USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1069 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 ASN : amide:sc= 0.264 K(o=0.37,f=-2.5) USER MOD Set 1.2: A 79 LYS NZ :NH3+ 147:sc= 0.102 (180deg=0) USER MOD Set 2.1: A 23 MET CE :methyl -150:sc= -2.01 (180deg=-1.89) USER MOD Set 2.2: A 53 MET CE :methyl -156:sc= -0.546 (180deg=-1.78!) USER MOD Set 3.1: A 35 ASN : amide:sc= 1.5 K(o=2.5,f=-3.8) USER MOD Set 3.2: A 38 LYS NZ :NH3+ 159:sc= 1.02 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -126:sc= 0.253 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0709 USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 5 MET CE :methyl -177:sc= 0 (180deg=-0.0185) USER MOD Single : A 6 LYS NZ :NH3+ 153:sc=-0.00457 (180deg=-0.958) USER MOD Single : A 7 ASN : amide:sc= -0.293 X(o=-0.29,f=-0.014) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.156 X(o=-0.16,f=-0.25) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -52:sc= 0.0664 USER MOD Single : A 26 THR OG1 : rot -92:sc= 0.117 USER MOD Single : A 30 ASN : amide:sc= -0.154 K(o=-0.15,f=-1.8!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -0.197 K(o=-0.2,f=-4!) USER MOD Single : A 48 THR OG1 : rot 150:sc= 0.00218 USER MOD Single : A 56 SER OG : rot -55:sc= 0.456 USER MOD Single : A 57 THR OG1 : rot -38:sc= 0.0314 USER MOD Single : A 58 LYS NZ :NH3+ -103:sc= 0.384 (180deg=-2.12!) USER MOD Single : A 60 ASN : amide:sc= -0.3 X(o=-0.3,f=-0.51) USER MOD Single : A 61 MET CE :methyl -166:sc= -0.27 (180deg=-0.871) USER MOD Single : A 69 HIS : no HD1:sc= -0.0204 X(o=-0.02,f=-0.37) USER MOD Single : A 70 HIS : no HD1:sc= -0.181 X(o=-0.18,f=-0.014) USER MOD Single : A 72 ASN : amide:sc= -0.119 K(o=-0.12,f=-0.7) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HE2:sc= -0.677 K(o=-0.68,f=-2.7!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.036 X(o=-0.036,f=-0.036) USER MOD Single : A 89 GLN : amide:sc= -1.18 K(o=-1.2,f=-2.8!) USER MOD Single : A 95 HIS : no HD1:sc= -0.0169 X(o=-0.017,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 156:sc= 0.135 USER MOD Single : A 101 THR OG1 : rot 104:sc= 1.27 USER MOD Single : A 104 ASN : amide:sc= 0.243 K(o=0.24,f=-6.8!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot 107:sc= 1.24 USER MOD Single : A 116 THR OG1 : rot 69:sc= 1.26 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -0.198 X(o=-0.2,f=-0.031) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= 0.128 K(o=0.13,f=-4!) USER MOD Single : A 130 SER OG : rot 180:sc=0.000496 USER MOD Single : A 131 MET CE :methyl -145:sc= -0.0142 (180deg=-0.503) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 5.677 19.911 19.940 1.00 0.00 N ATOM 2 CA SER A 1 4.725 19.648 18.848 1.00 0.00 C ATOM 3 C SER A 1 5.080 18.344 18.136 1.00 0.00 C ATOM 4 O SER A 1 6.072 17.697 18.482 1.00 0.00 O ATOM 5 CB SER A 1 4.622 20.849 17.902 1.00 0.00 C ATOM 6 OG SER A 1 5.876 21.471 17.695 1.00 0.00 O ATOM 0 H1 SER A 1 5.155 20.059 20.827 1.00 0.00 H new ATOM 0 H2 SER A 1 6.317 19.098 20.046 1.00 0.00 H new ATOM 0 H3 SER A 1 6.232 20.762 19.719 1.00 0.00 H new ATOM 0 HA SER A 1 3.728 19.514 19.268 1.00 0.00 H new ATOM 0 HB2 SER A 1 4.217 20.522 16.944 1.00 0.00 H new ATOM 0 HB3 SER A 1 3.921 21.575 18.313 1.00 0.00 H new ATOM 0 HG SER A 1 5.768 22.230 17.085 1.00 0.00 H new ATOM 12 N GLN A 2 4.237 17.914 17.197 1.00 0.00 N ATOM 13 CA GLN A 2 4.389 16.684 16.431 1.00 0.00 C ATOM 14 C GLN A 2 5.008 17.043 15.075 1.00 0.00 C ATOM 15 O GLN A 2 4.607 18.042 14.481 1.00 0.00 O ATOM 16 CB GLN A 2 2.989 16.066 16.272 1.00 0.00 C ATOM 17 CG GLN A 2 2.468 15.462 17.592 1.00 0.00 C ATOM 18 CD GLN A 2 0.973 15.133 17.582 1.00 0.00 C ATOM 19 OE1 GLN A 2 0.337 14.994 16.541 1.00 0.00 O ATOM 20 NE2 GLN A 2 0.377 14.980 18.755 1.00 0.00 N ATOM 0 H GLN A 2 3.398 18.435 16.942 1.00 0.00 H new ATOM 0 HA GLN A 2 5.040 15.962 16.924 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.294 16.830 15.924 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.020 15.291 15.507 1.00 0.00 H new ATOM 0 HG2 GLN A 2 3.028 14.552 17.809 1.00 0.00 H new ATOM 0 HG3 GLN A 2 2.670 16.161 18.404 1.00 0.00 H new ATOM 0 HE21 GLN A 2 0.910 15.097 19.617 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -0.615 14.746 18.796 1.00 0.00 H new ATOM 29 N GLU A 3 5.926 16.225 14.565 1.00 0.00 N ATOM 30 CA GLU A 3 6.625 16.439 13.292 1.00 0.00 C ATOM 31 C GLU A 3 6.059 15.506 12.219 1.00 0.00 C ATOM 32 O GLU A 3 6.798 14.804 11.529 1.00 0.00 O ATOM 33 CB GLU A 3 8.146 16.294 13.471 1.00 0.00 C ATOM 34 CG GLU A 3 8.826 17.553 14.014 1.00 0.00 C ATOM 35 CD GLU A 3 8.688 18.742 13.056 1.00 0.00 C ATOM 36 OE1 GLU A 3 9.269 18.713 11.948 1.00 0.00 O ATOM 37 OE2 GLU A 3 8.020 19.724 13.463 1.00 0.00 O ATOM 0 H GLU A 3 6.215 15.368 15.037 1.00 0.00 H new ATOM 0 HA GLU A 3 6.453 17.460 12.952 1.00 0.00 H new ATOM 0 HB2 GLU A 3 8.345 15.464 14.148 1.00 0.00 H new ATOM 0 HB3 GLU A 3 8.593 16.036 12.511 1.00 0.00 H new ATOM 0 HG2 GLU A 3 8.390 17.813 14.979 1.00 0.00 H new ATOM 0 HG3 GLU A 3 9.883 17.348 14.187 1.00 0.00 H new ATOM 44 N VAL A 4 4.729 15.477 12.092 1.00 0.00 N ATOM 45 CA VAL A 4 3.990 14.745 11.075 1.00 0.00 C ATOM 46 C VAL A 4 4.498 13.297 10.864 1.00 0.00 C ATOM 47 O VAL A 4 4.489 12.754 9.762 1.00 0.00 O ATOM 48 CB VAL A 4 3.861 15.700 9.858 1.00 0.00 C ATOM 49 CG1 VAL A 4 4.938 15.625 8.764 1.00 0.00 C ATOM 50 CG2 VAL A 4 2.450 15.606 9.291 1.00 0.00 C ATOM 0 H VAL A 4 4.116 15.988 12.727 1.00 0.00 H new ATOM 0 HA VAL A 4 2.972 14.497 11.374 1.00 0.00 H new ATOM 0 HB VAL A 4 4.055 16.691 10.268 1.00 0.00 H new ATOM 0 HG11 VAL A 4 4.713 16.350 7.982 1.00 0.00 H new ATOM 0 HG12 VAL A 4 5.913 15.849 9.197 1.00 0.00 H new ATOM 0 HG13 VAL A 4 4.953 14.623 8.336 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.356 16.276 8.436 1.00 0.00 H new ATOM 0 HG22 VAL A 4 2.253 14.582 8.973 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.730 15.893 10.057 1.00 0.00 H new ATOM 60 N MET A 5 4.946 12.654 11.952 1.00 0.00 N ATOM 61 CA MET A 5 5.615 11.356 11.986 1.00 0.00 C ATOM 62 C MET A 5 4.857 10.337 12.831 1.00 0.00 C ATOM 63 O MET A 5 5.391 9.284 13.192 1.00 0.00 O ATOM 64 CB MET A 5 7.072 11.517 12.432 1.00 0.00 C ATOM 65 CG MET A 5 7.200 12.005 13.877 1.00 0.00 C ATOM 66 SD MET A 5 8.530 11.290 14.877 1.00 0.00 S ATOM 67 CE MET A 5 7.839 9.645 15.208 1.00 0.00 C ATOM 0 H MET A 5 4.842 13.054 12.884 1.00 0.00 H new ATOM 0 HA MET A 5 5.620 10.954 10.973 1.00 0.00 H new ATOM 0 HB2 MET A 5 7.586 10.561 12.329 1.00 0.00 H new ATOM 0 HB3 MET A 5 7.574 12.222 11.769 1.00 0.00 H new ATOM 0 HG2 MET A 5 7.336 13.086 13.858 1.00 0.00 H new ATOM 0 HG3 MET A 5 6.255 11.811 14.384 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.514 9.091 15.861 1.00 0.00 H new ATOM 0 HE2 MET A 5 6.869 9.749 15.693 1.00 0.00 H new ATOM 0 HE3 MET A 5 7.719 9.105 14.269 1.00 0.00 H new ATOM 77 N LYS A 6 3.603 10.643 13.171 1.00 0.00 N ATOM 78 CA LYS A 6 2.721 9.645 13.744 1.00 0.00 C ATOM 79 C LYS A 6 2.555 8.522 12.722 1.00 0.00 C ATOM 80 O LYS A 6 2.761 8.749 11.528 1.00 0.00 O ATOM 81 CB LYS A 6 1.375 10.259 14.125 1.00 0.00 C ATOM 82 CG LYS A 6 1.488 11.486 15.045 1.00 0.00 C ATOM 83 CD LYS A 6 0.187 11.826 15.786 1.00 0.00 C ATOM 84 CE LYS A 6 -0.862 12.584 14.958 1.00 0.00 C ATOM 85 NZ LYS A 6 -1.487 11.750 13.912 1.00 0.00 N ATOM 0 H LYS A 6 3.186 11.567 13.058 1.00 0.00 H new ATOM 0 HA LYS A 6 3.151 9.245 14.662 1.00 0.00 H new ATOM 0 HB2 LYS A 6 0.847 10.546 13.216 1.00 0.00 H new ATOM 0 HB3 LYS A 6 0.768 9.501 14.620 1.00 0.00 H new ATOM 0 HG2 LYS A 6 2.276 11.309 15.777 1.00 0.00 H new ATOM 0 HG3 LYS A 6 1.793 12.347 14.451 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.259 10.899 16.146 1.00 0.00 H new ATOM 0 HD3 LYS A 6 0.434 12.423 16.664 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -1.637 12.963 15.624 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -0.392 13.450 14.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -2.441 12.109 13.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.909 11.786 13.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -1.552 10.767 14.245 1.00 0.00 H new ATOM 99 N ASN A 7 2.129 7.348 13.183 1.00 0.00 N ATOM 100 CA ASN A 7 2.010 6.145 12.361 1.00 0.00 C ATOM 101 C ASN A 7 1.319 6.474 11.054 1.00 0.00 C ATOM 102 O ASN A 7 0.232 7.059 11.055 1.00 0.00 O ATOM 103 CB ASN A 7 1.197 5.057 13.059 1.00 0.00 C ATOM 104 CG ASN A 7 0.903 3.857 12.163 1.00 0.00 C ATOM 105 OD1 ASN A 7 1.668 2.902 12.135 1.00 0.00 O ATOM 106 ND2 ASN A 7 -0.197 3.886 11.426 1.00 0.00 N ATOM 0 H ASN A 7 1.852 7.203 14.154 1.00 0.00 H new ATOM 0 HA ASN A 7 3.022 5.780 12.186 1.00 0.00 H new ATOM 0 HB2 ASN A 7 1.738 4.718 13.942 1.00 0.00 H new ATOM 0 HB3 ASN A 7 0.255 5.482 13.406 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -0.423 3.100 10.816 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -0.818 4.694 11.468 1.00 0.00 H new ATOM 113 N LEU A 8 1.931 5.988 9.987 1.00 0.00 N ATOM 114 CA LEU A 8 1.568 6.135 8.593 1.00 0.00 C ATOM 115 C LEU A 8 1.510 7.594 8.136 1.00 0.00 C ATOM 116 O LEU A 8 0.525 8.299 8.373 1.00 0.00 O ATOM 117 CB LEU A 8 0.329 5.272 8.362 1.00 0.00 C ATOM 118 CG LEU A 8 -0.236 5.213 6.941 1.00 0.00 C ATOM 119 CD1 LEU A 8 -1.263 6.325 6.780 1.00 0.00 C ATOM 120 CD2 LEU A 8 0.821 5.257 5.830 1.00 0.00 C ATOM 0 H LEU A 8 2.776 5.426 10.089 1.00 0.00 H new ATOM 0 HA LEU A 8 2.346 5.762 7.927 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.565 4.254 8.673 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.460 5.632 9.023 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.705 4.237 6.820 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.675 6.296 5.771 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.066 6.187 7.504 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.784 7.290 6.949 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.330 5.210 4.858 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.389 6.184 5.905 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.496 4.408 5.936 1.00 0.00 H new ATOM 132 N SER A 9 2.574 8.030 7.449 1.00 0.00 N ATOM 133 CA SER A 9 2.664 9.340 6.810 1.00 0.00 C ATOM 134 C SER A 9 1.479 9.548 5.868 1.00 0.00 C ATOM 135 O SER A 9 0.684 10.468 6.067 1.00 0.00 O ATOM 136 CB SER A 9 3.990 9.496 6.032 1.00 0.00 C ATOM 137 OG SER A 9 4.147 10.850 5.642 1.00 0.00 O ATOM 0 H SER A 9 3.413 7.465 7.322 1.00 0.00 H new ATOM 0 HA SER A 9 2.640 10.098 7.593 1.00 0.00 H new ATOM 0 HB2 SER A 9 4.829 9.185 6.654 1.00 0.00 H new ATOM 0 HB3 SER A 9 3.988 8.850 5.154 1.00 0.00 H new ATOM 0 HG SER A 9 4.988 10.953 5.150 1.00 0.00 H new ATOM 143 N LEU A 10 1.404 8.710 4.824 1.00 0.00 N ATOM 144 CA LEU A 10 0.641 8.962 3.608 1.00 0.00 C ATOM 145 C LEU A 10 -0.824 9.309 3.902 1.00 0.00 C ATOM 146 O LEU A 10 -1.426 8.792 4.844 1.00 0.00 O ATOM 147 CB LEU A 10 0.773 7.787 2.613 1.00 0.00 C ATOM 148 CG LEU A 10 2.093 7.596 1.815 1.00 0.00 C ATOM 149 CD1 LEU A 10 1.949 6.520 0.736 1.00 0.00 C ATOM 150 CD2 LEU A 10 2.588 8.885 1.129 1.00 0.00 C ATOM 0 H LEU A 10 1.890 7.813 4.809 1.00 0.00 H new ATOM 0 HA LEU A 10 1.072 9.843 3.132 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.594 6.867 3.170 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.035 7.883 1.887 1.00 0.00 H new ATOM 0 HG LEU A 10 2.825 7.295 2.564 1.00 0.00 H new ATOM 0 HD11 LEU A 10 2.892 6.415 0.199 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.689 5.570 1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.164 6.808 0.037 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.513 8.678 0.591 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.831 9.238 0.428 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.770 9.651 1.883 1.00 0.00 H new ATOM 162 N ASN A 11 -1.427 10.175 3.085 1.00 0.00 N ATOM 163 CA ASN A 11 -2.760 10.738 3.326 1.00 0.00 C ATOM 164 C ASN A 11 -3.874 9.749 2.945 1.00 0.00 C ATOM 165 O ASN A 11 -4.774 10.042 2.157 1.00 0.00 O ATOM 166 CB ASN A 11 -2.866 12.069 2.576 1.00 0.00 C ATOM 167 CG ASN A 11 -4.157 12.816 2.869 1.00 0.00 C ATOM 168 OD1 ASN A 11 -4.569 12.968 4.019 1.00 0.00 O ATOM 169 ND2 ASN A 11 -4.813 13.324 1.843 1.00 0.00 N ATOM 0 H ASN A 11 -0.997 10.511 2.223 1.00 0.00 H new ATOM 0 HA ASN A 11 -2.896 10.924 4.391 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -2.019 12.700 2.845 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -2.796 11.882 1.504 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -5.673 13.850 1.998 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -4.460 13.190 0.895 1.00 0.00 H new ATOM 176 N PHE A 12 -3.793 8.524 3.464 1.00 0.00 N ATOM 177 CA PHE A 12 -4.644 7.414 3.083 1.00 0.00 C ATOM 178 C PHE A 12 -6.084 7.611 3.517 1.00 0.00 C ATOM 179 O PHE A 12 -6.954 7.105 2.824 1.00 0.00 O ATOM 180 CB PHE A 12 -4.098 6.098 3.645 1.00 0.00 C ATOM 181 CG PHE A 12 -3.032 5.460 2.780 1.00 0.00 C ATOM 182 CD1 PHE A 12 -3.391 4.876 1.552 1.00 0.00 C ATOM 183 CD2 PHE A 12 -1.684 5.459 3.175 1.00 0.00 C ATOM 184 CE1 PHE A 12 -2.408 4.301 0.727 1.00 0.00 C ATOM 185 CE2 PHE A 12 -0.708 4.860 2.361 1.00 0.00 C ATOM 186 CZ PHE A 12 -1.067 4.287 1.136 1.00 0.00 C ATOM 0 H PHE A 12 -3.111 8.277 4.181 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.637 7.371 1.994 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.686 6.281 4.638 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -4.923 5.396 3.766 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -4.425 4.869 1.241 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -1.397 5.921 4.108 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -2.686 3.870 -0.223 1.00 0.00 H new ATOM 0 HE2 PHE A 12 0.323 4.842 2.682 1.00 0.00 H new ATOM 0 HZ PHE A 12 -0.314 3.835 0.508 1.00 0.00 H new ATOM 196 N GLY A 13 -6.370 8.334 4.604 1.00 0.00 N ATOM 197 CA GLY A 13 -7.742 8.564 5.056 1.00 0.00 C ATOM 198 C GLY A 13 -8.611 9.112 3.924 1.00 0.00 C ATOM 199 O GLY A 13 -9.557 8.464 3.490 1.00 0.00 O ATOM 0 H GLY A 13 -5.661 8.773 5.191 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.167 7.631 5.426 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.740 9.266 5.890 1.00 0.00 H new ATOM 203 N LYS A 14 -8.213 10.249 3.350 1.00 0.00 N ATOM 204 CA LYS A 14 -8.894 10.885 2.221 1.00 0.00 C ATOM 205 C LYS A 14 -8.975 9.928 1.039 1.00 0.00 C ATOM 206 O LYS A 14 -10.063 9.699 0.523 1.00 0.00 O ATOM 207 CB LYS A 14 -8.165 12.188 1.829 1.00 0.00 C ATOM 208 CG LYS A 14 -8.840 13.452 2.390 1.00 0.00 C ATOM 209 CD LYS A 14 -10.096 13.847 1.592 1.00 0.00 C ATOM 210 CE LYS A 14 -9.769 14.502 0.238 1.00 0.00 C ATOM 211 NZ LYS A 14 -9.530 15.959 0.350 1.00 0.00 N ATOM 0 H LYS A 14 -7.391 10.764 3.664 1.00 0.00 H new ATOM 0 HA LYS A 14 -9.912 11.137 2.519 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -7.137 12.143 2.188 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -8.121 12.259 0.742 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.112 13.284 3.432 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -8.129 14.278 2.376 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -10.705 12.959 1.422 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -10.696 14.536 2.187 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.886 14.025 -0.188 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -10.592 14.325 -0.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.314 16.349 -0.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.380 16.422 0.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -8.727 16.131 0.988 1.00 0.00 H new ATOM 225 N ALA A 15 -7.845 9.371 0.602 1.00 0.00 N ATOM 226 CA ALA A 15 -7.805 8.514 -0.579 1.00 0.00 C ATOM 227 C ALA A 15 -8.715 7.285 -0.409 1.00 0.00 C ATOM 228 O ALA A 15 -9.423 6.921 -1.344 1.00 0.00 O ATOM 229 CB ALA A 15 -6.354 8.117 -0.838 1.00 0.00 C ATOM 0 H ALA A 15 -6.940 9.501 1.054 1.00 0.00 H new ATOM 0 HA ALA A 15 -8.187 9.058 -1.443 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.304 7.476 -1.718 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.756 9.013 -1.007 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.964 7.579 0.026 1.00 0.00 H new ATOM 235 N LEU A 16 -8.739 6.664 0.776 1.00 0.00 N ATOM 236 CA LEU A 16 -9.628 5.561 1.133 1.00 0.00 C ATOM 237 C LEU A 16 -11.078 6.014 1.081 1.00 0.00 C ATOM 238 O LEU A 16 -11.927 5.252 0.624 1.00 0.00 O ATOM 239 CB LEU A 16 -9.372 5.058 2.567 1.00 0.00 C ATOM 240 CG LEU A 16 -8.165 4.133 2.760 1.00 0.00 C ATOM 241 CD1 LEU A 16 -7.992 3.858 4.251 1.00 0.00 C ATOM 242 CD2 LEU A 16 -8.334 2.768 2.099 1.00 0.00 C ATOM 0 H LEU A 16 -8.115 6.928 1.538 1.00 0.00 H new ATOM 0 HA LEU A 16 -9.431 4.763 0.417 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.245 5.925 3.215 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.263 4.532 2.909 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.315 4.643 2.307 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.136 3.201 4.403 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.826 4.798 4.777 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.891 3.379 4.639 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.443 2.165 2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.203 2.264 2.522 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.477 2.898 1.026 1.00 0.00 H new ATOM 254 N ASP A 17 -11.371 7.210 1.587 1.00 0.00 N ATOM 255 CA ASP A 17 -12.714 7.771 1.633 1.00 0.00 C ATOM 256 C ASP A 17 -13.223 8.086 0.230 1.00 0.00 C ATOM 257 O ASP A 17 -14.422 8.028 -0.002 1.00 0.00 O ATOM 258 CB ASP A 17 -12.737 9.036 2.498 1.00 0.00 C ATOM 259 CG ASP A 17 -14.117 9.249 3.101 1.00 0.00 C ATOM 260 OD1 ASP A 17 -14.965 9.948 2.503 1.00 0.00 O ATOM 261 OD2 ASP A 17 -14.341 8.769 4.235 1.00 0.00 O ATOM 0 H ASP A 17 -10.663 7.828 1.985 1.00 0.00 H new ATOM 0 HA ASP A 17 -13.374 7.027 2.078 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -11.996 8.953 3.293 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -12.461 9.901 1.894 1.00 0.00 H new ATOM 266 N GLU A 18 -12.342 8.346 -0.741 1.00 0.00 N ATOM 267 CA GLU A 18 -12.744 8.435 -2.141 1.00 0.00 C ATOM 268 C GLU A 18 -12.911 7.019 -2.704 1.00 0.00 C ATOM 269 O GLU A 18 -13.966 6.713 -3.254 1.00 0.00 O ATOM 270 CB GLU A 18 -11.794 9.326 -2.975 1.00 0.00 C ATOM 271 CG GLU A 18 -11.577 10.703 -2.319 1.00 0.00 C ATOM 272 CD GLU A 18 -11.385 11.896 -3.263 1.00 0.00 C ATOM 273 OE1 GLU A 18 -10.737 11.777 -4.324 1.00 0.00 O ATOM 274 OE2 GLU A 18 -11.814 13.019 -2.895 1.00 0.00 O ATOM 0 H GLU A 18 -11.346 8.498 -0.579 1.00 0.00 H new ATOM 0 HA GLU A 18 -13.708 8.939 -2.206 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.834 8.824 -3.092 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.207 9.461 -3.975 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.433 10.912 -1.677 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -10.702 10.637 -1.672 1.00 0.00 H new ATOM 281 N CYS A 19 -11.927 6.128 -2.524 1.00 0.00 N ATOM 282 CA CYS A 19 -11.936 4.747 -2.999 1.00 0.00 C ATOM 283 C CYS A 19 -13.175 3.969 -2.553 1.00 0.00 C ATOM 284 O CYS A 19 -13.749 3.214 -3.341 1.00 0.00 O ATOM 285 CB CYS A 19 -10.680 4.041 -2.482 1.00 0.00 C ATOM 286 SG CYS A 19 -9.179 4.321 -3.443 1.00 0.00 S ATOM 0 H CYS A 19 -11.071 6.364 -2.023 1.00 0.00 H new ATOM 0 HA CYS A 19 -11.955 4.775 -4.088 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -10.499 4.364 -1.457 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -10.875 2.969 -2.449 1.00 0.00 H new ATOM 291 N LYS A 20 -13.618 4.148 -1.304 1.00 0.00 N ATOM 292 CA LYS A 20 -14.825 3.489 -0.821 1.00 0.00 C ATOM 293 C LYS A 20 -16.016 3.947 -1.641 1.00 0.00 C ATOM 294 O LYS A 20 -16.842 3.113 -1.974 1.00 0.00 O ATOM 295 CB LYS A 20 -15.020 3.620 0.706 1.00 0.00 C ATOM 296 CG LYS A 20 -15.247 5.039 1.249 1.00 0.00 C ATOM 297 CD LYS A 20 -16.703 5.534 1.301 1.00 0.00 C ATOM 298 CE LYS A 20 -17.479 4.867 2.442 1.00 0.00 C ATOM 299 NZ LYS A 20 -18.942 4.959 2.260 1.00 0.00 N ATOM 0 H LYS A 20 -13.157 4.743 -0.615 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.718 2.415 -0.970 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -15.871 3.004 0.995 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -14.142 3.202 1.199 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -14.835 5.088 2.257 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.673 5.734 0.636 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.717 6.616 1.433 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.195 5.323 0.352 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -17.190 3.818 2.510 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -17.203 5.335 3.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -19.421 4.494 3.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -19.225 5.959 2.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -19.212 4.489 1.372 1.00 0.00 H new ATOM 313 N LYS A 21 -16.113 5.228 -2.010 1.00 0.00 N ATOM 314 CA LYS A 21 -17.241 5.732 -2.787 1.00 0.00 C ATOM 315 C LYS A 21 -17.159 5.234 -4.225 1.00 0.00 C ATOM 316 O LYS A 21 -18.198 5.061 -4.859 1.00 0.00 O ATOM 317 CB LYS A 21 -17.282 7.268 -2.750 1.00 0.00 C ATOM 318 CG LYS A 21 -17.327 7.813 -1.316 1.00 0.00 C ATOM 319 CD LYS A 21 -17.036 9.319 -1.280 1.00 0.00 C ATOM 320 CE LYS A 21 -17.014 9.839 0.161 1.00 0.00 C ATOM 321 NZ LYS A 21 -18.366 10.044 0.715 1.00 0.00 N ATOM 0 H LYS A 21 -15.416 5.936 -1.779 1.00 0.00 H new ATOM 0 HA LYS A 21 -18.162 5.355 -2.341 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -16.405 7.665 -3.260 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -18.156 7.620 -3.298 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -18.308 7.620 -0.882 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.598 7.285 -0.702 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.077 9.519 -1.757 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -17.795 9.853 -1.852 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.472 9.132 0.789 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -16.466 10.781 0.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -18.292 10.396 1.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -18.877 10.739 0.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -18.883 9.142 0.711 1.00 0.00 H new ATOM 335 N GLU A 22 -15.952 4.990 -4.743 1.00 0.00 N ATOM 336 CA GLU A 22 -15.752 4.501 -6.100 1.00 0.00 C ATOM 337 C GLU A 22 -16.422 3.147 -6.267 1.00 0.00 C ATOM 338 O GLU A 22 -17.334 3.025 -7.079 1.00 0.00 O ATOM 339 CB GLU A 22 -14.268 4.431 -6.490 1.00 0.00 C ATOM 340 CG GLU A 22 -13.619 5.816 -6.473 1.00 0.00 C ATOM 341 CD GLU A 22 -12.413 5.909 -7.395 1.00 0.00 C ATOM 342 OE1 GLU A 22 -11.417 5.194 -7.165 1.00 0.00 O ATOM 343 OE2 GLU A 22 -12.393 6.755 -8.314 1.00 0.00 O ATOM 0 H GLU A 22 -15.084 5.129 -4.225 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.215 5.218 -6.778 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -13.740 3.772 -5.801 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -14.172 3.995 -7.484 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.356 6.562 -6.769 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.313 6.057 -5.455 1.00 0.00 H new ATOM 350 N MET A 23 -16.027 2.140 -5.484 1.00 0.00 N ATOM 351 CA MET A 23 -16.584 0.800 -5.626 1.00 0.00 C ATOM 352 C MET A 23 -17.796 0.568 -4.719 1.00 0.00 C ATOM 353 O MET A 23 -18.251 -0.570 -4.611 1.00 0.00 O ATOM 354 CB MET A 23 -15.530 -0.279 -5.360 1.00 0.00 C ATOM 355 CG MET A 23 -14.071 0.058 -5.669 1.00 0.00 C ATOM 356 SD MET A 23 -13.090 -1.395 -6.131 1.00 0.00 S ATOM 357 CE MET A 23 -11.463 -0.660 -6.010 1.00 0.00 C ATOM 0 H MET A 23 -15.326 2.230 -4.749 1.00 0.00 H new ATOM 0 HA MET A 23 -16.918 0.724 -6.661 1.00 0.00 H new ATOM 0 HB2 MET A 23 -15.594 -0.557 -4.308 1.00 0.00 H new ATOM 0 HB3 MET A 23 -15.800 -1.161 -5.940 1.00 0.00 H new ATOM 0 HG2 MET A 23 -14.036 0.786 -6.480 1.00 0.00 H new ATOM 0 HG3 MET A 23 -13.621 0.531 -4.796 1.00 0.00 H new ATOM 0 HE1 MET A 23 -10.791 -1.146 -6.717 1.00 0.00 H new ATOM 0 HE2 MET A 23 -11.526 0.403 -6.241 1.00 0.00 H new ATOM 0 HE3 MET A 23 -11.080 -0.789 -4.998 1.00 0.00 H new ATOM 367 N THR A 24 -18.262 1.598 -4.004 1.00 0.00 N ATOM 368 CA THR A 24 -19.164 1.512 -2.856 1.00 0.00 C ATOM 369 C THR A 24 -18.777 0.367 -1.895 1.00 0.00 C ATOM 370 O THR A 24 -19.613 -0.369 -1.369 1.00 0.00 O ATOM 371 CB THR A 24 -20.628 1.612 -3.290 1.00 0.00 C ATOM 372 OG1 THR A 24 -21.432 1.831 -2.145 1.00 0.00 O ATOM 373 CG2 THR A 24 -21.076 0.385 -4.076 1.00 0.00 C ATOM 0 H THR A 24 -18.006 2.561 -4.223 1.00 0.00 H new ATOM 0 HA THR A 24 -19.037 2.389 -2.222 1.00 0.00 H new ATOM 0 HB THR A 24 -20.740 2.456 -3.970 1.00 0.00 H new ATOM 0 HG1 THR A 24 -21.223 1.157 -1.465 1.00 0.00 H new ATOM 0 HG21 THR A 24 -22.121 0.499 -4.364 1.00 0.00 H new ATOM 0 HG22 THR A 24 -20.462 0.282 -4.971 1.00 0.00 H new ATOM 0 HG23 THR A 24 -20.965 -0.505 -3.456 1.00 0.00 H new ATOM 381 N LEU A 25 -17.471 0.232 -1.662 1.00 0.00 N ATOM 382 CA LEU A 25 -16.875 -0.655 -0.655 1.00 0.00 C ATOM 383 C LEU A 25 -17.495 -0.391 0.727 1.00 0.00 C ATOM 384 O LEU A 25 -18.227 0.588 0.941 1.00 0.00 O ATOM 385 CB LEU A 25 -15.339 -0.483 -0.524 1.00 0.00 C ATOM 386 CG LEU A 25 -14.482 -0.533 -1.803 1.00 0.00 C ATOM 387 CD1 LEU A 25 -13.035 -0.126 -1.500 1.00 0.00 C ATOM 388 CD2 LEU A 25 -14.463 -1.945 -2.396 1.00 0.00 C ATOM 0 H LEU A 25 -16.771 0.756 -2.187 1.00 0.00 H new ATOM 0 HA LEU A 25 -17.082 -1.670 -0.995 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -15.153 0.475 -0.038 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -14.975 -1.259 0.150 1.00 0.00 H new ATOM 0 HG LEU A 25 -14.927 0.161 -2.516 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -12.446 -0.168 -2.416 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -13.018 0.889 -1.104 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.611 -0.810 -0.765 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -13.851 -1.953 -3.298 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -14.045 -2.640 -1.668 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -15.480 -2.249 -2.645 1.00 0.00 H new ATOM 400 N THR A 26 -17.108 -1.221 1.689 1.00 0.00 N ATOM 401 CA THR A 26 -17.398 -1.086 3.106 1.00 0.00 C ATOM 402 C THR A 26 -16.816 0.230 3.639 1.00 0.00 C ATOM 403 O THR A 26 -15.970 0.860 3.007 1.00 0.00 O ATOM 404 CB THR A 26 -16.856 -2.342 3.831 1.00 0.00 C ATOM 405 OG1 THR A 26 -15.724 -2.899 3.175 1.00 0.00 O ATOM 406 CG2 THR A 26 -17.929 -3.430 3.835 1.00 0.00 C ATOM 0 H THR A 26 -16.552 -2.052 1.486 1.00 0.00 H new ATOM 0 HA THR A 26 -18.471 -1.032 3.291 1.00 0.00 H new ATOM 0 HB THR A 26 -16.578 -2.025 4.836 1.00 0.00 H new ATOM 0 HG1 THR A 26 -16.019 -3.585 2.540 1.00 0.00 H new ATOM 0 HG21 THR A 26 -17.548 -4.315 4.345 1.00 0.00 H new ATOM 0 HG22 THR A 26 -18.815 -3.065 4.354 1.00 0.00 H new ATOM 0 HG23 THR A 26 -18.190 -3.687 2.808 1.00 0.00 H new ATOM 414 N ASP A 27 -17.316 0.698 4.781 1.00 0.00 N ATOM 415 CA ASP A 27 -16.755 1.826 5.527 1.00 0.00 C ATOM 416 C ASP A 27 -15.672 1.343 6.482 1.00 0.00 C ATOM 417 O ASP A 27 -14.703 2.059 6.721 1.00 0.00 O ATOM 418 CB ASP A 27 -17.854 2.500 6.341 1.00 0.00 C ATOM 419 CG ASP A 27 -17.308 3.682 7.140 1.00 0.00 C ATOM 420 OD1 ASP A 27 -17.244 4.793 6.561 1.00 0.00 O ATOM 421 OD2 ASP A 27 -16.990 3.516 8.343 1.00 0.00 O ATOM 0 H ASP A 27 -18.141 0.295 5.225 1.00 0.00 H new ATOM 0 HA ASP A 27 -16.326 2.531 4.815 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -18.645 2.844 5.674 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -18.303 1.775 7.020 1.00 0.00 H new ATOM 426 N ALA A 28 -15.808 0.100 6.964 1.00 0.00 N ATOM 427 CA ALA A 28 -14.885 -0.543 7.886 1.00 0.00 C ATOM 428 C ALA A 28 -13.443 -0.475 7.385 1.00 0.00 C ATOM 429 O ALA A 28 -12.541 -0.435 8.211 1.00 0.00 O ATOM 430 CB ALA A 28 -15.314 -1.997 8.112 1.00 0.00 C ATOM 0 H ALA A 28 -16.593 -0.499 6.709 1.00 0.00 H new ATOM 0 HA ALA A 28 -14.919 -0.005 8.834 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -14.621 -2.477 8.803 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -16.319 -2.019 8.532 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -15.307 -2.530 7.161 1.00 0.00 H new ATOM 436 N ILE A 29 -13.229 -0.396 6.064 1.00 0.00 N ATOM 437 CA ILE A 29 -11.950 -0.134 5.405 1.00 0.00 C ATOM 438 C ILE A 29 -11.151 0.994 6.069 1.00 0.00 C ATOM 439 O ILE A 29 -9.923 0.952 6.020 1.00 0.00 O ATOM 440 CB ILE A 29 -12.147 0.027 3.877 1.00 0.00 C ATOM 441 CG1 ILE A 29 -12.895 1.308 3.461 1.00 0.00 C ATOM 442 CG2 ILE A 29 -12.900 -1.170 3.275 1.00 0.00 C ATOM 443 CD1 ILE A 29 -12.035 2.556 3.615 1.00 0.00 C ATOM 0 H ILE A 29 -13.988 -0.521 5.394 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.314 -1.008 5.541 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.131 0.088 3.488 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.217 1.217 2.424 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.795 1.413 4.066 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -13.020 -1.022 2.202 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -12.333 -2.084 3.454 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -13.882 -1.254 3.741 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -12.607 3.432 3.309 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.734 2.664 4.657 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.147 2.466 2.989 1.00 0.00 H new ATOM 455 N ASN A 30 -11.817 1.975 6.693 1.00 0.00 N ATOM 456 CA ASN A 30 -11.172 3.113 7.334 1.00 0.00 C ATOM 457 C ASN A 30 -10.213 2.624 8.418 1.00 0.00 C ATOM 458 O ASN A 30 -9.084 3.116 8.505 1.00 0.00 O ATOM 459 CB ASN A 30 -12.237 4.059 7.917 1.00 0.00 C ATOM 460 CG ASN A 30 -11.638 5.379 8.393 1.00 0.00 C ATOM 461 OD1 ASN A 30 -10.754 5.409 9.247 1.00 0.00 O ATOM 462 ND2 ASN A 30 -12.081 6.503 7.855 1.00 0.00 N ATOM 0 H ASN A 30 -12.834 1.994 6.764 1.00 0.00 H new ATOM 0 HA ASN A 30 -10.594 3.668 6.595 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -12.996 4.258 7.161 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -12.739 3.568 8.751 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -11.689 7.398 8.148 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -12.814 6.475 7.147 1.00 0.00 H new ATOM 469 N GLU A 31 -10.656 1.659 9.234 1.00 0.00 N ATOM 470 CA GLU A 31 -9.789 0.903 10.106 1.00 0.00 C ATOM 471 C GLU A 31 -9.110 -0.269 9.424 1.00 0.00 C ATOM 472 O GLU A 31 -7.908 -0.409 9.535 1.00 0.00 O ATOM 473 CB GLU A 31 -10.468 0.484 11.376 1.00 0.00 C ATOM 474 CG GLU A 31 -11.706 -0.335 11.186 1.00 0.00 C ATOM 475 CD GLU A 31 -12.263 -0.798 12.523 1.00 0.00 C ATOM 476 OE1 GLU A 31 -11.516 -1.407 13.322 1.00 0.00 O ATOM 477 OE2 GLU A 31 -13.448 -0.536 12.822 1.00 0.00 O ATOM 0 H GLU A 31 -11.638 1.389 9.298 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.994 1.597 10.378 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -9.761 -0.087 11.978 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -10.724 1.377 11.946 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -12.458 0.252 10.659 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -11.482 -1.200 10.562 1.00 0.00 H new ATOM 484 N ASP A 32 -9.880 -1.116 8.763 1.00 0.00 N ATOM 485 CA ASP A 32 -9.534 -2.475 8.321 1.00 0.00 C ATOM 486 C ASP A 32 -8.244 -2.484 7.496 1.00 0.00 C ATOM 487 O ASP A 32 -7.398 -3.358 7.673 1.00 0.00 O ATOM 488 CB ASP A 32 -10.707 -3.087 7.532 1.00 0.00 C ATOM 489 CG ASP A 32 -10.873 -4.599 7.692 1.00 0.00 C ATOM 490 OD1 ASP A 32 -10.979 -5.072 8.847 1.00 0.00 O ATOM 491 OD2 ASP A 32 -11.111 -5.272 6.661 1.00 0.00 O ATOM 0 H ASP A 32 -10.832 -0.864 8.498 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.352 -3.088 9.204 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -11.630 -2.600 7.846 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.571 -2.861 6.474 1.00 0.00 H new ATOM 496 N PHE A 33 -8.062 -1.462 6.651 1.00 0.00 N ATOM 497 CA PHE A 33 -6.860 -1.220 5.854 1.00 0.00 C ATOM 498 C PHE A 33 -5.630 -1.013 6.746 1.00 0.00 C ATOM 499 O PHE A 33 -4.575 -1.589 6.498 1.00 0.00 O ATOM 500 CB PHE A 33 -7.122 0.018 4.981 1.00 0.00 C ATOM 501 CG PHE A 33 -6.031 0.410 4.000 1.00 0.00 C ATOM 502 CD1 PHE A 33 -5.977 -0.184 2.727 1.00 0.00 C ATOM 503 CD2 PHE A 33 -5.130 1.444 4.314 1.00 0.00 C ATOM 504 CE1 PHE A 33 -5.001 0.215 1.797 1.00 0.00 C ATOM 505 CE2 PHE A 33 -4.182 1.870 3.368 1.00 0.00 C ATOM 506 CZ PHE A 33 -4.088 1.230 2.125 1.00 0.00 C ATOM 0 H PHE A 33 -8.780 -0.753 6.500 1.00 0.00 H new ATOM 0 HA PHE A 33 -6.647 -2.087 5.229 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.040 -0.152 4.418 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.306 0.866 5.641 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.689 -0.951 2.462 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -5.167 1.912 5.286 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.953 -0.260 0.828 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.523 2.694 3.600 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.318 1.516 1.424 1.00 0.00 H new ATOM 516 N TYR A 34 -5.769 -0.184 7.782 1.00 0.00 N ATOM 517 CA TYR A 34 -4.735 0.102 8.773 1.00 0.00 C ATOM 518 C TYR A 34 -4.533 -1.098 9.707 1.00 0.00 C ATOM 519 O TYR A 34 -3.409 -1.423 10.098 1.00 0.00 O ATOM 520 CB TYR A 34 -5.097 1.353 9.598 1.00 0.00 C ATOM 521 CG TYR A 34 -4.988 2.695 8.888 1.00 0.00 C ATOM 522 CD1 TYR A 34 -5.766 2.978 7.748 1.00 0.00 C ATOM 523 CD2 TYR A 34 -4.131 3.690 9.398 1.00 0.00 C ATOM 524 CE1 TYR A 34 -5.671 4.222 7.102 1.00 0.00 C ATOM 525 CE2 TYR A 34 -4.046 4.948 8.776 1.00 0.00 C ATOM 526 CZ TYR A 34 -4.827 5.223 7.630 1.00 0.00 C ATOM 527 OH TYR A 34 -4.814 6.470 7.086 1.00 0.00 O ATOM 0 H TYR A 34 -6.636 0.324 7.959 1.00 0.00 H new ATOM 0 HA TYR A 34 -3.804 0.293 8.239 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -6.120 1.240 9.957 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.452 1.379 10.477 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -6.444 2.229 7.366 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -3.534 3.485 10.274 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -6.242 4.412 6.205 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.385 5.704 9.173 1.00 0.00 H new ATOM 0 HH TYR A 34 -4.177 7.033 7.573 1.00 0.00 H new ATOM 537 N ASN A 35 -5.627 -1.768 10.079 1.00 0.00 N ATOM 538 CA ASN A 35 -5.628 -2.933 10.946 1.00 0.00 C ATOM 539 C ASN A 35 -4.777 -4.007 10.282 1.00 0.00 C ATOM 540 O ASN A 35 -3.962 -4.611 10.976 1.00 0.00 O ATOM 541 CB ASN A 35 -7.051 -3.461 11.251 1.00 0.00 C ATOM 542 CG ASN A 35 -7.900 -2.605 12.181 1.00 0.00 C ATOM 543 OD1 ASN A 35 -7.367 -1.834 12.978 1.00 0.00 O ATOM 544 ND2 ASN A 35 -9.214 -2.763 12.138 1.00 0.00 N ATOM 0 H ASN A 35 -6.562 -1.500 9.772 1.00 0.00 H new ATOM 0 HA ASN A 35 -5.212 -2.651 11.913 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -7.584 -3.574 10.307 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -6.961 -4.456 11.687 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -9.812 -2.238 12.776 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.628 -3.409 11.466 1.00 0.00 H new ATOM 551 N PHE A 36 -4.944 -4.269 8.979 1.00 0.00 N ATOM 552 CA PHE A 36 -4.322 -5.379 8.244 1.00 0.00 C ATOM 553 C PHE A 36 -2.794 -5.456 8.444 1.00 0.00 C ATOM 554 O PHE A 36 -2.215 -6.540 8.349 1.00 0.00 O ATOM 555 CB PHE A 36 -4.666 -5.194 6.753 1.00 0.00 C ATOM 556 CG PHE A 36 -3.936 -6.024 5.697 1.00 0.00 C ATOM 557 CD1 PHE A 36 -3.893 -7.432 5.753 1.00 0.00 C ATOM 558 CD2 PHE A 36 -3.381 -5.374 4.577 1.00 0.00 C ATOM 559 CE1 PHE A 36 -3.390 -8.176 4.672 1.00 0.00 C ATOM 560 CE2 PHE A 36 -2.822 -6.117 3.520 1.00 0.00 C ATOM 561 CZ PHE A 36 -2.849 -7.519 3.555 1.00 0.00 C ATOM 0 H PHE A 36 -5.539 -3.692 8.385 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.714 -6.320 8.629 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -5.733 -5.388 6.639 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -4.505 -4.144 6.510 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.250 -7.944 6.635 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.384 -4.295 4.529 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.420 -9.255 4.700 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -2.372 -5.607 2.681 1.00 0.00 H new ATOM 0 HZ PHE A 36 -2.456 -8.090 2.727 1.00 0.00 H new ATOM 571 N TRP A 37 -2.128 -4.330 8.729 1.00 0.00 N ATOM 572 CA TRP A 37 -0.686 -4.255 8.972 1.00 0.00 C ATOM 573 C TRP A 37 -0.270 -4.846 10.325 1.00 0.00 C ATOM 574 O TRP A 37 0.920 -5.056 10.577 1.00 0.00 O ATOM 575 CB TRP A 37 -0.261 -2.782 8.927 1.00 0.00 C ATOM 576 CG TRP A 37 -0.742 -1.987 7.757 1.00 0.00 C ATOM 577 CD1 TRP A 37 -0.987 -2.467 6.517 1.00 0.00 C ATOM 578 CD2 TRP A 37 -1.114 -0.580 7.727 1.00 0.00 C ATOM 579 NE1 TRP A 37 -1.541 -1.473 5.743 1.00 0.00 N ATOM 580 CE2 TRP A 37 -1.641 -0.291 6.440 1.00 0.00 C ATOM 581 CE3 TRP A 37 -1.112 0.472 8.668 1.00 0.00 C ATOM 582 CZ2 TRP A 37 -2.174 0.961 6.118 1.00 0.00 C ATOM 583 CZ3 TRP A 37 -1.624 1.744 8.345 1.00 0.00 C ATOM 584 CH2 TRP A 37 -2.172 1.988 7.074 1.00 0.00 C ATOM 0 H TRP A 37 -2.591 -3.424 8.798 1.00 0.00 H new ATOM 0 HA TRP A 37 -0.194 -4.845 8.199 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -0.613 -2.297 9.837 1.00 0.00 H new ATOM 0 HB3 TRP A 37 0.828 -2.740 8.944 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -0.780 -3.474 6.185 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -1.840 -1.597 4.776 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -0.710 0.298 9.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -2.586 1.137 5.135 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -1.595 2.536 9.078 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -2.587 2.956 6.836 1.00 0.00 H new ATOM 595 N LYS A 38 -1.209 -5.043 11.244 1.00 0.00 N ATOM 596 CA LYS A 38 -0.981 -5.628 12.555 1.00 0.00 C ATOM 597 C LYS A 38 -0.883 -7.136 12.378 1.00 0.00 C ATOM 598 O LYS A 38 -1.588 -7.721 11.554 1.00 0.00 O ATOM 599 CB LYS A 38 -2.161 -5.285 13.476 1.00 0.00 C ATOM 600 CG LYS A 38 -2.386 -3.770 13.629 1.00 0.00 C ATOM 601 CD LYS A 38 -3.748 -3.474 14.265 1.00 0.00 C ATOM 602 CE LYS A 38 -3.967 -1.954 14.282 1.00 0.00 C ATOM 603 NZ LYS A 38 -5.248 -1.566 14.908 1.00 0.00 N ATOM 0 H LYS A 38 -2.185 -4.789 11.088 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.065 -5.239 13.000 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -3.068 -5.743 13.081 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.986 -5.722 14.459 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.594 -3.342 14.244 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.326 -3.290 12.652 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.542 -3.963 13.701 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -3.785 -3.872 15.279 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.147 -1.480 14.820 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.938 -1.576 13.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.198 -0.574 15.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.019 -1.676 14.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -5.431 -2.175 15.731 1.00 0.00 H new ATOM 617 N GLU A 39 -0.024 -7.779 13.153 1.00 0.00 N ATOM 618 CA GLU A 39 0.018 -9.230 13.242 1.00 0.00 C ATOM 619 C GLU A 39 -1.027 -9.709 14.245 1.00 0.00 C ATOM 620 O GLU A 39 -1.715 -8.903 14.882 1.00 0.00 O ATOM 621 CB GLU A 39 1.455 -9.661 13.555 1.00 0.00 C ATOM 622 CG GLU A 39 2.284 -9.375 12.298 1.00 0.00 C ATOM 623 CD GLU A 39 3.763 -9.699 12.456 1.00 0.00 C ATOM 624 OE1 GLU A 39 4.142 -10.878 12.231 1.00 0.00 O ATOM 625 OE2 GLU A 39 4.547 -8.764 12.719 1.00 0.00 O ATOM 0 H GLU A 39 0.665 -7.308 13.739 1.00 0.00 H new ATOM 0 HA GLU A 39 -0.246 -9.705 12.297 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.847 -9.110 14.410 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.494 -10.720 13.812 1.00 0.00 H new ATOM 0 HG2 GLU A 39 1.881 -9.954 11.467 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.177 -8.323 12.034 1.00 0.00 H new ATOM 632 N GLY A 40 -1.198 -11.028 14.314 1.00 0.00 N ATOM 633 CA GLY A 40 -2.246 -11.670 15.100 1.00 0.00 C ATOM 634 C GLY A 40 -3.649 -11.323 14.595 1.00 0.00 C ATOM 635 O GLY A 40 -4.588 -11.253 15.388 1.00 0.00 O ATOM 0 H GLY A 40 -0.602 -11.690 13.817 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.109 -12.751 15.070 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.152 -11.366 16.143 1.00 0.00 H new ATOM 639 N TYR A 41 -3.772 -11.003 13.308 1.00 0.00 N ATOM 640 CA TYR A 41 -4.974 -10.619 12.597 1.00 0.00 C ATOM 641 C TYR A 41 -4.976 -11.298 11.229 1.00 0.00 C ATOM 642 O TYR A 41 -4.118 -10.999 10.390 1.00 0.00 O ATOM 643 CB TYR A 41 -4.933 -9.114 12.408 1.00 0.00 C ATOM 644 CG TYR A 41 -5.752 -8.266 13.351 1.00 0.00 C ATOM 645 CD1 TYR A 41 -7.131 -8.140 13.120 1.00 0.00 C ATOM 646 CD2 TYR A 41 -5.100 -7.365 14.204 1.00 0.00 C ATOM 647 CE1 TYR A 41 -7.847 -7.064 13.670 1.00 0.00 C ATOM 648 CE2 TYR A 41 -5.823 -6.326 14.819 1.00 0.00 C ATOM 649 CZ TYR A 41 -7.196 -6.149 14.533 1.00 0.00 C ATOM 650 OH TYR A 41 -7.853 -5.061 15.026 1.00 0.00 O ATOM 0 H TYR A 41 -2.960 -11.009 12.690 1.00 0.00 H new ATOM 0 HA TYR A 41 -5.866 -10.913 13.149 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -3.894 -8.794 12.486 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -5.258 -8.895 11.391 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -7.644 -8.874 12.516 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -4.041 -7.468 14.390 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -8.893 -6.935 13.435 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -5.327 -5.662 15.512 1.00 0.00 H new ATOM 0 HH TYR A 41 -7.249 -4.547 15.601 1.00 0.00 H new ATOM 660 N GLU A 42 -5.947 -12.169 10.966 1.00 0.00 N ATOM 661 CA GLU A 42 -6.173 -12.756 9.658 1.00 0.00 C ATOM 662 C GLU A 42 -7.075 -11.815 8.845 1.00 0.00 C ATOM 663 O GLU A 42 -8.208 -12.156 8.507 1.00 0.00 O ATOM 664 CB GLU A 42 -6.708 -14.192 9.839 1.00 0.00 C ATOM 665 CG GLU A 42 -6.581 -15.007 8.550 1.00 0.00 C ATOM 666 CD GLU A 42 -6.807 -16.511 8.752 1.00 0.00 C ATOM 667 OE1 GLU A 42 -6.143 -17.090 9.647 1.00 0.00 O ATOM 668 OE2 GLU A 42 -7.549 -17.155 7.969 1.00 0.00 O ATOM 0 H GLU A 42 -6.609 -12.489 11.673 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.254 -12.858 9.080 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.158 -14.688 10.639 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.753 -14.156 10.146 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.301 -14.634 7.821 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -5.589 -14.850 8.127 1.00 0.00 H new ATOM 675 N ILE A 43 -6.608 -10.596 8.540 1.00 0.00 N ATOM 676 CA ILE A 43 -7.327 -9.738 7.596 1.00 0.00 C ATOM 677 C ILE A 43 -7.013 -10.252 6.202 1.00 0.00 C ATOM 678 O ILE A 43 -5.905 -10.092 5.686 1.00 0.00 O ATOM 679 CB ILE A 43 -7.100 -8.237 7.747 1.00 0.00 C ATOM 680 CG1 ILE A 43 -7.342 -7.811 9.187 1.00 0.00 C ATOM 681 CG2 ILE A 43 -8.025 -7.432 6.820 1.00 0.00 C ATOM 682 CD1 ILE A 43 -8.608 -8.257 9.900 1.00 0.00 C ATOM 0 H ILE A 43 -5.755 -10.191 8.925 1.00 0.00 H new ATOM 0 HA ILE A 43 -8.392 -9.813 7.815 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.066 -8.032 7.469 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.495 -8.161 9.777 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -7.320 -6.722 9.213 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -7.836 -6.367 6.954 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.831 -7.708 5.783 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.065 -7.650 7.065 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -8.612 -7.861 10.916 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.479 -7.884 9.362 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -8.642 -9.346 9.935 1.00 0.00 H new ATOM 694 N LYS A 44 -7.990 -10.927 5.615 1.00 0.00 N ATOM 695 CA LYS A 44 -7.904 -11.559 4.311 1.00 0.00 C ATOM 696 C LYS A 44 -9.084 -11.173 3.425 1.00 0.00 C ATOM 697 O LYS A 44 -9.397 -11.874 2.466 1.00 0.00 O ATOM 698 CB LYS A 44 -7.759 -13.063 4.515 1.00 0.00 C ATOM 699 CG LYS A 44 -8.912 -13.654 5.323 1.00 0.00 C ATOM 700 CD LYS A 44 -8.952 -15.168 5.203 1.00 0.00 C ATOM 701 CE LYS A 44 -9.601 -15.494 3.860 1.00 0.00 C ATOM 702 NZ LYS A 44 -9.334 -16.880 3.448 1.00 0.00 N ATOM 0 H LYS A 44 -8.902 -11.053 6.054 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.025 -11.204 3.773 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.709 -13.556 3.544 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.818 -13.269 5.025 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -8.806 -13.373 6.371 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.856 -13.234 4.974 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -7.947 -15.585 5.257 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -9.522 -15.605 6.023 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -10.677 -15.336 3.928 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -9.226 -14.810 3.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -9.791 -17.064 2.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -8.308 -17.024 3.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -9.714 -17.534 4.162 1.00 0.00 H new ATOM 716 N ASN A 45 -9.834 -10.139 3.806 1.00 0.00 N ATOM 717 CA ASN A 45 -11.095 -9.832 3.141 1.00 0.00 C ATOM 718 C ASN A 45 -10.843 -9.205 1.771 1.00 0.00 C ATOM 719 O ASN A 45 -9.778 -8.656 1.506 1.00 0.00 O ATOM 720 CB ASN A 45 -12.035 -8.959 3.994 1.00 0.00 C ATOM 721 CG ASN A 45 -13.410 -8.924 3.337 1.00 0.00 C ATOM 722 OD1 ASN A 45 -13.855 -9.919 2.769 1.00 0.00 O ATOM 723 ND2 ASN A 45 -14.051 -7.780 3.261 1.00 0.00 N ATOM 0 H ASN A 45 -9.590 -9.505 4.567 1.00 0.00 H new ATOM 0 HA ASN A 45 -11.614 -10.780 3.001 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -12.110 -9.362 5.004 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -11.634 -7.949 4.083 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -14.920 -7.716 2.730 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -13.680 -6.955 3.733 1.00 0.00 H new ATOM 730 N ARG A 46 -11.847 -9.267 0.899 1.00 0.00 N ATOM 731 CA ARG A 46 -11.812 -8.721 -0.450 1.00 0.00 C ATOM 732 C ARG A 46 -11.479 -7.240 -0.357 1.00 0.00 C ATOM 733 O ARG A 46 -10.440 -6.817 -0.854 1.00 0.00 O ATOM 734 CB ARG A 46 -13.148 -8.911 -1.176 1.00 0.00 C ATOM 735 CG ARG A 46 -13.778 -10.289 -0.996 1.00 0.00 C ATOM 736 CD ARG A 46 -15.185 -10.206 -1.573 1.00 0.00 C ATOM 737 NE ARG A 46 -15.689 -11.537 -1.919 1.00 0.00 N ATOM 738 CZ ARG A 46 -16.288 -12.394 -1.086 1.00 0.00 C ATOM 739 NH1 ARG A 46 -16.577 -12.059 0.169 1.00 0.00 N ATOM 740 NH2 ARG A 46 -16.556 -13.617 -1.520 1.00 0.00 N ATOM 0 H ARG A 46 -12.736 -9.714 1.123 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.054 -9.253 -1.026 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -13.850 -8.156 -0.822 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.997 -8.731 -2.240 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.193 -11.052 -1.510 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -13.808 -10.566 0.058 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -15.852 -9.737 -0.849 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -15.182 -9.572 -2.460 1.00 0.00 H new ATOM 0 HE ARG A 46 -15.572 -11.838 -2.886 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -16.341 -11.129 0.516 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -17.034 -12.732 0.784 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -16.306 -13.887 -2.471 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.013 -14.289 -0.903 1.00 0.00 H new ATOM 754 N GLU A 47 -12.333 -6.459 0.309 1.00 0.00 N ATOM 755 CA GLU A 47 -12.295 -5.002 0.279 1.00 0.00 C ATOM 756 C GLU A 47 -10.962 -4.423 0.799 1.00 0.00 C ATOM 757 O GLU A 47 -10.608 -3.301 0.442 1.00 0.00 O ATOM 758 CB GLU A 47 -13.527 -4.405 0.984 1.00 0.00 C ATOM 759 CG GLU A 47 -14.853 -4.632 0.225 1.00 0.00 C ATOM 760 CD GLU A 47 -15.646 -5.887 0.623 1.00 0.00 C ATOM 761 OE1 GLU A 47 -15.033 -6.937 0.914 1.00 0.00 O ATOM 762 OE2 GLU A 47 -16.900 -5.861 0.586 1.00 0.00 O ATOM 0 H GLU A 47 -13.082 -6.832 0.893 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.343 -4.698 -0.767 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.610 -4.841 1.980 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.374 -3.334 1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -15.490 -3.760 0.376 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -14.634 -4.687 -0.841 1.00 0.00 H new ATOM 769 N THR A 48 -10.177 -5.198 1.553 1.00 0.00 N ATOM 770 CA THR A 48 -8.795 -4.904 1.933 1.00 0.00 C ATOM 771 C THR A 48 -7.930 -4.774 0.666 1.00 0.00 C ATOM 772 O THR A 48 -7.259 -3.762 0.449 1.00 0.00 O ATOM 773 CB THR A 48 -8.320 -6.056 2.844 1.00 0.00 C ATOM 774 OG1 THR A 48 -9.248 -6.303 3.887 1.00 0.00 O ATOM 775 CG2 THR A 48 -6.960 -5.812 3.497 1.00 0.00 C ATOM 0 H THR A 48 -10.504 -6.087 1.931 1.00 0.00 H new ATOM 0 HA THR A 48 -8.713 -3.960 2.472 1.00 0.00 H new ATOM 0 HB THR A 48 -8.235 -6.912 2.174 1.00 0.00 H new ATOM 0 HG1 THR A 48 -9.216 -7.250 4.135 1.00 0.00 H new ATOM 0 HG21 THR A 48 -6.697 -6.666 4.121 1.00 0.00 H new ATOM 0 HG22 THR A 48 -6.203 -5.681 2.724 1.00 0.00 H new ATOM 0 HG23 THR A 48 -7.008 -4.914 4.113 1.00 0.00 H new ATOM 783 N GLY A 49 -7.982 -5.785 -0.205 1.00 0.00 N ATOM 784 CA GLY A 49 -7.320 -5.805 -1.499 1.00 0.00 C ATOM 785 C GLY A 49 -7.907 -4.774 -2.447 1.00 0.00 C ATOM 786 O GLY A 49 -7.150 -4.067 -3.100 1.00 0.00 O ATOM 0 H GLY A 49 -8.506 -6.639 -0.016 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.255 -5.612 -1.366 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.412 -6.798 -1.939 1.00 0.00 H new ATOM 790 N CYS A 50 -9.233 -4.621 -2.503 1.00 0.00 N ATOM 791 CA CYS A 50 -9.886 -3.587 -3.293 1.00 0.00 C ATOM 792 C CYS A 50 -9.359 -2.199 -2.928 1.00 0.00 C ATOM 793 O CYS A 50 -9.100 -1.409 -3.832 1.00 0.00 O ATOM 794 CB CYS A 50 -11.403 -3.592 -3.086 1.00 0.00 C ATOM 795 SG CYS A 50 -12.402 -5.074 -3.476 1.00 0.00 S ATOM 0 H CYS A 50 -9.884 -5.219 -1.995 1.00 0.00 H new ATOM 0 HA CYS A 50 -9.661 -3.808 -4.336 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -11.583 -3.352 -2.038 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -11.808 -2.770 -3.675 1.00 0.00 H new ATOM 800 N ALA A 51 -9.203 -1.889 -1.634 1.00 0.00 N ATOM 801 CA ALA A 51 -8.675 -0.604 -1.204 1.00 0.00 C ATOM 802 C ALA A 51 -7.246 -0.434 -1.699 1.00 0.00 C ATOM 803 O ALA A 51 -6.966 0.585 -2.316 1.00 0.00 O ATOM 804 CB ALA A 51 -8.781 -0.453 0.322 1.00 0.00 C ATOM 0 H ALA A 51 -9.439 -2.521 -0.869 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.275 0.193 -1.644 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -8.380 0.516 0.620 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.827 -0.521 0.623 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.212 -1.246 0.807 1.00 0.00 H new ATOM 810 N ILE A 52 -6.362 -1.412 -1.485 1.00 0.00 N ATOM 811 CA ILE A 52 -4.992 -1.396 -2.000 1.00 0.00 C ATOM 812 C ILE A 52 -5.022 -1.127 -3.513 1.00 0.00 C ATOM 813 O ILE A 52 -4.445 -0.159 -3.980 1.00 0.00 O ATOM 814 CB ILE A 52 -4.289 -2.714 -1.609 1.00 0.00 C ATOM 815 CG1 ILE A 52 -4.162 -2.797 -0.072 1.00 0.00 C ATOM 816 CG2 ILE A 52 -2.895 -2.867 -2.245 1.00 0.00 C ATOM 817 CD1 ILE A 52 -3.835 -4.205 0.415 1.00 0.00 C ATOM 0 H ILE A 52 -6.581 -2.247 -0.942 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.407 -0.590 -1.557 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.907 -3.527 -1.991 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.383 -2.111 0.262 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -5.095 -2.466 0.384 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.454 -3.813 -1.931 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -2.987 -2.852 -3.331 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.256 -2.044 -1.923 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.757 -4.205 1.502 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.626 -4.889 0.108 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.888 -4.528 -0.016 1.00 0.00 H new ATOM 829 N MET A 53 -5.732 -1.944 -4.277 1.00 0.00 N ATOM 830 CA MET A 53 -5.776 -1.890 -5.731 1.00 0.00 C ATOM 831 C MET A 53 -6.355 -0.568 -6.259 1.00 0.00 C ATOM 832 O MET A 53 -5.871 -0.026 -7.243 1.00 0.00 O ATOM 833 CB MET A 53 -6.586 -3.110 -6.162 1.00 0.00 C ATOM 834 CG MET A 53 -6.689 -3.300 -7.668 1.00 0.00 C ATOM 835 SD MET A 53 -8.241 -2.692 -8.393 1.00 0.00 S ATOM 836 CE MET A 53 -9.469 -3.620 -7.441 1.00 0.00 C ATOM 0 H MET A 53 -6.313 -2.687 -3.889 1.00 0.00 H new ATOM 0 HA MET A 53 -4.773 -1.917 -6.157 1.00 0.00 H new ATOM 0 HB2 MET A 53 -6.135 -4.002 -5.726 1.00 0.00 H new ATOM 0 HB3 MET A 53 -7.592 -3.027 -5.750 1.00 0.00 H new ATOM 0 HG2 MET A 53 -5.853 -2.788 -8.145 1.00 0.00 H new ATOM 0 HG3 MET A 53 -6.586 -4.361 -7.897 1.00 0.00 H new ATOM 0 HE1 MET A 53 -10.393 -3.696 -8.015 1.00 0.00 H new ATOM 0 HE2 MET A 53 -9.088 -4.620 -7.232 1.00 0.00 H new ATOM 0 HE3 MET A 53 -9.667 -3.104 -6.502 1.00 0.00 H new ATOM 846 N CYS A 54 -7.363 0.006 -5.597 1.00 0.00 N ATOM 847 CA CYS A 54 -7.806 1.367 -5.898 1.00 0.00 C ATOM 848 C CYS A 54 -6.678 2.355 -5.618 1.00 0.00 C ATOM 849 O CYS A 54 -6.400 3.279 -6.385 1.00 0.00 O ATOM 850 CB CYS A 54 -9.008 1.711 -5.018 1.00 0.00 C ATOM 851 SG CYS A 54 -9.612 3.409 -5.208 1.00 0.00 S ATOM 0 H CYS A 54 -7.886 -0.451 -4.850 1.00 0.00 H new ATOM 0 HA CYS A 54 -8.085 1.430 -6.950 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -9.820 1.021 -5.247 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -8.737 1.549 -3.975 1.00 0.00 H new ATOM 856 N LEU A 55 -6.043 2.194 -4.462 1.00 0.00 N ATOM 857 CA LEU A 55 -5.020 3.110 -4.010 1.00 0.00 C ATOM 858 C LEU A 55 -3.771 3.121 -4.877 1.00 0.00 C ATOM 859 O LEU A 55 -3.079 4.141 -4.872 1.00 0.00 O ATOM 860 CB LEU A 55 -4.710 2.862 -2.532 1.00 0.00 C ATOM 861 CG LEU A 55 -5.848 3.399 -1.646 1.00 0.00 C ATOM 862 CD1 LEU A 55 -5.690 2.868 -0.227 1.00 0.00 C ATOM 863 CD2 LEU A 55 -5.870 4.925 -1.647 1.00 0.00 C ATOM 0 H LEU A 55 -6.227 1.425 -3.818 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.424 4.117 -4.116 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.577 1.795 -2.356 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.772 3.348 -2.264 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.798 3.052 -2.053 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.498 3.251 0.397 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.726 1.779 -0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.732 3.194 0.179 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.684 5.278 -1.013 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.922 5.303 -1.264 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.020 5.286 -2.664 1.00 0.00 H new ATOM 875 N SER A 56 -3.515 2.082 -5.676 1.00 0.00 N ATOM 876 CA SER A 56 -2.355 2.066 -6.555 1.00 0.00 C ATOM 877 C SER A 56 -2.501 3.113 -7.678 1.00 0.00 C ATOM 878 O SER A 56 -1.514 3.553 -8.260 1.00 0.00 O ATOM 879 CB SER A 56 -2.060 0.619 -7.005 1.00 0.00 C ATOM 880 OG SER A 56 -2.960 0.058 -7.924 1.00 0.00 O ATOM 0 H SER A 56 -4.097 1.246 -5.729 1.00 0.00 H new ATOM 0 HA SER A 56 -1.458 2.383 -6.023 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.063 0.594 -7.444 1.00 0.00 H new ATOM 0 HB3 SER A 56 -2.035 -0.016 -6.120 1.00 0.00 H new ATOM 0 HG SER A 56 -3.871 0.116 -7.567 1.00 0.00 H new ATOM 886 N THR A 57 -3.711 3.658 -7.888 1.00 0.00 N ATOM 887 CA THR A 57 -3.974 4.705 -8.877 1.00 0.00 C ATOM 888 C THR A 57 -4.427 6.012 -8.195 1.00 0.00 C ATOM 889 O THR A 57 -4.899 6.951 -8.837 1.00 0.00 O ATOM 890 CB THR A 57 -4.874 4.120 -9.989 1.00 0.00 C ATOM 891 OG1 THR A 57 -4.886 4.940 -11.144 1.00 0.00 O ATOM 892 CG2 THR A 57 -6.306 3.812 -9.545 1.00 0.00 C ATOM 0 H THR A 57 -4.541 3.377 -7.367 1.00 0.00 H new ATOM 0 HA THR A 57 -3.069 5.025 -9.394 1.00 0.00 H new ATOM 0 HB THR A 57 -4.416 3.162 -10.235 1.00 0.00 H new ATOM 0 HG1 THR A 57 -4.880 5.883 -10.876 1.00 0.00 H new ATOM 0 HG21 THR A 57 -6.868 3.406 -10.386 1.00 0.00 H new ATOM 0 HG22 THR A 57 -6.287 3.083 -8.735 1.00 0.00 H new ATOM 0 HG23 THR A 57 -6.784 4.728 -9.198 1.00 0.00 H new ATOM 900 N LYS A 58 -4.222 6.108 -6.877 1.00 0.00 N ATOM 901 CA LYS A 58 -4.538 7.271 -6.046 1.00 0.00 C ATOM 902 C LYS A 58 -3.285 7.824 -5.374 1.00 0.00 C ATOM 903 O LYS A 58 -3.412 8.562 -4.402 1.00 0.00 O ATOM 904 CB LYS A 58 -5.603 6.907 -5.002 1.00 0.00 C ATOM 905 CG LYS A 58 -6.981 6.550 -5.587 1.00 0.00 C ATOM 906 CD LYS A 58 -8.023 7.617 -5.267 1.00 0.00 C ATOM 907 CE LYS A 58 -9.401 7.140 -5.726 1.00 0.00 C ATOM 908 NZ LYS A 58 -9.657 7.319 -7.171 1.00 0.00 N ATOM 0 H LYS A 58 -3.814 5.344 -6.339 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.939 8.052 -6.692 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.243 6.062 -4.415 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.721 7.745 -4.316 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.899 6.434 -6.668 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.308 5.590 -5.188 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -8.035 7.819 -4.196 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.766 8.552 -5.765 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.508 6.084 -5.478 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -10.164 7.678 -5.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.276 8.143 -7.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.756 7.472 -7.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -10.120 6.468 -7.550 1.00 0.00 H new ATOM 922 N LEU A 59 -2.077 7.504 -5.849 1.00 0.00 N ATOM 923 CA LEU A 59 -0.826 8.031 -5.286 1.00 0.00 C ATOM 924 C LEU A 59 -0.881 9.550 -5.191 1.00 0.00 C ATOM 925 O LEU A 59 -0.449 10.096 -4.184 1.00 0.00 O ATOM 926 CB LEU A 59 0.405 7.607 -6.107 1.00 0.00 C ATOM 927 CG LEU A 59 0.464 6.121 -6.496 1.00 0.00 C ATOM 928 CD1 LEU A 59 1.649 5.884 -7.426 1.00 0.00 C ATOM 929 CD2 LEU A 59 0.558 5.201 -5.276 1.00 0.00 C ATOM 0 H LEU A 59 -1.937 6.871 -6.636 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.724 7.606 -4.287 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.435 8.204 -7.018 1.00 0.00 H new ATOM 0 HB3 LEU A 59 1.301 7.851 -5.537 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.467 5.876 -7.008 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.690 4.830 -7.701 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.533 6.490 -8.325 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.572 6.163 -6.917 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.597 4.163 -5.605 1.00 0.00 H new ATOM 0 HD22 LEU A 59 1.460 5.437 -4.711 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.316 5.348 -4.641 1.00 0.00 H new ATOM 941 N ASN A 60 -1.510 10.190 -6.181 1.00 0.00 N ATOM 942 CA ASN A 60 -1.743 11.625 -6.311 1.00 0.00 C ATOM 943 C ASN A 60 -2.549 12.227 -5.152 1.00 0.00 C ATOM 944 O ASN A 60 -2.543 13.440 -4.967 1.00 0.00 O ATOM 945 CB ASN A 60 -2.463 11.891 -7.648 1.00 0.00 C ATOM 946 CG ASN A 60 -3.820 11.192 -7.757 1.00 0.00 C ATOM 947 OD1 ASN A 60 -4.844 11.714 -7.342 1.00 0.00 O ATOM 948 ND2 ASN A 60 -3.871 9.980 -8.297 1.00 0.00 N ATOM 0 H ASN A 60 -1.898 9.675 -6.972 1.00 0.00 H new ATOM 0 HA ASN A 60 -0.769 12.114 -6.284 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -2.605 12.965 -7.768 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -1.825 11.560 -8.468 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -4.762 9.489 -8.364 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -3.019 9.540 -8.645 1.00 0.00 H new ATOM 955 N MET A 61 -3.264 11.411 -4.380 1.00 0.00 N ATOM 956 CA MET A 61 -4.011 11.817 -3.199 1.00 0.00 C ATOM 957 C MET A 61 -3.159 11.701 -1.943 1.00 0.00 C ATOM 958 O MET A 61 -3.460 12.367 -0.950 1.00 0.00 O ATOM 959 CB MET A 61 -5.226 10.894 -3.024 1.00 0.00 C ATOM 960 CG MET A 61 -6.218 11.012 -4.180 1.00 0.00 C ATOM 961 SD MET A 61 -7.144 12.569 -4.187 1.00 0.00 S ATOM 962 CE MET A 61 -8.114 12.362 -2.669 1.00 0.00 C ATOM 0 H MET A 61 -3.340 10.412 -4.570 1.00 0.00 H new ATOM 0 HA MET A 61 -4.317 12.854 -3.337 1.00 0.00 H new ATOM 0 HB2 MET A 61 -4.886 9.861 -2.944 1.00 0.00 H new ATOM 0 HB3 MET A 61 -5.731 11.136 -2.089 1.00 0.00 H new ATOM 0 HG2 MET A 61 -5.678 10.916 -5.122 1.00 0.00 H new ATOM 0 HG3 MET A 61 -6.922 10.181 -4.130 1.00 0.00 H new ATOM 0 HE1 MET A 61 -8.914 13.102 -2.645 1.00 0.00 H new ATOM 0 HE2 MET A 61 -8.544 11.361 -2.646 1.00 0.00 H new ATOM 0 HE3 MET A 61 -7.467 12.499 -1.802 1.00 0.00 H new ATOM 972 N LEU A 62 -2.174 10.800 -1.935 1.00 0.00 N ATOM 973 CA LEU A 62 -1.396 10.400 -0.796 1.00 0.00 C ATOM 974 C LEU A 62 -0.239 11.359 -0.610 1.00 0.00 C ATOM 975 O LEU A 62 -0.169 12.026 0.421 1.00 0.00 O ATOM 976 CB LEU A 62 -0.949 8.949 -1.024 1.00 0.00 C ATOM 977 CG LEU A 62 -2.118 7.987 -1.258 1.00 0.00 C ATOM 978 CD1 LEU A 62 -1.586 6.631 -1.696 1.00 0.00 C ATOM 979 CD2 LEU A 62 -2.977 7.829 0.000 1.00 0.00 C ATOM 0 H LEU A 62 -1.894 10.309 -2.784 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.975 10.437 0.127 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.279 8.913 -1.883 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.377 8.612 -0.160 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.749 8.406 -2.042 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.420 5.949 -1.862 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.020 6.744 -2.621 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.936 6.227 -0.920 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -3.796 7.140 -0.203 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -2.365 7.436 0.812 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -3.382 8.799 0.288 1.00 0.00 H new ATOM 991 N ASP A 63 0.627 11.366 -1.617 1.00 0.00 N ATOM 992 CA ASP A 63 1.915 11.995 -1.770 1.00 0.00 C ATOM 993 C ASP A 63 2.041 13.471 -1.352 1.00 0.00 C ATOM 994 O ASP A 63 1.818 14.368 -2.160 1.00 0.00 O ATOM 995 CB ASP A 63 2.306 11.631 -3.200 1.00 0.00 C ATOM 996 CG ASP A 63 1.756 12.498 -4.343 1.00 0.00 C ATOM 997 OD1 ASP A 63 0.558 12.872 -4.344 1.00 0.00 O ATOM 998 OD2 ASP A 63 2.491 12.734 -5.323 1.00 0.00 O ATOM 0 H ASP A 63 0.396 10.850 -2.466 1.00 0.00 H new ATOM 0 HA ASP A 63 2.638 11.625 -1.043 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.394 11.647 -3.263 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.992 10.603 -3.380 1.00 0.00 H new ATOM 1003 N PRO A 64 2.441 13.778 -0.097 1.00 0.00 N ATOM 1004 CA PRO A 64 2.487 15.157 0.375 1.00 0.00 C ATOM 1005 C PRO A 64 3.569 15.964 -0.349 1.00 0.00 C ATOM 1006 O PRO A 64 3.300 17.051 -0.870 1.00 0.00 O ATOM 1007 CB PRO A 64 2.711 15.058 1.887 1.00 0.00 C ATOM 1008 CG PRO A 64 3.440 13.731 2.076 1.00 0.00 C ATOM 1009 CD PRO A 64 2.881 12.861 0.956 1.00 0.00 C ATOM 0 HA PRO A 64 1.566 15.699 0.161 1.00 0.00 H new ATOM 0 HB2 PRO A 64 3.305 15.894 2.256 1.00 0.00 H new ATOM 0 HB3 PRO A 64 1.766 15.073 2.431 1.00 0.00 H new ATOM 0 HG2 PRO A 64 4.520 13.850 1.992 1.00 0.00 H new ATOM 0 HG3 PRO A 64 3.242 13.300 3.057 1.00 0.00 H new ATOM 0 HD2 PRO A 64 3.640 12.175 0.581 1.00 0.00 H new ATOM 0 HD3 PRO A 64 2.050 12.253 1.314 1.00 0.00 H new ATOM 1017 N GLU A 65 4.794 15.445 -0.391 1.00 0.00 N ATOM 1018 CA GLU A 65 5.936 16.100 -1.021 1.00 0.00 C ATOM 1019 C GLU A 65 5.904 15.968 -2.545 1.00 0.00 C ATOM 1020 O GLU A 65 6.773 16.496 -3.237 1.00 0.00 O ATOM 1021 CB GLU A 65 7.232 15.473 -0.507 1.00 0.00 C ATOM 1022 CG GLU A 65 7.448 15.667 0.993 1.00 0.00 C ATOM 1023 CD GLU A 65 8.797 15.092 1.411 1.00 0.00 C ATOM 1024 OE1 GLU A 65 8.831 13.869 1.675 1.00 0.00 O ATOM 1025 OE2 GLU A 65 9.809 15.828 1.405 1.00 0.00 O ATOM 0 H GLU A 65 5.024 14.540 0.020 1.00 0.00 H new ATOM 0 HA GLU A 65 5.886 17.158 -0.766 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.224 14.406 -0.730 1.00 0.00 H new ATOM 0 HB3 GLU A 65 8.075 15.905 -1.047 1.00 0.00 H new ATOM 0 HG2 GLU A 65 7.405 16.728 1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 65 6.648 15.178 1.549 1.00 0.00 H new ATOM 1032 N GLY A 66 4.945 15.220 -3.083 1.00 0.00 N ATOM 1033 CA GLY A 66 4.894 14.913 -4.497 1.00 0.00 C ATOM 1034 C GLY A 66 6.090 14.061 -4.903 1.00 0.00 C ATOM 1035 O GLY A 66 6.725 14.350 -5.912 1.00 0.00 O ATOM 0 H GLY A 66 4.182 14.811 -2.543 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.969 14.384 -4.727 1.00 0.00 H new ATOM 0 HA3 GLY A 66 4.885 15.837 -5.075 1.00 0.00 H new ATOM 1039 N ASN A 67 6.429 13.048 -4.099 1.00 0.00 N ATOM 1040 CA ASN A 67 7.612 12.186 -4.261 1.00 0.00 C ATOM 1041 C ASN A 67 7.237 10.716 -4.483 1.00 0.00 C ATOM 1042 O ASN A 67 8.121 9.864 -4.594 1.00 0.00 O ATOM 1043 CB ASN A 67 8.540 12.338 -3.032 1.00 0.00 C ATOM 1044 CG ASN A 67 9.591 13.431 -3.169 1.00 0.00 C ATOM 1045 OD1 ASN A 67 10.791 13.189 -3.069 1.00 0.00 O ATOM 1046 ND2 ASN A 67 9.169 14.668 -3.362 1.00 0.00 N ATOM 0 H ASN A 67 5.868 12.794 -3.286 1.00 0.00 H new ATOM 0 HA ASN A 67 8.141 12.511 -5.157 1.00 0.00 H new ATOM 0 HB2 ASN A 67 7.929 12.547 -2.154 1.00 0.00 H new ATOM 0 HB3 ASN A 67 9.043 11.388 -2.852 1.00 0.00 H new ATOM 0 HD21 ASN A 67 9.842 15.432 -3.429 1.00 0.00 H new ATOM 0 HD22 ASN A 67 8.170 14.859 -3.444 1.00 0.00 H new ATOM 1053 N LEU A 68 5.939 10.398 -4.551 1.00 0.00 N ATOM 1054 CA LEU A 68 5.446 9.039 -4.744 1.00 0.00 C ATOM 1055 C LEU A 68 4.667 8.978 -6.044 1.00 0.00 C ATOM 1056 O LEU A 68 3.598 9.585 -6.150 1.00 0.00 O ATOM 1057 CB LEU A 68 4.549 8.636 -3.574 1.00 0.00 C ATOM 1058 CG LEU A 68 3.953 7.231 -3.736 1.00 0.00 C ATOM 1059 CD1 LEU A 68 5.023 6.145 -3.756 1.00 0.00 C ATOM 1060 CD2 LEU A 68 2.990 6.997 -2.585 1.00 0.00 C ATOM 0 H LEU A 68 5.195 11.091 -4.472 1.00 0.00 H new ATOM 0 HA LEU A 68 6.287 8.347 -4.789 1.00 0.00 H new ATOM 0 HB2 LEU A 68 5.125 8.676 -2.650 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.740 9.360 -3.477 1.00 0.00 H new ATOM 0 HG LEU A 68 3.438 7.176 -4.695 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.550 5.170 -3.872 1.00 0.00 H new ATOM 0 HD12 LEU A 68 5.703 6.320 -4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.582 6.168 -2.820 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.550 6.004 -2.675 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.528 7.072 -1.640 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.200 7.747 -2.613 1.00 0.00 H new ATOM 1072 N HIS A 69 5.197 8.275 -7.037 1.00 0.00 N ATOM 1073 CA HIS A 69 4.664 8.269 -8.386 1.00 0.00 C ATOM 1074 C HIS A 69 4.604 6.843 -8.930 1.00 0.00 C ATOM 1075 O HIS A 69 5.233 5.927 -8.398 1.00 0.00 O ATOM 1076 CB HIS A 69 5.559 9.147 -9.261 1.00 0.00 C ATOM 1077 CG HIS A 69 5.743 10.576 -8.797 1.00 0.00 C ATOM 1078 ND1 HIS A 69 4.789 11.393 -8.224 1.00 0.00 N ATOM 1079 CD2 HIS A 69 6.898 11.304 -8.895 1.00 0.00 C ATOM 1080 CE1 HIS A 69 5.349 12.593 -8.013 1.00 0.00 C ATOM 1081 NE2 HIS A 69 6.619 12.597 -8.448 1.00 0.00 N ATOM 0 H HIS A 69 6.021 7.685 -6.922 1.00 0.00 H new ATOM 0 HA HIS A 69 3.648 8.664 -8.388 1.00 0.00 H new ATOM 0 HB2 HIS A 69 6.541 8.678 -9.328 1.00 0.00 H new ATOM 0 HB3 HIS A 69 5.144 9.164 -10.269 1.00 0.00 H new ATOM 0 HD2 HIS A 69 7.851 10.944 -9.253 1.00 0.00 H new ATOM 0 HE1 HIS A 69 4.850 13.436 -7.558 1.00 0.00 H new ATOM 0 HE2 HIS A 69 7.258 13.392 -8.451 1.00 0.00 H new ATOM 1089 N HIS A 70 3.837 6.665 -10.003 1.00 0.00 N ATOM 1090 CA HIS A 70 3.578 5.377 -10.638 1.00 0.00 C ATOM 1091 C HIS A 70 4.890 4.887 -11.267 1.00 0.00 C ATOM 1092 O HIS A 70 5.474 5.599 -12.093 1.00 0.00 O ATOM 1093 CB HIS A 70 2.441 5.550 -11.665 1.00 0.00 C ATOM 1094 CG HIS A 70 1.584 4.341 -11.967 1.00 0.00 C ATOM 1095 ND1 HIS A 70 0.486 4.349 -12.797 1.00 0.00 N ATOM 1096 CD2 HIS A 70 1.702 3.073 -11.462 1.00 0.00 C ATOM 1097 CE1 HIS A 70 -0.044 3.115 -12.794 1.00 0.00 C ATOM 1098 NE2 HIS A 70 0.672 2.299 -12.006 1.00 0.00 N ATOM 0 H HIS A 70 3.364 7.439 -10.469 1.00 0.00 H new ATOM 0 HA HIS A 70 3.249 4.623 -9.923 1.00 0.00 H new ATOM 0 HB2 HIS A 70 1.786 6.347 -11.311 1.00 0.00 H new ATOM 0 HB3 HIS A 70 2.882 5.892 -12.601 1.00 0.00 H new ATOM 0 HD2 HIS A 70 2.456 2.732 -10.768 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -0.923 2.821 -13.348 1.00 0.00 H new ATOM 0 HE2 HIS A 70 0.499 1.308 -11.837 1.00 0.00 H new ATOM 1106 N GLY A 71 5.394 3.727 -10.834 1.00 0.00 N ATOM 1107 CA GLY A 71 6.697 3.210 -11.240 1.00 0.00 C ATOM 1108 C GLY A 71 7.872 4.036 -10.698 1.00 0.00 C ATOM 1109 O GLY A 71 9.009 3.861 -11.158 1.00 0.00 O ATOM 0 H GLY A 71 4.899 3.116 -10.184 1.00 0.00 H new ATOM 0 HA2 GLY A 71 6.796 2.181 -10.895 1.00 0.00 H new ATOM 0 HA3 GLY A 71 6.749 3.188 -12.329 1.00 0.00 H new ATOM 1113 N ASN A 72 7.640 4.970 -9.764 1.00 0.00 N ATOM 1114 CA ASN A 72 8.683 5.834 -9.220 1.00 0.00 C ATOM 1115 C ASN A 72 8.349 6.207 -7.775 1.00 0.00 C ATOM 1116 O ASN A 72 7.928 7.328 -7.487 1.00 0.00 O ATOM 1117 CB ASN A 72 8.904 7.066 -10.126 1.00 0.00 C ATOM 1118 CG ASN A 72 10.370 7.376 -10.371 1.00 0.00 C ATOM 1119 OD1 ASN A 72 11.269 7.005 -9.618 1.00 0.00 O ATOM 1120 ND2 ASN A 72 10.660 8.025 -11.486 1.00 0.00 N ATOM 0 H ASN A 72 6.717 5.143 -9.367 1.00 0.00 H new ATOM 0 HA ASN A 72 9.630 5.295 -9.203 1.00 0.00 H new ATOM 0 HB2 ASN A 72 8.411 6.898 -11.083 1.00 0.00 H new ATOM 0 HB3 ASN A 72 8.428 7.934 -9.670 1.00 0.00 H new ATOM 0 HD21 ASN A 72 11.632 8.220 -11.725 1.00 0.00 H new ATOM 0 HD22 ASN A 72 9.911 8.331 -12.108 1.00 0.00 H new ATOM 1127 N ALA A 73 8.540 5.280 -6.838 1.00 0.00 N ATOM 1128 CA ALA A 73 8.478 5.570 -5.407 1.00 0.00 C ATOM 1129 C ALA A 73 9.884 5.785 -4.829 1.00 0.00 C ATOM 1130 O ALA A 73 10.032 5.937 -3.621 1.00 0.00 O ATOM 1131 CB ALA A 73 7.727 4.437 -4.695 1.00 0.00 C ATOM 0 H ALA A 73 8.743 4.303 -7.051 1.00 0.00 H new ATOM 0 HA ALA A 73 7.931 6.499 -5.245 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.678 4.648 -3.627 1.00 0.00 H new ATOM 0 HB2 ALA A 73 6.717 4.361 -5.097 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.252 3.495 -4.855 1.00 0.00 H new ATOM 1137 N MET A 74 10.930 5.815 -5.662 1.00 0.00 N ATOM 1138 CA MET A 74 12.301 5.639 -5.219 1.00 0.00 C ATOM 1139 C MET A 74 12.810 6.890 -4.527 1.00 0.00 C ATOM 1140 O MET A 74 13.662 6.796 -3.644 1.00 0.00 O ATOM 1141 CB MET A 74 13.214 5.356 -6.413 1.00 0.00 C ATOM 1142 CG MET A 74 13.174 3.914 -6.912 1.00 0.00 C ATOM 1143 SD MET A 74 14.497 3.592 -8.111 1.00 0.00 S ATOM 1144 CE MET A 74 14.280 1.807 -8.304 1.00 0.00 C ATOM 0 H MET A 74 10.839 5.964 -6.667 1.00 0.00 H new ATOM 0 HA MET A 74 12.314 4.800 -4.524 1.00 0.00 H new ATOM 0 HB2 MET A 74 12.935 6.019 -7.232 1.00 0.00 H new ATOM 0 HB3 MET A 74 14.239 5.604 -6.137 1.00 0.00 H new ATOM 0 HG2 MET A 74 13.272 3.232 -6.067 1.00 0.00 H new ATOM 0 HG3 MET A 74 12.207 3.713 -7.373 1.00 0.00 H new ATOM 0 HE1 MET A 74 15.015 1.426 -9.013 1.00 0.00 H new ATOM 0 HE2 MET A 74 14.418 1.317 -7.340 1.00 0.00 H new ATOM 0 HE3 MET A 74 13.276 1.601 -8.676 1.00 0.00 H new ATOM 1154 N GLU A 75 12.350 8.080 -4.926 1.00 0.00 N ATOM 1155 CA GLU A 75 12.752 9.275 -4.210 1.00 0.00 C ATOM 1156 C GLU A 75 12.163 9.243 -2.803 1.00 0.00 C ATOM 1157 O GLU A 75 12.941 9.381 -1.863 1.00 0.00 O ATOM 1158 CB GLU A 75 12.407 10.568 -4.958 1.00 0.00 C ATOM 1159 CG GLU A 75 13.458 10.945 -6.015 1.00 0.00 C ATOM 1160 CD GLU A 75 13.397 12.429 -6.416 1.00 0.00 C ATOM 1161 OE1 GLU A 75 14.075 13.268 -5.767 1.00 0.00 O ATOM 1162 OE2 GLU A 75 12.748 12.783 -7.424 1.00 0.00 O ATOM 0 H GLU A 75 11.721 8.232 -5.714 1.00 0.00 H new ATOM 0 HA GLU A 75 13.840 9.277 -4.137 1.00 0.00 H new ATOM 0 HB2 GLU A 75 11.437 10.454 -5.442 1.00 0.00 H new ATOM 0 HB3 GLU A 75 12.312 11.383 -4.240 1.00 0.00 H new ATOM 0 HG2 GLU A 75 14.452 10.719 -5.629 1.00 0.00 H new ATOM 0 HG3 GLU A 75 13.312 10.328 -6.902 1.00 0.00 H new ATOM 1169 N PHE A 76 10.855 9.014 -2.662 1.00 0.00 N ATOM 1170 CA PHE A 76 10.156 8.819 -1.392 1.00 0.00 C ATOM 1171 C PHE A 76 10.882 7.756 -0.548 1.00 0.00 C ATOM 1172 O PHE A 76 11.257 8.031 0.594 1.00 0.00 O ATOM 1173 CB PHE A 76 8.679 8.517 -1.728 1.00 0.00 C ATOM 1174 CG PHE A 76 7.808 7.846 -0.685 1.00 0.00 C ATOM 1175 CD1 PHE A 76 7.133 8.592 0.297 1.00 0.00 C ATOM 1176 CD2 PHE A 76 7.595 6.462 -0.769 1.00 0.00 C ATOM 1177 CE1 PHE A 76 6.276 7.943 1.214 1.00 0.00 C ATOM 1178 CE2 PHE A 76 6.734 5.816 0.133 1.00 0.00 C ATOM 1179 CZ PHE A 76 6.080 6.554 1.133 1.00 0.00 C ATOM 0 H PHE A 76 10.229 8.957 -3.465 1.00 0.00 H new ATOM 0 HA PHE A 76 10.164 9.706 -0.759 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.203 9.461 -1.995 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.666 7.890 -2.619 1.00 0.00 H new ATOM 0 HD1 PHE A 76 7.270 9.662 0.351 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.097 5.888 -1.534 1.00 0.00 H new ATOM 0 HE1 PHE A 76 5.771 8.515 1.978 1.00 0.00 H new ATOM 0 HE2 PHE A 76 6.575 4.750 0.058 1.00 0.00 H new ATOM 0 HZ PHE A 76 5.429 6.056 1.837 1.00 0.00 H new ATOM 1189 N ALA A 77 11.181 6.595 -1.139 1.00 0.00 N ATOM 1190 CA ALA A 77 11.944 5.519 -0.525 1.00 0.00 C ATOM 1191 C ALA A 77 13.263 6.038 0.050 1.00 0.00 C ATOM 1192 O ALA A 77 13.534 5.876 1.246 1.00 0.00 O ATOM 1193 CB ALA A 77 12.200 4.405 -1.555 1.00 0.00 C ATOM 0 H ALA A 77 10.885 6.377 -2.091 1.00 0.00 H new ATOM 0 HA ALA A 77 11.362 5.110 0.301 1.00 0.00 H new ATOM 0 HB1 ALA A 77 12.772 3.603 -1.089 1.00 0.00 H new ATOM 0 HB2 ALA A 77 11.247 4.012 -1.911 1.00 0.00 H new ATOM 0 HB3 ALA A 77 12.763 4.810 -2.396 1.00 0.00 H new ATOM 1199 N LYS A 78 14.091 6.683 -0.782 1.00 0.00 N ATOM 1200 CA LYS A 78 15.414 7.162 -0.389 1.00 0.00 C ATOM 1201 C LYS A 78 15.324 8.103 0.804 1.00 0.00 C ATOM 1202 O LYS A 78 16.100 7.955 1.760 1.00 0.00 O ATOM 1203 CB LYS A 78 16.105 7.804 -1.603 1.00 0.00 C ATOM 1204 CG LYS A 78 16.926 6.740 -2.347 1.00 0.00 C ATOM 1205 CD LYS A 78 17.527 7.241 -3.662 1.00 0.00 C ATOM 1206 CE LYS A 78 16.438 7.395 -4.725 1.00 0.00 C ATOM 1207 NZ LYS A 78 16.981 7.866 -6.013 1.00 0.00 N ATOM 0 H LYS A 78 13.856 6.886 -1.753 1.00 0.00 H new ATOM 0 HA LYS A 78 16.026 6.321 -0.062 1.00 0.00 H new ATOM 0 HB2 LYS A 78 15.361 8.237 -2.271 1.00 0.00 H new ATOM 0 HB3 LYS A 78 16.754 8.617 -1.278 1.00 0.00 H new ATOM 0 HG2 LYS A 78 17.730 6.394 -1.698 1.00 0.00 H new ATOM 0 HG3 LYS A 78 16.289 5.879 -2.552 1.00 0.00 H new ATOM 0 HD2 LYS A 78 18.023 8.198 -3.500 1.00 0.00 H new ATOM 0 HD3 LYS A 78 18.287 6.542 -4.011 1.00 0.00 H new ATOM 0 HE2 LYS A 78 15.938 6.438 -4.872 1.00 0.00 H new ATOM 0 HE3 LYS A 78 15.684 8.098 -4.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 16.208 7.956 -6.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 17.436 8.792 -5.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 17.682 7.183 -6.365 1.00 0.00 H new ATOM 1221 N LYS A 79 14.364 9.030 0.787 1.00 0.00 N ATOM 1222 CA LYS A 79 14.150 9.975 1.875 1.00 0.00 C ATOM 1223 C LYS A 79 13.782 9.299 3.179 1.00 0.00 C ATOM 1224 O LYS A 79 14.045 9.887 4.233 1.00 0.00 O ATOM 1225 CB LYS A 79 13.100 11.015 1.483 1.00 0.00 C ATOM 1226 CG LYS A 79 13.669 11.785 0.289 1.00 0.00 C ATOM 1227 CD LYS A 79 12.974 13.091 -0.047 1.00 0.00 C ATOM 1228 CE LYS A 79 13.491 13.464 -1.442 1.00 0.00 C ATOM 1229 NZ LYS A 79 13.096 14.815 -1.849 1.00 0.00 N ATOM 0 H LYS A 79 13.711 9.143 0.011 1.00 0.00 H new ATOM 0 HA LYS A 79 15.101 10.479 2.047 1.00 0.00 H new ATOM 0 HB2 LYS A 79 12.158 10.534 1.220 1.00 0.00 H new ATOM 0 HB3 LYS A 79 12.893 11.688 2.315 1.00 0.00 H new ATOM 0 HG2 LYS A 79 14.721 11.995 0.484 1.00 0.00 H new ATOM 0 HG3 LYS A 79 13.630 11.139 -0.588 1.00 0.00 H new ATOM 0 HD2 LYS A 79 11.890 12.974 -0.045 1.00 0.00 H new ATOM 0 HD3 LYS A 79 13.212 13.865 0.683 1.00 0.00 H new ATOM 0 HE2 LYS A 79 14.578 13.389 -1.454 1.00 0.00 H new ATOM 0 HE3 LYS A 79 13.114 12.745 -2.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 13.842 15.231 -2.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 12.209 14.769 -2.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 12.957 15.405 -1.004 1.00 0.00 H new ATOM 1243 N HIS A 80 13.201 8.099 3.143 1.00 0.00 N ATOM 1244 CA HIS A 80 12.769 7.419 4.351 1.00 0.00 C ATOM 1245 C HIS A 80 13.742 6.289 4.707 1.00 0.00 C ATOM 1246 O HIS A 80 13.548 5.596 5.701 1.00 0.00 O ATOM 1247 CB HIS A 80 11.298 7.028 4.183 1.00 0.00 C ATOM 1248 CG HIS A 80 10.386 8.202 3.870 1.00 0.00 C ATOM 1249 ND1 HIS A 80 9.108 8.115 3.376 1.00 0.00 N ATOM 1250 CD2 HIS A 80 10.667 9.542 3.982 1.00 0.00 C ATOM 1251 CE1 HIS A 80 8.657 9.359 3.171 1.00 0.00 C ATOM 1252 NE2 HIS A 80 9.570 10.268 3.530 1.00 0.00 N ATOM 0 H HIS A 80 13.021 7.581 2.283 1.00 0.00 H new ATOM 0 HA HIS A 80 12.804 8.066 5.227 1.00 0.00 H new ATOM 0 HB2 HIS A 80 11.216 6.292 3.383 1.00 0.00 H new ATOM 0 HB3 HIS A 80 10.953 6.545 5.097 1.00 0.00 H new ATOM 0 HD1 HIS A 80 8.592 7.253 3.197 1.00 0.00 H new ATOM 0 HD2 HIS A 80 11.588 9.962 4.359 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.684 9.597 2.768 1.00 0.00 H new ATOM 1260 N GLY A 81 14.829 6.166 3.951 1.00 0.00 N ATOM 1261 CA GLY A 81 16.034 5.421 4.262 1.00 0.00 C ATOM 1262 C GLY A 81 16.219 4.182 3.409 1.00 0.00 C ATOM 1263 O GLY A 81 17.168 3.434 3.641 1.00 0.00 O ATOM 0 H GLY A 81 14.890 6.620 3.039 1.00 0.00 H new ATOM 0 HA2 GLY A 81 16.898 6.073 4.133 1.00 0.00 H new ATOM 0 HA3 GLY A 81 16.010 5.129 5.312 1.00 0.00 H new ATOM 1267 N ALA A 82 15.346 3.974 2.428 1.00 0.00 N ATOM 1268 CA ALA A 82 15.391 2.832 1.531 1.00 0.00 C ATOM 1269 C ALA A 82 16.141 3.221 0.256 1.00 0.00 C ATOM 1270 O ALA A 82 15.599 3.913 -0.609 1.00 0.00 O ATOM 1271 CB ALA A 82 13.977 2.313 1.263 1.00 0.00 C ATOM 0 H ALA A 82 14.573 4.610 2.233 1.00 0.00 H new ATOM 0 HA ALA A 82 15.937 2.008 1.991 1.00 0.00 H new ATOM 0 HB1 ALA A 82 14.025 1.457 0.589 1.00 0.00 H new ATOM 0 HB2 ALA A 82 13.517 2.009 2.203 1.00 0.00 H new ATOM 0 HB3 ALA A 82 13.380 3.102 0.805 1.00 0.00 H new ATOM 1277 N ASP A 83 17.408 2.816 0.172 1.00 0.00 N ATOM 1278 CA ASP A 83 18.271 2.986 -0.992 1.00 0.00 C ATOM 1279 C ASP A 83 17.764 2.179 -2.185 1.00 0.00 C ATOM 1280 O ASP A 83 16.726 1.518 -2.148 1.00 0.00 O ATOM 1281 CB ASP A 83 19.715 2.554 -0.677 1.00 0.00 C ATOM 1282 CG ASP A 83 19.801 1.208 0.016 1.00 0.00 C ATOM 1283 OD1 ASP A 83 19.746 0.175 -0.665 1.00 0.00 O ATOM 1284 OD2 ASP A 83 19.925 1.217 1.271 1.00 0.00 O ATOM 0 H ASP A 83 17.878 2.342 0.944 1.00 0.00 H new ATOM 0 HA ASP A 83 18.255 4.046 -1.245 1.00 0.00 H new ATOM 0 HB2 ASP A 83 20.285 2.514 -1.605 1.00 0.00 H new ATOM 0 HB3 ASP A 83 20.184 3.310 -0.047 1.00 0.00 H new ATOM 1289 N GLU A 84 18.490 2.253 -3.293 1.00 0.00 N ATOM 1290 CA GLU A 84 18.143 1.658 -4.578 1.00 0.00 C ATOM 1291 C GLU A 84 18.119 0.137 -4.479 1.00 0.00 C ATOM 1292 O GLU A 84 17.288 -0.510 -5.118 1.00 0.00 O ATOM 1293 CB GLU A 84 19.176 2.071 -5.641 1.00 0.00 C ATOM 1294 CG GLU A 84 19.440 3.575 -5.636 1.00 0.00 C ATOM 1295 CD GLU A 84 20.435 4.061 -6.695 1.00 0.00 C ATOM 1296 OE1 GLU A 84 21.403 3.346 -7.044 1.00 0.00 O ATOM 1297 OE2 GLU A 84 20.313 5.241 -7.100 1.00 0.00 O ATOM 0 H GLU A 84 19.379 2.753 -3.322 1.00 0.00 H new ATOM 0 HA GLU A 84 17.152 2.014 -4.861 1.00 0.00 H new ATOM 0 HB2 GLU A 84 20.111 1.539 -5.463 1.00 0.00 H new ATOM 0 HB3 GLU A 84 18.821 1.770 -6.626 1.00 0.00 H new ATOM 0 HG2 GLU A 84 18.493 4.095 -5.782 1.00 0.00 H new ATOM 0 HG3 GLU A 84 19.812 3.860 -4.652 1.00 0.00 H new ATOM 1304 N THR A 85 19.038 -0.439 -3.704 1.00 0.00 N ATOM 1305 CA THR A 85 19.011 -1.871 -3.412 1.00 0.00 C ATOM 1306 C THR A 85 17.810 -2.208 -2.530 1.00 0.00 C ATOM 1307 O THR A 85 17.125 -3.183 -2.836 1.00 0.00 O ATOM 1308 CB THR A 85 20.338 -2.365 -2.794 1.00 0.00 C ATOM 1309 OG1 THR A 85 21.241 -2.674 -3.836 1.00 0.00 O ATOM 1310 CG2 THR A 85 20.254 -3.640 -1.944 1.00 0.00 C ATOM 0 H THR A 85 19.810 0.065 -3.267 1.00 0.00 H new ATOM 0 HA THR A 85 18.900 -2.404 -4.356 1.00 0.00 H new ATOM 0 HB THR A 85 20.645 -1.548 -2.141 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.087 -2.987 -3.453 1.00 0.00 H new ATOM 0 HG21 THR A 85 21.245 -3.890 -1.564 1.00 0.00 H new ATOM 0 HG22 THR A 85 19.575 -3.475 -1.107 1.00 0.00 H new ATOM 0 HG23 THR A 85 19.883 -4.462 -2.556 1.00 0.00 H new ATOM 1318 N MET A 86 17.549 -1.459 -1.459 1.00 0.00 N ATOM 1319 CA MET A 86 16.459 -1.713 -0.533 1.00 0.00 C ATOM 1320 C MET A 86 15.114 -1.651 -1.256 1.00 0.00 C ATOM 1321 O MET A 86 14.272 -2.516 -1.041 1.00 0.00 O ATOM 1322 CB MET A 86 16.507 -0.673 0.588 1.00 0.00 C ATOM 1323 CG MET A 86 17.414 -1.064 1.755 1.00 0.00 C ATOM 1324 SD MET A 86 17.264 0.090 3.149 1.00 0.00 S ATOM 1325 CE MET A 86 18.642 -0.467 4.158 1.00 0.00 C ATOM 0 H MET A 86 18.106 -0.641 -1.210 1.00 0.00 H new ATOM 0 HA MET A 86 16.569 -2.712 -0.111 1.00 0.00 H new ATOM 0 HB2 MET A 86 16.850 0.276 0.176 1.00 0.00 H new ATOM 0 HB3 MET A 86 15.497 -0.511 0.964 1.00 0.00 H new ATOM 0 HG2 MET A 86 17.162 -2.071 2.089 1.00 0.00 H new ATOM 0 HG3 MET A 86 18.450 -1.091 1.416 1.00 0.00 H new ATOM 0 HE1 MET A 86 18.698 0.138 5.063 1.00 0.00 H new ATOM 0 HE2 MET A 86 18.495 -1.512 4.429 1.00 0.00 H new ATOM 0 HE3 MET A 86 19.570 -0.365 3.595 1.00 0.00 H new ATOM 1335 N ALA A 87 14.917 -0.653 -2.118 1.00 0.00 N ATOM 1336 CA ALA A 87 13.719 -0.557 -2.934 1.00 0.00 C ATOM 1337 C ALA A 87 13.650 -1.772 -3.858 1.00 0.00 C ATOM 1338 O ALA A 87 12.661 -2.498 -3.863 1.00 0.00 O ATOM 1339 CB ALA A 87 13.713 0.765 -3.705 1.00 0.00 C ATOM 0 H ALA A 87 15.583 0.105 -2.266 1.00 0.00 H new ATOM 0 HA ALA A 87 12.828 -0.560 -2.306 1.00 0.00 H new ATOM 0 HB1 ALA A 87 12.811 0.827 -4.314 1.00 0.00 H new ATOM 0 HB2 ALA A 87 13.734 1.597 -3.001 1.00 0.00 H new ATOM 0 HB3 ALA A 87 14.590 0.814 -4.350 1.00 0.00 H new ATOM 1345 N GLN A 88 14.725 -2.055 -4.605 1.00 0.00 N ATOM 1346 CA GLN A 88 14.773 -3.205 -5.504 1.00 0.00 C ATOM 1347 C GLN A 88 14.431 -4.515 -4.785 1.00 0.00 C ATOM 1348 O GLN A 88 13.755 -5.345 -5.382 1.00 0.00 O ATOM 1349 CB GLN A 88 16.145 -3.261 -6.188 1.00 0.00 C ATOM 1350 CG GLN A 88 16.295 -4.360 -7.252 1.00 0.00 C ATOM 1351 CD GLN A 88 15.383 -4.117 -8.452 1.00 0.00 C ATOM 1352 OE1 GLN A 88 15.481 -3.083 -9.111 1.00 0.00 O ATOM 1353 NE2 GLN A 88 14.460 -5.015 -8.752 1.00 0.00 N ATOM 0 H GLN A 88 15.578 -1.495 -4.601 1.00 0.00 H new ATOM 0 HA GLN A 88 14.007 -3.081 -6.270 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.342 -2.296 -6.654 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.909 -3.408 -5.425 1.00 0.00 H new ATOM 0 HG2 GLN A 88 17.332 -4.403 -7.586 1.00 0.00 H new ATOM 0 HG3 GLN A 88 16.063 -5.329 -6.809 1.00 0.00 H new ATOM 0 HE21 GLN A 88 14.383 -5.871 -8.202 1.00 0.00 H new ATOM 0 HE22 GLN A 88 13.825 -4.852 -9.533 1.00 0.00 H new ATOM 1362 N GLN A 89 14.861 -4.690 -3.532 1.00 0.00 N ATOM 1363 CA GLN A 89 14.547 -5.840 -2.694 1.00 0.00 C ATOM 1364 C GLN A 89 13.035 -6.015 -2.529 1.00 0.00 C ATOM 1365 O GLN A 89 12.558 -7.146 -2.440 1.00 0.00 O ATOM 1366 CB GLN A 89 15.229 -5.664 -1.319 1.00 0.00 C ATOM 1367 CG GLN A 89 16.503 -6.494 -1.145 1.00 0.00 C ATOM 1368 CD GLN A 89 16.255 -7.911 -0.625 1.00 0.00 C ATOM 1369 OE1 GLN A 89 15.129 -8.399 -0.526 1.00 0.00 O ATOM 1370 NE2 GLN A 89 17.314 -8.585 -0.219 1.00 0.00 N ATOM 0 H GLN A 89 15.457 -4.009 -3.062 1.00 0.00 H new ATOM 0 HA GLN A 89 14.925 -6.741 -3.177 1.00 0.00 H new ATOM 0 HB2 GLN A 89 15.472 -4.611 -1.178 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.521 -5.936 -0.536 1.00 0.00 H new ATOM 0 HG2 GLN A 89 17.019 -6.555 -2.103 1.00 0.00 H new ATOM 0 HG3 GLN A 89 17.170 -5.977 -0.456 1.00 0.00 H new ATOM 0 HE21 GLN A 89 18.244 -8.174 -0.304 1.00 0.00 H new ATOM 0 HE22 GLN A 89 17.203 -9.517 0.180 1.00 0.00 H new ATOM 1379 N LEU A 90 12.275 -4.929 -2.422 1.00 0.00 N ATOM 1380 CA LEU A 90 10.828 -4.970 -2.249 1.00 0.00 C ATOM 1381 C LEU A 90 10.130 -5.128 -3.593 1.00 0.00 C ATOM 1382 O LEU A 90 9.195 -5.913 -3.689 1.00 0.00 O ATOM 1383 CB LEU A 90 10.356 -3.689 -1.546 1.00 0.00 C ATOM 1384 CG LEU A 90 10.921 -3.508 -0.122 1.00 0.00 C ATOM 1385 CD1 LEU A 90 10.520 -2.129 0.415 1.00 0.00 C ATOM 1386 CD2 LEU A 90 10.482 -4.600 0.874 1.00 0.00 C ATOM 0 H LEU A 90 12.653 -3.982 -2.454 1.00 0.00 H new ATOM 0 HA LEU A 90 10.571 -5.831 -1.632 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.642 -2.829 -2.151 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.267 -3.695 -1.495 1.00 0.00 H new ATOM 0 HG LEU A 90 12.004 -3.596 -0.209 1.00 0.00 H new ATOM 0 HD11 LEU A 90 10.919 -2.000 1.421 1.00 0.00 H new ATOM 0 HD12 LEU A 90 10.923 -1.354 -0.237 1.00 0.00 H new ATOM 0 HD13 LEU A 90 9.433 -2.051 0.443 1.00 0.00 H new ATOM 0 HD21 LEU A 90 10.922 -4.400 1.851 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.395 -4.600 0.958 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.818 -5.574 0.518 1.00 0.00 H new ATOM 1398 N ILE A 91 10.608 -4.437 -4.620 1.00 0.00 N ATOM 1399 CA ILE A 91 10.064 -4.429 -5.976 1.00 0.00 C ATOM 1400 C ILE A 91 10.146 -5.838 -6.587 1.00 0.00 C ATOM 1401 O ILE A 91 9.220 -6.305 -7.254 1.00 0.00 O ATOM 1402 CB ILE A 91 10.866 -3.343 -6.734 1.00 0.00 C ATOM 1403 CG1 ILE A 91 10.427 -1.949 -6.207 1.00 0.00 C ATOM 1404 CG2 ILE A 91 10.833 -3.462 -8.268 1.00 0.00 C ATOM 1405 CD1 ILE A 91 11.452 -0.842 -6.413 1.00 0.00 C ATOM 0 H ILE A 91 11.427 -3.836 -4.527 1.00 0.00 H new ATOM 0 HA ILE A 91 9.003 -4.182 -6.022 1.00 0.00 H new ATOM 0 HB ILE A 91 11.923 -3.495 -6.518 1.00 0.00 H new ATOM 0 HG12 ILE A 91 9.499 -1.664 -6.702 1.00 0.00 H new ATOM 0 HG13 ILE A 91 10.208 -2.030 -5.142 1.00 0.00 H new ATOM 0 HG21 ILE A 91 11.423 -2.658 -8.708 1.00 0.00 H new ATOM 0 HG22 ILE A 91 11.250 -4.424 -8.567 1.00 0.00 H new ATOM 0 HG23 ILE A 91 9.803 -3.389 -8.617 1.00 0.00 H new ATOM 0 HD11 ILE A 91 11.061 0.095 -6.015 1.00 0.00 H new ATOM 0 HD12 ILE A 91 12.375 -1.100 -5.894 1.00 0.00 H new ATOM 0 HD13 ILE A 91 11.655 -0.727 -7.478 1.00 0.00 H new ATOM 1417 N ASP A 92 11.247 -6.555 -6.333 1.00 0.00 N ATOM 1418 CA ASP A 92 11.414 -7.943 -6.765 1.00 0.00 C ATOM 1419 C ASP A 92 10.321 -8.818 -6.169 1.00 0.00 C ATOM 1420 O ASP A 92 9.766 -9.675 -6.857 1.00 0.00 O ATOM 1421 CB ASP A 92 12.790 -8.467 -6.311 1.00 0.00 C ATOM 1422 CG ASP A 92 13.531 -9.294 -7.358 1.00 0.00 C ATOM 1423 OD1 ASP A 92 13.353 -10.532 -7.418 1.00 0.00 O ATOM 1424 OD2 ASP A 92 14.468 -8.749 -7.992 1.00 0.00 O ATOM 0 H ASP A 92 12.048 -6.186 -5.821 1.00 0.00 H new ATOM 0 HA ASP A 92 11.347 -7.980 -7.852 1.00 0.00 H new ATOM 0 HB2 ASP A 92 13.413 -7.618 -6.030 1.00 0.00 H new ATOM 0 HB3 ASP A 92 12.656 -9.074 -5.416 1.00 0.00 H new ATOM 1429 N ILE A 93 10.021 -8.592 -4.891 1.00 0.00 N ATOM 1430 CA ILE A 93 9.017 -9.288 -4.116 1.00 0.00 C ATOM 1431 C ILE A 93 7.603 -8.900 -4.533 1.00 0.00 C ATOM 1432 O ILE A 93 6.798 -9.816 -4.619 1.00 0.00 O ATOM 1433 CB ILE A 93 9.323 -9.046 -2.627 1.00 0.00 C ATOM 1434 CG1 ILE A 93 10.620 -9.833 -2.336 1.00 0.00 C ATOM 1435 CG2 ILE A 93 8.195 -9.450 -1.672 1.00 0.00 C ATOM 1436 CD1 ILE A 93 11.077 -9.703 -0.890 1.00 0.00 C ATOM 0 H ILE A 93 10.503 -7.877 -4.346 1.00 0.00 H new ATOM 0 HA ILE A 93 9.059 -10.361 -4.306 1.00 0.00 H new ATOM 0 HB ILE A 93 9.433 -7.976 -2.448 1.00 0.00 H new ATOM 0 HG12 ILE A 93 10.461 -10.886 -2.569 1.00 0.00 H new ATOM 0 HG13 ILE A 93 11.411 -9.477 -2.996 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.497 -9.245 -0.645 1.00 0.00 H new ATOM 0 HG22 ILE A 93 7.297 -8.879 -1.907 1.00 0.00 H new ATOM 0 HG23 ILE A 93 7.988 -10.514 -1.783 1.00 0.00 H new ATOM 0 HD11 ILE A 93 11.992 -10.277 -0.745 1.00 0.00 H new ATOM 0 HD12 ILE A 93 11.266 -8.654 -0.661 1.00 0.00 H new ATOM 0 HD13 ILE A 93 10.300 -10.085 -0.227 1.00 0.00 H new ATOM 1448 N VAL A 94 7.275 -7.637 -4.826 1.00 0.00 N ATOM 1449 CA VAL A 94 5.957 -7.289 -5.374 1.00 0.00 C ATOM 1450 C VAL A 94 5.730 -8.129 -6.620 1.00 0.00 C ATOM 1451 O VAL A 94 4.750 -8.879 -6.692 1.00 0.00 O ATOM 1452 CB VAL A 94 5.826 -5.773 -5.660 1.00 0.00 C ATOM 1453 CG1 VAL A 94 4.564 -5.388 -6.469 1.00 0.00 C ATOM 1454 CG2 VAL A 94 5.770 -5.044 -4.317 1.00 0.00 C ATOM 0 H VAL A 94 7.900 -6.841 -4.694 1.00 0.00 H new ATOM 0 HA VAL A 94 5.184 -7.510 -4.638 1.00 0.00 H new ATOM 0 HB VAL A 94 6.686 -5.489 -6.266 1.00 0.00 H new ATOM 0 HG11 VAL A 94 4.548 -4.310 -6.626 1.00 0.00 H new ATOM 0 HG12 VAL A 94 4.581 -5.895 -7.434 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.673 -5.688 -5.918 1.00 0.00 H new ATOM 0 HG21 VAL A 94 5.678 -3.972 -4.489 1.00 0.00 H new ATOM 0 HG22 VAL A 94 4.910 -5.396 -3.748 1.00 0.00 H new ATOM 0 HG23 VAL A 94 6.683 -5.244 -3.756 1.00 0.00 H new ATOM 1464 N HIS A 95 6.666 -8.073 -7.568 1.00 0.00 N ATOM 1465 CA HIS A 95 6.461 -8.741 -8.837 1.00 0.00 C ATOM 1466 C HIS A 95 6.605 -10.254 -8.685 1.00 0.00 C ATOM 1467 O HIS A 95 6.053 -11.008 -9.479 1.00 0.00 O ATOM 1468 CB HIS A 95 7.433 -8.135 -9.841 1.00 0.00 C ATOM 1469 CG HIS A 95 7.204 -6.656 -10.071 1.00 0.00 C ATOM 1470 ND1 HIS A 95 8.150 -5.761 -10.514 1.00 0.00 N ATOM 1471 CD2 HIS A 95 6.038 -5.957 -9.875 1.00 0.00 C ATOM 1472 CE1 HIS A 95 7.560 -4.556 -10.595 1.00 0.00 C ATOM 1473 NE2 HIS A 95 6.258 -4.642 -10.289 1.00 0.00 N ATOM 0 H HIS A 95 7.554 -7.580 -7.478 1.00 0.00 H new ATOM 0 HA HIS A 95 5.446 -8.588 -9.204 1.00 0.00 H new ATOM 0 HB2 HIS A 95 8.453 -8.288 -9.488 1.00 0.00 H new ATOM 0 HB3 HIS A 95 7.341 -8.663 -10.790 1.00 0.00 H new ATOM 0 HD2 HIS A 95 5.117 -6.353 -9.473 1.00 0.00 H new ATOM 0 HE1 HIS A 95 8.066 -3.642 -10.869 1.00 0.00 H new ATOM 0 HE2 HIS A 95 5.566 -3.895 -10.347 1.00 0.00 H new ATOM 1481 N GLY A 96 7.297 -10.703 -7.639 1.00 0.00 N ATOM 1482 CA GLY A 96 7.422 -12.099 -7.271 1.00 0.00 C ATOM 1483 C GLY A 96 6.191 -12.636 -6.540 1.00 0.00 C ATOM 1484 O GLY A 96 5.962 -13.850 -6.543 1.00 0.00 O ATOM 0 H GLY A 96 7.800 -10.079 -7.008 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.592 -12.692 -8.170 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.299 -12.225 -6.636 1.00 0.00 H new ATOM 1488 N CYS A 97 5.404 -11.750 -5.934 1.00 0.00 N ATOM 1489 CA CYS A 97 4.214 -12.048 -5.154 1.00 0.00 C ATOM 1490 C CYS A 97 2.992 -12.060 -6.048 1.00 0.00 C ATOM 1491 O CYS A 97 2.056 -12.798 -5.737 1.00 0.00 O ATOM 1492 CB CYS A 97 4.009 -11.031 -4.024 1.00 0.00 C ATOM 1493 SG CYS A 97 4.908 -11.412 -2.501 1.00 0.00 S ATOM 0 H CYS A 97 5.594 -10.749 -5.979 1.00 0.00 H new ATOM 0 HA CYS A 97 4.354 -13.032 -4.707 1.00 0.00 H new ATOM 0 HB2 CYS A 97 4.318 -10.047 -4.377 1.00 0.00 H new ATOM 0 HB3 CYS A 97 2.945 -10.968 -3.797 1.00 0.00 H new ATOM 1498 N GLU A 98 3.014 -11.340 -7.176 1.00 0.00 N ATOM 1499 CA GLU A 98 2.032 -11.524 -8.235 1.00 0.00 C ATOM 1500 C GLU A 98 1.949 -13.017 -8.605 1.00 0.00 C ATOM 1501 O GLU A 98 0.873 -13.528 -8.915 1.00 0.00 O ATOM 1502 CB GLU A 98 2.398 -10.717 -9.487 1.00 0.00 C ATOM 1503 CG GLU A 98 2.188 -9.209 -9.325 1.00 0.00 C ATOM 1504 CD GLU A 98 2.267 -8.473 -10.679 1.00 0.00 C ATOM 1505 OE1 GLU A 98 1.402 -8.720 -11.553 1.00 0.00 O ATOM 1506 OE2 GLU A 98 3.185 -7.645 -10.885 1.00 0.00 O ATOM 0 H GLU A 98 3.710 -10.621 -7.373 1.00 0.00 H new ATOM 0 HA GLU A 98 1.070 -11.169 -7.866 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.442 -10.905 -9.739 1.00 0.00 H new ATOM 0 HB3 GLU A 98 1.799 -11.071 -10.326 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.217 -9.024 -8.866 1.00 0.00 H new ATOM 0 HG3 GLU A 98 2.942 -8.807 -8.648 1.00 0.00 H new ATOM 1513 N LYS A 99 3.104 -13.702 -8.561 1.00 0.00 N ATOM 1514 CA LYS A 99 3.328 -15.069 -9.026 1.00 0.00 C ATOM 1515 C LYS A 99 2.827 -16.091 -8.020 1.00 0.00 C ATOM 1516 O LYS A 99 2.083 -17.010 -8.361 1.00 0.00 O ATOM 1517 CB LYS A 99 4.796 -15.350 -9.344 1.00 0.00 C ATOM 1518 CG LYS A 99 5.483 -14.184 -10.036 1.00 0.00 C ATOM 1519 CD LYS A 99 4.863 -13.761 -11.363 1.00 0.00 C ATOM 1520 CE LYS A 99 5.249 -14.767 -12.442 1.00 0.00 C ATOM 1521 NZ LYS A 99 4.140 -15.035 -13.366 1.00 0.00 N ATOM 0 H LYS A 99 3.952 -13.286 -8.176 1.00 0.00 H new ATOM 0 HA LYS A 99 2.757 -15.163 -9.950 1.00 0.00 H new ATOM 0 HB2 LYS A 99 5.325 -15.581 -8.420 1.00 0.00 H new ATOM 0 HB3 LYS A 99 4.863 -16.234 -9.979 1.00 0.00 H new ATOM 0 HG2 LYS A 99 5.478 -13.328 -9.362 1.00 0.00 H new ATOM 0 HG3 LYS A 99 6.526 -14.448 -10.208 1.00 0.00 H new ATOM 0 HD2 LYS A 99 3.778 -13.708 -11.270 1.00 0.00 H new ATOM 0 HD3 LYS A 99 5.209 -12.765 -11.638 1.00 0.00 H new ATOM 0 HE2 LYS A 99 6.104 -14.388 -13.002 1.00 0.00 H new ATOM 0 HE3 LYS A 99 5.563 -15.699 -11.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.445 -15.724 -14.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 3.332 -15.421 -12.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 3.856 -14.150 -13.834 1.00 0.00 H new ATOM 1535 N SER A 100 3.297 -15.981 -6.776 1.00 0.00 N ATOM 1536 CA SER A 100 2.962 -16.944 -5.744 1.00 0.00 C ATOM 1537 C SER A 100 1.483 -16.826 -5.363 1.00 0.00 C ATOM 1538 O SER A 100 0.862 -17.824 -4.983 1.00 0.00 O ATOM 1539 CB SER A 100 3.902 -16.749 -4.552 1.00 0.00 C ATOM 1540 OG SER A 100 3.827 -15.434 -4.051 1.00 0.00 O ATOM 0 H SER A 100 3.912 -15.229 -6.465 1.00 0.00 H new ATOM 0 HA SER A 100 3.103 -17.960 -6.114 1.00 0.00 H new ATOM 0 HB2 SER A 100 3.644 -17.456 -3.764 1.00 0.00 H new ATOM 0 HB3 SER A 100 4.926 -16.968 -4.854 1.00 0.00 H new ATOM 0 HG SER A 100 4.106 -15.425 -3.112 1.00 0.00 H new ATOM 1546 N THR A 101 0.897 -15.632 -5.481 1.00 0.00 N ATOM 1547 CA THR A 101 -0.546 -15.451 -5.465 1.00 0.00 C ATOM 1548 C THR A 101 -1.120 -16.187 -6.687 1.00 0.00 C ATOM 1549 O THR A 101 -0.566 -16.062 -7.778 1.00 0.00 O ATOM 1550 CB THR A 101 -0.857 -13.946 -5.508 1.00 0.00 C ATOM 1551 OG1 THR A 101 -0.194 -13.304 -4.442 1.00 0.00 O ATOM 1552 CG2 THR A 101 -2.341 -13.634 -5.357 1.00 0.00 C ATOM 0 H THR A 101 1.418 -14.762 -5.591 1.00 0.00 H new ATOM 0 HA THR A 101 -0.998 -15.859 -4.561 1.00 0.00 H new ATOM 0 HB THR A 101 -0.524 -13.594 -6.484 1.00 0.00 H new ATOM 0 HG1 THR A 101 0.587 -12.822 -4.785 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.492 -12.555 -5.396 1.00 0.00 H new ATOM 0 HG22 THR A 101 -2.897 -14.107 -6.166 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.698 -14.016 -4.400 1.00 0.00 H new ATOM 1560 N PRO A 102 -2.197 -16.977 -6.566 1.00 0.00 N ATOM 1561 CA PRO A 102 -2.856 -17.517 -7.741 1.00 0.00 C ATOM 1562 C PRO A 102 -3.500 -16.358 -8.511 1.00 0.00 C ATOM 1563 O PRO A 102 -4.144 -15.489 -7.921 1.00 0.00 O ATOM 1564 CB PRO A 102 -3.880 -18.511 -7.208 1.00 0.00 C ATOM 1565 CG PRO A 102 -4.234 -17.959 -5.825 1.00 0.00 C ATOM 1566 CD PRO A 102 -2.935 -17.300 -5.359 1.00 0.00 C ATOM 0 HA PRO A 102 -2.182 -18.019 -8.435 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -4.757 -18.568 -7.853 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -3.466 -19.517 -7.144 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -5.052 -17.241 -5.877 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -4.548 -18.751 -5.145 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -3.140 -16.403 -4.775 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -2.363 -17.973 -4.720 1.00 0.00 H new ATOM 1574 N ALA A 103 -3.321 -16.348 -9.829 1.00 0.00 N ATOM 1575 CA ALA A 103 -3.709 -15.256 -10.709 1.00 0.00 C ATOM 1576 C ALA A 103 -5.242 -15.195 -10.829 1.00 0.00 C ATOM 1577 O ALA A 103 -5.843 -15.904 -11.649 1.00 0.00 O ATOM 1578 CB ALA A 103 -2.985 -15.444 -12.046 1.00 0.00 C ATOM 0 H ALA A 103 -2.888 -17.126 -10.327 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.411 -14.288 -10.307 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.259 -14.637 -12.725 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.908 -15.429 -11.882 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -3.272 -16.400 -12.484 1.00 0.00 H new ATOM 1584 N ASN A 104 -5.865 -14.426 -9.935 1.00 0.00 N ATOM 1585 CA ASN A 104 -7.309 -14.370 -9.712 1.00 0.00 C ATOM 1586 C ASN A 104 -8.022 -13.656 -10.859 1.00 0.00 C ATOM 1587 O ASN A 104 -7.478 -12.790 -11.543 1.00 0.00 O ATOM 1588 CB ASN A 104 -7.614 -13.653 -8.389 1.00 0.00 C ATOM 1589 CG ASN A 104 -8.870 -14.154 -7.700 1.00 0.00 C ATOM 1590 OD1 ASN A 104 -9.952 -14.199 -8.273 1.00 0.00 O ATOM 1591 ND2 ASN A 104 -8.780 -14.533 -6.436 1.00 0.00 N ATOM 0 H ASN A 104 -5.352 -13.796 -9.318 1.00 0.00 H new ATOM 0 HA ASN A 104 -7.677 -15.395 -9.664 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -6.766 -13.777 -7.715 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -7.716 -12.585 -8.580 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -9.610 -14.861 -5.942 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -7.881 -14.497 -5.956 1.00 0.00 H new ATOM 1598 N ASP A 105 -9.288 -14.004 -11.021 1.00 0.00 N ATOM 1599 CA ASP A 105 -10.303 -13.302 -11.766 1.00 0.00 C ATOM 1600 C ASP A 105 -10.554 -11.901 -11.197 1.00 0.00 C ATOM 1601 O ASP A 105 -10.663 -10.923 -11.942 1.00 0.00 O ATOM 1602 CB ASP A 105 -11.559 -14.168 -11.680 1.00 0.00 C ATOM 1603 CG ASP A 105 -12.759 -13.678 -12.482 1.00 0.00 C ATOM 1604 OD1 ASP A 105 -12.612 -13.144 -13.600 1.00 0.00 O ATOM 1605 OD2 ASP A 105 -13.893 -13.966 -12.026 1.00 0.00 O ATOM 0 H ASP A 105 -9.655 -14.856 -10.597 1.00 0.00 H new ATOM 0 HA ASP A 105 -9.995 -13.149 -12.800 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.308 -15.174 -12.016 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -11.853 -14.246 -10.633 1.00 0.00 H new ATOM 1610 N ASP A 106 -10.578 -11.778 -9.862 1.00 0.00 N ATOM 1611 CA ASP A 106 -10.799 -10.486 -9.215 1.00 0.00 C ATOM 1612 C ASP A 106 -9.456 -9.848 -8.887 1.00 0.00 C ATOM 1613 O ASP A 106 -8.734 -10.356 -8.024 1.00 0.00 O ATOM 1614 CB ASP A 106 -11.591 -10.616 -7.909 1.00 0.00 C ATOM 1615 CG ASP A 106 -11.879 -9.233 -7.299 1.00 0.00 C ATOM 1616 OD1 ASP A 106 -11.640 -8.206 -7.974 1.00 0.00 O ATOM 1617 OD2 ASP A 106 -12.292 -9.154 -6.125 1.00 0.00 O ATOM 0 H ASP A 106 -10.447 -12.556 -9.216 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.374 -9.874 -9.910 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -12.530 -11.136 -8.099 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -11.029 -11.221 -7.198 1.00 0.00 H new ATOM 1622 N LYS A 107 -9.127 -8.718 -9.518 1.00 0.00 N ATOM 1623 CA LYS A 107 -7.926 -7.969 -9.190 1.00 0.00 C ATOM 1624 C LYS A 107 -7.895 -7.528 -7.730 1.00 0.00 C ATOM 1625 O LYS A 107 -6.807 -7.409 -7.179 1.00 0.00 O ATOM 1626 CB LYS A 107 -7.774 -6.768 -10.149 1.00 0.00 C ATOM 1627 CG LYS A 107 -6.371 -6.781 -10.756 1.00 0.00 C ATOM 1628 CD LYS A 107 -6.258 -7.896 -11.807 1.00 0.00 C ATOM 1629 CE LYS A 107 -6.536 -7.307 -13.189 1.00 0.00 C ATOM 1630 NZ LYS A 107 -6.180 -8.248 -14.268 1.00 0.00 N ATOM 0 H LYS A 107 -9.686 -8.304 -10.265 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.072 -8.634 -9.323 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -8.525 -6.820 -10.938 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -7.941 -5.835 -9.611 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.156 -5.816 -11.215 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -5.629 -6.934 -9.972 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.263 -8.339 -11.780 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -6.968 -8.693 -11.588 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -7.592 -7.047 -13.267 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.970 -6.383 -13.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -6.383 -7.812 -15.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -5.167 -8.477 -14.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -6.738 -9.120 -14.167 1.00 0.00 H new ATOM 1644 N CYS A 108 -9.043 -7.305 -7.090 1.00 0.00 N ATOM 1645 CA CYS A 108 -9.105 -6.923 -5.681 1.00 0.00 C ATOM 1646 C CYS A 108 -8.591 -8.060 -4.807 1.00 0.00 C ATOM 1647 O CYS A 108 -7.584 -7.923 -4.115 1.00 0.00 O ATOM 1648 CB CYS A 108 -10.531 -6.475 -5.343 1.00 0.00 C ATOM 1649 SG CYS A 108 -11.172 -6.689 -3.684 1.00 0.00 S ATOM 0 H CYS A 108 -9.957 -7.385 -7.536 1.00 0.00 H new ATOM 0 HA CYS A 108 -8.452 -6.074 -5.479 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -10.602 -5.414 -5.583 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -11.204 -7.001 -6.020 1.00 0.00 H new ATOM 1654 N ILE A 109 -9.300 -9.181 -4.816 1.00 0.00 N ATOM 1655 CA ILE A 109 -8.927 -10.401 -4.100 1.00 0.00 C ATOM 1656 C ILE A 109 -7.513 -10.872 -4.476 1.00 0.00 C ATOM 1657 O ILE A 109 -6.779 -11.335 -3.600 1.00 0.00 O ATOM 1658 CB ILE A 109 -10.047 -11.444 -4.346 1.00 0.00 C ATOM 1659 CG1 ILE A 109 -11.362 -10.959 -3.693 1.00 0.00 C ATOM 1660 CG2 ILE A 109 -9.671 -12.818 -3.772 1.00 0.00 C ATOM 1661 CD1 ILE A 109 -12.614 -11.712 -4.152 1.00 0.00 C ATOM 0 H ILE A 109 -10.174 -9.273 -5.334 1.00 0.00 H new ATOM 0 HA ILE A 109 -8.858 -10.226 -3.026 1.00 0.00 H new ATOM 0 HB ILE A 109 -10.179 -11.548 -5.423 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -11.272 -11.054 -2.611 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -11.491 -9.899 -3.910 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -10.478 -13.525 -3.962 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -8.757 -13.174 -4.248 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -9.510 -12.732 -2.697 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -13.489 -11.307 -3.644 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -12.734 -11.596 -5.229 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -12.512 -12.770 -3.910 1.00 0.00 H new ATOM 1673 N TRP A 110 -7.100 -10.752 -5.736 1.00 0.00 N ATOM 1674 CA TRP A 110 -5.709 -10.974 -6.128 1.00 0.00 C ATOM 1675 C TRP A 110 -4.783 -10.073 -5.310 1.00 0.00 C ATOM 1676 O TRP A 110 -3.911 -10.580 -4.616 1.00 0.00 O ATOM 1677 CB TRP A 110 -5.529 -10.737 -7.627 1.00 0.00 C ATOM 1678 CG TRP A 110 -4.151 -10.906 -8.170 1.00 0.00 C ATOM 1679 CD1 TRP A 110 -3.467 -12.064 -8.306 1.00 0.00 C ATOM 1680 CD2 TRP A 110 -3.289 -9.863 -8.694 1.00 0.00 C ATOM 1681 NE1 TRP A 110 -2.241 -11.809 -8.896 1.00 0.00 N ATOM 1682 CE2 TRP A 110 -2.104 -10.468 -9.198 1.00 0.00 C ATOM 1683 CE3 TRP A 110 -3.410 -8.464 -8.797 1.00 0.00 C ATOM 1684 CZ2 TRP A 110 -1.104 -9.712 -9.820 1.00 0.00 C ATOM 1685 CZ3 TRP A 110 -2.410 -7.695 -9.409 1.00 0.00 C ATOM 1686 CH2 TRP A 110 -1.261 -8.316 -9.919 1.00 0.00 C ATOM 0 H TRP A 110 -7.715 -10.500 -6.510 1.00 0.00 H new ATOM 0 HA TRP A 110 -5.445 -12.011 -5.922 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -6.191 -11.418 -8.161 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -5.863 -9.724 -7.854 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -3.822 -13.037 -8.001 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -1.532 -12.518 -9.083 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -4.287 -7.976 -8.398 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 -0.223 -10.193 -10.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -2.525 -6.624 -9.488 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -0.493 -7.721 -10.390 1.00 0.00 H new ATOM 1697 N THR A 111 -4.994 -8.759 -5.350 1.00 0.00 N ATOM 1698 CA THR A 111 -4.174 -7.760 -4.680 1.00 0.00 C ATOM 1699 C THR A 111 -4.112 -7.974 -3.157 1.00 0.00 C ATOM 1700 O THR A 111 -3.068 -7.726 -2.555 1.00 0.00 O ATOM 1701 CB THR A 111 -4.712 -6.374 -5.072 1.00 0.00 C ATOM 1702 OG1 THR A 111 -4.592 -6.200 -6.462 1.00 0.00 O ATOM 1703 CG2 THR A 111 -3.985 -5.210 -4.419 1.00 0.00 C ATOM 0 H THR A 111 -5.770 -8.349 -5.870 1.00 0.00 H new ATOM 0 HA THR A 111 -3.138 -7.850 -5.006 1.00 0.00 H new ATOM 0 HB THR A 111 -5.746 -6.361 -4.728 1.00 0.00 H new ATOM 0 HG1 THR A 111 -5.478 -6.259 -6.877 1.00 0.00 H new ATOM 0 HG21 THR A 111 -4.429 -4.271 -4.751 1.00 0.00 H new ATOM 0 HG22 THR A 111 -4.071 -5.289 -3.335 1.00 0.00 H new ATOM 0 HG23 THR A 111 -2.933 -5.234 -4.702 1.00 0.00 H new ATOM 1711 N LEU A 112 -5.176 -8.480 -2.512 1.00 0.00 N ATOM 1712 CA LEU A 112 -5.138 -8.885 -1.109 1.00 0.00 C ATOM 1713 C LEU A 112 -4.074 -9.967 -0.935 1.00 0.00 C ATOM 1714 O LEU A 112 -3.212 -9.845 -0.062 1.00 0.00 O ATOM 1715 CB LEU A 112 -6.541 -9.344 -0.673 1.00 0.00 C ATOM 1716 CG LEU A 112 -6.674 -9.874 0.764 1.00 0.00 C ATOM 1717 CD1 LEU A 112 -6.186 -11.310 0.897 1.00 0.00 C ATOM 1718 CD2 LEU A 112 -6.024 -8.953 1.803 1.00 0.00 C ATOM 0 H LEU A 112 -6.085 -8.617 -2.955 1.00 0.00 H new ATOM 0 HA LEU A 112 -4.862 -8.050 -0.464 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.227 -8.505 -0.792 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.872 -10.126 -1.357 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.742 -9.877 0.982 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.300 -11.639 1.930 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.773 -11.956 0.243 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -5.135 -11.365 0.613 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.151 -9.380 2.798 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -4.961 -8.851 1.584 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.498 -7.972 1.767 1.00 0.00 H new ATOM 1730 N GLY A 113 -4.134 -10.998 -1.778 1.00 0.00 N ATOM 1731 CA GLY A 113 -3.086 -12.008 -1.895 1.00 0.00 C ATOM 1732 C GLY A 113 -1.690 -11.385 -2.030 1.00 0.00 C ATOM 1733 O GLY A 113 -0.863 -11.560 -1.133 1.00 0.00 O ATOM 0 H GLY A 113 -4.922 -11.156 -2.406 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -3.109 -12.656 -1.019 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -3.286 -12.637 -2.762 1.00 0.00 H new ATOM 1737 N VAL A 114 -1.443 -10.615 -3.100 1.00 0.00 N ATOM 1738 CA VAL A 114 -0.140 -10.012 -3.408 1.00 0.00 C ATOM 1739 C VAL A 114 0.385 -9.252 -2.179 1.00 0.00 C ATOM 1740 O VAL A 114 1.522 -9.459 -1.760 1.00 0.00 O ATOM 1741 CB VAL A 114 -0.218 -9.118 -4.672 1.00 0.00 C ATOM 1742 CG1 VAL A 114 1.157 -8.551 -5.070 1.00 0.00 C ATOM 1743 CG2 VAL A 114 -0.747 -9.888 -5.890 1.00 0.00 C ATOM 0 H VAL A 114 -2.160 -10.390 -3.790 1.00 0.00 H new ATOM 0 HA VAL A 114 0.574 -10.803 -3.640 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.899 -8.310 -4.403 1.00 0.00 H new ATOM 0 HG11 VAL A 114 1.051 -7.932 -5.961 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.552 -7.947 -4.253 1.00 0.00 H new ATOM 0 HG13 VAL A 114 1.843 -9.372 -5.279 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -0.785 -9.223 -6.753 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -0.084 -10.726 -6.107 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -1.748 -10.263 -5.677 1.00 0.00 H new ATOM 1753 N ALA A 115 -0.438 -8.400 -1.557 1.00 0.00 N ATOM 1754 CA ALA A 115 -0.026 -7.588 -0.419 1.00 0.00 C ATOM 1755 C ALA A 115 0.209 -8.400 0.859 1.00 0.00 C ATOM 1756 O ALA A 115 1.040 -7.999 1.681 1.00 0.00 O ATOM 1757 CB ALA A 115 -1.079 -6.511 -0.163 1.00 0.00 C ATOM 0 H ALA A 115 -1.409 -8.258 -1.833 1.00 0.00 H new ATOM 0 HA ALA A 115 0.933 -7.140 -0.678 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.776 -5.901 0.688 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -1.176 -5.880 -1.046 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -2.037 -6.983 0.053 1.00 0.00 H new ATOM 1763 N THR A 116 -0.517 -9.502 1.065 1.00 0.00 N ATOM 1764 CA THR A 116 -0.272 -10.403 2.189 1.00 0.00 C ATOM 1765 C THR A 116 1.083 -11.082 1.978 1.00 0.00 C ATOM 1766 O THR A 116 1.939 -11.009 2.863 1.00 0.00 O ATOM 1767 CB THR A 116 -1.418 -11.421 2.350 1.00 0.00 C ATOM 1768 OG1 THR A 116 -2.672 -10.761 2.447 1.00 0.00 O ATOM 1769 CG2 THR A 116 -1.240 -12.259 3.620 1.00 0.00 C ATOM 0 H THR A 116 -1.286 -9.792 0.460 1.00 0.00 H new ATOM 0 HA THR A 116 -0.242 -9.837 3.120 1.00 0.00 H new ATOM 0 HB THR A 116 -1.392 -12.063 1.470 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.893 -10.350 1.585 1.00 0.00 H new ATOM 0 HG21 THR A 116 -2.063 -12.968 3.706 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.297 -12.803 3.568 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.233 -11.603 4.491 1.00 0.00 H new ATOM 1777 N CYS A 117 1.290 -11.666 0.790 1.00 0.00 N ATOM 1778 CA CYS A 117 2.552 -12.251 0.363 1.00 0.00 C ATOM 1779 C CYS A 117 3.689 -11.267 0.611 1.00 0.00 C ATOM 1780 O CYS A 117 4.667 -11.637 1.256 1.00 0.00 O ATOM 1781 CB CYS A 117 2.468 -12.669 -1.111 1.00 0.00 C ATOM 1782 SG CYS A 117 4.043 -13.146 -1.870 1.00 0.00 S ATOM 0 H CYS A 117 0.557 -11.743 0.084 1.00 0.00 H new ATOM 0 HA CYS A 117 2.756 -13.149 0.947 1.00 0.00 H new ATOM 0 HB2 CYS A 117 1.774 -13.506 -1.196 1.00 0.00 H new ATOM 0 HB3 CYS A 117 2.043 -11.844 -1.682 1.00 0.00 H new ATOM 1787 N PHE A 118 3.543 -10.011 0.169 1.00 0.00 N ATOM 1788 CA PHE A 118 4.577 -9.007 0.307 1.00 0.00 C ATOM 1789 C PHE A 118 5.028 -8.893 1.771 1.00 0.00 C ATOM 1790 O PHE A 118 6.164 -9.202 2.115 1.00 0.00 O ATOM 1791 CB PHE A 118 4.069 -7.679 -0.284 1.00 0.00 C ATOM 1792 CG PHE A 118 5.052 -6.526 -0.238 1.00 0.00 C ATOM 1793 CD1 PHE A 118 6.404 -6.759 0.042 1.00 0.00 C ATOM 1794 CD2 PHE A 118 4.631 -5.213 -0.510 1.00 0.00 C ATOM 1795 CE1 PHE A 118 7.328 -5.714 0.037 1.00 0.00 C ATOM 1796 CE2 PHE A 118 5.552 -4.153 -0.468 1.00 0.00 C ATOM 1797 CZ PHE A 118 6.901 -4.399 -0.192 1.00 0.00 C ATOM 0 H PHE A 118 2.699 -9.673 -0.293 1.00 0.00 H new ATOM 0 HA PHE A 118 5.466 -9.295 -0.254 1.00 0.00 H new ATOM 0 HB2 PHE A 118 3.784 -7.849 -1.322 1.00 0.00 H new ATOM 0 HB3 PHE A 118 3.166 -7.385 0.251 1.00 0.00 H new ATOM 0 HD1 PHE A 118 6.736 -7.762 0.265 1.00 0.00 H new ATOM 0 HD2 PHE A 118 3.597 -5.018 -0.752 1.00 0.00 H new ATOM 0 HE1 PHE A 118 8.374 -5.919 0.210 1.00 0.00 H new ATOM 0 HE2 PHE A 118 5.217 -3.143 -0.650 1.00 0.00 H new ATOM 0 HZ PHE A 118 7.607 -3.583 -0.156 1.00 0.00 H new ATOM 1807 N LYS A 119 4.125 -8.489 2.659 1.00 0.00 N ATOM 1808 CA LYS A 119 4.355 -8.371 4.103 1.00 0.00 C ATOM 1809 C LYS A 119 5.042 -9.602 4.673 1.00 0.00 C ATOM 1810 O LYS A 119 5.931 -9.499 5.519 1.00 0.00 O ATOM 1811 CB LYS A 119 3.019 -8.218 4.839 1.00 0.00 C ATOM 1812 CG LYS A 119 3.199 -7.407 6.139 1.00 0.00 C ATOM 1813 CD LYS A 119 2.222 -7.767 7.272 1.00 0.00 C ATOM 1814 CE LYS A 119 2.790 -8.740 8.317 1.00 0.00 C ATOM 1815 NZ LYS A 119 2.860 -10.144 7.868 1.00 0.00 N ATOM 0 H LYS A 119 3.178 -8.224 2.388 1.00 0.00 H new ATOM 0 HA LYS A 119 4.992 -7.498 4.246 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.297 -7.720 4.192 1.00 0.00 H new ATOM 0 HB3 LYS A 119 2.613 -9.202 5.072 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.218 -7.549 6.500 1.00 0.00 H new ATOM 0 HG3 LYS A 119 3.088 -6.348 5.907 1.00 0.00 H new ATOM 0 HD2 LYS A 119 1.916 -6.850 7.776 1.00 0.00 H new ATOM 0 HD3 LYS A 119 1.325 -8.206 6.835 1.00 0.00 H new ATOM 0 HE2 LYS A 119 3.791 -8.410 8.596 1.00 0.00 H new ATOM 0 HE3 LYS A 119 2.175 -8.689 9.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 3.253 -10.733 8.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 1.905 -10.480 7.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 3.471 -10.210 7.029 1.00 0.00 H new ATOM 1829 N ALA A 120 4.526 -10.767 4.295 1.00 0.00 N ATOM 1830 CA ALA A 120 5.051 -12.040 4.760 1.00 0.00 C ATOM 1831 C ALA A 120 6.524 -12.201 4.381 1.00 0.00 C ATOM 1832 O ALA A 120 7.321 -12.642 5.211 1.00 0.00 O ATOM 1833 CB ALA A 120 4.202 -13.206 4.238 1.00 0.00 C ATOM 0 H ALA A 120 3.733 -10.852 3.659 1.00 0.00 H new ATOM 0 HA ALA A 120 4.993 -12.053 5.848 1.00 0.00 H new ATOM 0 HB1 ALA A 120 4.615 -14.148 4.600 1.00 0.00 H new ATOM 0 HB2 ALA A 120 3.178 -13.098 4.595 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.209 -13.202 3.148 1.00 0.00 H new ATOM 1839 N GLU A 121 6.889 -11.807 3.162 1.00 0.00 N ATOM 1840 CA GLU A 121 8.253 -11.817 2.664 1.00 0.00 C ATOM 1841 C GLU A 121 9.129 -10.807 3.392 1.00 0.00 C ATOM 1842 O GLU A 121 10.246 -11.159 3.756 1.00 0.00 O ATOM 1843 CB GLU A 121 8.292 -11.495 1.176 1.00 0.00 C ATOM 1844 CG GLU A 121 7.577 -12.526 0.290 1.00 0.00 C ATOM 1845 CD GLU A 121 8.599 -13.423 -0.393 1.00 0.00 C ATOM 1846 OE1 GLU A 121 9.071 -14.410 0.223 1.00 0.00 O ATOM 1847 OE2 GLU A 121 9.024 -13.124 -1.526 1.00 0.00 O ATOM 0 H GLU A 121 6.218 -11.462 2.476 1.00 0.00 H new ATOM 0 HA GLU A 121 8.638 -12.821 2.842 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.838 -10.517 1.015 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.332 -11.419 0.859 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.898 -13.128 0.894 1.00 0.00 H new ATOM 0 HG3 GLU A 121 6.970 -12.016 -0.459 1.00 0.00 H new ATOM 1854 N ILE A 122 8.653 -9.578 3.630 1.00 0.00 N ATOM 1855 CA ILE A 122 9.375 -8.583 4.425 1.00 0.00 C ATOM 1856 C ILE A 122 9.838 -9.213 5.750 1.00 0.00 C ATOM 1857 O ILE A 122 10.952 -8.954 6.199 1.00 0.00 O ATOM 1858 CB ILE A 122 8.541 -7.288 4.650 1.00 0.00 C ATOM 1859 CG1 ILE A 122 8.078 -6.583 3.359 1.00 0.00 C ATOM 1860 CG2 ILE A 122 9.333 -6.284 5.501 1.00 0.00 C ATOM 1861 CD1 ILE A 122 7.102 -5.417 3.591 1.00 0.00 C ATOM 0 H ILE A 122 7.755 -9.248 3.275 1.00 0.00 H new ATOM 0 HA ILE A 122 10.257 -8.272 3.865 1.00 0.00 H new ATOM 0 HB ILE A 122 7.640 -7.623 5.163 1.00 0.00 H new ATOM 0 HG12 ILE A 122 8.954 -6.209 2.829 1.00 0.00 H new ATOM 0 HG13 ILE A 122 7.601 -7.317 2.709 1.00 0.00 H new ATOM 0 HG21 ILE A 122 8.737 -5.384 5.650 1.00 0.00 H new ATOM 0 HG22 ILE A 122 9.565 -6.730 6.468 1.00 0.00 H new ATOM 0 HG23 ILE A 122 10.260 -6.025 4.990 1.00 0.00 H new ATOM 0 HD11 ILE A 122 6.827 -4.977 2.633 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.207 -5.786 4.092 1.00 0.00 H new ATOM 0 HD13 ILE A 122 7.580 -4.661 4.213 1.00 0.00 H new ATOM 1873 N HIS A 123 9.040 -10.097 6.363 1.00 0.00 N ATOM 1874 CA HIS A 123 9.414 -10.750 7.615 1.00 0.00 C ATOM 1875 C HIS A 123 10.667 -11.641 7.508 1.00 0.00 C ATOM 1876 O HIS A 123 11.189 -12.068 8.540 1.00 0.00 O ATOM 1877 CB HIS A 123 8.214 -11.553 8.144 1.00 0.00 C ATOM 1878 CG HIS A 123 7.985 -11.418 9.628 1.00 0.00 C ATOM 1879 ND1 HIS A 123 7.569 -12.414 10.484 1.00 0.00 N ATOM 1880 CD2 HIS A 123 7.989 -10.246 10.338 1.00 0.00 C ATOM 1881 CE1 HIS A 123 7.341 -11.858 11.683 1.00 0.00 C ATOM 1882 NE2 HIS A 123 7.560 -10.537 11.633 1.00 0.00 N ATOM 0 H HIS A 123 8.126 -10.375 6.006 1.00 0.00 H new ATOM 0 HA HIS A 123 9.684 -9.962 8.318 1.00 0.00 H new ATOM 0 HB2 HIS A 123 7.315 -11.230 7.618 1.00 0.00 H new ATOM 0 HB3 HIS A 123 8.362 -12.606 7.905 1.00 0.00 H new ATOM 0 HD2 HIS A 123 8.273 -9.274 9.963 1.00 0.00 H new ATOM 0 HE1 HIS A 123 7.026 -12.398 12.564 1.00 0.00 H new ATOM 0 HE2 HIS A 123 7.437 -9.871 12.396 1.00 0.00 H new ATOM 1890 N LYS A 124 11.154 -11.946 6.302 1.00 0.00 N ATOM 1891 CA LYS A 124 12.343 -12.758 6.035 1.00 0.00 C ATOM 1892 C LYS A 124 13.563 -11.890 5.685 1.00 0.00 C ATOM 1893 O LYS A 124 14.657 -12.439 5.563 1.00 0.00 O ATOM 1894 CB LYS A 124 12.036 -13.754 4.897 1.00 0.00 C ATOM 1895 CG LYS A 124 11.022 -14.848 5.283 1.00 0.00 C ATOM 1896 CD LYS A 124 10.282 -15.445 4.075 1.00 0.00 C ATOM 1897 CE LYS A 124 11.151 -16.093 2.985 1.00 0.00 C ATOM 1898 NZ LYS A 124 11.808 -17.345 3.420 1.00 0.00 N ATOM 0 H LYS A 124 10.708 -11.618 5.445 1.00 0.00 H new ATOM 0 HA LYS A 124 12.595 -13.307 6.942 1.00 0.00 H new ATOM 0 HB2 LYS A 124 11.652 -13.203 4.038 1.00 0.00 H new ATOM 0 HB3 LYS A 124 12.965 -14.228 4.582 1.00 0.00 H new ATOM 0 HG2 LYS A 124 11.543 -15.646 5.812 1.00 0.00 H new ATOM 0 HG3 LYS A 124 10.293 -14.429 5.976 1.00 0.00 H new ATOM 0 HD2 LYS A 124 9.581 -16.195 4.442 1.00 0.00 H new ATOM 0 HD3 LYS A 124 9.690 -14.654 3.613 1.00 0.00 H new ATOM 0 HE2 LYS A 124 10.531 -16.302 2.113 1.00 0.00 H new ATOM 0 HE3 LYS A 124 11.915 -15.382 2.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 12.377 -17.728 2.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 12.425 -17.149 4.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 11.084 -18.040 3.694 1.00 0.00 H new ATOM 1912 N LEU A 125 13.431 -10.569 5.516 1.00 0.00 N ATOM 1913 CA LEU A 125 14.546 -9.670 5.218 1.00 0.00 C ATOM 1914 C LEU A 125 15.550 -9.603 6.375 1.00 0.00 C ATOM 1915 O LEU A 125 15.364 -10.174 7.453 1.00 0.00 O ATOM 1916 CB LEU A 125 14.001 -8.261 4.905 1.00 0.00 C ATOM 1917 CG LEU A 125 13.631 -8.049 3.429 1.00 0.00 C ATOM 1918 CD1 LEU A 125 12.717 -6.824 3.255 1.00 0.00 C ATOM 1919 CD2 LEU A 125 14.925 -7.935 2.604 1.00 0.00 C ATOM 0 H LEU A 125 12.533 -10.090 5.584 1.00 0.00 H new ATOM 0 HA LEU A 125 15.075 -10.063 4.350 1.00 0.00 H new ATOM 0 HB2 LEU A 125 13.120 -8.078 5.520 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.749 -7.521 5.192 1.00 0.00 H new ATOM 0 HG LEU A 125 13.062 -8.904 3.065 1.00 0.00 H new ATOM 0 HD11 LEU A 125 12.472 -6.700 2.200 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.800 -6.970 3.826 1.00 0.00 H new ATOM 0 HD13 LEU A 125 13.230 -5.933 3.616 1.00 0.00 H new ATOM 0 HD21 LEU A 125 14.675 -7.784 1.554 1.00 0.00 H new ATOM 0 HD22 LEU A 125 15.512 -7.089 2.962 1.00 0.00 H new ATOM 0 HD23 LEU A 125 15.506 -8.851 2.711 1.00 0.00 H new ATOM 1931 N ASN A 126 16.642 -8.875 6.142 1.00 0.00 N ATOM 1932 CA ASN A 126 17.627 -8.436 7.114 1.00 0.00 C ATOM 1933 C ASN A 126 17.319 -7.047 7.691 1.00 0.00 C ATOM 1934 O ASN A 126 18.085 -6.555 8.522 1.00 0.00 O ATOM 1935 CB ASN A 126 18.991 -8.403 6.414 1.00 0.00 C ATOM 1936 CG ASN A 126 19.125 -7.299 5.366 1.00 0.00 C ATOM 1937 OD1 ASN A 126 18.292 -7.188 4.474 1.00 0.00 O ATOM 1938 ND2 ASN A 126 20.146 -6.464 5.445 1.00 0.00 N ATOM 0 H ASN A 126 16.872 -8.557 5.200 1.00 0.00 H new ATOM 0 HA ASN A 126 17.615 -9.133 7.952 1.00 0.00 H new ATOM 0 HB2 ASN A 126 19.770 -8.273 7.165 1.00 0.00 H new ATOM 0 HB3 ASN A 126 19.166 -9.367 5.936 1.00 0.00 H new ATOM 0 HD21 ASN A 126 20.248 -5.716 4.759 1.00 0.00 H new ATOM 0 HD22 ASN A 126 20.833 -6.567 6.192 1.00 0.00 H new ATOM 1945 N TRP A 127 16.239 -6.403 7.247 1.00 0.00 N ATOM 1946 CA TRP A 127 15.794 -5.083 7.662 1.00 0.00 C ATOM 1947 C TRP A 127 14.268 -5.034 7.683 1.00 0.00 C ATOM 1948 O TRP A 127 13.589 -5.963 7.240 1.00 0.00 O ATOM 1949 CB TRP A 127 16.350 -3.989 6.730 1.00 0.00 C ATOM 1950 CG TRP A 127 15.827 -3.970 5.319 1.00 0.00 C ATOM 1951 CD1 TRP A 127 15.924 -4.997 4.450 1.00 0.00 C ATOM 1952 CD2 TRP A 127 15.110 -2.918 4.591 1.00 0.00 C ATOM 1953 NE1 TRP A 127 15.324 -4.675 3.256 1.00 0.00 N ATOM 1954 CE2 TRP A 127 14.796 -3.410 3.288 1.00 0.00 C ATOM 1955 CE3 TRP A 127 14.685 -1.604 4.886 1.00 0.00 C ATOM 1956 CZ2 TRP A 127 14.091 -2.663 2.340 1.00 0.00 C ATOM 1957 CZ3 TRP A 127 13.995 -0.828 3.931 1.00 0.00 C ATOM 1958 CH2 TRP A 127 13.687 -1.359 2.664 1.00 0.00 C ATOM 0 H TRP A 127 15.620 -6.816 6.549 1.00 0.00 H new ATOM 0 HA TRP A 127 16.175 -4.893 8.666 1.00 0.00 H new ATOM 0 HB2 TRP A 127 16.142 -3.019 7.182 1.00 0.00 H new ATOM 0 HB3 TRP A 127 17.434 -4.096 6.689 1.00 0.00 H new ATOM 0 HD1 TRP A 127 16.406 -5.940 4.663 1.00 0.00 H new ATOM 0 HE1 TRP A 127 15.277 -5.297 2.449 1.00 0.00 H new ATOM 0 HE3 TRP A 127 14.892 -1.186 5.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 13.861 -3.083 1.372 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 13.700 0.182 4.174 1.00 0.00 H new ATOM 0 HH2 TRP A 127 13.142 -0.765 1.945 1.00 0.00 H new ATOM 1969 N ALA A 128 13.749 -3.909 8.162 1.00 0.00 N ATOM 1970 CA ALA A 128 12.346 -3.571 8.232 1.00 0.00 C ATOM 1971 C ALA A 128 12.175 -2.258 7.465 1.00 0.00 C ATOM 1972 O ALA A 128 12.567 -1.215 7.989 1.00 0.00 O ATOM 1973 CB ALA A 128 11.916 -3.444 9.700 1.00 0.00 C ATOM 0 H ALA A 128 14.341 -3.166 8.534 1.00 0.00 H new ATOM 0 HA ALA A 128 11.715 -4.341 7.789 1.00 0.00 H new ATOM 0 HB1 ALA A 128 10.857 -3.189 9.748 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.085 -4.391 10.212 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.500 -2.661 10.184 1.00 0.00 H new ATOM 1979 N PRO A 129 11.639 -2.275 6.235 1.00 0.00 N ATOM 1980 CA PRO A 129 11.087 -1.071 5.641 1.00 0.00 C ATOM 1981 C PRO A 129 9.952 -0.581 6.532 1.00 0.00 C ATOM 1982 O PRO A 129 9.153 -1.399 7.022 1.00 0.00 O ATOM 1983 CB PRO A 129 10.542 -1.458 4.261 1.00 0.00 C ATOM 1984 CG PRO A 129 10.846 -2.949 4.093 1.00 0.00 C ATOM 1985 CD PRO A 129 11.259 -3.444 5.473 1.00 0.00 C ATOM 0 HA PRO A 129 11.833 -0.283 5.544 1.00 0.00 H new ATOM 0 HB2 PRO A 129 9.471 -1.268 4.197 1.00 0.00 H new ATOM 0 HB3 PRO A 129 11.017 -0.871 3.475 1.00 0.00 H new ATOM 0 HG2 PRO A 129 9.971 -3.488 3.729 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.643 -3.107 3.366 1.00 0.00 H new ATOM 0 HD2 PRO A 129 10.437 -3.972 5.957 1.00 0.00 H new ATOM 0 HD3 PRO A 129 12.090 -4.146 5.400 1.00 0.00 H new ATOM 1993 N SER A 130 9.835 0.736 6.687 1.00 0.00 N ATOM 1994 CA SER A 130 8.637 1.312 7.260 1.00 0.00 C ATOM 1995 C SER A 130 7.442 0.964 6.364 1.00 0.00 C ATOM 1996 O SER A 130 7.585 0.709 5.163 1.00 0.00 O ATOM 1997 CB SER A 130 8.797 2.824 7.399 1.00 0.00 C ATOM 1998 OG SER A 130 10.059 3.166 7.944 1.00 0.00 O ATOM 0 H SER A 130 10.552 1.413 6.424 1.00 0.00 H new ATOM 0 HA SER A 130 8.465 0.903 8.256 1.00 0.00 H new ATOM 0 HB2 SER A 130 8.682 3.294 6.422 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.006 3.217 8.037 1.00 0.00 H new ATOM 0 HG SER A 130 10.130 4.141 8.018 1.00 0.00 H new ATOM 2004 N MET A 131 6.251 0.926 6.949 1.00 0.00 N ATOM 2005 CA MET A 131 5.043 0.577 6.220 1.00 0.00 C ATOM 2006 C MET A 131 4.641 1.660 5.222 1.00 0.00 C ATOM 2007 O MET A 131 4.038 1.342 4.203 1.00 0.00 O ATOM 2008 CB MET A 131 3.922 0.328 7.216 1.00 0.00 C ATOM 2009 CG MET A 131 3.717 -1.152 7.508 1.00 0.00 C ATOM 2010 SD MET A 131 2.545 -1.991 6.405 1.00 0.00 S ATOM 2011 CE MET A 131 3.644 -2.991 5.369 1.00 0.00 C ATOM 0 H MET A 131 6.098 1.135 7.936 1.00 0.00 H new ATOM 0 HA MET A 131 5.238 -0.326 5.642 1.00 0.00 H new ATOM 0 HB2 MET A 131 4.145 0.851 8.146 1.00 0.00 H new ATOM 0 HB3 MET A 131 2.995 0.750 6.827 1.00 0.00 H new ATOM 0 HG2 MET A 131 4.681 -1.657 7.443 1.00 0.00 H new ATOM 0 HG3 MET A 131 3.369 -1.260 8.535 1.00 0.00 H new ATOM 0 HE1 MET A 131 3.241 -3.045 4.357 1.00 0.00 H new ATOM 0 HE2 MET A 131 4.634 -2.535 5.342 1.00 0.00 H new ATOM 0 HE3 MET A 131 3.719 -3.996 5.783 1.00 0.00 H new ATOM 2021 N ASP A 132 4.942 2.925 5.498 1.00 0.00 N ATOM 2022 CA ASP A 132 4.920 4.004 4.506 1.00 0.00 C ATOM 2023 C ASP A 132 5.674 3.606 3.244 1.00 0.00 C ATOM 2024 O ASP A 132 5.047 3.472 2.197 1.00 0.00 O ATOM 2025 CB ASP A 132 5.361 5.332 5.143 1.00 0.00 C ATOM 2026 CG ASP A 132 6.768 5.795 4.835 1.00 0.00 C ATOM 2027 OD1 ASP A 132 7.691 5.174 5.412 1.00 0.00 O ATOM 2028 OD2 ASP A 132 6.919 6.742 4.054 1.00 0.00 O ATOM 0 H ASP A 132 5.213 3.238 6.430 1.00 0.00 H new ATOM 0 HA ASP A 132 3.898 4.175 4.169 1.00 0.00 H new ATOM 0 HB2 ASP A 132 4.668 6.110 4.823 1.00 0.00 H new ATOM 0 HB3 ASP A 132 5.261 5.241 6.225 1.00 0.00 H new ATOM 2033 N VAL A 133 6.974 3.334 3.362 1.00 0.00 N ATOM 2034 CA VAL A 133 7.823 2.905 2.254 1.00 0.00 C ATOM 2035 C VAL A 133 7.191 1.684 1.577 1.00 0.00 C ATOM 2036 O VAL A 133 6.857 1.741 0.398 1.00 0.00 O ATOM 2037 CB VAL A 133 9.276 2.693 2.740 1.00 0.00 C ATOM 2038 CG1 VAL A 133 10.152 1.908 1.755 1.00 0.00 C ATOM 2039 CG2 VAL A 133 9.950 4.048 3.008 1.00 0.00 C ATOM 0 H VAL A 133 7.474 3.408 4.248 1.00 0.00 H new ATOM 0 HA VAL A 133 7.889 3.680 1.490 1.00 0.00 H new ATOM 0 HB VAL A 133 9.194 2.102 3.652 1.00 0.00 H new ATOM 0 HG11 VAL A 133 11.156 1.801 2.166 1.00 0.00 H new ATOM 0 HG12 VAL A 133 9.720 0.921 1.590 1.00 0.00 H new ATOM 0 HG13 VAL A 133 10.204 2.444 0.807 1.00 0.00 H new ATOM 0 HG21 VAL A 133 10.972 3.885 3.350 1.00 0.00 H new ATOM 0 HG22 VAL A 133 9.964 4.635 2.090 1.00 0.00 H new ATOM 0 HG23 VAL A 133 9.393 4.586 3.775 1.00 0.00 H new ATOM 2049 N ALA A 134 6.982 0.590 2.315 1.00 0.00 N ATOM 2050 CA ALA A 134 6.511 -0.678 1.754 1.00 0.00 C ATOM 2051 C ALA A 134 5.156 -0.531 1.061 1.00 0.00 C ATOM 2052 O ALA A 134 5.022 -0.908 -0.098 1.00 0.00 O ATOM 2053 CB ALA A 134 6.462 -1.740 2.854 1.00 0.00 C ATOM 0 H ALA A 134 7.136 0.560 3.323 1.00 0.00 H new ATOM 0 HA ALA A 134 7.217 -0.995 0.986 1.00 0.00 H new ATOM 0 HB1 ALA A 134 6.111 -2.683 2.434 1.00 0.00 H new ATOM 0 HB2 ALA A 134 7.459 -1.878 3.272 1.00 0.00 H new ATOM 0 HB3 ALA A 134 5.780 -1.417 3.641 1.00 0.00 H new ATOM 2059 N VAL A 135 4.130 -0.023 1.744 1.00 0.00 N ATOM 2060 CA VAL A 135 2.813 0.115 1.125 1.00 0.00 C ATOM 2061 C VAL A 135 2.876 1.158 -0.002 1.00 0.00 C ATOM 2062 O VAL A 135 2.156 1.011 -0.984 1.00 0.00 O ATOM 2063 CB VAL A 135 1.712 0.390 2.171 1.00 0.00 C ATOM 2064 CG1 VAL A 135 0.316 0.388 1.526 1.00 0.00 C ATOM 2065 CG2 VAL A 135 1.706 -0.686 3.276 1.00 0.00 C ATOM 0 H VAL A 135 4.183 0.295 2.712 1.00 0.00 H new ATOM 0 HA VAL A 135 2.529 -0.833 0.668 1.00 0.00 H new ATOM 0 HB VAL A 135 1.933 1.369 2.596 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -0.437 0.585 2.289 1.00 0.00 H new ATOM 0 HG12 VAL A 135 0.268 1.162 0.760 1.00 0.00 H new ATOM 0 HG13 VAL A 135 0.127 -0.584 1.071 1.00 0.00 H new ATOM 0 HG21 VAL A 135 0.919 -0.463 3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 135 1.524 -1.664 2.831 1.00 0.00 H new ATOM 0 HG23 VAL A 135 2.671 -0.692 3.783 1.00 0.00 H new ATOM 2075 N GLY A 136 3.758 2.155 0.086 1.00 0.00 N ATOM 2076 CA GLY A 136 4.011 3.095 -0.987 1.00 0.00 C ATOM 2077 C GLY A 136 4.508 2.372 -2.249 1.00 0.00 C ATOM 2078 O GLY A 136 3.998 2.666 -3.330 1.00 0.00 O ATOM 0 H GLY A 136 4.320 2.327 0.919 1.00 0.00 H new ATOM 0 HA2 GLY A 136 3.098 3.646 -1.215 1.00 0.00 H new ATOM 0 HA3 GLY A 136 4.753 3.826 -0.667 1.00 0.00 H new ATOM 2082 N GLU A 137 5.428 1.404 -2.116 1.00 0.00 N ATOM 2083 CA GLU A 137 6.110 0.712 -3.215 1.00 0.00 C ATOM 2084 C GLU A 137 5.089 -0.101 -4.000 1.00 0.00 C ATOM 2085 O GLU A 137 4.825 0.182 -5.161 1.00 0.00 O ATOM 2086 CB GLU A 137 7.259 -0.179 -2.729 1.00 0.00 C ATOM 2087 CG GLU A 137 8.345 0.676 -2.076 1.00 0.00 C ATOM 2088 CD GLU A 137 9.628 0.933 -2.876 1.00 0.00 C ATOM 2089 OE1 GLU A 137 10.525 0.066 -2.845 1.00 0.00 O ATOM 2090 OE2 GLU A 137 9.778 2.074 -3.379 1.00 0.00 O ATOM 0 H GLU A 137 5.728 1.070 -1.200 1.00 0.00 H new ATOM 0 HA GLU A 137 6.562 1.465 -3.860 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.884 -0.912 -2.015 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.678 -0.735 -3.567 1.00 0.00 H new ATOM 0 HG2 GLU A 137 7.906 1.642 -1.827 1.00 0.00 H new ATOM 0 HG3 GLU A 137 8.626 0.201 -1.136 1.00 0.00 H new ATOM 2097 N ILE A 138 4.432 -1.044 -3.316 1.00 0.00 N ATOM 2098 CA ILE A 138 3.506 -1.985 -3.960 1.00 0.00 C ATOM 2099 C ILE A 138 2.377 -1.249 -4.688 1.00 0.00 C ATOM 2100 O ILE A 138 1.866 -1.722 -5.695 1.00 0.00 O ATOM 2101 CB ILE A 138 2.992 -3.039 -2.945 1.00 0.00 C ATOM 2102 CG1 ILE A 138 2.095 -4.103 -3.619 1.00 0.00 C ATOM 2103 CG2 ILE A 138 2.253 -2.400 -1.751 1.00 0.00 C ATOM 2104 CD1 ILE A 138 1.797 -5.365 -2.787 1.00 0.00 C ATOM 0 H ILE A 138 4.525 -1.177 -2.309 1.00 0.00 H new ATOM 0 HA ILE A 138 4.051 -2.534 -4.728 1.00 0.00 H new ATOM 0 HB ILE A 138 3.882 -3.535 -2.558 1.00 0.00 H new ATOM 0 HG12 ILE A 138 1.147 -3.635 -3.883 1.00 0.00 H new ATOM 0 HG13 ILE A 138 2.569 -4.411 -4.551 1.00 0.00 H new ATOM 0 HG21 ILE A 138 1.914 -3.182 -1.072 1.00 0.00 H new ATOM 0 HG22 ILE A 138 2.929 -1.728 -1.222 1.00 0.00 H new ATOM 0 HG23 ILE A 138 1.393 -1.838 -2.114 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.160 -6.038 -3.362 1.00 0.00 H new ATOM 0 HD12 ILE A 138 2.732 -5.870 -2.544 1.00 0.00 H new ATOM 0 HD13 ILE A 138 1.288 -5.082 -1.866 1.00 0.00 H new ATOM 2116 N LEU A 139 1.958 -0.089 -4.191 1.00 0.00 N ATOM 2117 CA LEU A 139 0.938 0.725 -4.828 1.00 0.00 C ATOM 2118 C LEU A 139 1.466 1.507 -6.026 1.00 0.00 C ATOM 2119 O LEU A 139 0.743 1.767 -6.973 1.00 0.00 O ATOM 2120 CB LEU A 139 0.415 1.698 -3.791 1.00 0.00 C ATOM 2121 CG LEU A 139 -0.435 1.027 -2.689 1.00 0.00 C ATOM 2122 CD1 LEU A 139 -0.928 2.031 -1.649 1.00 0.00 C ATOM 2123 CD2 LEU A 139 -1.660 0.330 -3.241 1.00 0.00 C ATOM 0 H LEU A 139 2.323 0.312 -3.327 1.00 0.00 H new ATOM 0 HA LEU A 139 0.156 0.064 -5.203 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.258 2.210 -3.327 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -0.186 2.459 -4.289 1.00 0.00 H new ATOM 0 HG LEU A 139 0.236 0.300 -2.232 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.521 1.513 -0.895 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.073 2.510 -1.172 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.543 2.788 -2.137 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -2.220 -0.124 -2.423 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -2.291 1.056 -3.754 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.352 -0.445 -3.944 1.00 0.00 H new ATOM 2135 N ALA A 140 2.704 1.952 -5.976 1.00 0.00 N ATOM 2136 CA ALA A 140 3.409 2.393 -7.178 1.00 0.00 C ATOM 2137 C ALA A 140 3.554 1.300 -8.263 1.00 0.00 C ATOM 2138 O ALA A 140 4.022 1.645 -9.351 1.00 0.00 O ATOM 2139 CB ALA A 140 4.766 3.005 -6.810 1.00 0.00 C ATOM 0 H ALA A 140 3.250 2.021 -5.117 1.00 0.00 H new ATOM 0 HA ALA A 140 2.783 3.161 -7.633 1.00 0.00 H new ATOM 0 HB1 ALA A 140 5.277 3.328 -7.717 1.00 0.00 H new ATOM 0 HB2 ALA A 140 4.613 3.863 -6.155 1.00 0.00 H new ATOM 0 HB3 ALA A 140 5.374 2.260 -6.296 1.00 0.00 H new ATOM 2145 N GLU A 141 3.193 0.032 -8.007 1.00 0.00 N ATOM 2146 CA GLU A 141 3.512 -1.118 -8.856 1.00 0.00 C ATOM 2147 C GLU A 141 2.313 -1.979 -9.302 1.00 0.00 C ATOM 2148 O GLU A 141 2.320 -2.501 -10.421 1.00 0.00 O ATOM 2149 CB GLU A 141 4.492 -1.990 -8.069 1.00 0.00 C ATOM 2150 CG GLU A 141 5.876 -1.349 -7.998 1.00 0.00 C ATOM 2151 CD GLU A 141 6.874 -2.198 -7.233 1.00 0.00 C ATOM 2152 OE1 GLU A 141 6.795 -2.277 -5.984 1.00 0.00 O ATOM 2153 OE2 GLU A 141 7.778 -2.697 -7.932 1.00 0.00 O ATOM 0 H GLU A 141 2.656 -0.224 -7.179 1.00 0.00 H new ATOM 0 HA GLU A 141 3.922 -0.722 -9.785 1.00 0.00 H new ATOM 0 HB2 GLU A 141 4.111 -2.149 -7.060 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.567 -2.970 -8.539 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.247 -1.181 -9.009 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.796 -0.372 -7.522 1.00 0.00 H new ATOM 2160 N VAL A 142 1.330 -2.215 -8.429 1.00 0.00 N ATOM 2161 CA VAL A 142 0.293 -3.232 -8.624 1.00 0.00 C ATOM 2162 C VAL A 142 -0.843 -2.676 -9.488 1.00 0.00 C ATOM 2163 O VAL A 142 -1.254 -3.363 -10.447 1.00 0.00 O ATOM 2164 CB VAL A 142 -0.169 -3.767 -7.249 1.00 0.00 C ATOM 2165 CG1 VAL A 142 -1.590 -4.341 -7.228 1.00 0.00 C ATOM 2166 CG2 VAL A 142 0.809 -4.858 -6.788 1.00 0.00 C ATOM 0 H VAL A 142 1.231 -1.698 -7.555 1.00 0.00 H new ATOM 0 HA VAL A 142 0.692 -4.084 -9.174 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.179 -2.907 -6.579 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.826 -4.691 -6.223 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -2.300 -3.566 -7.518 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -1.656 -5.174 -7.928 1.00 0.00 H new ATOM 0 HG21 VAL A 142 0.493 -5.243 -5.818 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.818 -5.670 -7.516 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.810 -4.436 -6.702 1.00 0.00 H new TER 2176 VAL A 142