USER MOD reduce.3.24.130724 H: found=0, std=0, add=845, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 843 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 93 SER OG : rot -87:sc= -0.902 USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= 0.00464 USER MOD Set 2.1: A 14 THR OG1 : rot 179:sc= 1.14 USER MOD Set 2.2: A 67 GLN : amide:sc= -0.151 K(o=0.98,f=-2.3) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 174:sc= -0.0862 (180deg=-0.139) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 180:sc= -0.364 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ -171:sc= -1.15 (180deg=-1.32) USER MOD Single : A 13 ASN : amide:sc= -1.98 K(o=-2,f=-4!) USER MOD Single : A 22 SER OG : rot 180:sc= 0.00246 USER MOD Single : A 29 TYR OH : rot -177:sc= 0.685 USER MOD Single : A 31 LYS NZ :NH3+ 178:sc= -1.37 (180deg=-1.5) USER MOD Single : A 32 ASN : amide:sc= -1.55! K(o=-1.5!,f=-0.51) USER MOD Single : A 34 SER OG : rot -77:sc= 0.584 USER MOD Single : A 37 LYS NZ :NH3+ 161:sc= -1.27 (180deg=-2.26!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.472 USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ -159:sc= -0.0223 (180deg=-0.259) USER MOD Single : A 70 ASN : amide:sc= -1.89 K(o=-1.9,f=-4.4!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0301) USER MOD Single : A 88 ASN : amide:sc= -0.0334 K(o=-0.033,f=-1.5!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -0.329 X(o=-0.33,f=-0.46) USER MOD Single : A 94 THR OG1 : rot 60:sc= 0.882 USER MOD Single : A 96 SER OG : rot 66:sc= 0.645 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 152:sc= -0.102 (180deg=-0.512) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.0305 USER MOD Single : A 108 LYS NZ :NH3+ -164:sc=-0.00425 (180deg=-0.122) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -2.36! C(o=-2.4!,f=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.547 -0.120 -21.783 1.00 0.00 N ATOM 2 CA MET A 1 -16.943 -1.424 -21.390 1.00 0.00 C ATOM 3 C MET A 1 -15.926 -1.856 -22.449 1.00 0.00 C ATOM 4 O MET A 1 -15.476 -2.984 -22.468 1.00 0.00 O ATOM 5 CB MET A 1 -18.044 -2.483 -21.275 1.00 0.00 C ATOM 6 CG MET A 1 -18.219 -2.882 -19.810 1.00 0.00 C ATOM 7 SD MET A 1 -16.762 -3.799 -19.254 1.00 0.00 S ATOM 8 CE MET A 1 -17.507 -5.447 -19.278 1.00 0.00 C ATOM 0 H1 MET A 1 -18.309 0.124 -21.119 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.818 0.621 -21.761 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.937 -0.194 -22.744 1.00 0.00 H new ATOM 0 HA MET A 1 -16.441 -1.317 -20.428 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.981 -2.092 -21.671 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.786 -3.357 -21.872 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.359 -1.993 -19.195 1.00 0.00 H new ATOM 0 HG3 MET A 1 -19.113 -3.494 -19.693 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.769 -6.185 -18.963 1.00 0.00 H new ATOM 0 HE2 MET A 1 -18.358 -5.472 -18.597 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.844 -5.679 -20.288 1.00 0.00 H new ATOM 18 N SER A 2 -15.562 -0.967 -23.332 1.00 0.00 N ATOM 19 CA SER A 2 -14.575 -1.327 -24.389 1.00 0.00 C ATOM 20 C SER A 2 -13.179 -1.425 -23.771 1.00 0.00 C ATOM 21 O SER A 2 -12.378 -2.257 -24.150 1.00 0.00 O ATOM 22 CB SER A 2 -14.577 -0.253 -25.476 1.00 0.00 C ATOM 23 OG SER A 2 -13.252 -0.067 -25.954 1.00 0.00 O ATOM 0 H SER A 2 -15.905 -0.007 -23.367 1.00 0.00 H new ATOM 0 HA SER A 2 -14.847 -2.287 -24.827 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.233 -0.549 -26.295 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.967 0.684 -25.077 1.00 0.00 H new ATOM 0 HG SER A 2 -13.250 0.620 -26.653 1.00 0.00 H new ATOM 29 N THR A 3 -12.881 -0.581 -22.821 1.00 0.00 N ATOM 30 CA THR A 3 -11.536 -0.627 -22.180 1.00 0.00 C ATOM 31 C THR A 3 -11.674 -0.326 -20.686 1.00 0.00 C ATOM 32 O THR A 3 -12.446 0.520 -20.282 1.00 0.00 O ATOM 33 CB THR A 3 -10.626 0.419 -22.829 1.00 0.00 C ATOM 34 OG1 THR A 3 -9.411 0.505 -22.098 1.00 0.00 O ATOM 35 CG2 THR A 3 -11.324 1.779 -22.826 1.00 0.00 C ATOM 0 H THR A 3 -13.510 0.137 -22.461 1.00 0.00 H new ATOM 0 HA THR A 3 -11.103 -1.618 -22.313 1.00 0.00 H new ATOM 0 HB THR A 3 -10.412 0.127 -23.857 1.00 0.00 H new ATOM 0 HG1 THR A 3 -8.826 1.173 -22.513 1.00 0.00 H new ATOM 0 HG21 THR A 3 -10.675 2.522 -23.288 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.255 1.711 -23.388 1.00 0.00 H new ATOM 0 HG23 THR A 3 -11.540 2.075 -21.799 1.00 0.00 H new ATOM 43 N VAL A 4 -10.930 -1.012 -19.863 1.00 0.00 N ATOM 44 CA VAL A 4 -11.017 -0.765 -18.396 1.00 0.00 C ATOM 45 C VAL A 4 -10.482 0.634 -18.081 1.00 0.00 C ATOM 46 O VAL A 4 -10.113 1.382 -18.965 1.00 0.00 O ATOM 47 CB VAL A 4 -10.184 -1.809 -17.652 1.00 0.00 C ATOM 48 CG1 VAL A 4 -10.868 -3.173 -17.749 1.00 0.00 C ATOM 49 CG2 VAL A 4 -8.792 -1.892 -18.283 1.00 0.00 C ATOM 0 H VAL A 4 -10.265 -1.733 -20.143 1.00 0.00 H new ATOM 0 HA VAL A 4 -12.057 -0.836 -18.077 1.00 0.00 H new ATOM 0 HB VAL A 4 -10.094 -1.522 -16.604 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -10.273 -3.917 -17.218 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -11.860 -3.115 -17.302 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -10.959 -3.461 -18.796 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -8.196 -2.636 -17.754 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -8.884 -2.179 -19.331 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -8.303 -0.920 -18.215 1.00 0.00 H new ATOM 59 N THR A 5 -10.438 0.994 -16.827 1.00 0.00 N ATOM 60 CA THR A 5 -9.926 2.343 -16.457 1.00 0.00 C ATOM 61 C THR A 5 -8.623 2.196 -15.668 1.00 0.00 C ATOM 62 O THR A 5 -8.476 1.305 -14.855 1.00 0.00 O ATOM 63 CB THR A 5 -10.965 3.064 -15.596 1.00 0.00 C ATOM 64 OG1 THR A 5 -12.251 2.905 -16.178 1.00 0.00 O ATOM 65 CG2 THR A 5 -10.620 4.552 -15.514 1.00 0.00 C ATOM 0 H THR A 5 -10.734 0.412 -16.043 1.00 0.00 H new ATOM 0 HA THR A 5 -9.739 2.921 -17.362 1.00 0.00 H new ATOM 0 HB THR A 5 -10.964 2.639 -14.592 1.00 0.00 H new ATOM 0 HG1 THR A 5 -12.919 3.365 -15.627 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.361 5.064 -14.900 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.633 4.673 -15.067 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.620 4.981 -16.516 1.00 0.00 H new ATOM 73 N LYS A 6 -7.676 3.063 -15.903 1.00 0.00 N ATOM 74 CA LYS A 6 -6.385 2.972 -15.166 1.00 0.00 C ATOM 75 C LYS A 6 -6.265 4.150 -14.196 1.00 0.00 C ATOM 76 O LYS A 6 -6.576 5.275 -14.532 1.00 0.00 O ATOM 77 CB LYS A 6 -5.225 3.011 -16.162 1.00 0.00 C ATOM 78 CG LYS A 6 -4.711 1.591 -16.407 1.00 0.00 C ATOM 79 CD LYS A 6 -3.405 1.649 -17.200 1.00 0.00 C ATOM 80 CE LYS A 6 -3.709 1.975 -18.663 1.00 0.00 C ATOM 81 NZ LYS A 6 -2.477 1.789 -19.481 1.00 0.00 N ATOM 0 H LYS A 6 -7.741 3.829 -16.573 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.352 2.037 -14.607 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -5.553 3.457 -17.101 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -4.421 3.638 -15.775 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -4.549 1.083 -15.456 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -5.456 1.013 -16.955 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.744 2.406 -16.778 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -2.882 0.695 -17.130 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -4.505 1.328 -19.033 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -4.065 3.001 -18.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -2.684 2.011 -20.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.730 2.424 -19.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.156 0.803 -19.406 1.00 0.00 H new ATOM 95 N TYR A 7 -5.817 3.900 -12.996 1.00 0.00 N ATOM 96 CA TYR A 7 -5.677 5.006 -12.008 1.00 0.00 C ATOM 97 C TYR A 7 -4.202 5.392 -11.879 1.00 0.00 C ATOM 98 O TYR A 7 -3.399 4.644 -11.356 1.00 0.00 O ATOM 99 CB TYR A 7 -6.206 4.544 -10.649 1.00 0.00 C ATOM 100 CG TYR A 7 -7.614 5.053 -10.455 1.00 0.00 C ATOM 101 CD1 TYR A 7 -8.539 4.967 -11.503 1.00 0.00 C ATOM 102 CD2 TYR A 7 -7.996 5.611 -9.230 1.00 0.00 C ATOM 103 CE1 TYR A 7 -9.845 5.438 -11.324 1.00 0.00 C ATOM 104 CE2 TYR A 7 -9.301 6.083 -9.051 1.00 0.00 C ATOM 105 CZ TYR A 7 -10.226 5.996 -10.098 1.00 0.00 C ATOM 106 OH TYR A 7 -11.513 6.461 -9.923 1.00 0.00 O ATOM 0 H TYR A 7 -5.542 2.978 -12.658 1.00 0.00 H new ATOM 0 HA TYR A 7 -6.249 5.870 -12.346 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -6.191 3.456 -10.592 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -5.562 4.914 -9.852 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -8.245 4.537 -12.449 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -7.283 5.677 -8.422 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -10.559 5.371 -12.132 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -9.594 6.514 -8.105 1.00 0.00 H new ATOM 0 HH TYR A 7 -11.612 6.816 -9.015 1.00 0.00 H new ATOM 116 N PHE A 8 -3.840 6.553 -12.351 1.00 0.00 N ATOM 117 CA PHE A 8 -2.417 6.985 -12.254 1.00 0.00 C ATOM 118 C PHE A 8 -2.147 7.544 -10.856 1.00 0.00 C ATOM 119 O PHE A 8 -3.057 7.883 -10.126 1.00 0.00 O ATOM 120 CB PHE A 8 -2.141 8.068 -13.300 1.00 0.00 C ATOM 121 CG PHE A 8 -2.015 7.432 -14.663 1.00 0.00 C ATOM 122 CD1 PHE A 8 -3.154 6.946 -15.316 1.00 0.00 C ATOM 123 CD2 PHE A 8 -0.760 7.328 -15.273 1.00 0.00 C ATOM 124 CE1 PHE A 8 -3.037 6.357 -16.582 1.00 0.00 C ATOM 125 CE2 PHE A 8 -0.644 6.738 -16.538 1.00 0.00 C ATOM 126 CZ PHE A 8 -1.782 6.252 -17.192 1.00 0.00 C ATOM 0 H PHE A 8 -4.467 7.221 -12.799 1.00 0.00 H new ATOM 0 HA PHE A 8 -1.765 6.131 -12.435 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -2.948 8.800 -13.302 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -1.225 8.604 -13.051 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -4.122 7.025 -14.844 1.00 0.00 H new ATOM 0 HD2 PHE A 8 0.119 7.702 -14.769 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -3.916 5.984 -17.087 1.00 0.00 H new ATOM 0 HE2 PHE A 8 0.324 6.658 -17.009 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.692 5.796 -18.167 1.00 0.00 H new ATOM 136 N TYR A 9 -0.902 7.644 -10.477 1.00 0.00 N ATOM 137 CA TYR A 9 -0.575 8.183 -9.128 1.00 0.00 C ATOM 138 C TYR A 9 0.887 8.632 -9.098 1.00 0.00 C ATOM 139 O TYR A 9 1.763 7.963 -9.611 1.00 0.00 O ATOM 140 CB TYR A 9 -0.794 7.093 -8.077 1.00 0.00 C ATOM 141 CG TYR A 9 -0.233 7.551 -6.751 1.00 0.00 C ATOM 142 CD1 TYR A 9 -0.869 8.574 -6.038 1.00 0.00 C ATOM 143 CD2 TYR A 9 0.923 6.952 -6.236 1.00 0.00 C ATOM 144 CE1 TYR A 9 -0.349 8.999 -4.810 1.00 0.00 C ATOM 145 CE2 TYR A 9 1.442 7.377 -5.007 1.00 0.00 C ATOM 146 CZ TYR A 9 0.807 8.401 -4.295 1.00 0.00 C ATOM 147 OH TYR A 9 1.319 8.818 -3.083 1.00 0.00 O ATOM 0 H TYR A 9 -0.098 7.375 -11.044 1.00 0.00 H new ATOM 0 HA TYR A 9 -1.221 9.034 -8.911 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -1.858 6.876 -7.979 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -0.308 6.169 -8.390 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -1.761 9.035 -6.435 1.00 0.00 H new ATOM 0 HD2 TYR A 9 1.414 6.163 -6.786 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -0.840 9.788 -4.260 1.00 0.00 H new ATOM 0 HE2 TYR A 9 2.333 6.914 -4.608 1.00 0.00 H new ATOM 0 HH TYR A 9 2.123 8.299 -2.871 1.00 0.00 H new ATOM 157 N LYS A 10 1.160 9.761 -8.502 1.00 0.00 N ATOM 158 CA LYS A 10 2.566 10.251 -8.441 1.00 0.00 C ATOM 159 C LYS A 10 3.144 9.968 -7.052 1.00 0.00 C ATOM 160 O LYS A 10 2.781 10.598 -6.078 1.00 0.00 O ATOM 161 CB LYS A 10 2.594 11.756 -8.709 1.00 0.00 C ATOM 162 CG LYS A 10 3.840 12.108 -9.522 1.00 0.00 C ATOM 163 CD LYS A 10 4.072 13.620 -9.477 1.00 0.00 C ATOM 164 CE LYS A 10 5.249 13.985 -10.383 1.00 0.00 C ATOM 165 NZ LYS A 10 5.972 12.744 -10.781 1.00 0.00 N ATOM 0 H LYS A 10 0.470 10.365 -8.055 1.00 0.00 H new ATOM 0 HA LYS A 10 3.163 9.738 -9.195 1.00 0.00 H new ATOM 0 HB2 LYS A 10 1.697 12.056 -9.251 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.595 12.304 -7.767 1.00 0.00 H new ATOM 0 HG2 LYS A 10 4.708 11.585 -9.121 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.718 11.779 -10.554 1.00 0.00 H new ATOM 0 HD2 LYS A 10 3.174 14.146 -9.801 1.00 0.00 H new ATOM 0 HD3 LYS A 10 4.275 13.937 -8.454 1.00 0.00 H new ATOM 0 HE2 LYS A 10 4.891 14.510 -11.269 1.00 0.00 H new ATOM 0 HE3 LYS A 10 5.926 14.662 -9.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 6.855 12.998 -11.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 6.192 12.184 -9.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 5.373 12.183 -11.420 1.00 0.00 H new ATOM 179 N GLY A 11 4.042 9.026 -6.953 1.00 0.00 N ATOM 180 CA GLY A 11 4.641 8.705 -5.627 1.00 0.00 C ATOM 181 C GLY A 11 5.459 9.899 -5.133 1.00 0.00 C ATOM 182 O GLY A 11 5.216 11.029 -5.508 1.00 0.00 O ATOM 0 H GLY A 11 4.386 8.465 -7.732 1.00 0.00 H new ATOM 0 HA2 GLY A 11 3.856 8.467 -4.910 1.00 0.00 H new ATOM 0 HA3 GLY A 11 5.277 7.823 -5.707 1.00 0.00 H new ATOM 186 N GLU A 12 6.428 9.659 -4.292 1.00 0.00 N ATOM 187 CA GLU A 12 7.260 10.781 -3.774 1.00 0.00 C ATOM 188 C GLU A 12 7.991 11.453 -4.938 1.00 0.00 C ATOM 189 O GLU A 12 8.120 12.661 -4.987 1.00 0.00 O ATOM 190 CB GLU A 12 8.283 10.238 -2.775 1.00 0.00 C ATOM 191 CG GLU A 12 8.546 11.285 -1.691 1.00 0.00 C ATOM 192 CD GLU A 12 9.344 12.447 -2.286 1.00 0.00 C ATOM 193 OE1 GLU A 12 9.999 12.235 -3.293 1.00 0.00 O ATOM 194 OE2 GLU A 12 9.287 13.528 -1.723 1.00 0.00 O ATOM 0 H GLU A 12 6.679 8.735 -3.942 1.00 0.00 H new ATOM 0 HA GLU A 12 6.619 11.510 -3.278 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.913 9.317 -2.324 1.00 0.00 H new ATOM 0 HB3 GLU A 12 9.212 9.990 -3.289 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.602 11.649 -1.285 1.00 0.00 H new ATOM 0 HG3 GLU A 12 9.097 10.837 -0.864 1.00 0.00 H new ATOM 201 N ASN A 13 8.469 10.682 -5.875 1.00 0.00 N ATOM 202 CA ASN A 13 9.191 11.279 -7.034 1.00 0.00 C ATOM 203 C ASN A 13 8.928 10.440 -8.287 1.00 0.00 C ATOM 204 O ASN A 13 8.798 10.959 -9.378 1.00 0.00 O ATOM 205 CB ASN A 13 10.692 11.303 -6.742 1.00 0.00 C ATOM 206 CG ASN A 13 11.226 9.869 -6.691 1.00 0.00 C ATOM 207 OD1 ASN A 13 11.379 9.228 -7.710 1.00 0.00 O ATOM 208 ND2 ASN A 13 11.516 9.336 -5.534 1.00 0.00 N ATOM 0 H ASN A 13 8.391 9.665 -5.889 1.00 0.00 H new ATOM 0 HA ASN A 13 8.836 12.297 -7.198 1.00 0.00 H new ATOM 0 HB2 ASN A 13 11.214 11.869 -7.513 1.00 0.00 H new ATOM 0 HB3 ASN A 13 10.881 11.806 -5.794 1.00 0.00 H new ATOM 0 HD21 ASN A 13 11.871 8.381 -5.487 1.00 0.00 H new ATOM 0 HD22 ASN A 13 11.387 9.875 -4.678 1.00 0.00 H new ATOM 215 N THR A 14 8.849 9.146 -8.139 1.00 0.00 N ATOM 216 CA THR A 14 8.595 8.276 -9.323 1.00 0.00 C ATOM 217 C THR A 14 7.091 8.216 -9.599 1.00 0.00 C ATOM 218 O THR A 14 6.286 8.653 -8.802 1.00 0.00 O ATOM 219 CB THR A 14 9.118 6.865 -9.040 1.00 0.00 C ATOM 220 OG1 THR A 14 9.076 6.098 -10.236 1.00 0.00 O ATOM 221 CG2 THR A 14 8.247 6.199 -7.974 1.00 0.00 C ATOM 0 H THR A 14 8.949 8.654 -7.251 1.00 0.00 H new ATOM 0 HA THR A 14 9.108 8.687 -10.193 1.00 0.00 H new ATOM 0 HB THR A 14 10.145 6.924 -8.681 1.00 0.00 H new ATOM 0 HG1 THR A 14 9.431 5.201 -10.062 1.00 0.00 H new ATOM 0 HG21 THR A 14 8.621 5.195 -7.774 1.00 0.00 H new ATOM 0 HG22 THR A 14 8.280 6.788 -7.057 1.00 0.00 H new ATOM 0 HG23 THR A 14 7.218 6.139 -8.330 1.00 0.00 H new ATOM 229 N ASP A 15 6.706 7.678 -10.723 1.00 0.00 N ATOM 230 CA ASP A 15 5.255 7.591 -11.050 1.00 0.00 C ATOM 231 C ASP A 15 4.835 6.121 -11.118 1.00 0.00 C ATOM 232 O ASP A 15 5.528 5.293 -11.673 1.00 0.00 O ATOM 233 CB ASP A 15 4.995 8.259 -12.402 1.00 0.00 C ATOM 234 CG ASP A 15 3.500 8.200 -12.722 1.00 0.00 C ATOM 235 OD1 ASP A 15 2.723 8.026 -11.797 1.00 0.00 O ATOM 236 OD2 ASP A 15 3.158 8.333 -13.885 1.00 0.00 O ATOM 0 H ASP A 15 7.334 7.295 -11.430 1.00 0.00 H new ATOM 0 HA ASP A 15 4.678 8.099 -10.277 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.332 9.295 -12.378 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.565 7.756 -13.183 1.00 0.00 H new ATOM 241 N LEU A 16 3.703 5.792 -10.559 1.00 0.00 N ATOM 242 CA LEU A 16 3.240 4.376 -10.592 1.00 0.00 C ATOM 243 C LEU A 16 1.860 4.306 -11.249 1.00 0.00 C ATOM 244 O LEU A 16 1.100 5.253 -11.223 1.00 0.00 O ATOM 245 CB LEU A 16 3.153 3.833 -9.164 1.00 0.00 C ATOM 246 CG LEU A 16 4.559 3.727 -8.571 1.00 0.00 C ATOM 247 CD1 LEU A 16 4.463 3.603 -7.049 1.00 0.00 C ATOM 248 CD2 LEU A 16 5.259 2.490 -9.140 1.00 0.00 C ATOM 0 H LEU A 16 3.079 6.442 -10.081 1.00 0.00 H new ATOM 0 HA LEU A 16 3.947 3.777 -11.166 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.537 4.491 -8.551 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.672 2.855 -9.164 1.00 0.00 H new ATOM 0 HG LEU A 16 5.130 4.619 -8.827 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.465 3.527 -6.626 1.00 0.00 H new ATOM 0 HD12 LEU A 16 3.963 4.483 -6.643 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.892 2.711 -6.792 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.261 2.413 -8.718 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.688 1.598 -8.883 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.327 2.577 -10.224 1.00 0.00 H new ATOM 260 N ILE A 17 1.529 3.188 -11.837 1.00 0.00 N ATOM 261 CA ILE A 17 0.198 3.058 -12.494 1.00 0.00 C ATOM 262 C ILE A 17 -0.466 1.755 -12.043 1.00 0.00 C ATOM 263 O ILE A 17 0.185 0.746 -11.861 1.00 0.00 O ATOM 264 CB ILE A 17 0.379 3.038 -14.013 1.00 0.00 C ATOM 265 CG1 ILE A 17 1.094 4.317 -14.456 1.00 0.00 C ATOM 266 CG2 ILE A 17 -0.991 2.962 -14.689 1.00 0.00 C ATOM 267 CD1 ILE A 17 1.546 4.171 -15.910 1.00 0.00 C ATOM 0 H ILE A 17 2.123 2.360 -11.890 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.430 3.903 -12.214 1.00 0.00 H new ATOM 0 HB ILE A 17 0.973 2.170 -14.297 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.427 5.173 -14.356 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.954 4.507 -13.814 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -0.862 2.948 -15.771 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.503 2.053 -14.372 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.585 3.831 -14.406 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.055 5.082 -16.226 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.228 3.325 -15.996 1.00 0.00 H new ATOM 0 HD13 ILE A 17 0.677 4.002 -16.546 1.00 0.00 H new ATOM 279 N VAL A 18 -1.759 1.770 -11.861 1.00 0.00 N ATOM 280 CA VAL A 18 -2.463 0.531 -11.422 1.00 0.00 C ATOM 281 C VAL A 18 -3.707 0.318 -12.285 1.00 0.00 C ATOM 282 O VAL A 18 -4.284 1.254 -12.802 1.00 0.00 O ATOM 283 CB VAL A 18 -2.877 0.674 -9.956 1.00 0.00 C ATOM 284 CG1 VAL A 18 -1.671 0.408 -9.054 1.00 0.00 C ATOM 285 CG2 VAL A 18 -3.393 2.094 -9.710 1.00 0.00 C ATOM 0 H VAL A 18 -2.357 2.585 -11.997 1.00 0.00 H new ATOM 0 HA VAL A 18 -1.796 -0.324 -11.530 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.664 -0.046 -9.730 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.968 0.510 -8.010 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -1.302 -0.603 -9.229 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.883 1.126 -9.279 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -3.689 2.198 -8.666 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -2.605 2.812 -9.937 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -4.253 2.285 -10.351 1.00 0.00 H new ATOM 295 N PHE A 19 -4.127 -0.907 -12.444 1.00 0.00 N ATOM 296 CA PHE A 19 -5.335 -1.181 -13.273 1.00 0.00 C ATOM 297 C PHE A 19 -6.580 -1.142 -12.385 1.00 0.00 C ATOM 298 O PHE A 19 -6.517 -1.399 -11.199 1.00 0.00 O ATOM 299 CB PHE A 19 -5.210 -2.563 -13.917 1.00 0.00 C ATOM 300 CG PHE A 19 -4.654 -2.419 -15.313 1.00 0.00 C ATOM 301 CD1 PHE A 19 -5.348 -1.670 -16.270 1.00 0.00 C ATOM 302 CD2 PHE A 19 -3.443 -3.037 -15.651 1.00 0.00 C ATOM 303 CE1 PHE A 19 -4.833 -1.537 -17.565 1.00 0.00 C ATOM 304 CE2 PHE A 19 -2.928 -2.903 -16.946 1.00 0.00 C ATOM 305 CZ PHE A 19 -3.623 -2.153 -17.902 1.00 0.00 C ATOM 0 H PHE A 19 -3.686 -1.731 -12.035 1.00 0.00 H new ATOM 0 HA PHE A 19 -5.420 -0.425 -14.053 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.557 -3.198 -13.318 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -6.185 -3.050 -13.951 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.282 -1.194 -16.009 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.907 -3.616 -14.913 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -5.369 -0.959 -18.303 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.994 -3.378 -17.207 1.00 0.00 H new ATOM 0 HZ PHE A 19 -3.225 -2.050 -18.901 1.00 0.00 H new ATOM 315 N ALA A 20 -7.713 -0.822 -12.949 1.00 0.00 N ATOM 316 CA ALA A 20 -8.960 -0.767 -12.135 1.00 0.00 C ATOM 317 C ALA A 20 -10.106 -1.418 -12.912 1.00 0.00 C ATOM 318 O ALA A 20 -9.905 -2.015 -13.951 1.00 0.00 O ATOM 319 CB ALA A 20 -9.311 0.692 -11.837 1.00 0.00 C ATOM 0 H ALA A 20 -7.829 -0.597 -13.937 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.806 -1.303 -11.198 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.223 0.732 -11.242 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -8.495 1.157 -11.283 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -9.465 1.228 -12.774 1.00 0.00 H new ATOM 325 N ALA A 21 -11.309 -1.307 -12.417 1.00 0.00 N ATOM 326 CA ALA A 21 -12.467 -1.919 -13.127 1.00 0.00 C ATOM 327 C ALA A 21 -13.325 -0.815 -13.748 1.00 0.00 C ATOM 328 O ALA A 21 -13.397 -0.675 -14.953 1.00 0.00 O ATOM 329 CB ALA A 21 -13.309 -2.721 -12.133 1.00 0.00 C ATOM 0 H ALA A 21 -11.539 -0.819 -11.552 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.103 -2.582 -13.912 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.156 -3.169 -12.652 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -12.698 -3.507 -11.690 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -13.673 -2.059 -11.348 1.00 0.00 H new ATOM 335 N SER A 22 -13.977 -0.029 -12.936 1.00 0.00 N ATOM 336 CA SER A 22 -14.830 1.064 -13.481 1.00 0.00 C ATOM 337 C SER A 22 -14.937 2.190 -12.450 1.00 0.00 C ATOM 338 O SER A 22 -15.132 1.952 -11.275 1.00 0.00 O ATOM 339 CB SER A 22 -16.226 0.519 -13.787 1.00 0.00 C ATOM 340 OG SER A 22 -17.106 1.603 -14.051 1.00 0.00 O ATOM 0 H SER A 22 -13.956 -0.097 -11.918 1.00 0.00 H new ATOM 0 HA SER A 22 -14.383 1.450 -14.397 1.00 0.00 H new ATOM 0 HB2 SER A 22 -16.187 -0.150 -14.646 1.00 0.00 H new ATOM 0 HB3 SER A 22 -16.594 -0.066 -12.944 1.00 0.00 H new ATOM 0 HG SER A 22 -18.001 1.257 -14.249 1.00 0.00 H new ATOM 346 N GLU A 23 -14.809 3.415 -12.881 1.00 0.00 N ATOM 347 CA GLU A 23 -14.904 4.554 -11.925 1.00 0.00 C ATOM 348 C GLU A 23 -16.016 4.280 -10.912 1.00 0.00 C ATOM 349 O GLU A 23 -15.970 4.735 -9.786 1.00 0.00 O ATOM 350 CB GLU A 23 -15.219 5.840 -12.694 1.00 0.00 C ATOM 351 CG GLU A 23 -14.461 7.010 -12.066 1.00 0.00 C ATOM 352 CD GLU A 23 -15.014 8.328 -12.612 1.00 0.00 C ATOM 353 OE1 GLU A 23 -15.866 8.275 -13.484 1.00 0.00 O ATOM 354 OE2 GLU A 23 -14.577 9.368 -12.149 1.00 0.00 O ATOM 0 H GLU A 23 -14.643 3.676 -13.853 1.00 0.00 H new ATOM 0 HA GLU A 23 -13.956 4.667 -11.400 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -14.935 5.729 -13.741 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -16.291 6.035 -12.674 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -14.562 6.982 -10.981 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -13.397 6.930 -12.289 1.00 0.00 H new ATOM 361 N GLU A 24 -17.017 3.539 -11.301 1.00 0.00 N ATOM 362 CA GLU A 24 -18.131 3.236 -10.360 1.00 0.00 C ATOM 363 C GLU A 24 -17.592 2.443 -9.168 1.00 0.00 C ATOM 364 O GLU A 24 -17.405 2.973 -8.090 1.00 0.00 O ATOM 365 CB GLU A 24 -19.198 2.410 -11.081 1.00 0.00 C ATOM 366 CG GLU A 24 -20.332 2.077 -10.109 1.00 0.00 C ATOM 367 CD GLU A 24 -21.576 1.665 -10.897 1.00 0.00 C ATOM 368 OE1 GLU A 24 -22.291 2.547 -11.343 1.00 0.00 O ATOM 369 OE2 GLU A 24 -21.793 0.473 -11.041 1.00 0.00 O ATOM 0 H GLU A 24 -17.111 3.130 -12.231 1.00 0.00 H new ATOM 0 HA GLU A 24 -18.571 4.169 -10.007 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -19.588 2.966 -11.934 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -18.759 1.492 -11.472 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -20.028 1.271 -9.442 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -20.555 2.942 -9.484 1.00 0.00 H new ATOM 376 N LEU A 25 -17.339 1.176 -9.352 1.00 0.00 N ATOM 377 CA LEU A 25 -16.812 0.350 -8.229 1.00 0.00 C ATOM 378 C LEU A 25 -15.713 1.125 -7.499 1.00 0.00 C ATOM 379 O LEU A 25 -15.573 1.035 -6.295 1.00 0.00 O ATOM 380 CB LEU A 25 -16.234 -0.954 -8.783 1.00 0.00 C ATOM 381 CG LEU A 25 -17.352 -1.775 -9.426 1.00 0.00 C ATOM 382 CD1 LEU A 25 -16.771 -2.647 -10.540 1.00 0.00 C ATOM 383 CD2 LEU A 25 -18.001 -2.668 -8.367 1.00 0.00 C ATOM 0 H LEU A 25 -17.474 0.677 -10.231 1.00 0.00 H new ATOM 0 HA LEU A 25 -17.620 0.123 -7.534 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -15.459 -0.737 -9.518 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -15.764 -1.525 -7.982 1.00 0.00 H new ATOM 0 HG LEU A 25 -18.101 -1.103 -9.845 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -17.569 -3.232 -10.998 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -16.308 -2.012 -11.295 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -16.022 -3.320 -10.122 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -18.798 -3.254 -8.824 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -17.251 -3.340 -7.948 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -18.416 -2.048 -7.573 1.00 0.00 H new ATOM 395 N VAL A 26 -14.933 1.887 -8.216 1.00 0.00 N ATOM 396 CA VAL A 26 -13.845 2.665 -7.561 1.00 0.00 C ATOM 397 C VAL A 26 -14.454 3.659 -6.568 1.00 0.00 C ATOM 398 O VAL A 26 -14.142 3.648 -5.394 1.00 0.00 O ATOM 399 CB VAL A 26 -13.054 3.428 -8.624 1.00 0.00 C ATOM 400 CG1 VAL A 26 -11.824 4.074 -7.982 1.00 0.00 C ATOM 401 CG2 VAL A 26 -12.604 2.456 -9.718 1.00 0.00 C ATOM 0 H VAL A 26 -15.003 2.004 -9.227 1.00 0.00 H new ATOM 0 HA VAL A 26 -13.180 1.983 -7.031 1.00 0.00 H new ATOM 0 HB VAL A 26 -13.685 4.203 -9.059 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -11.261 4.618 -8.741 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -12.142 4.765 -7.201 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -11.192 3.300 -7.546 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -12.040 2.998 -10.477 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -11.973 1.682 -9.280 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -13.478 1.994 -10.177 1.00 0.00 H new ATOM 411 N ASP A 27 -15.321 4.517 -7.031 1.00 0.00 N ATOM 412 CA ASP A 27 -15.949 5.510 -6.113 1.00 0.00 C ATOM 413 C ASP A 27 -16.526 4.785 -4.895 1.00 0.00 C ATOM 414 O ASP A 27 -16.246 5.132 -3.764 1.00 0.00 O ATOM 415 CB ASP A 27 -17.071 6.246 -6.848 1.00 0.00 C ATOM 416 CG ASP A 27 -17.446 7.509 -6.073 1.00 0.00 C ATOM 417 OD1 ASP A 27 -17.239 7.527 -4.871 1.00 0.00 O ATOM 418 OD2 ASP A 27 -17.935 8.439 -6.694 1.00 0.00 O ATOM 0 H ASP A 27 -15.622 4.574 -8.004 1.00 0.00 H new ATOM 0 HA ASP A 27 -15.197 6.228 -5.786 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -16.749 6.507 -7.856 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -17.941 5.597 -6.949 1.00 0.00 H new ATOM 423 N GLU A 28 -17.329 3.780 -5.116 1.00 0.00 N ATOM 424 CA GLU A 28 -17.924 3.035 -3.971 1.00 0.00 C ATOM 425 C GLU A 28 -16.825 2.679 -2.968 1.00 0.00 C ATOM 426 O GLU A 28 -17.011 2.769 -1.770 1.00 0.00 O ATOM 427 CB GLU A 28 -18.581 1.752 -4.484 1.00 0.00 C ATOM 428 CG GLU A 28 -20.088 1.971 -4.624 1.00 0.00 C ATOM 429 CD GLU A 28 -20.690 2.282 -3.253 1.00 0.00 C ATOM 430 OE1 GLU A 28 -20.336 1.603 -2.304 1.00 0.00 O ATOM 431 OE2 GLU A 28 -21.495 3.196 -3.175 1.00 0.00 O ATOM 0 H GLU A 28 -17.599 3.443 -6.040 1.00 0.00 H new ATOM 0 HA GLU A 28 -18.674 3.657 -3.483 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -18.153 1.471 -5.446 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -18.385 0.930 -3.796 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -20.284 2.792 -5.313 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -20.557 1.082 -5.046 1.00 0.00 H new ATOM 438 N TYR A 29 -15.680 2.274 -3.445 1.00 0.00 N ATOM 439 CA TYR A 29 -14.571 1.912 -2.518 1.00 0.00 C ATOM 440 C TYR A 29 -14.117 3.158 -1.753 1.00 0.00 C ATOM 441 O TYR A 29 -14.163 3.204 -0.539 1.00 0.00 O ATOM 442 CB TYR A 29 -13.396 1.352 -3.322 1.00 0.00 C ATOM 443 CG TYR A 29 -12.397 0.720 -2.382 1.00 0.00 C ATOM 444 CD1 TYR A 29 -12.602 -0.584 -1.915 1.00 0.00 C ATOM 445 CD2 TYR A 29 -11.266 1.439 -1.976 1.00 0.00 C ATOM 446 CE1 TYR A 29 -11.676 -1.169 -1.043 1.00 0.00 C ATOM 447 CE2 TYR A 29 -10.340 0.853 -1.105 1.00 0.00 C ATOM 448 CZ TYR A 29 -10.545 -0.451 -0.638 1.00 0.00 C ATOM 449 OH TYR A 29 -9.632 -1.028 0.221 1.00 0.00 O ATOM 0 H TYR A 29 -15.465 2.178 -4.437 1.00 0.00 H new ATOM 0 HA TYR A 29 -14.920 1.159 -1.812 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -13.752 0.614 -4.041 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -12.920 2.149 -3.893 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -13.474 -1.139 -2.227 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -11.108 2.445 -2.335 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -11.835 -2.175 -0.683 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -9.467 1.407 -0.793 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.931 -0.378 0.438 1.00 0.00 H new ATOM 459 N LEU A 30 -13.680 4.168 -2.453 1.00 0.00 N ATOM 460 CA LEU A 30 -13.224 5.409 -1.765 1.00 0.00 C ATOM 461 C LEU A 30 -14.326 5.908 -0.827 1.00 0.00 C ATOM 462 O LEU A 30 -14.062 6.552 0.169 1.00 0.00 O ATOM 463 CB LEU A 30 -12.916 6.486 -2.807 1.00 0.00 C ATOM 464 CG LEU A 30 -11.923 5.936 -3.832 1.00 0.00 C ATOM 465 CD1 LEU A 30 -11.794 6.919 -4.997 1.00 0.00 C ATOM 466 CD2 LEU A 30 -10.557 5.750 -3.169 1.00 0.00 C ATOM 0 H LEU A 30 -13.619 4.188 -3.471 1.00 0.00 H new ATOM 0 HA LEU A 30 -12.325 5.194 -1.187 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -13.834 6.798 -3.305 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.501 7.369 -2.321 1.00 0.00 H new ATOM 0 HG LEU A 30 -12.281 4.976 -4.205 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -11.086 6.527 -5.727 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -12.767 7.052 -5.470 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -11.437 7.879 -4.625 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -9.849 5.358 -3.899 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -10.200 6.710 -2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -10.648 5.049 -2.339 1.00 0.00 H new ATOM 478 N LYS A 31 -15.559 5.617 -1.138 1.00 0.00 N ATOM 479 CA LYS A 31 -16.675 6.075 -0.264 1.00 0.00 C ATOM 480 C LYS A 31 -16.674 5.266 1.035 1.00 0.00 C ATOM 481 O LYS A 31 -17.178 5.703 2.050 1.00 0.00 O ATOM 482 CB LYS A 31 -18.008 5.873 -0.990 1.00 0.00 C ATOM 483 CG LYS A 31 -18.354 7.135 -1.783 1.00 0.00 C ATOM 484 CD LYS A 31 -19.269 8.031 -0.944 1.00 0.00 C ATOM 485 CE LYS A 31 -19.641 9.277 -1.749 1.00 0.00 C ATOM 486 NZ LYS A 31 -19.011 9.204 -3.097 1.00 0.00 N ATOM 0 H LYS A 31 -15.842 5.082 -1.959 1.00 0.00 H new ATOM 0 HA LYS A 31 -16.543 7.132 -0.033 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -17.943 5.016 -1.660 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -18.797 5.655 -0.270 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -17.443 7.673 -2.047 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -18.847 6.866 -2.717 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -20.169 7.486 -0.661 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -18.767 8.318 -0.020 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -20.724 9.351 -1.846 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -19.306 10.173 -1.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -19.291 10.035 -3.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -17.976 9.188 -2.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -19.325 8.339 -3.581 1.00 0.00 H new ATOM 500 N ASN A 32 -16.111 4.089 1.011 1.00 0.00 N ATOM 501 CA ASN A 32 -16.080 3.255 2.245 1.00 0.00 C ATOM 502 C ASN A 32 -14.981 2.197 2.119 1.00 0.00 C ATOM 503 O ASN A 32 -15.247 1.041 1.857 1.00 0.00 O ATOM 504 CB ASN A 32 -17.433 2.564 2.429 1.00 0.00 C ATOM 505 CG ASN A 32 -18.267 3.340 3.450 1.00 0.00 C ATOM 506 OD1 ASN A 32 -19.467 3.467 3.301 1.00 0.00 O ATOM 507 ND2 ASN A 32 -17.680 3.869 4.488 1.00 0.00 N ATOM 0 H ASN A 32 -15.672 3.670 0.191 1.00 0.00 H new ATOM 0 HA ASN A 32 -15.876 3.891 3.107 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -17.960 2.513 1.476 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -17.287 1.538 2.767 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -18.228 4.389 5.174 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -16.673 3.763 4.614 1.00 0.00 H new ATOM 514 N PRO A 33 -13.753 2.597 2.309 1.00 0.00 N ATOM 515 CA PRO A 33 -12.581 1.679 2.220 1.00 0.00 C ATOM 516 C PRO A 33 -12.760 0.428 3.085 1.00 0.00 C ATOM 517 O PRO A 33 -12.891 0.508 4.290 1.00 0.00 O ATOM 518 CB PRO A 33 -11.412 2.521 2.736 1.00 0.00 C ATOM 519 CG PRO A 33 -11.825 3.943 2.542 1.00 0.00 C ATOM 520 CD PRO A 33 -13.351 3.974 2.630 1.00 0.00 C ATOM 0 HA PRO A 33 -12.434 1.311 1.205 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -11.211 2.311 3.787 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -10.497 2.300 2.186 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -11.380 4.582 3.305 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -11.486 4.316 1.576 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -13.688 4.267 3.625 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -13.777 4.689 1.926 1.00 0.00 H new ATOM 528 N SER A 34 -12.766 -0.729 2.479 1.00 0.00 N ATOM 529 CA SER A 34 -12.936 -1.981 3.268 1.00 0.00 C ATOM 530 C SER A 34 -12.345 -3.159 2.490 1.00 0.00 C ATOM 531 O SER A 34 -12.501 -3.263 1.290 1.00 0.00 O ATOM 532 CB SER A 34 -14.426 -2.229 3.514 1.00 0.00 C ATOM 533 OG SER A 34 -15.162 -1.858 2.356 1.00 0.00 O ATOM 0 H SER A 34 -12.661 -0.860 1.473 1.00 0.00 H new ATOM 0 HA SER A 34 -12.421 -1.882 4.223 1.00 0.00 H new ATOM 0 HB2 SER A 34 -14.598 -3.280 3.747 1.00 0.00 H new ATOM 0 HB3 SER A 34 -14.765 -1.652 4.375 1.00 0.00 H new ATOM 0 HG SER A 34 -15.242 -0.882 2.318 1.00 0.00 H new ATOM 539 N ILE A 35 -11.667 -4.047 3.164 1.00 0.00 N ATOM 540 CA ILE A 35 -11.067 -5.216 2.463 1.00 0.00 C ATOM 541 C ILE A 35 -12.177 -6.058 1.832 1.00 0.00 C ATOM 542 O ILE A 35 -13.303 -6.062 2.290 1.00 0.00 O ATOM 543 CB ILE A 35 -10.289 -6.069 3.467 1.00 0.00 C ATOM 544 CG1 ILE A 35 -9.489 -7.136 2.715 1.00 0.00 C ATOM 545 CG2 ILE A 35 -11.267 -6.749 4.426 1.00 0.00 C ATOM 546 CD1 ILE A 35 -8.356 -6.468 1.933 1.00 0.00 C ATOM 0 H ILE A 35 -11.503 -4.013 4.170 1.00 0.00 H new ATOM 0 HA ILE A 35 -10.391 -4.864 1.684 1.00 0.00 H new ATOM 0 HB ILE A 35 -9.608 -5.433 4.033 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.081 -7.862 3.418 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -10.142 -7.683 2.034 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -10.712 -7.357 5.141 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -11.839 -5.991 4.961 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -11.948 -7.385 3.861 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -7.786 -7.228 1.398 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.775 -5.759 1.219 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -7.698 -5.941 2.624 1.00 0.00 H new ATOM 558 N GLY A 36 -11.871 -6.772 0.782 1.00 0.00 N ATOM 559 CA GLY A 36 -12.911 -7.612 0.124 1.00 0.00 C ATOM 560 C GLY A 36 -13.277 -7.004 -1.230 1.00 0.00 C ATOM 561 O GLY A 36 -12.812 -7.441 -2.265 1.00 0.00 O ATOM 0 H GLY A 36 -10.947 -6.809 0.352 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -12.541 -8.629 -0.010 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -13.796 -7.676 0.757 1.00 0.00 H new ATOM 565 N LYS A 37 -14.107 -5.998 -1.234 1.00 0.00 N ATOM 566 CA LYS A 37 -14.503 -5.362 -2.522 1.00 0.00 C ATOM 567 C LYS A 37 -13.247 -4.964 -3.301 1.00 0.00 C ATOM 568 O LYS A 37 -13.294 -4.711 -4.488 1.00 0.00 O ATOM 569 CB LYS A 37 -15.343 -4.114 -2.239 1.00 0.00 C ATOM 570 CG LYS A 37 -15.389 -3.234 -3.489 1.00 0.00 C ATOM 571 CD LYS A 37 -16.567 -2.263 -3.388 1.00 0.00 C ATOM 572 CE LYS A 37 -16.694 -1.475 -4.693 1.00 0.00 C ATOM 573 NZ LYS A 37 -18.134 -1.253 -5.001 1.00 0.00 N ATOM 0 H LYS A 37 -14.529 -5.588 -0.400 1.00 0.00 H new ATOM 0 HA LYS A 37 -15.089 -6.068 -3.111 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -16.353 -4.401 -1.947 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.916 -3.557 -1.405 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.456 -2.680 -3.591 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.491 -3.854 -4.380 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.488 -2.812 -3.191 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.418 -1.580 -2.552 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -16.178 -0.519 -4.604 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -16.217 -2.020 -5.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -18.227 -0.470 -5.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -18.538 -2.118 -5.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -18.644 -1.015 -4.126 1.00 0.00 H new ATOM 587 N LEU A 38 -12.122 -4.909 -2.641 1.00 0.00 N ATOM 588 CA LEU A 38 -10.864 -4.529 -3.344 1.00 0.00 C ATOM 589 C LEU A 38 -10.584 -5.531 -4.465 1.00 0.00 C ATOM 590 O LEU A 38 -10.288 -5.159 -5.583 1.00 0.00 O ATOM 591 CB LEU A 38 -9.701 -4.538 -2.349 1.00 0.00 C ATOM 592 CG LEU A 38 -8.497 -3.825 -2.965 1.00 0.00 C ATOM 593 CD1 LEU A 38 -8.582 -2.327 -2.668 1.00 0.00 C ATOM 594 CD2 LEU A 38 -7.209 -4.390 -2.363 1.00 0.00 C ATOM 0 H LEU A 38 -12.020 -5.111 -1.646 1.00 0.00 H new ATOM 0 HA LEU A 38 -10.972 -3.531 -3.768 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -9.996 -4.043 -1.424 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.437 -5.564 -2.091 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.496 -3.982 -4.044 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.723 -1.820 -3.108 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -9.500 -1.923 -3.095 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.584 -2.169 -1.589 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.349 -3.883 -2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.212 -4.233 -1.284 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.147 -5.458 -2.574 1.00 0.00 H new ATOM 606 N SER A 39 -10.675 -6.801 -4.176 1.00 0.00 N ATOM 607 CA SER A 39 -10.414 -7.824 -5.226 1.00 0.00 C ATOM 608 C SER A 39 -11.362 -7.599 -6.405 1.00 0.00 C ATOM 609 O SER A 39 -11.054 -7.927 -7.534 1.00 0.00 O ATOM 610 CB SER A 39 -10.644 -9.220 -4.646 1.00 0.00 C ATOM 611 OG SER A 39 -9.620 -9.513 -3.705 1.00 0.00 O ATOM 0 H SER A 39 -10.919 -7.173 -3.258 1.00 0.00 H new ATOM 0 HA SER A 39 -9.383 -7.738 -5.568 1.00 0.00 H new ATOM 0 HB2 SER A 39 -11.621 -9.270 -4.165 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.643 -9.962 -5.444 1.00 0.00 H new ATOM 0 HG SER A 39 -9.766 -10.407 -3.330 1.00 0.00 H new ATOM 617 N GLU A 40 -12.514 -7.040 -6.152 1.00 0.00 N ATOM 618 CA GLU A 40 -13.482 -6.794 -7.260 1.00 0.00 C ATOM 619 C GLU A 40 -13.059 -5.546 -8.036 1.00 0.00 C ATOM 620 O GLU A 40 -13.243 -5.456 -9.234 1.00 0.00 O ATOM 621 CB GLU A 40 -14.880 -6.582 -6.676 1.00 0.00 C ATOM 622 CG GLU A 40 -15.437 -7.920 -6.185 1.00 0.00 C ATOM 623 CD GLU A 40 -16.787 -7.692 -5.502 1.00 0.00 C ATOM 624 OE1 GLU A 40 -16.786 -7.249 -4.366 1.00 0.00 O ATOM 625 OE2 GLU A 40 -17.799 -7.963 -6.128 1.00 0.00 O ATOM 0 H GLU A 40 -12.827 -6.743 -5.228 1.00 0.00 H new ATOM 0 HA GLU A 40 -13.495 -7.653 -7.931 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -14.837 -5.870 -5.852 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.540 -6.156 -7.431 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -15.553 -8.607 -7.023 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -14.738 -8.383 -5.488 1.00 0.00 H new ATOM 632 N VAL A 41 -12.493 -4.580 -7.365 1.00 0.00 N ATOM 633 CA VAL A 41 -12.059 -3.339 -8.065 1.00 0.00 C ATOM 634 C VAL A 41 -10.760 -3.609 -8.827 1.00 0.00 C ATOM 635 O VAL A 41 -10.701 -3.493 -10.035 1.00 0.00 O ATOM 636 CB VAL A 41 -11.826 -2.229 -7.039 1.00 0.00 C ATOM 637 CG1 VAL A 41 -11.384 -0.953 -7.757 1.00 0.00 C ATOM 638 CG2 VAL A 41 -13.127 -1.959 -6.278 1.00 0.00 C ATOM 0 H VAL A 41 -12.313 -4.597 -6.361 1.00 0.00 H new ATOM 0 HA VAL A 41 -12.834 -3.029 -8.766 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.050 -2.539 -6.339 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.218 -0.162 -7.025 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -10.459 -1.144 -8.301 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -12.159 -0.642 -8.457 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -12.963 -1.168 -5.546 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.901 -1.649 -6.980 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -13.444 -2.867 -5.766 1.00 0.00 H new ATOM 648 N VAL A 42 -9.717 -3.971 -8.130 1.00 0.00 N ATOM 649 CA VAL A 42 -8.424 -4.248 -8.814 1.00 0.00 C ATOM 650 C VAL A 42 -8.461 -5.649 -9.428 1.00 0.00 C ATOM 651 O VAL A 42 -8.887 -6.600 -8.803 1.00 0.00 O ATOM 652 CB VAL A 42 -7.282 -4.165 -7.800 1.00 0.00 C ATOM 653 CG1 VAL A 42 -5.956 -4.478 -8.495 1.00 0.00 C ATOM 654 CG2 VAL A 42 -7.227 -2.754 -7.210 1.00 0.00 C ATOM 0 H VAL A 42 -9.706 -4.087 -7.117 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.265 -3.511 -9.601 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.452 -4.888 -7.002 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -5.143 -4.419 -7.771 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.994 -5.483 -8.916 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.784 -3.756 -9.294 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -6.413 -2.693 -6.487 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.057 -2.032 -8.009 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.171 -2.530 -6.713 1.00 0.00 H new ATOM 664 N GLU A 43 -8.016 -5.785 -10.647 1.00 0.00 N ATOM 665 CA GLU A 43 -8.026 -7.125 -11.299 1.00 0.00 C ATOM 666 C GLU A 43 -6.652 -7.777 -11.144 1.00 0.00 C ATOM 667 O GLU A 43 -6.533 -8.899 -10.693 1.00 0.00 O ATOM 668 CB GLU A 43 -8.352 -6.967 -12.786 1.00 0.00 C ATOM 669 CG GLU A 43 -9.633 -6.145 -12.944 1.00 0.00 C ATOM 670 CD GLU A 43 -9.650 -5.487 -14.324 1.00 0.00 C ATOM 671 OE1 GLU A 43 -9.017 -4.454 -14.475 1.00 0.00 O ATOM 672 OE2 GLU A 43 -10.296 -6.026 -15.208 1.00 0.00 O ATOM 0 H GLU A 43 -7.646 -5.026 -11.220 1.00 0.00 H new ATOM 0 HA GLU A 43 -8.781 -7.753 -10.827 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -7.526 -6.475 -13.300 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -8.477 -7.946 -13.248 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -10.506 -6.786 -12.824 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -9.688 -5.384 -12.166 1.00 0.00 H new ATOM 679 N LEU A 44 -5.611 -7.083 -11.516 1.00 0.00 N ATOM 680 CA LEU A 44 -4.244 -7.665 -11.390 1.00 0.00 C ATOM 681 C LEU A 44 -3.533 -7.041 -10.188 1.00 0.00 C ATOM 682 O LEU A 44 -3.566 -5.843 -9.988 1.00 0.00 O ATOM 683 CB LEU A 44 -3.446 -7.373 -12.663 1.00 0.00 C ATOM 684 CG LEU A 44 -3.567 -8.556 -13.625 1.00 0.00 C ATOM 685 CD1 LEU A 44 -5.044 -8.885 -13.847 1.00 0.00 C ATOM 686 CD2 LEU A 44 -2.920 -8.191 -14.963 1.00 0.00 C ATOM 0 H LEU A 44 -5.648 -6.139 -11.901 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.320 -8.743 -11.248 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -3.818 -6.465 -13.138 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.399 -7.197 -12.416 1.00 0.00 H new ATOM 0 HG LEU A 44 -3.062 -9.423 -13.200 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -5.130 -9.728 -14.533 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.506 -9.143 -12.894 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.550 -8.018 -14.273 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -3.005 -9.033 -15.650 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.426 -7.324 -15.387 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.867 -7.956 -14.806 1.00 0.00 H new ATOM 698 N PHE A 45 -2.889 -7.843 -9.386 1.00 0.00 N ATOM 699 CA PHE A 45 -2.176 -7.295 -8.197 1.00 0.00 C ATOM 700 C PHE A 45 -0.713 -7.033 -8.556 1.00 0.00 C ATOM 701 O PHE A 45 0.190 -7.588 -7.963 1.00 0.00 O ATOM 702 CB PHE A 45 -2.248 -8.303 -7.049 1.00 0.00 C ATOM 703 CG PHE A 45 -3.689 -8.502 -6.643 1.00 0.00 C ATOM 704 CD1 PHE A 45 -4.443 -7.416 -6.181 1.00 0.00 C ATOM 705 CD2 PHE A 45 -4.271 -9.773 -6.730 1.00 0.00 C ATOM 706 CE1 PHE A 45 -5.778 -7.601 -5.805 1.00 0.00 C ATOM 707 CE2 PHE A 45 -5.608 -9.956 -6.352 1.00 0.00 C ATOM 708 CZ PHE A 45 -6.361 -8.870 -5.891 1.00 0.00 C ATOM 0 H PHE A 45 -2.825 -8.854 -9.502 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.647 -6.361 -7.889 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -1.811 -9.253 -7.357 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.666 -7.945 -6.200 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -3.994 -6.436 -6.115 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.690 -10.610 -7.088 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -6.359 -6.763 -5.448 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -6.058 -10.936 -6.416 1.00 0.00 H new ATOM 0 HZ PHE A 45 -7.392 -9.012 -5.602 1.00 0.00 H new ATOM 718 N GLU A 46 -0.470 -6.193 -9.524 1.00 0.00 N ATOM 719 CA GLU A 46 0.935 -5.897 -9.921 1.00 0.00 C ATOM 720 C GLU A 46 1.072 -4.406 -10.237 1.00 0.00 C ATOM 721 O GLU A 46 0.373 -3.873 -11.076 1.00 0.00 O ATOM 722 CB GLU A 46 1.299 -6.717 -11.160 1.00 0.00 C ATOM 723 CG GLU A 46 2.811 -6.947 -11.194 1.00 0.00 C ATOM 724 CD GLU A 46 3.209 -7.530 -12.551 1.00 0.00 C ATOM 725 OE1 GLU A 46 2.413 -7.436 -13.470 1.00 0.00 O ATOM 726 OE2 GLU A 46 4.304 -8.059 -12.649 1.00 0.00 O ATOM 0 H GLU A 46 -1.185 -5.698 -10.058 1.00 0.00 H new ATOM 0 HA GLU A 46 1.606 -6.158 -9.103 1.00 0.00 H new ATOM 0 HB2 GLU A 46 0.775 -7.673 -11.143 1.00 0.00 H new ATOM 0 HB3 GLU A 46 0.980 -6.194 -12.062 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.336 -6.008 -11.022 1.00 0.00 H new ATOM 0 HG3 GLU A 46 3.104 -7.627 -10.394 1.00 0.00 H new ATOM 733 N VAL A 47 1.967 -3.728 -9.573 1.00 0.00 N ATOM 734 CA VAL A 47 2.147 -2.273 -9.837 1.00 0.00 C ATOM 735 C VAL A 47 3.005 -2.085 -11.090 1.00 0.00 C ATOM 736 O VAL A 47 3.976 -2.786 -11.301 1.00 0.00 O ATOM 737 CB VAL A 47 2.843 -1.620 -8.640 1.00 0.00 C ATOM 738 CG1 VAL A 47 2.661 -0.103 -8.709 1.00 0.00 C ATOM 739 CG2 VAL A 47 2.227 -2.148 -7.343 1.00 0.00 C ATOM 0 H VAL A 47 2.582 -4.119 -8.859 1.00 0.00 H new ATOM 0 HA VAL A 47 1.173 -1.808 -9.990 1.00 0.00 H new ATOM 0 HB VAL A 47 3.906 -1.860 -8.663 1.00 0.00 H new ATOM 0 HG11 VAL A 47 3.156 0.362 -7.857 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.098 0.274 -9.633 1.00 0.00 H new ATOM 0 HG13 VAL A 47 1.598 0.137 -8.686 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.722 -1.684 -6.490 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.164 -1.908 -7.321 1.00 0.00 H new ATOM 0 HG23 VAL A 47 2.356 -3.229 -7.293 1.00 0.00 H new ATOM 749 N PHE A 48 2.655 -1.143 -11.923 1.00 0.00 N ATOM 750 CA PHE A 48 3.452 -0.912 -13.161 1.00 0.00 C ATOM 751 C PHE A 48 4.049 0.496 -13.127 1.00 0.00 C ATOM 752 O PHE A 48 3.776 1.276 -12.236 1.00 0.00 O ATOM 753 CB PHE A 48 2.543 -1.050 -14.386 1.00 0.00 C ATOM 754 CG PHE A 48 1.694 -2.290 -14.244 1.00 0.00 C ATOM 755 CD1 PHE A 48 2.184 -3.527 -14.679 1.00 0.00 C ATOM 756 CD2 PHE A 48 0.417 -2.203 -13.679 1.00 0.00 C ATOM 757 CE1 PHE A 48 1.397 -4.677 -14.548 1.00 0.00 C ATOM 758 CE2 PHE A 48 -0.371 -3.353 -13.548 1.00 0.00 C ATOM 759 CZ PHE A 48 0.119 -4.591 -13.984 1.00 0.00 C ATOM 0 H PHE A 48 1.853 -0.525 -11.800 1.00 0.00 H new ATOM 0 HA PHE A 48 4.255 -1.647 -13.219 1.00 0.00 H new ATOM 0 HB2 PHE A 48 1.907 -0.170 -14.482 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.144 -1.109 -15.293 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.169 -3.594 -15.116 1.00 0.00 H new ATOM 0 HD2 PHE A 48 0.039 -1.248 -13.344 1.00 0.00 H new ATOM 0 HE1 PHE A 48 1.776 -5.631 -14.882 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -1.356 -3.286 -13.111 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.489 -5.478 -13.885 1.00 0.00 H new ATOM 769 N THR A 49 4.864 0.828 -14.090 1.00 0.00 N ATOM 770 CA THR A 49 5.479 2.185 -14.112 1.00 0.00 C ATOM 771 C THR A 49 6.147 2.420 -15.468 1.00 0.00 C ATOM 772 O THR A 49 6.517 1.490 -16.158 1.00 0.00 O ATOM 773 CB THR A 49 6.528 2.288 -13.002 1.00 0.00 C ATOM 774 OG1 THR A 49 7.662 2.992 -13.489 1.00 0.00 O ATOM 775 CG2 THR A 49 6.947 0.885 -12.562 1.00 0.00 C ATOM 0 H THR A 49 5.131 0.218 -14.863 1.00 0.00 H new ATOM 0 HA THR A 49 4.706 2.937 -13.952 1.00 0.00 H new ATOM 0 HB THR A 49 6.106 2.822 -12.151 1.00 0.00 H new ATOM 0 HG1 THR A 49 8.334 3.060 -12.779 1.00 0.00 H new ATOM 0 HG21 THR A 49 7.694 0.959 -11.772 1.00 0.00 H new ATOM 0 HG22 THR A 49 6.076 0.346 -12.189 1.00 0.00 H new ATOM 0 HG23 THR A 49 7.370 0.348 -13.411 1.00 0.00 H new ATOM 783 N PRO A 50 6.297 3.660 -15.845 1.00 0.00 N ATOM 784 CA PRO A 50 6.931 4.041 -17.140 1.00 0.00 C ATOM 785 C PRO A 50 8.433 3.744 -17.158 1.00 0.00 C ATOM 786 O PRO A 50 9.252 4.620 -16.960 1.00 0.00 O ATOM 787 CB PRO A 50 6.683 5.547 -17.245 1.00 0.00 C ATOM 788 CG PRO A 50 6.468 6.018 -15.844 1.00 0.00 C ATOM 789 CD PRO A 50 5.879 4.838 -15.071 1.00 0.00 C ATOM 0 HA PRO A 50 6.515 3.475 -17.973 1.00 0.00 H new ATOM 0 HB2 PRO A 50 7.533 6.053 -17.702 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.813 5.759 -17.867 1.00 0.00 H new ATOM 0 HG2 PRO A 50 7.407 6.344 -15.397 1.00 0.00 H new ATOM 0 HG3 PRO A 50 5.791 6.872 -15.822 1.00 0.00 H new ATOM 0 HD2 PRO A 50 6.259 4.800 -14.050 1.00 0.00 H new ATOM 0 HD3 PRO A 50 4.793 4.907 -15.004 1.00 0.00 H new ATOM 797 N GLN A 51 8.801 2.514 -17.395 1.00 0.00 N ATOM 798 CA GLN A 51 10.249 2.163 -17.426 1.00 0.00 C ATOM 799 C GLN A 51 10.579 1.480 -18.755 1.00 0.00 C ATOM 800 O GLN A 51 11.673 1.599 -19.270 1.00 0.00 O ATOM 801 CB GLN A 51 10.567 1.211 -16.270 1.00 0.00 C ATOM 802 CG GLN A 51 12.008 1.437 -15.805 1.00 0.00 C ATOM 803 CD GLN A 51 12.313 0.516 -14.622 1.00 0.00 C ATOM 804 OE1 GLN A 51 11.785 -0.574 -14.534 1.00 0.00 O ATOM 805 NE2 GLN A 51 13.149 0.912 -13.702 1.00 0.00 N ATOM 0 H GLN A 51 8.162 1.738 -17.568 1.00 0.00 H new ATOM 0 HA GLN A 51 10.846 3.069 -17.325 1.00 0.00 H new ATOM 0 HB2 GLN A 51 9.876 1.381 -15.444 1.00 0.00 H new ATOM 0 HB3 GLN A 51 10.434 0.177 -16.589 1.00 0.00 H new ATOM 0 HG2 GLN A 51 12.701 1.238 -16.623 1.00 0.00 H new ATOM 0 HG3 GLN A 51 12.149 2.478 -15.515 1.00 0.00 H new ATOM 0 HE21 GLN A 51 13.593 1.828 -13.776 1.00 0.00 H new ATOM 0 HE22 GLN A 51 13.359 0.306 -12.909 1.00 0.00 H new ATOM 814 N ASP A 52 9.641 0.765 -19.314 1.00 0.00 N ATOM 815 CA ASP A 52 9.903 0.076 -20.609 1.00 0.00 C ATOM 816 C ASP A 52 9.023 0.691 -21.699 1.00 0.00 C ATOM 817 O ASP A 52 8.840 1.890 -21.761 1.00 0.00 O ATOM 818 CB ASP A 52 9.577 -1.413 -20.469 1.00 0.00 C ATOM 819 CG ASP A 52 10.403 -2.213 -21.476 1.00 0.00 C ATOM 820 OD1 ASP A 52 11.618 -2.101 -21.438 1.00 0.00 O ATOM 821 OD2 ASP A 52 9.809 -2.925 -22.268 1.00 0.00 O ATOM 0 H ASP A 52 8.706 0.628 -18.930 1.00 0.00 H new ATOM 0 HA ASP A 52 10.952 0.194 -20.879 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.794 -1.750 -19.455 1.00 0.00 H new ATOM 0 HB3 ASP A 52 8.514 -1.581 -20.640 1.00 0.00 H new ATOM 826 N GLY A 53 8.476 -0.122 -22.562 1.00 0.00 N ATOM 827 CA GLY A 53 7.609 0.416 -23.648 1.00 0.00 C ATOM 828 C GLY A 53 6.680 -0.687 -24.156 1.00 0.00 C ATOM 829 O GLY A 53 6.993 -1.391 -25.097 1.00 0.00 O ATOM 0 H GLY A 53 8.592 -1.135 -22.561 1.00 0.00 H new ATOM 0 HA2 GLY A 53 7.023 1.257 -23.277 1.00 0.00 H new ATOM 0 HA3 GLY A 53 8.224 0.793 -24.465 1.00 0.00 H new ATOM 833 N ARG A 54 5.539 -0.845 -23.543 1.00 0.00 N ATOM 834 CA ARG A 54 4.591 -1.903 -23.991 1.00 0.00 C ATOM 835 C ARG A 54 3.195 -1.604 -23.443 1.00 0.00 C ATOM 836 O ARG A 54 2.520 -2.473 -22.929 1.00 0.00 O ATOM 837 CB ARG A 54 5.063 -3.263 -23.472 1.00 0.00 C ATOM 838 CG ARG A 54 5.548 -3.119 -22.028 1.00 0.00 C ATOM 839 CD ARG A 54 5.743 -4.505 -21.414 1.00 0.00 C ATOM 840 NE ARG A 54 6.220 -5.451 -22.462 1.00 0.00 N ATOM 841 CZ ARG A 54 6.734 -6.600 -22.119 1.00 0.00 C ATOM 842 NH1 ARG A 54 6.831 -6.922 -20.858 1.00 0.00 N ATOM 843 NH2 ARG A 54 7.151 -7.429 -23.037 1.00 0.00 N ATOM 0 H ARG A 54 5.222 -0.286 -22.751 1.00 0.00 H new ATOM 0 HA ARG A 54 4.556 -1.922 -25.080 1.00 0.00 H new ATOM 0 HB2 ARG A 54 4.249 -3.986 -23.523 1.00 0.00 H new ATOM 0 HB3 ARG A 54 5.868 -3.645 -24.101 1.00 0.00 H new ATOM 0 HG2 ARG A 54 6.485 -2.563 -22.002 1.00 0.00 H new ATOM 0 HG3 ARG A 54 4.824 -2.550 -21.445 1.00 0.00 H new ATOM 0 HD2 ARG A 54 6.465 -4.455 -20.599 1.00 0.00 H new ATOM 0 HD3 ARG A 54 4.805 -4.861 -20.988 1.00 0.00 H new ATOM 0 HE ARG A 54 6.145 -5.200 -23.448 1.00 0.00 H new ATOM 0 HH11 ARG A 54 6.505 -6.275 -20.140 1.00 0.00 H new ATOM 0 HH12 ARG A 54 7.233 -7.821 -20.591 1.00 0.00 H new ATOM 0 HH21 ARG A 54 7.075 -7.179 -24.023 1.00 0.00 H new ATOM 0 HH22 ARG A 54 7.553 -8.327 -22.768 1.00 0.00 H new ATOM 857 N GLY A 55 2.757 -0.378 -23.548 1.00 0.00 N ATOM 858 CA GLY A 55 1.404 -0.026 -23.032 1.00 0.00 C ATOM 859 C GLY A 55 1.417 1.409 -22.502 1.00 0.00 C ATOM 860 O GLY A 55 2.461 1.976 -22.243 1.00 0.00 O ATOM 0 H GLY A 55 3.277 0.393 -23.968 1.00 0.00 H new ATOM 0 HA2 GLY A 55 0.663 -0.125 -23.826 1.00 0.00 H new ATOM 0 HA3 GLY A 55 1.115 -0.715 -22.239 1.00 0.00 H new ATOM 864 N ALA A 56 0.267 2.002 -22.338 1.00 0.00 N ATOM 865 CA ALA A 56 0.215 3.400 -21.825 1.00 0.00 C ATOM 866 C ALA A 56 0.643 4.366 -22.932 1.00 0.00 C ATOM 867 O ALA A 56 0.807 3.983 -24.073 1.00 0.00 O ATOM 868 CB ALA A 56 1.163 3.541 -20.632 1.00 0.00 C ATOM 0 H ALA A 56 -0.639 1.579 -22.537 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.802 3.634 -21.511 1.00 0.00 H new ATOM 0 HB1 ALA A 56 1.125 4.564 -20.256 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.860 2.853 -19.843 1.00 0.00 H new ATOM 0 HB3 ALA A 56 2.180 3.307 -20.946 1.00 0.00 H new ATOM 874 N GLU A 57 0.824 5.615 -22.604 1.00 0.00 N ATOM 875 CA GLU A 57 1.241 6.604 -23.638 1.00 0.00 C ATOM 876 C GLU A 57 2.417 6.041 -24.437 1.00 0.00 C ATOM 877 O GLU A 57 2.743 6.522 -25.504 1.00 0.00 O ATOM 878 CB GLU A 57 1.663 7.908 -22.957 1.00 0.00 C ATOM 879 CG GLU A 57 1.264 7.865 -21.480 1.00 0.00 C ATOM 880 CD GLU A 57 -0.243 7.624 -21.364 1.00 0.00 C ATOM 881 OE1 GLU A 57 -0.991 8.557 -21.603 1.00 0.00 O ATOM 882 OE2 GLU A 57 -0.622 6.510 -21.041 1.00 0.00 O ATOM 0 H GLU A 57 0.701 5.994 -21.665 1.00 0.00 H new ATOM 0 HA GLU A 57 0.406 6.800 -24.311 1.00 0.00 H new ATOM 0 HB2 GLU A 57 2.740 8.047 -23.050 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.188 8.757 -23.448 1.00 0.00 H new ATOM 0 HG2 GLU A 57 1.810 7.073 -20.968 1.00 0.00 H new ATOM 0 HG3 GLU A 57 1.531 8.803 -20.993 1.00 0.00 H new ATOM 889 N GLY A 58 3.059 5.024 -23.930 1.00 0.00 N ATOM 890 CA GLY A 58 4.214 4.431 -24.660 1.00 0.00 C ATOM 891 C GLY A 58 5.319 4.072 -23.665 1.00 0.00 C ATOM 892 O GLY A 58 6.378 3.609 -24.039 1.00 0.00 O ATOM 0 H GLY A 58 2.833 4.578 -23.041 1.00 0.00 H new ATOM 0 HA2 GLY A 58 3.896 3.541 -25.203 1.00 0.00 H new ATOM 0 HA3 GLY A 58 4.592 5.137 -25.399 1.00 0.00 H new ATOM 896 N GLU A 59 5.081 4.280 -22.399 1.00 0.00 N ATOM 897 CA GLU A 59 6.117 3.950 -21.381 1.00 0.00 C ATOM 898 C GLU A 59 5.478 3.151 -20.243 1.00 0.00 C ATOM 899 O GLU A 59 4.692 3.668 -19.474 1.00 0.00 O ATOM 900 CB GLU A 59 6.715 5.243 -20.824 1.00 0.00 C ATOM 901 CG GLU A 59 7.193 6.125 -21.978 1.00 0.00 C ATOM 902 CD GLU A 59 7.263 7.582 -21.515 1.00 0.00 C ATOM 903 OE1 GLU A 59 8.029 7.857 -20.606 1.00 0.00 O ATOM 904 OE2 GLU A 59 6.549 8.396 -22.075 1.00 0.00 O ATOM 0 H GLU A 59 4.213 4.665 -22.026 1.00 0.00 H new ATOM 0 HA GLU A 59 6.905 3.356 -21.844 1.00 0.00 H new ATOM 0 HB2 GLU A 59 5.970 5.774 -20.231 1.00 0.00 H new ATOM 0 HB3 GLU A 59 7.548 5.014 -20.159 1.00 0.00 H new ATOM 0 HG2 GLU A 59 8.174 5.794 -22.320 1.00 0.00 H new ATOM 0 HG3 GLU A 59 6.513 6.034 -22.825 1.00 0.00 H new ATOM 911 N LEU A 60 5.809 1.894 -20.130 1.00 0.00 N ATOM 912 CA LEU A 60 5.219 1.065 -19.041 1.00 0.00 C ATOM 913 C LEU A 60 6.230 0.005 -18.603 1.00 0.00 C ATOM 914 O LEU A 60 7.079 -0.412 -19.367 1.00 0.00 O ATOM 915 CB LEU A 60 3.951 0.378 -19.553 1.00 0.00 C ATOM 916 CG LEU A 60 3.330 -0.453 -18.429 1.00 0.00 C ATOM 917 CD1 LEU A 60 1.816 -0.239 -18.410 1.00 0.00 C ATOM 918 CD2 LEU A 60 3.632 -1.935 -18.665 1.00 0.00 C ATOM 0 H LEU A 60 6.461 1.406 -20.743 1.00 0.00 H new ATOM 0 HA LEU A 60 4.970 1.703 -18.193 1.00 0.00 H new ATOM 0 HB2 LEU A 60 3.238 1.123 -19.905 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.189 -0.261 -20.403 1.00 0.00 H new ATOM 0 HG LEU A 60 3.752 -0.142 -17.473 1.00 0.00 H new ATOM 0 HD11 LEU A 60 1.375 -0.832 -17.609 1.00 0.00 H new ATOM 0 HD12 LEU A 60 1.600 0.816 -18.242 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.393 -0.549 -19.366 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.190 -2.528 -17.865 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.210 -2.244 -19.621 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.711 -2.089 -18.677 1.00 0.00 H new ATOM 930 N GLY A 61 6.148 -0.436 -17.377 1.00 0.00 N ATOM 931 CA GLY A 61 7.107 -1.469 -16.890 1.00 0.00 C ATOM 932 C GLY A 61 6.566 -2.102 -15.607 1.00 0.00 C ATOM 933 O GLY A 61 5.379 -2.095 -15.352 1.00 0.00 O ATOM 0 H GLY A 61 5.459 -0.126 -16.692 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.252 -2.234 -17.653 1.00 0.00 H new ATOM 0 HA3 GLY A 61 8.081 -1.017 -16.703 1.00 0.00 H new ATOM 937 N ALA A 62 7.430 -2.650 -14.796 1.00 0.00 N ATOM 938 CA ALA A 62 6.963 -3.282 -13.530 1.00 0.00 C ATOM 939 C ALA A 62 7.759 -2.713 -12.353 1.00 0.00 C ATOM 940 O ALA A 62 8.960 -2.874 -12.268 1.00 0.00 O ATOM 941 CB ALA A 62 7.178 -4.795 -13.606 1.00 0.00 C ATOM 0 H ALA A 62 8.437 -2.687 -14.955 1.00 0.00 H new ATOM 0 HA ALA A 62 5.903 -3.072 -13.388 1.00 0.00 H new ATOM 0 HB1 ALA A 62 6.837 -5.258 -12.680 1.00 0.00 H new ATOM 0 HB2 ALA A 62 6.613 -5.201 -14.445 1.00 0.00 H new ATOM 0 HB3 ALA A 62 8.238 -5.005 -13.747 1.00 0.00 H new ATOM 947 N ALA A 63 7.098 -2.049 -11.445 1.00 0.00 N ATOM 948 CA ALA A 63 7.818 -1.469 -10.275 1.00 0.00 C ATOM 949 C ALA A 63 8.614 -2.569 -9.570 1.00 0.00 C ATOM 950 O ALA A 63 8.511 -3.734 -9.901 1.00 0.00 O ATOM 951 CB ALA A 63 6.804 -0.866 -9.300 1.00 0.00 C ATOM 0 H ALA A 63 6.092 -1.883 -11.462 1.00 0.00 H new ATOM 0 HA ALA A 63 8.500 -0.690 -10.617 1.00 0.00 H new ATOM 0 HB1 ALA A 63 7.330 -0.442 -8.444 1.00 0.00 H new ATOM 0 HB2 ALA A 63 6.237 -0.082 -9.803 1.00 0.00 H new ATOM 0 HB3 ALA A 63 6.122 -1.644 -8.957 1.00 0.00 H new ATOM 957 N SER A 64 9.408 -2.210 -8.598 1.00 0.00 N ATOM 958 CA SER A 64 10.209 -3.236 -7.872 1.00 0.00 C ATOM 959 C SER A 64 9.981 -3.090 -6.366 1.00 0.00 C ATOM 960 O SER A 64 9.756 -2.005 -5.865 1.00 0.00 O ATOM 961 CB SER A 64 11.693 -3.037 -8.185 1.00 0.00 C ATOM 962 OG SER A 64 12.102 -3.997 -9.150 1.00 0.00 O ATOM 0 H SER A 64 9.536 -1.251 -8.276 1.00 0.00 H new ATOM 0 HA SER A 64 9.900 -4.232 -8.191 1.00 0.00 H new ATOM 0 HB2 SER A 64 11.865 -2.029 -8.562 1.00 0.00 H new ATOM 0 HB3 SER A 64 12.286 -3.143 -7.276 1.00 0.00 H new ATOM 0 HG SER A 64 13.052 -3.871 -9.354 1.00 0.00 H new ATOM 968 N LYS A 65 10.040 -4.172 -5.640 1.00 0.00 N ATOM 969 CA LYS A 65 9.826 -4.094 -4.167 1.00 0.00 C ATOM 970 C LYS A 65 10.644 -2.935 -3.595 1.00 0.00 C ATOM 971 O LYS A 65 10.304 -2.366 -2.577 1.00 0.00 O ATOM 972 CB LYS A 65 10.273 -5.405 -3.518 1.00 0.00 C ATOM 973 CG LYS A 65 10.431 -6.481 -4.594 1.00 0.00 C ATOM 974 CD LYS A 65 10.683 -7.835 -3.929 1.00 0.00 C ATOM 975 CE LYS A 65 10.406 -8.957 -4.932 1.00 0.00 C ATOM 976 NZ LYS A 65 8.935 -9.114 -5.109 1.00 0.00 N ATOM 0 H LYS A 65 10.227 -5.107 -6.003 1.00 0.00 H new ATOM 0 HA LYS A 65 8.769 -3.929 -3.960 1.00 0.00 H new ATOM 0 HB2 LYS A 65 11.217 -5.260 -2.993 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.541 -5.723 -2.775 1.00 0.00 H new ATOM 0 HG2 LYS A 65 9.533 -6.528 -5.211 1.00 0.00 H new ATOM 0 HG3 LYS A 65 11.260 -6.229 -5.256 1.00 0.00 H new ATOM 0 HD2 LYS A 65 11.713 -7.893 -3.578 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.041 -7.948 -3.055 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.876 -8.728 -5.889 1.00 0.00 H new ATOM 0 HE3 LYS A 65 10.842 -9.891 -4.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.730 -10.062 -5.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.460 -8.996 -4.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.587 -8.394 -5.774 1.00 0.00 H new ATOM 990 N ALA A 66 11.723 -2.582 -4.240 1.00 0.00 N ATOM 991 CA ALA A 66 12.561 -1.459 -3.732 1.00 0.00 C ATOM 992 C ALA A 66 11.840 -0.133 -3.975 1.00 0.00 C ATOM 993 O ALA A 66 11.716 0.689 -3.089 1.00 0.00 O ATOM 994 CB ALA A 66 13.903 -1.453 -4.466 1.00 0.00 C ATOM 0 H ALA A 66 12.060 -3.023 -5.096 1.00 0.00 H new ATOM 0 HA ALA A 66 12.732 -1.588 -2.663 1.00 0.00 H new ATOM 0 HB1 ALA A 66 14.517 -0.632 -4.095 1.00 0.00 H new ATOM 0 HB2 ALA A 66 14.417 -2.398 -4.292 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.733 -1.325 -5.535 1.00 0.00 H new ATOM 1000 N GLN A 67 11.363 0.084 -5.170 1.00 0.00 N ATOM 1001 CA GLN A 67 10.649 1.357 -5.469 1.00 0.00 C ATOM 1002 C GLN A 67 9.396 1.457 -4.597 1.00 0.00 C ATOM 1003 O GLN A 67 9.156 2.456 -3.948 1.00 0.00 O ATOM 1004 CB GLN A 67 10.248 1.383 -6.945 1.00 0.00 C ATOM 1005 CG GLN A 67 9.399 2.625 -7.223 1.00 0.00 C ATOM 1006 CD GLN A 67 9.422 2.936 -8.720 1.00 0.00 C ATOM 1007 OE1 GLN A 67 10.135 3.818 -9.159 1.00 0.00 O ATOM 1008 NE2 GLN A 67 8.667 2.245 -9.530 1.00 0.00 N ATOM 0 H GLN A 67 11.437 -0.566 -5.953 1.00 0.00 H new ATOM 0 HA GLN A 67 11.306 2.200 -5.257 1.00 0.00 H new ATOM 0 HB2 GLN A 67 11.138 1.390 -7.574 1.00 0.00 H new ATOM 0 HB3 GLN A 67 9.687 0.483 -7.196 1.00 0.00 H new ATOM 0 HG2 GLN A 67 8.374 2.459 -6.891 1.00 0.00 H new ATOM 0 HG3 GLN A 67 9.783 3.475 -6.659 1.00 0.00 H new ATOM 0 HE21 GLN A 67 8.069 1.505 -9.163 1.00 0.00 H new ATOM 0 HE22 GLN A 67 8.675 2.445 -10.530 1.00 0.00 H new ATOM 1017 N VAL A 68 8.592 0.429 -4.579 1.00 0.00 N ATOM 1018 CA VAL A 68 7.355 0.466 -3.749 1.00 0.00 C ATOM 1019 C VAL A 68 7.732 0.661 -2.280 1.00 0.00 C ATOM 1020 O VAL A 68 6.929 1.092 -1.475 1.00 0.00 O ATOM 1021 CB VAL A 68 6.594 -0.852 -3.909 1.00 0.00 C ATOM 1022 CG1 VAL A 68 5.249 -0.757 -3.187 1.00 0.00 C ATOM 1023 CG2 VAL A 68 6.354 -1.123 -5.396 1.00 0.00 C ATOM 0 H VAL A 68 8.738 -0.434 -5.103 1.00 0.00 H new ATOM 0 HA VAL A 68 6.724 1.293 -4.075 1.00 0.00 H new ATOM 0 HB VAL A 68 7.180 -1.664 -3.479 1.00 0.00 H new ATOM 0 HG11 VAL A 68 4.708 -1.696 -3.301 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.418 -0.562 -2.128 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.662 0.055 -3.616 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.812 -2.062 -5.512 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.768 -0.310 -5.824 1.00 0.00 H new ATOM 0 HG23 VAL A 68 7.311 -1.191 -5.913 1.00 0.00 H new ATOM 1033 N GLU A 69 8.947 0.348 -1.922 1.00 0.00 N ATOM 1034 CA GLU A 69 9.373 0.518 -0.505 1.00 0.00 C ATOM 1035 C GLU A 69 9.643 1.997 -0.226 1.00 0.00 C ATOM 1036 O GLU A 69 9.556 2.454 0.896 1.00 0.00 O ATOM 1037 CB GLU A 69 10.650 -0.289 -0.257 1.00 0.00 C ATOM 1038 CG GLU A 69 10.280 -1.712 0.168 1.00 0.00 C ATOM 1039 CD GLU A 69 11.385 -2.677 -0.264 1.00 0.00 C ATOM 1040 OE1 GLU A 69 12.526 -2.250 -0.330 1.00 0.00 O ATOM 1041 OE2 GLU A 69 11.072 -3.828 -0.523 1.00 0.00 O ATOM 0 H GLU A 69 9.663 -0.018 -2.550 1.00 0.00 H new ATOM 0 HA GLU A 69 8.583 0.163 0.157 1.00 0.00 H new ATOM 0 HB2 GLU A 69 11.258 -0.315 -1.161 1.00 0.00 H new ATOM 0 HB3 GLU A 69 11.250 0.189 0.517 1.00 0.00 H new ATOM 0 HG2 GLU A 69 10.145 -1.757 1.249 1.00 0.00 H new ATOM 0 HG3 GLU A 69 9.332 -2.003 -0.284 1.00 0.00 H new ATOM 1048 N ASN A 70 9.969 2.752 -1.240 1.00 0.00 N ATOM 1049 CA ASN A 70 10.244 4.201 -1.032 1.00 0.00 C ATOM 1050 C ASN A 70 8.919 4.959 -0.919 1.00 0.00 C ATOM 1051 O ASN A 70 8.857 6.039 -0.365 1.00 0.00 O ATOM 1052 CB ASN A 70 11.041 4.744 -2.220 1.00 0.00 C ATOM 1053 CG ASN A 70 12.400 4.044 -2.286 1.00 0.00 C ATOM 1054 OD1 ASN A 70 12.475 2.833 -2.233 1.00 0.00 O ATOM 1055 ND2 ASN A 70 13.485 4.761 -2.401 1.00 0.00 N ATOM 0 H ASN A 70 10.057 2.427 -2.203 1.00 0.00 H new ATOM 0 HA ASN A 70 10.820 4.335 -0.116 1.00 0.00 H new ATOM 0 HB2 ASN A 70 10.490 4.580 -3.146 1.00 0.00 H new ATOM 0 HB3 ASN A 70 11.179 5.820 -2.117 1.00 0.00 H new ATOM 0 HD21 ASN A 70 14.396 4.304 -2.446 1.00 0.00 H new ATOM 0 HD22 ASN A 70 13.422 5.778 -2.446 1.00 0.00 H new ATOM 1062 N GLU A 71 7.860 4.402 -1.438 1.00 0.00 N ATOM 1063 CA GLU A 71 6.541 5.091 -1.359 1.00 0.00 C ATOM 1064 C GLU A 71 5.736 4.518 -0.191 1.00 0.00 C ATOM 1065 O GLU A 71 5.287 5.238 0.679 1.00 0.00 O ATOM 1066 CB GLU A 71 5.773 4.874 -2.663 1.00 0.00 C ATOM 1067 CG GLU A 71 5.976 6.080 -3.583 1.00 0.00 C ATOM 1068 CD GLU A 71 7.418 6.095 -4.094 1.00 0.00 C ATOM 1069 OE1 GLU A 71 7.713 5.337 -5.002 1.00 0.00 O ATOM 1070 OE2 GLU A 71 8.204 6.866 -3.567 1.00 0.00 O ATOM 0 H GLU A 71 7.851 3.500 -1.913 1.00 0.00 H new ATOM 0 HA GLU A 71 6.697 6.158 -1.204 1.00 0.00 H new ATOM 0 HB2 GLU A 71 6.120 3.966 -3.155 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.712 4.737 -2.454 1.00 0.00 H new ATOM 0 HG2 GLU A 71 5.282 6.032 -4.422 1.00 0.00 H new ATOM 0 HG3 GLU A 71 5.760 7.002 -3.044 1.00 0.00 H new ATOM 1077 N PHE A 72 5.549 3.227 -0.164 1.00 0.00 N ATOM 1078 CA PHE A 72 4.771 2.610 0.948 1.00 0.00 C ATOM 1079 C PHE A 72 4.950 1.091 0.914 1.00 0.00 C ATOM 1080 O PHE A 72 4.037 0.356 0.593 1.00 0.00 O ATOM 1081 CB PHE A 72 3.290 2.953 0.787 1.00 0.00 C ATOM 1082 CG PHE A 72 2.985 3.207 -0.669 1.00 0.00 C ATOM 1083 CD1 PHE A 72 3.631 2.457 -1.660 1.00 0.00 C ATOM 1084 CD2 PHE A 72 2.058 4.192 -1.030 1.00 0.00 C ATOM 1085 CE1 PHE A 72 3.350 2.692 -3.011 1.00 0.00 C ATOM 1086 CE2 PHE A 72 1.776 4.427 -2.381 1.00 0.00 C ATOM 1087 CZ PHE A 72 2.422 3.677 -3.372 1.00 0.00 C ATOM 0 H PHE A 72 5.901 2.573 -0.863 1.00 0.00 H new ATOM 0 HA PHE A 72 5.131 2.997 1.901 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.674 2.135 1.161 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.044 3.834 1.380 1.00 0.00 H new ATOM 0 HD1 PHE A 72 4.346 1.697 -1.382 1.00 0.00 H new ATOM 0 HD2 PHE A 72 1.560 4.771 -0.266 1.00 0.00 H new ATOM 0 HE1 PHE A 72 3.849 2.114 -3.775 1.00 0.00 H new ATOM 0 HE2 PHE A 72 1.060 5.187 -2.659 1.00 0.00 H new ATOM 0 HZ PHE A 72 2.205 3.858 -4.414 1.00 0.00 H new ATOM 1097 N GLY A 73 6.120 0.614 1.242 1.00 0.00 N ATOM 1098 CA GLY A 73 6.355 -0.858 1.227 1.00 0.00 C ATOM 1099 C GLY A 73 7.357 -1.226 2.323 1.00 0.00 C ATOM 1100 O GLY A 73 8.343 -0.546 2.529 1.00 0.00 O ATOM 0 H GLY A 73 6.922 1.179 1.519 1.00 0.00 H new ATOM 0 HA2 GLY A 73 5.416 -1.389 1.385 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.735 -1.166 0.253 1.00 0.00 H new ATOM 1104 N LYS A 74 7.114 -2.297 3.027 1.00 0.00 N ATOM 1105 CA LYS A 74 8.054 -2.708 4.108 1.00 0.00 C ATOM 1106 C LYS A 74 7.729 -4.136 4.551 1.00 0.00 C ATOM 1107 O LYS A 74 8.585 -4.861 5.015 1.00 0.00 O ATOM 1108 CB LYS A 74 7.907 -1.759 5.299 1.00 0.00 C ATOM 1109 CG LYS A 74 8.893 -2.161 6.397 1.00 0.00 C ATOM 1110 CD LYS A 74 9.029 -1.018 7.405 1.00 0.00 C ATOM 1111 CE LYS A 74 9.437 -1.584 8.767 1.00 0.00 C ATOM 1112 NZ LYS A 74 10.868 -2.000 8.723 1.00 0.00 N ATOM 0 H LYS A 74 6.305 -2.905 2.901 1.00 0.00 H new ATOM 0 HA LYS A 74 9.077 -2.667 3.735 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.095 -0.732 4.985 1.00 0.00 H new ATOM 0 HB3 LYS A 74 6.887 -1.794 5.681 1.00 0.00 H new ATOM 0 HG2 LYS A 74 8.546 -3.064 6.900 1.00 0.00 H new ATOM 0 HG3 LYS A 74 9.865 -2.393 5.961 1.00 0.00 H new ATOM 0 HD2 LYS A 74 9.774 -0.301 7.059 1.00 0.00 H new ATOM 0 HD3 LYS A 74 8.085 -0.480 7.491 1.00 0.00 H new ATOM 0 HE2 LYS A 74 9.289 -0.834 9.544 1.00 0.00 H new ATOM 0 HE3 LYS A 74 8.807 -2.436 9.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 11.146 -2.385 9.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 10.995 -2.729 7.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 11.462 -1.177 8.498 1.00 0.00 H new ATOM 1126 N GLY A 75 6.497 -4.545 4.410 1.00 0.00 N ATOM 1127 CA GLY A 75 6.120 -5.926 4.824 1.00 0.00 C ATOM 1128 C GLY A 75 4.598 -6.035 4.916 1.00 0.00 C ATOM 1129 O GLY A 75 4.066 -6.780 5.715 1.00 0.00 O ATOM 0 H GLY A 75 5.737 -3.983 4.027 1.00 0.00 H new ATOM 0 HA2 GLY A 75 6.504 -6.650 4.105 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.571 -6.164 5.787 1.00 0.00 H new ATOM 1133 N LYS A 76 3.890 -5.297 4.104 1.00 0.00 N ATOM 1134 CA LYS A 76 2.402 -5.359 4.148 1.00 0.00 C ATOM 1135 C LYS A 76 1.892 -6.181 2.961 1.00 0.00 C ATOM 1136 O LYS A 76 2.656 -6.632 2.132 1.00 0.00 O ATOM 1137 CB LYS A 76 1.830 -3.942 4.071 1.00 0.00 C ATOM 1138 CG LYS A 76 2.809 -2.960 4.716 1.00 0.00 C ATOM 1139 CD LYS A 76 2.169 -1.573 4.788 1.00 0.00 C ATOM 1140 CE LYS A 76 2.408 -0.971 6.174 1.00 0.00 C ATOM 1141 NZ LYS A 76 1.687 0.328 6.282 1.00 0.00 N ATOM 0 H LYS A 76 4.278 -4.655 3.413 1.00 0.00 H new ATOM 0 HA LYS A 76 2.084 -5.828 5.079 1.00 0.00 H new ATOM 0 HB2 LYS A 76 1.654 -3.666 3.031 1.00 0.00 H new ATOM 0 HB3 LYS A 76 0.867 -3.899 4.580 1.00 0.00 H new ATOM 0 HG2 LYS A 76 3.076 -3.301 5.716 1.00 0.00 H new ATOM 0 HG3 LYS A 76 3.731 -2.917 4.137 1.00 0.00 H new ATOM 0 HD2 LYS A 76 2.593 -0.925 4.021 1.00 0.00 H new ATOM 0 HD3 LYS A 76 1.099 -1.644 4.590 1.00 0.00 H new ATOM 0 HE2 LYS A 76 2.060 -1.658 6.946 1.00 0.00 H new ATOM 0 HE3 LYS A 76 3.475 -0.822 6.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 1.849 0.738 7.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 2.040 0.982 5.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 0.668 0.172 6.143 1.00 0.00 H new ATOM 1155 N LYS A 77 0.605 -6.377 2.874 1.00 0.00 N ATOM 1156 CA LYS A 77 0.047 -7.169 1.741 1.00 0.00 C ATOM 1157 C LYS A 77 -0.134 -6.260 0.524 1.00 0.00 C ATOM 1158 O LYS A 77 -0.648 -5.164 0.626 1.00 0.00 O ATOM 1159 CB LYS A 77 -1.306 -7.756 2.146 1.00 0.00 C ATOM 1160 CG LYS A 77 -1.122 -8.684 3.348 1.00 0.00 C ATOM 1161 CD LYS A 77 -2.260 -9.707 3.382 1.00 0.00 C ATOM 1162 CE LYS A 77 -2.763 -9.862 4.819 1.00 0.00 C ATOM 1163 NZ LYS A 77 -1.700 -10.490 5.653 1.00 0.00 N ATOM 0 H LYS A 77 -0.084 -6.023 3.538 1.00 0.00 H new ATOM 0 HA LYS A 77 0.733 -7.978 1.491 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -2.002 -6.955 2.395 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.740 -8.307 1.311 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.161 -9.195 3.283 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -1.113 -8.104 4.271 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.074 -9.383 2.733 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.912 -10.667 3.002 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -3.033 -8.888 5.228 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.664 -10.476 4.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.090 -10.735 6.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.355 -11.352 5.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -0.912 -9.822 5.772 1.00 0.00 H new ATOM 1177 N ILE A 78 0.284 -6.707 -0.629 1.00 0.00 N ATOM 1178 CA ILE A 78 0.136 -5.868 -1.851 1.00 0.00 C ATOM 1179 C ILE A 78 -1.226 -5.170 -1.829 1.00 0.00 C ATOM 1180 O ILE A 78 -1.374 -4.064 -2.310 1.00 0.00 O ATOM 1181 CB ILE A 78 0.233 -6.756 -3.093 1.00 0.00 C ATOM 1182 CG1 ILE A 78 0.167 -5.883 -4.349 1.00 0.00 C ATOM 1183 CG2 ILE A 78 -0.930 -7.749 -3.103 1.00 0.00 C ATOM 1184 CD1 ILE A 78 1.527 -5.220 -4.582 1.00 0.00 C ATOM 0 H ILE A 78 0.721 -7.617 -0.777 1.00 0.00 H new ATOM 0 HA ILE A 78 0.928 -5.119 -1.876 1.00 0.00 H new ATOM 0 HB ILE A 78 1.177 -7.302 -3.077 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -0.106 -6.490 -5.212 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -0.606 -5.123 -4.236 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -0.861 -8.382 -3.988 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -0.886 -8.370 -2.208 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -1.874 -7.204 -3.120 1.00 0.00 H new ATOM 0 HD11 ILE A 78 1.480 -4.598 -5.476 1.00 0.00 H new ATOM 0 HD12 ILE A 78 1.782 -4.600 -3.722 1.00 0.00 H new ATOM 0 HD13 ILE A 78 2.289 -5.989 -4.714 1.00 0.00 H new ATOM 1196 N GLU A 79 -2.221 -5.807 -1.275 1.00 0.00 N ATOM 1197 CA GLU A 79 -3.571 -5.179 -1.222 1.00 0.00 C ATOM 1198 C GLU A 79 -3.469 -3.805 -0.557 1.00 0.00 C ATOM 1199 O GLU A 79 -3.858 -2.802 -1.119 1.00 0.00 O ATOM 1200 CB GLU A 79 -4.516 -6.069 -0.414 1.00 0.00 C ATOM 1201 CG GLU A 79 -4.540 -7.473 -1.022 1.00 0.00 C ATOM 1202 CD GLU A 79 -5.646 -8.297 -0.359 1.00 0.00 C ATOM 1203 OE1 GLU A 79 -5.843 -8.138 0.834 1.00 0.00 O ATOM 1204 OE2 GLU A 79 -6.277 -9.074 -1.058 1.00 0.00 O ATOM 0 H GLU A 79 -2.157 -6.735 -0.857 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.958 -5.064 -2.234 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.189 -6.117 0.625 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.520 -5.645 -0.413 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -4.711 -7.413 -2.097 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -3.575 -7.959 -0.880 1.00 0.00 H new ATOM 1211 N GLU A 80 -2.948 -3.752 0.639 1.00 0.00 N ATOM 1212 CA GLU A 80 -2.822 -2.444 1.340 1.00 0.00 C ATOM 1213 C GLU A 80 -2.189 -1.418 0.396 1.00 0.00 C ATOM 1214 O GLU A 80 -2.793 -0.423 0.050 1.00 0.00 O ATOM 1215 CB GLU A 80 -1.939 -2.611 2.578 1.00 0.00 C ATOM 1216 CG GLU A 80 -2.263 -1.510 3.589 1.00 0.00 C ATOM 1217 CD GLU A 80 -3.223 -2.055 4.649 1.00 0.00 C ATOM 1218 OE1 GLU A 80 -2.838 -2.974 5.353 1.00 0.00 O ATOM 1219 OE2 GLU A 80 -4.328 -1.546 4.736 1.00 0.00 O ATOM 0 H GLU A 80 -2.604 -4.559 1.160 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.810 -2.098 1.643 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -2.104 -3.591 3.026 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.887 -2.563 2.297 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -1.347 -1.155 4.061 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -2.712 -0.656 3.081 1.00 0.00 H new ATOM 1226 N VAL A 81 -0.976 -1.654 -0.022 1.00 0.00 N ATOM 1227 CA VAL A 81 -0.305 -0.693 -0.942 1.00 0.00 C ATOM 1228 C VAL A 81 -1.319 -0.176 -1.966 1.00 0.00 C ATOM 1229 O VAL A 81 -1.557 1.011 -2.073 1.00 0.00 O ATOM 1230 CB VAL A 81 0.841 -1.397 -1.670 1.00 0.00 C ATOM 1231 CG1 VAL A 81 1.392 -0.481 -2.764 1.00 0.00 C ATOM 1232 CG2 VAL A 81 1.954 -1.722 -0.671 1.00 0.00 C ATOM 0 H VAL A 81 -0.421 -2.470 0.234 1.00 0.00 H new ATOM 0 HA VAL A 81 0.091 0.144 -0.367 1.00 0.00 H new ATOM 0 HB VAL A 81 0.473 -2.319 -2.120 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.209 -0.984 -3.282 1.00 0.00 H new ATOM 0 HG12 VAL A 81 0.600 -0.247 -3.476 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.760 0.441 -2.315 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.772 -2.224 -1.188 1.00 0.00 H new ATOM 0 HG22 VAL A 81 2.321 -0.799 -0.222 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.563 -2.375 0.109 1.00 0.00 H new ATOM 1242 N ILE A 82 -1.915 -1.057 -2.720 1.00 0.00 N ATOM 1243 CA ILE A 82 -2.912 -0.615 -3.736 1.00 0.00 C ATOM 1244 C ILE A 82 -3.933 0.316 -3.078 1.00 0.00 C ATOM 1245 O ILE A 82 -4.607 1.080 -3.739 1.00 0.00 O ATOM 1246 CB ILE A 82 -3.632 -1.837 -4.310 1.00 0.00 C ATOM 1247 CG1 ILE A 82 -2.634 -2.694 -5.092 1.00 0.00 C ATOM 1248 CG2 ILE A 82 -4.752 -1.378 -5.246 1.00 0.00 C ATOM 1249 CD1 ILE A 82 -3.259 -4.056 -5.401 1.00 0.00 C ATOM 0 H ILE A 82 -1.755 -2.064 -2.677 1.00 0.00 H new ATOM 0 HA ILE A 82 -2.401 -0.084 -4.539 1.00 0.00 H new ATOM 0 HB ILE A 82 -4.058 -2.424 -3.496 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -2.356 -2.192 -6.018 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -1.720 -2.825 -4.513 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.265 -2.249 -5.655 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.463 -0.766 -4.690 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.328 -0.791 -6.061 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -2.547 -4.665 -5.958 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -3.515 -4.559 -4.468 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.161 -3.916 -5.997 1.00 0.00 H new ATOM 1261 N ASP A 83 -4.052 0.257 -1.779 1.00 0.00 N ATOM 1262 CA ASP A 83 -5.029 1.139 -1.080 1.00 0.00 C ATOM 1263 C ASP A 83 -4.469 2.561 -1.001 1.00 0.00 C ATOM 1264 O ASP A 83 -4.959 3.468 -1.642 1.00 0.00 O ATOM 1265 CB ASP A 83 -5.274 0.608 0.334 1.00 0.00 C ATOM 1266 CG ASP A 83 -6.747 0.798 0.703 1.00 0.00 C ATOM 1267 OD1 ASP A 83 -7.148 1.935 0.886 1.00 0.00 O ATOM 1268 OD2 ASP A 83 -7.447 -0.197 0.795 1.00 0.00 O ATOM 0 H ASP A 83 -3.515 -0.363 -1.173 1.00 0.00 H new ATOM 0 HA ASP A 83 -5.968 1.150 -1.633 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -5.008 -0.448 0.389 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -4.639 1.134 1.047 1.00 0.00 H new ATOM 1273 N LEU A 84 -3.444 2.760 -0.219 1.00 0.00 N ATOM 1274 CA LEU A 84 -2.853 4.123 -0.099 1.00 0.00 C ATOM 1275 C LEU A 84 -2.860 4.804 -1.468 1.00 0.00 C ATOM 1276 O LEU A 84 -2.890 6.015 -1.569 1.00 0.00 O ATOM 1277 CB LEU A 84 -1.413 4.012 0.408 1.00 0.00 C ATOM 1278 CG LEU A 84 -1.410 3.994 1.938 1.00 0.00 C ATOM 1279 CD1 LEU A 84 -0.136 3.309 2.437 1.00 0.00 C ATOM 1280 CD2 LEU A 84 -1.457 5.429 2.465 1.00 0.00 C ATOM 0 H LEU A 84 -2.990 2.039 0.342 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.441 4.713 0.604 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.949 3.104 0.022 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.822 4.852 0.043 1.00 0.00 H new ATOM 0 HG LEU A 84 -2.282 3.447 2.297 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.133 3.296 3.527 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.102 2.286 2.062 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.736 3.856 2.078 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.455 5.417 3.555 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.586 5.977 2.107 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.364 5.918 2.109 1.00 0.00 H new ATOM 1292 N ILE A 85 -2.833 4.038 -2.523 1.00 0.00 N ATOM 1293 CA ILE A 85 -2.838 4.643 -3.885 1.00 0.00 C ATOM 1294 C ILE A 85 -4.239 5.165 -4.205 1.00 0.00 C ATOM 1295 O ILE A 85 -4.472 6.357 -4.255 1.00 0.00 O ATOM 1296 CB ILE A 85 -2.440 3.584 -4.915 1.00 0.00 C ATOM 1297 CG1 ILE A 85 -0.914 3.494 -4.988 1.00 0.00 C ATOM 1298 CG2 ILE A 85 -2.993 3.973 -6.287 1.00 0.00 C ATOM 1299 CD1 ILE A 85 -0.489 2.025 -5.018 1.00 0.00 C ATOM 0 H ILE A 85 -2.808 3.019 -2.501 1.00 0.00 H new ATOM 0 HA ILE A 85 -2.126 5.468 -3.919 1.00 0.00 H new ATOM 0 HB ILE A 85 -2.849 2.618 -4.619 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.551 4.007 -5.879 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.468 3.995 -4.129 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -2.709 3.219 -7.021 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -4.080 4.039 -6.236 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.584 4.939 -6.583 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.598 1.962 -5.070 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -0.839 1.527 -4.114 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.923 1.538 -5.892 1.00 0.00 H new ATOM 1311 N LEU A 86 -5.177 4.283 -4.423 1.00 0.00 N ATOM 1312 CA LEU A 86 -6.562 4.730 -4.740 1.00 0.00 C ATOM 1313 C LEU A 86 -6.941 5.901 -3.830 1.00 0.00 C ATOM 1314 O LEU A 86 -7.598 6.835 -4.246 1.00 0.00 O ATOM 1315 CB LEU A 86 -7.536 3.573 -4.513 1.00 0.00 C ATOM 1316 CG LEU A 86 -7.139 2.390 -5.398 1.00 0.00 C ATOM 1317 CD1 LEU A 86 -7.557 1.083 -4.721 1.00 0.00 C ATOM 1318 CD2 LEU A 86 -7.841 2.509 -6.752 1.00 0.00 C ATOM 0 H LEU A 86 -5.043 3.272 -4.395 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.611 5.048 -5.781 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -7.526 3.276 -3.464 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -8.553 3.889 -4.745 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.059 2.393 -5.546 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.274 0.240 -5.351 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.058 0.998 -3.756 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.637 1.079 -4.573 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.559 1.667 -7.383 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -8.921 2.506 -6.604 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -7.544 3.440 -7.235 1.00 0.00 H new ATOM 1330 N ARG A 87 -6.533 5.858 -2.592 1.00 0.00 N ATOM 1331 CA ARG A 87 -6.871 6.968 -1.657 1.00 0.00 C ATOM 1332 C ARG A 87 -6.660 8.310 -2.362 1.00 0.00 C ATOM 1333 O ARG A 87 -7.277 9.302 -2.025 1.00 0.00 O ATOM 1334 CB ARG A 87 -5.965 6.891 -0.426 1.00 0.00 C ATOM 1335 CG ARG A 87 -6.373 7.973 0.576 1.00 0.00 C ATOM 1336 CD ARG A 87 -5.481 7.882 1.816 1.00 0.00 C ATOM 1337 NE ARG A 87 -6.327 7.883 3.048 1.00 0.00 N ATOM 1338 CZ ARG A 87 -7.340 8.702 3.162 1.00 0.00 C ATOM 1339 NH1 ARG A 87 -7.582 9.586 2.233 1.00 0.00 N ATOM 1340 NH2 ARG A 87 -8.100 8.651 4.222 1.00 0.00 N ATOM 0 H ARG A 87 -5.980 5.102 -2.187 1.00 0.00 H new ATOM 0 HA ARG A 87 -7.913 6.879 -1.348 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -6.042 5.906 0.035 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -4.924 7.025 -0.719 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -6.281 8.959 0.120 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -7.419 7.848 0.857 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -4.880 6.974 1.777 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -4.787 8.723 1.839 1.00 0.00 H new ATOM 0 HE ARG A 87 -6.112 7.238 3.808 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -6.979 9.641 1.412 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -8.374 10.222 2.328 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -7.903 7.974 4.959 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -8.891 9.289 4.314 1.00 0.00 H new ATOM 1354 N ASN A 88 -5.795 8.351 -3.337 1.00 0.00 N ATOM 1355 CA ASN A 88 -5.546 9.629 -4.060 1.00 0.00 C ATOM 1356 C ASN A 88 -6.160 9.552 -5.461 1.00 0.00 C ATOM 1357 O ASN A 88 -7.146 10.198 -5.752 1.00 0.00 O ATOM 1358 CB ASN A 88 -4.039 9.865 -4.176 1.00 0.00 C ATOM 1359 CG ASN A 88 -3.771 11.358 -4.371 1.00 0.00 C ATOM 1360 OD1 ASN A 88 -4.380 11.994 -5.207 1.00 0.00 O ATOM 1361 ND2 ASN A 88 -2.875 11.950 -3.628 1.00 0.00 N ATOM 0 H ASN A 88 -5.249 7.554 -3.665 1.00 0.00 H new ATOM 0 HA ASN A 88 -6.001 10.452 -3.509 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.534 9.508 -3.278 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.635 9.299 -5.015 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -2.688 12.945 -3.750 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -2.362 11.417 -2.925 1.00 0.00 H new ATOM 1368 N GLY A 89 -5.584 8.766 -6.329 1.00 0.00 N ATOM 1369 CA GLY A 89 -6.135 8.650 -7.708 1.00 0.00 C ATOM 1370 C GLY A 89 -5.886 9.952 -8.470 1.00 0.00 C ATOM 1371 O GLY A 89 -6.283 11.019 -8.042 1.00 0.00 O ATOM 0 H GLY A 89 -4.756 8.200 -6.143 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.665 7.816 -8.229 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.204 8.439 -7.667 1.00 0.00 H new ATOM 1375 N LYS A 90 -5.230 9.878 -9.596 1.00 0.00 N ATOM 1376 CA LYS A 90 -4.956 11.114 -10.382 1.00 0.00 C ATOM 1377 C LYS A 90 -5.275 10.861 -11.858 1.00 0.00 C ATOM 1378 O LYS A 90 -4.388 10.721 -12.677 1.00 0.00 O ATOM 1379 CB LYS A 90 -3.481 11.494 -10.237 1.00 0.00 C ATOM 1380 CG LYS A 90 -3.134 11.636 -8.753 1.00 0.00 C ATOM 1381 CD LYS A 90 -1.785 12.342 -8.609 1.00 0.00 C ATOM 1382 CE LYS A 90 -1.997 13.857 -8.623 1.00 0.00 C ATOM 1383 NZ LYS A 90 -2.252 14.335 -7.235 1.00 0.00 N ATOM 0 H LYS A 90 -4.872 9.015 -10.005 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.579 11.927 -10.010 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.851 10.733 -10.697 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.283 12.430 -10.759 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.910 12.204 -8.240 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.094 10.654 -8.282 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.302 12.040 -7.679 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.121 12.050 -9.422 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.119 14.354 -9.035 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.839 14.111 -9.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.396 15.365 -7.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -3.102 13.869 -6.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.436 14.105 -6.633 1.00 0.00 H new ATOM 1397 N PRO A 91 -6.536 10.806 -12.188 1.00 0.00 N ATOM 1398 CA PRO A 91 -6.995 10.568 -13.587 1.00 0.00 C ATOM 1399 C PRO A 91 -6.317 11.510 -14.586 1.00 0.00 C ATOM 1400 O PRO A 91 -5.166 11.867 -14.435 1.00 0.00 O ATOM 1401 CB PRO A 91 -8.500 10.842 -13.532 1.00 0.00 C ATOM 1402 CG PRO A 91 -8.892 10.634 -12.106 1.00 0.00 C ATOM 1403 CD PRO A 91 -7.664 10.964 -11.258 1.00 0.00 C ATOM 0 HA PRO A 91 -6.749 9.562 -13.926 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -8.726 11.858 -13.857 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -9.046 10.167 -14.191 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -9.731 11.276 -11.838 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -9.212 9.606 -11.939 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -7.714 11.978 -10.860 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -7.575 10.291 -10.405 1.00 0.00 H new ATOM 1411 N ASN A 92 -7.023 11.915 -15.607 1.00 0.00 N ATOM 1412 CA ASN A 92 -6.420 12.834 -16.613 1.00 0.00 C ATOM 1413 C ASN A 92 -7.473 13.838 -17.084 1.00 0.00 C ATOM 1414 O ASN A 92 -8.659 13.577 -17.036 1.00 0.00 O ATOM 1415 CB ASN A 92 -5.919 12.021 -17.809 1.00 0.00 C ATOM 1416 CG ASN A 92 -5.875 10.538 -17.437 1.00 0.00 C ATOM 1417 OD1 ASN A 92 -4.882 10.056 -16.930 1.00 0.00 O ATOM 1418 ND2 ASN A 92 -6.918 9.789 -17.668 1.00 0.00 N ATOM 0 H ASN A 92 -7.991 11.649 -15.787 1.00 0.00 H new ATOM 0 HA ASN A 92 -5.585 13.370 -16.161 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -6.576 12.172 -18.666 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -4.927 12.362 -18.104 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -6.899 8.799 -17.423 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -7.752 10.193 -18.094 1.00 0.00 H new ATOM 1425 N SER A 93 -7.051 14.986 -17.538 1.00 0.00 N ATOM 1426 CA SER A 93 -8.029 16.005 -18.012 1.00 0.00 C ATOM 1427 C SER A 93 -8.768 15.472 -19.241 1.00 0.00 C ATOM 1428 O SER A 93 -8.534 14.366 -19.686 1.00 0.00 O ATOM 1429 CB SER A 93 -7.288 17.291 -18.380 1.00 0.00 C ATOM 1430 OG SER A 93 -7.810 17.801 -19.600 1.00 0.00 O ATOM 0 H SER A 93 -6.071 15.262 -17.601 1.00 0.00 H new ATOM 0 HA SER A 93 -8.748 16.214 -17.219 1.00 0.00 H new ATOM 0 HB2 SER A 93 -7.401 18.029 -17.586 1.00 0.00 H new ATOM 0 HB3 SER A 93 -6.221 17.093 -18.482 1.00 0.00 H new ATOM 0 HG SER A 93 -7.339 17.390 -20.355 1.00 0.00 H new ATOM 1436 N THR A 94 -9.657 16.251 -19.794 1.00 0.00 N ATOM 1437 CA THR A 94 -10.408 15.788 -20.994 1.00 0.00 C ATOM 1438 C THR A 94 -9.806 16.424 -22.249 1.00 0.00 C ATOM 1439 O THR A 94 -10.131 17.538 -22.609 1.00 0.00 O ATOM 1440 CB THR A 94 -11.877 16.201 -20.867 1.00 0.00 C ATOM 1441 OG1 THR A 94 -11.993 17.600 -21.088 1.00 0.00 O ATOM 1442 CG2 THR A 94 -12.389 15.860 -19.466 1.00 0.00 C ATOM 0 H THR A 94 -9.895 17.187 -19.467 1.00 0.00 H new ATOM 0 HA THR A 94 -10.341 14.703 -21.069 1.00 0.00 H new ATOM 0 HB THR A 94 -12.470 15.664 -21.607 1.00 0.00 H new ATOM 0 HG1 THR A 94 -11.673 17.817 -21.988 1.00 0.00 H new ATOM 0 HG21 THR A 94 -13.435 16.155 -19.379 1.00 0.00 H new ATOM 0 HG22 THR A 94 -12.300 14.787 -19.297 1.00 0.00 H new ATOM 0 HG23 THR A 94 -11.798 16.395 -18.722 1.00 0.00 H new ATOM 1450 N THR A 95 -8.932 15.724 -22.919 1.00 0.00 N ATOM 1451 CA THR A 95 -8.310 16.290 -24.149 1.00 0.00 C ATOM 1452 C THR A 95 -8.472 15.300 -25.304 1.00 0.00 C ATOM 1453 O THR A 95 -7.533 14.644 -25.709 1.00 0.00 O ATOM 1454 CB THR A 95 -6.821 16.543 -23.899 1.00 0.00 C ATOM 1455 OG1 THR A 95 -6.609 16.772 -22.514 1.00 0.00 O ATOM 1456 CG2 THR A 95 -6.369 17.767 -24.697 1.00 0.00 C ATOM 0 H THR A 95 -8.622 14.785 -22.668 1.00 0.00 H new ATOM 0 HA THR A 95 -8.800 17.230 -24.404 1.00 0.00 H new ATOM 0 HB THR A 95 -6.245 15.674 -24.216 1.00 0.00 H new ATOM 0 HG1 THR A 95 -5.656 16.933 -22.351 1.00 0.00 H new ATOM 0 HG21 THR A 95 -5.309 17.947 -24.518 1.00 0.00 H new ATOM 0 HG22 THR A 95 -6.533 17.589 -25.760 1.00 0.00 H new ATOM 0 HG23 THR A 95 -6.943 18.639 -24.382 1.00 0.00 H new ATOM 1464 N SER A 96 -9.658 15.186 -25.839 1.00 0.00 N ATOM 1465 CA SER A 96 -9.877 14.238 -26.968 1.00 0.00 C ATOM 1466 C SER A 96 -9.055 14.687 -28.178 1.00 0.00 C ATOM 1467 O SER A 96 -9.588 14.954 -29.237 1.00 0.00 O ATOM 1468 CB SER A 96 -11.361 14.222 -27.338 1.00 0.00 C ATOM 1469 OG SER A 96 -11.610 15.211 -28.328 1.00 0.00 O ATOM 0 H SER A 96 -10.483 15.708 -25.543 1.00 0.00 H new ATOM 0 HA SER A 96 -9.565 13.237 -26.668 1.00 0.00 H new ATOM 0 HB2 SER A 96 -11.644 13.238 -27.712 1.00 0.00 H new ATOM 0 HB3 SER A 96 -11.970 14.414 -26.455 1.00 0.00 H new ATOM 0 HG SER A 96 -11.140 14.972 -29.154 1.00 0.00 H new ATOM 1475 N SER A 97 -7.762 14.772 -28.030 1.00 0.00 N ATOM 1476 CA SER A 97 -6.908 15.203 -29.173 1.00 0.00 C ATOM 1477 C SER A 97 -6.108 14.007 -29.692 1.00 0.00 C ATOM 1478 O SER A 97 -4.896 14.044 -29.767 1.00 0.00 O ATOM 1479 CB SER A 97 -5.947 16.296 -28.706 1.00 0.00 C ATOM 1480 OG SER A 97 -6.611 17.552 -28.742 1.00 0.00 O ATOM 0 H SER A 97 -7.260 14.562 -27.168 1.00 0.00 H new ATOM 0 HA SER A 97 -7.539 15.591 -29.972 1.00 0.00 H new ATOM 0 HB2 SER A 97 -5.601 16.084 -27.695 1.00 0.00 H new ATOM 0 HB3 SER A 97 -5.065 16.319 -29.347 1.00 0.00 H new ATOM 0 HG SER A 97 -5.998 18.255 -28.441 1.00 0.00 H new ATOM 1486 N LEU A 98 -6.776 12.945 -30.052 1.00 0.00 N ATOM 1487 CA LEU A 98 -6.052 11.748 -30.566 1.00 0.00 C ATOM 1488 C LEU A 98 -6.522 11.440 -31.990 1.00 0.00 C ATOM 1489 O LEU A 98 -7.700 11.300 -32.248 1.00 0.00 O ATOM 1490 CB LEU A 98 -6.343 10.547 -29.664 1.00 0.00 C ATOM 1491 CG LEU A 98 -5.430 10.596 -28.437 1.00 0.00 C ATOM 1492 CD1 LEU A 98 -5.938 11.659 -27.461 1.00 0.00 C ATOM 1493 CD2 LEU A 98 -5.432 9.230 -27.748 1.00 0.00 C ATOM 0 H LEU A 98 -7.791 12.855 -30.012 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.980 11.948 -30.571 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.388 10.557 -29.353 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.182 9.619 -30.213 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.416 10.847 -28.749 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -5.286 11.692 -26.588 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.938 12.633 -27.951 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.952 11.410 -27.148 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -4.782 9.263 -26.874 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -6.447 8.981 -27.437 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.069 8.472 -28.442 1.00 0.00 H new ATOM 1505 N LYS A 99 -5.608 11.334 -32.915 1.00 0.00 N ATOM 1506 CA LYS A 99 -6.003 11.034 -34.320 1.00 0.00 C ATOM 1507 C LYS A 99 -4.884 10.249 -35.008 1.00 0.00 C ATOM 1508 O LYS A 99 -3.791 10.745 -35.198 1.00 0.00 O ATOM 1509 CB LYS A 99 -6.243 12.344 -35.074 1.00 0.00 C ATOM 1510 CG LYS A 99 -7.387 12.157 -36.073 1.00 0.00 C ATOM 1511 CD LYS A 99 -6.993 11.102 -37.109 1.00 0.00 C ATOM 1512 CE LYS A 99 -7.698 11.399 -38.434 1.00 0.00 C ATOM 1513 NZ LYS A 99 -7.104 12.618 -39.050 1.00 0.00 N ATOM 0 H LYS A 99 -4.606 11.442 -32.759 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.918 10.441 -34.321 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.487 13.141 -34.371 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.336 12.646 -35.597 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -8.293 11.849 -35.551 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -7.610 13.102 -36.568 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.912 11.103 -37.252 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -7.267 10.108 -36.754 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -7.596 10.550 -39.110 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -8.765 11.547 -38.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.204 12.568 -40.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.597 13.462 -38.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.096 12.676 -38.802 1.00 0.00 H new ATOM 1527 N THR A 100 -5.147 9.027 -35.382 1.00 0.00 N ATOM 1528 CA THR A 100 -4.097 8.213 -36.056 1.00 0.00 C ATOM 1529 C THR A 100 -4.679 7.581 -37.323 1.00 0.00 C ATOM 1530 O THR A 100 -5.874 7.404 -37.449 1.00 0.00 O ATOM 1531 CB THR A 100 -3.622 7.108 -35.108 1.00 0.00 C ATOM 1532 OG1 THR A 100 -4.743 6.536 -34.450 1.00 0.00 O ATOM 1533 CG2 THR A 100 -2.665 7.701 -34.072 1.00 0.00 C ATOM 0 H THR A 100 -6.043 8.558 -35.250 1.00 0.00 H new ATOM 0 HA THR A 100 -3.255 8.852 -36.321 1.00 0.00 H new ATOM 0 HB THR A 100 -3.104 6.336 -35.678 1.00 0.00 H new ATOM 0 HG1 THR A 100 -4.440 5.828 -33.844 1.00 0.00 H new ATOM 0 HG21 THR A 100 -2.327 6.915 -33.397 1.00 0.00 H new ATOM 0 HG22 THR A 100 -1.805 8.138 -34.579 1.00 0.00 H new ATOM 0 HG23 THR A 100 -3.180 8.473 -33.500 1.00 0.00 H new ATOM 1541 N LYS A 101 -3.842 7.237 -38.264 1.00 0.00 N ATOM 1542 CA LYS A 101 -4.346 6.617 -39.521 1.00 0.00 C ATOM 1543 C LYS A 101 -5.233 5.419 -39.177 1.00 0.00 C ATOM 1544 O LYS A 101 -5.036 4.756 -38.177 1.00 0.00 O ATOM 1545 CB LYS A 101 -3.163 6.149 -40.370 1.00 0.00 C ATOM 1546 CG LYS A 101 -2.777 7.251 -41.359 1.00 0.00 C ATOM 1547 CD LYS A 101 -1.316 7.072 -41.779 1.00 0.00 C ATOM 1548 CE LYS A 101 -1.144 5.714 -42.462 1.00 0.00 C ATOM 1549 NZ LYS A 101 0.173 5.672 -43.160 1.00 0.00 N ATOM 0 H LYS A 101 -2.830 7.359 -38.216 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.926 7.351 -40.081 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -2.315 5.907 -39.729 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.426 5.238 -40.908 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -3.425 7.212 -42.234 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.918 8.230 -40.902 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.021 7.872 -42.458 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -0.665 7.137 -40.907 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.202 4.914 -41.724 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -1.951 5.549 -43.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.290 4.749 -43.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.211 6.427 -43.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 0.937 5.811 -42.468 1.00 0.00 H new ATOM 1563 N GLY A 102 -6.209 5.135 -39.996 1.00 0.00 N ATOM 1564 CA GLY A 102 -7.106 3.980 -39.714 1.00 0.00 C ATOM 1565 C GLY A 102 -6.401 2.678 -40.096 1.00 0.00 C ATOM 1566 O GLY A 102 -5.513 2.217 -39.407 1.00 0.00 O ATOM 0 H GLY A 102 -6.423 5.653 -40.848 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.374 3.964 -38.658 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -8.034 4.081 -40.277 1.00 0.00 H new ATOM 1570 N GLY A 103 -6.789 2.081 -41.190 1.00 0.00 N ATOM 1571 CA GLY A 103 -6.140 0.809 -41.615 1.00 0.00 C ATOM 1572 C GLY A 103 -6.168 -0.192 -40.458 1.00 0.00 C ATOM 1573 O GLY A 103 -5.490 -0.025 -39.464 1.00 0.00 O ATOM 0 H GLY A 103 -7.527 2.419 -41.807 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -6.659 0.395 -42.480 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.111 0.998 -41.921 1.00 0.00 H new ATOM 1577 N ASN A 104 -6.947 -1.231 -40.579 1.00 0.00 N ATOM 1578 CA ASN A 104 -7.017 -2.241 -39.486 1.00 0.00 C ATOM 1579 C ASN A 104 -6.615 -3.612 -40.033 1.00 0.00 C ATOM 1580 O ASN A 104 -7.407 -4.306 -40.640 1.00 0.00 O ATOM 1581 CB ASN A 104 -8.447 -2.308 -38.943 1.00 0.00 C ATOM 1582 CG ASN A 104 -8.562 -3.465 -37.950 1.00 0.00 C ATOM 1583 OD1 ASN A 104 -9.125 -4.496 -38.263 1.00 0.00 O ATOM 1584 ND2 ASN A 104 -8.049 -3.338 -36.756 1.00 0.00 N ATOM 0 H ASN A 104 -7.538 -1.424 -41.387 1.00 0.00 H new ATOM 0 HA ASN A 104 -6.337 -1.956 -38.683 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -8.706 -1.369 -38.455 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -9.152 -2.447 -39.762 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -8.121 -4.104 -36.086 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -7.577 -2.473 -36.493 1.00 0.00 H new ATOM 1591 N ALA A 105 -5.389 -4.009 -39.824 1.00 0.00 N ATOM 1592 CA ALA A 105 -4.939 -5.335 -40.332 1.00 0.00 C ATOM 1593 C ALA A 105 -4.225 -6.095 -39.212 1.00 0.00 C ATOM 1594 O ALA A 105 -4.305 -5.734 -38.055 1.00 0.00 O ATOM 1595 CB ALA A 105 -3.975 -5.131 -41.503 1.00 0.00 C ATOM 0 H ALA A 105 -4.680 -3.472 -39.324 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.803 -5.908 -40.667 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -3.645 -6.101 -41.876 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -4.482 -4.589 -42.301 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -3.111 -4.558 -41.167 1.00 0.00 H new ATOM 1601 N GLY A 106 -3.530 -7.147 -39.546 1.00 0.00 N ATOM 1602 CA GLY A 106 -2.813 -7.930 -38.501 1.00 0.00 C ATOM 1603 C GLY A 106 -2.466 -9.316 -39.046 1.00 0.00 C ATOM 1604 O GLY A 106 -2.262 -10.255 -38.302 1.00 0.00 O ATOM 0 H GLY A 106 -3.428 -7.498 -40.498 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -1.904 -7.408 -38.201 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -3.436 -8.023 -37.611 1.00 0.00 H new ATOM 1608 N THR A 107 -2.395 -9.453 -40.343 1.00 0.00 N ATOM 1609 CA THR A 107 -2.060 -10.778 -40.935 1.00 0.00 C ATOM 1610 C THR A 107 -1.678 -10.597 -42.406 1.00 0.00 C ATOM 1611 O THR A 107 -2.354 -9.919 -43.154 1.00 0.00 O ATOM 1612 CB THR A 107 -3.275 -11.704 -40.834 1.00 0.00 C ATOM 1613 OG1 THR A 107 -2.900 -13.017 -41.225 1.00 0.00 O ATOM 1614 CG2 THR A 107 -4.387 -11.193 -41.749 1.00 0.00 C ATOM 0 H THR A 107 -2.555 -8.704 -41.017 1.00 0.00 H new ATOM 0 HA THR A 107 -1.222 -11.217 -40.393 1.00 0.00 H new ATOM 0 HB THR A 107 -3.636 -11.720 -39.806 1.00 0.00 H new ATOM 0 HG1 THR A 107 -3.676 -13.612 -41.159 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.251 -11.854 -41.676 1.00 0.00 H new ATOM 0 HG22 THR A 107 -4.673 -10.186 -41.446 1.00 0.00 H new ATOM 0 HG23 THR A 107 -4.031 -11.174 -42.779 1.00 0.00 H new ATOM 1622 N LYS A 108 -0.599 -11.198 -42.826 1.00 0.00 N ATOM 1623 CA LYS A 108 -0.175 -11.060 -44.248 1.00 0.00 C ATOM 1624 C LYS A 108 -0.073 -9.576 -44.608 1.00 0.00 C ATOM 1625 O LYS A 108 -0.843 -9.063 -45.394 1.00 0.00 O ATOM 1626 CB LYS A 108 -1.205 -11.734 -45.156 1.00 0.00 C ATOM 1627 CG LYS A 108 -1.597 -13.091 -44.566 1.00 0.00 C ATOM 1628 CD LYS A 108 -2.750 -13.686 -45.375 1.00 0.00 C ATOM 1629 CE LYS A 108 -2.891 -15.173 -45.045 1.00 0.00 C ATOM 1630 NZ LYS A 108 -1.835 -15.943 -45.761 1.00 0.00 N ATOM 0 H LYS A 108 0.007 -11.778 -42.246 1.00 0.00 H new ATOM 0 HA LYS A 108 0.796 -11.536 -44.385 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -2.087 -11.101 -45.256 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -0.792 -11.866 -46.156 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.742 -13.767 -44.581 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.893 -12.974 -43.523 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -3.678 -13.162 -45.145 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.566 -13.555 -46.441 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -2.803 -15.328 -43.970 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -3.878 -15.530 -45.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -2.083 -16.953 -45.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -1.761 -15.602 -46.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.923 -15.812 -45.279 1.00 0.00 H new ATOM 1644 N ALA A 109 0.874 -8.882 -44.037 1.00 0.00 N ATOM 1645 CA ALA A 109 1.025 -7.432 -44.347 1.00 0.00 C ATOM 1646 C ALA A 109 2.472 -7.146 -44.752 1.00 0.00 C ATOM 1647 O ALA A 109 3.291 -8.040 -44.841 1.00 0.00 O ATOM 1648 CB ALA A 109 0.669 -6.607 -43.109 1.00 0.00 C ATOM 0 H ALA A 109 1.549 -9.256 -43.370 1.00 0.00 H new ATOM 0 HA ALA A 109 0.358 -7.163 -45.167 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.779 -5.546 -43.335 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.362 -6.811 -42.820 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.336 -6.875 -42.289 1.00 0.00 H new ATOM 1654 N TYR A 110 2.794 -5.906 -45.000 1.00 0.00 N ATOM 1655 CA TYR A 110 4.188 -5.565 -45.401 1.00 0.00 C ATOM 1656 C TYR A 110 4.563 -6.347 -46.661 1.00 0.00 C ATOM 1657 O TYR A 110 5.723 -6.490 -46.993 1.00 0.00 O ATOM 1658 CB TYR A 110 5.149 -5.932 -44.267 1.00 0.00 C ATOM 1659 CG TYR A 110 6.552 -5.518 -44.640 1.00 0.00 C ATOM 1660 CD1 TYR A 110 6.867 -4.162 -44.780 1.00 0.00 C ATOM 1661 CD2 TYR A 110 7.538 -6.491 -44.848 1.00 0.00 C ATOM 1662 CE1 TYR A 110 8.168 -3.776 -45.127 1.00 0.00 C ATOM 1663 CE2 TYR A 110 8.838 -6.106 -45.193 1.00 0.00 C ATOM 1664 CZ TYR A 110 9.153 -4.750 -45.333 1.00 0.00 C ATOM 1665 OH TYR A 110 10.435 -4.370 -45.674 1.00 0.00 O ATOM 0 H TYR A 110 2.153 -5.115 -44.942 1.00 0.00 H new ATOM 0 HA TYR A 110 4.256 -4.496 -45.604 1.00 0.00 H new ATOM 0 HB2 TYR A 110 4.846 -5.437 -43.345 1.00 0.00 H new ATOM 0 HB3 TYR A 110 5.113 -7.005 -44.079 1.00 0.00 H new ATOM 0 HD1 TYR A 110 6.106 -3.412 -44.620 1.00 0.00 H new ATOM 0 HD2 TYR A 110 7.295 -7.538 -44.742 1.00 0.00 H new ATOM 0 HE1 TYR A 110 8.411 -2.729 -45.235 1.00 0.00 H new ATOM 0 HE2 TYR A 110 9.599 -6.856 -45.351 1.00 0.00 H new ATOM 0 HH TYR A 110 10.995 -5.167 -45.779 1.00 0.00 H new ATOM 1675 N ASN A 111 3.589 -6.855 -47.366 1.00 0.00 N ATOM 1676 CA ASN A 111 3.891 -7.628 -48.603 1.00 0.00 C ATOM 1677 C ASN A 111 3.528 -6.789 -49.829 1.00 0.00 C ATOM 1678 O ASN A 111 2.369 -6.805 -50.213 1.00 0.00 O ATOM 1679 CB ASN A 111 3.072 -8.921 -48.609 1.00 0.00 C ATOM 1680 CG ASN A 111 3.241 -9.626 -49.957 1.00 0.00 C ATOM 1681 OD1 ASN A 111 2.972 -9.053 -50.993 1.00 0.00 O ATOM 1682 ND2 ASN A 111 3.678 -10.855 -49.986 1.00 0.00 N ATOM 1683 OXT ASN A 111 4.414 -6.144 -50.365 1.00 0.00 O ATOM 0 H ASN A 111 2.598 -6.768 -47.139 1.00 0.00 H new ATOM 0 HA ASN A 111 4.953 -7.871 -48.630 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.399 -9.575 -47.801 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.020 -8.698 -48.432 1.00 0.00 H new ATOM 0 HD21 ASN A 111 3.794 -11.334 -50.879 1.00 0.00 H new ATOM 0 HD22 ASN A 111 3.904 -11.337 -49.116 1.00 0.00 H new TER 1690 ASN A 111