USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1212 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 113 TYR OH : rot 164:sc= -0.869 USER MOD Set 1.2: A 116 LYS NZ :NH3+ 153:sc= 0.752 (180deg=-0.96) USER MOD Set 2.1: A 5 LYS NZ :NH3+ -108:sc= 0.965 (180deg=-0.423) USER MOD Set 2.2: A 91 TYR OH : rot 180:sc= -1.01 USER MOD Set 2.3: A 93 TYR OH : rot -168:sc= 1.24 USER MOD Set 2.4: A 98 MET CE :methyl 180:sc= -0.586 (180deg=-0.556) USER MOD Set 2.5: A 121 HIS : no HE2:sc= 0.878 K(o=1.5,f=-4.4) USER MOD Set 3.1: A 2 THR OG1 : rot 180:sc= 0.00898 USER MOD Set 3.2: A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 1 ALA N :NH3+ 132:sc= 0.0925 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.00422 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 HIS : no HE2:sc= -1.92! C(o=-1.9!,f=-3.3!) USER MOD Single : A 9 LYS NZ :NH3+ 158:sc= -0.0997 (180deg=-0.577) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 166:sc= -0.0137 (180deg=-0.172) USER MOD Single : A 22 THR OG1 : rot 67:sc= 1.19 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -125:sc= -2 (180deg=-4.58!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -171:sc= 1.14 (180deg=1.07) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 MET CE :methyl 139:sc= -0.222 (180deg=-4.74!) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.205 USER MOD Single : A 41 THR OG1 : rot 157:sc= -0.976 USER MOD Single : A 44 THR OG1 : rot 177:sc= 1.07 USER MOD Single : A 45 LYS NZ :NH3+ 169:sc= -0.0177 (180deg=-0.194) USER MOD Single : A 46 HIS : no HD1:sc= -0.226 X(o=-0.23,f=-0.078) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0366) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 77:sc= 0.694 USER MOD Single : A 63 LYS NZ :NH3+ 169:sc= -0.0221 (180deg=-0.152) USER MOD Single : A 64 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0464) USER MOD Single : A 65 MET CE :methyl 137:sc= -0.322 (180deg=-3.11!) USER MOD Single : A 68 ASN : amide:sc= -1.62 K(o=-1.6,f=-0.47) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 161:sc= 1.26 (180deg=1.01) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= -1.89! K(o=-1.9!,f=-0.15) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -177:sc= 1.21 (180deg=1.15) USER MOD Single : A 100 ASN : amide:sc= 1.09 K(o=1.1,f=-7.6!) USER MOD Single : A 106 GLN : amide:sc= -1.11 K(o=-1.1,f=-0.2) USER MOD Single : A 110 LYS NZ :NH3+ 179:sc= 1.18 (180deg=1.18) USER MOD Single : A 115 TYR OH : rot -122:sc= 0.733 USER MOD Single : A 118 ASN : amide:sc= -12.1! C(o=-12!,f=-21!) USER MOD Single : A 119 ASN : amide:sc= -1.21 K(o=-1.2,f=-0.0037) USER MOD Single : A 120 THR OG1 : rot 110:sc= 0.717 USER MOD Single : A 123 GLN : amide:sc= -2.37! C(o=-2.4!,f=-3.5!) USER MOD Single : A 127 LYS NZ :NH3+ 172:sc=-0.00327 (180deg=-0.0985) USER MOD Single : A 131 GLN : amide:sc= -0.571 X(o=-0.57,f=-0.76) USER MOD Single : A 133 LYS NZ :NH3+ 174:sc= 1.31 (180deg=1.05) USER MOD Single : A 134 LYS NZ :NH3+ -160:sc= -0.118 (180deg=-0.536) USER MOD Single : A 136 LYS NZ :NH3+ 171:sc=-0.00172 (180deg=-0.0874) USER MOD Single : A 138 ASN : amide:sc= 0.152 X(o=0.15,f=-0.28) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0.868 K(o=0.87,f=-2.7!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 149 GLN : amide:sc= -2.58! K(o=-2.6!,f=-1.8) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -15.855 18.801 7.996 1.00 0.00 N ATOM 2 CA ALA A 1 -15.391 17.563 7.394 1.00 0.00 C ATOM 3 C ALA A 1 -15.464 16.458 8.427 1.00 0.00 C ATOM 4 O ALA A 1 -15.299 16.719 9.621 1.00 0.00 O ATOM 5 CB ALA A 1 -13.972 17.737 6.896 1.00 0.00 C ATOM 0 H1 ALA A 1 -15.180 19.564 7.785 1.00 0.00 H new ATOM 0 H2 ALA A 1 -16.788 19.047 7.608 1.00 0.00 H new ATOM 0 H3 ALA A 1 -15.929 18.680 9.026 1.00 0.00 H new ATOM 0 HA ALA A 1 -16.021 17.300 6.545 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -13.628 16.806 6.445 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -13.943 18.533 6.152 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -13.322 17.997 7.732 1.00 0.00 H new ATOM 13 N THR A 2 -15.716 15.243 7.989 1.00 0.00 N ATOM 14 CA THR A 2 -15.796 14.115 8.888 1.00 0.00 C ATOM 15 C THR A 2 -14.388 13.598 9.152 1.00 0.00 C ATOM 16 O THR A 2 -13.983 13.338 10.299 1.00 0.00 O ATOM 17 CB THR A 2 -16.685 13.002 8.279 1.00 0.00 C ATOM 18 OG1 THR A 2 -16.244 12.707 6.926 1.00 0.00 O ATOM 19 CG2 THR A 2 -18.143 13.437 8.253 1.00 0.00 C ATOM 0 H THR A 2 -15.870 15.012 7.008 1.00 0.00 H new ATOM 0 HA THR A 2 -16.250 14.425 9.829 1.00 0.00 H new ATOM 0 HB THR A 2 -16.595 12.109 8.897 1.00 0.00 H new ATOM 0 HG1 THR A 2 -16.807 12.002 6.545 1.00 0.00 H new ATOM 0 HG21 THR A 2 -18.752 12.642 7.822 1.00 0.00 H new ATOM 0 HG22 THR A 2 -18.480 13.642 9.269 1.00 0.00 H new ATOM 0 HG23 THR A 2 -18.243 14.339 7.649 1.00 0.00 H new ATOM 27 N SER A 3 -13.652 13.480 8.089 1.00 0.00 N ATOM 28 CA SER A 3 -12.280 13.103 8.122 1.00 0.00 C ATOM 29 C SER A 3 -11.496 14.298 7.595 1.00 0.00 C ATOM 30 O SER A 3 -12.100 15.262 7.150 1.00 0.00 O ATOM 31 CB SER A 3 -12.093 11.867 7.244 1.00 0.00 C ATOM 32 OG SER A 3 -13.025 10.865 7.637 1.00 0.00 O ATOM 0 H SER A 3 -14.005 13.650 7.147 1.00 0.00 H new ATOM 0 HA SER A 3 -11.933 12.848 9.123 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.241 12.126 6.196 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.075 11.490 7.339 1.00 0.00 H new ATOM 0 HG SER A 3 -12.909 10.071 7.074 1.00 0.00 H new ATOM 38 N THR A 4 -10.193 14.246 7.603 1.00 0.00 N ATOM 39 CA THR A 4 -9.387 15.371 7.149 1.00 0.00 C ATOM 40 C THR A 4 -9.248 15.358 5.597 1.00 0.00 C ATOM 41 O THR A 4 -8.388 16.031 5.005 1.00 0.00 O ATOM 42 CB THR A 4 -8.015 15.298 7.806 1.00 0.00 C ATOM 43 OG1 THR A 4 -8.158 14.722 9.131 1.00 0.00 O ATOM 44 CG2 THR A 4 -7.424 16.695 7.956 1.00 0.00 C ATOM 0 H THR A 4 -9.655 13.439 7.918 1.00 0.00 H new ATOM 0 HA THR A 4 -9.878 16.302 7.433 1.00 0.00 H new ATOM 0 HB THR A 4 -7.359 14.689 7.184 1.00 0.00 H new ATOM 0 HG1 THR A 4 -7.279 14.669 9.561 1.00 0.00 H new ATOM 0 HG21 THR A 4 -6.443 16.627 8.427 1.00 0.00 H new ATOM 0 HG22 THR A 4 -7.323 17.155 6.973 1.00 0.00 H new ATOM 0 HG23 THR A 4 -8.082 17.304 8.575 1.00 0.00 H new ATOM 52 N LYS A 5 -10.131 14.608 4.974 1.00 0.00 N ATOM 53 CA LYS A 5 -10.223 14.416 3.554 1.00 0.00 C ATOM 54 C LYS A 5 -11.502 13.649 3.330 1.00 0.00 C ATOM 55 O LYS A 5 -12.226 13.382 4.306 1.00 0.00 O ATOM 56 CB LYS A 5 -9.063 13.549 3.063 1.00 0.00 C ATOM 57 CG LYS A 5 -9.100 12.094 3.549 1.00 0.00 C ATOM 58 CD LYS A 5 -7.904 11.324 3.053 1.00 0.00 C ATOM 59 CE LYS A 5 -6.645 11.834 3.702 1.00 0.00 C ATOM 60 NZ LYS A 5 -6.637 11.557 5.155 1.00 0.00 N ATOM 0 H LYS A 5 -10.845 14.087 5.483 1.00 0.00 H new ATOM 0 HA LYS A 5 -10.197 15.370 3.028 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -9.060 13.554 1.973 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -8.126 14.002 3.387 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -9.124 12.072 4.639 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -10.015 11.614 3.201 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -8.030 10.264 3.272 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -7.826 11.419 1.970 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.778 11.366 3.236 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -6.556 12.907 3.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -6.778 12.445 5.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -7.404 10.893 5.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -5.724 11.138 5.423 1.00 0.00 H new ATOM 74 N LYS A 6 -11.804 13.311 2.106 1.00 0.00 N ATOM 75 CA LYS A 6 -12.832 12.361 1.859 1.00 0.00 C ATOM 76 C LYS A 6 -12.455 11.389 0.770 1.00 0.00 C ATOM 77 O LYS A 6 -12.360 11.739 -0.419 1.00 0.00 O ATOM 78 CB LYS A 6 -14.246 12.911 1.625 1.00 0.00 C ATOM 79 CG LYS A 6 -15.202 11.735 1.415 1.00 0.00 C ATOM 80 CD LYS A 6 -16.655 12.084 1.296 1.00 0.00 C ATOM 81 CE LYS A 6 -17.431 10.797 1.054 1.00 0.00 C ATOM 82 NZ LYS A 6 -18.883 10.977 1.068 1.00 0.00 N ATOM 0 H LYS A 6 -11.349 13.683 1.272 1.00 0.00 H new ATOM 0 HA LYS A 6 -12.903 11.841 2.814 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -14.565 13.509 2.479 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -14.257 13.567 0.754 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -14.901 11.204 0.512 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -15.082 11.042 2.247 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -17.005 12.574 2.205 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -16.813 12.784 0.475 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -17.134 10.379 0.092 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -17.156 10.068 1.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -19.348 10.062 0.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -19.178 11.348 1.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -19.157 11.649 0.323 1.00 0.00 H new ATOM 96 N LEU A 7 -12.196 10.203 1.210 1.00 0.00 N ATOM 97 CA LEU A 7 -12.004 9.031 0.401 1.00 0.00 C ATOM 98 C LEU A 7 -12.853 8.008 1.052 1.00 0.00 C ATOM 99 O LEU A 7 -13.423 8.285 2.124 1.00 0.00 O ATOM 100 CB LEU A 7 -10.548 8.586 0.397 1.00 0.00 C ATOM 101 CG LEU A 7 -9.527 9.587 -0.111 1.00 0.00 C ATOM 102 CD1 LEU A 7 -8.126 9.027 0.045 1.00 0.00 C ATOM 103 CD2 LEU A 7 -9.797 9.931 -1.559 1.00 0.00 C ATOM 0 H LEU A 7 -12.106 10.007 2.207 1.00 0.00 H new ATOM 0 HA LEU A 7 -12.264 9.206 -0.643 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.275 8.309 1.415 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -10.470 7.684 -0.210 1.00 0.00 H new ATOM 0 HG LEU A 7 -9.609 10.499 0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.401 9.753 -0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -7.932 8.821 1.098 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.037 8.104 -0.528 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -9.055 10.650 -1.907 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -9.738 9.027 -2.165 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -10.793 10.364 -1.650 1.00 0.00 H new ATOM 115 N HIS A 8 -12.984 6.868 0.482 1.00 0.00 N ATOM 116 CA HIS A 8 -13.861 5.947 1.090 1.00 0.00 C ATOM 117 C HIS A 8 -13.185 4.743 1.618 1.00 0.00 C ATOM 118 O HIS A 8 -12.636 3.909 0.880 1.00 0.00 O ATOM 119 CB HIS A 8 -15.104 5.648 0.267 1.00 0.00 C ATOM 120 CG HIS A 8 -14.933 4.845 -1.001 1.00 0.00 C ATOM 121 ND1 HIS A 8 -15.900 3.993 -1.500 1.00 0.00 N ATOM 122 CD2 HIS A 8 -13.910 4.794 -1.884 1.00 0.00 C ATOM 123 CE1 HIS A 8 -15.444 3.469 -2.636 1.00 0.00 C ATOM 124 NE2 HIS A 8 -14.240 3.923 -2.917 1.00 0.00 N ATOM 0 H HIS A 8 -12.516 6.560 -0.370 1.00 0.00 H new ATOM 0 HA HIS A 8 -14.237 6.461 1.974 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -15.810 5.118 0.907 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -15.567 6.599 0.002 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -16.806 3.799 -1.072 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -12.984 5.343 -1.800 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -15.989 2.765 -3.246 1.00 0.00 H new ATOM 132 N LYS A 9 -13.162 4.704 2.898 1.00 0.00 N ATOM 133 CA LYS A 9 -12.657 3.645 3.626 1.00 0.00 C ATOM 134 C LYS A 9 -13.649 2.502 3.528 1.00 0.00 C ATOM 135 O LYS A 9 -14.858 2.719 3.615 1.00 0.00 O ATOM 136 CB LYS A 9 -12.510 4.074 5.063 1.00 0.00 C ATOM 137 CG LYS A 9 -11.597 3.196 5.822 1.00 0.00 C ATOM 138 CD LYS A 9 -10.183 3.424 5.405 1.00 0.00 C ATOM 139 CE LYS A 9 -9.606 4.692 6.003 1.00 0.00 C ATOM 140 NZ LYS A 9 -9.556 4.627 7.476 1.00 0.00 N ATOM 0 H LYS A 9 -13.519 5.461 3.480 1.00 0.00 H new ATOM 0 HA LYS A 9 -11.685 3.331 3.245 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -12.137 5.098 5.097 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -13.490 4.075 5.541 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -11.703 3.388 6.890 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -11.867 2.153 5.658 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -9.575 2.572 5.709 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -10.132 3.481 4.318 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.602 4.855 5.612 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -10.210 5.546 5.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -8.847 5.301 7.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -10.489 4.870 7.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.296 3.665 7.772 1.00 0.00 H new ATOM 154 N GLU A 10 -13.158 1.331 3.383 1.00 0.00 N ATOM 155 CA GLU A 10 -13.951 0.168 3.158 1.00 0.00 C ATOM 156 C GLU A 10 -13.293 -0.961 3.873 1.00 0.00 C ATOM 157 O GLU A 10 -12.071 -0.960 3.999 1.00 0.00 O ATOM 158 CB GLU A 10 -13.967 -0.158 1.669 1.00 0.00 C ATOM 159 CG GLU A 10 -14.852 0.720 0.790 1.00 0.00 C ATOM 160 CD GLU A 10 -16.318 0.415 0.956 1.00 0.00 C ATOM 161 OE1 GLU A 10 -16.777 -0.634 0.451 1.00 0.00 O ATOM 162 OE2 GLU A 10 -17.049 1.210 1.564 1.00 0.00 O ATOM 0 H GLU A 10 -12.157 1.140 3.418 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.971 0.329 3.508 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.945 -0.095 1.295 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.287 -1.193 1.550 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -14.673 1.768 1.032 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -14.572 0.582 -0.254 1.00 0.00 H new ATOM 169 N PRO A 11 -14.039 -1.899 4.398 1.00 0.00 N ATOM 170 CA PRO A 11 -13.463 -3.056 5.022 1.00 0.00 C ATOM 171 C PRO A 11 -13.145 -4.133 3.991 1.00 0.00 C ATOM 172 O PRO A 11 -13.912 -4.352 3.027 1.00 0.00 O ATOM 173 CB PRO A 11 -14.568 -3.522 5.986 1.00 0.00 C ATOM 174 CG PRO A 11 -15.587 -2.433 5.923 1.00 0.00 C ATOM 175 CD PRO A 11 -15.490 -1.909 4.541 1.00 0.00 C ATOM 0 HA PRO A 11 -12.519 -2.845 5.524 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -14.988 -4.480 5.678 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -14.185 -3.652 6.998 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -16.587 -2.813 6.133 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -15.381 -1.654 6.657 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -15.980 -2.554 3.812 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -15.930 -0.917 4.436 1.00 0.00 H new ATOM 183 N ALA A 12 -12.031 -4.770 4.175 1.00 0.00 N ATOM 184 CA ALA A 12 -11.574 -5.828 3.333 1.00 0.00 C ATOM 185 C ALA A 12 -11.090 -6.955 4.203 1.00 0.00 C ATOM 186 O ALA A 12 -10.979 -6.801 5.430 1.00 0.00 O ATOM 187 CB ALA A 12 -10.451 -5.325 2.433 1.00 0.00 C ATOM 0 H ALA A 12 -11.393 -4.559 4.943 1.00 0.00 H new ATOM 0 HA ALA A 12 -12.386 -6.182 2.697 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -10.106 -6.137 1.793 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -10.819 -4.507 1.814 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -9.623 -4.971 3.047 1.00 0.00 H new ATOM 193 N THR A 13 -10.860 -8.079 3.618 1.00 0.00 N ATOM 194 CA THR A 13 -10.354 -9.200 4.368 1.00 0.00 C ATOM 195 C THR A 13 -9.125 -9.767 3.665 1.00 0.00 C ATOM 196 O THR A 13 -9.099 -9.838 2.454 1.00 0.00 O ATOM 197 CB THR A 13 -11.443 -10.278 4.510 1.00 0.00 C ATOM 198 OG1 THR A 13 -12.652 -9.675 5.015 1.00 0.00 O ATOM 199 CG2 THR A 13 -10.996 -11.353 5.463 1.00 0.00 C ATOM 0 H THR A 13 -11.010 -8.257 2.625 1.00 0.00 H new ATOM 0 HA THR A 13 -10.070 -8.870 5.367 1.00 0.00 H new ATOM 0 HB THR A 13 -11.626 -10.722 3.531 1.00 0.00 H new ATOM 0 HG1 THR A 13 -13.347 -10.360 5.104 1.00 0.00 H new ATOM 0 HG21 THR A 13 -11.777 -12.108 5.552 1.00 0.00 H new ATOM 0 HG22 THR A 13 -10.085 -11.817 5.086 1.00 0.00 H new ATOM 0 HG23 THR A 13 -10.802 -10.914 6.442 1.00 0.00 H new ATOM 207 N LEU A 14 -8.114 -10.133 4.410 1.00 0.00 N ATOM 208 CA LEU A 14 -6.905 -10.649 3.819 1.00 0.00 C ATOM 209 C LEU A 14 -7.114 -12.034 3.204 1.00 0.00 C ATOM 210 O LEU A 14 -7.534 -12.975 3.875 1.00 0.00 O ATOM 211 CB LEU A 14 -5.732 -10.600 4.840 1.00 0.00 C ATOM 212 CG LEU A 14 -4.326 -11.075 4.385 1.00 0.00 C ATOM 213 CD1 LEU A 14 -4.155 -12.575 4.514 1.00 0.00 C ATOM 214 CD2 LEU A 14 -4.043 -10.636 2.954 1.00 0.00 C ATOM 0 H LEU A 14 -8.103 -10.083 5.429 1.00 0.00 H new ATOM 0 HA LEU A 14 -6.627 -10.002 2.987 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -5.637 -9.570 5.185 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -6.020 -11.200 5.703 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.604 -10.604 5.052 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -3.155 -12.857 4.183 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -4.289 -12.868 5.555 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -4.897 -13.080 3.896 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.052 -10.980 2.657 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -4.791 -11.065 2.287 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.083 -9.548 2.892 1.00 0.00 H new ATOM 226 N ILE A 15 -6.870 -12.115 1.912 1.00 0.00 N ATOM 227 CA ILE A 15 -6.916 -13.360 1.197 1.00 0.00 C ATOM 228 C ILE A 15 -5.507 -13.847 0.947 1.00 0.00 C ATOM 229 O ILE A 15 -5.164 -14.991 1.267 1.00 0.00 O ATOM 230 CB ILE A 15 -7.715 -13.247 -0.134 1.00 0.00 C ATOM 231 CG1 ILE A 15 -9.172 -12.888 0.173 1.00 0.00 C ATOM 232 CG2 ILE A 15 -7.639 -14.546 -0.939 1.00 0.00 C ATOM 233 CD1 ILE A 15 -10.054 -12.782 -1.045 1.00 0.00 C ATOM 0 H ILE A 15 -6.633 -11.311 1.331 1.00 0.00 H new ATOM 0 HA ILE A 15 -7.447 -14.086 1.812 1.00 0.00 H new ATOM 0 HB ILE A 15 -7.270 -12.459 -0.741 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -9.586 -13.641 0.843 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -9.195 -11.939 0.708 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -8.207 -14.435 -1.863 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -6.598 -14.766 -1.177 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.058 -15.363 -0.352 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.068 -12.525 -0.739 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -9.668 -12.008 -1.708 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -10.065 -13.737 -1.571 1.00 0.00 H new ATOM 245 N LYS A 16 -4.670 -12.979 0.431 1.00 0.00 N ATOM 246 CA LYS A 16 -3.303 -13.362 0.136 1.00 0.00 C ATOM 247 C LYS A 16 -2.472 -12.120 0.036 1.00 0.00 C ATOM 248 O LYS A 16 -2.948 -11.131 -0.422 1.00 0.00 O ATOM 249 CB LYS A 16 -3.262 -14.081 -1.219 1.00 0.00 C ATOM 250 CG LYS A 16 -1.922 -14.678 -1.592 1.00 0.00 C ATOM 251 CD LYS A 16 -1.940 -15.156 -3.027 1.00 0.00 C ATOM 252 CE LYS A 16 -0.668 -15.891 -3.399 1.00 0.00 C ATOM 253 NZ LYS A 16 -0.543 -17.172 -2.679 1.00 0.00 N ATOM 0 H LYS A 16 -4.904 -12.012 0.207 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.924 -14.018 0.920 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -4.007 -14.877 -1.213 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -3.556 -13.375 -1.996 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.136 -13.935 -1.459 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -1.690 -15.510 -0.927 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -2.796 -15.814 -3.179 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -2.072 -14.302 -3.691 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -0.656 -16.076 -4.473 1.00 0.00 H new ATOM 0 HE3 LYS A 16 0.194 -15.262 -3.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 0.199 -17.749 -3.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -0.292 -16.989 -1.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -1.448 -17.682 -2.719 1.00 0.00 H new ATOM 267 N ALA A 17 -1.273 -12.148 0.490 1.00 0.00 N ATOM 268 CA ALA A 17 -0.382 -11.033 0.271 1.00 0.00 C ATOM 269 C ALA A 17 0.557 -11.448 -0.824 1.00 0.00 C ATOM 270 O ALA A 17 1.088 -12.558 -0.775 1.00 0.00 O ATOM 271 CB ALA A 17 0.345 -10.681 1.536 1.00 0.00 C ATOM 0 H ALA A 17 -0.872 -12.923 1.017 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.926 -10.135 -0.021 1.00 0.00 H new ATOM 0 HB1 ALA A 17 1.011 -9.839 1.350 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -0.376 -10.410 2.307 1.00 0.00 H new ATOM 0 HB3 ALA A 17 0.929 -11.538 1.871 1.00 0.00 H new ATOM 277 N ILE A 18 0.754 -10.615 -1.833 1.00 0.00 N ATOM 278 CA ILE A 18 1.451 -11.111 -2.990 1.00 0.00 C ATOM 279 C ILE A 18 2.909 -10.665 -3.067 1.00 0.00 C ATOM 280 O ILE A 18 3.809 -11.449 -2.787 1.00 0.00 O ATOM 281 CB ILE A 18 0.671 -10.782 -4.293 1.00 0.00 C ATOM 282 CG1 ILE A 18 -0.809 -11.137 -4.060 1.00 0.00 C ATOM 283 CG2 ILE A 18 1.244 -11.564 -5.472 1.00 0.00 C ATOM 284 CD1 ILE A 18 -1.729 -11.044 -5.238 1.00 0.00 C ATOM 0 H ILE A 18 0.455 -9.640 -1.871 1.00 0.00 H new ATOM 0 HA ILE A 18 1.491 -12.195 -2.882 1.00 0.00 H new ATOM 0 HB ILE A 18 0.764 -9.723 -4.534 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -0.855 -12.156 -3.675 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -1.194 -10.483 -3.278 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.685 -11.321 -6.376 1.00 0.00 H new ATOM 0 HG22 ILE A 18 2.292 -11.298 -5.610 1.00 0.00 H new ATOM 0 HG23 ILE A 18 1.165 -12.633 -5.273 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -2.739 -11.321 -4.934 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -1.732 -10.022 -5.618 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -1.387 -11.721 -6.021 1.00 0.00 H new ATOM 296 N ASP A 19 3.158 -9.418 -3.385 1.00 0.00 N ATOM 297 CA ASP A 19 4.577 -8.997 -3.631 1.00 0.00 C ATOM 298 C ASP A 19 4.960 -7.807 -2.847 1.00 0.00 C ATOM 299 O ASP A 19 5.959 -7.150 -3.119 1.00 0.00 O ATOM 300 CB ASP A 19 4.810 -8.659 -5.076 1.00 0.00 C ATOM 301 CG ASP A 19 4.945 -9.850 -5.989 1.00 0.00 C ATOM 302 OD1 ASP A 19 5.993 -10.558 -5.928 1.00 0.00 O ATOM 303 OD2 ASP A 19 4.035 -10.104 -6.789 1.00 0.00 O ATOM 0 H ASP A 19 2.457 -8.684 -3.484 1.00 0.00 H new ATOM 0 HA ASP A 19 5.182 -9.852 -3.327 1.00 0.00 H new ATOM 0 HB2 ASP A 19 3.984 -8.041 -5.428 1.00 0.00 H new ATOM 0 HB3 ASP A 19 5.715 -8.056 -5.152 1.00 0.00 H new ATOM 308 N GLY A 20 4.214 -7.548 -1.881 1.00 0.00 N ATOM 309 CA GLY A 20 4.375 -6.335 -1.157 1.00 0.00 C ATOM 310 C GLY A 20 3.469 -5.381 -1.791 1.00 0.00 C ATOM 311 O GLY A 20 2.321 -5.249 -1.390 1.00 0.00 O ATOM 0 H GLY A 20 3.465 -8.154 -1.548 1.00 0.00 H new ATOM 0 HA2 GLY A 20 4.129 -6.470 -0.104 1.00 0.00 H new ATOM 0 HA3 GLY A 20 5.407 -5.986 -1.201 1.00 0.00 H new ATOM 315 N ASP A 21 3.909 -4.851 -2.898 1.00 0.00 N ATOM 316 CA ASP A 21 3.085 -4.022 -3.679 1.00 0.00 C ATOM 317 C ASP A 21 2.353 -4.857 -4.655 1.00 0.00 C ATOM 318 O ASP A 21 2.787 -5.031 -5.788 1.00 0.00 O ATOM 319 CB ASP A 21 3.776 -2.809 -4.316 1.00 0.00 C ATOM 320 CG ASP A 21 2.933 -2.147 -5.386 1.00 0.00 C ATOM 321 OD1 ASP A 21 1.706 -2.025 -5.208 1.00 0.00 O ATOM 322 OD2 ASP A 21 3.493 -1.755 -6.442 1.00 0.00 O ATOM 0 H ASP A 21 4.849 -4.991 -3.269 1.00 0.00 H new ATOM 0 HA ASP A 21 2.378 -3.546 -3.000 1.00 0.00 H new ATOM 0 HB2 ASP A 21 4.008 -2.080 -3.540 1.00 0.00 H new ATOM 0 HB3 ASP A 21 4.725 -3.124 -4.751 1.00 0.00 H new ATOM 327 N THR A 22 1.442 -5.591 -4.050 1.00 0.00 N ATOM 328 CA THR A 22 0.320 -6.336 -4.603 1.00 0.00 C ATOM 329 C THR A 22 -0.136 -7.331 -3.537 1.00 0.00 C ATOM 330 O THR A 22 0.708 -8.105 -2.954 1.00 0.00 O ATOM 331 CB THR A 22 0.477 -7.110 -5.971 1.00 0.00 C ATOM 332 OG1 THR A 22 1.027 -6.286 -7.003 1.00 0.00 O ATOM 333 CG2 THR A 22 -0.903 -7.434 -6.454 1.00 0.00 C ATOM 0 H THR A 22 1.471 -5.694 -3.036 1.00 0.00 H new ATOM 0 HA THR A 22 -0.391 -5.553 -4.866 1.00 0.00 H new ATOM 0 HB THR A 22 1.121 -7.970 -5.791 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.954 -6.060 -6.781 1.00 0.00 H new ATOM 0 HG21 THR A 22 -0.840 -7.971 -7.400 1.00 0.00 H new ATOM 0 HG22 THR A 22 -1.410 -8.056 -5.716 1.00 0.00 H new ATOM 0 HG23 THR A 22 -1.464 -6.511 -6.597 1.00 0.00 H new ATOM 341 N VAL A 23 -1.423 -7.290 -3.239 1.00 0.00 N ATOM 342 CA VAL A 23 -2.046 -8.134 -2.231 1.00 0.00 C ATOM 343 C VAL A 23 -3.377 -8.656 -2.835 1.00 0.00 C ATOM 344 O VAL A 23 -3.768 -8.201 -3.869 1.00 0.00 O ATOM 345 CB VAL A 23 -2.393 -7.268 -0.959 1.00 0.00 C ATOM 346 CG1 VAL A 23 -2.793 -8.087 0.256 1.00 0.00 C ATOM 347 CG2 VAL A 23 -1.297 -6.285 -0.607 1.00 0.00 C ATOM 0 H VAL A 23 -2.078 -6.657 -3.699 1.00 0.00 H new ATOM 0 HA VAL A 23 -1.379 -8.948 -1.948 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.275 -6.699 -1.252 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.016 -7.419 1.088 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.677 -8.680 0.020 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -1.974 -8.751 0.533 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.589 -5.716 0.276 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -0.374 -6.827 -0.401 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -1.138 -5.603 -1.442 1.00 0.00 H new ATOM 357 N LYS A 24 -4.004 -9.628 -2.229 1.00 0.00 N ATOM 358 CA LYS A 24 -5.365 -10.025 -2.563 1.00 0.00 C ATOM 359 C LYS A 24 -6.204 -9.909 -1.354 1.00 0.00 C ATOM 360 O LYS A 24 -5.952 -10.601 -0.328 1.00 0.00 O ATOM 361 CB LYS A 24 -5.546 -11.445 -3.111 1.00 0.00 C ATOM 362 CG LYS A 24 -5.484 -11.569 -4.630 1.00 0.00 C ATOM 363 CD LYS A 24 -5.762 -12.999 -5.100 1.00 0.00 C ATOM 364 CE LYS A 24 -7.175 -13.477 -4.711 1.00 0.00 C ATOM 365 NZ LYS A 24 -7.446 -14.847 -5.182 1.00 0.00 N ATOM 0 H LYS A 24 -3.588 -10.180 -1.479 1.00 0.00 H new ATOM 0 HA LYS A 24 -5.655 -9.353 -3.370 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.776 -12.085 -2.679 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.508 -11.829 -2.770 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -6.211 -10.892 -5.079 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.500 -11.257 -4.979 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.648 -13.052 -6.183 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.021 -13.672 -4.668 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.285 -13.438 -3.627 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.916 -12.797 -5.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.406 -15.128 -4.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.367 -14.880 -6.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.756 -15.502 -4.762 1.00 0.00 H new ATOM 379 N LEU A 25 -7.181 -9.067 -1.438 1.00 0.00 N ATOM 380 CA LEU A 25 -8.084 -8.872 -0.357 1.00 0.00 C ATOM 381 C LEU A 25 -9.505 -9.172 -0.798 1.00 0.00 C ATOM 382 O LEU A 25 -9.816 -9.160 -1.985 1.00 0.00 O ATOM 383 CB LEU A 25 -7.993 -7.441 0.153 1.00 0.00 C ATOM 384 CG LEU A 25 -6.627 -6.968 0.622 1.00 0.00 C ATOM 385 CD1 LEU A 25 -6.677 -5.501 0.913 1.00 0.00 C ATOM 386 CD2 LEU A 25 -6.178 -7.728 1.850 1.00 0.00 C ATOM 0 H LEU A 25 -7.374 -8.495 -2.260 1.00 0.00 H new ATOM 0 HA LEU A 25 -7.812 -9.554 0.449 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -8.329 -6.775 -0.642 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -8.694 -7.330 0.980 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.904 -7.157 -0.172 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.697 -5.163 1.249 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.957 -4.960 0.009 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -7.414 -5.310 1.693 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.198 -7.368 2.162 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.895 -7.573 2.656 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.117 -8.791 1.618 1.00 0.00 H new ATOM 398 N MET A 26 -10.315 -9.500 0.155 1.00 0.00 N ATOM 399 CA MET A 26 -11.735 -9.712 -0.006 1.00 0.00 C ATOM 400 C MET A 26 -12.334 -8.378 0.174 1.00 0.00 C ATOM 401 O MET A 26 -12.172 -7.784 1.224 1.00 0.00 O ATOM 402 CB MET A 26 -12.244 -10.562 1.142 1.00 0.00 C ATOM 403 CG MET A 26 -13.724 -10.983 1.127 1.00 0.00 C ATOM 404 SD MET A 26 -14.029 -12.651 0.479 1.00 0.00 S ATOM 405 CE MET A 26 -13.814 -12.443 -1.280 1.00 0.00 C ATOM 0 H MET A 26 -10.000 -9.636 1.115 1.00 0.00 H new ATOM 0 HA MET A 26 -11.967 -10.185 -0.960 1.00 0.00 H new ATOM 0 HB2 MET A 26 -11.639 -11.468 1.181 1.00 0.00 H new ATOM 0 HB3 MET A 26 -12.061 -10.017 2.068 1.00 0.00 H new ATOM 0 HG2 MET A 26 -14.115 -10.925 2.143 1.00 0.00 H new ATOM 0 HG3 MET A 26 -14.286 -10.266 0.528 1.00 0.00 H new ATOM 0 HE1 MET A 26 -14.707 -12.792 -1.799 1.00 0.00 H new ATOM 0 HE2 MET A 26 -13.652 -11.389 -1.505 1.00 0.00 H new ATOM 0 HE3 MET A 26 -12.952 -13.021 -1.612 1.00 0.00 H new ATOM 415 N TYR A 27 -12.969 -7.913 -0.794 1.00 0.00 N ATOM 416 CA TYR A 27 -13.556 -6.656 -0.757 1.00 0.00 C ATOM 417 C TYR A 27 -14.978 -6.781 -1.214 1.00 0.00 C ATOM 418 O TYR A 27 -15.253 -7.232 -2.335 1.00 0.00 O ATOM 419 CB TYR A 27 -12.726 -5.705 -1.607 1.00 0.00 C ATOM 420 CG TYR A 27 -13.368 -4.377 -1.927 1.00 0.00 C ATOM 421 CD1 TYR A 27 -13.397 -3.364 -0.990 1.00 0.00 C ATOM 422 CD2 TYR A 27 -13.947 -4.136 -3.171 1.00 0.00 C ATOM 423 CE1 TYR A 27 -13.978 -2.155 -1.271 1.00 0.00 C ATOM 424 CE2 TYR A 27 -14.531 -2.922 -3.459 1.00 0.00 C ATOM 425 CZ TYR A 27 -14.544 -1.935 -2.499 1.00 0.00 C ATOM 426 OH TYR A 27 -15.116 -0.715 -2.774 1.00 0.00 O ATOM 0 H TYR A 27 -13.104 -8.411 -1.674 1.00 0.00 H new ATOM 0 HA TYR A 27 -13.578 -6.243 0.252 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -11.784 -5.517 -1.092 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -12.483 -6.205 -2.545 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -12.954 -3.527 -0.019 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -13.938 -4.913 -3.921 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -13.990 -1.375 -0.524 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -14.974 -2.746 -4.428 1.00 0.00 H new ATOM 0 HH TYR A 27 -15.472 -0.719 -3.687 1.00 0.00 H new ATOM 436 N LYS A 28 -15.869 -6.528 -0.277 1.00 0.00 N ATOM 437 CA LYS A 28 -17.312 -6.530 -0.464 1.00 0.00 C ATOM 438 C LYS A 28 -17.796 -7.915 -0.928 1.00 0.00 C ATOM 439 O LYS A 28 -18.852 -8.066 -1.567 1.00 0.00 O ATOM 440 CB LYS A 28 -17.714 -5.402 -1.427 1.00 0.00 C ATOM 441 CG LYS A 28 -19.187 -5.000 -1.353 1.00 0.00 C ATOM 442 CD LYS A 28 -19.488 -3.775 -2.213 1.00 0.00 C ATOM 443 CE LYS A 28 -18.614 -2.575 -1.834 1.00 0.00 C ATOM 444 NZ LYS A 28 -18.741 -2.215 -0.399 1.00 0.00 N ATOM 0 H LYS A 28 -15.598 -6.305 0.681 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.806 -6.334 0.487 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -17.100 -4.526 -1.217 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -17.486 -5.713 -2.446 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -19.808 -5.834 -1.680 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -19.454 -4.791 -0.317 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -19.329 -4.022 -3.263 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -20.539 -3.506 -2.105 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -17.572 -2.802 -2.058 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -18.892 -1.718 -2.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -18.255 -1.312 -0.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -19.747 -2.120 -0.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -18.310 -2.960 0.185 1.00 0.00 H new ATOM 458 N GLY A 29 -17.026 -8.922 -0.566 1.00 0.00 N ATOM 459 CA GLY A 29 -17.358 -10.272 -0.903 1.00 0.00 C ATOM 460 C GLY A 29 -16.671 -10.754 -2.160 1.00 0.00 C ATOM 461 O GLY A 29 -16.914 -11.870 -2.608 1.00 0.00 O ATOM 0 H GLY A 29 -16.162 -8.818 -0.034 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -17.086 -10.925 -0.074 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -18.437 -10.353 -1.032 1.00 0.00 H new ATOM 465 N GLN A 30 -15.803 -9.929 -2.736 1.00 0.00 N ATOM 466 CA GLN A 30 -15.100 -10.293 -3.942 1.00 0.00 C ATOM 467 C GLN A 30 -13.612 -10.224 -3.723 1.00 0.00 C ATOM 468 O GLN A 30 -13.137 -9.322 -3.053 1.00 0.00 O ATOM 469 CB GLN A 30 -15.476 -9.333 -5.022 1.00 0.00 C ATOM 470 CG GLN A 30 -16.932 -9.358 -5.335 1.00 0.00 C ATOM 471 CD GLN A 30 -17.311 -8.296 -6.331 1.00 0.00 C ATOM 472 OE1 GLN A 30 -17.644 -7.169 -5.956 1.00 0.00 O ATOM 473 NE2 GLN A 30 -17.255 -8.628 -7.590 1.00 0.00 N ATOM 0 H GLN A 30 -15.575 -9.001 -2.378 1.00 0.00 H new ATOM 0 HA GLN A 30 -15.370 -11.312 -4.221 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -15.191 -8.325 -4.721 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -14.911 -9.568 -5.924 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -17.202 -10.338 -5.729 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -17.503 -9.215 -4.417 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -16.974 -9.572 -7.857 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -17.492 -7.944 -8.309 1.00 0.00 H new ATOM 482 N PRO A 31 -12.846 -11.188 -4.232 1.00 0.00 N ATOM 483 CA PRO A 31 -11.416 -11.154 -4.109 1.00 0.00 C ATOM 484 C PRO A 31 -10.859 -10.201 -5.101 1.00 0.00 C ATOM 485 O PRO A 31 -11.310 -10.148 -6.256 1.00 0.00 O ATOM 486 CB PRO A 31 -10.955 -12.561 -4.472 1.00 0.00 C ATOM 487 CG PRO A 31 -12.185 -13.342 -4.702 1.00 0.00 C ATOM 488 CD PRO A 31 -13.287 -12.368 -4.976 1.00 0.00 C ATOM 0 HA PRO A 31 -11.096 -10.848 -3.113 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.328 -12.549 -5.363 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -10.360 -12.997 -3.669 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -12.056 -14.023 -5.543 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -12.420 -13.953 -3.831 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -13.393 -12.162 -6.041 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -14.251 -12.734 -4.624 1.00 0.00 H new ATOM 496 N MET A 32 -9.934 -9.440 -4.692 1.00 0.00 N ATOM 497 CA MET A 32 -9.339 -8.551 -5.593 1.00 0.00 C ATOM 498 C MET A 32 -7.909 -8.370 -5.251 1.00 0.00 C ATOM 499 O MET A 32 -7.529 -8.317 -4.069 1.00 0.00 O ATOM 500 CB MET A 32 -10.069 -7.216 -5.629 1.00 0.00 C ATOM 501 CG MET A 32 -9.806 -6.456 -6.934 1.00 0.00 C ATOM 502 SD MET A 32 -10.714 -4.907 -7.086 1.00 0.00 S ATOM 503 CE MET A 32 -10.029 -4.003 -5.720 1.00 0.00 C ATOM 0 H MET A 32 -9.571 -9.413 -3.739 1.00 0.00 H new ATOM 0 HA MET A 32 -9.410 -8.978 -6.593 1.00 0.00 H new ATOM 0 HB2 MET A 32 -11.140 -7.385 -5.517 1.00 0.00 H new ATOM 0 HB3 MET A 32 -9.752 -6.606 -4.783 1.00 0.00 H new ATOM 0 HG2 MET A 32 -8.739 -6.247 -7.010 1.00 0.00 H new ATOM 0 HG3 MET A 32 -10.066 -7.100 -7.774 1.00 0.00 H new ATOM 0 HE1 MET A 32 -9.857 -2.969 -6.018 1.00 0.00 H new ATOM 0 HE2 MET A 32 -10.725 -4.029 -4.881 1.00 0.00 H new ATOM 0 HE3 MET A 32 -9.084 -4.456 -5.421 1.00 0.00 H new ATOM 513 N THR A 33 -7.125 -8.364 -6.261 1.00 0.00 N ATOM 514 CA THR A 33 -5.747 -8.122 -6.175 1.00 0.00 C ATOM 515 C THR A 33 -5.566 -6.633 -5.945 1.00 0.00 C ATOM 516 O THR A 33 -5.808 -5.874 -6.819 1.00 0.00 O ATOM 517 CB THR A 33 -5.137 -8.502 -7.529 1.00 0.00 C ATOM 518 OG1 THR A 33 -6.120 -9.269 -8.268 1.00 0.00 O ATOM 519 CG2 THR A 33 -3.914 -9.363 -7.343 1.00 0.00 C ATOM 0 H THR A 33 -7.448 -8.537 -7.213 1.00 0.00 H new ATOM 0 HA THR A 33 -5.276 -8.689 -5.373 1.00 0.00 H new ATOM 0 HB THR A 33 -4.855 -7.592 -8.059 1.00 0.00 H new ATOM 0 HG1 THR A 33 -5.750 -9.521 -9.140 1.00 0.00 H new ATOM 0 HG21 THR A 33 -3.498 -9.620 -8.317 1.00 0.00 H new ATOM 0 HG22 THR A 33 -3.169 -8.817 -6.764 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.188 -10.275 -6.813 1.00 0.00 H new ATOM 527 N PHE A 34 -5.217 -6.234 -4.763 1.00 0.00 N ATOM 528 CA PHE A 34 -5.029 -4.839 -4.460 1.00 0.00 C ATOM 529 C PHE A 34 -3.598 -4.408 -4.692 1.00 0.00 C ATOM 530 O PHE A 34 -2.663 -5.236 -4.658 1.00 0.00 O ATOM 531 CB PHE A 34 -5.442 -4.485 -3.055 1.00 0.00 C ATOM 532 CG PHE A 34 -6.916 -4.399 -2.799 1.00 0.00 C ATOM 533 CD1 PHE A 34 -7.708 -5.522 -2.745 1.00 0.00 C ATOM 534 CD2 PHE A 34 -7.500 -3.164 -2.578 1.00 0.00 C ATOM 535 CE1 PHE A 34 -9.059 -5.420 -2.479 1.00 0.00 C ATOM 536 CE2 PHE A 34 -8.839 -3.053 -2.316 1.00 0.00 C ATOM 537 CZ PHE A 34 -9.623 -4.180 -2.264 1.00 0.00 C ATOM 0 H PHE A 34 -5.053 -6.862 -3.976 1.00 0.00 H new ATOM 0 HA PHE A 34 -5.682 -4.298 -5.145 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -5.019 -5.226 -2.377 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -4.993 -3.526 -2.798 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -7.268 -6.494 -2.912 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -6.890 -2.274 -2.613 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -9.672 -6.308 -2.439 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -9.279 -2.081 -2.150 1.00 0.00 H new ATOM 0 HZ PHE A 34 -10.679 -4.095 -2.055 1.00 0.00 H new ATOM 547 N ARG A 35 -3.439 -3.119 -4.887 1.00 0.00 N ATOM 548 CA ARG A 35 -2.201 -2.497 -5.227 1.00 0.00 C ATOM 549 C ARG A 35 -1.891 -1.443 -4.193 1.00 0.00 C ATOM 550 O ARG A 35 -2.798 -0.742 -3.727 1.00 0.00 O ATOM 551 CB ARG A 35 -2.384 -1.829 -6.591 1.00 0.00 C ATOM 552 CG ARG A 35 -1.111 -1.664 -7.390 1.00 0.00 C ATOM 553 CD ARG A 35 -0.358 -0.457 -6.934 1.00 0.00 C ATOM 554 NE ARG A 35 1.023 -0.472 -7.318 1.00 0.00 N ATOM 555 CZ ARG A 35 1.701 0.511 -7.893 1.00 0.00 C ATOM 556 NH1 ARG A 35 1.105 1.473 -8.586 1.00 0.00 N ATOM 557 NH2 ARG A 35 2.998 0.490 -7.803 1.00 0.00 N ATOM 0 H ARG A 35 -4.209 -2.455 -4.807 1.00 0.00 H new ATOM 0 HA ARG A 35 -1.389 -3.223 -5.260 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -3.091 -2.417 -7.176 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -2.833 -0.847 -6.442 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -0.488 -2.552 -7.279 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -1.349 -1.572 -8.450 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -0.832 0.435 -7.344 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -0.425 -0.384 -5.849 1.00 0.00 H new ATOM 0 HE ARG A 35 1.539 -1.331 -7.128 1.00 0.00 H new ATOM 0 HH11 ARG A 35 0.090 1.473 -8.691 1.00 0.00 H new ATOM 0 HH12 ARG A 35 1.662 2.213 -9.014 1.00 0.00 H new ATOM 0 HH21 ARG A 35 3.462 -0.267 -7.302 1.00 0.00 H new ATOM 0 HH22 ARG A 35 3.551 1.231 -8.234 1.00 0.00 H new ATOM 571 N LEU A 36 -0.641 -1.310 -3.863 1.00 0.00 N ATOM 572 CA LEU A 36 -0.214 -0.325 -2.914 1.00 0.00 C ATOM 573 C LEU A 36 -0.133 1.059 -3.528 1.00 0.00 C ATOM 574 O LEU A 36 0.750 1.372 -4.328 1.00 0.00 O ATOM 575 CB LEU A 36 1.112 -0.693 -2.281 1.00 0.00 C ATOM 576 CG LEU A 36 1.149 -1.966 -1.466 1.00 0.00 C ATOM 577 CD1 LEU A 36 2.476 -2.103 -0.781 1.00 0.00 C ATOM 578 CD2 LEU A 36 0.056 -1.992 -0.453 1.00 0.00 C ATOM 0 H LEU A 36 0.113 -1.882 -4.244 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.973 -0.304 -2.132 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.855 -0.776 -3.074 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.422 0.131 -1.638 1.00 0.00 H new ATOM 0 HG LEU A 36 1.004 -2.803 -2.148 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.491 -3.023 -0.197 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.269 -2.134 -1.528 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.634 -1.251 -0.119 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.110 -2.920 0.117 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.166 -1.144 0.223 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -0.909 -1.931 -0.957 1.00 0.00 H new ATOM 590 N LEU A 37 -1.119 1.837 -3.206 1.00 0.00 N ATOM 591 CA LEU A 37 -1.162 3.265 -3.553 1.00 0.00 C ATOM 592 C LEU A 37 0.082 3.996 -3.130 1.00 0.00 C ATOM 593 O LEU A 37 0.573 3.824 -2.023 1.00 0.00 O ATOM 594 CB LEU A 37 -2.295 3.983 -2.869 1.00 0.00 C ATOM 595 CG LEU A 37 -3.486 4.428 -3.711 1.00 0.00 C ATOM 596 CD1 LEU A 37 -4.103 5.600 -3.135 1.00 0.00 C ATOM 597 CD2 LEU A 37 -3.101 4.844 -5.018 1.00 0.00 C ATOM 0 H LEU A 37 -1.937 1.516 -2.688 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.278 3.274 -4.637 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.671 3.333 -2.079 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.883 4.868 -2.384 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.150 3.564 -3.747 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.951 5.904 -3.749 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.448 5.371 -2.127 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.376 6.411 -3.094 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.985 5.151 -5.577 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -2.409 5.683 -4.944 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -2.614 4.017 -5.534 1.00 0.00 H new ATOM 609 N LEU A 38 0.514 4.842 -4.003 1.00 0.00 N ATOM 610 CA LEU A 38 1.637 5.733 -3.814 1.00 0.00 C ATOM 611 C LEU A 38 2.964 5.007 -3.503 1.00 0.00 C ATOM 612 O LEU A 38 3.855 5.573 -2.883 1.00 0.00 O ATOM 613 CB LEU A 38 1.390 6.862 -2.768 1.00 0.00 C ATOM 614 CG LEU A 38 0.374 7.963 -3.130 1.00 0.00 C ATOM 615 CD1 LEU A 38 0.644 8.519 -4.523 1.00 0.00 C ATOM 616 CD2 LEU A 38 -1.052 7.475 -2.978 1.00 0.00 C ATOM 0 H LEU A 38 0.079 4.945 -4.920 1.00 0.00 H new ATOM 0 HA LEU A 38 1.737 6.209 -4.789 1.00 0.00 H new ATOM 0 HB2 LEU A 38 1.061 6.394 -1.840 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.346 7.343 -2.561 1.00 0.00 H new ATOM 0 HG LEU A 38 0.502 8.783 -2.423 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.087 9.294 -4.753 1.00 0.00 H new ATOM 0 HD12 LEU A 38 1.647 8.945 -4.557 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.565 7.717 -5.257 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.741 8.277 -3.242 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.217 6.623 -3.638 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.225 7.173 -1.945 1.00 0.00 H new ATOM 628 N VAL A 39 3.155 3.843 -4.059 1.00 0.00 N ATOM 629 CA VAL A 39 4.237 2.961 -3.601 1.00 0.00 C ATOM 630 C VAL A 39 5.092 2.433 -4.723 1.00 0.00 C ATOM 631 O VAL A 39 4.587 2.015 -5.761 1.00 0.00 O ATOM 632 CB VAL A 39 3.653 1.769 -2.760 1.00 0.00 C ATOM 633 CG1 VAL A 39 4.631 0.632 -2.583 1.00 0.00 C ATOM 634 CG2 VAL A 39 3.226 2.248 -1.400 1.00 0.00 C ATOM 0 H VAL A 39 2.592 3.470 -4.823 1.00 0.00 H new ATOM 0 HA VAL A 39 4.886 3.572 -2.974 1.00 0.00 H new ATOM 0 HB VAL A 39 2.800 1.393 -3.324 1.00 0.00 H new ATOM 0 HG11 VAL A 39 4.167 -0.159 -1.994 1.00 0.00 H new ATOM 0 HG12 VAL A 39 4.913 0.239 -3.560 1.00 0.00 H new ATOM 0 HG13 VAL A 39 5.520 0.994 -2.067 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.824 1.411 -0.829 1.00 0.00 H new ATOM 0 HG22 VAL A 39 4.085 2.666 -0.875 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.459 3.015 -1.509 1.00 0.00 H new ATOM 644 N ASP A 40 6.391 2.518 -4.544 1.00 0.00 N ATOM 645 CA ASP A 40 7.309 1.879 -5.465 1.00 0.00 C ATOM 646 C ASP A 40 8.169 0.911 -4.723 1.00 0.00 C ATOM 647 O ASP A 40 9.048 1.324 -3.961 1.00 0.00 O ATOM 648 CB ASP A 40 8.196 2.869 -6.173 1.00 0.00 C ATOM 649 CG ASP A 40 8.934 2.233 -7.343 1.00 0.00 C ATOM 650 OD1 ASP A 40 8.257 1.795 -8.301 1.00 0.00 O ATOM 651 OD2 ASP A 40 10.181 2.148 -7.330 1.00 0.00 O ATOM 0 H ASP A 40 6.835 3.019 -3.775 1.00 0.00 H new ATOM 0 HA ASP A 40 6.706 1.369 -6.216 1.00 0.00 H new ATOM 0 HB2 ASP A 40 7.594 3.703 -6.533 1.00 0.00 H new ATOM 0 HB3 ASP A 40 8.919 3.279 -5.467 1.00 0.00 H new ATOM 656 N THR A 41 7.862 -0.344 -4.869 1.00 0.00 N ATOM 657 CA THR A 41 8.646 -1.409 -4.280 1.00 0.00 C ATOM 658 C THR A 41 9.718 -1.902 -5.254 1.00 0.00 C ATOM 659 O THR A 41 9.629 -1.654 -6.468 1.00 0.00 O ATOM 660 CB THR A 41 7.746 -2.601 -3.910 1.00 0.00 C ATOM 661 OG1 THR A 41 6.935 -2.974 -5.044 1.00 0.00 O ATOM 662 CG2 THR A 41 6.877 -2.261 -2.732 1.00 0.00 C ATOM 0 H THR A 41 7.056 -0.668 -5.403 1.00 0.00 H new ATOM 0 HA THR A 41 9.121 -1.006 -3.385 1.00 0.00 H new ATOM 0 HB THR A 41 8.378 -3.445 -3.634 1.00 0.00 H new ATOM 0 HG1 THR A 41 6.654 -3.908 -4.952 1.00 0.00 H new ATOM 0 HG21 THR A 41 6.248 -3.116 -2.485 1.00 0.00 H new ATOM 0 HG22 THR A 41 7.505 -2.014 -1.876 1.00 0.00 H new ATOM 0 HG23 THR A 41 6.247 -1.406 -2.979 1.00 0.00 H new ATOM 670 N PRO A 42 10.763 -2.568 -4.752 1.00 0.00 N ATOM 671 CA PRO A 42 11.751 -3.224 -5.593 1.00 0.00 C ATOM 672 C PRO A 42 11.207 -4.570 -6.100 1.00 0.00 C ATOM 673 O PRO A 42 9.987 -4.813 -6.051 1.00 0.00 O ATOM 674 CB PRO A 42 12.947 -3.441 -4.649 1.00 0.00 C ATOM 675 CG PRO A 42 12.595 -2.706 -3.403 1.00 0.00 C ATOM 676 CD PRO A 42 11.110 -2.695 -3.343 1.00 0.00 C ATOM 0 HA PRO A 42 12.014 -2.644 -6.478 1.00 0.00 H new ATOM 0 HB2 PRO A 42 13.105 -4.501 -4.450 1.00 0.00 H new ATOM 0 HB3 PRO A 42 13.869 -3.058 -5.086 1.00 0.00 H new ATOM 0 HG2 PRO A 42 13.018 -3.198 -2.527 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.993 -1.691 -3.422 1.00 0.00 H new ATOM 0 HD2 PRO A 42 10.711 -3.609 -2.903 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.730 -1.863 -2.750 1.00 0.00 H new ATOM 684 N GLU A 43 12.069 -5.429 -6.583 1.00 0.00 N ATOM 685 CA GLU A 43 11.622 -6.707 -7.096 1.00 0.00 C ATOM 686 C GLU A 43 11.751 -7.786 -6.038 1.00 0.00 C ATOM 687 O GLU A 43 12.543 -7.667 -5.085 1.00 0.00 O ATOM 688 CB GLU A 43 12.409 -7.112 -8.321 1.00 0.00 C ATOM 689 CG GLU A 43 12.464 -6.047 -9.395 1.00 0.00 C ATOM 690 CD GLU A 43 13.294 -6.463 -10.565 1.00 0.00 C ATOM 691 OE1 GLU A 43 14.531 -6.258 -10.536 1.00 0.00 O ATOM 692 OE2 GLU A 43 12.736 -7.003 -11.548 1.00 0.00 O ATOM 0 H GLU A 43 13.076 -5.273 -6.633 1.00 0.00 H new ATOM 0 HA GLU A 43 10.574 -6.596 -7.373 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.426 -7.364 -8.020 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.968 -8.016 -8.742 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.452 -5.822 -9.732 1.00 0.00 H new ATOM 0 HG3 GLU A 43 12.871 -5.129 -8.972 1.00 0.00 H new ATOM 699 N THR A 44 11.019 -8.840 -6.234 1.00 0.00 N ATOM 700 CA THR A 44 10.958 -9.967 -5.339 1.00 0.00 C ATOM 701 C THR A 44 12.059 -11.022 -5.724 1.00 0.00 C ATOM 702 O THR A 44 11.979 -12.202 -5.373 1.00 0.00 O ATOM 703 CB THR A 44 9.549 -10.586 -5.491 1.00 0.00 C ATOM 704 OG1 THR A 44 8.573 -9.520 -5.508 1.00 0.00 O ATOM 705 CG2 THR A 44 9.213 -11.522 -4.338 1.00 0.00 C ATOM 0 H THR A 44 10.422 -8.948 -7.054 1.00 0.00 H new ATOM 0 HA THR A 44 11.138 -9.659 -4.309 1.00 0.00 H new ATOM 0 HB THR A 44 9.532 -11.160 -6.417 1.00 0.00 H new ATOM 0 HG1 THR A 44 7.680 -9.896 -5.657 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.215 -11.935 -4.484 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.940 -12.333 -4.304 1.00 0.00 H new ATOM 0 HG23 THR A 44 9.243 -10.969 -3.399 1.00 0.00 H new ATOM 713 N LYS A 45 13.106 -10.548 -6.375 1.00 0.00 N ATOM 714 CA LYS A 45 14.186 -11.345 -6.902 1.00 0.00 C ATOM 715 C LYS A 45 15.183 -10.348 -7.463 1.00 0.00 C ATOM 716 O LYS A 45 14.889 -9.146 -7.460 1.00 0.00 O ATOM 717 CB LYS A 45 13.718 -12.351 -8.006 1.00 0.00 C ATOM 718 CG LYS A 45 13.376 -11.768 -9.388 1.00 0.00 C ATOM 719 CD LYS A 45 12.152 -10.870 -9.394 1.00 0.00 C ATOM 720 CE LYS A 45 11.903 -10.289 -10.785 1.00 0.00 C ATOM 721 NZ LYS A 45 11.654 -11.340 -11.802 1.00 0.00 N ATOM 0 H LYS A 45 13.227 -9.551 -6.556 1.00 0.00 H new ATOM 0 HA LYS A 45 14.617 -11.970 -6.120 1.00 0.00 H new ATOM 0 HB2 LYS A 45 14.502 -13.096 -8.138 1.00 0.00 H new ATOM 0 HB3 LYS A 45 12.838 -12.876 -7.634 1.00 0.00 H new ATOM 0 HG2 LYS A 45 14.232 -11.201 -9.753 1.00 0.00 H new ATOM 0 HG3 LYS A 45 13.215 -12.588 -10.087 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.279 -11.438 -9.072 1.00 0.00 H new ATOM 0 HD3 LYS A 45 12.288 -10.060 -8.677 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.047 -9.615 -10.746 1.00 0.00 H new ATOM 0 HE3 LYS A 45 12.765 -9.693 -11.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 11.309 -10.900 -12.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 12.538 -11.852 -11.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 10.939 -12.006 -11.445 1.00 0.00 H new ATOM 735 N HIS A 46 16.315 -10.787 -7.945 1.00 0.00 N ATOM 736 CA HIS A 46 17.301 -9.843 -8.434 1.00 0.00 C ATOM 737 C HIS A 46 18.079 -10.427 -9.592 1.00 0.00 C ATOM 738 O HIS A 46 18.262 -11.644 -9.656 1.00 0.00 O ATOM 739 CB HIS A 46 18.273 -9.414 -7.297 1.00 0.00 C ATOM 740 CG HIS A 46 19.248 -10.472 -6.802 1.00 0.00 C ATOM 741 ND1 HIS A 46 18.886 -11.726 -6.356 1.00 0.00 N ATOM 742 CD2 HIS A 46 20.600 -10.427 -6.707 1.00 0.00 C ATOM 743 CE1 HIS A 46 19.992 -12.383 -6.012 1.00 0.00 C ATOM 744 NE2 HIS A 46 21.067 -11.639 -6.205 1.00 0.00 N ATOM 0 H HIS A 46 16.580 -11.770 -8.012 1.00 0.00 H new ATOM 0 HA HIS A 46 16.768 -8.959 -8.785 1.00 0.00 H new ATOM 0 HB2 HIS A 46 18.848 -8.556 -7.646 1.00 0.00 H new ATOM 0 HB3 HIS A 46 17.678 -9.075 -6.449 1.00 0.00 H new ATOM 0 HD2 HIS A 46 21.218 -9.584 -6.978 1.00 0.00 H new ATOM 0 HE1 HIS A 46 20.008 -13.392 -5.626 1.00 0.00 H new ATOM 0 HE2 HIS A 46 22.037 -11.898 -6.024 1.00 0.00 H new ATOM 752 N PRO A 47 18.510 -9.590 -10.548 1.00 0.00 N ATOM 753 CA PRO A 47 19.400 -10.034 -11.603 1.00 0.00 C ATOM 754 C PRO A 47 20.782 -10.289 -11.004 1.00 0.00 C ATOM 755 O PRO A 47 21.242 -11.435 -10.920 1.00 0.00 O ATOM 756 CB PRO A 47 19.430 -8.855 -12.598 1.00 0.00 C ATOM 757 CG PRO A 47 18.340 -7.931 -12.163 1.00 0.00 C ATOM 758 CD PRO A 47 18.143 -8.170 -10.697 1.00 0.00 C ATOM 0 HA PRO A 47 19.083 -10.957 -12.088 1.00 0.00 H new ATOM 0 HB2 PRO A 47 20.398 -8.354 -12.582 1.00 0.00 H new ATOM 0 HB3 PRO A 47 19.267 -9.200 -13.619 1.00 0.00 H new ATOM 0 HG2 PRO A 47 18.612 -6.893 -12.354 1.00 0.00 H new ATOM 0 HG3 PRO A 47 17.421 -8.127 -12.715 1.00 0.00 H new ATOM 0 HD2 PRO A 47 18.778 -7.522 -10.092 1.00 0.00 H new ATOM 0 HD3 PRO A 47 17.114 -7.984 -10.391 1.00 0.00 H new ATOM 766 N LYS A 48 21.402 -9.217 -10.541 1.00 0.00 N ATOM 767 CA LYS A 48 22.677 -9.248 -9.819 1.00 0.00 C ATOM 768 C LYS A 48 22.735 -8.104 -8.847 1.00 0.00 C ATOM 769 O LYS A 48 22.917 -8.285 -7.642 1.00 0.00 O ATOM 770 CB LYS A 48 23.909 -9.139 -10.739 1.00 0.00 C ATOM 771 CG LYS A 48 24.223 -10.373 -11.600 1.00 0.00 C ATOM 772 CD LYS A 48 24.362 -11.655 -10.752 1.00 0.00 C ATOM 773 CE LYS A 48 25.473 -11.574 -9.699 1.00 0.00 C ATOM 774 NZ LYS A 48 26.820 -11.564 -10.294 1.00 0.00 N ATOM 0 H LYS A 48 21.029 -8.275 -10.656 1.00 0.00 H new ATOM 0 HA LYS A 48 22.713 -10.215 -9.318 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.767 -8.285 -11.402 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.780 -8.921 -10.121 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.432 -10.511 -12.337 1.00 0.00 H new ATOM 0 HG3 LYS A 48 25.147 -10.203 -12.153 1.00 0.00 H new ATOM 0 HD2 LYS A 48 23.414 -11.856 -10.253 1.00 0.00 H new ATOM 0 HD3 LYS A 48 24.560 -12.499 -11.413 1.00 0.00 H new ATOM 0 HE2 LYS A 48 25.337 -10.672 -9.102 1.00 0.00 H new ATOM 0 HE3 LYS A 48 25.387 -12.422 -9.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 27.533 -11.508 -9.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 26.964 -12.436 -10.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 26.916 -10.741 -10.922 1.00 0.00 H new ATOM 788 N LYS A 49 22.583 -6.929 -9.380 1.00 0.00 N ATOM 789 CA LYS A 49 22.666 -5.732 -8.613 1.00 0.00 C ATOM 790 C LYS A 49 21.394 -4.949 -8.704 1.00 0.00 C ATOM 791 O LYS A 49 20.405 -5.385 -9.301 1.00 0.00 O ATOM 792 CB LYS A 49 23.815 -4.844 -9.100 1.00 0.00 C ATOM 793 CG LYS A 49 25.206 -5.369 -8.825 1.00 0.00 C ATOM 794 CD LYS A 49 26.278 -4.370 -9.272 1.00 0.00 C ATOM 795 CE LYS A 49 26.140 -3.012 -8.571 1.00 0.00 C ATOM 796 NZ LYS A 49 26.246 -3.113 -7.097 1.00 0.00 N ATOM 0 H LYS A 49 22.396 -6.778 -10.371 1.00 0.00 H new ATOM 0 HA LYS A 49 22.844 -6.028 -7.579 1.00 0.00 H new ATOM 0 HB2 LYS A 49 23.707 -4.697 -10.175 1.00 0.00 H new ATOM 0 HB3 LYS A 49 23.717 -3.864 -8.633 1.00 0.00 H new ATOM 0 HG2 LYS A 49 25.316 -5.571 -7.760 1.00 0.00 H new ATOM 0 HG3 LYS A 49 25.349 -6.316 -9.346 1.00 0.00 H new ATOM 0 HD2 LYS A 49 27.265 -4.784 -9.066 1.00 0.00 H new ATOM 0 HD3 LYS A 49 26.211 -4.228 -10.351 1.00 0.00 H new ATOM 0 HE2 LYS A 49 26.912 -2.337 -8.941 1.00 0.00 H new ATOM 0 HE3 LYS A 49 25.179 -2.570 -8.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 26.214 -2.161 -6.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 25.454 -3.678 -6.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 27.145 -3.571 -6.844 1.00 0.00 H new ATOM 810 N GLY A 50 21.429 -3.825 -8.087 1.00 0.00 N ATOM 811 CA GLY A 50 20.371 -2.882 -8.134 1.00 0.00 C ATOM 812 C GLY A 50 19.826 -2.730 -6.772 1.00 0.00 C ATOM 813 O GLY A 50 20.573 -2.812 -5.795 1.00 0.00 O ATOM 0 H GLY A 50 22.220 -3.526 -7.517 1.00 0.00 H new ATOM 0 HA2 GLY A 50 20.732 -1.924 -8.508 1.00 0.00 H new ATOM 0 HA3 GLY A 50 19.593 -3.218 -8.819 1.00 0.00 H new ATOM 817 N VAL A 51 18.560 -2.532 -6.669 1.00 0.00 N ATOM 818 CA VAL A 51 17.911 -2.537 -5.386 1.00 0.00 C ATOM 819 C VAL A 51 17.432 -3.972 -5.225 1.00 0.00 C ATOM 820 O VAL A 51 16.230 -4.254 -5.177 1.00 0.00 O ATOM 821 CB VAL A 51 16.720 -1.543 -5.346 1.00 0.00 C ATOM 822 CG1 VAL A 51 16.190 -1.398 -3.939 1.00 0.00 C ATOM 823 CG2 VAL A 51 17.126 -0.186 -5.904 1.00 0.00 C ATOM 0 H VAL A 51 17.939 -2.362 -7.460 1.00 0.00 H new ATOM 0 HA VAL A 51 18.577 -2.221 -4.583 1.00 0.00 H new ATOM 0 HB VAL A 51 15.925 -1.946 -5.973 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.356 -0.697 -3.935 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.850 -2.368 -3.576 1.00 0.00 H new ATOM 0 HG13 VAL A 51 16.981 -1.025 -3.289 1.00 0.00 H new ATOM 0 HG21 VAL A 51 16.274 0.493 -5.865 1.00 0.00 H new ATOM 0 HG22 VAL A 51 17.943 0.222 -5.309 1.00 0.00 H new ATOM 0 HG23 VAL A 51 17.452 -0.300 -6.938 1.00 0.00 H new ATOM 833 N GLU A 52 18.434 -4.850 -5.181 1.00 0.00 N ATOM 834 CA GLU A 52 18.319 -6.292 -5.338 1.00 0.00 C ATOM 835 C GLU A 52 17.079 -6.953 -4.785 1.00 0.00 C ATOM 836 O GLU A 52 16.111 -7.146 -5.515 1.00 0.00 O ATOM 837 CB GLU A 52 19.663 -7.052 -5.081 1.00 0.00 C ATOM 838 CG GLU A 52 20.445 -6.714 -3.793 1.00 0.00 C ATOM 839 CD GLU A 52 19.931 -7.402 -2.553 1.00 0.00 C ATOM 840 OE1 GLU A 52 19.056 -6.854 -1.868 1.00 0.00 O ATOM 841 OE2 GLU A 52 20.386 -8.526 -2.250 1.00 0.00 O ATOM 0 H GLU A 52 19.398 -4.554 -5.026 1.00 0.00 H new ATOM 0 HA GLU A 52 18.124 -6.405 -6.404 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.447 -8.120 -5.072 1.00 0.00 H new ATOM 0 HB3 GLU A 52 20.320 -6.867 -5.931 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.491 -6.984 -3.936 1.00 0.00 H new ATOM 0 HG3 GLU A 52 20.413 -5.636 -3.635 1.00 0.00 H new ATOM 848 N LYS A 53 17.060 -7.279 -3.549 1.00 0.00 N ATOM 849 CA LYS A 53 15.928 -7.924 -3.027 1.00 0.00 C ATOM 850 C LYS A 53 15.427 -7.265 -1.823 1.00 0.00 C ATOM 851 O LYS A 53 15.610 -7.716 -0.701 1.00 0.00 O ATOM 852 CB LYS A 53 16.103 -9.407 -2.837 1.00 0.00 C ATOM 853 CG LYS A 53 16.290 -10.144 -4.131 1.00 0.00 C ATOM 854 CD LYS A 53 16.216 -11.621 -3.939 1.00 0.00 C ATOM 855 CE LYS A 53 17.329 -12.123 -3.024 1.00 0.00 C ATOM 856 NZ LYS A 53 17.226 -13.564 -2.733 1.00 0.00 N ATOM 0 H LYS A 53 17.815 -7.109 -2.885 1.00 0.00 H new ATOM 0 HA LYS A 53 15.159 -7.825 -3.794 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.965 -9.587 -2.195 1.00 0.00 H new ATOM 0 HB3 LYS A 53 15.231 -9.807 -2.320 1.00 0.00 H new ATOM 0 HG2 LYS A 53 15.526 -9.831 -4.842 1.00 0.00 H new ATOM 0 HG3 LYS A 53 17.255 -9.881 -4.564 1.00 0.00 H new ATOM 0 HD2 LYS A 53 15.248 -11.886 -3.514 1.00 0.00 H new ATOM 0 HD3 LYS A 53 16.287 -12.119 -4.906 1.00 0.00 H new ATOM 0 HE2 LYS A 53 18.294 -11.919 -3.488 1.00 0.00 H new ATOM 0 HE3 LYS A 53 17.302 -11.566 -2.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 18.007 -13.849 -2.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 16.319 -13.759 -2.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 17.280 -14.102 -3.621 1.00 0.00 H new ATOM 870 N TYR A 54 14.849 -6.158 -2.052 1.00 0.00 N ATOM 871 CA TYR A 54 14.184 -5.445 -1.035 1.00 0.00 C ATOM 872 C TYR A 54 12.683 -5.544 -1.264 1.00 0.00 C ATOM 873 O TYR A 54 11.871 -5.017 -0.515 1.00 0.00 O ATOM 874 CB TYR A 54 14.731 -4.021 -0.941 1.00 0.00 C ATOM 875 CG TYR A 54 16.053 -3.967 -0.217 1.00 0.00 C ATOM 876 CD1 TYR A 54 16.126 -4.297 1.129 1.00 0.00 C ATOM 877 CD2 TYR A 54 17.229 -3.620 -0.872 1.00 0.00 C ATOM 878 CE1 TYR A 54 17.321 -4.276 1.806 1.00 0.00 C ATOM 879 CE2 TYR A 54 18.437 -3.602 -0.197 1.00 0.00 C ATOM 880 CZ TYR A 54 18.472 -3.930 1.145 1.00 0.00 C ATOM 881 OH TYR A 54 19.670 -3.929 1.825 1.00 0.00 O ATOM 0 H TYR A 54 14.822 -5.709 -2.968 1.00 0.00 H new ATOM 0 HA TYR A 54 14.373 -5.881 -0.054 1.00 0.00 H new ATOM 0 HB2 TYR A 54 14.851 -3.612 -1.944 1.00 0.00 H new ATOM 0 HB3 TYR A 54 14.009 -3.389 -0.424 1.00 0.00 H new ATOM 0 HD1 TYR A 54 15.225 -4.576 1.655 1.00 0.00 H new ATOM 0 HD2 TYR A 54 17.200 -3.361 -1.920 1.00 0.00 H new ATOM 0 HE1 TYR A 54 17.354 -4.531 2.855 1.00 0.00 H new ATOM 0 HE2 TYR A 54 19.346 -3.334 -0.715 1.00 0.00 H new ATOM 0 HH TYR A 54 20.391 -3.663 1.217 1.00 0.00 H new ATOM 891 N GLY A 55 12.344 -6.325 -2.282 1.00 0.00 N ATOM 892 CA GLY A 55 10.985 -6.607 -2.637 1.00 0.00 C ATOM 893 C GLY A 55 10.401 -7.725 -1.779 1.00 0.00 C ATOM 894 O GLY A 55 9.280 -7.601 -1.317 1.00 0.00 O ATOM 0 H GLY A 55 13.028 -6.781 -2.886 1.00 0.00 H new ATOM 0 HA2 GLY A 55 10.383 -5.706 -2.520 1.00 0.00 H new ATOM 0 HA3 GLY A 55 10.934 -6.890 -3.688 1.00 0.00 H new ATOM 898 N PRO A 56 11.142 -8.851 -1.504 1.00 0.00 N ATOM 899 CA PRO A 56 10.624 -9.912 -0.638 1.00 0.00 C ATOM 900 C PRO A 56 10.465 -9.427 0.811 1.00 0.00 C ATOM 901 O PRO A 56 9.656 -9.947 1.574 1.00 0.00 O ATOM 902 CB PRO A 56 11.699 -10.989 -0.743 1.00 0.00 C ATOM 903 CG PRO A 56 12.930 -10.244 -1.040 1.00 0.00 C ATOM 904 CD PRO A 56 12.491 -9.217 -2.015 1.00 0.00 C ATOM 0 HA PRO A 56 9.633 -10.259 -0.932 1.00 0.00 H new ATOM 0 HB2 PRO A 56 11.789 -11.553 0.185 1.00 0.00 H new ATOM 0 HB3 PRO A 56 11.468 -11.706 -1.531 1.00 0.00 H new ATOM 0 HG2 PRO A 56 13.350 -9.791 -0.142 1.00 0.00 H new ATOM 0 HG3 PRO A 56 13.699 -10.892 -1.460 1.00 0.00 H new ATOM 0 HD2 PRO A 56 13.165 -8.360 -2.034 1.00 0.00 H new ATOM 0 HD3 PRO A 56 12.448 -9.612 -3.030 1.00 0.00 H new ATOM 912 N GLU A 57 11.226 -8.403 1.167 1.00 0.00 N ATOM 913 CA GLU A 57 11.138 -7.811 2.481 1.00 0.00 C ATOM 914 C GLU A 57 9.844 -6.988 2.531 1.00 0.00 C ATOM 915 O GLU A 57 9.071 -7.054 3.501 1.00 0.00 O ATOM 916 CB GLU A 57 12.361 -6.926 2.731 1.00 0.00 C ATOM 917 CG GLU A 57 12.565 -6.531 4.184 1.00 0.00 C ATOM 918 CD GLU A 57 12.872 -7.721 5.059 1.00 0.00 C ATOM 919 OE1 GLU A 57 14.056 -8.065 5.220 1.00 0.00 O ATOM 920 OE2 GLU A 57 11.939 -8.339 5.602 1.00 0.00 O ATOM 0 H GLU A 57 11.915 -7.966 0.554 1.00 0.00 H new ATOM 0 HA GLU A 57 11.120 -8.577 3.257 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.251 -7.450 2.381 1.00 0.00 H new ATOM 0 HB3 GLU A 57 12.268 -6.021 2.131 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.381 -5.812 4.252 1.00 0.00 H new ATOM 0 HG3 GLU A 57 11.669 -6.032 4.553 1.00 0.00 H new ATOM 927 N ALA A 58 9.587 -6.273 1.428 1.00 0.00 N ATOM 928 CA ALA A 58 8.367 -5.484 1.242 1.00 0.00 C ATOM 929 C ALA A 58 7.166 -6.390 1.328 1.00 0.00 C ATOM 930 O ALA A 58 6.156 -6.078 2.001 1.00 0.00 O ATOM 931 CB ALA A 58 8.384 -4.802 -0.124 1.00 0.00 C ATOM 0 H ALA A 58 10.226 -6.227 0.635 1.00 0.00 H new ATOM 0 HA ALA A 58 8.315 -4.724 2.021 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.472 -4.219 -0.251 1.00 0.00 H new ATOM 0 HB2 ALA A 58 9.249 -4.142 -0.191 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.443 -5.558 -0.907 1.00 0.00 H new ATOM 937 N SER A 59 7.299 -7.532 0.660 1.00 0.00 N ATOM 938 CA SER A 59 6.281 -8.549 0.642 1.00 0.00 C ATOM 939 C SER A 59 6.032 -8.984 2.039 1.00 0.00 C ATOM 940 O SER A 59 4.921 -8.921 2.492 1.00 0.00 O ATOM 941 CB SER A 59 6.704 -9.784 -0.169 1.00 0.00 C ATOM 942 OG SER A 59 5.577 -10.611 -0.490 1.00 0.00 O ATOM 0 H SER A 59 8.128 -7.769 0.115 1.00 0.00 H new ATOM 0 HA SER A 59 5.392 -8.123 0.177 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.197 -9.466 -1.088 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.432 -10.363 0.400 1.00 0.00 H new ATOM 0 HG SER A 59 5.878 -11.387 -1.007 1.00 0.00 H new ATOM 948 N ALA A 60 7.114 -9.300 2.758 1.00 0.00 N ATOM 949 CA ALA A 60 7.031 -9.876 4.078 1.00 0.00 C ATOM 950 C ALA A 60 6.417 -8.914 5.044 1.00 0.00 C ATOM 951 O ALA A 60 5.622 -9.303 5.910 1.00 0.00 O ATOM 952 CB ALA A 60 8.382 -10.318 4.556 1.00 0.00 C ATOM 0 H ALA A 60 8.069 -9.158 2.428 1.00 0.00 H new ATOM 0 HA ALA A 60 6.388 -10.754 4.020 1.00 0.00 H new ATOM 0 HB1 ALA A 60 8.292 -10.749 5.553 1.00 0.00 H new ATOM 0 HB2 ALA A 60 8.783 -11.066 3.872 1.00 0.00 H new ATOM 0 HB3 ALA A 60 9.054 -9.461 4.590 1.00 0.00 H new ATOM 958 N PHE A 61 6.749 -7.666 4.879 1.00 0.00 N ATOM 959 CA PHE A 61 6.208 -6.637 5.704 1.00 0.00 C ATOM 960 C PHE A 61 4.710 -6.468 5.411 1.00 0.00 C ATOM 961 O PHE A 61 3.869 -6.499 6.347 1.00 0.00 O ATOM 962 CB PHE A 61 6.946 -5.346 5.450 1.00 0.00 C ATOM 963 CG PHE A 61 6.762 -4.342 6.530 1.00 0.00 C ATOM 964 CD1 PHE A 61 5.646 -3.553 6.571 1.00 0.00 C ATOM 965 CD2 PHE A 61 7.720 -4.187 7.498 1.00 0.00 C ATOM 966 CE1 PHE A 61 5.484 -2.624 7.553 1.00 0.00 C ATOM 967 CE2 PHE A 61 7.565 -3.261 8.493 1.00 0.00 C ATOM 968 CZ PHE A 61 6.440 -2.473 8.523 1.00 0.00 C ATOM 0 H PHE A 61 7.402 -7.338 4.168 1.00 0.00 H new ATOM 0 HA PHE A 61 6.327 -6.910 6.753 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.009 -5.559 5.339 1.00 0.00 H new ATOM 0 HB3 PHE A 61 6.606 -4.921 4.506 1.00 0.00 H new ATOM 0 HD1 PHE A 61 4.883 -3.668 5.815 1.00 0.00 H new ATOM 0 HD2 PHE A 61 8.607 -4.803 7.475 1.00 0.00 H new ATOM 0 HE1 PHE A 61 4.600 -2.004 7.567 1.00 0.00 H new ATOM 0 HE2 PHE A 61 8.325 -3.150 9.253 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.310 -1.740 9.305 1.00 0.00 H new ATOM 978 N THR A 62 4.371 -6.348 4.118 1.00 0.00 N ATOM 979 CA THR A 62 2.983 -6.176 3.710 1.00 0.00 C ATOM 980 C THR A 62 2.177 -7.360 4.199 1.00 0.00 C ATOM 981 O THR A 62 1.114 -7.207 4.852 1.00 0.00 O ATOM 982 CB THR A 62 2.839 -6.070 2.157 1.00 0.00 C ATOM 983 OG1 THR A 62 3.598 -4.978 1.669 1.00 0.00 O ATOM 984 CG2 THR A 62 1.384 -5.888 1.767 1.00 0.00 C ATOM 0 H THR A 62 5.039 -6.368 3.348 1.00 0.00 H new ATOM 0 HA THR A 62 2.617 -5.246 4.146 1.00 0.00 H new ATOM 0 HB THR A 62 3.211 -6.995 1.717 1.00 0.00 H new ATOM 0 HG1 THR A 62 4.548 -5.220 1.655 1.00 0.00 H new ATOM 0 HG21 THR A 62 1.304 -5.816 0.682 1.00 0.00 H new ATOM 0 HG22 THR A 62 0.804 -6.741 2.118 1.00 0.00 H new ATOM 0 HG23 THR A 62 0.997 -4.975 2.220 1.00 0.00 H new ATOM 992 N LYS A 63 2.745 -8.532 3.970 1.00 0.00 N ATOM 993 CA LYS A 63 2.108 -9.742 4.293 1.00 0.00 C ATOM 994 C LYS A 63 1.938 -9.905 5.769 1.00 0.00 C ATOM 995 O LYS A 63 0.869 -10.299 6.202 1.00 0.00 O ATOM 996 CB LYS A 63 2.726 -10.946 3.573 1.00 0.00 C ATOM 997 CG LYS A 63 4.089 -11.324 3.939 1.00 0.00 C ATOM 998 CD LYS A 63 4.125 -12.314 5.028 1.00 0.00 C ATOM 999 CE LYS A 63 3.548 -13.666 4.619 1.00 0.00 C ATOM 1000 NZ LYS A 63 4.308 -14.320 3.535 1.00 0.00 N ATOM 0 H LYS A 63 3.668 -8.643 3.551 1.00 0.00 H new ATOM 0 HA LYS A 63 1.093 -9.696 3.899 1.00 0.00 H new ATOM 0 HB2 LYS A 63 2.081 -11.808 3.744 1.00 0.00 H new ATOM 0 HB3 LYS A 63 2.709 -10.743 2.502 1.00 0.00 H new ATOM 0 HG2 LYS A 63 4.597 -11.731 3.065 1.00 0.00 H new ATOM 0 HG3 LYS A 63 4.641 -10.434 4.243 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.156 -12.449 5.356 1.00 0.00 H new ATOM 0 HD3 LYS A 63 3.566 -11.929 5.881 1.00 0.00 H new ATOM 0 HE2 LYS A 63 3.529 -14.323 5.488 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.515 -13.531 4.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 3.986 -15.303 3.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 4.152 -13.807 2.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 5.322 -14.311 3.767 1.00 0.00 H new ATOM 1014 N LYS A 64 2.961 -9.520 6.570 1.00 0.00 N ATOM 1015 CA LYS A 64 2.799 -9.589 7.980 1.00 0.00 C ATOM 1016 C LYS A 64 1.694 -8.698 8.378 1.00 0.00 C ATOM 1017 O LYS A 64 0.764 -9.178 8.996 1.00 0.00 O ATOM 1018 CB LYS A 64 4.134 -9.419 8.802 1.00 0.00 C ATOM 1019 CG LYS A 64 4.808 -8.043 8.861 1.00 0.00 C ATOM 1020 CD LYS A 64 4.088 -7.105 9.797 1.00 0.00 C ATOM 1021 CE LYS A 64 4.839 -5.798 10.014 1.00 0.00 C ATOM 1022 NZ LYS A 64 6.076 -5.984 10.819 1.00 0.00 N ATOM 0 H LYS A 64 3.864 -9.175 6.246 1.00 0.00 H new ATOM 0 HA LYS A 64 2.517 -10.607 8.249 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.929 -9.728 9.827 1.00 0.00 H new ATOM 0 HB3 LYS A 64 4.861 -10.123 8.396 1.00 0.00 H new ATOM 0 HG2 LYS A 64 5.842 -8.159 9.187 1.00 0.00 H new ATOM 0 HG3 LYS A 64 4.835 -7.609 7.862 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.098 -6.888 9.396 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.942 -7.599 10.758 1.00 0.00 H new ATOM 0 HE2 LYS A 64 5.099 -5.366 9.047 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.185 -5.085 10.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 6.470 -5.055 11.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.849 -6.509 11.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 6.775 -6.518 10.264 1.00 0.00 H new ATOM 1036 N MET A 65 1.710 -7.431 7.900 1.00 0.00 N ATOM 1037 CA MET A 65 0.667 -6.477 8.278 1.00 0.00 C ATOM 1038 C MET A 65 -0.705 -7.012 7.992 1.00 0.00 C ATOM 1039 O MET A 65 -1.526 -7.157 8.910 1.00 0.00 O ATOM 1040 CB MET A 65 0.849 -5.141 7.602 1.00 0.00 C ATOM 1041 CG MET A 65 2.091 -4.423 8.041 1.00 0.00 C ATOM 1042 SD MET A 65 2.310 -2.808 7.270 1.00 0.00 S ATOM 1043 CE MET A 65 0.961 -1.884 7.976 1.00 0.00 C ATOM 0 H MET A 65 2.420 -7.062 7.267 1.00 0.00 H new ATOM 0 HA MET A 65 0.764 -6.330 9.354 1.00 0.00 H new ATOM 0 HB2 MET A 65 0.884 -5.289 6.523 1.00 0.00 H new ATOM 0 HB3 MET A 65 -0.018 -4.514 7.810 1.00 0.00 H new ATOM 0 HG2 MET A 65 2.063 -4.298 9.123 1.00 0.00 H new ATOM 0 HG3 MET A 65 2.958 -5.044 7.814 1.00 0.00 H new ATOM 0 HE1 MET A 65 1.310 -0.891 8.261 1.00 0.00 H new ATOM 0 HE2 MET A 65 0.160 -1.791 7.242 1.00 0.00 H new ATOM 0 HE3 MET A 65 0.586 -2.404 8.858 1.00 0.00 H new ATOM 1053 N VAL A 66 -0.934 -7.394 6.760 1.00 0.00 N ATOM 1054 CA VAL A 66 -2.241 -7.872 6.386 1.00 0.00 C ATOM 1055 C VAL A 66 -2.618 -9.192 7.071 1.00 0.00 C ATOM 1056 O VAL A 66 -3.790 -9.420 7.361 1.00 0.00 O ATOM 1057 CB VAL A 66 -2.452 -7.945 4.866 1.00 0.00 C ATOM 1058 CG1 VAL A 66 -2.392 -6.557 4.265 1.00 0.00 C ATOM 1059 CG2 VAL A 66 -1.429 -8.840 4.205 1.00 0.00 C ATOM 0 H VAL A 66 -0.244 -7.384 6.009 1.00 0.00 H new ATOM 0 HA VAL A 66 -2.930 -7.114 6.759 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.438 -8.375 4.687 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.543 -6.620 3.187 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.172 -5.936 4.705 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.417 -6.114 4.470 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.610 -8.867 3.130 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.429 -8.451 4.395 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.510 -9.848 4.612 1.00 0.00 H new ATOM 1069 N GLU A 67 -1.645 -10.046 7.355 1.00 0.00 N ATOM 1070 CA GLU A 67 -1.947 -11.277 8.051 1.00 0.00 C ATOM 1071 C GLU A 67 -2.207 -11.054 9.542 1.00 0.00 C ATOM 1072 O GLU A 67 -3.024 -11.757 10.143 1.00 0.00 O ATOM 1073 CB GLU A 67 -0.872 -12.321 7.862 1.00 0.00 C ATOM 1074 CG GLU A 67 -0.720 -12.811 6.423 1.00 0.00 C ATOM 1075 CD GLU A 67 0.174 -14.019 6.294 1.00 0.00 C ATOM 1076 OE1 GLU A 67 1.310 -14.012 6.807 1.00 0.00 O ATOM 1077 OE2 GLU A 67 -0.250 -15.013 5.644 1.00 0.00 O ATOM 0 H GLU A 67 -0.662 -9.910 7.118 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.866 -11.651 7.600 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.081 -11.910 8.196 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.093 -13.174 8.503 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.705 -13.052 6.023 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.317 -12.003 5.812 1.00 0.00 H new ATOM 1084 N ASN A 68 -1.532 -10.090 10.146 1.00 0.00 N ATOM 1085 CA ASN A 68 -1.745 -9.849 11.578 1.00 0.00 C ATOM 1086 C ASN A 68 -2.880 -8.947 11.812 1.00 0.00 C ATOM 1087 O ASN A 68 -3.449 -8.930 12.914 1.00 0.00 O ATOM 1088 CB ASN A 68 -0.525 -9.306 12.355 1.00 0.00 C ATOM 1089 CG ASN A 68 -0.021 -7.951 11.935 1.00 0.00 C ATOM 1090 OD1 ASN A 68 -0.554 -6.892 12.313 1.00 0.00 O ATOM 1091 ND2 ASN A 68 1.095 -7.984 11.280 1.00 0.00 N ATOM 0 H ASN A 68 -0.854 -9.477 9.694 1.00 0.00 H new ATOM 0 HA ASN A 68 -1.947 -10.847 11.968 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -0.784 -9.263 13.413 1.00 0.00 H new ATOM 0 HB3 ASN A 68 0.291 -10.022 12.255 1.00 0.00 H new ATOM 0 HD21 ASN A 68 1.578 -7.115 11.052 1.00 0.00 H new ATOM 0 HD22 ASN A 68 1.491 -8.879 10.992 1.00 0.00 H new ATOM 1098 N ALA A 69 -3.217 -8.169 10.821 1.00 0.00 N ATOM 1099 CA ALA A 69 -4.221 -7.247 10.990 1.00 0.00 C ATOM 1100 C ALA A 69 -5.564 -7.890 11.110 1.00 0.00 C ATOM 1101 O ALA A 69 -5.930 -8.786 10.350 1.00 0.00 O ATOM 1102 CB ALA A 69 -4.228 -6.225 9.911 1.00 0.00 C ATOM 0 H ALA A 69 -2.788 -8.182 9.896 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.009 -6.740 11.931 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.038 -5.517 10.086 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.276 -5.694 9.907 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.375 -6.714 8.948 1.00 0.00 H new ATOM 1108 N LYS A 70 -6.269 -7.427 12.068 1.00 0.00 N ATOM 1109 CA LYS A 70 -7.619 -7.836 12.304 1.00 0.00 C ATOM 1110 C LYS A 70 -8.505 -7.011 11.402 1.00 0.00 C ATOM 1111 O LYS A 70 -9.585 -7.436 10.990 1.00 0.00 O ATOM 1112 CB LYS A 70 -8.043 -7.563 13.762 1.00 0.00 C ATOM 1113 CG LYS A 70 -7.352 -8.318 14.866 1.00 0.00 C ATOM 1114 CD LYS A 70 -5.952 -7.797 15.112 1.00 0.00 C ATOM 1115 CE LYS A 70 -5.479 -8.232 16.457 1.00 0.00 C ATOM 1116 NZ LYS A 70 -4.102 -7.792 16.742 1.00 0.00 N ATOM 0 H LYS A 70 -5.925 -6.735 12.734 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.706 -8.905 12.111 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -7.906 -6.499 13.953 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.111 -7.766 13.840 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.936 -8.237 15.783 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -7.306 -9.376 14.609 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.276 -8.168 14.342 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.943 -6.709 15.048 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -6.149 -7.835 17.220 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.530 -9.319 16.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.822 -8.120 17.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.456 -8.191 16.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -4.055 -6.754 16.708 1.00 0.00 H new ATOM 1130 N LYS A 71 -8.005 -5.845 11.048 1.00 0.00 N ATOM 1131 CA LYS A 71 -8.789 -4.897 10.312 1.00 0.00 C ATOM 1132 C LYS A 71 -8.113 -4.496 9.067 1.00 0.00 C ATOM 1133 O LYS A 71 -7.303 -3.579 9.083 1.00 0.00 O ATOM 1134 CB LYS A 71 -8.983 -3.620 11.084 1.00 0.00 C ATOM 1135 CG LYS A 71 -10.068 -2.783 10.489 1.00 0.00 C ATOM 1136 CD LYS A 71 -10.222 -1.436 11.136 1.00 0.00 C ATOM 1137 CE LYS A 71 -8.972 -0.586 11.016 1.00 0.00 C ATOM 1138 NZ LYS A 71 -9.264 0.839 11.249 1.00 0.00 N ATOM 0 H LYS A 71 -7.056 -5.538 11.263 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.739 -5.395 10.116 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -9.228 -3.853 12.120 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -8.051 -3.055 11.096 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -9.865 -2.644 9.427 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -11.012 -3.322 10.565 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -11.060 -0.910 10.678 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -10.467 -1.569 12.190 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -8.228 -0.928 11.735 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -8.539 -0.712 10.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.383 1.341 11.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.684 1.252 10.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.932 0.932 12.041 1.00 0.00 H new ATOM 1152 N ILE A 72 -8.340 -5.147 8.022 1.00 0.00 N ATOM 1153 CA ILE A 72 -7.814 -4.613 6.838 1.00 0.00 C ATOM 1154 C ILE A 72 -8.809 -3.733 6.168 1.00 0.00 C ATOM 1155 O ILE A 72 -9.812 -4.184 5.636 1.00 0.00 O ATOM 1156 CB ILE A 72 -7.201 -5.614 5.872 1.00 0.00 C ATOM 1157 CG1 ILE A 72 -6.086 -6.366 6.577 1.00 0.00 C ATOM 1158 CG2 ILE A 72 -6.653 -4.880 4.645 1.00 0.00 C ATOM 1159 CD1 ILE A 72 -6.531 -7.653 7.229 1.00 0.00 C ATOM 0 H ILE A 72 -8.864 -6.019 7.946 1.00 0.00 H new ATOM 0 HA ILE A 72 -6.960 -4.016 7.159 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.961 -6.323 5.543 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.299 -6.589 5.856 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.648 -5.718 7.336 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -6.215 -5.601 3.955 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.464 -4.348 4.147 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.890 -4.167 4.958 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -5.678 -8.131 7.711 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -7.296 -7.437 7.975 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -6.941 -8.321 6.472 1.00 0.00 H new ATOM 1171 N GLU A 73 -8.575 -2.483 6.291 1.00 0.00 N ATOM 1172 CA GLU A 73 -9.369 -1.526 5.577 1.00 0.00 C ATOM 1173 C GLU A 73 -8.664 -1.112 4.361 1.00 0.00 C ATOM 1174 O GLU A 73 -7.444 -1.201 4.257 1.00 0.00 O ATOM 1175 CB GLU A 73 -9.700 -0.281 6.348 1.00 0.00 C ATOM 1176 CG GLU A 73 -10.747 -0.433 7.420 1.00 0.00 C ATOM 1177 CD GLU A 73 -10.964 0.837 8.219 1.00 0.00 C ATOM 1178 OE1 GLU A 73 -9.989 1.398 8.759 1.00 0.00 O ATOM 1179 OE2 GLU A 73 -12.110 1.309 8.314 1.00 0.00 O ATOM 0 H GLU A 73 -7.842 -2.085 6.877 1.00 0.00 H new ATOM 0 HA GLU A 73 -10.308 -2.038 5.368 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -8.786 0.092 6.810 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -10.035 0.481 5.644 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.689 -0.732 6.961 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -10.453 -1.236 8.096 1.00 0.00 H new ATOM 1186 N VAL A 74 -9.411 -0.650 3.471 1.00 0.00 N ATOM 1187 CA VAL A 74 -8.933 -0.152 2.252 1.00 0.00 C ATOM 1188 C VAL A 74 -9.574 1.172 2.019 1.00 0.00 C ATOM 1189 O VAL A 74 -10.593 1.469 2.625 1.00 0.00 O ATOM 1190 CB VAL A 74 -9.251 -1.117 1.099 1.00 0.00 C ATOM 1191 CG1 VAL A 74 -8.413 -2.370 1.199 1.00 0.00 C ATOM 1192 CG2 VAL A 74 -10.712 -1.487 1.152 1.00 0.00 C ATOM 0 H VAL A 74 -10.426 -0.600 3.564 1.00 0.00 H new ATOM 0 HA VAL A 74 -7.849 -0.047 2.292 1.00 0.00 H new ATOM 0 HB VAL A 74 -9.021 -0.622 0.155 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -8.656 -3.037 0.372 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -7.357 -2.106 1.153 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -8.621 -2.872 2.144 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -10.944 -2.172 0.336 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -10.931 -1.970 2.104 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -11.319 -0.587 1.054 1.00 0.00 H new ATOM 1202 N GLU A 75 -8.976 1.974 1.213 1.00 0.00 N ATOM 1203 CA GLU A 75 -9.545 3.270 0.918 1.00 0.00 C ATOM 1204 C GLU A 75 -9.232 3.609 -0.495 1.00 0.00 C ATOM 1205 O GLU A 75 -8.083 3.849 -0.835 1.00 0.00 O ATOM 1206 CB GLU A 75 -8.986 4.315 1.886 1.00 0.00 C ATOM 1207 CG GLU A 75 -9.668 5.660 1.887 1.00 0.00 C ATOM 1208 CD GLU A 75 -9.206 6.541 3.042 1.00 0.00 C ATOM 1209 OE1 GLU A 75 -7.983 6.810 3.181 1.00 0.00 O ATOM 1210 OE2 GLU A 75 -10.048 6.938 3.857 1.00 0.00 O ATOM 0 H GLU A 75 -8.095 1.771 0.740 1.00 0.00 H new ATOM 0 HA GLU A 75 -10.627 3.254 1.045 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -9.035 3.906 2.895 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -7.932 4.467 1.654 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -9.468 6.167 0.943 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -10.747 5.518 1.950 1.00 0.00 H new ATOM 1217 N PHE A 76 -10.211 3.549 -1.342 1.00 0.00 N ATOM 1218 CA PHE A 76 -9.970 3.851 -2.707 1.00 0.00 C ATOM 1219 C PHE A 76 -9.817 5.300 -2.881 1.00 0.00 C ATOM 1220 O PHE A 76 -10.610 6.099 -2.348 1.00 0.00 O ATOM 1221 CB PHE A 76 -11.025 3.304 -3.634 1.00 0.00 C ATOM 1222 CG PHE A 76 -10.989 1.831 -3.769 1.00 0.00 C ATOM 1223 CD1 PHE A 76 -11.643 1.010 -2.875 1.00 0.00 C ATOM 1224 CD2 PHE A 76 -10.271 1.261 -4.794 1.00 0.00 C ATOM 1225 CE1 PHE A 76 -11.578 -0.350 -3.012 1.00 0.00 C ATOM 1226 CE2 PHE A 76 -10.203 -0.089 -4.939 1.00 0.00 C ATOM 1227 CZ PHE A 76 -10.857 -0.904 -4.042 1.00 0.00 C ATOM 0 H PHE A 76 -11.172 3.296 -1.111 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.042 3.352 -2.984 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -12.008 3.603 -3.269 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -10.900 3.754 -4.619 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -12.209 1.442 -2.063 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -9.752 1.897 -5.496 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -12.094 -0.988 -2.310 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -9.639 -0.520 -5.753 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.803 -1.977 -4.148 1.00 0.00 H new ATOM 1237 N ASP A 77 -8.825 5.650 -3.618 1.00 0.00 N ATOM 1238 CA ASP A 77 -8.534 7.034 -3.818 1.00 0.00 C ATOM 1239 C ASP A 77 -9.288 7.467 -5.006 1.00 0.00 C ATOM 1240 O ASP A 77 -9.805 6.631 -5.751 1.00 0.00 O ATOM 1241 CB ASP A 77 -7.095 7.270 -4.046 1.00 0.00 C ATOM 1242 CG ASP A 77 -6.626 8.690 -3.604 1.00 0.00 C ATOM 1243 OD1 ASP A 77 -7.050 9.682 -4.234 1.00 0.00 O ATOM 1244 OD2 ASP A 77 -5.806 8.832 -2.652 1.00 0.00 O ATOM 0 H ASP A 77 -8.198 5.002 -4.095 1.00 0.00 H new ATOM 0 HA ASP A 77 -8.815 7.593 -2.926 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.520 6.520 -3.503 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -6.875 7.135 -5.105 1.00 0.00 H new ATOM 1249 N LYS A 78 -9.278 8.699 -5.275 1.00 0.00 N ATOM 1250 CA LYS A 78 -10.145 9.211 -6.275 1.00 0.00 C ATOM 1251 C LYS A 78 -9.439 9.497 -7.566 1.00 0.00 C ATOM 1252 O LYS A 78 -9.906 10.285 -8.407 1.00 0.00 O ATOM 1253 CB LYS A 78 -10.989 10.353 -5.762 1.00 0.00 C ATOM 1254 CG LYS A 78 -10.194 11.366 -5.038 1.00 0.00 C ATOM 1255 CD LYS A 78 -11.069 12.342 -4.328 1.00 0.00 C ATOM 1256 CE LYS A 78 -10.216 13.107 -3.398 1.00 0.00 C ATOM 1257 NZ LYS A 78 -10.953 14.110 -2.615 1.00 0.00 N ATOM 0 H LYS A 78 -8.680 9.390 -4.822 1.00 0.00 H new ATOM 0 HA LYS A 78 -10.852 8.419 -6.522 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -11.499 10.828 -6.600 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -11.761 9.961 -5.100 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.541 10.872 -4.319 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.551 11.896 -5.741 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.555 13.009 -5.040 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -11.860 11.824 -3.785 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -9.725 12.414 -2.715 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -9.431 13.606 -3.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -10.295 14.610 -1.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -11.401 14.793 -3.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -11.686 13.638 -2.048 1.00 0.00 H new ATOM 1271 N GLY A 79 -8.342 8.839 -7.732 1.00 0.00 N ATOM 1272 CA GLY A 79 -7.638 8.879 -8.950 1.00 0.00 C ATOM 1273 C GLY A 79 -8.075 7.768 -9.838 1.00 0.00 C ATOM 1274 O GLY A 79 -8.649 7.971 -10.906 1.00 0.00 O ATOM 0 H GLY A 79 -7.912 8.256 -7.014 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.807 9.836 -9.444 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.567 8.803 -8.761 1.00 0.00 H new ATOM 1278 N GLN A 80 -7.893 6.587 -9.322 1.00 0.00 N ATOM 1279 CA GLN A 80 -8.033 5.380 -10.042 1.00 0.00 C ATOM 1280 C GLN A 80 -8.409 4.336 -9.029 1.00 0.00 C ATOM 1281 O GLN A 80 -8.326 4.598 -7.840 1.00 0.00 O ATOM 1282 CB GLN A 80 -6.665 5.028 -10.583 1.00 0.00 C ATOM 1283 CG GLN A 80 -6.666 4.238 -11.852 1.00 0.00 C ATOM 1284 CD GLN A 80 -7.079 5.071 -13.035 1.00 0.00 C ATOM 1285 OE1 GLN A 80 -7.670 4.568 -13.980 1.00 0.00 O ATOM 1286 NE2 GLN A 80 -6.737 6.344 -13.002 1.00 0.00 N ATOM 0 H GLN A 80 -7.632 6.446 -8.346 1.00 0.00 H new ATOM 0 HA GLN A 80 -8.766 5.451 -10.846 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -6.109 5.951 -10.749 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.126 4.463 -9.823 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -5.670 3.830 -12.026 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -7.344 3.391 -11.751 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -6.244 6.719 -12.191 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -6.965 6.954 -13.787 1.00 0.00 H new ATOM 1295 N ARG A 81 -8.807 3.185 -9.469 1.00 0.00 N ATOM 1296 CA ARG A 81 -9.139 2.116 -8.554 1.00 0.00 C ATOM 1297 C ARG A 81 -8.322 0.857 -8.903 1.00 0.00 C ATOM 1298 O ARG A 81 -8.323 -0.114 -8.180 1.00 0.00 O ATOM 1299 CB ARG A 81 -10.625 1.796 -8.643 1.00 0.00 C ATOM 1300 CG ARG A 81 -11.583 2.990 -8.514 1.00 0.00 C ATOM 1301 CD ARG A 81 -11.523 3.713 -7.169 1.00 0.00 C ATOM 1302 NE ARG A 81 -12.819 4.432 -6.972 1.00 0.00 N ATOM 1303 CZ ARG A 81 -13.155 5.288 -5.988 1.00 0.00 C ATOM 1304 NH1 ARG A 81 -12.249 5.844 -5.232 1.00 0.00 N ATOM 1305 NH2 ARG A 81 -14.423 5.651 -5.842 1.00 0.00 N ATOM 0 H ARG A 81 -8.913 2.951 -10.456 1.00 0.00 H new ATOM 0 HA ARG A 81 -8.900 2.434 -7.539 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -10.814 1.307 -9.598 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -10.868 1.075 -7.862 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -11.360 3.705 -9.306 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -12.602 2.640 -8.678 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -11.356 3.001 -6.361 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -10.691 4.416 -7.151 1.00 0.00 H new ATOM 0 HE ARG A 81 -13.540 4.251 -7.671 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -11.262 5.633 -5.380 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -12.528 6.489 -4.493 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -15.135 5.282 -6.472 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -14.686 6.299 -5.099 1.00 0.00 H new ATOM 1319 N THR A 82 -7.618 0.914 -10.011 1.00 0.00 N ATOM 1320 CA THR A 82 -6.820 -0.207 -10.532 1.00 0.00 C ATOM 1321 C THR A 82 -5.414 0.210 -11.087 1.00 0.00 C ATOM 1322 O THR A 82 -5.291 1.257 -11.735 1.00 0.00 O ATOM 1323 CB THR A 82 -7.586 -0.993 -11.624 1.00 0.00 C ATOM 1324 OG1 THR A 82 -8.070 -0.092 -12.641 1.00 0.00 O ATOM 1325 CG2 THR A 82 -8.753 -1.786 -11.038 1.00 0.00 C ATOM 0 H THR A 82 -7.574 1.749 -10.596 1.00 0.00 H new ATOM 0 HA THR A 82 -6.647 -0.846 -9.666 1.00 0.00 H new ATOM 0 HB THR A 82 -6.887 -1.702 -12.068 1.00 0.00 H new ATOM 0 HG1 THR A 82 -8.551 -0.601 -13.327 1.00 0.00 H new ATOM 0 HG21 THR A 82 -9.265 -2.324 -11.836 1.00 0.00 H new ATOM 0 HG22 THR A 82 -8.377 -2.499 -10.304 1.00 0.00 H new ATOM 0 HG23 THR A 82 -9.451 -1.102 -10.555 1.00 0.00 H new ATOM 1333 N ASP A 83 -4.352 -0.611 -10.810 1.00 0.00 N ATOM 1334 CA ASP A 83 -2.970 -0.327 -11.336 1.00 0.00 C ATOM 1335 C ASP A 83 -2.176 -1.655 -11.540 1.00 0.00 C ATOM 1336 O ASP A 83 -2.720 -2.719 -11.360 1.00 0.00 O ATOM 1337 CB ASP A 83 -2.226 0.573 -10.346 1.00 0.00 C ATOM 1338 CG ASP A 83 -1.044 1.392 -10.883 1.00 0.00 C ATOM 1339 OD1 ASP A 83 -0.320 0.947 -11.790 1.00 0.00 O ATOM 1340 OD2 ASP A 83 -0.796 2.471 -10.333 1.00 0.00 O ATOM 0 H ASP A 83 -4.419 -1.455 -10.240 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.056 0.176 -12.299 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -2.947 1.267 -9.914 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -1.860 -0.053 -9.532 1.00 0.00 H new ATOM 1345 N LYS A 84 -0.888 -1.553 -11.868 1.00 0.00 N ATOM 1346 CA LYS A 84 0.023 -2.668 -12.191 1.00 0.00 C ATOM 1347 C LYS A 84 -0.494 -3.519 -13.339 1.00 0.00 C ATOM 1348 O LYS A 84 -0.158 -3.303 -14.491 1.00 0.00 O ATOM 1349 CB LYS A 84 0.364 -3.538 -10.965 1.00 0.00 C ATOM 1350 CG LYS A 84 1.315 -2.913 -9.957 1.00 0.00 C ATOM 1351 CD LYS A 84 2.736 -2.793 -10.510 1.00 0.00 C ATOM 1352 CE LYS A 84 3.684 -2.221 -9.467 1.00 0.00 C ATOM 1353 NZ LYS A 84 5.081 -2.150 -9.935 1.00 0.00 N ATOM 0 H LYS A 84 -0.421 -0.648 -11.920 1.00 0.00 H new ATOM 0 HA LYS A 84 0.953 -2.202 -12.518 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.564 -3.791 -10.453 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.800 -4.473 -11.316 1.00 0.00 H new ATOM 0 HG2 LYS A 84 0.950 -1.925 -9.678 1.00 0.00 H new ATOM 0 HG3 LYS A 84 1.329 -3.516 -9.049 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.090 -3.774 -10.828 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.733 -2.153 -11.393 1.00 0.00 H new ATOM 0 HE2 LYS A 84 3.349 -1.222 -9.188 1.00 0.00 H new ATOM 0 HE3 LYS A 84 3.639 -2.835 -8.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.679 -1.753 -9.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 5.415 -3.105 -10.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 5.135 -1.542 -10.777 1.00 0.00 H new ATOM 1367 N TYR A 85 -1.343 -4.442 -13.023 1.00 0.00 N ATOM 1368 CA TYR A 85 -1.907 -5.342 -14.011 1.00 0.00 C ATOM 1369 C TYR A 85 -3.406 -5.335 -13.867 1.00 0.00 C ATOM 1370 O TYR A 85 -4.106 -6.208 -14.358 1.00 0.00 O ATOM 1371 CB TYR A 85 -1.329 -6.761 -13.855 1.00 0.00 C ATOM 1372 CG TYR A 85 0.178 -6.821 -14.040 1.00 0.00 C ATOM 1373 CD1 TYR A 85 0.743 -6.815 -15.310 1.00 0.00 C ATOM 1374 CD2 TYR A 85 1.029 -6.873 -12.946 1.00 0.00 C ATOM 1375 CE1 TYR A 85 2.115 -6.852 -15.480 1.00 0.00 C ATOM 1376 CE2 TYR A 85 2.399 -6.912 -13.105 1.00 0.00 C ATOM 1377 CZ TYR A 85 2.938 -6.902 -14.374 1.00 0.00 C ATOM 1378 OH TYR A 85 4.304 -6.933 -14.539 1.00 0.00 O ATOM 0 H TYR A 85 -1.675 -4.604 -12.072 1.00 0.00 H new ATOM 0 HA TYR A 85 -1.643 -5.004 -15.013 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -1.582 -7.142 -12.865 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -1.804 -7.421 -14.581 1.00 0.00 H new ATOM 0 HD1 TYR A 85 0.101 -6.781 -16.177 1.00 0.00 H new ATOM 0 HD2 TYR A 85 0.611 -6.883 -11.950 1.00 0.00 H new ATOM 0 HE1 TYR A 85 2.540 -6.842 -16.473 1.00 0.00 H new ATOM 0 HE2 TYR A 85 3.045 -6.950 -12.241 1.00 0.00 H new ATOM 0 HH TYR A 85 4.739 -6.966 -13.661 1.00 0.00 H new ATOM 1388 N GLY A 86 -3.881 -4.297 -13.223 1.00 0.00 N ATOM 1389 CA GLY A 86 -5.277 -4.147 -12.959 1.00 0.00 C ATOM 1390 C GLY A 86 -5.594 -4.630 -11.592 1.00 0.00 C ATOM 1391 O GLY A 86 -6.633 -5.234 -11.328 1.00 0.00 O ATOM 0 H GLY A 86 -3.303 -3.535 -12.869 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -5.563 -3.100 -13.058 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -5.856 -4.707 -13.694 1.00 0.00 H new ATOM 1395 N ARG A 87 -4.657 -4.364 -10.723 1.00 0.00 N ATOM 1396 CA ARG A 87 -4.773 -4.618 -9.323 1.00 0.00 C ATOM 1397 C ARG A 87 -5.589 -3.442 -8.792 1.00 0.00 C ATOM 1398 O ARG A 87 -5.761 -2.511 -9.500 1.00 0.00 O ATOM 1399 CB ARG A 87 -3.384 -4.589 -8.668 1.00 0.00 C ATOM 1400 CG ARG A 87 -2.276 -5.361 -9.383 1.00 0.00 C ATOM 1401 CD ARG A 87 -2.555 -6.841 -9.535 1.00 0.00 C ATOM 1402 NE ARG A 87 -1.365 -7.557 -10.034 1.00 0.00 N ATOM 1403 CZ ARG A 87 -1.347 -8.799 -10.533 1.00 0.00 C ATOM 1404 NH1 ARG A 87 -2.469 -9.461 -10.697 1.00 0.00 N ATOM 1405 NH2 ARG A 87 -0.190 -9.362 -10.869 1.00 0.00 N ATOM 0 H ARG A 87 -3.762 -3.950 -10.985 1.00 0.00 H new ATOM 0 HA ARG A 87 -5.225 -5.588 -9.116 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -3.071 -3.549 -8.578 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -3.476 -4.983 -7.656 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.125 -4.927 -10.371 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -1.344 -5.232 -8.832 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -2.858 -7.258 -8.574 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.387 -6.989 -10.223 1.00 0.00 H new ATOM 0 HE ARG A 87 -0.475 -7.060 -9.995 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -3.358 -9.029 -10.444 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -2.452 -10.407 -11.077 1.00 0.00 H new ATOM 0 HH21 ARG A 87 0.682 -8.848 -10.746 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -0.175 -10.308 -11.249 1.00 0.00 H new ATOM 1419 N GLY A 88 -5.967 -3.429 -7.568 1.00 0.00 N ATOM 1420 CA GLY A 88 -6.832 -2.434 -7.094 1.00 0.00 C ATOM 1421 C GLY A 88 -6.116 -1.483 -6.289 1.00 0.00 C ATOM 1422 O GLY A 88 -5.708 -1.734 -5.168 1.00 0.00 O ATOM 0 H GLY A 88 -5.680 -4.114 -6.869 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.304 -1.925 -7.934 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -7.630 -2.888 -6.507 1.00 0.00 H new ATOM 1426 N LEU A 89 -5.971 -0.429 -6.884 1.00 0.00 N ATOM 1427 CA LEU A 89 -5.219 0.640 -6.514 1.00 0.00 C ATOM 1428 C LEU A 89 -6.011 1.439 -5.499 1.00 0.00 C ATOM 1429 O LEU A 89 -7.044 2.025 -5.823 1.00 0.00 O ATOM 1430 CB LEU A 89 -4.993 1.315 -7.857 1.00 0.00 C ATOM 1431 CG LEU A 89 -4.203 2.583 -7.984 1.00 0.00 C ATOM 1432 CD1 LEU A 89 -4.938 3.772 -7.427 1.00 0.00 C ATOM 1433 CD2 LEU A 89 -2.865 2.348 -7.341 1.00 0.00 C ATOM 0 H LEU A 89 -6.443 -0.263 -7.773 1.00 0.00 H new ATOM 0 HA LEU A 89 -4.268 0.451 -6.016 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.513 0.579 -8.502 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.978 1.514 -8.279 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.054 2.835 -9.034 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.325 4.666 -7.542 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -5.877 3.904 -7.965 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -5.146 3.609 -6.370 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.262 3.253 -7.415 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -3.006 2.091 -6.291 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -2.356 1.530 -7.850 1.00 0.00 H new ATOM 1445 N ALA A 90 -5.542 1.399 -4.274 1.00 0.00 N ATOM 1446 CA ALA A 90 -6.207 2.009 -3.173 1.00 0.00 C ATOM 1447 C ALA A 90 -5.293 1.976 -1.992 1.00 0.00 C ATOM 1448 O ALA A 90 -4.161 1.464 -2.071 1.00 0.00 O ATOM 1449 CB ALA A 90 -7.468 1.224 -2.825 1.00 0.00 C ATOM 0 H ALA A 90 -4.672 0.931 -4.022 1.00 0.00 H new ATOM 0 HA ALA A 90 -6.475 3.033 -3.433 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -7.970 1.698 -1.982 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.137 1.211 -3.685 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -7.199 0.202 -2.559 1.00 0.00 H new ATOM 1455 N TYR A 91 -5.743 2.543 -0.934 1.00 0.00 N ATOM 1456 CA TYR A 91 -5.081 2.459 0.307 1.00 0.00 C ATOM 1457 C TYR A 91 -5.398 1.220 0.957 1.00 0.00 C ATOM 1458 O TYR A 91 -6.519 0.711 0.831 1.00 0.00 O ATOM 1459 CB TYR A 91 -5.544 3.497 1.213 1.00 0.00 C ATOM 1460 CG TYR A 91 -5.010 4.777 0.910 1.00 0.00 C ATOM 1461 CD1 TYR A 91 -3.790 5.087 1.378 1.00 0.00 C ATOM 1462 CD2 TYR A 91 -5.701 5.681 0.153 1.00 0.00 C ATOM 1463 CE1 TYR A 91 -3.228 6.248 1.113 1.00 0.00 C ATOM 1464 CE2 TYR A 91 -5.166 6.876 -0.133 1.00 0.00 C ATOM 1465 CZ TYR A 91 -3.928 7.179 0.337 1.00 0.00 C ATOM 1466 OH TYR A 91 -3.391 8.383 0.012 1.00 0.00 O ATOM 0 H TYR A 91 -6.603 3.091 -0.910 1.00 0.00 H new ATOM 0 HA TYR A 91 -4.015 2.554 0.100 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -6.632 3.545 1.175 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -5.272 3.228 2.234 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -3.258 4.369 1.985 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -6.684 5.431 -0.217 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -2.242 6.478 1.489 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -5.713 7.590 -0.731 1.00 0.00 H new ATOM 0 HH TYR A 91 -4.029 8.890 -0.533 1.00 0.00 H new ATOM 1476 N ILE A 92 -4.468 0.776 1.698 1.00 0.00 N ATOM 1477 CA ILE A 92 -4.614 -0.378 2.457 1.00 0.00 C ATOM 1478 C ILE A 92 -4.084 -0.143 3.871 1.00 0.00 C ATOM 1479 O ILE A 92 -2.886 0.186 4.107 1.00 0.00 O ATOM 1480 CB ILE A 92 -3.971 -1.581 1.769 1.00 0.00 C ATOM 1481 CG1 ILE A 92 -4.005 -2.796 2.658 1.00 0.00 C ATOM 1482 CG2 ILE A 92 -2.594 -1.252 1.292 1.00 0.00 C ATOM 1483 CD1 ILE A 92 -3.529 -4.058 1.988 1.00 0.00 C ATOM 0 H ILE A 92 -3.557 1.225 1.792 1.00 0.00 H new ATOM 0 HA ILE A 92 -5.674 -0.617 2.544 1.00 0.00 H new ATOM 0 HB ILE A 92 -4.558 -1.827 0.884 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -3.388 -2.608 3.537 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -5.025 -2.947 3.011 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -2.159 -2.125 0.806 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -2.643 -0.428 0.581 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -1.974 -0.963 2.141 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -3.584 -4.887 2.693 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.160 -4.273 1.126 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -2.498 -3.929 1.659 1.00 0.00 H new ATOM 1495 N TYR A 93 -4.978 -0.260 4.784 1.00 0.00 N ATOM 1496 CA TYR A 93 -4.727 -0.027 6.155 1.00 0.00 C ATOM 1497 C TYR A 93 -4.876 -1.344 6.886 1.00 0.00 C ATOM 1498 O TYR A 93 -5.942 -1.975 6.867 1.00 0.00 O ATOM 1499 CB TYR A 93 -5.692 1.034 6.699 1.00 0.00 C ATOM 1500 CG TYR A 93 -5.637 2.386 5.973 1.00 0.00 C ATOM 1501 CD1 TYR A 93 -4.642 3.329 6.238 1.00 0.00 C ATOM 1502 CD2 TYR A 93 -6.605 2.729 5.045 1.00 0.00 C ATOM 1503 CE1 TYR A 93 -4.629 4.552 5.600 1.00 0.00 C ATOM 1504 CE2 TYR A 93 -6.588 3.941 4.411 1.00 0.00 C ATOM 1505 CZ TYR A 93 -5.604 4.855 4.692 1.00 0.00 C ATOM 1506 OH TYR A 93 -5.576 6.070 4.035 1.00 0.00 O ATOM 0 H TYR A 93 -5.941 -0.531 4.587 1.00 0.00 H new ATOM 0 HA TYR A 93 -3.717 0.356 6.303 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -6.709 0.646 6.638 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -5.475 1.195 7.755 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -3.869 3.097 6.955 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -7.391 2.024 4.816 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -3.850 5.268 5.818 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -7.352 4.179 3.686 1.00 0.00 H new ATOM 0 HH TYR A 93 -6.428 6.212 3.573 1.00 0.00 H new ATOM 1516 N ALA A 94 -3.851 -1.701 7.581 1.00 0.00 N ATOM 1517 CA ALA A 94 -3.701 -2.994 8.169 1.00 0.00 C ATOM 1518 C ALA A 94 -3.788 -2.788 9.606 1.00 0.00 C ATOM 1519 O ALA A 94 -2.904 -2.185 10.219 1.00 0.00 O ATOM 1520 CB ALA A 94 -2.368 -3.632 7.796 1.00 0.00 C ATOM 0 H ALA A 94 -3.063 -1.079 7.764 1.00 0.00 H new ATOM 0 HA ALA A 94 -4.471 -3.676 7.809 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -2.292 -4.614 8.262 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.306 -3.739 6.713 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -1.552 -3.000 8.145 1.00 0.00 H new ATOM 1526 N ASP A 95 -4.964 -3.073 10.102 1.00 0.00 N ATOM 1527 CA ASP A 95 -5.347 -2.862 11.488 1.00 0.00 C ATOM 1528 C ASP A 95 -5.453 -1.355 11.716 1.00 0.00 C ATOM 1529 O ASP A 95 -5.705 -0.857 12.803 1.00 0.00 O ATOM 1530 CB ASP A 95 -4.375 -3.577 12.455 1.00 0.00 C ATOM 1531 CG ASP A 95 -4.718 -3.421 13.902 1.00 0.00 C ATOM 1532 OD1 ASP A 95 -5.661 -4.076 14.367 1.00 0.00 O ATOM 1533 OD2 ASP A 95 -4.014 -2.670 14.614 1.00 0.00 O ATOM 0 H ASP A 95 -5.714 -3.473 9.538 1.00 0.00 H new ATOM 0 HA ASP A 95 -6.318 -3.309 11.699 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -4.355 -4.639 12.211 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -3.369 -3.193 12.289 1.00 0.00 H new ATOM 1538 N GLY A 96 -5.325 -0.659 10.611 1.00 0.00 N ATOM 1539 CA GLY A 96 -5.365 0.726 10.572 1.00 0.00 C ATOM 1540 C GLY A 96 -4.090 1.337 10.097 1.00 0.00 C ATOM 1541 O GLY A 96 -4.075 2.463 9.605 1.00 0.00 O ATOM 0 H GLY A 96 -5.186 -1.089 9.696 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -6.178 1.041 9.917 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.593 1.105 11.568 1.00 0.00 H new ATOM 1545 N LYS A 97 -3.040 0.592 10.193 1.00 0.00 N ATOM 1546 CA LYS A 97 -1.744 1.087 9.845 1.00 0.00 C ATOM 1547 C LYS A 97 -1.611 1.007 8.357 1.00 0.00 C ATOM 1548 O LYS A 97 -1.857 -0.028 7.777 1.00 0.00 O ATOM 1549 CB LYS A 97 -0.714 0.225 10.504 1.00 0.00 C ATOM 1550 CG LYS A 97 -0.840 0.179 12.019 1.00 0.00 C ATOM 1551 CD LYS A 97 -0.732 -1.246 12.523 1.00 0.00 C ATOM 1552 CE LYS A 97 -0.771 -1.322 14.041 1.00 0.00 C ATOM 1553 NZ LYS A 97 -2.044 -0.832 14.613 1.00 0.00 N ATOM 0 H LYS A 97 -3.052 -0.376 10.514 1.00 0.00 H new ATOM 0 HA LYS A 97 -1.608 2.117 10.173 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -0.794 -0.788 10.110 1.00 0.00 H new ATOM 0 HB3 LYS A 97 0.278 0.592 10.241 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -0.060 0.790 12.472 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -1.796 0.606 12.322 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.548 -1.839 12.110 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.197 -1.688 12.162 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.614 -2.355 14.351 1.00 0.00 H new ATOM 0 HE3 LYS A 97 0.053 -0.737 14.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.992 -0.861 15.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -2.211 0.146 14.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -2.826 -1.436 14.289 1.00 0.00 H new ATOM 1567 N MET A 98 -1.244 2.068 7.745 1.00 0.00 N ATOM 1568 CA MET A 98 -1.160 2.092 6.322 1.00 0.00 C ATOM 1569 C MET A 98 0.013 1.293 5.857 1.00 0.00 C ATOM 1570 O MET A 98 1.175 1.638 6.151 1.00 0.00 O ATOM 1571 CB MET A 98 -1.054 3.498 5.781 1.00 0.00 C ATOM 1572 CG MET A 98 -0.815 3.525 4.279 1.00 0.00 C ATOM 1573 SD MET A 98 -0.415 5.161 3.643 1.00 0.00 S ATOM 1574 CE MET A 98 -1.745 6.144 4.320 1.00 0.00 C ATOM 0 H MET A 98 -0.993 2.943 8.205 1.00 0.00 H new ATOM 0 HA MET A 98 -2.082 1.653 5.942 1.00 0.00 H new ATOM 0 HB2 MET A 98 -1.970 4.043 6.010 1.00 0.00 H new ATOM 0 HB3 MET A 98 -0.239 4.018 6.285 1.00 0.00 H new ATOM 0 HG2 MET A 98 -0.002 2.841 4.036 1.00 0.00 H new ATOM 0 HG3 MET A 98 -1.705 3.154 3.771 1.00 0.00 H new ATOM 0 HE1 MET A 98 -1.626 7.181 4.008 1.00 0.00 H new ATOM 0 HE2 MET A 98 -2.700 5.763 3.958 1.00 0.00 H new ATOM 0 HE3 MET A 98 -1.721 6.088 5.408 1.00 0.00 H new ATOM 1584 N VAL A 99 -0.287 0.253 5.110 1.00 0.00 N ATOM 1585 CA VAL A 99 0.730 -0.615 4.552 1.00 0.00 C ATOM 1586 C VAL A 99 1.646 0.192 3.660 1.00 0.00 C ATOM 1587 O VAL A 99 2.868 0.034 3.689 1.00 0.00 O ATOM 1588 CB VAL A 99 0.082 -1.749 3.727 1.00 0.00 C ATOM 1589 CG1 VAL A 99 1.112 -2.501 2.920 1.00 0.00 C ATOM 1590 CG2 VAL A 99 -0.683 -2.701 4.629 1.00 0.00 C ATOM 0 H VAL A 99 -1.242 -0.016 4.872 1.00 0.00 H new ATOM 0 HA VAL A 99 1.300 -1.056 5.369 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.620 -1.290 3.031 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.622 -3.292 2.352 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.608 -1.815 2.234 1.00 0.00 H new ATOM 0 HG13 VAL A 99 1.850 -2.940 3.591 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.131 -3.492 4.027 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.000 -3.141 5.356 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.468 -2.155 5.153 1.00 0.00 H new ATOM 1600 N ASN A 100 1.032 1.105 2.931 1.00 0.00 N ATOM 1601 CA ASN A 100 1.720 1.911 1.970 1.00 0.00 C ATOM 1602 C ASN A 100 2.849 2.705 2.678 1.00 0.00 C ATOM 1603 O ASN A 100 4.080 2.524 2.400 1.00 0.00 O ATOM 1604 CB ASN A 100 0.760 2.862 1.199 1.00 0.00 C ATOM 1605 CG ASN A 100 -0.625 2.297 0.874 1.00 0.00 C ATOM 1606 OD1 ASN A 100 -1.287 1.645 1.689 1.00 0.00 O ATOM 1607 ND2 ASN A 100 -1.036 2.498 -0.314 1.00 0.00 N ATOM 0 H ASN A 100 0.033 1.301 2.998 1.00 0.00 H new ATOM 0 HA ASN A 100 2.158 1.249 1.222 1.00 0.00 H new ATOM 0 HB2 ASN A 100 0.631 3.771 1.787 1.00 0.00 H new ATOM 0 HB3 ASN A 100 1.241 3.152 0.265 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -1.933 2.117 -0.615 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -0.468 3.040 -0.965 1.00 0.00 H new ATOM 1614 N GLU A 101 2.411 3.532 3.632 1.00 0.00 N ATOM 1615 CA GLU A 101 3.249 4.306 4.526 1.00 0.00 C ATOM 1616 C GLU A 101 4.281 3.439 5.150 1.00 0.00 C ATOM 1617 O GLU A 101 5.443 3.699 5.038 1.00 0.00 O ATOM 1618 CB GLU A 101 2.434 4.861 5.684 1.00 0.00 C ATOM 1619 CG GLU A 101 3.206 5.841 6.572 1.00 0.00 C ATOM 1620 CD GLU A 101 2.474 6.242 7.825 1.00 0.00 C ATOM 1621 OE1 GLU A 101 2.096 5.354 8.614 1.00 0.00 O ATOM 1622 OE2 GLU A 101 2.336 7.451 8.083 1.00 0.00 O ATOM 0 H GLU A 101 1.416 3.680 3.802 1.00 0.00 H new ATOM 0 HA GLU A 101 3.693 5.103 3.929 1.00 0.00 H new ATOM 0 HB2 GLU A 101 1.552 5.363 5.287 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.080 4.032 6.297 1.00 0.00 H new ATOM 0 HG2 GLU A 101 4.159 5.390 6.849 1.00 0.00 H new ATOM 0 HG3 GLU A 101 3.433 6.737 5.994 1.00 0.00 H new ATOM 1629 N ALA A 102 3.836 2.402 5.807 1.00 0.00 N ATOM 1630 CA ALA A 102 4.717 1.563 6.540 1.00 0.00 C ATOM 1631 C ALA A 102 5.792 0.955 5.655 1.00 0.00 C ATOM 1632 O ALA A 102 6.965 0.927 6.037 1.00 0.00 O ATOM 1633 CB ALA A 102 3.934 0.541 7.291 1.00 0.00 C ATOM 0 H ALA A 102 2.855 2.124 5.843 1.00 0.00 H new ATOM 0 HA ALA A 102 5.254 2.170 7.269 1.00 0.00 H new ATOM 0 HB1 ALA A 102 4.615 -0.100 7.851 1.00 0.00 H new ATOM 0 HB2 ALA A 102 3.254 1.039 7.982 1.00 0.00 H new ATOM 0 HB3 ALA A 102 3.360 -0.065 6.590 1.00 0.00 H new ATOM 1639 N LEU A 103 5.432 0.598 4.432 1.00 0.00 N ATOM 1640 CA LEU A 103 6.392 0.011 3.537 1.00 0.00 C ATOM 1641 C LEU A 103 7.383 1.061 3.115 1.00 0.00 C ATOM 1642 O LEU A 103 8.594 0.825 3.110 1.00 0.00 O ATOM 1643 CB LEU A 103 5.739 -0.589 2.305 1.00 0.00 C ATOM 1644 CG LEU A 103 6.023 -2.060 2.084 1.00 0.00 C ATOM 1645 CD1 LEU A 103 5.394 -2.887 3.178 1.00 0.00 C ATOM 1646 CD2 LEU A 103 5.548 -2.503 0.728 1.00 0.00 C ATOM 0 H LEU A 103 4.493 0.706 4.049 1.00 0.00 H new ATOM 0 HA LEU A 103 6.891 -0.797 4.071 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.661 -0.449 2.379 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.073 -0.034 1.428 1.00 0.00 H new ATOM 0 HG LEU A 103 7.102 -2.211 2.120 1.00 0.00 H new ATOM 0 HD11 LEU A 103 5.607 -3.942 3.005 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.804 -2.587 4.142 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.315 -2.730 3.178 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.764 -3.563 0.595 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.473 -2.339 0.647 1.00 0.00 H new ATOM 0 HD23 LEU A 103 6.062 -1.929 -0.043 1.00 0.00 H new ATOM 1658 N VAL A 104 6.883 2.247 2.804 1.00 0.00 N ATOM 1659 CA VAL A 104 7.774 3.331 2.404 1.00 0.00 C ATOM 1660 C VAL A 104 8.547 3.907 3.616 1.00 0.00 C ATOM 1661 O VAL A 104 9.620 4.484 3.473 1.00 0.00 O ATOM 1662 CB VAL A 104 7.012 4.440 1.611 1.00 0.00 C ATOM 1663 CG1 VAL A 104 5.972 5.116 2.405 1.00 0.00 C ATOM 1664 CG2 VAL A 104 7.920 5.433 0.935 1.00 0.00 C ATOM 0 H VAL A 104 5.891 2.483 2.819 1.00 0.00 H new ATOM 0 HA VAL A 104 8.516 2.911 1.724 1.00 0.00 H new ATOM 0 HB VAL A 104 6.501 3.897 0.816 1.00 0.00 H new ATOM 0 HG11 VAL A 104 5.483 5.874 1.793 1.00 0.00 H new ATOM 0 HG12 VAL A 104 5.234 4.385 2.736 1.00 0.00 H new ATOM 0 HG13 VAL A 104 6.428 5.590 3.274 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.320 6.172 0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 104 8.534 5.934 1.684 1.00 0.00 H new ATOM 0 HG23 VAL A 104 8.565 4.913 0.227 1.00 0.00 H new ATOM 1674 N ARG A 105 8.038 3.644 4.808 1.00 0.00 N ATOM 1675 CA ARG A 105 8.604 4.147 6.030 1.00 0.00 C ATOM 1676 C ARG A 105 9.676 3.211 6.441 1.00 0.00 C ATOM 1677 O ARG A 105 10.599 3.581 7.130 1.00 0.00 O ATOM 1678 CB ARG A 105 7.541 4.209 7.149 1.00 0.00 C ATOM 1679 CG ARG A 105 7.982 4.987 8.376 1.00 0.00 C ATOM 1680 CD ARG A 105 8.213 6.452 8.043 1.00 0.00 C ATOM 1681 NE ARG A 105 7.118 7.342 8.482 1.00 0.00 N ATOM 1682 CZ ARG A 105 7.114 8.073 9.614 1.00 0.00 C ATOM 1683 NH1 ARG A 105 8.047 7.885 10.550 1.00 0.00 N ATOM 1684 NH2 ARG A 105 6.145 8.956 9.824 1.00 0.00 N ATOM 0 H ARG A 105 7.209 3.066 4.947 1.00 0.00 H new ATOM 0 HA ARG A 105 8.987 5.154 5.868 1.00 0.00 H new ATOM 0 HB2 ARG A 105 6.634 4.663 6.750 1.00 0.00 H new ATOM 0 HB3 ARG A 105 7.284 3.193 7.449 1.00 0.00 H new ATOM 0 HG2 ARG A 105 7.224 4.903 9.155 1.00 0.00 H new ATOM 0 HG3 ARG A 105 8.899 4.553 8.775 1.00 0.00 H new ATOM 0 HD2 ARG A 105 9.143 6.779 8.508 1.00 0.00 H new ATOM 0 HD3 ARG A 105 8.342 6.554 6.966 1.00 0.00 H new ATOM 0 HE ARG A 105 6.298 7.408 7.879 1.00 0.00 H new ATOM 0 HH11 ARG A 105 8.773 7.182 10.412 1.00 0.00 H new ATOM 0 HH12 ARG A 105 8.034 8.444 11.403 1.00 0.00 H new ATOM 0 HH21 ARG A 105 5.408 9.079 9.130 1.00 0.00 H new ATOM 0 HH22 ARG A 105 6.138 9.512 10.679 1.00 0.00 H new ATOM 1698 N GLN A 106 9.507 1.975 6.042 1.00 0.00 N ATOM 1699 CA GLN A 106 10.423 0.966 6.275 1.00 0.00 C ATOM 1700 C GLN A 106 11.442 0.816 5.171 1.00 0.00 C ATOM 1701 O GLN A 106 12.275 -0.088 5.218 1.00 0.00 O ATOM 1702 CB GLN A 106 9.691 -0.295 6.465 1.00 0.00 C ATOM 1703 CG GLN A 106 9.197 -0.484 7.874 1.00 0.00 C ATOM 1704 CD GLN A 106 10.331 -0.575 8.888 1.00 0.00 C ATOM 1705 OE1 GLN A 106 10.177 -0.174 10.031 1.00 0.00 O ATOM 1706 NE2 GLN A 106 11.455 -1.135 8.490 1.00 0.00 N ATOM 0 H GLN A 106 8.683 1.665 5.527 1.00 0.00 H new ATOM 0 HA GLN A 106 10.987 1.230 7.170 1.00 0.00 H new ATOM 0 HB2 GLN A 106 8.842 -0.322 5.782 1.00 0.00 H new ATOM 0 HB3 GLN A 106 10.341 -1.129 6.199 1.00 0.00 H new ATOM 0 HG2 GLN A 106 8.543 0.347 8.140 1.00 0.00 H new ATOM 0 HG3 GLN A 106 8.596 -1.392 7.925 1.00 0.00 H new ATOM 0 HE21 GLN A 106 11.550 -1.459 7.528 1.00 0.00 H new ATOM 0 HE22 GLN A 106 12.230 -1.244 9.144 1.00 0.00 H new ATOM 1715 N GLY A 107 11.392 1.688 4.195 1.00 0.00 N ATOM 1716 CA GLY A 107 12.368 1.650 3.148 1.00 0.00 C ATOM 1717 C GLY A 107 12.224 0.446 2.262 1.00 0.00 C ATOM 1718 O GLY A 107 13.217 -0.092 1.800 1.00 0.00 O ATOM 0 H GLY A 107 10.691 2.424 4.108 1.00 0.00 H new ATOM 0 HA2 GLY A 107 12.281 2.553 2.543 1.00 0.00 H new ATOM 0 HA3 GLY A 107 13.366 1.655 3.587 1.00 0.00 H new ATOM 1722 N LEU A 108 11.007 -0.011 2.079 1.00 0.00 N ATOM 1723 CA LEU A 108 10.733 -1.094 1.146 1.00 0.00 C ATOM 1724 C LEU A 108 9.958 -0.557 -0.029 1.00 0.00 C ATOM 1725 O LEU A 108 9.611 -1.282 -0.955 1.00 0.00 O ATOM 1726 CB LEU A 108 9.947 -2.257 1.775 1.00 0.00 C ATOM 1727 CG LEU A 108 10.656 -3.167 2.781 1.00 0.00 C ATOM 1728 CD1 LEU A 108 12.147 -3.275 2.568 1.00 0.00 C ATOM 1729 CD2 LEU A 108 10.269 -2.890 4.197 1.00 0.00 C ATOM 0 H LEU A 108 10.184 0.348 2.563 1.00 0.00 H new ATOM 0 HA LEU A 108 11.699 -1.491 0.834 1.00 0.00 H new ATOM 0 HB2 LEU A 108 9.073 -1.835 2.271 1.00 0.00 H new ATOM 0 HB3 LEU A 108 9.580 -2.885 0.963 1.00 0.00 H new ATOM 0 HG LEU A 108 10.281 -4.168 2.570 1.00 0.00 H new ATOM 0 HD11 LEU A 108 12.575 -3.937 3.321 1.00 0.00 H new ATOM 0 HD12 LEU A 108 12.344 -3.679 1.575 1.00 0.00 H new ATOM 0 HD13 LEU A 108 12.599 -2.287 2.654 1.00 0.00 H new ATOM 0 HD21 LEU A 108 10.806 -3.568 4.860 1.00 0.00 H new ATOM 0 HD22 LEU A 108 10.522 -1.860 4.449 1.00 0.00 H new ATOM 0 HD23 LEU A 108 9.196 -3.039 4.317 1.00 0.00 H new ATOM 1741 N ALA A 109 9.699 0.709 0.020 1.00 0.00 N ATOM 1742 CA ALA A 109 8.952 1.386 -0.976 1.00 0.00 C ATOM 1743 C ALA A 109 9.403 2.795 -1.022 1.00 0.00 C ATOM 1744 O ALA A 109 9.987 3.301 -0.061 1.00 0.00 O ATOM 1745 CB ALA A 109 7.480 1.342 -0.640 1.00 0.00 C ATOM 0 H ALA A 109 10.013 1.314 0.779 1.00 0.00 H new ATOM 0 HA ALA A 109 9.106 0.905 -1.942 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.915 1.865 -1.412 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.149 0.305 -0.588 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.312 1.825 0.323 1.00 0.00 H new ATOM 1751 N LYS A 110 9.193 3.380 -2.139 1.00 0.00 N ATOM 1752 CA LYS A 110 9.441 4.776 -2.375 1.00 0.00 C ATOM 1753 C LYS A 110 8.076 5.365 -2.573 1.00 0.00 C ATOM 1754 O LYS A 110 7.121 4.595 -2.870 1.00 0.00 O ATOM 1755 CB LYS A 110 10.185 4.965 -3.687 1.00 0.00 C ATOM 1756 CG LYS A 110 11.371 4.058 -3.916 1.00 0.00 C ATOM 1757 CD LYS A 110 11.780 4.130 -5.367 1.00 0.00 C ATOM 1758 CE LYS A 110 12.789 3.069 -5.727 1.00 0.00 C ATOM 1759 NZ LYS A 110 12.845 2.891 -7.190 1.00 0.00 N ATOM 0 H LYS A 110 8.829 2.892 -2.957 1.00 0.00 H new ATOM 0 HA LYS A 110 10.020 5.219 -1.564 1.00 0.00 H new ATOM 0 HB2 LYS A 110 9.480 4.820 -4.505 1.00 0.00 H new ATOM 0 HB3 LYS A 110 10.528 5.998 -3.741 1.00 0.00 H new ATOM 0 HG2 LYS A 110 12.201 4.358 -3.277 1.00 0.00 H new ATOM 0 HG3 LYS A 110 11.116 3.033 -3.648 1.00 0.00 H new ATOM 0 HD2 LYS A 110 10.898 4.019 -5.997 1.00 0.00 H new ATOM 0 HD3 LYS A 110 12.200 5.114 -5.576 1.00 0.00 H new ATOM 0 HE2 LYS A 110 13.772 3.350 -5.350 1.00 0.00 H new ATOM 0 HE3 LYS A 110 12.522 2.126 -5.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 13.556 2.169 -7.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 11.914 2.586 -7.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 13.105 3.792 -7.640 1.00 0.00 H new ATOM 1773 N VAL A 111 7.942 6.661 -2.462 1.00 0.00 N ATOM 1774 CA VAL A 111 6.666 7.254 -2.712 1.00 0.00 C ATOM 1775 C VAL A 111 6.497 7.416 -4.198 1.00 0.00 C ATOM 1776 O VAL A 111 7.258 8.136 -4.875 1.00 0.00 O ATOM 1777 CB VAL A 111 6.381 8.597 -1.945 1.00 0.00 C ATOM 1778 CG1 VAL A 111 7.400 9.667 -2.243 1.00 0.00 C ATOM 1779 CG2 VAL A 111 4.987 9.114 -2.271 1.00 0.00 C ATOM 0 H VAL A 111 8.686 7.309 -2.206 1.00 0.00 H new ATOM 0 HA VAL A 111 5.919 6.572 -2.306 1.00 0.00 H new ATOM 0 HB VAL A 111 6.450 8.366 -0.882 1.00 0.00 H new ATOM 0 HG11 VAL A 111 7.152 10.571 -1.686 1.00 0.00 H new ATOM 0 HG12 VAL A 111 8.390 9.319 -1.948 1.00 0.00 H new ATOM 0 HG13 VAL A 111 7.396 9.886 -3.311 1.00 0.00 H new ATOM 0 HG21 VAL A 111 4.808 10.044 -1.731 1.00 0.00 H new ATOM 0 HG22 VAL A 111 4.908 9.296 -3.343 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.245 8.373 -1.973 1.00 0.00 H new ATOM 1789 N ALA A 112 5.582 6.691 -4.716 1.00 0.00 N ATOM 1790 CA ALA A 112 5.308 6.748 -6.095 1.00 0.00 C ATOM 1791 C ALA A 112 4.197 7.725 -6.330 1.00 0.00 C ATOM 1792 O ALA A 112 3.661 8.306 -5.401 1.00 0.00 O ATOM 1793 CB ALA A 112 4.947 5.376 -6.642 1.00 0.00 C ATOM 0 H ALA A 112 5.000 6.038 -4.191 1.00 0.00 H new ATOM 0 HA ALA A 112 6.202 7.079 -6.623 1.00 0.00 H new ATOM 0 HB1 ALA A 112 4.741 5.453 -7.710 1.00 0.00 H new ATOM 0 HB2 ALA A 112 5.779 4.690 -6.481 1.00 0.00 H new ATOM 0 HB3 ALA A 112 4.062 5.000 -6.128 1.00 0.00 H new ATOM 1799 N TYR A 113 3.842 7.857 -7.534 1.00 0.00 N ATOM 1800 CA TYR A 113 2.810 8.743 -7.947 1.00 0.00 C ATOM 1801 C TYR A 113 2.110 8.043 -9.033 1.00 0.00 C ATOM 1802 O TYR A 113 2.536 8.028 -10.182 1.00 0.00 O ATOM 1803 CB TYR A 113 3.350 10.106 -8.376 1.00 0.00 C ATOM 1804 CG TYR A 113 2.298 11.091 -8.866 1.00 0.00 C ATOM 1805 CD1 TYR A 113 1.050 11.226 -8.239 1.00 0.00 C ATOM 1806 CD2 TYR A 113 2.559 11.889 -9.959 1.00 0.00 C ATOM 1807 CE1 TYR A 113 0.123 12.125 -8.702 1.00 0.00 C ATOM 1808 CE2 TYR A 113 1.640 12.789 -10.417 1.00 0.00 C ATOM 1809 CZ TYR A 113 0.426 12.909 -9.791 1.00 0.00 C ATOM 1810 OH TYR A 113 -0.489 13.819 -10.266 1.00 0.00 O ATOM 0 H TYR A 113 4.268 7.338 -8.302 1.00 0.00 H new ATOM 0 HA TYR A 113 2.131 8.976 -7.126 1.00 0.00 H new ATOM 0 HB2 TYR A 113 3.879 10.552 -7.533 1.00 0.00 H new ATOM 0 HB3 TYR A 113 4.083 9.956 -9.169 1.00 0.00 H new ATOM 0 HD1 TYR A 113 0.816 10.614 -7.380 1.00 0.00 H new ATOM 0 HD2 TYR A 113 3.510 11.801 -10.464 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -0.837 12.217 -8.216 1.00 0.00 H new ATOM 0 HE2 TYR A 113 1.869 13.407 -11.273 1.00 0.00 H new ATOM 0 HH TYR A 113 -0.039 14.455 -10.861 1.00 0.00 H new ATOM 1820 N VAL A 114 1.096 7.388 -8.629 1.00 0.00 N ATOM 1821 CA VAL A 114 0.372 6.472 -9.443 1.00 0.00 C ATOM 1822 C VAL A 114 -0.358 7.114 -10.598 1.00 0.00 C ATOM 1823 O VAL A 114 -0.077 6.828 -11.762 1.00 0.00 O ATOM 1824 CB VAL A 114 -0.583 5.626 -8.588 1.00 0.00 C ATOM 1825 CG1 VAL A 114 0.214 4.610 -7.782 1.00 0.00 C ATOM 1826 CG2 VAL A 114 -1.408 6.496 -7.625 1.00 0.00 C ATOM 0 H VAL A 114 0.724 7.472 -7.683 1.00 0.00 H new ATOM 0 HA VAL A 114 1.120 5.823 -9.899 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.271 5.119 -9.265 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -0.467 4.011 -7.176 1.00 0.00 H new ATOM 0 HG12 VAL A 114 0.765 3.958 -8.461 1.00 0.00 H new ATOM 0 HG13 VAL A 114 0.916 5.132 -7.131 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -2.071 5.861 -7.038 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -0.737 7.036 -6.957 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -2.001 7.209 -8.197 1.00 0.00 H new ATOM 1836 N TYR A 115 -1.262 7.974 -10.278 1.00 0.00 N ATOM 1837 CA TYR A 115 -2.092 8.603 -11.218 1.00 0.00 C ATOM 1838 C TYR A 115 -2.434 9.931 -10.630 1.00 0.00 C ATOM 1839 O TYR A 115 -2.439 10.055 -9.391 1.00 0.00 O ATOM 1840 CB TYR A 115 -3.405 7.830 -11.446 1.00 0.00 C ATOM 1841 CG TYR A 115 -3.296 6.405 -11.911 1.00 0.00 C ATOM 1842 CD1 TYR A 115 -3.261 6.099 -13.261 1.00 0.00 C ATOM 1843 CD2 TYR A 115 -3.277 5.360 -10.998 1.00 0.00 C ATOM 1844 CE1 TYR A 115 -3.213 4.793 -13.692 1.00 0.00 C ATOM 1845 CE2 TYR A 115 -3.216 4.057 -11.427 1.00 0.00 C ATOM 1846 CZ TYR A 115 -3.188 3.778 -12.770 1.00 0.00 C ATOM 1847 OH TYR A 115 -3.168 2.472 -13.189 1.00 0.00 O ATOM 0 H TYR A 115 -1.442 8.262 -9.316 1.00 0.00 H new ATOM 0 HA TYR A 115 -1.579 8.666 -12.178 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -3.967 7.838 -10.512 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -3.997 8.379 -12.179 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -3.272 6.898 -13.987 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -3.311 5.574 -9.940 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -3.195 4.569 -14.748 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -3.190 3.252 -10.707 1.00 0.00 H new ATOM 0 HH TYR A 115 -3.942 1.998 -12.820 1.00 0.00 H new ATOM 1857 N LYS A 116 -2.701 10.902 -11.452 1.00 0.00 N ATOM 1858 CA LYS A 116 -3.102 12.216 -10.989 1.00 0.00 C ATOM 1859 C LYS A 116 -4.461 12.066 -10.327 1.00 0.00 C ATOM 1860 O LYS A 116 -5.473 11.823 -10.983 1.00 0.00 O ATOM 1861 CB LYS A 116 -3.196 13.182 -12.181 1.00 0.00 C ATOM 1862 CG LYS A 116 -3.029 14.703 -11.909 1.00 0.00 C ATOM 1863 CD LYS A 116 -3.963 15.309 -10.851 1.00 0.00 C ATOM 1864 CE LYS A 116 -3.340 15.316 -9.453 1.00 0.00 C ATOM 1865 NZ LYS A 116 -2.038 16.034 -9.417 1.00 0.00 N ATOM 0 H LYS A 116 -2.650 10.814 -12.467 1.00 0.00 H new ATOM 0 HA LYS A 116 -2.375 12.619 -10.284 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -2.438 12.889 -12.908 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -4.166 13.033 -12.654 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -1.999 14.885 -11.602 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -3.181 15.237 -12.847 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -4.217 16.330 -11.137 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -4.895 14.744 -10.827 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.031 15.786 -8.753 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -3.195 14.289 -9.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -1.877 16.412 -8.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -1.271 15.375 -9.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -2.054 16.817 -10.101 1.00 0.00 H new ATOM 1879 N GLY A 117 -4.453 12.135 -9.037 1.00 0.00 N ATOM 1880 CA GLY A 117 -5.639 11.998 -8.297 1.00 0.00 C ATOM 1881 C GLY A 117 -5.354 11.272 -7.045 1.00 0.00 C ATOM 1882 O GLY A 117 -5.565 11.793 -5.961 1.00 0.00 O ATOM 0 H GLY A 117 -3.616 12.289 -8.475 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -6.057 12.980 -8.074 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -6.385 11.459 -8.881 1.00 0.00 H new ATOM 1886 N ASN A 118 -4.765 10.113 -7.189 1.00 0.00 N ATOM 1887 CA ASN A 118 -4.478 9.282 -6.046 1.00 0.00 C ATOM 1888 C ASN A 118 -3.154 9.671 -5.511 1.00 0.00 C ATOM 1889 O ASN A 118 -2.126 9.236 -6.028 1.00 0.00 O ATOM 1890 CB ASN A 118 -4.410 7.792 -6.372 1.00 0.00 C ATOM 1891 CG ASN A 118 -5.481 7.276 -7.277 1.00 0.00 C ATOM 1892 OD1 ASN A 118 -6.569 6.937 -6.873 1.00 0.00 O ATOM 1893 ND2 ASN A 118 -5.184 7.199 -8.534 1.00 0.00 N ATOM 0 H ASN A 118 -4.474 9.722 -8.085 1.00 0.00 H new ATOM 0 HA ASN A 118 -5.292 9.432 -5.337 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -3.443 7.583 -6.828 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -4.449 7.232 -5.437 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -5.872 6.848 -9.200 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -4.262 7.489 -8.859 1.00 0.00 H new ATOM 1900 N ASN A 119 -3.161 10.545 -4.550 1.00 0.00 N ATOM 1901 CA ASN A 119 -1.951 11.014 -3.922 1.00 0.00 C ATOM 1902 C ASN A 119 -2.323 11.794 -2.676 1.00 0.00 C ATOM 1903 O ASN A 119 -1.547 12.589 -2.155 1.00 0.00 O ATOM 1904 CB ASN A 119 -1.081 11.863 -4.906 1.00 0.00 C ATOM 1905 CG ASN A 119 -1.673 13.218 -5.316 1.00 0.00 C ATOM 1906 OD1 ASN A 119 -0.953 14.198 -5.451 1.00 0.00 O ATOM 1907 ND2 ASN A 119 -2.942 13.262 -5.637 1.00 0.00 N ATOM 0 H ASN A 119 -4.013 10.960 -4.172 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.335 10.161 -3.639 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -0.108 12.036 -4.445 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -0.907 11.275 -5.807 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -3.345 14.123 -6.006 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -3.527 12.435 -5.518 1.00 0.00 H new ATOM 1914 N THR A 120 -3.478 11.459 -2.128 1.00 0.00 N ATOM 1915 CA THR A 120 -4.035 12.172 -1.000 1.00 0.00 C ATOM 1916 C THR A 120 -3.147 12.041 0.250 1.00 0.00 C ATOM 1917 O THR A 120 -3.127 12.923 1.095 1.00 0.00 O ATOM 1918 CB THR A 120 -5.456 11.667 -0.729 1.00 0.00 C ATOM 1919 OG1 THR A 120 -6.089 11.418 -1.996 1.00 0.00 O ATOM 1920 CG2 THR A 120 -6.259 12.728 -0.013 1.00 0.00 C ATOM 0 H THR A 120 -4.054 10.684 -2.456 1.00 0.00 H new ATOM 0 HA THR A 120 -4.076 13.233 -1.244 1.00 0.00 H new ATOM 0 HB THR A 120 -5.410 10.767 -0.116 1.00 0.00 H new ATOM 0 HG1 THR A 120 -6.196 10.452 -2.124 1.00 0.00 H new ATOM 0 HG21 THR A 120 -7.267 12.357 0.174 1.00 0.00 H new ATOM 0 HG22 THR A 120 -5.779 12.969 0.936 1.00 0.00 H new ATOM 0 HG23 THR A 120 -6.311 13.624 -0.631 1.00 0.00 H new ATOM 1928 N HIS A 121 -2.417 10.958 0.359 1.00 0.00 N ATOM 1929 CA HIS A 121 -1.456 10.810 1.413 1.00 0.00 C ATOM 1930 C HIS A 121 -0.071 10.798 0.873 1.00 0.00 C ATOM 1931 O HIS A 121 0.846 10.382 1.564 1.00 0.00 O ATOM 1932 CB HIS A 121 -1.682 9.570 2.260 1.00 0.00 C ATOM 1933 CG HIS A 121 -2.740 9.692 3.298 1.00 0.00 C ATOM 1934 ND1 HIS A 121 -3.726 8.753 3.511 1.00 0.00 N ATOM 1935 CD2 HIS A 121 -2.891 10.620 4.266 1.00 0.00 C ATOM 1936 CE1 HIS A 121 -4.420 9.120 4.577 1.00 0.00 C ATOM 1937 NE2 HIS A 121 -3.959 10.254 5.083 1.00 0.00 N ATOM 0 H HIS A 121 -2.475 10.163 -0.277 1.00 0.00 H new ATOM 0 HA HIS A 121 -1.591 11.676 2.062 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -1.938 8.741 1.600 1.00 0.00 H new ATOM 0 HB3 HIS A 121 -0.744 9.309 2.750 1.00 0.00 H new ATOM 0 HD1 HIS A 121 -3.892 7.920 2.946 1.00 0.00 H new ATOM 0 HD2 HIS A 121 -2.282 11.504 4.388 1.00 0.00 H new ATOM 0 HE1 HIS A 121 -5.254 8.566 4.982 1.00 0.00 H new ATOM 1945 N GLU A 122 0.116 11.326 -0.330 1.00 0.00 N ATOM 1946 CA GLU A 122 1.441 11.357 -0.921 1.00 0.00 C ATOM 1947 C GLU A 122 2.388 12.179 -0.048 1.00 0.00 C ATOM 1948 O GLU A 122 3.569 11.894 0.015 1.00 0.00 O ATOM 1949 CB GLU A 122 1.401 11.910 -2.335 1.00 0.00 C ATOM 1950 CG GLU A 122 2.771 11.982 -3.008 1.00 0.00 C ATOM 1951 CD GLU A 122 2.842 12.983 -4.125 1.00 0.00 C ATOM 1952 OE1 GLU A 122 3.025 14.189 -3.826 1.00 0.00 O ATOM 1953 OE2 GLU A 122 2.768 12.608 -5.305 1.00 0.00 O ATOM 0 H GLU A 122 -0.622 11.732 -0.905 1.00 0.00 H new ATOM 0 HA GLU A 122 1.812 10.334 -0.976 1.00 0.00 H new ATOM 0 HB2 GLU A 122 0.742 11.288 -2.940 1.00 0.00 H new ATOM 0 HB3 GLU A 122 0.965 12.909 -2.312 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.522 12.233 -2.259 1.00 0.00 H new ATOM 0 HG3 GLU A 122 3.027 10.997 -3.398 1.00 0.00 H new ATOM 1960 N GLN A 123 1.842 13.149 0.688 1.00 0.00 N ATOM 1961 CA GLN A 123 2.657 13.966 1.565 1.00 0.00 C ATOM 1962 C GLN A 123 3.218 13.076 2.702 1.00 0.00 C ATOM 1963 O GLN A 123 4.405 13.126 3.045 1.00 0.00 O ATOM 1964 CB GLN A 123 1.872 15.204 2.114 1.00 0.00 C ATOM 1965 CG GLN A 123 0.755 14.919 3.129 1.00 0.00 C ATOM 1966 CD GLN A 123 -0.435 14.152 2.607 1.00 0.00 C ATOM 1967 OE1 GLN A 123 -1.037 13.382 3.345 1.00 0.00 O ATOM 1968 NE2 GLN A 123 -0.824 14.360 1.372 1.00 0.00 N ATOM 0 H GLN A 123 0.849 13.380 0.689 1.00 0.00 H new ATOM 0 HA GLN A 123 3.490 14.378 0.996 1.00 0.00 H new ATOM 0 HB2 GLN A 123 2.588 15.882 2.578 1.00 0.00 H new ATOM 0 HB3 GLN A 123 1.435 15.733 1.267 1.00 0.00 H new ATOM 0 HG2 GLN A 123 1.183 14.363 3.963 1.00 0.00 H new ATOM 0 HG3 GLN A 123 0.402 15.870 3.528 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -0.306 15.006 0.776 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -1.644 13.876 1.007 1.00 0.00 H new ATOM 1977 N LEU A 124 2.372 12.183 3.174 1.00 0.00 N ATOM 1978 CA LEU A 124 2.699 11.246 4.211 1.00 0.00 C ATOM 1979 C LEU A 124 3.707 10.217 3.697 1.00 0.00 C ATOM 1980 O LEU A 124 4.695 9.880 4.386 1.00 0.00 O ATOM 1981 CB LEU A 124 1.380 10.612 4.740 1.00 0.00 C ATOM 1982 CG LEU A 124 1.458 9.292 5.517 1.00 0.00 C ATOM 1983 CD1 LEU A 124 0.240 9.126 6.386 1.00 0.00 C ATOM 1984 CD2 LEU A 124 1.489 8.122 4.558 1.00 0.00 C ATOM 0 H LEU A 124 1.415 12.093 2.833 1.00 0.00 H new ATOM 0 HA LEU A 124 3.185 11.745 5.050 1.00 0.00 H new ATOM 0 HB2 LEU A 124 0.895 11.346 5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 124 0.723 10.454 3.885 1.00 0.00 H new ATOM 0 HG LEU A 124 2.363 9.317 6.124 1.00 0.00 H new ATOM 0 HD11 LEU A 124 0.308 8.185 6.932 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.183 9.953 7.094 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -0.654 9.120 5.762 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.544 7.191 5.122 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.584 8.125 3.951 1.00 0.00 H new ATOM 0 HD23 LEU A 124 2.361 8.206 3.910 1.00 0.00 H new ATOM 1996 N LEU A 125 3.478 9.732 2.491 1.00 0.00 N ATOM 1997 CA LEU A 125 4.371 8.773 1.911 1.00 0.00 C ATOM 1998 C LEU A 125 5.701 9.383 1.555 1.00 0.00 C ATOM 1999 O LEU A 125 6.729 8.755 1.750 1.00 0.00 O ATOM 2000 CB LEU A 125 3.771 8.008 0.743 1.00 0.00 C ATOM 2001 CG LEU A 125 2.724 6.961 1.087 1.00 0.00 C ATOM 2002 CD1 LEU A 125 1.316 7.424 0.801 1.00 0.00 C ATOM 2003 CD2 LEU A 125 3.045 5.674 0.396 1.00 0.00 C ATOM 0 H LEU A 125 2.684 9.990 1.905 1.00 0.00 H new ATOM 0 HA LEU A 125 4.546 8.032 2.691 1.00 0.00 H new ATOM 0 HB2 LEU A 125 3.322 8.727 0.058 1.00 0.00 H new ATOM 0 HB3 LEU A 125 4.581 7.517 0.204 1.00 0.00 H new ATOM 0 HG LEU A 125 2.760 6.795 2.164 1.00 0.00 H new ATOM 0 HD11 LEU A 125 0.613 6.635 1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 125 1.100 8.316 1.389 1.00 0.00 H new ATOM 0 HD13 LEU A 125 1.218 7.656 -0.259 1.00 0.00 H new ATOM 0 HD21 LEU A 125 2.291 4.928 0.647 1.00 0.00 H new ATOM 0 HD22 LEU A 125 3.054 5.832 -0.682 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.025 5.322 0.719 1.00 0.00 H new ATOM 2015 N ARG A 126 5.699 10.623 1.065 1.00 0.00 N ATOM 2016 CA ARG A 126 6.946 11.293 0.785 1.00 0.00 C ATOM 2017 C ARG A 126 7.657 11.592 2.074 1.00 0.00 C ATOM 2018 O ARG A 126 8.876 11.564 2.107 1.00 0.00 O ATOM 2019 CB ARG A 126 6.803 12.555 -0.057 1.00 0.00 C ATOM 2020 CG ARG A 126 6.239 13.722 0.659 1.00 0.00 C ATOM 2021 CD ARG A 126 6.393 14.940 -0.161 1.00 0.00 C ATOM 2022 NE ARG A 126 6.006 16.152 0.584 1.00 0.00 N ATOM 2023 CZ ARG A 126 5.923 17.389 0.063 1.00 0.00 C ATOM 2024 NH1 ARG A 126 6.394 17.641 -1.162 1.00 0.00 N ATOM 2025 NH2 ARG A 126 5.425 18.381 0.798 1.00 0.00 N ATOM 0 H ARG A 126 4.860 11.166 0.861 1.00 0.00 H new ATOM 0 HA ARG A 126 7.536 10.608 0.177 1.00 0.00 H new ATOM 0 HB2 ARG A 126 7.784 12.826 -0.448 1.00 0.00 H new ATOM 0 HB3 ARG A 126 6.168 12.332 -0.915 1.00 0.00 H new ATOM 0 HG2 ARG A 126 5.185 13.551 0.876 1.00 0.00 H new ATOM 0 HG3 ARG A 126 6.745 13.851 1.616 1.00 0.00 H new ATOM 0 HD2 ARG A 126 7.429 15.030 -0.489 1.00 0.00 H new ATOM 0 HD3 ARG A 126 5.781 14.854 -1.059 1.00 0.00 H new ATOM 0 HE ARG A 126 5.783 16.044 1.574 1.00 0.00 H new ATOM 0 HH11 ARG A 126 6.820 16.893 -1.709 1.00 0.00 H new ATOM 0 HH12 ARG A 126 6.327 18.582 -1.550 1.00 0.00 H new ATOM 0 HH21 ARG A 126 5.109 18.201 1.751 1.00 0.00 H new ATOM 0 HH22 ARG A 126 5.360 19.321 0.408 1.00 0.00 H new ATOM 2039 N LYS A 127 6.882 11.867 3.146 1.00 0.00 N ATOM 2040 CA LYS A 127 7.462 12.053 4.459 1.00 0.00 C ATOM 2041 C LYS A 127 8.119 10.743 4.890 1.00 0.00 C ATOM 2042 O LYS A 127 9.248 10.749 5.349 1.00 0.00 O ATOM 2043 CB LYS A 127 6.384 12.503 5.491 1.00 0.00 C ATOM 2044 CG LYS A 127 6.908 13.065 6.839 1.00 0.00 C ATOM 2045 CD LYS A 127 7.633 12.031 7.705 1.00 0.00 C ATOM 2046 CE LYS A 127 8.164 12.636 8.997 1.00 0.00 C ATOM 2047 NZ LYS A 127 7.083 13.128 9.868 1.00 0.00 N ATOM 0 H LYS A 127 5.867 11.961 3.112 1.00 0.00 H new ATOM 0 HA LYS A 127 8.212 12.843 4.417 1.00 0.00 H new ATOM 0 HB2 LYS A 127 5.761 13.265 5.023 1.00 0.00 H new ATOM 0 HB3 LYS A 127 5.739 11.651 5.704 1.00 0.00 H new ATOM 0 HG2 LYS A 127 7.586 13.894 6.636 1.00 0.00 H new ATOM 0 HG3 LYS A 127 6.068 13.471 7.403 1.00 0.00 H new ATOM 0 HD2 LYS A 127 6.951 11.215 7.941 1.00 0.00 H new ATOM 0 HD3 LYS A 127 8.460 11.602 7.140 1.00 0.00 H new ATOM 0 HE2 LYS A 127 8.748 11.888 9.533 1.00 0.00 H new ATOM 0 HE3 LYS A 127 8.840 13.458 8.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 7.478 13.406 10.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 6.627 13.951 9.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 6.379 12.375 10.007 1.00 0.00 H new ATOM 2061 N ALA A 128 7.423 9.614 4.702 1.00 0.00 N ATOM 2062 CA ALA A 128 7.938 8.327 5.102 1.00 0.00 C ATOM 2063 C ALA A 128 9.179 8.006 4.307 1.00 0.00 C ATOM 2064 O ALA A 128 10.211 7.569 4.873 1.00 0.00 O ATOM 2065 CB ALA A 128 6.877 7.284 4.890 1.00 0.00 C ATOM 0 H ALA A 128 6.499 9.581 4.272 1.00 0.00 H new ATOM 0 HA ALA A 128 8.206 8.344 6.158 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.260 6.309 5.191 1.00 0.00 H new ATOM 0 HB2 ALA A 128 6.000 7.530 5.489 1.00 0.00 H new ATOM 0 HB3 ALA A 128 6.600 7.256 3.836 1.00 0.00 H new ATOM 2071 N GLU A 129 9.084 8.253 3.008 1.00 0.00 N ATOM 2072 CA GLU A 129 10.174 8.095 2.109 1.00 0.00 C ATOM 2073 C GLU A 129 11.350 8.914 2.594 1.00 0.00 C ATOM 2074 O GLU A 129 12.396 8.372 2.850 1.00 0.00 O ATOM 2075 CB GLU A 129 9.789 8.529 0.696 1.00 0.00 C ATOM 2076 CG GLU A 129 10.909 8.351 -0.301 1.00 0.00 C ATOM 2077 CD GLU A 129 10.597 8.898 -1.659 1.00 0.00 C ATOM 2078 OE1 GLU A 129 10.724 10.134 -1.854 1.00 0.00 O ATOM 2079 OE2 GLU A 129 10.258 8.125 -2.552 1.00 0.00 O ATOM 0 H GLU A 129 8.225 8.573 2.561 1.00 0.00 H new ATOM 0 HA GLU A 129 10.446 7.040 2.078 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.923 7.954 0.368 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.488 9.576 0.713 1.00 0.00 H new ATOM 0 HG2 GLU A 129 11.805 8.840 0.081 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.139 7.289 -0.390 1.00 0.00 H new ATOM 2086 N ALA A 130 11.128 10.216 2.788 1.00 0.00 N ATOM 2087 CA ALA A 130 12.176 11.139 3.210 1.00 0.00 C ATOM 2088 C ALA A 130 12.759 10.742 4.538 1.00 0.00 C ATOM 2089 O ALA A 130 13.945 10.869 4.761 1.00 0.00 O ATOM 2090 CB ALA A 130 11.667 12.557 3.262 1.00 0.00 C ATOM 0 H ALA A 130 10.217 10.656 2.656 1.00 0.00 H new ATOM 0 HA ALA A 130 12.969 11.087 2.464 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.471 13.221 3.580 1.00 0.00 H new ATOM 0 HB2 ALA A 130 11.320 12.855 2.273 1.00 0.00 H new ATOM 0 HB3 ALA A 130 10.842 12.622 3.971 1.00 0.00 H new ATOM 2096 N GLN A 131 11.917 10.242 5.397 1.00 0.00 N ATOM 2097 CA GLN A 131 12.298 9.747 6.696 1.00 0.00 C ATOM 2098 C GLN A 131 13.274 8.562 6.495 1.00 0.00 C ATOM 2099 O GLN A 131 14.405 8.530 7.056 1.00 0.00 O ATOM 2100 CB GLN A 131 10.994 9.312 7.418 1.00 0.00 C ATOM 2101 CG GLN A 131 11.061 9.067 8.921 1.00 0.00 C ATOM 2102 CD GLN A 131 11.896 7.884 9.330 1.00 0.00 C ATOM 2103 OE1 GLN A 131 12.496 7.887 10.391 1.00 0.00 O ATOM 2104 NE2 GLN A 131 11.895 6.849 8.541 1.00 0.00 N ATOM 0 H GLN A 131 10.917 10.164 5.211 1.00 0.00 H new ATOM 0 HA GLN A 131 12.805 10.498 7.302 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.240 10.078 7.237 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.639 8.396 6.945 1.00 0.00 H new ATOM 0 HG2 GLN A 131 11.460 9.960 9.403 1.00 0.00 H new ATOM 0 HG3 GLN A 131 10.048 8.927 9.298 1.00 0.00 H new ATOM 0 HE21 GLN A 131 11.382 6.880 7.660 1.00 0.00 H new ATOM 0 HE22 GLN A 131 12.407 6.007 8.804 1.00 0.00 H new ATOM 2113 N ALA A 132 12.879 7.657 5.609 1.00 0.00 N ATOM 2114 CA ALA A 132 13.628 6.456 5.355 1.00 0.00 C ATOM 2115 C ALA A 132 14.927 6.832 4.658 1.00 0.00 C ATOM 2116 O ALA A 132 15.977 6.215 4.850 1.00 0.00 O ATOM 2117 CB ALA A 132 12.788 5.552 4.484 1.00 0.00 C ATOM 0 H ALA A 132 12.029 7.745 5.052 1.00 0.00 H new ATOM 0 HA ALA A 132 13.869 5.934 6.281 1.00 0.00 H new ATOM 0 HB1 ALA A 132 13.337 4.633 4.278 1.00 0.00 H new ATOM 0 HB2 ALA A 132 11.858 5.312 4.999 1.00 0.00 H new ATOM 0 HB3 ALA A 132 12.562 6.058 3.545 1.00 0.00 H new ATOM 2123 N LYS A 133 14.832 7.887 3.898 1.00 0.00 N ATOM 2124 CA LYS A 133 15.900 8.462 3.164 1.00 0.00 C ATOM 2125 C LYS A 133 16.919 9.033 4.080 1.00 0.00 C ATOM 2126 O LYS A 133 18.076 8.694 3.994 1.00 0.00 O ATOM 2127 CB LYS A 133 15.334 9.536 2.281 1.00 0.00 C ATOM 2128 CG LYS A 133 14.692 9.018 1.062 1.00 0.00 C ATOM 2129 CD LYS A 133 14.153 10.152 0.247 1.00 0.00 C ATOM 2130 CE LYS A 133 14.059 9.771 -1.191 1.00 0.00 C ATOM 2131 NZ LYS A 133 13.326 10.764 -2.009 1.00 0.00 N ATOM 0 H LYS A 133 13.953 8.389 3.774 1.00 0.00 H new ATOM 0 HA LYS A 133 16.389 7.697 2.562 1.00 0.00 H new ATOM 0 HB2 LYS A 133 14.605 10.114 2.848 1.00 0.00 H new ATOM 0 HB3 LYS A 133 16.133 10.221 1.998 1.00 0.00 H new ATOM 0 HG2 LYS A 133 15.413 8.448 0.476 1.00 0.00 H new ATOM 0 HG3 LYS A 133 13.886 8.335 1.328 1.00 0.00 H new ATOM 0 HD2 LYS A 133 13.168 10.437 0.618 1.00 0.00 H new ATOM 0 HD3 LYS A 133 14.799 11.023 0.356 1.00 0.00 H new ATOM 0 HE2 LYS A 133 15.064 9.648 -1.594 1.00 0.00 H new ATOM 0 HE3 LYS A 133 13.562 8.804 -1.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 13.381 10.496 -3.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 12.330 10.791 -1.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 13.752 11.704 -1.878 1.00 0.00 H new ATOM 2145 N LYS A 134 16.472 9.874 4.980 1.00 0.00 N ATOM 2146 CA LYS A 134 17.353 10.494 5.929 1.00 0.00 C ATOM 2147 C LYS A 134 17.902 9.517 6.926 1.00 0.00 C ATOM 2148 O LYS A 134 18.962 9.759 7.508 1.00 0.00 O ATOM 2149 CB LYS A 134 16.705 11.699 6.607 1.00 0.00 C ATOM 2150 CG LYS A 134 15.435 11.437 7.384 1.00 0.00 C ATOM 2151 CD LYS A 134 15.696 11.119 8.842 1.00 0.00 C ATOM 2152 CE LYS A 134 14.397 10.997 9.618 1.00 0.00 C ATOM 2153 NZ LYS A 134 13.598 12.247 9.560 1.00 0.00 N ATOM 0 H LYS A 134 15.493 10.144 5.072 1.00 0.00 H new ATOM 0 HA LYS A 134 18.205 10.867 5.361 1.00 0.00 H new ATOM 0 HB2 LYS A 134 17.434 12.141 7.286 1.00 0.00 H new ATOM 0 HB3 LYS A 134 16.489 12.445 5.842 1.00 0.00 H new ATOM 0 HG2 LYS A 134 14.787 12.311 7.317 1.00 0.00 H new ATOM 0 HG3 LYS A 134 14.898 10.606 6.926 1.00 0.00 H new ATOM 0 HD2 LYS A 134 16.258 10.188 8.919 1.00 0.00 H new ATOM 0 HD3 LYS A 134 16.314 11.901 9.283 1.00 0.00 H new ATOM 0 HE2 LYS A 134 13.810 10.172 9.215 1.00 0.00 H new ATOM 0 HE3 LYS A 134 14.617 10.754 10.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 12.915 12.259 10.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 14.232 13.068 9.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 13.087 12.291 8.655 1.00 0.00 H new ATOM 2167 N GLU A 135 17.200 8.421 7.169 1.00 0.00 N ATOM 2168 CA GLU A 135 17.785 7.444 8.068 1.00 0.00 C ATOM 2169 C GLU A 135 18.677 6.482 7.307 1.00 0.00 C ATOM 2170 O GLU A 135 19.579 5.857 7.871 1.00 0.00 O ATOM 2171 CB GLU A 135 16.755 6.727 8.889 1.00 0.00 C ATOM 2172 CG GLU A 135 15.866 5.794 8.148 1.00 0.00 C ATOM 2173 CD GLU A 135 15.003 4.973 9.084 1.00 0.00 C ATOM 2174 OE1 GLU A 135 15.555 4.207 9.903 1.00 0.00 O ATOM 2175 OE2 GLU A 135 13.770 5.087 9.039 1.00 0.00 O ATOM 0 H GLU A 135 16.283 8.194 6.784 1.00 0.00 H new ATOM 0 HA GLU A 135 18.407 7.988 8.779 1.00 0.00 H new ATOM 0 HB2 GLU A 135 17.268 6.166 9.670 1.00 0.00 H new ATOM 0 HB3 GLU A 135 16.134 7.471 9.387 1.00 0.00 H new ATOM 0 HG2 GLU A 135 15.228 6.361 7.470 1.00 0.00 H new ATOM 0 HG3 GLU A 135 16.471 5.127 7.533 1.00 0.00 H new ATOM 2182 N LYS A 136 18.398 6.389 6.041 1.00 0.00 N ATOM 2183 CA LYS A 136 19.123 5.575 5.062 1.00 0.00 C ATOM 2184 C LYS A 136 18.773 4.143 5.232 1.00 0.00 C ATOM 2185 O LYS A 136 19.583 3.313 5.656 1.00 0.00 O ATOM 2186 CB LYS A 136 20.663 5.781 4.989 1.00 0.00 C ATOM 2187 CG LYS A 136 21.151 7.068 4.302 1.00 0.00 C ATOM 2188 CD LYS A 136 20.862 8.334 5.096 1.00 0.00 C ATOM 2189 CE LYS A 136 21.612 8.384 6.418 1.00 0.00 C ATOM 2190 NZ LYS A 136 23.077 8.441 6.234 1.00 0.00 N ATOM 0 H LYS A 136 17.620 6.899 5.623 1.00 0.00 H new ATOM 0 HA LYS A 136 18.781 5.940 4.093 1.00 0.00 H new ATOM 0 HB2 LYS A 136 21.058 5.766 6.005 1.00 0.00 H new ATOM 0 HB3 LYS A 136 21.097 4.929 4.465 1.00 0.00 H new ATOM 0 HG2 LYS A 136 22.225 6.994 4.132 1.00 0.00 H new ATOM 0 HG3 LYS A 136 20.678 7.148 3.323 1.00 0.00 H new ATOM 0 HD2 LYS A 136 21.133 9.203 4.497 1.00 0.00 H new ATOM 0 HD3 LYS A 136 19.791 8.401 5.288 1.00 0.00 H new ATOM 0 HE2 LYS A 136 21.286 9.256 6.985 1.00 0.00 H new ATOM 0 HE3 LYS A 136 21.357 7.505 7.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 23.535 8.627 7.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 23.415 7.533 5.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 23.314 9.203 5.568 1.00 0.00 H new ATOM 2204 N LEU A 137 17.537 3.874 4.960 1.00 0.00 N ATOM 2205 CA LEU A 137 16.983 2.581 5.108 1.00 0.00 C ATOM 2206 C LEU A 137 17.363 1.624 4.011 1.00 0.00 C ATOM 2207 O LEU A 137 18.088 1.968 3.139 1.00 0.00 O ATOM 2208 CB LEU A 137 15.496 2.702 5.183 1.00 0.00 C ATOM 2209 CG LEU A 137 14.906 2.786 6.575 1.00 0.00 C ATOM 2210 CD1 LEU A 137 13.460 2.988 6.527 1.00 0.00 C ATOM 2211 CD2 LEU A 137 15.184 1.569 7.386 1.00 0.00 C ATOM 0 H LEU A 137 16.874 4.570 4.620 1.00 0.00 H new ATOM 0 HA LEU A 137 17.394 2.160 6.026 1.00 0.00 H new ATOM 0 HB2 LEU A 137 15.195 3.591 4.628 1.00 0.00 H new ATOM 0 HB3 LEU A 137 15.055 1.845 4.674 1.00 0.00 H new ATOM 0 HG LEU A 137 15.387 3.641 7.049 1.00 0.00 H new ATOM 0 HD11 LEU A 137 13.067 3.044 7.542 1.00 0.00 H new ATOM 0 HD12 LEU A 137 13.240 3.917 6.001 1.00 0.00 H new ATOM 0 HD13 LEU A 137 12.993 2.154 6.003 1.00 0.00 H new ATOM 0 HD21 LEU A 137 14.739 1.681 8.375 1.00 0.00 H new ATOM 0 HD22 LEU A 137 14.755 0.697 6.892 1.00 0.00 H new ATOM 0 HD23 LEU A 137 16.261 1.437 7.486 1.00 0.00 H new ATOM 2223 N ASN A 138 16.840 0.420 4.130 1.00 0.00 N ATOM 2224 CA ASN A 138 16.926 -0.704 3.171 1.00 0.00 C ATOM 2225 C ASN A 138 17.199 -0.261 1.731 1.00 0.00 C ATOM 2226 O ASN A 138 18.306 -0.418 1.229 1.00 0.00 O ATOM 2227 CB ASN A 138 15.596 -1.471 3.215 1.00 0.00 C ATOM 2228 CG ASN A 138 15.354 -2.206 4.513 1.00 0.00 C ATOM 2229 OD1 ASN A 138 16.265 -2.757 5.106 1.00 0.00 O ATOM 2230 ND2 ASN A 138 14.152 -2.124 5.017 1.00 0.00 N ATOM 0 H ASN A 138 16.299 0.165 4.957 1.00 0.00 H new ATOM 0 HA ASN A 138 17.770 -1.326 3.470 1.00 0.00 H new ATOM 0 HB2 ASN A 138 14.778 -0.770 3.048 1.00 0.00 H new ATOM 0 HB3 ASN A 138 15.574 -2.188 2.394 1.00 0.00 H new ATOM 0 HD21 ASN A 138 13.954 -2.528 5.932 1.00 0.00 H new ATOM 0 HD22 ASN A 138 13.411 -1.656 4.495 1.00 0.00 H new ATOM 2237 N ILE A 139 16.203 0.321 1.084 1.00 0.00 N ATOM 2238 CA ILE A 139 16.371 0.782 -0.297 1.00 0.00 C ATOM 2239 C ILE A 139 17.153 2.089 -0.380 1.00 0.00 C ATOM 2240 O ILE A 139 17.738 2.407 -1.390 1.00 0.00 O ATOM 2241 CB ILE A 139 15.027 0.959 -1.030 1.00 0.00 C ATOM 2242 CG1 ILE A 139 14.126 1.958 -0.321 1.00 0.00 C ATOM 2243 CG2 ILE A 139 14.317 -0.370 -1.191 1.00 0.00 C ATOM 2244 CD1 ILE A 139 12.839 2.220 -1.061 1.00 0.00 C ATOM 0 H ILE A 139 15.278 0.487 1.481 1.00 0.00 H new ATOM 0 HA ILE A 139 16.939 -0.006 -0.791 1.00 0.00 H new ATOM 0 HB ILE A 139 15.251 1.356 -2.020 1.00 0.00 H new ATOM 0 HG12 ILE A 139 13.895 1.586 0.677 1.00 0.00 H new ATOM 0 HG13 ILE A 139 14.664 2.898 -0.195 1.00 0.00 H new ATOM 0 HG21 ILE A 139 13.371 -0.217 -1.711 1.00 0.00 H new ATOM 0 HG22 ILE A 139 14.943 -1.049 -1.769 1.00 0.00 H new ATOM 0 HG23 ILE A 139 14.125 -0.801 -0.209 1.00 0.00 H new ATOM 0 HD11 ILE A 139 12.240 2.941 -0.505 1.00 0.00 H new ATOM 0 HD12 ILE A 139 13.063 2.620 -2.050 1.00 0.00 H new ATOM 0 HD13 ILE A 139 12.283 1.288 -1.164 1.00 0.00 H new ATOM 2256 N TRP A 140 17.188 2.803 0.691 1.00 0.00 N ATOM 2257 CA TRP A 140 17.801 4.118 0.749 1.00 0.00 C ATOM 2258 C TRP A 140 19.272 4.047 1.063 1.00 0.00 C ATOM 2259 O TRP A 140 19.968 5.057 1.168 1.00 0.00 O ATOM 2260 CB TRP A 140 17.011 4.941 1.734 1.00 0.00 C ATOM 2261 CG TRP A 140 15.653 5.148 1.228 1.00 0.00 C ATOM 2262 CD1 TRP A 140 14.542 4.873 1.880 1.00 0.00 C ATOM 2263 CD2 TRP A 140 15.260 5.596 -0.086 1.00 0.00 C ATOM 2264 NE1 TRP A 140 13.456 5.082 1.083 1.00 0.00 N ATOM 2265 CE2 TRP A 140 13.873 5.543 -0.129 1.00 0.00 C ATOM 2266 CE3 TRP A 140 15.950 6.032 -1.219 1.00 0.00 C ATOM 2267 CZ2 TRP A 140 13.146 5.902 -1.258 1.00 0.00 C ATOM 2268 CZ3 TRP A 140 15.234 6.394 -2.338 1.00 0.00 C ATOM 2269 CH2 TRP A 140 13.843 6.325 -2.350 1.00 0.00 C ATOM 0 H TRP A 140 16.788 2.498 1.578 1.00 0.00 H new ATOM 0 HA TRP A 140 17.765 4.601 -0.227 1.00 0.00 H new ATOM 0 HB2 TRP A 140 16.977 4.436 2.699 1.00 0.00 H new ATOM 0 HB3 TRP A 140 17.500 5.902 1.894 1.00 0.00 H new ATOM 0 HD1 TRP A 140 14.498 4.530 2.903 1.00 0.00 H new ATOM 0 HE1 TRP A 140 12.486 4.919 1.352 1.00 0.00 H new ATOM 0 HE3 TRP A 140 17.029 6.084 -1.218 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 12.067 5.848 -1.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 15.758 6.736 -3.218 1.00 0.00 H new ATOM 0 HH2 TRP A 140 13.306 6.612 -3.242 1.00 0.00 H new ATOM 2280 N SER A 141 19.726 2.854 1.169 1.00 0.00 N ATOM 2281 CA SER A 141 21.086 2.559 1.395 1.00 0.00 C ATOM 2282 C SER A 141 21.727 2.255 0.039 1.00 0.00 C ATOM 2283 O SER A 141 22.954 2.240 -0.108 1.00 0.00 O ATOM 2284 CB SER A 141 21.150 1.337 2.333 1.00 0.00 C ATOM 2285 OG SER A 141 22.476 1.006 2.717 1.00 0.00 O ATOM 0 H SER A 141 19.135 2.026 1.098 1.00 0.00 H new ATOM 0 HA SER A 141 21.620 3.388 1.859 1.00 0.00 H new ATOM 0 HB2 SER A 141 20.558 1.539 3.226 1.00 0.00 H new ATOM 0 HB3 SER A 141 20.696 0.480 1.836 1.00 0.00 H new ATOM 0 HG SER A 141 22.460 0.227 3.311 1.00 0.00 H new ATOM 2291 N GLU A 142 20.872 2.074 -0.954 1.00 0.00 N ATOM 2292 CA GLU A 142 21.251 1.657 -2.241 1.00 0.00 C ATOM 2293 C GLU A 142 21.395 2.804 -3.236 1.00 0.00 C ATOM 2294 O GLU A 142 21.253 3.994 -2.892 1.00 0.00 O ATOM 2295 CB GLU A 142 20.218 0.666 -2.725 1.00 0.00 C ATOM 2296 CG GLU A 142 20.180 -0.621 -1.927 1.00 0.00 C ATOM 2297 CD GLU A 142 21.553 -1.225 -1.772 1.00 0.00 C ATOM 2298 OE1 GLU A 142 22.126 -1.718 -2.774 1.00 0.00 O ATOM 2299 OE2 GLU A 142 22.103 -1.184 -0.662 1.00 0.00 O ATOM 0 H GLU A 142 19.868 2.225 -0.856 1.00 0.00 H new ATOM 0 HA GLU A 142 22.240 1.204 -2.176 1.00 0.00 H new ATOM 0 HB2 GLU A 142 19.234 1.134 -2.688 1.00 0.00 H new ATOM 0 HB3 GLU A 142 20.418 0.428 -3.770 1.00 0.00 H new ATOM 0 HG2 GLU A 142 19.756 -0.426 -0.942 1.00 0.00 H new ATOM 0 HG3 GLU A 142 19.522 -1.336 -2.421 1.00 0.00 H new ATOM 2306 N ASP A 143 21.657 2.415 -4.473 1.00 0.00 N ATOM 2307 CA ASP A 143 21.864 3.311 -5.587 1.00 0.00 C ATOM 2308 C ASP A 143 20.581 3.375 -6.345 1.00 0.00 C ATOM 2309 O ASP A 143 20.229 2.429 -7.049 1.00 0.00 O ATOM 2310 CB ASP A 143 22.951 2.742 -6.511 1.00 0.00 C ATOM 2311 CG ASP A 143 23.283 3.629 -7.701 1.00 0.00 C ATOM 2312 OD1 ASP A 143 22.513 3.660 -8.694 1.00 0.00 O ATOM 2313 OD2 ASP A 143 24.358 4.261 -7.686 1.00 0.00 O ATOM 0 H ASP A 143 21.733 1.432 -4.733 1.00 0.00 H new ATOM 0 HA ASP A 143 22.171 4.296 -5.235 1.00 0.00 H new ATOM 0 HB2 ASP A 143 23.858 2.579 -5.929 1.00 0.00 H new ATOM 0 HB3 ASP A 143 22.628 1.768 -6.877 1.00 0.00 H new ATOM 2318 N ASN A 144 19.835 4.405 -6.139 1.00 0.00 N ATOM 2319 CA ASN A 144 18.579 4.531 -6.809 1.00 0.00 C ATOM 2320 C ASN A 144 18.077 5.954 -6.946 1.00 0.00 C ATOM 2321 O ASN A 144 17.184 6.210 -7.761 1.00 0.00 O ATOM 2322 CB ASN A 144 17.510 3.662 -6.144 1.00 0.00 C ATOM 2323 CG ASN A 144 17.403 3.838 -4.639 1.00 0.00 C ATOM 2324 OD1 ASN A 144 17.641 4.907 -4.086 1.00 0.00 O ATOM 2325 ND2 ASN A 144 17.062 2.779 -3.969 1.00 0.00 N ATOM 0 H ASN A 144 20.069 5.175 -5.512 1.00 0.00 H new ATOM 0 HA ASN A 144 18.768 4.178 -7.823 1.00 0.00 H new ATOM 0 HB2 ASN A 144 16.543 3.889 -6.593 1.00 0.00 H new ATOM 0 HB3 ASN A 144 17.724 2.615 -6.361 1.00 0.00 H new ATOM 0 HD21 ASN A 144 16.985 2.821 -2.953 1.00 0.00 H new ATOM 0 HD22 ASN A 144 16.871 1.905 -4.459 1.00 0.00 H new ATOM 2332 N ALA A 145 18.618 6.888 -6.200 1.00 0.00 N ATOM 2333 CA ALA A 145 18.076 8.225 -6.249 1.00 0.00 C ATOM 2334 C ALA A 145 19.123 9.300 -6.407 1.00 0.00 C ATOM 2335 O ALA A 145 19.462 9.674 -7.522 1.00 0.00 O ATOM 2336 CB ALA A 145 17.154 8.499 -5.053 1.00 0.00 C ATOM 0 H ALA A 145 19.409 6.755 -5.570 1.00 0.00 H new ATOM 0 HA ALA A 145 17.475 8.270 -7.157 1.00 0.00 H new ATOM 0 HB1 ALA A 145 16.763 9.514 -5.120 1.00 0.00 H new ATOM 0 HB2 ALA A 145 16.326 7.790 -5.062 1.00 0.00 H new ATOM 0 HB3 ALA A 145 17.717 8.388 -4.126 1.00 0.00 H new ATOM 2342 N ASP A 146 19.646 9.763 -5.289 1.00 0.00 N ATOM 2343 CA ASP A 146 20.587 10.900 -5.221 1.00 0.00 C ATOM 2344 C ASP A 146 19.932 12.147 -5.776 1.00 0.00 C ATOM 2345 O ASP A 146 20.534 13.007 -6.406 1.00 0.00 O ATOM 2346 CB ASP A 146 21.927 10.590 -5.873 1.00 0.00 C ATOM 2347 CG ASP A 146 22.991 11.582 -5.441 1.00 0.00 C ATOM 2348 OD1 ASP A 146 23.187 11.758 -4.209 1.00 0.00 O ATOM 2349 OD2 ASP A 146 23.619 12.226 -6.295 1.00 0.00 O ATOM 0 H ASP A 146 19.434 9.362 -4.375 1.00 0.00 H new ATOM 0 HA ASP A 146 20.823 11.086 -4.173 1.00 0.00 H new ATOM 0 HB2 ASP A 146 22.239 9.580 -5.607 1.00 0.00 H new ATOM 0 HB3 ASP A 146 21.821 10.616 -6.958 1.00 0.00 H new ATOM 2354 N SER A 147 18.687 12.235 -5.474 1.00 0.00 N ATOM 2355 CA SER A 147 17.847 13.294 -5.886 1.00 0.00 C ATOM 2356 C SER A 147 16.856 13.511 -4.762 1.00 0.00 C ATOM 2357 O SER A 147 15.698 13.879 -4.955 1.00 0.00 O ATOM 2358 CB SER A 147 17.195 12.821 -7.168 1.00 0.00 C ATOM 2359 OG SER A 147 16.525 11.556 -6.991 1.00 0.00 O ATOM 0 H SER A 147 18.207 11.537 -4.906 1.00 0.00 H new ATOM 0 HA SER A 147 18.353 14.240 -6.079 1.00 0.00 H new ATOM 0 HB2 SER A 147 16.478 13.568 -7.509 1.00 0.00 H new ATOM 0 HB3 SER A 147 17.951 12.726 -7.947 1.00 0.00 H new ATOM 0 HG SER A 147 16.114 11.282 -7.838 1.00 0.00 H new ATOM 2365 N GLY A 148 17.380 13.353 -3.577 1.00 0.00 N ATOM 2366 CA GLY A 148 16.592 13.294 -2.400 1.00 0.00 C ATOM 2367 C GLY A 148 16.730 11.949 -1.853 1.00 0.00 C ATOM 2368 O GLY A 148 16.329 10.989 -2.487 1.00 0.00 O ATOM 0 H GLY A 148 18.382 13.261 -3.411 1.00 0.00 H new ATOM 0 HA2 GLY A 148 16.925 14.039 -1.677 1.00 0.00 H new ATOM 0 HA3 GLY A 148 15.548 13.512 -2.625 1.00 0.00 H new ATOM 2372 N GLN A 149 17.365 11.891 -0.734 1.00 0.00 N ATOM 2373 CA GLN A 149 17.650 10.731 0.058 1.00 0.00 C ATOM 2374 C GLN A 149 18.057 11.321 1.398 1.00 0.00 C ATOM 2375 O GLN A 149 17.210 11.988 2.017 1.00 0.00 O ATOM 2376 CB GLN A 149 18.811 9.824 -0.489 1.00 0.00 C ATOM 2377 CG GLN A 149 18.713 9.435 -1.940 1.00 0.00 C ATOM 2378 CD GLN A 149 19.559 8.259 -2.309 1.00 0.00 C ATOM 2379 OE1 GLN A 149 20.721 8.394 -2.677 1.00 0.00 O ATOM 2380 NE2 GLN A 149 18.958 7.115 -2.291 1.00 0.00 N ATOM 2381 OXT GLN A 149 19.225 11.220 1.781 1.00 0.00 O ATOM 0 H GLN A 149 17.737 12.737 -0.302 1.00 0.00 H new ATOM 0 HA GLN A 149 16.786 10.067 0.078 1.00 0.00 H new ATOM 0 HB2 GLN A 149 19.756 10.345 -0.335 1.00 0.00 H new ATOM 0 HB3 GLN A 149 18.848 8.914 0.110 1.00 0.00 H new ATOM 0 HG2 GLN A 149 17.673 9.211 -2.177 1.00 0.00 H new ATOM 0 HG3 GLN A 149 19.003 10.287 -2.555 1.00 0.00 H new ATOM 0 HE21 GLN A 149 17.990 7.052 -1.976 1.00 0.00 H new ATOM 0 HE22 GLN A 149 19.452 6.275 -2.591 1.00 0.00 H new TER 2390 GLN A 149