USER MOD reduce.3.24.130724 H: found=0, std=0, add=1167, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1166 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 55 ASN : amide:sc= 0.12 K(o=0.48,f=-4.5!) USER MOD Set 1.2: A 59 TYR OH : rot -44:sc= 0.153 USER MOD Set 1.3: A 76 LYS NZ :NH3+ 172:sc= 0.209 (180deg=0) USER MOD Set 2.1: A 43 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 45 ASN : amide:sc= -1.13 K(o=-1.1,f=-2.3) USER MOD Single : A 1 MET CE :methyl -145:sc= -0.148 (180deg=-0.987) USER MOD Single : A 1 MET N :NH3+ -124:sc= -0.0121 (180deg=-0.311) USER MOD Single : A 3 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00525) USER MOD Single : A 5 MET CE :methyl -155:sc= -0.19 (180deg=-1.41) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= -1.07 USER MOD Single : A 23 SER OG : rot -20:sc= 1.27 USER MOD Single : A 27 TYR OH : rot 171:sc= 0.00233 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -107:sc= 0 (180deg=-0.0447) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -74:sc= -1.08 USER MOD Single : A 68 ASN : amide:sc= -0.256 X(o=-0.26,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 139:sc= 0.468 (180deg=-0.00145) USER MOD Single : A 86 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HE2:sc= 0.101 K(o=0.1,f=-3.3!) USER MOD Single : A 102 SER OG : rot -109:sc= 0.0313 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 112 MET CE :methyl -174:sc= -1.98 (180deg=-2.13) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 GLN : amide:sc= -0.0453 X(o=-0.045,f=-0.47) USER MOD Single : A 119 ASN : amide:sc= -0.0473 X(o=-0.047,f=0) USER MOD Single : A 121 LYS NZ :NH3+ -118:sc= 0 (180deg=-0.108) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc=-0.00507 (180deg=-0.00507) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 110.337 22.615 15.026 1.00 0.00 N ATOM 2 CA MET A 1 111.606 22.263 15.727 1.00 0.00 C ATOM 3 C MET A 1 111.860 20.751 15.629 1.00 0.00 C ATOM 4 O MET A 1 112.034 20.071 16.628 1.00 0.00 O ATOM 5 CB MET A 1 111.391 22.711 17.178 1.00 0.00 C ATOM 6 CG MET A 1 111.414 24.239 17.253 1.00 0.00 C ATOM 7 SD MET A 1 111.486 24.756 18.987 1.00 0.00 S ATOM 8 CE MET A 1 109.900 24.055 19.504 1.00 0.00 C ATOM 0 H1 MET A 1 110.529 23.338 14.304 1.00 0.00 H new ATOM 0 H2 MET A 1 109.945 21.766 14.571 1.00 0.00 H new ATOM 0 H3 MET A 1 109.652 22.986 15.714 1.00 0.00 H new ATOM 0 HA MET A 1 112.480 22.746 15.290 1.00 0.00 H new ATOM 0 HB2 MET A 1 110.438 22.333 17.548 1.00 0.00 H new ATOM 0 HB3 MET A 1 112.169 22.294 17.817 1.00 0.00 H new ATOM 0 HG2 MET A 1 112.276 24.628 16.710 1.00 0.00 H new ATOM 0 HG3 MET A 1 110.525 24.651 16.776 1.00 0.00 H new ATOM 0 HE1 MET A 1 109.441 24.704 20.250 1.00 0.00 H new ATOM 0 HE2 MET A 1 109.240 23.972 18.640 1.00 0.00 H new ATOM 0 HE3 MET A 1 110.062 23.066 19.934 1.00 0.00 H new ATOM 20 N VAL A 2 111.881 20.230 14.422 1.00 0.00 N ATOM 21 CA VAL A 2 112.122 18.767 14.209 1.00 0.00 C ATOM 22 C VAL A 2 113.465 18.582 13.491 1.00 0.00 C ATOM 23 O VAL A 2 113.765 19.293 12.547 1.00 0.00 O ATOM 24 CB VAL A 2 110.947 18.268 13.342 1.00 0.00 C ATOM 25 CG1 VAL A 2 111.079 16.763 13.076 1.00 0.00 C ATOM 26 CG2 VAL A 2 109.614 18.508 14.061 1.00 0.00 C ATOM 0 H VAL A 2 111.739 20.765 13.565 1.00 0.00 H new ATOM 0 HA VAL A 2 112.171 18.207 15.143 1.00 0.00 H new ATOM 0 HB VAL A 2 110.971 18.818 12.401 1.00 0.00 H new ATOM 0 HG11 VAL A 2 110.242 16.427 12.463 1.00 0.00 H new ATOM 0 HG12 VAL A 2 112.014 16.567 12.552 1.00 0.00 H new ATOM 0 HG13 VAL A 2 111.074 16.224 14.024 1.00 0.00 H new ATOM 0 HG21 VAL A 2 108.795 18.151 13.437 1.00 0.00 H new ATOM 0 HG22 VAL A 2 109.610 17.970 15.009 1.00 0.00 H new ATOM 0 HG23 VAL A 2 109.489 19.574 14.249 1.00 0.00 H new ATOM 36 N LYS A 3 114.260 17.636 13.939 1.00 0.00 N ATOM 37 CA LYS A 3 115.595 17.384 13.313 1.00 0.00 C ATOM 38 C LYS A 3 115.506 16.218 12.325 1.00 0.00 C ATOM 39 O LYS A 3 115.092 15.130 12.687 1.00 0.00 O ATOM 40 CB LYS A 3 116.523 17.029 14.478 1.00 0.00 C ATOM 41 CG LYS A 3 116.732 18.261 15.361 1.00 0.00 C ATOM 42 CD LYS A 3 117.749 17.937 16.457 1.00 0.00 C ATOM 43 CE LYS A 3 117.894 19.138 17.392 1.00 0.00 C ATOM 44 NZ LYS A 3 118.887 20.028 16.726 1.00 0.00 N ATOM 0 H LYS A 3 114.035 17.022 14.722 1.00 0.00 H new ATOM 0 HA LYS A 3 115.956 18.248 12.754 1.00 0.00 H new ATOM 0 HB2 LYS A 3 116.093 16.217 15.065 1.00 0.00 H new ATOM 0 HB3 LYS A 3 117.481 16.675 14.098 1.00 0.00 H new ATOM 0 HG2 LYS A 3 117.085 19.098 14.758 1.00 0.00 H new ATOM 0 HG3 LYS A 3 115.786 18.567 15.807 1.00 0.00 H new ATOM 0 HD2 LYS A 3 117.426 17.062 17.020 1.00 0.00 H new ATOM 0 HD3 LYS A 3 118.713 17.691 16.012 1.00 0.00 H new ATOM 0 HE2 LYS A 3 116.940 19.646 17.532 1.00 0.00 H new ATOM 0 HE3 LYS A 3 118.239 18.830 18.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 119.078 20.851 17.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 119.771 19.504 16.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 118.506 20.351 15.814 1.00 0.00 H new ATOM 58 N LEU A 4 115.891 16.449 11.090 1.00 0.00 N ATOM 59 CA LEU A 4 115.867 15.371 10.054 1.00 0.00 C ATOM 60 C LEU A 4 117.296 14.979 9.670 1.00 0.00 C ATOM 61 O LEU A 4 118.196 15.798 9.725 1.00 0.00 O ATOM 62 CB LEU A 4 115.142 15.983 8.851 1.00 0.00 C ATOM 63 CG LEU A 4 113.680 16.262 9.208 1.00 0.00 C ATOM 64 CD1 LEU A 4 113.047 17.132 8.121 1.00 0.00 C ATOM 65 CD2 LEU A 4 112.917 14.940 9.307 1.00 0.00 C ATOM 0 H LEU A 4 116.225 17.352 10.754 1.00 0.00 H new ATOM 0 HA LEU A 4 115.370 14.469 10.412 1.00 0.00 H new ATOM 0 HB2 LEU A 4 115.635 16.908 8.551 1.00 0.00 H new ATOM 0 HB3 LEU A 4 115.194 15.304 8.000 1.00 0.00 H new ATOM 0 HG LEU A 4 113.634 16.782 10.165 1.00 0.00 H new ATOM 0 HD11 LEU A 4 112.006 17.331 8.375 1.00 0.00 H new ATOM 0 HD12 LEU A 4 113.589 18.075 8.048 1.00 0.00 H new ATOM 0 HD13 LEU A 4 113.094 16.611 7.165 1.00 0.00 H new ATOM 0 HD21 LEU A 4 111.876 15.139 9.561 1.00 0.00 H new ATOM 0 HD22 LEU A 4 112.964 14.420 8.350 1.00 0.00 H new ATOM 0 HD23 LEU A 4 113.367 14.317 10.080 1.00 0.00 H new ATOM 77 N MET A 5 117.496 13.739 9.284 1.00 0.00 N ATOM 78 CA MET A 5 118.851 13.267 8.869 1.00 0.00 C ATOM 79 C MET A 5 118.906 13.116 7.348 1.00 0.00 C ATOM 80 O MET A 5 117.938 12.706 6.734 1.00 0.00 O ATOM 81 CB MET A 5 119.027 11.907 9.546 1.00 0.00 C ATOM 82 CG MET A 5 120.504 11.509 9.517 1.00 0.00 C ATOM 83 SD MET A 5 120.684 9.814 10.129 1.00 0.00 S ATOM 84 CE MET A 5 120.081 10.114 11.809 1.00 0.00 C ATOM 0 H MET A 5 116.766 13.028 9.240 1.00 0.00 H new ATOM 0 HA MET A 5 119.637 13.966 9.154 1.00 0.00 H new ATOM 0 HB2 MET A 5 118.672 11.953 10.576 1.00 0.00 H new ATOM 0 HB3 MET A 5 118.427 11.154 9.035 1.00 0.00 H new ATOM 0 HG2 MET A 5 120.892 11.583 8.501 1.00 0.00 H new ATOM 0 HG3 MET A 5 121.088 12.193 10.132 1.00 0.00 H new ATOM 0 HE1 MET A 5 120.497 9.366 12.484 1.00 0.00 H new ATOM 0 HE2 MET A 5 120.389 11.108 12.134 1.00 0.00 H new ATOM 0 HE3 MET A 5 118.993 10.049 11.822 1.00 0.00 H new ATOM 94 N ILE A 6 120.028 13.445 6.750 1.00 0.00 N ATOM 95 CA ILE A 6 120.162 13.377 5.259 1.00 0.00 C ATOM 96 C ILE A 6 121.417 12.572 4.900 1.00 0.00 C ATOM 97 O ILE A 6 122.479 12.805 5.449 1.00 0.00 O ATOM 98 CB ILE A 6 120.282 14.839 4.776 1.00 0.00 C ATOM 99 CG1 ILE A 6 119.081 15.693 5.236 1.00 0.00 C ATOM 100 CG2 ILE A 6 120.382 14.893 3.244 1.00 0.00 C ATOM 101 CD1 ILE A 6 117.743 15.130 4.728 1.00 0.00 C ATOM 0 H ILE A 6 120.866 13.761 7.238 1.00 0.00 H new ATOM 0 HA ILE A 6 119.312 12.885 4.787 1.00 0.00 H new ATOM 0 HB ILE A 6 121.189 15.250 5.219 1.00 0.00 H new ATOM 0 HG12 ILE A 6 119.065 15.738 6.325 1.00 0.00 H new ATOM 0 HG13 ILE A 6 119.204 16.715 4.876 1.00 0.00 H new ATOM 0 HG21 ILE A 6 120.466 15.931 2.921 1.00 0.00 H new ATOM 0 HG22 ILE A 6 121.262 14.339 2.917 1.00 0.00 H new ATOM 0 HG23 ILE A 6 119.489 14.448 2.805 1.00 0.00 H new ATOM 0 HD11 ILE A 6 116.926 15.763 5.076 1.00 0.00 H new ATOM 0 HD12 ILE A 6 117.747 15.109 3.638 1.00 0.00 H new ATOM 0 HD13 ILE A 6 117.606 14.118 5.109 1.00 0.00 H new ATOM 113 N ILE A 7 121.288 11.636 3.988 1.00 0.00 N ATOM 114 CA ILE A 7 122.471 10.850 3.509 1.00 0.00 C ATOM 115 C ILE A 7 122.490 10.870 1.974 1.00 0.00 C ATOM 116 O ILE A 7 121.447 10.930 1.347 1.00 0.00 O ATOM 117 CB ILE A 7 122.288 9.419 4.052 1.00 0.00 C ATOM 118 CG1 ILE A 7 122.214 9.434 5.586 1.00 0.00 C ATOM 119 CG2 ILE A 7 123.476 8.539 3.642 1.00 0.00 C ATOM 120 CD1 ILE A 7 121.687 8.088 6.091 1.00 0.00 C ATOM 0 H ILE A 7 120.403 11.381 3.550 1.00 0.00 H new ATOM 0 HA ILE A 7 123.418 11.263 3.856 1.00 0.00 H new ATOM 0 HB ILE A 7 121.363 9.020 3.637 1.00 0.00 H new ATOM 0 HG12 ILE A 7 123.201 9.629 6.005 1.00 0.00 H new ATOM 0 HG13 ILE A 7 121.560 10.240 5.920 1.00 0.00 H new ATOM 0 HG21 ILE A 7 123.334 7.531 4.032 1.00 0.00 H new ATOM 0 HG22 ILE A 7 123.543 8.501 2.555 1.00 0.00 H new ATOM 0 HG23 ILE A 7 124.397 8.959 4.048 1.00 0.00 H new ATOM 0 HD11 ILE A 7 121.636 8.103 7.180 1.00 0.00 H new ATOM 0 HD12 ILE A 7 120.692 7.911 5.683 1.00 0.00 H new ATOM 0 HD13 ILE A 7 122.358 7.291 5.770 1.00 0.00 H new ATOM 132 N GLU A 8 123.662 10.823 1.384 1.00 0.00 N ATOM 133 CA GLU A 8 123.781 10.837 -0.108 1.00 0.00 C ATOM 134 C GLU A 8 124.146 9.441 -0.624 1.00 0.00 C ATOM 135 O GLU A 8 124.951 8.752 -0.023 1.00 0.00 O ATOM 136 CB GLU A 8 124.905 11.830 -0.409 1.00 0.00 C ATOM 137 CG GLU A 8 124.456 13.245 -0.034 1.00 0.00 C ATOM 138 CD GLU A 8 125.553 14.247 -0.399 1.00 0.00 C ATOM 139 OE1 GLU A 8 126.098 14.134 -1.486 1.00 0.00 O ATOM 140 OE2 GLU A 8 125.831 15.112 0.415 1.00 0.00 O ATOM 0 H GLU A 8 124.552 10.775 1.881 1.00 0.00 H new ATOM 0 HA GLU A 8 122.847 11.121 -0.592 1.00 0.00 H new ATOM 0 HB2 GLU A 8 125.801 11.562 0.151 1.00 0.00 H new ATOM 0 HB3 GLU A 8 125.166 11.789 -1.466 1.00 0.00 H new ATOM 0 HG2 GLU A 8 123.533 13.495 -0.557 1.00 0.00 H new ATOM 0 HG3 GLU A 8 124.242 13.298 1.033 1.00 0.00 H new ATOM 147 N GLY A 9 123.557 9.035 -1.727 1.00 0.00 N ATOM 148 CA GLY A 9 123.859 7.696 -2.323 1.00 0.00 C ATOM 149 C GLY A 9 124.041 7.839 -3.836 1.00 0.00 C ATOM 150 O GLY A 9 123.444 8.706 -4.449 1.00 0.00 O ATOM 0 H GLY A 9 122.871 9.584 -2.244 1.00 0.00 H new ATOM 0 HA2 GLY A 9 124.762 7.282 -1.875 1.00 0.00 H new ATOM 0 HA3 GLY A 9 123.049 6.999 -2.108 1.00 0.00 H new ATOM 154 N GLU A 10 124.856 6.993 -4.426 1.00 0.00 N ATOM 155 CA GLU A 10 125.102 7.058 -5.900 1.00 0.00 C ATOM 156 C GLU A 10 124.381 5.908 -6.608 1.00 0.00 C ATOM 157 O GLU A 10 124.329 4.802 -6.099 1.00 0.00 O ATOM 158 CB GLU A 10 126.617 6.919 -6.065 1.00 0.00 C ATOM 159 CG GLU A 10 127.004 7.232 -7.511 1.00 0.00 C ATOM 160 CD GLU A 10 128.500 6.978 -7.707 1.00 0.00 C ATOM 161 OE1 GLU A 10 129.285 7.670 -7.081 1.00 0.00 O ATOM 162 OE2 GLU A 10 128.835 6.096 -8.481 1.00 0.00 O ATOM 0 H GLU A 10 125.365 6.254 -3.941 1.00 0.00 H new ATOM 0 HA GLU A 10 124.730 7.986 -6.335 1.00 0.00 H new ATOM 0 HB2 GLU A 10 127.131 7.598 -5.385 1.00 0.00 H new ATOM 0 HB3 GLU A 10 126.931 5.908 -5.804 1.00 0.00 H new ATOM 0 HG2 GLU A 10 126.426 6.611 -8.196 1.00 0.00 H new ATOM 0 HG3 GLU A 10 126.767 8.270 -7.745 1.00 0.00 H new ATOM 169 N VAL A 11 123.830 6.171 -7.774 1.00 0.00 N ATOM 170 CA VAL A 11 123.105 5.112 -8.561 1.00 0.00 C ATOM 171 C VAL A 11 124.083 3.995 -8.956 1.00 0.00 C ATOM 172 O VAL A 11 125.081 4.254 -9.603 1.00 0.00 O ATOM 173 CB VAL A 11 122.546 5.799 -9.827 1.00 0.00 C ATOM 174 CG1 VAL A 11 121.700 4.811 -10.639 1.00 0.00 C ATOM 175 CG2 VAL A 11 121.662 6.996 -9.452 1.00 0.00 C ATOM 0 H VAL A 11 123.852 7.088 -8.221 1.00 0.00 H new ATOM 0 HA VAL A 11 122.303 4.665 -7.974 1.00 0.00 H new ATOM 0 HB VAL A 11 123.395 6.141 -10.419 1.00 0.00 H new ATOM 0 HG11 VAL A 11 121.313 5.309 -11.528 1.00 0.00 H new ATOM 0 HG12 VAL A 11 122.317 3.963 -10.937 1.00 0.00 H new ATOM 0 HG13 VAL A 11 120.868 4.458 -10.030 1.00 0.00 H new ATOM 0 HG21 VAL A 11 121.280 7.464 -10.359 1.00 0.00 H new ATOM 0 HG22 VAL A 11 120.827 6.654 -8.840 1.00 0.00 H new ATOM 0 HG23 VAL A 11 122.251 7.721 -8.890 1.00 0.00 H new ATOM 185 N VAL A 12 123.793 2.775 -8.569 1.00 0.00 N ATOM 186 CA VAL A 12 124.640 1.607 -8.975 1.00 0.00 C ATOM 187 C VAL A 12 123.764 0.520 -9.609 1.00 0.00 C ATOM 188 O VAL A 12 122.558 0.520 -9.437 1.00 0.00 O ATOM 189 CB VAL A 12 125.322 1.093 -7.694 1.00 0.00 C ATOM 190 CG1 VAL A 12 126.253 2.175 -7.140 1.00 0.00 C ATOM 191 CG2 VAL A 12 124.292 0.723 -6.617 1.00 0.00 C ATOM 0 H VAL A 12 122.995 2.536 -7.981 1.00 0.00 H new ATOM 0 HA VAL A 12 125.386 1.891 -9.717 1.00 0.00 H new ATOM 0 HB VAL A 12 125.888 0.198 -7.953 1.00 0.00 H new ATOM 0 HG11 VAL A 12 126.735 1.810 -6.233 1.00 0.00 H new ATOM 0 HG12 VAL A 12 127.013 2.417 -7.883 1.00 0.00 H new ATOM 0 HG13 VAL A 12 125.674 3.069 -6.909 1.00 0.00 H new ATOM 0 HG21 VAL A 12 124.809 0.364 -5.727 1.00 0.00 H new ATOM 0 HG22 VAL A 12 123.700 1.602 -6.363 1.00 0.00 H new ATOM 0 HG23 VAL A 12 123.635 -0.060 -6.995 1.00 0.00 H new ATOM 201 N SER A 13 124.370 -0.394 -10.332 1.00 0.00 N ATOM 202 CA SER A 13 123.594 -1.492 -10.996 1.00 0.00 C ATOM 203 C SER A 13 123.372 -2.646 -10.014 1.00 0.00 C ATOM 204 O SER A 13 124.303 -3.101 -9.374 1.00 0.00 O ATOM 205 CB SER A 13 124.451 -1.955 -12.179 1.00 0.00 C ATOM 206 OG SER A 13 123.729 -2.918 -12.932 1.00 0.00 O ATOM 0 H SER A 13 125.377 -0.426 -10.492 1.00 0.00 H new ATOM 0 HA SER A 13 122.612 -1.151 -11.325 1.00 0.00 H new ATOM 0 HB2 SER A 13 124.712 -1.105 -12.809 1.00 0.00 H new ATOM 0 HB3 SER A 13 125.386 -2.384 -11.820 1.00 0.00 H new ATOM 0 HG SER A 13 124.273 -3.215 -13.691 1.00 0.00 H new ATOM 212 N GLY A 14 122.148 -3.110 -9.903 1.00 0.00 N ATOM 213 CA GLY A 14 121.827 -4.238 -8.976 1.00 0.00 C ATOM 214 C GLY A 14 120.399 -4.727 -9.235 1.00 0.00 C ATOM 215 O GLY A 14 119.454 -3.970 -9.104 1.00 0.00 O ATOM 0 H GLY A 14 121.349 -2.748 -10.424 1.00 0.00 H new ATOM 0 HA2 GLY A 14 122.534 -5.055 -9.123 1.00 0.00 H new ATOM 0 HA3 GLY A 14 121.928 -3.911 -7.941 1.00 0.00 H new ATOM 219 N LEU A 15 120.253 -5.981 -9.600 1.00 0.00 N ATOM 220 CA LEU A 15 118.899 -6.563 -9.853 1.00 0.00 C ATOM 221 C LEU A 15 118.931 -8.080 -9.651 1.00 0.00 C ATOM 222 O LEU A 15 118.058 -8.639 -9.012 1.00 0.00 O ATOM 223 CB LEU A 15 118.586 -6.220 -11.311 1.00 0.00 C ATOM 224 CG LEU A 15 117.074 -6.308 -11.543 1.00 0.00 C ATOM 225 CD1 LEU A 15 116.693 -5.454 -12.754 1.00 0.00 C ATOM 226 CD2 LEU A 15 116.682 -7.764 -11.802 1.00 0.00 C ATOM 0 H LEU A 15 121.027 -6.632 -9.734 1.00 0.00 H new ATOM 0 HA LEU A 15 118.145 -6.168 -9.172 1.00 0.00 H new ATOM 0 HB2 LEU A 15 118.943 -5.217 -11.544 1.00 0.00 H new ATOM 0 HB3 LEU A 15 119.108 -6.907 -11.977 1.00 0.00 H new ATOM 0 HG LEU A 15 116.549 -5.942 -10.661 1.00 0.00 H new ATOM 0 HD11 LEU A 15 115.617 -5.516 -12.919 1.00 0.00 H new ATOM 0 HD12 LEU A 15 116.972 -4.417 -12.570 1.00 0.00 H new ATOM 0 HD13 LEU A 15 117.218 -5.820 -13.637 1.00 0.00 H new ATOM 0 HD21 LEU A 15 115.606 -7.827 -11.967 1.00 0.00 H new ATOM 0 HD22 LEU A 15 117.207 -8.131 -12.684 1.00 0.00 H new ATOM 0 HD23 LEU A 15 116.953 -8.373 -10.939 1.00 0.00 H new ATOM 238 N GLY A 16 119.933 -8.738 -10.192 1.00 0.00 N ATOM 239 CA GLY A 16 120.094 -10.215 -10.009 1.00 0.00 C ATOM 240 C GLY A 16 120.323 -10.559 -8.531 1.00 0.00 C ATOM 241 O GLY A 16 119.963 -11.637 -8.090 1.00 0.00 O ATOM 0 H GLY A 16 120.658 -8.303 -10.763 1.00 0.00 H new ATOM 0 HA2 GLY A 16 119.205 -10.730 -10.374 1.00 0.00 H new ATOM 0 HA3 GLY A 16 120.935 -10.570 -10.604 1.00 0.00 H new ATOM 245 N GLU A 17 120.914 -9.656 -7.775 1.00 0.00 N ATOM 246 CA GLU A 17 121.165 -9.908 -6.314 1.00 0.00 C ATOM 247 C GLU A 17 119.844 -10.085 -5.555 1.00 0.00 C ATOM 248 O GLU A 17 119.789 -10.803 -4.572 1.00 0.00 O ATOM 249 CB GLU A 17 121.913 -8.678 -5.786 1.00 0.00 C ATOM 250 CG GLU A 17 123.289 -8.590 -6.452 1.00 0.00 C ATOM 251 CD GLU A 17 124.067 -7.408 -5.872 1.00 0.00 C ATOM 252 OE1 GLU A 17 124.054 -7.248 -4.662 1.00 0.00 O ATOM 253 OE2 GLU A 17 124.663 -6.679 -6.649 1.00 0.00 O ATOM 0 H GLU A 17 121.235 -8.748 -8.111 1.00 0.00 H new ATOM 0 HA GLU A 17 121.743 -10.821 -6.172 1.00 0.00 H new ATOM 0 HB2 GLU A 17 121.339 -7.774 -5.992 1.00 0.00 H new ATOM 0 HB3 GLU A 17 122.025 -8.744 -4.704 1.00 0.00 H new ATOM 0 HG2 GLU A 17 123.842 -9.516 -6.291 1.00 0.00 H new ATOM 0 HG3 GLU A 17 123.175 -8.470 -7.529 1.00 0.00 H new ATOM 260 N GLY A 18 118.795 -9.435 -6.009 1.00 0.00 N ATOM 261 CA GLY A 18 117.447 -9.602 -5.384 1.00 0.00 C ATOM 262 C GLY A 18 116.923 -11.013 -5.671 1.00 0.00 C ATOM 263 O GLY A 18 116.928 -11.455 -6.806 1.00 0.00 O ATOM 0 H GLY A 18 118.820 -8.788 -6.797 1.00 0.00 H new ATOM 0 HA2 GLY A 18 117.510 -9.438 -4.308 1.00 0.00 H new ATOM 0 HA3 GLY A 18 116.756 -8.858 -5.780 1.00 0.00 H new ATOM 267 N ARG A 19 116.476 -11.707 -4.649 1.00 0.00 N ATOM 268 CA ARG A 19 116.047 -13.131 -4.806 1.00 0.00 C ATOM 269 C ARG A 19 114.557 -13.289 -4.481 1.00 0.00 C ATOM 270 O ARG A 19 114.139 -14.319 -3.980 1.00 0.00 O ATOM 271 CB ARG A 19 116.906 -13.912 -3.807 1.00 0.00 C ATOM 272 CG ARG A 19 118.367 -13.891 -4.258 1.00 0.00 C ATOM 273 CD ARG A 19 119.210 -14.733 -3.298 1.00 0.00 C ATOM 274 NE ARG A 19 118.780 -16.145 -3.542 1.00 0.00 N ATOM 275 CZ ARG A 19 119.214 -16.857 -4.565 1.00 0.00 C ATOM 276 NH1 ARG A 19 120.059 -16.391 -5.455 1.00 0.00 N ATOM 277 NH2 ARG A 19 118.782 -18.082 -4.698 1.00 0.00 N ATOM 0 H ARG A 19 116.390 -11.340 -3.701 1.00 0.00 H new ATOM 0 HA ARG A 19 116.178 -13.488 -5.827 1.00 0.00 H new ATOM 0 HB2 ARG A 19 116.816 -13.473 -2.813 1.00 0.00 H new ATOM 0 HB3 ARG A 19 116.552 -14.940 -3.734 1.00 0.00 H new ATOM 0 HG2 ARG A 19 118.451 -14.282 -5.272 1.00 0.00 H new ATOM 0 HG3 ARG A 19 118.737 -12.866 -4.280 1.00 0.00 H new ATOM 0 HD2 ARG A 19 120.275 -14.606 -3.492 1.00 0.00 H new ATOM 0 HD3 ARG A 19 119.038 -14.441 -2.262 1.00 0.00 H new ATOM 0 HE ARG A 19 118.124 -16.575 -2.890 1.00 0.00 H new ATOM 0 HH11 ARG A 19 120.411 -15.437 -5.374 1.00 0.00 H new ATOM 0 HH12 ARG A 19 120.364 -16.983 -6.228 1.00 0.00 H new ATOM 0 HH21 ARG A 19 118.125 -18.467 -4.020 1.00 0.00 H new ATOM 0 HH22 ARG A 19 119.102 -18.654 -5.480 1.00 0.00 H new ATOM 291 N TYR A 20 113.765 -12.278 -4.766 1.00 0.00 N ATOM 292 CA TYR A 20 112.293 -12.353 -4.512 1.00 0.00 C ATOM 293 C TYR A 20 111.512 -11.939 -5.766 1.00 0.00 C ATOM 294 O TYR A 20 112.005 -11.176 -6.577 1.00 0.00 O ATOM 295 CB TYR A 20 112.039 -11.393 -3.341 1.00 0.00 C ATOM 296 CG TYR A 20 112.324 -9.935 -3.638 1.00 0.00 C ATOM 297 CD1 TYR A 20 113.669 -9.450 -3.638 1.00 0.00 C ATOM 298 CD2 TYR A 20 111.243 -9.044 -3.918 1.00 0.00 C ATOM 299 CE1 TYR A 20 113.930 -8.071 -3.918 1.00 0.00 C ATOM 300 CE2 TYR A 20 111.505 -7.667 -4.197 1.00 0.00 C ATOM 301 CZ TYR A 20 112.847 -7.181 -4.198 1.00 0.00 C ATOM 302 OH TYR A 20 113.099 -5.852 -4.467 1.00 0.00 O ATOM 0 H TYR A 20 114.083 -11.396 -5.168 1.00 0.00 H new ATOM 0 HA TYR A 20 111.962 -13.363 -4.272 1.00 0.00 H new ATOM 0 HB2 TYR A 20 110.998 -11.489 -3.031 1.00 0.00 H new ATOM 0 HB3 TYR A 20 112.653 -11.703 -2.496 1.00 0.00 H new ATOM 0 HD1 TYR A 20 114.487 -10.123 -3.427 1.00 0.00 H new ATOM 0 HD2 TYR A 20 110.227 -9.411 -3.919 1.00 0.00 H new ATOM 0 HE1 TYR A 20 114.945 -7.703 -3.918 1.00 0.00 H new ATOM 0 HE2 TYR A 20 110.687 -6.994 -4.407 1.00 0.00 H new ATOM 0 HH TYR A 20 112.253 -5.387 -4.637 1.00 0.00 H new ATOM 312 N PHE A 21 110.306 -12.442 -5.915 1.00 0.00 N ATOM 313 CA PHE A 21 109.456 -12.079 -7.089 1.00 0.00 C ATOM 314 C PHE A 21 108.308 -11.167 -6.646 1.00 0.00 C ATOM 315 O PHE A 21 107.501 -11.551 -5.818 1.00 0.00 O ATOM 316 CB PHE A 21 108.914 -13.410 -7.612 1.00 0.00 C ATOM 317 CG PHE A 21 109.991 -14.343 -8.114 1.00 0.00 C ATOM 318 CD1 PHE A 21 110.496 -14.200 -9.444 1.00 0.00 C ATOM 319 CD2 PHE A 21 110.505 -15.367 -7.262 1.00 0.00 C ATOM 320 CE1 PHE A 21 111.514 -15.081 -9.920 1.00 0.00 C ATOM 321 CE2 PHE A 21 111.524 -16.249 -7.738 1.00 0.00 C ATOM 322 CZ PHE A 21 112.029 -16.106 -9.066 1.00 0.00 C ATOM 0 H PHE A 21 109.873 -13.096 -5.263 1.00 0.00 H new ATOM 0 HA PHE A 21 110.014 -11.539 -7.854 1.00 0.00 H new ATOM 0 HB2 PHE A 21 108.358 -13.905 -6.816 1.00 0.00 H new ATOM 0 HB3 PHE A 21 108.209 -13.214 -8.420 1.00 0.00 H new ATOM 0 HD1 PHE A 21 110.107 -13.426 -10.089 1.00 0.00 H new ATOM 0 HD2 PHE A 21 110.124 -15.475 -6.257 1.00 0.00 H new ATOM 0 HE1 PHE A 21 111.895 -14.973 -10.925 1.00 0.00 H new ATOM 0 HE2 PHE A 21 111.912 -17.024 -7.093 1.00 0.00 H new ATOM 0 HZ PHE A 21 112.800 -16.772 -9.425 1.00 0.00 H new ATOM 332 N LEU A 22 108.239 -9.976 -7.196 1.00 0.00 N ATOM 333 CA LEU A 22 107.164 -9.004 -6.808 1.00 0.00 C ATOM 334 C LEU A 22 105.828 -9.362 -7.472 1.00 0.00 C ATOM 335 O LEU A 22 104.778 -9.049 -6.943 1.00 0.00 O ATOM 336 CB LEU A 22 107.644 -7.628 -7.280 1.00 0.00 C ATOM 337 CG LEU A 22 108.774 -7.144 -6.371 1.00 0.00 C ATOM 338 CD1 LEU A 22 109.468 -5.940 -7.013 1.00 0.00 C ATOM 339 CD2 LEU A 22 108.195 -6.732 -5.014 1.00 0.00 C ATOM 0 H LEU A 22 108.888 -9.633 -7.904 1.00 0.00 H new ATOM 0 HA LEU A 22 106.993 -9.022 -5.732 1.00 0.00 H new ATOM 0 HB2 LEU A 22 107.992 -7.686 -8.311 1.00 0.00 H new ATOM 0 HB3 LEU A 22 106.818 -6.917 -7.262 1.00 0.00 H new ATOM 0 HG LEU A 22 109.496 -7.948 -6.232 1.00 0.00 H new ATOM 0 HD11 LEU A 22 110.273 -5.596 -6.364 1.00 0.00 H new ATOM 0 HD12 LEU A 22 109.880 -6.230 -7.980 1.00 0.00 H new ATOM 0 HD13 LEU A 22 108.746 -5.136 -7.153 1.00 0.00 H new ATOM 0 HD21 LEU A 22 109.000 -6.387 -4.365 1.00 0.00 H new ATOM 0 HD22 LEU A 22 107.473 -5.928 -5.156 1.00 0.00 H new ATOM 0 HD23 LEU A 22 107.700 -7.588 -4.555 1.00 0.00 H new ATOM 351 N SER A 23 105.863 -10.011 -8.619 1.00 0.00 N ATOM 352 CA SER A 23 104.599 -10.394 -9.344 1.00 0.00 C ATOM 353 C SER A 23 103.672 -11.256 -8.471 1.00 0.00 C ATOM 354 O SER A 23 102.474 -11.280 -8.691 1.00 0.00 O ATOM 355 CB SER A 23 105.037 -11.190 -10.578 1.00 0.00 C ATOM 356 OG SER A 23 105.946 -10.408 -11.341 1.00 0.00 O ATOM 0 H SER A 23 106.723 -10.295 -9.089 1.00 0.00 H new ATOM 0 HA SER A 23 104.034 -9.500 -9.608 1.00 0.00 H new ATOM 0 HB2 SER A 23 105.509 -12.124 -10.274 1.00 0.00 H new ATOM 0 HB3 SER A 23 104.169 -11.453 -11.183 1.00 0.00 H new ATOM 0 HG SER A 23 105.841 -9.462 -11.106 1.00 0.00 H new ATOM 362 N LEU A 24 104.217 -11.953 -7.496 1.00 0.00 N ATOM 363 CA LEU A 24 103.378 -12.816 -6.594 1.00 0.00 C ATOM 364 C LEU A 24 102.394 -11.945 -5.784 1.00 0.00 C ATOM 365 O LEU A 24 102.789 -10.888 -5.327 1.00 0.00 O ATOM 366 CB LEU A 24 104.361 -13.528 -5.653 1.00 0.00 C ATOM 367 CG LEU A 24 103.802 -14.893 -5.242 1.00 0.00 C ATOM 368 CD1 LEU A 24 103.844 -15.847 -6.438 1.00 0.00 C ATOM 369 CD2 LEU A 24 104.650 -15.467 -4.105 1.00 0.00 C ATOM 0 H LEU A 24 105.215 -11.961 -7.285 1.00 0.00 H new ATOM 0 HA LEU A 24 102.784 -13.531 -7.164 1.00 0.00 H new ATOM 0 HB2 LEU A 24 105.324 -13.655 -6.149 1.00 0.00 H new ATOM 0 HB3 LEU A 24 104.536 -12.917 -4.768 1.00 0.00 H new ATOM 0 HG LEU A 24 102.771 -14.776 -4.908 1.00 0.00 H new ATOM 0 HD11 LEU A 24 103.446 -16.818 -6.143 1.00 0.00 H new ATOM 0 HD12 LEU A 24 103.242 -15.439 -7.250 1.00 0.00 H new ATOM 0 HD13 LEU A 24 104.874 -15.964 -6.774 1.00 0.00 H new ATOM 0 HD21 LEU A 24 104.254 -16.439 -3.811 1.00 0.00 H new ATOM 0 HD22 LEU A 24 105.680 -15.582 -4.442 1.00 0.00 H new ATOM 0 HD23 LEU A 24 104.621 -14.790 -3.252 1.00 0.00 H new ATOM 381 N PRO A 25 101.154 -12.388 -5.620 1.00 0.00 N ATOM 382 CA PRO A 25 100.125 -11.561 -4.902 1.00 0.00 C ATOM 383 C PRO A 25 100.572 -11.092 -3.499 1.00 0.00 C ATOM 384 O PRO A 25 100.448 -9.913 -3.221 1.00 0.00 O ATOM 385 CB PRO A 25 98.922 -12.498 -4.804 1.00 0.00 C ATOM 386 CG PRO A 25 99.085 -13.393 -5.981 1.00 0.00 C ATOM 387 CD PRO A 25 100.556 -13.667 -6.063 1.00 0.00 C ATOM 0 HA PRO A 25 99.923 -10.632 -5.436 1.00 0.00 H new ATOM 0 HB2 PRO A 25 98.925 -13.059 -3.869 1.00 0.00 H new ATOM 0 HB3 PRO A 25 97.981 -11.949 -4.844 1.00 0.00 H new ATOM 0 HG2 PRO A 25 98.519 -14.316 -5.856 1.00 0.00 H new ATOM 0 HG3 PRO A 25 98.721 -12.917 -6.892 1.00 0.00 H new ATOM 0 HD2 PRO A 25 100.850 -14.495 -5.418 1.00 0.00 H new ATOM 0 HD3 PRO A 25 100.863 -13.927 -7.076 1.00 0.00 H new ATOM 395 N PRO A 26 101.076 -11.980 -2.646 1.00 0.00 N ATOM 396 CA PRO A 26 101.309 -11.612 -1.210 1.00 0.00 C ATOM 397 C PRO A 26 102.203 -10.371 -1.065 1.00 0.00 C ATOM 398 O PRO A 26 101.958 -9.538 -0.211 1.00 0.00 O ATOM 399 CB PRO A 26 101.995 -12.842 -0.609 1.00 0.00 C ATOM 400 CG PRO A 26 101.639 -13.966 -1.520 1.00 0.00 C ATOM 401 CD PRO A 26 101.483 -13.379 -2.892 1.00 0.00 C ATOM 0 HA PRO A 26 100.376 -11.355 -0.709 1.00 0.00 H new ATOM 0 HB2 PRO A 26 103.075 -12.705 -0.555 1.00 0.00 H new ATOM 0 HB3 PRO A 26 101.647 -13.031 0.406 1.00 0.00 H new ATOM 0 HG2 PRO A 26 102.416 -14.731 -1.513 1.00 0.00 H new ATOM 0 HG3 PRO A 26 100.715 -14.447 -1.198 1.00 0.00 H new ATOM 0 HD2 PRO A 26 102.415 -13.429 -3.455 1.00 0.00 H new ATOM 0 HD3 PRO A 26 100.732 -13.916 -3.471 1.00 0.00 H new ATOM 409 N TYR A 27 103.217 -10.249 -1.893 1.00 0.00 N ATOM 410 CA TYR A 27 104.196 -9.118 -1.755 1.00 0.00 C ATOM 411 C TYR A 27 103.512 -7.774 -2.025 1.00 0.00 C ATOM 412 O TYR A 27 103.735 -6.813 -1.309 1.00 0.00 O ATOM 413 CB TYR A 27 105.295 -9.365 -2.793 1.00 0.00 C ATOM 414 CG TYR A 27 106.309 -10.397 -2.364 1.00 0.00 C ATOM 415 CD1 TYR A 27 107.038 -10.221 -1.147 1.00 0.00 C ATOM 416 CD2 TYR A 27 106.541 -11.550 -3.176 1.00 0.00 C ATOM 417 CE1 TYR A 27 108.000 -11.198 -0.743 1.00 0.00 C ATOM 418 CE2 TYR A 27 107.502 -12.526 -2.772 1.00 0.00 C ATOM 419 CZ TYR A 27 108.232 -12.351 -1.555 1.00 0.00 C ATOM 420 OH TYR A 27 109.160 -13.295 -1.166 1.00 0.00 O ATOM 0 H TYR A 27 103.410 -10.889 -2.664 1.00 0.00 H new ATOM 0 HA TYR A 27 104.603 -9.079 -0.745 1.00 0.00 H new ATOM 0 HB2 TYR A 27 104.835 -9.686 -3.728 1.00 0.00 H new ATOM 0 HB3 TYR A 27 105.809 -8.426 -2.997 1.00 0.00 H new ATOM 0 HD1 TYR A 27 106.862 -9.350 -0.533 1.00 0.00 H new ATOM 0 HD2 TYR A 27 105.990 -11.683 -4.095 1.00 0.00 H new ATOM 0 HE1 TYR A 27 108.552 -11.065 0.176 1.00 0.00 H new ATOM 0 HE2 TYR A 27 107.678 -13.397 -3.386 1.00 0.00 H new ATOM 0 HH TYR A 27 109.092 -14.080 -1.749 1.00 0.00 H new ATOM 430 N LYS A 28 102.685 -7.708 -3.045 1.00 0.00 N ATOM 431 CA LYS A 28 101.987 -6.422 -3.390 1.00 0.00 C ATOM 432 C LYS A 28 101.019 -6.026 -2.269 1.00 0.00 C ATOM 433 O LYS A 28 100.916 -4.861 -1.926 1.00 0.00 O ATOM 434 CB LYS A 28 101.218 -6.684 -4.690 1.00 0.00 C ATOM 435 CG LYS A 28 100.700 -5.359 -5.254 1.00 0.00 C ATOM 436 CD LYS A 28 99.713 -5.637 -6.389 1.00 0.00 C ATOM 437 CE LYS A 28 100.475 -6.130 -7.621 1.00 0.00 C ATOM 438 NZ LYS A 28 99.441 -6.771 -8.482 1.00 0.00 N ATOM 0 H LYS A 28 102.462 -8.493 -3.657 1.00 0.00 H new ATOM 0 HA LYS A 28 102.698 -5.605 -3.510 1.00 0.00 H new ATOM 0 HB2 LYS A 28 101.868 -7.172 -5.417 1.00 0.00 H new ATOM 0 HB3 LYS A 28 100.385 -7.362 -4.502 1.00 0.00 H new ATOM 0 HG2 LYS A 28 100.213 -4.783 -4.467 1.00 0.00 H new ATOM 0 HG3 LYS A 28 101.532 -4.758 -5.621 1.00 0.00 H new ATOM 0 HD2 LYS A 28 98.984 -6.385 -6.076 1.00 0.00 H new ATOM 0 HD3 LYS A 28 99.157 -4.731 -6.631 1.00 0.00 H new ATOM 0 HE2 LYS A 28 100.964 -5.305 -8.139 1.00 0.00 H new ATOM 0 HE3 LYS A 28 101.255 -6.840 -7.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 99.887 -7.135 -9.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 98.997 -7.557 -7.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 98.716 -6.069 -8.734 1.00 0.00 H new ATOM 452 N GLU A 29 100.323 -6.989 -1.704 1.00 0.00 N ATOM 453 CA GLU A 29 99.339 -6.690 -0.609 1.00 0.00 C ATOM 454 C GLU A 29 100.062 -6.159 0.634 1.00 0.00 C ATOM 455 O GLU A 29 99.645 -5.172 1.215 1.00 0.00 O ATOM 456 CB GLU A 29 98.637 -8.014 -0.287 1.00 0.00 C ATOM 457 CG GLU A 29 97.802 -8.464 -1.489 1.00 0.00 C ATOM 458 CD GLU A 29 96.585 -7.548 -1.649 1.00 0.00 C ATOM 459 OE1 GLU A 29 95.959 -7.242 -0.647 1.00 0.00 O ATOM 460 OE2 GLU A 29 96.299 -7.167 -2.773 1.00 0.00 O ATOM 0 H GLU A 29 100.395 -7.975 -1.956 1.00 0.00 H new ATOM 0 HA GLU A 29 98.626 -5.926 -0.920 1.00 0.00 H new ATOM 0 HB2 GLU A 29 99.375 -8.777 -0.039 1.00 0.00 H new ATOM 0 HB3 GLU A 29 97.997 -7.894 0.587 1.00 0.00 H new ATOM 0 HG2 GLU A 29 98.409 -8.439 -2.394 1.00 0.00 H new ATOM 0 HG3 GLU A 29 97.477 -9.495 -1.352 1.00 0.00 H new ATOM 467 N ILE A 30 101.137 -6.803 1.030 1.00 0.00 N ATOM 468 CA ILE A 30 101.851 -6.402 2.287 1.00 0.00 C ATOM 469 C ILE A 30 102.544 -5.045 2.086 1.00 0.00 C ATOM 470 O ILE A 30 102.624 -4.248 3.005 1.00 0.00 O ATOM 471 CB ILE A 30 102.842 -7.540 2.603 1.00 0.00 C ATOM 472 CG1 ILE A 30 103.520 -7.278 3.949 1.00 0.00 C ATOM 473 CG2 ILE A 30 103.916 -7.677 1.517 1.00 0.00 C ATOM 474 CD1 ILE A 30 104.165 -8.574 4.445 1.00 0.00 C ATOM 0 H ILE A 30 101.552 -7.592 0.534 1.00 0.00 H new ATOM 0 HA ILE A 30 101.171 -6.267 3.128 1.00 0.00 H new ATOM 0 HB ILE A 30 102.274 -8.470 2.641 1.00 0.00 H new ATOM 0 HG12 ILE A 30 104.275 -6.498 3.845 1.00 0.00 H new ATOM 0 HG13 ILE A 30 102.790 -6.920 4.675 1.00 0.00 H new ATOM 0 HG21 ILE A 30 104.595 -8.490 1.777 1.00 0.00 H new ATOM 0 HG22 ILE A 30 103.441 -7.893 0.560 1.00 0.00 H new ATOM 0 HG23 ILE A 30 104.477 -6.746 1.441 1.00 0.00 H new ATOM 0 HD11 ILE A 30 104.650 -8.395 5.404 1.00 0.00 H new ATOM 0 HD12 ILE A 30 103.398 -9.340 4.564 1.00 0.00 H new ATOM 0 HD13 ILE A 30 104.906 -8.912 3.721 1.00 0.00 H new ATOM 486 N PHE A 31 103.032 -4.786 0.892 1.00 0.00 N ATOM 487 CA PHE A 31 103.678 -3.465 0.588 1.00 0.00 C ATOM 488 C PHE A 31 102.645 -2.335 0.670 1.00 0.00 C ATOM 489 O PHE A 31 102.917 -1.295 1.239 1.00 0.00 O ATOM 490 CB PHE A 31 104.251 -3.581 -0.833 1.00 0.00 C ATOM 491 CG PHE A 31 105.675 -4.093 -0.882 1.00 0.00 C ATOM 492 CD1 PHE A 31 106.673 -3.534 -0.021 1.00 0.00 C ATOM 493 CD2 PHE A 31 106.025 -5.135 -1.796 1.00 0.00 C ATOM 494 CE1 PHE A 31 108.015 -4.020 -0.073 1.00 0.00 C ATOM 495 CE2 PHE A 31 107.369 -5.620 -1.848 1.00 0.00 C ATOM 496 CZ PHE A 31 108.364 -5.063 -0.986 1.00 0.00 C ATOM 0 H PHE A 31 103.010 -5.439 0.109 1.00 0.00 H new ATOM 0 HA PHE A 31 104.463 -3.231 1.307 1.00 0.00 H new ATOM 0 HB2 PHE A 31 103.616 -4.247 -1.417 1.00 0.00 H new ATOM 0 HB3 PHE A 31 104.211 -2.602 -1.311 1.00 0.00 H new ATOM 0 HD1 PHE A 31 106.411 -2.745 0.668 1.00 0.00 H new ATOM 0 HD2 PHE A 31 105.274 -5.556 -2.448 1.00 0.00 H new ATOM 0 HE1 PHE A 31 108.767 -3.599 0.578 1.00 0.00 H new ATOM 0 HE2 PHE A 31 107.633 -6.407 -2.539 1.00 0.00 H new ATOM 0 HZ PHE A 31 109.379 -5.430 -1.025 1.00 0.00 H new ATOM 506 N LYS A 32 101.474 -2.542 0.109 1.00 0.00 N ATOM 507 CA LYS A 32 100.395 -1.498 0.167 1.00 0.00 C ATOM 508 C LYS A 32 99.919 -1.289 1.609 1.00 0.00 C ATOM 509 O LYS A 32 99.510 -0.199 1.966 1.00 0.00 O ATOM 510 CB LYS A 32 99.246 -2.017 -0.705 1.00 0.00 C ATOM 511 CG LYS A 32 98.224 -0.898 -0.924 1.00 0.00 C ATOM 512 CD LYS A 32 97.068 -1.422 -1.779 1.00 0.00 C ATOM 513 CE LYS A 32 96.111 -0.273 -2.104 1.00 0.00 C ATOM 514 NZ LYS A 32 94.966 -0.915 -2.809 1.00 0.00 N ATOM 0 H LYS A 32 101.218 -3.394 -0.390 1.00 0.00 H new ATOM 0 HA LYS A 32 100.762 -0.536 -0.190 1.00 0.00 H new ATOM 0 HB2 LYS A 32 99.631 -2.364 -1.664 1.00 0.00 H new ATOM 0 HB3 LYS A 32 98.768 -2.871 -0.225 1.00 0.00 H new ATOM 0 HG2 LYS A 32 97.848 -0.541 0.035 1.00 0.00 H new ATOM 0 HG3 LYS A 32 98.698 -0.049 -1.416 1.00 0.00 H new ATOM 0 HD2 LYS A 32 97.453 -1.860 -2.700 1.00 0.00 H new ATOM 0 HD3 LYS A 32 96.537 -2.212 -1.247 1.00 0.00 H new ATOM 0 HE2 LYS A 32 95.782 0.235 -1.198 1.00 0.00 H new ATOM 0 HE3 LYS A 32 96.592 0.476 -2.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 94.266 -0.190 -3.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 95.309 -1.385 -3.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 94.524 -1.618 -2.184 1.00 0.00 H new ATOM 528 N LYS A 33 99.965 -2.320 2.421 1.00 0.00 N ATOM 529 CA LYS A 33 99.573 -2.179 3.863 1.00 0.00 C ATOM 530 C LYS A 33 100.592 -1.320 4.619 1.00 0.00 C ATOM 531 O LYS A 33 100.215 -0.501 5.439 1.00 0.00 O ATOM 532 CB LYS A 33 99.532 -3.598 4.442 1.00 0.00 C ATOM 533 CG LYS A 33 98.882 -3.568 5.828 1.00 0.00 C ATOM 534 CD LYS A 33 98.893 -4.975 6.427 1.00 0.00 C ATOM 535 CE LYS A 33 98.101 -4.978 7.736 1.00 0.00 C ATOM 536 NZ LYS A 33 97.625 -6.381 7.894 1.00 0.00 N ATOM 0 H LYS A 33 100.258 -3.257 2.146 1.00 0.00 H new ATOM 0 HA LYS A 33 98.606 -1.686 3.959 1.00 0.00 H new ATOM 0 HB2 LYS A 33 98.970 -4.256 3.780 1.00 0.00 H new ATOM 0 HB3 LYS A 33 100.542 -4.003 4.511 1.00 0.00 H new ATOM 0 HG2 LYS A 33 99.421 -2.880 6.479 1.00 0.00 H new ATOM 0 HG3 LYS A 33 97.858 -3.201 5.753 1.00 0.00 H new ATOM 0 HD2 LYS A 33 98.457 -5.685 5.724 1.00 0.00 H new ATOM 0 HD3 LYS A 33 99.919 -5.296 6.609 1.00 0.00 H new ATOM 0 HE2 LYS A 33 98.726 -4.676 8.576 1.00 0.00 H new ATOM 0 HE3 LYS A 33 97.265 -4.280 7.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 97.072 -6.463 8.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 97.027 -6.638 7.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 98.443 -7.022 7.938 1.00 0.00 H new ATOM 550 N ILE A 34 101.864 -1.502 4.345 1.00 0.00 N ATOM 551 CA ILE A 34 102.930 -0.774 5.111 1.00 0.00 C ATOM 552 C ILE A 34 103.091 0.644 4.544 1.00 0.00 C ATOM 553 O ILE A 34 103.321 1.581 5.288 1.00 0.00 O ATOM 554 CB ILE A 34 104.231 -1.588 4.950 1.00 0.00 C ATOM 555 CG1 ILE A 34 104.042 -3.027 5.451 1.00 0.00 C ATOM 556 CG2 ILE A 34 105.363 -0.946 5.766 1.00 0.00 C ATOM 557 CD1 ILE A 34 105.127 -3.921 4.846 1.00 0.00 C ATOM 0 H ILE A 34 102.212 -2.128 3.619 1.00 0.00 H new ATOM 0 HA ILE A 34 102.675 -0.678 6.166 1.00 0.00 H new ATOM 0 HB ILE A 34 104.484 -1.597 3.890 1.00 0.00 H new ATOM 0 HG12 ILE A 34 104.097 -3.055 6.539 1.00 0.00 H new ATOM 0 HG13 ILE A 34 103.055 -3.395 5.172 1.00 0.00 H new ATOM 0 HG21 ILE A 34 106.276 -1.530 5.644 1.00 0.00 H new ATOM 0 HG22 ILE A 34 105.533 0.071 5.414 1.00 0.00 H new ATOM 0 HG23 ILE A 34 105.085 -0.924 6.820 1.00 0.00 H new ATOM 0 HD11 ILE A 34 104.995 -4.943 5.200 1.00 0.00 H new ATOM 0 HD12 ILE A 34 105.051 -3.901 3.759 1.00 0.00 H new ATOM 0 HD13 ILE A 34 106.109 -3.556 5.148 1.00 0.00 H new ATOM 569 N LEU A 35 102.969 0.795 3.245 1.00 0.00 N ATOM 570 CA LEU A 35 103.226 2.118 2.591 1.00 0.00 C ATOM 571 C LEU A 35 101.921 2.820 2.202 1.00 0.00 C ATOM 572 O LEU A 35 101.883 4.035 2.116 1.00 0.00 O ATOM 573 CB LEU A 35 104.024 1.789 1.328 1.00 0.00 C ATOM 574 CG LEU A 35 105.392 1.213 1.696 1.00 0.00 C ATOM 575 CD1 LEU A 35 105.992 0.523 0.470 1.00 0.00 C ATOM 576 CD2 LEU A 35 106.317 2.345 2.149 1.00 0.00 C ATOM 0 H LEU A 35 102.699 0.049 2.604 1.00 0.00 H new ATOM 0 HA LEU A 35 103.754 2.791 3.267 1.00 0.00 H new ATOM 0 HB2 LEU A 35 103.473 1.073 0.718 1.00 0.00 H new ATOM 0 HB3 LEU A 35 104.151 2.689 0.726 1.00 0.00 H new ATOM 0 HG LEU A 35 105.281 0.491 2.505 1.00 0.00 H new ATOM 0 HD11 LEU A 35 106.968 0.110 0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 35 105.332 -0.281 0.145 1.00 0.00 H new ATOM 0 HD13 LEU A 35 106.105 1.248 -0.336 1.00 0.00 H new ATOM 0 HD21 LEU A 35 107.292 1.935 2.411 1.00 0.00 H new ATOM 0 HD22 LEU A 35 106.432 3.066 1.340 1.00 0.00 H new ATOM 0 HD23 LEU A 35 105.886 2.841 3.019 1.00 0.00 H new ATOM 588 N GLY A 36 100.866 2.072 1.970 1.00 0.00 N ATOM 589 CA GLY A 36 99.606 2.658 1.422 1.00 0.00 C ATOM 590 C GLY A 36 99.664 2.783 -0.110 1.00 0.00 C ATOM 591 O GLY A 36 98.846 3.482 -0.683 1.00 0.00 O ATOM 0 H GLY A 36 100.828 1.067 2.141 1.00 0.00 H new ATOM 0 HA2 GLY A 36 98.759 2.033 1.706 1.00 0.00 H new ATOM 0 HA3 GLY A 36 99.439 3.641 1.863 1.00 0.00 H new ATOM 595 N PHE A 37 100.602 2.131 -0.774 1.00 0.00 N ATOM 596 CA PHE A 37 100.568 2.049 -2.268 1.00 0.00 C ATOM 597 C PHE A 37 101.253 0.767 -2.755 1.00 0.00 C ATOM 598 O PHE A 37 102.004 0.149 -2.021 1.00 0.00 O ATOM 599 CB PHE A 37 101.297 3.304 -2.771 1.00 0.00 C ATOM 600 CG PHE A 37 102.767 3.386 -2.418 1.00 0.00 C ATOM 601 CD1 PHE A 37 103.715 2.557 -3.096 1.00 0.00 C ATOM 602 CD2 PHE A 37 103.214 4.308 -1.419 1.00 0.00 C ATOM 603 CE1 PHE A 37 105.104 2.646 -2.776 1.00 0.00 C ATOM 604 CE2 PHE A 37 104.604 4.396 -1.098 1.00 0.00 C ATOM 605 CZ PHE A 37 105.548 3.565 -1.776 1.00 0.00 C ATOM 0 H PHE A 37 101.390 1.653 -0.337 1.00 0.00 H new ATOM 0 HA PHE A 37 99.548 2.011 -2.650 1.00 0.00 H new ATOM 0 HB2 PHE A 37 101.198 3.351 -3.855 1.00 0.00 H new ATOM 0 HB3 PHE A 37 100.794 4.182 -2.367 1.00 0.00 H new ATOM 0 HD1 PHE A 37 103.380 1.862 -3.852 1.00 0.00 H new ATOM 0 HD2 PHE A 37 102.501 4.937 -0.908 1.00 0.00 H new ATOM 0 HE1 PHE A 37 105.818 2.019 -3.289 1.00 0.00 H new ATOM 0 HE2 PHE A 37 104.941 5.091 -0.343 1.00 0.00 H new ATOM 0 HZ PHE A 37 106.598 3.632 -1.532 1.00 0.00 H new ATOM 615 N GLU A 38 100.993 0.379 -3.983 1.00 0.00 N ATOM 616 CA GLU A 38 101.641 -0.838 -4.565 1.00 0.00 C ATOM 617 C GLU A 38 102.895 -0.434 -5.360 1.00 0.00 C ATOM 618 O GLU A 38 102.750 0.148 -6.420 1.00 0.00 O ATOM 619 CB GLU A 38 100.591 -1.444 -5.499 1.00 0.00 C ATOM 620 CG GLU A 38 99.418 -1.977 -4.674 1.00 0.00 C ATOM 621 CD GLU A 38 98.269 -2.365 -5.608 1.00 0.00 C ATOM 622 OE1 GLU A 38 97.961 -1.583 -6.493 1.00 0.00 O ATOM 623 OE2 GLU A 38 97.716 -3.437 -5.422 1.00 0.00 O ATOM 0 H GLU A 38 100.351 0.861 -4.613 1.00 0.00 H new ATOM 0 HA GLU A 38 101.957 -1.545 -3.798 1.00 0.00 H new ATOM 0 HB2 GLU A 38 100.240 -0.692 -6.205 1.00 0.00 H new ATOM 0 HB3 GLU A 38 101.033 -2.250 -6.085 1.00 0.00 H new ATOM 0 HG2 GLU A 38 99.734 -2.842 -4.090 1.00 0.00 H new ATOM 0 HG3 GLU A 38 99.084 -1.219 -3.965 1.00 0.00 H new ATOM 630 N PRO A 39 104.082 -0.737 -4.854 1.00 0.00 N ATOM 631 CA PRO A 39 105.337 -0.306 -5.545 1.00 0.00 C ATOM 632 C PRO A 39 105.494 -1.039 -6.882 1.00 0.00 C ATOM 633 O PRO A 39 104.912 -2.091 -7.080 1.00 0.00 O ATOM 634 CB PRO A 39 106.437 -0.708 -4.563 1.00 0.00 C ATOM 635 CG PRO A 39 105.845 -1.864 -3.838 1.00 0.00 C ATOM 636 CD PRO A 39 104.408 -1.495 -3.625 1.00 0.00 C ATOM 0 HA PRO A 39 105.354 0.757 -5.785 1.00 0.00 H new ATOM 0 HB2 PRO A 39 107.356 -0.985 -5.080 1.00 0.00 H new ATOM 0 HB3 PRO A 39 106.687 0.107 -3.884 1.00 0.00 H new ATOM 0 HG2 PRO A 39 105.935 -2.782 -4.419 1.00 0.00 H new ATOM 0 HG3 PRO A 39 106.353 -2.037 -2.889 1.00 0.00 H new ATOM 0 HD2 PRO A 39 103.776 -2.376 -3.513 1.00 0.00 H new ATOM 0 HD3 PRO A 39 104.274 -0.890 -2.728 1.00 0.00 H new ATOM 644 N TYR A 40 106.273 -0.484 -7.784 1.00 0.00 N ATOM 645 CA TYR A 40 106.472 -1.118 -9.130 1.00 0.00 C ATOM 646 C TYR A 40 107.373 -2.348 -9.002 1.00 0.00 C ATOM 647 O TYR A 40 108.070 -2.504 -8.014 1.00 0.00 O ATOM 648 CB TYR A 40 107.152 -0.061 -10.005 1.00 0.00 C ATOM 649 CG TYR A 40 107.286 -0.472 -11.451 1.00 0.00 C ATOM 650 CD1 TYR A 40 108.452 -1.173 -11.890 1.00 0.00 C ATOM 651 CD2 TYR A 40 106.247 -0.161 -12.382 1.00 0.00 C ATOM 652 CE1 TYR A 40 108.579 -1.562 -13.259 1.00 0.00 C ATOM 653 CE2 TYR A 40 106.374 -0.551 -13.752 1.00 0.00 C ATOM 654 CZ TYR A 40 107.541 -1.251 -14.190 1.00 0.00 C ATOM 655 OH TYR A 40 107.664 -1.627 -15.513 1.00 0.00 O ATOM 0 H TYR A 40 106.783 0.388 -7.644 1.00 0.00 H new ATOM 0 HA TYR A 40 105.525 -1.443 -9.560 1.00 0.00 H new ATOM 0 HB2 TYR A 40 106.581 0.866 -9.950 1.00 0.00 H new ATOM 0 HB3 TYR A 40 108.143 0.150 -9.602 1.00 0.00 H new ATOM 0 HD1 TYR A 40 109.237 -1.409 -11.187 1.00 0.00 H new ATOM 0 HD2 TYR A 40 105.366 0.369 -12.051 1.00 0.00 H new ATOM 0 HE1 TYR A 40 109.460 -2.091 -13.590 1.00 0.00 H new ATOM 0 HE2 TYR A 40 105.589 -0.317 -14.455 1.00 0.00 H new ATOM 0 HH TYR A 40 106.870 -1.339 -16.010 1.00 0.00 H new ATOM 665 N GLU A 41 107.361 -3.209 -9.997 1.00 0.00 N ATOM 666 CA GLU A 41 108.225 -4.435 -9.953 1.00 0.00 C ATOM 667 C GLU A 41 109.662 -4.072 -10.353 1.00 0.00 C ATOM 668 O GLU A 41 110.083 -4.290 -11.478 1.00 0.00 O ATOM 669 CB GLU A 41 107.602 -5.416 -10.957 1.00 0.00 C ATOM 670 CG GLU A 41 106.225 -5.858 -10.456 1.00 0.00 C ATOM 671 CD GLU A 41 105.639 -6.900 -11.414 1.00 0.00 C ATOM 672 OE1 GLU A 41 105.734 -6.698 -12.613 1.00 0.00 O ATOM 673 OE2 GLU A 41 105.103 -7.883 -10.928 1.00 0.00 O ATOM 0 H GLU A 41 106.790 -3.115 -10.837 1.00 0.00 H new ATOM 0 HA GLU A 41 108.273 -4.873 -8.956 1.00 0.00 H new ATOM 0 HB2 GLU A 41 107.510 -4.942 -11.934 1.00 0.00 H new ATOM 0 HB3 GLU A 41 108.250 -6.283 -11.083 1.00 0.00 H new ATOM 0 HG2 GLU A 41 106.309 -6.278 -9.454 1.00 0.00 H new ATOM 0 HG3 GLU A 41 105.559 -4.998 -10.387 1.00 0.00 H new ATOM 680 N GLY A 42 110.407 -3.514 -9.425 1.00 0.00 N ATOM 681 CA GLY A 42 111.851 -3.208 -9.663 1.00 0.00 C ATOM 682 C GLY A 42 112.461 -2.608 -8.393 1.00 0.00 C ATOM 683 O GLY A 42 111.774 -2.432 -7.402 1.00 0.00 O ATOM 0 H GLY A 42 110.067 -3.255 -8.499 1.00 0.00 H new ATOM 0 HA2 GLY A 42 112.385 -4.116 -9.942 1.00 0.00 H new ATOM 0 HA3 GLY A 42 111.954 -2.510 -10.494 1.00 0.00 H new ATOM 687 N THR A 43 113.738 -2.300 -8.426 1.00 0.00 N ATOM 688 CA THR A 43 114.413 -1.673 -7.247 1.00 0.00 C ATOM 689 C THR A 43 115.357 -0.553 -7.693 1.00 0.00 C ATOM 690 O THR A 43 115.845 -0.555 -8.809 1.00 0.00 O ATOM 691 CB THR A 43 115.213 -2.787 -6.560 1.00 0.00 C ATOM 692 OG1 THR A 43 115.798 -3.649 -7.529 1.00 0.00 O ATOM 693 CG2 THR A 43 114.292 -3.591 -5.642 1.00 0.00 C ATOM 0 H THR A 43 114.346 -2.459 -9.230 1.00 0.00 H new ATOM 0 HA THR A 43 113.679 -1.231 -6.573 1.00 0.00 H new ATOM 0 HB THR A 43 116.009 -2.334 -5.970 1.00 0.00 H new ATOM 0 HG1 THR A 43 116.306 -4.353 -7.076 1.00 0.00 H new ATOM 0 HG21 THR A 43 114.863 -4.382 -5.155 1.00 0.00 H new ATOM 0 HG22 THR A 43 113.867 -2.932 -4.885 1.00 0.00 H new ATOM 0 HG23 THR A 43 113.488 -4.034 -6.230 1.00 0.00 H new ATOM 701 N LEU A 44 115.604 0.393 -6.818 1.00 0.00 N ATOM 702 CA LEU A 44 116.696 1.387 -7.033 1.00 0.00 C ATOM 703 C LEU A 44 117.820 1.099 -6.035 1.00 0.00 C ATOM 704 O LEU A 44 117.624 1.219 -4.839 1.00 0.00 O ATOM 705 CB LEU A 44 116.051 2.750 -6.758 1.00 0.00 C ATOM 706 CG LEU A 44 117.047 3.876 -7.055 1.00 0.00 C ATOM 707 CD1 LEU A 44 117.263 3.987 -8.566 1.00 0.00 C ATOM 708 CD2 LEU A 44 116.493 5.200 -6.523 1.00 0.00 C ATOM 0 H LEU A 44 115.084 0.518 -5.950 1.00 0.00 H new ATOM 0 HA LEU A 44 117.125 1.351 -8.034 1.00 0.00 H new ATOM 0 HB2 LEU A 44 115.160 2.870 -7.375 1.00 0.00 H new ATOM 0 HB3 LEU A 44 115.728 2.805 -5.718 1.00 0.00 H new ATOM 0 HG LEU A 44 117.997 3.655 -6.568 1.00 0.00 H new ATOM 0 HD11 LEU A 44 117.972 4.789 -8.774 1.00 0.00 H new ATOM 0 HD12 LEU A 44 117.658 3.045 -8.947 1.00 0.00 H new ATOM 0 HD13 LEU A 44 116.313 4.206 -9.054 1.00 0.00 H new ATOM 0 HD21 LEU A 44 117.201 6.002 -6.734 1.00 0.00 H new ATOM 0 HD22 LEU A 44 115.542 5.418 -7.009 1.00 0.00 H new ATOM 0 HD23 LEU A 44 116.341 5.124 -5.446 1.00 0.00 H new ATOM 720 N ASN A 45 118.979 0.722 -6.523 1.00 0.00 N ATOM 721 CA ASN A 45 120.104 0.335 -5.620 1.00 0.00 C ATOM 722 C ASN A 45 121.086 1.500 -5.473 1.00 0.00 C ATOM 723 O ASN A 45 121.616 1.988 -6.455 1.00 0.00 O ATOM 724 CB ASN A 45 120.780 -0.851 -6.312 1.00 0.00 C ATOM 725 CG ASN A 45 119.942 -2.114 -6.099 1.00 0.00 C ATOM 726 OD1 ASN A 45 118.774 -2.145 -6.431 1.00 0.00 O ATOM 727 ND2 ASN A 45 120.495 -3.162 -5.555 1.00 0.00 N ATOM 0 H ASN A 45 119.193 0.666 -7.519 1.00 0.00 H new ATOM 0 HA ASN A 45 119.760 0.079 -4.618 1.00 0.00 H new ATOM 0 HB2 ASN A 45 120.889 -0.650 -7.378 1.00 0.00 H new ATOM 0 HB3 ASN A 45 121.783 -0.996 -5.911 1.00 0.00 H new ATOM 0 HD21 ASN A 45 119.947 -4.009 -5.408 1.00 0.00 H new ATOM 0 HD22 ASN A 45 121.476 -3.134 -5.277 1.00 0.00 H new ATOM 734 N LEU A 46 121.322 1.936 -4.256 1.00 0.00 N ATOM 735 CA LEU A 46 122.262 3.075 -4.011 1.00 0.00 C ATOM 736 C LEU A 46 123.413 2.634 -3.103 1.00 0.00 C ATOM 737 O LEU A 46 123.201 1.952 -2.117 1.00 0.00 O ATOM 738 CB LEU A 46 121.423 4.157 -3.328 1.00 0.00 C ATOM 739 CG LEU A 46 120.529 4.845 -4.363 1.00 0.00 C ATOM 740 CD1 LEU A 46 119.492 5.711 -3.645 1.00 0.00 C ATOM 741 CD2 LEU A 46 121.386 5.732 -5.270 1.00 0.00 C ATOM 0 H LEU A 46 120.898 1.546 -3.414 1.00 0.00 H new ATOM 0 HA LEU A 46 122.711 3.436 -4.936 1.00 0.00 H new ATOM 0 HB2 LEU A 46 120.812 3.715 -2.542 1.00 0.00 H new ATOM 0 HB3 LEU A 46 122.074 4.889 -2.851 1.00 0.00 H new ATOM 0 HG LEU A 46 120.023 4.089 -4.964 1.00 0.00 H new ATOM 0 HD11 LEU A 46 118.855 6.201 -4.381 1.00 0.00 H new ATOM 0 HD12 LEU A 46 118.881 5.084 -2.996 1.00 0.00 H new ATOM 0 HD13 LEU A 46 120.001 6.466 -3.045 1.00 0.00 H new ATOM 0 HD21 LEU A 46 120.749 6.222 -6.007 1.00 0.00 H new ATOM 0 HD22 LEU A 46 121.891 6.487 -4.668 1.00 0.00 H new ATOM 0 HD23 LEU A 46 122.128 5.119 -5.782 1.00 0.00 H new ATOM 753 N LYS A 47 124.618 3.028 -3.445 1.00 0.00 N ATOM 754 CA LYS A 47 125.796 2.778 -2.559 1.00 0.00 C ATOM 755 C LYS A 47 126.057 4.022 -1.703 1.00 0.00 C ATOM 756 O LYS A 47 126.072 5.126 -2.216 1.00 0.00 O ATOM 757 CB LYS A 47 126.968 2.520 -3.510 1.00 0.00 C ATOM 758 CG LYS A 47 128.194 2.066 -2.713 1.00 0.00 C ATOM 759 CD LYS A 47 129.399 1.961 -3.649 1.00 0.00 C ATOM 760 CE LYS A 47 130.588 1.369 -2.889 1.00 0.00 C ATOM 761 NZ LYS A 47 131.167 2.514 -2.131 1.00 0.00 N ATOM 0 H LYS A 47 124.836 3.518 -4.312 1.00 0.00 H new ATOM 0 HA LYS A 47 125.643 1.939 -1.881 1.00 0.00 H new ATOM 0 HB2 LYS A 47 126.695 1.758 -4.240 1.00 0.00 H new ATOM 0 HB3 LYS A 47 127.201 3.427 -4.068 1.00 0.00 H new ATOM 0 HG2 LYS A 47 128.403 2.775 -1.911 1.00 0.00 H new ATOM 0 HG3 LYS A 47 127.999 1.102 -2.243 1.00 0.00 H new ATOM 0 HD2 LYS A 47 129.153 1.334 -4.506 1.00 0.00 H new ATOM 0 HD3 LYS A 47 129.657 2.946 -4.038 1.00 0.00 H new ATOM 0 HE2 LYS A 47 130.270 0.571 -2.218 1.00 0.00 H new ATOM 0 HE3 LYS A 47 131.319 0.938 -3.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 132.064 2.804 -2.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 130.501 3.312 -2.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 131.341 2.226 -1.147 1.00 0.00 H new ATOM 775 N LEU A 48 126.255 3.837 -0.419 1.00 0.00 N ATOM 776 CA LEU A 48 126.427 4.992 0.513 1.00 0.00 C ATOM 777 C LEU A 48 127.857 5.035 1.055 1.00 0.00 C ATOM 778 O LEU A 48 128.565 4.044 1.018 1.00 0.00 O ATOM 779 CB LEU A 48 125.445 4.747 1.661 1.00 0.00 C ATOM 780 CG LEU A 48 124.004 4.807 1.149 1.00 0.00 C ATOM 781 CD1 LEU A 48 123.059 4.298 2.240 1.00 0.00 C ATOM 782 CD2 LEU A 48 123.643 6.252 0.801 1.00 0.00 C ATOM 0 H LEU A 48 126.305 2.921 0.027 1.00 0.00 H new ATOM 0 HA LEU A 48 126.241 5.940 0.009 1.00 0.00 H new ATOM 0 HB2 LEU A 48 125.638 3.774 2.112 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.593 5.494 2.441 1.00 0.00 H new ATOM 0 HG LEU A 48 123.908 4.185 0.259 1.00 0.00 H new ATOM 0 HD11 LEU A 48 122.031 4.339 1.879 1.00 0.00 H new ATOM 0 HD12 LEU A 48 123.314 3.269 2.491 1.00 0.00 H new ATOM 0 HD13 LEU A 48 123.157 4.923 3.127 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.617 6.293 0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 48 123.737 6.875 1.690 1.00 0.00 H new ATOM 0 HD23 LEU A 48 124.318 6.619 0.028 1.00 0.00 H new ATOM 794 N ASP A 49 128.271 6.178 1.550 1.00 0.00 N ATOM 795 CA ASP A 49 129.593 6.284 2.249 1.00 0.00 C ATOM 796 C ASP A 49 129.470 5.991 3.757 1.00 0.00 C ATOM 797 O ASP A 49 130.395 6.262 4.502 1.00 0.00 O ATOM 798 CB ASP A 49 130.088 7.720 1.999 1.00 0.00 C ATOM 799 CG ASP A 49 129.120 8.762 2.577 1.00 0.00 C ATOM 800 OD1 ASP A 49 127.959 8.737 2.202 1.00 0.00 O ATOM 801 OD2 ASP A 49 129.559 9.567 3.382 1.00 0.00 O ATOM 0 H ASP A 49 127.745 7.050 1.499 1.00 0.00 H new ATOM 0 HA ASP A 49 130.296 5.545 1.865 1.00 0.00 H new ATOM 0 HB2 ASP A 49 131.073 7.849 2.448 1.00 0.00 H new ATOM 0 HB3 ASP A 49 130.203 7.884 0.928 1.00 0.00 H new ATOM 806 N ARG A 50 128.354 5.448 4.206 1.00 0.00 N ATOM 807 CA ARG A 50 128.154 5.170 5.660 1.00 0.00 C ATOM 808 C ARG A 50 127.322 3.895 5.829 1.00 0.00 C ATOM 809 O ARG A 50 126.403 3.654 5.067 1.00 0.00 O ATOM 810 CB ARG A 50 127.386 6.378 6.205 1.00 0.00 C ATOM 811 CG ARG A 50 128.266 7.629 6.145 1.00 0.00 C ATOM 812 CD ARG A 50 127.546 8.789 6.842 1.00 0.00 C ATOM 813 NE ARG A 50 128.401 10.001 6.614 1.00 0.00 N ATOM 814 CZ ARG A 50 128.382 11.048 7.416 1.00 0.00 C ATOM 815 NH1 ARG A 50 127.597 11.134 8.466 1.00 0.00 N ATOM 816 NH2 ARG A 50 129.173 12.051 7.148 1.00 0.00 N ATOM 0 H ARG A 50 127.567 5.185 3.612 1.00 0.00 H new ATOM 0 HA ARG A 50 129.097 5.022 6.186 1.00 0.00 H new ATOM 0 HB2 ARG A 50 126.478 6.534 5.623 1.00 0.00 H new ATOM 0 HB3 ARG A 50 127.078 6.189 7.233 1.00 0.00 H new ATOM 0 HG2 ARG A 50 129.224 7.437 6.629 1.00 0.00 H new ATOM 0 HG3 ARG A 50 128.479 7.889 5.108 1.00 0.00 H new ATOM 0 HD2 ARG A 50 126.547 8.933 6.430 1.00 0.00 H new ATOM 0 HD3 ARG A 50 127.426 8.591 7.907 1.00 0.00 H new ATOM 0 HE ARG A 50 129.023 10.016 5.805 1.00 0.00 H new ATOM 0 HH11 ARG A 50 126.963 10.368 8.693 1.00 0.00 H new ATOM 0 HH12 ARG A 50 127.622 11.967 9.054 1.00 0.00 H new ATOM 0 HH21 ARG A 50 129.787 12.013 6.334 1.00 0.00 H new ATOM 0 HH22 ARG A 50 129.178 12.873 7.752 1.00 0.00 H new ATOM 830 N GLU A 51 127.643 3.089 6.819 1.00 0.00 N ATOM 831 CA GLU A 51 126.856 1.835 7.086 1.00 0.00 C ATOM 832 C GLU A 51 125.406 2.174 7.463 1.00 0.00 C ATOM 833 O GLU A 51 125.152 3.196 8.076 1.00 0.00 O ATOM 834 CB GLU A 51 127.566 1.099 8.238 1.00 0.00 C ATOM 835 CG GLU A 51 127.662 1.979 9.493 1.00 0.00 C ATOM 836 CD GLU A 51 128.057 1.114 10.692 1.00 0.00 C ATOM 837 OE1 GLU A 51 127.236 0.319 11.120 1.00 0.00 O ATOM 838 OE2 GLU A 51 129.173 1.262 11.162 1.00 0.00 O ATOM 0 H GLU A 51 128.422 3.247 7.458 1.00 0.00 H new ATOM 0 HA GLU A 51 126.812 1.206 6.197 1.00 0.00 H new ATOM 0 HB2 GLU A 51 127.024 0.183 8.475 1.00 0.00 H new ATOM 0 HB3 GLU A 51 128.567 0.805 7.921 1.00 0.00 H new ATOM 0 HG2 GLU A 51 128.399 2.768 9.342 1.00 0.00 H new ATOM 0 HG3 GLU A 51 126.706 2.467 9.682 1.00 0.00 H new ATOM 845 N PHE A 52 124.474 1.322 7.097 1.00 0.00 N ATOM 846 CA PHE A 52 123.032 1.577 7.406 1.00 0.00 C ATOM 847 C PHE A 52 122.382 0.333 8.017 1.00 0.00 C ATOM 848 O PHE A 52 122.588 -0.772 7.548 1.00 0.00 O ATOM 849 CB PHE A 52 122.385 1.910 6.060 1.00 0.00 C ATOM 850 CG PHE A 52 120.936 2.323 6.176 1.00 0.00 C ATOM 851 CD1 PHE A 52 119.936 1.342 6.464 1.00 0.00 C ATOM 852 CD2 PHE A 52 120.563 3.692 6.006 1.00 0.00 C ATOM 853 CE1 PHE A 52 118.565 1.730 6.581 1.00 0.00 C ATOM 854 CE2 PHE A 52 119.192 4.080 6.122 1.00 0.00 C ATOM 855 CZ PHE A 52 118.194 3.098 6.410 1.00 0.00 C ATOM 0 H PHE A 52 124.655 0.454 6.593 1.00 0.00 H new ATOM 0 HA PHE A 52 122.910 2.383 8.129 1.00 0.00 H new ATOM 0 HB2 PHE A 52 122.947 2.714 5.584 1.00 0.00 H new ATOM 0 HB3 PHE A 52 122.456 1.041 5.406 1.00 0.00 H new ATOM 0 HD1 PHE A 52 120.217 0.307 6.593 1.00 0.00 H new ATOM 0 HD2 PHE A 52 121.317 4.434 5.790 1.00 0.00 H new ATOM 0 HE1 PHE A 52 117.810 0.989 6.799 1.00 0.00 H new ATOM 0 HE2 PHE A 52 118.910 5.115 5.992 1.00 0.00 H new ATOM 0 HZ PHE A 52 117.158 3.391 6.498 1.00 0.00 H new ATOM 865 N ASP A 53 121.605 0.522 9.058 1.00 0.00 N ATOM 866 CA ASP A 53 120.804 -0.595 9.646 1.00 0.00 C ATOM 867 C ASP A 53 119.401 -0.095 10.002 1.00 0.00 C ATOM 868 O ASP A 53 119.259 0.898 10.694 1.00 0.00 O ATOM 869 CB ASP A 53 121.564 -1.011 10.909 1.00 0.00 C ATOM 870 CG ASP A 53 122.902 -1.645 10.521 1.00 0.00 C ATOM 871 OD1 ASP A 53 122.910 -2.457 9.610 1.00 0.00 O ATOM 872 OD2 ASP A 53 123.896 -1.308 11.144 1.00 0.00 O ATOM 0 H ASP A 53 121.492 1.419 9.531 1.00 0.00 H new ATOM 0 HA ASP A 53 120.683 -1.430 8.955 1.00 0.00 H new ATOM 0 HB2 ASP A 53 121.733 -0.143 11.546 1.00 0.00 H new ATOM 0 HB3 ASP A 53 120.969 -1.719 11.486 1.00 0.00 H new ATOM 877 N ILE A 54 118.379 -0.776 9.533 1.00 0.00 N ATOM 878 CA ILE A 54 116.967 -0.333 9.798 1.00 0.00 C ATOM 879 C ILE A 54 116.642 -0.367 11.305 1.00 0.00 C ATOM 880 O ILE A 54 115.749 0.332 11.751 1.00 0.00 O ATOM 881 CB ILE A 54 116.059 -1.277 8.982 1.00 0.00 C ATOM 882 CG1 ILE A 54 114.599 -0.822 9.100 1.00 0.00 C ATOM 883 CG2 ILE A 54 116.194 -2.727 9.465 1.00 0.00 C ATOM 884 CD1 ILE A 54 113.739 -1.540 8.058 1.00 0.00 C ATOM 0 H ILE A 54 118.462 -1.625 8.974 1.00 0.00 H new ATOM 0 HA ILE A 54 116.811 0.702 9.494 1.00 0.00 H new ATOM 0 HB ILE A 54 116.371 -1.235 7.939 1.00 0.00 H new ATOM 0 HG12 ILE A 54 114.224 -1.034 10.101 1.00 0.00 H new ATOM 0 HG13 ILE A 54 114.533 0.257 8.957 1.00 0.00 H new ATOM 0 HG21 ILE A 54 115.543 -3.370 8.872 1.00 0.00 H new ATOM 0 HG22 ILE A 54 117.228 -3.054 9.351 1.00 0.00 H new ATOM 0 HG23 ILE A 54 115.907 -2.789 10.515 1.00 0.00 H new ATOM 0 HD11 ILE A 54 112.704 -1.210 8.150 1.00 0.00 H new ATOM 0 HD12 ILE A 54 114.107 -1.306 7.059 1.00 0.00 H new ATOM 0 HD13 ILE A 54 113.792 -2.616 8.221 1.00 0.00 H new ATOM 896 N ASN A 55 117.353 -1.165 12.075 1.00 0.00 N ATOM 897 CA ASN A 55 117.078 -1.259 13.550 1.00 0.00 C ATOM 898 C ASN A 55 117.580 -0.023 14.314 1.00 0.00 C ATOM 899 O ASN A 55 117.408 0.049 15.519 1.00 0.00 O ATOM 900 CB ASN A 55 117.809 -2.513 14.044 1.00 0.00 C ATOM 901 CG ASN A 55 117.200 -3.758 13.396 1.00 0.00 C ATOM 902 OD1 ASN A 55 116.001 -3.838 13.216 1.00 0.00 O ATOM 903 ND2 ASN A 55 117.981 -4.738 13.034 1.00 0.00 N ATOM 0 H ASN A 55 118.114 -1.757 11.743 1.00 0.00 H new ATOM 0 HA ASN A 55 116.004 -1.312 13.726 1.00 0.00 H new ATOM 0 HB2 ASN A 55 118.869 -2.447 13.800 1.00 0.00 H new ATOM 0 HB3 ASN A 55 117.736 -2.584 15.129 1.00 0.00 H new ATOM 0 HD21 ASN A 55 117.585 -5.572 12.600 1.00 0.00 H new ATOM 0 HD22 ASN A 55 118.987 -4.671 13.185 1.00 0.00 H new ATOM 910 N LYS A 56 118.189 0.936 13.645 1.00 0.00 N ATOM 911 CA LYS A 56 118.509 2.247 14.296 1.00 0.00 C ATOM 912 C LYS A 56 117.373 3.265 14.102 1.00 0.00 C ATOM 913 O LYS A 56 117.348 4.278 14.778 1.00 0.00 O ATOM 914 CB LYS A 56 119.794 2.741 13.625 1.00 0.00 C ATOM 915 CG LYS A 56 120.953 1.811 13.992 1.00 0.00 C ATOM 916 CD LYS A 56 122.256 2.364 13.412 1.00 0.00 C ATOM 917 CE LYS A 56 123.393 1.375 13.674 1.00 0.00 C ATOM 918 NZ LYS A 56 124.641 2.159 13.461 1.00 0.00 N ATOM 0 H LYS A 56 118.478 0.862 12.670 1.00 0.00 H new ATOM 0 HA LYS A 56 118.631 2.129 15.373 1.00 0.00 H new ATOM 0 HB2 LYS A 56 119.664 2.768 12.543 1.00 0.00 H new ATOM 0 HB3 LYS A 56 120.016 3.759 13.945 1.00 0.00 H new ATOM 0 HG2 LYS A 56 121.033 1.723 15.075 1.00 0.00 H new ATOM 0 HG3 LYS A 56 120.766 0.810 13.604 1.00 0.00 H new ATOM 0 HD2 LYS A 56 122.147 2.533 12.341 1.00 0.00 H new ATOM 0 HD3 LYS A 56 122.487 3.328 13.865 1.00 0.00 H new ATOM 0 HE2 LYS A 56 123.345 0.977 14.688 1.00 0.00 H new ATOM 0 HE3 LYS A 56 123.340 0.524 12.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 125.467 1.548 13.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 124.662 2.519 12.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 124.667 2.958 14.126 1.00 0.00 H new ATOM 932 N PHE A 57 116.446 3.012 13.198 1.00 0.00 N ATOM 933 CA PHE A 57 115.255 3.903 13.036 1.00 0.00 C ATOM 934 C PHE A 57 113.984 3.119 13.376 1.00 0.00 C ATOM 935 O PHE A 57 114.046 1.929 13.628 1.00 0.00 O ATOM 936 CB PHE A 57 115.237 4.334 11.564 1.00 0.00 C ATOM 937 CG PHE A 57 116.520 4.976 11.085 1.00 0.00 C ATOM 938 CD1 PHE A 57 116.702 6.389 11.196 1.00 0.00 C ATOM 939 CD2 PHE A 57 117.556 4.165 10.527 1.00 0.00 C ATOM 940 CE1 PHE A 57 117.918 6.991 10.748 1.00 0.00 C ATOM 941 CE2 PHE A 57 118.771 4.766 10.077 1.00 0.00 C ATOM 942 CZ PHE A 57 118.953 6.178 10.187 1.00 0.00 C ATOM 0 H PHE A 57 116.470 2.216 12.561 1.00 0.00 H new ATOM 0 HA PHE A 57 115.303 4.769 13.696 1.00 0.00 H new ATOM 0 HB2 PHE A 57 115.029 3.461 10.945 1.00 0.00 H new ATOM 0 HB3 PHE A 57 114.416 5.035 11.413 1.00 0.00 H new ATOM 0 HD1 PHE A 57 115.920 7.002 11.619 1.00 0.00 H new ATOM 0 HD2 PHE A 57 117.420 3.097 10.446 1.00 0.00 H new ATOM 0 HE1 PHE A 57 118.056 8.059 10.833 1.00 0.00 H new ATOM 0 HE2 PHE A 57 119.552 4.152 9.653 1.00 0.00 H new ATOM 0 HZ PHE A 57 119.872 6.632 9.847 1.00 0.00 H new ATOM 952 N LYS A 58 112.849 3.781 13.381 1.00 0.00 N ATOM 953 CA LYS A 58 111.565 3.106 13.754 1.00 0.00 C ATOM 954 C LYS A 58 110.882 2.546 12.502 1.00 0.00 C ATOM 955 O LYS A 58 110.267 3.281 11.750 1.00 0.00 O ATOM 956 CB LYS A 58 110.702 4.192 14.400 1.00 0.00 C ATOM 957 CG LYS A 58 111.328 4.623 15.728 1.00 0.00 C ATOM 958 CD LYS A 58 110.462 5.704 16.377 1.00 0.00 C ATOM 959 CE LYS A 58 109.179 5.072 16.922 1.00 0.00 C ATOM 960 NZ LYS A 58 108.696 6.021 17.964 1.00 0.00 N ATOM 0 H LYS A 58 112.758 4.768 13.140 1.00 0.00 H new ATOM 0 HA LYS A 58 111.726 2.268 14.433 1.00 0.00 H new ATOM 0 HB2 LYS A 58 110.617 5.049 13.731 1.00 0.00 H new ATOM 0 HB3 LYS A 58 109.692 3.817 14.567 1.00 0.00 H new ATOM 0 HG2 LYS A 58 111.417 3.765 16.395 1.00 0.00 H new ATOM 0 HG3 LYS A 58 112.336 5.002 15.560 1.00 0.00 H new ATOM 0 HD2 LYS A 58 111.012 6.190 17.183 1.00 0.00 H new ATOM 0 HD3 LYS A 58 110.218 6.476 15.647 1.00 0.00 H new ATOM 0 HE2 LYS A 58 108.438 4.940 16.134 1.00 0.00 H new ATOM 0 HE3 LYS A 58 109.373 4.086 17.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 107.818 5.657 18.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 109.419 6.121 18.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 108.513 6.949 17.531 1.00 0.00 H new ATOM 974 N TYR A 59 110.991 1.254 12.290 1.00 0.00 N ATOM 975 CA TYR A 59 110.400 0.610 11.077 1.00 0.00 C ATOM 976 C TYR A 59 109.196 -0.262 11.461 1.00 0.00 C ATOM 977 O TYR A 59 108.853 -0.365 12.625 1.00 0.00 O ATOM 978 CB TYR A 59 111.551 -0.220 10.483 1.00 0.00 C ATOM 979 CG TYR A 59 111.989 -1.400 11.330 1.00 0.00 C ATOM 980 CD1 TYR A 59 113.007 -1.239 12.320 1.00 0.00 C ATOM 981 CD2 TYR A 59 111.371 -2.675 11.142 1.00 0.00 C ATOM 982 CE1 TYR A 59 113.408 -2.353 13.120 1.00 0.00 C ATOM 983 CE2 TYR A 59 111.772 -3.788 11.943 1.00 0.00 C ATOM 984 CZ TYR A 59 112.790 -3.627 12.933 1.00 0.00 C ATOM 985 OH TYR A 59 113.177 -4.702 13.706 1.00 0.00 O ATOM 0 H TYR A 59 111.473 0.611 12.918 1.00 0.00 H new ATOM 0 HA TYR A 59 110.017 1.332 10.356 1.00 0.00 H new ATOM 0 HB2 TYR A 59 111.247 -0.588 9.503 1.00 0.00 H new ATOM 0 HB3 TYR A 59 112.408 0.434 10.326 1.00 0.00 H new ATOM 0 HD1 TYR A 59 113.473 -0.275 12.463 1.00 0.00 H new ATOM 0 HD2 TYR A 59 110.601 -2.797 10.395 1.00 0.00 H new ATOM 0 HE1 TYR A 59 114.179 -2.232 13.867 1.00 0.00 H new ATOM 0 HE2 TYR A 59 111.306 -4.752 11.800 1.00 0.00 H new ATOM 0 HH TYR A 59 114.155 -4.728 13.764 1.00 0.00 H new ATOM 995 N ILE A 60 108.568 -0.878 10.486 1.00 0.00 N ATOM 996 CA ILE A 60 107.473 -1.859 10.764 1.00 0.00 C ATOM 997 C ILE A 60 107.977 -3.258 10.388 1.00 0.00 C ATOM 998 O ILE A 60 108.529 -3.445 9.319 1.00 0.00 O ATOM 999 CB ILE A 60 106.283 -1.431 9.884 1.00 0.00 C ATOM 1000 CG1 ILE A 60 105.838 -0.006 10.242 1.00 0.00 C ATOM 1001 CG2 ILE A 60 105.093 -2.374 10.104 1.00 0.00 C ATOM 1002 CD1 ILE A 60 104.921 0.538 9.144 1.00 0.00 C ATOM 0 H ILE A 60 108.772 -0.739 9.496 1.00 0.00 H new ATOM 0 HA ILE A 60 107.172 -1.881 11.811 1.00 0.00 H new ATOM 0 HB ILE A 60 106.605 -1.470 8.843 1.00 0.00 H new ATOM 0 HG12 ILE A 60 105.315 -0.007 11.199 1.00 0.00 H new ATOM 0 HG13 ILE A 60 106.709 0.640 10.355 1.00 0.00 H new ATOM 0 HG21 ILE A 60 104.259 -2.060 9.476 1.00 0.00 H new ATOM 0 HG22 ILE A 60 105.382 -3.392 9.842 1.00 0.00 H new ATOM 0 HG23 ILE A 60 104.791 -2.341 11.151 1.00 0.00 H new ATOM 0 HD11 ILE A 60 104.607 1.550 9.401 1.00 0.00 H new ATOM 0 HD12 ILE A 60 105.459 0.555 8.196 1.00 0.00 H new ATOM 0 HD13 ILE A 60 104.044 -0.102 9.052 1.00 0.00 H new ATOM 1014 N GLU A 61 107.788 -4.221 11.261 1.00 0.00 N ATOM 1015 CA GLU A 61 108.281 -5.608 11.001 1.00 0.00 C ATOM 1016 C GLU A 61 107.108 -6.526 10.651 1.00 0.00 C ATOM 1017 O GLU A 61 106.030 -6.384 11.200 1.00 0.00 O ATOM 1018 CB GLU A 61 108.923 -6.047 12.318 1.00 0.00 C ATOM 1019 CG GLU A 61 109.775 -7.296 12.083 1.00 0.00 C ATOM 1020 CD GLU A 61 110.322 -7.801 13.420 1.00 0.00 C ATOM 1021 OE1 GLU A 61 109.555 -7.867 14.366 1.00 0.00 O ATOM 1022 OE2 GLU A 61 111.500 -8.113 13.475 1.00 0.00 O ATOM 0 H GLU A 61 107.307 -4.101 12.152 1.00 0.00 H new ATOM 0 HA GLU A 61 108.981 -5.650 10.167 1.00 0.00 H new ATOM 0 HB2 GLU A 61 109.541 -5.243 12.719 1.00 0.00 H new ATOM 0 HB3 GLU A 61 108.151 -6.255 13.059 1.00 0.00 H new ATOM 0 HG2 GLU A 61 109.177 -8.073 11.606 1.00 0.00 H new ATOM 0 HG3 GLU A 61 110.597 -7.066 11.405 1.00 0.00 H new ATOM 1029 N THR A 62 107.318 -7.456 9.746 1.00 0.00 N ATOM 1030 CA THR A 62 106.224 -8.390 9.329 1.00 0.00 C ATOM 1031 C THR A 62 106.659 -9.848 9.511 1.00 0.00 C ATOM 1032 O THR A 62 107.758 -10.222 9.143 1.00 0.00 O ATOM 1033 CB THR A 62 105.973 -8.073 7.854 1.00 0.00 C ATOM 1034 OG1 THR A 62 107.201 -8.132 7.143 1.00 0.00 O ATOM 1035 CG2 THR A 62 105.372 -6.672 7.730 1.00 0.00 C ATOM 0 H THR A 62 108.210 -7.608 9.275 1.00 0.00 H new ATOM 0 HA THR A 62 105.324 -8.262 9.930 1.00 0.00 H new ATOM 0 HB THR A 62 105.279 -8.802 7.436 1.00 0.00 H new ATOM 0 HG1 THR A 62 107.740 -7.342 7.356 1.00 0.00 H new ATOM 0 HG21 THR A 62 105.193 -6.445 6.679 1.00 0.00 H new ATOM 0 HG22 THR A 62 104.430 -6.631 8.276 1.00 0.00 H new ATOM 0 HG23 THR A 62 106.065 -5.941 8.146 1.00 0.00 H new ATOM 1043 N GLU A 63 105.788 -10.658 10.070 1.00 0.00 N ATOM 1044 CA GLU A 63 106.170 -12.039 10.516 1.00 0.00 C ATOM 1045 C GLU A 63 106.278 -13.011 9.331 1.00 0.00 C ATOM 1046 O GLU A 63 105.936 -12.672 8.213 1.00 0.00 O ATOM 1047 CB GLU A 63 105.086 -12.497 11.509 1.00 0.00 C ATOM 1048 CG GLU A 63 103.695 -12.514 10.856 1.00 0.00 C ATOM 1049 CD GLU A 63 102.756 -13.393 11.683 1.00 0.00 C ATOM 1050 OE1 GLU A 63 102.951 -14.598 11.684 1.00 0.00 O ATOM 1051 OE2 GLU A 63 101.857 -12.847 12.301 1.00 0.00 O ATOM 0 H GLU A 63 104.812 -10.416 10.239 1.00 0.00 H new ATOM 0 HA GLU A 63 107.154 -12.028 10.985 1.00 0.00 H new ATOM 0 HB2 GLU A 63 105.328 -13.493 11.879 1.00 0.00 H new ATOM 0 HB3 GLU A 63 105.076 -11.831 12.371 1.00 0.00 H new ATOM 0 HG2 GLU A 63 103.299 -11.500 10.791 1.00 0.00 H new ATOM 0 HG3 GLU A 63 103.764 -12.895 9.837 1.00 0.00 H new ATOM 1058 N ASP A 64 106.751 -14.212 9.590 1.00 0.00 N ATOM 1059 CA ASP A 64 106.937 -15.232 8.503 1.00 0.00 C ATOM 1060 C ASP A 64 105.565 -15.670 7.978 1.00 0.00 C ATOM 1061 O ASP A 64 104.633 -15.823 8.748 1.00 0.00 O ATOM 1062 CB ASP A 64 107.660 -16.430 9.143 1.00 0.00 C ATOM 1063 CG ASP A 64 109.025 -16.002 9.695 1.00 0.00 C ATOM 1064 OD1 ASP A 64 109.853 -15.571 8.912 1.00 0.00 O ATOM 1065 OD2 ASP A 64 109.216 -16.114 10.895 1.00 0.00 O ATOM 0 H ASP A 64 107.019 -14.532 10.521 1.00 0.00 H new ATOM 0 HA ASP A 64 107.511 -14.829 7.669 1.00 0.00 H new ATOM 0 HB2 ASP A 64 107.050 -16.844 9.946 1.00 0.00 H new ATOM 0 HB3 ASP A 64 107.792 -17.220 8.404 1.00 0.00 H new ATOM 1070 N PHE A 65 105.445 -15.871 6.684 1.00 0.00 N ATOM 1071 CA PHE A 65 104.125 -16.234 6.078 1.00 0.00 C ATOM 1072 C PHE A 65 104.297 -17.339 5.029 1.00 0.00 C ATOM 1073 O PHE A 65 105.405 -17.628 4.614 1.00 0.00 O ATOM 1074 CB PHE A 65 103.606 -14.940 5.440 1.00 0.00 C ATOM 1075 CG PHE A 65 104.502 -14.372 4.362 1.00 0.00 C ATOM 1076 CD1 PHE A 65 104.317 -14.768 3.001 1.00 0.00 C ATOM 1077 CD2 PHE A 65 105.530 -13.440 4.702 1.00 0.00 C ATOM 1078 CE1 PHE A 65 105.162 -14.232 1.980 1.00 0.00 C ATOM 1079 CE2 PHE A 65 106.375 -12.905 3.680 1.00 0.00 C ATOM 1080 CZ PHE A 65 106.190 -13.301 2.319 1.00 0.00 C ATOM 0 H PHE A 65 106.214 -15.798 6.018 1.00 0.00 H new ATOM 0 HA PHE A 65 103.427 -16.624 6.819 1.00 0.00 H new ATOM 0 HB2 PHE A 65 102.621 -15.129 5.014 1.00 0.00 H new ATOM 0 HB3 PHE A 65 103.477 -14.190 6.221 1.00 0.00 H new ATOM 0 HD1 PHE A 65 103.539 -15.472 2.744 1.00 0.00 H new ATOM 0 HD2 PHE A 65 105.669 -13.140 5.730 1.00 0.00 H new ATOM 0 HE1 PHE A 65 105.023 -14.531 0.952 1.00 0.00 H new ATOM 0 HE2 PHE A 65 107.153 -12.201 3.936 1.00 0.00 H new ATOM 0 HZ PHE A 65 106.828 -12.896 1.547 1.00 0.00 H new ATOM 1090 N GLU A 66 103.209 -17.947 4.610 1.00 0.00 N ATOM 1091 CA GLU A 66 103.271 -19.016 3.567 1.00 0.00 C ATOM 1092 C GLU A 66 102.331 -18.687 2.401 1.00 0.00 C ATOM 1093 O GLU A 66 101.306 -18.055 2.584 1.00 0.00 O ATOM 1094 CB GLU A 66 102.815 -20.295 4.277 1.00 0.00 C ATOM 1095 CG GLU A 66 104.021 -20.998 4.908 1.00 0.00 C ATOM 1096 CD GLU A 66 103.563 -22.217 5.717 1.00 0.00 C ATOM 1097 OE1 GLU A 66 102.526 -22.135 6.357 1.00 0.00 O ATOM 1098 OE2 GLU A 66 104.266 -23.213 5.690 1.00 0.00 O ATOM 0 H GLU A 66 102.270 -17.743 4.953 1.00 0.00 H new ATOM 0 HA GLU A 66 104.271 -19.116 3.146 1.00 0.00 H new ATOM 0 HB2 GLU A 66 102.081 -20.053 5.045 1.00 0.00 H new ATOM 0 HB3 GLU A 66 102.325 -20.961 3.567 1.00 0.00 H new ATOM 0 HG2 GLU A 66 104.717 -21.310 4.129 1.00 0.00 H new ATOM 0 HG3 GLU A 66 104.557 -20.304 5.555 1.00 0.00 H new ATOM 1105 N PHE A 67 102.691 -19.116 1.213 1.00 0.00 N ATOM 1106 CA PHE A 67 101.803 -18.961 0.022 1.00 0.00 C ATOM 1107 C PHE A 67 102.043 -20.127 -0.943 1.00 0.00 C ATOM 1108 O PHE A 67 103.174 -20.489 -1.208 1.00 0.00 O ATOM 1109 CB PHE A 67 102.214 -17.627 -0.610 1.00 0.00 C ATOM 1110 CG PHE A 67 101.439 -17.275 -1.861 1.00 0.00 C ATOM 1111 CD1 PHE A 67 100.085 -16.828 -1.765 1.00 0.00 C ATOM 1112 CD2 PHE A 67 102.063 -17.390 -3.141 1.00 0.00 C ATOM 1113 CE1 PHE A 67 99.354 -16.498 -2.948 1.00 0.00 C ATOM 1114 CE2 PHE A 67 101.333 -17.060 -4.325 1.00 0.00 C ATOM 1115 CZ PHE A 67 99.979 -16.613 -4.229 1.00 0.00 C ATOM 0 H PHE A 67 103.581 -19.575 1.019 1.00 0.00 H new ATOM 0 HA PHE A 67 100.743 -18.967 0.277 1.00 0.00 H new ATOM 0 HB2 PHE A 67 102.080 -16.832 0.124 1.00 0.00 H new ATOM 0 HB3 PHE A 67 103.276 -17.663 -0.851 1.00 0.00 H new ATOM 0 HD1 PHE A 67 99.614 -16.739 -0.797 1.00 0.00 H new ATOM 0 HD2 PHE A 67 103.087 -17.726 -3.214 1.00 0.00 H new ATOM 0 HE1 PHE A 67 98.330 -16.162 -2.874 1.00 0.00 H new ATOM 0 HE2 PHE A 67 101.805 -17.149 -5.292 1.00 0.00 H new ATOM 0 HZ PHE A 67 99.428 -16.362 -5.123 1.00 0.00 H new ATOM 1125 N ASN A 68 100.986 -20.719 -1.463 1.00 0.00 N ATOM 1126 CA ASN A 68 101.095 -21.861 -2.441 1.00 0.00 C ATOM 1127 C ASN A 68 102.000 -22.987 -1.910 1.00 0.00 C ATOM 1128 O ASN A 68 102.684 -23.648 -2.673 1.00 0.00 O ATOM 1129 CB ASN A 68 101.673 -21.259 -3.732 1.00 0.00 C ATOM 1130 CG ASN A 68 100.542 -20.734 -4.622 1.00 0.00 C ATOM 1131 OD1 ASN A 68 100.454 -21.086 -5.781 1.00 0.00 O ATOM 1132 ND2 ASN A 68 99.669 -19.899 -4.127 1.00 0.00 N ATOM 0 H ASN A 68 100.026 -20.451 -1.244 1.00 0.00 H new ATOM 0 HA ASN A 68 100.120 -22.318 -2.609 1.00 0.00 H new ATOM 0 HB2 ASN A 68 102.360 -20.449 -3.488 1.00 0.00 H new ATOM 0 HB3 ASN A 68 102.248 -22.014 -4.269 1.00 0.00 H new ATOM 0 HD21 ASN A 68 98.914 -19.543 -4.714 1.00 0.00 H new ATOM 0 HD22 ASN A 68 99.742 -19.603 -3.154 1.00 0.00 H new ATOM 1139 N GLY A 69 101.996 -23.198 -0.614 1.00 0.00 N ATOM 1140 CA GLY A 69 102.780 -24.318 -0.005 1.00 0.00 C ATOM 1141 C GLY A 69 104.276 -23.982 0.094 1.00 0.00 C ATOM 1142 O GLY A 69 105.083 -24.876 0.284 1.00 0.00 O ATOM 0 H GLY A 69 101.475 -22.632 0.056 1.00 0.00 H new ATOM 0 HA2 GLY A 69 102.390 -24.535 0.989 1.00 0.00 H new ATOM 0 HA3 GLY A 69 102.649 -25.220 -0.603 1.00 0.00 H new ATOM 1146 N LYS A 70 104.652 -22.726 -0.029 1.00 0.00 N ATOM 1147 CA LYS A 70 106.091 -22.330 0.076 1.00 0.00 C ATOM 1148 C LYS A 70 106.272 -21.346 1.233 1.00 0.00 C ATOM 1149 O LYS A 70 105.447 -20.469 1.427 1.00 0.00 O ATOM 1150 CB LYS A 70 106.420 -21.657 -1.257 1.00 0.00 C ATOM 1151 CG LYS A 70 106.374 -22.693 -2.383 1.00 0.00 C ATOM 1152 CD LYS A 70 106.804 -22.039 -3.697 1.00 0.00 C ATOM 1153 CE LYS A 70 106.643 -23.040 -4.843 1.00 0.00 C ATOM 1154 NZ LYS A 70 106.964 -22.268 -6.076 1.00 0.00 N ATOM 0 H LYS A 70 104.011 -21.951 -0.200 1.00 0.00 H new ATOM 0 HA LYS A 70 106.744 -23.181 0.269 1.00 0.00 H new ATOM 0 HB2 LYS A 70 105.708 -20.857 -1.457 1.00 0.00 H new ATOM 0 HB3 LYS A 70 107.408 -21.200 -1.210 1.00 0.00 H new ATOM 0 HG2 LYS A 70 107.032 -23.530 -2.149 1.00 0.00 H new ATOM 0 HG3 LYS A 70 105.366 -23.097 -2.479 1.00 0.00 H new ATOM 0 HD2 LYS A 70 106.201 -21.151 -3.888 1.00 0.00 H new ATOM 0 HD3 LYS A 70 107.841 -21.711 -3.630 1.00 0.00 H new ATOM 0 HE2 LYS A 70 107.315 -23.889 -4.723 1.00 0.00 H new ATOM 0 HE3 LYS A 70 105.629 -23.439 -4.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 106.876 -22.888 -6.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 106.304 -21.470 -6.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 107.937 -21.907 -6.016 1.00 0.00 H new ATOM 1168 N ARG A 71 107.336 -21.490 1.987 1.00 0.00 N ATOM 1169 CA ARG A 71 107.565 -20.609 3.176 1.00 0.00 C ATOM 1170 C ARG A 71 108.430 -19.407 2.791 1.00 0.00 C ATOM 1171 O ARG A 71 109.456 -19.559 2.154 1.00 0.00 O ATOM 1172 CB ARG A 71 108.291 -21.489 4.199 1.00 0.00 C ATOM 1173 CG ARG A 71 107.343 -22.583 4.692 1.00 0.00 C ATOM 1174 CD ARG A 71 108.059 -23.457 5.728 1.00 0.00 C ATOM 1175 NE ARG A 71 107.084 -24.538 6.094 1.00 0.00 N ATOM 1176 CZ ARG A 71 107.464 -25.716 6.551 1.00 0.00 C ATOM 1177 NH1 ARG A 71 108.721 -26.035 6.754 1.00 0.00 N ATOM 1178 NH2 ARG A 71 106.544 -26.600 6.826 1.00 0.00 N ATOM 0 H ARG A 71 108.063 -22.188 1.827 1.00 0.00 H new ATOM 0 HA ARG A 71 106.631 -20.212 3.574 1.00 0.00 H new ATOM 0 HB2 ARG A 71 109.176 -21.936 3.747 1.00 0.00 H new ATOM 0 HB3 ARG A 71 108.633 -20.883 5.038 1.00 0.00 H new ATOM 0 HG2 ARG A 71 106.453 -22.135 5.133 1.00 0.00 H new ATOM 0 HG3 ARG A 71 107.010 -23.195 3.853 1.00 0.00 H new ATOM 0 HD2 ARG A 71 108.976 -23.880 5.317 1.00 0.00 H new ATOM 0 HD3 ARG A 71 108.342 -22.873 6.604 1.00 0.00 H new ATOM 0 HE ARG A 71 106.087 -24.354 5.985 1.00 0.00 H new ATOM 0 HH11 ARG A 71 109.457 -25.357 6.557 1.00 0.00 H new ATOM 0 HH12 ARG A 71 108.961 -26.961 7.109 1.00 0.00 H new ATOM 0 HH21 ARG A 71 105.560 -26.372 6.686 1.00 0.00 H new ATOM 0 HH22 ARG A 71 106.809 -27.519 7.181 1.00 0.00 H new ATOM 1192 N PHE A 72 108.011 -18.223 3.178 1.00 0.00 N ATOM 1193 CA PHE A 72 108.799 -16.985 2.894 1.00 0.00 C ATOM 1194 C PHE A 72 109.171 -16.299 4.211 1.00 0.00 C ATOM 1195 O PHE A 72 108.386 -16.284 5.143 1.00 0.00 O ATOM 1196 CB PHE A 72 107.864 -16.103 2.066 1.00 0.00 C ATOM 1197 CG PHE A 72 107.491 -16.710 0.735 1.00 0.00 C ATOM 1198 CD1 PHE A 72 106.464 -17.703 0.664 1.00 0.00 C ATOM 1199 CD2 PHE A 72 108.165 -16.294 -0.456 1.00 0.00 C ATOM 1200 CE1 PHE A 72 106.111 -18.278 -0.597 1.00 0.00 C ATOM 1201 CE2 PHE A 72 107.813 -16.869 -1.715 1.00 0.00 C ATOM 1202 CZ PHE A 72 106.786 -17.861 -1.786 1.00 0.00 C ATOM 0 H PHE A 72 107.142 -18.063 3.687 1.00 0.00 H new ATOM 0 HA PHE A 72 109.730 -17.189 2.365 1.00 0.00 H new ATOM 0 HB2 PHE A 72 106.956 -15.912 2.637 1.00 0.00 H new ATOM 0 HB3 PHE A 72 108.342 -15.138 1.896 1.00 0.00 H new ATOM 0 HD1 PHE A 72 105.955 -18.019 1.563 1.00 0.00 H new ATOM 0 HD2 PHE A 72 108.941 -15.544 -0.403 1.00 0.00 H new ATOM 0 HE1 PHE A 72 105.335 -19.027 -0.651 1.00 0.00 H new ATOM 0 HE2 PHE A 72 108.323 -16.554 -2.614 1.00 0.00 H new ATOM 0 HZ PHE A 72 106.520 -18.295 -2.738 1.00 0.00 H new ATOM 1212 N PHE A 73 110.351 -15.729 4.277 1.00 0.00 N ATOM 1213 CA PHE A 73 110.915 -15.275 5.588 1.00 0.00 C ATOM 1214 C PHE A 73 110.428 -13.863 5.922 1.00 0.00 C ATOM 1215 O PHE A 73 110.084 -13.097 5.039 1.00 0.00 O ATOM 1216 CB PHE A 73 112.436 -15.293 5.416 1.00 0.00 C ATOM 1217 CG PHE A 73 113.000 -16.676 5.192 1.00 0.00 C ATOM 1218 CD1 PHE A 73 113.403 -17.474 6.308 1.00 0.00 C ATOM 1219 CD2 PHE A 73 113.133 -17.188 3.864 1.00 0.00 C ATOM 1220 CE1 PHE A 73 113.937 -18.782 6.096 1.00 0.00 C ATOM 1221 CE2 PHE A 73 113.667 -18.496 3.652 1.00 0.00 C ATOM 1222 CZ PHE A 73 114.069 -19.293 4.768 1.00 0.00 C ATOM 0 H PHE A 73 110.952 -15.558 3.471 1.00 0.00 H new ATOM 0 HA PHE A 73 110.597 -15.921 6.406 1.00 0.00 H new ATOM 0 HB2 PHE A 73 112.706 -14.658 4.572 1.00 0.00 H new ATOM 0 HB3 PHE A 73 112.899 -14.859 6.302 1.00 0.00 H new ATOM 0 HD1 PHE A 73 113.304 -17.088 7.312 1.00 0.00 H new ATOM 0 HD2 PHE A 73 112.830 -16.586 3.020 1.00 0.00 H new ATOM 0 HE1 PHE A 73 114.241 -19.385 6.939 1.00 0.00 H new ATOM 0 HE2 PHE A 73 113.767 -18.882 2.648 1.00 0.00 H new ATOM 0 HZ PHE A 73 114.473 -20.282 4.608 1.00 0.00 H new ATOM 1232 N GLY A 74 110.402 -13.530 7.193 1.00 0.00 N ATOM 1233 CA GLY A 74 109.882 -12.204 7.644 1.00 0.00 C ATOM 1234 C GLY A 74 110.807 -11.087 7.161 1.00 0.00 C ATOM 1235 O GLY A 74 111.973 -11.316 6.886 1.00 0.00 O ATOM 0 H GLY A 74 110.726 -14.135 7.948 1.00 0.00 H new ATOM 0 HA2 GLY A 74 108.876 -12.048 7.255 1.00 0.00 H new ATOM 0 HA3 GLY A 74 109.810 -12.183 8.731 1.00 0.00 H new ATOM 1239 N VAL A 75 110.287 -9.885 7.064 1.00 0.00 N ATOM 1240 CA VAL A 75 111.061 -8.752 6.465 1.00 0.00 C ATOM 1241 C VAL A 75 110.848 -7.472 7.277 1.00 0.00 C ATOM 1242 O VAL A 75 109.880 -7.354 8.006 1.00 0.00 O ATOM 1243 CB VAL A 75 110.554 -8.586 5.021 1.00 0.00 C ATOM 1244 CG1 VAL A 75 110.871 -9.850 4.217 1.00 0.00 C ATOM 1245 CG2 VAL A 75 109.040 -8.337 4.983 1.00 0.00 C ATOM 0 H VAL A 75 109.348 -9.639 7.378 1.00 0.00 H new ATOM 0 HA VAL A 75 112.132 -8.956 6.473 1.00 0.00 H new ATOM 0 HB VAL A 75 111.058 -7.723 4.586 1.00 0.00 H new ATOM 0 HG11 VAL A 75 110.511 -9.731 3.195 1.00 0.00 H new ATOM 0 HG12 VAL A 75 111.949 -10.013 4.206 1.00 0.00 H new ATOM 0 HG13 VAL A 75 110.379 -10.707 4.677 1.00 0.00 H new ATOM 0 HG21 VAL A 75 108.716 -8.224 3.948 1.00 0.00 H new ATOM 0 HG22 VAL A 75 108.521 -9.182 5.436 1.00 0.00 H new ATOM 0 HG23 VAL A 75 108.807 -7.428 5.537 1.00 0.00 H new ATOM 1255 N LYS A 76 111.751 -6.527 7.149 1.00 0.00 N ATOM 1256 CA LYS A 76 111.596 -5.206 7.831 1.00 0.00 C ATOM 1257 C LYS A 76 111.490 -4.099 6.777 1.00 0.00 C ATOM 1258 O LYS A 76 112.241 -4.090 5.817 1.00 0.00 O ATOM 1259 CB LYS A 76 112.867 -5.031 8.665 1.00 0.00 C ATOM 1260 CG LYS A 76 112.914 -6.090 9.771 1.00 0.00 C ATOM 1261 CD LYS A 76 114.144 -5.857 10.651 1.00 0.00 C ATOM 1262 CE LYS A 76 114.204 -6.932 11.738 1.00 0.00 C ATOM 1263 NZ LYS A 76 115.530 -6.747 12.390 1.00 0.00 N ATOM 0 H LYS A 76 112.600 -6.619 6.592 1.00 0.00 H new ATOM 0 HA LYS A 76 110.701 -5.157 8.451 1.00 0.00 H new ATOM 0 HB2 LYS A 76 113.746 -5.120 8.027 1.00 0.00 H new ATOM 0 HB3 LYS A 76 112.890 -4.033 9.103 1.00 0.00 H new ATOM 0 HG2 LYS A 76 112.008 -6.041 10.375 1.00 0.00 H new ATOM 0 HG3 LYS A 76 112.951 -7.087 9.333 1.00 0.00 H new ATOM 0 HD2 LYS A 76 115.049 -5.887 10.045 1.00 0.00 H new ATOM 0 HD3 LYS A 76 114.097 -4.867 11.105 1.00 0.00 H new ATOM 0 HE2 LYS A 76 113.392 -6.814 12.455 1.00 0.00 H new ATOM 0 HE3 LYS A 76 114.110 -7.931 11.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 115.591 -7.355 13.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 116.284 -7.004 11.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 115.642 -5.753 12.673 1.00 0.00 H new ATOM 1277 N VAL A 77 110.569 -3.181 6.958 1.00 0.00 N ATOM 1278 CA VAL A 77 110.335 -2.107 5.938 1.00 0.00 C ATOM 1279 C VAL A 77 110.270 -0.745 6.641 1.00 0.00 C ATOM 1280 O VAL A 77 109.692 -0.629 7.706 1.00 0.00 O ATOM 1281 CB VAL A 77 108.995 -2.453 5.259 1.00 0.00 C ATOM 1282 CG1 VAL A 77 108.670 -1.431 4.163 1.00 0.00 C ATOM 1283 CG2 VAL A 77 109.068 -3.840 4.607 1.00 0.00 C ATOM 0 H VAL A 77 109.963 -3.129 7.777 1.00 0.00 H new ATOM 0 HA VAL A 77 111.135 -2.051 5.199 1.00 0.00 H new ATOM 0 HB VAL A 77 108.221 -2.439 6.027 1.00 0.00 H new ATOM 0 HG11 VAL A 77 107.721 -1.690 3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 77 108.598 -0.436 4.603 1.00 0.00 H new ATOM 0 HG13 VAL A 77 109.460 -1.439 3.412 1.00 0.00 H new ATOM 0 HG21 VAL A 77 108.114 -4.069 4.132 1.00 0.00 H new ATOM 0 HG22 VAL A 77 109.858 -3.848 3.856 1.00 0.00 H new ATOM 0 HG23 VAL A 77 109.283 -4.589 5.369 1.00 0.00 H new ATOM 1293 N LEU A 78 110.858 0.268 6.046 1.00 0.00 N ATOM 1294 CA LEU A 78 110.822 1.641 6.640 1.00 0.00 C ATOM 1295 C LEU A 78 110.532 2.684 5.541 1.00 0.00 C ATOM 1296 O LEU A 78 111.246 2.706 4.557 1.00 0.00 O ATOM 1297 CB LEU A 78 112.227 1.829 7.224 1.00 0.00 C ATOM 1298 CG LEU A 78 112.347 3.172 7.954 1.00 0.00 C ATOM 1299 CD1 LEU A 78 111.472 3.175 9.210 1.00 0.00 C ATOM 1300 CD2 LEU A 78 113.804 3.384 8.364 1.00 0.00 C ATOM 0 H LEU A 78 111.366 0.199 5.164 1.00 0.00 H new ATOM 0 HA LEU A 78 110.044 1.764 7.393 1.00 0.00 H new ATOM 0 HB2 LEU A 78 112.449 1.015 7.914 1.00 0.00 H new ATOM 0 HB3 LEU A 78 112.966 1.779 6.424 1.00 0.00 H new ATOM 0 HG LEU A 78 112.018 3.970 7.289 1.00 0.00 H new ATOM 0 HD11 LEU A 78 111.568 4.135 9.718 1.00 0.00 H new ATOM 0 HD12 LEU A 78 110.431 3.015 8.929 1.00 0.00 H new ATOM 0 HD13 LEU A 78 111.793 2.377 9.879 1.00 0.00 H new ATOM 0 HD21 LEU A 78 113.901 4.337 8.884 1.00 0.00 H new ATOM 0 HD22 LEU A 78 114.117 2.576 9.025 1.00 0.00 H new ATOM 0 HD23 LEU A 78 114.435 3.390 7.475 1.00 0.00 H new ATOM 1312 N PRO A 79 109.510 3.514 5.716 1.00 0.00 N ATOM 1313 CA PRO A 79 109.210 4.586 4.712 1.00 0.00 C ATOM 1314 C PRO A 79 110.357 5.601 4.616 1.00 0.00 C ATOM 1315 O PRO A 79 111.049 5.850 5.586 1.00 0.00 O ATOM 1316 CB PRO A 79 107.948 5.254 5.273 1.00 0.00 C ATOM 1317 CG PRO A 79 107.349 4.204 6.139 1.00 0.00 C ATOM 1318 CD PRO A 79 108.521 3.560 6.812 1.00 0.00 C ATOM 0 HA PRO A 79 109.081 4.191 3.704 1.00 0.00 H new ATOM 0 HB2 PRO A 79 108.189 6.152 5.841 1.00 0.00 H new ATOM 0 HB3 PRO A 79 107.266 5.554 4.477 1.00 0.00 H new ATOM 0 HG2 PRO A 79 106.661 4.634 6.866 1.00 0.00 H new ATOM 0 HG3 PRO A 79 106.782 3.481 5.552 1.00 0.00 H new ATOM 0 HD2 PRO A 79 108.877 4.144 7.660 1.00 0.00 H new ATOM 0 HD3 PRO A 79 108.281 2.566 7.188 1.00 0.00 H new ATOM 1326 N ILE A 80 110.549 6.176 3.450 1.00 0.00 N ATOM 1327 CA ILE A 80 111.519 7.307 3.288 1.00 0.00 C ATOM 1328 C ILE A 80 110.962 8.348 2.308 1.00 0.00 C ATOM 1329 O ILE A 80 109.969 8.108 1.647 1.00 0.00 O ATOM 1330 CB ILE A 80 112.827 6.694 2.752 1.00 0.00 C ATOM 1331 CG1 ILE A 80 112.595 5.967 1.415 1.00 0.00 C ATOM 1332 CG2 ILE A 80 113.392 5.709 3.782 1.00 0.00 C ATOM 1333 CD1 ILE A 80 113.938 5.599 0.776 1.00 0.00 C ATOM 0 H ILE A 80 110.067 5.905 2.593 1.00 0.00 H new ATOM 0 HA ILE A 80 111.693 7.818 4.235 1.00 0.00 H new ATOM 0 HB ILE A 80 113.538 7.502 2.582 1.00 0.00 H new ATOM 0 HG12 ILE A 80 112.003 5.067 1.580 1.00 0.00 H new ATOM 0 HG13 ILE A 80 112.025 6.605 0.740 1.00 0.00 H new ATOM 0 HG21 ILE A 80 114.317 5.276 3.402 1.00 0.00 H new ATOM 0 HG22 ILE A 80 113.594 6.235 4.715 1.00 0.00 H new ATOM 0 HG23 ILE A 80 112.667 4.915 3.962 1.00 0.00 H new ATOM 0 HD11 ILE A 80 113.763 5.085 -0.169 1.00 0.00 H new ATOM 0 HD12 ILE A 80 114.515 6.506 0.594 1.00 0.00 H new ATOM 0 HD13 ILE A 80 114.493 4.944 1.447 1.00 0.00 H new ATOM 1345 N LYS A 81 111.603 9.489 2.222 1.00 0.00 N ATOM 1346 CA LYS A 81 111.308 10.460 1.124 1.00 0.00 C ATOM 1347 C LYS A 81 112.543 10.599 0.229 1.00 0.00 C ATOM 1348 O LYS A 81 113.639 10.790 0.721 1.00 0.00 O ATOM 1349 CB LYS A 81 110.994 11.785 1.822 1.00 0.00 C ATOM 1350 CG LYS A 81 109.703 11.655 2.635 1.00 0.00 C ATOM 1351 CD LYS A 81 108.504 11.570 1.688 1.00 0.00 C ATOM 1352 CE LYS A 81 107.207 11.608 2.500 1.00 0.00 C ATOM 1353 NZ LYS A 81 106.998 10.204 2.953 1.00 0.00 N ATOM 0 H LYS A 81 112.327 9.791 2.874 1.00 0.00 H new ATOM 0 HA LYS A 81 110.478 10.141 0.494 1.00 0.00 H new ATOM 0 HB2 LYS A 81 111.819 12.065 2.477 1.00 0.00 H new ATOM 0 HB3 LYS A 81 110.890 12.579 1.083 1.00 0.00 H new ATOM 0 HG2 LYS A 81 109.746 10.766 3.264 1.00 0.00 H new ATOM 0 HG3 LYS A 81 109.593 12.511 3.301 1.00 0.00 H new ATOM 0 HD2 LYS A 81 108.527 12.399 0.980 1.00 0.00 H new ATOM 0 HD3 LYS A 81 108.553 10.651 1.104 1.00 0.00 H new ATOM 0 HE2 LYS A 81 107.291 12.288 3.347 1.00 0.00 H new ATOM 0 HE3 LYS A 81 106.371 11.956 1.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 106.666 10.203 3.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 106.287 9.746 2.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 107.895 9.682 2.889 1.00 0.00 H new ATOM 1367 N ILE A 82 112.363 10.503 -1.068 1.00 0.00 N ATOM 1368 CA ILE A 82 113.524 10.523 -2.014 1.00 0.00 C ATOM 1369 C ILE A 82 113.568 11.887 -2.711 1.00 0.00 C ATOM 1370 O ILE A 82 112.605 12.292 -3.337 1.00 0.00 O ATOM 1371 CB ILE A 82 113.270 9.382 -3.020 1.00 0.00 C ATOM 1372 CG1 ILE A 82 113.181 8.034 -2.291 1.00 0.00 C ATOM 1373 CG2 ILE A 82 114.418 9.301 -4.035 1.00 0.00 C ATOM 1374 CD1 ILE A 82 112.576 6.983 -3.226 1.00 0.00 C ATOM 0 H ILE A 82 111.451 10.411 -1.515 1.00 0.00 H new ATOM 0 HA ILE A 82 114.482 10.379 -1.514 1.00 0.00 H new ATOM 0 HB ILE A 82 112.331 9.592 -3.532 1.00 0.00 H new ATOM 0 HG12 ILE A 82 114.173 7.719 -1.966 1.00 0.00 H new ATOM 0 HG13 ILE A 82 112.569 8.134 -1.395 1.00 0.00 H new ATOM 0 HG21 ILE A 82 114.225 8.491 -4.739 1.00 0.00 H new ATOM 0 HG22 ILE A 82 114.491 10.244 -4.578 1.00 0.00 H new ATOM 0 HG23 ILE A 82 115.354 9.111 -3.511 1.00 0.00 H new ATOM 0 HD11 ILE A 82 112.514 6.027 -2.707 1.00 0.00 H new ATOM 0 HD12 ILE A 82 111.577 7.297 -3.529 1.00 0.00 H new ATOM 0 HD13 ILE A 82 113.206 6.876 -4.109 1.00 0.00 H new ATOM 1386 N LEU A 83 114.679 12.580 -2.598 1.00 0.00 N ATOM 1387 CA LEU A 83 114.811 13.937 -3.211 1.00 0.00 C ATOM 1388 C LEU A 83 115.734 13.875 -4.432 1.00 0.00 C ATOM 1389 O LEU A 83 116.909 13.577 -4.306 1.00 0.00 O ATOM 1390 CB LEU A 83 115.429 14.816 -2.120 1.00 0.00 C ATOM 1391 CG LEU A 83 114.458 14.960 -0.944 1.00 0.00 C ATOM 1392 CD1 LEU A 83 115.182 15.608 0.237 1.00 0.00 C ATOM 1393 CD2 LEU A 83 113.276 15.840 -1.359 1.00 0.00 C ATOM 0 H LEU A 83 115.508 12.256 -2.100 1.00 0.00 H new ATOM 0 HA LEU A 83 113.852 14.328 -3.551 1.00 0.00 H new ATOM 0 HB2 LEU A 83 116.366 14.377 -1.776 1.00 0.00 H new ATOM 0 HB3 LEU A 83 115.668 15.799 -2.526 1.00 0.00 H new ATOM 0 HG LEU A 83 114.093 13.975 -0.654 1.00 0.00 H new ATOM 0 HD11 LEU A 83 114.492 15.711 1.075 1.00 0.00 H new ATOM 0 HD12 LEU A 83 116.024 14.983 0.535 1.00 0.00 H new ATOM 0 HD13 LEU A 83 115.547 16.593 -0.056 1.00 0.00 H new ATOM 0 HD21 LEU A 83 112.586 15.941 -0.521 1.00 0.00 H new ATOM 0 HD22 LEU A 83 113.640 16.825 -1.650 1.00 0.00 H new ATOM 0 HD23 LEU A 83 112.759 15.381 -2.201 1.00 0.00 H new ATOM 1405 N ILE A 84 115.201 14.154 -5.600 1.00 0.00 N ATOM 1406 CA ILE A 84 116.029 14.181 -6.847 1.00 0.00 C ATOM 1407 C ILE A 84 115.744 15.495 -7.583 1.00 0.00 C ATOM 1408 O ILE A 84 114.609 15.779 -7.924 1.00 0.00 O ATOM 1409 CB ILE A 84 115.591 12.958 -7.679 1.00 0.00 C ATOM 1410 CG1 ILE A 84 115.837 11.662 -6.892 1.00 0.00 C ATOM 1411 CG2 ILE A 84 116.398 12.888 -8.982 1.00 0.00 C ATOM 1412 CD1 ILE A 84 115.093 10.503 -7.559 1.00 0.00 C ATOM 0 H ILE A 84 114.214 14.367 -5.742 1.00 0.00 H new ATOM 0 HA ILE A 84 117.100 14.132 -6.652 1.00 0.00 H new ATOM 0 HB ILE A 84 114.529 13.064 -7.901 1.00 0.00 H new ATOM 0 HG12 ILE A 84 116.905 11.446 -6.853 1.00 0.00 H new ATOM 0 HG13 ILE A 84 115.498 11.780 -5.863 1.00 0.00 H new ATOM 0 HG21 ILE A 84 116.080 12.021 -9.561 1.00 0.00 H new ATOM 0 HG22 ILE A 84 116.229 13.794 -9.564 1.00 0.00 H new ATOM 0 HG23 ILE A 84 117.459 12.799 -8.749 1.00 0.00 H new ATOM 0 HD11 ILE A 84 115.270 9.586 -6.998 1.00 0.00 H new ATOM 0 HD12 ILE A 84 114.025 10.718 -7.575 1.00 0.00 H new ATOM 0 HD13 ILE A 84 115.454 10.379 -8.580 1.00 0.00 H new ATOM 1424 N GLY A 85 116.764 16.290 -7.820 1.00 0.00 N ATOM 1425 CA GLY A 85 116.579 17.617 -8.488 1.00 0.00 C ATOM 1426 C GLY A 85 115.749 18.541 -7.589 1.00 0.00 C ATOM 1427 O GLY A 85 116.137 18.829 -6.471 1.00 0.00 O ATOM 0 H GLY A 85 117.729 16.070 -7.574 1.00 0.00 H new ATOM 0 HA2 GLY A 85 117.549 18.070 -8.693 1.00 0.00 H new ATOM 0 HA3 GLY A 85 116.080 17.485 -9.448 1.00 0.00 H new ATOM 1431 N ASN A 86 114.619 18.997 -8.080 1.00 0.00 N ATOM 1432 CA ASN A 86 113.693 19.831 -7.251 1.00 0.00 C ATOM 1433 C ASN A 86 112.392 19.085 -6.920 1.00 0.00 C ATOM 1434 O ASN A 86 111.420 19.709 -6.530 1.00 0.00 O ATOM 1435 CB ASN A 86 113.393 21.059 -8.114 1.00 0.00 C ATOM 1436 CG ASN A 86 114.657 21.909 -8.259 1.00 0.00 C ATOM 1437 OD1 ASN A 86 115.424 22.047 -7.326 1.00 0.00 O ATOM 1438 ND2 ASN A 86 114.909 22.490 -9.400 1.00 0.00 N ATOM 0 H ASN A 86 114.297 18.823 -9.032 1.00 0.00 H new ATOM 0 HA ASN A 86 114.144 20.087 -6.292 1.00 0.00 H new ATOM 0 HB2 ASN A 86 113.038 20.747 -9.096 1.00 0.00 H new ATOM 0 HB3 ASN A 86 112.597 21.649 -7.660 1.00 0.00 H new ATOM 0 HD21 ASN A 86 115.749 23.059 -9.508 1.00 0.00 H new ATOM 0 HD22 ASN A 86 114.266 22.375 -10.184 1.00 0.00 H new ATOM 1445 N LYS A 87 112.361 17.774 -7.067 1.00 0.00 N ATOM 1446 CA LYS A 87 111.096 17.002 -6.866 1.00 0.00 C ATOM 1447 C LYS A 87 111.264 15.979 -5.740 1.00 0.00 C ATOM 1448 O LYS A 87 112.331 15.416 -5.569 1.00 0.00 O ATOM 1449 CB LYS A 87 110.851 16.290 -8.198 1.00 0.00 C ATOM 1450 CG LYS A 87 110.521 17.320 -9.281 1.00 0.00 C ATOM 1451 CD LYS A 87 110.165 16.597 -10.581 1.00 0.00 C ATOM 1452 CE LYS A 87 109.945 17.624 -11.693 1.00 0.00 C ATOM 1453 NZ LYS A 87 109.488 16.829 -12.867 1.00 0.00 N ATOM 0 H LYS A 87 113.170 17.206 -7.320 1.00 0.00 H new ATOM 0 HA LYS A 87 110.264 17.648 -6.584 1.00 0.00 H new ATOM 0 HB2 LYS A 87 111.734 15.718 -8.483 1.00 0.00 H new ATOM 0 HB3 LYS A 87 110.031 15.580 -8.096 1.00 0.00 H new ATOM 0 HG2 LYS A 87 109.688 17.946 -8.961 1.00 0.00 H new ATOM 0 HG3 LYS A 87 111.373 17.981 -9.441 1.00 0.00 H new ATOM 0 HD2 LYS A 87 110.965 15.911 -10.859 1.00 0.00 H new ATOM 0 HD3 LYS A 87 109.265 15.998 -10.442 1.00 0.00 H new ATOM 0 HE2 LYS A 87 109.200 18.365 -11.404 1.00 0.00 H new ATOM 0 HE3 LYS A 87 110.864 18.166 -11.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 109.316 17.465 -13.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 110.220 16.137 -13.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 108.608 16.329 -12.627 1.00 0.00 H new ATOM 1467 N LYS A 88 110.217 15.743 -4.981 1.00 0.00 N ATOM 1468 CA LYS A 88 110.262 14.724 -3.884 1.00 0.00 C ATOM 1469 C LYS A 88 109.162 13.675 -4.087 1.00 0.00 C ATOM 1470 O LYS A 88 108.008 14.013 -4.288 1.00 0.00 O ATOM 1471 CB LYS A 88 110.075 15.503 -2.570 1.00 0.00 C ATOM 1472 CG LYS A 88 108.738 16.257 -2.537 1.00 0.00 C ATOM 1473 CD LYS A 88 108.635 17.049 -1.232 1.00 0.00 C ATOM 1474 CE LYS A 88 107.206 17.570 -1.061 1.00 0.00 C ATOM 1475 NZ LYS A 88 107.127 18.016 0.358 1.00 0.00 N ATOM 0 H LYS A 88 109.321 16.221 -5.078 1.00 0.00 H new ATOM 0 HA LYS A 88 111.206 14.178 -3.872 1.00 0.00 H new ATOM 0 HB2 LYS A 88 110.123 14.812 -1.728 1.00 0.00 H new ATOM 0 HB3 LYS A 88 110.894 16.211 -2.448 1.00 0.00 H new ATOM 0 HG2 LYS A 88 108.666 16.931 -3.391 1.00 0.00 H new ATOM 0 HG3 LYS A 88 107.909 15.554 -2.615 1.00 0.00 H new ATOM 0 HD2 LYS A 88 108.906 16.415 -0.387 1.00 0.00 H new ATOM 0 HD3 LYS A 88 109.338 17.882 -1.244 1.00 0.00 H new ATOM 0 HE2 LYS A 88 107.001 18.393 -1.746 1.00 0.00 H new ATOM 0 HE3 LYS A 88 106.474 16.791 -1.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 106.175 18.387 0.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 107.320 17.210 0.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 107.831 18.763 0.527 1.00 0.00 H new ATOM 1489 N ILE A 89 109.524 12.413 -4.038 1.00 0.00 N ATOM 1490 CA ILE A 89 108.526 11.308 -4.211 1.00 0.00 C ATOM 1491 C ILE A 89 108.622 10.361 -3.006 1.00 0.00 C ATOM 1492 O ILE A 89 109.702 10.123 -2.496 1.00 0.00 O ATOM 1493 CB ILE A 89 108.909 10.594 -5.523 1.00 0.00 C ATOM 1494 CG1 ILE A 89 108.847 11.574 -6.703 1.00 0.00 C ATOM 1495 CG2 ILE A 89 107.936 9.442 -5.807 1.00 0.00 C ATOM 1496 CD1 ILE A 89 109.566 10.970 -7.910 1.00 0.00 C ATOM 0 H ILE A 89 110.482 12.098 -3.883 1.00 0.00 H new ATOM 0 HA ILE A 89 107.499 11.668 -4.263 1.00 0.00 H new ATOM 0 HB ILE A 89 109.922 10.209 -5.410 1.00 0.00 H new ATOM 0 HG12 ILE A 89 107.809 11.789 -6.956 1.00 0.00 H new ATOM 0 HG13 ILE A 89 109.311 12.521 -6.427 1.00 0.00 H new ATOM 0 HG21 ILE A 89 108.219 8.947 -6.736 1.00 0.00 H new ATOM 0 HG22 ILE A 89 107.973 8.724 -4.988 1.00 0.00 H new ATOM 0 HG23 ILE A 89 106.924 9.835 -5.899 1.00 0.00 H new ATOM 0 HD11 ILE A 89 109.521 11.667 -8.747 1.00 0.00 H new ATOM 0 HD12 ILE A 89 110.608 10.777 -7.654 1.00 0.00 H new ATOM 0 HD13 ILE A 89 109.082 10.034 -8.191 1.00 0.00 H new ATOM 1508 N ASP A 90 107.502 9.835 -2.562 1.00 0.00 N ATOM 1509 CA ASP A 90 107.507 8.874 -1.410 1.00 0.00 C ATOM 1510 C ASP A 90 108.048 7.515 -1.861 1.00 0.00 C ATOM 1511 O ASP A 90 107.706 7.038 -2.930 1.00 0.00 O ATOM 1512 CB ASP A 90 106.049 8.740 -0.958 1.00 0.00 C ATOM 1513 CG ASP A 90 105.568 10.075 -0.382 1.00 0.00 C ATOM 1514 OD1 ASP A 90 105.671 11.070 -1.080 1.00 0.00 O ATOM 1515 OD2 ASP A 90 105.104 10.078 0.746 1.00 0.00 O ATOM 0 H ASP A 90 106.580 10.032 -2.951 1.00 0.00 H new ATOM 0 HA ASP A 90 108.143 9.228 -0.598 1.00 0.00 H new ATOM 0 HB2 ASP A 90 105.421 8.448 -1.800 1.00 0.00 H new ATOM 0 HB3 ASP A 90 105.961 7.955 -0.207 1.00 0.00 H new ATOM 1520 N GLY A 91 108.884 6.903 -1.054 1.00 0.00 N ATOM 1521 CA GLY A 91 109.427 5.549 -1.379 1.00 0.00 C ATOM 1522 C GLY A 91 109.644 4.772 -0.080 1.00 0.00 C ATOM 1523 O GLY A 91 109.142 5.161 0.960 1.00 0.00 O ATOM 0 H GLY A 91 109.216 7.292 -0.172 1.00 0.00 H new ATOM 0 HA2 GLY A 91 108.735 5.012 -2.027 1.00 0.00 H new ATOM 0 HA3 GLY A 91 110.367 5.641 -1.923 1.00 0.00 H new ATOM 1527 N ALA A 92 110.386 3.690 -0.139 1.00 0.00 N ATOM 1528 CA ALA A 92 110.648 2.867 1.083 1.00 0.00 C ATOM 1529 C ALA A 92 111.895 2.001 0.889 1.00 0.00 C ATOM 1530 O ALA A 92 112.257 1.680 -0.228 1.00 0.00 O ATOM 1531 CB ALA A 92 109.402 1.996 1.248 1.00 0.00 C ATOM 0 H ALA A 92 110.825 3.340 -0.991 1.00 0.00 H new ATOM 0 HA ALA A 92 110.832 3.483 1.963 1.00 0.00 H new ATOM 0 HB1 ALA A 92 109.516 1.360 2.126 1.00 0.00 H new ATOM 0 HB2 ALA A 92 108.526 2.633 1.372 1.00 0.00 H new ATOM 0 HB3 ALA A 92 109.274 1.373 0.363 1.00 0.00 H new ATOM 1537 N ILE A 93 112.539 1.629 1.971 1.00 0.00 N ATOM 1538 CA ILE A 93 113.731 0.727 1.896 1.00 0.00 C ATOM 1539 C ILE A 93 113.335 -0.648 2.449 1.00 0.00 C ATOM 1540 O ILE A 93 112.590 -0.732 3.409 1.00 0.00 O ATOM 1541 CB ILE A 93 114.821 1.379 2.771 1.00 0.00 C ATOM 1542 CG1 ILE A 93 115.154 2.788 2.265 1.00 0.00 C ATOM 1543 CG2 ILE A 93 116.105 0.542 2.731 1.00 0.00 C ATOM 1544 CD1 ILE A 93 115.939 3.546 3.339 1.00 0.00 C ATOM 0 H ILE A 93 112.284 1.917 2.916 1.00 0.00 H new ATOM 0 HA ILE A 93 114.094 0.592 0.877 1.00 0.00 H new ATOM 0 HB ILE A 93 114.437 1.434 3.790 1.00 0.00 H new ATOM 0 HG12 ILE A 93 115.739 2.727 1.347 1.00 0.00 H new ATOM 0 HG13 ILE A 93 114.237 3.325 2.023 1.00 0.00 H new ATOM 0 HG21 ILE A 93 116.866 1.013 3.353 1.00 0.00 H new ATOM 0 HG22 ILE A 93 115.898 -0.460 3.108 1.00 0.00 H new ATOM 0 HG23 ILE A 93 116.465 0.476 1.704 1.00 0.00 H new ATOM 0 HD11 ILE A 93 116.175 4.547 2.978 1.00 0.00 H new ATOM 0 HD12 ILE A 93 115.338 3.619 4.245 1.00 0.00 H new ATOM 0 HD13 ILE A 93 116.863 3.012 3.559 1.00 0.00 H new ATOM 1556 N VAL A 94 113.829 -1.705 1.844 1.00 0.00 N ATOM 1557 CA VAL A 94 113.419 -3.090 2.245 1.00 0.00 C ATOM 1558 C VAL A 94 114.672 -3.919 2.563 1.00 0.00 C ATOM 1559 O VAL A 94 115.624 -3.918 1.805 1.00 0.00 O ATOM 1560 CB VAL A 94 112.653 -3.668 1.039 1.00 0.00 C ATOM 1561 CG1 VAL A 94 112.155 -5.086 1.350 1.00 0.00 C ATOM 1562 CG2 VAL A 94 111.433 -2.798 0.711 1.00 0.00 C ATOM 0 H VAL A 94 114.506 -1.666 1.082 1.00 0.00 H new ATOM 0 HA VAL A 94 112.792 -3.100 3.137 1.00 0.00 H new ATOM 0 HB VAL A 94 113.338 -3.688 0.191 1.00 0.00 H new ATOM 0 HG11 VAL A 94 111.616 -5.480 0.488 1.00 0.00 H new ATOM 0 HG12 VAL A 94 113.006 -5.730 1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 94 111.489 -5.057 2.212 1.00 0.00 H new ATOM 0 HG21 VAL A 94 110.904 -3.221 -0.143 1.00 0.00 H new ATOM 0 HG22 VAL A 94 110.766 -2.767 1.572 1.00 0.00 H new ATOM 0 HG23 VAL A 94 111.761 -1.787 0.470 1.00 0.00 H new ATOM 1572 N VAL A 95 114.660 -4.614 3.678 1.00 0.00 N ATOM 1573 CA VAL A 95 115.791 -5.529 4.036 1.00 0.00 C ATOM 1574 C VAL A 95 115.220 -6.758 4.773 1.00 0.00 C ATOM 1575 O VAL A 95 114.360 -6.586 5.616 1.00 0.00 O ATOM 1576 CB VAL A 95 116.720 -4.707 4.951 1.00 0.00 C ATOM 1577 CG1 VAL A 95 117.928 -5.547 5.383 1.00 0.00 C ATOM 1578 CG2 VAL A 95 117.242 -3.471 4.207 1.00 0.00 C ATOM 0 H VAL A 95 113.905 -4.585 4.363 1.00 0.00 H new ATOM 0 HA VAL A 95 116.337 -5.892 3.166 1.00 0.00 H new ATOM 0 HB VAL A 95 116.144 -4.405 5.825 1.00 0.00 H new ATOM 0 HG11 VAL A 95 118.573 -4.951 6.028 1.00 0.00 H new ATOM 0 HG12 VAL A 95 117.584 -6.427 5.927 1.00 0.00 H new ATOM 0 HG13 VAL A 95 118.487 -5.861 4.501 1.00 0.00 H new ATOM 0 HG21 VAL A 95 117.897 -2.900 4.865 1.00 0.00 H new ATOM 0 HG22 VAL A 95 117.799 -3.786 3.325 1.00 0.00 H new ATOM 0 HG23 VAL A 95 116.401 -2.848 3.902 1.00 0.00 H new ATOM 1588 N PRO A 96 115.691 -7.957 4.455 1.00 0.00 N ATOM 1589 CA PRO A 96 115.244 -9.186 5.193 1.00 0.00 C ATOM 1590 C PRO A 96 115.540 -9.084 6.698 1.00 0.00 C ATOM 1591 O PRO A 96 116.440 -8.370 7.102 1.00 0.00 O ATOM 1592 CB PRO A 96 116.081 -10.300 4.559 1.00 0.00 C ATOM 1593 CG PRO A 96 116.383 -9.781 3.198 1.00 0.00 C ATOM 1594 CD PRO A 96 116.655 -8.320 3.395 1.00 0.00 C ATOM 0 HA PRO A 96 114.169 -9.349 5.117 1.00 0.00 H new ATOM 0 HB2 PRO A 96 116.992 -10.489 5.127 1.00 0.00 H new ATOM 0 HB3 PRO A 96 115.531 -11.240 4.516 1.00 0.00 H new ATOM 0 HG2 PRO A 96 117.244 -10.288 2.764 1.00 0.00 H new ATOM 0 HG3 PRO A 96 115.545 -9.939 2.520 1.00 0.00 H new ATOM 0 HD2 PRO A 96 117.685 -8.136 3.702 1.00 0.00 H new ATOM 0 HD3 PRO A 96 116.488 -7.749 2.482 1.00 0.00 H new ATOM 1602 N LYS A 97 114.786 -9.794 7.509 1.00 0.00 N ATOM 1603 CA LYS A 97 115.005 -9.763 8.995 1.00 0.00 C ATOM 1604 C LYS A 97 116.369 -10.362 9.357 1.00 0.00 C ATOM 1605 O LYS A 97 117.005 -9.919 10.297 1.00 0.00 O ATOM 1606 CB LYS A 97 113.884 -10.602 9.618 1.00 0.00 C ATOM 1607 CG LYS A 97 112.569 -9.824 9.566 1.00 0.00 C ATOM 1608 CD LYS A 97 111.443 -10.688 10.140 1.00 0.00 C ATOM 1609 CE LYS A 97 111.543 -10.714 11.666 1.00 0.00 C ATOM 1610 NZ LYS A 97 110.908 -12.000 12.071 1.00 0.00 N ATOM 0 H LYS A 97 114.023 -10.398 7.203 1.00 0.00 H new ATOM 0 HA LYS A 97 114.992 -8.738 9.365 1.00 0.00 H new ATOM 0 HB2 LYS A 97 113.781 -11.545 9.081 1.00 0.00 H new ATOM 0 HB3 LYS A 97 114.132 -10.848 10.651 1.00 0.00 H new ATOM 0 HG2 LYS A 97 112.658 -8.899 10.135 1.00 0.00 H new ATOM 0 HG3 LYS A 97 112.340 -9.545 8.538 1.00 0.00 H new ATOM 0 HD2 LYS A 97 110.475 -10.290 9.836 1.00 0.00 H new ATOM 0 HD3 LYS A 97 111.510 -11.701 9.744 1.00 0.00 H new ATOM 0 HE2 LYS A 97 112.581 -10.666 11.995 1.00 0.00 H new ATOM 0 HE3 LYS A 97 111.028 -9.862 12.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 110.938 -12.091 13.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 109.919 -12.015 11.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 111.424 -12.793 11.639 1.00 0.00 H new ATOM 1624 N LYS A 98 116.808 -11.356 8.617 1.00 0.00 N ATOM 1625 CA LYS A 98 118.092 -12.054 8.948 1.00 0.00 C ATOM 1626 C LYS A 98 119.278 -11.301 8.340 1.00 0.00 C ATOM 1627 O LYS A 98 119.383 -11.182 7.132 1.00 0.00 O ATOM 1628 CB LYS A 98 117.976 -13.454 8.336 1.00 0.00 C ATOM 1629 CG LYS A 98 119.126 -14.330 8.837 1.00 0.00 C ATOM 1630 CD LYS A 98 118.961 -15.751 8.295 1.00 0.00 C ATOM 1631 CE LYS A 98 119.284 -15.771 6.799 1.00 0.00 C ATOM 1632 NZ LYS A 98 119.253 -17.211 6.418 1.00 0.00 N ATOM 0 H LYS A 98 116.327 -11.715 7.792 1.00 0.00 H new ATOM 0 HA LYS A 98 118.259 -12.101 10.024 1.00 0.00 H new ATOM 0 HB2 LYS A 98 117.020 -13.902 8.606 1.00 0.00 H new ATOM 0 HB3 LYS A 98 118.002 -13.390 7.248 1.00 0.00 H new ATOM 0 HG2 LYS A 98 120.081 -13.915 8.514 1.00 0.00 H new ATOM 0 HG3 LYS A 98 119.138 -14.344 9.927 1.00 0.00 H new ATOM 0 HD2 LYS A 98 119.622 -16.434 8.829 1.00 0.00 H new ATOM 0 HD3 LYS A 98 117.941 -16.099 8.462 1.00 0.00 H new ATOM 0 HE2 LYS A 98 118.554 -15.196 6.230 1.00 0.00 H new ATOM 0 HE3 LYS A 98 120.261 -15.331 6.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 119.465 -17.307 5.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 119.963 -17.732 6.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 118.309 -17.601 6.612 1.00 0.00 H new ATOM 1646 N THR A 99 120.159 -10.798 9.177 1.00 0.00 N ATOM 1647 CA THR A 99 121.377 -10.082 8.685 1.00 0.00 C ATOM 1648 C THR A 99 122.621 -10.611 9.406 1.00 0.00 C ATOM 1649 O THR A 99 122.585 -10.860 10.598 1.00 0.00 O ATOM 1650 CB THR A 99 121.137 -8.611 9.031 1.00 0.00 C ATOM 1651 OG1 THR A 99 119.857 -8.219 8.558 1.00 0.00 O ATOM 1652 CG2 THR A 99 122.214 -7.748 8.371 1.00 0.00 C ATOM 0 H THR A 99 120.082 -10.856 10.192 1.00 0.00 H new ATOM 0 HA THR A 99 121.543 -10.225 7.617 1.00 0.00 H new ATOM 0 HB THR A 99 121.181 -8.479 10.112 1.00 0.00 H new ATOM 0 HG1 THR A 99 119.701 -7.277 8.780 1.00 0.00 H new ATOM 0 HG21 THR A 99 122.043 -6.700 8.618 1.00 0.00 H new ATOM 0 HG22 THR A 99 123.196 -8.050 8.735 1.00 0.00 H new ATOM 0 HG23 THR A 99 122.172 -7.878 7.290 1.00 0.00 H new ATOM 1660 N TYR A 100 123.707 -10.778 8.685 1.00 0.00 N ATOM 1661 CA TYR A 100 124.969 -11.301 9.296 1.00 0.00 C ATOM 1662 C TYR A 100 125.875 -10.139 9.713 1.00 0.00 C ATOM 1663 O TYR A 100 126.361 -10.104 10.829 1.00 0.00 O ATOM 1664 CB TYR A 100 125.633 -12.136 8.199 1.00 0.00 C ATOM 1665 CG TYR A 100 126.837 -12.911 8.677 1.00 0.00 C ATOM 1666 CD1 TYR A 100 128.138 -12.322 8.618 1.00 0.00 C ATOM 1667 CD2 TYR A 100 126.677 -14.236 9.190 1.00 0.00 C ATOM 1668 CE1 TYR A 100 129.278 -13.056 9.071 1.00 0.00 C ATOM 1669 CE2 TYR A 100 127.817 -14.971 9.643 1.00 0.00 C ATOM 1670 CZ TYR A 100 129.117 -14.381 9.583 1.00 0.00 C ATOM 1671 OH TYR A 100 130.218 -15.089 10.021 1.00 0.00 O ATOM 0 H TYR A 100 123.771 -10.571 7.688 1.00 0.00 H new ATOM 0 HA TYR A 100 124.778 -11.892 10.192 1.00 0.00 H new ATOM 0 HB2 TYR A 100 124.901 -12.833 7.791 1.00 0.00 H new ATOM 0 HB3 TYR A 100 125.935 -11.477 7.385 1.00 0.00 H new ATOM 0 HD1 TYR A 100 128.260 -11.321 8.231 1.00 0.00 H new ATOM 0 HD2 TYR A 100 125.694 -14.682 9.235 1.00 0.00 H new ATOM 0 HE1 TYR A 100 130.260 -12.610 9.026 1.00 0.00 H new ATOM 0 HE2 TYR A 100 127.695 -15.972 10.030 1.00 0.00 H new ATOM 0 HH TYR A 100 129.934 -15.972 10.339 1.00 0.00 H new ATOM 1681 N HIS A 101 126.098 -9.202 8.819 1.00 0.00 N ATOM 1682 CA HIS A 101 126.975 -8.030 9.125 1.00 0.00 C ATOM 1683 C HIS A 101 126.348 -6.745 8.578 1.00 0.00 C ATOM 1684 O HIS A 101 125.354 -6.794 7.875 1.00 0.00 O ATOM 1685 CB HIS A 101 128.295 -8.329 8.414 1.00 0.00 C ATOM 1686 CG HIS A 101 129.414 -7.405 8.809 1.00 0.00 C ATOM 1687 ND1 HIS A 101 129.718 -6.261 8.089 1.00 0.00 N ATOM 1688 CD2 HIS A 101 130.312 -7.444 9.849 1.00 0.00 C ATOM 1689 CE1 HIS A 101 130.757 -5.662 8.697 1.00 0.00 C ATOM 1690 NE2 HIS A 101 131.159 -6.340 9.775 1.00 0.00 N ATOM 0 H HIS A 101 125.703 -9.202 7.879 1.00 0.00 H new ATOM 0 HA HIS A 101 127.113 -7.884 10.196 1.00 0.00 H new ATOM 0 HB2 HIS A 101 128.590 -9.356 8.630 1.00 0.00 H new ATOM 0 HB3 HIS A 101 128.142 -8.261 7.337 1.00 0.00 H new ATOM 0 HD1 HIS A 101 129.240 -5.933 7.250 1.00 0.00 H new ATOM 0 HD2 HIS A 101 130.355 -8.212 10.607 1.00 0.00 H new ATOM 0 HE1 HIS A 101 131.211 -4.744 8.355 1.00 0.00 H new ATOM 1698 N SER A 102 126.926 -5.609 8.901 1.00 0.00 N ATOM 1699 CA SER A 102 126.404 -4.303 8.386 1.00 0.00 C ATOM 1700 C SER A 102 127.068 -3.969 7.047 1.00 0.00 C ATOM 1701 O SER A 102 128.219 -4.302 6.828 1.00 0.00 O ATOM 1702 CB SER A 102 126.775 -3.262 9.444 1.00 0.00 C ATOM 1703 OG SER A 102 126.176 -3.616 10.682 1.00 0.00 O ATOM 0 H SER A 102 127.744 -5.532 9.505 1.00 0.00 H new ATOM 0 HA SER A 102 125.328 -4.331 8.217 1.00 0.00 H new ATOM 0 HB2 SER A 102 127.858 -3.208 9.553 1.00 0.00 H new ATOM 0 HB3 SER A 102 126.436 -2.274 9.133 1.00 0.00 H new ATOM 0 HG SER A 102 125.452 -2.988 10.887 1.00 0.00 H new ATOM 1709 N SER A 103 126.344 -3.317 6.164 1.00 0.00 N ATOM 1710 CA SER A 103 126.873 -3.019 4.799 1.00 0.00 C ATOM 1711 C SER A 103 126.572 -1.569 4.409 1.00 0.00 C ATOM 1712 O SER A 103 125.826 -0.886 5.088 1.00 0.00 O ATOM 1713 CB SER A 103 126.136 -3.985 3.871 1.00 0.00 C ATOM 1714 OG SER A 103 126.418 -5.322 4.265 1.00 0.00 O ATOM 0 H SER A 103 125.398 -2.976 6.337 1.00 0.00 H new ATOM 0 HA SER A 103 127.955 -3.140 4.744 1.00 0.00 H new ATOM 0 HB2 SER A 103 125.063 -3.800 3.913 1.00 0.00 H new ATOM 0 HB3 SER A 103 126.447 -3.825 2.839 1.00 0.00 H new ATOM 0 HG SER A 103 125.946 -5.944 3.673 1.00 0.00 H new ATOM 1720 N GLU A 104 127.155 -1.111 3.325 1.00 0.00 N ATOM 1721 CA GLU A 104 126.884 0.271 2.818 1.00 0.00 C ATOM 1722 C GLU A 104 126.014 0.227 1.555 1.00 0.00 C ATOM 1723 O GLU A 104 126.091 1.121 0.732 1.00 0.00 O ATOM 1724 CB GLU A 104 128.267 0.850 2.492 1.00 0.00 C ATOM 1725 CG GLU A 104 128.841 1.558 3.722 1.00 0.00 C ATOM 1726 CD GLU A 104 130.282 1.988 3.443 1.00 0.00 C ATOM 1727 OE1 GLU A 104 131.026 1.188 2.898 1.00 0.00 O ATOM 1728 OE2 GLU A 104 130.619 3.110 3.780 1.00 0.00 O ATOM 0 H GLU A 104 127.817 -1.646 2.763 1.00 0.00 H new ATOM 0 HA GLU A 104 126.344 0.873 3.548 1.00 0.00 H new ATOM 0 HB2 GLU A 104 128.939 0.052 2.175 1.00 0.00 H new ATOM 0 HB3 GLU A 104 128.190 1.551 1.661 1.00 0.00 H new ATOM 0 HG2 GLU A 104 128.233 2.428 3.970 1.00 0.00 H new ATOM 0 HG3 GLU A 104 128.810 0.892 4.584 1.00 0.00 H new ATOM 1735 N ILE A 105 125.198 -0.793 1.402 1.00 0.00 N ATOM 1736 CA ILE A 105 124.311 -0.902 0.199 1.00 0.00 C ATOM 1737 C ILE A 105 122.851 -0.979 0.660 1.00 0.00 C ATOM 1738 O ILE A 105 122.504 -1.809 1.482 1.00 0.00 O ATOM 1739 CB ILE A 105 124.732 -2.195 -0.532 1.00 0.00 C ATOM 1740 CG1 ILE A 105 126.235 -2.185 -0.886 1.00 0.00 C ATOM 1741 CG2 ILE A 105 123.908 -2.377 -1.816 1.00 0.00 C ATOM 1742 CD1 ILE A 105 126.609 -0.990 -1.777 1.00 0.00 C ATOM 0 H ILE A 105 125.109 -1.561 2.067 1.00 0.00 H new ATOM 0 HA ILE A 105 124.404 -0.043 -0.465 1.00 0.00 H new ATOM 0 HB ILE A 105 124.543 -3.027 0.146 1.00 0.00 H new ATOM 0 HG12 ILE A 105 126.823 -2.151 0.031 1.00 0.00 H new ATOM 0 HG13 ILE A 105 126.493 -3.113 -1.397 1.00 0.00 H new ATOM 0 HG21 ILE A 105 124.217 -3.293 -2.320 1.00 0.00 H new ATOM 0 HG22 ILE A 105 122.850 -2.441 -1.563 1.00 0.00 H new ATOM 0 HG23 ILE A 105 124.072 -1.526 -2.477 1.00 0.00 H new ATOM 0 HD11 ILE A 105 127.675 -1.023 -2.001 1.00 0.00 H new ATOM 0 HD12 ILE A 105 126.041 -1.037 -2.706 1.00 0.00 H new ATOM 0 HD13 ILE A 105 126.376 -0.061 -1.256 1.00 0.00 H new ATOM 1754 N ILE A 106 122.009 -0.117 0.135 1.00 0.00 N ATOM 1755 CA ILE A 106 120.549 -0.148 0.476 1.00 0.00 C ATOM 1756 C ILE A 106 119.714 -0.276 -0.803 1.00 0.00 C ATOM 1757 O ILE A 106 120.066 0.285 -1.826 1.00 0.00 O ATOM 1758 CB ILE A 106 120.242 1.169 1.212 1.00 0.00 C ATOM 1759 CG1 ILE A 106 120.617 2.391 0.358 1.00 0.00 C ATOM 1760 CG2 ILE A 106 121.028 1.218 2.525 1.00 0.00 C ATOM 1761 CD1 ILE A 106 119.986 3.649 0.959 1.00 0.00 C ATOM 0 H ILE A 106 122.276 0.615 -0.523 1.00 0.00 H new ATOM 0 HA ILE A 106 120.302 -1.003 1.106 1.00 0.00 H new ATOM 0 HB ILE A 106 119.170 1.201 1.409 1.00 0.00 H new ATOM 0 HG12 ILE A 106 121.701 2.500 0.316 1.00 0.00 H new ATOM 0 HG13 ILE A 106 120.271 2.252 -0.666 1.00 0.00 H new ATOM 0 HG21 ILE A 106 120.810 2.151 3.045 1.00 0.00 H new ATOM 0 HG22 ILE A 106 120.739 0.376 3.154 1.00 0.00 H new ATOM 0 HG23 ILE A 106 122.096 1.162 2.312 1.00 0.00 H new ATOM 0 HD11 ILE A 106 120.252 4.515 0.353 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.902 3.539 0.978 1.00 0.00 H new ATOM 0 HD13 ILE A 106 120.354 3.791 1.975 1.00 0.00 H new ATOM 1773 N GLU A 107 118.623 -1.004 -0.740 1.00 0.00 N ATOM 1774 CA GLU A 107 117.738 -1.178 -1.932 1.00 0.00 C ATOM 1775 C GLU A 107 116.371 -0.541 -1.670 1.00 0.00 C ATOM 1776 O GLU A 107 115.760 -0.781 -0.644 1.00 0.00 O ATOM 1777 CB GLU A 107 117.599 -2.691 -2.117 1.00 0.00 C ATOM 1778 CG GLU A 107 118.794 -3.221 -2.913 1.00 0.00 C ATOM 1779 CD GLU A 107 118.639 -4.727 -3.133 1.00 0.00 C ATOM 1780 OE1 GLU A 107 118.283 -5.413 -2.189 1.00 0.00 O ATOM 1781 OE2 GLU A 107 118.880 -5.171 -4.244 1.00 0.00 O ATOM 0 H GLU A 107 118.306 -1.490 0.099 1.00 0.00 H new ATOM 0 HA GLU A 107 118.149 -0.700 -2.821 1.00 0.00 H new ATOM 0 HB2 GLU A 107 117.548 -3.183 -1.146 1.00 0.00 H new ATOM 0 HB3 GLU A 107 116.670 -2.920 -2.639 1.00 0.00 H new ATOM 0 HG2 GLU A 107 118.860 -2.708 -3.873 1.00 0.00 H new ATOM 0 HG3 GLU A 107 119.721 -3.015 -2.377 1.00 0.00 H new ATOM 1788 N ILE A 108 115.904 0.261 -2.599 1.00 0.00 N ATOM 1789 CA ILE A 108 114.649 1.051 -2.385 1.00 0.00 C ATOM 1790 C ILE A 108 113.579 0.594 -3.387 1.00 0.00 C ATOM 1791 O ILE A 108 113.892 0.139 -4.471 1.00 0.00 O ATOM 1792 CB ILE A 108 115.057 2.520 -2.618 1.00 0.00 C ATOM 1793 CG1 ILE A 108 116.094 2.947 -1.573 1.00 0.00 C ATOM 1794 CG2 ILE A 108 113.844 3.453 -2.501 1.00 0.00 C ATOM 1795 CD1 ILE A 108 116.771 4.244 -2.020 1.00 0.00 C ATOM 0 H ILE A 108 116.345 0.403 -3.508 1.00 0.00 H new ATOM 0 HA ILE A 108 114.223 0.917 -1.391 1.00 0.00 H new ATOM 0 HB ILE A 108 115.475 2.593 -3.622 1.00 0.00 H new ATOM 0 HG12 ILE A 108 115.612 3.091 -0.606 1.00 0.00 H new ATOM 0 HG13 ILE A 108 116.839 2.162 -1.444 1.00 0.00 H new ATOM 0 HG21 ILE A 108 114.159 4.483 -2.670 1.00 0.00 H new ATOM 0 HG22 ILE A 108 113.098 3.175 -3.246 1.00 0.00 H new ATOM 0 HG23 ILE A 108 113.412 3.365 -1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 108 117.508 4.545 -1.275 1.00 0.00 H new ATOM 0 HD12 ILE A 108 117.267 4.084 -2.977 1.00 0.00 H new ATOM 0 HD13 ILE A 108 116.021 5.028 -2.126 1.00 0.00 H new ATOM 1807 N ILE A 109 112.327 0.719 -3.014 1.00 0.00 N ATOM 1808 CA ILE A 109 111.203 0.566 -3.991 1.00 0.00 C ATOM 1809 C ILE A 109 110.443 1.893 -4.107 1.00 0.00 C ATOM 1810 O ILE A 109 110.439 2.680 -3.176 1.00 0.00 O ATOM 1811 CB ILE A 109 110.295 -0.555 -3.452 1.00 0.00 C ATOM 1812 CG1 ILE A 109 109.790 -0.239 -2.035 1.00 0.00 C ATOM 1813 CG2 ILE A 109 111.071 -1.873 -3.425 1.00 0.00 C ATOM 1814 CD1 ILE A 109 108.500 -1.018 -1.766 1.00 0.00 C ATOM 0 H ILE A 109 112.033 0.924 -2.059 1.00 0.00 H new ATOM 0 HA ILE A 109 111.562 0.309 -4.987 1.00 0.00 H new ATOM 0 HB ILE A 109 109.433 -0.636 -4.114 1.00 0.00 H new ATOM 0 HG12 ILE A 109 110.549 -0.506 -1.299 1.00 0.00 H new ATOM 0 HG13 ILE A 109 109.609 0.831 -1.932 1.00 0.00 H new ATOM 0 HG21 ILE A 109 110.428 -2.666 -3.043 1.00 0.00 H new ATOM 0 HG22 ILE A 109 111.397 -2.124 -4.434 1.00 0.00 H new ATOM 0 HG23 ILE A 109 111.942 -1.769 -2.778 1.00 0.00 H new ATOM 0 HD11 ILE A 109 108.142 -0.794 -0.761 1.00 0.00 H new ATOM 0 HD12 ILE A 109 107.742 -0.729 -2.494 1.00 0.00 H new ATOM 0 HD13 ILE A 109 108.696 -2.087 -1.851 1.00 0.00 H new ATOM 1826 N ALA A 110 109.811 2.130 -5.234 1.00 0.00 N ATOM 1827 CA ALA A 110 109.109 3.429 -5.469 1.00 0.00 C ATOM 1828 C ALA A 110 107.817 3.198 -6.272 1.00 0.00 C ATOM 1829 O ALA A 110 107.661 2.138 -6.848 1.00 0.00 O ATOM 1830 CB ALA A 110 110.097 4.289 -6.258 1.00 0.00 C ATOM 0 H ALA A 110 109.753 1.469 -6.009 1.00 0.00 H new ATOM 0 HA ALA A 110 108.817 3.912 -4.537 1.00 0.00 H new ATOM 0 HB1 ALA A 110 109.648 5.260 -6.467 1.00 0.00 H new ATOM 0 HB2 ALA A 110 111.006 4.428 -5.673 1.00 0.00 H new ATOM 0 HB3 ALA A 110 110.342 3.793 -7.197 1.00 0.00 H new ATOM 1836 N PRO A 111 106.925 4.180 -6.300 1.00 0.00 N ATOM 1837 CA PRO A 111 105.662 4.055 -7.099 1.00 0.00 C ATOM 1838 C PRO A 111 105.956 3.852 -8.592 1.00 0.00 C ATOM 1839 O PRO A 111 105.206 3.186 -9.284 1.00 0.00 O ATOM 1840 CB PRO A 111 104.965 5.399 -6.866 1.00 0.00 C ATOM 1841 CG PRO A 111 105.514 5.860 -5.562 1.00 0.00 C ATOM 1842 CD PRO A 111 106.962 5.485 -5.607 1.00 0.00 C ATOM 0 HA PRO A 111 105.062 3.196 -6.801 1.00 0.00 H new ATOM 0 HB2 PRO A 111 105.184 6.107 -7.665 1.00 0.00 H new ATOM 0 HB3 PRO A 111 103.882 5.287 -6.827 1.00 0.00 H new ATOM 0 HG2 PRO A 111 105.387 6.935 -5.436 1.00 0.00 H new ATOM 0 HG3 PRO A 111 105.006 5.379 -4.726 1.00 0.00 H new ATOM 0 HD2 PRO A 111 107.556 6.219 -6.152 1.00 0.00 H new ATOM 0 HD3 PRO A 111 107.393 5.404 -4.609 1.00 0.00 H new ATOM 1850 N MET A 112 107.038 4.422 -9.076 1.00 0.00 N ATOM 1851 CA MET A 112 107.385 4.317 -10.528 1.00 0.00 C ATOM 1852 C MET A 112 108.907 4.228 -10.718 1.00 0.00 C ATOM 1853 O MET A 112 109.661 4.481 -9.795 1.00 0.00 O ATOM 1854 CB MET A 112 106.750 5.543 -11.227 1.00 0.00 C ATOM 1855 CG MET A 112 107.528 6.862 -11.051 1.00 0.00 C ATOM 1856 SD MET A 112 107.416 7.477 -9.351 1.00 0.00 S ATOM 1857 CE MET A 112 105.664 7.929 -9.387 1.00 0.00 C ATOM 0 H MET A 112 107.701 4.961 -8.518 1.00 0.00 H new ATOM 0 HA MET A 112 106.990 3.405 -10.976 1.00 0.00 H new ATOM 0 HB2 MET A 112 106.660 5.330 -12.292 1.00 0.00 H new ATOM 0 HB3 MET A 112 105.739 5.680 -10.843 1.00 0.00 H new ATOM 0 HG2 MET A 112 108.574 6.707 -11.315 1.00 0.00 H new ATOM 0 HG3 MET A 112 107.135 7.612 -11.737 1.00 0.00 H new ATOM 0 HE1 MET A 112 105.400 8.436 -8.459 1.00 0.00 H new ATOM 0 HE2 MET A 112 105.477 8.595 -10.230 1.00 0.00 H new ATOM 0 HE3 MET A 112 105.058 7.029 -9.494 1.00 0.00 H new ATOM 1867 N LYS A 113 109.344 3.872 -11.907 1.00 0.00 N ATOM 1868 CA LYS A 113 110.814 3.725 -12.174 1.00 0.00 C ATOM 1869 C LYS A 113 111.483 5.102 -12.187 1.00 0.00 C ATOM 1870 O LYS A 113 111.354 5.851 -13.140 1.00 0.00 O ATOM 1871 CB LYS A 113 110.938 3.054 -13.547 1.00 0.00 C ATOM 1872 CG LYS A 113 112.385 2.608 -13.768 1.00 0.00 C ATOM 1873 CD LYS A 113 112.453 1.667 -14.972 1.00 0.00 C ATOM 1874 CE LYS A 113 112.252 2.467 -16.262 1.00 0.00 C ATOM 1875 NZ LYS A 113 112.149 1.442 -17.338 1.00 0.00 N ATOM 0 H LYS A 113 108.742 3.676 -12.707 1.00 0.00 H new ATOM 0 HA LYS A 113 111.304 3.131 -11.403 1.00 0.00 H new ATOM 0 HB2 LYS A 113 110.269 2.196 -13.606 1.00 0.00 H new ATOM 0 HB3 LYS A 113 110.636 3.748 -14.331 1.00 0.00 H new ATOM 0 HG2 LYS A 113 113.022 3.476 -13.936 1.00 0.00 H new ATOM 0 HG3 LYS A 113 112.761 2.104 -12.878 1.00 0.00 H new ATOM 0 HD2 LYS A 113 113.417 1.158 -14.994 1.00 0.00 H new ATOM 0 HD3 LYS A 113 111.687 0.896 -14.887 1.00 0.00 H new ATOM 0 HE2 LYS A 113 111.351 3.078 -16.211 1.00 0.00 H new ATOM 0 HE3 LYS A 113 113.087 3.145 -16.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 112.010 1.914 -18.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 113.024 0.880 -17.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 111.341 0.816 -17.145 1.00 0.00 H new ATOM 1889 N LEU A 114 112.198 5.432 -11.131 1.00 0.00 N ATOM 1890 CA LEU A 114 112.844 6.785 -11.014 1.00 0.00 C ATOM 1891 C LEU A 114 113.827 7.040 -12.163 1.00 0.00 C ATOM 1892 O LEU A 114 113.976 8.164 -12.607 1.00 0.00 O ATOM 1893 CB LEU A 114 113.599 6.787 -9.679 1.00 0.00 C ATOM 1894 CG LEU A 114 112.602 6.679 -8.522 1.00 0.00 C ATOM 1895 CD1 LEU A 114 113.358 6.390 -7.225 1.00 0.00 C ATOM 1896 CD2 LEU A 114 111.839 7.998 -8.380 1.00 0.00 C ATOM 0 H LEU A 114 112.363 4.814 -10.337 1.00 0.00 H new ATOM 0 HA LEU A 114 112.089 7.570 -11.060 1.00 0.00 H new ATOM 0 HB2 LEU A 114 114.301 5.954 -9.646 1.00 0.00 H new ATOM 0 HB3 LEU A 114 114.185 7.701 -9.583 1.00 0.00 H new ATOM 0 HG LEU A 114 111.899 5.871 -8.724 1.00 0.00 H new ATOM 0 HD11 LEU A 114 112.649 6.313 -6.400 1.00 0.00 H new ATOM 0 HD12 LEU A 114 113.904 5.452 -7.323 1.00 0.00 H new ATOM 0 HD13 LEU A 114 114.060 7.199 -7.025 1.00 0.00 H new ATOM 0 HD21 LEU A 114 111.129 7.921 -7.556 1.00 0.00 H new ATOM 0 HD22 LEU A 114 112.543 8.806 -8.178 1.00 0.00 H new ATOM 0 HD23 LEU A 114 111.301 8.208 -9.304 1.00 0.00 H new ATOM 1908 N ARG A 115 114.484 6.005 -12.643 1.00 0.00 N ATOM 1909 CA ARG A 115 115.546 6.183 -13.692 1.00 0.00 C ATOM 1910 C ARG A 115 114.953 6.763 -14.979 1.00 0.00 C ATOM 1911 O ARG A 115 115.599 7.545 -15.653 1.00 0.00 O ATOM 1912 CB ARG A 115 116.131 4.796 -13.970 1.00 0.00 C ATOM 1913 CG ARG A 115 116.856 4.283 -12.725 1.00 0.00 C ATOM 1914 CD ARG A 115 117.509 2.932 -13.032 1.00 0.00 C ATOM 1915 NE ARG A 115 118.619 3.223 -14.000 1.00 0.00 N ATOM 1916 CZ ARG A 115 119.089 2.317 -14.836 1.00 0.00 C ATOM 1917 NH1 ARG A 115 118.650 1.080 -14.878 1.00 0.00 N ATOM 1918 NH2 ARG A 115 120.046 2.664 -15.655 1.00 0.00 N ATOM 0 H ARG A 115 114.329 5.040 -12.351 1.00 0.00 H new ATOM 0 HA ARG A 115 116.311 6.877 -13.343 1.00 0.00 H new ATOM 0 HB2 ARG A 115 115.336 4.105 -14.250 1.00 0.00 H new ATOM 0 HB3 ARG A 115 116.822 4.844 -14.811 1.00 0.00 H new ATOM 0 HG2 ARG A 115 117.613 5.001 -12.411 1.00 0.00 H new ATOM 0 HG3 ARG A 115 116.153 4.179 -11.899 1.00 0.00 H new ATOM 0 HD2 ARG A 115 117.894 2.469 -12.124 1.00 0.00 H new ATOM 0 HD3 ARG A 115 116.787 2.238 -13.462 1.00 0.00 H new ATOM 0 HE ARG A 115 119.026 4.158 -14.012 1.00 0.00 H new ATOM 0 HH11 ARG A 115 117.910 0.780 -14.244 1.00 0.00 H new ATOM 0 HH12 ARG A 115 119.049 0.420 -15.545 1.00 0.00 H new ATOM 0 HH21 ARG A 115 120.412 3.616 -15.638 1.00 0.00 H new ATOM 0 HH22 ARG A 115 120.427 1.983 -16.312 1.00 0.00 H new ATOM 1932 N GLU A 116 113.739 6.383 -15.307 1.00 0.00 N ATOM 1933 CA GLU A 116 113.076 6.920 -16.536 1.00 0.00 C ATOM 1934 C GLU A 116 112.553 8.329 -16.252 1.00 0.00 C ATOM 1935 O GLU A 116 112.796 9.245 -17.018 1.00 0.00 O ATOM 1936 CB GLU A 116 111.926 5.962 -16.863 1.00 0.00 C ATOM 1937 CG GLU A 116 111.329 6.320 -18.226 1.00 0.00 C ATOM 1938 CD GLU A 116 110.106 5.442 -18.496 1.00 0.00 C ATOM 1939 OE1 GLU A 116 110.279 4.240 -18.614 1.00 0.00 O ATOM 1940 OE2 GLU A 116 109.017 5.986 -18.580 1.00 0.00 O ATOM 0 H GLU A 116 113.178 5.720 -14.772 1.00 0.00 H new ATOM 0 HA GLU A 116 113.765 6.987 -17.378 1.00 0.00 H new ATOM 0 HB2 GLU A 116 112.288 4.934 -16.872 1.00 0.00 H new ATOM 0 HB3 GLU A 116 111.158 6.023 -16.092 1.00 0.00 H new ATOM 0 HG2 GLU A 116 111.045 7.372 -18.245 1.00 0.00 H new ATOM 0 HG3 GLU A 116 112.073 6.176 -19.010 1.00 0.00 H new ATOM 1947 N GLN A 117 111.858 8.504 -15.150 1.00 0.00 N ATOM 1948 CA GLN A 117 111.174 9.813 -14.864 1.00 0.00 C ATOM 1949 C GLN A 117 112.193 10.952 -14.740 1.00 0.00 C ATOM 1950 O GLN A 117 111.903 12.078 -15.103 1.00 0.00 O ATOM 1951 CB GLN A 117 110.421 9.630 -13.541 1.00 0.00 C ATOM 1952 CG GLN A 117 109.316 8.586 -13.716 1.00 0.00 C ATOM 1953 CD GLN A 117 108.185 9.171 -14.565 1.00 0.00 C ATOM 1954 OE1 GLN A 117 107.734 10.272 -14.321 1.00 0.00 O ATOM 1955 NE2 GLN A 117 107.706 8.474 -15.560 1.00 0.00 N ATOM 0 H GLN A 117 111.734 7.792 -14.430 1.00 0.00 H new ATOM 0 HA GLN A 117 110.497 10.079 -15.676 1.00 0.00 H new ATOM 0 HB2 GLN A 117 111.112 9.315 -12.759 1.00 0.00 H new ATOM 0 HB3 GLN A 117 109.990 10.579 -13.222 1.00 0.00 H new ATOM 0 HG2 GLN A 117 109.718 7.693 -14.194 1.00 0.00 H new ATOM 0 HG3 GLN A 117 108.933 8.281 -12.742 1.00 0.00 H new ATOM 0 HE21 GLN A 117 108.085 7.549 -15.764 1.00 0.00 H new ATOM 0 HE22 GLN A 117 106.953 8.854 -16.133 1.00 0.00 H new ATOM 1964 N PHE A 118 113.369 10.660 -14.232 1.00 0.00 N ATOM 1965 CA PHE A 118 114.408 11.719 -14.030 1.00 0.00 C ATOM 1966 C PHE A 118 115.570 11.604 -15.028 1.00 0.00 C ATOM 1967 O PHE A 118 116.554 12.310 -14.891 1.00 0.00 O ATOM 1968 CB PHE A 118 114.913 11.493 -12.604 1.00 0.00 C ATOM 1969 CG PHE A 118 113.904 11.858 -11.542 1.00 0.00 C ATOM 1970 CD1 PHE A 118 112.923 10.903 -11.129 1.00 0.00 C ATOM 1971 CD2 PHE A 118 113.930 13.159 -10.950 1.00 0.00 C ATOM 1972 CE1 PHE A 118 111.969 11.250 -10.123 1.00 0.00 C ATOM 1973 CE2 PHE A 118 112.975 13.504 -9.944 1.00 0.00 C ATOM 1974 CZ PHE A 118 111.995 12.550 -9.530 1.00 0.00 C ATOM 0 H PHE A 118 113.654 9.723 -13.946 1.00 0.00 H new ATOM 0 HA PHE A 118 113.988 12.713 -14.188 1.00 0.00 H new ATOM 0 HB2 PHE A 118 115.189 10.445 -12.487 1.00 0.00 H new ATOM 0 HB3 PHE A 118 115.818 12.080 -12.451 1.00 0.00 H new ATOM 0 HD1 PHE A 118 112.903 9.920 -11.577 1.00 0.00 H new ATOM 0 HD2 PHE A 118 114.670 13.880 -11.263 1.00 0.00 H new ATOM 0 HE1 PHE A 118 111.228 10.529 -9.811 1.00 0.00 H new ATOM 0 HE2 PHE A 118 112.994 14.487 -9.496 1.00 0.00 H new ATOM 0 HZ PHE A 118 111.274 12.811 -8.769 1.00 0.00 H new ATOM 1984 N ASN A 119 115.485 10.738 -16.026 1.00 0.00 N ATOM 1985 CA ASN A 119 116.598 10.549 -17.026 1.00 0.00 C ATOM 1986 C ASN A 119 117.953 10.293 -16.336 1.00 0.00 C ATOM 1987 O ASN A 119 118.964 10.873 -16.698 1.00 0.00 O ATOM 1988 CB ASN A 119 116.631 11.836 -17.862 1.00 0.00 C ATOM 1989 CG ASN A 119 115.338 11.956 -18.673 1.00 0.00 C ATOM 1990 OD1 ASN A 119 114.661 12.963 -18.612 1.00 0.00 O ATOM 1991 ND2 ASN A 119 114.966 10.964 -19.434 1.00 0.00 N ATOM 0 H ASN A 119 114.673 10.143 -16.190 1.00 0.00 H new ATOM 0 HA ASN A 119 116.420 9.672 -17.648 1.00 0.00 H new ATOM 0 HB2 ASN A 119 116.745 12.702 -17.210 1.00 0.00 H new ATOM 0 HB3 ASN A 119 117.492 11.825 -18.531 1.00 0.00 H new ATOM 0 HD21 ASN A 119 114.106 11.033 -19.978 1.00 0.00 H new ATOM 0 HD22 ASN A 119 115.535 10.119 -19.485 1.00 0.00 H new ATOM 1998 N LEU A 120 117.967 9.424 -15.350 1.00 0.00 N ATOM 1999 CA LEU A 120 119.180 9.245 -14.492 1.00 0.00 C ATOM 2000 C LEU A 120 120.078 8.134 -15.040 1.00 0.00 C ATOM 2001 O LEU A 120 119.598 7.098 -15.463 1.00 0.00 O ATOM 2002 CB LEU A 120 118.654 8.867 -13.105 1.00 0.00 C ATOM 2003 CG LEU A 120 117.993 10.083 -12.452 1.00 0.00 C ATOM 2004 CD1 LEU A 120 117.226 9.637 -11.206 1.00 0.00 C ATOM 2005 CD2 LEU A 120 119.069 11.095 -12.048 1.00 0.00 C ATOM 0 H LEU A 120 117.179 8.825 -15.102 1.00 0.00 H new ATOM 0 HA LEU A 120 119.783 10.152 -14.465 1.00 0.00 H new ATOM 0 HB2 LEU A 120 117.935 8.052 -13.188 1.00 0.00 H new ATOM 0 HB3 LEU A 120 119.472 8.508 -12.481 1.00 0.00 H new ATOM 0 HG LEU A 120 117.305 10.545 -13.160 1.00 0.00 H new ATOM 0 HD11 LEU A 120 116.755 10.502 -10.740 1.00 0.00 H new ATOM 0 HD12 LEU A 120 116.460 8.915 -11.489 1.00 0.00 H new ATOM 0 HD13 LEU A 120 117.916 9.175 -10.500 1.00 0.00 H new ATOM 0 HD21 LEU A 120 118.598 11.961 -11.583 1.00 0.00 H new ATOM 0 HD22 LEU A 120 119.756 10.632 -11.340 1.00 0.00 H new ATOM 0 HD23 LEU A 120 119.620 11.413 -12.933 1.00 0.00 H new ATOM 2017 N LYS A 121 121.374 8.356 -15.031 1.00 0.00 N ATOM 2018 CA LYS A 121 122.345 7.321 -15.497 1.00 0.00 C ATOM 2019 C LYS A 121 123.214 6.858 -14.324 1.00 0.00 C ATOM 2020 O LYS A 121 123.363 7.569 -13.346 1.00 0.00 O ATOM 2021 CB LYS A 121 123.201 8.027 -16.549 1.00 0.00 C ATOM 2022 CG LYS A 121 124.026 6.992 -17.316 1.00 0.00 C ATOM 2023 CD LYS A 121 124.932 7.704 -18.323 1.00 0.00 C ATOM 2024 CE LYS A 121 125.649 6.668 -19.188 1.00 0.00 C ATOM 2025 NZ LYS A 121 126.764 6.162 -18.338 1.00 0.00 N ATOM 0 H LYS A 121 121.802 9.226 -14.715 1.00 0.00 H new ATOM 0 HA LYS A 121 121.850 6.438 -15.901 1.00 0.00 H new ATOM 0 HB2 LYS A 121 122.564 8.583 -17.238 1.00 0.00 H new ATOM 0 HB3 LYS A 121 123.861 8.751 -16.070 1.00 0.00 H new ATOM 0 HG2 LYS A 121 124.627 6.404 -16.622 1.00 0.00 H new ATOM 0 HG3 LYS A 121 123.366 6.296 -17.834 1.00 0.00 H new ATOM 0 HD2 LYS A 121 124.341 8.371 -18.951 1.00 0.00 H new ATOM 0 HD3 LYS A 121 125.661 8.322 -17.799 1.00 0.00 H new ATOM 0 HE2 LYS A 121 124.976 5.861 -19.477 1.00 0.00 H new ATOM 0 HE3 LYS A 121 126.025 7.115 -20.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 127.674 6.382 -18.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 126.723 6.618 -17.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 126.674 5.132 -18.224 1.00 0.00 H new ATOM 2039 N ASP A 122 123.788 5.677 -14.420 1.00 0.00 N ATOM 2040 CA ASP A 122 124.637 5.123 -13.304 1.00 0.00 C ATOM 2041 C ASP A 122 125.777 6.082 -12.934 1.00 0.00 C ATOM 2042 O ASP A 122 126.410 6.657 -13.802 1.00 0.00 O ATOM 2043 CB ASP A 122 125.223 3.806 -13.829 1.00 0.00 C ATOM 2044 CG ASP A 122 124.094 2.797 -14.052 1.00 0.00 C ATOM 2045 OD1 ASP A 122 123.786 2.068 -13.124 1.00 0.00 O ATOM 2046 OD2 ASP A 122 123.558 2.771 -15.148 1.00 0.00 O ATOM 0 H ASP A 122 123.705 5.065 -15.232 1.00 0.00 H new ATOM 0 HA ASP A 122 124.037 4.980 -12.405 1.00 0.00 H new ATOM 0 HB2 ASP A 122 125.759 3.981 -14.762 1.00 0.00 H new ATOM 0 HB3 ASP A 122 125.945 3.408 -13.117 1.00 0.00 H new ATOM 2051 N GLY A 123 126.029 6.248 -11.655 1.00 0.00 N ATOM 2052 CA GLY A 123 127.087 7.196 -11.189 1.00 0.00 C ATOM 2053 C GLY A 123 126.476 8.517 -10.705 1.00 0.00 C ATOM 2054 O GLY A 123 127.097 9.219 -9.926 1.00 0.00 O ATOM 0 H GLY A 123 125.538 5.759 -10.907 1.00 0.00 H new ATOM 0 HA2 GLY A 123 127.658 6.739 -10.381 1.00 0.00 H new ATOM 0 HA3 GLY A 123 127.786 7.392 -12.002 1.00 0.00 H new ATOM 2058 N ASP A 124 125.282 8.862 -11.150 1.00 0.00 N ATOM 2059 CA ASP A 124 124.632 10.142 -10.703 1.00 0.00 C ATOM 2060 C ASP A 124 124.325 10.078 -9.204 1.00 0.00 C ATOM 2061 O ASP A 124 124.189 9.002 -8.650 1.00 0.00 O ATOM 2062 CB ASP A 124 123.337 10.289 -11.514 1.00 0.00 C ATOM 2063 CG ASP A 124 123.623 11.004 -12.838 1.00 0.00 C ATOM 2064 OD1 ASP A 124 124.392 11.952 -12.829 1.00 0.00 O ATOM 2065 OD2 ASP A 124 123.062 10.592 -13.838 1.00 0.00 O ATOM 0 H ASP A 124 124.730 8.309 -11.806 1.00 0.00 H new ATOM 0 HA ASP A 124 125.288 10.997 -10.867 1.00 0.00 H new ATOM 0 HB2 ASP A 124 122.907 9.306 -11.708 1.00 0.00 H new ATOM 0 HB3 ASP A 124 122.601 10.852 -10.940 1.00 0.00 H new ATOM 2070 N VAL A 125 124.216 11.217 -8.559 1.00 0.00 N ATOM 2071 CA VAL A 125 124.035 11.248 -7.071 1.00 0.00 C ATOM 2072 C VAL A 125 122.631 11.773 -6.740 1.00 0.00 C ATOM 2073 O VAL A 125 122.186 12.759 -7.297 1.00 0.00 O ATOM 2074 CB VAL A 125 125.130 12.189 -6.527 1.00 0.00 C ATOM 2075 CG1 VAL A 125 125.056 12.266 -4.997 1.00 0.00 C ATOM 2076 CG2 VAL A 125 126.520 11.667 -6.911 1.00 0.00 C ATOM 0 H VAL A 125 124.245 12.134 -9.004 1.00 0.00 H new ATOM 0 HA VAL A 125 124.124 10.259 -6.621 1.00 0.00 H new ATOM 0 HB VAL A 125 124.967 13.176 -6.960 1.00 0.00 H new ATOM 0 HG11 VAL A 125 125.835 12.934 -4.628 1.00 0.00 H new ATOM 0 HG12 VAL A 125 124.080 12.648 -4.699 1.00 0.00 H new ATOM 0 HG13 VAL A 125 125.201 11.271 -4.575 1.00 0.00 H new ATOM 0 HG21 VAL A 125 127.282 12.341 -6.520 1.00 0.00 H new ATOM 0 HG22 VAL A 125 126.664 10.672 -6.489 1.00 0.00 H new ATOM 0 HG23 VAL A 125 126.602 11.616 -7.997 1.00 0.00 H new ATOM 2086 N ILE A 126 121.948 11.108 -5.836 1.00 0.00 N ATOM 2087 CA ILE A 126 120.621 11.596 -5.342 1.00 0.00 C ATOM 2088 C ILE A 126 120.622 11.619 -3.810 1.00 0.00 C ATOM 2089 O ILE A 126 121.436 10.959 -3.186 1.00 0.00 O ATOM 2090 CB ILE A 126 119.560 10.621 -5.888 1.00 0.00 C ATOM 2091 CG1 ILE A 126 119.845 9.177 -5.450 1.00 0.00 C ATOM 2092 CG2 ILE A 126 119.544 10.687 -7.417 1.00 0.00 C ATOM 2093 CD1 ILE A 126 118.609 8.312 -5.705 1.00 0.00 C ATOM 0 H ILE A 126 122.261 10.234 -5.414 1.00 0.00 H new ATOM 0 HA ILE A 126 120.408 12.610 -5.681 1.00 0.00 H new ATOM 0 HB ILE A 126 118.592 10.918 -5.485 1.00 0.00 H new ATOM 0 HG12 ILE A 126 120.699 8.781 -6.000 1.00 0.00 H new ATOM 0 HG13 ILE A 126 120.108 9.152 -4.392 1.00 0.00 H new ATOM 0 HG21 ILE A 126 118.793 9.997 -7.803 1.00 0.00 H new ATOM 0 HG22 ILE A 126 119.302 11.701 -7.735 1.00 0.00 H new ATOM 0 HG23 ILE A 126 120.525 10.410 -7.803 1.00 0.00 H new ATOM 0 HD11 ILE A 126 118.812 7.287 -5.394 1.00 0.00 H new ATOM 0 HD12 ILE A 126 117.767 8.704 -5.135 1.00 0.00 H new ATOM 0 HD13 ILE A 126 118.367 8.328 -6.768 1.00 0.00 H new ATOM 2105 N LYS A 127 119.721 12.366 -3.215 1.00 0.00 N ATOM 2106 CA LYS A 127 119.707 12.522 -1.728 1.00 0.00 C ATOM 2107 C LYS A 127 118.497 11.799 -1.132 1.00 0.00 C ATOM 2108 O LYS A 127 117.408 11.870 -1.671 1.00 0.00 O ATOM 2109 CB LYS A 127 119.602 14.029 -1.486 1.00 0.00 C ATOM 2110 CG LYS A 127 120.893 14.714 -1.940 1.00 0.00 C ATOM 2111 CD LYS A 127 120.831 16.203 -1.593 1.00 0.00 C ATOM 2112 CE LYS A 127 122.069 16.909 -2.149 1.00 0.00 C ATOM 2113 NZ LYS A 127 121.822 18.358 -1.916 1.00 0.00 N ATOM 0 H LYS A 127 118.987 12.879 -3.704 1.00 0.00 H new ATOM 0 HA LYS A 127 120.595 12.096 -1.261 1.00 0.00 H new ATOM 0 HB2 LYS A 127 118.751 14.437 -2.032 1.00 0.00 H new ATOM 0 HB3 LYS A 127 119.426 14.226 -0.428 1.00 0.00 H new ATOM 0 HG2 LYS A 127 121.752 14.252 -1.454 1.00 0.00 H new ATOM 0 HG3 LYS A 127 121.027 14.585 -3.014 1.00 0.00 H new ATOM 0 HD2 LYS A 127 119.928 16.647 -2.011 1.00 0.00 H new ATOM 0 HD3 LYS A 127 120.780 16.333 -0.512 1.00 0.00 H new ATOM 0 HE2 LYS A 127 122.975 16.576 -1.642 1.00 0.00 H new ATOM 0 HE3 LYS A 127 122.202 16.697 -3.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 122.629 18.909 -2.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 120.958 18.648 -2.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 121.707 18.531 -0.897 1.00 0.00 H new ATOM 2127 N ILE A 128 118.689 11.112 -0.030 1.00 0.00 N ATOM 2128 CA ILE A 128 117.550 10.444 0.678 1.00 0.00 C ATOM 2129 C ILE A 128 117.297 11.130 2.026 1.00 0.00 C ATOM 2130 O ILE A 128 118.227 11.460 2.740 1.00 0.00 O ATOM 2131 CB ILE A 128 117.943 8.966 0.857 1.00 0.00 C ATOM 2132 CG1 ILE A 128 119.270 8.821 1.620 1.00 0.00 C ATOM 2133 CG2 ILE A 128 118.084 8.310 -0.520 1.00 0.00 C ATOM 2134 CD1 ILE A 128 119.460 7.364 2.050 1.00 0.00 C ATOM 0 H ILE A 128 119.598 10.984 0.414 1.00 0.00 H new ATOM 0 HA ILE A 128 116.623 10.517 0.109 1.00 0.00 H new ATOM 0 HB ILE A 128 117.160 8.477 1.437 1.00 0.00 H new ATOM 0 HG12 ILE A 128 120.101 9.135 0.988 1.00 0.00 H new ATOM 0 HG13 ILE A 128 119.271 9.472 2.494 1.00 0.00 H new ATOM 0 HG21 ILE A 128 118.362 7.263 -0.398 1.00 0.00 H new ATOM 0 HG22 ILE A 128 117.135 8.373 -1.052 1.00 0.00 H new ATOM 0 HG23 ILE A 128 118.855 8.826 -1.092 1.00 0.00 H new ATOM 0 HD11 ILE A 128 120.401 7.264 2.591 1.00 0.00 H new ATOM 0 HD12 ILE A 128 118.636 7.065 2.698 1.00 0.00 H new ATOM 0 HD13 ILE A 128 119.478 6.724 1.168 1.00 0.00 H new ATOM 2146 N LEU A 129 116.043 11.341 2.358 1.00 0.00 N ATOM 2147 CA LEU A 129 115.683 12.057 3.620 1.00 0.00 C ATOM 2148 C LEU A 129 115.038 11.083 4.611 1.00 0.00 C ATOM 2149 O LEU A 129 114.143 10.338 4.252 1.00 0.00 O ATOM 2150 CB LEU A 129 114.682 13.132 3.190 1.00 0.00 C ATOM 2151 CG LEU A 129 114.436 14.110 4.344 1.00 0.00 C ATOM 2152 CD1 LEU A 129 113.991 15.464 3.784 1.00 0.00 C ATOM 2153 CD2 LEU A 129 113.344 13.559 5.266 1.00 0.00 C ATOM 0 H LEU A 129 115.245 11.042 1.798 1.00 0.00 H new ATOM 0 HA LEU A 129 116.552 12.487 4.118 1.00 0.00 H new ATOM 0 HB2 LEU A 129 115.063 13.669 2.322 1.00 0.00 H new ATOM 0 HB3 LEU A 129 113.743 12.667 2.890 1.00 0.00 H new ATOM 0 HG LEU A 129 115.359 14.234 4.910 1.00 0.00 H new ATOM 0 HD11 LEU A 129 113.817 16.158 4.606 1.00 0.00 H new ATOM 0 HD12 LEU A 129 114.769 15.862 3.132 1.00 0.00 H new ATOM 0 HD13 LEU A 129 113.070 15.337 3.214 1.00 0.00 H new ATOM 0 HD21 LEU A 129 113.173 14.258 6.085 1.00 0.00 H new ATOM 0 HD22 LEU A 129 112.421 13.430 4.700 1.00 0.00 H new ATOM 0 HD23 LEU A 129 113.660 12.597 5.670 1.00 0.00 H new ATOM 2165 N ILE A 130 115.493 11.094 5.843 1.00 0.00 N ATOM 2166 CA ILE A 130 114.949 10.159 6.881 1.00 0.00 C ATOM 2167 C ILE A 130 114.363 10.982 8.038 1.00 0.00 C ATOM 2168 O ILE A 130 115.012 11.879 8.546 1.00 0.00 O ATOM 2169 CB ILE A 130 116.145 9.307 7.353 1.00 0.00 C ATOM 2170 CG1 ILE A 130 116.774 8.542 6.178 1.00 0.00 C ATOM 2171 CG2 ILE A 130 115.683 8.282 8.397 1.00 0.00 C ATOM 2172 CD1 ILE A 130 118.218 8.179 6.527 1.00 0.00 C ATOM 0 H ILE A 130 116.227 11.719 6.177 1.00 0.00 H new ATOM 0 HA ILE A 130 114.154 9.521 6.495 1.00 0.00 H new ATOM 0 HB ILE A 130 116.882 9.985 7.784 1.00 0.00 H new ATOM 0 HG12 ILE A 130 116.200 7.639 5.968 1.00 0.00 H new ATOM 0 HG13 ILE A 130 116.748 9.153 5.276 1.00 0.00 H new ATOM 0 HG21 ILE A 130 116.535 7.686 8.723 1.00 0.00 H new ATOM 0 HG22 ILE A 130 115.255 8.803 9.254 1.00 0.00 H new ATOM 0 HG23 ILE A 130 114.930 7.628 7.957 1.00 0.00 H new ATOM 0 HD11 ILE A 130 118.668 7.636 5.696 1.00 0.00 H new ATOM 0 HD12 ILE A 130 118.787 9.090 6.716 1.00 0.00 H new ATOM 0 HD13 ILE A 130 118.230 7.552 7.419 1.00 0.00 H new ATOM 2184 N LYS A 131 113.153 10.671 8.442 1.00 0.00 N ATOM 2185 CA LYS A 131 112.511 11.388 9.590 1.00 0.00 C ATOM 2186 C LYS A 131 112.786 10.642 10.897 1.00 0.00 C ATOM 2187 O LYS A 131 113.005 9.443 10.889 1.00 0.00 O ATOM 2188 CB LYS A 131 111.012 11.395 9.281 1.00 0.00 C ATOM 2189 CG LYS A 131 110.744 12.276 8.058 1.00 0.00 C ATOM 2190 CD LYS A 131 109.252 12.246 7.722 1.00 0.00 C ATOM 2191 CE LYS A 131 108.476 13.055 8.762 1.00 0.00 C ATOM 2192 NZ LYS A 131 107.043 12.879 8.394 1.00 0.00 N ATOM 0 H LYS A 131 112.577 9.943 8.020 1.00 0.00 H new ATOM 0 HA LYS A 131 112.901 12.399 9.710 1.00 0.00 H new ATOM 0 HB2 LYS A 131 110.664 10.379 9.093 1.00 0.00 H new ATOM 0 HB3 LYS A 131 110.455 11.769 10.140 1.00 0.00 H new ATOM 0 HG2 LYS A 131 111.062 13.299 8.258 1.00 0.00 H new ATOM 0 HG3 LYS A 131 111.326 11.922 7.207 1.00 0.00 H new ATOM 0 HD2 LYS A 131 109.085 12.658 6.727 1.00 0.00 H new ATOM 0 HD3 LYS A 131 108.893 11.217 7.705 1.00 0.00 H new ATOM 0 HE2 LYS A 131 108.672 12.692 9.771 1.00 0.00 H new ATOM 0 HE3 LYS A 131 108.763 14.106 8.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 106.446 13.406 9.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 106.885 13.239 7.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 106.797 11.869 8.431 1.00 0.00 H new ATOM 2206 N GLY A 132 112.773 11.346 12.007 1.00 0.00 N ATOM 2207 CA GLY A 132 113.039 10.710 13.334 1.00 0.00 C ATOM 2208 C GLY A 132 112.422 11.562 14.446 1.00 0.00 C ATOM 2209 O GLY A 132 111.855 12.608 14.184 1.00 0.00 O ATOM 0 H GLY A 132 112.586 12.348 12.047 1.00 0.00 H new ATOM 0 HA2 GLY A 132 112.619 9.704 13.357 1.00 0.00 H new ATOM 0 HA3 GLY A 132 114.113 10.610 13.492 1.00 0.00 H new ATOM 2213 N ASP A 133 112.537 11.115 15.677 1.00 0.00 N ATOM 2214 CA ASP A 133 111.956 11.863 16.834 1.00 0.00 C ATOM 2215 C ASP A 133 113.046 12.674 17.543 1.00 0.00 C ATOM 2216 O ASP A 133 114.128 12.170 17.789 1.00 0.00 O ATOM 2217 CB ASP A 133 111.398 10.783 17.764 1.00 0.00 C ATOM 2218 CG ASP A 133 110.565 11.438 18.868 1.00 0.00 C ATOM 2219 OD1 ASP A 133 109.374 11.606 18.665 1.00 0.00 O ATOM 2220 OD2 ASP A 133 111.133 11.760 19.899 1.00 0.00 O ATOM 0 H ASP A 133 113.016 10.251 15.929 1.00 0.00 H new ATOM 0 HA ASP A 133 111.187 12.571 16.524 1.00 0.00 H new ATOM 0 HB2 ASP A 133 110.784 10.083 17.198 1.00 0.00 H new ATOM 0 HB3 ASP A 133 112.214 10.209 18.202 1.00 0.00 H new ATOM 2225 N LYS A 134 112.757 13.916 17.864 1.00 0.00 N ATOM 2226 CA LYS A 134 113.760 14.785 18.567 1.00 0.00 C ATOM 2227 C LYS A 134 113.993 14.274 19.993 1.00 0.00 C ATOM 2228 O LYS A 134 115.124 14.165 20.432 1.00 0.00 O ATOM 2229 CB LYS A 134 113.162 16.196 18.598 1.00 0.00 C ATOM 2230 CG LYS A 134 114.220 17.194 19.072 1.00 0.00 C ATOM 2231 CD LYS A 134 113.595 18.587 19.181 1.00 0.00 C ATOM 2232 CE LYS A 134 114.684 19.612 19.510 1.00 0.00 C ATOM 2233 NZ LYS A 134 114.176 20.900 18.959 1.00 0.00 N ATOM 0 H LYS A 134 111.864 14.368 17.668 1.00 0.00 H new ATOM 0 HA LYS A 134 114.722 14.776 18.055 1.00 0.00 H new ATOM 0 HB2 LYS A 134 112.806 16.472 17.606 1.00 0.00 H new ATOM 0 HB3 LYS A 134 112.300 16.221 19.264 1.00 0.00 H new ATOM 0 HG2 LYS A 134 114.619 16.886 20.039 1.00 0.00 H new ATOM 0 HG3 LYS A 134 115.057 17.213 18.373 1.00 0.00 H new ATOM 0 HD2 LYS A 134 113.104 18.851 18.245 1.00 0.00 H new ATOM 0 HD3 LYS A 134 112.829 18.594 19.956 1.00 0.00 H new ATOM 0 HE2 LYS A 134 114.851 19.680 20.585 1.00 0.00 H new ATOM 0 HE3 LYS A 134 115.636 19.336 19.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 114.868 21.654 19.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 114.033 20.806 17.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 113.272 21.140 19.414 1.00 0.00 H new ATOM 2247 N ASP A 135 112.930 13.966 20.703 1.00 0.00 N ATOM 2248 CA ASP A 135 113.058 13.506 22.126 1.00 0.00 C ATOM 2249 C ASP A 135 113.737 12.134 22.183 1.00 0.00 C ATOM 2250 O ASP A 135 114.477 11.844 23.105 1.00 0.00 O ATOM 2251 CB ASP A 135 111.633 13.415 22.683 1.00 0.00 C ATOM 2252 CG ASP A 135 111.009 14.812 22.733 1.00 0.00 C ATOM 2253 OD1 ASP A 135 111.689 15.729 23.165 1.00 0.00 O ATOM 2254 OD2 ASP A 135 109.862 14.941 22.340 1.00 0.00 O ATOM 0 H ASP A 135 111.973 14.014 20.355 1.00 0.00 H new ATOM 0 HA ASP A 135 113.667 14.197 22.709 1.00 0.00 H new ATOM 0 HB2 ASP A 135 111.029 12.758 22.057 1.00 0.00 H new ATOM 0 HB3 ASP A 135 111.650 12.977 23.681 1.00 0.00 H new ATOM 2259 N GLU A 136 113.487 11.289 21.202 1.00 0.00 N ATOM 2260 CA GLU A 136 114.075 9.903 21.154 1.00 0.00 C ATOM 2261 C GLU A 136 113.792 9.121 22.443 1.00 0.00 C ATOM 2262 O GLU A 136 114.364 8.055 22.605 1.00 0.00 O ATOM 2263 CB GLU A 136 115.586 10.077 20.954 1.00 0.00 C ATOM 2264 CG GLU A 136 115.854 10.719 19.591 1.00 0.00 C ATOM 2265 CD GLU A 136 117.358 10.722 19.314 1.00 0.00 C ATOM 2266 OE1 GLU A 136 118.047 11.541 19.902 1.00 0.00 O ATOM 2267 OE2 GLU A 136 117.796 9.908 18.518 1.00 0.00 O ATOM 2268 OXT GLU A 136 113.009 9.603 23.245 1.00 0.00 O ATOM 0 H GLU A 136 112.883 11.510 20.411 1.00 0.00 H new ATOM 0 HA GLU A 136 113.626 9.330 20.343 1.00 0.00 H new ATOM 0 HB2 GLU A 136 115.999 10.700 21.748 1.00 0.00 H new ATOM 0 HB3 GLU A 136 116.085 9.110 21.016 1.00 0.00 H new ATOM 0 HG2 GLU A 136 115.331 10.169 18.809 1.00 0.00 H new ATOM 0 HG3 GLU A 136 115.469 11.739 19.576 1.00 0.00 H new TER 2275 GLU A 136