 114 2.737 5.428 10.942 1.00 1.90 O ATOM 0 H GLU A 114 1.422 1.104 9.668 1.00 0.32 H new ATOM 0 HA GLU A 114 2.180 0.567 12.467 1.00 0.37 H new ATOM 0 HB2 GLU A 114 0.557 2.784 11.161 1.00 0.43 H new ATOM 0 HB3 GLU A 114 0.844 2.634 12.883 1.00 0.43 H new ATOM 0 HG2 GLU A 114 3.281 2.849 12.505 1.00 0.96 H new ATOM 0 HG3 GLU A 114 3.009 2.973 10.778 1.00 0.96 H new ATOM 1733 N THR A 115 0.143 -0.771 12.910 1.00 0.47 N ATOM 1734 CA THR A 115 -1.036 -1.589 13.152 1.00 0.49 C ATOM 1735 C THR A 115 -1.805 -1.083 14.371 1.00 0.52 C ATOM 1736 O THR A 115 -1.258 -0.999 15.473 1.00 0.64 O ATOM 1737 CB THR A 115 -0.634 -3.067 13.389 1.00 0.67 C ATOM 1738 OG1 THR A 115 0.204 -3.177 14.550 1.00 1.38 O ATOM 1739 CG2 THR A 115 0.115 -3.627 12.191 1.00 1.39 C ATOM 0 H THR A 115 0.952 -1.009 13.484 1.00 0.47 H new ATOM 0 HA THR A 115 -1.673 -1.521 12.270 1.00 0.49 H new ATOM 0 HB THR A 115 -1.551 -3.638 13.538 1.00 0.67 H new ATOM 0 HG1 THR A 115 -0.049 -2.491 15.202 1.00 1.38 H new ATOM 0 HG21 THR A 115 0.385 -4.665 12.384 1.00 1.39 H new ATOM 0 HG22 THR A 115 -0.521 -3.576 11.308 1.00 1.39 H new ATOM 0 HG23 THR A 115 1.019 -3.042 12.021 1.00 1.39 H new ATOM 1747 N HIS A 116 -3.065 -0.700 14.166 1.00 0.47 N ATOM 1748 CA HIS A 116 -3.922 -0.311 15.279 1.00 0.56 C ATOM 1749 C HIS A 116 -5.307 -0.955 15.144 1.00 0.56 C ATOM 1750 O HIS A 116 -6.182 -0.429 14.458 1.00 0.55 O ATOM 1751 CB HIS A 116 -4.042 1.218 15.338 1.00 0.66 C ATOM 1752 CG HIS A 116 -4.498 1.744 16.668 1.00 1.29 C ATOM 1753 ND1 HIS A 116 -5.446 2.735 16.808 1.00 1.88 N ATOM 1754 CD2 HIS A 116 -4.101 1.431 17.924 1.00 2.27 C ATOM 1755 CE1 HIS A 116 -5.611 3.006 18.090 1.00 2.63 C ATOM 1756 NE2 HIS A 116 -4.806 2.229 18.789 1.00 2.89 N ATOM 0 H HIS A 116 -3.509 -0.652 13.249 1.00 0.47 H new ATOM 0 HA HIS A 116 -3.473 -0.664 16.207 1.00 0.56 H new ATOM 0 HB2 HIS A 116 -3.074 1.658 15.098 1.00 0.66 H new ATOM 0 HB3 HIS A 116 -4.741 1.547 14.570 1.00 0.66 H new ATOM 0 HD2 HIS A 116 -3.364 0.689 18.195 1.00 2.27 H new ATOM 0 HE1 HIS A 116 -6.290 3.740 18.497 1.00 2.63 H new ATOM 0 HE2 HIS A 116 -4.722 2.223 19.805 1.00 2.89 H new ATOM 1765 N GLY A 117 -5.499 -2.072 15.828 1.00 0.64 N ATOM 1766 CA GLY A 117 -6.787 -2.750 15.826 1.00 0.71 C ATOM 1767 C GLY A 117 -7.083 -3.477 14.521 1.00 0.69 C ATOM 1768 O GLY A 117 -6.484 -4.513 14.228 1.00 0.74 O ATOM 0 H GLY A 117 -4.781 -2.528 16.391 1.00 0.64 H new ATOM 0 HA2 GLY A 117 -6.814 -3.466 16.647 1.00 0.71 H new ATOM 0 HA3 GLY A 117 -7.574 -2.020 16.014 1.00 0.71 H new ATOM 1772 N THR A 118 -7.996 -2.923 13.731 1.00 0.66 N ATOM 1773 CA THR A 118 -8.383 -3.523 12.458 1.00 0.69 C ATOM 1774 C THR A 118 -7.770 -2.746 11.295 1.00 0.56 C ATOM 1775 O THR A 118 -7.181 -3.324 10.383 1.00 0.57 O ATOM 1776 CB THR A 118 -9.921 -3.558 12.300 1.00 0.81 C ATOM 1777 OG1 THR A 118 -10.525 -4.109 13.480 1.00 1.60 O ATOM 1778 CG2 THR A 118 -10.325 -4.393 11.094 1.00 1.39 C ATOM 0 H THR A 118 -8.484 -2.055 13.951 1.00 0.66 H new ATOM 0 HA THR A 118 -8.009 -4.547 12.448 1.00 0.69 H new ATOM 0 HB THR A 118 -10.267 -2.535 12.152 1.00 0.81 H new ATOM 0 HG1 THR A 118 -11.499 -4.126 13.372 1.00 1.60 H new ATOM 0 HG21 THR A 118 -11.411 -4.402 11.005 1.00 1.39 H new ATOM 0 HG22 THR A 118 -9.890 -3.963 10.192 1.00 1.39 H new ATOM 0 HG23 THR A 118 -9.963 -5.413 11.220 1.00 1.39 H new ATOM 1786 N LYS A 119 -7.906 -1.427 11.351 1.00 0.50 N ATOM 1787 CA LYS A 119 -7.308 -0.538 10.362 1.00 0.41 C ATOM 1788 C LYS A 119 -5.814 -0.375 10.696 1.00 0.35 C ATOM 1789 O LYS A 119 -5.400 -0.575 11.836 1.00 0.40 O ATOM 1790 CB LYS A 119 -8.029 0.810 10.397 1.00 0.46 C ATOM 1791 CG LYS A 119 -7.961 1.524 11.734 1.00 0.98 C ATOM 1792 CD LYS A 119 -9.077 2.549 11.854 1.00 1.36 C ATOM 1793 CE LYS A 119 -8.773 3.599 12.904 1.00 1.79 C ATOM 1794 NZ LYS A 119 -7.623 4.452 12.509 1.00 2.49 N ATOM 0 H LYS A 119 -8.432 -0.945 12.080 1.00 0.50 H new ATOM 0 HA LYS A 119 -7.405 -0.951 9.358 1.00 0.41 H new ATOM 0 HB2 LYS A 119 -7.601 1.457 9.631 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -9.076 0.655 10.135 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -8.039 0.798 12.544 1.00 0.98 H new ATOM 0 HG3 LYS A 119 -6.995 2.017 11.840 1.00 0.98 H new ATOM 0 HD2 LYS A 119 -9.229 3.034 10.890 1.00 1.36 H new ATOM 0 HD3 LYS A 119 -10.009 2.043 12.107 1.00 1.36 H new ATOM 0 HE2 LYS A 119 -9.653 4.223 13.060 1.00 1.79 H new ATOM 0 HE3 LYS A 119 -8.555 3.111 13.854 1.00 1.79 H new ATOM 0 HZ1 LYS A 119 -6.772 4.148 13.025 1.00 2.49 H new ATOM 0 HZ2 LYS A 119 -7.459 4.361 11.486 1.00 2.49 H new ATOM 0 HZ3 LYS A 119 -7.832 5.444 12.739 1.00 2.49 H new ATOM 1808 N ASN A 120 -5.036 0.020 9.713 1.00 0.30 N ATOM 1809 CA ASN A 120 -3.578 0.076 9.774 1.00 0.28 C ATOM 1810 C ASN A 120 -3.113 1.204 8.858 1.00 0.28 C ATOM 1811 O ASN A 120 -3.802 1.536 7.895 1.00 0.32 O ATOM 1812 CB ASN A 120 -2.956 -1.232 9.251 1.00 0.36 C ATOM 1813 CG ASN A 120 -2.841 -2.377 10.254 1.00 1.26 C ATOM 1814 OD1 ASN A 120 -1.963 -3.220 10.121 1.00 2.08 O ATOM 1815 ND2 ASN A 120 -3.708 -2.437 11.248 1.00 2.07 N ATOM 0 H ASN A 120 -5.407 0.324 8.813 1.00 0.30 H new ATOM 0 HA ASN A 120 -3.273 0.232 10.809 1.00 0.28 H new ATOM 0 HB2 ASN A 120 -3.549 -1.578 8.404 1.00 0.36 H new ATOM 0 HB3 ASN A 120 -1.959 -1.008 8.872 1.00 0.36 H new ATOM 0 HD21 ASN A 120 -3.655 -3.197 11.926 1.00 2.07 H new ATOM 0 HD22 ASN A 120 -4.431 -1.723 11.338 1.00 2.07 H new ATOM 1822 N TYR A 121 -1.965 1.791 9.155 1.00 0.31 N ATOM 1823 CA TYR A 121 -1.447 2.904 8.360 1.00 0.37 C ATOM 1824 C TYR A 121 -0.189 2.502 7.591 1.00 0.30 C ATOM 1825 O TYR A 121 0.478 1.535 7.964 1.00 0.34 O ATOM 1826 CB TYR A 121 -1.131 4.084 9.281 1.00 0.66 C ATOM 1827 CG TYR A 121 -2.353 4.687 9.937 1.00 1.06 C ATOM 1828 CD1 TYR A 121 -2.880 4.156 11.106 1.00 1.46 C ATOM 1829 CD2 TYR A 121 -2.978 5.788 9.378 1.00 1.41 C ATOM 1830 CE1 TYR A 121 -3.999 4.710 11.695 1.00 1.98 C ATOM 1831 CE2 TYR A 121 -4.095 6.348 9.958 1.00 2.01 C ATOM 1832 CZ TYR A 121 -4.602 5.806 11.115 1.00 2.23 C ATOM 1833 OH TYR A 121 -5.719 6.363 11.693 1.00 2.84 O ATOM 0 H TYR A 121 -1.371 1.519 9.939 1.00 0.31 H new ATOM 0 HA TYR A 121 -2.209 3.189 7.635 1.00 0.37 H new ATOM 0 HB2 TYR A 121 -0.439 3.754 10.056 1.00 0.66 H new ATOM 0 HB3 TYR A 121 -0.620 4.856 8.706 1.00 0.66 H new ATOM 0 HD1 TYR A 121 -2.408 3.298 11.561 1.00 1.46 H new ATOM 0 HD2 TYR A 121 -2.582 6.217 8.469 1.00 1.41 H new ATOM 0 HE1 TYR A 121 -4.400 4.287 12.605 1.00 1.98 H new ATOM 0 HE2 TYR A 121 -4.569 7.207 9.507 1.00 2.01 H new ATOM 0 HH TYR A 121 -6.476 6.295 11.074 1.00 2.84 H new ATOM 1843 N PHE A 122 0.144 3.247 6.526 1.00 0.30 N ATOM 1844 CA PHE A 122 1.409 3.068 5.836 1.00 0.29 C ATOM 1845 C PHE A 122 2.067 4.419 5.616 1.00 0.26 C ATOM 1846 O PHE A 122 1.743 5.117 4.663 1.00 0.32 O ATOM 1847 CB PHE A 122 1.219 2.395 4.473 1.00 0.34 C ATOM 1848 CG PHE A 122 0.666 1.002 4.532 1.00 1.05 C ATOM 1849 CD1 PHE A 122 1.361 -0.005 5.184 1.00 1.45 C ATOM 1850 CD2 PHE A 122 -0.557 0.705 3.957 1.00 1.56 C ATOM 1851 CE1 PHE A 122 0.845 -1.283 5.256 1.00 2.18 C ATOM 1852 CE2 PHE A 122 -1.079 -0.571 4.028 1.00 2.27 C ATOM 1853 CZ PHE A 122 -0.334 -1.586 4.602 1.00 2.54 C ATOM 0 H PHE A 122 -0.451 3.976 6.132 1.00 0.30 H new ATOM 0 HA PHE A 122 2.035 2.429 6.459 1.00 0.29 H new ATOM 0 HB2 PHE A 122 0.552 3.010 3.869 1.00 0.34 H new ATOM 0 HB3 PHE A 122 2.180 2.368 3.959 1.00 0.34 H new ATOM 0 HD1 PHE A 122 2.315 0.213 5.640 1.00 1.45 H new ATOM 0 HD2 PHE A 122 -1.109 1.480 3.447 1.00 1.56 H new ATOM 0 HE1 PHE A 122 1.361 -2.044 5.822 1.00 2.18 H new ATOM 0 HE2 PHE A 122 -2.065 -0.776 3.637 1.00 2.27 H new ATOM 0 HZ PHE A 122 -0.672 -2.610 4.539 1.00 2.54 H new ATOM 1863 N THR A 123 3.014 4.769 6.461 1.00 0.22 N ATOM 1864 CA THR A 123 3.724 6.015 6.317 1.00 0.22 C ATOM 1865 C THR A 123 4.920 5.753 5.431 1.00 0.20 C ATOM 1866 O THR A 123 5.569 4.728 5.571 1.00 0.19 O ATOM 1867 CB THR A 123 4.195 6.525 7.698 1.00 0.24 C ATOM 1868 OG1 THR A 123 3.068 6.696 8.569 1.00 0.32 O ATOM 1869 CG2 THR A 123 4.937 7.845 7.574 1.00 0.33 C ATOM 0 H THR A 123 3.308 4.203 7.257 1.00 0.22 H new ATOM 0 HA THR A 123 3.076 6.775 5.880 1.00 0.22 H new ATOM 0 HB THR A 123 4.875 5.782 8.114 1.00 0.24 H new ATOM 0 HG1 THR A 123 3.155 6.095 9.338 1.00 0.32 H new ATOM 0 HG21 THR A 123 5.255 8.178 8.562 1.00 0.33 H new ATOM 0 HG22 THR A 123 5.811 7.713 6.937 1.00 0.33 H new ATOM 0 HG23 THR A 123 4.277 8.593 7.134 1.00 0.33 H new ATOM 1877 N SER A 124 5.210 6.628 4.494 1.00 0.21 N ATOM 1878 CA SER A 124 6.288 6.337 3.587 1.00 0.23 C ATOM 1879 C SER A 124 7.586 6.448 4.354 1.00 0.29 C ATOM 1880 O SER A 124 7.862 7.454 5.005 1.00 0.34 O ATOM 1881 CB SER A 124 6.278 7.270 2.379 1.00 0.26 C ATOM 1882 OG SER A 124 7.296 6.923 1.455 1.00 1.17 O ATOM 0 H SER A 124 4.731 7.516 4.345 1.00 0.21 H new ATOM 0 HA SER A 124 6.171 5.328 3.193 1.00 0.23 H new ATOM 0 HB2 SER A 124 5.306 7.223 1.888 1.00 0.26 H new ATOM 0 HB3 SER A 124 6.419 8.299 2.710 1.00 0.26 H new ATOM 0 HG SER A 124 7.266 7.535 0.690 1.00 1.17 H new ATOM 1888 N VAL A 125 8.367 5.387 4.296 1.00 0.33 N ATOM 1889 CA VAL A 125 9.554 5.279 5.108 1.00 0.43 C ATOM 1890 C VAL A 125 10.633 6.209 4.570 1.00 0.53 C ATOM 1891 O VAL A 125 11.509 6.660 5.310 1.00 0.65 O ATOM 1892 CB VAL A 125 10.030 3.804 5.154 1.00 0.48 C ATOM 1893 CG1 VAL A 125 11.496 3.695 5.551 1.00 0.81 C ATOM 1894 CG2 VAL A 125 9.167 3.013 6.121 1.00 0.47 C ATOM 0 H VAL A 125 8.196 4.585 3.690 1.00 0.33 H new ATOM 0 HA VAL A 125 9.332 5.585 6.130 1.00 0.43 H new ATOM 0 HB VAL A 125 9.929 3.389 4.151 1.00 0.48 H new ATOM 0 HG11 VAL A 125 11.790 2.646 5.572 1.00 0.81 H new ATOM 0 HG12 VAL A 125 12.110 4.230 4.826 1.00 0.81 H new ATOM 0 HG13 VAL A 125 11.639 4.131 6.540 1.00 0.81 H new ATOM 0 HG21 VAL A 125 9.507 1.978 6.149 1.00 0.47 H new ATOM 0 HG22 VAL A 125 9.246 3.447 7.118 1.00 0.47 H new ATOM 0 HG23 VAL A 125 8.128 3.045 5.792 1.00 0.47 H new ATOM 1904 N ALA A 126 10.532 6.533 3.292 1.00 0.53 N ATOM 1905 CA ALA A 126 11.402 7.540 2.704 1.00 0.63 C ATOM 1906 C ALA A 126 10.989 8.941 3.158 1.00 0.63 C ATOM 1907 O ALA A 126 11.823 9.746 3.560 1.00 0.72 O ATOM 1908 CB ALA A 126 11.379 7.444 1.187 1.00 0.68 C ATOM 0 H ALA A 126 9.862 6.118 2.645 1.00 0.53 H new ATOM 0 HA ALA A 126 12.420 7.355 3.046 1.00 0.63 H new ATOM 0 HB1 ALA A 126 12.035 8.205 0.764 1.00 0.68 H new ATOM 0 HB2 ALA A 126 11.723 6.456 0.880 1.00 0.68 H new ATOM 0 HB3 ALA A 126 10.362 7.602 0.828 1.00 0.68 H new ATOM 1914 N HIS A 127 9.686 9.210 3.110 1.00 0.56 N ATOM 1915 CA HIS A 127 9.130 10.512 3.477 1.00 0.58 C ATOM 1916 C HIS A 127 7.780 10.329 4.166 1.00 0.47 C ATOM 1917 O HIS A 127 6.822 9.908 3.539 1.00 0.44 O ATOM 1918 CB HIS A 127 8.930 11.386 2.234 1.00 0.72 C ATOM 1919 CG HIS A 127 10.067 12.307 1.907 1.00 1.15 C ATOM 1920 ND1 HIS A 127 9.886 13.652 1.673 1.00 1.70 N ATOM 1921 CD2 HIS A 127 11.390 12.075 1.740 1.00 1.99 C ATOM 1922 CE1 HIS A 127 11.044 14.205 1.375 1.00 2.29 C ATOM 1923 NE2 HIS A 127 11.977 13.272 1.409 1.00 2.47 N ATOM 0 H HIS A 127 8.984 8.531 2.815 1.00 0.56 H new ATOM 0 HA HIS A 127 9.833 10.999 4.153 1.00 0.58 H new ATOM 0 HB2 HIS A 127 8.754 10.735 1.377 1.00 0.72 H new ATOM 0 HB3 HIS A 127 8.029 11.983 2.372 1.00 0.72 H new ATOM 0 HD2 HIS A 127 11.891 11.124 1.847 1.00 1.99 H new ATOM 0 HE1 HIS A 127 11.203 15.247 1.142 1.00 2.29 H new ATOM 0 HE2 HIS A 127 12.969 13.416 1.221 1.00 2.47 H new ATOM 1932 N PRO A 128 7.684 10.673 5.454 1.00 0.47 N ATOM 1933 CA PRO A 128 6.445 10.540 6.238 1.00 0.43 C ATOM 1934 C PRO A 128 5.282 11.342 5.661 1.00 0.40 C ATOM 1935 O PRO A 128 4.134 10.923 5.747 1.00 0.39 O ATOM 1936 CB PRO A 128 6.816 11.060 7.617 1.00 0.53 C ATOM 1937 CG PRO A 128 8.032 11.894 7.396 1.00 0.79 C ATOM 1938 CD PRO A 128 8.772 11.241 6.265 1.00 0.60 C ATOM 0 HA PRO A 128 6.096 9.507 6.242 1.00 0.43 H new ATOM 0 HB2 PRO A 128 6.006 11.648 8.049 1.00 0.53 H new ATOM 0 HB3 PRO A 128 7.018 10.241 8.307 1.00 0.53 H new ATOM 0 HG2 PRO A 128 7.763 12.920 7.147 1.00 0.79 H new ATOM 0 HG3 PRO A 128 8.647 11.935 8.295 1.00 0.79 H new ATOM 0 HD2 PRO A 128 9.365 11.960 5.700 1.00 0.60 H new ATOM 0 HD3 PRO A 128 9.457 10.471 6.620 1.00 0.60 H new ATOM 1946 N ASN A 129 5.579 12.538 5.148 1.00 0.44 N ATOM 1947 CA ASN A 129 4.549 13.402 4.565 1.00 0.47 C ATOM 1948 C ASN A 129 3.985 12.805 3.285 1.00 0.39 C ATOM 1949 O ASN A 129 3.075 13.346 2.666 1.00 0.44 O ATOM 1950 CB ASN A 129 5.107 14.786 4.291 1.00 0.57 C ATOM 1951 CG ASN A 129 5.252 15.597 5.561 1.00 1.07 C ATOM 1952 OD1 ASN A 129 6.315 15.625 6.183 1.00 1.84 O ATOM 1953 ND2 ASN A 129 4.166 16.234 5.973 1.00 1.44 N ATOM 0 H ASN A 129 6.521 12.930 5.124 1.00 0.44 H new ATOM 0 HA ASN A 129 3.738 13.483 5.289 1.00 0.47 H new ATOM 0 HB2 ASN A 129 6.078 14.696 3.805 1.00 0.57 H new ATOM 0 HB3 ASN A 129 4.451 15.312 3.597 1.00 0.57 H new ATOM 0 HD21 ASN A 129 4.189 16.775 6.837 1.00 1.44 H new ATOM 0 HD22 ASN A 129 3.307 16.183 5.426 1.00 1.44 H new ATOM 1960 N LEU A 130 4.563 11.707 2.885 1.00 0.32 N ATOM 1961 CA LEU A 130 3.934 10.802 1.972 1.00 0.26 C ATOM 1962 C LEU A 130 3.278 9.774 2.856 1.00 0.24 C ATOM 1963 O LEU A 130 3.934 9.178 3.711 1.00 0.26 O ATOM 1964 CB LEU A 130 4.977 10.090 1.098 1.00 0.30 C ATOM 1965 CG LEU A 130 5.701 10.909 0.022 1.00 0.58 C ATOM 1966 CD1 LEU A 130 6.145 12.275 0.527 1.00 1.38 C ATOM 1967 CD2 LEU A 130 6.909 10.124 -0.470 1.00 1.28 C ATOM 0 H LEU A 130 5.492 11.415 3.188 1.00 0.32 H new ATOM 0 HA LEU A 130 3.243 11.322 1.309 1.00 0.26 H new ATOM 0 HB2 LEU A 130 5.733 9.667 1.760 1.00 0.30 H new ATOM 0 HB3 LEU A 130 4.482 9.254 0.604 1.00 0.30 H new ATOM 0 HG LEU A 130 4.998 11.084 -0.792 1.00 0.58 H new ATOM 0 HD11 LEU A 130 6.652 12.812 -0.275 1.00 1.38 H new ATOM 0 HD12 LEU A 130 5.274 12.844 0.851 1.00 1.38 H new ATOM 0 HD13 LEU A 130 6.828 12.148 1.367 1.00 1.38 H new ATOM 0 HD21 LEU A 130 7.430 10.699 -1.236 1.00 1.28 H new ATOM 0 HD22 LEU A 130 7.585 9.935 0.364 1.00 1.28 H new ATOM 0 HD23 LEU A 130 6.579 9.175 -0.892 1.00 1.28 H new ATOM 1979 N PHE A 131 2.032 9.512 2.635 1.00 0.23 N ATOM 1980 CA PHE A 131 1.333 8.579 3.488 1.00 0.27 C ATOM 1981 C PHE A 131 0.224 7.961 2.670 1.00 0.26 C ATOM 1982 O PHE A 131 -0.450 8.662 1.912 1.00 0.26 O ATOM 1983 CB PHE A 131 0.825 9.334 4.727 1.00 0.42 C ATOM 1984 CG PHE A 131 0.559 8.529 5.968 1.00 0.36 C ATOM 1985 CD1 PHE A 131 0.139 7.217 5.912 1.00 0.63 C ATOM 1986 CD2 PHE A 131 0.717 9.124 7.210 1.00 0.65 C ATOM 1987 CE1 PHE A 131 -0.119 6.509 7.070 1.00 0.97 C ATOM 1988 CE2 PHE A 131 0.463 8.424 8.369 1.00 0.96 C ATOM 1989 CZ PHE A 131 0.045 7.114 8.299 1.00 1.05 C ATOM 0 H PHE A 131 1.474 9.919 1.884 1.00 0.23 H new ATOM 0 HA PHE A 131 1.975 7.775 3.848 1.00 0.27 H new ATOM 0 HB2 PHE A 131 1.556 10.104 4.975 1.00 0.42 H new ATOM 0 HB3 PHE A 131 -0.097 9.847 4.454 1.00 0.42 H new ATOM 0 HD1 PHE A 131 0.010 6.738 4.953 1.00 0.63 H new ATOM 0 HD2 PHE A 131 1.044 10.152 7.270 1.00 0.65 H new ATOM 0 HE1 PHE A 131 -0.449 5.482 7.013 1.00 0.97 H new ATOM 0 HE2 PHE A 131 0.591 8.901 9.329 1.00 0.96 H new ATOM 0 HZ PHE A 131 -0.154 6.561 9.205 1.00 1.05 H new ATOM 1999 N ILE A 132 0.001 6.680 2.847 1.00 0.28 N ATOM 2000 CA ILE A 132 -0.799 5.939 1.913 1.00 0.27 C ATOM 2001 C ILE A 132 -2.256 6.079 2.300 1.00 0.25 C ATOM 2002 O ILE A 132 -2.764 5.424 3.206 1.00 0.32 O ATOM 2003 CB ILE A 132 -0.331 4.459 1.906 1.00 0.34 C ATOM 2004 CG1 ILE A 132 0.973 4.338 1.114 1.00 0.87 C ATOM 2005 CG2 ILE A 132 -1.394 3.526 1.332 1.00 0.80 C ATOM 2006 CD1 ILE A 132 0.871 4.830 -0.314 1.00 1.39 C ATOM 0 H ILE A 132 0.363 6.134 3.629 1.00 0.28 H new ATOM 0 HA ILE A 132 -0.683 6.326 0.901 1.00 0.27 H new ATOM 0 HB ILE A 132 -0.162 4.153 2.938 1.00 0.34 H new ATOM 0 HG12 ILE A 132 1.752 4.902 1.627 1.00 0.87 H new ATOM 0 HG13 ILE A 132 1.287 3.294 1.107 1.00 0.87 H new ATOM 0 HG21 ILE A 132 -1.024 2.501 1.346 1.00 0.80 H new ATOM 0 HG22 ILE A 132 -2.300 3.593 1.934 1.00 0.80 H new ATOM 0 HG23 ILE A 132 -1.617 3.817 0.306 1.00 0.80 H new ATOM 0 HD11 ILE A 132 1.835 4.711 -0.809 1.00 1.39 H new ATOM 0 HD12 ILE A 132 0.116 4.251 -0.845 1.00 1.39 H new ATOM 0 HD13 ILE A 132 0.589 5.883 -0.317 1.00 1.39 H new ATOM 2018 N ALA A 133 -2.895 6.992 1.590 1.00 0.22 N ATOM 2019 CA ALA A 133 -4.253 7.406 1.879 1.00 0.23 C ATOM 2020 C ALA A 133 -5.284 6.671 1.058 1.00 0.23 C ATOM 2021 O ALA A 133 -5.022 6.222 -0.049 1.00 0.26 O ATOM 2022 CB ALA A 133 -4.392 8.899 1.656 1.00 0.25 C ATOM 0 H ALA A 133 -2.481 7.470 0.790 1.00 0.22 H new ATOM 0 HA ALA A 133 -4.443 7.157 2.923 1.00 0.23 H new ATOM 0 HB1 ALA A 133 -5.415 9.206 1.875 1.00 0.25 H new ATOM 0 HB2 ALA A 133 -3.705 9.431 2.314 1.00 0.25 H new ATOM 0 HB3 ALA A 133 -4.156 9.135 0.618 1.00 0.25 H new ATOM 2028 N THR A 134 -6.462 6.581 1.623 1.00 0.23 N ATOM 2029 CA THR A 134 -7.629 6.061 0.949 1.00 0.25 C ATOM 2030 C THR A 134 -8.753 7.079 1.093 1.00 0.26 C ATOM 2031 O THR A 134 -9.032 7.557 2.194 1.00 0.31 O ATOM 2032 CB THR A 134 -8.011 4.703 1.542 1.00 0.31 C ATOM 2033 OG1 THR A 134 -6.802 4.077 1.962 1.00 0.96 O ATOM 2034 CG2 THR A 134 -8.698 3.820 0.513 1.00 1.01 C ATOM 0 H THR A 134 -6.642 6.873 2.584 1.00 0.23 H new ATOM 0 HA THR A 134 -7.428 5.904 -0.111 1.00 0.25 H new ATOM 0 HB THR A 134 -8.706 4.846 2.370 1.00 0.31 H new ATOM 0 HG1 THR A 134 -6.904 3.753 2.881 1.00 0.96 H new ATOM 0 HG21 THR A 134 -8.955 2.864 0.968 1.00 1.01 H new ATOM 0 HG22 THR A 134 -9.606 4.310 0.161 1.00 1.01 H new ATOM 0 HG23 THR A 134 -8.026 3.652 -0.329 1.00 1.01 H new ATOM 2042 N LYS A 135 -9.328 7.486 -0.015 1.00 0.28 N ATOM 2043 CA LYS A 135 -10.371 8.498 0.019 1.00 0.31 C ATOM 2044 C LYS A 135 -11.729 7.860 -0.254 1.00 0.40 C ATOM 2045 O LYS A 135 -11.853 6.991 -1.114 1.00 0.47 O ATOM 2046 CB LYS A 135 -10.080 9.601 -1.011 1.00 0.35 C ATOM 2047 CG LYS A 135 -8.830 10.442 -0.729 1.00 0.69 C ATOM 2048 CD LYS A 135 -8.963 11.256 0.556 1.00 0.76 C ATOM 2049 CE LYS A 135 -8.315 12.639 0.435 1.00 0.89 C ATOM 2050 NZ LYS A 135 -6.831 12.585 0.264 1.00 0.63 N ATOM 0 H LYS A 135 -9.097 7.139 -0.946 1.00 0.28 H new ATOM 0 HA LYS A 135 -10.390 8.949 1.011 1.00 0.31 H new ATOM 0 HB2 LYS A 135 -9.975 9.140 -1.993 1.00 0.35 H new ATOM 0 HB3 LYS A 135 -10.942 10.266 -1.061 1.00 0.35 H new ATOM 0 HG2 LYS A 135 -7.962 9.787 -0.654 1.00 0.69 H new ATOM 0 HG3 LYS A 135 -8.650 11.115 -1.567 1.00 0.69 H new ATOM 0 HD2 LYS A 135 -10.018 11.372 0.803 1.00 0.76 H new ATOM 0 HD3 LYS A 135 -8.501 10.711 1.379 1.00 0.76 H new ATOM 0 HE2 LYS A 135 -8.752 13.164 -0.414 1.00 0.89 H new ATOM 0 HE3 LYS A 135 -8.550 13.222 1.326 1.00 0.89 H new ATOM 0 HZ1 LYS A 135 -6.369 12.953 1.120 1.00 0.63 H new ATOM 0 HZ2 LYS A 135 -6.535 11.600 0.107 1.00 0.63 H new ATOM 0 HZ3 LYS A 135 -6.555 13.164 -0.555 1.00 0.63 H new ATOM 2064 N GLN A 136 -12.754 8.388 0.405 1.00 0.49 N ATOM 2065 CA GLN A 136 -14.103 7.821 0.368 1.00 0.63 C ATOM 2066 C GLN A 136 -14.755 8.086 -0.978 1.00 0.58 C ATOM 2067 O GLN A 136 -15.623 7.340 -1.431 1.00 0.69 O ATOM 2068 CB GLN A 136 -14.946 8.466 1.482 1.00 0.82 C ATOM 2069 CG GLN A 136 -16.415 8.054 1.493 1.00 1.05 C ATOM 2070 CD GLN A 136 -16.698 6.856 2.381 1.00 1.14 C ATOM 2071 OE1 GLN A 136 -17.789 6.723 2.930 1.00 1.75 O ATOM 2072 NE2 GLN A 136 -15.720 5.986 2.536 1.00 1.20 N ATOM 0 H GLN A 136 -12.676 9.225 0.983 1.00 0.49 H new ATOM 0 HA GLN A 136 -14.042 6.743 0.518 1.00 0.63 H new ATOM 0 HB2 GLN A 136 -14.505 8.212 2.446 1.00 0.82 H new ATOM 0 HB3 GLN A 136 -14.888 9.550 1.381 1.00 0.82 H new ATOM 0 HG2 GLN A 136 -17.019 8.897 1.829 1.00 1.05 H new ATOM 0 HG3 GLN A 136 -16.728 7.824 0.475 1.00 1.05 H new ATOM 0 HE21 GLN A 136 -14.828 6.132 2.063 1.00 1.20 H new ATOM 0 HE22 GLN A 136 -15.855 5.167 3.129 1.00 1.20 H new ATOM 2081 N ASP A 137 -14.321 9.159 -1.599 1.00 0.48 N ATOM 2082 CA ASP A 137 -14.960 9.660 -2.816 1.00 0.52 C ATOM 2083 C ASP A 137 -13.943 9.898 -3.928 1.00 0.47 C ATOM 2084 O ASP A 137 -14.272 9.817 -5.114 1.00 0.56 O ATOM 2085 CB ASP A 137 -15.721 10.956 -2.511 1.00 0.63 C ATOM 2086 CG ASP A 137 -16.447 11.516 -3.720 1.00 1.34 C ATOM 2087 OD1 ASP A 137 -17.518 10.984 -4.076 1.00 1.43 O ATOM 2088 OD2 ASP A 137 -15.936 12.477 -4.335 1.00 2.21 O ATOM 0 H ASP A 137 -13.523 9.712 -1.286 1.00 0.48 H new ATOM 0 HA ASP A 137 -15.660 8.901 -3.164 1.00 0.52 H new ATOM 0 HB2 ASP A 137 -16.442 10.769 -1.716 1.00 0.63 H new ATOM 0 HB3 ASP A 137 -15.021 11.703 -2.137 1.00 0.63 H new ATOM 2093 N TYR A 138 -12.708 10.184 -3.541 1.00 0.39 N ATOM 2094 CA TYR A 138 -11.677 10.551 -4.493 1.00 0.38 C ATOM 2095 C TYR A 138 -10.849 9.336 -4.865 1.00 0.32 C ATOM 2096 O TYR A 138 -11.109 8.225 -4.407 1.00 0.31 O ATOM 2097 CB TYR A 138 -10.733 11.619 -3.928 1.00 0.44 C ATOM 2098 CG TYR A 138 -11.399 12.877 -3.422 1.00 0.82 C ATOM 2099 CD1 TYR A 138 -12.284 13.602 -4.211 1.00 0.99 C ATOM 2100 CD2 TYR A 138 -11.109 13.354 -2.152 1.00 1.41 C ATOM 2101 CE1 TYR A 138 -12.861 14.769 -3.743 1.00 1.45 C ATOM 2102 CE2 TYR A 138 -11.682 14.512 -1.676 1.00 1.98 C ATOM 2103 CZ TYR A 138 -12.556 15.217 -2.473 1.00 1.94 C ATOM 2104 OH TYR A 138 -13.120 16.379 -1.997 1.00 2.50 O ATOM 0 H TYR A 138 -12.398 10.168 -2.569 1.00 0.39 H new ATOM 0 HA TYR A 138 -12.184 10.953 -5.370 1.00 0.38 H new ATOM 0 HB2 TYR A 138 -10.162 11.178 -3.111 1.00 0.44 H new ATOM 0 HB3 TYR A 138 -10.019 11.894 -4.704 1.00 0.44 H new ATOM 0 HD1 TYR A 138 -12.525 13.250 -5.203 1.00 0.99 H new ATOM 0 HD2 TYR A 138 -10.421 12.807 -1.525 1.00 1.41 H new ATOM 0 HE1 TYR A 138 -13.545 15.326 -4.366 1.00 1.45 H new ATOM 0 HE2 TYR A 138 -11.447 14.865 -0.683 1.00 1.98 H new ATOM 0 HH TYR A 138 -12.800 16.549 -1.087 1.00 2.50 H new ATOM 2114 N TRP A 139 -9.852 9.565 -5.694 1.00 0.34 N ATOM 2115 CA TRP A 139 -8.849 8.562 -5.986 1.00 0.33 C ATOM 2116 C TRP A 139 -7.944 8.404 -4.765 1.00 0.30 C ATOM 2117 O TRP A 139 -7.921 9.272 -3.885 1.00 0.32 O ATOM 2118 CB TRP A 139 -8.030 8.989 -7.208 1.00 0.40 C ATOM 2119 CG TRP A 139 -8.877 9.353 -8.392 1.00 1.19 C ATOM 2120 CD1 TRP A 139 -9.374 10.590 -8.693 1.00 2.40 C ATOM 2121 CD2 TRP A 139 -9.330 8.477 -9.431 1.00 1.47 C ATOM 2122 NE1 TRP A 139 -10.114 10.533 -9.847 1.00 3.09 N ATOM 2123 CE2 TRP A 139 -10.098 9.249 -10.322 1.00 2.48 C ATOM 2124 CE3 TRP A 139 -9.160 7.117 -9.694 1.00 1.75 C ATOM 2125 CZ2 TRP A 139 -10.695 8.706 -11.455 1.00 2.99 C ATOM 2126 CZ3 TRP A 139 -9.754 6.578 -10.820 1.00 2.37 C ATOM 2127 CH2 TRP A 139 -10.512 7.371 -11.689 1.00 2.74 C ATOM 0 H TRP A 139 -9.714 10.449 -6.183 1.00 0.34 H new ATOM 0 HA TRP A 139 -9.326 7.608 -6.209 1.00 0.33 H new ATOM 0 HB2 TRP A 139 -7.407 9.842 -6.939 1.00 0.40 H new ATOM 0 HB3 TRP A 139 -7.357 8.178 -7.487 1.00 0.40 H new ATOM 0 HD1 TRP A 139 -9.208 11.482 -8.108 1.00 2.40 H new ATOM 0 HE1 TRP A 139 -10.598 11.319 -10.281 1.00 3.09 H new ATOM 0 HE3 TRP A 139 -8.575 6.497 -9.030 1.00 1.75 H new ATOM 0 HZ2 TRP A 139 -11.282 9.316 -12.126 1.00 2.99 H new ATOM 0 HZ3 TRP A 139 -9.631 5.526 -11.033 1.00 2.37 H new ATOM 0 HH2 TRP A 139 -10.961 6.920 -12.561 1.00 2.74 H new ATOM 2138 N VAL A 140 -7.213 7.303 -4.698 1.00 0.30 N ATOM 2139 CA VAL A 140 -6.302 7.067 -3.588 1.00 0.33 C ATOM 2140 C VAL A 140 -5.145 8.047 -3.659 1.00 0.30 C ATOM 2141 O VAL A 140 -4.282 7.965 -4.534 1.00 0.32 O ATOM 2142 CB VAL A 140 -5.790 5.605 -3.574 1.00 0.44 C ATOM 2143 CG1 VAL A 140 -4.430 5.480 -2.897 1.00 1.58 C ATOM 2144 CG2 VAL A 140 -6.798 4.723 -2.866 1.00 1.28 C ATOM 0 H VAL A 140 -7.232 6.560 -5.397 1.00 0.30 H new ATOM 0 HA VAL A 140 -6.845 7.225 -2.656 1.00 0.33 H new ATOM 0 HB VAL A 140 -5.671 5.284 -4.609 1.00 0.44 H new ATOM 0 HG11 VAL A 140 -4.111 4.438 -2.911 1.00 1.58 H new ATOM 0 HG12 VAL A 140 -3.701 6.090 -3.430 1.00 1.58 H new ATOM 0 HG13 VAL A 140 -4.504 5.823 -1.865 1.00 1.58 H new ATOM 0 HG21 VAL A 140 -6.438 3.694 -2.856 1.00 1.28 H new ATOM 0 HG22 VAL A 140 -6.930 5.071 -1.842 1.00 1.28 H new ATOM 0 HG23 VAL A 140 -7.753 4.768 -3.390 1.00 1.28 H new ATOM 2154 N CYS A 141 -5.167 9.011 -2.757 1.00 0.30 N ATOM 2155 CA CYS A 141 -4.179 10.055 -2.775 1.00 0.26 C ATOM 2156 C CYS A 141 -3.135 9.809 -1.692 1.00 0.25 C ATOM 2157 O CYS A 141 -3.005 8.702 -1.171 1.00 0.29 O ATOM 2158 CB CYS A 141 -4.892 11.400 -2.561 1.00 0.33 C ATOM 2159 SG CYS A 141 -3.887 12.871 -2.876 1.00 1.21 S ATOM 0 H CYS A 141 -5.857 9.086 -2.010 1.00 0.30 H new ATOM 0 HA CYS A 141 -3.661 10.069 -3.734 1.00 0.26 H new ATOM 0 HB2 CYS A 141 -5.768 11.434 -3.208 1.00 0.33 H new ATOM 0 HB3 CYS A 141 -5.253 11.441 -1.533 1.00 0.33 H new ATOM 0 HG CYS A 141 -4.205 13.804 -2.028 1.00 1.21 H new ATOM 2165 N LEU A 142 -2.417 10.852 -1.355 1.00 0.21 N ATOM 2166 CA LEU A 142 -1.357 10.815 -0.394 1.00 0.23 C ATOM 2167 C LEU A 142 -1.485 12.070 0.437 1.00 0.24 C ATOM 2168 O LEU A 142 -2.113 13.017 -0.013 1.00 0.23 O ATOM 2169 CB LEU A 142 -0.059 10.769 -1.211 1.00 0.21 C ATOM 2170 CG LEU A 142 1.220 10.415 -0.486 1.00 0.22 C ATOM 2171 CD1 LEU A 142 1.367 8.908 -0.372 1.00 0.23 C ATOM 2172 CD2 LEU A 142 2.413 11.001 -1.217 1.00 0.25 C ATOM 0 H LEU A 142 -2.564 11.777 -1.759 1.00 0.21 H new ATOM 0 HA LEU A 142 -1.378 9.960 0.282 1.00 0.23 H new ATOM 0 HB2 LEU A 142 -0.197 10.049 -2.018 1.00 0.21 H new ATOM 0 HB3 LEU A 142 0.079 11.745 -1.675 1.00 0.21 H new ATOM 0 HG LEU A 142 1.178 10.837 0.518 1.00 0.22 H new ATOM 0 HD11 LEU A 142 2.293 8.671 0.152 1.00 0.23 H new ATOM 0 HD12 LEU A 142 0.522 8.501 0.183 1.00 0.23 H new ATOM 0 HD13 LEU A 142 1.392 8.468 -1.369 1.00 0.23 H new ATOM 0 HD21 LEU A 142 3.329 10.740 -0.687 1.00 0.25 H new ATOM 0 HD22 LEU A 142 2.453 10.599 -2.229 1.00 0.25 H new ATOM 0 HD23 LEU A 142 2.316 12.086 -1.261 1.00 0.25 H new ATOM 2184 N ALA A 143 -1.013 12.045 1.662 1.00 0.34 N ATOM 2185 CA ALA A 143 -0.693 13.247 2.391 1.00 0.33 C ATOM 2186 C ALA A 143 0.029 12.823 3.634 1.00 0.60 C ATOM 2187 O ALA A 143 -0.206 11.744 4.116 1.00 0.91 O ATOM 2188 CB ALA A 143 -1.952 14.029 2.751 1.00 0.38 C ATOM 0 H ALA A 143 -0.840 11.185 2.182 1.00 0.34 H new ATOM 0 HA ALA A 143 -0.076 13.906 1.780 1.00 0.33 H new ATOM 0 HB1 ALA A 143 -1.676 14.929 3.300 1.00 0.38 H new ATOM 0 HB2 ALA A 143 -2.481 14.307 1.839 1.00 0.38 H new ATOM 0 HB3 ALA A 143 -2.600 13.410 3.371 1.00 0.38 H new ATOM 2194 N GLY A 144 0.836 13.663 4.199 1.00 0.63 N ATOM 2195 CA GLY A 144 1.341 13.378 5.516 1.00 0.93 C ATOM 2196 C GLY A 144 0.485 14.091 6.502 1.00 0.93 C ATOM 2197 O GLY A 144 0.930 14.476 7.582 1.00 1.13 O ATOM 0 H GLY A 144 1.158 14.537 3.784 1.00 0.63 H new ATOM 0 HA2 GLY A 144 1.327 12.305 5.705 1.00 0.93 H new ATOM 0 HA3 GLY A 144 2.377 13.704 5.605 1.00 0.93 H new ATOM 2201 N GLY A 145 -0.768 14.238 6.129 1.00 0.94 N ATOM 2202 CA GLY A 145 -1.596 15.195 6.821 1.00 1.38 C ATOM 2203 C GLY A 145 -3.060 15.139 6.468 1.00 1.61 C ATOM 2204 O GLY A 145 -3.544 14.131 5.958 1.00 1.48 O ATOM 0 H GLY A 145 -1.223 13.724 5.374 1.00 0.94 H new ATOM 0 HA2 GLY A 145 -1.490 15.037 7.894 1.00 1.38 H new ATOM 0 HA3 GLY A 145 -1.224 16.197 6.608 1.00 1.38 H new ATOM 2208 N PRO A 146 -3.756 16.255 6.779 1.00 2.13 N ATOM 2209 CA PRO A 146 -5.197 16.476 6.672 1.00 2.27 C ATOM 2210 C PRO A 146 -5.998 15.493 5.813 1.00 1.59 C ATOM 2211 O PRO A 146 -5.567 15.091 4.735 1.00 2.15 O ATOM 2212 CB PRO A 146 -5.227 17.877 6.068 1.00 3.57 C ATOM 2213 CG PRO A 146 -4.008 18.566 6.611 1.00 3.98 C ATOM 2214 CD PRO A 146 -3.138 17.501 7.243 1.00 2.93 C ATOM 0 HA PRO A 146 -5.682 16.339 7.639 1.00 2.27 H new ATOM 0 HB2 PRO A 146 -5.204 17.837 4.979 1.00 3.57 H new ATOM 0 HB3 PRO A 146 -6.137 18.407 6.349 1.00 3.57 H new ATOM 0 HG2 PRO A 146 -3.470 19.080 5.815 1.00 3.98 H new ATOM 0 HG3 PRO A 146 -4.288 19.321 7.346 1.00 3.98 H new ATOM 0 HD2 PRO A 146 -2.100 17.582 6.919 1.00 2.93 H new ATOM 0 HD3 PRO A 146 -3.139 17.572 8.331 1.00 2.93 H new ATOM 2222 N PRO A 147 -7.271 15.316 6.243 1.00 1.33 N ATOM 2223 CA PRO A 147 -8.257 14.280 5.912 1.00 1.05 C ATOM 2224 C PRO A 147 -7.967 13.166 4.885 1.00 0.70 C ATOM 2225 O PRO A 147 -8.918 12.500 4.470 1.00 0.86 O ATOM 2226 CB PRO A 147 -9.417 15.166 5.481 1.00 1.57 C ATOM 2227 CG PRO A 147 -9.346 16.332 6.433 1.00 2.12 C ATOM 2228 CD PRO A 147 -7.979 16.272 7.096 1.00 2.10 C ATOM 0 HA PRO A 147 -8.372 13.612 6.766 1.00 1.05 H new ATOM 0 HB2 PRO A 147 -9.312 15.488 4.445 1.00 1.57 H new ATOM 0 HB3 PRO A 147 -10.370 14.643 5.558 1.00 1.57 H new ATOM 0 HG2 PRO A 147 -9.477 17.274 5.901 1.00 2.12 H new ATOM 0 HG3 PRO A 147 -10.140 16.273 7.177 1.00 2.12 H new ATOM 0 HD2 PRO A 147 -7.490 17.246 7.112 1.00 2.10 H new ATOM 0 HD3 PRO A 147 -8.041 15.930 8.129 1.00 2.10 H new ATOM 2236 N SER A 148 -6.735 12.919 4.449 1.00 0.49 N ATOM 2237 CA SER A 148 -6.503 11.731 3.691 1.00 0.43 C ATOM 2238 C SER A 148 -6.552 10.571 4.665 1.00 0.37 C ATOM 2239 O SER A 148 -5.826 10.555 5.658 1.00 0.37 O ATOM 2240 CB SER A 148 -5.155 11.828 2.987 1.00 0.57 C ATOM 2241 OG SER A 148 -5.115 12.979 2.156 1.00 0.64 O ATOM 0 H SER A 148 -5.920 13.511 4.608 1.00 0.49 H new ATOM 0 HA SER A 148 -7.255 11.589 2.915 1.00 0.43 H new ATOM 0 HB2 SER A 148 -4.354 11.876 3.725 1.00 0.57 H new ATOM 0 HB3 SER A 148 -4.984 10.933 2.389 1.00 0.57 H new ATOM 0 HG SER A 148 -4.244 13.031 1.711 1.00 0.64 H new ATOM 2247 N ILE A 149 -7.397 9.603 4.384 1.00 0.37 N ATOM 2248 CA ILE A 149 -7.591 8.511 5.308 1.00 0.32 C ATOM 2249 C ILE A 149 -6.669 7.380 4.978 1.00 0.26 C ATOM 2250 O ILE A 149 -6.936 6.537 4.121 1.00 0.29 O ATOM 2251 CB ILE A 149 -9.051 8.059 5.408 1.00 0.35 C ATOM 2252 CG1 ILE A 149 -9.889 9.236 5.922 1.00 0.57 C ATOM 2253 CG2 ILE A 149 -9.182 6.857 6.337 1.00 0.56 C ATOM 2254 CD1 ILE A 149 -9.456 9.751 7.280 1.00 1.21 C ATOM 0 H ILE A 149 -7.955 9.551 3.532 1.00 0.37 H new ATOM 0 HA ILE A 149 -7.338 8.879 6.302 1.00 0.32 H new ATOM 0 HB ILE A 149 -9.410 7.752 4.425 1.00 0.35 H new ATOM 0 HG12 ILE A 149 -9.834 10.051 5.201 1.00 0.57 H new ATOM 0 HG13 ILE A 149 -10.933 8.929 5.977 1.00 0.57 H new ATOM 0 HG21 ILE A 149 -10.227 6.553 6.393 1.00 0.56 H new ATOM 0 HG22 ILE A 149 -8.584 6.032 5.951 1.00 0.56 H new ATOM 0 HG23 ILE A 149 -8.828 7.126 7.332 1.00 0.56 H new ATOM 0 HD11 ILE A 149 -10.096 10.582 7.575 1.00 1.21 H new ATOM 0 HD12 ILE A 149 -9.538 8.951 8.016 1.00 1.21 H new ATOM 0 HD13 ILE A 149 -8.422 10.090 7.227 1.00 1.21 H new ATOM 2266 N THR A 150 -5.565 7.385 5.661 1.00 0.24 N ATOM 2267 CA THR A 150 -4.498 6.495 5.363 1.00 0.25 C ATOM 2268 C THR A 150 -4.718 5.241 6.169 1.00 0.26 C ATOM 2269 O THR A 150 -3.799 4.629 6.688 1.00 0.34 O ATOM 2270 CB THR A 150 -3.148 7.162 5.727 1.00 0.28 C ATOM 2271 OG1 THR A 150 -3.219 7.704 7.053 1.00 0.53 O ATOM 2272 CG2 THR A 150 -2.831 8.298 4.768 1.00 0.69 C ATOM 0 H THR A 150 -5.383 8.013 6.444 1.00 0.24 H new ATOM 0 HA THR A 150 -4.470 6.251 4.301 1.00 0.25 H new ATOM 0 HB THR A 150 -2.369 6.402 5.663 1.00 0.28 H new ATOM 0 HG1 THR A 150 -2.313 7.808 7.413 1.00 0.53 H new ATOM 0 HG21 THR A 150 -1.879 8.751 5.043 1.00 0.69 H new ATOM 0 HG22 THR A 150 -2.768 7.909 3.752 1.00 0.69 H new ATOM 0 HG23 THR A 150 -3.619 9.049 4.821 1.00 0.69 H new ATOM 2280 N ASP A 151 -5.978 4.879 6.271 1.00 0.25 N ATOM 2281 CA ASP A 151 -6.348 3.683 6.909 1.00 0.25 C ATOM 2282 C ASP A 151 -6.527 2.610 5.876 1.00 0.26 C ATOM 2283 O ASP A 151 -6.945 2.854 4.760 1.00 0.27 O ATOM 2284 CB ASP A 151 -7.597 3.895 7.728 1.00 0.29 C ATOM 2285 CG ASP A 151 -7.317 4.562 9.065 1.00 0.79 C ATOM 2286 OD1 ASP A 151 -6.893 3.867 10.012 1.00 1.25 O ATOM 2287 OD2 ASP A 151 -7.498 5.792 9.170 1.00 1.07 O ATOM 0 H ASP A 151 -6.760 5.423 5.906 1.00 0.25 H new ATOM 0 HA ASP A 151 -5.564 3.366 7.597 1.00 0.25 H new ATOM 0 HB2 ASP A 151 -8.298 4.507 7.161 1.00 0.29 H new ATOM 0 HB3 ASP A 151 -8.081 2.934 7.901 1.00 0.29 H new ATOM 2292 N PHE A 152 -6.156 1.454 6.253 1.00 0.27 N ATOM 2293 CA PHE A 152 -6.503 0.248 5.567 1.00 0.27 C ATOM 2294 C PHE A 152 -6.835 -0.785 6.615 1.00 0.28 C ATOM 2295 O PHE A 152 -6.585 -0.571 7.775 1.00 0.30 O ATOM 2296 CB PHE A 152 -5.363 -0.205 4.648 1.00 0.30 C ATOM 2297 CG PHE A 152 -4.663 -1.484 5.034 1.00 1.46 C ATOM 2298 CD1 PHE A 152 -3.665 -1.486 5.992 1.00 2.11 C ATOM 2299 CD2 PHE A 152 -4.996 -2.682 4.421 1.00 2.12 C ATOM 2300 CE1 PHE A 152 -3.015 -2.657 6.334 1.00 3.33 C ATOM 2301 CE2 PHE A 152 -4.351 -3.853 4.761 1.00 3.35 C ATOM 2302 CZ PHE A 152 -3.359 -3.841 5.718 1.00 3.93 C ATOM 0 H PHE A 152 -5.579 1.299 7.079 1.00 0.27 H new ATOM 0 HA PHE A 152 -7.366 0.402 4.920 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -5.762 -0.324 3.641 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -4.621 0.592 4.605 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -3.390 -0.562 6.478 1.00 2.11 H new ATOM 0 HD2 PHE A 152 -5.770 -2.699 3.668 1.00 2.12 H new ATOM 0 HE1 PHE A 152 -2.238 -2.644 7.084 1.00 3.33 H new ATOM 0 HE2 PHE A 152 -4.623 -4.779 4.277 1.00 3.35 H new ATOM 0 HZ PHE A 152 -2.853 -4.757 5.984 1.00 3.93 H new ATOM 2312 N GLN A 153 -7.382 -1.881 6.198 1.00 0.30 N ATOM 2313 CA GLN A 153 -7.829 -2.926 7.085 1.00 0.33 C ATOM 2314 C GLN A 153 -8.000 -4.165 6.253 1.00 0.38 C ATOM 2315 O GLN A 153 -8.376 -4.067 5.084 1.00 0.44 O ATOM 2316 CB GLN A 153 -9.122 -2.552 7.835 1.00 0.44 C ATOM 2317 CG GLN A 153 -10.309 -2.178 6.959 1.00 0.70 C ATOM 2318 CD GLN A 153 -11.552 -1.876 7.774 1.00 0.63 C ATOM 2319 OE1 GLN A 153 -12.671 -2.096 7.320 1.00 1.27 O ATOM 2320 NE2 GLN A 153 -11.365 -1.364 8.980 1.00 1.20 N ATOM 0 H GLN A 153 -7.537 -2.087 5.211 1.00 0.30 H new ATOM 0 HA GLN A 153 -7.090 -3.090 7.869 1.00 0.33 H new ATOM 0 HB2 GLN A 153 -9.410 -3.393 8.466 1.00 0.44 H new ATOM 0 HB3 GLN A 153 -8.906 -1.715 8.499 1.00 0.44 H new ATOM 0 HG2 GLN A 153 -10.052 -1.307 6.355 1.00 0.70 H new ATOM 0 HG3 GLN A 153 -10.520 -2.994 6.268 1.00 0.70 H new ATOM 0 HE21 GLN A 153 -10.419 -1.196 9.322 1.00 1.20 H new ATOM 0 HE22 GLN A 153 -12.167 -1.138 9.568 1.00 1.20 H new ATOM 2329 N ILE A 154 -7.702 -5.318 6.808 1.00 0.43 N ATOM 2330 CA ILE A 154 -7.654 -6.508 5.999 1.00 0.45 C ATOM 2331 C ILE A 154 -9.006 -7.181 6.029 1.00 0.44 C ATOM 2332 O ILE A 154 -9.502 -7.620 7.067 1.00 0.49 O ATOM 2333 CB ILE A 154 -6.557 -7.496 6.468 1.00 0.56 C ATOM 2334 CG1 ILE A 154 -6.645 -7.740 7.981 1.00 1.14 C ATOM 2335 CG2 ILE A 154 -5.176 -6.977 6.087 1.00 1.53 C ATOM 2336 CD1 ILE A 154 -5.627 -8.736 8.500 1.00 1.63 C ATOM 0 H ILE A 154 -7.493 -5.454 7.797 1.00 0.43 H new ATOM 0 HA ILE A 154 -7.401 -6.212 4.981 1.00 0.45 H new ATOM 0 HB ILE A 154 -6.721 -8.449 5.965 1.00 0.56 H new ATOM 0 HG12 ILE A 154 -6.510 -6.792 8.501 1.00 1.14 H new ATOM 0 HG13 ILE A 154 -7.646 -8.097 8.224 1.00 1.14 H new ATOM 0 HG21 ILE A 154 -4.416 -7.683 6.424 1.00 1.53 H new ATOM 0 HG22 ILE A 154 -5.115 -6.867 5.004 1.00 1.53 H new ATOM 0 HG23 ILE A 154 -5.008 -6.010 6.560 1.00 1.53 H new ATOM 0 HD11 ILE A 154 -5.751 -8.856 9.576 1.00 1.63 H new ATOM 0 HD12 ILE A 154 -5.775 -9.697 8.008 1.00 1.63 H new ATOM 0 HD13 ILE A 154 -4.621 -8.372 8.289 1.00 1.63 H new ATOM 2348 N LEU A 155 -9.592 -7.236 4.851 1.00 0.43 N ATOM 2349 CA LEU A 155 -10.961 -7.648 4.681 1.00 0.44 C ATOM 2350 C LEU A 155 -11.015 -9.057 4.129 1.00 0.57 C ATOM 2351 O LEU A 155 -10.453 -9.361 3.078 1.00 0.67 O ATOM 2352 CB LEU A 155 -11.735 -6.696 3.751 1.00 0.53 C ATOM 2353 CG LEU A 155 -12.081 -5.300 4.304 1.00 0.46 C ATOM 2354 CD1 LEU A 155 -13.309 -4.766 3.585 1.00 0.82 C ATOM 2355 CD2 LEU A 155 -12.322 -5.347 5.808 1.00 0.73 C ATOM 0 H LEU A 155 -9.123 -6.993 3.979 1.00 0.43 H new ATOM 0 HA LEU A 155 -11.436 -7.618 5.661 1.00 0.44 H new ATOM 0 HB2 LEU A 155 -11.151 -6.564 2.841 1.00 0.53 H new ATOM 0 HB3 LEU A 155 -12.665 -7.186 3.464 1.00 0.53 H new ATOM 0 HG LEU A 155 -11.237 -4.633 4.128 1.00 0.46 H new ATOM 0 HD11 LEU A 155 -13.557 -3.778 3.973 1.00 0.82 H new ATOM 0 HD12 LEU A 155 -13.103 -4.695 2.517 1.00 0.82 H new ATOM 0 HD13 LEU A 155 -14.149 -5.442 3.748 1.00 0.82 H new ATOM 0 HD21 LEU A 155 -12.564 -4.347 6.169 1.00 0.73 H new ATOM 0 HD22 LEU A 155 -13.151 -6.021 6.023 1.00 0.73 H new ATOM 0 HD23 LEU A 155 -11.423 -5.706 6.309 1.00 0.73 H new ATOM 2367 N GLU A 156 -11.666 -9.906 4.882 1.00 0.67 N ATOM 2368 CA GLU A 156 -11.901 -11.275 4.494 1.00 0.89 C ATOM 2369 C GLU A 156 -13.156 -11.289 3.638 1.00 0.99 C ATOM 2370 O GLU A 156 -13.969 -10.385 3.741 1.00 0.90 O ATOM 2371 CB GLU A 156 -12.117 -12.101 5.770 1.00 1.04 C ATOM 2372 CG GLU A 156 -12.276 -13.594 5.553 1.00 1.58 C ATOM 2373 CD GLU A 156 -10.996 -14.354 5.814 1.00 2.05 C ATOM 2374 OE1 GLU A 156 -10.745 -14.722 6.985 1.00 2.57 O ATOM 2375 OE2 GLU A 156 -10.238 -14.597 4.857 1.00 2.53 O ATOM 0 H GLU A 156 -12.053 -9.664 5.794 1.00 0.67 H new ATOM 0 HA GLU A 156 -11.064 -11.694 3.935 1.00 0.89 H new ATOM 0 HB2 GLU A 156 -11.272 -11.935 6.439 1.00 1.04 H new ATOM 0 HB3 GLU A 156 -13.005 -11.727 6.280 1.00 1.04 H new ATOM 0 HG2 GLU A 156 -13.060 -13.972 6.209 1.00 1.58 H new ATOM 0 HG3 GLU A 156 -12.601 -13.777 4.529 1.00 1.58 H new ATOM 2382 N ASN A 157 -13.308 -12.284 2.790 1.00 1.23 N ATOM 2383 CA ASN A 157 -14.502 -12.391 1.956 1.00 1.41 C ATOM 2384 C ASN A 157 -15.605 -13.107 2.738 1.00 1.66 C ATOM 2385 O ASN A 157 -15.310 -13.845 3.682 1.00 1.82 O ATOM 2386 CB ASN A 157 -14.140 -13.147 0.665 1.00 1.68 C ATOM 2387 CG ASN A 157 -15.341 -13.537 -0.178 1.00 2.14 C ATOM 2388 OD1 ASN A 157 -15.866 -12.736 -0.949 1.00 2.67 O ATOM 2389 ND2 ASN A 157 -15.755 -14.789 -0.070 1.00 2.44 N ATOM 0 H ASN A 157 -12.627 -13.031 2.655 1.00 1.23 H new ATOM 0 HA ASN A 157 -14.872 -11.402 1.684 1.00 1.41 H new ATOM 0 HB2 ASN A 157 -13.475 -12.525 0.066 1.00 1.68 H new ATOM 0 HB3 ASN A 157 -13.585 -14.048 0.927 1.00 1.68 H new ATOM 0 HD21 ASN A 157 -16.535 -15.119 -0.638 1.00 2.44 H new ATOM 0 HD22 ASN A 157 -15.294 -15.424 0.581 1.00 2.44 H new ATOM 2396 N GLN A 158 -16.865 -12.906 2.358 1.00 1.77 N ATOM 2397 CA GLN A 158 -17.980 -13.399 3.150 1.00 2.06 C ATOM 2398 C GLN A 158 -18.052 -14.921 3.100 1.00 2.49 C ATOM 2399 O GLN A 158 -18.042 -15.593 4.136 1.00 2.73 O ATOM 2400 CB GLN A 158 -19.288 -12.793 2.636 1.00 2.08 C ATOM 2401 CG GLN A 158 -19.318 -11.270 2.632 1.00 2.54 C ATOM 2402 CD GLN A 158 -19.585 -10.653 3.999 1.00 2.68 C ATOM 2403 OE1 GLN A 158 -20.157 -9.569 4.095 1.00 3.15 O ATOM 2404 NE2 GLN A 158 -19.176 -11.325 5.064 1.00 2.98 N ATOM 0 H GLN A 158 -17.135 -12.407 1.510 1.00 1.77 H new ATOM 0 HA GLN A 158 -17.827 -13.100 4.187 1.00 2.06 H new ATOM 0 HB2 GLN A 158 -19.466 -13.150 1.622 1.00 2.08 H new ATOM 0 HB3 GLN A 158 -20.110 -13.159 3.251 1.00 2.08 H new ATOM 0 HG2 GLN A 158 -18.364 -10.899 2.257 1.00 2.54 H new ATOM 0 HG3 GLN A 158 -20.087 -10.934 1.936 1.00 2.54 H new ATOM 0 HE21 GLN A 158 -18.704 -12.222 4.951 1.00 2.98 H new ATOM 0 HE22 GLN A 158 -19.333 -10.945 5.998 1.00 2.98 H new ATOM 2413 N ALA A 159 -18.095 -15.456 1.893 1.00 2.67 N ATOM 2414 CA ALA A 159 -18.143 -16.892 1.690 1.00 3.14 C ATOM 2415 C ALA A 159 -17.356 -17.262 0.444 1.00 3.38 C ATOM 2416 O ALA A 159 -16.295 -17.906 0.576 1.00 3.55 O ATOM 2417 CB ALA A 159 -19.582 -17.368 1.584 1.00 3.37 C ATOM 2418 OXT ALA A 159 -17.768 -16.851 -0.659 1.00 3.78 O ATOM 0 H ALA A 159 -18.098 -14.911 1.031 1.00 2.67 H new ATOM 0 HA ALA A 159 -17.690 -17.387 2.548 1.00 3.14 H new ATOM 0 HB1 ALA A 159 -19.598 -18.447 1.432 1.00 3.37 H new ATOM 0 HB2 ALA A 159 -20.115 -17.123 2.503 1.00 3.37 H new ATOM 0 HB3 ALA A 159 -20.067 -16.876 0.741 1.00 3.37 H new TER 2424 ALA A 159