USER MOD reduce.3.24.130724 H: found=0, std=0, add=1402, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1400 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 Single : A 1 MET CE :methyl -154:sc= -0.121 (180deg=-0.791) USER MOD Single : A 1 MET N :NH3+ -174:sc= -0.0892 (180deg=-0.32) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 GLN : amide:sc=-0.00347 K(o=-0.0035,f=-1.5!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 HIS : no HD1:sc=-0.00186 X(o=-0.0019,f=0) USER MOD Single : A 15 MET CE :methyl -156:sc= -2.61! (180deg=-5.4!) USER MOD Single : A 18 LYS NZ :NH3+ -153:sc= -0.168 (180deg=-0.9) USER MOD Single : A 22 SER OG : rot 150:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -107:sc= -0.921 (180deg=-2.56!) USER MOD Single : A 41 LYS NZ :NH3+ -161:sc= -0.053 (180deg=-0.492) USER MOD Single : A 43 TYR OH : rot 150:sc= -0.0809 USER MOD Single : A 48 GLN : amide:sc= -0.21 K(o=-0.21,f=-1) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -161:sc= -0.0192 (180deg=-0.337) USER MOD Single : A 66 THR OG1 : rot 67:sc= 0.541 USER MOD Single : A 67 CYS SG : rot -61:sc= 1.03 USER MOD Single : A 70 ASN :FLIP amide:sc= -1.54! C(o=-2.1!,f=-1.5!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -1.5 X(o=-1.5,f=-1.1) USER MOD Single : A 74 SER OG : rot -58:sc= 0.6 USER MOD Single : A 77 CYS SG : rot -26:sc= -0.642 USER MOD Single : A 80 CYS SG : rot -140:sc= -0.337 USER MOD Single : A 85 CYS SG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -138:sc= -0.0995 (180deg=-0.778) USER MOD Single : B 1 MET N :NH3+ -167:sc= -0.0695 (180deg=-0.245) USER MOD Single : B 2 THR OG1 : rot 180:sc= 0 USER MOD Single : B 3 THR OG1 : rot 180:sc= 0 USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 GLN : amide:sc= -0.0109 K(o=-0.011,f=-1.5!) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 HIS : no HD1:sc= -0.0278 X(o=-0.028,f=0) USER MOD Single : B 15 MET CE :methyl -156:sc= -2.65! (180deg=-5.34!) USER MOD Single : B 18 LYS NZ :NH3+ -134:sc= -0.141 (180deg=-0.929) USER MOD Single : B 22 SER OG : rot 150:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 LYS NZ :NH3+ 131:sc= -0.913 (180deg=-2.43!) USER MOD Single : B 41 LYS NZ :NH3+ -163:sc= -0.0438 (180deg=-0.426) USER MOD Single : B 43 TYR OH : rot 150:sc= -0.0721 USER MOD Single : B 48 GLN : amide:sc= -0.275 K(o=-0.27,f=-1.1) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 64 LYS NZ :NH3+ -162:sc= -0.0153 (180deg=-0.301) USER MOD Single : B 66 THR OG1 : rot 102:sc= 0.643 USER MOD Single : B 67 CYS SG : rot -57:sc= 1.01 USER MOD Single : B 70 ASN : amide:sc= -2.09 X(o=-2.1,f=-1.6) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 GLN : amide:sc= -1.28 X(o=-1.3,f=-0.99) USER MOD Single : B 74 SER OG : rot -59:sc= 0.585 USER MOD Single : B 77 CYS SG : rot -21:sc= -0.662 USER MOD Single : B 80 CYS SG : rot -140:sc= -0.335 USER MOD Single : B 85 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 117.050 -12.788 11.632 1.00 0.00 N ATOM 2 CA MET A 1 115.831 -12.528 10.815 1.00 0.00 C ATOM 3 C MET A 1 115.874 -11.093 10.288 1.00 0.00 C ATOM 4 O MET A 1 115.272 -10.770 9.284 1.00 0.00 O ATOM 5 CB MET A 1 114.586 -12.721 11.685 1.00 0.00 C ATOM 6 CG MET A 1 113.337 -12.700 10.803 1.00 0.00 C ATOM 7 SD MET A 1 111.866 -12.985 11.823 1.00 0.00 S ATOM 8 CE MET A 1 112.138 -14.742 12.175 1.00 0.00 C ATOM 0 H1 MET A 1 117.076 -13.790 11.908 1.00 0.00 H new ATOM 0 H2 MET A 1 117.897 -12.561 11.073 1.00 0.00 H new ATOM 0 H3 MET A 1 117.029 -12.195 12.486 1.00 0.00 H new ATOM 0 HA MET A 1 115.795 -13.222 9.975 1.00 0.00 H new ATOM 0 HB2 MET A 1 114.648 -13.667 12.222 1.00 0.00 H new ATOM 0 HB3 MET A 1 114.528 -11.932 12.435 1.00 0.00 H new ATOM 0 HG2 MET A 1 113.257 -11.741 10.292 1.00 0.00 H new ATOM 0 HG3 MET A 1 113.411 -13.467 10.032 1.00 0.00 H new ATOM 0 HE1 MET A 1 111.182 -15.225 12.376 1.00 0.00 H new ATOM 0 HE2 MET A 1 112.610 -15.217 11.315 1.00 0.00 H new ATOM 0 HE3 MET A 1 112.786 -14.843 13.046 1.00 0.00 H new ATOM 20 N THR A 2 116.587 -10.231 10.958 1.00 0.00 N ATOM 21 CA THR A 2 116.678 -8.817 10.500 1.00 0.00 C ATOM 22 C THR A 2 117.500 -8.754 9.211 1.00 0.00 C ATOM 23 O THR A 2 116.965 -8.628 8.128 1.00 0.00 O ATOM 24 CB THR A 2 117.357 -7.976 11.583 1.00 0.00 C ATOM 25 OG1 THR A 2 116.710 -8.200 12.826 1.00 0.00 O ATOM 26 CG2 THR A 2 117.264 -6.493 11.216 1.00 0.00 C ATOM 0 H THR A 2 117.112 -10.446 11.806 1.00 0.00 H new ATOM 0 HA THR A 2 115.678 -8.427 10.312 1.00 0.00 H new ATOM 0 HB THR A 2 118.406 -8.262 11.661 1.00 0.00 H new ATOM 0 HG1 THR A 2 117.144 -7.664 13.522 1.00 0.00 H new ATOM 0 HG21 THR A 2 117.748 -5.896 11.989 1.00 0.00 H new ATOM 0 HG22 THR A 2 117.761 -6.323 10.261 1.00 0.00 H new ATOM 0 HG23 THR A 2 116.216 -6.203 11.137 1.00 0.00 H new ATOM 34 N THR A 3 118.796 -8.842 9.319 1.00 0.00 N ATOM 35 CA THR A 3 119.651 -8.786 8.101 1.00 0.00 C ATOM 36 C THR A 3 119.545 -10.110 7.340 1.00 0.00 C ATOM 37 O THR A 3 119.266 -11.145 7.912 1.00 0.00 O ATOM 38 CB THR A 3 121.105 -8.542 8.514 1.00 0.00 C ATOM 39 OG1 THR A 3 121.538 -9.595 9.364 1.00 0.00 O ATOM 40 CG2 THR A 3 121.206 -7.208 9.256 1.00 0.00 C ATOM 0 H THR A 3 119.301 -8.950 10.199 1.00 0.00 H new ATOM 0 HA THR A 3 119.316 -7.974 7.456 1.00 0.00 H new ATOM 0 HB THR A 3 121.737 -8.511 7.626 1.00 0.00 H new ATOM 0 HG1 THR A 3 122.469 -9.441 9.628 1.00 0.00 H new ATOM 0 HG21 THR A 3 122.241 -7.033 9.551 1.00 0.00 H new ATOM 0 HG22 THR A 3 120.874 -6.402 8.602 1.00 0.00 H new ATOM 0 HG23 THR A 3 120.576 -7.237 10.145 1.00 0.00 H new ATOM 48 N SER A 4 119.769 -10.084 6.055 1.00 0.00 N ATOM 49 CA SER A 4 119.681 -11.338 5.257 1.00 0.00 C ATOM 50 C SER A 4 120.954 -12.161 5.460 1.00 0.00 C ATOM 51 O SER A 4 121.939 -11.692 5.995 1.00 0.00 O ATOM 52 CB SER A 4 119.527 -10.989 3.776 1.00 0.00 C ATOM 53 OG SER A 4 118.394 -10.147 3.607 1.00 0.00 O ATOM 0 H SER A 4 120.009 -9.247 5.523 1.00 0.00 H new ATOM 0 HA SER A 4 118.818 -11.919 5.584 1.00 0.00 H new ATOM 0 HB2 SER A 4 120.424 -10.488 3.414 1.00 0.00 H new ATOM 0 HB3 SER A 4 119.410 -11.898 3.187 1.00 0.00 H new ATOM 0 HG SER A 4 118.294 -9.920 2.659 1.00 0.00 H new ATOM 59 N GLN A 5 120.924 -13.398 5.046 1.00 0.00 N ATOM 60 CA GLN A 5 122.107 -14.289 5.216 1.00 0.00 C ATOM 61 C GLN A 5 123.327 -13.693 4.515 1.00 0.00 C ATOM 62 O GLN A 5 124.451 -14.052 4.803 1.00 0.00 O ATOM 63 CB GLN A 5 121.803 -15.660 4.612 1.00 0.00 C ATOM 64 CG GLN A 5 120.766 -16.385 5.470 1.00 0.00 C ATOM 65 CD GLN A 5 120.365 -17.693 4.785 1.00 0.00 C ATOM 66 OE1 GLN A 5 120.482 -17.823 3.583 1.00 0.00 O ATOM 67 NE2 GLN A 5 119.896 -18.676 5.503 1.00 0.00 N ATOM 0 H GLN A 5 120.121 -13.834 4.592 1.00 0.00 H new ATOM 0 HA GLN A 5 122.320 -14.389 6.280 1.00 0.00 H new ATOM 0 HB2 GLN A 5 121.430 -15.545 3.594 1.00 0.00 H new ATOM 0 HB3 GLN A 5 122.716 -16.252 4.552 1.00 0.00 H new ATOM 0 HG2 GLN A 5 121.175 -16.590 6.459 1.00 0.00 H new ATOM 0 HG3 GLN A 5 119.890 -15.753 5.613 1.00 0.00 H new ATOM 0 HE21 GLN A 5 119.797 -18.568 6.512 1.00 0.00 H new ATOM 0 HE22 GLN A 5 119.628 -19.552 5.055 1.00 0.00 H new ATOM 76 N LYS A 6 123.125 -12.791 3.591 1.00 0.00 N ATOM 77 CA LYS A 6 124.279 -12.184 2.872 1.00 0.00 C ATOM 78 C LYS A 6 125.166 -11.431 3.865 1.00 0.00 C ATOM 79 O LYS A 6 126.377 -11.446 3.762 1.00 0.00 O ATOM 80 CB LYS A 6 123.753 -11.206 1.821 1.00 0.00 C ATOM 81 CG LYS A 6 123.036 -11.986 0.716 1.00 0.00 C ATOM 82 CD LYS A 6 122.508 -11.012 -0.338 1.00 0.00 C ATOM 83 CE LYS A 6 121.791 -11.794 -1.439 1.00 0.00 C ATOM 84 NZ LYS A 6 121.117 -10.841 -2.366 1.00 0.00 N ATOM 0 H LYS A 6 122.208 -12.449 3.304 1.00 0.00 H new ATOM 0 HA LYS A 6 124.863 -12.968 2.390 1.00 0.00 H new ATOM 0 HB2 LYS A 6 123.069 -10.493 2.281 1.00 0.00 H new ATOM 0 HB3 LYS A 6 124.577 -10.630 1.399 1.00 0.00 H new ATOM 0 HG2 LYS A 6 123.721 -12.699 0.257 1.00 0.00 H new ATOM 0 HG3 LYS A 6 122.213 -12.562 1.139 1.00 0.00 H new ATOM 0 HD2 LYS A 6 121.824 -10.298 0.121 1.00 0.00 H new ATOM 0 HD3 LYS A 6 123.331 -10.437 -0.762 1.00 0.00 H new ATOM 0 HE2 LYS A 6 122.505 -12.408 -1.988 1.00 0.00 H new ATOM 0 HE3 LYS A 6 121.058 -12.471 -1.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 120.629 -11.372 -3.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 120.425 -10.273 -1.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 121.826 -10.212 -2.793 1.00 0.00 H new ATOM 98 N HIS A 7 124.579 -10.757 4.813 1.00 0.00 N ATOM 99 CA HIS A 7 125.398 -9.988 5.792 1.00 0.00 C ATOM 100 C HIS A 7 126.371 -10.919 6.520 1.00 0.00 C ATOM 101 O HIS A 7 127.553 -10.649 6.605 1.00 0.00 O ATOM 102 CB HIS A 7 124.461 -9.311 6.806 1.00 0.00 C ATOM 103 CG HIS A 7 125.244 -8.797 7.989 1.00 0.00 C ATOM 104 ND1 HIS A 7 125.912 -7.580 7.972 1.00 0.00 N ATOM 105 CD2 HIS A 7 125.474 -9.333 9.233 1.00 0.00 C ATOM 106 CE1 HIS A 7 126.505 -7.426 9.172 1.00 0.00 C ATOM 107 NE2 HIS A 7 126.268 -8.466 9.973 1.00 0.00 N ATOM 0 H HIS A 7 123.570 -10.705 4.953 1.00 0.00 H new ATOM 0 HA HIS A 7 125.977 -9.231 5.263 1.00 0.00 H new ATOM 0 HB2 HIS A 7 123.932 -8.487 6.327 1.00 0.00 H new ATOM 0 HB3 HIS A 7 123.706 -10.021 7.143 1.00 0.00 H new ATOM 0 HD2 HIS A 7 125.096 -10.282 9.582 1.00 0.00 H new ATOM 0 HE1 HIS A 7 127.098 -6.568 9.451 1.00 0.00 H new ATOM 0 HE2 HIS A 7 126.600 -8.597 10.928 1.00 0.00 H new ATOM 115 N ARG A 8 125.889 -12.009 7.057 1.00 0.00 N ATOM 116 CA ARG A 8 126.784 -12.945 7.787 1.00 0.00 C ATOM 117 C ARG A 8 127.718 -13.650 6.806 1.00 0.00 C ATOM 118 O ARG A 8 128.849 -13.964 7.121 1.00 0.00 O ATOM 119 CB ARG A 8 125.932 -13.980 8.526 1.00 0.00 C ATOM 120 CG ARG A 8 125.152 -13.286 9.643 1.00 0.00 C ATOM 121 CD ARG A 8 124.299 -14.311 10.392 1.00 0.00 C ATOM 122 NE ARG A 8 123.435 -13.605 11.380 1.00 0.00 N ATOM 123 CZ ARG A 8 122.429 -14.227 11.934 1.00 0.00 C ATOM 124 NH1 ARG A 8 122.176 -15.468 11.619 1.00 0.00 N ATOM 125 NH2 ARG A 8 121.677 -13.607 12.801 1.00 0.00 N ATOM 0 H ARG A 8 124.909 -12.290 7.019 1.00 0.00 H new ATOM 0 HA ARG A 8 127.386 -12.386 8.503 1.00 0.00 H new ATOM 0 HB2 ARG A 8 125.244 -14.464 7.833 1.00 0.00 H new ATOM 0 HB3 ARG A 8 126.568 -14.762 8.942 1.00 0.00 H new ATOM 0 HG2 ARG A 8 125.842 -12.799 10.333 1.00 0.00 H new ATOM 0 HG3 ARG A 8 124.516 -12.506 9.225 1.00 0.00 H new ATOM 0 HD2 ARG A 8 123.683 -14.872 9.689 1.00 0.00 H new ATOM 0 HD3 ARG A 8 124.939 -15.032 10.901 1.00 0.00 H new ATOM 0 HE ARG A 8 123.630 -12.634 11.624 1.00 0.00 H new ATOM 0 HH11 ARG A 8 122.764 -15.952 10.940 1.00 0.00 H new ATOM 0 HH12 ARG A 8 121.390 -15.954 12.052 1.00 0.00 H new ATOM 0 HH21 ARG A 8 121.875 -12.637 13.046 1.00 0.00 H new ATOM 0 HH22 ARG A 8 120.891 -14.092 13.234 1.00 0.00 H new ATOM 139 N ASP A 9 127.254 -13.900 5.618 1.00 0.00 N ATOM 140 CA ASP A 9 128.113 -14.582 4.612 1.00 0.00 C ATOM 141 C ASP A 9 129.232 -13.647 4.147 1.00 0.00 C ATOM 142 O ASP A 9 130.350 -14.067 3.929 1.00 0.00 O ATOM 143 CB ASP A 9 127.273 -15.010 3.409 1.00 0.00 C ATOM 144 CG ASP A 9 126.342 -16.154 3.815 1.00 0.00 C ATOM 145 OD1 ASP A 9 126.606 -16.775 4.832 1.00 0.00 O ATOM 146 OD2 ASP A 9 125.381 -16.393 3.100 1.00 0.00 O ATOM 0 H ASP A 9 126.315 -13.662 5.298 1.00 0.00 H new ATOM 0 HA ASP A 9 128.555 -15.464 5.076 1.00 0.00 H new ATOM 0 HB2 ASP A 9 126.690 -14.166 3.041 1.00 0.00 H new ATOM 0 HB3 ASP A 9 127.923 -15.328 2.594 1.00 0.00 H new ATOM 151 N PHE A 10 128.936 -12.386 3.966 1.00 0.00 N ATOM 152 CA PHE A 10 129.984 -11.438 3.482 1.00 0.00 C ATOM 153 C PHE A 10 131.068 -11.233 4.546 1.00 0.00 C ATOM 154 O PHE A 10 132.242 -11.170 4.240 1.00 0.00 O ATOM 155 CB PHE A 10 129.329 -10.094 3.157 1.00 0.00 C ATOM 156 CG PHE A 10 130.342 -9.177 2.513 1.00 0.00 C ATOM 157 CD1 PHE A 10 130.499 -9.181 1.122 1.00 0.00 C ATOM 158 CD2 PHE A 10 131.117 -8.317 3.303 1.00 0.00 C ATOM 159 CE1 PHE A 10 131.431 -8.328 0.518 1.00 0.00 C ATOM 160 CE2 PHE A 10 132.050 -7.464 2.700 1.00 0.00 C ATOM 161 CZ PHE A 10 132.208 -7.470 1.307 1.00 0.00 C ATOM 0 H PHE A 10 128.018 -11.973 4.131 1.00 0.00 H new ATOM 0 HA PHE A 10 130.451 -11.856 2.590 1.00 0.00 H new ATOM 0 HB2 PHE A 10 128.482 -10.244 2.487 1.00 0.00 H new ATOM 0 HB3 PHE A 10 128.939 -9.639 4.067 1.00 0.00 H new ATOM 0 HD1 PHE A 10 129.900 -9.843 0.514 1.00 0.00 H new ATOM 0 HD2 PHE A 10 130.995 -8.312 4.376 1.00 0.00 H new ATOM 0 HE1 PHE A 10 131.551 -8.332 -0.555 1.00 0.00 H new ATOM 0 HE2 PHE A 10 132.648 -6.801 3.308 1.00 0.00 H new ATOM 0 HZ PHE A 10 132.929 -6.813 0.842 1.00 0.00 H new ATOM 171 N VAL A 11 130.691 -11.117 5.790 1.00 0.00 N ATOM 172 CA VAL A 11 131.710 -10.906 6.859 1.00 0.00 C ATOM 173 C VAL A 11 132.318 -12.247 7.272 1.00 0.00 C ATOM 174 O VAL A 11 132.951 -12.357 8.303 1.00 0.00 O ATOM 175 CB VAL A 11 131.043 -10.257 8.073 1.00 0.00 C ATOM 176 CG1 VAL A 11 130.386 -8.941 7.649 1.00 0.00 C ATOM 177 CG2 VAL A 11 129.982 -11.207 8.633 1.00 0.00 C ATOM 0 H VAL A 11 129.724 -11.159 6.113 1.00 0.00 H new ATOM 0 HA VAL A 11 132.499 -10.257 6.479 1.00 0.00 H new ATOM 0 HB VAL A 11 131.790 -10.055 8.840 1.00 0.00 H new ATOM 0 HG11 VAL A 11 129.910 -8.477 8.513 1.00 0.00 H new ATOM 0 HG12 VAL A 11 131.144 -8.269 7.248 1.00 0.00 H new ATOM 0 HG13 VAL A 11 129.635 -9.139 6.884 1.00 0.00 H new ATOM 0 HG21 VAL A 11 129.504 -10.749 9.499 1.00 0.00 H new ATOM 0 HG22 VAL A 11 129.232 -11.407 7.868 1.00 0.00 H new ATOM 0 HG23 VAL A 11 130.453 -12.143 8.932 1.00 0.00 H new ATOM 187 N ALA A 12 132.110 -13.276 6.481 1.00 0.00 N ATOM 188 CA ALA A 12 132.654 -14.631 6.823 1.00 0.00 C ATOM 189 C ALA A 12 133.594 -15.131 5.721 1.00 0.00 C ATOM 190 O ALA A 12 134.235 -16.152 5.868 1.00 0.00 O ATOM 191 CB ALA A 12 131.490 -15.611 6.966 1.00 0.00 C ATOM 0 H ALA A 12 131.584 -13.234 5.608 1.00 0.00 H new ATOM 0 HA ALA A 12 133.213 -14.561 7.756 1.00 0.00 H new ATOM 0 HB1 ALA A 12 131.875 -16.600 7.215 1.00 0.00 H new ATOM 0 HB2 ALA A 12 130.824 -15.271 7.759 1.00 0.00 H new ATOM 0 HB3 ALA A 12 130.940 -15.662 6.026 1.00 0.00 H new ATOM 197 N GLU A 13 133.691 -14.431 4.620 1.00 0.00 N ATOM 198 CA GLU A 13 134.604 -14.894 3.525 1.00 0.00 C ATOM 199 C GLU A 13 135.130 -13.681 2.739 1.00 0.00 C ATOM 200 O GLU A 13 134.461 -12.671 2.650 1.00 0.00 O ATOM 201 CB GLU A 13 133.824 -15.820 2.584 1.00 0.00 C ATOM 202 CG GLU A 13 132.727 -15.026 1.869 1.00 0.00 C ATOM 203 CD GLU A 13 131.703 -15.994 1.268 1.00 0.00 C ATOM 204 OE1 GLU A 13 132.085 -16.773 0.411 1.00 0.00 O ATOM 205 OE2 GLU A 13 130.555 -15.940 1.678 1.00 0.00 O ATOM 0 H GLU A 13 133.184 -13.567 4.430 1.00 0.00 H new ATOM 0 HA GLU A 13 135.449 -15.432 3.954 1.00 0.00 H new ATOM 0 HB2 GLU A 13 134.500 -16.264 1.853 1.00 0.00 H new ATOM 0 HB3 GLU A 13 133.382 -16.640 3.150 1.00 0.00 H new ATOM 0 HG2 GLU A 13 132.237 -14.351 2.570 1.00 0.00 H new ATOM 0 HG3 GLU A 13 133.163 -14.408 1.084 1.00 0.00 H new ATOM 212 N PRO A 14 136.308 -13.771 2.149 1.00 0.00 N ATOM 213 CA PRO A 14 136.876 -12.645 1.348 1.00 0.00 C ATOM 214 C PRO A 14 135.837 -12.053 0.387 1.00 0.00 C ATOM 215 O PRO A 14 134.886 -12.709 0.012 1.00 0.00 O ATOM 216 CB PRO A 14 138.027 -13.293 0.563 1.00 0.00 C ATOM 217 CG PRO A 14 138.461 -14.463 1.390 1.00 0.00 C ATOM 218 CD PRO A 14 137.227 -14.930 2.180 1.00 0.00 C ATOM 0 HA PRO A 14 137.199 -11.817 1.979 1.00 0.00 H new ATOM 0 HB2 PRO A 14 137.698 -13.611 -0.426 1.00 0.00 H new ATOM 0 HB3 PRO A 14 138.847 -12.590 0.415 1.00 0.00 H new ATOM 0 HG2 PRO A 14 138.841 -15.265 0.757 1.00 0.00 H new ATOM 0 HG3 PRO A 14 139.269 -14.181 2.065 1.00 0.00 H new ATOM 0 HD2 PRO A 14 136.773 -15.809 1.723 1.00 0.00 H new ATOM 0 HD3 PRO A 14 137.489 -15.201 3.203 1.00 0.00 H new ATOM 226 N MET A 15 136.010 -10.822 -0.020 1.00 0.00 N ATOM 227 CA MET A 15 135.026 -10.207 -0.959 1.00 0.00 C ATOM 228 C MET A 15 135.459 -10.471 -2.402 1.00 0.00 C ATOM 229 O MET A 15 134.652 -10.477 -3.310 1.00 0.00 O ATOM 230 CB MET A 15 134.945 -8.696 -0.714 1.00 0.00 C ATOM 231 CG MET A 15 136.355 -8.101 -0.661 1.00 0.00 C ATOM 232 SD MET A 15 136.253 -6.292 -0.721 1.00 0.00 S ATOM 233 CE MET A 15 135.982 -5.994 1.046 1.00 0.00 C ATOM 0 H MET A 15 136.785 -10.219 0.255 1.00 0.00 H new ATOM 0 HA MET A 15 134.045 -10.650 -0.788 1.00 0.00 H new ATOM 0 HB2 MET A 15 134.370 -8.220 -1.508 1.00 0.00 H new ATOM 0 HB3 MET A 15 134.422 -8.498 0.221 1.00 0.00 H new ATOM 0 HG2 MET A 15 136.860 -8.417 0.252 1.00 0.00 H new ATOM 0 HG3 MET A 15 136.948 -8.470 -1.498 1.00 0.00 H new ATOM 0 HE1 MET A 15 135.481 -5.035 1.181 1.00 0.00 H new ATOM 0 HE2 MET A 15 135.361 -6.789 1.458 1.00 0.00 H new ATOM 0 HE3 MET A 15 136.941 -5.978 1.564 1.00 0.00 H new ATOM 243 N GLY A 16 136.728 -10.693 -2.623 1.00 0.00 N ATOM 244 CA GLY A 16 137.207 -10.960 -4.009 1.00 0.00 C ATOM 245 C GLY A 16 136.757 -9.830 -4.934 1.00 0.00 C ATOM 246 O GLY A 16 136.834 -8.667 -4.594 1.00 0.00 O ATOM 0 H GLY A 16 137.452 -10.701 -1.904 1.00 0.00 H new ATOM 0 HA2 GLY A 16 138.294 -11.041 -4.020 1.00 0.00 H new ATOM 0 HA3 GLY A 16 136.813 -11.912 -4.364 1.00 0.00 H new ATOM 250 N GLU A 17 136.313 -10.168 -6.118 1.00 0.00 N ATOM 251 CA GLU A 17 135.880 -9.126 -7.103 1.00 0.00 C ATOM 252 C GLU A 17 134.353 -9.078 -7.190 1.00 0.00 C ATOM 253 O GLU A 17 133.794 -8.801 -8.233 1.00 0.00 O ATOM 254 CB GLU A 17 136.456 -9.478 -8.477 1.00 0.00 C ATOM 255 CG GLU A 17 137.975 -9.294 -8.450 1.00 0.00 C ATOM 256 CD GLU A 17 138.558 -9.644 -9.821 1.00 0.00 C ATOM 257 OE1 GLU A 17 137.798 -10.068 -10.675 1.00 0.00 O ATOM 258 OE2 GLU A 17 139.756 -9.488 -9.990 1.00 0.00 O ATOM 0 H GLU A 17 136.231 -11.129 -6.449 1.00 0.00 H new ATOM 0 HA GLU A 17 136.243 -8.150 -6.779 1.00 0.00 H new ATOM 0 HB2 GLU A 17 136.207 -10.507 -8.736 1.00 0.00 H new ATOM 0 HB3 GLU A 17 136.014 -8.841 -9.243 1.00 0.00 H new ATOM 0 HG2 GLU A 17 138.222 -8.265 -8.190 1.00 0.00 H new ATOM 0 HG3 GLU A 17 138.415 -9.931 -7.683 1.00 0.00 H new ATOM 265 N LYS A 18 133.669 -9.351 -6.113 1.00 0.00 N ATOM 266 CA LYS A 18 132.179 -9.322 -6.150 1.00 0.00 C ATOM 267 C LYS A 18 131.711 -7.899 -6.507 1.00 0.00 C ATOM 268 O LYS A 18 132.383 -6.933 -6.204 1.00 0.00 O ATOM 269 CB LYS A 18 131.637 -9.715 -4.772 1.00 0.00 C ATOM 270 CG LYS A 18 131.840 -11.217 -4.563 1.00 0.00 C ATOM 271 CD LYS A 18 131.462 -11.594 -3.131 1.00 0.00 C ATOM 272 CE LYS A 18 131.491 -13.116 -2.986 1.00 0.00 C ATOM 273 NZ LYS A 18 130.464 -13.718 -3.883 1.00 0.00 N ATOM 0 H LYS A 18 134.077 -9.593 -5.210 1.00 0.00 H new ATOM 0 HA LYS A 18 131.809 -10.023 -6.899 1.00 0.00 H new ATOM 0 HB2 LYS A 18 132.151 -9.154 -3.992 1.00 0.00 H new ATOM 0 HB3 LYS A 18 130.579 -9.465 -4.699 1.00 0.00 H new ATOM 0 HG2 LYS A 18 131.229 -11.778 -5.270 1.00 0.00 H new ATOM 0 HG3 LYS A 18 132.879 -11.484 -4.757 1.00 0.00 H new ATOM 0 HD2 LYS A 18 132.157 -11.137 -2.427 1.00 0.00 H new ATOM 0 HD3 LYS A 18 130.469 -11.213 -2.892 1.00 0.00 H new ATOM 0 HE2 LYS A 18 132.480 -13.498 -3.239 1.00 0.00 H new ATOM 0 HE3 LYS A 18 131.296 -13.398 -1.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 130.153 -14.630 -3.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 129.648 -13.077 -3.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 130.873 -13.867 -4.828 1.00 0.00 H new ATOM 287 N PRO A 19 130.578 -7.766 -7.162 1.00 0.00 N ATOM 288 CA PRO A 19 130.044 -6.430 -7.578 1.00 0.00 C ATOM 289 C PRO A 19 129.628 -5.561 -6.383 1.00 0.00 C ATOM 290 O PRO A 19 129.359 -6.052 -5.304 1.00 0.00 O ATOM 291 CB PRO A 19 128.830 -6.770 -8.464 1.00 0.00 C ATOM 292 CG PRO A 19 128.412 -8.148 -8.051 1.00 0.00 C ATOM 293 CD PRO A 19 129.681 -8.862 -7.577 1.00 0.00 C ATOM 0 HA PRO A 19 130.801 -5.841 -8.097 1.00 0.00 H new ATOM 0 HB2 PRO A 19 128.022 -6.053 -8.316 1.00 0.00 H new ATOM 0 HB3 PRO A 19 129.094 -6.739 -9.521 1.00 0.00 H new ATOM 0 HG2 PRO A 19 127.670 -8.106 -7.254 1.00 0.00 H new ATOM 0 HG3 PRO A 19 127.955 -8.681 -8.885 1.00 0.00 H new ATOM 0 HD2 PRO A 19 129.471 -9.540 -6.750 1.00 0.00 H new ATOM 0 HD3 PRO A 19 130.124 -9.459 -8.374 1.00 0.00 H new ATOM 301 N VAL A 20 129.588 -4.269 -6.575 1.00 0.00 N ATOM 302 CA VAL A 20 129.205 -3.354 -5.463 1.00 0.00 C ATOM 303 C VAL A 20 127.840 -3.750 -4.895 1.00 0.00 C ATOM 304 O VAL A 20 127.644 -3.801 -3.697 1.00 0.00 O ATOM 305 CB VAL A 20 129.145 -1.911 -5.982 1.00 0.00 C ATOM 306 CG1 VAL A 20 128.214 -1.828 -7.196 1.00 0.00 C ATOM 307 CG2 VAL A 20 128.614 -0.993 -4.877 1.00 0.00 C ATOM 0 H VAL A 20 129.805 -3.807 -7.458 1.00 0.00 H new ATOM 0 HA VAL A 20 129.952 -3.429 -4.673 1.00 0.00 H new ATOM 0 HB VAL A 20 130.147 -1.597 -6.275 1.00 0.00 H new ATOM 0 HG11 VAL A 20 128.178 -0.800 -7.557 1.00 0.00 H new ATOM 0 HG12 VAL A 20 128.589 -2.478 -7.987 1.00 0.00 H new ATOM 0 HG13 VAL A 20 127.212 -2.147 -6.909 1.00 0.00 H new ATOM 0 HG21 VAL A 20 128.571 0.032 -5.245 1.00 0.00 H new ATOM 0 HG22 VAL A 20 127.615 -1.316 -4.585 1.00 0.00 H new ATOM 0 HG23 VAL A 20 129.278 -1.041 -4.014 1.00 0.00 H new ATOM 317 N GLY A 21 126.886 -4.013 -5.753 1.00 0.00 N ATOM 318 CA GLY A 21 125.523 -4.385 -5.280 1.00 0.00 C ATOM 319 C GLY A 21 125.593 -5.623 -4.388 1.00 0.00 C ATOM 320 O GLY A 21 124.600 -6.051 -3.834 1.00 0.00 O ATOM 0 H GLY A 21 126.997 -3.985 -6.767 1.00 0.00 H new ATOM 0 HA2 GLY A 21 125.083 -3.555 -4.728 1.00 0.00 H new ATOM 0 HA3 GLY A 21 124.874 -4.580 -6.134 1.00 0.00 H new ATOM 324 N SER A 22 126.751 -6.205 -4.230 1.00 0.00 N ATOM 325 CA SER A 22 126.860 -7.407 -3.359 1.00 0.00 C ATOM 326 C SER A 22 126.956 -6.952 -1.905 1.00 0.00 C ATOM 327 O SER A 22 126.642 -7.687 -0.989 1.00 0.00 O ATOM 328 CB SER A 22 128.114 -8.199 -3.730 1.00 0.00 C ATOM 329 OG SER A 22 128.177 -9.377 -2.936 1.00 0.00 O ATOM 0 H SER A 22 127.622 -5.901 -4.665 1.00 0.00 H new ATOM 0 HA SER A 22 125.985 -8.042 -3.494 1.00 0.00 H new ATOM 0 HB2 SER A 22 128.093 -8.460 -4.788 1.00 0.00 H new ATOM 0 HB3 SER A 22 129.004 -7.590 -3.569 1.00 0.00 H new ATOM 0 HG SER A 22 128.633 -10.085 -3.437 1.00 0.00 H new ATOM 335 N LEU A 23 127.386 -5.739 -1.685 1.00 0.00 N ATOM 336 CA LEU A 23 127.498 -5.233 -0.292 1.00 0.00 C ATOM 337 C LEU A 23 126.103 -5.174 0.334 1.00 0.00 C ATOM 338 O LEU A 23 125.135 -4.802 -0.299 1.00 0.00 O ATOM 339 CB LEU A 23 128.130 -3.839 -0.300 1.00 0.00 C ATOM 340 CG LEU A 23 129.565 -3.919 -0.848 1.00 0.00 C ATOM 341 CD1 LEU A 23 130.097 -2.500 -1.075 1.00 0.00 C ATOM 342 CD2 LEU A 23 130.480 -4.662 0.146 1.00 0.00 C ATOM 0 H LEU A 23 127.664 -5.079 -2.411 1.00 0.00 H new ATOM 0 HA LEU A 23 128.129 -5.902 0.294 1.00 0.00 H new ATOM 0 HB2 LEU A 23 127.534 -3.163 -0.914 1.00 0.00 H new ATOM 0 HB3 LEU A 23 128.139 -3.428 0.710 1.00 0.00 H new ATOM 0 HG LEU A 23 129.557 -4.467 -1.790 1.00 0.00 H new ATOM 0 HD11 LEU A 23 131.114 -2.551 -1.464 1.00 0.00 H new ATOM 0 HD12 LEU A 23 129.460 -1.983 -1.792 1.00 0.00 H new ATOM 0 HD13 LEU A 23 130.096 -1.956 -0.131 1.00 0.00 H new ATOM 0 HD21 LEU A 23 131.492 -4.710 -0.257 1.00 0.00 H new ATOM 0 HD22 LEU A 23 130.493 -4.129 1.097 1.00 0.00 H new ATOM 0 HD23 LEU A 23 130.103 -5.673 0.302 1.00 0.00 H new ATOM 354 N ALA A 24 126.007 -5.546 1.572 1.00 0.00 N ATOM 355 CA ALA A 24 124.682 -5.527 2.254 1.00 0.00 C ATOM 356 C ALA A 24 124.174 -4.088 2.379 1.00 0.00 C ATOM 357 O ALA A 24 124.907 -3.178 2.713 1.00 0.00 O ATOM 358 CB ALA A 24 124.816 -6.145 3.647 1.00 0.00 C ATOM 0 H ALA A 24 126.787 -5.864 2.147 1.00 0.00 H new ATOM 0 HA ALA A 24 123.970 -6.104 1.664 1.00 0.00 H new ATOM 0 HB1 ALA A 24 123.847 -6.131 4.146 1.00 0.00 H new ATOM 0 HB2 ALA A 24 125.163 -7.174 3.557 1.00 0.00 H new ATOM 0 HB3 ALA A 24 125.534 -5.570 4.232 1.00 0.00 H new ATOM 364 N GLY A 25 122.908 -3.884 2.112 1.00 0.00 N ATOM 365 CA GLY A 25 122.316 -2.512 2.213 1.00 0.00 C ATOM 366 C GLY A 25 122.216 -1.883 0.819 1.00 0.00 C ATOM 367 O GLY A 25 121.464 -0.953 0.605 1.00 0.00 O ATOM 0 H GLY A 25 122.254 -4.613 1.827 1.00 0.00 H new ATOM 0 HA2 GLY A 25 121.327 -2.566 2.669 1.00 0.00 H new ATOM 0 HA3 GLY A 25 122.932 -1.887 2.860 1.00 0.00 H new ATOM 371 N ILE A 26 122.962 -2.384 -0.133 1.00 0.00 N ATOM 372 CA ILE A 26 122.908 -1.816 -1.518 1.00 0.00 C ATOM 373 C ILE A 26 122.018 -2.715 -2.377 1.00 0.00 C ATOM 374 O ILE A 26 122.296 -3.886 -2.548 1.00 0.00 O ATOM 375 CB ILE A 26 124.320 -1.784 -2.106 1.00 0.00 C ATOM 376 CG1 ILE A 26 125.269 -1.060 -1.138 1.00 0.00 C ATOM 377 CG2 ILE A 26 124.299 -1.056 -3.451 1.00 0.00 C ATOM 378 CD1 ILE A 26 124.709 0.318 -0.767 1.00 0.00 C ATOM 0 H ILE A 26 123.608 -3.164 -0.012 1.00 0.00 H new ATOM 0 HA ILE A 26 122.505 -0.804 -1.495 1.00 0.00 H new ATOM 0 HB ILE A 26 124.672 -2.805 -2.255 1.00 0.00 H new ATOM 0 HG12 ILE A 26 125.405 -1.658 -0.237 1.00 0.00 H new ATOM 0 HG13 ILE A 26 126.251 -0.948 -1.598 1.00 0.00 H new ATOM 0 HG21 ILE A 26 125.306 -1.034 -3.869 1.00 0.00 H new ATOM 0 HG22 ILE A 26 123.633 -1.579 -4.137 1.00 0.00 H new ATOM 0 HG23 ILE A 26 123.944 -0.036 -3.307 1.00 0.00 H new ATOM 0 HD11 ILE A 26 125.394 0.816 -0.081 1.00 0.00 H new ATOM 0 HD12 ILE A 26 124.597 0.920 -1.669 1.00 0.00 H new ATOM 0 HD13 ILE A 26 123.738 0.199 -0.287 1.00 0.00 H new ATOM 390 N GLY A 27 120.948 -2.194 -2.924 1.00 0.00 N ATOM 391 CA GLY A 27 120.052 -3.037 -3.771 1.00 0.00 C ATOM 392 C GLY A 27 120.458 -2.920 -5.243 1.00 0.00 C ATOM 393 O GLY A 27 121.358 -2.185 -5.596 1.00 0.00 O ATOM 0 H GLY A 27 120.657 -1.222 -2.820 1.00 0.00 H new ATOM 0 HA2 GLY A 27 120.109 -4.077 -3.451 1.00 0.00 H new ATOM 0 HA3 GLY A 27 119.016 -2.721 -3.645 1.00 0.00 H new ATOM 397 N GLU A 28 119.810 -3.665 -6.093 1.00 0.00 N ATOM 398 CA GLU A 28 120.163 -3.634 -7.542 1.00 0.00 C ATOM 399 C GLU A 28 120.052 -2.205 -8.086 1.00 0.00 C ATOM 400 O GLU A 28 120.865 -1.773 -8.879 1.00 0.00 O ATOM 401 CB GLU A 28 119.199 -4.537 -8.311 1.00 0.00 C ATOM 402 CG GLU A 28 119.464 -5.999 -7.945 1.00 0.00 C ATOM 403 CD GLU A 28 118.498 -6.901 -8.717 1.00 0.00 C ATOM 404 OE1 GLU A 28 117.581 -6.370 -9.324 1.00 0.00 O ATOM 405 OE2 GLU A 28 118.686 -8.105 -8.680 1.00 0.00 O ATOM 0 H GLU A 28 119.048 -4.297 -5.847 1.00 0.00 H new ATOM 0 HA GLU A 28 121.188 -3.984 -7.666 1.00 0.00 H new ATOM 0 HB2 GLU A 28 118.169 -4.273 -8.073 1.00 0.00 H new ATOM 0 HB3 GLU A 28 119.326 -4.391 -9.384 1.00 0.00 H new ATOM 0 HG2 GLU A 28 120.494 -6.264 -8.183 1.00 0.00 H new ATOM 0 HG3 GLU A 28 119.337 -6.145 -6.872 1.00 0.00 H new ATOM 412 N VAL A 29 119.054 -1.470 -7.682 1.00 0.00 N ATOM 413 CA VAL A 29 118.906 -0.078 -8.200 1.00 0.00 C ATOM 414 C VAL A 29 120.045 0.792 -7.668 1.00 0.00 C ATOM 415 O VAL A 29 120.618 1.590 -8.384 1.00 0.00 O ATOM 416 CB VAL A 29 117.568 0.499 -7.734 1.00 0.00 C ATOM 417 CG1 VAL A 29 117.462 1.962 -8.166 1.00 0.00 C ATOM 418 CG2 VAL A 29 116.420 -0.304 -8.350 1.00 0.00 C ATOM 0 H VAL A 29 118.338 -1.769 -7.020 1.00 0.00 H new ATOM 0 HA VAL A 29 118.939 -0.093 -9.289 1.00 0.00 H new ATOM 0 HB VAL A 29 117.507 0.439 -6.647 1.00 0.00 H new ATOM 0 HG11 VAL A 29 116.508 2.371 -7.833 1.00 0.00 H new ATOM 0 HG12 VAL A 29 118.277 2.533 -7.721 1.00 0.00 H new ATOM 0 HG13 VAL A 29 117.525 2.026 -9.252 1.00 0.00 H new ATOM 0 HG21 VAL A 29 115.468 0.109 -8.017 1.00 0.00 H new ATOM 0 HG22 VAL A 29 116.479 -0.248 -9.437 1.00 0.00 H new ATOM 0 HG23 VAL A 29 116.494 -1.345 -8.035 1.00 0.00 H new ATOM 428 N LEU A 30 120.369 0.650 -6.415 1.00 0.00 N ATOM 429 CA LEU A 30 121.459 1.472 -5.822 1.00 0.00 C ATOM 430 C LEU A 30 122.799 1.072 -6.441 1.00 0.00 C ATOM 431 O LEU A 30 123.645 1.902 -6.707 1.00 0.00 O ATOM 432 CB LEU A 30 121.503 1.241 -4.307 1.00 0.00 C ATOM 433 CG LEU A 30 120.235 1.812 -3.649 1.00 0.00 C ATOM 434 CD1 LEU A 30 120.180 1.366 -2.181 1.00 0.00 C ATOM 435 CD2 LEU A 30 120.233 3.353 -3.725 1.00 0.00 C ATOM 0 H LEU A 30 119.923 -0.004 -5.772 1.00 0.00 H new ATOM 0 HA LEU A 30 121.270 2.526 -6.024 1.00 0.00 H new ATOM 0 HB2 LEU A 30 121.583 0.175 -4.096 1.00 0.00 H new ATOM 0 HB3 LEU A 30 122.388 1.717 -3.884 1.00 0.00 H new ATOM 0 HG LEU A 30 119.361 1.438 -4.181 1.00 0.00 H new ATOM 0 HD11 LEU A 30 119.283 1.769 -1.712 1.00 0.00 H new ATOM 0 HD12 LEU A 30 120.157 0.277 -2.132 1.00 0.00 H new ATOM 0 HD13 LEU A 30 121.061 1.735 -1.655 1.00 0.00 H new ATOM 0 HD21 LEU A 30 119.329 3.739 -3.255 1.00 0.00 H new ATOM 0 HD22 LEU A 30 121.108 3.744 -3.205 1.00 0.00 H new ATOM 0 HD23 LEU A 30 120.261 3.666 -4.769 1.00 0.00 H new ATOM 447 N GLY A 31 122.996 -0.194 -6.672 1.00 0.00 N ATOM 448 CA GLY A 31 124.280 -0.651 -7.275 1.00 0.00 C ATOM 449 C GLY A 31 124.474 0.000 -8.649 1.00 0.00 C ATOM 450 O GLY A 31 125.568 0.379 -9.016 1.00 0.00 O ATOM 0 H GLY A 31 122.324 -0.934 -6.470 1.00 0.00 H new ATOM 0 HA2 GLY A 31 125.112 -0.392 -6.620 1.00 0.00 H new ATOM 0 HA3 GLY A 31 124.279 -1.736 -7.374 1.00 0.00 H new ATOM 454 N LYS A 32 123.424 0.113 -9.419 1.00 0.00 N ATOM 455 CA LYS A 32 123.548 0.717 -10.781 1.00 0.00 C ATOM 456 C LYS A 32 123.996 2.182 -10.698 1.00 0.00 C ATOM 457 O LYS A 32 124.780 2.634 -11.508 1.00 0.00 O ATOM 458 CB LYS A 32 122.186 0.632 -11.485 1.00 0.00 C ATOM 459 CG LYS A 32 122.246 1.240 -12.899 1.00 0.00 C ATOM 460 CD LYS A 32 123.200 0.440 -13.796 1.00 0.00 C ATOM 461 CE LYS A 32 122.921 0.780 -15.265 1.00 0.00 C ATOM 462 NZ LYS A 32 123.800 -0.039 -16.146 1.00 0.00 N ATOM 0 H LYS A 32 122.483 -0.187 -9.164 1.00 0.00 H new ATOM 0 HA LYS A 32 124.301 0.166 -11.344 1.00 0.00 H new ATOM 0 HB2 LYS A 32 121.872 -0.410 -11.548 1.00 0.00 H new ATOM 0 HB3 LYS A 32 121.435 1.156 -10.893 1.00 0.00 H new ATOM 0 HG2 LYS A 32 121.249 1.249 -13.338 1.00 0.00 H new ATOM 0 HG3 LYS A 32 122.578 2.276 -12.840 1.00 0.00 H new ATOM 0 HD2 LYS A 32 124.235 0.675 -13.547 1.00 0.00 H new ATOM 0 HD3 LYS A 32 123.066 -0.628 -13.627 1.00 0.00 H new ATOM 0 HE2 LYS A 32 121.874 0.588 -15.500 1.00 0.00 H new ATOM 0 HE3 LYS A 32 123.098 1.841 -15.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 123.608 0.194 -17.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 124.796 0.165 -15.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 123.610 -1.049 -15.984 1.00 0.00 H new ATOM 476 N LYS A 33 123.499 2.942 -9.761 1.00 0.00 N ATOM 477 CA LYS A 33 123.912 4.377 -9.706 1.00 0.00 C ATOM 478 C LYS A 33 125.385 4.477 -9.302 1.00 0.00 C ATOM 479 O LYS A 33 126.143 5.231 -9.879 1.00 0.00 O ATOM 480 CB LYS A 33 123.050 5.121 -8.686 1.00 0.00 C ATOM 481 CG LYS A 33 121.616 5.213 -9.209 1.00 0.00 C ATOM 482 CD LYS A 33 120.745 5.957 -8.196 1.00 0.00 C ATOM 483 CE LYS A 33 119.314 6.043 -8.727 1.00 0.00 C ATOM 484 NZ LYS A 33 118.780 4.666 -8.924 1.00 0.00 N ATOM 0 H LYS A 33 122.838 2.642 -9.044 1.00 0.00 H new ATOM 0 HA LYS A 33 123.778 4.826 -10.690 1.00 0.00 H new ATOM 0 HB2 LYS A 33 123.068 4.600 -7.729 1.00 0.00 H new ATOM 0 HB3 LYS A 33 123.451 6.120 -8.513 1.00 0.00 H new ATOM 0 HG2 LYS A 33 121.601 5.732 -10.167 1.00 0.00 H new ATOM 0 HG3 LYS A 33 121.217 4.214 -9.382 1.00 0.00 H new ATOM 0 HD2 LYS A 33 120.759 5.439 -7.237 1.00 0.00 H new ATOM 0 HD3 LYS A 33 121.142 6.957 -8.023 1.00 0.00 H new ATOM 0 HE2 LYS A 33 118.686 6.593 -8.026 1.00 0.00 H new ATOM 0 HE3 LYS A 33 119.295 6.591 -9.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 118.733 4.454 -9.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 119.406 3.980 -8.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 117.827 4.601 -8.513 1.00 0.00 H new ATOM 498 N LEU A 34 125.805 3.715 -8.333 1.00 0.00 N ATOM 499 CA LEU A 34 127.237 3.765 -7.924 1.00 0.00 C ATOM 500 C LEU A 34 128.103 3.299 -9.103 1.00 0.00 C ATOM 501 O LEU A 34 129.158 3.838 -9.372 1.00 0.00 O ATOM 502 CB LEU A 34 127.449 2.852 -6.709 1.00 0.00 C ATOM 503 CG LEU A 34 126.764 3.450 -5.469 1.00 0.00 C ATOM 504 CD1 LEU A 34 126.748 2.404 -4.351 1.00 0.00 C ATOM 505 CD2 LEU A 34 127.523 4.703 -4.985 1.00 0.00 C ATOM 0 H LEU A 34 125.223 3.062 -7.808 1.00 0.00 H new ATOM 0 HA LEU A 34 127.519 4.782 -7.651 1.00 0.00 H new ATOM 0 HB2 LEU A 34 127.044 1.861 -6.915 1.00 0.00 H new ATOM 0 HB3 LEU A 34 128.515 2.728 -6.520 1.00 0.00 H new ATOM 0 HG LEU A 34 125.745 3.736 -5.730 1.00 0.00 H new ATOM 0 HD11 LEU A 34 126.263 2.822 -3.469 1.00 0.00 H new ATOM 0 HD12 LEU A 34 126.198 1.524 -4.684 1.00 0.00 H new ATOM 0 HD13 LEU A 34 127.771 2.121 -4.103 1.00 0.00 H new ATOM 0 HD21 LEU A 34 127.025 5.114 -4.107 1.00 0.00 H new ATOM 0 HD22 LEU A 34 128.547 4.431 -4.728 1.00 0.00 H new ATOM 0 HD23 LEU A 34 127.534 5.450 -5.778 1.00 0.00 H new ATOM 517 N GLU A 35 127.651 2.293 -9.797 1.00 0.00 N ATOM 518 CA GLU A 35 128.436 1.774 -10.957 1.00 0.00 C ATOM 519 C GLU A 35 128.618 2.884 -11.996 1.00 0.00 C ATOM 520 O GLU A 35 129.673 3.038 -12.579 1.00 0.00 O ATOM 521 CB GLU A 35 127.693 0.589 -11.584 1.00 0.00 C ATOM 522 CG GLU A 35 128.484 0.048 -12.780 1.00 0.00 C ATOM 523 CD GLU A 35 127.766 -1.175 -13.353 1.00 0.00 C ATOM 524 OE1 GLU A 35 126.832 -1.641 -12.719 1.00 0.00 O ATOM 525 OE2 GLU A 35 128.164 -1.629 -14.413 1.00 0.00 O ATOM 0 H GLU A 35 126.773 1.806 -9.614 1.00 0.00 H new ATOM 0 HA GLU A 35 129.417 1.445 -10.615 1.00 0.00 H new ATOM 0 HB2 GLU A 35 127.555 -0.198 -10.843 1.00 0.00 H new ATOM 0 HB3 GLU A 35 126.699 0.901 -11.906 1.00 0.00 H new ATOM 0 HG2 GLU A 35 128.580 0.818 -13.545 1.00 0.00 H new ATOM 0 HG3 GLU A 35 129.494 -0.221 -12.470 1.00 0.00 H new ATOM 532 N GLU A 36 127.594 3.650 -12.241 1.00 0.00 N ATOM 533 CA GLU A 36 127.701 4.744 -13.246 1.00 0.00 C ATOM 534 C GLU A 36 128.681 5.805 -12.742 1.00 0.00 C ATOM 535 O GLU A 36 129.212 6.585 -13.505 1.00 0.00 O ATOM 536 CB GLU A 36 126.318 5.369 -13.462 1.00 0.00 C ATOM 537 CG GLU A 36 126.412 6.489 -14.502 1.00 0.00 C ATOM 538 CD GLU A 36 125.016 7.049 -14.776 1.00 0.00 C ATOM 539 OE1 GLU A 36 124.065 6.509 -14.235 1.00 0.00 O ATOM 540 OE2 GLU A 36 124.919 8.006 -15.527 1.00 0.00 O ATOM 0 H GLU A 36 126.684 3.566 -11.788 1.00 0.00 H new ATOM 0 HA GLU A 36 128.066 4.342 -14.191 1.00 0.00 H new ATOM 0 HB2 GLU A 36 125.613 4.608 -13.796 1.00 0.00 H new ATOM 0 HB3 GLU A 36 125.937 5.765 -12.521 1.00 0.00 H new ATOM 0 HG2 GLU A 36 127.069 7.281 -14.141 1.00 0.00 H new ATOM 0 HG3 GLU A 36 126.850 6.107 -15.424 1.00 0.00 H new ATOM 547 N ARG A 37 128.908 5.853 -11.457 1.00 0.00 N ATOM 548 CA ARG A 37 129.839 6.889 -10.908 1.00 0.00 C ATOM 549 C ARG A 37 131.277 6.359 -10.846 1.00 0.00 C ATOM 550 O ARG A 37 132.168 7.049 -10.391 1.00 0.00 O ATOM 551 CB ARG A 37 129.385 7.320 -9.510 1.00 0.00 C ATOM 552 CG ARG A 37 128.088 8.129 -9.624 1.00 0.00 C ATOM 553 CD ARG A 37 127.760 8.772 -8.276 1.00 0.00 C ATOM 554 NE ARG A 37 128.779 9.816 -7.967 1.00 0.00 N ATOM 555 CZ ARG A 37 128.530 10.728 -7.065 1.00 0.00 C ATOM 556 NH1 ARG A 37 127.365 10.768 -6.482 1.00 0.00 N ATOM 557 NH2 ARG A 37 129.443 11.610 -6.761 1.00 0.00 N ATOM 0 H ARG A 37 128.495 5.227 -10.766 1.00 0.00 H new ATOM 0 HA ARG A 37 129.817 7.750 -11.576 1.00 0.00 H new ATOM 0 HB2 ARG A 37 129.226 6.444 -8.881 1.00 0.00 H new ATOM 0 HB3 ARG A 37 130.160 7.919 -9.032 1.00 0.00 H new ATOM 0 HG2 ARG A 37 128.194 8.899 -10.388 1.00 0.00 H new ATOM 0 HG3 ARG A 37 127.270 7.480 -9.937 1.00 0.00 H new ATOM 0 HD2 ARG A 37 126.765 9.216 -8.304 1.00 0.00 H new ATOM 0 HD3 ARG A 37 127.749 8.015 -7.492 1.00 0.00 H new ATOM 0 HE ARG A 37 129.672 9.818 -8.460 1.00 0.00 H new ATOM 0 HH11 ARG A 37 126.647 10.087 -6.730 1.00 0.00 H new ATOM 0 HH12 ARG A 37 127.171 11.480 -5.778 1.00 0.00 H new ATOM 0 HH21 ARG A 37 130.350 11.587 -7.227 1.00 0.00 H new ATOM 0 HH22 ARG A 37 129.250 12.322 -6.057 1.00 0.00 H new ATOM 571 N GLY A 38 131.530 5.167 -11.338 1.00 0.00 N ATOM 572 CA GLY A 38 132.935 4.637 -11.345 1.00 0.00 C ATOM 573 C GLY A 38 133.158 3.591 -10.251 1.00 0.00 C ATOM 574 O GLY A 38 134.260 3.108 -10.080 1.00 0.00 O ATOM 0 H GLY A 38 130.829 4.541 -11.733 1.00 0.00 H new ATOM 0 HA2 GLY A 38 133.151 4.196 -12.318 1.00 0.00 H new ATOM 0 HA3 GLY A 38 133.634 5.462 -11.206 1.00 0.00 H new ATOM 578 N PHE A 39 132.138 3.209 -9.526 1.00 0.00 N ATOM 579 CA PHE A 39 132.316 2.162 -8.470 1.00 0.00 C ATOM 580 C PHE A 39 131.737 0.856 -9.009 1.00 0.00 C ATOM 581 O PHE A 39 130.677 0.419 -8.609 1.00 0.00 O ATOM 582 CB PHE A 39 131.548 2.566 -7.215 1.00 0.00 C ATOM 583 CG PHE A 39 132.135 3.827 -6.633 1.00 0.00 C ATOM 584 CD1 PHE A 39 133.202 3.750 -5.733 1.00 0.00 C ATOM 585 CD2 PHE A 39 131.616 5.072 -7.000 1.00 0.00 C ATOM 586 CE1 PHE A 39 133.752 4.920 -5.196 1.00 0.00 C ATOM 587 CE2 PHE A 39 132.163 6.243 -6.465 1.00 0.00 C ATOM 588 CZ PHE A 39 133.234 6.168 -5.562 1.00 0.00 C ATOM 0 H PHE A 39 131.190 3.575 -9.618 1.00 0.00 H new ATOM 0 HA PHE A 39 133.371 2.048 -8.222 1.00 0.00 H new ATOM 0 HB2 PHE A 39 130.497 2.723 -7.457 1.00 0.00 H new ATOM 0 HB3 PHE A 39 131.589 1.763 -6.479 1.00 0.00 H new ATOM 0 HD1 PHE A 39 133.602 2.787 -5.452 1.00 0.00 H new ATOM 0 HD2 PHE A 39 130.793 5.130 -7.697 1.00 0.00 H new ATOM 0 HE1 PHE A 39 134.575 4.860 -4.500 1.00 0.00 H new ATOM 0 HE2 PHE A 39 131.761 7.205 -6.747 1.00 0.00 H new ATOM 0 HZ PHE A 39 133.658 7.072 -5.150 1.00 0.00 H new ATOM 598 N ASP A 40 132.415 0.252 -9.945 1.00 0.00 N ATOM 599 CA ASP A 40 131.890 -1.004 -10.550 1.00 0.00 C ATOM 600 C ASP A 40 132.176 -2.207 -9.649 1.00 0.00 C ATOM 601 O ASP A 40 131.679 -3.289 -9.893 1.00 0.00 O ATOM 602 CB ASP A 40 132.541 -1.214 -11.920 1.00 0.00 C ATOM 603 CG ASP A 40 134.052 -1.377 -11.754 1.00 0.00 C ATOM 604 OD1 ASP A 40 134.551 -1.045 -10.691 1.00 0.00 O ATOM 605 OD2 ASP A 40 134.684 -1.829 -12.693 1.00 0.00 O ATOM 0 H ASP A 40 133.309 0.573 -10.317 1.00 0.00 H new ATOM 0 HA ASP A 40 130.810 -0.914 -10.662 1.00 0.00 H new ATOM 0 HB2 ASP A 40 132.121 -2.097 -12.401 1.00 0.00 H new ATOM 0 HB3 ASP A 40 132.326 -0.365 -12.569 1.00 0.00 H new ATOM 610 N LYS A 41 132.974 -2.047 -8.617 1.00 0.00 N ATOM 611 CA LYS A 41 133.279 -3.210 -7.718 1.00 0.00 C ATOM 612 C LYS A 41 133.233 -2.778 -6.247 1.00 0.00 C ATOM 613 O LYS A 41 133.333 -1.613 -5.918 1.00 0.00 O ATOM 614 CB LYS A 41 134.649 -3.779 -8.079 1.00 0.00 C ATOM 615 CG LYS A 41 134.597 -4.258 -9.533 1.00 0.00 C ATOM 616 CD LYS A 41 135.907 -4.944 -9.909 1.00 0.00 C ATOM 617 CE LYS A 41 135.871 -5.328 -11.389 1.00 0.00 C ATOM 618 NZ LYS A 41 134.782 -6.320 -11.616 1.00 0.00 N ATOM 0 H LYS A 41 133.424 -1.169 -8.359 1.00 0.00 H new ATOM 0 HA LYS A 41 132.526 -3.985 -7.858 1.00 0.00 H new ATOM 0 HB2 LYS A 41 135.421 -3.020 -7.956 1.00 0.00 H new ATOM 0 HB3 LYS A 41 134.905 -4.605 -7.415 1.00 0.00 H new ATOM 0 HG2 LYS A 41 133.765 -4.949 -9.666 1.00 0.00 H new ATOM 0 HG3 LYS A 41 134.418 -3.412 -10.196 1.00 0.00 H new ATOM 0 HD2 LYS A 41 136.748 -4.278 -9.715 1.00 0.00 H new ATOM 0 HD3 LYS A 41 136.055 -5.832 -9.295 1.00 0.00 H new ATOM 0 HE2 LYS A 41 135.705 -4.442 -12.002 1.00 0.00 H new ATOM 0 HE3 LYS A 41 136.830 -5.749 -11.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 134.948 -6.819 -12.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 134.770 -7.007 -10.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 133.867 -5.827 -11.658 1.00 0.00 H new ATOM 632 N ALA A 42 133.034 -3.726 -5.367 1.00 0.00 N ATOM 633 CA ALA A 42 132.923 -3.419 -3.907 1.00 0.00 C ATOM 634 C ALA A 42 134.235 -2.884 -3.314 1.00 0.00 C ATOM 635 O ALA A 42 134.219 -1.989 -2.492 1.00 0.00 O ATOM 636 CB ALA A 42 132.531 -4.696 -3.164 1.00 0.00 C ATOM 0 H ALA A 42 132.942 -4.715 -5.601 1.00 0.00 H new ATOM 0 HA ALA A 42 132.168 -2.641 -3.790 1.00 0.00 H new ATOM 0 HB1 ALA A 42 132.447 -4.485 -2.098 1.00 0.00 H new ATOM 0 HB2 ALA A 42 131.573 -5.056 -3.540 1.00 0.00 H new ATOM 0 HB3 ALA A 42 133.293 -5.459 -3.324 1.00 0.00 H new ATOM 642 N TYR A 43 135.364 -3.433 -3.670 1.00 0.00 N ATOM 643 CA TYR A 43 136.634 -2.950 -3.048 1.00 0.00 C ATOM 644 C TYR A 43 136.853 -1.459 -3.332 1.00 0.00 C ATOM 645 O TYR A 43 137.600 -0.802 -2.635 1.00 0.00 O ATOM 646 CB TYR A 43 137.840 -3.785 -3.504 1.00 0.00 C ATOM 647 CG TYR A 43 138.100 -3.629 -4.983 1.00 0.00 C ATOM 648 CD1 TYR A 43 138.708 -2.467 -5.468 1.00 0.00 C ATOM 649 CD2 TYR A 43 137.763 -4.663 -5.864 1.00 0.00 C ATOM 650 CE1 TYR A 43 138.975 -2.338 -6.833 1.00 0.00 C ATOM 651 CE2 TYR A 43 138.029 -4.531 -7.230 1.00 0.00 C ATOM 652 CZ TYR A 43 138.637 -3.369 -7.715 1.00 0.00 C ATOM 653 OH TYR A 43 138.903 -3.241 -9.063 1.00 0.00 O ATOM 0 H TYR A 43 135.465 -4.183 -4.353 1.00 0.00 H new ATOM 0 HA TYR A 43 136.540 -3.077 -1.969 1.00 0.00 H new ATOM 0 HB2 TYR A 43 138.725 -3.481 -2.945 1.00 0.00 H new ATOM 0 HB3 TYR A 43 137.663 -4.836 -3.274 1.00 0.00 H new ATOM 0 HD1 TYR A 43 138.971 -1.670 -4.788 1.00 0.00 H new ATOM 0 HD2 TYR A 43 137.298 -5.562 -5.489 1.00 0.00 H new ATOM 0 HE1 TYR A 43 139.443 -1.440 -7.208 1.00 0.00 H new ATOM 0 HE2 TYR A 43 137.765 -5.327 -7.911 1.00 0.00 H new ATOM 0 HH TYR A 43 139.070 -4.126 -9.449 1.00 0.00 H new ATOM 663 N VAL A 44 136.195 -0.900 -4.311 1.00 0.00 N ATOM 664 CA VAL A 44 136.372 0.562 -4.560 1.00 0.00 C ATOM 665 C VAL A 44 135.553 1.302 -3.500 1.00 0.00 C ATOM 666 O VAL A 44 135.902 2.373 -3.042 1.00 0.00 O ATOM 667 CB VAL A 44 135.862 0.936 -5.957 1.00 0.00 C ATOM 668 CG1 VAL A 44 136.189 2.404 -6.250 1.00 0.00 C ATOM 669 CG2 VAL A 44 136.540 0.054 -7.006 1.00 0.00 C ATOM 0 H VAL A 44 135.553 -1.381 -4.940 1.00 0.00 H new ATOM 0 HA VAL A 44 137.427 0.831 -4.505 1.00 0.00 H new ATOM 0 HB VAL A 44 134.783 0.786 -5.994 1.00 0.00 H new ATOM 0 HG11 VAL A 44 135.825 2.667 -7.243 1.00 0.00 H new ATOM 0 HG12 VAL A 44 135.707 3.039 -5.507 1.00 0.00 H new ATOM 0 HG13 VAL A 44 137.268 2.552 -6.208 1.00 0.00 H new ATOM 0 HG21 VAL A 44 136.175 0.322 -7.998 1.00 0.00 H new ATOM 0 HG22 VAL A 44 137.619 0.202 -6.964 1.00 0.00 H new ATOM 0 HG23 VAL A 44 136.310 -0.992 -6.806 1.00 0.00 H new ATOM 679 N VAL A 45 134.466 0.695 -3.103 1.00 0.00 N ATOM 680 CA VAL A 45 133.587 1.296 -2.061 1.00 0.00 C ATOM 681 C VAL A 45 134.236 1.058 -0.699 1.00 0.00 C ATOM 682 O VAL A 45 134.212 1.906 0.170 1.00 0.00 O ATOM 683 CB VAL A 45 132.212 0.629 -2.099 1.00 0.00 C ATOM 684 CG1 VAL A 45 131.332 1.204 -0.987 1.00 0.00 C ATOM 685 CG2 VAL A 45 131.560 0.894 -3.456 1.00 0.00 C ATOM 0 H VAL A 45 134.147 -0.205 -3.463 1.00 0.00 H new ATOM 0 HA VAL A 45 133.463 2.364 -2.241 1.00 0.00 H new ATOM 0 HB VAL A 45 132.323 -0.445 -1.951 1.00 0.00 H new ATOM 0 HG11 VAL A 45 130.352 0.728 -1.015 1.00 0.00 H new ATOM 0 HG12 VAL A 45 131.799 1.017 -0.020 1.00 0.00 H new ATOM 0 HG13 VAL A 45 131.217 2.278 -1.132 1.00 0.00 H new ATOM 0 HG21 VAL A 45 130.579 0.420 -3.487 1.00 0.00 H new ATOM 0 HG22 VAL A 45 131.449 1.968 -3.603 1.00 0.00 H new ATOM 0 HG23 VAL A 45 132.187 0.483 -4.247 1.00 0.00 H new ATOM 695 N LEU A 46 134.849 -0.081 -0.520 1.00 0.00 N ATOM 696 CA LEU A 46 135.534 -0.357 0.768 1.00 0.00 C ATOM 697 C LEU A 46 136.605 0.718 0.945 1.00 0.00 C ATOM 698 O LEU A 46 136.842 1.210 2.030 1.00 0.00 O ATOM 699 CB LEU A 46 136.197 -1.745 0.716 1.00 0.00 C ATOM 700 CG LEU A 46 136.859 -2.082 2.070 1.00 0.00 C ATOM 701 CD1 LEU A 46 135.798 -2.522 3.092 1.00 0.00 C ATOM 702 CD2 LEU A 46 137.904 -3.198 1.879 1.00 0.00 C ATOM 0 H LEU A 46 134.903 -0.829 -1.211 1.00 0.00 H new ATOM 0 HA LEU A 46 134.826 -0.344 1.597 1.00 0.00 H new ATOM 0 HB2 LEU A 46 135.451 -2.501 0.471 1.00 0.00 H new ATOM 0 HB3 LEU A 46 136.945 -1.767 -0.076 1.00 0.00 H new ATOM 0 HG LEU A 46 137.356 -1.189 2.449 1.00 0.00 H new ATOM 0 HD11 LEU A 46 136.281 -2.756 4.041 1.00 0.00 H new ATOM 0 HD12 LEU A 46 135.079 -1.716 3.240 1.00 0.00 H new ATOM 0 HD13 LEU A 46 135.280 -3.407 2.721 1.00 0.00 H new ATOM 0 HD21 LEU A 46 138.367 -3.431 2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 46 137.416 -4.090 1.486 1.00 0.00 H new ATOM 0 HD23 LEU A 46 138.669 -2.864 1.178 1.00 0.00 H new ATOM 714 N GLY A 47 137.257 1.074 -0.130 1.00 0.00 N ATOM 715 CA GLY A 47 138.327 2.106 -0.064 1.00 0.00 C ATOM 716 C GLY A 47 137.754 3.429 0.448 1.00 0.00 C ATOM 717 O GLY A 47 138.356 4.095 1.266 1.00 0.00 O ATOM 0 H GLY A 47 137.090 0.688 -1.059 1.00 0.00 H new ATOM 0 HA2 GLY A 47 139.127 1.769 0.595 1.00 0.00 H new ATOM 0 HA3 GLY A 47 138.766 2.249 -1.051 1.00 0.00 H new ATOM 721 N GLN A 48 136.595 3.821 -0.012 1.00 0.00 N ATOM 722 CA GLN A 48 136.004 5.100 0.475 1.00 0.00 C ATOM 723 C GLN A 48 135.808 5.006 1.991 1.00 0.00 C ATOM 724 O GLN A 48 136.083 5.934 2.727 1.00 0.00 O ATOM 725 CB GLN A 48 134.651 5.331 -0.206 1.00 0.00 C ATOM 726 CG GLN A 48 134.148 6.742 0.107 1.00 0.00 C ATOM 727 CD GLN A 48 135.025 7.769 -0.613 1.00 0.00 C ATOM 728 OE1 GLN A 48 135.419 7.563 -1.744 1.00 0.00 O ATOM 729 NE2 GLN A 48 135.344 8.879 -0.003 1.00 0.00 N ATOM 0 H GLN A 48 136.036 3.315 -0.699 1.00 0.00 H new ATOM 0 HA GLN A 48 136.668 5.931 0.238 1.00 0.00 H new ATOM 0 HB2 GLN A 48 134.749 5.201 -1.284 1.00 0.00 H new ATOM 0 HB3 GLN A 48 133.928 4.592 0.140 1.00 0.00 H new ATOM 0 HG2 GLN A 48 133.111 6.848 -0.210 1.00 0.00 H new ATOM 0 HG3 GLN A 48 134.172 6.918 1.182 1.00 0.00 H new ATOM 0 HE21 GLN A 48 135.014 9.052 0.946 1.00 0.00 H new ATOM 0 HE22 GLN A 48 135.924 9.572 -0.476 1.00 0.00 H new ATOM 738 N PHE A 49 135.345 3.878 2.457 1.00 0.00 N ATOM 739 CA PHE A 49 135.135 3.689 3.921 1.00 0.00 C ATOM 740 C PHE A 49 136.480 3.864 4.641 1.00 0.00 C ATOM 741 O PHE A 49 136.564 4.466 5.693 1.00 0.00 O ATOM 742 CB PHE A 49 134.582 2.279 4.148 1.00 0.00 C ATOM 743 CG PHE A 49 134.319 2.052 5.616 1.00 0.00 C ATOM 744 CD1 PHE A 49 133.309 2.775 6.261 1.00 0.00 C ATOM 745 CD2 PHE A 49 135.068 1.108 6.329 1.00 0.00 C ATOM 746 CE1 PHE A 49 133.050 2.558 7.619 1.00 0.00 C ATOM 747 CE2 PHE A 49 134.811 0.890 7.685 1.00 0.00 C ATOM 748 CZ PHE A 49 133.801 1.615 8.332 1.00 0.00 C ATOM 0 H PHE A 49 135.101 3.072 1.881 1.00 0.00 H new ATOM 0 HA PHE A 49 134.429 4.421 4.314 1.00 0.00 H new ATOM 0 HB2 PHE A 49 133.660 2.146 3.581 1.00 0.00 H new ATOM 0 HB3 PHE A 49 135.292 1.538 3.780 1.00 0.00 H new ATOM 0 HD1 PHE A 49 132.729 3.501 5.710 1.00 0.00 H new ATOM 0 HD2 PHE A 49 135.845 0.548 5.830 1.00 0.00 H new ATOM 0 HE1 PHE A 49 132.272 3.117 8.117 1.00 0.00 H new ATOM 0 HE2 PHE A 49 135.391 0.163 8.234 1.00 0.00 H new ATOM 0 HZ PHE A 49 133.602 1.447 9.380 1.00 0.00 H new ATOM 758 N LEU A 50 137.521 3.340 4.071 1.00 0.00 N ATOM 759 CA LEU A 50 138.862 3.477 4.717 1.00 0.00 C ATOM 760 C LEU A 50 139.282 4.949 4.658 1.00 0.00 C ATOM 761 O LEU A 50 139.882 5.473 5.576 1.00 0.00 O ATOM 762 CB LEU A 50 139.896 2.609 3.989 1.00 0.00 C ATOM 763 CG LEU A 50 139.502 1.127 4.075 1.00 0.00 C ATOM 764 CD1 LEU A 50 140.514 0.292 3.283 1.00 0.00 C ATOM 765 CD2 LEU A 50 139.489 0.661 5.544 1.00 0.00 C ATOM 0 H LEU A 50 137.510 2.824 3.191 1.00 0.00 H new ATOM 0 HA LEU A 50 138.806 3.144 5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 50 139.966 2.914 2.945 1.00 0.00 H new ATOM 0 HB3 LEU A 50 140.881 2.757 4.431 1.00 0.00 H new ATOM 0 HG LEU A 50 138.504 0.998 3.657 1.00 0.00 H new ATOM 0 HD11 LEU A 50 140.240 -0.762 3.340 1.00 0.00 H new ATOM 0 HD12 LEU A 50 140.513 0.611 2.241 1.00 0.00 H new ATOM 0 HD13 LEU A 50 141.510 0.431 3.704 1.00 0.00 H new ATOM 0 HD21 LEU A 50 139.208 -0.391 5.589 1.00 0.00 H new ATOM 0 HD22 LEU A 50 140.481 0.791 5.976 1.00 0.00 H new ATOM 0 HD23 LEU A 50 138.768 1.254 6.107 1.00 0.00 H new ATOM 777 N VAL A 51 138.975 5.612 3.581 1.00 0.00 N ATOM 778 CA VAL A 51 139.353 7.051 3.444 1.00 0.00 C ATOM 779 C VAL A 51 138.594 7.895 4.480 1.00 0.00 C ATOM 780 O VAL A 51 139.050 8.945 4.889 1.00 0.00 O ATOM 781 CB VAL A 51 139.014 7.529 2.026 1.00 0.00 C ATOM 782 CG1 VAL A 51 139.165 9.050 1.934 1.00 0.00 C ATOM 783 CG2 VAL A 51 139.968 6.870 1.029 1.00 0.00 C ATOM 0 H VAL A 51 138.475 5.220 2.783 1.00 0.00 H new ATOM 0 HA VAL A 51 140.423 7.164 3.619 1.00 0.00 H new ATOM 0 HB VAL A 51 137.985 7.255 1.795 1.00 0.00 H new ATOM 0 HG11 VAL A 51 138.922 9.379 0.924 1.00 0.00 H new ATOM 0 HG12 VAL A 51 138.488 9.526 2.643 1.00 0.00 H new ATOM 0 HG13 VAL A 51 140.192 9.329 2.169 1.00 0.00 H new ATOM 0 HG21 VAL A 51 139.730 7.207 0.020 1.00 0.00 H new ATOM 0 HG22 VAL A 51 140.994 7.145 1.271 1.00 0.00 H new ATOM 0 HG23 VAL A 51 139.860 5.787 1.084 1.00 0.00 H new ATOM 793 N LEU A 52 137.436 7.454 4.896 1.00 0.00 N ATOM 794 CA LEU A 52 136.640 8.242 5.892 1.00 0.00 C ATOM 795 C LEU A 52 137.016 7.826 7.319 1.00 0.00 C ATOM 796 O LEU A 52 136.331 8.159 8.266 1.00 0.00 O ATOM 797 CB LEU A 52 135.148 7.988 5.671 1.00 0.00 C ATOM 798 CG LEU A 52 134.718 8.520 4.295 1.00 0.00 C ATOM 799 CD1 LEU A 52 133.273 8.088 4.018 1.00 0.00 C ATOM 800 CD2 LEU A 52 134.819 10.060 4.260 1.00 0.00 C ATOM 0 H LEU A 52 137.004 6.582 4.591 1.00 0.00 H new ATOM 0 HA LEU A 52 136.859 9.301 5.758 1.00 0.00 H new ATOM 0 HB2 LEU A 52 134.940 6.920 5.738 1.00 0.00 H new ATOM 0 HB3 LEU A 52 134.568 8.475 6.455 1.00 0.00 H new ATOM 0 HG LEU A 52 135.378 8.111 3.530 1.00 0.00 H new ATOM 0 HD11 LEU A 52 132.962 8.463 3.043 1.00 0.00 H new ATOM 0 HD12 LEU A 52 133.211 7.000 4.026 1.00 0.00 H new ATOM 0 HD13 LEU A 52 132.618 8.494 4.789 1.00 0.00 H new ATOM 0 HD21 LEU A 52 134.511 10.423 3.279 1.00 0.00 H new ATOM 0 HD22 LEU A 52 134.168 10.485 5.024 1.00 0.00 H new ATOM 0 HD23 LEU A 52 135.849 10.362 4.452 1.00 0.00 H new ATOM 812 N LYS A 53 138.094 7.117 7.492 1.00 0.00 N ATOM 813 CA LYS A 53 138.502 6.707 8.868 1.00 0.00 C ATOM 814 C LYS A 53 137.301 6.134 9.631 1.00 0.00 C ATOM 815 O LYS A 53 137.126 6.398 10.804 1.00 0.00 O ATOM 816 CB LYS A 53 139.055 7.920 9.622 1.00 0.00 C ATOM 817 CG LYS A 53 140.408 8.320 9.021 1.00 0.00 C ATOM 818 CD LYS A 53 141.033 9.460 9.837 1.00 0.00 C ATOM 819 CE LYS A 53 140.377 10.796 9.475 1.00 0.00 C ATOM 820 NZ LYS A 53 141.141 11.907 10.109 1.00 0.00 N ATOM 0 H LYS A 53 138.711 6.803 6.743 1.00 0.00 H new ATOM 0 HA LYS A 53 139.272 5.939 8.793 1.00 0.00 H new ATOM 0 HB2 LYS A 53 138.355 8.753 9.556 1.00 0.00 H new ATOM 0 HB3 LYS A 53 139.170 7.683 10.680 1.00 0.00 H new ATOM 0 HG2 LYS A 53 141.078 7.460 9.011 1.00 0.00 H new ATOM 0 HG3 LYS A 53 140.276 8.634 7.986 1.00 0.00 H new ATOM 0 HD2 LYS A 53 140.910 9.264 10.902 1.00 0.00 H new ATOM 0 HD3 LYS A 53 142.105 9.509 9.644 1.00 0.00 H new ATOM 0 HE2 LYS A 53 140.358 10.924 8.393 1.00 0.00 H new ATOM 0 HE3 LYS A 53 139.342 10.810 9.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 140.698 12.816 9.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 141.137 11.786 11.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 142.122 11.896 9.763 1.00 0.00 H new ATOM 834 N LYS A 54 136.476 5.352 8.972 1.00 0.00 N ATOM 835 CA LYS A 54 135.279 4.734 9.633 1.00 0.00 C ATOM 836 C LYS A 54 134.339 5.818 10.175 1.00 0.00 C ATOM 837 O LYS A 54 133.521 5.552 11.033 1.00 0.00 O ATOM 838 CB LYS A 54 135.727 3.838 10.798 1.00 0.00 C ATOM 839 CG LYS A 54 136.636 2.726 10.276 1.00 0.00 C ATOM 840 CD LYS A 54 137.077 1.838 11.442 1.00 0.00 C ATOM 841 CE LYS A 54 137.988 0.725 10.922 1.00 0.00 C ATOM 842 NZ LYS A 54 138.341 -0.190 12.043 1.00 0.00 N ATOM 0 H LYS A 54 136.584 5.112 7.987 1.00 0.00 H new ATOM 0 HA LYS A 54 134.750 4.140 8.888 1.00 0.00 H new ATOM 0 HB2 LYS A 54 136.255 4.432 11.543 1.00 0.00 H new ATOM 0 HB3 LYS A 54 134.857 3.407 11.293 1.00 0.00 H new ATOM 0 HG2 LYS A 54 136.109 2.131 9.531 1.00 0.00 H new ATOM 0 HG3 LYS A 54 137.508 3.156 9.782 1.00 0.00 H new ATOM 0 HD2 LYS A 54 137.603 2.434 12.188 1.00 0.00 H new ATOM 0 HD3 LYS A 54 136.205 1.408 11.935 1.00 0.00 H new ATOM 0 HE2 LYS A 54 137.486 0.170 10.129 1.00 0.00 H new ATOM 0 HE3 LYS A 54 138.892 1.153 10.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 138.961 -0.947 11.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 138.836 0.345 12.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 137.474 -0.607 12.437 1.00 0.00 H new ATOM 856 N ASP A 55 134.415 7.026 9.685 1.00 0.00 N ATOM 857 CA ASP A 55 133.483 8.073 10.199 1.00 0.00 C ATOM 858 C ASP A 55 132.055 7.723 9.751 1.00 0.00 C ATOM 859 O ASP A 55 131.737 7.734 8.579 1.00 0.00 O ATOM 860 CB ASP A 55 133.890 9.435 9.640 1.00 0.00 C ATOM 861 CG ASP A 55 135.208 9.873 10.283 1.00 0.00 C ATOM 862 OD1 ASP A 55 135.371 9.640 11.469 1.00 0.00 O ATOM 863 OD2 ASP A 55 136.030 10.436 9.579 1.00 0.00 O ATOM 0 H ASP A 55 135.069 7.331 8.964 1.00 0.00 H new ATOM 0 HA ASP A 55 133.525 8.114 11.287 1.00 0.00 H new ATOM 0 HB2 ASP A 55 134.002 9.378 8.557 1.00 0.00 H new ATOM 0 HB3 ASP A 55 133.112 10.171 9.842 1.00 0.00 H new ATOM 868 N GLU A 56 131.206 7.378 10.685 1.00 0.00 N ATOM 869 CA GLU A 56 129.801 6.983 10.351 1.00 0.00 C ATOM 870 C GLU A 56 128.973 8.146 9.780 1.00 0.00 C ATOM 871 O GLU A 56 128.209 7.968 8.853 1.00 0.00 O ATOM 872 CB GLU A 56 129.130 6.470 11.626 1.00 0.00 C ATOM 873 CG GLU A 56 127.766 5.869 11.288 1.00 0.00 C ATOM 874 CD GLU A 56 127.177 5.224 12.543 1.00 0.00 C ATOM 875 OE1 GLU A 56 127.832 5.273 13.572 1.00 0.00 O ATOM 876 OE2 GLU A 56 126.086 4.688 12.455 1.00 0.00 O ATOM 0 H GLU A 56 131.429 7.352 11.680 1.00 0.00 H new ATOM 0 HA GLU A 56 129.845 6.213 9.581 1.00 0.00 H new ATOM 0 HB2 GLU A 56 129.760 5.719 12.103 1.00 0.00 H new ATOM 0 HB3 GLU A 56 129.011 7.286 12.339 1.00 0.00 H new ATOM 0 HG2 GLU A 56 127.096 6.643 10.914 1.00 0.00 H new ATOM 0 HG3 GLU A 56 127.868 5.127 10.497 1.00 0.00 H new ATOM 883 N ASP A 57 129.099 9.324 10.326 1.00 0.00 N ATOM 884 CA ASP A 57 128.295 10.479 9.813 1.00 0.00 C ATOM 885 C ASP A 57 128.780 10.890 8.423 1.00 0.00 C ATOM 886 O ASP A 57 127.996 11.214 7.554 1.00 0.00 O ATOM 887 CB ASP A 57 128.429 11.664 10.773 1.00 0.00 C ATOM 888 CG ASP A 57 127.693 11.351 12.076 1.00 0.00 C ATOM 889 OD1 ASP A 57 126.850 10.469 12.060 1.00 0.00 O ATOM 890 OD2 ASP A 57 127.981 12.002 13.067 1.00 0.00 O ATOM 0 H ASP A 57 129.722 9.541 11.104 1.00 0.00 H new ATOM 0 HA ASP A 57 127.250 10.177 9.746 1.00 0.00 H new ATOM 0 HB2 ASP A 57 129.481 11.864 10.976 1.00 0.00 H new ATOM 0 HB3 ASP A 57 128.016 12.564 10.317 1.00 0.00 H new ATOM 895 N LEU A 58 130.055 10.877 8.204 1.00 0.00 N ATOM 896 CA LEU A 58 130.562 11.266 6.859 1.00 0.00 C ATOM 897 C LEU A 58 130.176 10.185 5.847 1.00 0.00 C ATOM 898 O LEU A 58 129.791 10.475 4.733 1.00 0.00 O ATOM 899 CB LEU A 58 132.086 11.425 6.891 1.00 0.00 C ATOM 900 CG LEU A 58 132.487 12.535 7.876 1.00 0.00 C ATOM 901 CD1 LEU A 58 134.015 12.599 7.962 1.00 0.00 C ATOM 902 CD2 LEU A 58 131.945 13.893 7.396 1.00 0.00 C ATOM 0 H LEU A 58 130.767 10.618 8.886 1.00 0.00 H new ATOM 0 HA LEU A 58 130.119 12.219 6.569 1.00 0.00 H new ATOM 0 HB2 LEU A 58 132.550 10.484 7.185 1.00 0.00 H new ATOM 0 HB3 LEU A 58 132.454 11.664 5.893 1.00 0.00 H new ATOM 0 HG LEU A 58 132.066 12.314 8.857 1.00 0.00 H new ATOM 0 HD11 LEU A 58 134.308 13.384 8.659 1.00 0.00 H new ATOM 0 HD12 LEU A 58 134.400 11.641 8.312 1.00 0.00 H new ATOM 0 HD13 LEU A 58 134.426 12.817 6.976 1.00 0.00 H new ATOM 0 HD21 LEU A 58 132.236 14.671 8.102 1.00 0.00 H new ATOM 0 HD22 LEU A 58 132.357 14.122 6.413 1.00 0.00 H new ATOM 0 HD23 LEU A 58 130.858 13.849 7.332 1.00 0.00 H new ATOM 914 N PHE A 59 130.252 8.944 6.237 1.00 0.00 N ATOM 915 CA PHE A 59 129.861 7.844 5.308 1.00 0.00 C ATOM 916 C PHE A 59 128.370 7.960 4.972 1.00 0.00 C ATOM 917 O PHE A 59 127.973 7.868 3.827 1.00 0.00 O ATOM 918 CB PHE A 59 130.148 6.495 5.972 1.00 0.00 C ATOM 919 CG PHE A 59 129.673 5.367 5.083 1.00 0.00 C ATOM 920 CD1 PHE A 59 130.437 4.979 3.974 1.00 0.00 C ATOM 921 CD2 PHE A 59 128.479 4.697 5.378 1.00 0.00 C ATOM 922 CE1 PHE A 59 130.003 3.923 3.160 1.00 0.00 C ATOM 923 CE2 PHE A 59 128.046 3.643 4.565 1.00 0.00 C ATOM 924 CZ PHE A 59 128.809 3.256 3.455 1.00 0.00 C ATOM 0 H PHE A 59 130.568 8.642 7.159 1.00 0.00 H new ATOM 0 HA PHE A 59 130.437 7.919 4.386 1.00 0.00 H new ATOM 0 HB2 PHE A 59 131.217 6.394 6.161 1.00 0.00 H new ATOM 0 HB3 PHE A 59 129.647 6.443 6.939 1.00 0.00 H new ATOM 0 HD1 PHE A 59 131.359 5.493 3.747 1.00 0.00 H new ATOM 0 HD2 PHE A 59 127.891 4.994 6.234 1.00 0.00 H new ATOM 0 HE1 PHE A 59 130.591 3.624 2.305 1.00 0.00 H new ATOM 0 HE2 PHE A 59 127.124 3.128 4.793 1.00 0.00 H new ATOM 0 HZ PHE A 59 128.475 2.443 2.827 1.00 0.00 H new ATOM 934 N ARG A 60 127.538 8.142 5.966 1.00 0.00 N ATOM 935 CA ARG A 60 126.073 8.237 5.703 1.00 0.00 C ATOM 936 C ARG A 60 125.761 9.411 4.773 1.00 0.00 C ATOM 937 O ARG A 60 125.029 9.268 3.813 1.00 0.00 O ATOM 938 CB ARG A 60 125.313 8.437 7.022 1.00 0.00 C ATOM 939 CG ARG A 60 125.298 7.134 7.825 1.00 0.00 C ATOM 940 CD ARG A 60 124.512 7.353 9.121 1.00 0.00 C ATOM 941 NE ARG A 60 124.366 6.056 9.842 1.00 0.00 N ATOM 942 CZ ARG A 60 123.959 6.040 11.083 1.00 0.00 C ATOM 943 NH1 ARG A 60 123.705 7.160 11.702 1.00 0.00 N ATOM 944 NH2 ARG A 60 123.806 4.902 11.705 1.00 0.00 N ATOM 0 H ARG A 60 127.810 8.229 6.945 1.00 0.00 H new ATOM 0 HA ARG A 60 125.758 7.309 5.227 1.00 0.00 H new ATOM 0 HB2 ARG A 60 125.785 9.227 7.606 1.00 0.00 H new ATOM 0 HB3 ARG A 60 124.292 8.758 6.817 1.00 0.00 H new ATOM 0 HG2 ARG A 60 124.842 6.336 7.239 1.00 0.00 H new ATOM 0 HG3 ARG A 60 126.317 6.820 8.052 1.00 0.00 H new ATOM 0 HD2 ARG A 60 125.027 8.076 9.753 1.00 0.00 H new ATOM 0 HD3 ARG A 60 123.530 7.769 8.897 1.00 0.00 H new ATOM 0 HE ARG A 60 124.584 5.181 9.366 1.00 0.00 H new ATOM 0 HH11 ARG A 60 123.824 8.049 11.217 1.00 0.00 H new ATOM 0 HH12 ARG A 60 123.387 7.146 12.671 1.00 0.00 H new ATOM 0 HH21 ARG A 60 124.004 4.026 11.222 1.00 0.00 H new ATOM 0 HH22 ARG A 60 123.488 4.889 12.674 1.00 0.00 H new ATOM 958 N GLU A 61 126.303 10.569 5.031 1.00 0.00 N ATOM 959 CA GLU A 61 126.021 11.729 4.142 1.00 0.00 C ATOM 960 C GLU A 61 126.571 11.440 2.744 1.00 0.00 C ATOM 961 O GLU A 61 125.962 11.775 1.747 1.00 0.00 O ATOM 962 CB GLU A 61 126.689 12.983 4.712 1.00 0.00 C ATOM 963 CG GLU A 61 126.402 14.177 3.800 1.00 0.00 C ATOM 964 CD GLU A 61 126.928 15.456 4.451 1.00 0.00 C ATOM 965 OE1 GLU A 61 127.376 15.381 5.583 1.00 0.00 O ATOM 966 OE2 GLU A 61 126.876 16.491 3.807 1.00 0.00 O ATOM 0 H GLU A 61 126.926 10.761 5.815 1.00 0.00 H new ATOM 0 HA GLU A 61 124.945 11.892 4.081 1.00 0.00 H new ATOM 0 HB2 GLU A 61 126.315 13.182 5.716 1.00 0.00 H new ATOM 0 HB3 GLU A 61 127.765 12.828 4.797 1.00 0.00 H new ATOM 0 HG2 GLU A 61 126.876 14.029 2.830 1.00 0.00 H new ATOM 0 HG3 GLU A 61 125.330 14.262 3.621 1.00 0.00 H new ATOM 973 N TRP A 62 127.714 10.825 2.660 1.00 0.00 N ATOM 974 CA TRP A 62 128.294 10.522 1.321 1.00 0.00 C ATOM 975 C TRP A 62 127.411 9.539 0.545 1.00 0.00 C ATOM 976 O TRP A 62 127.113 9.746 -0.609 1.00 0.00 O ATOM 977 CB TRP A 62 129.697 9.915 1.494 1.00 0.00 C ATOM 978 CG TRP A 62 130.168 9.343 0.187 1.00 0.00 C ATOM 979 CD1 TRP A 62 130.799 10.035 -0.789 1.00 0.00 C ATOM 980 CD2 TRP A 62 130.030 7.977 -0.303 1.00 0.00 C ATOM 981 NE1 TRP A 62 131.062 9.177 -1.845 1.00 0.00 N ATOM 982 CE2 TRP A 62 130.607 7.897 -1.592 1.00 0.00 C ATOM 983 CE3 TRP A 62 129.468 6.810 0.246 1.00 0.00 C ATOM 984 CZ2 TRP A 62 130.623 6.698 -2.313 1.00 0.00 C ATOM 985 CZ3 TRP A 62 129.485 5.605 -0.475 1.00 0.00 C ATOM 986 CH2 TRP A 62 130.061 5.550 -1.751 1.00 0.00 C ATOM 0 H TRP A 62 128.272 10.519 3.457 1.00 0.00 H new ATOM 0 HA TRP A 62 128.354 11.453 0.757 1.00 0.00 H new ATOM 0 HB2 TRP A 62 130.394 10.679 1.839 1.00 0.00 H new ATOM 0 HB3 TRP A 62 129.675 9.136 2.256 1.00 0.00 H new ATOM 0 HD1 TRP A 62 131.056 11.083 -0.751 1.00 0.00 H new ATOM 0 HE1 TRP A 62 131.534 9.456 -2.705 1.00 0.00 H new ATOM 0 HE3 TRP A 62 129.021 6.841 1.228 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 131.067 6.661 -3.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 129.051 4.715 -0.043 1.00 0.00 H new ATOM 0 HH2 TRP A 62 130.070 4.620 -2.300 1.00 0.00 H new ATOM 997 N LEU A 63 127.001 8.469 1.159 1.00 0.00 N ATOM 998 CA LEU A 63 126.161 7.476 0.430 1.00 0.00 C ATOM 999 C LEU A 63 124.795 8.072 0.090 1.00 0.00 C ATOM 1000 O LEU A 63 124.310 7.944 -1.018 1.00 0.00 O ATOM 1001 CB LEU A 63 125.984 6.230 1.308 1.00 0.00 C ATOM 1002 CG LEU A 63 125.102 5.191 0.601 1.00 0.00 C ATOM 1003 CD1 LEU A 63 125.727 4.779 -0.741 1.00 0.00 C ATOM 1004 CD2 LEU A 63 124.973 3.961 1.505 1.00 0.00 C ATOM 0 H LEU A 63 127.208 8.237 2.130 1.00 0.00 H new ATOM 0 HA LEU A 63 126.656 7.205 -0.502 1.00 0.00 H new ATOM 0 HB2 LEU A 63 126.958 5.795 1.533 1.00 0.00 H new ATOM 0 HB3 LEU A 63 125.533 6.510 2.260 1.00 0.00 H new ATOM 0 HG LEU A 63 124.120 5.623 0.407 1.00 0.00 H new ATOM 0 HD11 LEU A 63 125.089 4.042 -1.229 1.00 0.00 H new ATOM 0 HD12 LEU A 63 125.824 5.656 -1.382 1.00 0.00 H new ATOM 0 HD13 LEU A 63 126.712 4.347 -0.566 1.00 0.00 H new ATOM 0 HD21 LEU A 63 124.349 3.214 1.016 1.00 0.00 H new ATOM 0 HD22 LEU A 63 125.962 3.542 1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 63 124.517 4.251 2.451 1.00 0.00 H new ATOM 1016 N LYS A 64 124.165 8.714 1.028 1.00 0.00 N ATOM 1017 CA LYS A 64 122.828 9.310 0.755 1.00 0.00 C ATOM 1018 C LYS A 64 122.936 10.357 -0.355 1.00 0.00 C ATOM 1019 O LYS A 64 122.146 10.381 -1.278 1.00 0.00 O ATOM 1020 CB LYS A 64 122.282 9.955 2.030 1.00 0.00 C ATOM 1021 CG LYS A 64 120.881 10.509 1.763 1.00 0.00 C ATOM 1022 CD LYS A 64 120.316 11.109 3.049 1.00 0.00 C ATOM 1023 CE LYS A 64 118.946 11.727 2.762 1.00 0.00 C ATOM 1024 NZ LYS A 64 119.122 12.957 1.940 1.00 0.00 N ATOM 0 H LYS A 64 124.517 8.853 1.975 1.00 0.00 H new ATOM 0 HA LYS A 64 122.147 8.524 0.431 1.00 0.00 H new ATOM 0 HB2 LYS A 64 122.247 9.221 2.835 1.00 0.00 H new ATOM 0 HB3 LYS A 64 122.945 10.756 2.358 1.00 0.00 H new ATOM 0 HG2 LYS A 64 120.922 11.268 0.982 1.00 0.00 H new ATOM 0 HG3 LYS A 64 120.227 9.715 1.402 1.00 0.00 H new ATOM 0 HD2 LYS A 64 120.226 10.338 3.814 1.00 0.00 H new ATOM 0 HD3 LYS A 64 120.995 11.867 3.439 1.00 0.00 H new ATOM 0 HE2 LYS A 64 118.315 11.011 2.235 1.00 0.00 H new ATOM 0 HE3 LYS A 64 118.441 11.970 3.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 118.268 13.546 2.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 119.942 13.493 2.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 119.279 12.691 0.947 1.00 0.00 H new ATOM 1038 N ASP A 65 123.904 11.225 -0.269 1.00 0.00 N ATOM 1039 CA ASP A 65 124.060 12.275 -1.314 1.00 0.00 C ATOM 1040 C ASP A 65 124.518 11.632 -2.622 1.00 0.00 C ATOM 1041 O ASP A 65 124.271 12.142 -3.698 1.00 0.00 O ATOM 1042 CB ASP A 65 125.101 13.301 -0.867 1.00 0.00 C ATOM 1043 CG ASP A 65 124.542 14.126 0.292 1.00 0.00 C ATOM 1044 OD1 ASP A 65 123.363 14.439 0.257 1.00 0.00 O ATOM 1045 OD2 ASP A 65 125.303 14.444 1.189 1.00 0.00 O ATOM 0 H ASP A 65 124.595 11.253 0.481 1.00 0.00 H new ATOM 0 HA ASP A 65 123.102 12.772 -1.465 1.00 0.00 H new ATOM 0 HB2 ASP A 65 126.016 12.795 -0.559 1.00 0.00 H new ATOM 0 HB3 ASP A 65 125.363 13.955 -1.699 1.00 0.00 H new ATOM 1050 N THR A 66 125.208 10.529 -2.538 1.00 0.00 N ATOM 1051 CA THR A 66 125.715 9.865 -3.770 1.00 0.00 C ATOM 1052 C THR A 66 124.585 9.134 -4.495 1.00 0.00 C ATOM 1053 O THR A 66 124.574 9.091 -5.710 1.00 0.00 O ATOM 1054 CB THR A 66 126.829 8.875 -3.384 1.00 0.00 C ATOM 1055 OG1 THR A 66 127.884 9.590 -2.761 1.00 0.00 O ATOM 1056 CG2 THR A 66 127.388 8.160 -4.620 1.00 0.00 C ATOM 0 H THR A 66 125.443 10.057 -1.665 1.00 0.00 H new ATOM 0 HA THR A 66 126.114 10.621 -4.446 1.00 0.00 H new ATOM 0 HB THR A 66 126.408 8.130 -2.708 1.00 0.00 H new ATOM 0 HG1 THR A 66 127.574 9.948 -1.903 1.00 0.00 H new ATOM 0 HG21 THR A 66 128.173 7.467 -4.316 1.00 0.00 H new ATOM 0 HG22 THR A 66 126.588 7.608 -5.114 1.00 0.00 H new ATOM 0 HG23 THR A 66 127.801 8.896 -5.310 1.00 0.00 H new ATOM 1064 N CYS A 67 123.655 8.517 -3.793 1.00 0.00 N ATOM 1065 CA CYS A 67 122.569 7.753 -4.495 1.00 0.00 C ATOM 1066 C CYS A 67 121.176 8.103 -3.962 1.00 0.00 C ATOM 1067 O CYS A 67 120.195 8.001 -4.672 1.00 0.00 O ATOM 1068 CB CYS A 67 122.812 6.260 -4.281 1.00 0.00 C ATOM 1069 SG CYS A 67 122.897 5.913 -2.507 1.00 0.00 S ATOM 0 H CYS A 67 123.603 8.510 -2.774 1.00 0.00 H new ATOM 0 HA CYS A 67 122.599 8.019 -5.552 1.00 0.00 H new ATOM 0 HB2 CYS A 67 122.010 5.681 -4.738 1.00 0.00 H new ATOM 0 HB3 CYS A 67 123.740 5.958 -4.767 1.00 0.00 H new ATOM 0 HG CYS A 67 123.881 6.580 -1.981 1.00 0.00 H new ATOM 1075 N GLY A 68 121.074 8.493 -2.714 1.00 0.00 N ATOM 1076 CA GLY A 68 119.735 8.825 -2.124 1.00 0.00 C ATOM 1077 C GLY A 68 119.335 7.704 -1.162 1.00 0.00 C ATOM 1078 O GLY A 68 118.187 7.573 -0.788 1.00 0.00 O ATOM 0 H GLY A 68 121.862 8.597 -2.075 1.00 0.00 H new ATOM 0 HA2 GLY A 68 119.779 9.778 -1.597 1.00 0.00 H new ATOM 0 HA3 GLY A 68 118.990 8.931 -2.912 1.00 0.00 H new ATOM 1082 N ALA A 69 120.278 6.893 -0.760 1.00 0.00 N ATOM 1083 CA ALA A 69 119.967 5.775 0.176 1.00 0.00 C ATOM 1084 C ALA A 69 119.206 6.303 1.393 1.00 0.00 C ATOM 1085 O ALA A 69 119.353 7.445 1.781 1.00 0.00 O ATOM 1086 CB ALA A 69 121.274 5.130 0.644 1.00 0.00 C ATOM 0 H ALA A 69 121.256 6.958 -1.042 1.00 0.00 H new ATOM 0 HA ALA A 69 119.351 5.040 -0.341 1.00 0.00 H new ATOM 0 HB1 ALA A 69 121.051 4.312 1.329 1.00 0.00 H new ATOM 0 HB2 ALA A 69 121.818 4.744 -0.218 1.00 0.00 H new ATOM 0 HB3 ALA A 69 121.885 5.875 1.155 1.00 0.00 H new ATOM 1092 N ASN A 70 118.390 5.479 1.998 1.00 0.00 N ATOM 1093 CA ASN A 70 117.611 5.929 3.190 1.00 0.00 C ATOM 1094 C ASN A 70 118.401 5.629 4.466 1.00 0.00 C ATOM 1095 O ASN A 70 119.412 4.956 4.442 1.00 0.00 O ATOM 1096 CB ASN A 70 116.279 5.173 3.231 1.00 0.00 C ATOM 1097 CG ASN A 70 115.424 5.704 4.383 1.00 0.00 C ATOM 1098 OD1 ASN A 70 115.209 6.987 4.484 1.00 0.00 O flip ATOM 1099 ND2 ASN A 70 114.945 4.943 5.199 1.00 0.00 N flip ATOM 0 H ASN A 70 118.229 4.512 1.717 1.00 0.00 H new ATOM 0 HA ASN A 70 117.429 7.002 3.123 1.00 0.00 H new ATOM 0 HB2 ASN A 70 115.750 5.295 2.286 1.00 0.00 H new ATOM 0 HB3 ASN A 70 116.459 4.106 3.360 1.00 0.00 H new ATOM 0 HD21 ASN A 70 115.113 3.940 5.121 1.00 0.00 H new ATOM 0 HD22 ASN A 70 114.375 5.307 5.963 1.00 0.00 H new ATOM 1106 N ALA A 71 117.949 6.138 5.577 1.00 0.00 N ATOM 1107 CA ALA A 71 118.666 5.908 6.863 1.00 0.00 C ATOM 1108 C ALA A 71 118.745 4.410 7.179 1.00 0.00 C ATOM 1109 O ALA A 71 119.702 3.951 7.765 1.00 0.00 O ATOM 1110 CB ALA A 71 117.921 6.621 7.992 1.00 0.00 C ATOM 0 H ALA A 71 117.107 6.708 5.651 1.00 0.00 H new ATOM 0 HA ALA A 71 119.678 6.302 6.773 1.00 0.00 H new ATOM 0 HB1 ALA A 71 118.443 6.455 8.934 1.00 0.00 H new ATOM 0 HB2 ALA A 71 117.881 7.690 7.783 1.00 0.00 H new ATOM 0 HB3 ALA A 71 116.907 6.227 8.064 1.00 0.00 H new ATOM 1116 N LYS A 72 117.747 3.646 6.828 1.00 0.00 N ATOM 1117 CA LYS A 72 117.790 2.189 7.156 1.00 0.00 C ATOM 1118 C LYS A 72 118.831 1.473 6.292 1.00 0.00 C ATOM 1119 O LYS A 72 119.574 0.630 6.762 1.00 0.00 O ATOM 1120 CB LYS A 72 116.410 1.575 6.895 1.00 0.00 C ATOM 1121 CG LYS A 72 115.364 2.194 7.835 1.00 0.00 C ATOM 1122 CD LYS A 72 115.446 1.557 9.229 1.00 0.00 C ATOM 1123 CE LYS A 72 114.246 2.006 10.062 1.00 0.00 C ATOM 1124 NZ LYS A 72 114.244 1.278 11.362 1.00 0.00 N ATOM 0 H LYS A 72 116.912 3.961 6.334 1.00 0.00 H new ATOM 0 HA LYS A 72 118.064 2.072 8.205 1.00 0.00 H new ATOM 0 HB2 LYS A 72 116.121 1.742 5.858 1.00 0.00 H new ATOM 0 HB3 LYS A 72 116.450 0.496 7.045 1.00 0.00 H new ATOM 0 HG2 LYS A 72 115.526 3.269 7.911 1.00 0.00 H new ATOM 0 HG3 LYS A 72 114.366 2.050 7.422 1.00 0.00 H new ATOM 0 HD2 LYS A 72 115.458 0.470 9.145 1.00 0.00 H new ATOM 0 HD3 LYS A 72 116.374 1.849 9.721 1.00 0.00 H new ATOM 0 HE2 LYS A 72 114.292 3.081 10.235 1.00 0.00 H new ATOM 0 HE3 LYS A 72 113.320 1.809 9.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 113.428 1.583 11.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 114.181 0.255 11.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 115.122 1.487 11.878 1.00 0.00 H new ATOM 1138 N GLN A 73 118.873 1.780 5.025 1.00 0.00 N ATOM 1139 CA GLN A 73 119.838 1.097 4.124 1.00 0.00 C ATOM 1140 C GLN A 73 121.268 1.488 4.483 1.00 0.00 C ATOM 1141 O GLN A 73 122.190 0.711 4.327 1.00 0.00 O ATOM 1142 CB GLN A 73 119.541 1.482 2.671 1.00 0.00 C ATOM 1143 CG GLN A 73 118.178 0.915 2.253 1.00 0.00 C ATOM 1144 CD GLN A 73 118.224 -0.616 2.247 1.00 0.00 C ATOM 1145 OE1 GLN A 73 117.227 -1.266 2.491 1.00 0.00 O ATOM 1146 NE2 GLN A 73 119.345 -1.224 1.973 1.00 0.00 N ATOM 0 H GLN A 73 118.278 2.476 4.576 1.00 0.00 H new ATOM 0 HA GLN A 73 119.733 0.019 4.243 1.00 0.00 H new ATOM 0 HB2 GLN A 73 119.542 2.567 2.565 1.00 0.00 H new ATOM 0 HB3 GLN A 73 120.322 1.097 2.016 1.00 0.00 H new ATOM 0 HG2 GLN A 73 117.406 1.261 2.940 1.00 0.00 H new ATOM 0 HG3 GLN A 73 117.911 1.282 1.262 1.00 0.00 H new ATOM 0 HE21 GLN A 73 120.183 -0.680 1.768 1.00 0.00 H new ATOM 0 HE22 GLN A 73 119.383 -2.243 1.964 1.00 0.00 H new ATOM 1155 N SER A 74 121.470 2.684 4.960 1.00 0.00 N ATOM 1156 CA SER A 74 122.848 3.111 5.322 1.00 0.00 C ATOM 1157 C SER A 74 123.329 2.328 6.544 1.00 0.00 C ATOM 1158 O SER A 74 124.485 1.966 6.642 1.00 0.00 O ATOM 1159 CB SER A 74 122.847 4.605 5.647 1.00 0.00 C ATOM 1160 OG SER A 74 122.335 4.796 6.960 1.00 0.00 O ATOM 0 H SER A 74 120.742 3.382 5.114 1.00 0.00 H new ATOM 0 HA SER A 74 123.517 2.917 4.483 1.00 0.00 H new ATOM 0 HB2 SER A 74 123.858 5.006 5.576 1.00 0.00 H new ATOM 0 HB3 SER A 74 122.238 5.147 4.923 1.00 0.00 H new ATOM 0 HG SER A 74 121.431 4.422 7.016 1.00 0.00 H new ATOM 1166 N ARG A 75 122.457 2.064 7.485 1.00 0.00 N ATOM 1167 CA ARG A 75 122.869 1.311 8.703 1.00 0.00 C ATOM 1168 C ARG A 75 123.383 -0.072 8.318 1.00 0.00 C ATOM 1169 O ARG A 75 124.322 -0.572 8.906 1.00 0.00 O ATOM 1170 CB ARG A 75 121.675 1.173 9.647 1.00 0.00 C ATOM 1171 CG ARG A 75 121.344 2.541 10.244 1.00 0.00 C ATOM 1172 CD ARG A 75 120.109 2.424 11.138 1.00 0.00 C ATOM 1173 NE ARG A 75 120.380 1.459 12.238 1.00 0.00 N ATOM 1174 CZ ARG A 75 119.601 1.430 13.284 1.00 0.00 C ATOM 1175 NH1 ARG A 75 118.591 2.252 13.365 1.00 0.00 N ATOM 1176 NH2 ARG A 75 119.831 0.582 14.248 1.00 0.00 N ATOM 0 H ARG A 75 121.475 2.340 7.459 1.00 0.00 H new ATOM 0 HA ARG A 75 123.668 1.857 9.205 1.00 0.00 H new ATOM 0 HB2 ARG A 75 120.813 0.781 9.107 1.00 0.00 H new ATOM 0 HB3 ARG A 75 121.904 0.462 10.441 1.00 0.00 H new ATOM 0 HG2 ARG A 75 122.190 2.911 10.822 1.00 0.00 H new ATOM 0 HG3 ARG A 75 121.162 3.262 9.447 1.00 0.00 H new ATOM 0 HD2 ARG A 75 119.853 3.400 11.551 1.00 0.00 H new ATOM 0 HD3 ARG A 75 119.253 2.091 10.551 1.00 0.00 H new ATOM 0 HE ARG A 75 121.174 0.821 12.174 1.00 0.00 H new ATOM 0 HH11 ARG A 75 118.412 2.916 12.611 1.00 0.00 H new ATOM 0 HH12 ARG A 75 117.981 2.231 14.182 1.00 0.00 H new ATOM 0 HH21 ARG A 75 120.621 -0.060 14.185 1.00 0.00 H new ATOM 0 HH22 ARG A 75 119.221 0.561 15.065 1.00 0.00 H new ATOM 1190 N ASP A 76 122.774 -0.723 7.366 1.00 0.00 N ATOM 1191 CA ASP A 76 123.226 -2.089 6.989 1.00 0.00 C ATOM 1192 C ASP A 76 124.613 -2.043 6.348 1.00 0.00 C ATOM 1193 O ASP A 76 125.446 -2.892 6.602 1.00 0.00 O ATOM 1194 CB ASP A 76 122.228 -2.689 5.996 1.00 0.00 C ATOM 1195 CG ASP A 76 120.912 -2.994 6.715 1.00 0.00 C ATOM 1196 OD1 ASP A 76 120.950 -3.188 7.919 1.00 0.00 O ATOM 1197 OD2 ASP A 76 119.891 -3.030 6.049 1.00 0.00 O ATOM 0 H ASP A 76 121.981 -0.366 6.833 1.00 0.00 H new ATOM 0 HA ASP A 76 123.280 -2.703 7.888 1.00 0.00 H new ATOM 0 HB2 ASP A 76 122.053 -1.994 5.175 1.00 0.00 H new ATOM 0 HB3 ASP A 76 122.636 -3.601 5.560 1.00 0.00 H new ATOM 1202 N CYS A 77 124.883 -1.069 5.523 1.00 0.00 N ATOM 1203 CA CYS A 77 126.226 -0.998 4.883 1.00 0.00 C ATOM 1204 C CYS A 77 127.295 -0.632 5.918 1.00 0.00 C ATOM 1205 O CYS A 77 128.396 -1.145 5.882 1.00 0.00 O ATOM 1206 CB CYS A 77 126.208 0.070 3.788 1.00 0.00 C ATOM 1207 SG CYS A 77 125.192 -0.500 2.403 1.00 0.00 S ATOM 0 H CYS A 77 124.236 -0.324 5.266 1.00 0.00 H new ATOM 0 HA CYS A 77 126.463 -1.973 4.456 1.00 0.00 H new ATOM 0 HB2 CYS A 77 125.810 1.005 4.184 1.00 0.00 H new ATOM 0 HB3 CYS A 77 127.223 0.274 3.448 1.00 0.00 H new ATOM 0 HG CYS A 77 125.175 -1.800 2.383 1.00 0.00 H new ATOM 1213 N PHE A 78 127.008 0.266 6.822 1.00 0.00 N ATOM 1214 CA PHE A 78 128.051 0.654 7.814 1.00 0.00 C ATOM 1215 C PHE A 78 128.476 -0.563 8.632 1.00 0.00 C ATOM 1216 O PHE A 78 129.629 -0.947 8.639 1.00 0.00 O ATOM 1217 CB PHE A 78 127.494 1.735 8.741 1.00 0.00 C ATOM 1218 CG PHE A 78 128.545 2.131 9.750 1.00 0.00 C ATOM 1219 CD1 PHE A 78 129.446 3.165 9.462 1.00 0.00 C ATOM 1220 CD2 PHE A 78 128.614 1.467 10.978 1.00 0.00 C ATOM 1221 CE1 PHE A 78 130.415 3.531 10.405 1.00 0.00 C ATOM 1222 CE2 PHE A 78 129.582 1.833 11.920 1.00 0.00 C ATOM 1223 CZ PHE A 78 130.483 2.866 11.634 1.00 0.00 C ATOM 0 H PHE A 78 126.110 0.741 6.916 1.00 0.00 H new ATOM 0 HA PHE A 78 128.922 1.042 7.286 1.00 0.00 H new ATOM 0 HB2 PHE A 78 127.189 2.605 8.159 1.00 0.00 H new ATOM 0 HB3 PHE A 78 126.605 1.366 9.253 1.00 0.00 H new ATOM 0 HD1 PHE A 78 129.393 3.679 8.514 1.00 0.00 H new ATOM 0 HD2 PHE A 78 127.919 0.670 11.200 1.00 0.00 H new ATOM 0 HE1 PHE A 78 131.110 4.327 10.183 1.00 0.00 H new ATOM 0 HE2 PHE A 78 129.634 1.318 12.868 1.00 0.00 H new ATOM 0 HZ PHE A 78 131.230 3.149 12.361 1.00 0.00 H new ATOM 1233 N GLY A 79 127.559 -1.169 9.331 1.00 0.00 N ATOM 1234 CA GLY A 79 127.909 -2.355 10.158 1.00 0.00 C ATOM 1235 C GLY A 79 128.442 -3.487 9.276 1.00 0.00 C ATOM 1236 O GLY A 79 129.302 -4.244 9.673 1.00 0.00 O ATOM 0 H GLY A 79 126.578 -0.892 9.365 1.00 0.00 H new ATOM 0 HA2 GLY A 79 128.659 -2.080 10.899 1.00 0.00 H new ATOM 0 HA3 GLY A 79 127.030 -2.696 10.705 1.00 0.00 H new ATOM 1240 N CYS A 80 127.951 -3.608 8.077 1.00 0.00 N ATOM 1241 CA CYS A 80 128.452 -4.700 7.195 1.00 0.00 C ATOM 1242 C CYS A 80 129.911 -4.428 6.829 1.00 0.00 C ATOM 1243 O CYS A 80 130.756 -5.296 6.915 1.00 0.00 O ATOM 1244 CB CYS A 80 127.611 -4.760 5.922 1.00 0.00 C ATOM 1245 SG CYS A 80 128.186 -6.128 4.887 1.00 0.00 S ATOM 0 H CYS A 80 127.233 -3.007 7.671 1.00 0.00 H new ATOM 0 HA CYS A 80 128.378 -5.652 7.721 1.00 0.00 H new ATOM 0 HB2 CYS A 80 126.559 -4.897 6.174 1.00 0.00 H new ATOM 0 HB3 CYS A 80 127.689 -3.819 5.377 1.00 0.00 H new ATOM 0 HG CYS A 80 128.177 -5.762 3.640 1.00 0.00 H new ATOM 1251 N LEU A 81 130.216 -3.224 6.442 1.00 0.00 N ATOM 1252 CA LEU A 81 131.630 -2.912 6.099 1.00 0.00 C ATOM 1253 C LEU A 81 132.463 -2.919 7.388 1.00 0.00 C ATOM 1254 O LEU A 81 133.587 -3.380 7.406 1.00 0.00 O ATOM 1255 CB LEU A 81 131.707 -1.533 5.432 1.00 0.00 C ATOM 1256 CG LEU A 81 131.031 -1.581 4.052 1.00 0.00 C ATOM 1257 CD1 LEU A 81 130.910 -0.155 3.501 1.00 0.00 C ATOM 1258 CD2 LEU A 81 131.854 -2.449 3.075 1.00 0.00 C ATOM 0 H LEU A 81 129.558 -2.450 6.349 1.00 0.00 H new ATOM 0 HA LEU A 81 132.019 -3.658 5.406 1.00 0.00 H new ATOM 0 HB2 LEU A 81 131.219 -0.788 6.060 1.00 0.00 H new ATOM 0 HB3 LEU A 81 132.748 -1.228 5.326 1.00 0.00 H new ATOM 0 HG LEU A 81 130.040 -2.023 4.157 1.00 0.00 H new ATOM 0 HD11 LEU A 81 130.431 -0.183 2.522 1.00 0.00 H new ATOM 0 HD12 LEU A 81 130.310 0.448 4.182 1.00 0.00 H new ATOM 0 HD13 LEU A 81 131.903 0.284 3.407 1.00 0.00 H new ATOM 0 HD21 LEU A 81 131.360 -2.471 2.104 1.00 0.00 H new ATOM 0 HD22 LEU A 81 132.852 -2.026 2.965 1.00 0.00 H new ATOM 0 HD23 LEU A 81 131.931 -3.463 3.466 1.00 0.00 H new ATOM 1270 N ARG A 82 131.920 -2.409 8.465 1.00 0.00 N ATOM 1271 CA ARG A 82 132.678 -2.380 9.754 1.00 0.00 C ATOM 1272 C ARG A 82 133.048 -3.803 10.191 1.00 0.00 C ATOM 1273 O ARG A 82 134.151 -4.058 10.630 1.00 0.00 O ATOM 1274 CB ARG A 82 131.807 -1.744 10.846 1.00 0.00 C ATOM 1275 CG ARG A 82 132.660 -1.458 12.100 1.00 0.00 C ATOM 1276 CD ARG A 82 131.780 -1.478 13.359 1.00 0.00 C ATOM 1277 NE ARG A 82 130.431 -0.930 13.045 1.00 0.00 N ATOM 1278 CZ ARG A 82 129.438 -1.141 13.867 1.00 0.00 C ATOM 1279 NH1 ARG A 82 129.627 -1.849 14.948 1.00 0.00 N ATOM 1280 NH2 ARG A 82 128.258 -0.650 13.610 1.00 0.00 N ATOM 0 H ARG A 82 130.982 -2.010 8.507 1.00 0.00 H new ATOM 0 HA ARG A 82 133.588 -1.798 9.607 1.00 0.00 H new ATOM 0 HB2 ARG A 82 131.365 -0.818 10.477 1.00 0.00 H new ATOM 0 HB3 ARG A 82 130.983 -2.411 11.100 1.00 0.00 H new ATOM 0 HG2 ARG A 82 133.450 -2.204 12.188 1.00 0.00 H new ATOM 0 HG3 ARG A 82 133.147 -0.487 12.004 1.00 0.00 H new ATOM 0 HD2 ARG A 82 131.689 -2.498 13.734 1.00 0.00 H new ATOM 0 HD3 ARG A 82 132.246 -0.889 14.148 1.00 0.00 H new ATOM 0 HE ARG A 82 130.283 -0.392 12.191 1.00 0.00 H new ATOM 0 HH11 ARG A 82 130.549 -2.236 15.149 1.00 0.00 H new ATOM 0 HH12 ARG A 82 128.853 -2.015 15.591 1.00 0.00 H new ATOM 0 HH21 ARG A 82 128.108 -0.099 12.765 1.00 0.00 H new ATOM 0 HH22 ARG A 82 127.485 -0.817 14.254 1.00 0.00 H new ATOM 1294 N GLU A 83 132.133 -4.730 10.084 1.00 0.00 N ATOM 1295 CA GLU A 83 132.435 -6.132 10.504 1.00 0.00 C ATOM 1296 C GLU A 83 133.417 -6.795 9.531 1.00 0.00 C ATOM 1297 O GLU A 83 134.286 -7.533 9.947 1.00 0.00 O ATOM 1298 CB GLU A 83 131.135 -6.960 10.599 1.00 0.00 C ATOM 1299 CG GLU A 83 130.438 -6.724 11.953 1.00 0.00 C ATOM 1300 CD GLU A 83 129.778 -5.347 11.985 1.00 0.00 C ATOM 1301 OE1 GLU A 83 130.448 -4.397 12.351 1.00 0.00 O ATOM 1302 OE2 GLU A 83 128.610 -5.265 11.637 1.00 0.00 O ATOM 0 H GLU A 83 131.191 -4.578 9.725 1.00 0.00 H new ATOM 0 HA GLU A 83 132.900 -6.097 11.489 1.00 0.00 H new ATOM 0 HB2 GLU A 83 130.463 -6.686 9.786 1.00 0.00 H new ATOM 0 HB3 GLU A 83 131.363 -8.019 10.481 1.00 0.00 H new ATOM 0 HG2 GLU A 83 129.688 -7.497 12.122 1.00 0.00 H new ATOM 0 HG3 GLU A 83 131.165 -6.804 12.761 1.00 0.00 H new ATOM 1309 N TRP A 84 133.321 -6.540 8.252 1.00 0.00 N ATOM 1310 CA TRP A 84 134.289 -7.165 7.307 1.00 0.00 C ATOM 1311 C TRP A 84 135.701 -6.715 7.695 1.00 0.00 C ATOM 1312 O TRP A 84 136.628 -7.499 7.746 1.00 0.00 O ATOM 1313 CB TRP A 84 133.969 -6.724 5.876 1.00 0.00 C ATOM 1314 CG TRP A 84 134.808 -7.506 4.918 1.00 0.00 C ATOM 1315 CD1 TRP A 84 134.416 -8.639 4.289 1.00 0.00 C ATOM 1316 CD2 TRP A 84 136.168 -7.240 4.470 1.00 0.00 C ATOM 1317 NE1 TRP A 84 135.448 -9.083 3.483 1.00 0.00 N ATOM 1318 CE2 TRP A 84 136.549 -8.254 3.562 1.00 0.00 C ATOM 1319 CE3 TRP A 84 137.098 -6.227 4.762 1.00 0.00 C ATOM 1320 CZ2 TRP A 84 137.810 -8.265 2.963 1.00 0.00 C ATOM 1321 CZ3 TRP A 84 138.369 -6.234 4.161 1.00 0.00 C ATOM 1322 CH2 TRP A 84 138.723 -7.251 3.264 1.00 0.00 C ATOM 0 H TRP A 84 132.621 -5.932 7.826 1.00 0.00 H new ATOM 0 HA TRP A 84 134.220 -8.252 7.358 1.00 0.00 H new ATOM 0 HB2 TRP A 84 132.912 -6.881 5.663 1.00 0.00 H new ATOM 0 HB3 TRP A 84 134.163 -5.658 5.760 1.00 0.00 H new ATOM 0 HD1 TRP A 84 133.454 -9.118 4.399 1.00 0.00 H new ATOM 0 HE1 TRP A 84 135.402 -9.920 2.902 1.00 0.00 H new ATOM 0 HE3 TRP A 84 136.835 -5.439 5.452 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 138.078 -9.051 2.272 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 139.076 -5.451 4.392 1.00 0.00 H new ATOM 0 HH2 TRP A 84 139.701 -7.251 2.806 1.00 0.00 H new ATOM 1333 N CYS A 85 135.862 -5.447 7.968 1.00 0.00 N ATOM 1334 CA CYS A 85 137.206 -4.928 8.358 1.00 0.00 C ATOM 1335 C CYS A 85 137.657 -5.609 9.651 1.00 0.00 C ATOM 1336 O CYS A 85 138.808 -5.958 9.815 1.00 0.00 O ATOM 1337 CB CYS A 85 137.126 -3.415 8.577 1.00 0.00 C ATOM 1338 SG CYS A 85 136.975 -2.580 6.978 1.00 0.00 S ATOM 0 H CYS A 85 135.120 -4.748 7.938 1.00 0.00 H new ATOM 0 HA CYS A 85 137.923 -5.141 7.565 1.00 0.00 H new ATOM 0 HB2 CYS A 85 136.271 -3.173 9.208 1.00 0.00 H new ATOM 0 HB3 CYS A 85 138.016 -3.065 9.099 1.00 0.00 H new ATOM 0 HG CYS A 85 136.905 -1.295 7.164 1.00 0.00 H new ATOM 1344 N ASP A 86 136.751 -5.799 10.568 1.00 0.00 N ATOM 1345 CA ASP A 86 137.106 -6.457 11.857 1.00 0.00 C ATOM 1346 C ASP A 86 137.645 -7.864 11.593 1.00 0.00 C ATOM 1347 O ASP A 86 138.494 -8.356 12.308 1.00 0.00 O ATOM 1348 CB ASP A 86 135.862 -6.548 12.745 1.00 0.00 C ATOM 1349 CG ASP A 86 135.476 -5.150 13.232 1.00 0.00 C ATOM 1350 OD1 ASP A 86 136.363 -4.321 13.355 1.00 0.00 O ATOM 1351 OD2 ASP A 86 134.301 -4.931 13.473 1.00 0.00 O ATOM 0 H ASP A 86 135.772 -5.525 10.480 1.00 0.00 H new ATOM 0 HA ASP A 86 137.872 -5.867 12.359 1.00 0.00 H new ATOM 0 HB2 ASP A 86 135.037 -6.991 12.188 1.00 0.00 H new ATOM 0 HB3 ASP A 86 136.057 -7.200 13.597 1.00 0.00 H new ATOM 1356 N ALA A 87 137.140 -8.529 10.588 1.00 0.00 N ATOM 1357 CA ALA A 87 137.607 -9.918 10.302 1.00 0.00 C ATOM 1358 C ALA A 87 138.870 -9.895 9.435 1.00 0.00 C ATOM 1359 O ALA A 87 139.762 -10.699 9.619 1.00 0.00 O ATOM 1360 CB ALA A 87 136.501 -10.683 9.565 1.00 0.00 C ATOM 0 H ALA A 87 136.426 -8.172 9.954 1.00 0.00 H new ATOM 0 HA ALA A 87 137.839 -10.411 11.246 1.00 0.00 H new ATOM 0 HB1 ALA A 87 136.839 -11.698 9.355 1.00 0.00 H new ATOM 0 HB2 ALA A 87 135.607 -10.720 10.188 1.00 0.00 H new ATOM 0 HB3 ALA A 87 136.270 -10.176 8.628 1.00 0.00 H new ATOM 1366 N PHE A 88 138.947 -9.004 8.477 1.00 0.00 N ATOM 1367 CA PHE A 88 140.150 -8.963 7.583 1.00 0.00 C ATOM 1368 C PHE A 88 141.074 -7.809 7.975 1.00 0.00 C ATOM 1369 O PHE A 88 142.032 -7.990 8.699 1.00 0.00 O ATOM 1370 CB PHE A 88 139.695 -8.767 6.136 1.00 0.00 C ATOM 1371 CG PHE A 88 138.937 -9.990 5.674 1.00 0.00 C ATOM 1372 CD1 PHE A 88 139.636 -11.113 5.214 1.00 0.00 C ATOM 1373 CD2 PHE A 88 137.537 -10.000 5.703 1.00 0.00 C ATOM 1374 CE1 PHE A 88 138.935 -12.246 4.784 1.00 0.00 C ATOM 1375 CE2 PHE A 88 136.836 -11.133 5.271 1.00 0.00 C ATOM 1376 CZ PHE A 88 137.535 -12.256 4.812 1.00 0.00 C ATOM 0 H PHE A 88 138.232 -8.305 8.274 1.00 0.00 H new ATOM 0 HA PHE A 88 140.694 -9.902 7.686 1.00 0.00 H new ATOM 0 HB2 PHE A 88 139.061 -7.883 6.060 1.00 0.00 H new ATOM 0 HB3 PHE A 88 140.558 -8.597 5.492 1.00 0.00 H new ATOM 0 HD1 PHE A 88 140.716 -11.105 5.191 1.00 0.00 H new ATOM 0 HD2 PHE A 88 136.998 -9.134 6.058 1.00 0.00 H new ATOM 0 HE1 PHE A 88 139.474 -13.113 4.431 1.00 0.00 H new ATOM 0 HE2 PHE A 88 135.756 -11.140 5.292 1.00 0.00 H new ATOM 0 HZ PHE A 88 136.994 -13.130 4.480 1.00 0.00 H new ATOM 1386 N LEU A 89 140.799 -6.619 7.501 1.00 0.00 N ATOM 1387 CA LEU A 89 141.662 -5.447 7.839 1.00 0.00 C ATOM 1388 C LEU A 89 141.153 -4.800 9.130 1.00 0.00 C ATOM 1389 O LEU A 89 140.165 -4.087 9.062 1.00 0.00 O ATOM 1390 CB LEU A 89 141.604 -4.435 6.684 1.00 0.00 C ATOM 1391 CG LEU A 89 142.259 -3.106 7.088 1.00 0.00 C ATOM 1392 CD1 LEU A 89 143.676 -3.357 7.613 1.00 0.00 C ATOM 1393 CD2 LEU A 89 142.328 -2.189 5.861 1.00 0.00 C ATOM 1394 OXT LEU A 89 141.759 -5.029 10.163 1.00 0.00 O ATOM 0 H LEU A 89 140.009 -6.409 6.891 1.00 0.00 H new ATOM 0 HA LEU A 89 142.693 -5.770 7.985 1.00 0.00 H new ATOM 0 HB2 LEU A 89 142.111 -4.844 5.810 1.00 0.00 H new ATOM 0 HB3 LEU A 89 140.566 -4.262 6.398 1.00 0.00 H new ATOM 0 HG LEU A 89 141.667 -2.636 7.873 1.00 0.00 H new ATOM 0 HD11 LEU A 89 144.132 -2.409 7.897 1.00 0.00 H new ATOM 0 HD12 LEU A 89 143.631 -4.013 8.483 1.00 0.00 H new ATOM 0 HD13 LEU A 89 144.275 -3.829 6.834 1.00 0.00 H new ATOM 0 HD21 LEU A 89 142.792 -1.243 6.140 1.00 0.00 H new ATOM 0 HD22 LEU A 89 142.920 -2.668 5.082 1.00 0.00 H new ATOM 0 HD23 LEU A 89 141.321 -2.003 5.488 1.00 0.00 H new TER 1406 LEU A 89 ATOM 1407 N MET B 1 168.443 -8.140 -0.444 1.00 0.00 N ATOM 1408 CA MET B 1 169.407 -7.031 -0.204 1.00 0.00 C ATOM 1409 C MET B 1 168.853 -5.740 -0.809 1.00 0.00 C ATOM 1410 O MET B 1 169.193 -4.651 -0.394 1.00 0.00 O ATOM 1411 CB MET B 1 170.747 -7.373 -0.857 1.00 0.00 C ATOM 1412 CG MET B 1 171.808 -6.366 -0.408 1.00 0.00 C ATOM 1413 SD MET B 1 173.409 -6.801 -1.136 1.00 0.00 S ATOM 1414 CE MET B 1 173.746 -8.279 -0.141 1.00 0.00 C ATOM 0 H1 MET B 1 168.701 -8.957 0.145 1.00 0.00 H new ATOM 0 H2 MET B 1 167.483 -7.825 -0.198 1.00 0.00 H new ATOM 0 H3 MET B 1 168.471 -8.413 -1.447 1.00 0.00 H new ATOM 0 HA MET B 1 169.552 -6.895 0.868 1.00 0.00 H new ATOM 0 HB2 MET B 1 171.050 -8.383 -0.582 1.00 0.00 H new ATOM 0 HB3 MET B 1 170.649 -7.354 -1.942 1.00 0.00 H new ATOM 0 HG2 MET B 1 171.520 -5.360 -0.713 1.00 0.00 H new ATOM 0 HG3 MET B 1 171.881 -6.361 0.680 1.00 0.00 H new ATOM 0 HE1 MET B 1 174.794 -8.285 0.159 1.00 0.00 H new ATOM 0 HE2 MET B 1 173.114 -8.271 0.747 1.00 0.00 H new ATOM 0 HE3 MET B 1 173.533 -9.171 -0.730 1.00 0.00 H new ATOM 1426 N THR B 2 167.996 -5.858 -1.785 1.00 0.00 N ATOM 1427 CA THR B 2 167.412 -4.643 -2.419 1.00 0.00 C ATOM 1428 C THR B 2 166.457 -3.968 -1.432 1.00 0.00 C ATOM 1429 O THR B 2 166.786 -2.972 -0.818 1.00 0.00 O ATOM 1430 CB THR B 2 166.645 -5.047 -3.680 1.00 0.00 C ATOM 1431 OG1 THR B 2 167.481 -5.852 -4.499 1.00 0.00 O ATOM 1432 CG2 THR B 2 166.226 -3.794 -4.451 1.00 0.00 C ATOM 0 H THR B 2 167.674 -6.745 -2.172 1.00 0.00 H new ATOM 0 HA THR B 2 168.209 -3.949 -2.687 1.00 0.00 H new ATOM 0 HB THR B 2 165.755 -5.610 -3.400 1.00 0.00 H new ATOM 0 HG1 THR B 2 166.993 -6.114 -5.307 1.00 0.00 H new ATOM 0 HG21 THR B 2 165.680 -4.085 -5.349 1.00 0.00 H new ATOM 0 HG22 THR B 2 165.586 -3.176 -3.821 1.00 0.00 H new ATOM 0 HG23 THR B 2 167.113 -3.227 -4.734 1.00 0.00 H new ATOM 1440 N THR B 3 165.277 -4.500 -1.278 1.00 0.00 N ATOM 1441 CA THR B 3 164.302 -3.889 -0.334 1.00 0.00 C ATOM 1442 C THR B 3 164.718 -4.200 1.105 1.00 0.00 C ATOM 1443 O THR B 3 165.377 -5.184 1.373 1.00 0.00 O ATOM 1444 CB THR B 3 162.907 -4.462 -0.603 1.00 0.00 C ATOM 1445 OG1 THR B 3 162.935 -5.872 -0.428 1.00 0.00 O ATOM 1446 CG2 THR B 3 162.489 -4.129 -2.036 1.00 0.00 C ATOM 0 H THR B 3 164.946 -5.332 -1.766 1.00 0.00 H new ATOM 0 HA THR B 3 164.284 -2.809 -0.477 1.00 0.00 H new ATOM 0 HB THR B 3 162.191 -4.025 0.093 1.00 0.00 H new ATOM 0 HG1 THR B 3 162.043 -6.241 -0.598 1.00 0.00 H new ATOM 0 HG21 THR B 3 161.496 -4.536 -2.229 1.00 0.00 H new ATOM 0 HG22 THR B 3 162.469 -3.047 -2.167 1.00 0.00 H new ATOM 0 HG23 THR B 3 163.203 -4.566 -2.734 1.00 0.00 H new ATOM 1454 N SER B 4 164.339 -3.366 2.034 1.00 0.00 N ATOM 1455 CA SER B 4 164.713 -3.610 3.455 1.00 0.00 C ATOM 1456 C SER B 4 163.797 -4.683 4.046 1.00 0.00 C ATOM 1457 O SER B 4 162.790 -5.047 3.472 1.00 0.00 O ATOM 1458 CB SER B 4 164.563 -2.313 4.251 1.00 0.00 C ATOM 1459 OG SER B 4 165.348 -1.294 3.643 1.00 0.00 O ATOM 0 H SER B 4 163.786 -2.525 1.870 1.00 0.00 H new ATOM 0 HA SER B 4 165.748 -3.949 3.506 1.00 0.00 H new ATOM 0 HB2 SER B 4 163.516 -2.011 4.282 1.00 0.00 H new ATOM 0 HB3 SER B 4 164.882 -2.467 5.282 1.00 0.00 H new ATOM 0 HG SER B 4 165.252 -0.461 4.150 1.00 0.00 H new ATOM 1465 N GLN B 5 164.159 -5.199 5.188 1.00 0.00 N ATOM 1466 CA GLN B 5 163.343 -6.264 5.836 1.00 0.00 C ATOM 1467 C GLN B 5 161.920 -5.768 6.089 1.00 0.00 C ATOM 1468 O GLN B 5 161.010 -6.549 6.281 1.00 0.00 O ATOM 1469 CB GLN B 5 163.982 -6.653 7.171 1.00 0.00 C ATOM 1470 CG GLN B 5 165.293 -7.400 6.919 1.00 0.00 C ATOM 1471 CD GLN B 5 165.992 -7.661 8.255 1.00 0.00 C ATOM 1472 OE1 GLN B 5 165.771 -6.955 9.218 1.00 0.00 O ATOM 1473 NE2 GLN B 5 166.831 -8.655 8.354 1.00 0.00 N ATOM 0 H GLN B 5 164.994 -4.925 5.705 1.00 0.00 H new ATOM 0 HA GLN B 5 163.306 -7.128 5.172 1.00 0.00 H new ATOM 0 HB2 GLN B 5 164.170 -5.761 7.768 1.00 0.00 H new ATOM 0 HB3 GLN B 5 163.299 -7.281 7.742 1.00 0.00 H new ATOM 0 HG2 GLN B 5 165.095 -8.343 6.409 1.00 0.00 H new ATOM 0 HG3 GLN B 5 165.939 -6.813 6.266 1.00 0.00 H new ATOM 0 HE21 GLN B 5 167.017 -9.248 7.545 1.00 0.00 H new ATOM 0 HE22 GLN B 5 167.301 -8.839 9.240 1.00 0.00 H new ATOM 1482 N LYS B 6 161.713 -4.478 6.100 1.00 0.00 N ATOM 1483 CA LYS B 6 160.347 -3.941 6.350 1.00 0.00 C ATOM 1484 C LYS B 6 159.401 -4.405 5.241 1.00 0.00 C ATOM 1485 O LYS B 6 158.253 -4.719 5.485 1.00 0.00 O ATOM 1486 CB LYS B 6 160.406 -2.413 6.358 1.00 0.00 C ATOM 1487 CG LYS B 6 161.187 -1.942 7.587 1.00 0.00 C ATOM 1488 CD LYS B 6 161.248 -0.413 7.599 1.00 0.00 C ATOM 1489 CE LYS B 6 162.030 0.056 8.827 1.00 0.00 C ATOM 1490 NZ LYS B 6 162.250 1.527 8.743 1.00 0.00 N ATOM 0 H LYS B 6 162.434 -3.773 5.946 1.00 0.00 H new ATOM 0 HA LYS B 6 159.982 -4.304 7.311 1.00 0.00 H new ATOM 0 HB2 LYS B 6 160.885 -2.052 5.448 1.00 0.00 H new ATOM 0 HB3 LYS B 6 159.398 -1.999 6.373 1.00 0.00 H new ATOM 0 HG2 LYS B 6 160.708 -2.304 8.496 1.00 0.00 H new ATOM 0 HG3 LYS B 6 162.195 -2.356 7.571 1.00 0.00 H new ATOM 0 HD2 LYS B 6 161.727 -0.050 6.689 1.00 0.00 H new ATOM 0 HD3 LYS B 6 160.240 0.002 7.616 1.00 0.00 H new ATOM 0 HE2 LYS B 6 161.481 -0.189 9.736 1.00 0.00 H new ATOM 0 HE3 LYS B 6 162.987 -0.463 8.882 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 162.782 1.847 9.578 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 162.790 1.749 7.882 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 161.332 2.014 8.710 1.00 0.00 H new ATOM 1504 N HIS B 7 159.863 -4.435 4.024 1.00 0.00 N ATOM 1505 CA HIS B 7 158.975 -4.859 2.905 1.00 0.00 C ATOM 1506 C HIS B 7 158.440 -6.272 3.154 1.00 0.00 C ATOM 1507 O HIS B 7 157.253 -6.519 3.065 1.00 0.00 O ATOM 1508 CB HIS B 7 159.773 -4.824 1.591 1.00 0.00 C ATOM 1509 CG HIS B 7 159.022 -5.544 0.498 1.00 0.00 C ATOM 1510 ND1 HIS B 7 158.012 -4.942 -0.239 1.00 0.00 N ATOM 1511 CD2 HIS B 7 159.130 -6.824 0.009 1.00 0.00 C ATOM 1512 CE1 HIS B 7 157.556 -5.852 -1.122 1.00 0.00 C ATOM 1513 NE2 HIS B 7 158.205 -7.012 -1.010 1.00 0.00 N ATOM 0 H HIS B 7 160.815 -4.185 3.755 1.00 0.00 H new ATOM 0 HA HIS B 7 158.127 -4.177 2.840 1.00 0.00 H new ATOM 0 HB2 HIS B 7 159.954 -3.790 1.296 1.00 0.00 H new ATOM 0 HB3 HIS B 7 160.748 -5.289 1.738 1.00 0.00 H new ATOM 0 HD2 HIS B 7 159.827 -7.569 0.363 1.00 0.00 H new ATOM 0 HE1 HIS B 7 156.764 -5.665 -1.832 1.00 0.00 H new ATOM 0 HE2 HIS B 7 158.054 -7.859 -1.558 1.00 0.00 H new ATOM 1521 N ARG B 8 159.302 -7.207 3.456 1.00 0.00 N ATOM 1522 CA ARG B 8 158.842 -8.600 3.699 1.00 0.00 C ATOM 1523 C ARG B 8 158.060 -8.675 5.009 1.00 0.00 C ATOM 1524 O ARG B 8 157.133 -9.448 5.150 1.00 0.00 O ATOM 1525 CB ARG B 8 160.059 -9.525 3.771 1.00 0.00 C ATOM 1526 CG ARG B 8 160.718 -9.599 2.392 1.00 0.00 C ATOM 1527 CD ARG B 8 161.935 -10.523 2.450 1.00 0.00 C ATOM 1528 NE ARG B 8 162.653 -10.474 1.144 1.00 0.00 N ATOM 1529 CZ ARG B 8 163.862 -10.954 1.043 1.00 0.00 C ATOM 1530 NH1 ARG B 8 164.448 -11.473 2.088 1.00 0.00 N ATOM 1531 NH2 ARG B 8 164.486 -10.914 -0.102 1.00 0.00 N ATOM 0 H ARG B 8 160.308 -7.062 3.544 1.00 0.00 H new ATOM 0 HA ARG B 8 158.190 -8.912 2.883 1.00 0.00 H new ATOM 0 HB2 ARG B 8 160.771 -9.152 4.508 1.00 0.00 H new ATOM 0 HB3 ARG B 8 159.755 -10.520 4.096 1.00 0.00 H new ATOM 0 HG2 ARG B 8 160.004 -9.969 1.657 1.00 0.00 H new ATOM 0 HG3 ARG B 8 161.021 -8.603 2.069 1.00 0.00 H new ATOM 0 HD2 ARG B 8 162.601 -10.216 3.256 1.00 0.00 H new ATOM 0 HD3 ARG B 8 161.621 -11.544 2.667 1.00 0.00 H new ATOM 0 HE ARG B 8 162.198 -10.064 0.328 1.00 0.00 H new ATOM 0 HH11 ARG B 8 163.961 -11.503 2.984 1.00 0.00 H new ATOM 0 HH12 ARG B 8 165.393 -11.848 2.009 1.00 0.00 H new ATOM 0 HH21 ARG B 8 164.029 -10.507 -0.918 1.00 0.00 H new ATOM 0 HH22 ARG B 8 165.431 -11.289 -0.181 1.00 0.00 H new ATOM 1545 N ASP B 9 158.425 -7.877 5.966 1.00 0.00 N ATOM 1546 CA ASP B 9 157.703 -7.897 7.267 1.00 0.00 C ATOM 1547 C ASP B 9 156.298 -7.309 7.106 1.00 0.00 C ATOM 1548 O ASP B 9 155.349 -7.781 7.697 1.00 0.00 O ATOM 1549 CB ASP B 9 158.477 -7.088 8.308 1.00 0.00 C ATOM 1550 CG ASP B 9 159.762 -7.829 8.682 1.00 0.00 C ATOM 1551 OD1 ASP B 9 159.834 -9.019 8.419 1.00 0.00 O ATOM 1552 OD2 ASP B 9 160.651 -7.197 9.229 1.00 0.00 O ATOM 0 H ASP B 9 159.194 -7.209 5.906 1.00 0.00 H new ATOM 0 HA ASP B 9 157.620 -8.931 7.600 1.00 0.00 H new ATOM 0 HB2 ASP B 9 158.716 -6.101 7.912 1.00 0.00 H new ATOM 0 HB3 ASP B 9 157.862 -6.935 9.195 1.00 0.00 H new ATOM 1557 N PHE B 10 156.161 -6.266 6.329 1.00 0.00 N ATOM 1558 CA PHE B 10 154.817 -5.635 6.160 1.00 0.00 C ATOM 1559 C PHE B 10 153.867 -6.568 5.403 1.00 0.00 C ATOM 1560 O PHE B 10 152.704 -6.679 5.736 1.00 0.00 O ATOM 1561 CB PHE B 10 154.974 -4.327 5.379 1.00 0.00 C ATOM 1562 CG PHE B 10 153.654 -3.594 5.342 1.00 0.00 C ATOM 1563 CD1 PHE B 10 153.333 -2.687 6.358 1.00 0.00 C ATOM 1564 CD2 PHE B 10 152.755 -3.814 4.290 1.00 0.00 C ATOM 1565 CE1 PHE B 10 152.112 -2.000 6.327 1.00 0.00 C ATOM 1566 CE2 PHE B 10 151.533 -3.127 4.259 1.00 0.00 C ATOM 1567 CZ PHE B 10 151.213 -2.221 5.278 1.00 0.00 C ATOM 0 H PHE B 10 156.918 -5.825 5.806 1.00 0.00 H new ATOM 0 HA PHE B 10 154.395 -5.439 7.146 1.00 0.00 H new ATOM 0 HB2 PHE B 10 155.735 -3.702 5.847 1.00 0.00 H new ATOM 0 HB3 PHE B 10 155.313 -4.537 4.364 1.00 0.00 H new ATOM 0 HD1 PHE B 10 154.027 -2.516 7.167 1.00 0.00 H new ATOM 0 HD2 PHE B 10 153.003 -4.512 3.504 1.00 0.00 H new ATOM 0 HE1 PHE B 10 151.865 -1.301 7.112 1.00 0.00 H new ATOM 0 HE2 PHE B 10 150.839 -3.296 3.449 1.00 0.00 H new ATOM 0 HZ PHE B 10 150.271 -1.693 5.254 1.00 0.00 H new ATOM 1577 N VAL B 11 154.342 -7.233 4.387 1.00 0.00 N ATOM 1578 CA VAL B 11 153.449 -8.147 3.613 1.00 0.00 C ATOM 1579 C VAL B 11 153.349 -9.499 4.322 1.00 0.00 C ATOM 1580 O VAL B 11 152.918 -10.478 3.745 1.00 0.00 O ATOM 1581 CB VAL B 11 154.027 -8.352 2.211 1.00 0.00 C ATOM 1582 CG1 VAL B 11 154.184 -6.995 1.522 1.00 0.00 C ATOM 1583 CG2 VAL B 11 155.394 -9.032 2.324 1.00 0.00 C ATOM 0 H VAL B 11 155.306 -7.185 4.058 1.00 0.00 H new ATOM 0 HA VAL B 11 152.456 -7.704 3.542 1.00 0.00 H new ATOM 0 HB VAL B 11 153.355 -8.979 1.624 1.00 0.00 H new ATOM 0 HG11 VAL B 11 154.596 -7.140 0.523 1.00 0.00 H new ATOM 0 HG12 VAL B 11 153.211 -6.510 1.447 1.00 0.00 H new ATOM 0 HG13 VAL B 11 154.858 -6.367 2.105 1.00 0.00 H new ATOM 0 HG21 VAL B 11 155.810 -9.180 1.328 1.00 0.00 H new ATOM 0 HG22 VAL B 11 156.066 -8.403 2.908 1.00 0.00 H new ATOM 0 HG23 VAL B 11 155.280 -9.997 2.817 1.00 0.00 H new ATOM 1593 N ALA B 12 153.765 -9.563 5.567 1.00 0.00 N ATOM 1594 CA ALA B 12 153.719 -10.856 6.327 1.00 0.00 C ATOM 1595 C ALA B 12 152.851 -10.714 7.581 1.00 0.00 C ATOM 1596 O ALA B 12 152.584 -11.681 8.265 1.00 0.00 O ATOM 1597 CB ALA B 12 155.140 -11.236 6.745 1.00 0.00 C ATOM 0 H ALA B 12 154.136 -8.771 6.092 1.00 0.00 H new ATOM 0 HA ALA B 12 153.289 -11.627 5.687 1.00 0.00 H new ATOM 0 HB1 ALA B 12 155.118 -12.175 7.298 1.00 0.00 H new ATOM 0 HB2 ALA B 12 155.761 -11.353 5.857 1.00 0.00 H new ATOM 0 HB3 ALA B 12 155.555 -10.452 7.378 1.00 0.00 H new ATOM 1603 N GLU B 13 152.404 -9.525 7.899 1.00 0.00 N ATOM 1604 CA GLU B 13 151.552 -9.356 9.120 1.00 0.00 C ATOM 1605 C GLU B 13 150.578 -8.182 8.918 1.00 0.00 C ATOM 1606 O GLU B 13 150.882 -7.251 8.197 1.00 0.00 O ATOM 1607 CB GLU B 13 152.457 -9.074 10.325 1.00 0.00 C ATOM 1608 CG GLU B 13 153.153 -7.721 10.145 1.00 0.00 C ATOM 1609 CD GLU B 13 154.343 -7.624 11.103 1.00 0.00 C ATOM 1610 OE1 GLU B 13 154.119 -7.661 12.302 1.00 0.00 O ATOM 1611 OE2 GLU B 13 155.459 -7.518 10.621 1.00 0.00 O ATOM 0 H GLU B 13 152.589 -8.671 7.373 1.00 0.00 H new ATOM 0 HA GLU B 13 150.978 -10.266 9.295 1.00 0.00 H new ATOM 0 HB2 GLU B 13 151.867 -9.071 11.242 1.00 0.00 H new ATOM 0 HB3 GLU B 13 153.200 -9.865 10.427 1.00 0.00 H new ATOM 0 HG2 GLU B 13 153.492 -7.609 9.115 1.00 0.00 H new ATOM 0 HG3 GLU B 13 152.450 -6.911 10.339 1.00 0.00 H new ATOM 1618 N PRO B 14 149.423 -8.197 9.557 1.00 0.00 N ATOM 1619 CA PRO B 14 148.437 -7.083 9.429 1.00 0.00 C ATOM 1620 C PRO B 14 149.110 -5.712 9.569 1.00 0.00 C ATOM 1621 O PRO B 14 150.165 -5.590 10.160 1.00 0.00 O ATOM 1622 CB PRO B 14 147.458 -7.321 10.589 1.00 0.00 C ATOM 1623 CG PRO B 14 147.518 -8.793 10.860 1.00 0.00 C ATOM 1624 CD PRO B 14 148.923 -9.263 10.454 1.00 0.00 C ATOM 0 HA PRO B 14 147.953 -7.076 8.452 1.00 0.00 H new ATOM 0 HB2 PRO B 14 147.745 -6.747 11.470 1.00 0.00 H new ATOM 0 HB3 PRO B 14 146.448 -7.011 10.321 1.00 0.00 H new ATOM 0 HG2 PRO B 14 147.331 -9.000 11.914 1.00 0.00 H new ATOM 0 HG3 PRO B 14 146.754 -9.322 10.291 1.00 0.00 H new ATOM 0 HD2 PRO B 14 149.568 -9.385 11.324 1.00 0.00 H new ATOM 0 HD3 PRO B 14 148.888 -10.226 9.945 1.00 0.00 H new ATOM 1632 N MET B 15 148.512 -4.678 9.037 1.00 0.00 N ATOM 1633 CA MET B 15 149.129 -3.323 9.152 1.00 0.00 C ATOM 1634 C MET B 15 148.623 -2.636 10.421 1.00 0.00 C ATOM 1635 O MET B 15 149.271 -1.763 10.965 1.00 0.00 O ATOM 1636 CB MET B 15 148.764 -2.477 7.928 1.00 0.00 C ATOM 1637 CG MET B 15 147.258 -2.560 7.668 1.00 0.00 C ATOM 1638 SD MET B 15 146.782 -1.300 6.452 1.00 0.00 S ATOM 1639 CE MET B 15 147.164 -2.239 4.951 1.00 0.00 C ATOM 0 H MET B 15 147.627 -4.712 8.530 1.00 0.00 H new ATOM 0 HA MET B 15 150.213 -3.427 9.203 1.00 0.00 H new ATOM 0 HB2 MET B 15 149.057 -1.440 8.091 1.00 0.00 H new ATOM 0 HB3 MET B 15 149.313 -2.830 7.055 1.00 0.00 H new ATOM 0 HG2 MET B 15 146.996 -3.552 7.301 1.00 0.00 H new ATOM 0 HG3 MET B 15 146.709 -2.409 8.598 1.00 0.00 H new ATOM 0 HE1 MET B 15 147.354 -1.549 4.129 1.00 0.00 H new ATOM 0 HE2 MET B 15 148.049 -2.853 5.121 1.00 0.00 H new ATOM 0 HE3 MET B 15 146.320 -2.881 4.699 1.00 0.00 H new ATOM 1649 N GLY B 16 147.471 -3.022 10.900 1.00 0.00 N ATOM 1650 CA GLY B 16 146.928 -2.391 12.135 1.00 0.00 C ATOM 1651 C GLY B 16 146.884 -0.872 11.961 1.00 0.00 C ATOM 1652 O GLY B 16 146.493 -0.368 10.926 1.00 0.00 O ATOM 0 H GLY B 16 146.883 -3.747 10.489 1.00 0.00 H new ATOM 0 HA2 GLY B 16 145.928 -2.772 12.340 1.00 0.00 H new ATOM 0 HA3 GLY B 16 147.550 -2.651 12.991 1.00 0.00 H new ATOM 1656 N GLU B 17 147.257 -0.141 12.980 1.00 0.00 N ATOM 1657 CA GLU B 17 147.216 1.356 12.908 1.00 0.00 C ATOM 1658 C GLU B 17 148.629 1.919 12.734 1.00 0.00 C ATOM 1659 O GLU B 17 148.937 2.994 13.212 1.00 0.00 O ATOM 1660 CB GLU B 17 146.613 1.893 14.206 1.00 0.00 C ATOM 1661 CG GLU B 17 145.128 1.527 14.263 1.00 0.00 C ATOM 1662 CD GLU B 17 144.517 2.061 15.559 1.00 0.00 C ATOM 1663 OE1 GLU B 17 145.258 2.607 16.359 1.00 0.00 O ATOM 1664 OE2 GLU B 17 143.319 1.909 15.732 1.00 0.00 O ATOM 0 H GLU B 17 147.591 -0.518 13.867 1.00 0.00 H new ATOM 0 HA GLU B 17 146.610 1.660 12.054 1.00 0.00 H new ATOM 0 HB2 GLU B 17 147.136 1.473 15.065 1.00 0.00 H new ATOM 0 HB3 GLU B 17 146.735 2.975 14.257 1.00 0.00 H new ATOM 0 HG2 GLU B 17 144.606 1.947 13.403 1.00 0.00 H new ATOM 0 HG3 GLU B 17 145.008 0.445 14.211 1.00 0.00 H new ATOM 1671 N LYS B 18 149.495 1.209 12.062 1.00 0.00 N ATOM 1672 CA LYS B 18 150.884 1.715 11.870 1.00 0.00 C ATOM 1673 C LYS B 18 150.836 3.037 11.084 1.00 0.00 C ATOM 1674 O LYS B 18 149.939 3.254 10.293 1.00 0.00 O ATOM 1675 CB LYS B 18 151.689 0.674 11.086 1.00 0.00 C ATOM 1676 CG LYS B 18 151.993 -0.516 11.996 1.00 0.00 C ATOM 1677 CD LYS B 18 152.645 -1.635 11.183 1.00 0.00 C ATOM 1678 CE LYS B 18 153.112 -2.742 12.129 1.00 0.00 C ATOM 1679 NZ LYS B 18 154.154 -2.201 13.048 1.00 0.00 N ATOM 0 H LYS B 18 149.301 0.302 11.638 1.00 0.00 H new ATOM 0 HA LYS B 18 151.357 1.888 12.837 1.00 0.00 H new ATOM 0 HB2 LYS B 18 151.127 0.345 10.212 1.00 0.00 H new ATOM 0 HB3 LYS B 18 152.617 1.114 10.721 1.00 0.00 H new ATOM 0 HG2 LYS B 18 152.656 -0.208 12.805 1.00 0.00 H new ATOM 0 HG3 LYS B 18 151.074 -0.877 12.457 1.00 0.00 H new ATOM 0 HD2 LYS B 18 151.935 -2.035 10.459 1.00 0.00 H new ATOM 0 HD3 LYS B 18 153.491 -1.244 10.617 1.00 0.00 H new ATOM 0 HE2 LYS B 18 152.268 -3.125 12.703 1.00 0.00 H new ATOM 0 HE3 LYS B 18 153.514 -3.578 11.557 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 154.951 -2.867 13.100 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 154.491 -1.285 12.690 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 153.748 -2.073 13.997 1.00 0.00 H new ATOM 1693 N PRO B 19 151.780 3.926 11.309 1.00 0.00 N ATOM 1694 CA PRO B 19 151.813 5.252 10.615 1.00 0.00 C ATOM 1695 C PRO B 19 152.083 5.125 9.109 1.00 0.00 C ATOM 1696 O PRO B 19 152.625 4.144 8.642 1.00 0.00 O ATOM 1697 CB PRO B 19 152.951 6.015 11.321 1.00 0.00 C ATOM 1698 CG PRO B 19 153.826 4.956 11.918 1.00 0.00 C ATOM 1699 CD PRO B 19 152.914 3.770 12.240 1.00 0.00 C ATOM 0 HA PRO B 19 150.852 5.762 10.679 1.00 0.00 H new ATOM 0 HB2 PRO B 19 153.507 6.633 10.616 1.00 0.00 H new ATOM 0 HB3 PRO B 19 152.560 6.682 12.090 1.00 0.00 H new ATOM 0 HG2 PRO B 19 154.611 4.663 11.221 1.00 0.00 H new ATOM 0 HG3 PRO B 19 154.319 5.322 12.819 1.00 0.00 H new ATOM 0 HD2 PRO B 19 153.427 2.820 12.088 1.00 0.00 H new ATOM 0 HD3 PRO B 19 152.583 3.792 13.278 1.00 0.00 H new ATOM 1707 N VAL B 20 151.694 6.117 8.352 1.00 0.00 N ATOM 1708 CA VAL B 20 151.908 6.070 6.879 1.00 0.00 C ATOM 1709 C VAL B 20 153.388 5.840 6.564 1.00 0.00 C ATOM 1710 O VAL B 20 153.739 5.041 5.718 1.00 0.00 O ATOM 1711 CB VAL B 20 151.448 7.393 6.249 1.00 0.00 C ATOM 1712 CG1 VAL B 20 152.147 8.571 6.934 1.00 0.00 C ATOM 1713 CG2 VAL B 20 151.800 7.396 4.758 1.00 0.00 C ATOM 0 H VAL B 20 151.235 6.961 8.694 1.00 0.00 H new ATOM 0 HA VAL B 20 151.327 5.246 6.465 1.00 0.00 H new ATOM 0 HB VAL B 20 150.370 7.492 6.376 1.00 0.00 H new ATOM 0 HG11 VAL B 20 151.815 9.505 6.481 1.00 0.00 H new ATOM 0 HG12 VAL B 20 151.899 8.574 7.995 1.00 0.00 H new ATOM 0 HG13 VAL B 20 153.226 8.473 6.814 1.00 0.00 H new ATOM 0 HG21 VAL B 20 151.474 8.334 4.309 1.00 0.00 H new ATOM 0 HG22 VAL B 20 152.878 7.292 4.639 1.00 0.00 H new ATOM 0 HG23 VAL B 20 151.298 6.564 4.264 1.00 0.00 H new ATOM 1723 N GLY B 21 154.261 6.554 7.231 1.00 0.00 N ATOM 1724 CA GLY B 21 155.720 6.405 6.970 1.00 0.00 C ATOM 1725 C GLY B 21 156.152 4.958 7.194 1.00 0.00 C ATOM 1726 O GLY B 21 157.292 4.603 6.963 1.00 0.00 O ATOM 0 H GLY B 21 154.021 7.237 7.949 1.00 0.00 H new ATOM 0 HA2 GLY B 21 155.946 6.705 5.947 1.00 0.00 H new ATOM 0 HA3 GLY B 21 156.284 7.066 7.628 1.00 0.00 H new ATOM 1730 N SER B 22 155.263 4.109 7.634 1.00 0.00 N ATOM 1731 CA SER B 22 155.645 2.688 7.854 1.00 0.00 C ATOM 1732 C SER B 22 155.594 1.954 6.516 1.00 0.00 C ATOM 1733 O SER B 22 156.233 0.939 6.327 1.00 0.00 O ATOM 1734 CB SER B 22 154.664 2.037 8.830 1.00 0.00 C ATOM 1735 OG SER B 22 155.072 0.699 9.083 1.00 0.00 O ATOM 0 H SER B 22 154.293 4.338 7.849 1.00 0.00 H new ATOM 0 HA SER B 22 156.651 2.635 8.271 1.00 0.00 H new ATOM 0 HB2 SER B 22 154.631 2.602 9.762 1.00 0.00 H new ATOM 0 HB3 SER B 22 153.657 2.050 8.414 1.00 0.00 H new ATOM 0 HG SER B 22 154.800 0.440 9.988 1.00 0.00 H new ATOM 1741 N LEU B 23 154.840 2.466 5.582 1.00 0.00 N ATOM 1742 CA LEU B 23 154.750 1.801 4.255 1.00 0.00 C ATOM 1743 C LEU B 23 156.124 1.840 3.581 1.00 0.00 C ATOM 1744 O LEU B 23 156.840 2.820 3.647 1.00 0.00 O ATOM 1745 CB LEU B 23 153.718 2.526 3.385 1.00 0.00 C ATOM 1746 CG LEU B 23 152.324 2.408 4.022 1.00 0.00 C ATOM 1747 CD1 LEU B 23 151.351 3.331 3.279 1.00 0.00 C ATOM 1748 CD2 LEU B 23 151.818 0.954 3.945 1.00 0.00 C ATOM 0 H LEU B 23 154.284 3.315 5.682 1.00 0.00 H new ATOM 0 HA LEU B 23 154.438 0.764 4.382 1.00 0.00 H new ATOM 0 HB2 LEU B 23 153.992 3.576 3.279 1.00 0.00 H new ATOM 0 HB3 LEU B 23 153.708 2.097 2.383 1.00 0.00 H new ATOM 0 HG LEU B 23 152.386 2.700 5.070 1.00 0.00 H new ATOM 0 HD11 LEU B 23 150.360 3.251 3.727 1.00 0.00 H new ATOM 0 HD12 LEU B 23 151.700 4.361 3.351 1.00 0.00 H new ATOM 0 HD13 LEU B 23 151.300 3.038 2.230 1.00 0.00 H new ATOM 0 HD21 LEU B 23 150.830 0.888 4.400 1.00 0.00 H new ATOM 0 HD22 LEU B 23 151.758 0.644 2.902 1.00 0.00 H new ATOM 0 HD23 LEU B 23 152.508 0.300 4.478 1.00 0.00 H new ATOM 1760 N ALA B 24 156.487 0.772 2.942 1.00 0.00 N ATOM 1761 CA ALA B 24 157.813 0.724 2.266 1.00 0.00 C ATOM 1762 C ALA B 24 157.858 1.739 1.117 1.00 0.00 C ATOM 1763 O ALA B 24 156.927 1.875 0.350 1.00 0.00 O ATOM 1764 CB ALA B 24 158.054 -0.682 1.715 1.00 0.00 C ATOM 0 H ALA B 24 155.924 -0.074 2.856 1.00 0.00 H new ATOM 0 HA ALA B 24 158.589 0.973 2.989 1.00 0.00 H new ATOM 0 HB1 ALA B 24 159.025 -0.717 1.220 1.00 0.00 H new ATOM 0 HB2 ALA B 24 158.038 -1.401 2.534 1.00 0.00 H new ATOM 0 HB3 ALA B 24 157.272 -0.931 0.998 1.00 0.00 H new ATOM 1770 N GLY B 25 158.953 2.446 1.001 1.00 0.00 N ATOM 1771 CA GLY B 25 159.096 3.460 -0.092 1.00 0.00 C ATOM 1772 C GLY B 25 158.818 4.862 0.456 1.00 0.00 C ATOM 1773 O GLY B 25 159.209 5.852 -0.132 1.00 0.00 O ATOM 0 H GLY B 25 159.760 2.365 1.619 1.00 0.00 H new ATOM 0 HA2 GLY B 25 160.102 3.417 -0.510 1.00 0.00 H new ATOM 0 HA3 GLY B 25 158.404 3.233 -0.903 1.00 0.00 H new ATOM 1777 N ILE B 26 158.153 4.960 1.579 1.00 0.00 N ATOM 1778 CA ILE B 26 157.854 6.304 2.169 1.00 0.00 C ATOM 1779 C ILE B 26 158.864 6.582 3.282 1.00 0.00 C ATOM 1780 O ILE B 26 158.946 5.846 4.247 1.00 0.00 O ATOM 1781 CB ILE B 26 156.441 6.295 2.755 1.00 0.00 C ATOM 1782 CG1 ILE B 26 155.443 5.808 1.692 1.00 0.00 C ATOM 1783 CG2 ILE B 26 156.063 7.705 3.210 1.00 0.00 C ATOM 1784 CD1 ILE B 26 155.587 6.628 0.404 1.00 0.00 C ATOM 0 H ILE B 26 157.803 4.166 2.115 1.00 0.00 H new ATOM 0 HA ILE B 26 157.922 7.075 1.402 1.00 0.00 H new ATOM 0 HB ILE B 26 156.411 5.621 3.611 1.00 0.00 H new ATOM 0 HG12 ILE B 26 155.615 4.753 1.479 1.00 0.00 H new ATOM 0 HG13 ILE B 26 154.426 5.894 2.073 1.00 0.00 H new ATOM 0 HG21 ILE B 26 155.056 7.695 3.627 1.00 0.00 H new ATOM 0 HG22 ILE B 26 156.767 8.043 3.970 1.00 0.00 H new ATOM 0 HG23 ILE B 26 156.096 8.384 2.358 1.00 0.00 H new ATOM 0 HD11 ILE B 26 154.873 6.269 -0.337 1.00 0.00 H new ATOM 0 HD12 ILE B 26 155.391 7.679 0.618 1.00 0.00 H new ATOM 0 HD13 ILE B 26 156.599 6.519 0.015 1.00 0.00 H new ATOM 1796 N GLY B 27 159.641 7.631 3.172 1.00 0.00 N ATOM 1797 CA GLY B 27 160.641 7.938 4.236 1.00 0.00 C ATOM 1798 C GLY B 27 160.038 8.904 5.261 1.00 0.00 C ATOM 1799 O GLY B 27 158.914 9.350 5.129 1.00 0.00 O ATOM 0 H GLY B 27 159.625 8.287 2.391 1.00 0.00 H new ATOM 0 HA2 GLY B 27 160.952 7.018 4.731 1.00 0.00 H new ATOM 0 HA3 GLY B 27 161.534 8.378 3.791 1.00 0.00 H new ATOM 1803 N GLU B 28 160.774 9.202 6.294 1.00 0.00 N ATOM 1804 CA GLU B 28 160.250 10.113 7.353 1.00 0.00 C ATOM 1805 C GLU B 28 159.840 11.458 6.746 1.00 0.00 C ATOM 1806 O GLU B 28 158.838 12.036 7.122 1.00 0.00 O ATOM 1807 CB GLU B 28 161.344 10.348 8.397 1.00 0.00 C ATOM 1808 CG GLU B 28 161.596 9.056 9.176 1.00 0.00 C ATOM 1809 CD GLU B 28 162.690 9.296 10.218 1.00 0.00 C ATOM 1810 OE1 GLU B 28 163.312 10.344 10.165 1.00 0.00 O ATOM 1811 OE2 GLU B 28 162.891 8.424 11.047 1.00 0.00 O ATOM 0 H GLU B 28 161.719 8.854 6.453 1.00 0.00 H new ATOM 0 HA GLU B 28 159.377 9.653 7.816 1.00 0.00 H new ATOM 0 HB2 GLU B 28 162.262 10.675 7.909 1.00 0.00 H new ATOM 0 HB3 GLU B 28 161.045 11.144 9.079 1.00 0.00 H new ATOM 0 HG2 GLU B 28 160.679 8.728 9.665 1.00 0.00 H new ATOM 0 HG3 GLU B 28 161.896 8.260 8.494 1.00 0.00 H new ATOM 1818 N VAL B 29 160.601 11.970 5.819 1.00 0.00 N ATOM 1819 CA VAL B 29 160.242 13.284 5.211 1.00 0.00 C ATOM 1820 C VAL B 29 158.964 13.136 4.385 1.00 0.00 C ATOM 1821 O VAL B 29 158.084 13.976 4.421 1.00 0.00 O ATOM 1822 CB VAL B 29 161.380 13.755 4.304 1.00 0.00 C ATOM 1823 CG1 VAL B 29 160.969 15.044 3.592 1.00 0.00 C ATOM 1824 CG2 VAL B 29 162.635 14.008 5.143 1.00 0.00 C ATOM 0 H VAL B 29 161.452 11.539 5.457 1.00 0.00 H new ATOM 0 HA VAL B 29 160.080 14.015 6.003 1.00 0.00 H new ATOM 0 HB VAL B 29 161.592 12.985 3.562 1.00 0.00 H new ATOM 0 HG11 VAL B 29 161.781 15.378 2.946 1.00 0.00 H new ATOM 0 HG12 VAL B 29 160.079 14.859 2.990 1.00 0.00 H new ATOM 0 HG13 VAL B 29 160.753 15.815 4.331 1.00 0.00 H new ATOM 0 HG21 VAL B 29 163.445 14.343 4.495 1.00 0.00 H new ATOM 0 HG22 VAL B 29 162.426 14.775 5.889 1.00 0.00 H new ATOM 0 HG23 VAL B 29 162.930 13.086 5.644 1.00 0.00 H new ATOM 1834 N LEU B 30 158.862 12.079 3.630 1.00 0.00 N ATOM 1835 CA LEU B 30 157.652 11.871 2.787 1.00 0.00 C ATOM 1836 C LEU B 30 156.437 11.624 3.682 1.00 0.00 C ATOM 1837 O LEU B 30 155.348 12.090 3.411 1.00 0.00 O ATOM 1838 CB LEU B 30 157.874 10.663 1.870 1.00 0.00 C ATOM 1839 CG LEU B 30 158.972 10.976 0.840 1.00 0.00 C ATOM 1840 CD1 LEU B 30 159.346 9.690 0.092 1.00 0.00 C ATOM 1841 CD2 LEU B 30 158.484 12.039 -0.166 1.00 0.00 C ATOM 0 H LEU B 30 159.568 11.346 3.560 1.00 0.00 H new ATOM 0 HA LEU B 30 157.474 12.759 2.181 1.00 0.00 H new ATOM 0 HB2 LEU B 30 158.158 9.794 2.463 1.00 0.00 H new ATOM 0 HB3 LEU B 30 156.946 10.410 1.358 1.00 0.00 H new ATOM 0 HG LEU B 30 159.845 11.368 1.362 1.00 0.00 H new ATOM 0 HD11 LEU B 30 160.124 9.908 -0.639 1.00 0.00 H new ATOM 0 HD12 LEU B 30 159.713 8.949 0.803 1.00 0.00 H new ATOM 0 HD13 LEU B 30 158.467 9.298 -0.420 1.00 0.00 H new ATOM 0 HD21 LEU B 30 159.274 12.248 -0.887 1.00 0.00 H new ATOM 0 HD22 LEU B 30 157.604 11.667 -0.690 1.00 0.00 H new ATOM 0 HD23 LEU B 30 158.229 12.955 0.367 1.00 0.00 H new ATOM 1853 N GLY B 31 156.617 10.893 4.743 1.00 0.00 N ATOM 1854 CA GLY B 31 155.476 10.612 5.658 1.00 0.00 C ATOM 1855 C GLY B 31 154.918 11.925 6.218 1.00 0.00 C ATOM 1856 O GLY B 31 153.723 12.088 6.364 1.00 0.00 O ATOM 0 H GLY B 31 157.506 10.476 5.018 1.00 0.00 H new ATOM 0 HA2 GLY B 31 154.694 10.074 5.123 1.00 0.00 H new ATOM 0 HA3 GLY B 31 155.804 9.969 6.475 1.00 0.00 H new ATOM 1860 N LYS B 32 155.775 12.854 6.550 1.00 0.00 N ATOM 1861 CA LYS B 32 155.297 14.150 7.123 1.00 0.00 C ATOM 1862 C LYS B 32 154.430 14.914 6.115 1.00 0.00 C ATOM 1863 O LYS B 32 153.448 15.527 6.486 1.00 0.00 O ATOM 1864 CB LYS B 32 156.518 15.001 7.502 1.00 0.00 C ATOM 1865 CG LYS B 32 156.096 16.356 8.102 1.00 0.00 C ATOM 1866 CD LYS B 32 155.334 16.156 9.419 1.00 0.00 C ATOM 1867 CE LYS B 32 155.308 17.477 10.195 1.00 0.00 C ATOM 1868 NZ LYS B 32 154.625 17.276 11.505 1.00 0.00 N ATOM 0 H LYS B 32 156.787 12.773 6.450 1.00 0.00 H new ATOM 0 HA LYS B 32 154.688 13.944 8.003 1.00 0.00 H new ATOM 0 HB2 LYS B 32 157.132 14.459 8.221 1.00 0.00 H new ATOM 0 HB3 LYS B 32 157.134 15.169 6.619 1.00 0.00 H new ATOM 0 HG2 LYS B 32 156.978 16.972 8.277 1.00 0.00 H new ATOM 0 HG3 LYS B 32 155.468 16.894 7.391 1.00 0.00 H new ATOM 0 HD2 LYS B 32 154.317 15.820 9.217 1.00 0.00 H new ATOM 0 HD3 LYS B 32 155.813 15.380 10.016 1.00 0.00 H new ATOM 0 HE2 LYS B 32 156.325 17.836 10.355 1.00 0.00 H new ATOM 0 HE3 LYS B 32 154.788 18.240 9.616 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 154.609 18.174 12.029 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 153.650 16.952 11.342 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 155.139 16.561 12.058 1.00 0.00 H new ATOM 1882 N LYS B 33 154.778 14.922 4.857 1.00 0.00 N ATOM 1883 CA LYS B 33 153.948 15.695 3.886 1.00 0.00 C ATOM 1884 C LYS B 33 152.581 15.028 3.725 1.00 0.00 C ATOM 1885 O LYS B 33 151.561 15.687 3.719 1.00 0.00 O ATOM 1886 CB LYS B 33 154.655 15.746 2.531 1.00 0.00 C ATOM 1887 CG LYS B 33 155.912 16.610 2.650 1.00 0.00 C ATOM 1888 CD LYS B 33 156.627 16.668 1.301 1.00 0.00 C ATOM 1889 CE LYS B 33 157.881 17.533 1.429 1.00 0.00 C ATOM 1890 NZ LYS B 33 158.790 16.933 2.446 1.00 0.00 N ATOM 0 H LYS B 33 155.585 14.437 4.464 1.00 0.00 H new ATOM 0 HA LYS B 33 153.811 16.709 4.262 1.00 0.00 H new ATOM 0 HB2 LYS B 33 154.921 14.739 2.208 1.00 0.00 H new ATOM 0 HB3 LYS B 33 153.987 16.157 1.774 1.00 0.00 H new ATOM 0 HG2 LYS B 33 155.644 17.616 2.974 1.00 0.00 H new ATOM 0 HG3 LYS B 33 156.578 16.198 3.408 1.00 0.00 H new ATOM 0 HD2 LYS B 33 156.896 15.663 0.976 1.00 0.00 H new ATOM 0 HD3 LYS B 33 155.963 17.081 0.542 1.00 0.00 H new ATOM 0 HE2 LYS B 33 158.388 17.603 0.467 1.00 0.00 H new ATOM 0 HE3 LYS B 33 157.609 18.547 1.721 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 159.753 16.870 2.057 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 158.799 17.529 3.298 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 158.454 15.980 2.693 1.00 0.00 H new ATOM 1904 N LEU B 34 152.544 13.731 3.613 1.00 0.00 N ATOM 1905 CA LEU B 34 151.232 13.040 3.477 1.00 0.00 C ATOM 1906 C LEU B 34 150.414 13.279 4.753 1.00 0.00 C ATOM 1907 O LEU B 34 149.219 13.494 4.715 1.00 0.00 O ATOM 1908 CB LEU B 34 151.469 11.539 3.266 1.00 0.00 C ATOM 1909 CG LEU B 34 152.084 11.287 1.879 1.00 0.00 C ATOM 1910 CD1 LEU B 34 152.563 9.835 1.798 1.00 0.00 C ATOM 1911 CD2 LEU B 34 151.038 11.540 0.773 1.00 0.00 C ATOM 0 H LEU B 34 153.361 13.121 3.610 1.00 0.00 H new ATOM 0 HA LEU B 34 150.684 13.431 2.620 1.00 0.00 H new ATOM 0 HB2 LEU B 34 152.133 11.156 4.041 1.00 0.00 H new ATOM 0 HB3 LEU B 34 150.527 10.998 3.358 1.00 0.00 H new ATOM 0 HG LEU B 34 152.923 11.968 1.734 1.00 0.00 H new ATOM 0 HD11 LEU B 34 153.000 9.650 0.817 1.00 0.00 H new ATOM 0 HD12 LEU B 34 153.313 9.656 2.569 1.00 0.00 H new ATOM 0 HD13 LEU B 34 151.718 9.164 1.951 1.00 0.00 H new ATOM 0 HD21 LEU B 34 151.489 11.357 -0.203 1.00 0.00 H new ATOM 0 HD22 LEU B 34 150.191 10.868 0.913 1.00 0.00 H new ATOM 0 HD23 LEU B 34 150.695 12.573 0.826 1.00 0.00 H new ATOM 1923 N GLU B 35 151.066 13.237 5.881 1.00 0.00 N ATOM 1924 CA GLU B 35 150.342 13.456 7.171 1.00 0.00 C ATOM 1925 C GLU B 35 149.696 14.843 7.175 1.00 0.00 C ATOM 1926 O GLU B 35 148.579 15.018 7.622 1.00 0.00 O ATOM 1927 CB GLU B 35 151.334 13.341 8.335 1.00 0.00 C ATOM 1928 CG GLU B 35 150.608 13.564 9.666 1.00 0.00 C ATOM 1929 CD GLU B 35 151.594 13.378 10.820 1.00 0.00 C ATOM 1930 OE1 GLU B 35 152.697 12.926 10.563 1.00 0.00 O ATOM 1931 OE2 GLU B 35 151.228 13.689 11.941 1.00 0.00 O ATOM 0 H GLU B 35 152.067 13.061 5.969 1.00 0.00 H new ATOM 0 HA GLU B 35 149.562 12.702 7.282 1.00 0.00 H new ATOM 0 HB2 GLU B 35 151.803 12.357 8.328 1.00 0.00 H new ATOM 0 HB3 GLU B 35 152.131 14.075 8.218 1.00 0.00 H new ATOM 0 HG2 GLU B 35 150.181 14.566 9.696 1.00 0.00 H new ATOM 0 HG3 GLU B 35 149.780 12.862 9.764 1.00 0.00 H new ATOM 1938 N GLU B 36 150.390 15.829 6.686 1.00 0.00 N ATOM 1939 CA GLU B 36 149.823 17.205 6.665 1.00 0.00 C ATOM 1940 C GLU B 36 148.631 17.251 5.704 1.00 0.00 C ATOM 1941 O GLU B 36 147.790 18.123 5.785 1.00 0.00 O ATOM 1942 CB GLU B 36 150.902 18.192 6.204 1.00 0.00 C ATOM 1943 CG GLU B 36 150.333 19.613 6.188 1.00 0.00 C ATOM 1944 CD GLU B 36 151.440 20.601 5.813 1.00 0.00 C ATOM 1945 OE1 GLU B 36 152.571 20.167 5.673 1.00 0.00 O ATOM 1946 OE2 GLU B 36 151.138 21.775 5.677 1.00 0.00 O ATOM 0 H GLU B 36 151.329 15.742 6.298 1.00 0.00 H new ATOM 0 HA GLU B 36 149.488 17.479 7.665 1.00 0.00 H new ATOM 0 HB2 GLU B 36 151.762 18.142 6.872 1.00 0.00 H new ATOM 0 HB3 GLU B 36 151.255 17.921 5.209 1.00 0.00 H new ATOM 0 HG2 GLU B 36 149.513 19.680 5.473 1.00 0.00 H new ATOM 0 HG3 GLU B 36 149.923 19.863 7.167 1.00 0.00 H new ATOM 1953 N ARG B 37 148.564 16.327 4.783 1.00 0.00 N ATOM 1954 CA ARG B 37 147.432 16.339 3.804 1.00 0.00 C ATOM 1955 C ARG B 37 146.251 15.505 4.314 1.00 0.00 C ATOM 1956 O ARG B 37 145.255 15.366 3.633 1.00 0.00 O ATOM 1957 CB ARG B 37 147.901 15.800 2.450 1.00 0.00 C ATOM 1958 CG ARG B 37 148.855 16.809 1.802 1.00 0.00 C ATOM 1959 CD ARG B 37 149.131 16.403 0.354 1.00 0.00 C ATOM 1960 NE ARG B 37 147.885 16.559 -0.449 1.00 0.00 N ATOM 1961 CZ ARG B 37 147.948 16.611 -1.752 1.00 0.00 C ATOM 1962 NH1 ARG B 37 149.106 16.595 -2.351 1.00 0.00 N ATOM 1963 NH2 ARG B 37 146.851 16.698 -2.455 1.00 0.00 N ATOM 0 H ARG B 37 149.237 15.569 4.664 1.00 0.00 H new ATOM 0 HA ARG B 37 147.099 17.370 3.687 1.00 0.00 H new ATOM 0 HB2 ARG B 37 148.403 14.842 2.582 1.00 0.00 H new ATOM 0 HB3 ARG B 37 147.044 15.624 1.800 1.00 0.00 H new ATOM 0 HG2 ARG B 37 148.419 17.807 1.833 1.00 0.00 H new ATOM 0 HG3 ARG B 37 149.789 16.852 2.362 1.00 0.00 H new ATOM 0 HD2 ARG B 37 149.926 17.021 -0.064 1.00 0.00 H new ATOM 0 HD3 ARG B 37 149.476 15.370 0.314 1.00 0.00 H new ATOM 0 HE ARG B 37 146.982 16.625 0.020 1.00 0.00 H new ATOM 0 HH11 ARG B 37 149.964 16.542 -1.802 1.00 0.00 H new ATOM 0 HH12 ARG B 37 149.154 16.636 -3.369 1.00 0.00 H new ATOM 0 HH21 ARG B 37 145.946 16.725 -1.986 1.00 0.00 H new ATOM 0 HH22 ARG B 37 146.900 16.739 -3.473 1.00 0.00 H new ATOM 1977 N GLY B 38 146.323 14.986 5.519 1.00 0.00 N ATOM 1978 CA GLY B 38 145.163 14.209 6.075 1.00 0.00 C ATOM 1979 C GLY B 38 145.417 12.701 6.043 1.00 0.00 C ATOM 1980 O GLY B 38 144.552 11.925 6.400 1.00 0.00 O ATOM 0 H GLY B 38 147.129 15.065 6.139 1.00 0.00 H new ATOM 0 HA2 GLY B 38 144.974 14.523 7.101 1.00 0.00 H new ATOM 0 HA3 GLY B 38 144.265 14.438 5.501 1.00 0.00 H new ATOM 1984 N PHE B 39 146.588 12.265 5.655 1.00 0.00 N ATOM 1985 CA PHE B 39 146.880 10.797 5.645 1.00 0.00 C ATOM 1986 C PHE B 39 147.766 10.492 6.851 1.00 0.00 C ATOM 1987 O PHE B 39 148.952 10.260 6.726 1.00 0.00 O ATOM 1988 CB PHE B 39 147.635 10.434 4.369 1.00 0.00 C ATOM 1989 CG PHE B 39 146.761 10.677 3.165 1.00 0.00 C ATOM 1990 CD1 PHE B 39 145.893 9.677 2.717 1.00 0.00 C ATOM 1991 CD2 PHE B 39 146.816 11.907 2.501 1.00 0.00 C ATOM 1992 CE1 PHE B 39 145.078 9.905 1.603 1.00 0.00 C ATOM 1993 CE2 PHE B 39 146.001 12.136 1.386 1.00 0.00 C ATOM 1994 CZ PHE B 39 145.130 11.134 0.936 1.00 0.00 C ATOM 0 H PHE B 39 147.355 12.861 5.344 1.00 0.00 H new ATOM 0 HA PHE B 39 145.953 10.225 5.687 1.00 0.00 H new ATOM 0 HB2 PHE B 39 148.545 11.029 4.294 1.00 0.00 H new ATOM 0 HB3 PHE B 39 147.940 9.388 4.402 1.00 0.00 H new ATOM 0 HD1 PHE B 39 145.852 8.728 3.231 1.00 0.00 H new ATOM 0 HD2 PHE B 39 147.487 12.679 2.848 1.00 0.00 H new ATOM 0 HE1 PHE B 39 144.408 9.132 1.257 1.00 0.00 H new ATOM 0 HE2 PHE B 39 146.043 13.085 0.872 1.00 0.00 H new ATOM 0 HZ PHE B 39 144.500 11.310 0.076 1.00 0.00 H new ATOM 2004 N ASP B 40 147.198 10.531 8.024 1.00 0.00 N ATOM 2005 CA ASP B 40 148.008 10.287 9.250 1.00 0.00 C ATOM 2006 C ASP B 40 148.225 8.788 9.473 1.00 0.00 C ATOM 2007 O ASP B 40 148.999 8.401 10.328 1.00 0.00 O ATOM 2008 CB ASP B 40 147.288 10.892 10.458 1.00 0.00 C ATOM 2009 CG ASP B 40 145.938 10.204 10.653 1.00 0.00 C ATOM 2010 OD1 ASP B 40 145.497 9.534 9.733 1.00 0.00 O ATOM 2011 OD2 ASP B 40 145.363 10.361 11.718 1.00 0.00 O ATOM 0 H ASP B 40 146.209 10.721 8.187 1.00 0.00 H new ATOM 0 HA ASP B 40 148.984 10.757 9.125 1.00 0.00 H new ATOM 0 HB2 ASP B 40 147.899 10.775 11.353 1.00 0.00 H new ATOM 0 HB3 ASP B 40 147.143 11.962 10.308 1.00 0.00 H new ATOM 2016 N LYS B 41 147.556 7.937 8.731 1.00 0.00 N ATOM 2017 CA LYS B 41 147.743 6.461 8.930 1.00 0.00 C ATOM 2018 C LYS B 41 147.837 5.743 7.578 1.00 0.00 C ATOM 2019 O LYS B 41 147.421 6.250 6.556 1.00 0.00 O ATOM 2020 CB LYS B 41 146.585 5.914 9.762 1.00 0.00 C ATOM 2021 CG LYS B 41 146.601 6.618 11.122 1.00 0.00 C ATOM 2022 CD LYS B 41 145.535 6.023 12.036 1.00 0.00 C ATOM 2023 CE LYS B 41 145.503 6.803 13.352 1.00 0.00 C ATOM 2024 NZ LYS B 41 146.809 6.644 14.052 1.00 0.00 N ATOM 0 H LYS B 41 146.893 8.197 8.001 1.00 0.00 H new ATOM 0 HA LYS B 41 148.677 6.283 9.463 1.00 0.00 H new ATOM 0 HB2 LYS B 41 145.636 6.088 9.254 1.00 0.00 H new ATOM 0 HB3 LYS B 41 146.685 4.836 9.890 1.00 0.00 H new ATOM 0 HG2 LYS B 41 147.584 6.514 11.582 1.00 0.00 H new ATOM 0 HG3 LYS B 41 146.422 7.685 10.989 1.00 0.00 H new ATOM 0 HD2 LYS B 41 144.560 6.065 11.551 1.00 0.00 H new ATOM 0 HD3 LYS B 41 145.750 4.972 12.228 1.00 0.00 H new ATOM 0 HE2 LYS B 41 145.308 7.858 13.158 1.00 0.00 H new ATOM 0 HE3 LYS B 41 144.692 6.440 13.984 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 146.703 6.917 15.050 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 147.115 5.652 13.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 147.521 7.253 13.600 1.00 0.00 H new ATOM 2038 N ALA B 42 148.430 4.577 7.576 1.00 0.00 N ATOM 2039 CA ALA B 42 148.621 3.807 6.309 1.00 0.00 C ATOM 2040 C ALA B 42 147.293 3.343 5.690 1.00 0.00 C ATOM 2041 O ALA B 42 147.133 3.368 4.487 1.00 0.00 O ATOM 2042 CB ALA B 42 149.483 2.579 6.604 1.00 0.00 C ATOM 0 H ALA B 42 148.795 4.119 8.411 1.00 0.00 H new ATOM 0 HA ALA B 42 149.103 4.471 5.591 1.00 0.00 H new ATOM 0 HB1 ALA B 42 149.630 2.009 5.687 1.00 0.00 H new ATOM 0 HB2 ALA B 42 150.451 2.898 6.991 1.00 0.00 H new ATOM 0 HB3 ALA B 42 148.984 1.954 7.344 1.00 0.00 H new ATOM 2048 N TYR B 43 146.356 2.880 6.473 1.00 0.00 N ATOM 2049 CA TYR B 43 145.088 2.375 5.864 1.00 0.00 C ATOM 2050 C TYR B 43 144.381 3.480 5.072 1.00 0.00 C ATOM 2051 O TYR B 43 143.561 3.200 4.220 1.00 0.00 O ATOM 2052 CB TYR B 43 144.156 1.769 6.925 1.00 0.00 C ATOM 2053 CG TYR B 43 143.676 2.810 7.907 1.00 0.00 C ATOM 2054 CD1 TYR B 43 142.677 3.715 7.536 1.00 0.00 C ATOM 2055 CD2 TYR B 43 144.207 2.845 9.202 1.00 0.00 C ATOM 2056 CE1 TYR B 43 142.213 4.658 8.457 1.00 0.00 C ATOM 2057 CE2 TYR B 43 143.742 3.790 10.121 1.00 0.00 C ATOM 2058 CZ TYR B 43 142.744 4.696 9.750 1.00 0.00 C ATOM 2059 OH TYR B 43 142.284 5.626 10.660 1.00 0.00 O ATOM 0 H TYR B 43 146.409 2.829 7.490 1.00 0.00 H new ATOM 0 HA TYR B 43 145.351 1.579 5.168 1.00 0.00 H new ATOM 0 HB2 TYR B 43 143.298 1.308 6.435 1.00 0.00 H new ATOM 0 HB3 TYR B 43 144.680 0.978 7.461 1.00 0.00 H new ATOM 0 HD1 TYR B 43 142.264 3.685 6.538 1.00 0.00 H new ATOM 0 HD2 TYR B 43 144.975 2.143 9.491 1.00 0.00 H new ATOM 0 HE1 TYR B 43 141.443 5.359 8.170 1.00 0.00 H new ATOM 0 HE2 TYR B 43 144.154 3.820 11.119 1.00 0.00 H new ATOM 0 HH TYR B 43 142.357 5.260 11.566 1.00 0.00 H new ATOM 2069 N VAL B 44 144.703 4.725 5.299 1.00 0.00 N ATOM 2070 CA VAL B 44 144.049 5.800 4.493 1.00 0.00 C ATOM 2071 C VAL B 44 144.722 5.808 3.119 1.00 0.00 C ATOM 2072 O VAL B 44 144.118 6.087 2.102 1.00 0.00 O ATOM 2073 CB VAL B 44 144.237 7.165 5.165 1.00 0.00 C ATOM 2074 CG1 VAL B 44 143.434 8.229 4.408 1.00 0.00 C ATOM 2075 CG2 VAL B 44 143.742 7.102 6.612 1.00 0.00 C ATOM 0 H VAL B 44 145.378 5.042 5.995 1.00 0.00 H new ATOM 0 HA VAL B 44 142.979 5.611 4.408 1.00 0.00 H new ATOM 0 HB VAL B 44 145.296 7.424 5.151 1.00 0.00 H new ATOM 0 HG11 VAL B 44 143.570 9.198 4.889 1.00 0.00 H new ATOM 0 HG12 VAL B 44 143.783 8.283 3.377 1.00 0.00 H new ATOM 0 HG13 VAL B 44 142.377 7.964 4.420 1.00 0.00 H new ATOM 0 HG21 VAL B 44 143.878 8.074 7.086 1.00 0.00 H new ATOM 0 HG22 VAL B 44 142.685 6.837 6.624 1.00 0.00 H new ATOM 0 HG23 VAL B 44 144.311 6.350 7.159 1.00 0.00 H new ATOM 2085 N VAL B 45 145.986 5.472 3.109 1.00 0.00 N ATOM 2086 CA VAL B 45 146.756 5.420 1.836 1.00 0.00 C ATOM 2087 C VAL B 45 146.391 4.125 1.114 1.00 0.00 C ATOM 2088 O VAL B 45 146.258 4.087 -0.093 1.00 0.00 O ATOM 2089 CB VAL B 45 148.254 5.433 2.140 1.00 0.00 C ATOM 2090 CG1 VAL B 45 149.043 5.316 0.834 1.00 0.00 C ATOM 2091 CG2 VAL B 45 148.616 6.743 2.839 1.00 0.00 C ATOM 0 H VAL B 45 146.522 5.229 3.942 1.00 0.00 H new ATOM 0 HA VAL B 45 146.516 6.282 1.213 1.00 0.00 H new ATOM 0 HB VAL B 45 148.502 4.592 2.788 1.00 0.00 H new ATOM 0 HG11 VAL B 45 150.111 5.325 1.052 1.00 0.00 H new ATOM 0 HG12 VAL B 45 148.783 4.383 0.334 1.00 0.00 H new ATOM 0 HG13 VAL B 45 148.798 6.156 0.184 1.00 0.00 H new ATOM 0 HG21 VAL B 45 149.684 6.756 3.057 1.00 0.00 H new ATOM 0 HG22 VAL B 45 148.368 7.583 2.189 1.00 0.00 H new ATOM 0 HG23 VAL B 45 148.054 6.826 3.769 1.00 0.00 H new ATOM 2101 N LEU B 46 146.191 3.067 1.851 1.00 0.00 N ATOM 2102 CA LEU B 46 145.794 1.784 1.212 1.00 0.00 C ATOM 2103 C LEU B 46 144.472 2.037 0.488 1.00 0.00 C ATOM 2104 O LEU B 46 144.231 1.540 -0.593 1.00 0.00 O ATOM 2105 CB LEU B 46 145.595 0.707 2.292 1.00 0.00 C ATOM 2106 CG LEU B 46 145.247 -0.652 1.645 1.00 0.00 C ATOM 2107 CD1 LEU B 46 146.514 -1.316 1.079 1.00 0.00 C ATOM 2108 CD2 LEU B 46 144.587 -1.575 2.689 1.00 0.00 C ATOM 0 H LEU B 46 146.286 3.037 2.866 1.00 0.00 H new ATOM 0 HA LEU B 46 146.561 1.438 0.518 1.00 0.00 H new ATOM 0 HB2 LEU B 46 146.502 0.610 2.889 1.00 0.00 H new ATOM 0 HB3 LEU B 46 144.797 1.008 2.971 1.00 0.00 H new ATOM 0 HG LEU B 46 144.548 -0.483 0.826 1.00 0.00 H new ATOM 0 HD11 LEU B 46 146.252 -2.273 0.627 1.00 0.00 H new ATOM 0 HD12 LEU B 46 146.959 -0.667 0.324 1.00 0.00 H new ATOM 0 HD13 LEU B 46 147.230 -1.479 1.884 1.00 0.00 H new ATOM 0 HD21 LEU B 46 144.344 -2.532 2.227 1.00 0.00 H new ATOM 0 HD22 LEU B 46 145.276 -1.737 3.518 1.00 0.00 H new ATOM 0 HD23 LEU B 46 143.674 -1.109 3.061 1.00 0.00 H new ATOM 2120 N GLY B 47 143.611 2.808 1.097 1.00 0.00 N ATOM 2121 CA GLY B 47 142.290 3.108 0.481 1.00 0.00 C ATOM 2122 C GLY B 47 142.483 3.799 -0.871 1.00 0.00 C ATOM 2123 O GLY B 47 141.810 3.486 -1.831 1.00 0.00 O ATOM 0 H GLY B 47 143.770 3.246 2.004 1.00 0.00 H new ATOM 0 HA2 GLY B 47 141.724 2.186 0.349 1.00 0.00 H new ATOM 0 HA3 GLY B 47 141.708 3.747 1.145 1.00 0.00 H new ATOM 2127 N GLN B 48 143.393 4.731 -0.963 1.00 0.00 N ATOM 2128 CA GLN B 48 143.612 5.418 -2.270 1.00 0.00 C ATOM 2129 C GLN B 48 144.017 4.372 -3.311 1.00 0.00 C ATOM 2130 O GLN B 48 143.563 4.388 -4.439 1.00 0.00 O ATOM 2131 CB GLN B 48 144.728 6.458 -2.122 1.00 0.00 C ATOM 2132 CG GLN B 48 144.801 7.322 -3.383 1.00 0.00 C ATOM 2133 CD GLN B 48 143.563 8.220 -3.460 1.00 0.00 C ATOM 2134 OE1 GLN B 48 143.117 8.742 -2.459 1.00 0.00 O ATOM 2135 NE2 GLN B 48 142.993 8.428 -4.615 1.00 0.00 N ATOM 0 H GLN B 48 143.990 5.045 -0.198 1.00 0.00 H new ATOM 0 HA GLN B 48 142.698 5.921 -2.585 1.00 0.00 H new ATOM 0 HB2 GLN B 48 144.540 7.085 -1.251 1.00 0.00 H new ATOM 0 HB3 GLN B 48 145.683 5.959 -1.956 1.00 0.00 H new ATOM 0 HG2 GLN B 48 145.705 7.931 -3.367 1.00 0.00 H new ATOM 0 HG3 GLN B 48 144.859 6.688 -4.268 1.00 0.00 H new ATOM 0 HE21 GLN B 48 143.369 7.989 -5.456 1.00 0.00 H new ATOM 0 HE22 GLN B 48 142.172 9.030 -4.677 1.00 0.00 H new ATOM 2144 N PHE B 49 144.863 3.455 -2.930 1.00 0.00 N ATOM 2145 CA PHE B 49 145.303 2.387 -3.872 1.00 0.00 C ATOM 2146 C PHE B 49 144.072 1.589 -4.327 1.00 0.00 C ATOM 2147 O PHE B 49 143.937 1.231 -5.481 1.00 0.00 O ATOM 2148 CB PHE B 49 146.291 1.477 -3.139 1.00 0.00 C ATOM 2149 CG PHE B 49 146.794 0.397 -4.066 1.00 0.00 C ATOM 2150 CD1 PHE B 49 147.599 0.739 -5.158 1.00 0.00 C ATOM 2151 CD2 PHE B 49 146.473 -0.944 -3.826 1.00 0.00 C ATOM 2152 CE1 PHE B 49 148.081 -0.260 -6.012 1.00 0.00 C ATOM 2153 CE2 PHE B 49 146.953 -1.942 -4.678 1.00 0.00 C ATOM 2154 CZ PHE B 49 147.757 -1.601 -5.773 1.00 0.00 C ATOM 0 H PHE B 49 145.272 3.399 -1.997 1.00 0.00 H new ATOM 0 HA PHE B 49 145.788 2.815 -4.749 1.00 0.00 H new ATOM 0 HB2 PHE B 49 147.129 2.065 -2.766 1.00 0.00 H new ATOM 0 HB3 PHE B 49 145.807 1.026 -2.273 1.00 0.00 H new ATOM 0 HD1 PHE B 49 147.848 1.774 -5.342 1.00 0.00 H new ATOM 0 HD2 PHE B 49 145.854 -1.208 -2.981 1.00 0.00 H new ATOM 0 HE1 PHE B 49 148.703 0.004 -6.855 1.00 0.00 H new ATOM 0 HE2 PHE B 49 146.704 -2.976 -4.492 1.00 0.00 H new ATOM 0 HZ PHE B 49 148.127 -2.372 -6.433 1.00 0.00 H new ATOM 2164 N LEU B 50 143.182 1.317 -3.423 1.00 0.00 N ATOM 2165 CA LEU B 50 141.958 0.547 -3.801 1.00 0.00 C ATOM 2166 C LEU B 50 141.096 1.423 -4.716 1.00 0.00 C ATOM 2167 O LEU B 50 140.487 0.949 -5.653 1.00 0.00 O ATOM 2168 CB LEU B 50 141.163 0.161 -2.547 1.00 0.00 C ATOM 2169 CG LEU B 50 142.008 -0.748 -1.641 1.00 0.00 C ATOM 2170 CD1 LEU B 50 141.218 -1.062 -0.366 1.00 0.00 C ATOM 2171 CD2 LEU B 50 142.350 -2.061 -2.370 1.00 0.00 C ATOM 0 H LEU B 50 143.242 1.590 -2.442 1.00 0.00 H new ATOM 0 HA LEU B 50 142.245 -0.368 -4.319 1.00 0.00 H new ATOM 0 HB2 LEU B 50 140.871 1.059 -2.002 1.00 0.00 H new ATOM 0 HB3 LEU B 50 140.245 -0.351 -2.833 1.00 0.00 H new ATOM 0 HG LEU B 50 142.936 -0.236 -1.387 1.00 0.00 H new ATOM 0 HD11 LEU B 50 141.813 -1.707 0.281 1.00 0.00 H new ATOM 0 HD12 LEU B 50 140.989 -0.134 0.158 1.00 0.00 H new ATOM 0 HD13 LEU B 50 140.289 -1.569 -0.629 1.00 0.00 H new ATOM 0 HD21 LEU B 50 142.949 -2.695 -1.716 1.00 0.00 H new ATOM 0 HD22 LEU B 50 141.429 -2.580 -2.635 1.00 0.00 H new ATOM 0 HD23 LEU B 50 142.914 -1.838 -3.275 1.00 0.00 H new ATOM 2183 N VAL B 51 141.041 2.695 -4.444 1.00 0.00 N ATOM 2184 CA VAL B 51 140.220 3.615 -5.284 1.00 0.00 C ATOM 2185 C VAL B 51 140.801 3.689 -6.706 1.00 0.00 C ATOM 2186 O VAL B 51 140.097 3.956 -7.659 1.00 0.00 O ATOM 2187 CB VAL B 51 140.213 5.010 -4.647 1.00 0.00 C ATOM 2188 CG1 VAL B 51 139.583 6.024 -5.607 1.00 0.00 C ATOM 2189 CG2 VAL B 51 139.395 4.971 -3.355 1.00 0.00 C ATOM 0 H VAL B 51 141.533 3.142 -3.670 1.00 0.00 H new ATOM 0 HA VAL B 51 139.199 3.238 -5.343 1.00 0.00 H new ATOM 0 HB VAL B 51 141.239 5.308 -4.432 1.00 0.00 H new ATOM 0 HG11 VAL B 51 139.583 7.011 -5.145 1.00 0.00 H new ATOM 0 HG12 VAL B 51 140.159 6.056 -6.532 1.00 0.00 H new ATOM 0 HG13 VAL B 51 138.558 5.727 -5.828 1.00 0.00 H new ATOM 0 HG21 VAL B 51 139.388 5.961 -2.899 1.00 0.00 H new ATOM 0 HG22 VAL B 51 138.373 4.668 -3.581 1.00 0.00 H new ATOM 0 HG23 VAL B 51 139.841 4.256 -2.663 1.00 0.00 H new ATOM 2199 N LEU B 52 142.083 3.470 -6.853 1.00 0.00 N ATOM 2200 CA LEU B 52 142.711 3.546 -8.211 1.00 0.00 C ATOM 2201 C LEU B 52 142.669 2.175 -8.893 1.00 0.00 C ATOM 2202 O LEU B 52 143.329 1.954 -9.888 1.00 0.00 O ATOM 2203 CB LEU B 52 144.168 3.994 -8.076 1.00 0.00 C ATOM 2204 CG LEU B 52 144.233 5.423 -7.518 1.00 0.00 C ATOM 2205 CD1 LEU B 52 145.694 5.778 -7.215 1.00 0.00 C ATOM 2206 CD2 LEU B 52 143.655 6.425 -8.540 1.00 0.00 C ATOM 0 H LEU B 52 142.724 3.242 -6.093 1.00 0.00 H new ATOM 0 HA LEU B 52 142.156 4.264 -8.815 1.00 0.00 H new ATOM 0 HB2 LEU B 52 144.706 3.313 -7.416 1.00 0.00 H new ATOM 0 HB3 LEU B 52 144.661 3.952 -9.047 1.00 0.00 H new ATOM 0 HG LEU B 52 143.642 5.478 -6.604 1.00 0.00 H new ATOM 0 HD11 LEU B 52 145.747 6.792 -6.818 1.00 0.00 H new ATOM 0 HD12 LEU B 52 146.093 5.079 -6.480 1.00 0.00 H new ATOM 0 HD13 LEU B 52 146.281 5.716 -8.131 1.00 0.00 H new ATOM 0 HD21 LEU B 52 143.708 7.434 -8.130 1.00 0.00 H new ATOM 0 HD22 LEU B 52 144.233 6.377 -9.463 1.00 0.00 H new ATOM 0 HD23 LEU B 52 142.616 6.172 -8.749 1.00 0.00 H new ATOM 2218 N LYS B 53 141.895 1.257 -8.388 1.00 0.00 N ATOM 2219 CA LYS B 53 141.813 -0.085 -9.034 1.00 0.00 C ATOM 2220 C LYS B 53 143.218 -0.615 -9.343 1.00 0.00 C ATOM 2221 O LYS B 53 143.447 -1.196 -10.384 1.00 0.00 O ATOM 2222 CB LYS B 53 141.006 0.018 -10.331 1.00 0.00 C ATOM 2223 CG LYS B 53 139.531 0.274 -9.995 1.00 0.00 C ATOM 2224 CD LYS B 53 138.688 0.267 -11.277 1.00 0.00 C ATOM 2225 CE LYS B 53 138.844 1.595 -12.026 1.00 0.00 C ATOM 2226 NZ LYS B 53 137.856 1.650 -13.140 1.00 0.00 N ATOM 0 H LYS B 53 141.316 1.376 -7.557 1.00 0.00 H new ATOM 0 HA LYS B 53 141.319 -0.775 -8.350 1.00 0.00 H new ATOM 0 HB2 LYS B 53 141.395 0.826 -10.951 1.00 0.00 H new ATOM 0 HB3 LYS B 53 141.105 -0.902 -10.908 1.00 0.00 H new ATOM 0 HG2 LYS B 53 139.169 -0.491 -9.308 1.00 0.00 H new ATOM 0 HG3 LYS B 53 139.427 1.233 -9.488 1.00 0.00 H new ATOM 0 HD2 LYS B 53 138.997 -0.558 -11.919 1.00 0.00 H new ATOM 0 HD3 LYS B 53 137.639 0.103 -11.029 1.00 0.00 H new ATOM 0 HE2 LYS B 53 138.688 2.431 -11.344 1.00 0.00 H new ATOM 0 HE3 LYS B 53 139.857 1.688 -12.418 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 137.959 2.550 -13.651 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 138.026 0.859 -13.794 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 136.893 1.579 -12.754 1.00 0.00 H new ATOM 2240 N LYS B 54 144.155 -0.419 -8.445 1.00 0.00 N ATOM 2241 CA LYS B 54 145.557 -0.912 -8.650 1.00 0.00 C ATOM 2242 C LYS B 54 146.173 -0.282 -9.907 1.00 0.00 C ATOM 2243 O LYS B 54 147.134 -0.796 -10.443 1.00 0.00 O ATOM 2244 CB LYS B 54 145.561 -2.440 -8.804 1.00 0.00 C ATOM 2245 CG LYS B 54 144.985 -3.089 -7.545 1.00 0.00 C ATOM 2246 CD LYS B 54 144.993 -4.610 -7.708 1.00 0.00 C ATOM 2247 CE LYS B 54 144.417 -5.263 -6.450 1.00 0.00 C ATOM 2248 NZ LYS B 54 144.509 -6.745 -6.575 1.00 0.00 N ATOM 0 H LYS B 54 144.005 0.071 -7.563 1.00 0.00 H new ATOM 0 HA LYS B 54 146.148 -0.627 -7.779 1.00 0.00 H new ATOM 0 HB2 LYS B 54 144.972 -2.728 -9.675 1.00 0.00 H new ATOM 0 HB3 LYS B 54 146.577 -2.795 -8.975 1.00 0.00 H new ATOM 0 HG2 LYS B 54 145.573 -2.803 -6.673 1.00 0.00 H new ATOM 0 HG3 LYS B 54 143.968 -2.736 -7.373 1.00 0.00 H new ATOM 0 HD2 LYS B 54 144.405 -4.896 -8.580 1.00 0.00 H new ATOM 0 HD3 LYS B 54 146.010 -4.962 -7.880 1.00 0.00 H new ATOM 0 HE2 LYS B 54 144.964 -4.927 -5.569 1.00 0.00 H new ATOM 0 HE3 LYS B 54 143.378 -4.962 -6.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 144.118 -7.190 -5.721 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 143.968 -7.057 -7.407 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 145.505 -7.023 -6.685 1.00 0.00 H new ATOM 2262 N ASP B 55 145.662 0.820 -10.379 1.00 0.00 N ATOM 2263 CA ASP B 55 146.277 1.442 -11.590 1.00 0.00 C ATOM 2264 C ASP B 55 147.675 1.962 -11.218 1.00 0.00 C ATOM 2265 O ASP B 55 147.822 2.876 -10.430 1.00 0.00 O ATOM 2266 CB ASP B 55 145.398 2.594 -12.069 1.00 0.00 C ATOM 2267 CG ASP B 55 144.101 2.033 -12.658 1.00 0.00 C ATOM 2268 OD1 ASP B 55 144.166 1.000 -13.305 1.00 0.00 O ATOM 2269 OD2 ASP B 55 143.065 2.641 -12.447 1.00 0.00 O ATOM 0 H ASP B 55 144.859 1.312 -9.989 1.00 0.00 H new ATOM 0 HA ASP B 55 146.362 0.708 -12.391 1.00 0.00 H new ATOM 0 HB2 ASP B 55 145.174 3.264 -11.239 1.00 0.00 H new ATOM 0 HB3 ASP B 55 145.927 3.182 -12.819 1.00 0.00 H new ATOM 2274 N GLU B 56 148.698 1.356 -11.760 1.00 0.00 N ATOM 2275 CA GLU B 56 150.103 1.761 -11.435 1.00 0.00 C ATOM 2276 C GLU B 56 150.448 3.173 -11.937 1.00 0.00 C ATOM 2277 O GLU B 56 151.104 3.932 -11.255 1.00 0.00 O ATOM 2278 CB GLU B 56 151.055 0.754 -12.082 1.00 0.00 C ATOM 2279 CG GLU B 56 152.484 1.014 -11.609 1.00 0.00 C ATOM 2280 CD GLU B 56 153.398 -0.092 -12.139 1.00 0.00 C ATOM 2281 OE1 GLU B 56 152.898 -0.971 -12.821 1.00 0.00 O ATOM 2282 OE2 GLU B 56 154.582 -0.044 -11.853 1.00 0.00 O ATOM 0 H GLU B 56 148.621 0.586 -12.424 1.00 0.00 H new ATOM 0 HA GLU B 56 150.205 1.773 -10.350 1.00 0.00 H new ATOM 0 HB2 GLU B 56 150.756 -0.262 -11.823 1.00 0.00 H new ATOM 0 HB3 GLU B 56 151.001 0.835 -13.168 1.00 0.00 H new ATOM 0 HG2 GLU B 56 152.826 1.986 -11.964 1.00 0.00 H new ATOM 0 HG3 GLU B 56 152.520 1.041 -10.520 1.00 0.00 H new ATOM 2289 N ASP B 57 150.031 3.529 -13.121 1.00 0.00 N ATOM 2290 CA ASP B 57 150.363 4.888 -13.657 1.00 0.00 C ATOM 2291 C ASP B 57 149.603 5.965 -12.884 1.00 0.00 C ATOM 2292 O ASP B 57 150.131 7.019 -12.591 1.00 0.00 O ATOM 2293 CB ASP B 57 149.988 4.961 -15.138 1.00 0.00 C ATOM 2294 CG ASP B 57 150.942 4.084 -15.951 1.00 0.00 C ATOM 2295 OD1 ASP B 57 152.009 3.778 -15.445 1.00 0.00 O ATOM 2296 OD2 ASP B 57 150.593 3.740 -17.068 1.00 0.00 O ATOM 0 H ASP B 57 149.475 2.942 -13.743 1.00 0.00 H new ATOM 0 HA ASP B 57 151.433 5.060 -13.541 1.00 0.00 H new ATOM 0 HB2 ASP B 57 148.960 4.627 -15.280 1.00 0.00 H new ATOM 0 HB3 ASP B 57 150.039 5.993 -15.486 1.00 0.00 H new ATOM 2301 N LEU B 58 148.381 5.713 -12.548 1.00 0.00 N ATOM 2302 CA LEU B 58 147.612 6.738 -11.789 1.00 0.00 C ATOM 2303 C LEU B 58 148.184 6.846 -10.375 1.00 0.00 C ATOM 2304 O LEU B 58 148.315 7.924 -9.829 1.00 0.00 O ATOM 2305 CB LEU B 58 146.131 6.349 -11.719 1.00 0.00 C ATOM 2306 CG LEU B 58 145.531 6.274 -13.132 1.00 0.00 C ATOM 2307 CD1 LEU B 58 144.082 5.786 -13.035 1.00 0.00 C ATOM 2308 CD2 LEU B 58 145.558 7.663 -13.796 1.00 0.00 C ATOM 0 H LEU B 58 147.878 4.852 -12.760 1.00 0.00 H new ATOM 0 HA LEU B 58 147.696 7.699 -12.297 1.00 0.00 H new ATOM 0 HB2 LEU B 58 146.024 5.386 -11.220 1.00 0.00 H new ATOM 0 HB3 LEU B 58 145.584 7.079 -11.123 1.00 0.00 H new ATOM 0 HG LEU B 58 146.119 5.582 -13.735 1.00 0.00 H new ATOM 0 HD11 LEU B 58 143.649 5.730 -14.034 1.00 0.00 H new ATOM 0 HD12 LEU B 58 144.061 4.798 -12.575 1.00 0.00 H new ATOM 0 HD13 LEU B 58 143.504 6.482 -12.427 1.00 0.00 H new ATOM 0 HD21 LEU B 58 145.130 7.596 -14.796 1.00 0.00 H new ATOM 0 HD22 LEU B 58 144.975 8.364 -13.198 1.00 0.00 H new ATOM 0 HD23 LEU B 58 146.588 8.014 -13.864 1.00 0.00 H new ATOM 2320 N PHE B 59 148.551 5.741 -9.788 1.00 0.00 N ATOM 2321 CA PHE B 59 149.146 5.782 -8.422 1.00 0.00 C ATOM 2322 C PHE B 59 150.471 6.550 -8.460 1.00 0.00 C ATOM 2323 O PHE B 59 150.730 7.401 -7.631 1.00 0.00 O ATOM 2324 CB PHE B 59 149.380 4.351 -7.929 1.00 0.00 C ATOM 2325 CG PHE B 59 150.067 4.372 -6.582 1.00 0.00 C ATOM 2326 CD1 PHE B 59 149.331 4.646 -5.423 1.00 0.00 C ATOM 2327 CD2 PHE B 59 151.439 4.098 -6.492 1.00 0.00 C ATOM 2328 CE1 PHE B 59 149.966 4.649 -4.174 1.00 0.00 C ATOM 2329 CE2 PHE B 59 152.074 4.103 -5.243 1.00 0.00 C ATOM 2330 CZ PHE B 59 151.337 4.378 -4.084 1.00 0.00 C ATOM 0 H PHE B 59 148.465 4.810 -10.195 1.00 0.00 H new ATOM 0 HA PHE B 59 148.464 6.290 -7.739 1.00 0.00 H new ATOM 0 HB2 PHE B 59 148.429 3.824 -7.853 1.00 0.00 H new ATOM 0 HB3 PHE B 59 149.990 3.805 -8.649 1.00 0.00 H new ATOM 0 HD1 PHE B 59 148.274 4.855 -5.492 1.00 0.00 H new ATOM 0 HD2 PHE B 59 152.006 3.883 -7.385 1.00 0.00 H new ATOM 0 HE1 PHE B 59 149.398 4.860 -3.280 1.00 0.00 H new ATOM 0 HE2 PHE B 59 153.131 3.895 -5.174 1.00 0.00 H new ATOM 0 HZ PHE B 59 151.826 4.381 -3.121 1.00 0.00 H new ATOM 2340 N ARG B 60 151.323 6.241 -9.405 1.00 0.00 N ATOM 2341 CA ARG B 60 152.640 6.938 -9.478 1.00 0.00 C ATOM 2342 C ARG B 60 152.450 8.444 -9.660 1.00 0.00 C ATOM 2343 O ARG B 60 153.062 9.238 -8.974 1.00 0.00 O ATOM 2344 CB ARG B 60 153.459 6.395 -10.656 1.00 0.00 C ATOM 2345 CG ARG B 60 153.980 4.993 -10.336 1.00 0.00 C ATOM 2346 CD ARG B 60 154.815 4.485 -11.516 1.00 0.00 C ATOM 2347 NE ARG B 60 155.447 3.183 -11.156 1.00 0.00 N ATOM 2348 CZ ARG B 60 155.991 2.443 -12.085 1.00 0.00 C ATOM 2349 NH1 ARG B 60 155.958 2.828 -13.331 1.00 0.00 N ATOM 2350 NH2 ARG B 60 156.568 1.316 -11.767 1.00 0.00 N ATOM 0 H ARG B 60 151.163 5.538 -10.127 1.00 0.00 H new ATOM 0 HA ARG B 60 153.168 6.755 -8.542 1.00 0.00 H new ATOM 0 HB2 ARG B 60 152.842 6.365 -11.554 1.00 0.00 H new ATOM 0 HB3 ARG B 60 154.295 7.062 -10.865 1.00 0.00 H new ATOM 0 HG2 ARG B 60 154.585 5.015 -9.430 1.00 0.00 H new ATOM 0 HG3 ARG B 60 153.146 4.317 -10.147 1.00 0.00 H new ATOM 0 HD2 ARG B 60 154.184 4.364 -12.396 1.00 0.00 H new ATOM 0 HD3 ARG B 60 155.583 5.215 -11.773 1.00 0.00 H new ATOM 0 HE ARG B 60 155.454 2.871 -10.185 1.00 0.00 H new ATOM 0 HH11 ARG B 60 155.507 3.708 -13.581 1.00 0.00 H new ATOM 0 HH12 ARG B 60 156.383 2.249 -14.055 1.00 0.00 H new ATOM 0 HH21 ARG B 60 156.594 1.013 -10.793 1.00 0.00 H new ATOM 0 HH22 ARG B 60 156.993 0.738 -12.492 1.00 0.00 H new ATOM 2364 N GLU B 61 151.613 8.858 -10.572 1.00 0.00 N ATOM 2365 CA GLU B 61 151.403 10.318 -10.771 1.00 0.00 C ATOM 2366 C GLU B 61 150.800 10.924 -9.503 1.00 0.00 C ATOM 2367 O GLU B 61 151.145 12.018 -9.102 1.00 0.00 O ATOM 2368 CB GLU B 61 150.457 10.541 -11.954 1.00 0.00 C ATOM 2369 CG GLU B 61 150.240 12.041 -12.162 1.00 0.00 C ATOM 2370 CD GLU B 61 149.423 12.269 -13.435 1.00 0.00 C ATOM 2371 OE1 GLU B 61 149.169 11.301 -14.132 1.00 0.00 O ATOM 2372 OE2 GLU B 61 149.071 13.408 -13.693 1.00 0.00 O ATOM 0 H GLU B 61 151.068 8.251 -11.185 1.00 0.00 H new ATOM 0 HA GLU B 61 152.358 10.799 -10.980 1.00 0.00 H new ATOM 0 HB2 GLU B 61 150.876 10.095 -12.856 1.00 0.00 H new ATOM 0 HB3 GLU B 61 149.503 10.048 -11.768 1.00 0.00 H new ATOM 0 HG2 GLU B 61 149.721 12.466 -11.303 1.00 0.00 H new ATOM 0 HG3 GLU B 61 151.200 12.551 -12.238 1.00 0.00 H new ATOM 2379 N TRP B 62 149.906 10.225 -8.869 1.00 0.00 N ATOM 2380 CA TRP B 62 149.285 10.768 -7.628 1.00 0.00 C ATOM 2381 C TRP B 62 150.326 10.932 -6.514 1.00 0.00 C ATOM 2382 O TRP B 62 150.396 11.955 -5.871 1.00 0.00 O ATOM 2383 CB TRP B 62 148.176 9.819 -7.147 1.00 0.00 C ATOM 2384 CG TRP B 62 147.747 10.200 -5.758 1.00 0.00 C ATOM 2385 CD1 TRP B 62 146.815 11.131 -5.454 1.00 0.00 C ATOM 2386 CD2 TRP B 62 148.242 9.686 -4.487 1.00 0.00 C ATOM 2387 NE1 TRP B 62 146.702 11.217 -4.075 1.00 0.00 N ATOM 2388 CE2 TRP B 62 147.562 10.342 -3.435 1.00 0.00 C ATOM 2389 CE3 TRP B 62 149.205 8.716 -4.150 1.00 0.00 C ATOM 2390 CZ2 TRP B 62 147.829 10.049 -2.095 1.00 0.00 C ATOM 2391 CZ3 TRP B 62 149.475 8.418 -2.805 1.00 0.00 C ATOM 2392 CH2 TRP B 62 148.788 9.083 -1.781 1.00 0.00 C ATOM 0 H TRP B 62 149.577 9.302 -9.153 1.00 0.00 H new ATOM 0 HA TRP B 62 148.866 11.747 -7.859 1.00 0.00 H new ATOM 0 HB2 TRP B 62 147.325 9.866 -7.826 1.00 0.00 H new ATOM 0 HB3 TRP B 62 148.536 8.790 -7.157 1.00 0.00 H new ATOM 0 HD1 TRP B 62 146.251 11.712 -6.168 1.00 0.00 H new ATOM 0 HE1 TRP B 62 146.063 11.848 -3.591 1.00 0.00 H new ATOM 0 HE3 TRP B 62 149.740 8.197 -4.932 1.00 0.00 H new ATOM 0 HZ2 TRP B 62 147.298 10.565 -1.309 1.00 0.00 H new ATOM 0 HZ3 TRP B 62 150.216 7.672 -2.558 1.00 0.00 H new ATOM 0 HH2 TRP B 62 149.000 8.849 -0.748 1.00 0.00 H new ATOM 2403 N LEU B 63 151.124 9.935 -6.272 1.00 0.00 N ATOM 2404 CA LEU B 63 152.133 10.046 -5.181 1.00 0.00 C ATOM 2405 C LEU B 63 153.191 11.094 -5.529 1.00 0.00 C ATOM 2406 O LEU B 63 153.547 11.923 -4.715 1.00 0.00 O ATOM 2407 CB LEU B 63 152.799 8.679 -4.974 1.00 0.00 C ATOM 2408 CG LEU B 63 153.865 8.758 -3.872 1.00 0.00 C ATOM 2409 CD1 LEU B 63 153.237 9.220 -2.547 1.00 0.00 C ATOM 2410 CD2 LEU B 63 154.484 7.368 -3.687 1.00 0.00 C ATOM 0 H LEU B 63 151.124 9.050 -6.779 1.00 0.00 H new ATOM 0 HA LEU B 63 151.634 10.357 -4.263 1.00 0.00 H new ATOM 0 HB2 LEU B 63 152.046 7.938 -4.706 1.00 0.00 H new ATOM 0 HB3 LEU B 63 153.256 8.346 -5.906 1.00 0.00 H new ATOM 0 HG LEU B 63 154.630 9.478 -4.162 1.00 0.00 H new ATOM 0 HD11 LEU B 63 154.007 9.270 -1.777 1.00 0.00 H new ATOM 0 HD12 LEU B 63 152.792 10.206 -2.680 1.00 0.00 H new ATOM 0 HD13 LEU B 63 152.466 8.512 -2.243 1.00 0.00 H new ATOM 0 HD21 LEU B 63 155.244 7.409 -2.906 1.00 0.00 H new ATOM 0 HD22 LEU B 63 153.707 6.659 -3.400 1.00 0.00 H new ATOM 0 HD23 LEU B 63 154.942 7.046 -4.622 1.00 0.00 H new ATOM 2422 N LYS B 64 153.702 11.063 -6.723 1.00 0.00 N ATOM 2423 CA LYS B 64 154.741 12.054 -7.116 1.00 0.00 C ATOM 2424 C LYS B 64 154.175 13.473 -7.029 1.00 0.00 C ATOM 2425 O LYS B 64 154.794 14.368 -6.488 1.00 0.00 O ATOM 2426 CB LYS B 64 155.214 11.767 -8.542 1.00 0.00 C ATOM 2427 CG LYS B 64 156.327 12.747 -8.919 1.00 0.00 C ATOM 2428 CD LYS B 64 156.834 12.428 -10.324 1.00 0.00 C ATOM 2429 CE LYS B 64 157.894 13.453 -10.727 1.00 0.00 C ATOM 2430 NZ LYS B 64 157.241 14.771 -10.963 1.00 0.00 N ATOM 0 H LYS B 64 153.446 10.393 -7.448 1.00 0.00 H new ATOM 0 HA LYS B 64 155.587 11.971 -6.434 1.00 0.00 H new ATOM 0 HB2 LYS B 64 155.577 10.742 -8.616 1.00 0.00 H new ATOM 0 HB3 LYS B 64 154.381 11.861 -9.238 1.00 0.00 H new ATOM 0 HG2 LYS B 64 155.954 13.770 -8.879 1.00 0.00 H new ATOM 0 HG3 LYS B 64 157.145 12.678 -8.202 1.00 0.00 H new ATOM 0 HD2 LYS B 64 157.255 11.423 -10.351 1.00 0.00 H new ATOM 0 HD3 LYS B 64 156.007 12.446 -11.034 1.00 0.00 H new ATOM 0 HE2 LYS B 64 158.646 13.542 -9.943 1.00 0.00 H new ATOM 0 HE3 LYS B 64 158.410 13.124 -11.629 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 157.877 15.379 -11.518 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 156.353 14.630 -11.486 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 157.037 15.226 -10.050 1.00 0.00 H new ATOM 2444 N ASP B 65 153.003 13.684 -7.560 1.00 0.00 N ATOM 2445 CA ASP B 65 152.394 15.044 -7.514 1.00 0.00 C ATOM 2446 C ASP B 65 152.001 15.383 -6.078 1.00 0.00 C ATOM 2447 O ASP B 65 151.939 16.534 -5.694 1.00 0.00 O ATOM 2448 CB ASP B 65 151.148 15.080 -8.401 1.00 0.00 C ATOM 2449 CG ASP B 65 151.563 14.995 -9.870 1.00 0.00 C ATOM 2450 OD1 ASP B 65 152.602 15.539 -10.205 1.00 0.00 O ATOM 2451 OD2 ASP B 65 150.836 14.385 -10.635 1.00 0.00 O ATOM 0 H ASP B 65 152.439 12.972 -8.025 1.00 0.00 H new ATOM 0 HA ASP B 65 153.119 15.773 -7.875 1.00 0.00 H new ATOM 0 HB2 ASP B 65 150.487 14.250 -8.151 1.00 0.00 H new ATOM 0 HB3 ASP B 65 150.589 15.998 -8.223 1.00 0.00 H new ATOM 2456 N THR B 66 151.705 14.388 -5.289 1.00 0.00 N ATOM 2457 CA THR B 66 151.281 14.645 -3.886 1.00 0.00 C ATOM 2458 C THR B 66 152.483 15.014 -3.015 1.00 0.00 C ATOM 2459 O THR B 66 152.355 15.827 -2.120 1.00 0.00 O ATOM 2460 CB THR B 66 150.589 13.385 -3.332 1.00 0.00 C ATOM 2461 OG1 THR B 66 149.450 13.098 -4.127 1.00 0.00 O ATOM 2462 CG2 THR B 66 150.131 13.595 -1.883 1.00 0.00 C ATOM 0 H THR B 66 151.739 13.405 -5.557 1.00 0.00 H new ATOM 0 HA THR B 66 150.585 15.484 -3.871 1.00 0.00 H new ATOM 0 HB THR B 66 151.303 12.562 -3.359 1.00 0.00 H new ATOM 0 HG1 THR B 66 149.658 12.365 -4.743 1.00 0.00 H new ATOM 0 HG21 THR B 66 149.646 12.689 -1.520 1.00 0.00 H new ATOM 0 HG22 THR B 66 150.995 13.820 -1.257 1.00 0.00 H new ATOM 0 HG23 THR B 66 149.426 14.425 -1.841 1.00 0.00 H new ATOM 2470 N CYS B 67 153.638 14.413 -3.215 1.00 0.00 N ATOM 2471 CA CYS B 67 154.812 14.732 -2.335 1.00 0.00 C ATOM 2472 C CYS B 67 156.080 15.026 -3.140 1.00 0.00 C ATOM 2473 O CYS B 67 156.947 15.751 -2.693 1.00 0.00 O ATOM 2474 CB CYS B 67 155.076 13.530 -1.427 1.00 0.00 C ATOM 2475 SG CYS B 67 155.328 12.053 -2.444 1.00 0.00 S ATOM 0 H CYS B 67 153.816 13.722 -3.943 1.00 0.00 H new ATOM 0 HA CYS B 67 154.569 15.626 -1.760 1.00 0.00 H new ATOM 0 HB2 CYS B 67 155.954 13.713 -0.808 1.00 0.00 H new ATOM 0 HB3 CYS B 67 154.235 13.380 -0.750 1.00 0.00 H new ATOM 0 HG CYS B 67 154.293 11.871 -3.209 1.00 0.00 H new ATOM 2481 N GLY B 68 156.214 14.452 -4.312 1.00 0.00 N ATOM 2482 CA GLY B 68 157.445 14.677 -5.138 1.00 0.00 C ATOM 2483 C GLY B 68 158.292 13.403 -5.106 1.00 0.00 C ATOM 2484 O GLY B 68 159.462 13.413 -5.433 1.00 0.00 O ATOM 0 H GLY B 68 155.521 13.834 -4.735 1.00 0.00 H new ATOM 0 HA2 GLY B 68 157.172 14.925 -6.164 1.00 0.00 H new ATOM 0 HA3 GLY B 68 158.014 15.520 -4.747 1.00 0.00 H new ATOM 2488 N ALA B 69 157.707 12.302 -4.711 1.00 0.00 N ATOM 2489 CA ALA B 69 158.467 11.018 -4.651 1.00 0.00 C ATOM 2490 C ALA B 69 159.170 10.762 -5.984 1.00 0.00 C ATOM 2491 O ALA B 69 158.726 11.199 -7.027 1.00 0.00 O ATOM 2492 CB ALA B 69 157.495 9.871 -4.368 1.00 0.00 C ATOM 0 H ALA B 69 156.730 12.237 -4.426 1.00 0.00 H new ATOM 0 HA ALA B 69 159.213 11.080 -3.859 1.00 0.00 H new ATOM 0 HB1 ALA B 69 158.045 8.931 -4.323 1.00 0.00 H new ATOM 0 HB2 ALA B 69 156.995 10.045 -3.415 1.00 0.00 H new ATOM 0 HB3 ALA B 69 156.752 9.819 -5.164 1.00 0.00 H new ATOM 2498 N ASN B 70 160.271 10.056 -5.958 1.00 0.00 N ATOM 2499 CA ASN B 70 161.015 9.770 -7.220 1.00 0.00 C ATOM 2500 C ASN B 70 160.523 8.451 -7.820 1.00 0.00 C ATOM 2501 O ASN B 70 159.779 7.714 -7.206 1.00 0.00 O ATOM 2502 CB ASN B 70 162.509 9.657 -6.908 1.00 0.00 C ATOM 2503 CG ASN B 70 163.294 9.475 -8.208 1.00 0.00 C ATOM 2504 OD1 ASN B 70 164.084 8.562 -8.330 1.00 0.00 O ATOM 2505 ND2 ASN B 70 163.108 10.314 -9.191 1.00 0.00 N ATOM 0 H ASN B 70 160.688 9.664 -5.114 1.00 0.00 H new ATOM 0 HA ASN B 70 160.846 10.577 -7.933 1.00 0.00 H new ATOM 0 HB2 ASN B 70 162.851 10.552 -6.388 1.00 0.00 H new ATOM 0 HB3 ASN B 70 162.689 8.813 -6.242 1.00 0.00 H new ATOM 0 HD21 ASN B 70 163.627 10.202 -10.062 1.00 0.00 H new ATOM 0 HD22 ASN B 70 162.444 11.081 -9.088 1.00 0.00 H new ATOM 2512 N ALA B 71 160.930 8.159 -9.023 1.00 0.00 N ATOM 2513 CA ALA B 71 160.488 6.900 -9.686 1.00 0.00 C ATOM 2514 C ALA B 71 160.921 5.676 -8.873 1.00 0.00 C ATOM 2515 O ALA B 71 160.238 4.675 -8.850 1.00 0.00 O ATOM 2516 CB ALA B 71 161.108 6.819 -11.083 1.00 0.00 C ATOM 0 H ALA B 71 161.554 8.742 -9.580 1.00 0.00 H new ATOM 0 HA ALA B 71 159.400 6.908 -9.756 1.00 0.00 H new ATOM 0 HB1 ALA B 71 160.787 5.899 -11.571 1.00 0.00 H new ATOM 0 HB2 ALA B 71 160.785 7.675 -11.675 1.00 0.00 H new ATOM 0 HB3 ALA B 71 162.195 6.825 -11.000 1.00 0.00 H new ATOM 2522 N LYS B 72 162.054 5.725 -8.227 1.00 0.00 N ATOM 2523 CA LYS B 72 162.510 4.531 -7.455 1.00 0.00 C ATOM 2524 C LYS B 72 161.646 4.335 -6.207 1.00 0.00 C ATOM 2525 O LYS B 72 161.268 3.229 -5.864 1.00 0.00 O ATOM 2526 CB LYS B 72 163.968 4.734 -7.030 1.00 0.00 C ATOM 2527 CG LYS B 72 164.879 4.815 -8.266 1.00 0.00 C ATOM 2528 CD LYS B 72 165.173 3.412 -8.813 1.00 0.00 C ATOM 2529 CE LYS B 72 166.269 3.504 -9.875 1.00 0.00 C ATOM 2530 NZ LYS B 72 166.661 2.130 -10.301 1.00 0.00 N ATOM 0 H LYS B 72 162.679 6.531 -8.199 1.00 0.00 H new ATOM 0 HA LYS B 72 162.420 3.648 -8.087 1.00 0.00 H new ATOM 0 HB2 LYS B 72 164.059 5.648 -6.443 1.00 0.00 H new ATOM 0 HB3 LYS B 72 164.285 3.911 -6.390 1.00 0.00 H new ATOM 0 HG2 LYS B 72 164.402 5.419 -9.037 1.00 0.00 H new ATOM 0 HG3 LYS B 72 165.813 5.312 -8.004 1.00 0.00 H new ATOM 0 HD2 LYS B 72 165.488 2.753 -8.004 1.00 0.00 H new ATOM 0 HD3 LYS B 72 164.269 2.980 -9.243 1.00 0.00 H new ATOM 0 HE2 LYS B 72 165.913 4.075 -10.733 1.00 0.00 H new ATOM 0 HE3 LYS B 72 167.134 4.034 -9.476 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 167.407 2.190 -11.024 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 167.017 1.600 -9.480 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 165.834 1.640 -10.697 1.00 0.00 H new ATOM 2544 N GLN B 73 161.350 5.396 -5.509 1.00 0.00 N ATOM 2545 CA GLN B 73 160.542 5.272 -4.267 1.00 0.00 C ATOM 2546 C GLN B 73 159.117 4.838 -4.602 1.00 0.00 C ATOM 2547 O GLN B 73 158.472 4.152 -3.834 1.00 0.00 O ATOM 2548 CB GLN B 73 160.519 6.617 -3.535 1.00 0.00 C ATOM 2549 CG GLN B 73 161.928 6.956 -3.028 1.00 0.00 C ATOM 2550 CD GLN B 73 162.361 5.942 -1.965 1.00 0.00 C ATOM 2551 OE1 GLN B 73 163.535 5.656 -1.825 1.00 0.00 O ATOM 2552 NE2 GLN B 73 161.461 5.386 -1.202 1.00 0.00 N ATOM 0 H GLN B 73 161.635 6.346 -5.747 1.00 0.00 H new ATOM 0 HA GLN B 73 160.994 4.517 -3.624 1.00 0.00 H new ATOM 0 HB2 GLN B 73 160.165 7.400 -4.205 1.00 0.00 H new ATOM 0 HB3 GLN B 73 159.822 6.574 -2.698 1.00 0.00 H new ATOM 0 HG2 GLN B 73 162.634 6.948 -3.859 1.00 0.00 H new ATOM 0 HG3 GLN B 73 161.940 7.962 -2.609 1.00 0.00 H new ATOM 0 HE21 GLN B 73 160.476 5.625 -1.318 1.00 0.00 H new ATOM 0 HE22 GLN B 73 161.742 4.713 -0.489 1.00 0.00 H new ATOM 2561 N SER B 74 158.613 5.231 -5.739 1.00 0.00 N ATOM 2562 CA SER B 74 157.229 4.837 -6.109 1.00 0.00 C ATOM 2563 C SER B 74 157.173 3.333 -6.379 1.00 0.00 C ATOM 2564 O SER B 74 156.210 2.672 -6.047 1.00 0.00 O ATOM 2565 CB SER B 74 156.805 5.592 -7.368 1.00 0.00 C ATOM 2566 OG SER B 74 157.392 4.972 -8.504 1.00 0.00 O ATOM 0 H SER B 74 159.100 5.807 -6.425 1.00 0.00 H new ATOM 0 HA SER B 74 156.555 5.082 -5.288 1.00 0.00 H new ATOM 0 HB2 SER B 74 155.719 5.591 -7.459 1.00 0.00 H new ATOM 0 HB3 SER B 74 157.119 6.634 -7.305 1.00 0.00 H new ATOM 0 HG SER B 74 158.368 4.981 -8.414 1.00 0.00 H new ATOM 2572 N ARG B 75 158.196 2.781 -6.984 1.00 0.00 N ATOM 2573 CA ARG B 75 158.196 1.321 -7.279 1.00 0.00 C ATOM 2574 C ARG B 75 158.096 0.520 -5.985 1.00 0.00 C ATOM 2575 O ARG B 75 157.442 -0.503 -5.938 1.00 0.00 O ATOM 2576 CB ARG B 75 159.482 0.947 -8.017 1.00 0.00 C ATOM 2577 CG ARG B 75 159.441 1.535 -9.428 1.00 0.00 C ATOM 2578 CD ARG B 75 160.752 1.224 -10.151 1.00 0.00 C ATOM 2579 NE ARG B 75 160.937 -0.251 -10.236 1.00 0.00 N ATOM 2580 CZ ARG B 75 161.811 -0.749 -11.066 1.00 0.00 C ATOM 2581 NH1 ARG B 75 162.516 0.046 -11.823 1.00 0.00 N ATOM 2582 NH2 ARG B 75 161.979 -2.040 -11.140 1.00 0.00 N ATOM 0 H ARG B 75 159.031 3.283 -7.286 1.00 0.00 H new ATOM 0 HA ARG B 75 157.335 1.087 -7.905 1.00 0.00 H new ATOM 0 HB2 ARG B 75 160.349 1.327 -7.477 1.00 0.00 H new ATOM 0 HB3 ARG B 75 159.586 -0.137 -8.065 1.00 0.00 H new ATOM 0 HG2 ARG B 75 158.600 1.118 -9.982 1.00 0.00 H new ATOM 0 HG3 ARG B 75 159.288 2.613 -9.379 1.00 0.00 H new ATOM 0 HD2 ARG B 75 160.739 1.657 -11.151 1.00 0.00 H new ATOM 0 HD3 ARG B 75 161.589 1.676 -9.618 1.00 0.00 H new ATOM 0 HE ARG B 75 160.381 -0.871 -9.646 1.00 0.00 H new ATOM 0 HH11 ARG B 75 162.383 1.056 -11.765 1.00 0.00 H new ATOM 0 HH12 ARG B 75 163.200 -0.342 -12.473 1.00 0.00 H new ATOM 0 HH21 ARG B 75 161.427 -2.661 -10.549 1.00 0.00 H new ATOM 0 HH22 ARG B 75 162.663 -2.429 -11.789 1.00 0.00 H new ATOM 2596 N ASP B 76 158.750 0.939 -4.939 1.00 0.00 N ATOM 2597 CA ASP B 76 158.704 0.163 -3.671 1.00 0.00 C ATOM 2598 C ASP B 76 157.302 0.206 -3.062 1.00 0.00 C ATOM 2599 O ASP B 76 156.816 -0.784 -2.550 1.00 0.00 O ATOM 2600 CB ASP B 76 159.706 0.762 -2.683 1.00 0.00 C ATOM 2601 CG ASP B 76 161.130 0.472 -3.161 1.00 0.00 C ATOM 2602 OD1 ASP B 76 161.308 -0.497 -3.881 1.00 0.00 O ATOM 2603 OD2 ASP B 76 162.020 1.224 -2.799 1.00 0.00 O ATOM 0 H ASP B 76 159.315 1.787 -4.908 1.00 0.00 H new ATOM 0 HA ASP B 76 158.959 -0.876 -3.882 1.00 0.00 H new ATOM 0 HB2 ASP B 76 159.551 1.838 -2.599 1.00 0.00 H new ATOM 0 HB3 ASP B 76 159.551 0.339 -1.690 1.00 0.00 H new ATOM 2608 N CYS B 77 156.641 1.330 -3.106 1.00 0.00 N ATOM 2609 CA CYS B 77 155.273 1.402 -2.520 1.00 0.00 C ATOM 2610 C CYS B 77 154.283 0.599 -3.368 1.00 0.00 C ATOM 2611 O CYS B 77 153.402 -0.054 -2.843 1.00 0.00 O ATOM 2612 CB CYS B 77 154.820 2.861 -2.476 1.00 0.00 C ATOM 2613 SG CYS B 77 155.782 3.757 -1.231 1.00 0.00 S ATOM 0 H CYS B 77 156.986 2.196 -3.519 1.00 0.00 H new ATOM 0 HA CYS B 77 155.300 0.984 -1.514 1.00 0.00 H new ATOM 0 HB2 CYS B 77 154.952 3.323 -3.454 1.00 0.00 H new ATOM 0 HB3 CYS B 77 153.758 2.916 -2.238 1.00 0.00 H new ATOM 0 HG CYS B 77 156.290 2.912 -0.384 1.00 0.00 H new ATOM 2619 N PHE B 78 154.387 0.653 -4.669 1.00 0.00 N ATOM 2620 CA PHE B 78 153.410 -0.099 -5.505 1.00 0.00 C ATOM 2621 C PHE B 78 153.491 -1.593 -5.196 1.00 0.00 C ATOM 2622 O PHE B 78 152.526 -2.205 -4.784 1.00 0.00 O ATOM 2623 CB PHE B 78 153.713 0.144 -6.985 1.00 0.00 C ATOM 2624 CG PHE B 78 152.725 -0.618 -7.836 1.00 0.00 C ATOM 2625 CD1 PHE B 78 151.520 -0.020 -8.223 1.00 0.00 C ATOM 2626 CD2 PHE B 78 153.022 -1.921 -8.247 1.00 0.00 C ATOM 2627 CE1 PHE B 78 150.611 -0.728 -9.019 1.00 0.00 C ATOM 2628 CE2 PHE B 78 152.113 -2.629 -9.044 1.00 0.00 C ATOM 2629 CZ PHE B 78 150.907 -2.033 -9.429 1.00 0.00 C ATOM 0 H PHE B 78 155.096 1.177 -5.182 1.00 0.00 H new ATOM 0 HA PHE B 78 152.403 0.250 -5.279 1.00 0.00 H new ATOM 0 HB2 PHE B 78 153.655 1.209 -7.208 1.00 0.00 H new ATOM 0 HB3 PHE B 78 154.729 -0.175 -7.216 1.00 0.00 H new ATOM 0 HD1 PHE B 78 151.291 0.987 -7.908 1.00 0.00 H new ATOM 0 HD2 PHE B 78 153.952 -2.382 -7.950 1.00 0.00 H new ATOM 0 HE1 PHE B 78 149.681 -0.267 -9.317 1.00 0.00 H new ATOM 0 HE2 PHE B 78 152.343 -3.635 -9.361 1.00 0.00 H new ATOM 0 HZ PHE B 78 150.205 -2.579 -10.042 1.00 0.00 H new ATOM 2639 N GLY B 79 154.632 -2.187 -5.399 1.00 0.00 N ATOM 2640 CA GLY B 79 154.776 -3.643 -5.128 1.00 0.00 C ATOM 2641 C GLY B 79 154.518 -3.942 -3.649 1.00 0.00 C ATOM 2642 O GLY B 79 153.999 -4.981 -3.299 1.00 0.00 O ATOM 0 H GLY B 79 155.474 -1.725 -5.742 1.00 0.00 H new ATOM 0 HA2 GLY B 79 154.076 -4.205 -5.746 1.00 0.00 H new ATOM 0 HA3 GLY B 79 155.778 -3.972 -5.402 1.00 0.00 H new ATOM 2646 N CYS B 80 154.864 -3.042 -2.774 1.00 0.00 N ATOM 2647 CA CYS B 80 154.623 -3.305 -1.328 1.00 0.00 C ATOM 2648 C CYS B 80 153.119 -3.326 -1.061 1.00 0.00 C ATOM 2649 O CYS B 80 152.604 -4.215 -0.411 1.00 0.00 O ATOM 2650 CB CYS B 80 155.274 -2.207 -0.489 1.00 0.00 C ATOM 2651 SG CYS B 80 155.028 -2.566 1.268 1.00 0.00 S ATOM 0 H CYS B 80 155.298 -2.145 -2.992 1.00 0.00 H new ATOM 0 HA CYS B 80 155.056 -4.268 -1.058 1.00 0.00 H new ATOM 0 HB2 CYS B 80 156.339 -2.146 -0.713 1.00 0.00 H new ATOM 0 HB3 CYS B 80 154.840 -1.239 -0.738 1.00 0.00 H new ATOM 0 HG CYS B 80 154.766 -1.463 1.904 1.00 0.00 H new ATOM 2657 N LEU B 81 152.407 -2.364 -1.572 1.00 0.00 N ATOM 2658 CA LEU B 81 150.936 -2.360 -1.353 1.00 0.00 C ATOM 2659 C LEU B 81 150.315 -3.509 -2.156 1.00 0.00 C ATOM 2660 O LEU B 81 149.401 -4.170 -1.705 1.00 0.00 O ATOM 2661 CB LEU B 81 150.348 -1.020 -1.816 1.00 0.00 C ATOM 2662 CG LEU B 81 150.826 0.110 -0.888 1.00 0.00 C ATOM 2663 CD1 LEU B 81 150.428 1.461 -1.491 1.00 0.00 C ATOM 2664 CD2 LEU B 81 150.201 -0.041 0.516 1.00 0.00 C ATOM 0 H LEU B 81 152.773 -1.589 -2.125 1.00 0.00 H new ATOM 0 HA LEU B 81 150.717 -2.492 -0.293 1.00 0.00 H new ATOM 0 HB2 LEU B 81 150.654 -0.814 -2.842 1.00 0.00 H new ATOM 0 HB3 LEU B 81 149.259 -1.070 -1.812 1.00 0.00 H new ATOM 0 HG LEU B 81 151.910 0.055 -0.791 1.00 0.00 H new ATOM 0 HD11 LEU B 81 150.765 2.265 -0.837 1.00 0.00 H new ATOM 0 HD12 LEU B 81 150.892 1.573 -2.471 1.00 0.00 H new ATOM 0 HD13 LEU B 81 149.344 1.508 -1.595 1.00 0.00 H new ATOM 0 HD21 LEU B 81 150.551 0.767 1.159 1.00 0.00 H new ATOM 0 HD22 LEU B 81 149.115 0.002 0.437 1.00 0.00 H new ATOM 0 HD23 LEU B 81 150.496 -0.999 0.945 1.00 0.00 H new ATOM 2676 N ARG B 82 150.801 -3.749 -3.349 1.00 0.00 N ATOM 2677 CA ARG B 82 150.239 -4.851 -4.187 1.00 0.00 C ATOM 2678 C ARG B 82 150.390 -6.200 -3.472 1.00 0.00 C ATOM 2679 O ARG B 82 149.488 -7.015 -3.472 1.00 0.00 O ATOM 2680 CB ARG B 82 150.998 -4.919 -5.519 1.00 0.00 C ATOM 2681 CG ARG B 82 150.263 -5.861 -6.498 1.00 0.00 C ATOM 2682 CD ARG B 82 151.256 -6.469 -7.500 1.00 0.00 C ATOM 2683 NE ARG B 82 152.316 -5.477 -7.831 1.00 0.00 N ATOM 2684 CZ ARG B 82 153.420 -5.876 -8.406 1.00 0.00 C ATOM 2685 NH1 ARG B 82 153.598 -7.143 -8.665 1.00 0.00 N ATOM 2686 NH2 ARG B 82 154.346 -5.012 -8.718 1.00 0.00 N ATOM 0 H ARG B 82 151.565 -3.227 -3.779 1.00 0.00 H new ATOM 0 HA ARG B 82 149.182 -4.648 -4.360 1.00 0.00 H new ATOM 0 HB2 ARG B 82 151.079 -3.922 -5.952 1.00 0.00 H new ATOM 0 HB3 ARG B 82 152.014 -5.277 -5.350 1.00 0.00 H new ATOM 0 HG2 ARG B 82 149.764 -6.655 -5.943 1.00 0.00 H new ATOM 0 HG3 ARG B 82 149.489 -5.310 -7.032 1.00 0.00 H new ATOM 0 HD2 ARG B 82 151.706 -7.368 -7.079 1.00 0.00 H new ATOM 0 HD3 ARG B 82 150.732 -6.770 -8.407 1.00 0.00 H new ATOM 0 HE ARG B 82 152.181 -4.490 -7.610 1.00 0.00 H new ATOM 0 HH11 ARG B 82 152.876 -7.820 -8.419 1.00 0.00 H new ATOM 0 HH12 ARG B 82 154.459 -7.456 -9.114 1.00 0.00 H new ATOM 0 HH21 ARG B 82 154.210 -4.022 -8.513 1.00 0.00 H new ATOM 0 HH22 ARG B 82 155.206 -5.326 -9.167 1.00 0.00 H new ATOM 2700 N GLU B 83 151.526 -6.450 -2.876 1.00 0.00 N ATOM 2701 CA GLU B 83 151.733 -7.755 -2.180 1.00 0.00 C ATOM 2702 C GLU B 83 150.893 -7.824 -0.899 1.00 0.00 C ATOM 2703 O GLU B 83 150.357 -8.865 -0.571 1.00 0.00 O ATOM 2704 CB GLU B 83 153.228 -7.951 -1.846 1.00 0.00 C ATOM 2705 CG GLU B 83 153.988 -8.523 -3.059 1.00 0.00 C ATOM 2706 CD GLU B 83 154.174 -7.441 -4.123 1.00 0.00 C ATOM 2707 OE1 GLU B 83 153.273 -7.263 -4.925 1.00 0.00 O ATOM 2708 OE2 GLU B 83 155.219 -6.811 -4.118 1.00 0.00 O ATOM 0 H GLU B 83 152.318 -5.809 -2.841 1.00 0.00 H new ATOM 0 HA GLU B 83 151.412 -8.555 -2.847 1.00 0.00 H new ATOM 0 HB2 GLU B 83 153.668 -6.998 -1.552 1.00 0.00 H new ATOM 0 HB3 GLU B 83 153.330 -8.625 -0.996 1.00 0.00 H new ATOM 0 HG2 GLU B 83 154.959 -8.903 -2.743 1.00 0.00 H new ATOM 0 HG3 GLU B 83 153.437 -9.365 -3.478 1.00 0.00 H new ATOM 2715 N TRP B 84 150.743 -6.745 -0.173 1.00 0.00 N ATOM 2716 CA TRP B 84 149.910 -6.801 1.062 1.00 0.00 C ATOM 2717 C TRP B 84 148.487 -7.209 0.665 1.00 0.00 C ATOM 2718 O TRP B 84 147.865 -8.045 1.291 1.00 0.00 O ATOM 2719 CB TRP B 84 149.893 -5.428 1.738 1.00 0.00 C ATOM 2720 CG TRP B 84 149.228 -5.537 3.072 1.00 0.00 C ATOM 2721 CD1 TRP B 84 149.872 -5.727 4.247 1.00 0.00 C ATOM 2722 CD2 TRP B 84 147.807 -5.475 3.389 1.00 0.00 C ATOM 2723 NE1 TRP B 84 148.938 -5.779 5.266 1.00 0.00 N ATOM 2724 CE2 TRP B 84 147.651 -5.631 4.787 1.00 0.00 C ATOM 2725 CE3 TRP B 84 146.651 -5.299 2.609 1.00 0.00 C ATOM 2726 CZ2 TRP B 84 146.393 -5.614 5.389 1.00 0.00 C ATOM 2727 CZ3 TRP B 84 145.383 -5.282 3.212 1.00 0.00 C ATOM 2728 CH2 TRP B 84 145.254 -5.439 4.600 1.00 0.00 C ATOM 0 H TRP B 84 151.158 -5.837 -0.381 1.00 0.00 H new ATOM 0 HA TRP B 84 150.323 -7.526 1.763 1.00 0.00 H new ATOM 0 HB2 TRP B 84 150.911 -5.057 1.857 1.00 0.00 H new ATOM 0 HB3 TRP B 84 149.362 -4.710 1.113 1.00 0.00 H new ATOM 0 HD1 TRP B 84 150.941 -5.822 4.369 1.00 0.00 H new ATOM 0 HE1 TRP B 84 149.171 -5.910 6.250 1.00 0.00 H new ATOM 0 HE3 TRP B 84 146.739 -5.176 1.540 1.00 0.00 H new ATOM 0 HZ2 TRP B 84 146.300 -5.735 6.458 1.00 0.00 H new ATOM 0 HZ3 TRP B 84 144.501 -5.147 2.603 1.00 0.00 H new ATOM 0 HH2 TRP B 84 144.276 -5.425 5.058 1.00 0.00 H new ATOM 2739 N CYS B 85 147.975 -6.615 -0.381 1.00 0.00 N ATOM 2740 CA CYS B 85 146.596 -6.958 -0.838 1.00 0.00 C ATOM 2741 C CYS B 85 146.547 -8.436 -1.232 1.00 0.00 C ATOM 2742 O CYS B 85 145.591 -9.135 -0.956 1.00 0.00 O ATOM 2743 CB CYS B 85 146.227 -6.094 -2.045 1.00 0.00 C ATOM 2744 SG CYS B 85 145.909 -4.398 -1.498 1.00 0.00 S ATOM 0 H CYS B 85 148.452 -5.907 -0.939 1.00 0.00 H new ATOM 0 HA CYS B 85 145.887 -6.772 -0.031 1.00 0.00 H new ATOM 0 HB2 CYS B 85 147.036 -6.106 -2.775 1.00 0.00 H new ATOM 0 HB3 CYS B 85 145.344 -6.499 -2.540 1.00 0.00 H new ATOM 0 HG CYS B 85 145.598 -3.662 -2.524 1.00 0.00 H new ATOM 2750 N ASP B 86 147.575 -8.913 -1.876 1.00 0.00 N ATOM 2751 CA ASP B 86 147.607 -10.341 -2.296 1.00 0.00 C ATOM 2752 C ASP B 86 147.505 -11.249 -1.068 1.00 0.00 C ATOM 2753 O ASP B 86 146.950 -12.328 -1.127 1.00 0.00 O ATOM 2754 CB ASP B 86 148.918 -10.629 -3.033 1.00 0.00 C ATOM 2755 CG ASP B 86 148.906 -9.929 -4.393 1.00 0.00 C ATOM 2756 OD1 ASP B 86 147.828 -9.746 -4.934 1.00 0.00 O ATOM 2757 OD2 ASP B 86 149.976 -9.590 -4.872 1.00 0.00 O ATOM 0 H ASP B 86 148.400 -8.371 -2.131 1.00 0.00 H new ATOM 0 HA ASP B 86 146.764 -10.536 -2.958 1.00 0.00 H new ATOM 0 HB2 ASP B 86 149.764 -10.281 -2.441 1.00 0.00 H new ATOM 0 HB3 ASP B 86 149.043 -11.703 -3.167 1.00 0.00 H new ATOM 2762 N ALA B 87 148.061 -10.834 0.040 1.00 0.00 N ATOM 2763 CA ALA B 87 148.020 -11.693 1.262 1.00 0.00 C ATOM 2764 C ALA B 87 146.714 -11.471 2.032 1.00 0.00 C ATOM 2765 O ALA B 87 146.147 -12.400 2.572 1.00 0.00 O ATOM 2766 CB ALA B 87 149.208 -11.344 2.165 1.00 0.00 C ATOM 0 H ALA B 87 148.540 -9.941 0.152 1.00 0.00 H new ATOM 0 HA ALA B 87 148.075 -12.739 0.960 1.00 0.00 H new ATOM 0 HB1 ALA B 87 149.182 -11.968 3.058 1.00 0.00 H new ATOM 0 HB2 ALA B 87 150.139 -11.520 1.626 1.00 0.00 H new ATOM 0 HB3 ALA B 87 149.149 -10.295 2.454 1.00 0.00 H new ATOM 2772 N PHE B 88 146.244 -10.250 2.114 1.00 0.00 N ATOM 2773 CA PHE B 88 144.986 -9.980 2.883 1.00 0.00 C ATOM 2774 C PHE B 88 143.806 -9.778 1.931 1.00 0.00 C ATOM 2775 O PHE B 88 143.052 -10.692 1.665 1.00 0.00 O ATOM 2776 CB PHE B 88 145.172 -8.712 3.720 1.00 0.00 C ATOM 2777 CG PHE B 88 146.208 -8.960 4.790 1.00 0.00 C ATOM 2778 CD1 PHE B 88 145.843 -9.595 5.983 1.00 0.00 C ATOM 2779 CD2 PHE B 88 147.534 -8.555 4.590 1.00 0.00 C ATOM 2780 CE1 PHE B 88 146.803 -9.825 6.977 1.00 0.00 C ATOM 2781 CE2 PHE B 88 148.494 -8.784 5.584 1.00 0.00 C ATOM 2782 CZ PHE B 88 148.128 -9.419 6.777 1.00 0.00 C ATOM 0 H PHE B 88 146.674 -9.431 1.684 1.00 0.00 H new ATOM 0 HA PHE B 88 144.779 -10.834 3.527 1.00 0.00 H new ATOM 0 HB2 PHE B 88 145.484 -7.885 3.082 1.00 0.00 H new ATOM 0 HB3 PHE B 88 144.225 -8.423 4.176 1.00 0.00 H new ATOM 0 HD1 PHE B 88 144.821 -9.908 6.137 1.00 0.00 H new ATOM 0 HD2 PHE B 88 147.816 -8.066 3.669 1.00 0.00 H new ATOM 0 HE1 PHE B 88 146.521 -10.315 7.897 1.00 0.00 H new ATOM 0 HE2 PHE B 88 149.516 -8.471 5.430 1.00 0.00 H new ATOM 0 HZ PHE B 88 148.868 -9.596 7.543 1.00 0.00 H new ATOM 2792 N LEU B 89 143.633 -8.587 1.415 1.00 0.00 N ATOM 2793 CA LEU B 89 142.498 -8.320 0.480 1.00 0.00 C ATOM 2794 C LEU B 89 142.940 -8.626 -0.953 1.00 0.00 C ATOM 2795 O LEU B 89 143.637 -7.806 -1.526 1.00 0.00 O ATOM 2796 CB LEU B 89 142.091 -6.842 0.603 1.00 0.00 C ATOM 2797 CG LEU B 89 141.111 -6.451 -0.513 1.00 0.00 C ATOM 2798 CD1 LEU B 89 139.921 -7.416 -0.526 1.00 0.00 C ATOM 2799 CD2 LEU B 89 140.605 -5.027 -0.259 1.00 0.00 C ATOM 2800 OXT LEU B 89 142.571 -9.676 -1.453 1.00 0.00 O ATOM 0 H LEU B 89 144.233 -7.784 1.603 1.00 0.00 H new ATOM 0 HA LEU B 89 141.647 -8.953 0.731 1.00 0.00 H new ATOM 0 HB2 LEU B 89 141.631 -6.667 1.575 1.00 0.00 H new ATOM 0 HB3 LEU B 89 142.978 -6.211 0.552 1.00 0.00 H new ATOM 0 HG LEU B 89 141.621 -6.500 -1.475 1.00 0.00 H new ATOM 0 HD11 LEU B 89 139.231 -7.132 -1.320 1.00 0.00 H new ATOM 0 HD12 LEU B 89 140.278 -8.431 -0.701 1.00 0.00 H new ATOM 0 HD13 LEU B 89 139.407 -7.373 0.434 1.00 0.00 H new ATOM 0 HD21 LEU B 89 139.908 -4.742 -1.048 1.00 0.00 H new ATOM 0 HD22 LEU B 89 140.098 -4.988 0.705 1.00 0.00 H new ATOM 0 HD23 LEU B 89 141.449 -4.337 -0.253 1.00 0.00 H new TER 2812 LEU B 89