USER MOD reduce.3.24.130724 H: found=0, std=0, add=1067, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1064 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 32 SER OG : rot 170:sc= 0.215 USER MOD Set 1.2: A 40 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 42 GLN : amide:sc= -0.254 K(o=0.19,f=1.2) USER MOD Set 1.4: A 126 ASN : amide:sc= 0.225 K(o=0.19,f=1.5) USER MOD Single : A 0 GLY N :NH3+ 137:sc= 0.141 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -13:sc= 1.21 USER MOD Single : A 10 THR OG1 : rot -53:sc= 1.44 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00222) USER MOD Single : A 28 CYS SG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=-0.097) USER MOD Single : A 48 HIS : no HE2:sc=-0.00209 X(o=-0.0021,f=-0.3) USER MOD Single : A 53 GLN : amide:sc= 0.343 K(o=0.34,f=-4.8!) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= -0.0563 USER MOD Single : A 69 THR OG1 : rot 120:sc= 0.66 USER MOD Single : A 70 LYS NZ :NH3+ -156:sc= -0.0477 (180deg=-0.387) USER MOD Single : A 72 HIS : no HE2:sc= -0.0786 K(o=-0.079,f=-4!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.0227 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 MET CE :methyl 151:sc= -0.0348 (180deg=-0.557) USER MOD Single : A 95 MET CE :methyl -177:sc= -0.146 (180deg=-0.15) USER MOD Single : A 99 ASN : amide:sc= -0.458 X(o=-0.46,f=-0.028) USER MOD Single : A 102 ASN : amide:sc= -0.206 X(o=-0.21,f=0) USER MOD Single : A 104 LYS NZ :NH3+ -159:sc= 1.17 (180deg=0.87) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 143:sc= 0.567 (180deg=0.0652) USER MOD Single : A 114 GLN : amide:sc= -0.349 X(o=-0.35,f=-0.1) USER MOD Single : A 115 ASN : amide:sc= -0.781 K(o=-0.78,f=0) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 163:sc= 1.24 (180deg=1.06) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 8 N GLY A 0 0.796 1.971 -2.457 1.00 0.00 N ATOM 9 CA GLY A 0 0.106 2.784 -3.456 1.00 0.00 C ATOM 10 C GLY A 0 -0.197 4.156 -2.843 1.00 0.00 C ATOM 11 O GLY A 0 -0.173 4.312 -1.620 1.00 0.00 O ATOM 0 H1 GLY A 0 0.407 1.006 -2.466 1.00 0.00 H new ATOM 0 H2 GLY A 0 1.812 1.937 -2.678 1.00 0.00 H new ATOM 0 H3 GLY A 0 0.661 2.390 -1.515 1.00 0.00 H new ATOM 0 HA2 GLY A 0 0.725 2.895 -4.346 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -0.818 2.297 -3.769 1.00 0.00 H new ATOM 15 N ALA A 1 -0.450 5.157 -3.680 1.00 0.00 N ATOM 16 CA ALA A 1 -0.507 6.549 -3.250 1.00 0.00 C ATOM 17 C ALA A 1 -1.356 7.432 -4.190 1.00 0.00 C ATOM 18 O ALA A 1 -1.844 6.984 -5.232 1.00 0.00 O ATOM 19 CB ALA A 1 0.944 7.004 -3.132 1.00 0.00 C ATOM 0 H ALA A 1 -0.621 5.025 -4.677 1.00 0.00 H new ATOM 0 HA ALA A 1 -1.018 6.647 -2.292 1.00 0.00 H new ATOM 0 HB1 ALA A 1 0.974 8.045 -2.811 1.00 0.00 H new ATOM 0 HB2 ALA A 1 1.461 6.384 -2.400 1.00 0.00 H new ATOM 0 HB3 ALA A 1 1.435 6.908 -4.100 1.00 0.00 H new ATOM 25 N LEU A 2 -1.539 8.693 -3.797 1.00 0.00 N ATOM 26 CA LEU A 2 -2.430 9.670 -4.429 1.00 0.00 C ATOM 27 C LEU A 2 -1.624 10.891 -4.893 1.00 0.00 C ATOM 28 O LEU A 2 -0.620 11.245 -4.266 1.00 0.00 O ATOM 29 CB LEU A 2 -3.507 10.086 -3.408 1.00 0.00 C ATOM 30 CG LEU A 2 -4.294 8.930 -2.764 1.00 0.00 C ATOM 31 CD1 LEU A 2 -5.231 9.448 -1.680 1.00 0.00 C ATOM 32 CD2 LEU A 2 -5.122 8.145 -3.779 1.00 0.00 C ATOM 0 H LEU A 2 -1.047 9.080 -2.992 1.00 0.00 H new ATOM 0 HA LEU A 2 -2.910 9.230 -5.303 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -3.028 10.662 -2.616 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.214 10.752 -3.903 1.00 0.00 H new ATOM 0 HG LEU A 2 -3.547 8.263 -2.334 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -5.776 8.613 -1.240 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -4.650 9.950 -0.906 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -5.939 10.153 -2.117 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -5.656 7.342 -3.270 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -5.839 8.812 -4.257 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -4.462 7.719 -4.535 1.00 0.00 H new ATOM 44 N SER A 3 -2.026 11.525 -5.997 1.00 0.00 N ATOM 45 CA SER A 3 -1.301 12.687 -6.545 1.00 0.00 C ATOM 46 C SER A 3 -1.373 13.910 -5.620 1.00 0.00 C ATOM 47 O SER A 3 -2.257 14.001 -4.769 1.00 0.00 O ATOM 48 CB SER A 3 -1.830 13.013 -7.945 1.00 0.00 C ATOM 49 OG SER A 3 -0.978 13.948 -8.587 1.00 0.00 O ATOM 0 H SER A 3 -2.851 11.257 -6.534 1.00 0.00 H new ATOM 0 HA SER A 3 -0.246 12.422 -6.617 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.894 12.101 -8.539 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.839 13.419 -7.875 1.00 0.00 H new ATOM 0 HG SER A 3 -1.326 14.147 -9.481 1.00 0.00 H new ATOM 55 N TYR A 4 -0.466 14.880 -5.795 1.00 0.00 N ATOM 56 CA TYR A 4 -0.438 16.120 -5.003 1.00 0.00 C ATOM 57 C TYR A 4 -1.808 16.813 -4.971 1.00 0.00 C ATOM 58 O TYR A 4 -2.282 17.215 -3.910 1.00 0.00 O ATOM 59 CB TYR A 4 0.616 17.081 -5.573 1.00 0.00 C ATOM 60 CG TYR A 4 0.716 18.395 -4.815 1.00 0.00 C ATOM 61 CD1 TYR A 4 -0.129 19.470 -5.153 1.00 0.00 C ATOM 62 CD2 TYR A 4 1.627 18.531 -3.749 1.00 0.00 C ATOM 63 CE1 TYR A 4 -0.092 20.666 -4.410 1.00 0.00 C ATOM 64 CE2 TYR A 4 1.667 19.724 -3.001 1.00 0.00 C ATOM 65 CZ TYR A 4 0.804 20.793 -3.326 1.00 0.00 C ATOM 66 OH TYR A 4 0.846 21.945 -2.604 1.00 0.00 O ATOM 0 H TYR A 4 0.275 14.827 -6.494 1.00 0.00 H new ATOM 0 HA TYR A 4 -0.179 15.850 -3.979 1.00 0.00 H new ATOM 0 HB2 TYR A 4 1.589 16.589 -5.560 1.00 0.00 H new ATOM 0 HB3 TYR A 4 0.378 17.290 -6.616 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -0.809 19.377 -5.987 1.00 0.00 H new ATOM 0 HD2 TYR A 4 2.296 17.719 -3.505 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -0.748 21.484 -4.669 1.00 0.00 H new ATOM 0 HE2 TYR A 4 2.359 19.821 -2.178 1.00 0.00 H new ATOM 0 HH TYR A 4 1.517 21.862 -1.895 1.00 0.00 H new ATOM 76 N GLU A 5 -2.463 16.901 -6.134 1.00 0.00 N ATOM 77 CA GLU A 5 -3.776 17.537 -6.312 1.00 0.00 C ATOM 78 C GLU A 5 -4.914 16.891 -5.509 1.00 0.00 C ATOM 79 O GLU A 5 -5.982 17.493 -5.381 1.00 0.00 O ATOM 80 CB GLU A 5 -4.132 17.578 -7.809 1.00 0.00 C ATOM 81 CG GLU A 5 -4.437 16.217 -8.459 1.00 0.00 C ATOM 82 CD GLU A 5 -5.867 15.695 -8.198 1.00 0.00 C ATOM 83 OE1 GLU A 5 -6.837 16.321 -8.690 1.00 0.00 O ATOM 84 OE2 GLU A 5 -6.015 14.631 -7.547 1.00 0.00 O ATOM 0 H GLU A 5 -2.085 16.522 -7.002 1.00 0.00 H new ATOM 0 HA GLU A 5 -3.679 18.546 -5.911 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -4.999 18.225 -7.940 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -3.305 18.040 -8.348 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -4.283 16.299 -9.535 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -3.721 15.482 -8.090 1.00 0.00 H new ATOM 91 N THR A 6 -4.719 15.668 -5.002 1.00 0.00 N ATOM 92 CA THR A 6 -5.760 14.900 -4.315 1.00 0.00 C ATOM 93 C THR A 6 -6.017 15.486 -2.928 1.00 0.00 C ATOM 94 O THR A 6 -5.258 15.262 -1.983 1.00 0.00 O ATOM 95 CB THR A 6 -5.414 13.407 -4.258 1.00 0.00 C ATOM 96 OG1 THR A 6 -5.324 12.887 -5.572 1.00 0.00 O ATOM 97 CG2 THR A 6 -6.481 12.597 -3.517 1.00 0.00 C ATOM 0 H THR A 6 -3.825 15.180 -5.059 1.00 0.00 H new ATOM 0 HA THR A 6 -6.684 14.979 -4.888 1.00 0.00 H new ATOM 0 HB THR A 6 -4.466 13.322 -3.727 1.00 0.00 H new ATOM 0 HG1 THR A 6 -5.695 13.535 -6.206 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.194 11.546 -3.501 1.00 0.00 H new ATOM 0 HG22 THR A 6 -6.571 12.964 -2.495 1.00 0.00 H new ATOM 0 HG23 THR A 6 -7.438 12.704 -4.027 1.00 0.00 H new ATOM 105 N GLU A 7 -7.071 16.300 -2.819 1.00 0.00 N ATOM 106 CA GLU A 7 -7.434 16.960 -1.566 1.00 0.00 C ATOM 107 C GLU A 7 -8.061 15.958 -0.585 1.00 0.00 C ATOM 108 O GLU A 7 -8.969 15.196 -0.934 1.00 0.00 O ATOM 109 CB GLU A 7 -8.376 18.161 -1.782 1.00 0.00 C ATOM 110 CG GLU A 7 -7.934 19.100 -2.914 1.00 0.00 C ATOM 111 CD GLU A 7 -8.738 20.415 -2.904 1.00 0.00 C ATOM 112 OE1 GLU A 7 -9.807 20.487 -3.559 1.00 0.00 O ATOM 113 OE2 GLU A 7 -8.298 21.395 -2.256 1.00 0.00 O ATOM 0 H GLU A 7 -7.694 16.518 -3.596 1.00 0.00 H new ATOM 0 HA GLU A 7 -6.511 17.349 -1.137 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -9.378 17.790 -2.000 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.442 18.731 -0.855 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.872 19.321 -2.811 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -8.064 18.600 -3.874 1.00 0.00 H new ATOM 120 N ILE A 8 -7.596 15.999 0.662 1.00 0.00 N ATOM 121 CA ILE A 8 -8.091 15.194 1.780 1.00 0.00 C ATOM 122 C ILE A 8 -8.840 16.136 2.718 1.00 0.00 C ATOM 123 O ILE A 8 -8.301 17.167 3.127 1.00 0.00 O ATOM 124 CB ILE A 8 -6.915 14.506 2.516 1.00 0.00 C ATOM 125 CG1 ILE A 8 -5.980 13.726 1.567 1.00 0.00 C ATOM 126 CG2 ILE A 8 -7.407 13.581 3.642 1.00 0.00 C ATOM 127 CD1 ILE A 8 -6.659 12.690 0.661 1.00 0.00 C ATOM 0 H ILE A 8 -6.833 16.619 0.934 1.00 0.00 H new ATOM 0 HA ILE A 8 -8.753 14.405 1.424 1.00 0.00 H new ATOM 0 HB ILE A 8 -6.335 15.318 2.955 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.454 14.443 0.936 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -5.227 13.217 2.168 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.551 13.118 4.133 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -7.972 14.163 4.370 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.047 12.805 3.222 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -5.908 12.204 0.038 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.161 11.942 1.275 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.391 13.187 0.025 1.00 0.00 H new ATOM 139 N LEU A 9 -10.088 15.801 3.048 1.00 0.00 N ATOM 140 CA LEU A 9 -10.843 16.505 4.082 1.00 0.00 C ATOM 141 C LEU A 9 -10.209 16.251 5.465 1.00 0.00 C ATOM 142 O LEU A 9 -10.103 15.104 5.906 1.00 0.00 O ATOM 143 CB LEU A 9 -12.315 16.052 4.030 1.00 0.00 C ATOM 144 CG LEU A 9 -13.242 16.918 4.903 1.00 0.00 C ATOM 145 CD1 LEU A 9 -13.513 18.287 4.279 1.00 0.00 C ATOM 146 CD2 LEU A 9 -14.583 16.212 5.103 1.00 0.00 C ATOM 0 H LEU A 9 -10.601 15.037 2.608 1.00 0.00 H new ATOM 0 HA LEU A 9 -10.812 17.580 3.905 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -12.663 16.084 2.998 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -12.382 15.014 4.357 1.00 0.00 H new ATOM 0 HG LEU A 9 -12.732 17.063 5.855 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -14.171 18.860 4.932 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -12.572 18.822 4.152 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -13.989 18.156 3.307 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -15.232 16.832 5.722 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -15.055 16.046 4.135 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -14.420 15.254 5.596 1.00 0.00 H new ATOM 158 N THR A 10 -9.823 17.322 6.160 1.00 0.00 N ATOM 159 CA THR A 10 -9.187 17.277 7.488 1.00 0.00 C ATOM 160 C THR A 10 -9.961 18.097 8.521 1.00 0.00 C ATOM 161 O THR A 10 -10.620 19.083 8.186 1.00 0.00 O ATOM 162 CB THR A 10 -7.715 17.736 7.449 1.00 0.00 C ATOM 163 OG1 THR A 10 -7.606 19.081 7.040 1.00 0.00 O ATOM 164 CG2 THR A 10 -6.839 16.888 6.525 1.00 0.00 C ATOM 0 H THR A 10 -9.945 18.272 5.810 1.00 0.00 H new ATOM 0 HA THR A 10 -9.207 16.231 7.792 1.00 0.00 H new ATOM 0 HB THR A 10 -7.357 17.616 8.471 1.00 0.00 H new ATOM 0 HG1 THR A 10 -8.090 19.207 6.197 1.00 0.00 H new ATOM 0 HG21 THR A 10 -5.817 17.266 6.545 1.00 0.00 H new ATOM 0 HG22 THR A 10 -6.850 15.852 6.863 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.225 16.941 5.507 1.00 0.00 H new ATOM 172 N VAL A 11 -9.885 17.697 9.796 1.00 0.00 N ATOM 173 CA VAL A 11 -10.548 18.422 10.906 1.00 0.00 C ATOM 174 C VAL A 11 -9.773 19.681 11.314 1.00 0.00 C ATOM 175 O VAL A 11 -10.370 20.691 11.687 1.00 0.00 O ATOM 176 CB VAL A 11 -10.748 17.518 12.143 1.00 0.00 C ATOM 177 CG1 VAL A 11 -11.630 18.173 13.215 1.00 0.00 C ATOM 178 CG2 VAL A 11 -11.402 16.177 11.793 1.00 0.00 C ATOM 0 H VAL A 11 -9.369 16.869 10.094 1.00 0.00 H new ATOM 0 HA VAL A 11 -11.525 18.723 10.529 1.00 0.00 H new ATOM 0 HB VAL A 11 -9.740 17.360 12.525 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.738 17.495 14.062 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.167 19.101 13.550 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -12.613 18.389 12.796 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.519 15.582 12.699 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.381 16.355 11.347 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.772 15.639 11.084 1.00 0.00 H new ATOM 188 N GLU A 12 -8.441 19.636 11.219 1.00 0.00 N ATOM 189 CA GLU A 12 -7.561 20.755 11.591 1.00 0.00 C ATOM 190 C GLU A 12 -7.714 21.993 10.690 1.00 0.00 C ATOM 191 O GLU A 12 -7.494 23.114 11.159 1.00 0.00 O ATOM 192 CB GLU A 12 -6.100 20.279 11.572 1.00 0.00 C ATOM 193 CG GLU A 12 -5.661 19.644 12.898 1.00 0.00 C ATOM 194 CD GLU A 12 -5.656 20.657 14.062 1.00 0.00 C ATOM 195 OE1 GLU A 12 -4.785 21.560 14.091 1.00 0.00 O ATOM 196 OE2 GLU A 12 -6.524 20.554 14.963 1.00 0.00 O ATOM 0 H GLU A 12 -7.936 18.817 10.880 1.00 0.00 H new ATOM 0 HA GLU A 12 -7.859 21.068 12.592 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -5.970 19.555 10.768 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -5.450 21.125 11.348 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -6.330 18.818 13.141 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.663 19.222 12.783 1.00 0.00 H new ATOM 203 N TYR A 13 -8.119 21.809 9.425 1.00 0.00 N ATOM 204 CA TYR A 13 -8.261 22.898 8.449 1.00 0.00 C ATOM 205 C TYR A 13 -9.435 22.716 7.475 1.00 0.00 C ATOM 206 O TYR A 13 -10.247 23.634 7.322 1.00 0.00 O ATOM 207 CB TYR A 13 -6.958 23.025 7.641 1.00 0.00 C ATOM 208 CG TYR A 13 -5.803 23.681 8.376 1.00 0.00 C ATOM 209 CD1 TYR A 13 -5.912 25.028 8.779 1.00 0.00 C ATOM 210 CD2 TYR A 13 -4.614 22.966 8.634 1.00 0.00 C ATOM 211 CE1 TYR A 13 -4.848 25.657 9.454 1.00 0.00 C ATOM 212 CE2 TYR A 13 -3.544 23.594 9.304 1.00 0.00 C ATOM 213 CZ TYR A 13 -3.661 24.939 9.719 1.00 0.00 C ATOM 214 OH TYR A 13 -2.626 25.542 10.366 1.00 0.00 O ATOM 0 H TYR A 13 -8.359 20.892 9.048 1.00 0.00 H new ATOM 0 HA TYR A 13 -8.469 23.800 9.024 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -6.647 22.029 7.324 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -7.164 23.598 6.737 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -6.816 25.580 8.569 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -4.524 21.937 8.318 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -4.940 26.686 9.768 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.634 23.046 9.500 1.00 0.00 H new ATOM 0 HH TYR A 13 -1.888 24.905 10.468 1.00 0.00 H new ATOM 224 N GLY A 14 -9.520 21.566 6.797 1.00 0.00 N ATOM 225 CA GLY A 14 -10.467 21.332 5.704 1.00 0.00 C ATOM 226 C GLY A 14 -9.836 20.554 4.549 1.00 0.00 C ATOM 227 O GLY A 14 -8.943 19.732 4.755 1.00 0.00 O ATOM 0 H GLY A 14 -8.925 20.762 6.996 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -11.328 20.781 6.083 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -10.838 22.289 5.336 1.00 0.00 H new ATOM 231 N LEU A 15 -10.322 20.802 3.334 1.00 0.00 N ATOM 232 CA LEU A 15 -9.811 20.232 2.084 1.00 0.00 C ATOM 233 C LEU A 15 -8.402 20.773 1.767 1.00 0.00 C ATOM 234 O LEU A 15 -8.255 21.940 1.394 1.00 0.00 O ATOM 235 CB LEU A 15 -10.792 20.593 0.949 1.00 0.00 C ATOM 236 CG LEU A 15 -12.188 19.958 1.072 1.00 0.00 C ATOM 237 CD1 LEU A 15 -13.127 20.540 0.018 1.00 0.00 C ATOM 238 CD2 LEU A 15 -12.117 18.447 0.864 1.00 0.00 C ATOM 0 H LEU A 15 -11.113 21.429 3.185 1.00 0.00 H new ATOM 0 HA LEU A 15 -9.732 19.149 2.182 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -10.904 21.677 0.916 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.353 20.289 -0.001 1.00 0.00 H new ATOM 0 HG LEU A 15 -12.562 20.174 2.073 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -14.112 20.083 0.115 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -13.212 21.617 0.161 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -12.729 20.336 -0.976 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -13.116 18.020 0.956 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -11.721 18.235 -0.129 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -11.463 18.006 1.617 1.00 0.00 H new ATOM 250 N LEU A 16 -7.370 19.931 1.906 1.00 0.00 N ATOM 251 CA LEU A 16 -5.972 20.267 1.590 1.00 0.00 C ATOM 252 C LEU A 16 -5.250 19.160 0.793 1.00 0.00 C ATOM 253 O LEU A 16 -5.552 17.979 0.986 1.00 0.00 O ATOM 254 CB LEU A 16 -5.223 20.537 2.906 1.00 0.00 C ATOM 255 CG LEU A 16 -5.501 21.926 3.504 1.00 0.00 C ATOM 256 CD1 LEU A 16 -4.984 21.956 4.936 1.00 0.00 C ATOM 257 CD2 LEU A 16 -4.807 23.039 2.716 1.00 0.00 C ATOM 0 H LEU A 16 -7.484 18.977 2.248 1.00 0.00 H new ATOM 0 HA LEU A 16 -5.978 21.152 0.954 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.501 19.776 3.635 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -4.152 20.435 2.731 1.00 0.00 H new ATOM 0 HG LEU A 16 -6.576 22.099 3.464 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.175 22.937 5.371 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -5.494 21.192 5.523 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.912 21.760 4.940 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.031 24.003 3.174 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.730 22.874 2.726 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.166 23.034 1.687 1.00 0.00 H new ATOM 269 N PRO A 17 -4.283 19.510 -0.080 1.00 0.00 N ATOM 270 CA PRO A 17 -3.539 18.554 -0.904 1.00 0.00 C ATOM 271 C PRO A 17 -2.684 17.605 -0.054 1.00 0.00 C ATOM 272 O PRO A 17 -1.851 18.049 0.742 1.00 0.00 O ATOM 273 CB PRO A 17 -2.684 19.409 -1.850 1.00 0.00 C ATOM 274 CG PRO A 17 -2.520 20.735 -1.121 1.00 0.00 C ATOM 275 CD PRO A 17 -3.827 20.870 -0.348 1.00 0.00 C ATOM 0 HA PRO A 17 -4.211 17.899 -1.458 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -1.719 18.941 -2.045 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.173 19.544 -2.815 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -1.657 20.725 -0.455 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -2.376 21.562 -1.816 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -3.675 21.420 0.581 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -4.567 21.422 -0.928 1.00 0.00 H new ATOM 283 N ILE A 18 -2.848 16.292 -0.255 1.00 0.00 N ATOM 284 CA ILE A 18 -2.084 15.254 0.462 1.00 0.00 C ATOM 285 C ILE A 18 -0.569 15.431 0.339 1.00 0.00 C ATOM 286 O ILE A 18 0.157 15.221 1.312 1.00 0.00 O ATOM 287 CB ILE A 18 -2.521 13.842 0.013 1.00 0.00 C ATOM 288 CG1 ILE A 18 -1.930 12.770 0.956 1.00 0.00 C ATOM 289 CG2 ILE A 18 -2.185 13.557 -1.460 1.00 0.00 C ATOM 290 CD1 ILE A 18 -2.600 11.400 0.808 1.00 0.00 C ATOM 0 H ILE A 18 -3.519 15.913 -0.924 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.317 15.371 1.520 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.608 13.799 0.083 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -0.863 12.669 0.757 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.031 13.107 1.988 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.515 12.551 -1.720 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -2.694 14.281 -2.096 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -1.108 13.636 -1.609 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -2.139 10.693 1.498 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.662 11.488 1.035 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -2.476 11.043 -0.214 1.00 0.00 H new ATOM 302 N GLY A 19 -0.079 15.878 -0.823 1.00 0.00 N ATOM 303 CA GLY A 19 1.355 16.042 -1.046 1.00 0.00 C ATOM 304 C GLY A 19 1.982 17.099 -0.141 1.00 0.00 C ATOM 305 O GLY A 19 3.074 16.885 0.376 1.00 0.00 O ATOM 0 H GLY A 19 -0.659 16.132 -1.623 1.00 0.00 H new ATOM 0 HA2 GLY A 19 1.854 15.087 -0.881 1.00 0.00 H new ATOM 0 HA3 GLY A 19 1.526 16.315 -2.087 1.00 0.00 H new ATOM 309 N LYS A 20 1.266 18.191 0.160 1.00 0.00 N ATOM 310 CA LYS A 20 1.741 19.229 1.085 1.00 0.00 C ATOM 311 C LYS A 20 1.798 18.712 2.524 1.00 0.00 C ATOM 312 O LYS A 20 2.738 19.016 3.252 1.00 0.00 O ATOM 313 CB LYS A 20 0.817 20.453 0.970 1.00 0.00 C ATOM 314 CG LYS A 20 1.335 21.678 1.738 1.00 0.00 C ATOM 315 CD LYS A 20 0.316 22.824 1.669 1.00 0.00 C ATOM 316 CE LYS A 20 0.827 24.031 2.465 1.00 0.00 C ATOM 317 NZ LYS A 20 -0.186 25.120 2.522 1.00 0.00 N ATOM 0 H LYS A 20 0.343 18.379 -0.230 1.00 0.00 H new ATOM 0 HA LYS A 20 2.758 19.514 0.814 1.00 0.00 H new ATOM 0 HB2 LYS A 20 0.701 20.714 -0.082 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.172 20.190 1.344 1.00 0.00 H new ATOM 0 HG2 LYS A 20 1.521 21.411 2.778 1.00 0.00 H new ATOM 0 HG3 LYS A 20 2.286 22.003 1.317 1.00 0.00 H new ATOM 0 HD2 LYS A 20 0.147 23.109 0.631 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -0.642 22.494 2.069 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.082 23.718 3.477 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.742 24.408 2.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 0.194 25.919 3.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -0.411 25.436 1.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.050 24.767 2.981 1.00 0.00 H new ATOM 331 N ILE A 21 0.825 17.886 2.916 1.00 0.00 N ATOM 332 CA ILE A 21 0.753 17.287 4.255 1.00 0.00 C ATOM 333 C ILE A 21 1.916 16.317 4.450 1.00 0.00 C ATOM 334 O ILE A 21 2.507 16.295 5.521 1.00 0.00 O ATOM 335 CB ILE A 21 -0.619 16.611 4.492 1.00 0.00 C ATOM 336 CG1 ILE A 21 -1.760 17.658 4.466 1.00 0.00 C ATOM 337 CG2 ILE A 21 -0.663 15.821 5.814 1.00 0.00 C ATOM 338 CD1 ILE A 21 -3.154 17.061 4.222 1.00 0.00 C ATOM 0 H ILE A 21 0.055 17.610 2.307 1.00 0.00 H new ATOM 0 HA ILE A 21 0.843 18.075 5.003 1.00 0.00 H new ATOM 0 HB ILE A 21 -0.762 15.901 3.678 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -1.768 18.195 5.415 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -1.549 18.390 3.687 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -1.646 15.366 5.933 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.098 15.041 5.797 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.472 16.496 6.648 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -3.896 17.859 4.218 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.167 16.549 3.260 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.389 16.350 5.014 1.00 0.00 H new ATOM 350 N VAL A 22 2.287 15.561 3.413 1.00 0.00 N ATOM 351 CA VAL A 22 3.372 14.571 3.460 1.00 0.00 C ATOM 352 C VAL A 22 4.764 15.190 3.290 1.00 0.00 C ATOM 353 O VAL A 22 5.686 14.803 4.007 1.00 0.00 O ATOM 354 CB VAL A 22 3.100 13.478 2.412 1.00 0.00 C ATOM 355 CG1 VAL A 22 4.254 12.483 2.253 1.00 0.00 C ATOM 356 CG2 VAL A 22 1.844 12.690 2.825 1.00 0.00 C ATOM 0 H VAL A 22 1.835 15.619 2.500 1.00 0.00 H new ATOM 0 HA VAL A 22 3.380 14.128 4.456 1.00 0.00 H new ATOM 0 HB VAL A 22 2.971 13.987 1.457 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.993 11.741 1.498 1.00 0.00 H new ATOM 0 HG12 VAL A 22 5.153 13.015 1.943 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.438 11.984 3.204 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.643 11.913 2.088 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.006 12.232 3.800 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.991 13.367 2.880 1.00 0.00 H new ATOM 366 N GLU A 23 4.941 16.182 2.409 1.00 0.00 N ATOM 367 CA GLU A 23 6.238 16.869 2.240 1.00 0.00 C ATOM 368 C GLU A 23 6.623 17.717 3.463 1.00 0.00 C ATOM 369 O GLU A 23 7.814 17.895 3.747 1.00 0.00 O ATOM 370 CB GLU A 23 6.248 17.768 0.991 1.00 0.00 C ATOM 371 CG GLU A 23 6.325 16.983 -0.325 1.00 0.00 C ATOM 372 CD GLU A 23 6.712 17.917 -1.489 1.00 0.00 C ATOM 373 OE1 GLU A 23 5.848 18.675 -1.994 1.00 0.00 O ATOM 374 OE2 GLU A 23 7.900 17.914 -1.897 1.00 0.00 O ATOM 0 H GLU A 23 4.203 16.532 1.798 1.00 0.00 H new ATOM 0 HA GLU A 23 6.974 16.074 2.123 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.347 18.382 0.987 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.097 18.449 1.049 1.00 0.00 H new ATOM 0 HG2 GLU A 23 7.058 16.182 -0.235 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.363 16.513 -0.532 1.00 0.00 H new ATOM 381 N LYS A 24 5.626 18.202 4.217 1.00 0.00 N ATOM 382 CA LYS A 24 5.808 19.099 5.378 1.00 0.00 C ATOM 383 C LYS A 24 5.431 18.433 6.708 1.00 0.00 C ATOM 384 O LYS A 24 5.551 19.056 7.767 1.00 0.00 O ATOM 385 CB LYS A 24 5.022 20.407 5.164 1.00 0.00 C ATOM 386 CG LYS A 24 5.300 21.154 3.852 1.00 0.00 C ATOM 387 CD LYS A 24 6.779 21.531 3.664 1.00 0.00 C ATOM 388 CE LYS A 24 6.968 22.562 2.542 1.00 0.00 C ATOM 389 NZ LYS A 24 6.579 23.936 2.971 1.00 0.00 N ATOM 0 H LYS A 24 4.647 17.979 4.036 1.00 0.00 H new ATOM 0 HA LYS A 24 6.871 19.331 5.447 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.957 20.179 5.210 1.00 0.00 H new ATOM 0 HB3 LYS A 24 5.241 21.079 5.994 1.00 0.00 H new ATOM 0 HG2 LYS A 24 4.982 20.533 3.015 1.00 0.00 H new ATOM 0 HG3 LYS A 24 4.695 22.061 3.824 1.00 0.00 H new ATOM 0 HD2 LYS A 24 7.173 21.934 4.597 1.00 0.00 H new ATOM 0 HD3 LYS A 24 7.356 20.635 3.435 1.00 0.00 H new ATOM 0 HE2 LYS A 24 8.011 22.564 2.224 1.00 0.00 H new ATOM 0 HE3 LYS A 24 6.371 22.270 1.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 6.754 24.605 2.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 5.569 23.950 3.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 7.142 24.213 3.800 1.00 0.00 H new ATOM 403 N ARG A 25 5.014 17.161 6.647 1.00 0.00 N ATOM 404 CA ARG A 25 4.603 16.290 7.761 1.00 0.00 C ATOM 405 C ARG A 25 3.634 16.988 8.722 1.00 0.00 C ATOM 406 O ARG A 25 3.883 17.098 9.925 1.00 0.00 O ATOM 407 CB ARG A 25 5.832 15.649 8.425 1.00 0.00 C ATOM 408 CG ARG A 25 6.702 14.862 7.420 1.00 0.00 C ATOM 409 CD ARG A 25 7.859 15.657 6.794 1.00 0.00 C ATOM 410 NE ARG A 25 8.770 16.213 7.815 1.00 0.00 N ATOM 411 CZ ARG A 25 9.573 17.255 7.680 1.00 0.00 C ATOM 412 NH1 ARG A 25 9.704 17.898 6.552 1.00 0.00 N ATOM 413 NH2 ARG A 25 10.271 17.676 8.697 1.00 0.00 N ATOM 0 H ARG A 25 4.950 16.676 5.752 1.00 0.00 H new ATOM 0 HA ARG A 25 4.016 15.462 7.363 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.436 16.427 8.893 1.00 0.00 H new ATOM 0 HB3 ARG A 25 5.504 14.979 9.220 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.114 13.989 7.926 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.061 14.493 6.620 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.421 15.009 6.122 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.455 16.469 6.189 1.00 0.00 H new ATOM 0 HE ARG A 25 8.781 15.743 8.720 1.00 0.00 H new ATOM 0 HH11 ARG A 25 9.176 17.601 5.732 1.00 0.00 H new ATOM 0 HH12 ARG A 25 10.335 18.697 6.491 1.00 0.00 H new ATOM 0 HH21 ARG A 25 10.198 17.202 9.597 1.00 0.00 H new ATOM 0 HH22 ARG A 25 10.890 18.480 8.593 1.00 0.00 H new ATOM 427 N ILE A 26 2.562 17.547 8.150 1.00 0.00 N ATOM 428 CA ILE A 26 1.595 18.379 8.880 1.00 0.00 C ATOM 429 C ILE A 26 0.741 17.480 9.783 1.00 0.00 C ATOM 430 O ILE A 26 0.107 16.531 9.319 1.00 0.00 O ATOM 431 CB ILE A 26 0.739 19.237 7.915 1.00 0.00 C ATOM 432 CG1 ILE A 26 1.654 20.182 7.101 1.00 0.00 C ATOM 433 CG2 ILE A 26 -0.304 20.051 8.705 1.00 0.00 C ATOM 434 CD1 ILE A 26 0.975 20.908 5.932 1.00 0.00 C ATOM 0 H ILE A 26 2.338 17.435 7.161 1.00 0.00 H new ATOM 0 HA ILE A 26 2.131 19.089 9.510 1.00 0.00 H new ATOM 0 HB ILE A 26 0.212 18.576 7.227 1.00 0.00 H new ATOM 0 HG12 ILE A 26 2.071 20.928 7.777 1.00 0.00 H new ATOM 0 HG13 ILE A 26 2.491 19.603 6.710 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.898 20.649 8.014 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.958 19.371 9.252 1.00 0.00 H new ATOM 0 HG23 ILE A 26 0.205 20.709 9.409 1.00 0.00 H new ATOM 0 HD11 ILE A 26 1.702 21.544 5.427 1.00 0.00 H new ATOM 0 HD12 ILE A 26 0.583 20.175 5.227 1.00 0.00 H new ATOM 0 HD13 ILE A 26 0.157 21.521 6.310 1.00 0.00 H new ATOM 446 N GLU A 27 0.731 17.780 11.083 1.00 0.00 N ATOM 447 CA GLU A 27 -0.077 17.070 12.080 1.00 0.00 C ATOM 448 C GLU A 27 -1.564 17.421 11.909 1.00 0.00 C ATOM 449 O GLU A 27 -2.011 18.501 12.304 1.00 0.00 O ATOM 450 CB GLU A 27 0.416 17.367 13.507 1.00 0.00 C ATOM 451 CG GLU A 27 1.868 16.917 13.725 1.00 0.00 C ATOM 452 CD GLU A 27 2.264 16.972 15.212 1.00 0.00 C ATOM 453 OE1 GLU A 27 2.285 18.080 15.805 1.00 0.00 O ATOM 454 OE2 GLU A 27 2.573 15.908 15.804 1.00 0.00 O ATOM 0 H GLU A 27 1.292 18.534 11.480 1.00 0.00 H new ATOM 0 HA GLU A 27 0.037 15.998 11.919 1.00 0.00 H new ATOM 0 HB2 GLU A 27 0.336 18.436 13.702 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.231 16.863 14.225 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.994 15.900 13.352 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.537 17.554 13.146 1.00 0.00 H new ATOM 461 N CYS A 28 -2.324 16.507 11.300 1.00 0.00 N ATOM 462 CA CYS A 28 -3.741 16.674 10.978 1.00 0.00 C ATOM 463 C CYS A 28 -4.588 15.459 11.399 1.00 0.00 C ATOM 464 O CYS A 28 -4.094 14.477 11.959 1.00 0.00 O ATOM 465 CB CYS A 28 -3.875 17.018 9.477 1.00 0.00 C ATOM 466 SG CYS A 28 -3.430 15.602 8.421 1.00 0.00 S ATOM 0 H CYS A 28 -1.956 15.601 11.009 1.00 0.00 H new ATOM 0 HA CYS A 28 -4.145 17.503 11.559 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -4.899 17.324 9.263 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -3.233 17.866 9.239 1.00 0.00 H new ATOM 0 HG CYS A 28 -3.559 15.935 7.171 1.00 0.00 H new ATOM 472 N THR A 29 -5.883 15.530 11.099 1.00 0.00 N ATOM 473 CA THR A 29 -6.905 14.547 11.492 1.00 0.00 C ATOM 474 C THR A 29 -7.765 14.239 10.271 1.00 0.00 C ATOM 475 O THR A 29 -8.001 15.138 9.464 1.00 0.00 O ATOM 476 CB THR A 29 -7.811 15.111 12.609 1.00 0.00 C ATOM 477 OG1 THR A 29 -7.125 15.996 13.469 1.00 0.00 O ATOM 478 CG2 THR A 29 -8.430 14.039 13.499 1.00 0.00 C ATOM 0 H THR A 29 -6.270 16.301 10.555 1.00 0.00 H new ATOM 0 HA THR A 29 -6.412 13.649 11.865 1.00 0.00 H new ATOM 0 HB THR A 29 -8.594 15.630 12.057 1.00 0.00 H new ATOM 0 HG1 THR A 29 -7.740 16.327 14.156 1.00 0.00 H new ATOM 0 HG21 THR A 29 -9.052 14.512 14.259 1.00 0.00 H new ATOM 0 HG22 THR A 29 -9.042 13.371 12.893 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.639 13.466 13.983 1.00 0.00 H new ATOM 486 N VAL A 30 -8.270 13.013 10.138 1.00 0.00 N ATOM 487 CA VAL A 30 -9.003 12.531 8.950 1.00 0.00 C ATOM 488 C VAL A 30 -10.263 11.766 9.351 1.00 0.00 C ATOM 489 O VAL A 30 -10.358 11.266 10.474 1.00 0.00 O ATOM 490 CB VAL A 30 -8.110 11.652 8.042 1.00 0.00 C ATOM 491 CG1 VAL A 30 -6.920 12.441 7.486 1.00 0.00 C ATOM 492 CG2 VAL A 30 -7.582 10.387 8.733 1.00 0.00 C ATOM 0 H VAL A 30 -8.183 12.304 10.866 1.00 0.00 H new ATOM 0 HA VAL A 30 -9.298 13.412 8.380 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.766 11.340 7.229 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -6.316 11.791 6.853 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -7.285 13.283 6.898 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.312 12.811 8.311 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.965 9.822 8.035 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.985 10.669 9.600 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -8.422 9.771 9.055 1.00 0.00 H new ATOM 502 N TYR A 31 -11.220 11.663 8.427 1.00 0.00 N ATOM 503 CA TYR A 31 -12.504 10.984 8.636 1.00 0.00 C ATOM 504 C TYR A 31 -12.440 9.548 8.110 1.00 0.00 C ATOM 505 O TYR A 31 -11.889 9.298 7.037 1.00 0.00 O ATOM 506 CB TYR A 31 -13.630 11.750 7.929 1.00 0.00 C ATOM 507 CG TYR A 31 -13.811 13.179 8.406 1.00 0.00 C ATOM 508 CD1 TYR A 31 -12.996 14.211 7.896 1.00 0.00 C ATOM 509 CD2 TYR A 31 -14.796 13.473 9.369 1.00 0.00 C ATOM 510 CE1 TYR A 31 -13.164 15.534 8.346 1.00 0.00 C ATOM 511 CE2 TYR A 31 -14.985 14.801 9.801 1.00 0.00 C ATOM 512 CZ TYR A 31 -14.176 15.836 9.282 1.00 0.00 C ATOM 513 OH TYR A 31 -14.373 17.121 9.688 1.00 0.00 O ATOM 0 H TYR A 31 -11.124 12.057 7.491 1.00 0.00 H new ATOM 0 HA TYR A 31 -12.711 10.957 9.706 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -13.429 11.760 6.858 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -14.566 11.210 8.073 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -12.241 13.985 7.158 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -15.406 12.681 9.776 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -12.519 16.317 7.975 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -15.749 15.028 10.530 1.00 0.00 H new ATOM 0 HH TYR A 31 -15.110 17.151 10.333 1.00 0.00 H new ATOM 523 N SER A 32 -13.006 8.605 8.857 1.00 0.00 N ATOM 524 CA SER A 32 -12.910 7.161 8.603 1.00 0.00 C ATOM 525 C SER A 32 -14.100 6.426 9.226 1.00 0.00 C ATOM 526 O SER A 32 -14.659 6.892 10.214 1.00 0.00 O ATOM 527 CB SER A 32 -11.588 6.673 9.213 1.00 0.00 C ATOM 528 OG SER A 32 -11.568 5.273 9.446 1.00 0.00 O ATOM 0 H SER A 32 -13.563 8.826 9.683 1.00 0.00 H new ATOM 0 HA SER A 32 -12.930 6.958 7.532 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.767 6.936 8.546 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.414 7.195 10.154 1.00 0.00 H new ATOM 0 HG SER A 32 -10.658 4.993 9.680 1.00 0.00 H new ATOM 534 N VAL A 33 -14.478 5.264 8.685 1.00 0.00 N ATOM 535 CA VAL A 33 -15.554 4.429 9.245 1.00 0.00 C ATOM 536 C VAL A 33 -14.972 3.386 10.210 1.00 0.00 C ATOM 537 O VAL A 33 -14.069 2.629 9.846 1.00 0.00 O ATOM 538 CB VAL A 33 -16.383 3.732 8.145 1.00 0.00 C ATOM 539 CG1 VAL A 33 -17.791 3.492 8.672 1.00 0.00 C ATOM 540 CG2 VAL A 33 -16.501 4.541 6.845 1.00 0.00 C ATOM 0 H VAL A 33 -14.049 4.872 7.847 1.00 0.00 H new ATOM 0 HA VAL A 33 -16.227 5.091 9.790 1.00 0.00 H new ATOM 0 HB VAL A 33 -15.859 2.807 7.906 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -18.388 3.000 7.904 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -17.745 2.858 9.558 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -18.250 4.446 8.932 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -17.098 3.984 6.123 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -16.982 5.496 7.053 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -15.507 4.718 6.435 1.00 0.00 H new ATOM 550 N ASP A 34 -15.476 3.350 11.448 1.00 0.00 N ATOM 551 CA ASP A 34 -15.086 2.384 12.486 1.00 0.00 C ATOM 552 C ASP A 34 -15.546 0.949 12.152 1.00 0.00 C ATOM 553 O ASP A 34 -16.295 0.702 11.201 1.00 0.00 O ATOM 554 CB ASP A 34 -15.652 2.837 13.848 1.00 0.00 C ATOM 555 CG ASP A 34 -14.924 2.222 15.060 1.00 0.00 C ATOM 556 OD1 ASP A 34 -13.793 2.649 15.394 1.00 0.00 O ATOM 557 OD2 ASP A 34 -15.488 1.277 15.662 1.00 0.00 O ATOM 0 H ASP A 34 -16.186 4.009 11.767 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.997 2.360 12.532 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -15.592 3.923 13.913 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -16.708 2.573 13.898 1.00 0.00 H new ATOM 562 N ASN A 35 -15.148 -0.003 12.994 1.00 0.00 N ATOM 563 CA ASN A 35 -15.514 -1.423 12.890 1.00 0.00 C ATOM 564 C ASN A 35 -17.033 -1.671 13.031 1.00 0.00 C ATOM 565 O ASN A 35 -17.558 -2.646 12.488 1.00 0.00 O ATOM 566 CB ASN A 35 -14.724 -2.215 13.947 1.00 0.00 C ATOM 567 CG ASN A 35 -13.227 -2.224 13.677 1.00 0.00 C ATOM 568 OD1 ASN A 35 -12.762 -2.651 12.627 1.00 0.00 O ATOM 569 ND2 ASN A 35 -12.420 -1.762 14.606 1.00 0.00 N ATOM 0 H ASN A 35 -14.544 0.193 13.792 1.00 0.00 H new ATOM 0 HA ASN A 35 -15.254 -1.766 11.889 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -14.909 -1.784 14.931 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -15.090 -3.241 13.975 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -11.412 -1.760 14.451 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -12.802 -1.405 15.482 1.00 0.00 H new ATOM 576 N ASN A 36 -17.746 -0.773 13.724 1.00 0.00 N ATOM 577 CA ASN A 36 -19.208 -0.777 13.869 1.00 0.00 C ATOM 578 C ASN A 36 -19.947 -0.067 12.708 1.00 0.00 C ATOM 579 O ASN A 36 -21.180 -0.061 12.674 1.00 0.00 O ATOM 580 CB ASN A 36 -19.553 -0.129 15.221 1.00 0.00 C ATOM 581 CG ASN A 36 -19.142 -0.995 16.400 1.00 0.00 C ATOM 582 OD1 ASN A 36 -19.810 -1.960 16.752 1.00 0.00 O ATOM 583 ND2 ASN A 36 -18.041 -0.692 17.052 1.00 0.00 N ATOM 0 H ASN A 36 -17.305 0.004 14.217 1.00 0.00 H new ATOM 0 HA ASN A 36 -19.552 -1.811 13.833 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -19.057 0.839 15.294 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -20.626 0.058 15.268 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -17.746 -1.259 17.847 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -17.481 0.110 16.763 1.00 0.00 H new ATOM 590 N GLY A 37 -19.219 0.549 11.767 1.00 0.00 N ATOM 591 CA GLY A 37 -19.777 1.298 10.635 1.00 0.00 C ATOM 592 C GLY A 37 -20.153 2.757 10.950 1.00 0.00 C ATOM 593 O GLY A 37 -20.931 3.363 10.208 1.00 0.00 O ATOM 0 H GLY A 37 -18.199 0.539 11.773 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -19.052 1.292 9.821 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -20.665 0.778 10.276 1.00 0.00 H new ATOM 597 N ASN A 38 -19.611 3.328 12.033 1.00 0.00 N ATOM 598 CA ASN A 38 -19.797 4.734 12.417 1.00 0.00 C ATOM 599 C ASN A 38 -18.637 5.588 11.886 1.00 0.00 C ATOM 600 O ASN A 38 -17.472 5.257 12.116 1.00 0.00 O ATOM 601 CB ASN A 38 -19.864 4.831 13.954 1.00 0.00 C ATOM 602 CG ASN A 38 -21.039 4.078 14.558 1.00 0.00 C ATOM 603 OD1 ASN A 38 -22.158 4.102 14.063 1.00 0.00 O ATOM 604 ND2 ASN A 38 -20.825 3.383 15.655 1.00 0.00 N ATOM 0 H ASN A 38 -19.017 2.813 12.683 1.00 0.00 H new ATOM 0 HA ASN A 38 -20.725 5.108 11.985 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -18.937 4.441 14.376 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -19.929 5.880 14.242 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -21.590 2.867 16.089 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -19.894 3.360 16.071 1.00 0.00 H new ATOM 611 N ILE A 39 -18.925 6.691 11.193 1.00 0.00 N ATOM 612 CA ILE A 39 -17.899 7.629 10.726 1.00 0.00 C ATOM 613 C ILE A 39 -17.382 8.441 11.924 1.00 0.00 C ATOM 614 O ILE A 39 -18.153 9.100 12.631 1.00 0.00 O ATOM 615 CB ILE A 39 -18.424 8.526 9.582 1.00 0.00 C ATOM 616 CG1 ILE A 39 -19.067 7.658 8.471 1.00 0.00 C ATOM 617 CG2 ILE A 39 -17.263 9.360 9.007 1.00 0.00 C ATOM 618 CD1 ILE A 39 -19.474 8.411 7.199 1.00 0.00 C ATOM 0 H ILE A 39 -19.875 6.960 10.939 1.00 0.00 H new ATOM 0 HA ILE A 39 -17.064 7.072 10.301 1.00 0.00 H new ATOM 0 HB ILE A 39 -19.186 9.199 9.975 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -18.365 6.870 8.197 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -19.950 7.169 8.881 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -17.634 9.992 8.200 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -16.840 9.985 9.793 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -16.493 8.693 8.620 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -19.913 7.712 6.487 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -20.204 9.180 7.450 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -18.594 8.877 6.755 1.00 0.00 H new ATOM 630 N TYR A 40 -16.071 8.388 12.142 1.00 0.00 N ATOM 631 CA TYR A 40 -15.335 9.036 13.230 1.00 0.00 C ATOM 632 C TYR A 40 -14.056 9.719 12.717 1.00 0.00 C ATOM 633 O TYR A 40 -13.696 9.592 11.542 1.00 0.00 O ATOM 634 CB TYR A 40 -15.038 8.008 14.343 1.00 0.00 C ATOM 635 CG TYR A 40 -13.858 7.069 14.117 1.00 0.00 C ATOM 636 CD1 TYR A 40 -13.945 6.008 13.194 1.00 0.00 C ATOM 637 CD2 TYR A 40 -12.681 7.227 14.880 1.00 0.00 C ATOM 638 CE1 TYR A 40 -12.870 5.110 13.035 1.00 0.00 C ATOM 639 CE2 TYR A 40 -11.620 6.310 14.750 1.00 0.00 C ATOM 640 CZ TYR A 40 -11.724 5.235 13.842 1.00 0.00 C ATOM 641 OH TYR A 40 -10.708 4.338 13.753 1.00 0.00 O ATOM 0 H TYR A 40 -15.453 7.859 11.527 1.00 0.00 H new ATOM 0 HA TYR A 40 -15.955 9.826 13.653 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.865 8.553 15.271 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.931 7.401 14.491 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.841 5.882 12.604 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -12.594 8.056 15.567 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.926 4.326 12.294 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -10.727 6.430 15.345 1.00 0.00 H new ATOM 0 HH TYR A 40 -9.999 4.583 14.384 1.00 0.00 H new ATOM 651 N THR A 41 -13.365 10.445 13.597 1.00 0.00 N ATOM 652 CA THR A 41 -12.148 11.208 13.267 1.00 0.00 C ATOM 653 C THR A 41 -10.929 10.691 14.025 1.00 0.00 C ATOM 654 O THR A 41 -11.008 10.385 15.217 1.00 0.00 O ATOM 655 CB THR A 41 -12.328 12.712 13.529 1.00 0.00 C ATOM 656 OG1 THR A 41 -12.923 12.974 14.788 1.00 0.00 O ATOM 657 CG2 THR A 41 -13.202 13.343 12.448 1.00 0.00 C ATOM 0 H THR A 41 -13.635 10.524 14.577 1.00 0.00 H new ATOM 0 HA THR A 41 -11.976 11.062 12.201 1.00 0.00 H new ATOM 0 HB THR A 41 -11.328 13.146 13.518 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.016 13.942 14.911 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.318 14.408 12.650 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.731 13.208 11.474 1.00 0.00 H new ATOM 0 HG23 THR A 41 -14.181 12.865 12.447 1.00 0.00 H new ATOM 665 N GLN A 42 -9.787 10.623 13.333 1.00 0.00 N ATOM 666 CA GLN A 42 -8.546 10.014 13.831 1.00 0.00 C ATOM 667 C GLN A 42 -7.301 10.816 13.403 1.00 0.00 C ATOM 668 O GLN A 42 -7.266 11.319 12.276 1.00 0.00 O ATOM 669 CB GLN A 42 -8.477 8.559 13.333 1.00 0.00 C ATOM 670 CG GLN A 42 -8.437 8.430 11.795 1.00 0.00 C ATOM 671 CD GLN A 42 -8.546 6.992 11.306 1.00 0.00 C ATOM 672 OE1 GLN A 42 -7.749 6.509 10.518 1.00 0.00 O ATOM 673 NE2 GLN A 42 -9.543 6.254 11.732 1.00 0.00 N ATOM 0 H GLN A 42 -9.696 10.998 12.389 1.00 0.00 H new ATOM 0 HA GLN A 42 -8.555 10.026 14.921 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -7.590 8.083 13.752 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -9.341 8.013 13.712 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -9.252 9.014 11.367 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.507 8.862 11.426 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -10.219 6.641 12.391 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -9.643 5.293 11.405 1.00 0.00 H new ATOM 682 N PRO A 43 -6.283 10.965 14.272 1.00 0.00 N ATOM 683 CA PRO A 43 -5.061 11.698 13.945 1.00 0.00 C ATOM 684 C PRO A 43 -4.140 10.896 13.013 1.00 0.00 C ATOM 685 O PRO A 43 -4.113 9.661 13.035 1.00 0.00 O ATOM 686 CB PRO A 43 -4.386 11.966 15.294 1.00 0.00 C ATOM 687 CG PRO A 43 -4.821 10.777 16.147 1.00 0.00 C ATOM 688 CD PRO A 43 -6.233 10.483 15.646 1.00 0.00 C ATOM 0 HA PRO A 43 -5.283 12.619 13.405 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -3.301 12.017 15.198 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.712 12.912 15.726 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -4.160 9.921 16.011 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -4.814 11.020 17.210 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -6.449 9.416 15.693 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -6.978 10.986 16.263 1.00 0.00 H new ATOM 696 N VAL A 44 -3.340 11.607 12.215 1.00 0.00 N ATOM 697 CA VAL A 44 -2.241 11.025 11.430 1.00 0.00 C ATOM 698 C VAL A 44 -1.163 10.426 12.349 1.00 0.00 C ATOM 699 O VAL A 44 -0.809 11.016 13.375 1.00 0.00 O ATOM 700 CB VAL A 44 -1.669 12.082 10.458 1.00 0.00 C ATOM 701 CG1 VAL A 44 -0.975 13.266 11.141 1.00 0.00 C ATOM 702 CG2 VAL A 44 -0.688 11.459 9.468 1.00 0.00 C ATOM 0 H VAL A 44 -3.436 12.615 12.092 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.627 10.201 10.830 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.548 12.469 9.942 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.605 13.957 10.384 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.686 13.782 11.786 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.140 12.902 11.740 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.306 12.231 8.800 1.00 0.00 H new ATOM 0 HG22 VAL A 44 0.141 11.007 10.013 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.198 10.693 8.883 1.00 0.00 H new ATOM 712 N ALA A 45 -0.636 9.250 11.991 1.00 0.00 N ATOM 713 CA ALA A 45 0.485 8.618 12.692 1.00 0.00 C ATOM 714 C ALA A 45 1.829 9.014 12.059 1.00 0.00 C ATOM 715 O ALA A 45 2.730 9.472 12.766 1.00 0.00 O ATOM 716 CB ALA A 45 0.293 7.095 12.671 1.00 0.00 C ATOM 0 H ALA A 45 -0.979 8.706 11.199 1.00 0.00 H new ATOM 0 HA ALA A 45 0.503 8.965 13.725 1.00 0.00 H new ATOM 0 HB1 ALA A 45 1.123 6.616 13.191 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.642 6.839 13.169 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.262 6.746 11.639 1.00 0.00 H new ATOM 722 N GLN A 46 1.950 8.845 10.736 1.00 0.00 N ATOM 723 CA GLN A 46 3.183 9.021 9.954 1.00 0.00 C ATOM 724 C GLN A 46 2.876 9.605 8.561 1.00 0.00 C ATOM 725 O GLN A 46 1.718 9.844 8.214 1.00 0.00 O ATOM 726 CB GLN A 46 3.943 7.683 9.818 1.00 0.00 C ATOM 727 CG GLN A 46 4.156 6.990 11.172 1.00 0.00 C ATOM 728 CD GLN A 46 5.383 6.096 11.255 1.00 0.00 C ATOM 729 OE1 GLN A 46 5.943 5.606 10.281 1.00 0.00 O ATOM 730 NE2 GLN A 46 5.862 5.889 12.463 1.00 0.00 N ATOM 0 H GLN A 46 1.158 8.570 10.155 1.00 0.00 H new ATOM 0 HA GLN A 46 3.818 9.727 10.489 1.00 0.00 H new ATOM 0 HB2 GLN A 46 3.387 7.018 9.156 1.00 0.00 H new ATOM 0 HB3 GLN A 46 4.910 7.864 9.349 1.00 0.00 H new ATOM 0 HG2 GLN A 46 4.230 7.754 11.946 1.00 0.00 H new ATOM 0 HG3 GLN A 46 3.274 6.391 11.399 1.00 0.00 H new ATOM 0 HE21 GLN A 46 5.396 6.297 13.273 1.00 0.00 H new ATOM 0 HE22 GLN A 46 6.700 5.321 12.589 1.00 0.00 H new ATOM 739 N TRP A 47 3.901 9.792 7.729 1.00 0.00 N ATOM 740 CA TRP A 47 3.778 10.332 6.371 1.00 0.00 C ATOM 741 C TRP A 47 4.701 9.549 5.428 1.00 0.00 C ATOM 742 O TRP A 47 5.898 9.425 5.705 1.00 0.00 O ATOM 743 CB TRP A 47 4.127 11.830 6.389 1.00 0.00 C ATOM 744 CG TRP A 47 3.301 12.688 7.304 1.00 0.00 C ATOM 745 CD1 TRP A 47 2.235 13.442 6.948 1.00 0.00 C ATOM 746 CD2 TRP A 47 3.461 12.889 8.745 1.00 0.00 C ATOM 747 NE1 TRP A 47 1.726 14.093 8.055 1.00 0.00 N ATOM 748 CE2 TRP A 47 2.434 13.774 9.195 1.00 0.00 C ATOM 749 CE3 TRP A 47 4.372 12.417 9.717 1.00 0.00 C ATOM 750 CZ2 TRP A 47 2.316 14.159 10.536 1.00 0.00 C ATOM 751 CZ3 TRP A 47 4.247 12.784 11.072 1.00 0.00 C ATOM 752 CH2 TRP A 47 3.220 13.650 11.482 1.00 0.00 C ATOM 0 H TRP A 47 4.863 9.568 7.985 1.00 0.00 H new ATOM 0 HA TRP A 47 2.755 10.225 6.009 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.174 11.935 6.672 1.00 0.00 H new ATOM 0 HB3 TRP A 47 4.030 12.217 5.375 1.00 0.00 H new ATOM 0 HD1 TRP A 47 1.840 13.523 5.946 1.00 0.00 H new ATOM 0 HE1 TRP A 47 0.928 14.728 8.032 1.00 0.00 H new ATOM 0 HE3 TRP A 47 5.178 11.764 9.416 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 1.536 14.842 10.840 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 4.945 12.397 11.799 1.00 0.00 H new ATOM 0 HH2 TRP A 47 3.126 13.924 12.522 1.00 0.00 H new ATOM 763 N HIS A 48 4.157 9.026 4.325 1.00 0.00 N ATOM 764 CA HIS A 48 4.895 8.193 3.368 1.00 0.00 C ATOM 765 C HIS A 48 4.850 8.808 1.962 1.00 0.00 C ATOM 766 O HIS A 48 3.802 9.219 1.460 1.00 0.00 O ATOM 767 CB HIS A 48 4.349 6.751 3.341 1.00 0.00 C ATOM 768 CG HIS A 48 4.172 6.101 4.694 1.00 0.00 C ATOM 769 ND1 HIS A 48 5.171 5.608 5.509 1.00 0.00 N ATOM 770 CD2 HIS A 48 2.982 5.842 5.318 1.00 0.00 C ATOM 771 CE1 HIS A 48 4.595 5.068 6.597 1.00 0.00 C ATOM 772 NE2 HIS A 48 3.255 5.185 6.527 1.00 0.00 N ATOM 0 H HIS A 48 3.181 9.170 4.068 1.00 0.00 H new ATOM 0 HA HIS A 48 5.933 8.154 3.698 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.387 6.754 2.829 1.00 0.00 H new ATOM 0 HB3 HIS A 48 5.024 6.136 2.746 1.00 0.00 H new ATOM 0 HD1 HIS A 48 6.172 5.647 5.319 1.00 0.00 H new ATOM 0 HD2 HIS A 48 2.002 6.099 4.944 1.00 0.00 H new ATOM 0 HE1 HIS A 48 5.131 4.605 7.412 1.00 0.00 H new ATOM 780 N ASP A 49 6.008 8.836 1.306 1.00 0.00 N ATOM 781 CA ASP A 49 6.215 9.430 -0.014 1.00 0.00 C ATOM 782 C ASP A 49 6.882 8.414 -0.947 1.00 0.00 C ATOM 783 O ASP A 49 7.943 7.855 -0.650 1.00 0.00 O ATOM 784 CB ASP A 49 7.007 10.742 0.102 1.00 0.00 C ATOM 785 CG ASP A 49 8.400 10.596 0.744 1.00 0.00 C ATOM 786 OD1 ASP A 49 8.495 10.468 1.989 1.00 0.00 O ATOM 787 OD2 ASP A 49 9.417 10.669 0.011 1.00 0.00 O ATOM 0 H ASP A 49 6.860 8.431 1.693 1.00 0.00 H new ATOM 0 HA ASP A 49 5.251 9.687 -0.454 1.00 0.00 H new ATOM 0 HB2 ASP A 49 7.123 11.170 -0.894 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.424 11.452 0.688 1.00 0.00 H new ATOM 792 N ARG A 50 6.207 8.135 -2.066 1.00 0.00 N ATOM 793 CA ARG A 50 6.599 7.093 -3.031 1.00 0.00 C ATOM 794 C ARG A 50 7.551 7.622 -4.101 1.00 0.00 C ATOM 795 O ARG A 50 8.425 6.896 -4.574 1.00 0.00 O ATOM 796 CB ARG A 50 5.332 6.559 -3.696 1.00 0.00 C ATOM 797 CG ARG A 50 4.310 5.957 -2.710 1.00 0.00 C ATOM 798 CD ARG A 50 4.831 4.760 -1.901 1.00 0.00 C ATOM 799 NE ARG A 50 5.317 3.666 -2.770 1.00 0.00 N ATOM 800 CZ ARG A 50 5.836 2.515 -2.391 1.00 0.00 C ATOM 801 NH1 ARG A 50 5.989 2.196 -1.136 1.00 0.00 N ATOM 802 NH2 ARG A 50 6.209 1.658 -3.294 1.00 0.00 N ATOM 0 H ARG A 50 5.358 8.633 -2.335 1.00 0.00 H new ATOM 0 HA ARG A 50 7.127 6.306 -2.493 1.00 0.00 H new ATOM 0 HB2 ARG A 50 4.855 7.369 -4.248 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.610 5.797 -4.425 1.00 0.00 H new ATOM 0 HG2 ARG A 50 3.991 6.736 -2.017 1.00 0.00 H new ATOM 0 HG3 ARG A 50 3.427 5.645 -3.268 1.00 0.00 H new ATOM 0 HD2 ARG A 50 5.639 5.089 -1.248 1.00 0.00 H new ATOM 0 HD3 ARG A 50 4.035 4.384 -1.258 1.00 0.00 H new ATOM 0 HE ARG A 50 5.242 3.820 -3.776 1.00 0.00 H new ATOM 0 HH11 ARG A 50 5.703 2.848 -0.406 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.395 1.295 -0.885 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.099 1.879 -4.284 1.00 0.00 H new ATOM 0 HH22 ARG A 50 6.612 0.764 -3.013 1.00 0.00 H new ATOM 816 N GLY A 51 7.361 8.886 -4.485 1.00 0.00 N ATOM 817 CA GLY A 51 8.251 9.640 -5.367 1.00 0.00 C ATOM 818 C GLY A 51 7.850 9.636 -6.841 1.00 0.00 C ATOM 819 O GLY A 51 7.912 10.687 -7.477 1.00 0.00 O ATOM 0 H GLY A 51 6.555 9.431 -4.179 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.294 10.672 -5.020 1.00 0.00 H new ATOM 0 HA3 GLY A 51 9.258 9.232 -5.278 1.00 0.00 H new ATOM 823 N GLU A 52 7.432 8.487 -7.390 1.00 0.00 N ATOM 824 CA GLU A 52 7.260 8.309 -8.849 1.00 0.00 C ATOM 825 C GLU A 52 6.741 6.923 -9.269 1.00 0.00 C ATOM 826 O GLU A 52 7.487 5.992 -9.585 1.00 0.00 O ATOM 827 CB GLU A 52 8.548 8.629 -9.616 1.00 0.00 C ATOM 828 CG GLU A 52 9.833 8.005 -9.048 1.00 0.00 C ATOM 829 CD GLU A 52 11.061 8.410 -9.880 1.00 0.00 C ATOM 830 OE1 GLU A 52 11.685 9.460 -9.584 1.00 0.00 O ATOM 831 OE2 GLU A 52 11.420 7.680 -10.837 1.00 0.00 O ATOM 0 H GLU A 52 7.203 7.656 -6.844 1.00 0.00 H new ATOM 0 HA GLU A 52 6.484 9.026 -9.116 1.00 0.00 H new ATOM 0 HB2 GLU A 52 8.428 8.295 -10.647 1.00 0.00 H new ATOM 0 HB3 GLU A 52 8.673 9.711 -9.644 1.00 0.00 H new ATOM 0 HG2 GLU A 52 9.969 8.323 -8.014 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.739 6.919 -9.037 1.00 0.00 H new ATOM 838 N GLN A 53 5.421 6.805 -9.300 1.00 0.00 N ATOM 839 CA GLN A 53 4.693 5.609 -9.742 1.00 0.00 C ATOM 840 C GLN A 53 3.681 5.921 -10.857 1.00 0.00 C ATOM 841 O GLN A 53 3.273 7.067 -11.042 1.00 0.00 O ATOM 842 CB GLN A 53 4.012 4.998 -8.513 1.00 0.00 C ATOM 843 CG GLN A 53 5.053 4.755 -7.408 1.00 0.00 C ATOM 844 CD GLN A 53 4.528 4.021 -6.198 1.00 0.00 C ATOM 845 OE1 GLN A 53 5.144 3.107 -5.665 1.00 0.00 O ATOM 846 NE2 GLN A 53 3.454 4.480 -5.601 1.00 0.00 N ATOM 0 H GLN A 53 4.801 7.561 -9.010 1.00 0.00 H new ATOM 0 HA GLN A 53 5.393 4.896 -10.178 1.00 0.00 H new ATOM 0 HB2 GLN A 53 3.231 5.666 -8.149 1.00 0.00 H new ATOM 0 HB3 GLN A 53 3.529 4.059 -8.783 1.00 0.00 H new ATOM 0 HG2 GLN A 53 5.883 4.188 -7.828 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.454 5.717 -7.087 1.00 0.00 H new ATOM 0 HE21 GLN A 53 2.922 5.241 -6.023 1.00 0.00 H new ATOM 0 HE22 GLN A 53 3.151 4.076 -4.715 1.00 0.00 H new ATOM 855 N GLU A 54 3.286 4.902 -11.622 1.00 0.00 N ATOM 856 CA GLU A 54 2.316 4.999 -12.719 1.00 0.00 C ATOM 857 C GLU A 54 0.902 5.390 -12.232 1.00 0.00 C ATOM 858 O GLU A 54 0.182 4.593 -11.623 1.00 0.00 O ATOM 859 CB GLU A 54 2.309 3.717 -13.577 1.00 0.00 C ATOM 860 CG GLU A 54 2.220 2.374 -12.828 1.00 0.00 C ATOM 861 CD GLU A 54 3.613 1.814 -12.475 1.00 0.00 C ATOM 862 OE1 GLU A 54 4.192 2.220 -11.437 1.00 0.00 O ATOM 863 OE2 GLU A 54 4.138 0.963 -13.233 1.00 0.00 O ATOM 0 H GLU A 54 3.643 3.955 -11.493 1.00 0.00 H new ATOM 0 HA GLU A 54 2.644 5.816 -13.361 1.00 0.00 H new ATOM 0 HB2 GLU A 54 1.468 3.776 -14.267 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.217 3.709 -14.181 1.00 0.00 H new ATOM 0 HG2 GLU A 54 1.641 2.507 -11.914 1.00 0.00 H new ATOM 0 HG3 GLU A 54 1.684 1.651 -13.443 1.00 0.00 H new ATOM 870 N VAL A 55 0.505 6.637 -12.503 1.00 0.00 N ATOM 871 CA VAL A 55 -0.792 7.219 -12.123 1.00 0.00 C ATOM 872 C VAL A 55 -1.766 7.173 -13.298 1.00 0.00 C ATOM 873 O VAL A 55 -1.422 7.498 -14.438 1.00 0.00 O ATOM 874 CB VAL A 55 -0.650 8.682 -11.651 1.00 0.00 C ATOM 875 CG1 VAL A 55 -1.931 9.177 -10.968 1.00 0.00 C ATOM 876 CG2 VAL A 55 0.477 8.851 -10.632 1.00 0.00 C ATOM 0 H VAL A 55 1.097 7.295 -13.011 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.176 6.621 -11.296 1.00 0.00 H new ATOM 0 HB VAL A 55 -0.438 9.257 -12.552 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.797 10.210 -10.648 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -2.763 9.120 -11.670 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.145 8.553 -10.100 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.540 9.896 -10.329 1.00 0.00 H new ATOM 0 HG22 VAL A 55 0.274 8.231 -9.759 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.422 8.546 -11.081 1.00 0.00 H new ATOM 886 N PHE A 56 -3.019 6.849 -12.995 1.00 0.00 N ATOM 887 CA PHE A 56 -4.125 6.812 -13.943 1.00 0.00 C ATOM 888 C PHE A 56 -5.259 7.713 -13.442 1.00 0.00 C ATOM 889 O PHE A 56 -5.534 7.800 -12.244 1.00 0.00 O ATOM 890 CB PHE A 56 -4.583 5.358 -14.123 1.00 0.00 C ATOM 891 CG PHE A 56 -3.550 4.433 -14.749 1.00 0.00 C ATOM 892 CD1 PHE A 56 -2.463 3.957 -13.988 1.00 0.00 C ATOM 893 CD2 PHE A 56 -3.675 4.041 -16.096 1.00 0.00 C ATOM 894 CE1 PHE A 56 -1.498 3.118 -14.572 1.00 0.00 C ATOM 895 CE2 PHE A 56 -2.719 3.183 -16.675 1.00 0.00 C ATOM 896 CZ PHE A 56 -1.625 2.731 -15.917 1.00 0.00 C ATOM 0 H PHE A 56 -3.301 6.596 -12.048 1.00 0.00 H new ATOM 0 HA PHE A 56 -3.809 7.190 -14.916 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -4.864 4.958 -13.149 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -5.480 5.349 -14.742 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -2.371 4.239 -12.949 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -4.505 4.399 -16.686 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -0.659 2.771 -13.987 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -2.827 2.872 -17.704 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.884 2.088 -16.367 1.00 0.00 H new ATOM 906 N GLU A 57 -5.891 8.424 -14.370 1.00 0.00 N ATOM 907 CA GLU A 57 -7.131 9.156 -14.138 1.00 0.00 C ATOM 908 C GLU A 57 -8.309 8.178 -14.213 1.00 0.00 C ATOM 909 O GLU A 57 -8.389 7.367 -15.142 1.00 0.00 O ATOM 910 CB GLU A 57 -7.265 10.246 -15.212 1.00 0.00 C ATOM 911 CG GLU A 57 -8.533 11.104 -15.124 1.00 0.00 C ATOM 912 CD GLU A 57 -9.345 11.014 -16.433 1.00 0.00 C ATOM 913 OE1 GLU A 57 -10.143 10.061 -16.592 1.00 0.00 O ATOM 914 OE2 GLU A 57 -9.179 11.897 -17.311 1.00 0.00 O ATOM 0 H GLU A 57 -5.547 8.509 -15.327 1.00 0.00 H new ATOM 0 HA GLU A 57 -7.125 9.623 -13.153 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -6.397 10.903 -15.149 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -7.235 9.771 -16.193 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -9.146 10.771 -14.286 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -8.263 12.142 -14.928 1.00 0.00 H new ATOM 921 N TYR A 58 -9.231 8.289 -13.259 1.00 0.00 N ATOM 922 CA TYR A 58 -10.468 7.524 -13.182 1.00 0.00 C ATOM 923 C TYR A 58 -11.657 8.496 -13.163 1.00 0.00 C ATOM 924 O TYR A 58 -11.974 9.099 -12.133 1.00 0.00 O ATOM 925 CB TYR A 58 -10.426 6.628 -11.936 1.00 0.00 C ATOM 926 CG TYR A 58 -9.162 5.803 -11.769 1.00 0.00 C ATOM 927 CD1 TYR A 58 -8.978 4.611 -12.497 1.00 0.00 C ATOM 928 CD2 TYR A 58 -8.172 6.234 -10.863 1.00 0.00 C ATOM 929 CE1 TYR A 58 -7.824 3.830 -12.293 1.00 0.00 C ATOM 930 CE2 TYR A 58 -7.011 5.466 -10.671 1.00 0.00 C ATOM 931 CZ TYR A 58 -6.837 4.259 -11.377 1.00 0.00 C ATOM 932 OH TYR A 58 -5.713 3.520 -11.184 1.00 0.00 O ATOM 0 H TYR A 58 -9.129 8.945 -12.485 1.00 0.00 H new ATOM 0 HA TYR A 58 -10.584 6.876 -14.051 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -10.549 7.256 -11.054 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -11.280 5.951 -11.967 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -9.723 4.296 -13.213 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -8.306 7.155 -10.316 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -7.694 2.905 -12.835 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -6.251 5.801 -9.981 1.00 0.00 H new ATOM 0 HH TYR A 58 -5.141 3.961 -10.522 1.00 0.00 H new ATOM 942 N CYS A 59 -12.286 8.704 -14.322 1.00 0.00 N ATOM 943 CA CYS A 59 -13.485 9.530 -14.443 1.00 0.00 C ATOM 944 C CYS A 59 -14.706 8.765 -13.908 1.00 0.00 C ATOM 945 O CYS A 59 -14.898 7.593 -14.245 1.00 0.00 O ATOM 946 CB CYS A 59 -13.660 9.926 -15.913 1.00 0.00 C ATOM 947 SG CYS A 59 -14.999 11.141 -16.083 1.00 0.00 S ATOM 0 H CYS A 59 -11.975 8.301 -15.206 1.00 0.00 H new ATOM 0 HA CYS A 59 -13.386 10.437 -13.847 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -12.730 10.344 -16.297 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -13.883 9.042 -16.511 1.00 0.00 H new ATOM 0 HG CYS A 59 -15.132 11.467 -17.334 1.00 0.00 H new ATOM 953 N LEU A 60 -15.532 9.403 -13.075 1.00 0.00 N ATOM 954 CA LEU A 60 -16.758 8.798 -12.535 1.00 0.00 C ATOM 955 C LEU A 60 -18.001 9.117 -13.380 1.00 0.00 C ATOM 956 O LEU A 60 -18.023 10.067 -14.162 1.00 0.00 O ATOM 957 CB LEU A 60 -16.926 9.267 -11.079 1.00 0.00 C ATOM 958 CG LEU A 60 -16.666 8.190 -10.009 1.00 0.00 C ATOM 959 CD1 LEU A 60 -15.378 7.387 -10.181 1.00 0.00 C ATOM 960 CD2 LEU A 60 -16.570 8.852 -8.642 1.00 0.00 C ATOM 0 H LEU A 60 -15.371 10.357 -12.753 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.659 7.713 -12.569 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -16.248 10.102 -10.903 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.940 9.646 -10.951 1.00 0.00 H new ATOM 0 HG LEU A 60 -17.503 7.499 -10.112 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -15.294 6.658 -9.375 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -15.398 6.868 -11.139 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -14.522 8.061 -10.151 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -16.386 8.093 -7.882 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -15.751 9.571 -8.643 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -17.505 9.367 -8.421 1.00 0.00 H new ATOM 972 N GLU A 61 -19.066 8.332 -13.182 1.00 0.00 N ATOM 973 CA GLU A 61 -20.324 8.466 -13.948 1.00 0.00 C ATOM 974 C GLU A 61 -21.064 9.791 -13.684 1.00 0.00 C ATOM 975 O GLU A 61 -21.847 10.251 -14.517 1.00 0.00 O ATOM 976 CB GLU A 61 -21.271 7.292 -13.651 1.00 0.00 C ATOM 977 CG GLU A 61 -20.721 5.949 -14.145 1.00 0.00 C ATOM 978 CD GLU A 61 -21.798 4.849 -14.127 1.00 0.00 C ATOM 979 OE1 GLU A 61 -22.794 4.950 -14.883 1.00 0.00 O ATOM 980 OE2 GLU A 61 -21.618 3.834 -13.413 1.00 0.00 O ATOM 0 H GLU A 61 -19.087 7.585 -12.488 1.00 0.00 H new ATOM 0 HA GLU A 61 -20.032 8.459 -14.998 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -21.447 7.235 -12.577 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -22.236 7.480 -14.122 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -20.336 6.064 -15.158 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -19.882 5.647 -13.518 1.00 0.00 H new ATOM 987 N ASP A 62 -20.794 10.420 -12.537 1.00 0.00 N ATOM 988 CA ASP A 62 -21.313 11.756 -12.188 1.00 0.00 C ATOM 989 C ASP A 62 -20.549 12.900 -12.889 1.00 0.00 C ATOM 990 O ASP A 62 -21.078 14.005 -13.037 1.00 0.00 O ATOM 991 CB ASP A 62 -21.258 11.922 -10.665 1.00 0.00 C ATOM 992 CG ASP A 62 -21.871 13.247 -10.187 1.00 0.00 C ATOM 993 OD1 ASP A 62 -23.112 13.409 -10.277 1.00 0.00 O ATOM 994 OD2 ASP A 62 -21.119 14.119 -9.687 1.00 0.00 O ATOM 0 H ASP A 62 -20.202 10.015 -11.812 1.00 0.00 H new ATOM 0 HA ASP A 62 -22.342 11.822 -12.541 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -21.786 11.092 -10.195 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -20.220 11.867 -10.336 1.00 0.00 H new ATOM 999 N GLY A 63 -19.314 12.636 -13.335 1.00 0.00 N ATOM 1000 CA GLY A 63 -18.443 13.584 -14.041 1.00 0.00 C ATOM 1001 C GLY A 63 -17.188 14.000 -13.260 1.00 0.00 C ATOM 1002 O GLY A 63 -16.391 14.796 -13.767 1.00 0.00 O ATOM 0 H GLY A 63 -18.878 11.722 -13.209 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -18.136 13.140 -14.988 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -19.019 14.478 -14.281 1.00 0.00 H new ATOM 1006 N SER A 64 -17.008 13.504 -12.029 1.00 0.00 N ATOM 1007 CA SER A 64 -15.825 13.777 -11.199 1.00 0.00 C ATOM 1008 C SER A 64 -14.563 13.048 -11.692 1.00 0.00 C ATOM 1009 O SER A 64 -14.621 12.183 -12.570 1.00 0.00 O ATOM 1010 CB SER A 64 -16.114 13.452 -9.727 1.00 0.00 C ATOM 1011 OG SER A 64 -15.932 12.087 -9.422 1.00 0.00 O ATOM 0 H SER A 64 -17.688 12.894 -11.575 1.00 0.00 H new ATOM 0 HA SER A 64 -15.614 14.843 -11.290 1.00 0.00 H new ATOM 0 HB2 SER A 64 -15.461 14.051 -9.093 1.00 0.00 H new ATOM 0 HB3 SER A 64 -17.139 13.739 -9.491 1.00 0.00 H new ATOM 0 HG SER A 64 -16.127 11.935 -8.474 1.00 0.00 H new ATOM 1017 N LEU A 65 -13.413 13.386 -11.099 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.095 12.840 -11.438 1.00 0.00 C ATOM 1019 C LEU A 65 -11.331 12.418 -10.171 1.00 0.00 C ATOM 1020 O LEU A 65 -11.414 13.072 -9.126 1.00 0.00 O ATOM 1021 CB LEU A 65 -11.292 13.912 -12.203 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.836 14.308 -13.589 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.083 15.536 -14.106 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -11.653 13.185 -14.609 1.00 0.00 C ATOM 0 H LEU A 65 -13.373 14.071 -10.344 1.00 0.00 H new ATOM 0 HA LEU A 65 -12.227 11.956 -12.061 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.242 14.809 -11.585 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.270 13.552 -12.326 1.00 0.00 H new ATOM 0 HG LEU A 65 -12.899 14.517 -13.472 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.470 15.814 -15.086 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.221 16.366 -13.413 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.021 15.304 -14.187 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -12.049 13.502 -15.574 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.592 12.954 -14.710 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -12.187 12.297 -14.272 1.00 0.00 H new ATOM 1036 N ILE A 66 -10.546 11.346 -10.296 1.00 0.00 N ATOM 1037 CA ILE A 66 -9.666 10.780 -9.260 1.00 0.00 C ATOM 1038 C ILE A 66 -8.337 10.405 -9.942 1.00 0.00 C ATOM 1039 O ILE A 66 -8.356 9.902 -11.066 1.00 0.00 O ATOM 1040 CB ILE A 66 -10.333 9.546 -8.586 1.00 0.00 C ATOM 1041 CG1 ILE A 66 -11.777 9.841 -8.097 1.00 0.00 C ATOM 1042 CG2 ILE A 66 -9.463 9.039 -7.419 1.00 0.00 C ATOM 1043 CD1 ILE A 66 -12.492 8.673 -7.406 1.00 0.00 C ATOM 0 H ILE A 66 -10.501 10.818 -11.168 1.00 0.00 H new ATOM 0 HA ILE A 66 -9.484 11.505 -8.467 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.408 8.768 -9.346 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -11.743 10.683 -7.406 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -12.375 10.155 -8.953 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -9.942 8.176 -6.957 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.481 8.751 -7.795 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.350 9.831 -6.679 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -13.492 8.986 -7.104 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -12.567 7.833 -8.096 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -11.926 8.369 -6.525 1.00 0.00 H new ATOM 1055 N ARG A 67 -7.187 10.651 -9.294 1.00 0.00 N ATOM 1056 CA ARG A 67 -5.836 10.454 -9.872 1.00 0.00 C ATOM 1057 C ARG A 67 -4.947 9.664 -8.900 1.00 0.00 C ATOM 1058 O ARG A 67 -4.400 10.223 -7.946 1.00 0.00 O ATOM 1059 CB ARG A 67 -5.187 11.807 -10.244 1.00 0.00 C ATOM 1060 CG ARG A 67 -6.047 12.722 -11.138 1.00 0.00 C ATOM 1061 CD ARG A 67 -5.349 14.067 -11.407 1.00 0.00 C ATOM 1062 NE ARG A 67 -4.502 14.061 -12.618 1.00 0.00 N ATOM 1063 CZ ARG A 67 -3.497 14.879 -12.893 1.00 0.00 C ATOM 1064 NH1 ARG A 67 -3.065 15.777 -12.051 1.00 0.00 N ATOM 1065 NH2 ARG A 67 -2.898 14.831 -14.049 1.00 0.00 N ATOM 0 H ARG A 67 -7.163 10.999 -8.336 1.00 0.00 H new ATOM 0 HA ARG A 67 -5.938 9.875 -10.790 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.949 12.343 -9.325 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.243 11.612 -10.753 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -6.250 12.221 -12.084 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -7.010 12.900 -10.659 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -6.105 14.846 -11.506 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -4.735 14.327 -10.545 1.00 0.00 H new ATOM 0 HE ARG A 67 -4.714 13.350 -13.318 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -3.505 15.871 -11.136 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -2.287 16.385 -12.308 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -3.202 14.159 -14.753 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -2.125 15.466 -14.250 1.00 0.00 H new ATOM 1079 N ALA A 68 -4.830 8.355 -9.124 1.00 0.00 N ATOM 1080 CA ALA A 68 -4.146 7.431 -8.212 1.00 0.00 C ATOM 1081 C ALA A 68 -3.434 6.269 -8.927 1.00 0.00 C ATOM 1082 O ALA A 68 -3.660 5.983 -10.107 1.00 0.00 O ATOM 1083 CB ALA A 68 -5.169 6.900 -7.193 1.00 0.00 C ATOM 0 H ALA A 68 -5.211 7.899 -9.953 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.355 7.988 -7.710 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.676 6.211 -6.507 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.588 7.734 -6.630 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.969 6.378 -7.719 1.00 0.00 H new ATOM 1089 N THR A 69 -2.574 5.578 -8.178 1.00 0.00 N ATOM 1090 CA THR A 69 -1.899 4.340 -8.602 1.00 0.00 C ATOM 1091 C THR A 69 -2.793 3.120 -8.407 1.00 0.00 C ATOM 1092 O THR A 69 -3.611 3.088 -7.488 1.00 0.00 O ATOM 1093 CB THR A 69 -0.635 4.103 -7.765 1.00 0.00 C ATOM 1094 OG1 THR A 69 -0.921 4.185 -6.384 1.00 0.00 O ATOM 1095 CG2 THR A 69 0.438 5.129 -8.078 1.00 0.00 C ATOM 0 H THR A 69 -2.318 5.867 -7.234 1.00 0.00 H new ATOM 0 HA THR A 69 -1.657 4.465 -9.657 1.00 0.00 H new ATOM 0 HB THR A 69 -0.277 3.105 -8.018 1.00 0.00 H new ATOM 0 HG1 THR A 69 -0.702 3.332 -5.953 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.319 4.932 -7.468 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.705 5.066 -9.133 1.00 0.00 H new ATOM 0 HG23 THR A 69 0.061 6.128 -7.859 1.00 0.00 H new ATOM 1103 N LYS A 70 -2.539 2.060 -9.179 1.00 0.00 N ATOM 1104 CA LYS A 70 -3.271 0.782 -9.089 1.00 0.00 C ATOM 1105 C LYS A 70 -3.152 0.071 -7.739 1.00 0.00 C ATOM 1106 O LYS A 70 -4.017 -0.728 -7.395 1.00 0.00 O ATOM 1107 CB LYS A 70 -2.803 -0.180 -10.195 1.00 0.00 C ATOM 1108 CG LYS A 70 -3.622 -0.091 -11.489 1.00 0.00 C ATOM 1109 CD LYS A 70 -3.229 1.069 -12.408 1.00 0.00 C ATOM 1110 CE LYS A 70 -3.861 0.878 -13.796 1.00 0.00 C ATOM 1111 NZ LYS A 70 -3.242 -0.263 -14.534 1.00 0.00 N ATOM 0 H LYS A 70 -1.812 2.059 -9.894 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.321 1.049 -9.211 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.758 0.028 -10.424 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -2.850 -1.201 -9.817 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -3.514 -1.026 -12.038 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.677 0.007 -11.231 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.559 2.014 -11.976 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.144 1.121 -12.498 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.931 0.703 -13.687 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.745 1.793 -14.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.373 -0.127 -15.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -2.226 -0.306 -14.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.696 -1.152 -14.242 1.00 0.00 H new ATOM 1125 N ASP A 71 -2.091 0.345 -6.983 1.00 0.00 N ATOM 1126 CA ASP A 71 -1.765 -0.347 -5.732 1.00 0.00 C ATOM 1127 C ASP A 71 -2.459 0.277 -4.515 1.00 0.00 C ATOM 1128 O ASP A 71 -2.440 -0.306 -3.428 1.00 0.00 O ATOM 1129 CB ASP A 71 -0.247 -0.315 -5.523 1.00 0.00 C ATOM 1130 CG ASP A 71 0.503 -1.213 -6.516 1.00 0.00 C ATOM 1131 OD1 ASP A 71 0.571 -2.445 -6.282 1.00 0.00 O ATOM 1132 OD2 ASP A 71 1.039 -0.695 -7.527 1.00 0.00 O ATOM 0 H ASP A 71 -1.417 1.071 -7.226 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.125 -1.372 -5.819 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.109 0.710 -5.625 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.017 -0.632 -4.506 1.00 0.00 H new ATOM 1137 N HIS A 72 -3.061 1.464 -4.673 1.00 0.00 N ATOM 1138 CA HIS A 72 -3.809 2.095 -3.590 1.00 0.00 C ATOM 1139 C HIS A 72 -5.199 1.435 -3.528 1.00 0.00 C ATOM 1140 O HIS A 72 -5.867 1.278 -4.559 1.00 0.00 O ATOM 1141 CB HIS A 72 -3.929 3.604 -3.851 1.00 0.00 C ATOM 1142 CG HIS A 72 -4.374 4.407 -2.645 1.00 0.00 C ATOM 1143 ND1 HIS A 72 -5.418 4.162 -1.780 1.00 0.00 N ATOM 1144 CD2 HIS A 72 -3.718 5.489 -2.129 1.00 0.00 C ATOM 1145 CE1 HIS A 72 -5.356 5.042 -0.769 1.00 0.00 C ATOM 1146 NE2 HIS A 72 -4.335 5.889 -0.942 1.00 0.00 N ATOM 0 H HIS A 72 -3.042 2.001 -5.540 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.297 1.962 -2.637 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -2.964 3.981 -4.189 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.637 3.766 -4.664 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -6.122 3.432 -1.890 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -2.854 5.962 -2.572 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -6.037 5.064 0.069 1.00 0.00 H new ATOM 1154 N LYS A 73 -5.644 1.040 -2.333 1.00 0.00 N ATOM 1155 CA LYS A 73 -6.967 0.432 -2.130 1.00 0.00 C ATOM 1156 C LYS A 73 -8.034 1.501 -1.899 1.00 0.00 C ATOM 1157 O LYS A 73 -7.733 2.656 -1.600 1.00 0.00 O ATOM 1158 CB LYS A 73 -6.899 -0.595 -0.985 1.00 0.00 C ATOM 1159 CG LYS A 73 -6.019 -1.801 -1.362 1.00 0.00 C ATOM 1160 CD LYS A 73 -5.318 -2.414 -0.148 1.00 0.00 C ATOM 1161 CE LYS A 73 -4.333 -3.483 -0.631 1.00 0.00 C ATOM 1162 NZ LYS A 73 -4.953 -4.835 -0.729 1.00 0.00 N ATOM 0 H LYS A 73 -5.099 1.132 -1.476 1.00 0.00 H new ATOM 0 HA LYS A 73 -7.261 -0.101 -3.034 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -6.500 -0.118 -0.090 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -7.905 -0.938 -0.742 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -6.635 -2.560 -1.844 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -5.271 -1.488 -2.090 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -4.791 -1.642 0.413 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -6.051 -2.855 0.528 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -3.941 -3.196 -1.607 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -3.485 -3.525 0.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -4.243 -5.519 -1.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -5.304 -5.125 0.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -5.745 -4.806 -1.402 1.00 0.00 H new ATOM 1176 N PHE A 74 -9.295 1.129 -2.053 1.00 0.00 N ATOM 1177 CA PHE A 74 -10.429 2.002 -1.755 1.00 0.00 C ATOM 1178 C PHE A 74 -11.506 1.185 -1.041 1.00 0.00 C ATOM 1179 O PHE A 74 -11.721 0.011 -1.356 1.00 0.00 O ATOM 1180 CB PHE A 74 -10.959 2.669 -3.036 1.00 0.00 C ATOM 1181 CG PHE A 74 -10.055 3.713 -3.684 1.00 0.00 C ATOM 1182 CD1 PHE A 74 -8.907 3.335 -4.415 1.00 0.00 C ATOM 1183 CD2 PHE A 74 -10.389 5.080 -3.589 1.00 0.00 C ATOM 1184 CE1 PHE A 74 -8.086 4.311 -5.005 1.00 0.00 C ATOM 1185 CE2 PHE A 74 -9.586 6.051 -4.210 1.00 0.00 C ATOM 1186 CZ PHE A 74 -8.426 5.671 -4.907 1.00 0.00 C ATOM 0 H PHE A 74 -9.567 0.206 -2.391 1.00 0.00 H new ATOM 0 HA PHE A 74 -10.113 2.810 -1.096 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.159 1.888 -3.770 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -11.914 3.141 -2.805 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -8.659 2.289 -4.521 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -11.266 5.382 -3.036 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -7.192 4.015 -5.535 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -9.861 7.094 -4.152 1.00 0.00 H new ATOM 0 HZ PHE A 74 -7.799 6.421 -5.365 1.00 0.00 H new ATOM 1196 N MET A 75 -12.159 1.797 -0.050 1.00 0.00 N ATOM 1197 CA MET A 75 -13.250 1.172 0.691 1.00 0.00 C ATOM 1198 C MET A 75 -14.468 1.036 -0.232 1.00 0.00 C ATOM 1199 O MET A 75 -15.115 2.030 -0.579 1.00 0.00 O ATOM 1200 CB MET A 75 -13.553 1.982 1.955 1.00 0.00 C ATOM 1201 CG MET A 75 -14.648 1.339 2.813 1.00 0.00 C ATOM 1202 SD MET A 75 -15.117 2.306 4.276 1.00 0.00 S ATOM 1203 CE MET A 75 -13.932 1.701 5.510 1.00 0.00 C ATOM 0 H MET A 75 -11.942 2.744 0.260 1.00 0.00 H new ATOM 0 HA MET A 75 -12.969 0.171 1.018 1.00 0.00 H new ATOM 0 HB2 MET A 75 -12.643 2.081 2.547 1.00 0.00 H new ATOM 0 HB3 MET A 75 -13.861 2.989 1.673 1.00 0.00 H new ATOM 0 HG2 MET A 75 -15.533 1.184 2.196 1.00 0.00 H new ATOM 0 HG3 MET A 75 -14.309 0.355 3.136 1.00 0.00 H new ATOM 0 HE1 MET A 75 -14.104 2.209 6.459 1.00 0.00 H new ATOM 0 HE2 MET A 75 -14.063 0.627 5.644 1.00 0.00 H new ATOM 0 HE3 MET A 75 -12.917 1.903 5.169 1.00 0.00 H new ATOM 1213 N THR A 76 -14.772 -0.189 -0.662 1.00 0.00 N ATOM 1214 CA THR A 76 -15.969 -0.466 -1.474 1.00 0.00 C ATOM 1215 C THR A 76 -17.243 -0.240 -0.669 1.00 0.00 C ATOM 1216 O THR A 76 -17.218 -0.177 0.562 1.00 0.00 O ATOM 1217 CB THR A 76 -15.985 -1.898 -2.019 1.00 0.00 C ATOM 1218 OG1 THR A 76 -15.907 -2.839 -0.972 1.00 0.00 O ATOM 1219 CG2 THR A 76 -14.833 -2.128 -2.988 1.00 0.00 C ATOM 0 H THR A 76 -14.205 -1.013 -0.463 1.00 0.00 H new ATOM 0 HA THR A 76 -15.930 0.228 -2.314 1.00 0.00 H new ATOM 0 HB THR A 76 -16.928 -2.031 -2.549 1.00 0.00 H new ATOM 0 HG1 THR A 76 -15.921 -3.745 -1.345 1.00 0.00 H new ATOM 0 HG21 THR A 76 -14.869 -3.152 -3.359 1.00 0.00 H new ATOM 0 HG22 THR A 76 -14.918 -1.435 -3.825 1.00 0.00 H new ATOM 0 HG23 THR A 76 -13.886 -1.961 -2.474 1.00 0.00 H new ATOM 1227 N VAL A 77 -18.388 -0.184 -1.351 1.00 0.00 N ATOM 1228 CA VAL A 77 -19.703 -0.130 -0.685 1.00 0.00 C ATOM 1229 C VAL A 77 -19.982 -1.310 0.262 1.00 0.00 C ATOM 1230 O VAL A 77 -20.759 -1.168 1.208 1.00 0.00 O ATOM 1231 CB VAL A 77 -20.855 0.005 -1.695 1.00 0.00 C ATOM 1232 CG1 VAL A 77 -20.819 1.392 -2.339 1.00 0.00 C ATOM 1233 CG2 VAL A 77 -20.821 -1.070 -2.789 1.00 0.00 C ATOM 0 H VAL A 77 -18.437 -0.175 -2.370 1.00 0.00 H new ATOM 0 HA VAL A 77 -19.654 0.767 -0.068 1.00 0.00 H new ATOM 0 HB VAL A 77 -21.782 -0.133 -1.138 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -21.637 1.483 -3.054 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -20.925 2.154 -1.567 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -19.869 1.529 -2.856 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -21.658 -0.922 -3.471 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -19.885 -0.996 -3.343 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -20.895 -2.057 -2.332 1.00 0.00 H new ATOM 1243 N ASP A 78 -19.329 -2.457 0.047 1.00 0.00 N ATOM 1244 CA ASP A 78 -19.390 -3.628 0.933 1.00 0.00 C ATOM 1245 C ASP A 78 -18.512 -3.490 2.197 1.00 0.00 C ATOM 1246 O ASP A 78 -18.656 -4.273 3.141 1.00 0.00 O ATOM 1247 CB ASP A 78 -18.951 -4.875 0.151 1.00 0.00 C ATOM 1248 CG ASP A 78 -19.814 -5.125 -1.094 1.00 0.00 C ATOM 1249 OD1 ASP A 78 -20.992 -5.536 -0.947 1.00 0.00 O ATOM 1250 OD2 ASP A 78 -19.308 -4.927 -2.226 1.00 0.00 O ATOM 0 H ASP A 78 -18.730 -2.602 -0.765 1.00 0.00 H new ATOM 0 HA ASP A 78 -20.422 -3.714 1.272 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.909 -4.763 -0.150 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -19.002 -5.746 0.805 1.00 0.00 H new ATOM 1255 N GLY A 79 -17.594 -2.515 2.222 1.00 0.00 N ATOM 1256 CA GLY A 79 -16.646 -2.275 3.319 1.00 0.00 C ATOM 1257 C GLY A 79 -15.299 -2.998 3.163 1.00 0.00 C ATOM 1258 O GLY A 79 -14.520 -3.046 4.118 1.00 0.00 O ATOM 0 H GLY A 79 -17.487 -1.850 1.456 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -16.463 -1.203 3.397 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -17.106 -2.588 4.256 1.00 0.00 H new ATOM 1262 N GLN A 80 -15.018 -3.576 1.988 1.00 0.00 N ATOM 1263 CA GLN A 80 -13.747 -4.256 1.685 1.00 0.00 C ATOM 1264 C GLN A 80 -12.658 -3.254 1.257 1.00 0.00 C ATOM 1265 O GLN A 80 -12.969 -2.128 0.870 1.00 0.00 O ATOM 1266 CB GLN A 80 -13.959 -5.312 0.586 1.00 0.00 C ATOM 1267 CG GLN A 80 -15.007 -6.372 0.965 1.00 0.00 C ATOM 1268 CD GLN A 80 -15.014 -7.533 -0.029 1.00 0.00 C ATOM 1269 OE1 GLN A 80 -14.410 -8.576 0.191 1.00 0.00 O ATOM 1270 NE2 GLN A 80 -15.675 -7.404 -1.160 1.00 0.00 N ATOM 0 H GLN A 80 -15.675 -3.586 1.208 1.00 0.00 H new ATOM 0 HA GLN A 80 -13.407 -4.749 2.596 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -14.269 -4.815 -0.333 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -13.010 -5.806 0.376 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -14.798 -6.750 1.966 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -15.995 -5.913 0.997 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -16.183 -6.542 -1.358 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -15.679 -8.166 -1.838 1.00 0.00 H new ATOM 1279 N MET A 81 -11.386 -3.674 1.267 1.00 0.00 N ATOM 1280 CA MET A 81 -10.219 -2.840 0.935 1.00 0.00 C ATOM 1281 C MET A 81 -9.425 -3.432 -0.240 1.00 0.00 C ATOM 1282 O MET A 81 -8.430 -4.140 -0.067 1.00 0.00 O ATOM 1283 CB MET A 81 -9.372 -2.528 2.189 1.00 0.00 C ATOM 1284 CG MET A 81 -8.742 -3.723 2.929 1.00 0.00 C ATOM 1285 SD MET A 81 -9.350 -4.074 4.607 1.00 0.00 S ATOM 1286 CE MET A 81 -10.795 -5.110 4.248 1.00 0.00 C ATOM 0 H MET A 81 -11.131 -4.631 1.513 1.00 0.00 H new ATOM 0 HA MET A 81 -10.571 -1.870 0.583 1.00 0.00 H new ATOM 0 HB2 MET A 81 -8.569 -1.852 1.895 1.00 0.00 H new ATOM 0 HB3 MET A 81 -10.001 -1.987 2.896 1.00 0.00 H new ATOM 0 HG2 MET A 81 -8.893 -4.615 2.321 1.00 0.00 H new ATOM 0 HG3 MET A 81 -7.666 -3.556 2.987 1.00 0.00 H new ATOM 0 HE1 MET A 81 -10.963 -5.800 5.075 1.00 0.00 H new ATOM 0 HE2 MET A 81 -11.673 -4.477 4.119 1.00 0.00 H new ATOM 0 HE3 MET A 81 -10.619 -5.676 3.333 1.00 0.00 H new ATOM 1296 N LEU A 82 -9.899 -3.158 -1.461 1.00 0.00 N ATOM 1297 CA LEU A 82 -9.384 -3.747 -2.707 1.00 0.00 C ATOM 1298 C LEU A 82 -8.708 -2.673 -3.581 1.00 0.00 C ATOM 1299 O LEU A 82 -9.128 -1.513 -3.539 1.00 0.00 O ATOM 1300 CB LEU A 82 -10.542 -4.409 -3.490 1.00 0.00 C ATOM 1301 CG LEU A 82 -11.488 -5.322 -2.683 1.00 0.00 C ATOM 1302 CD1 LEU A 82 -12.597 -5.851 -3.591 1.00 0.00 C ATOM 1303 CD2 LEU A 82 -10.764 -6.518 -2.063 1.00 0.00 C ATOM 0 H LEU A 82 -10.668 -2.506 -1.616 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.640 -4.502 -2.452 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.139 -3.620 -3.948 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.113 -4.996 -4.302 1.00 0.00 H new ATOM 0 HG LEU A 82 -11.897 -4.714 -1.876 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -13.262 -6.495 -3.016 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -13.165 -5.014 -3.998 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -12.157 -6.422 -4.409 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -11.477 -7.127 -1.507 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -10.312 -7.119 -2.852 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.986 -6.162 -1.388 1.00 0.00 H new ATOM 1315 N PRO A 83 -7.671 -3.032 -4.368 1.00 0.00 N ATOM 1316 CA PRO A 83 -6.973 -2.091 -5.243 1.00 0.00 C ATOM 1317 C PRO A 83 -7.888 -1.591 -6.361 1.00 0.00 C ATOM 1318 O PRO A 83 -8.711 -2.341 -6.886 1.00 0.00 O ATOM 1319 CB PRO A 83 -5.769 -2.853 -5.802 1.00 0.00 C ATOM 1320 CG PRO A 83 -6.177 -4.318 -5.705 1.00 0.00 C ATOM 1321 CD PRO A 83 -7.099 -4.365 -4.490 1.00 0.00 C ATOM 0 HA PRO A 83 -6.657 -1.201 -4.699 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -5.559 -2.565 -6.832 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -4.867 -2.652 -5.224 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -6.689 -4.650 -6.608 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -5.310 -4.966 -5.574 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -7.880 -5.114 -4.622 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -6.546 -4.636 -3.591 1.00 0.00 H new ATOM 1329 N ILE A 84 -7.716 -0.335 -6.774 1.00 0.00 N ATOM 1330 CA ILE A 84 -8.516 0.274 -7.850 1.00 0.00 C ATOM 1331 C ILE A 84 -8.433 -0.469 -9.200 1.00 0.00 C ATOM 1332 O ILE A 84 -9.394 -0.468 -9.970 1.00 0.00 O ATOM 1333 CB ILE A 84 -8.178 1.771 -7.962 1.00 0.00 C ATOM 1334 CG1 ILE A 84 -9.144 2.461 -8.937 1.00 0.00 C ATOM 1335 CG2 ILE A 84 -6.717 2.007 -8.363 1.00 0.00 C ATOM 1336 CD1 ILE A 84 -9.396 3.927 -8.585 1.00 0.00 C ATOM 0 H ILE A 84 -7.019 0.294 -6.375 1.00 0.00 H new ATOM 0 HA ILE A 84 -9.565 0.174 -7.571 1.00 0.00 H new ATOM 0 HB ILE A 84 -8.303 2.215 -6.974 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -8.739 2.399 -9.947 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.093 1.925 -8.941 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.526 3.078 -8.429 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -6.059 1.567 -7.614 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -6.526 1.544 -9.331 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -10.086 4.362 -9.309 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.829 3.992 -7.587 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -8.453 4.474 -8.608 1.00 0.00 H new ATOM 1348 N ASP A 85 -7.331 -1.187 -9.442 1.00 0.00 N ATOM 1349 CA ASP A 85 -7.175 -2.114 -10.574 1.00 0.00 C ATOM 1350 C ASP A 85 -8.263 -3.203 -10.615 1.00 0.00 C ATOM 1351 O ASP A 85 -8.717 -3.604 -11.689 1.00 0.00 O ATOM 1352 CB ASP A 85 -5.804 -2.794 -10.468 1.00 0.00 C ATOM 1353 CG ASP A 85 -5.440 -3.571 -11.745 1.00 0.00 C ATOM 1354 OD1 ASP A 85 -5.348 -2.950 -12.832 1.00 0.00 O ATOM 1355 OD2 ASP A 85 -5.207 -4.801 -11.659 1.00 0.00 O ATOM 0 H ASP A 85 -6.505 -1.141 -8.846 1.00 0.00 H new ATOM 0 HA ASP A 85 -7.266 -1.528 -11.488 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -5.041 -2.041 -10.273 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -5.803 -3.476 -9.617 1.00 0.00 H new ATOM 1360 N GLU A 86 -8.700 -3.660 -9.439 1.00 0.00 N ATOM 1361 CA GLU A 86 -9.758 -4.662 -9.278 1.00 0.00 C ATOM 1362 C GLU A 86 -11.150 -4.022 -9.403 1.00 0.00 C ATOM 1363 O GLU A 86 -12.053 -4.595 -10.017 1.00 0.00 O ATOM 1364 CB GLU A 86 -9.611 -5.339 -7.899 1.00 0.00 C ATOM 1365 CG GLU A 86 -10.000 -6.820 -7.890 1.00 0.00 C ATOM 1366 CD GLU A 86 -8.817 -7.726 -8.292 1.00 0.00 C ATOM 1367 OE1 GLU A 86 -8.382 -7.697 -9.467 1.00 0.00 O ATOM 1368 OE2 GLU A 86 -8.314 -8.486 -7.428 1.00 0.00 O ATOM 0 H GLU A 86 -8.319 -3.336 -8.550 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.658 -5.406 -10.068 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -8.577 -5.243 -7.566 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -10.229 -4.807 -7.176 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -10.349 -7.098 -6.896 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -10.831 -6.982 -8.576 1.00 0.00 H new ATOM 1375 N ILE A 87 -11.319 -2.813 -8.851 1.00 0.00 N ATOM 1376 CA ILE A 87 -12.601 -2.097 -8.797 1.00 0.00 C ATOM 1377 C ILE A 87 -13.090 -1.744 -10.205 1.00 0.00 C ATOM 1378 O ILE A 87 -14.278 -1.878 -10.503 1.00 0.00 O ATOM 1379 CB ILE A 87 -12.455 -0.840 -7.909 1.00 0.00 C ATOM 1380 CG1 ILE A 87 -12.024 -1.236 -6.476 1.00 0.00 C ATOM 1381 CG2 ILE A 87 -13.781 -0.063 -7.864 1.00 0.00 C ATOM 1382 CD1 ILE A 87 -11.557 -0.068 -5.598 1.00 0.00 C ATOM 0 H ILE A 87 -10.553 -2.295 -8.421 1.00 0.00 H new ATOM 0 HA ILE A 87 -13.356 -2.745 -8.352 1.00 0.00 H new ATOM 0 HB ILE A 87 -11.685 -0.201 -8.341 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -12.862 -1.730 -5.983 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.218 -1.966 -6.543 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -13.664 0.820 -7.235 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -14.057 0.244 -8.873 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -14.563 -0.701 -7.452 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -11.276 -0.442 -4.614 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -10.697 0.415 -6.062 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -12.366 0.655 -5.494 1.00 0.00 H new ATOM 1394 N PHE A 88 -12.173 -1.343 -11.090 1.00 0.00 N ATOM 1395 CA PHE A 88 -12.468 -1.066 -12.499 1.00 0.00 C ATOM 1396 C PHE A 88 -12.944 -2.311 -13.281 1.00 0.00 C ATOM 1397 O PHE A 88 -13.806 -2.189 -14.152 1.00 0.00 O ATOM 1398 CB PHE A 88 -11.224 -0.445 -13.148 1.00 0.00 C ATOM 1399 CG PHE A 88 -11.374 -0.118 -14.625 1.00 0.00 C ATOM 1400 CD1 PHE A 88 -12.295 0.858 -15.052 1.00 0.00 C ATOM 1401 CD2 PHE A 88 -10.597 -0.803 -15.579 1.00 0.00 C ATOM 1402 CE1 PHE A 88 -12.420 1.168 -16.417 1.00 0.00 C ATOM 1403 CE2 PHE A 88 -10.722 -0.495 -16.947 1.00 0.00 C ATOM 1404 CZ PHE A 88 -11.629 0.494 -17.365 1.00 0.00 C ATOM 0 H PHE A 88 -11.193 -1.200 -10.845 1.00 0.00 H new ATOM 0 HA PHE A 88 -13.303 -0.366 -12.537 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -10.969 0.469 -12.612 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -10.386 -1.131 -13.025 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -12.909 1.371 -14.326 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -9.903 -1.567 -15.260 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -13.123 1.923 -16.738 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -10.121 -1.019 -17.675 1.00 0.00 H new ATOM 0 HZ PHE A 88 -11.719 0.736 -18.414 1.00 0.00 H new ATOM 1414 N GLU A 89 -12.432 -3.509 -12.967 1.00 0.00 N ATOM 1415 CA GLU A 89 -12.842 -4.754 -13.643 1.00 0.00 C ATOM 1416 C GLU A 89 -14.205 -5.279 -13.163 1.00 0.00 C ATOM 1417 O GLU A 89 -15.061 -5.598 -13.994 1.00 0.00 O ATOM 1418 CB GLU A 89 -11.786 -5.861 -13.467 1.00 0.00 C ATOM 1419 CG GLU A 89 -10.575 -5.666 -14.388 1.00 0.00 C ATOM 1420 CD GLU A 89 -9.805 -6.990 -14.560 1.00 0.00 C ATOM 1421 OE1 GLU A 89 -8.975 -7.343 -13.689 1.00 0.00 O ATOM 1422 OE2 GLU A 89 -10.032 -7.697 -15.573 1.00 0.00 O ATOM 0 H GLU A 89 -11.727 -3.645 -12.243 1.00 0.00 H new ATOM 0 HA GLU A 89 -12.934 -4.496 -14.698 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -11.451 -5.878 -12.430 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -12.242 -6.830 -13.671 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -10.906 -5.303 -15.361 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -9.914 -4.906 -13.972 1.00 0.00 H new ATOM 1429 N ARG A 90 -14.431 -5.362 -11.842 1.00 0.00 N ATOM 1430 CA ARG A 90 -15.718 -5.771 -11.259 1.00 0.00 C ATOM 1431 C ARG A 90 -16.804 -4.689 -11.348 1.00 0.00 C ATOM 1432 O ARG A 90 -17.976 -4.992 -11.123 1.00 0.00 O ATOM 1433 CB ARG A 90 -15.501 -6.215 -9.804 1.00 0.00 C ATOM 1434 CG ARG A 90 -14.811 -7.579 -9.672 1.00 0.00 C ATOM 1435 CD ARG A 90 -13.329 -7.630 -10.044 1.00 0.00 C ATOM 1436 NE ARG A 90 -12.722 -8.920 -9.663 1.00 0.00 N ATOM 1437 CZ ARG A 90 -11.590 -9.427 -10.117 1.00 0.00 C ATOM 1438 NH1 ARG A 90 -10.896 -8.847 -11.053 1.00 0.00 N ATOM 1439 NH2 ARG A 90 -11.124 -10.540 -9.624 1.00 0.00 N ATOM 0 H ARG A 90 -13.720 -5.145 -11.144 1.00 0.00 H new ATOM 0 HA ARG A 90 -16.090 -6.606 -11.852 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -14.902 -5.463 -9.290 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -16.466 -6.255 -9.298 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -14.916 -7.917 -8.641 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -15.345 -8.294 -10.298 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -13.216 -7.476 -11.117 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -12.800 -6.817 -9.548 1.00 0.00 H new ATOM 0 HE ARG A 90 -13.230 -9.479 -8.977 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -11.222 -7.971 -11.461 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -10.026 -9.269 -11.378 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -11.634 -11.023 -8.884 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -10.249 -10.928 -9.978 1.00 0.00 H new ATOM 1453 N GLU A 91 -16.433 -3.450 -11.688 1.00 0.00 N ATOM 1454 CA GLU A 91 -17.325 -2.282 -11.782 1.00 0.00 C ATOM 1455 C GLU A 91 -18.060 -1.991 -10.453 1.00 0.00 C ATOM 1456 O GLU A 91 -19.232 -1.602 -10.433 1.00 0.00 O ATOM 1457 CB GLU A 91 -18.263 -2.399 -13.001 1.00 0.00 C ATOM 1458 CG GLU A 91 -17.521 -2.643 -14.324 1.00 0.00 C ATOM 1459 CD GLU A 91 -18.481 -2.539 -15.523 1.00 0.00 C ATOM 1460 OE1 GLU A 91 -19.275 -3.481 -15.760 1.00 0.00 O ATOM 1461 OE2 GLU A 91 -18.446 -1.513 -16.247 1.00 0.00 O ATOM 0 H GLU A 91 -15.465 -3.221 -11.915 1.00 0.00 H new ATOM 0 HA GLU A 91 -16.707 -1.401 -11.954 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -18.966 -3.215 -12.832 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -18.851 -1.485 -13.086 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -16.717 -1.915 -14.433 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -17.058 -3.630 -14.309 1.00 0.00 H new ATOM 1468 N LEU A 92 -17.373 -2.225 -9.327 1.00 0.00 N ATOM 1469 CA LEU A 92 -17.902 -1.999 -7.977 1.00 0.00 C ATOM 1470 C LEU A 92 -17.904 -0.507 -7.606 1.00 0.00 C ATOM 1471 O LEU A 92 -17.020 0.258 -7.999 1.00 0.00 O ATOM 1472 CB LEU A 92 -17.080 -2.812 -6.958 1.00 0.00 C ATOM 1473 CG LEU A 92 -17.306 -4.332 -7.067 1.00 0.00 C ATOM 1474 CD1 LEU A 92 -16.234 -5.085 -6.279 1.00 0.00 C ATOM 1475 CD2 LEU A 92 -18.676 -4.761 -6.537 1.00 0.00 C ATOM 0 H LEU A 92 -16.418 -2.583 -9.330 1.00 0.00 H new ATOM 0 HA LEU A 92 -18.939 -2.335 -7.957 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -16.021 -2.598 -7.102 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -17.337 -2.485 -5.951 1.00 0.00 H new ATOM 0 HG LEU A 92 -17.252 -4.575 -8.128 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -16.406 -6.158 -6.365 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -15.250 -4.842 -6.680 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -16.281 -4.793 -5.230 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -18.783 -5.841 -6.637 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -18.763 -4.484 -5.486 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -19.459 -4.264 -7.109 1.00 0.00 H new ATOM 1487 N ASP A 93 -18.896 -0.099 -6.813 1.00 0.00 N ATOM 1488 CA ASP A 93 -19.004 1.263 -6.282 1.00 0.00 C ATOM 1489 C ASP A 93 -18.138 1.463 -5.018 1.00 0.00 C ATOM 1490 O ASP A 93 -17.734 0.503 -4.350 1.00 0.00 O ATOM 1491 CB ASP A 93 -20.473 1.569 -5.968 1.00 0.00 C ATOM 1492 CG ASP A 93 -21.394 1.405 -7.190 1.00 0.00 C ATOM 1493 OD1 ASP A 93 -21.300 2.219 -8.137 1.00 0.00 O ATOM 1494 OD2 ASP A 93 -22.244 0.482 -7.183 1.00 0.00 O ATOM 0 H ASP A 93 -19.656 -0.711 -6.517 1.00 0.00 H new ATOM 0 HA ASP A 93 -18.632 1.952 -7.040 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -20.814 0.908 -5.171 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -20.554 2.589 -5.593 1.00 0.00 H new ATOM 1499 N LEU A 94 -17.916 2.728 -4.642 1.00 0.00 N ATOM 1500 CA LEU A 94 -17.110 3.121 -3.478 1.00 0.00 C ATOM 1501 C LEU A 94 -17.978 3.730 -2.366 1.00 0.00 C ATOM 1502 O LEU A 94 -18.992 4.388 -2.627 1.00 0.00 O ATOM 1503 CB LEU A 94 -16.006 4.096 -3.932 1.00 0.00 C ATOM 1504 CG LEU A 94 -15.030 3.510 -4.972 1.00 0.00 C ATOM 1505 CD1 LEU A 94 -13.968 4.547 -5.337 1.00 0.00 C ATOM 1506 CD2 LEU A 94 -14.331 2.249 -4.459 1.00 0.00 C ATOM 0 H LEU A 94 -18.300 3.525 -5.149 1.00 0.00 H new ATOM 0 HA LEU A 94 -16.646 2.231 -3.054 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -16.474 4.986 -4.352 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -15.438 4.416 -3.058 1.00 0.00 H new ATOM 0 HG LEU A 94 -15.620 3.243 -5.849 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -13.284 4.124 -6.072 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -14.450 5.430 -5.757 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -13.412 4.828 -4.443 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -13.653 1.871 -5.225 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -13.764 2.488 -3.559 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -15.077 1.488 -4.227 1.00 0.00 H new ATOM 1518 N MET A 95 -17.587 3.512 -1.108 1.00 0.00 N ATOM 1519 CA MET A 95 -18.265 4.111 0.048 1.00 0.00 C ATOM 1520 C MET A 95 -17.912 5.605 0.171 1.00 0.00 C ATOM 1521 O MET A 95 -16.763 5.986 -0.062 1.00 0.00 O ATOM 1522 CB MET A 95 -17.912 3.347 1.334 1.00 0.00 C ATOM 1523 CG MET A 95 -19.000 3.573 2.397 1.00 0.00 C ATOM 1524 SD MET A 95 -18.686 2.898 4.049 1.00 0.00 S ATOM 1525 CE MET A 95 -18.440 1.140 3.685 1.00 0.00 C ATOM 0 H MET A 95 -16.795 2.918 -0.861 1.00 0.00 H new ATOM 0 HA MET A 95 -19.342 4.035 -0.103 1.00 0.00 H new ATOM 0 HB2 MET A 95 -17.817 2.282 1.120 1.00 0.00 H new ATOM 0 HB3 MET A 95 -16.947 3.683 1.713 1.00 0.00 H new ATOM 0 HG2 MET A 95 -19.161 4.647 2.494 1.00 0.00 H new ATOM 0 HG3 MET A 95 -19.931 3.143 2.026 1.00 0.00 H new ATOM 0 HE1 MET A 95 -18.291 0.593 4.616 1.00 0.00 H new ATOM 0 HE2 MET A 95 -19.318 0.749 3.171 1.00 0.00 H new ATOM 0 HE3 MET A 95 -17.563 1.019 3.049 1.00 0.00 H new ATOM 1535 N ARG A 96 -18.893 6.439 0.557 1.00 0.00 N ATOM 1536 CA ARG A 96 -18.743 7.907 0.690 1.00 0.00 C ATOM 1537 C ARG A 96 -19.162 8.433 2.075 1.00 0.00 C ATOM 1538 O ARG A 96 -19.752 7.704 2.876 1.00 0.00 O ATOM 1539 CB ARG A 96 -19.517 8.664 -0.417 1.00 0.00 C ATOM 1540 CG ARG A 96 -19.426 8.104 -1.849 1.00 0.00 C ATOM 1541 CD ARG A 96 -20.759 7.507 -2.318 1.00 0.00 C ATOM 1542 NE ARG A 96 -21.133 6.317 -1.522 1.00 0.00 N ATOM 1543 CZ ARG A 96 -22.069 6.230 -0.586 1.00 0.00 C ATOM 1544 NH1 ARG A 96 -22.945 7.163 -0.372 1.00 0.00 N ATOM 1545 NH2 ARG A 96 -22.142 5.179 0.183 1.00 0.00 N ATOM 0 H ARG A 96 -19.830 6.111 0.790 1.00 0.00 H new ATOM 0 HA ARG A 96 -17.677 8.103 0.574 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -20.569 8.695 -0.133 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -19.161 9.694 -0.434 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -19.125 8.899 -2.531 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -18.651 7.338 -1.890 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -21.543 8.260 -2.239 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -20.685 7.233 -3.370 1.00 0.00 H new ATOM 0 HE ARG A 96 -20.610 5.463 -1.716 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -22.934 8.012 -0.937 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -23.645 7.047 0.361 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -21.476 4.415 0.067 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -22.865 5.121 0.900 1.00 0.00 H new ATOM 1559 N VAL A 97 -18.919 9.729 2.311 1.00 0.00 N ATOM 1560 CA VAL A 97 -19.283 10.480 3.541 1.00 0.00 C ATOM 1561 C VAL A 97 -20.215 11.680 3.284 1.00 0.00 C ATOM 1562 O VAL A 97 -20.945 12.104 4.180 1.00 0.00 O ATOM 1563 CB VAL A 97 -18.007 10.873 4.326 1.00 0.00 C ATOM 1564 CG1 VAL A 97 -17.033 11.775 3.559 1.00 0.00 C ATOM 1565 CG2 VAL A 97 -18.270 11.550 5.671 1.00 0.00 C ATOM 0 H VAL A 97 -18.443 10.317 1.626 1.00 0.00 H new ATOM 0 HA VAL A 97 -19.875 9.808 4.163 1.00 0.00 H new ATOM 0 HB VAL A 97 -17.553 9.895 4.486 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -16.171 11.997 4.188 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -16.701 11.266 2.654 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -17.534 12.705 3.289 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -17.320 11.789 6.150 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -18.838 12.467 5.512 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -18.840 10.877 6.312 1.00 0.00 H new ATOM 1575 N ASP A 98 -20.286 12.180 2.045 1.00 0.00 N ATOM 1576 CA ASP A 98 -21.134 13.319 1.640 1.00 0.00 C ATOM 1577 C ASP A 98 -22.596 12.928 1.313 1.00 0.00 C ATOM 1578 O ASP A 98 -23.391 13.774 0.899 1.00 0.00 O ATOM 1579 CB ASP A 98 -20.467 14.036 0.451 1.00 0.00 C ATOM 1580 CG ASP A 98 -19.422 15.070 0.910 1.00 0.00 C ATOM 1581 OD1 ASP A 98 -18.419 14.699 1.566 1.00 0.00 O ATOM 1582 OD2 ASP A 98 -19.617 16.280 0.631 1.00 0.00 O ATOM 0 H ASP A 98 -19.742 11.797 1.272 1.00 0.00 H new ATOM 0 HA ASP A 98 -21.210 13.992 2.494 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -19.988 13.299 -0.194 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -21.231 14.534 -0.146 1.00 0.00 H new ATOM 1587 N ASN A 99 -22.965 11.650 1.508 1.00 0.00 N ATOM 1588 CA ASN A 99 -24.289 11.073 1.165 1.00 0.00 C ATOM 1589 C ASN A 99 -24.642 11.230 -0.326 1.00 0.00 C ATOM 1590 O ASN A 99 -25.800 11.349 -0.733 1.00 0.00 O ATOM 1591 CB ASN A 99 -25.365 11.531 2.174 1.00 0.00 C ATOM 1592 CG ASN A 99 -25.147 10.792 3.477 1.00 0.00 C ATOM 1593 OD1 ASN A 99 -25.873 9.876 3.841 1.00 0.00 O ATOM 1594 ND2 ASN A 99 -24.045 11.068 4.134 1.00 0.00 N ATOM 0 H ASN A 99 -22.334 10.963 1.922 1.00 0.00 H new ATOM 0 HA ASN A 99 -24.242 9.990 1.280 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -25.301 12.607 2.334 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -26.362 11.325 1.784 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -23.789 10.518 4.954 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -23.445 11.833 3.825 1.00 0.00 H new ATOM 1601 N LEU A 100 -23.579 11.197 -1.129 1.00 0.00 N ATOM 1602 CA LEU A 100 -23.631 11.154 -2.598 1.00 0.00 C ATOM 1603 C LEU A 100 -24.131 9.789 -3.117 1.00 0.00 C ATOM 1604 O LEU A 100 -24.010 8.786 -2.405 1.00 0.00 O ATOM 1605 CB LEU A 100 -22.228 11.460 -3.163 1.00 0.00 C ATOM 1606 CG LEU A 100 -21.846 12.950 -3.146 1.00 0.00 C ATOM 1607 CD1 LEU A 100 -20.402 13.093 -3.620 1.00 0.00 C ATOM 1608 CD2 LEU A 100 -22.715 13.807 -4.072 1.00 0.00 C ATOM 0 H LEU A 100 -22.625 11.199 -0.768 1.00 0.00 H new ATOM 0 HA LEU A 100 -24.342 11.907 -2.938 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -21.489 10.902 -2.589 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -22.176 11.096 -4.189 1.00 0.00 H new ATOM 0 HG LEU A 100 -21.990 13.298 -2.123 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -20.119 14.146 -3.612 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -19.744 12.535 -2.954 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -20.311 12.700 -4.633 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -22.394 14.847 -4.013 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -22.612 13.453 -5.098 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -23.758 13.732 -3.765 1.00 0.00 H new ATOM 1620 N PRO A 101 -24.642 9.716 -4.362 1.00 0.00 N ATOM 1621 CA PRO A 101 -25.040 8.458 -4.990 1.00 0.00 C ATOM 1622 C PRO A 101 -23.827 7.550 -5.244 1.00 0.00 C ATOM 1623 O PRO A 101 -22.707 8.020 -5.469 1.00 0.00 O ATOM 1624 CB PRO A 101 -25.750 8.858 -6.289 1.00 0.00 C ATOM 1625 CG PRO A 101 -25.126 10.207 -6.646 1.00 0.00 C ATOM 1626 CD PRO A 101 -24.818 10.828 -5.285 1.00 0.00 C ATOM 0 HA PRO A 101 -25.699 7.874 -4.348 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -25.588 8.122 -7.076 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -26.827 8.941 -6.147 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -24.224 10.086 -7.245 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -25.812 10.826 -7.224 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -23.918 11.441 -5.332 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -25.631 11.478 -4.961 1.00 0.00 H new ATOM 1634 N ASN A 102 -24.046 6.234 -5.211 1.00 0.00 N ATOM 1635 CA ASN A 102 -23.007 5.237 -5.477 1.00 0.00 C ATOM 1636 C ASN A 102 -22.623 5.246 -6.971 1.00 0.00 C ATOM 1637 O ASN A 102 -23.486 5.080 -7.840 1.00 0.00 O ATOM 1638 CB ASN A 102 -23.511 3.857 -5.021 1.00 0.00 C ATOM 1639 CG ASN A 102 -23.871 3.816 -3.546 1.00 0.00 C ATOM 1640 OD1 ASN A 102 -25.025 3.663 -3.168 1.00 0.00 O ATOM 1641 ND2 ASN A 102 -22.910 3.973 -2.660 1.00 0.00 N ATOM 0 H ASN A 102 -24.957 5.827 -4.997 1.00 0.00 H new ATOM 0 HA ASN A 102 -22.104 5.478 -4.915 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -24.385 3.582 -5.611 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -22.743 3.110 -5.223 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -23.129 3.967 -1.664 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -21.947 4.101 -2.970 1.00 0.00 H new ATOM 1648 N ILE A 103 -21.331 5.450 -7.258 1.00 0.00 N ATOM 1649 CA ILE A 103 -20.771 5.570 -8.615 1.00 0.00 C ATOM 1650 C ILE A 103 -19.408 4.875 -8.721 1.00 0.00 C ATOM 1651 O ILE A 103 -18.556 4.995 -7.835 1.00 0.00 O ATOM 1652 CB ILE A 103 -20.706 7.044 -9.090 1.00 0.00 C ATOM 1653 CG1 ILE A 103 -20.082 8.000 -8.044 1.00 0.00 C ATOM 1654 CG2 ILE A 103 -22.109 7.510 -9.528 1.00 0.00 C ATOM 1655 CD1 ILE A 103 -20.125 9.478 -8.448 1.00 0.00 C ATOM 0 H ILE A 103 -20.622 5.539 -6.530 1.00 0.00 H new ATOM 0 HA ILE A 103 -21.453 5.054 -9.291 1.00 0.00 H new ATOM 0 HB ILE A 103 -20.033 7.082 -9.946 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -20.606 7.877 -7.096 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -19.045 7.710 -7.875 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -22.060 8.547 -9.861 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -22.462 6.882 -10.346 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -22.798 7.431 -8.687 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -19.669 10.083 -7.664 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -19.576 9.617 -9.379 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -21.161 9.787 -8.589 1.00 0.00 H new ATOM 1667 N LYS A 104 -19.216 4.164 -9.839 1.00 0.00 N ATOM 1668 CA LYS A 104 -17.985 3.449 -10.203 1.00 0.00 C ATOM 1669 C LYS A 104 -17.212 4.190 -11.296 1.00 0.00 C ATOM 1670 O LYS A 104 -17.646 5.220 -11.818 1.00 0.00 O ATOM 1671 CB LYS A 104 -18.316 1.971 -10.535 1.00 0.00 C ATOM 1672 CG LYS A 104 -19.156 1.685 -11.798 1.00 0.00 C ATOM 1673 CD LYS A 104 -18.356 1.714 -13.111 1.00 0.00 C ATOM 1674 CE LYS A 104 -19.123 1.090 -14.285 1.00 0.00 C ATOM 1675 NZ LYS A 104 -20.087 2.033 -14.906 1.00 0.00 N ATOM 0 H LYS A 104 -19.945 4.067 -10.545 1.00 0.00 H new ATOM 0 HA LYS A 104 -17.303 3.427 -9.353 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -17.374 1.431 -10.630 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -18.842 1.546 -9.680 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -19.625 0.707 -11.694 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -19.959 2.419 -11.860 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -18.103 2.746 -13.355 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -17.416 1.180 -12.971 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -18.412 0.754 -15.040 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -19.658 0.207 -13.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -20.809 1.497 -15.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -20.545 2.600 -14.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -19.583 2.664 -15.561 1.00 0.00 H new ATOM 1689 N ILE A 105 -16.044 3.652 -11.634 1.00 0.00 N ATOM 1690 CA ILE A 105 -15.119 4.185 -12.644 1.00 0.00 C ATOM 1691 C ILE A 105 -15.719 4.016 -14.047 1.00 0.00 C ATOM 1692 O ILE A 105 -15.762 2.913 -14.598 1.00 0.00 O ATOM 1693 CB ILE A 105 -13.754 3.490 -12.498 1.00 0.00 C ATOM 1694 CG1 ILE A 105 -13.186 3.686 -11.072 1.00 0.00 C ATOM 1695 CG2 ILE A 105 -12.774 4.023 -13.556 1.00 0.00 C ATOM 1696 CD1 ILE A 105 -12.125 2.650 -10.711 1.00 0.00 C ATOM 0 H ILE A 105 -15.697 2.798 -11.197 1.00 0.00 H new ATOM 0 HA ILE A 105 -14.965 5.253 -12.492 1.00 0.00 H new ATOM 0 HB ILE A 105 -13.890 2.420 -12.658 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -12.755 4.684 -10.991 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -14.001 3.631 -10.350 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -11.811 3.525 -13.444 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -13.171 3.826 -14.552 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -12.644 5.097 -13.423 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -11.763 2.837 -9.700 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -12.559 1.652 -10.762 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -11.294 2.720 -11.413 1.00 0.00 H new ATOM 1708 N ALA A 106 -16.221 5.116 -14.604 1.00 0.00 N ATOM 1709 CA ALA A 106 -16.879 5.169 -15.907 1.00 0.00 C ATOM 1710 C ALA A 106 -15.887 4.900 -17.056 1.00 0.00 C ATOM 1711 O ALA A 106 -16.192 4.141 -17.979 1.00 0.00 O ATOM 1712 CB ALA A 106 -17.538 6.551 -16.044 1.00 0.00 C ATOM 0 H ALA A 106 -16.179 6.026 -14.145 1.00 0.00 H new ATOM 0 HA ALA A 106 -17.635 4.387 -15.972 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -18.039 6.621 -17.010 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -18.268 6.687 -15.246 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -16.775 7.326 -15.974 1.00 0.00 H new ATOM 1718 N THR A 107 -14.691 5.493 -16.965 1.00 0.00 N ATOM 1719 CA THR A 107 -13.556 5.335 -17.896 1.00 0.00 C ATOM 1720 C THR A 107 -12.215 5.571 -17.180 1.00 0.00 C ATOM 1721 O THR A 107 -12.167 6.174 -16.103 1.00 0.00 O ATOM 1722 CB THR A 107 -13.643 6.303 -19.099 1.00 0.00 C ATOM 1723 OG1 THR A 107 -14.015 7.608 -18.707 1.00 0.00 O ATOM 1724 CG2 THR A 107 -14.634 5.858 -20.175 1.00 0.00 C ATOM 0 H THR A 107 -14.472 6.132 -16.200 1.00 0.00 H new ATOM 0 HA THR A 107 -13.610 4.310 -18.264 1.00 0.00 H new ATOM 0 HB THR A 107 -12.635 6.295 -19.514 1.00 0.00 H new ATOM 0 HG1 THR A 107 -14.056 8.187 -19.496 1.00 0.00 H new ATOM 0 HG21 THR A 107 -14.641 6.586 -20.987 1.00 0.00 H new ATOM 0 HG22 THR A 107 -14.336 4.884 -20.563 1.00 0.00 H new ATOM 0 HG23 THR A 107 -15.632 5.787 -19.743 1.00 0.00 H new ATOM 1732 N ARG A 108 -11.118 5.121 -17.805 1.00 0.00 N ATOM 1733 CA ARG A 108 -9.731 5.252 -17.320 1.00 0.00 C ATOM 1734 C ARG A 108 -8.834 5.877 -18.397 1.00 0.00 C ATOM 1735 O ARG A 108 -9.008 5.584 -19.584 1.00 0.00 O ATOM 1736 CB ARG A 108 -9.233 3.859 -16.878 1.00 0.00 C ATOM 1737 CG ARG A 108 -7.738 3.817 -16.514 1.00 0.00 C ATOM 1738 CD ARG A 108 -7.317 2.448 -15.961 1.00 0.00 C ATOM 1739 NE ARG A 108 -6.226 1.833 -16.750 1.00 0.00 N ATOM 1740 CZ ARG A 108 -5.921 0.549 -16.827 1.00 0.00 C ATOM 1741 NH1 ARG A 108 -6.583 -0.366 -16.176 1.00 0.00 N ATOM 1742 NH2 ARG A 108 -4.915 0.154 -17.555 1.00 0.00 N ATOM 0 H ARG A 108 -11.172 4.635 -18.700 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.693 5.924 -16.463 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -9.816 3.532 -16.017 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -9.422 3.145 -17.680 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -7.143 4.049 -17.398 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -7.524 4.588 -15.774 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -6.994 2.561 -14.926 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -8.179 1.781 -15.955 1.00 0.00 H new ATOM 0 HE ARG A 108 -5.645 2.471 -17.295 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -7.368 -0.101 -15.581 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -6.316 -1.347 -16.262 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -4.358 0.837 -18.069 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -4.684 -0.838 -17.611 1.00 0.00 H new ATOM 1756 N LYS A 109 -7.856 6.694 -17.989 1.00 0.00 N ATOM 1757 CA LYS A 109 -6.895 7.362 -18.888 1.00 0.00 C ATOM 1758 C LYS A 109 -5.522 7.486 -18.212 1.00 0.00 C ATOM 1759 O LYS A 109 -5.400 8.119 -17.165 1.00 0.00 O ATOM 1760 CB LYS A 109 -7.507 8.723 -19.282 1.00 0.00 C ATOM 1761 CG LYS A 109 -6.787 9.414 -20.450 1.00 0.00 C ATOM 1762 CD LYS A 109 -7.556 10.644 -20.964 1.00 0.00 C ATOM 1763 CE LYS A 109 -8.879 10.257 -21.650 1.00 0.00 C ATOM 1764 NZ LYS A 109 -9.589 11.443 -22.198 1.00 0.00 N ATOM 0 H LYS A 109 -7.704 6.917 -17.005 1.00 0.00 H new ATOM 0 HA LYS A 109 -6.720 6.781 -19.793 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -8.554 8.576 -19.549 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -7.489 9.383 -18.415 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -5.790 9.719 -20.130 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -6.657 8.703 -21.266 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -7.763 11.315 -20.131 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -6.931 11.193 -21.668 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -8.677 9.551 -22.456 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -9.523 9.747 -20.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -10.474 11.139 -22.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -9.805 12.106 -21.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -8.985 11.915 -22.901 1.00 0.00 H new ATOM 1778 N TYR A 110 -4.492 6.840 -18.762 1.00 0.00 N ATOM 1779 CA TYR A 110 -3.131 6.889 -18.199 1.00 0.00 C ATOM 1780 C TYR A 110 -2.569 8.319 -18.230 1.00 0.00 C ATOM 1781 O TYR A 110 -2.570 8.964 -19.285 1.00 0.00 O ATOM 1782 CB TYR A 110 -2.203 5.927 -18.958 1.00 0.00 C ATOM 1783 CG TYR A 110 -0.769 5.877 -18.440 1.00 0.00 C ATOM 1784 CD1 TYR A 110 -0.506 5.803 -17.056 1.00 0.00 C ATOM 1785 CD2 TYR A 110 0.311 5.905 -19.344 1.00 0.00 C ATOM 1786 CE1 TYR A 110 0.816 5.772 -16.579 1.00 0.00 C ATOM 1787 CE2 TYR A 110 1.640 5.847 -18.874 1.00 0.00 C ATOM 1788 CZ TYR A 110 1.894 5.778 -17.486 1.00 0.00 C ATOM 1789 OH TYR A 110 3.174 5.725 -17.021 1.00 0.00 O ATOM 0 H TYR A 110 -4.571 6.270 -19.604 1.00 0.00 H new ATOM 0 HA TYR A 110 -3.184 6.573 -17.157 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -2.626 4.924 -18.911 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -2.185 6.216 -20.009 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -1.328 5.770 -16.356 1.00 0.00 H new ATOM 0 HD2 TYR A 110 0.120 5.971 -20.405 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.005 5.744 -15.516 1.00 0.00 H new ATOM 0 HE2 TYR A 110 2.462 5.855 -19.574 1.00 0.00 H new ATOM 0 HH TYR A 110 3.797 5.736 -17.777 1.00 0.00 H new ATOM 1799 N LEU A 111 -2.091 8.818 -17.084 1.00 0.00 N ATOM 1800 CA LEU A 111 -1.573 10.184 -16.967 1.00 0.00 C ATOM 1801 C LEU A 111 -0.053 10.241 -17.146 1.00 0.00 C ATOM 1802 O LEU A 111 0.464 11.144 -17.809 1.00 0.00 O ATOM 1803 CB LEU A 111 -1.939 10.728 -15.580 1.00 0.00 C ATOM 1804 CG LEU A 111 -3.443 10.883 -15.352 1.00 0.00 C ATOM 1805 CD1 LEU A 111 -3.698 11.099 -13.864 1.00 0.00 C ATOM 1806 CD2 LEU A 111 -4.009 12.031 -16.194 1.00 0.00 C ATOM 0 H LEU A 111 -2.053 8.287 -16.214 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.020 10.787 -17.757 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.533 10.060 -14.820 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -1.459 11.697 -15.442 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.957 9.976 -15.670 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.768 11.211 -13.691 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.327 10.241 -13.303 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -3.181 12.000 -13.533 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.080 12.121 -16.014 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.515 12.963 -15.918 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.835 11.828 -17.251 1.00 0.00 H new ATOM 1818 N GLY A 112 0.657 9.293 -16.532 1.00 0.00 N ATOM 1819 CA GLY A 112 2.120 9.218 -16.527 1.00 0.00 C ATOM 1820 C GLY A 112 2.682 8.781 -15.171 1.00 0.00 C ATOM 1821 O GLY A 112 2.043 8.035 -14.431 1.00 0.00 O ATOM 0 H GLY A 112 0.218 8.535 -16.010 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.447 8.517 -17.295 1.00 0.00 H new ATOM 0 HA3 GLY A 112 2.531 10.193 -16.790 1.00 0.00 H new ATOM 1825 N LYS A 113 3.872 9.277 -14.824 1.00 0.00 N ATOM 1826 CA LYS A 113 4.688 8.827 -13.674 1.00 0.00 C ATOM 1827 C LYS A 113 4.969 9.959 -12.680 1.00 0.00 C ATOM 1828 O LYS A 113 6.063 10.517 -12.583 1.00 0.00 O ATOM 1829 CB LYS A 113 5.974 8.179 -14.187 1.00 0.00 C ATOM 1830 CG LYS A 113 6.630 7.332 -13.083 1.00 0.00 C ATOM 1831 CD LYS A 113 8.067 6.908 -13.418 1.00 0.00 C ATOM 1832 CE LYS A 113 9.023 8.111 -13.467 1.00 0.00 C ATOM 1833 NZ LYS A 113 10.430 7.682 -13.676 1.00 0.00 N ATOM 0 H LYS A 113 4.317 10.030 -15.349 1.00 0.00 H new ATOM 0 HA LYS A 113 4.119 8.083 -13.116 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.752 7.552 -15.051 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.668 8.950 -14.522 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.633 7.900 -12.152 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.026 6.441 -12.911 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.418 6.195 -12.672 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.079 6.395 -14.380 1.00 0.00 H new ATOM 0 HE2 LYS A 113 8.723 8.782 -14.272 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.948 8.675 -12.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.914 8.366 -14.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.919 7.636 -12.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.444 6.743 -14.123 1.00 0.00 H new ATOM 1847 N GLN A 114 3.911 10.335 -11.981 1.00 0.00 N ATOM 1848 CA GLN A 114 3.825 11.529 -11.136 1.00 0.00 C ATOM 1849 C GLN A 114 4.242 11.220 -9.697 1.00 0.00 C ATOM 1850 O GLN A 114 4.166 10.080 -9.228 1.00 0.00 O ATOM 1851 CB GLN A 114 2.401 12.108 -11.198 1.00 0.00 C ATOM 1852 CG GLN A 114 1.921 11.981 -12.646 1.00 0.00 C ATOM 1853 CD GLN A 114 0.766 12.837 -13.064 1.00 0.00 C ATOM 1854 OE1 GLN A 114 0.085 13.522 -12.311 1.00 0.00 O ATOM 1855 NE2 GLN A 114 0.538 12.793 -14.349 1.00 0.00 N ATOM 0 H GLN A 114 3.045 9.796 -11.983 1.00 0.00 H new ATOM 0 HA GLN A 114 4.520 12.278 -11.515 1.00 0.00 H new ATOM 0 HB2 GLN A 114 1.737 11.567 -10.524 1.00 0.00 H new ATOM 0 HB3 GLN A 114 2.396 13.151 -10.882 1.00 0.00 H new ATOM 0 HG2 GLN A 114 2.762 12.206 -13.301 1.00 0.00 H new ATOM 0 HG3 GLN A 114 1.650 10.940 -12.822 1.00 0.00 H new ATOM 0 HE21 GLN A 114 1.122 12.213 -14.951 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -0.224 13.339 -14.751 1.00 0.00 H new ATOM 1864 N ASN A 115 4.651 12.253 -8.970 1.00 0.00 N ATOM 1865 CA ASN A 115 4.892 12.193 -7.548 1.00 0.00 C ATOM 1866 C ASN A 115 3.581 11.921 -6.795 1.00 0.00 C ATOM 1867 O ASN A 115 2.650 12.731 -6.842 1.00 0.00 O ATOM 1868 CB ASN A 115 5.566 13.512 -7.122 1.00 0.00 C ATOM 1869 CG ASN A 115 6.548 13.259 -6.002 1.00 0.00 C ATOM 1870 OD1 ASN A 115 7.694 13.692 -6.029 1.00 0.00 O ATOM 1871 ND2 ASN A 115 6.160 12.489 -5.015 1.00 0.00 N ATOM 0 H ASN A 115 4.826 13.175 -9.370 1.00 0.00 H new ATOM 0 HA ASN A 115 5.560 11.368 -7.298 1.00 0.00 H new ATOM 0 HB2 ASN A 115 6.081 13.957 -7.973 1.00 0.00 H new ATOM 0 HB3 ASN A 115 4.810 14.227 -6.798 1.00 0.00 H new ATOM 0 HD21 ASN A 115 6.812 12.250 -4.268 1.00 0.00 H new ATOM 0 HD22 ASN A 115 5.206 12.129 -4.994 1.00 0.00 H new ATOM 1878 N VAL A 116 3.530 10.798 -6.073 1.00 0.00 N ATOM 1879 CA VAL A 116 2.359 10.399 -5.277 1.00 0.00 C ATOM 1880 C VAL A 116 2.733 10.164 -3.808 1.00 0.00 C ATOM 1881 O VAL A 116 3.861 9.781 -3.488 1.00 0.00 O ATOM 1882 CB VAL A 116 1.637 9.195 -5.915 1.00 0.00 C ATOM 1883 CG1 VAL A 116 0.962 9.549 -7.240 1.00 0.00 C ATOM 1884 CG2 VAL A 116 2.556 8.003 -6.200 1.00 0.00 C ATOM 0 H VAL A 116 4.303 10.134 -6.022 1.00 0.00 H new ATOM 0 HA VAL A 116 1.647 11.224 -5.281 1.00 0.00 H new ATOM 0 HB VAL A 116 0.899 8.919 -5.162 1.00 0.00 H new ATOM 0 HG11 VAL A 116 0.469 8.665 -7.645 1.00 0.00 H new ATOM 0 HG12 VAL A 116 0.223 10.332 -7.074 1.00 0.00 H new ATOM 0 HG13 VAL A 116 1.712 9.902 -7.948 1.00 0.00 H new ATOM 0 HG21 VAL A 116 1.977 7.196 -6.648 1.00 0.00 H new ATOM 0 HG22 VAL A 116 3.345 8.308 -6.887 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.001 7.656 -5.268 1.00 0.00 H new ATOM 1894 N TYR A 117 1.770 10.406 -2.918 1.00 0.00 N ATOM 1895 CA TYR A 117 1.935 10.463 -1.462 1.00 0.00 C ATOM 1896 C TYR A 117 0.792 9.737 -0.722 1.00 0.00 C ATOM 1897 O TYR A 117 -0.297 9.553 -1.271 1.00 0.00 O ATOM 1898 CB TYR A 117 1.959 11.938 -1.036 1.00 0.00 C ATOM 1899 CG TYR A 117 2.833 12.864 -1.865 1.00 0.00 C ATOM 1900 CD1 TYR A 117 2.291 13.501 -2.999 1.00 0.00 C ATOM 1901 CD2 TYR A 117 4.166 13.116 -1.488 1.00 0.00 C ATOM 1902 CE1 TYR A 117 3.075 14.401 -3.746 1.00 0.00 C ATOM 1903 CE2 TYR A 117 4.947 14.030 -2.222 1.00 0.00 C ATOM 1904 CZ TYR A 117 4.398 14.687 -3.345 1.00 0.00 C ATOM 1905 OH TYR A 117 5.147 15.586 -4.039 1.00 0.00 O ATOM 0 H TYR A 117 0.806 10.576 -3.205 1.00 0.00 H new ATOM 0 HA TYR A 117 2.866 9.961 -1.200 1.00 0.00 H new ATOM 0 HB2 TYR A 117 0.938 12.318 -1.061 1.00 0.00 H new ATOM 0 HB3 TYR A 117 2.293 11.989 0.000 1.00 0.00 H new ATOM 0 HD1 TYR A 117 1.272 13.299 -3.296 1.00 0.00 H new ATOM 0 HD2 TYR A 117 4.590 12.608 -0.635 1.00 0.00 H new ATOM 0 HE1 TYR A 117 2.664 14.873 -4.626 1.00 0.00 H new ATOM 0 HE2 TYR A 117 5.966 14.228 -1.926 1.00 0.00 H new ATOM 0 HH TYR A 117 6.032 15.662 -3.626 1.00 0.00 H new ATOM 1915 N ASP A 118 1.032 9.324 0.525 1.00 0.00 N ATOM 1916 CA ASP A 118 0.104 8.526 1.334 1.00 0.00 C ATOM 1917 C ASP A 118 0.419 8.683 2.833 1.00 0.00 C ATOM 1918 O ASP A 118 1.516 8.369 3.293 1.00 0.00 O ATOM 1919 CB ASP A 118 0.210 7.055 0.906 1.00 0.00 C ATOM 1920 CG ASP A 118 -0.566 6.122 1.849 1.00 0.00 C ATOM 1921 OD1 ASP A 118 -1.778 6.361 2.061 1.00 0.00 O ATOM 1922 OD2 ASP A 118 0.036 5.141 2.355 1.00 0.00 O ATOM 0 H ASP A 118 1.900 9.541 1.014 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.915 8.877 1.173 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -0.173 6.944 -0.109 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.259 6.758 0.885 1.00 0.00 H new ATOM 1927 N ILE A 119 -0.529 9.193 3.619 1.00 0.00 N ATOM 1928 CA ILE A 119 -0.360 9.315 5.073 1.00 0.00 C ATOM 1929 C ILE A 119 -0.437 7.951 5.776 1.00 0.00 C ATOM 1930 O ILE A 119 -1.170 7.048 5.362 1.00 0.00 O ATOM 1931 CB ILE A 119 -1.363 10.317 5.674 1.00 0.00 C ATOM 1932 CG1 ILE A 119 -2.825 10.030 5.267 1.00 0.00 C ATOM 1933 CG2 ILE A 119 -0.905 11.733 5.276 1.00 0.00 C ATOM 1934 CD1 ILE A 119 -3.843 10.672 6.212 1.00 0.00 C ATOM 0 H ILE A 119 -1.428 9.531 3.274 1.00 0.00 H new ATOM 0 HA ILE A 119 0.642 9.708 5.247 1.00 0.00 H new ATOM 0 HB ILE A 119 -1.365 10.219 6.760 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -2.994 10.398 4.255 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -2.986 8.952 5.246 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.597 12.468 5.687 1.00 0.00 H new ATOM 0 HG22 ILE A 119 0.095 11.916 5.669 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.889 11.818 4.189 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -4.852 10.435 5.875 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.697 10.285 7.221 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.706 11.753 6.215 1.00 0.00 H new ATOM 1946 N GLY A 120 0.305 7.818 6.876 1.00 0.00 N ATOM 1947 CA GLY A 120 0.342 6.618 7.709 1.00 0.00 C ATOM 1948 C GLY A 120 -0.543 6.757 8.947 1.00 0.00 C ATOM 1949 O GLY A 120 -0.751 7.858 9.464 1.00 0.00 O ATOM 0 H GLY A 120 0.912 8.562 7.220 1.00 0.00 H new ATOM 0 HA2 GLY A 120 0.015 5.759 7.123 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.369 6.421 8.017 1.00 0.00 H new ATOM 1953 N VAL A 121 -1.052 5.628 9.436 1.00 0.00 N ATOM 1954 CA VAL A 121 -2.060 5.539 10.508 1.00 0.00 C ATOM 1955 C VAL A 121 -1.819 4.262 11.332 1.00 0.00 C ATOM 1956 O VAL A 121 -1.399 3.239 10.784 1.00 0.00 O ATOM 1957 CB VAL A 121 -3.472 5.493 9.889 1.00 0.00 C ATOM 1958 CG1 VAL A 121 -4.571 5.556 10.955 1.00 0.00 C ATOM 1959 CG2 VAL A 121 -3.783 6.610 8.881 1.00 0.00 C ATOM 0 H VAL A 121 -0.768 4.712 9.088 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.978 6.412 11.156 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.467 4.539 9.362 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -5.548 5.521 10.473 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -4.470 4.708 11.632 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -4.478 6.484 11.519 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -4.799 6.488 8.505 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -3.692 7.579 9.372 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -3.079 6.557 8.050 1.00 0.00 H new ATOM 2037 N ASN A 126 -7.379 3.924 6.522 1.00 0.00 N ATOM 2038 CA ASN A 126 -8.253 4.567 5.528 1.00 0.00 C ATOM 2039 C ASN A 126 -8.628 6.021 5.898 1.00 0.00 C ATOM 2040 O ASN A 126 -8.512 6.424 7.058 1.00 0.00 O ATOM 2041 CB ASN A 126 -9.507 3.683 5.343 1.00 0.00 C ATOM 2042 CG ASN A 126 -10.292 3.513 6.629 1.00 0.00 C ATOM 2043 OD1 ASN A 126 -9.964 2.709 7.490 1.00 0.00 O ATOM 2044 ND2 ASN A 126 -11.341 4.280 6.808 1.00 0.00 N ATOM 0 HA ASN A 126 -7.709 4.648 4.587 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -10.151 4.126 4.584 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -9.206 2.703 4.973 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -11.886 4.207 7.667 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -11.612 4.950 6.088 1.00 0.00 H new ATOM 2051 N PHE A 127 -9.092 6.801 4.912 1.00 0.00 N ATOM 2052 CA PHE A 127 -9.449 8.222 5.056 1.00 0.00 C ATOM 2053 C PHE A 127 -10.380 8.726 3.929 1.00 0.00 C ATOM 2054 O PHE A 127 -10.357 8.202 2.815 1.00 0.00 O ATOM 2055 CB PHE A 127 -8.171 9.081 5.118 1.00 0.00 C ATOM 2056 CG PHE A 127 -7.167 8.856 4.002 1.00 0.00 C ATOM 2057 CD1 PHE A 127 -7.368 9.446 2.740 1.00 0.00 C ATOM 2058 CD2 PHE A 127 -6.024 8.061 4.224 1.00 0.00 C ATOM 2059 CE1 PHE A 127 -6.444 9.225 1.704 1.00 0.00 C ATOM 2060 CE2 PHE A 127 -5.097 7.850 3.189 1.00 0.00 C ATOM 2061 CZ PHE A 127 -5.310 8.428 1.925 1.00 0.00 C ATOM 0 H PHE A 127 -9.234 6.452 3.964 1.00 0.00 H new ATOM 0 HA PHE A 127 -10.006 8.319 5.988 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -8.462 10.131 5.113 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -7.675 8.892 6.070 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -8.233 10.069 2.567 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -5.860 7.613 5.193 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -6.607 9.670 0.734 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -4.221 7.244 3.365 1.00 0.00 H new ATOM 0 HZ PHE A 127 -4.603 8.259 1.126 1.00 0.00 H new ATOM 2071 N ALA A 128 -11.187 9.757 4.204 1.00 0.00 N ATOM 2072 CA ALA A 128 -12.093 10.386 3.234 1.00 0.00 C ATOM 2073 C ALA A 128 -11.377 11.375 2.282 1.00 0.00 C ATOM 2074 O ALA A 128 -10.529 12.169 2.701 1.00 0.00 O ATOM 2075 CB ALA A 128 -13.208 11.109 4.006 1.00 0.00 C ATOM 0 H ALA A 128 -11.230 10.188 5.128 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.502 9.599 2.601 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.891 11.582 3.301 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.756 10.389 4.614 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.769 11.869 4.652 1.00 0.00 H new ATOM 2081 N LEU A 129 -11.775 11.369 1.006 1.00 0.00 N ATOM 2082 CA LEU A 129 -11.340 12.304 -0.045 1.00 0.00 C ATOM 2083 C LEU A 129 -12.280 13.523 -0.179 1.00 0.00 C ATOM 2084 O LEU A 129 -13.308 13.608 0.491 1.00 0.00 O ATOM 2085 CB LEU A 129 -11.251 11.543 -1.385 1.00 0.00 C ATOM 2086 CG LEU A 129 -10.286 10.338 -1.409 1.00 0.00 C ATOM 2087 CD1 LEU A 129 -10.253 9.743 -2.815 1.00 0.00 C ATOM 2088 CD2 LEU A 129 -8.860 10.707 -1.024 1.00 0.00 C ATOM 0 H LEU A 129 -12.442 10.680 0.658 1.00 0.00 H new ATOM 0 HA LEU A 129 -10.362 12.696 0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -12.248 11.191 -1.649 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.945 12.245 -2.161 1.00 0.00 H new ATOM 0 HG LEU A 129 -10.661 9.625 -0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -9.572 8.892 -2.834 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -11.254 9.413 -3.094 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -9.909 10.498 -3.522 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.232 9.817 -1.060 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.476 11.451 -1.722 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.850 11.117 -0.014 1.00 0.00 H new ATOM 2100 N LYS A 130 -11.943 14.445 -1.096 1.00 0.00 N ATOM 2101 CA LYS A 130 -12.684 15.683 -1.419 1.00 0.00 C ATOM 2102 C LYS A 130 -14.194 15.507 -1.606 1.00 0.00 C ATOM 2103 O LYS A 130 -14.987 16.136 -0.905 1.00 0.00 O ATOM 2104 CB LYS A 130 -12.048 16.301 -2.678 1.00 0.00 C ATOM 2105 CG LYS A 130 -12.705 17.616 -3.129 1.00 0.00 C ATOM 2106 CD LYS A 130 -12.129 18.071 -4.478 1.00 0.00 C ATOM 2107 CE LYS A 130 -12.823 19.326 -5.028 1.00 0.00 C ATOM 2108 NZ LYS A 130 -12.529 20.536 -4.216 1.00 0.00 N ATOM 0 H LYS A 130 -11.102 14.345 -1.664 1.00 0.00 H new ATOM 0 HA LYS A 130 -12.598 16.343 -0.556 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -10.990 16.482 -2.487 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -12.106 15.580 -3.493 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -13.783 17.480 -3.215 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -12.540 18.388 -2.378 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -11.064 18.271 -4.364 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -12.226 17.261 -5.201 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -12.502 19.495 -6.056 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -13.900 19.161 -5.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -12.766 21.388 -4.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -13.097 20.516 -3.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -11.519 20.552 -3.971 1.00 0.00 H new ATOM 2122 N ASN A 131 -14.581 14.667 -2.569 1.00 0.00 N ATOM 2123 CA ASN A 131 -15.987 14.373 -2.871 1.00 0.00 C ATOM 2124 C ASN A 131 -16.645 13.506 -1.784 1.00 0.00 C ATOM 2125 O ASN A 131 -17.867 13.503 -1.658 1.00 0.00 O ATOM 2126 CB ASN A 131 -16.064 13.679 -4.239 1.00 0.00 C ATOM 2127 CG ASN A 131 -15.871 14.651 -5.392 1.00 0.00 C ATOM 2128 OD1 ASN A 131 -16.661 15.559 -5.608 1.00 0.00 O ATOM 2129 ND2 ASN A 131 -14.819 14.503 -6.167 1.00 0.00 N ATOM 0 H ASN A 131 -13.923 14.167 -3.167 1.00 0.00 H new ATOM 0 HA ASN A 131 -16.540 15.312 -2.896 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -15.303 12.900 -4.292 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -17.031 13.187 -4.340 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.664 15.144 -6.945 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -14.158 13.747 -5.990 1.00 0.00 H new ATOM 2136 N GLY A 132 -15.839 12.775 -1.010 1.00 0.00 N ATOM 2137 CA GLY A 132 -16.268 11.989 0.145 1.00 0.00 C ATOM 2138 C GLY A 132 -15.881 10.511 0.081 1.00 0.00 C ATOM 2139 O GLY A 132 -16.129 9.797 1.046 1.00 0.00 O ATOM 0 H GLY A 132 -14.835 12.713 -1.178 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -15.839 12.426 1.047 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -17.351 12.065 0.239 1.00 0.00 H new ATOM 2143 N PHE A 133 -15.309 10.019 -1.021 1.00 0.00 N ATOM 2144 CA PHE A 133 -14.934 8.601 -1.158 1.00 0.00 C ATOM 2145 C PHE A 133 -13.901 8.206 -0.092 1.00 0.00 C ATOM 2146 O PHE A 133 -12.949 8.952 0.134 1.00 0.00 O ATOM 2147 CB PHE A 133 -14.379 8.331 -2.564 1.00 0.00 C ATOM 2148 CG PHE A 133 -15.273 8.830 -3.682 1.00 0.00 C ATOM 2149 CD1 PHE A 133 -16.527 8.228 -3.898 1.00 0.00 C ATOM 2150 CD2 PHE A 133 -14.877 9.929 -4.468 1.00 0.00 C ATOM 2151 CE1 PHE A 133 -17.409 8.762 -4.853 1.00 0.00 C ATOM 2152 CE2 PHE A 133 -15.752 10.448 -5.437 1.00 0.00 C ATOM 2153 CZ PHE A 133 -17.030 9.888 -5.604 1.00 0.00 C ATOM 0 H PHE A 133 -15.092 10.585 -1.841 1.00 0.00 H new ATOM 0 HA PHE A 133 -15.827 7.994 -1.011 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -13.401 8.804 -2.655 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -14.227 7.258 -2.684 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -16.812 7.355 -3.329 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -13.902 10.372 -4.326 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -18.376 8.308 -5.010 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -15.442 11.278 -6.054 1.00 0.00 H new ATOM 0 HZ PHE A 133 -17.722 10.323 -6.310 1.00 0.00 H new ATOM 2163 N ILE A 134 -14.051 7.047 0.555 1.00 0.00 N ATOM 2164 CA ILE A 134 -13.046 6.548 1.504 1.00 0.00 C ATOM 2165 C ILE A 134 -11.988 5.748 0.724 1.00 0.00 C ATOM 2166 O ILE A 134 -12.285 4.719 0.111 1.00 0.00 O ATOM 2167 CB ILE A 134 -13.676 5.744 2.668 1.00 0.00 C ATOM 2168 CG1 ILE A 134 -14.589 6.567 3.609 1.00 0.00 C ATOM 2169 CG2 ILE A 134 -12.557 5.143 3.546 1.00 0.00 C ATOM 2170 CD1 ILE A 134 -15.998 6.850 3.078 1.00 0.00 C ATOM 0 H ILE A 134 -14.859 6.435 0.440 1.00 0.00 H new ATOM 0 HA ILE A 134 -12.559 7.394 1.989 1.00 0.00 H new ATOM 0 HB ILE A 134 -14.294 4.989 2.183 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.677 6.037 4.557 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -14.101 7.519 3.820 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -13.001 4.577 4.365 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -11.937 4.481 2.942 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -11.942 5.946 3.952 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -16.554 7.432 3.813 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -15.930 7.412 2.147 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -16.514 5.907 2.896 1.00 0.00 H new ATOM 2182 N ALA A 135 -10.738 6.210 0.768 1.00 0.00 N ATOM 2183 CA ALA A 135 -9.571 5.520 0.233 1.00 0.00 C ATOM 2184 C ALA A 135 -8.870 4.752 1.369 1.00 0.00 C ATOM 2185 O ALA A 135 -8.980 5.138 2.534 1.00 0.00 O ATOM 2186 CB ALA A 135 -8.656 6.565 -0.415 1.00 0.00 C ATOM 0 H ALA A 135 -10.505 7.108 1.193 1.00 0.00 H new ATOM 0 HA ALA A 135 -9.851 4.789 -0.526 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -7.774 6.073 -0.824 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -9.193 7.072 -1.217 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -8.350 7.295 0.334 1.00 0.00 H new ATOM 2192 N SER A 136 -8.154 3.672 1.055 1.00 0.00 N ATOM 2193 CA SER A 136 -7.546 2.760 2.040 1.00 0.00 C ATOM 2194 C SER A 136 -6.108 2.354 1.668 1.00 0.00 C ATOM 2195 O SER A 136 -5.750 2.262 0.493 1.00 0.00 O ATOM 2196 CB SER A 136 -8.476 1.564 2.290 1.00 0.00 C ATOM 2197 OG SER A 136 -8.876 0.914 1.098 1.00 0.00 O ATOM 0 H SER A 136 -7.973 3.396 0.090 1.00 0.00 H new ATOM 0 HA SER A 136 -7.439 3.295 2.984 1.00 0.00 H new ATOM 0 HB2 SER A 136 -7.970 0.847 2.936 1.00 0.00 H new ATOM 0 HB3 SER A 136 -9.362 1.906 2.825 1.00 0.00 H new ATOM 0 HG SER A 136 -9.464 0.161 1.317 1.00 0.00 H new ATOM 2203 N ASN A 137 -5.258 2.136 2.677 1.00 0.00 N ATOM 2204 CA ASN A 137 -3.797 1.994 2.547 1.00 0.00 C ATOM 2205 C ASN A 137 -3.214 0.682 3.121 1.00 0.00 C ATOM 2206 O ASN A 137 -3.927 -0.075 3.819 1.00 0.00 O ATOM 2207 CB ASN A 137 -3.135 3.261 3.138 1.00 0.00 C ATOM 2208 CG ASN A 137 -3.320 3.460 4.640 1.00 0.00 C ATOM 2209 OD1 ASN A 137 -2.801 2.724 5.471 1.00 0.00 O ATOM 2210 ND2 ASN A 137 -4.036 4.489 5.046 1.00 0.00 N ATOM 0 H ASN A 137 -5.576 2.050 3.642 1.00 0.00 H new ATOM 0 HA ASN A 137 -3.562 1.910 1.486 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -2.067 3.226 2.923 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -3.535 4.133 2.622 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -4.154 4.667 6.043 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -4.472 5.108 4.363 1.00 0.00 H new