USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 694 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 45 LYS NZ :NH3+ 128:sc= 1.17 (180deg=0.879) USER MOD Set 1.2: A 59 MET CE :methyl -165:sc= -0.373 (180deg=-0.691) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -151:sc= 0.801 (180deg=-0.18!) USER MOD Single : A 25 LYS NZ :NH3+ 169:sc= 1.26 (180deg=0.986) USER MOD Single : A 29 GLN : amide:sc= 0.545 K(o=0.54,f=-0.13) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -134:sc= -0.401! USER MOD Single : A 35 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.34) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 165:sc= -0.0162 (180deg=-0.276) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.00711 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 46 LYS NZ :NH3+ 164:sc= -0.0677 (180deg=-0.329) USER MOD Single : A 48 LYS NZ :NH3+ 176:sc= 2.31 (180deg=2.2) USER MOD Single : A 50 SER OG : rot -93:sc= 1.23 USER MOD Single : A 51 TYR OH : rot -130:sc= -0.555 USER MOD Single : A 52 CYS SG : rot 87:sc= -0.878! USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 55 GLN : amide:sc= -0.147 X(o=-0.15,f=-0.21) USER MOD Single : A 60 ASN : amide:sc= 0.184 X(o=0.18,f=0) USER MOD Single : A 61 SER OG : rot -78:sc= 1.22 USER MOD Single : A 69 GLN : amide:sc= -0.144 K(o=-0.14,f=-0.73) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 75 HIS : no HD1:sc= 0.599 K(o=0.6,f=-4.9!) USER MOD Single : A 76 THR OG1 : rot 56:sc= 1.12 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 157:sc= 1.25 USER MOD Single : A 92 GLN : amide:sc= 0.692 K(o=0.69,f=0) USER MOD Single : A 94 GLN : amide:sc= -0.129 K(o=-0.13,f=-1.3!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.154 USER MOD Single : B 357 ASN : amide:sc= -0.192 X(o=-0.19,f=-0.6) USER MOD Single : B 358 ASN : amide:sc= 0 K(o=0,f=-0.77) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 2.602 6.385 9.571 1.00 10.00 N ATOM 2 CA TYR A 21 2.832 5.428 8.465 1.00 10.00 C ATOM 3 C TYR A 21 1.524 4.770 8.061 1.00 10.00 C ATOM 4 O TYR A 21 0.661 4.531 8.903 1.00 10.00 O ATOM 5 CB TYR A 21 3.839 4.352 8.884 1.00 10.00 C ATOM 6 CG TYR A 21 5.279 4.816 8.877 1.00 10.00 C ATOM 7 CD1 TYR A 21 6.051 4.738 7.724 1.00 10.00 C ATOM 8 CD2 TYR A 21 5.870 5.323 10.026 1.00 10.00 C ATOM 9 CE1 TYR A 21 7.369 5.159 7.718 1.00 10.00 C ATOM 10 CE2 TYR A 21 7.184 5.746 10.027 1.00 10.00 C ATOM 11 CZ TYR A 21 7.930 5.659 8.872 1.00 10.00 C ATOM 12 OH TYR A 21 9.242 6.079 8.873 1.00 10.00 O ATOM 0 HA TYR A 21 3.236 5.979 7.616 1.00 10.00 H new ATOM 0 HB2 TYR A 21 3.586 4.003 9.885 1.00 10.00 H new ATOM 0 HB3 TYR A 21 3.741 3.497 8.214 1.00 10.00 H new ATOM 0 HD1 TYR A 21 5.615 4.343 6.818 1.00 10.00 H new ATOM 0 HD2 TYR A 21 5.291 5.388 10.936 1.00 10.00 H new ATOM 0 HE1 TYR A 21 7.955 5.096 6.813 1.00 10.00 H new ATOM 0 HE2 TYR A 21 7.625 6.143 10.929 1.00 10.00 H new ATOM 0 HH TYR A 21 9.481 6.405 9.766 1.00 10.00 H new ATOM 22 N ILE A 22 1.385 4.476 6.778 1.00 10.00 N ATOM 23 CA ILE A 22 0.183 3.842 6.257 1.00 10.00 C ATOM 24 C ILE A 22 0.510 2.434 5.776 1.00 10.00 C ATOM 25 O ILE A 22 1.314 2.253 4.863 1.00 10.00 O ATOM 26 CB ILE A 22 -0.426 4.660 5.093 1.00 10.00 C ATOM 27 CG1 ILE A 22 -0.928 6.022 5.597 1.00 10.00 C ATOM 28 CG2 ILE A 22 -1.555 3.887 4.421 1.00 10.00 C ATOM 29 CD1 ILE A 22 -2.083 5.927 6.575 1.00 10.00 C ATOM 0 H ILE A 22 2.096 4.668 6.072 1.00 10.00 H new ATOM 0 HA ILE A 22 -0.551 3.797 7.062 1.00 10.00 H new ATOM 0 HB ILE A 22 0.355 4.833 4.352 1.00 10.00 H new ATOM 0 HG12 ILE A 22 -0.102 6.548 6.075 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -1.237 6.623 4.742 1.00 10.00 H new ATOM 0 HG21 ILE A 22 -1.968 4.481 3.606 1.00 10.00 H new ATOM 0 HG22 ILE A 22 -1.168 2.948 4.025 1.00 10.00 H new ATOM 0 HG23 ILE A 22 -2.338 3.678 5.150 1.00 10.00 H new ATOM 0 HD11 ILE A 22 -2.381 6.929 6.885 1.00 10.00 H new ATOM 0 HD12 ILE A 22 -2.926 5.430 6.095 1.00 10.00 H new ATOM 0 HD13 ILE A 22 -1.774 5.354 7.449 1.00 10.00 H new ATOM 41 N LYS A 23 -0.097 1.441 6.395 1.00 10.00 N ATOM 42 CA LYS A 23 0.152 0.060 6.023 1.00 10.00 C ATOM 43 C LYS A 23 -0.926 -0.447 5.069 1.00 10.00 C ATOM 44 O LYS A 23 -2.047 -0.757 5.480 1.00 10.00 O ATOM 45 CB LYS A 23 0.214 -0.823 7.269 1.00 10.00 C ATOM 46 CG LYS A 23 0.751 -2.217 7.002 1.00 10.00 C ATOM 47 CD LYS A 23 0.094 -3.249 7.905 1.00 10.00 C ATOM 48 CE LYS A 23 -1.240 -3.724 7.339 1.00 10.00 C ATOM 49 NZ LYS A 23 -2.344 -2.771 7.619 1.00 10.00 N ATOM 0 H LYS A 23 -0.765 1.563 7.156 1.00 10.00 H new ATOM 0 HA LYS A 23 1.113 0.013 5.511 1.00 10.00 H new ATOM 0 HB2 LYS A 23 0.842 -0.338 8.016 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -0.785 -0.904 7.696 1.00 10.00 H new ATOM 0 HG2 LYS A 23 0.577 -2.481 5.959 1.00 10.00 H new ATOM 0 HG3 LYS A 23 1.830 -2.229 7.159 1.00 10.00 H new ATOM 0 HD2 LYS A 23 0.761 -4.102 8.029 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -0.062 -2.820 8.895 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -1.146 -3.861 6.262 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -1.487 -4.697 7.764 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -3.243 -3.290 7.681 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.162 -2.284 8.520 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -2.401 -2.071 6.852 1.00 10.00 H new ATOM 63 N LEU A 24 -0.581 -0.519 3.794 1.00 10.00 N ATOM 64 CA LEU A 24 -1.504 -0.991 2.773 1.00 10.00 C ATOM 65 C LEU A 24 -1.498 -2.511 2.736 1.00 10.00 C ATOM 66 O LEU A 24 -0.466 -3.138 2.992 1.00 10.00 O ATOM 67 CB LEU A 24 -1.111 -0.440 1.400 1.00 10.00 C ATOM 68 CG LEU A 24 -1.015 1.084 1.311 1.00 10.00 C ATOM 69 CD1 LEU A 24 -0.365 1.501 0.000 1.00 10.00 C ATOM 70 CD2 LEU A 24 -2.392 1.715 1.442 1.00 10.00 C ATOM 0 H LEU A 24 0.338 -0.255 3.439 1.00 10.00 H new ATOM 0 HA LEU A 24 -2.506 -0.638 3.019 1.00 10.00 H new ATOM 0 HB2 LEU A 24 -0.148 -0.865 1.118 1.00 10.00 H new ATOM 0 HB3 LEU A 24 -1.839 -0.785 0.666 1.00 10.00 H new ATOM 0 HG LEU A 24 -0.394 1.437 2.134 1.00 10.00 H new ATOM 0 HD11 LEU A 24 -0.305 2.588 -0.047 1.00 10.00 H new ATOM 0 HD12 LEU A 24 0.638 1.079 -0.059 1.00 10.00 H new ATOM 0 HD13 LEU A 24 -0.962 1.135 -0.835 1.00 10.00 H new ATOM 0 HD21 LEU A 24 -2.303 2.799 1.376 1.00 10.00 H new ATOM 0 HD22 LEU A 24 -3.035 1.354 0.639 1.00 10.00 H new ATOM 0 HD23 LEU A 24 -2.826 1.444 2.404 1.00 10.00 H new ATOM 82 N LYS A 25 -2.642 -3.101 2.426 1.00 10.00 N ATOM 83 CA LYS A 25 -2.744 -4.548 2.357 1.00 10.00 C ATOM 84 C LYS A 25 -2.944 -4.987 0.914 1.00 10.00 C ATOM 85 O LYS A 25 -4.052 -4.919 0.377 1.00 10.00 O ATOM 86 CB LYS A 25 -3.893 -5.056 3.229 1.00 10.00 C ATOM 87 CG LYS A 25 -3.600 -6.398 3.883 1.00 10.00 C ATOM 88 CD LYS A 25 -4.864 -7.061 4.407 1.00 10.00 C ATOM 89 CE LYS A 25 -5.671 -7.688 3.281 1.00 10.00 C ATOM 90 NZ LYS A 25 -6.750 -8.571 3.794 1.00 10.00 N ATOM 0 H LYS A 25 -3.508 -2.602 2.219 1.00 10.00 H new ATOM 0 HA LYS A 25 -1.816 -4.977 2.735 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -4.105 -4.320 4.004 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -4.792 -5.145 2.619 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -3.117 -7.056 3.161 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -2.897 -6.256 4.704 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -4.599 -7.826 5.136 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -5.475 -6.323 4.927 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -6.108 -6.901 2.667 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -5.007 -8.264 2.636 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -7.388 -8.829 3.014 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -6.331 -9.433 4.197 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -7.288 -8.070 4.530 1.00 10.00 H new ATOM 104 N VAL A 26 -1.863 -5.417 0.287 1.00 10.00 N ATOM 105 CA VAL A 26 -1.914 -5.864 -1.095 1.00 10.00 C ATOM 106 C VAL A 26 -2.488 -7.270 -1.164 1.00 10.00 C ATOM 107 O VAL A 26 -2.096 -8.147 -0.393 1.00 10.00 O ATOM 108 CB VAL A 26 -0.522 -5.844 -1.766 1.00 10.00 C ATOM 109 CG1 VAL A 26 -0.655 -5.865 -3.281 1.00 10.00 C ATOM 110 CG2 VAL A 26 0.285 -4.633 -1.313 1.00 10.00 C ATOM 0 H VAL A 26 -0.938 -5.466 0.713 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.556 -5.169 -1.637 1.00 10.00 H new ATOM 0 HB VAL A 26 0.014 -6.741 -1.457 1.00 10.00 H new ATOM 0 HG11 VAL A 26 0.337 -5.850 -3.734 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -1.181 -6.769 -3.588 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -1.216 -4.990 -3.609 1.00 10.00 H new ATOM 0 HG21 VAL A 26 1.260 -4.643 -1.800 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.246 -3.720 -1.583 1.00 10.00 H new ATOM 0 HG23 VAL A 26 0.419 -4.669 -0.232 1.00 10.00 H new ATOM 120 N ILE A 27 -3.425 -7.470 -2.074 1.00 10.00 N ATOM 121 CA ILE A 27 -4.068 -8.764 -2.237 1.00 10.00 C ATOM 122 C ILE A 27 -3.341 -9.605 -3.280 1.00 10.00 C ATOM 123 O ILE A 27 -3.367 -9.297 -4.473 1.00 10.00 O ATOM 124 CB ILE A 27 -5.549 -8.613 -2.655 1.00 10.00 C ATOM 125 CG1 ILE A 27 -6.241 -7.518 -1.832 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.283 -9.941 -2.507 1.00 10.00 C ATOM 127 CD1 ILE A 27 -6.305 -7.804 -0.347 1.00 10.00 C ATOM 0 H ILE A 27 -3.759 -6.750 -2.714 1.00 10.00 H new ATOM 0 HA ILE A 27 -4.024 -9.264 -1.270 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.579 -8.317 -3.704 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -5.715 -6.576 -1.987 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -7.255 -7.382 -2.208 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -7.324 -9.817 -2.805 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -5.811 -10.691 -3.142 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.240 -10.267 -1.468 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -6.809 -6.981 0.161 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -6.858 -8.728 -0.178 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -5.294 -7.909 0.047 1.00 10.00 H new ATOM 139 N GLY A 28 -2.681 -10.657 -2.819 1.00 10.00 N ATOM 140 CA GLY A 28 -1.970 -11.534 -3.722 1.00 10.00 C ATOM 141 C GLY A 28 -2.885 -12.564 -4.353 1.00 10.00 C ATOM 142 O GLY A 28 -3.968 -12.846 -3.833 1.00 10.00 O ATOM 0 H GLY A 28 -2.626 -10.918 -1.835 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -1.497 -10.941 -4.505 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -1.172 -12.042 -3.180 1.00 10.00 H new ATOM 146 N GLN A 29 -2.444 -13.140 -5.466 1.00 10.00 N ATOM 147 CA GLN A 29 -3.231 -14.140 -6.183 1.00 10.00 C ATOM 148 C GLN A 29 -3.440 -15.395 -5.336 1.00 10.00 C ATOM 149 O GLN A 29 -4.473 -16.054 -5.432 1.00 10.00 O ATOM 150 CB GLN A 29 -2.546 -14.498 -7.505 1.00 10.00 C ATOM 151 CG GLN A 29 -3.344 -15.457 -8.380 1.00 10.00 C ATOM 152 CD GLN A 29 -4.739 -14.951 -8.696 1.00 10.00 C ATOM 153 OE1 GLN A 29 -4.949 -14.234 -9.674 1.00 10.00 O ATOM 154 NE2 GLN A 29 -5.704 -15.327 -7.873 1.00 10.00 N ATOM 0 H GLN A 29 -1.542 -12.931 -5.894 1.00 10.00 H new ATOM 0 HA GLN A 29 -4.212 -13.713 -6.393 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -2.360 -13.582 -8.065 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -1.574 -14.943 -7.290 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -2.804 -15.624 -9.312 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -3.419 -16.422 -7.878 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -5.489 -15.922 -7.073 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -6.663 -15.022 -8.038 1.00 10.00 H new ATOM 163 N ASP A 30 -2.465 -15.712 -4.494 1.00 10.00 N ATOM 164 CA ASP A 30 -2.551 -16.885 -3.631 1.00 10.00 C ATOM 165 C ASP A 30 -3.156 -16.511 -2.281 1.00 10.00 C ATOM 166 O ASP A 30 -2.917 -17.175 -1.272 1.00 10.00 O ATOM 167 CB ASP A 30 -1.168 -17.524 -3.443 1.00 10.00 C ATOM 168 CG ASP A 30 -0.200 -16.647 -2.674 1.00 10.00 C ATOM 169 OD1 ASP A 30 0.192 -15.582 -3.201 1.00 10.00 O ATOM 170 OD2 ASP A 30 0.184 -17.022 -1.545 1.00 10.00 O ATOM 0 H ASP A 30 -1.605 -15.174 -4.390 1.00 10.00 H new ATOM 0 HA ASP A 30 -3.202 -17.616 -4.111 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -1.282 -18.473 -2.919 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -0.744 -17.750 -4.421 1.00 10.00 H new ATOM 175 N SER A 31 -3.956 -15.443 -2.286 1.00 10.00 N ATOM 176 CA SER A 31 -4.622 -14.945 -1.085 1.00 10.00 C ATOM 177 C SER A 31 -3.605 -14.476 -0.051 1.00 10.00 C ATOM 178 O SER A 31 -3.822 -14.586 1.156 1.00 10.00 O ATOM 179 CB SER A 31 -5.542 -16.020 -0.505 1.00 10.00 C ATOM 180 OG SER A 31 -6.354 -16.583 -1.522 1.00 10.00 O ATOM 0 H SER A 31 -4.159 -14.900 -3.125 1.00 10.00 H new ATOM 0 HA SER A 31 -5.232 -14.084 -1.360 1.00 10.00 H new ATOM 0 HB2 SER A 31 -4.946 -16.801 -0.034 1.00 10.00 H new ATOM 0 HB3 SER A 31 -6.171 -15.587 0.273 1.00 10.00 H new ATOM 0 HG SER A 31 -6.935 -17.270 -1.134 1.00 10.00 H new ATOM 186 N SER A 32 -2.497 -13.953 -0.540 1.00 10.00 N ATOM 187 CA SER A 32 -1.445 -13.452 0.318 1.00 10.00 C ATOM 188 C SER A 32 -1.745 -12.015 0.725 1.00 10.00 C ATOM 189 O SER A 32 -2.067 -11.180 -0.122 1.00 10.00 O ATOM 190 CB SER A 32 -0.116 -13.531 -0.426 1.00 10.00 C ATOM 191 OG SER A 32 -0.326 -13.426 -1.827 1.00 10.00 O ATOM 0 H SER A 32 -2.303 -13.864 -1.537 1.00 10.00 H new ATOM 0 HA SER A 32 -1.387 -14.058 1.222 1.00 10.00 H new ATOM 0 HB2 SER A 32 0.544 -12.732 -0.090 1.00 10.00 H new ATOM 0 HB3 SER A 32 0.381 -14.473 -0.196 1.00 10.00 H new ATOM 0 HG SER A 32 0.202 -14.110 -2.289 1.00 10.00 H new ATOM 197 N GLU A 33 -1.672 -11.731 2.015 1.00 10.00 N ATOM 198 CA GLU A 33 -1.936 -10.389 2.504 1.00 10.00 C ATOM 199 C GLU A 33 -0.620 -9.654 2.713 1.00 10.00 C ATOM 200 O GLU A 33 0.023 -9.790 3.756 1.00 10.00 O ATOM 201 CB GLU A 33 -2.742 -10.435 3.805 1.00 10.00 C ATOM 202 CG GLU A 33 -3.932 -11.382 3.748 1.00 10.00 C ATOM 203 CD GLU A 33 -4.732 -11.397 5.033 1.00 10.00 C ATOM 204 OE1 GLU A 33 -5.683 -10.594 5.150 1.00 10.00 O ATOM 205 OE2 GLU A 33 -4.428 -12.216 5.923 1.00 10.00 O ATOM 0 H GLU A 33 -1.433 -12.409 2.739 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.529 -9.852 1.763 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.085 -10.739 4.620 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -3.097 -9.431 4.039 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -4.583 -11.091 2.924 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.578 -12.390 3.534 1.00 10.00 H new ATOM 212 N ILE A 34 -0.211 -8.894 1.709 1.00 10.00 N ATOM 213 CA ILE A 34 1.039 -8.153 1.785 1.00 10.00 C ATOM 214 C ILE A 34 0.859 -6.905 2.635 1.00 10.00 C ATOM 215 O ILE A 34 0.017 -6.058 2.339 1.00 10.00 O ATOM 216 CB ILE A 34 1.560 -7.736 0.392 1.00 10.00 C ATOM 217 CG1 ILE A 34 1.244 -8.803 -0.669 1.00 10.00 C ATOM 218 CG2 ILE A 34 3.056 -7.463 0.446 1.00 10.00 C ATOM 219 CD1 ILE A 34 1.901 -10.146 -0.422 1.00 10.00 C ATOM 0 H ILE A 34 -0.724 -8.774 0.835 1.00 10.00 H new ATOM 0 HA ILE A 34 1.773 -8.820 2.238 1.00 10.00 H new ATOM 0 HB ILE A 34 1.046 -6.819 0.103 1.00 10.00 H new ATOM 0 HG12 ILE A 34 0.164 -8.944 -0.715 1.00 10.00 H new ATOM 0 HG13 ILE A 34 1.559 -8.432 -1.644 1.00 10.00 H new ATOM 0 HG21 ILE A 34 3.408 -7.170 -0.543 1.00 10.00 H new ATOM 0 HG22 ILE A 34 3.254 -6.659 1.154 1.00 10.00 H new ATOM 0 HG23 ILE A 34 3.579 -8.364 0.765 1.00 10.00 H new ATOM 0 HD11 ILE A 34 1.625 -10.838 -1.217 1.00 10.00 H new ATOM 0 HD12 ILE A 34 2.984 -10.024 -0.407 1.00 10.00 H new ATOM 0 HD13 ILE A 34 1.568 -10.543 0.537 1.00 10.00 H new ATOM 231 N HIS A 35 1.648 -6.797 3.691 1.00 10.00 N ATOM 232 CA HIS A 35 1.573 -5.658 4.589 1.00 10.00 C ATOM 233 C HIS A 35 2.714 -4.691 4.296 1.00 10.00 C ATOM 234 O HIS A 35 3.800 -4.798 4.871 1.00 10.00 O ATOM 235 CB HIS A 35 1.635 -6.118 6.053 1.00 10.00 C ATOM 236 CG HIS A 35 0.387 -6.798 6.540 1.00 10.00 C ATOM 237 ND1 HIS A 35 0.086 -6.870 7.880 1.00 10.00 N ATOM 238 CD2 HIS A 35 -0.591 -7.419 5.837 1.00 10.00 C ATOM 239 CE1 HIS A 35 -1.059 -7.526 7.961 1.00 10.00 C ATOM 240 NE2 HIS A 35 -1.504 -7.878 6.750 1.00 10.00 N ATOM 0 H HIS A 35 2.352 -7.489 3.948 1.00 10.00 H new ATOM 0 HA HIS A 35 0.622 -5.150 4.428 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.477 -6.800 6.172 1.00 10.00 H new ATOM 0 HB3 HIS A 35 1.834 -5.253 6.685 1.00 10.00 H new ATOM 0 HD2 HIS A 35 -0.641 -7.531 4.764 1.00 10.00 H new ATOM 0 HE1 HIS A 35 -1.569 -7.749 8.886 1.00 10.00 H new ATOM 0 HE2 HIS A 35 -2.361 -8.391 6.545 1.00 10.00 H new ATOM 248 N PHE A 36 2.468 -3.760 3.390 1.00 10.00 N ATOM 249 CA PHE A 36 3.479 -2.783 3.018 1.00 10.00 C ATOM 250 C PHE A 36 3.281 -1.495 3.801 1.00 10.00 C ATOM 251 O PHE A 36 2.240 -0.845 3.690 1.00 10.00 O ATOM 252 CB PHE A 36 3.426 -2.496 1.516 1.00 10.00 C ATOM 253 CG PHE A 36 4.782 -2.443 0.866 1.00 10.00 C ATOM 254 CD1 PHE A 36 5.831 -1.768 1.471 1.00 10.00 C ATOM 255 CD2 PHE A 36 5.008 -3.074 -0.347 1.00 10.00 C ATOM 256 CE1 PHE A 36 7.079 -1.722 0.876 1.00 10.00 C ATOM 257 CE2 PHE A 36 6.253 -3.030 -0.946 1.00 10.00 C ATOM 258 CZ PHE A 36 7.289 -2.356 -0.334 1.00 10.00 C ATOM 0 H PHE A 36 1.580 -3.659 2.899 1.00 10.00 H new ATOM 0 HA PHE A 36 4.459 -3.196 3.258 1.00 10.00 H new ATOM 0 HB2 PHE A 36 2.828 -3.266 1.028 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.917 -1.546 1.354 1.00 10.00 H new ATOM 0 HD1 PHE A 36 5.672 -1.273 2.417 1.00 10.00 H new ATOM 0 HD2 PHE A 36 4.202 -3.606 -0.830 1.00 10.00 H new ATOM 0 HE1 PHE A 36 7.888 -1.192 1.356 1.00 10.00 H new ATOM 0 HE2 PHE A 36 6.414 -3.523 -1.893 1.00 10.00 H new ATOM 0 HZ PHE A 36 8.263 -2.324 -0.800 1.00 10.00 H new ATOM 268 N LYS A 37 4.275 -1.130 4.593 1.00 10.00 N ATOM 269 CA LYS A 37 4.199 0.080 5.390 1.00 10.00 C ATOM 270 C LYS A 37 4.789 1.254 4.620 1.00 10.00 C ATOM 271 O LYS A 37 6.008 1.396 4.523 1.00 10.00 O ATOM 272 CB LYS A 37 4.935 -0.115 6.715 1.00 10.00 C ATOM 273 CG LYS A 37 4.367 0.713 7.855 1.00 10.00 C ATOM 274 CD LYS A 37 4.871 0.230 9.208 1.00 10.00 C ATOM 275 CE LYS A 37 4.434 -1.199 9.499 1.00 10.00 C ATOM 276 NZ LYS A 37 4.648 -1.567 10.920 1.00 10.00 N ATOM 0 H LYS A 37 5.143 -1.655 4.700 1.00 10.00 H new ATOM 0 HA LYS A 37 3.152 0.297 5.603 1.00 10.00 H new ATOM 0 HB2 LYS A 37 4.898 -1.169 6.990 1.00 10.00 H new ATOM 0 HB3 LYS A 37 5.985 0.142 6.579 1.00 10.00 H new ATOM 0 HG2 LYS A 37 4.641 1.759 7.717 1.00 10.00 H new ATOM 0 HG3 LYS A 37 3.278 0.663 7.833 1.00 10.00 H new ATOM 0 HD2 LYS A 37 5.959 0.289 9.232 1.00 10.00 H new ATOM 0 HD3 LYS A 37 4.498 0.890 9.991 1.00 10.00 H new ATOM 0 HE2 LYS A 37 3.379 -1.313 9.250 1.00 10.00 H new ATOM 0 HE3 LYS A 37 4.989 -1.885 8.859 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 4.337 -2.547 11.075 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 5.658 -1.483 11.152 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 4.098 -0.929 11.530 1.00 10.00 H new ATOM 290 N VAL A 38 3.915 2.084 4.066 1.00 10.00 N ATOM 291 CA VAL A 38 4.339 3.241 3.292 1.00 10.00 C ATOM 292 C VAL A 38 4.250 4.511 4.133 1.00 10.00 C ATOM 293 O VAL A 38 3.708 4.498 5.241 1.00 10.00 O ATOM 294 CB VAL A 38 3.492 3.407 2.002 1.00 10.00 C ATOM 295 CG1 VAL A 38 3.325 2.073 1.295 1.00 10.00 C ATOM 296 CG2 VAL A 38 2.132 4.020 2.306 1.00 10.00 C ATOM 0 H VAL A 38 2.903 1.976 4.139 1.00 10.00 H new ATOM 0 HA VAL A 38 5.376 3.074 3.000 1.00 10.00 H new ATOM 0 HB VAL A 38 4.027 4.088 1.341 1.00 10.00 H new ATOM 0 HG11 VAL A 38 2.728 2.211 0.393 1.00 10.00 H new ATOM 0 HG12 VAL A 38 4.305 1.679 1.025 1.00 10.00 H new ATOM 0 HG13 VAL A 38 2.822 1.370 1.959 1.00 10.00 H new ATOM 0 HG21 VAL A 38 1.564 4.123 1.381 1.00 10.00 H new ATOM 0 HG22 VAL A 38 1.588 3.375 2.996 1.00 10.00 H new ATOM 0 HG23 VAL A 38 2.269 5.002 2.759 1.00 10.00 H new ATOM 306 N LYS A 39 4.781 5.603 3.608 1.00 10.00 N ATOM 307 CA LYS A 39 4.761 6.873 4.311 1.00 10.00 C ATOM 308 C LYS A 39 4.078 7.934 3.455 1.00 10.00 C ATOM 309 O LYS A 39 4.334 8.035 2.253 1.00 10.00 O ATOM 310 CB LYS A 39 6.187 7.299 4.663 1.00 10.00 C ATOM 311 CG LYS A 39 6.260 8.391 5.716 1.00 10.00 C ATOM 312 CD LYS A 39 7.701 8.746 6.044 1.00 10.00 C ATOM 313 CE LYS A 39 7.790 10.035 6.845 1.00 10.00 C ATOM 314 NZ LYS A 39 9.187 10.528 6.943 1.00 10.00 N ATOM 0 H LYS A 39 5.233 5.634 2.694 1.00 10.00 H new ATOM 0 HA LYS A 39 4.196 6.760 5.236 1.00 10.00 H new ATOM 0 HB2 LYS A 39 6.739 6.428 5.017 1.00 10.00 H new ATOM 0 HB3 LYS A 39 6.686 7.646 3.758 1.00 10.00 H new ATOM 0 HG2 LYS A 39 5.737 9.278 5.360 1.00 10.00 H new ATOM 0 HG3 LYS A 39 5.749 8.061 6.621 1.00 10.00 H new ATOM 0 HD2 LYS A 39 8.157 7.933 6.609 1.00 10.00 H new ATOM 0 HD3 LYS A 39 8.270 8.851 5.120 1.00 10.00 H new ATOM 0 HE2 LYS A 39 7.167 10.798 6.377 1.00 10.00 H new ATOM 0 HE3 LYS A 39 7.392 9.869 7.846 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 9.206 11.408 7.496 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 9.776 9.811 7.412 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 9.558 10.711 5.989 1.00 10.00 H new ATOM 328 N MET A 40 3.205 8.716 4.080 1.00 10.00 N ATOM 329 CA MET A 40 2.466 9.766 3.384 1.00 10.00 C ATOM 330 C MET A 40 3.364 10.976 3.101 1.00 10.00 C ATOM 331 O MET A 40 3.262 12.011 3.764 1.00 10.00 O ATOM 332 CB MET A 40 1.242 10.187 4.211 1.00 10.00 C ATOM 333 CG MET A 40 0.322 11.170 3.502 1.00 10.00 C ATOM 334 SD MET A 40 -0.405 10.493 1.997 1.00 10.00 S ATOM 335 CE MET A 40 -1.505 9.252 2.679 1.00 10.00 C ATOM 0 H MET A 40 2.990 8.643 5.074 1.00 10.00 H new ATOM 0 HA MET A 40 2.126 9.369 2.427 1.00 10.00 H new ATOM 0 HB2 MET A 40 0.671 9.297 4.474 1.00 10.00 H new ATOM 0 HB3 MET A 40 1.584 10.634 5.144 1.00 10.00 H new ATOM 0 HG2 MET A 40 -0.476 11.468 4.182 1.00 10.00 H new ATOM 0 HG3 MET A 40 0.883 12.071 3.255 1.00 10.00 H new ATOM 0 HE1 MET A 40 -2.213 8.934 1.914 1.00 10.00 H new ATOM 0 HE2 MET A 40 -0.922 8.394 3.014 1.00 10.00 H new ATOM 0 HE3 MET A 40 -2.049 9.673 3.524 1.00 10.00 H new ATOM 345 N THR A 41 4.253 10.824 2.121 1.00 10.00 N ATOM 346 CA THR A 41 5.172 11.887 1.720 1.00 10.00 C ATOM 347 C THR A 41 6.098 11.401 0.601 1.00 10.00 C ATOM 348 O THR A 41 6.518 12.182 -0.254 1.00 10.00 O ATOM 349 CB THR A 41 6.012 12.410 2.916 1.00 10.00 C ATOM 350 OG1 THR A 41 6.757 13.574 2.534 1.00 10.00 O ATOM 351 CG2 THR A 41 6.967 11.348 3.435 1.00 10.00 C ATOM 0 H THR A 41 4.356 9.963 1.584 1.00 10.00 H new ATOM 0 HA THR A 41 4.567 12.716 1.352 1.00 10.00 H new ATOM 0 HB THR A 41 5.315 12.667 3.714 1.00 10.00 H new ATOM 0 HG1 THR A 41 7.280 13.893 3.299 1.00 10.00 H new ATOM 0 HG21 THR A 41 7.538 11.750 4.272 1.00 10.00 H new ATOM 0 HG22 THR A 41 6.399 10.479 3.767 1.00 10.00 H new ATOM 0 HG23 THR A 41 7.650 11.052 2.639 1.00 10.00 H new ATOM 359 N THR A 42 6.404 10.108 0.609 1.00 10.00 N ATOM 360 CA THR A 42 7.271 9.513 -0.397 1.00 10.00 C ATOM 361 C THR A 42 6.473 9.113 -1.636 1.00 10.00 C ATOM 362 O THR A 42 5.271 8.853 -1.551 1.00 10.00 O ATOM 363 CB THR A 42 7.976 8.274 0.174 1.00 10.00 C ATOM 364 OG1 THR A 42 8.016 8.372 1.601 1.00 10.00 O ATOM 365 CG2 THR A 42 9.390 8.151 -0.375 1.00 10.00 C ATOM 0 H THR A 42 6.060 9.449 1.308 1.00 10.00 H new ATOM 0 HA THR A 42 8.015 10.257 -0.681 1.00 10.00 H new ATOM 0 HB THR A 42 7.419 7.385 -0.122 1.00 10.00 H new ATOM 0 HG1 THR A 42 8.464 7.582 1.971 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.868 7.266 0.045 1.00 10.00 H new ATOM 0 HG22 THR A 42 9.352 8.063 -1.461 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.964 9.037 -0.103 1.00 10.00 H new ATOM 373 N HIS A 43 7.138 9.083 -2.783 1.00 10.00 N ATOM 374 CA HIS A 43 6.493 8.709 -4.034 1.00 10.00 C ATOM 375 C HIS A 43 6.288 7.202 -4.087 1.00 10.00 C ATOM 376 O HIS A 43 7.075 6.439 -3.522 1.00 10.00 O ATOM 377 CB HIS A 43 7.338 9.162 -5.227 1.00 10.00 C ATOM 378 CG HIS A 43 7.715 10.610 -5.181 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.930 11.011 -4.685 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.008 11.702 -5.561 1.00 10.00 C ATOM 381 CE1 HIS A 43 8.941 12.328 -4.777 1.00 10.00 C ATOM 382 NE2 HIS A 43 7.799 12.793 -5.301 1.00 10.00 N ATOM 0 H HIS A 43 8.127 9.314 -2.873 1.00 10.00 H new ATOM 0 HA HIS A 43 5.522 9.203 -4.084 1.00 10.00 H new ATOM 0 HB2 HIS A 43 8.246 8.560 -5.267 1.00 10.00 H new ATOM 0 HB3 HIS A 43 6.786 8.968 -6.147 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.015 11.712 -5.986 1.00 10.00 H new ATOM 0 HE1 HIS A 43 9.767 12.952 -4.469 1.00 10.00 H new ATOM 0 HE2 HIS A 43 7.563 13.770 -5.474 1.00 10.00 H new ATOM 390 N LEU A 44 5.246 6.774 -4.789 1.00 10.00 N ATOM 391 CA LEU A 44 4.935 5.354 -4.907 1.00 10.00 C ATOM 392 C LEU A 44 5.966 4.625 -5.765 1.00 10.00 C ATOM 393 O LEU A 44 5.974 3.399 -5.823 1.00 10.00 O ATOM 394 CB LEU A 44 3.523 5.164 -5.471 1.00 10.00 C ATOM 395 CG LEU A 44 2.398 5.444 -4.471 1.00 10.00 C ATOM 396 CD1 LEU A 44 1.080 5.679 -5.190 1.00 10.00 C ATOM 397 CD2 LEU A 44 2.265 4.294 -3.483 1.00 10.00 C ATOM 0 H LEU A 44 4.602 7.390 -5.285 1.00 10.00 H new ATOM 0 HA LEU A 44 4.974 4.917 -3.909 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.398 5.820 -6.333 1.00 10.00 H new ATOM 0 HB3 LEU A 44 3.424 4.141 -5.833 1.00 10.00 H new ATOM 0 HG LEU A 44 2.652 6.349 -3.920 1.00 10.00 H new ATOM 0 HD11 LEU A 44 0.296 5.876 -4.458 1.00 10.00 H new ATOM 0 HD12 LEU A 44 1.177 6.536 -5.857 1.00 10.00 H new ATOM 0 HD13 LEU A 44 0.820 4.794 -5.771 1.00 10.00 H new ATOM 0 HD21 LEU A 44 1.461 4.510 -2.780 1.00 10.00 H new ATOM 0 HD22 LEU A 44 2.038 3.375 -4.023 1.00 10.00 H new ATOM 0 HD23 LEU A 44 3.201 4.173 -2.938 1.00 10.00 H new ATOM 409 N LYS A 45 6.837 5.382 -6.426 1.00 10.00 N ATOM 410 CA LYS A 45 7.889 4.802 -7.252 1.00 10.00 C ATOM 411 C LYS A 45 8.787 3.916 -6.394 1.00 10.00 C ATOM 412 O LYS A 45 9.079 2.776 -6.753 1.00 10.00 O ATOM 413 CB LYS A 45 8.717 5.909 -7.913 1.00 10.00 C ATOM 414 CG LYS A 45 9.952 5.414 -8.656 1.00 10.00 C ATOM 415 CD LYS A 45 9.589 4.511 -9.826 1.00 10.00 C ATOM 416 CE LYS A 45 10.776 4.302 -10.754 1.00 10.00 C ATOM 417 NZ LYS A 45 10.428 3.455 -11.924 1.00 10.00 N ATOM 0 H LYS A 45 6.834 6.402 -6.405 1.00 10.00 H new ATOM 0 HA LYS A 45 7.432 4.197 -8.035 1.00 10.00 H new ATOM 0 HB2 LYS A 45 8.081 6.453 -8.612 1.00 10.00 H new ATOM 0 HB3 LYS A 45 9.029 6.619 -7.147 1.00 10.00 H new ATOM 0 HG2 LYS A 45 10.522 6.268 -9.021 1.00 10.00 H new ATOM 0 HG3 LYS A 45 10.597 4.871 -7.965 1.00 10.00 H new ATOM 0 HD2 LYS A 45 9.244 3.547 -9.451 1.00 10.00 H new ATOM 0 HD3 LYS A 45 8.762 4.950 -10.384 1.00 10.00 H new ATOM 0 HE2 LYS A 45 11.138 5.269 -11.102 1.00 10.00 H new ATOM 0 HE3 LYS A 45 11.591 3.837 -10.200 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 10.713 3.939 -12.800 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.926 2.545 -11.854 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 9.402 3.288 -11.939 1.00 10.00 H new ATOM 431 N LYS A 46 9.190 4.448 -5.241 1.00 10.00 N ATOM 432 CA LYS A 46 10.048 3.729 -4.304 1.00 10.00 C ATOM 433 C LYS A 46 9.366 2.443 -3.827 1.00 10.00 C ATOM 434 O LYS A 46 10.027 1.448 -3.531 1.00 10.00 O ATOM 435 CB LYS A 46 10.373 4.644 -3.113 1.00 10.00 C ATOM 436 CG LYS A 46 11.305 4.028 -2.078 1.00 10.00 C ATOM 437 CD LYS A 46 12.743 3.935 -2.574 1.00 10.00 C ATOM 438 CE LYS A 46 13.397 5.305 -2.696 1.00 10.00 C ATOM 439 NZ LYS A 46 13.456 6.025 -1.395 1.00 10.00 N ATOM 0 H LYS A 46 8.932 5.385 -4.932 1.00 10.00 H new ATOM 0 HA LYS A 46 10.974 3.449 -4.805 1.00 10.00 H new ATOM 0 HB2 LYS A 46 10.825 5.562 -3.489 1.00 10.00 H new ATOM 0 HB3 LYS A 46 9.441 4.925 -2.622 1.00 10.00 H new ATOM 0 HG2 LYS A 46 11.276 4.624 -1.166 1.00 10.00 H new ATOM 0 HG3 LYS A 46 10.948 3.031 -1.819 1.00 10.00 H new ATOM 0 HD2 LYS A 46 13.323 3.317 -1.889 1.00 10.00 H new ATOM 0 HD3 LYS A 46 12.760 3.438 -3.544 1.00 10.00 H new ATOM 0 HE2 LYS A 46 14.407 5.188 -3.089 1.00 10.00 H new ATOM 0 HE3 LYS A 46 12.842 5.906 -3.416 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 14.134 6.811 -1.464 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 12.514 6.399 -1.162 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 13.762 5.369 -0.649 1.00 10.00 H new ATOM 453 N LEU A 47 8.039 2.471 -3.785 1.00 10.00 N ATOM 454 CA LEU A 47 7.250 1.321 -3.347 1.00 10.00 C ATOM 455 C LEU A 47 7.115 0.287 -4.461 1.00 10.00 C ATOM 456 O LEU A 47 7.199 -0.918 -4.223 1.00 10.00 O ATOM 457 CB LEU A 47 5.855 1.771 -2.892 1.00 10.00 C ATOM 458 CG LEU A 47 5.761 2.347 -1.474 1.00 10.00 C ATOM 459 CD1 LEU A 47 6.376 1.398 -0.462 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.418 3.718 -1.391 1.00 10.00 C ATOM 0 H LEU A 47 7.482 3.283 -4.051 1.00 10.00 H new ATOM 0 HA LEU A 47 7.773 0.861 -2.509 1.00 10.00 H new ATOM 0 HB2 LEU A 47 5.492 2.523 -3.592 1.00 10.00 H new ATOM 0 HB3 LEU A 47 5.180 0.918 -2.961 1.00 10.00 H new ATOM 0 HG LEU A 47 4.704 2.465 -1.235 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.297 1.829 0.536 1.00 10.00 H new ATOM 0 HD12 LEU A 47 5.847 0.445 -0.489 1.00 10.00 H new ATOM 0 HD13 LEU A 47 7.426 1.237 -0.706 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.335 4.100 -0.374 1.00 10.00 H new ATOM 0 HD22 LEU A 47 7.470 3.634 -1.663 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.920 4.402 -2.077 1.00 10.00 H new ATOM 472 N LYS A 48 6.900 0.762 -5.679 1.00 10.00 N ATOM 473 CA LYS A 48 6.745 -0.120 -6.825 1.00 10.00 C ATOM 474 C LYS A 48 8.039 -0.876 -7.116 1.00 10.00 C ATOM 475 O LYS A 48 8.009 -2.036 -7.523 1.00 10.00 O ATOM 476 CB LYS A 48 6.314 0.676 -8.060 1.00 10.00 C ATOM 477 CG LYS A 48 4.914 1.263 -7.950 1.00 10.00 C ATOM 478 CD LYS A 48 4.564 2.130 -9.150 1.00 10.00 C ATOM 479 CE LYS A 48 4.373 1.296 -10.408 1.00 10.00 C ATOM 480 NZ LYS A 48 3.903 2.115 -11.555 1.00 10.00 N ATOM 0 H LYS A 48 6.829 1.755 -5.899 1.00 10.00 H new ATOM 0 HA LYS A 48 5.970 -0.847 -6.584 1.00 10.00 H new ATOM 0 HB2 LYS A 48 7.026 1.485 -8.227 1.00 10.00 H new ATOM 0 HB3 LYS A 48 6.359 0.026 -8.934 1.00 10.00 H new ATOM 0 HG2 LYS A 48 4.188 0.455 -7.862 1.00 10.00 H new ATOM 0 HG3 LYS A 48 4.841 1.858 -7.039 1.00 10.00 H new ATOM 0 HD2 LYS A 48 3.652 2.689 -8.942 1.00 10.00 H new ATOM 0 HD3 LYS A 48 5.356 2.861 -9.314 1.00 10.00 H new ATOM 0 HE2 LYS A 48 5.315 0.814 -10.669 1.00 10.00 H new ATOM 0 HE3 LYS A 48 3.653 0.502 -10.210 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 3.851 1.521 -12.407 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 2.960 2.500 -11.343 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 4.568 2.898 -11.718 1.00 10.00 H new ATOM 494 N GLU A 49 9.169 -0.216 -6.899 1.00 10.00 N ATOM 495 CA GLU A 49 10.472 -0.827 -7.145 1.00 10.00 C ATOM 496 C GLU A 49 10.782 -1.899 -6.103 1.00 10.00 C ATOM 497 O GLU A 49 11.239 -2.992 -6.442 1.00 10.00 O ATOM 498 CB GLU A 49 11.572 0.242 -7.135 1.00 10.00 C ATOM 499 CG GLU A 49 11.366 1.343 -8.164 1.00 10.00 C ATOM 500 CD GLU A 49 12.395 1.317 -9.274 1.00 10.00 C ATOM 501 OE1 GLU A 49 13.095 2.332 -9.464 1.00 10.00 O ATOM 502 OE2 GLU A 49 12.501 0.288 -9.970 1.00 10.00 O ATOM 0 H GLU A 49 9.211 0.743 -6.553 1.00 10.00 H new ATOM 0 HA GLU A 49 10.440 -1.300 -8.126 1.00 10.00 H new ATOM 0 HB2 GLU A 49 11.622 0.690 -6.142 1.00 10.00 H new ATOM 0 HB3 GLU A 49 12.534 -0.238 -7.317 1.00 10.00 H new ATOM 0 HG2 GLU A 49 10.370 1.246 -8.597 1.00 10.00 H new ATOM 0 HG3 GLU A 49 11.403 2.311 -7.664 1.00 10.00 H new ATOM 509 N SER A 50 10.504 -1.590 -4.841 1.00 10.00 N ATOM 510 CA SER A 50 10.775 -2.514 -3.746 1.00 10.00 C ATOM 511 C SER A 50 9.894 -3.759 -3.827 1.00 10.00 C ATOM 512 O SER A 50 10.346 -4.867 -3.531 1.00 10.00 O ATOM 513 CB SER A 50 10.573 -1.810 -2.405 1.00 10.00 C ATOM 514 OG SER A 50 9.485 -0.908 -2.466 1.00 10.00 O ATOM 0 H SER A 50 10.090 -0.704 -4.551 1.00 10.00 H new ATOM 0 HA SER A 50 11.812 -2.838 -3.831 1.00 10.00 H new ATOM 0 HB2 SER A 50 10.394 -2.550 -1.625 1.00 10.00 H new ATOM 0 HB3 SER A 50 11.481 -1.273 -2.132 1.00 10.00 H new ATOM 0 HG SER A 50 9.813 -0.016 -2.706 1.00 10.00 H new ATOM 520 N TYR A 51 8.641 -3.577 -4.232 1.00 10.00 N ATOM 521 CA TYR A 51 7.710 -4.693 -4.350 1.00 10.00 C ATOM 522 C TYR A 51 8.236 -5.723 -5.344 1.00 10.00 C ATOM 523 O TYR A 51 8.214 -6.925 -5.075 1.00 10.00 O ATOM 524 CB TYR A 51 6.328 -4.203 -4.786 1.00 10.00 C ATOM 525 CG TYR A 51 5.225 -5.216 -4.553 1.00 10.00 C ATOM 526 CD1 TYR A 51 4.496 -5.210 -3.371 1.00 10.00 C ATOM 527 CD2 TYR A 51 4.917 -6.179 -5.507 1.00 10.00 C ATOM 528 CE1 TYR A 51 3.495 -6.132 -3.145 1.00 10.00 C ATOM 529 CE2 TYR A 51 3.913 -7.104 -5.288 1.00 10.00 C ATOM 530 CZ TYR A 51 3.207 -7.077 -4.104 1.00 10.00 C ATOM 531 OH TYR A 51 2.210 -7.997 -3.877 1.00 10.00 O ATOM 0 H TYR A 51 8.248 -2.670 -4.483 1.00 10.00 H new ATOM 0 HA TYR A 51 7.618 -5.162 -3.371 1.00 10.00 H new ATOM 0 HB2 TYR A 51 6.089 -3.287 -4.246 1.00 10.00 H new ATOM 0 HB3 TYR A 51 6.359 -3.949 -5.846 1.00 10.00 H new ATOM 0 HD1 TYR A 51 4.717 -4.471 -2.615 1.00 10.00 H new ATOM 0 HD2 TYR A 51 5.471 -6.205 -6.434 1.00 10.00 H new ATOM 0 HE1 TYR A 51 2.939 -6.113 -2.219 1.00 10.00 H new ATOM 0 HE2 TYR A 51 3.683 -7.844 -6.040 1.00 10.00 H new ATOM 0 HH TYR A 51 2.547 -8.898 -4.065 1.00 10.00 H new ATOM 541 N CYS A 52 8.720 -5.244 -6.487 1.00 10.00 N ATOM 542 CA CYS A 52 9.265 -6.124 -7.515 1.00 10.00 C ATOM 543 C CYS A 52 10.451 -6.906 -6.959 1.00 10.00 C ATOM 544 O CYS A 52 10.570 -8.115 -7.172 1.00 10.00 O ATOM 545 CB CYS A 52 9.689 -5.317 -8.746 1.00 10.00 C ATOM 546 SG CYS A 52 8.388 -4.257 -9.419 1.00 10.00 S ATOM 0 H CYS A 52 8.746 -4.252 -6.724 1.00 10.00 H new ATOM 0 HA CYS A 52 8.489 -6.828 -7.818 1.00 10.00 H new ATOM 0 HB2 CYS A 52 10.547 -4.698 -8.483 1.00 10.00 H new ATOM 0 HB3 CYS A 52 10.019 -6.007 -9.523 1.00 10.00 H new ATOM 0 HG CYS A 52 8.396 -3.114 -8.800 1.00 10.00 H new ATOM 552 N GLN A 53 11.304 -6.210 -6.208 1.00 10.00 N ATOM 553 CA GLN A 53 12.478 -6.824 -5.600 1.00 10.00 C ATOM 554 C GLN A 53 12.060 -7.889 -4.590 1.00 10.00 C ATOM 555 O GLN A 53 12.689 -8.941 -4.490 1.00 10.00 O ATOM 556 CB GLN A 53 13.341 -5.766 -4.912 1.00 10.00 C ATOM 557 CG GLN A 53 13.856 -4.695 -5.859 1.00 10.00 C ATOM 558 CD GLN A 53 14.611 -3.595 -5.139 1.00 10.00 C ATOM 559 OE1 GLN A 53 14.351 -3.302 -3.972 1.00 10.00 O ATOM 560 NE2 GLN A 53 15.554 -2.975 -5.831 1.00 10.00 N ATOM 0 H GLN A 53 11.201 -5.215 -6.007 1.00 10.00 H new ATOM 0 HA GLN A 53 13.063 -7.296 -6.389 1.00 10.00 H new ATOM 0 HB2 GLN A 53 12.759 -5.292 -4.122 1.00 10.00 H new ATOM 0 HB3 GLN A 53 14.189 -6.255 -4.434 1.00 10.00 H new ATOM 0 HG2 GLN A 53 14.510 -5.154 -6.600 1.00 10.00 H new ATOM 0 HG3 GLN A 53 13.016 -4.260 -6.401 1.00 10.00 H new ATOM 0 HE21 GLN A 53 15.740 -3.247 -6.796 1.00 10.00 H new ATOM 0 HE22 GLN A 53 16.095 -2.226 -5.399 1.00 10.00 H new ATOM 569 N ARG A 54 10.991 -7.607 -3.852 1.00 10.00 N ATOM 570 CA ARG A 54 10.479 -8.539 -2.854 1.00 10.00 C ATOM 571 C ARG A 54 9.962 -9.806 -3.526 1.00 10.00 C ATOM 572 O ARG A 54 10.111 -10.910 -2.998 1.00 10.00 O ATOM 573 CB ARG A 54 9.355 -7.892 -2.037 1.00 10.00 C ATOM 574 CG ARG A 54 8.939 -8.713 -0.827 1.00 10.00 C ATOM 575 CD ARG A 54 9.798 -8.391 0.385 1.00 10.00 C ATOM 576 NE ARG A 54 9.295 -9.023 1.606 1.00 10.00 N ATOM 577 CZ ARG A 54 10.016 -9.171 2.713 1.00 10.00 C ATOM 578 NH1 ARG A 54 11.252 -8.689 2.770 1.00 10.00 N ATOM 579 NH2 ARG A 54 9.499 -9.790 3.765 1.00 10.00 N ATOM 0 H ARG A 54 10.462 -6.738 -3.927 1.00 10.00 H new ATOM 0 HA ARG A 54 11.297 -8.800 -2.183 1.00 10.00 H new ATOM 0 HB2 ARG A 54 9.679 -6.906 -1.704 1.00 10.00 H new ATOM 0 HB3 ARG A 54 8.488 -7.742 -2.681 1.00 10.00 H new ATOM 0 HG2 ARG A 54 7.892 -8.517 -0.595 1.00 10.00 H new ATOM 0 HG3 ARG A 54 9.020 -9.775 -1.061 1.00 10.00 H new ATOM 0 HD2 ARG A 54 10.820 -8.722 0.202 1.00 10.00 H new ATOM 0 HD3 ARG A 54 9.834 -7.311 0.526 1.00 10.00 H new ATOM 0 HE ARG A 54 8.336 -9.370 1.607 1.00 10.00 H new ATOM 0 HH11 ARG A 54 11.648 -8.205 1.964 1.00 10.00 H new ATOM 0 HH12 ARG A 54 11.805 -8.803 3.619 1.00 10.00 H new ATOM 0 HH21 ARG A 54 8.547 -10.154 3.726 1.00 10.00 H new ATOM 0 HH22 ARG A 54 10.053 -9.903 4.614 1.00 10.00 H new ATOM 593 N GLN A 55 9.355 -9.638 -4.694 1.00 10.00 N ATOM 594 CA GLN A 55 8.823 -10.762 -5.451 1.00 10.00 C ATOM 595 C GLN A 55 9.953 -11.525 -6.133 1.00 10.00 C ATOM 596 O GLN A 55 9.797 -12.691 -6.498 1.00 10.00 O ATOM 597 CB GLN A 55 7.812 -10.276 -6.492 1.00 10.00 C ATOM 598 CG GLN A 55 6.575 -9.628 -5.888 1.00 10.00 C ATOM 599 CD GLN A 55 5.870 -10.526 -4.893 1.00 10.00 C ATOM 600 OE1 GLN A 55 6.132 -10.470 -3.692 1.00 10.00 O ATOM 601 NE2 GLN A 55 4.974 -11.363 -5.387 1.00 10.00 N ATOM 0 H GLN A 55 9.219 -8.730 -5.138 1.00 10.00 H new ATOM 0 HA GLN A 55 8.315 -11.433 -4.759 1.00 10.00 H new ATOM 0 HB2 GLN A 55 8.300 -9.560 -7.153 1.00 10.00 H new ATOM 0 HB3 GLN A 55 7.504 -11.121 -7.109 1.00 10.00 H new ATOM 0 HG2 GLN A 55 6.861 -8.700 -5.394 1.00 10.00 H new ATOM 0 HG3 GLN A 55 5.882 -9.363 -6.687 1.00 10.00 H new ATOM 0 HE21 GLN A 55 4.787 -11.377 -6.390 1.00 10.00 H new ATOM 0 HE22 GLN A 55 4.469 -11.995 -4.766 1.00 10.00 H new ATOM 610 N GLY A 56 11.086 -10.855 -6.295 1.00 10.00 N ATOM 611 CA GLY A 56 12.236 -11.472 -6.921 1.00 10.00 C ATOM 612 C GLY A 56 12.212 -11.347 -8.427 1.00 10.00 C ATOM 613 O GLY A 56 12.787 -12.177 -9.130 1.00 10.00 O ATOM 0 H GLY A 56 11.228 -9.889 -6.001 1.00 10.00 H new ATOM 0 HA2 GLY A 56 13.146 -11.012 -6.536 1.00 10.00 H new ATOM 0 HA3 GLY A 56 12.272 -12.527 -6.648 1.00 10.00 H new ATOM 617 N VAL A 57 11.553 -10.306 -8.922 1.00 10.00 N ATOM 618 CA VAL A 57 11.442 -10.072 -10.358 1.00 10.00 C ATOM 619 C VAL A 57 11.781 -8.620 -10.690 1.00 10.00 C ATOM 620 O VAL A 57 11.730 -7.755 -9.816 1.00 10.00 O ATOM 621 CB VAL A 57 10.018 -10.399 -10.877 1.00 10.00 C ATOM 622 CG1 VAL A 57 9.804 -11.904 -10.957 1.00 10.00 C ATOM 623 CG2 VAL A 57 8.961 -9.752 -9.994 1.00 10.00 C ATOM 0 H VAL A 57 11.085 -9.606 -8.346 1.00 10.00 H new ATOM 0 HA VAL A 57 12.152 -10.735 -10.852 1.00 10.00 H new ATOM 0 HB VAL A 57 9.921 -9.988 -11.882 1.00 10.00 H new ATOM 0 HG11 VAL A 57 8.798 -12.110 -11.323 1.00 10.00 H new ATOM 0 HG12 VAL A 57 10.535 -12.340 -11.638 1.00 10.00 H new ATOM 0 HG13 VAL A 57 9.926 -12.342 -9.966 1.00 10.00 H new ATOM 0 HG21 VAL A 57 7.969 -9.994 -10.376 1.00 10.00 H new ATOM 0 HG22 VAL A 57 9.059 -10.127 -8.975 1.00 10.00 H new ATOM 0 HG23 VAL A 57 9.097 -8.670 -9.997 1.00 10.00 H new ATOM 633 N PRO A 58 12.152 -8.332 -11.951 1.00 10.00 N ATOM 634 CA PRO A 58 12.483 -6.968 -12.383 1.00 10.00 C ATOM 635 C PRO A 58 11.279 -6.032 -12.297 1.00 10.00 C ATOM 636 O PRO A 58 10.143 -6.479 -12.155 1.00 10.00 O ATOM 637 CB PRO A 58 12.919 -7.144 -13.841 1.00 10.00 C ATOM 638 CG PRO A 58 12.301 -8.429 -14.270 1.00 10.00 C ATOM 639 CD PRO A 58 12.292 -9.303 -13.051 1.00 10.00 C ATOM 0 HA PRO A 58 13.248 -6.516 -11.752 1.00 10.00 H new ATOM 0 HB2 PRO A 58 12.576 -6.314 -14.459 1.00 10.00 H new ATOM 0 HB3 PRO A 58 14.005 -7.179 -13.928 1.00 10.00 H new ATOM 0 HG2 PRO A 58 11.290 -8.271 -14.646 1.00 10.00 H new ATOM 0 HG3 PRO A 58 12.873 -8.888 -15.077 1.00 10.00 H new ATOM 0 HD2 PRO A 58 11.466 -10.014 -13.070 1.00 10.00 H new ATOM 0 HD3 PRO A 58 13.210 -9.883 -12.963 1.00 10.00 H new ATOM 647 N MET A 59 11.532 -4.735 -12.386 1.00 10.00 N ATOM 648 CA MET A 59 10.464 -3.745 -12.309 1.00 10.00 C ATOM 649 C MET A 59 9.617 -3.757 -13.580 1.00 10.00 C ATOM 650 O MET A 59 10.057 -4.248 -14.621 1.00 10.00 O ATOM 651 CB MET A 59 11.061 -2.352 -12.086 1.00 10.00 C ATOM 652 CG MET A 59 10.158 -1.407 -11.304 1.00 10.00 C ATOM 653 SD MET A 59 9.071 -0.433 -12.366 1.00 10.00 S ATOM 654 CE MET A 59 8.297 0.644 -11.163 1.00 10.00 C ATOM 0 H MET A 59 12.465 -4.342 -12.511 1.00 10.00 H new ATOM 0 HA MET A 59 9.818 -3.998 -11.468 1.00 10.00 H new ATOM 0 HB2 MET A 59 12.008 -2.455 -11.556 1.00 10.00 H new ATOM 0 HB3 MET A 59 11.285 -1.905 -13.055 1.00 10.00 H new ATOM 0 HG2 MET A 59 9.553 -1.986 -10.606 1.00 10.00 H new ATOM 0 HG3 MET A 59 10.774 -0.734 -10.709 1.00 10.00 H new ATOM 0 HE1 MET A 59 7.420 1.114 -11.607 1.00 10.00 H new ATOM 0 HE2 MET A 59 7.995 0.060 -10.293 1.00 10.00 H new ATOM 0 HE3 MET A 59 9.005 1.414 -10.855 1.00 10.00 H new ATOM 664 N ASN A 60 8.396 -3.231 -13.472 1.00 10.00 N ATOM 665 CA ASN A 60 7.450 -3.150 -14.593 1.00 10.00 C ATOM 666 C ASN A 60 6.941 -4.533 -14.997 1.00 10.00 C ATOM 667 O ASN A 60 6.345 -4.703 -16.062 1.00 10.00 O ATOM 668 CB ASN A 60 8.073 -2.439 -15.803 1.00 10.00 C ATOM 669 CG ASN A 60 7.058 -1.627 -16.593 1.00 10.00 C ATOM 670 OD1 ASN A 60 6.930 -0.418 -16.401 1.00 10.00 O ATOM 671 ND2 ASN A 60 6.328 -2.282 -17.482 1.00 10.00 N ATOM 0 H ASN A 60 8.031 -2.846 -12.601 1.00 10.00 H new ATOM 0 HA ASN A 60 6.600 -2.560 -14.250 1.00 10.00 H new ATOM 0 HB2 ASN A 60 8.872 -1.781 -15.461 1.00 10.00 H new ATOM 0 HB3 ASN A 60 8.530 -3.180 -16.459 1.00 10.00 H new ATOM 0 HD21 ASN A 60 5.631 -1.784 -18.036 1.00 10.00 H new ATOM 0 HD22 ASN A 60 6.463 -3.285 -17.613 1.00 10.00 H new ATOM 678 N SER A 61 7.175 -5.523 -14.146 1.00 10.00 N ATOM 679 CA SER A 61 6.713 -6.874 -14.420 1.00 10.00 C ATOM 680 C SER A 61 5.308 -7.061 -13.863 1.00 10.00 C ATOM 681 O SER A 61 4.550 -7.922 -14.315 1.00 10.00 O ATOM 682 CB SER A 61 7.666 -7.895 -13.796 1.00 10.00 C ATOM 683 OG SER A 61 7.853 -7.632 -12.414 1.00 10.00 O ATOM 0 H SER A 61 7.679 -5.416 -13.266 1.00 10.00 H new ATOM 0 HA SER A 61 6.693 -7.030 -15.499 1.00 10.00 H new ATOM 0 HB2 SER A 61 7.266 -8.900 -13.928 1.00 10.00 H new ATOM 0 HB3 SER A 61 8.627 -7.864 -14.310 1.00 10.00 H new ATOM 0 HG SER A 61 8.484 -6.890 -12.305 1.00 10.00 H new ATOM 689 N LEU A 62 4.967 -6.233 -12.888 1.00 10.00 N ATOM 690 CA LEU A 62 3.669 -6.290 -12.241 1.00 10.00 C ATOM 691 C LEU A 62 3.006 -4.918 -12.248 1.00 10.00 C ATOM 692 O LEU A 62 3.672 -3.893 -12.093 1.00 10.00 O ATOM 693 CB LEU A 62 3.830 -6.784 -10.801 1.00 10.00 C ATOM 694 CG LEU A 62 4.605 -8.097 -10.639 1.00 10.00 C ATOM 695 CD1 LEU A 62 5.384 -8.094 -9.335 1.00 10.00 C ATOM 696 CD2 LEU A 62 3.662 -9.289 -10.691 1.00 10.00 C ATOM 0 H LEU A 62 5.582 -5.505 -12.525 1.00 10.00 H new ATOM 0 HA LEU A 62 3.034 -6.984 -12.792 1.00 10.00 H new ATOM 0 HB2 LEU A 62 4.335 -6.010 -10.224 1.00 10.00 H new ATOM 0 HB3 LEU A 62 2.839 -6.911 -10.365 1.00 10.00 H new ATOM 0 HG LEU A 62 5.310 -8.183 -11.466 1.00 10.00 H new ATOM 0 HD11 LEU A 62 5.929 -9.033 -9.235 1.00 10.00 H new ATOM 0 HD12 LEU A 62 6.089 -7.263 -9.335 1.00 10.00 H new ATOM 0 HD13 LEU A 62 4.693 -7.984 -8.499 1.00 10.00 H new ATOM 0 HD21 LEU A 62 4.233 -10.210 -10.574 1.00 10.00 H new ATOM 0 HD22 LEU A 62 2.931 -9.210 -9.886 1.00 10.00 H new ATOM 0 HD23 LEU A 62 3.145 -9.302 -11.650 1.00 10.00 H new ATOM 708 N ARG A 63 1.697 -4.907 -12.441 1.00 10.00 N ATOM 709 CA ARG A 63 0.934 -3.671 -12.458 1.00 10.00 C ATOM 710 C ARG A 63 0.015 -3.608 -11.243 1.00 10.00 C ATOM 711 O ARG A 63 -0.700 -4.566 -10.940 1.00 10.00 O ATOM 712 CB ARG A 63 0.119 -3.544 -13.754 1.00 10.00 C ATOM 713 CG ARG A 63 -0.814 -4.717 -14.021 1.00 10.00 C ATOM 714 CD ARG A 63 -1.603 -4.524 -15.306 1.00 10.00 C ATOM 715 NE ARG A 63 -2.538 -5.624 -15.541 1.00 10.00 N ATOM 716 CZ ARG A 63 -2.354 -6.587 -16.443 1.00 10.00 C ATOM 717 NH1 ARG A 63 -1.316 -6.552 -17.273 1.00 10.00 N ATOM 718 NH2 ARG A 63 -3.225 -7.581 -16.533 1.00 10.00 N ATOM 0 H ARG A 63 1.138 -5.747 -12.589 1.00 10.00 H new ATOM 0 HA ARG A 63 1.633 -2.835 -12.418 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -0.470 -2.628 -13.711 1.00 10.00 H new ATOM 0 HB3 ARG A 63 0.806 -3.442 -14.594 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -0.233 -5.637 -14.085 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -1.503 -4.832 -13.184 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -2.153 -3.584 -15.257 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -0.914 -4.447 -16.147 1.00 10.00 H new ATOM 0 HE ARG A 63 -3.387 -5.656 -14.977 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -0.649 -5.782 -17.224 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -1.186 -7.296 -17.959 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -4.034 -7.608 -15.913 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -3.087 -8.320 -17.223 1.00 10.00 H new ATOM 732 N PHE A 64 0.052 -2.485 -10.541 1.00 10.00 N ATOM 733 CA PHE A 64 -0.772 -2.295 -9.355 1.00 10.00 C ATOM 734 C PHE A 64 -2.106 -1.671 -9.730 1.00 10.00 C ATOM 735 O PHE A 64 -2.150 -0.683 -10.463 1.00 10.00 O ATOM 736 CB PHE A 64 -0.053 -1.405 -8.343 1.00 10.00 C ATOM 737 CG PHE A 64 1.229 -1.988 -7.827 1.00 10.00 C ATOM 738 CD1 PHE A 64 2.430 -1.732 -8.467 1.00 10.00 C ATOM 739 CD2 PHE A 64 1.234 -2.789 -6.696 1.00 10.00 C ATOM 740 CE1 PHE A 64 3.611 -2.265 -7.993 1.00 10.00 C ATOM 741 CE2 PHE A 64 2.413 -3.325 -6.217 1.00 10.00 C ATOM 742 CZ PHE A 64 3.602 -3.060 -6.867 1.00 10.00 C ATOM 0 H PHE A 64 0.646 -1.689 -10.773 1.00 10.00 H new ATOM 0 HA PHE A 64 -0.951 -3.271 -8.904 1.00 10.00 H new ATOM 0 HB2 PHE A 64 0.158 -0.441 -8.806 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -0.720 -1.216 -7.502 1.00 10.00 H new ATOM 0 HD1 PHE A 64 2.442 -1.107 -9.348 1.00 10.00 H new ATOM 0 HD2 PHE A 64 0.306 -2.996 -6.184 1.00 10.00 H new ATOM 0 HE1 PHE A 64 4.541 -2.060 -8.503 1.00 10.00 H new ATOM 0 HE2 PHE A 64 2.405 -3.950 -5.336 1.00 10.00 H new ATOM 0 HZ PHE A 64 4.526 -3.476 -6.493 1.00 10.00 H new ATOM 752 N LEU A 65 -3.183 -2.245 -9.223 1.00 10.00 N ATOM 753 CA LEU A 65 -4.520 -1.751 -9.507 1.00 10.00 C ATOM 754 C LEU A 65 -5.178 -1.199 -8.248 1.00 10.00 C ATOM 755 O LEU A 65 -5.363 -1.914 -7.258 1.00 10.00 O ATOM 756 CB LEU A 65 -5.383 -2.863 -10.108 1.00 10.00 C ATOM 757 CG LEU A 65 -4.954 -3.350 -11.493 1.00 10.00 C ATOM 758 CD1 LEU A 65 -5.835 -4.507 -11.935 1.00 10.00 C ATOM 759 CD2 LEU A 65 -5.019 -2.211 -12.501 1.00 10.00 C ATOM 0 H LEU A 65 -3.157 -3.059 -8.609 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.433 -0.941 -10.231 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.378 -3.713 -9.425 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.412 -2.509 -10.169 1.00 10.00 H new ATOM 0 HG LEU A 65 -3.923 -3.699 -11.439 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -5.522 -4.847 -12.922 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -5.743 -5.327 -11.223 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -6.873 -4.178 -11.977 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -4.711 -2.575 -13.481 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -6.040 -1.834 -12.559 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -4.353 -1.408 -12.186 1.00 10.00 H new ATOM 771 N PHE A 66 -5.525 0.074 -8.300 1.00 10.00 N ATOM 772 CA PHE A 66 -6.170 0.756 -7.197 1.00 10.00 C ATOM 773 C PHE A 66 -7.436 1.423 -7.714 1.00 10.00 C ATOM 774 O PHE A 66 -7.367 2.331 -8.545 1.00 10.00 O ATOM 775 CB PHE A 66 -5.217 1.791 -6.599 1.00 10.00 C ATOM 776 CG PHE A 66 -5.632 2.309 -5.253 1.00 10.00 C ATOM 777 CD1 PHE A 66 -5.424 1.554 -4.110 1.00 10.00 C ATOM 778 CD2 PHE A 66 -6.224 3.554 -5.130 1.00 10.00 C ATOM 779 CE1 PHE A 66 -5.793 2.034 -2.869 1.00 10.00 C ATOM 780 CE2 PHE A 66 -6.597 4.039 -3.893 1.00 10.00 C ATOM 781 CZ PHE A 66 -6.382 3.278 -2.761 1.00 10.00 C ATOM 0 H PHE A 66 -5.365 0.666 -9.115 1.00 10.00 H new ATOM 0 HA PHE A 66 -6.431 0.045 -6.413 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -4.225 1.348 -6.514 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -5.133 2.631 -7.288 1.00 10.00 H new ATOM 0 HD1 PHE A 66 -4.968 0.578 -4.191 1.00 10.00 H new ATOM 0 HD2 PHE A 66 -6.396 4.153 -6.012 1.00 10.00 H new ATOM 0 HE1 PHE A 66 -5.621 1.438 -1.985 1.00 10.00 H new ATOM 0 HE2 PHE A 66 -7.057 5.013 -3.810 1.00 10.00 H new ATOM 0 HZ PHE A 66 -6.674 3.656 -1.792 1.00 10.00 H new ATOM 791 N GLU A 67 -8.587 0.930 -7.262 1.00 10.00 N ATOM 792 CA GLU A 67 -9.884 1.458 -7.686 1.00 10.00 C ATOM 793 C GLU A 67 -10.103 1.191 -9.172 1.00 10.00 C ATOM 794 O GLU A 67 -10.842 1.910 -9.845 1.00 10.00 O ATOM 795 CB GLU A 67 -9.996 2.959 -7.390 1.00 10.00 C ATOM 796 CG GLU A 67 -10.458 3.272 -5.978 1.00 10.00 C ATOM 797 CD GLU A 67 -11.850 2.746 -5.703 1.00 10.00 C ATOM 798 OE1 GLU A 67 -11.978 1.700 -5.036 1.00 10.00 O ATOM 799 OE2 GLU A 67 -12.828 3.371 -6.164 1.00 10.00 O ATOM 0 H GLU A 67 -8.649 0.159 -6.597 1.00 10.00 H new ATOM 0 HA GLU A 67 -10.660 0.945 -7.117 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -9.025 3.426 -7.557 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -10.692 3.409 -8.098 1.00 10.00 H new ATOM 0 HG2 GLU A 67 -9.759 2.837 -5.264 1.00 10.00 H new ATOM 0 HG3 GLU A 67 -10.442 4.351 -5.823 1.00 10.00 H new ATOM 806 N GLY A 68 -9.445 0.152 -9.675 1.00 10.00 N ATOM 807 CA GLY A 68 -9.566 -0.209 -11.074 1.00 10.00 C ATOM 808 C GLY A 68 -8.521 0.461 -11.945 1.00 10.00 C ATOM 809 O GLY A 68 -8.299 0.051 -13.084 1.00 10.00 O ATOM 0 H GLY A 68 -8.825 -0.450 -9.133 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -9.477 -1.291 -11.175 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -10.559 0.064 -11.431 1.00 10.00 H new ATOM 813 N GLN A 69 -7.864 1.478 -11.407 1.00 10.00 N ATOM 814 CA GLN A 69 -6.851 2.213 -12.148 1.00 10.00 C ATOM 815 C GLN A 69 -5.458 1.731 -11.781 1.00 10.00 C ATOM 816 O GLN A 69 -5.215 1.310 -10.651 1.00 10.00 O ATOM 817 CB GLN A 69 -6.984 3.707 -11.865 1.00 10.00 C ATOM 818 CG GLN A 69 -8.302 4.288 -12.344 1.00 10.00 C ATOM 819 CD GLN A 69 -8.146 5.121 -13.596 1.00 10.00 C ATOM 820 OE1 GLN A 69 -7.173 5.858 -13.748 1.00 10.00 O ATOM 821 NE2 GLN A 69 -9.091 4.996 -14.509 1.00 10.00 N ATOM 0 H GLN A 69 -8.016 1.814 -10.456 1.00 10.00 H new ATOM 0 HA GLN A 69 -7.003 2.035 -13.213 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -6.887 3.878 -10.793 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -6.163 4.237 -12.348 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -9.004 3.477 -12.536 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -8.733 4.903 -11.554 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -9.882 4.373 -14.343 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -9.031 5.522 -15.381 1.00 10.00 H new ATOM 830 N ARG A 70 -4.542 1.782 -12.738 1.00 10.00 N ATOM 831 CA ARG A 70 -3.176 1.353 -12.492 1.00 10.00 C ATOM 832 C ARG A 70 -2.357 2.493 -11.891 1.00 10.00 C ATOM 833 O ARG A 70 -2.395 3.623 -12.375 1.00 10.00 O ATOM 834 CB ARG A 70 -2.517 0.824 -13.775 1.00 10.00 C ATOM 835 CG ARG A 70 -2.462 1.827 -14.919 1.00 10.00 C ATOM 836 CD ARG A 70 -1.802 1.227 -16.152 1.00 10.00 C ATOM 837 NE ARG A 70 -0.397 0.883 -15.916 1.00 10.00 N ATOM 838 CZ ARG A 70 0.191 -0.232 -16.359 1.00 10.00 C ATOM 839 NH1 ARG A 70 -0.488 -1.108 -17.089 1.00 10.00 N ATOM 840 NH2 ARG A 70 1.467 -0.473 -16.078 1.00 10.00 N ATOM 0 H ARG A 70 -4.720 2.114 -13.686 1.00 10.00 H new ATOM 0 HA ARG A 70 -3.205 0.533 -11.774 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -1.502 0.504 -13.541 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -3.061 -0.059 -14.110 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -3.472 2.154 -15.167 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -1.910 2.712 -14.603 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -2.347 0.333 -16.455 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -1.867 1.935 -16.978 1.00 10.00 H new ATOM 0 HE ARG A 70 0.170 1.538 -15.378 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -1.467 -0.933 -17.316 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -0.031 -1.957 -17.423 1.00 10.00 H new ATOM 0 HH21 ARG A 70 2.002 0.194 -15.522 1.00 10.00 H new ATOM 0 HH22 ARG A 70 1.912 -1.325 -16.418 1.00 10.00 H new ATOM 854 N ILE A 71 -1.633 2.186 -10.826 1.00 10.00 N ATOM 855 CA ILE A 71 -0.806 3.175 -10.142 1.00 10.00 C ATOM 856 C ILE A 71 0.412 3.551 -10.980 1.00 10.00 C ATOM 857 O ILE A 71 1.169 2.681 -11.421 1.00 10.00 O ATOM 858 CB ILE A 71 -0.343 2.648 -8.764 1.00 10.00 C ATOM 859 CG1 ILE A 71 -1.548 2.425 -7.844 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.650 3.604 -8.117 1.00 10.00 C ATOM 861 CD1 ILE A 71 -2.361 3.677 -7.584 1.00 10.00 C ATOM 0 H ILE A 71 -1.600 1.254 -10.412 1.00 10.00 H new ATOM 0 HA ILE A 71 -1.418 4.065 -9.996 1.00 10.00 H new ATOM 0 HB ILE A 71 0.160 1.694 -8.920 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -2.196 1.668 -8.287 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -1.197 2.027 -6.892 1.00 10.00 H new ATOM 0 HG21 ILE A 71 0.958 3.208 -7.149 1.00 10.00 H new ATOM 0 HG22 ILE A 71 1.523 3.712 -8.760 1.00 10.00 H new ATOM 0 HG23 ILE A 71 0.180 4.577 -7.978 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -3.196 3.438 -6.925 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -1.729 4.429 -7.112 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -2.743 4.065 -8.528 1.00 10.00 H new ATOM 873 N ALA A 72 0.596 4.849 -11.196 1.00 10.00 N ATOM 874 CA ALA A 72 1.721 5.345 -11.973 1.00 10.00 C ATOM 875 C ALA A 72 2.997 5.342 -11.135 1.00 10.00 C ATOM 876 O ALA A 72 3.010 4.846 -10.009 1.00 10.00 O ATOM 877 CB ALA A 72 1.428 6.744 -12.503 1.00 10.00 C ATOM 0 H ALA A 72 -0.024 5.578 -10.841 1.00 10.00 H new ATOM 0 HA ALA A 72 1.871 4.680 -12.824 1.00 10.00 H new ATOM 0 HB1 ALA A 72 2.280 7.100 -13.082 1.00 10.00 H new ATOM 0 HB2 ALA A 72 0.544 6.714 -13.140 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.250 7.420 -11.667 1.00 10.00 H new ATOM 883 N ASP A 73 4.068 5.890 -11.682 1.00 10.00 N ATOM 884 CA ASP A 73 5.346 5.935 -10.978 1.00 10.00 C ATOM 885 C ASP A 73 5.495 7.242 -10.219 1.00 10.00 C ATOM 886 O ASP A 73 6.093 7.287 -9.144 1.00 10.00 O ATOM 887 CB ASP A 73 6.509 5.767 -11.958 1.00 10.00 C ATOM 888 CG ASP A 73 6.719 4.324 -12.371 1.00 10.00 C ATOM 889 OD1 ASP A 73 5.718 3.623 -12.630 1.00 10.00 O ATOM 890 OD2 ASP A 73 7.886 3.890 -12.445 1.00 10.00 O ATOM 0 H ASP A 73 4.082 6.311 -12.611 1.00 10.00 H new ATOM 0 HA ASP A 73 5.366 5.111 -10.265 1.00 10.00 H new ATOM 0 HB2 ASP A 73 6.322 6.372 -12.845 1.00 10.00 H new ATOM 0 HB3 ASP A 73 7.423 6.147 -11.501 1.00 10.00 H new ATOM 895 N ASN A 74 4.937 8.301 -10.782 1.00 10.00 N ATOM 896 CA ASN A 74 5.004 9.622 -10.166 1.00 10.00 C ATOM 897 C ASN A 74 3.812 9.849 -9.241 1.00 10.00 C ATOM 898 O ASN A 74 3.635 10.937 -8.692 1.00 10.00 O ATOM 899 CB ASN A 74 5.057 10.716 -11.239 1.00 10.00 C ATOM 900 CG ASN A 74 3.721 10.940 -11.923 1.00 10.00 C ATOM 901 OD1 ASN A 74 3.319 10.168 -12.793 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.035 12.009 -11.549 1.00 10.00 N ATOM 0 H ASN A 74 4.431 8.274 -11.667 1.00 10.00 H new ATOM 0 HA ASN A 74 5.917 9.672 -9.572 1.00 10.00 H new ATOM 0 HB2 ASN A 74 5.386 11.649 -10.783 1.00 10.00 H new ATOM 0 HB3 ASN A 74 5.802 10.447 -11.988 1.00 10.00 H new ATOM 0 HD21 ASN A 74 2.137 12.218 -11.986 1.00 10.00 H new ATOM 0 HD22 ASN A 74 3.404 12.624 -10.824 1.00 10.00 H new ATOM 909 N HIS A 75 2.997 8.814 -9.071 1.00 10.00 N ATOM 910 CA HIS A 75 1.823 8.897 -8.213 1.00 10.00 C ATOM 911 C HIS A 75 2.230 8.896 -6.744 1.00 10.00 C ATOM 912 O HIS A 75 3.228 8.275 -6.360 1.00 10.00 O ATOM 913 CB HIS A 75 0.864 7.735 -8.489 1.00 10.00 C ATOM 914 CG HIS A 75 -0.251 8.074 -9.435 1.00 10.00 C ATOM 915 ND1 HIS A 75 -0.936 7.092 -10.112 1.00 10.00 N ATOM 916 CD2 HIS A 75 -0.763 9.284 -9.774 1.00 10.00 C ATOM 917 CE1 HIS A 75 -1.842 7.723 -10.843 1.00 10.00 C ATOM 918 NE2 HIS A 75 -1.773 9.048 -10.669 1.00 10.00 N ATOM 0 H HIS A 75 3.129 7.906 -9.517 1.00 10.00 H new ATOM 0 HA HIS A 75 1.311 9.833 -8.436 1.00 10.00 H new ATOM 0 HB2 HIS A 75 1.431 6.899 -8.897 1.00 10.00 H new ATOM 0 HB3 HIS A 75 0.436 7.399 -7.545 1.00 10.00 H new ATOM 0 HD2 HIS A 75 -0.437 10.247 -9.409 1.00 10.00 H new ATOM 0 HE1 HIS A 75 -2.547 7.231 -11.497 1.00 10.00 H new ATOM 0 HE2 HIS A 75 -2.361 9.750 -11.118 1.00 10.00 H new ATOM 926 N THR A 76 1.462 9.601 -5.932 1.00 10.00 N ATOM 927 CA THR A 76 1.721 9.683 -4.505 1.00 10.00 C ATOM 928 C THR A 76 0.476 9.256 -3.725 1.00 10.00 C ATOM 929 O THR A 76 -0.639 9.421 -4.214 1.00 10.00 O ATOM 930 CB THR A 76 2.127 11.116 -4.098 1.00 10.00 C ATOM 931 OG1 THR A 76 1.969 12.017 -5.206 1.00 10.00 O ATOM 932 CG2 THR A 76 3.571 11.156 -3.622 1.00 10.00 C ATOM 0 H THR A 76 0.646 10.130 -6.240 1.00 10.00 H new ATOM 0 HA THR A 76 2.547 9.012 -4.268 1.00 10.00 H new ATOM 0 HB THR A 76 1.475 11.427 -3.282 1.00 10.00 H new ATOM 0 HG1 THR A 76 1.049 11.968 -5.539 1.00 10.00 H new ATOM 0 HG21 THR A 76 3.833 12.176 -3.341 1.00 10.00 H new ATOM 0 HG22 THR A 76 3.688 10.500 -2.759 1.00 10.00 H new ATOM 0 HG23 THR A 76 4.228 10.820 -4.424 1.00 10.00 H new ATOM 940 N PRO A 77 0.637 8.703 -2.505 1.00 10.00 N ATOM 941 CA PRO A 77 -0.501 8.260 -1.679 1.00 10.00 C ATOM 942 C PRO A 77 -1.426 9.416 -1.292 1.00 10.00 C ATOM 943 O PRO A 77 -2.558 9.204 -0.853 1.00 10.00 O ATOM 944 CB PRO A 77 0.161 7.663 -0.428 1.00 10.00 C ATOM 945 CG PRO A 77 1.576 7.407 -0.814 1.00 10.00 C ATOM 946 CD PRO A 77 1.925 8.446 -1.838 1.00 10.00 C ATOM 0 HA PRO A 77 -1.134 7.554 -2.216 1.00 10.00 H new ATOM 0 HB2 PRO A 77 0.102 8.352 0.415 1.00 10.00 H new ATOM 0 HB3 PRO A 77 -0.336 6.742 -0.122 1.00 10.00 H new ATOM 0 HG2 PRO A 77 2.234 7.477 0.052 1.00 10.00 H new ATOM 0 HG3 PRO A 77 1.693 6.403 -1.223 1.00 10.00 H new ATOM 0 HD2 PRO A 77 2.327 9.348 -1.376 1.00 10.00 H new ATOM 0 HD3 PRO A 77 2.677 8.084 -2.539 1.00 10.00 H new ATOM 954 N LYS A 78 -0.924 10.638 -1.453 1.00 10.00 N ATOM 955 CA LYS A 78 -1.687 11.838 -1.138 1.00 10.00 C ATOM 956 C LYS A 78 -2.890 11.958 -2.066 1.00 10.00 C ATOM 957 O LYS A 78 -3.998 12.292 -1.636 1.00 10.00 O ATOM 958 CB LYS A 78 -0.791 13.076 -1.273 1.00 10.00 C ATOM 959 CG LYS A 78 -1.504 14.393 -1.007 1.00 10.00 C ATOM 960 CD LYS A 78 -1.835 14.572 0.466 1.00 10.00 C ATOM 961 CE LYS A 78 -0.580 14.754 1.307 1.00 10.00 C ATOM 962 NZ LYS A 78 -0.886 15.302 2.654 1.00 10.00 N ATOM 0 H LYS A 78 0.016 10.821 -1.803 1.00 10.00 H new ATOM 0 HA LYS A 78 -2.045 11.768 -0.111 1.00 10.00 H new ATOM 0 HB2 LYS A 78 0.046 12.982 -0.581 1.00 10.00 H new ATOM 0 HB3 LYS A 78 -0.372 13.099 -2.279 1.00 10.00 H new ATOM 0 HG2 LYS A 78 -0.876 15.219 -1.341 1.00 10.00 H new ATOM 0 HG3 LYS A 78 -2.422 14.433 -1.593 1.00 10.00 H new ATOM 0 HD2 LYS A 78 -2.485 15.438 0.590 1.00 10.00 H new ATOM 0 HD3 LYS A 78 -2.389 13.704 0.823 1.00 10.00 H new ATOM 0 HE2 LYS A 78 -0.072 13.795 1.413 1.00 10.00 H new ATOM 0 HE3 LYS A 78 0.108 15.424 0.791 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 -0.003 15.410 3.193 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 -1.347 16.229 2.555 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 -1.522 14.651 3.157 1.00 10.00 H new ATOM 976 N GLU A 79 -2.668 11.666 -3.338 1.00 10.00 N ATOM 977 CA GLU A 79 -3.725 11.733 -4.327 1.00 10.00 C ATOM 978 C GLU A 79 -4.440 10.391 -4.402 1.00 10.00 C ATOM 979 O GLU A 79 -4.002 9.422 -3.777 1.00 10.00 O ATOM 980 CB GLU A 79 -3.158 12.126 -5.694 1.00 10.00 C ATOM 981 CG GLU A 79 -2.144 11.144 -6.251 1.00 10.00 C ATOM 982 CD GLU A 79 -1.194 11.792 -7.232 1.00 10.00 C ATOM 983 OE1 GLU A 79 -1.667 12.380 -8.225 1.00 10.00 O ATOM 984 OE2 GLU A 79 0.035 11.717 -7.010 1.00 10.00 O ATOM 0 H GLU A 79 -1.761 11.380 -3.708 1.00 10.00 H new ATOM 0 HA GLU A 79 -4.443 12.498 -4.031 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -3.981 12.223 -6.402 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -2.690 13.107 -5.613 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -1.574 10.710 -5.430 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -2.668 10.325 -6.744 1.00 10.00 H new ATOM 991 N LEU A 80 -5.546 10.353 -5.145 1.00 10.00 N ATOM 992 CA LEU A 80 -6.355 9.139 -5.320 1.00 10.00 C ATOM 993 C LEU A 80 -7.144 8.815 -4.052 1.00 10.00 C ATOM 994 O LEU A 80 -8.351 8.576 -4.105 1.00 10.00 O ATOM 995 CB LEU A 80 -5.487 7.941 -5.729 1.00 10.00 C ATOM 996 CG LEU A 80 -4.667 8.141 -7.002 1.00 10.00 C ATOM 997 CD1 LEU A 80 -3.517 7.154 -7.055 1.00 10.00 C ATOM 998 CD2 LEU A 80 -5.542 7.996 -8.233 1.00 10.00 C ATOM 0 H LEU A 80 -5.910 11.164 -5.645 1.00 10.00 H new ATOM 0 HA LEU A 80 -7.063 9.335 -6.125 1.00 10.00 H new ATOM 0 HB2 LEU A 80 -4.807 7.708 -4.910 1.00 10.00 H new ATOM 0 HB3 LEU A 80 -6.133 7.073 -5.864 1.00 10.00 H new ATOM 0 HG LEU A 80 -4.258 9.151 -6.987 1.00 10.00 H new ATOM 0 HD11 LEU A 80 -2.944 7.312 -7.969 1.00 10.00 H new ATOM 0 HD12 LEU A 80 -2.870 7.303 -6.191 1.00 10.00 H new ATOM 0 HD13 LEU A 80 -3.909 6.137 -7.044 1.00 10.00 H new ATOM 0 HD21 LEU A 80 -4.938 8.142 -9.128 1.00 10.00 H new ATOM 0 HD22 LEU A 80 -5.982 6.999 -8.251 1.00 10.00 H new ATOM 0 HD23 LEU A 80 -6.336 8.742 -8.205 1.00 10.00 H new ATOM 1010 N GLY A 81 -6.461 8.808 -2.917 1.00 10.00 N ATOM 1011 CA GLY A 81 -7.110 8.522 -1.656 1.00 10.00 C ATOM 1012 C GLY A 81 -6.671 7.198 -1.073 1.00 10.00 C ATOM 1013 O GLY A 81 -7.401 6.210 -1.149 1.00 10.00 O ATOM 0 H GLY A 81 -5.461 8.997 -2.848 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -6.889 9.320 -0.947 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -8.190 8.513 -1.800 1.00 10.00 H new ATOM 1017 N MET A 82 -5.475 7.175 -0.500 1.00 10.00 N ATOM 1018 CA MET A 82 -4.935 5.962 0.105 1.00 10.00 C ATOM 1019 C MET A 82 -4.970 6.066 1.623 1.00 10.00 C ATOM 1020 O MET A 82 -4.457 7.026 2.200 1.00 10.00 O ATOM 1021 CB MET A 82 -3.501 5.715 -0.366 1.00 10.00 C ATOM 1022 CG MET A 82 -3.417 5.064 -1.734 1.00 10.00 C ATOM 1023 SD MET A 82 -1.722 4.707 -2.234 1.00 10.00 S ATOM 1024 CE MET A 82 -2.013 3.770 -3.730 1.00 10.00 C ATOM 0 H MET A 82 -4.858 7.985 -0.441 1.00 10.00 H new ATOM 0 HA MET A 82 -5.555 5.122 -0.208 1.00 10.00 H new ATOM 0 HB2 MET A 82 -2.967 6.665 -0.391 1.00 10.00 H new ATOM 0 HB3 MET A 82 -2.992 5.082 0.361 1.00 10.00 H new ATOM 0 HG2 MET A 82 -3.992 4.138 -1.727 1.00 10.00 H new ATOM 0 HG3 MET A 82 -3.879 5.720 -2.472 1.00 10.00 H new ATOM 0 HE1 MET A 82 -1.059 3.472 -4.164 1.00 10.00 H new ATOM 0 HE2 MET A 82 -2.597 2.881 -3.494 1.00 10.00 H new ATOM 0 HE3 MET A 82 -2.561 4.385 -4.444 1.00 10.00 H new ATOM 1034 N GLU A 83 -5.587 5.084 2.263 1.00 10.00 N ATOM 1035 CA GLU A 83 -5.692 5.070 3.713 1.00 10.00 C ATOM 1036 C GLU A 83 -5.132 3.776 4.295 1.00 10.00 C ATOM 1037 O GLU A 83 -4.684 2.893 3.564 1.00 10.00 O ATOM 1038 CB GLU A 83 -7.148 5.243 4.141 1.00 10.00 C ATOM 1039 CG GLU A 83 -7.448 6.601 4.752 1.00 10.00 C ATOM 1040 CD GLU A 83 -6.655 6.861 6.018 1.00 10.00 C ATOM 1041 OE1 GLU A 83 -6.360 5.894 6.753 1.00 10.00 O ATOM 1042 OE2 GLU A 83 -6.334 8.036 6.293 1.00 10.00 O ATOM 0 H GLU A 83 -6.023 4.286 1.800 1.00 10.00 H new ATOM 0 HA GLU A 83 -5.103 5.902 4.098 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -7.792 5.094 3.274 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -7.400 4.466 4.863 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -7.226 7.380 4.023 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -8.513 6.667 4.975 1.00 10.00 H new ATOM 1049 N GLU A 84 -5.157 3.681 5.614 1.00 10.00 N ATOM 1050 CA GLU A 84 -4.664 2.507 6.321 1.00 10.00 C ATOM 1051 C GLU A 84 -5.561 1.304 6.048 1.00 10.00 C ATOM 1052 O GLU A 84 -6.787 1.439 6.012 1.00 10.00 O ATOM 1053 CB GLU A 84 -4.610 2.806 7.819 1.00 10.00 C ATOM 1054 CG GLU A 84 -4.224 1.620 8.687 1.00 10.00 C ATOM 1055 CD GLU A 84 -2.817 1.133 8.427 1.00 10.00 C ATOM 1056 OE1 GLU A 84 -1.881 1.960 8.461 1.00 10.00 O ATOM 1057 OE2 GLU A 84 -2.642 -0.081 8.198 1.00 10.00 O ATOM 0 H GLU A 84 -5.519 4.413 6.225 1.00 10.00 H new ATOM 0 HA GLU A 84 -3.662 2.267 5.966 1.00 10.00 H new ATOM 0 HB2 GLU A 84 -3.896 3.612 7.990 1.00 10.00 H new ATOM 0 HB3 GLU A 84 -5.586 3.171 8.139 1.00 10.00 H new ATOM 0 HG2 GLU A 84 -4.318 1.899 9.737 1.00 10.00 H new ATOM 0 HG3 GLU A 84 -4.924 0.804 8.510 1.00 10.00 H new ATOM 1064 N GLU A 85 -4.939 0.140 5.843 1.00 10.00 N ATOM 1065 CA GLU A 85 -5.661 -1.104 5.575 1.00 10.00 C ATOM 1066 C GLU A 85 -6.423 -1.033 4.255 1.00 10.00 C ATOM 1067 O GLU A 85 -7.424 -1.731 4.065 1.00 10.00 O ATOM 1068 CB GLU A 85 -6.621 -1.434 6.724 1.00 10.00 C ATOM 1069 CG GLU A 85 -5.997 -2.290 7.810 1.00 10.00 C ATOM 1070 CD GLU A 85 -5.731 -3.708 7.348 1.00 10.00 C ATOM 1071 OE1 GLU A 85 -4.559 -4.132 7.368 1.00 10.00 O ATOM 1072 OE2 GLU A 85 -6.695 -4.401 6.958 1.00 10.00 O ATOM 0 H GLU A 85 -3.925 0.035 5.858 1.00 10.00 H new ATOM 0 HA GLU A 85 -4.922 -1.901 5.496 1.00 10.00 H new ATOM 0 HB2 GLU A 85 -6.978 -0.504 7.166 1.00 10.00 H new ATOM 0 HB3 GLU A 85 -7.492 -1.951 6.321 1.00 10.00 H new ATOM 0 HG2 GLU A 85 -5.061 -1.835 8.134 1.00 10.00 H new ATOM 0 HG3 GLU A 85 -6.658 -2.311 8.676 1.00 10.00 H new ATOM 1079 N ASP A 86 -5.940 -0.203 3.339 1.00 10.00 N ATOM 1080 CA ASP A 86 -6.581 -0.052 2.041 1.00 10.00 C ATOM 1081 C ASP A 86 -6.366 -1.299 1.194 1.00 10.00 C ATOM 1082 O ASP A 86 -5.400 -2.040 1.396 1.00 10.00 O ATOM 1083 CB ASP A 86 -6.039 1.172 1.308 1.00 10.00 C ATOM 1084 CG ASP A 86 -7.140 2.007 0.690 1.00 10.00 C ATOM 1085 OD1 ASP A 86 -8.090 1.428 0.118 1.00 10.00 O ATOM 1086 OD2 ASP A 86 -7.062 3.248 0.775 1.00 10.00 O ATOM 0 H ASP A 86 -5.109 0.374 3.471 1.00 10.00 H new ATOM 0 HA ASP A 86 -7.650 0.086 2.206 1.00 10.00 H new ATOM 0 HB2 ASP A 86 -5.468 1.786 2.004 1.00 10.00 H new ATOM 0 HB3 ASP A 86 -5.349 0.850 0.528 1.00 10.00 H new ATOM 1091 N VAL A 87 -7.262 -1.520 0.246 1.00 10.00 N ATOM 1092 CA VAL A 87 -7.185 -2.685 -0.620 1.00 10.00 C ATOM 1093 C VAL A 87 -6.560 -2.330 -1.965 1.00 10.00 C ATOM 1094 O VAL A 87 -7.062 -1.472 -2.694 1.00 10.00 O ATOM 1095 CB VAL A 87 -8.578 -3.308 -0.853 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -8.477 -4.554 -1.724 1.00 10.00 C ATOM 1097 CG2 VAL A 87 -9.244 -3.636 0.472 1.00 10.00 C ATOM 0 H VAL A 87 -8.054 -0.906 0.056 1.00 10.00 H new ATOM 0 HA VAL A 87 -6.553 -3.415 -0.114 1.00 10.00 H new ATOM 0 HB VAL A 87 -9.193 -2.577 -1.377 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -9.471 -4.975 -1.874 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -8.046 -4.289 -2.689 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -7.842 -5.291 -1.233 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -10.225 -4.074 0.288 1.00 10.00 H new ATOM 0 HG22 VAL A 87 -8.627 -4.346 1.023 1.00 10.00 H new ATOM 0 HG23 VAL A 87 -9.359 -2.724 1.057 1.00 10.00 H new ATOM 1107 N ILE A 88 -5.460 -2.992 -2.279 1.00 10.00 N ATOM 1108 CA ILE A 88 -4.759 -2.779 -3.531 1.00 10.00 C ATOM 1109 C ILE A 88 -4.356 -4.127 -4.116 1.00 10.00 C ATOM 1110 O ILE A 88 -3.907 -5.014 -3.390 1.00 10.00 O ATOM 1111 CB ILE A 88 -3.520 -1.869 -3.341 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -2.727 -1.746 -4.648 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -2.632 -2.387 -2.218 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -1.611 -0.726 -4.588 1.00 10.00 C ATOM 0 H ILE A 88 -5.029 -3.691 -1.674 1.00 10.00 H new ATOM 0 HA ILE A 88 -5.428 -2.268 -4.224 1.00 10.00 H new ATOM 0 HB ILE A 88 -3.872 -0.876 -3.063 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.305 -2.719 -4.900 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -3.410 -1.477 -5.453 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -1.769 -1.731 -2.104 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -3.198 -2.407 -1.287 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.293 -3.395 -2.458 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.095 -0.695 -5.548 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -2.028 0.257 -4.368 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.905 -1.004 -3.805 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.543 -4.294 -5.416 1.00 10.00 N ATOM 1127 CA GLU A 89 -4.207 -5.547 -6.074 1.00 10.00 C ATOM 1128 C GLU A 89 -3.044 -5.364 -7.039 1.00 10.00 C ATOM 1129 O GLU A 89 -2.752 -4.248 -7.470 1.00 10.00 O ATOM 1130 CB GLU A 89 -5.425 -6.099 -6.817 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.502 -6.628 -5.887 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.751 -7.070 -6.619 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -7.637 -7.560 -7.761 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -8.852 -6.952 -6.048 1.00 10.00 O ATOM 0 H GLU A 89 -4.925 -3.579 -6.035 1.00 10.00 H new ATOM 0 HA GLU A 89 -3.905 -6.260 -5.307 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.848 -5.313 -7.443 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -5.104 -6.899 -7.484 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.103 -7.469 -5.320 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -6.765 -5.853 -5.167 1.00 10.00 H new ATOM 1141 N VAL A 90 -2.381 -6.463 -7.365 1.00 10.00 N ATOM 1142 CA VAL A 90 -1.251 -6.437 -8.278 1.00 10.00 C ATOM 1143 C VAL A 90 -1.262 -7.673 -9.175 1.00 10.00 C ATOM 1144 O VAL A 90 -1.429 -8.800 -8.703 1.00 10.00 O ATOM 1145 CB VAL A 90 0.089 -6.340 -7.508 1.00 10.00 C ATOM 1146 CG1 VAL A 90 0.230 -7.478 -6.508 1.00 10.00 C ATOM 1147 CG2 VAL A 90 1.269 -6.314 -8.466 1.00 10.00 C ATOM 0 H VAL A 90 -2.609 -7.390 -7.007 1.00 10.00 H new ATOM 0 HA VAL A 90 -1.344 -5.549 -8.903 1.00 10.00 H new ATOM 0 HB VAL A 90 0.085 -5.402 -6.952 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.180 -7.384 -5.982 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -0.588 -7.434 -5.789 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.200 -8.432 -7.035 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.197 -6.246 -7.898 1.00 10.00 H new ATOM 0 HG22 VAL A 90 1.274 -7.227 -9.062 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.183 -5.451 -9.126 1.00 10.00 H new ATOM 1157 N TYR A 91 -1.110 -7.456 -10.473 1.00 10.00 N ATOM 1158 CA TYR A 91 -1.110 -8.552 -11.436 1.00 10.00 C ATOM 1159 C TYR A 91 0.080 -8.432 -12.376 1.00 10.00 C ATOM 1160 O TYR A 91 0.647 -7.353 -12.527 1.00 10.00 O ATOM 1161 CB TYR A 91 -2.415 -8.564 -12.238 1.00 10.00 C ATOM 1162 CG TYR A 91 -3.631 -8.880 -11.401 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -4.035 -10.192 -11.197 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -4.369 -7.866 -10.804 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -5.140 -10.485 -10.422 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -5.475 -8.150 -10.029 1.00 10.00 C ATOM 1167 CZ TYR A 91 -5.856 -9.459 -9.840 1.00 10.00 C ATOM 1168 OH TYR A 91 -6.954 -9.745 -9.059 1.00 10.00 O ATOM 0 H TYR A 91 -0.985 -6.532 -10.886 1.00 10.00 H new ATOM 0 HA TYR A 91 -1.031 -9.490 -10.887 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -2.551 -7.591 -12.710 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -2.334 -9.299 -13.039 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -3.476 -10.997 -11.652 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -4.072 -6.838 -10.949 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.442 -11.511 -10.272 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -6.039 -7.349 -9.573 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.126 -8.997 -8.450 1.00 10.00 H new ATOM 1178 N GLN A 92 0.460 -9.539 -12.996 1.00 10.00 N ATOM 1179 CA GLN A 92 1.589 -9.548 -13.919 1.00 10.00 C ATOM 1180 C GLN A 92 1.242 -8.818 -15.211 1.00 10.00 C ATOM 1181 O GLN A 92 0.143 -8.971 -15.747 1.00 10.00 O ATOM 1182 CB GLN A 92 2.009 -10.984 -14.229 1.00 10.00 C ATOM 1183 CG GLN A 92 3.351 -11.087 -14.936 1.00 10.00 C ATOM 1184 CD GLN A 92 3.415 -12.268 -15.878 1.00 10.00 C ATOM 1185 OE1 GLN A 92 3.769 -13.378 -15.480 1.00 10.00 O ATOM 1186 NE2 GLN A 92 3.074 -12.038 -17.135 1.00 10.00 N ATOM 0 H GLN A 92 0.004 -10.444 -12.878 1.00 10.00 H new ATOM 0 HA GLN A 92 2.420 -9.028 -13.442 1.00 10.00 H new ATOM 0 HB2 GLN A 92 2.054 -11.549 -13.298 1.00 10.00 H new ATOM 0 HB3 GLN A 92 1.244 -11.451 -14.849 1.00 10.00 H new ATOM 0 HG2 GLN A 92 3.536 -10.169 -15.494 1.00 10.00 H new ATOM 0 HG3 GLN A 92 4.144 -11.174 -14.194 1.00 10.00 H new ATOM 0 HE21 GLN A 92 2.787 -11.103 -17.422 1.00 10.00 H new ATOM 0 HE22 GLN A 92 3.098 -12.796 -17.817 1.00 10.00 H new ATOM 1195 N GLU A 93 2.181 -8.024 -15.704 1.00 10.00 N ATOM 1196 CA GLU A 93 1.985 -7.271 -16.932 1.00 10.00 C ATOM 1197 C GLU A 93 2.083 -8.182 -18.148 1.00 10.00 C ATOM 1198 O GLU A 93 2.645 -9.276 -18.072 1.00 10.00 O ATOM 1199 CB GLU A 93 3.018 -6.147 -17.035 1.00 10.00 C ATOM 1200 CG GLU A 93 2.577 -4.855 -16.369 1.00 10.00 C ATOM 1201 CD GLU A 93 1.568 -4.088 -17.203 1.00 10.00 C ATOM 1202 OE1 GLU A 93 0.622 -4.714 -17.733 1.00 10.00 O ATOM 1203 OE2 GLU A 93 1.713 -2.857 -17.330 1.00 10.00 O ATOM 0 H GLU A 93 3.092 -7.885 -15.268 1.00 10.00 H new ATOM 0 HA GLU A 93 0.986 -6.835 -16.908 1.00 10.00 H new ATOM 0 HB2 GLU A 93 3.952 -6.480 -16.581 1.00 10.00 H new ATOM 0 HB3 GLU A 93 3.227 -5.951 -18.087 1.00 10.00 H new ATOM 0 HG2 GLU A 93 2.142 -5.082 -15.396 1.00 10.00 H new ATOM 0 HG3 GLU A 93 3.449 -4.226 -16.190 1.00 10.00 H new ATOM 1210 N GLN A 94 1.544 -7.717 -19.268 1.00 10.00 N ATOM 1211 CA GLN A 94 1.566 -8.481 -20.509 1.00 10.00 C ATOM 1212 C GLN A 94 3.000 -8.660 -20.995 1.00 10.00 C ATOM 1213 O GLN A 94 3.396 -9.746 -21.422 1.00 10.00 O ATOM 1214 CB GLN A 94 0.742 -7.769 -21.584 1.00 10.00 C ATOM 1215 CG GLN A 94 0.444 -8.633 -22.797 1.00 10.00 C ATOM 1216 CD GLN A 94 -0.801 -9.479 -22.614 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -1.747 -9.077 -21.935 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -0.806 -10.660 -23.212 1.00 10.00 N ATOM 0 H GLN A 94 1.084 -6.810 -19.342 1.00 10.00 H new ATOM 0 HA GLN A 94 1.131 -9.462 -20.318 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -0.199 -7.436 -21.146 1.00 10.00 H new ATOM 0 HB3 GLN A 94 1.277 -6.876 -21.908 1.00 10.00 H new ATOM 0 HG2 GLN A 94 0.321 -7.995 -23.672 1.00 10.00 H new ATOM 0 HG3 GLN A 94 1.296 -9.284 -22.994 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -0.002 -10.955 -23.766 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -1.614 -11.275 -23.119 1.00 10.00 H new ATOM 1227 N THR A 95 3.773 -7.585 -20.907 1.00 10.00 N ATOM 1228 CA THR A 95 5.164 -7.584 -21.334 1.00 10.00 C ATOM 1229 C THR A 95 5.999 -8.574 -20.524 1.00 10.00 C ATOM 1230 O THR A 95 6.850 -9.277 -21.070 1.00 10.00 O ATOM 1231 CB THR A 95 5.755 -6.176 -21.179 1.00 10.00 C ATOM 1232 OG1 THR A 95 4.689 -5.235 -20.991 1.00 10.00 O ATOM 1233 CG2 THR A 95 6.572 -5.788 -22.397 1.00 10.00 C ATOM 0 H THR A 95 3.452 -6.690 -20.538 1.00 10.00 H new ATOM 0 HA THR A 95 5.191 -7.888 -22.380 1.00 10.00 H new ATOM 0 HB THR A 95 6.416 -6.170 -20.313 1.00 10.00 H new ATOM 0 HG1 THR A 95 5.062 -4.334 -20.890 1.00 10.00 H new ATOM 0 HG21 THR A 95 6.978 -4.786 -22.259 1.00 10.00 H new ATOM 0 HG22 THR A 95 7.390 -6.496 -22.527 1.00 10.00 H new ATOM 0 HG23 THR A 95 5.936 -5.803 -23.282 1.00 10.00 H new ATOM 1241 N GLY A 96 5.745 -8.628 -19.223 1.00 10.00 N ATOM 1242 CA GLY A 96 6.479 -9.534 -18.359 1.00 10.00 C ATOM 1243 C GLY A 96 7.591 -8.838 -17.602 1.00 10.00 C ATOM 1244 O GLY A 96 8.112 -9.372 -16.622 1.00 10.00 O ATOM 0 H GLY A 96 5.043 -8.060 -18.749 1.00 10.00 H new ATOM 0 HA2 GLY A 96 5.791 -9.991 -17.648 1.00 10.00 H new ATOM 0 HA3 GLY A 96 6.901 -10.341 -18.958 1.00 10.00 H new ATOM 1248 N GLY A 97 7.953 -7.648 -18.057 1.00 10.00 N ATOM 1249 CA GLY A 97 9.005 -6.889 -17.416 1.00 10.00 C ATOM 1250 C GLY A 97 9.893 -6.205 -18.430 1.00 10.00 C ATOM 1251 O GLY A 97 10.479 -5.150 -18.112 1.00 10.00 O ATOM 0 H GLY A 97 7.532 -7.192 -18.866 1.00 10.00 H new ATOM 0 HA2 GLY A 97 8.565 -6.143 -16.754 1.00 10.00 H new ATOM 0 HA3 GLY A 97 9.606 -7.552 -16.794 1.00 10.00 H new ATOM 1256 N ASN B 357 -5.016 -15.730 6.106 1.00 10.00 N ATOM 1257 CA ASN B 357 -4.267 -15.284 7.311 1.00 10.00 C ATOM 1258 C ASN B 357 -2.756 -15.360 7.071 1.00 10.00 C ATOM 1259 O ASN B 357 -2.017 -15.944 7.862 1.00 10.00 O ATOM 1260 CB ASN B 357 -4.649 -16.149 8.521 1.00 10.00 C ATOM 1261 CG ASN B 357 -4.136 -15.599 9.843 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -4.146 -14.388 10.079 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -3.679 -16.486 10.712 1.00 10.00 N ATOM 0 HA ASN B 357 -4.533 -14.247 7.514 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -5.735 -16.235 8.569 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -4.256 -17.155 8.378 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -3.318 -16.177 11.614 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -3.688 -17.479 10.479 1.00 10.00 H new ATOM 1270 N ASN B 358 -2.301 -14.786 5.968 1.00 10.00 N ATOM 1271 CA ASN B 358 -0.874 -14.778 5.649 1.00 10.00 C ATOM 1272 C ASN B 358 -0.421 -13.337 5.532 1.00 10.00 C ATOM 1273 O ASN B 358 -0.934 -12.594 4.709 1.00 10.00 O ATOM 1274 CB ASN B 358 -0.635 -15.522 4.328 1.00 10.00 C ATOM 1275 CG ASN B 358 0.831 -15.692 3.977 1.00 10.00 C ATOM 1276 OD1 ASN B 358 1.706 -15.639 4.844 1.00 10.00 O ATOM 1277 ND2 ASN B 358 1.108 -15.910 2.697 1.00 10.00 N ATOM 0 H ASN B 358 -2.892 -14.321 5.279 1.00 10.00 H new ATOM 0 HA ASN B 358 -0.307 -15.280 6.433 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -1.101 -16.505 4.386 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -1.131 -14.981 3.522 1.00 10.00 H new ATOM 0 HD21 ASN B 358 2.075 -16.041 2.400 1.00 10.00 H new ATOM 0 HD22 ASN B 358 0.354 -15.946 2.011 1.00 10.00 H new ATOM 1284 N ARG B 359 0.542 -12.942 6.336 1.00 10.00 N ATOM 1285 CA ARG B 359 1.020 -11.573 6.300 1.00 10.00 C ATOM 1286 C ARG B 359 2.530 -11.489 6.139 1.00 10.00 C ATOM 1287 O ARG B 359 3.285 -12.155 6.853 1.00 10.00 O ATOM 1288 CB ARG B 359 0.579 -10.805 7.550 1.00 10.00 C ATOM 1289 CG ARG B 359 0.939 -11.491 8.853 1.00 10.00 C ATOM 1290 CD ARG B 359 0.738 -10.565 10.038 1.00 10.00 C ATOM 1291 NE ARG B 359 1.225 -11.154 11.282 1.00 10.00 N ATOM 1292 CZ ARG B 359 0.891 -10.709 12.485 1.00 10.00 C ATOM 1293 NH1 ARG B 359 0.055 -9.688 12.608 1.00 10.00 N ATOM 1294 NH2 ARG B 359 1.397 -11.283 13.570 1.00 10.00 N ATOM 0 H ARG B 359 1.007 -13.541 7.018 1.00 10.00 H new ATOM 0 HA ARG B 359 0.571 -11.110 5.421 1.00 10.00 H new ATOM 0 HB2 ARG B 359 1.034 -9.815 7.535 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.501 -10.661 7.513 1.00 10.00 H new ATOM 0 HG2 ARG B 359 0.326 -12.383 8.978 1.00 10.00 H new ATOM 0 HG3 ARG B 359 1.977 -11.820 8.818 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.257 -9.624 9.855 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -0.322 -10.330 10.139 1.00 10.00 H new ATOM 0 HE ARG B 359 1.857 -11.952 11.222 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -0.333 -9.243 11.776 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -0.201 -9.347 13.535 1.00 10.00 H new ATOM 0 HH21 ARG B 359 2.043 -12.067 13.478 1.00 10.00 H new ATOM 0 HH22 ARG B 359 1.140 -10.940 14.496 1.00 10.00 H new ATOM 1308 N ASP B 360 2.960 -10.684 5.190 1.00 10.00 N ATOM 1309 CA ASP B 360 4.379 -10.430 4.984 1.00 10.00 C ATOM 1310 C ASP B 360 4.558 -8.934 5.170 1.00 10.00 C ATOM 1311 O ASP B 360 3.837 -8.159 4.545 1.00 10.00 O ATOM 1312 CB ASP B 360 4.855 -10.859 3.588 1.00 10.00 C ATOM 1313 CG ASP B 360 6.370 -10.770 3.434 1.00 10.00 C ATOM 1314 OD1 ASP B 360 6.846 -10.190 2.434 1.00 10.00 O ATOM 1315 OD2 ASP B 360 7.098 -11.290 4.308 1.00 10.00 O ATOM 0 H ASP B 360 2.346 -10.189 4.543 1.00 10.00 H new ATOM 0 HA ASP B 360 4.976 -11.010 5.688 1.00 10.00 H new ATOM 0 HB2 ASP B 360 4.533 -11.883 3.397 1.00 10.00 H new ATOM 0 HB3 ASP B 360 4.379 -10.230 2.836 1.00 10.00 H new ATOM 1320 N PRO B 361 5.500 -8.481 6.003 1.00 10.00 N ATOM 1321 CA PRO B 361 5.676 -7.066 6.249 1.00 10.00 C ATOM 1322 C PRO B 361 6.943 -6.489 5.627 1.00 10.00 C ATOM 1323 O PRO B 361 8.053 -6.984 5.820 1.00 10.00 O ATOM 1324 CB PRO B 361 5.795 -7.060 7.784 1.00 10.00 C ATOM 1325 CG PRO B 361 6.290 -8.438 8.163 1.00 10.00 C ATOM 1326 CD PRO B 361 6.349 -9.261 6.893 1.00 10.00 C ATOM 0 HA PRO B 361 4.876 -6.460 5.823 1.00 10.00 H new ATOM 0 HB2 PRO B 361 6.489 -6.289 8.120 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.833 -6.848 8.250 1.00 10.00 H new ATOM 0 HG2 PRO B 361 7.274 -8.378 8.628 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.622 -8.900 8.889 1.00 10.00 H new ATOM 0 HD2 PRO B 361 7.366 -9.355 6.512 1.00 10.00 H new ATOM 0 HD3 PRO B 361 5.969 -10.272 7.041 1.00 10.00 H new ATOM 1334 N ILE B 362 6.736 -5.424 4.862 1.00 10.00 N ATOM 1335 CA ILE B 362 7.813 -4.723 4.180 1.00 10.00 C ATOM 1336 C ILE B 362 7.855 -3.269 4.622 1.00 10.00 C ATOM 1337 O ILE B 362 6.816 -2.608 4.720 1.00 10.00 O ATOM 1338 CB ILE B 362 7.673 -4.771 2.644 1.00 10.00 C ATOM 1339 CG1 ILE B 362 6.953 -6.050 2.210 1.00 10.00 C ATOM 1340 CG2 ILE B 362 9.047 -4.674 1.980 1.00 10.00 C ATOM 1341 CD1 ILE B 362 6.587 -6.070 0.744 1.00 10.00 C ATOM 0 H ILE B 362 5.813 -5.022 4.698 1.00 10.00 H new ATOM 0 HA ILE B 362 8.737 -5.233 4.451 1.00 10.00 H new ATOM 0 HB ILE B 362 7.075 -3.917 2.324 1.00 10.00 H new ATOM 0 HG12 ILE B 362 7.589 -6.907 2.429 1.00 10.00 H new ATOM 0 HG13 ILE B 362 6.046 -6.166 2.804 1.00 10.00 H new ATOM 0 HG21 ILE B 362 8.931 -4.709 0.897 1.00 10.00 H new ATOM 0 HG22 ILE B 362 9.523 -3.735 2.264 1.00 10.00 H new ATOM 0 HG23 ILE B 362 9.668 -5.508 2.306 1.00 10.00 H new ATOM 0 HD11 ILE B 362 6.080 -7.006 0.508 1.00 10.00 H new ATOM 0 HD12 ILE B 362 5.925 -5.233 0.523 1.00 10.00 H new ATOM 0 HD13 ILE B 362 7.492 -5.986 0.142 1.00 10.00 H new ATOM 1353 N VAL B 363 9.046 -2.784 4.912 1.00 10.00 N ATOM 1354 CA VAL B 363 9.230 -1.411 5.339 1.00 10.00 C ATOM 1355 C VAL B 363 10.039 -0.664 4.287 1.00 10.00 C ATOM 1356 O VAL B 363 11.027 -1.177 3.757 1.00 10.00 O ATOM 1357 CB VAL B 363 9.901 -1.317 6.728 1.00 10.00 C ATOM 1358 CG1 VAL B 363 10.103 0.135 7.149 1.00 10.00 C ATOM 1359 CG2 VAL B 363 9.058 -2.054 7.756 1.00 10.00 C ATOM 0 H VAL B 363 9.908 -3.326 4.859 1.00 10.00 H new ATOM 0 HA VAL B 363 8.249 -0.948 5.440 1.00 10.00 H new ATOM 0 HB VAL B 363 10.884 -1.784 6.667 1.00 10.00 H new ATOM 0 HG11 VAL B 363 10.577 0.167 8.130 1.00 10.00 H new ATOM 0 HG12 VAL B 363 10.739 0.639 6.422 1.00 10.00 H new ATOM 0 HG13 VAL B 363 9.137 0.638 7.196 1.00 10.00 H new ATOM 0 HG21 VAL B 363 9.534 -1.985 8.734 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.066 -1.604 7.803 1.00 10.00 H new ATOM 0 HG23 VAL B 363 8.968 -3.102 7.469 1.00 10.00 H new ATOM 1369 N ILE B 364 9.592 0.539 4.000 1.00 10.00 N ATOM 1370 CA ILE B 364 10.163 1.388 2.976 1.00 10.00 C ATOM 1371 C ILE B 364 10.846 2.603 3.583 1.00 10.00 C ATOM 1372 O ILE B 364 10.464 3.093 4.649 1.00 10.00 O ATOM 1373 CB ILE B 364 9.110 1.833 1.927 1.00 10.00 C ATOM 1374 CG1 ILE B 364 9.804 2.207 0.612 1.00 10.00 C ATOM 1375 CG2 ILE B 364 8.264 2.996 2.438 1.00 10.00 C ATOM 1376 CD1 ILE B 364 10.552 1.055 -0.029 1.00 10.00 C ATOM 0 H ILE B 364 8.802 0.965 4.484 1.00 10.00 H new ATOM 0 HA ILE B 364 10.912 0.788 2.459 1.00 10.00 H new ATOM 0 HB ILE B 364 8.437 0.994 1.748 1.00 10.00 H new ATOM 0 HG12 ILE B 364 9.058 2.580 -0.090 1.00 10.00 H new ATOM 0 HG13 ILE B 364 10.502 3.023 0.799 1.00 10.00 H new ATOM 0 HG21 ILE B 364 7.538 3.280 1.676 1.00 10.00 H new ATOM 0 HG22 ILE B 364 7.740 2.694 3.344 1.00 10.00 H new ATOM 0 HG23 ILE B 364 8.910 3.846 2.659 1.00 10.00 H new ATOM 0 HD11 ILE B 364 11.017 1.394 -0.955 1.00 10.00 H new ATOM 0 HD12 ILE B 364 11.322 0.696 0.654 1.00 10.00 H new ATOM 0 HD13 ILE B 364 9.855 0.246 -0.248 1.00 10.00 H new