USER MOD reduce.3.24.130724 H: found=0, std=0, add=1004, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1002 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: B 41 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 43 HIS : no HD1:sc= -0.99 K(o=-0.99,f=-0.11) USER MOD Set 2.1: A 41 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 43 HIS : no HD1:sc= -1.02 K(o=-1,f=-0.095) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 135:sc= 0.0169 (180deg=-0.0541) USER MOD Single : A 5 THR OG1 : rot 82:sc= 0.0935 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.162 USER MOD Single : A 13 MET CE :methyl -162:sc= 0 (180deg=-0.56) USER MOD Single : A 19 THR OG1 : rot 180:sc= -0.366 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -1.58 K(o=-1.6,f=-2.4!) USER MOD Single : A 35 ASN : amide:sc= -1.34 K(o=-1.3,f=-0.52) USER MOD Single : A 38 LYS NZ :NH3+ -151:sc= 0.259 (180deg=-0.996) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.0791 X(o=0.079,f=0) USER MOD Single : A 52 GLN : amide:sc= -0.046 K(o=-0.046,f=-1.7) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 37:sc= 1.14 USER MOD Single : A 60 SER OG : rot 180:sc= 0.00985 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 136:sc= 0.0184 (180deg=-0.0385) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.11 USER MOD Single : B 11 THR OG1 : rot 180:sc= -0.154 USER MOD Single : B 13 MET CE :methyl -162:sc=-0.00605 (180deg=-0.554) USER MOD Single : B 19 THR OG1 : rot 180:sc= -0.356 USER MOD Single : B 21 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 29 GLN : amide:sc= -1.63 K(o=-1.6,f=-2.4!) USER MOD Single : B 35 ASN : amide:sc= -1.34 K(o=-1.3,f=-0.55) USER MOD Single : B 38 LYS NZ :NH3+ -152:sc= 0.256 (180deg=-1.07) USER MOD Single : B 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 49 GLN : amide:sc= 0.0843 X(o=0.084,f=0) USER MOD Single : B 52 GLN : amide:sc= -0.047 K(o=-0.047,f=-1.6) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 57 GLN : amide:sc= -0.122 K(o=-0.12,f=-3.4!) USER MOD Single : B 58 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.778 -11.571 -5.293 1.00 0.00 N ATOM 2 CA MET A 1 -1.544 -10.792 -4.049 1.00 0.00 C ATOM 3 C MET A 1 -0.101 -10.929 -3.575 1.00 0.00 C ATOM 4 O MET A 1 0.511 -11.989 -3.713 1.00 0.00 O ATOM 5 CB MET A 1 -2.504 -11.299 -2.971 1.00 0.00 C ATOM 6 CG MET A 1 -2.294 -12.760 -2.608 1.00 0.00 C ATOM 7 SD MET A 1 -2.550 -13.083 -0.853 1.00 0.00 S ATOM 8 CE MET A 1 -1.562 -14.560 -0.634 1.00 0.00 C ATOM 0 H1 MET A 1 -2.671 -12.098 -5.210 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.833 -10.922 -6.104 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.994 -12.239 -5.437 1.00 0.00 H new ATOM 0 HA MET A 1 -1.724 -9.736 -4.248 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.385 -10.690 -2.075 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.529 -11.163 -3.316 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.978 -13.377 -3.191 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.282 -13.057 -2.884 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.619 -14.885 0.405 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.940 -15.350 -1.282 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.525 -14.345 -0.891 1.00 0.00 H new ATOM 20 N LEU A 2 0.438 -9.850 -3.016 1.00 0.00 N ATOM 21 CA LEU A 2 1.810 -9.848 -2.521 1.00 0.00 C ATOM 22 C LEU A 2 1.840 -9.687 -1.004 1.00 0.00 C ATOM 23 O LEU A 2 1.612 -8.595 -0.485 1.00 0.00 O ATOM 24 CB LEU A 2 2.603 -8.718 -3.180 1.00 0.00 C ATOM 25 CG LEU A 2 4.106 -8.725 -2.893 1.00 0.00 C ATOM 26 CD1 LEU A 2 4.888 -8.316 -4.131 1.00 0.00 C ATOM 27 CD2 LEU A 2 4.431 -7.802 -1.728 1.00 0.00 C ATOM 0 H LEU A 2 -0.055 -8.965 -2.894 1.00 0.00 H new ATOM 0 HA LEU A 2 2.267 -10.804 -2.775 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.455 -8.772 -4.259 1.00 0.00 H new ATOM 0 HB3 LEU A 2 2.190 -7.765 -2.849 1.00 0.00 H new ATOM 0 HG LEU A 2 4.399 -9.739 -2.621 1.00 0.00 H new ATOM 0 HD11 LEU A 2 5.955 -8.327 -3.908 1.00 0.00 H new ATOM 0 HD12 LEU A 2 4.680 -9.016 -4.941 1.00 0.00 H new ATOM 0 HD13 LEU A 2 4.591 -7.312 -4.434 1.00 0.00 H new ATOM 0 HD21 LEU A 2 5.504 -7.820 -1.538 1.00 0.00 H new ATOM 0 HD22 LEU A 2 4.122 -6.785 -1.972 1.00 0.00 H new ATOM 0 HD23 LEU A 2 3.900 -8.139 -0.838 1.00 0.00 H new ATOM 39 N ILE A 3 2.125 -10.776 -0.292 1.00 0.00 N ATOM 40 CA ILE A 3 2.183 -10.729 1.164 1.00 0.00 C ATOM 41 C ILE A 3 3.627 -10.661 1.654 1.00 0.00 C ATOM 42 O ILE A 3 4.355 -11.654 1.638 1.00 0.00 O ATOM 43 CB ILE A 3 1.461 -11.938 1.802 1.00 0.00 C ATOM 44 CG1 ILE A 3 1.318 -11.737 3.312 1.00 0.00 C ATOM 45 CG2 ILE A 3 2.196 -13.236 1.502 1.00 0.00 C ATOM 46 CD1 ILE A 3 0.025 -12.293 3.875 1.00 0.00 C ATOM 0 H ILE A 3 2.317 -11.692 -0.697 1.00 0.00 H new ATOM 0 HA ILE A 3 1.665 -9.822 1.476 1.00 0.00 H new ATOM 0 HB ILE A 3 0.465 -12.008 1.364 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.159 -12.214 3.815 1.00 0.00 H new ATOM 0 HG13 ILE A 3 1.374 -10.672 3.536 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.666 -14.069 1.963 1.00 0.00 H new ATOM 0 HG22 ILE A 3 2.242 -13.387 0.424 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.208 -13.183 1.904 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.010 -12.116 4.950 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.822 -11.799 3.398 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.025 -13.365 3.682 1.00 0.00 H new ATOM 58 N LEU A 4 4.027 -9.474 2.099 1.00 0.00 N ATOM 59 CA LEU A 4 5.374 -9.254 2.613 1.00 0.00 C ATOM 60 C LEU A 4 5.329 -8.663 4.018 1.00 0.00 C ATOM 61 O LEU A 4 4.784 -7.577 4.219 1.00 0.00 O ATOM 62 CB LEU A 4 6.154 -8.324 1.681 1.00 0.00 C ATOM 63 CG LEU A 4 7.663 -8.566 1.641 1.00 0.00 C ATOM 64 CD1 LEU A 4 8.210 -8.306 0.246 1.00 0.00 C ATOM 65 CD2 LEU A 4 8.369 -7.688 2.664 1.00 0.00 C ATOM 0 H LEU A 4 3.433 -8.645 2.114 1.00 0.00 H new ATOM 0 HA LEU A 4 5.880 -10.218 2.659 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.757 -8.430 0.671 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.975 -7.293 1.987 1.00 0.00 H new ATOM 0 HG LEU A 4 7.851 -9.610 1.893 1.00 0.00 H new ATOM 0 HD11 LEU A 4 9.285 -8.484 0.238 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.726 -8.976 -0.465 1.00 0.00 H new ATOM 0 HD13 LEU A 4 8.011 -7.272 -0.036 1.00 0.00 H new ATOM 0 HD21 LEU A 4 9.442 -7.872 2.623 1.00 0.00 H new ATOM 0 HD22 LEU A 4 8.172 -6.639 2.441 1.00 0.00 H new ATOM 0 HD23 LEU A 4 7.999 -7.922 3.662 1.00 0.00 H new ATOM 77 N THR A 5 5.899 -9.365 4.992 1.00 0.00 N ATOM 78 CA THR A 5 5.906 -8.869 6.364 1.00 0.00 C ATOM 79 C THR A 5 6.581 -7.511 6.441 1.00 0.00 C ATOM 80 O THR A 5 7.487 -7.212 5.663 1.00 0.00 O ATOM 81 CB THR A 5 6.618 -9.840 7.303 1.00 0.00 C ATOM 82 OG1 THR A 5 6.862 -11.080 6.662 1.00 0.00 O ATOM 83 CG2 THR A 5 5.835 -10.116 8.567 1.00 0.00 C ATOM 0 H THR A 5 6.356 -10.267 4.860 1.00 0.00 H new ATOM 0 HA THR A 5 4.867 -8.775 6.679 1.00 0.00 H new ATOM 0 HB THR A 5 7.556 -9.353 7.570 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.671 -11.011 6.113 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.391 -10.812 9.195 1.00 0.00 H new ATOM 0 HG22 THR A 5 5.679 -9.183 9.109 1.00 0.00 H new ATOM 0 HG23 THR A 5 4.870 -10.551 8.309 1.00 0.00 H new ATOM 91 N ARG A 6 6.139 -6.697 7.389 1.00 0.00 N ATOM 92 CA ARG A 6 6.703 -5.370 7.578 1.00 0.00 C ATOM 93 C ARG A 6 5.973 -4.620 8.683 1.00 0.00 C ATOM 94 O ARG A 6 4.759 -4.750 8.850 1.00 0.00 O ATOM 95 CB ARG A 6 6.642 -4.561 6.278 1.00 0.00 C ATOM 96 CG ARG A 6 7.858 -3.675 6.058 1.00 0.00 C ATOM 97 CD ARG A 6 9.130 -4.496 5.911 1.00 0.00 C ATOM 98 NE ARG A 6 9.956 -4.450 7.116 1.00 0.00 N ATOM 99 CZ ARG A 6 10.885 -3.524 7.347 1.00 0.00 C ATOM 100 NH1 ARG A 6 11.106 -2.557 6.465 1.00 0.00 N ATOM 101 NH2 ARG A 6 11.593 -3.564 8.467 1.00 0.00 N ATOM 0 H ARG A 6 5.390 -6.934 8.040 1.00 0.00 H new ATOM 0 HA ARG A 6 7.746 -5.494 7.868 1.00 0.00 H new ATOM 0 HB2 ARG A 6 6.545 -5.247 5.437 1.00 0.00 H new ATOM 0 HB3 ARG A 6 5.746 -3.940 6.288 1.00 0.00 H new ATOM 0 HG2 ARG A 6 7.710 -3.069 5.164 1.00 0.00 H new ATOM 0 HG3 ARG A 6 7.964 -2.986 6.896 1.00 0.00 H new ATOM 0 HD2 ARG A 6 8.869 -5.531 5.690 1.00 0.00 H new ATOM 0 HD3 ARG A 6 9.705 -4.124 5.063 1.00 0.00 H new ATOM 0 HE ARG A 6 9.812 -5.171 7.823 1.00 0.00 H new ATOM 0 HH11 ARG A 6 10.562 -2.519 5.603 1.00 0.00 H new ATOM 0 HH12 ARG A 6 11.819 -1.852 6.650 1.00 0.00 H new ATOM 0 HH21 ARG A 6 11.426 -4.303 9.150 1.00 0.00 H new ATOM 0 HH22 ARG A 6 12.305 -2.856 8.646 1.00 0.00 H new ATOM 115 N ARG A 7 6.730 -3.832 9.429 1.00 0.00 N ATOM 116 CA ARG A 7 6.177 -3.037 10.519 1.00 0.00 C ATOM 117 C ARG A 7 7.160 -1.949 10.941 1.00 0.00 C ATOM 118 O ARG A 7 7.146 -1.494 12.085 1.00 0.00 O ATOM 119 CB ARG A 7 5.835 -3.924 11.714 1.00 0.00 C ATOM 120 CG ARG A 7 4.981 -3.225 12.759 1.00 0.00 C ATOM 121 CD ARG A 7 5.366 -3.646 14.168 1.00 0.00 C ATOM 122 NE ARG A 7 4.204 -4.049 14.956 1.00 0.00 N ATOM 123 CZ ARG A 7 4.267 -4.426 16.231 1.00 0.00 C ATOM 124 NH1 ARG A 7 5.432 -4.452 16.865 1.00 0.00 N ATOM 125 NH2 ARG A 7 3.161 -4.777 16.873 1.00 0.00 N ATOM 0 H ARG A 7 7.736 -3.724 9.300 1.00 0.00 H new ATOM 0 HA ARG A 7 5.262 -2.564 10.162 1.00 0.00 H new ATOM 0 HB2 ARG A 7 5.310 -4.811 11.360 1.00 0.00 H new ATOM 0 HB3 ARG A 7 6.759 -4.266 12.180 1.00 0.00 H new ATOM 0 HG2 ARG A 7 5.092 -2.145 12.658 1.00 0.00 H new ATOM 0 HG3 ARG A 7 3.930 -3.455 12.584 1.00 0.00 H new ATOM 0 HD2 ARG A 7 6.075 -4.473 14.118 1.00 0.00 H new ATOM 0 HD3 ARG A 7 5.874 -2.821 14.667 1.00 0.00 H new ATOM 0 HE ARG A 7 3.290 -4.041 14.502 1.00 0.00 H new ATOM 0 HH11 ARG A 7 6.285 -4.182 16.375 1.00 0.00 H new ATOM 0 HH12 ARG A 7 5.475 -4.742 17.842 1.00 0.00 H new ATOM 0 HH21 ARG A 7 2.263 -4.758 16.390 1.00 0.00 H new ATOM 0 HH22 ARG A 7 3.208 -5.066 17.850 1.00 0.00 H new ATOM 139 N VAL A 8 8.018 -1.543 10.011 1.00 0.00 N ATOM 140 CA VAL A 8 9.015 -0.518 10.286 1.00 0.00 C ATOM 141 C VAL A 8 9.017 0.548 9.196 1.00 0.00 C ATOM 142 O VAL A 8 8.919 1.742 9.482 1.00 0.00 O ATOM 143 CB VAL A 8 10.428 -1.127 10.401 1.00 0.00 C ATOM 144 CG1 VAL A 8 11.337 -0.216 11.212 1.00 0.00 C ATOM 145 CG2 VAL A 8 10.367 -2.519 11.019 1.00 0.00 C ATOM 0 H VAL A 8 8.042 -1.909 9.059 1.00 0.00 H new ATOM 0 HA VAL A 8 8.748 -0.059 11.238 1.00 0.00 H new ATOM 0 HB VAL A 8 10.844 -1.220 9.398 1.00 0.00 H new ATOM 0 HG11 VAL A 8 12.329 -0.662 11.283 1.00 0.00 H new ATOM 0 HG12 VAL A 8 11.409 0.755 10.722 1.00 0.00 H new ATOM 0 HG13 VAL A 8 10.925 -0.088 12.213 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.374 -2.930 11.091 1.00 0.00 H new ATOM 0 HG22 VAL A 8 9.929 -2.456 12.015 1.00 0.00 H new ATOM 0 HG23 VAL A 8 9.754 -3.168 10.394 1.00 0.00 H new ATOM 155 N GLY A 9 9.129 0.111 7.945 1.00 0.00 N ATOM 156 CA GLY A 9 9.141 1.044 6.833 1.00 0.00 C ATOM 157 C GLY A 9 8.891 0.367 5.499 1.00 0.00 C ATOM 158 O GLY A 9 9.831 -0.050 4.821 1.00 0.00 O ATOM 0 H GLY A 9 9.212 -0.871 7.682 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.381 1.808 6.996 1.00 0.00 H new ATOM 0 HA3 GLY A 9 10.104 1.554 6.802 1.00 0.00 H new ATOM 162 N GLU A 10 7.622 0.260 5.118 1.00 0.00 N ATOM 163 CA GLU A 10 7.250 -0.367 3.854 1.00 0.00 C ATOM 164 C GLU A 10 6.754 0.678 2.860 1.00 0.00 C ATOM 165 O GLU A 10 5.642 0.580 2.338 1.00 0.00 O ATOM 166 CB GLU A 10 6.170 -1.427 4.083 1.00 0.00 C ATOM 167 CG GLU A 10 6.296 -2.633 3.165 1.00 0.00 C ATOM 168 CD GLU A 10 5.155 -2.732 2.172 1.00 0.00 C ATOM 169 OE1 GLU A 10 4.012 -2.991 2.604 1.00 0.00 O ATOM 170 OE2 GLU A 10 5.405 -2.552 0.961 1.00 0.00 O ATOM 0 H GLU A 10 6.833 0.600 5.667 1.00 0.00 H new ATOM 0 HA GLU A 10 8.135 -0.849 3.439 1.00 0.00 H new ATOM 0 HB2 GLU A 10 6.216 -1.763 5.119 1.00 0.00 H new ATOM 0 HB3 GLU A 10 5.190 -0.972 3.939 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.240 -2.575 2.623 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.329 -3.541 3.767 1.00 0.00 H new ATOM 177 N THR A 11 7.584 1.685 2.609 1.00 0.00 N ATOM 178 CA THR A 11 7.232 2.758 1.686 1.00 0.00 C ATOM 179 C THR A 11 6.997 2.226 0.275 1.00 0.00 C ATOM 180 O THR A 11 7.944 1.961 -0.466 1.00 0.00 O ATOM 181 CB THR A 11 8.334 3.818 1.665 1.00 0.00 C ATOM 182 OG1 THR A 11 8.653 4.236 2.980 1.00 0.00 O ATOM 183 CG2 THR A 11 7.963 5.051 0.869 1.00 0.00 C ATOM 0 H THR A 11 8.507 1.781 3.033 1.00 0.00 H new ATOM 0 HA THR A 11 6.303 3.208 2.037 1.00 0.00 H new ATOM 0 HB THR A 11 9.187 3.338 1.185 1.00 0.00 H new ATOM 0 HG1 THR A 11 9.361 4.913 2.945 1.00 0.00 H new ATOM 0 HG21 THR A 11 8.788 5.763 0.895 1.00 0.00 H new ATOM 0 HG22 THR A 11 7.759 4.769 -0.164 1.00 0.00 H new ATOM 0 HG23 THR A 11 7.074 5.510 1.302 1.00 0.00 H new ATOM 191 N LEU A 12 5.728 2.087 -0.095 1.00 0.00 N ATOM 192 CA LEU A 12 5.362 1.604 -1.422 1.00 0.00 C ATOM 193 C LEU A 12 4.726 2.732 -2.231 1.00 0.00 C ATOM 194 O LEU A 12 4.156 3.663 -1.662 1.00 0.00 O ATOM 195 CB LEU A 12 4.412 0.395 -1.309 1.00 0.00 C ATOM 196 CG LEU A 12 2.980 0.603 -1.825 1.00 0.00 C ATOM 197 CD1 LEU A 12 2.864 0.156 -3.274 1.00 0.00 C ATOM 198 CD2 LEU A 12 1.985 -0.151 -0.958 1.00 0.00 C ATOM 0 H LEU A 12 4.934 2.303 0.507 1.00 0.00 H new ATOM 0 HA LEU A 12 6.261 1.275 -1.943 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.854 -0.439 -1.854 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.358 0.099 -0.261 1.00 0.00 H new ATOM 0 HG LEU A 12 2.749 1.667 -1.772 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.843 0.311 -3.622 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.549 0.738 -3.890 1.00 0.00 H new ATOM 0 HD13 LEU A 12 3.117 -0.902 -3.350 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.976 0.008 -1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 12 2.217 -1.216 -0.980 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.047 0.213 0.068 1.00 0.00 H new ATOM 210 N MET A 13 4.816 2.650 -3.555 1.00 0.00 N ATOM 211 CA MET A 13 4.234 3.676 -4.409 1.00 0.00 C ATOM 212 C MET A 13 3.432 3.058 -5.548 1.00 0.00 C ATOM 213 O MET A 13 3.991 2.635 -6.559 1.00 0.00 O ATOM 214 CB MET A 13 5.332 4.578 -4.975 1.00 0.00 C ATOM 215 CG MET A 13 4.807 5.868 -5.584 1.00 0.00 C ATOM 216 SD MET A 13 4.858 5.860 -7.387 1.00 0.00 S ATOM 217 CE MET A 13 5.909 7.275 -7.703 1.00 0.00 C ATOM 0 H MET A 13 5.281 1.892 -4.054 1.00 0.00 H new ATOM 0 HA MET A 13 3.556 4.273 -3.800 1.00 0.00 H new ATOM 0 HB2 MET A 13 6.036 4.822 -4.179 1.00 0.00 H new ATOM 0 HB3 MET A 13 5.887 4.027 -5.734 1.00 0.00 H new ATOM 0 HG2 MET A 13 3.780 6.029 -5.255 1.00 0.00 H new ATOM 0 HG3 MET A 13 5.396 6.706 -5.212 1.00 0.00 H new ATOM 0 HE1 MET A 13 5.784 7.597 -8.737 1.00 0.00 H new ATOM 0 HE2 MET A 13 5.634 8.090 -7.033 1.00 0.00 H new ATOM 0 HE3 MET A 13 6.950 7.001 -7.532 1.00 0.00 H new ATOM 227 N ILE A 14 2.117 3.019 -5.377 1.00 0.00 N ATOM 228 CA ILE A 14 1.228 2.466 -6.387 1.00 0.00 C ATOM 229 C ILE A 14 0.267 3.533 -6.903 1.00 0.00 C ATOM 230 O ILE A 14 -0.257 4.334 -6.128 1.00 0.00 O ATOM 231 CB ILE A 14 0.421 1.273 -5.833 1.00 0.00 C ATOM 232 CG1 ILE A 14 -0.397 0.623 -6.949 1.00 0.00 C ATOM 233 CG2 ILE A 14 -0.482 1.719 -4.690 1.00 0.00 C ATOM 234 CD1 ILE A 14 0.450 0.117 -8.095 1.00 0.00 C ATOM 0 H ILE A 14 1.642 3.366 -4.544 1.00 0.00 H new ATOM 0 HA ILE A 14 1.851 2.114 -7.209 1.00 0.00 H new ATOM 0 HB ILE A 14 1.119 0.533 -5.442 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -0.969 -0.207 -6.535 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.117 1.347 -7.331 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.042 0.863 -4.314 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.126 2.136 -3.887 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -1.177 2.478 -5.050 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -0.193 -0.332 -8.852 1.00 0.00 H new ATOM 0 HD12 ILE A 14 1.002 0.948 -8.534 1.00 0.00 H new ATOM 0 HD13 ILE A 14 1.153 -0.630 -7.726 1.00 0.00 H new ATOM 246 N GLY A 15 0.037 3.543 -8.212 1.00 0.00 N ATOM 247 CA GLY A 15 -0.862 4.522 -8.798 1.00 0.00 C ATOM 248 C GLY A 15 -0.185 5.367 -9.860 1.00 0.00 C ATOM 249 O GLY A 15 0.105 4.885 -10.955 1.00 0.00 O ATOM 0 H GLY A 15 0.456 2.892 -8.877 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -1.717 4.009 -9.237 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.249 5.172 -8.013 1.00 0.00 H new ATOM 253 N ASP A 16 0.063 6.633 -9.538 1.00 0.00 N ATOM 254 CA ASP A 16 0.706 7.546 -10.478 1.00 0.00 C ATOM 255 C ASP A 16 1.659 8.518 -9.775 1.00 0.00 C ATOM 256 O ASP A 16 2.358 9.283 -10.437 1.00 0.00 O ATOM 257 CB ASP A 16 -0.354 8.332 -11.253 1.00 0.00 C ATOM 258 CG ASP A 16 -0.945 7.532 -12.397 1.00 0.00 C ATOM 259 OD1 ASP A 16 -1.529 6.460 -12.132 1.00 0.00 O ATOM 260 OD2 ASP A 16 -0.823 7.977 -13.557 1.00 0.00 O ATOM 0 H ASP A 16 -0.170 7.049 -8.637 1.00 0.00 H new ATOM 0 HA ASP A 16 1.297 6.942 -11.167 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.151 8.631 -10.572 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.090 9.247 -11.645 1.00 0.00 H new ATOM 265 N GLU A 17 1.687 8.480 -8.439 1.00 0.00 N ATOM 266 CA GLU A 17 2.556 9.354 -7.645 1.00 0.00 C ATOM 267 C GLU A 17 2.082 9.381 -6.193 1.00 0.00 C ATOM 268 O GLU A 17 1.633 10.413 -5.694 1.00 0.00 O ATOM 269 CB GLU A 17 2.576 10.782 -8.213 1.00 0.00 C ATOM 270 CG GLU A 17 3.304 11.786 -7.330 1.00 0.00 C ATOM 271 CD GLU A 17 4.118 12.783 -8.131 1.00 0.00 C ATOM 272 OE1 GLU A 17 4.901 12.348 -9.001 1.00 0.00 O ATOM 273 OE2 GLU A 17 3.971 14.000 -7.889 1.00 0.00 O ATOM 0 H GLU A 17 1.113 7.848 -7.881 1.00 0.00 H new ATOM 0 HA GLU A 17 3.569 8.955 -7.690 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.050 10.766 -9.195 1.00 0.00 H new ATOM 0 HB3 GLU A 17 1.550 11.119 -8.360 1.00 0.00 H new ATOM 0 HG2 GLU A 17 2.577 12.322 -6.720 1.00 0.00 H new ATOM 0 HG3 GLU A 17 3.962 11.252 -6.645 1.00 0.00 H new ATOM 280 N VAL A 18 2.170 8.237 -5.523 1.00 0.00 N ATOM 281 CA VAL A 18 1.739 8.127 -4.145 1.00 0.00 C ATOM 282 C VAL A 18 2.906 7.771 -3.218 1.00 0.00 C ATOM 283 O VAL A 18 4.071 7.951 -3.572 1.00 0.00 O ATOM 284 CB VAL A 18 0.628 7.069 -4.019 1.00 0.00 C ATOM 285 CG1 VAL A 18 -0.491 7.352 -5.010 1.00 0.00 C ATOM 286 CG2 VAL A 18 1.184 5.667 -4.220 1.00 0.00 C ATOM 0 H VAL A 18 2.538 7.372 -5.919 1.00 0.00 H new ATOM 0 HA VAL A 18 1.350 9.099 -3.840 1.00 0.00 H new ATOM 0 HB VAL A 18 0.218 7.125 -3.011 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.268 6.595 -4.907 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.915 8.336 -4.809 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.093 7.329 -6.025 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.378 4.939 -4.126 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.628 5.590 -5.213 1.00 0.00 H new ATOM 0 HG23 VAL A 18 1.945 5.466 -3.466 1.00 0.00 H new ATOM 296 N THR A 19 2.577 7.263 -2.031 1.00 0.00 N ATOM 297 CA THR A 19 3.574 6.873 -1.038 1.00 0.00 C ATOM 298 C THR A 19 2.870 6.432 0.241 1.00 0.00 C ATOM 299 O THR A 19 2.354 7.261 0.988 1.00 0.00 O ATOM 300 CB THR A 19 4.529 8.033 -0.737 1.00 0.00 C ATOM 301 OG1 THR A 19 3.921 9.281 -1.037 1.00 0.00 O ATOM 302 CG2 THR A 19 5.833 7.951 -1.504 1.00 0.00 C ATOM 0 H THR A 19 1.614 7.111 -1.732 1.00 0.00 H new ATOM 0 HA THR A 19 4.161 6.046 -1.438 1.00 0.00 H new ATOM 0 HB THR A 19 4.751 7.954 0.327 1.00 0.00 H new ATOM 0 HG1 THR A 19 4.548 10.007 -0.836 1.00 0.00 H new ATOM 0 HG21 THR A 19 6.462 8.802 -1.244 1.00 0.00 H new ATOM 0 HG22 THR A 19 6.349 7.026 -1.246 1.00 0.00 H new ATOM 0 HG23 THR A 19 5.627 7.965 -2.574 1.00 0.00 H new ATOM 310 N VAL A 20 2.828 5.126 0.480 1.00 0.00 N ATOM 311 CA VAL A 20 2.157 4.598 1.662 1.00 0.00 C ATOM 312 C VAL A 20 3.127 3.907 2.618 1.00 0.00 C ATOM 313 O VAL A 20 3.601 2.802 2.350 1.00 0.00 O ATOM 314 CB VAL A 20 1.046 3.604 1.274 1.00 0.00 C ATOM 315 CG1 VAL A 20 -0.042 4.305 0.475 1.00 0.00 C ATOM 316 CG2 VAL A 20 1.620 2.434 0.490 1.00 0.00 C ATOM 0 H VAL A 20 3.247 4.418 -0.124 1.00 0.00 H new ATOM 0 HA VAL A 20 1.720 5.457 2.172 1.00 0.00 H new ATOM 0 HB VAL A 20 0.601 3.213 2.189 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -0.818 3.587 0.210 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -0.477 5.104 1.075 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.388 4.727 -0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 20 0.818 1.744 0.226 1.00 0.00 H new ATOM 0 HG22 VAL A 20 2.095 2.803 -0.419 1.00 0.00 H new ATOM 0 HG23 VAL A 20 2.359 1.915 1.100 1.00 0.00 H new ATOM 326 N THR A 21 3.407 4.565 3.739 1.00 0.00 N ATOM 327 CA THR A 21 4.307 4.017 4.748 1.00 0.00 C ATOM 328 C THR A 21 3.508 3.413 5.901 1.00 0.00 C ATOM 329 O THR A 21 2.879 4.133 6.678 1.00 0.00 O ATOM 330 CB THR A 21 5.244 5.106 5.274 1.00 0.00 C ATOM 331 OG1 THR A 21 5.460 6.100 4.288 1.00 0.00 O ATOM 332 CG2 THR A 21 6.598 4.578 5.697 1.00 0.00 C ATOM 0 H THR A 21 3.022 5.481 3.972 1.00 0.00 H new ATOM 0 HA THR A 21 4.906 3.232 4.286 1.00 0.00 H new ATOM 0 HB THR A 21 4.744 5.519 6.150 1.00 0.00 H new ATOM 0 HG1 THR A 21 6.060 6.788 4.643 1.00 0.00 H new ATOM 0 HG21 THR A 21 7.213 5.402 6.060 1.00 0.00 H new ATOM 0 HG22 THR A 21 6.470 3.844 6.492 1.00 0.00 H new ATOM 0 HG23 THR A 21 7.088 4.108 4.844 1.00 0.00 H new ATOM 340 N VAL A 22 3.527 2.087 6.000 1.00 0.00 N ATOM 341 CA VAL A 22 2.795 1.387 7.051 1.00 0.00 C ATOM 342 C VAL A 22 3.528 1.457 8.389 1.00 0.00 C ATOM 343 O VAL A 22 4.054 0.456 8.876 1.00 0.00 O ATOM 344 CB VAL A 22 2.556 -0.091 6.677 1.00 0.00 C ATOM 345 CG1 VAL A 22 3.879 -0.815 6.471 1.00 0.00 C ATOM 346 CG2 VAL A 22 1.717 -0.785 7.741 1.00 0.00 C ATOM 0 H VAL A 22 4.041 1.476 5.366 1.00 0.00 H new ATOM 0 HA VAL A 22 1.833 1.890 7.151 1.00 0.00 H new ATOM 0 HB VAL A 22 2.005 -0.122 5.737 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.687 -1.855 6.208 1.00 0.00 H new ATOM 0 HG12 VAL A 22 4.436 -0.334 5.667 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.463 -0.775 7.391 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.560 -1.826 7.459 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.236 -0.743 8.698 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.753 -0.283 7.829 1.00 0.00 H new ATOM 356 N LEU A 23 3.556 2.646 8.981 1.00 0.00 N ATOM 357 CA LEU A 23 4.220 2.845 10.264 1.00 0.00 C ATOM 358 C LEU A 23 3.248 2.579 11.420 1.00 0.00 C ATOM 359 O LEU A 23 2.368 1.725 11.306 1.00 0.00 O ATOM 360 CB LEU A 23 4.795 4.267 10.343 1.00 0.00 C ATOM 361 CG LEU A 23 5.975 4.473 11.312 1.00 0.00 C ATOM 362 CD1 LEU A 23 6.458 3.152 11.906 1.00 0.00 C ATOM 363 CD2 LEU A 23 7.120 5.188 10.609 1.00 0.00 C ATOM 0 H LEU A 23 3.127 3.486 8.593 1.00 0.00 H new ATOM 0 HA LEU A 23 5.043 2.136 10.350 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.117 4.562 9.344 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.992 4.945 10.632 1.00 0.00 H new ATOM 0 HG LEU A 23 5.620 5.093 12.135 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.291 3.341 12.584 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.643 2.680 12.455 1.00 0.00 H new ATOM 0 HD13 LEU A 23 6.786 2.491 11.104 1.00 0.00 H new ATOM 0 HD21 LEU A 23 7.946 5.326 11.307 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.457 4.590 9.762 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.779 6.160 10.254 1.00 0.00 H new ATOM 375 N GLY A 24 3.406 3.300 12.532 1.00 0.00 N ATOM 376 CA GLY A 24 2.531 3.103 13.671 1.00 0.00 C ATOM 377 C GLY A 24 2.655 1.712 14.252 1.00 0.00 C ATOM 378 O GLY A 24 1.828 0.843 13.979 1.00 0.00 O ATOM 0 H GLY A 24 4.123 4.014 12.660 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.767 3.839 14.440 1.00 0.00 H new ATOM 0 HA3 GLY A 24 1.499 3.278 13.369 1.00 0.00 H new ATOM 382 N VAL A 25 3.696 1.493 15.047 1.00 0.00 N ATOM 383 CA VAL A 25 3.925 0.194 15.650 1.00 0.00 C ATOM 384 C VAL A 25 3.155 0.038 16.960 1.00 0.00 C ATOM 385 O VAL A 25 3.504 0.639 17.976 1.00 0.00 O ATOM 386 CB VAL A 25 5.429 -0.030 15.914 1.00 0.00 C ATOM 387 CG1 VAL A 25 5.669 -1.365 16.606 1.00 0.00 C ATOM 388 CG2 VAL A 25 6.213 0.054 14.611 1.00 0.00 C ATOM 0 H VAL A 25 4.391 2.200 15.286 1.00 0.00 H new ATOM 0 HA VAL A 25 3.565 -0.554 14.943 1.00 0.00 H new ATOM 0 HB VAL A 25 5.781 0.758 16.580 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.737 -1.498 16.780 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.141 -1.381 17.559 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.301 -2.174 15.974 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.272 -0.106 14.813 1.00 0.00 H new ATOM 0 HG22 VAL A 25 5.855 -0.711 13.921 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.073 1.039 14.165 1.00 0.00 H new ATOM 398 N LYS A 26 2.104 -0.774 16.921 1.00 0.00 N ATOM 399 CA LYS A 26 1.274 -1.017 18.096 1.00 0.00 C ATOM 400 C LYS A 26 0.994 -2.507 18.265 1.00 0.00 C ATOM 401 O LYS A 26 0.753 -3.218 17.290 1.00 0.00 O ATOM 402 CB LYS A 26 -0.043 -0.247 17.982 1.00 0.00 C ATOM 403 CG LYS A 26 0.014 1.149 18.581 1.00 0.00 C ATOM 404 CD LYS A 26 -0.554 1.178 19.992 1.00 0.00 C ATOM 405 CE LYS A 26 0.502 1.570 21.013 1.00 0.00 C ATOM 406 NZ LYS A 26 0.411 3.010 21.381 1.00 0.00 N ATOM 0 H LYS A 26 1.806 -1.277 16.085 1.00 0.00 H new ATOM 0 HA LYS A 26 1.817 -0.667 18.974 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.320 -0.171 16.930 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.830 -0.814 18.479 1.00 0.00 H new ATOM 0 HG2 LYS A 26 1.047 1.496 18.597 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.545 1.839 17.949 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -1.383 1.884 20.036 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -0.957 0.197 20.243 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.386 0.959 21.908 1.00 0.00 H new ATOM 0 HE3 LYS A 26 1.493 1.360 20.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.148 3.237 22.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.547 3.595 20.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -0.525 3.205 21.790 1.00 0.00 H new ATOM 420 N GLY A 27 1.041 -2.974 19.510 1.00 0.00 N ATOM 421 CA GLY A 27 0.805 -4.380 19.799 1.00 0.00 C ATOM 422 C GLY A 27 -0.374 -4.970 19.045 1.00 0.00 C ATOM 423 O GLY A 27 -0.248 -6.024 18.422 1.00 0.00 O ATOM 0 H GLY A 27 1.240 -2.400 20.329 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.703 -4.948 19.553 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.636 -4.498 20.869 1.00 0.00 H new ATOM 427 N ASN A 28 -1.524 -4.305 19.106 1.00 0.00 N ATOM 428 CA ASN A 28 -2.719 -4.795 18.426 1.00 0.00 C ATOM 429 C ASN A 28 -2.966 -4.043 17.118 1.00 0.00 C ATOM 430 O ASN A 28 -2.520 -4.474 16.055 1.00 0.00 O ATOM 431 CB ASN A 28 -3.938 -4.678 19.345 1.00 0.00 C ATOM 432 CG ASN A 28 -3.972 -5.765 20.402 1.00 0.00 C ATOM 433 OD1 ASN A 28 -4.414 -6.884 20.143 1.00 0.00 O ATOM 434 ND2 ASN A 28 -3.504 -5.440 21.601 1.00 0.00 N ATOM 0 H ASN A 28 -1.654 -3.431 19.616 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.558 -5.845 18.181 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -3.931 -3.702 19.831 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -4.847 -4.729 18.746 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -3.501 -6.130 22.352 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -3.147 -4.500 21.771 1.00 0.00 H new ATOM 441 N GLN A 29 -3.679 -2.921 17.197 1.00 0.00 N ATOM 442 CA GLN A 29 -3.980 -2.126 16.012 1.00 0.00 C ATOM 443 C GLN A 29 -2.836 -1.169 15.694 1.00 0.00 C ATOM 444 O GLN A 29 -2.475 -0.323 16.512 1.00 0.00 O ATOM 445 CB GLN A 29 -5.280 -1.344 16.212 1.00 0.00 C ATOM 446 CG GLN A 29 -6.470 -2.223 16.563 1.00 0.00 C ATOM 447 CD GLN A 29 -6.635 -2.413 18.058 1.00 0.00 C ATOM 448 OE1 GLN A 29 -6.716 -3.540 18.548 1.00 0.00 O ATOM 449 NE2 GLN A 29 -6.687 -1.308 18.793 1.00 0.00 N ATOM 0 H GLN A 29 -4.057 -2.544 18.066 1.00 0.00 H new ATOM 0 HA GLN A 29 -4.103 -2.807 15.169 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.135 -0.610 17.005 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.505 -0.789 15.301 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -7.378 -1.779 16.155 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.350 -3.197 16.088 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.616 -0.394 18.346 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.798 -1.373 19.805 1.00 0.00 H new ATOM 458 N VAL A 30 -2.258 -1.325 14.508 1.00 0.00 N ATOM 459 CA VAL A 30 -1.137 -0.493 14.085 1.00 0.00 C ATOM 460 C VAL A 30 -1.606 0.719 13.288 1.00 0.00 C ATOM 461 O VAL A 30 -2.468 0.606 12.417 1.00 0.00 O ATOM 462 CB VAL A 30 -0.139 -1.295 13.229 1.00 0.00 C ATOM 463 CG1 VAL A 30 0.567 -2.346 14.072 1.00 0.00 C ATOM 464 CG2 VAL A 30 -0.848 -1.936 12.045 1.00 0.00 C ATOM 0 H VAL A 30 -2.548 -2.021 13.821 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.643 -0.151 14.995 1.00 0.00 H new ATOM 0 HB VAL A 30 0.615 -0.609 12.844 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.268 -2.902 13.449 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.110 -1.858 14.882 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.170 -3.032 14.490 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.128 -2.499 11.451 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.625 -2.609 12.407 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.300 -1.160 11.428 1.00 0.00 H new ATOM 474 N ARG A 31 -1.019 1.877 13.582 1.00 0.00 N ATOM 475 CA ARG A 31 -1.358 3.102 12.887 1.00 0.00 C ATOM 476 C ARG A 31 -0.702 3.118 11.512 1.00 0.00 C ATOM 477 O ARG A 31 0.503 3.336 11.391 1.00 0.00 O ATOM 478 CB ARG A 31 -0.921 4.321 13.704 1.00 0.00 C ATOM 479 CG ARG A 31 -1.870 4.660 14.842 1.00 0.00 C ATOM 480 CD ARG A 31 -2.583 5.982 14.603 1.00 0.00 C ATOM 481 NE ARG A 31 -3.385 6.386 15.756 1.00 0.00 N ATOM 482 CZ ARG A 31 -4.381 7.267 15.696 1.00 0.00 C ATOM 483 NH1 ARG A 31 -4.701 7.840 14.542 1.00 0.00 N ATOM 484 NH2 ARG A 31 -5.060 7.576 16.792 1.00 0.00 N ATOM 0 H ARG A 31 -0.304 1.986 14.301 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.440 3.146 12.761 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.073 4.137 14.113 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -0.839 5.182 13.041 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.606 3.864 14.952 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -1.313 4.710 15.778 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -1.848 6.756 14.383 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.225 5.895 13.727 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.169 5.968 16.661 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -4.183 7.606 13.695 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -5.465 8.514 14.502 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.819 7.139 17.681 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.823 8.251 16.746 1.00 0.00 H new ATOM 498 N ILE A 32 -1.496 2.864 10.479 1.00 0.00 N ATOM 499 CA ILE A 32 -0.980 2.825 9.116 1.00 0.00 C ATOM 500 C ILE A 32 -0.985 4.209 8.480 1.00 0.00 C ATOM 501 O ILE A 32 -1.988 4.919 8.522 1.00 0.00 O ATOM 502 CB ILE A 32 -1.801 1.863 8.234 1.00 0.00 C ATOM 503 CG1 ILE A 32 -2.152 0.591 9.012 1.00 0.00 C ATOM 504 CG2 ILE A 32 -1.034 1.520 6.966 1.00 0.00 C ATOM 505 CD1 ILE A 32 -3.031 -0.367 8.239 1.00 0.00 C ATOM 0 H ILE A 32 -2.497 2.682 10.558 1.00 0.00 H new ATOM 0 HA ILE A 32 0.047 2.465 9.179 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.729 2.359 7.951 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.231 0.080 9.292 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -2.657 0.868 9.937 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.627 0.840 6.355 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.833 2.432 6.404 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -0.091 1.041 7.230 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.239 -1.245 8.851 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.968 0.126 7.981 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -2.520 -0.674 7.326 1.00 0.00 H new ATOM 517 N GLY A 33 0.145 4.581 7.883 1.00 0.00 N ATOM 518 CA GLY A 33 0.257 5.875 7.238 1.00 0.00 C ATOM 519 C GLY A 33 0.156 5.773 5.733 1.00 0.00 C ATOM 520 O GLY A 33 1.054 5.241 5.080 1.00 0.00 O ATOM 0 H GLY A 33 0.986 4.006 7.835 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.528 6.533 7.609 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.210 6.332 7.506 1.00 0.00 H new ATOM 524 N VAL A 34 -0.940 6.275 5.177 1.00 0.00 N ATOM 525 CA VAL A 34 -1.147 6.227 3.738 1.00 0.00 C ATOM 526 C VAL A 34 -1.067 7.615 3.114 1.00 0.00 C ATOM 527 O VAL A 34 -2.006 8.407 3.207 1.00 0.00 O ATOM 528 CB VAL A 34 -2.513 5.603 3.393 1.00 0.00 C ATOM 529 CG1 VAL A 34 -2.656 5.413 1.889 1.00 0.00 C ATOM 530 CG2 VAL A 34 -2.697 4.283 4.126 1.00 0.00 C ATOM 0 H VAL A 34 -1.696 6.718 5.700 1.00 0.00 H new ATOM 0 HA VAL A 34 -0.350 5.606 3.328 1.00 0.00 H new ATOM 0 HB VAL A 34 -3.295 6.287 3.721 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -3.628 4.971 1.669 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -2.575 6.379 1.391 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.867 4.752 1.529 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -3.667 3.857 3.870 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -1.908 3.591 3.832 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.648 4.454 5.201 1.00 0.00 H new ATOM 540 N ASN A 35 0.061 7.900 2.473 1.00 0.00 N ATOM 541 CA ASN A 35 0.260 9.189 1.825 1.00 0.00 C ATOM 542 C ASN A 35 -0.083 9.094 0.343 1.00 0.00 C ATOM 543 O ASN A 35 0.650 8.491 -0.439 1.00 0.00 O ATOM 544 CB ASN A 35 1.703 9.666 2.005 1.00 0.00 C ATOM 545 CG ASN A 35 1.786 11.142 2.340 1.00 0.00 C ATOM 546 OD1 ASN A 35 1.112 11.969 1.726 1.00 0.00 O ATOM 547 ND2 ASN A 35 2.615 11.481 3.321 1.00 0.00 N ATOM 0 H ASN A 35 0.849 7.257 2.389 1.00 0.00 H new ATOM 0 HA ASN A 35 -0.404 9.915 2.293 1.00 0.00 H new ATOM 0 HB2 ASN A 35 2.177 9.089 2.799 1.00 0.00 H new ATOM 0 HB3 ASN A 35 2.264 9.472 1.091 1.00 0.00 H new ATOM 0 HD21 ASN A 35 2.712 12.460 3.592 1.00 0.00 H new ATOM 0 HD22 ASN A 35 3.155 10.763 3.804 1.00 0.00 H new ATOM 554 N ALA A 36 -1.211 9.684 -0.029 1.00 0.00 N ATOM 555 CA ALA A 36 -1.664 9.657 -1.415 1.00 0.00 C ATOM 556 C ALA A 36 -2.184 11.019 -1.867 1.00 0.00 C ATOM 557 O ALA A 36 -2.774 11.762 -1.083 1.00 0.00 O ATOM 558 CB ALA A 36 -2.740 8.597 -1.593 1.00 0.00 C ATOM 0 H ALA A 36 -1.829 10.187 0.608 1.00 0.00 H new ATOM 0 HA ALA A 36 -0.806 9.408 -2.040 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.071 8.585 -2.631 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.335 7.620 -1.330 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.586 8.825 -0.945 1.00 0.00 H new ATOM 564 N PRO A 37 -1.974 11.359 -3.151 1.00 0.00 N ATOM 565 CA PRO A 37 -2.425 12.629 -3.720 1.00 0.00 C ATOM 566 C PRO A 37 -3.909 12.608 -4.068 1.00 0.00 C ATOM 567 O PRO A 37 -4.489 11.544 -4.284 1.00 0.00 O ATOM 568 CB PRO A 37 -1.582 12.753 -4.986 1.00 0.00 C ATOM 569 CG PRO A 37 -1.354 11.346 -5.417 1.00 0.00 C ATOM 570 CD PRO A 37 -1.282 10.524 -4.155 1.00 0.00 C ATOM 0 HA PRO A 37 -2.308 13.461 -3.025 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.101 13.325 -5.755 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -0.641 13.266 -4.788 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -2.163 11.000 -6.061 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -0.431 11.260 -5.991 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -1.772 9.558 -4.278 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -0.250 10.324 -3.866 1.00 0.00 H new ATOM 578 N LYS A 38 -4.520 13.786 -4.121 1.00 0.00 N ATOM 579 CA LYS A 38 -5.938 13.896 -4.444 1.00 0.00 C ATOM 580 C LYS A 38 -6.148 14.101 -5.943 1.00 0.00 C ATOM 581 O LYS A 38 -7.062 14.814 -6.357 1.00 0.00 O ATOM 582 CB LYS A 38 -6.570 15.053 -3.669 1.00 0.00 C ATOM 583 CG LYS A 38 -8.088 14.990 -3.613 1.00 0.00 C ATOM 584 CD LYS A 38 -8.709 16.373 -3.727 1.00 0.00 C ATOM 585 CE LYS A 38 -8.859 16.799 -5.179 1.00 0.00 C ATOM 586 NZ LYS A 38 -7.643 17.496 -5.682 1.00 0.00 N ATOM 0 H LYS A 38 -4.057 14.677 -3.945 1.00 0.00 H new ATOM 0 HA LYS A 38 -6.421 12.963 -4.154 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -6.177 15.056 -2.652 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -6.270 15.994 -4.129 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -8.457 14.357 -4.420 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -8.399 14.526 -2.677 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -9.686 16.375 -3.243 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -8.089 17.096 -3.197 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -9.056 15.922 -5.796 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -9.722 17.458 -5.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.913 18.173 -6.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -7.186 18.005 -4.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.980 16.798 -6.075 1.00 0.00 H new ATOM 600 N GLU A 39 -5.297 13.475 -6.753 1.00 0.00 N ATOM 601 CA GLU A 39 -5.396 13.595 -8.204 1.00 0.00 C ATOM 602 C GLU A 39 -5.639 12.234 -8.851 1.00 0.00 C ATOM 603 O GLU A 39 -6.403 12.121 -9.809 1.00 0.00 O ATOM 604 CB GLU A 39 -4.122 14.221 -8.773 1.00 0.00 C ATOM 605 CG GLU A 39 -3.753 15.546 -8.125 1.00 0.00 C ATOM 606 CD GLU A 39 -2.939 16.437 -9.043 1.00 0.00 C ATOM 607 OE1 GLU A 39 -3.475 16.856 -10.091 1.00 0.00 O ATOM 608 OE2 GLU A 39 -1.767 16.715 -8.715 1.00 0.00 O ATOM 0 H GLU A 39 -4.533 12.881 -6.429 1.00 0.00 H new ATOM 0 HA GLU A 39 -6.244 14.241 -8.431 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.296 13.522 -8.646 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.249 14.373 -9.845 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.663 16.068 -7.831 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -3.186 15.355 -7.214 1.00 0.00 H new ATOM 615 N VAL A 40 -4.986 11.203 -8.322 1.00 0.00 N ATOM 616 CA VAL A 40 -5.136 9.852 -8.854 1.00 0.00 C ATOM 617 C VAL A 40 -6.417 9.203 -8.340 1.00 0.00 C ATOM 618 O VAL A 40 -6.927 9.567 -7.281 1.00 0.00 O ATOM 619 CB VAL A 40 -3.933 8.959 -8.487 1.00 0.00 C ATOM 620 CG1 VAL A 40 -3.949 7.680 -9.310 1.00 0.00 C ATOM 621 CG2 VAL A 40 -2.626 9.712 -8.687 1.00 0.00 C ATOM 0 H VAL A 40 -4.350 11.277 -7.528 1.00 0.00 H new ATOM 0 HA VAL A 40 -5.185 9.943 -9.939 1.00 0.00 H new ATOM 0 HB VAL A 40 -4.012 8.690 -7.434 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -3.093 7.062 -9.038 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -4.870 7.132 -9.112 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.895 7.929 -10.370 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.789 9.065 -8.423 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.536 10.014 -9.731 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.615 10.597 -8.051 1.00 0.00 H new ATOM 631 N SER A 41 -6.933 8.241 -9.098 1.00 0.00 N ATOM 632 CA SER A 41 -8.157 7.543 -8.722 1.00 0.00 C ATOM 633 C SER A 41 -8.002 6.855 -7.369 1.00 0.00 C ATOM 634 O SER A 41 -7.237 5.901 -7.231 1.00 0.00 O ATOM 635 CB SER A 41 -8.530 6.514 -9.790 1.00 0.00 C ATOM 636 OG SER A 41 -9.906 6.181 -9.720 1.00 0.00 O ATOM 0 H SER A 41 -6.522 7.927 -9.977 1.00 0.00 H new ATOM 0 HA SER A 41 -8.955 8.281 -8.643 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.299 6.911 -10.778 1.00 0.00 H new ATOM 0 HB3 SER A 41 -7.928 5.615 -9.659 1.00 0.00 H new ATOM 0 HG SER A 41 -10.119 5.523 -10.414 1.00 0.00 H new ATOM 642 N VAL A 42 -8.736 7.344 -6.375 1.00 0.00 N ATOM 643 CA VAL A 42 -8.684 6.775 -5.034 1.00 0.00 C ATOM 644 C VAL A 42 -10.069 6.311 -4.583 1.00 0.00 C ATOM 645 O VAL A 42 -11.004 7.109 -4.508 1.00 0.00 O ATOM 646 CB VAL A 42 -8.133 7.791 -4.013 1.00 0.00 C ATOM 647 CG1 VAL A 42 -9.038 9.011 -3.923 1.00 0.00 C ATOM 648 CG2 VAL A 42 -7.964 7.141 -2.648 1.00 0.00 C ATOM 0 H VAL A 42 -9.374 8.134 -6.473 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.012 5.918 -5.077 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.153 8.122 -4.356 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -8.630 9.714 -3.197 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -9.099 9.492 -4.899 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -10.035 8.702 -3.608 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -7.574 7.874 -1.942 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -8.929 6.776 -2.297 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -7.267 6.306 -2.726 1.00 0.00 H new ATOM 658 N HIS A 43 -10.193 5.024 -4.271 1.00 0.00 N ATOM 659 CA HIS A 43 -11.459 4.463 -3.813 1.00 0.00 C ATOM 660 C HIS A 43 -11.255 3.676 -2.522 1.00 0.00 C ATOM 661 O HIS A 43 -10.388 2.806 -2.452 1.00 0.00 O ATOM 662 CB HIS A 43 -12.062 3.558 -4.888 1.00 0.00 C ATOM 663 CG HIS A 43 -12.514 4.298 -6.109 1.00 0.00 C ATOM 664 ND1 HIS A 43 -13.788 4.194 -6.624 1.00 0.00 N ATOM 665 CD2 HIS A 43 -11.853 5.159 -6.920 1.00 0.00 C ATOM 666 CE1 HIS A 43 -13.893 4.956 -7.698 1.00 0.00 C ATOM 667 NE2 HIS A 43 -12.733 5.553 -7.898 1.00 0.00 N ATOM 0 H HIS A 43 -9.430 4.349 -4.327 1.00 0.00 H new ATOM 0 HA HIS A 43 -12.149 5.284 -3.619 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -11.323 2.811 -5.179 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -12.910 3.020 -4.465 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -10.826 5.476 -6.817 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -14.777 5.071 -8.308 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -12.524 6.202 -8.656 1.00 0.00 H new ATOM 675 N ARG A 44 -12.052 3.978 -1.502 1.00 0.00 N ATOM 676 CA ARG A 44 -11.940 3.284 -0.223 1.00 0.00 C ATOM 677 C ARG A 44 -13.003 3.767 0.758 1.00 0.00 C ATOM 678 O ARG A 44 -13.935 3.034 1.088 1.00 0.00 O ATOM 679 CB ARG A 44 -10.543 3.476 0.380 1.00 0.00 C ATOM 680 CG ARG A 44 -9.922 4.839 0.095 1.00 0.00 C ATOM 681 CD ARG A 44 -9.647 5.614 1.376 1.00 0.00 C ATOM 682 NE ARG A 44 -8.215 5.749 1.638 1.00 0.00 N ATOM 683 CZ ARG A 44 -7.489 4.844 2.293 1.00 0.00 C ATOM 684 NH1 ARG A 44 -8.052 3.733 2.753 1.00 0.00 N ATOM 685 NH2 ARG A 44 -6.194 5.051 2.487 1.00 0.00 N ATOM 0 H ARG A 44 -12.778 4.694 -1.535 1.00 0.00 H new ATOM 0 HA ARG A 44 -12.099 2.222 -0.408 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -10.603 3.335 1.459 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -9.883 2.700 -0.007 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -8.991 4.706 -0.456 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -10.591 5.417 -0.543 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -10.097 6.604 1.304 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -10.123 5.107 2.216 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.743 6.587 1.299 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -9.048 3.567 2.606 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.489 3.045 3.253 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -5.755 5.902 2.135 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.636 4.359 2.988 1.00 0.00 H new ATOM 699 N GLU A 45 -12.860 5.005 1.221 1.00 0.00 N ATOM 700 CA GLU A 45 -13.809 5.582 2.164 1.00 0.00 C ATOM 701 C GLU A 45 -13.773 7.106 2.104 1.00 0.00 C ATOM 702 O GLU A 45 -12.754 7.728 2.413 1.00 0.00 O ATOM 703 CB GLU A 45 -13.503 5.105 3.585 1.00 0.00 C ATOM 704 CG GLU A 45 -14.263 3.850 3.983 1.00 0.00 C ATOM 705 CD GLU A 45 -15.766 4.030 3.906 1.00 0.00 C ATOM 706 OE1 GLU A 45 -16.328 3.866 2.803 1.00 0.00 O ATOM 707 OE2 GLU A 45 -16.381 4.335 4.950 1.00 0.00 O ATOM 0 H GLU A 45 -12.096 5.627 0.958 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.809 5.249 1.887 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -12.433 4.915 3.673 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -13.744 5.903 4.287 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.965 3.028 3.332 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -13.986 3.569 4.999 1.00 0.00 H new ATOM 714 N GLU A 46 -14.892 7.702 1.707 1.00 0.00 N ATOM 715 CA GLU A 46 -14.991 9.153 1.607 1.00 0.00 C ATOM 716 C GLU A 46 -14.762 9.807 2.964 1.00 0.00 C ATOM 717 O GLU A 46 -14.172 10.884 3.052 1.00 0.00 O ATOM 718 CB GLU A 46 -16.361 9.555 1.058 1.00 0.00 C ATOM 719 CG GLU A 46 -16.521 9.292 -0.430 1.00 0.00 C ATOM 720 CD GLU A 46 -17.467 10.271 -1.097 1.00 0.00 C ATOM 721 OE1 GLU A 46 -17.101 11.458 -1.224 1.00 0.00 O ATOM 722 OE2 GLU A 46 -18.575 9.851 -1.492 1.00 0.00 O ATOM 0 H GLU A 46 -15.743 7.202 1.449 1.00 0.00 H new ATOM 0 HA GLU A 46 -14.217 9.499 0.922 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -17.134 9.011 1.600 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -16.523 10.615 1.251 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -15.545 9.350 -0.912 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -16.890 8.277 -0.578 1.00 0.00 H new ATOM 729 N ILE A 47 -15.231 9.150 4.019 1.00 0.00 N ATOM 730 CA ILE A 47 -15.077 9.669 5.372 1.00 0.00 C ATOM 731 C ILE A 47 -13.643 9.499 5.865 1.00 0.00 C ATOM 732 O ILE A 47 -13.075 10.405 6.470 1.00 0.00 O ATOM 733 CB ILE A 47 -16.041 8.973 6.355 1.00 0.00 C ATOM 734 CG1 ILE A 47 -15.963 9.629 7.736 1.00 0.00 C ATOM 735 CG2 ILE A 47 -15.727 7.486 6.450 1.00 0.00 C ATOM 736 CD1 ILE A 47 -17.051 10.653 7.980 1.00 0.00 C ATOM 0 H ILE A 47 -15.721 8.257 3.963 1.00 0.00 H new ATOM 0 HA ILE A 47 -15.319 10.731 5.335 1.00 0.00 H new ATOM 0 HB ILE A 47 -17.058 9.085 5.978 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -16.025 8.855 8.501 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.991 10.110 7.847 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -16.417 7.012 7.148 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -15.834 7.028 5.467 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -14.705 7.352 6.803 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -16.934 11.077 8.977 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -16.977 11.447 7.237 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -18.027 10.173 7.902 1.00 0.00 H new ATOM 748 N TYR A 48 -13.065 8.329 5.604 1.00 0.00 N ATOM 749 CA TYR A 48 -11.697 8.035 6.025 1.00 0.00 C ATOM 750 C TYR A 48 -10.732 9.133 5.584 1.00 0.00 C ATOM 751 O TYR A 48 -9.862 9.552 6.348 1.00 0.00 O ATOM 752 CB TYR A 48 -11.244 6.691 5.452 1.00 0.00 C ATOM 753 CG TYR A 48 -11.631 5.504 6.306 1.00 0.00 C ATOM 754 CD1 TYR A 48 -12.955 5.280 6.659 1.00 0.00 C ATOM 755 CD2 TYR A 48 -10.670 4.608 6.757 1.00 0.00 C ATOM 756 CE1 TYR A 48 -13.311 4.196 7.440 1.00 0.00 C ATOM 757 CE2 TYR A 48 -11.018 3.522 7.537 1.00 0.00 C ATOM 758 CZ TYR A 48 -12.339 3.321 7.876 1.00 0.00 C ATOM 759 OH TYR A 48 -12.689 2.241 8.653 1.00 0.00 O ATOM 0 H TYR A 48 -13.523 7.568 5.102 1.00 0.00 H new ATOM 0 HA TYR A 48 -11.688 7.987 7.114 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -11.673 6.567 4.458 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -10.161 6.704 5.333 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -13.719 5.963 6.318 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -9.634 4.763 6.494 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -14.345 4.036 7.707 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.259 2.834 7.879 1.00 0.00 H new ATOM 0 HH TYR A 48 -11.887 1.724 8.874 1.00 0.00 H new ATOM 769 N GLN A 49 -10.887 9.591 4.346 1.00 0.00 N ATOM 770 CA GLN A 49 -10.023 10.636 3.806 1.00 0.00 C ATOM 771 C GLN A 49 -10.490 12.021 4.244 1.00 0.00 C ATOM 772 O GLN A 49 -9.677 12.882 4.584 1.00 0.00 O ATOM 773 CB GLN A 49 -9.992 10.558 2.279 1.00 0.00 C ATOM 774 CG GLN A 49 -11.341 10.820 1.630 1.00 0.00 C ATOM 775 CD GLN A 49 -11.352 10.485 0.151 1.00 0.00 C ATOM 776 OE1 GLN A 49 -11.150 11.355 -0.696 1.00 0.00 O ATOM 777 NE2 GLN A 49 -11.589 9.217 -0.167 1.00 0.00 N ATOM 0 H GLN A 49 -11.601 9.256 3.699 1.00 0.00 H new ATOM 0 HA GLN A 49 -9.018 10.475 4.197 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -9.269 11.281 1.901 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.640 9.570 1.981 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -12.105 10.231 2.138 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -11.606 11.869 1.763 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -11.751 8.529 0.568 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.609 8.932 -1.146 1.00 0.00 H new ATOM 786 N ARG A 50 -11.803 12.234 4.221 1.00 0.00 N ATOM 787 CA ARG A 50 -12.382 13.518 4.599 1.00 0.00 C ATOM 788 C ARG A 50 -12.317 13.766 6.109 1.00 0.00 C ATOM 789 O ARG A 50 -12.769 14.806 6.587 1.00 0.00 O ATOM 790 CB ARG A 50 -13.836 13.598 4.128 1.00 0.00 C ATOM 791 CG ARG A 50 -13.978 13.831 2.632 1.00 0.00 C ATOM 792 CD ARG A 50 -14.910 14.995 2.333 1.00 0.00 C ATOM 793 NE ARG A 50 -16.280 14.552 2.088 1.00 0.00 N ATOM 794 CZ ARG A 50 -17.340 15.355 2.141 1.00 0.00 C ATOM 795 NH1 ARG A 50 -17.193 16.642 2.430 1.00 0.00 N ATOM 796 NH2 ARG A 50 -18.551 14.869 1.905 1.00 0.00 N ATOM 0 H ARG A 50 -12.487 11.531 3.943 1.00 0.00 H new ATOM 0 HA ARG A 50 -11.789 14.292 4.112 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -14.347 12.672 4.393 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -14.339 14.404 4.662 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -12.997 14.029 2.199 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -14.360 12.927 2.157 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -14.899 15.692 3.171 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -14.544 15.538 1.462 1.00 0.00 H new ATOM 0 HE ARG A 50 -16.433 13.569 1.863 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -16.264 17.021 2.613 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -18.009 17.252 2.469 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -18.669 13.881 1.683 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -19.364 15.484 1.945 1.00 0.00 H new ATOM 810 N ILE A 51 -11.759 12.818 6.859 1.00 0.00 N ATOM 811 CA ILE A 51 -11.652 12.961 8.307 1.00 0.00 C ATOM 812 C ILE A 51 -10.194 13.044 8.749 1.00 0.00 C ATOM 813 O ILE A 51 -9.830 13.894 9.561 1.00 0.00 O ATOM 814 CB ILE A 51 -12.346 11.797 9.047 1.00 0.00 C ATOM 815 CG1 ILE A 51 -12.417 12.089 10.547 1.00 0.00 C ATOM 816 CG2 ILE A 51 -11.618 10.484 8.793 1.00 0.00 C ATOM 817 CD1 ILE A 51 -13.544 11.363 11.250 1.00 0.00 C ATOM 0 H ILE A 51 -11.376 11.948 6.490 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.157 13.891 8.568 1.00 0.00 H new ATOM 0 HB ILE A 51 -13.361 11.702 8.662 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -11.470 11.808 11.009 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -12.538 13.162 10.695 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -12.125 9.678 9.324 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.617 10.269 7.724 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -10.591 10.563 9.148 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -13.535 11.616 12.310 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -14.497 11.662 10.814 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -13.413 10.287 11.133 1.00 0.00 H new ATOM 829 N GLN A 52 -9.364 12.159 8.208 1.00 0.00 N ATOM 830 CA GLN A 52 -7.947 12.139 8.548 1.00 0.00 C ATOM 831 C GLN A 52 -7.153 13.032 7.603 1.00 0.00 C ATOM 832 O GLN A 52 -6.367 13.872 8.042 1.00 0.00 O ATOM 833 CB GLN A 52 -7.408 10.709 8.496 1.00 0.00 C ATOM 834 CG GLN A 52 -7.799 9.867 9.700 1.00 0.00 C ATOM 835 CD GLN A 52 -6.997 10.214 10.939 1.00 0.00 C ATOM 836 OE1 GLN A 52 -6.217 11.167 10.941 1.00 0.00 O ATOM 837 NE2 GLN A 52 -7.185 9.441 12.003 1.00 0.00 N ATOM 0 H GLN A 52 -9.647 11.448 7.534 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.834 12.522 9.562 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.773 10.225 7.590 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -6.321 10.742 8.424 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.860 10.007 9.907 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -7.657 8.813 9.463 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -7.841 8.662 11.958 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -6.673 9.627 12.865 1.00 0.00 H new ATOM 846 N ALA A 53 -7.365 12.850 6.303 1.00 0.00 N ATOM 847 CA ALA A 53 -6.673 13.642 5.300 1.00 0.00 C ATOM 848 C ALA A 53 -7.254 15.048 5.223 1.00 0.00 C ATOM 849 O ALA A 53 -6.519 16.033 5.149 1.00 0.00 O ATOM 850 CB ALA A 53 -6.751 12.960 3.942 1.00 0.00 C ATOM 0 H ALA A 53 -8.012 12.159 5.922 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.626 13.723 5.591 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -6.228 13.565 3.201 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -6.285 11.976 4.002 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -7.795 12.850 3.650 1.00 0.00 H new ATOM 856 N GLU A 54 -8.581 15.133 5.246 1.00 0.00 N ATOM 857 CA GLU A 54 -9.265 16.418 5.183 1.00 0.00 C ATOM 858 C GLU A 54 -9.762 16.831 6.566 1.00 0.00 C ATOM 859 O GLU A 54 -10.571 16.136 7.182 1.00 0.00 O ATOM 860 CB GLU A 54 -10.431 16.354 4.195 1.00 0.00 C ATOM 861 CG GLU A 54 -10.498 17.549 3.258 1.00 0.00 C ATOM 862 CD GLU A 54 -9.544 17.427 2.087 1.00 0.00 C ATOM 863 OE1 GLU A 54 -8.316 17.416 2.319 1.00 0.00 O ATOM 864 OE2 GLU A 54 -10.023 17.340 0.937 1.00 0.00 O ATOM 0 H GLU A 54 -9.203 14.327 5.308 1.00 0.00 H new ATOM 0 HA GLU A 54 -8.555 17.168 4.835 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.346 15.443 3.603 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.366 16.286 4.752 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.516 17.655 2.883 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.268 18.457 3.816 1.00 0.00 H new ATOM 871 N LYS A 55 -9.258 17.962 7.046 1.00 0.00 N ATOM 872 CA LYS A 55 -9.621 18.482 8.352 1.00 0.00 C ATOM 873 C LYS A 55 -11.132 18.626 8.506 1.00 0.00 C ATOM 874 O LYS A 55 -11.708 19.650 8.138 1.00 0.00 O ATOM 875 CB LYS A 55 -8.946 19.835 8.586 1.00 0.00 C ATOM 876 CG LYS A 55 -9.264 20.866 7.516 1.00 0.00 C ATOM 877 CD LYS A 55 -8.082 21.786 7.259 1.00 0.00 C ATOM 878 CE LYS A 55 -7.930 22.098 5.779 1.00 0.00 C ATOM 879 NZ LYS A 55 -6.510 22.351 5.407 1.00 0.00 N ATOM 0 H LYS A 55 -8.588 18.541 6.539 1.00 0.00 H new ATOM 0 HA LYS A 55 -9.276 17.766 9.097 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -9.256 20.223 9.556 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -7.867 19.690 8.630 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -9.539 20.359 6.591 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -10.126 21.457 7.824 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -8.214 22.714 7.816 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.169 21.319 7.629 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -8.316 21.265 5.191 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -8.532 22.972 5.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -6.449 22.560 4.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -6.148 23.162 5.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -5.939 21.508 5.622 1.00 0.00 H new ATOM 893 N SER A 56 -11.769 17.596 9.054 1.00 0.00 N ATOM 894 CA SER A 56 -13.215 17.612 9.258 1.00 0.00 C ATOM 895 C SER A 56 -13.576 18.229 10.609 1.00 0.00 C ATOM 896 O SER A 56 -14.457 17.733 11.311 1.00 0.00 O ATOM 897 CB SER A 56 -13.779 16.193 9.167 1.00 0.00 C ATOM 898 OG SER A 56 -15.020 16.180 8.484 1.00 0.00 O ATOM 0 H SER A 56 -11.308 16.741 9.365 1.00 0.00 H new ATOM 0 HA SER A 56 -13.657 18.225 8.473 1.00 0.00 H new ATOM 0 HB2 SER A 56 -13.069 15.549 8.649 1.00 0.00 H new ATOM 0 HB3 SER A 56 -13.908 15.785 10.169 1.00 0.00 H new ATOM 0 HG SER A 56 -15.358 15.261 8.438 1.00 0.00 H new ATOM 904 N GLN A 57 -12.894 19.315 10.965 1.00 0.00 N ATOM 905 CA GLN A 57 -13.146 19.999 12.228 1.00 0.00 C ATOM 906 C GLN A 57 -12.822 19.098 13.415 1.00 0.00 C ATOM 907 O GLN A 57 -13.237 17.940 13.462 1.00 0.00 O ATOM 908 CB GLN A 57 -14.604 20.459 12.303 1.00 0.00 C ATOM 909 CG GLN A 57 -14.813 21.893 11.842 1.00 0.00 C ATOM 910 CD GLN A 57 -15.809 22.002 10.703 1.00 0.00 C ATOM 911 OE1 GLN A 57 -15.460 22.406 9.595 1.00 0.00 O ATOM 912 NE2 GLN A 57 -17.058 21.641 10.973 1.00 0.00 N ATOM 0 H GLN A 57 -12.162 19.740 10.395 1.00 0.00 H new ATOM 0 HA GLN A 57 -12.494 20.872 12.273 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -15.217 19.797 11.692 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -14.955 20.361 13.330 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -15.161 22.493 12.682 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -13.858 22.311 11.525 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -17.303 21.312 11.907 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -17.772 21.693 10.247 1.00 0.00 H new ATOM 921 N GLN A 58 -12.077 19.640 14.374 1.00 0.00 N ATOM 922 CA GLN A 58 -11.697 18.888 15.565 1.00 0.00 C ATOM 923 C GLN A 58 -11.929 19.715 16.826 1.00 0.00 C ATOM 924 O GLN A 58 -12.442 19.211 17.825 1.00 0.00 O ATOM 925 CB GLN A 58 -10.229 18.464 15.480 1.00 0.00 C ATOM 926 CG GLN A 58 -9.273 19.620 15.237 1.00 0.00 C ATOM 927 CD GLN A 58 -7.820 19.189 15.259 1.00 0.00 C ATOM 928 OE1 GLN A 58 -7.141 19.306 16.280 1.00 0.00 O ATOM 929 NE2 GLN A 58 -7.334 18.687 14.130 1.00 0.00 N ATOM 0 H GLN A 58 -11.725 20.597 14.349 1.00 0.00 H new ATOM 0 HA GLN A 58 -12.322 17.996 15.617 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -9.951 17.962 16.407 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -10.116 17.736 14.677 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -9.498 20.076 14.273 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -9.433 20.385 15.997 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -7.932 18.608 13.308 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -6.362 18.380 14.085 1.00 0.00 H new ATOM 938 N SER A 59 -11.550 20.989 16.772 1.00 0.00 N ATOM 939 CA SER A 59 -11.719 21.886 17.908 1.00 0.00 C ATOM 940 C SER A 59 -12.068 23.295 17.438 1.00 0.00 C ATOM 941 O SER A 59 -11.184 24.103 17.155 1.00 0.00 O ATOM 942 CB SER A 59 -10.444 21.919 18.753 1.00 0.00 C ATOM 943 OG SER A 59 -9.357 22.451 18.017 1.00 0.00 O ATOM 0 H SER A 59 -11.124 21.422 15.953 1.00 0.00 H new ATOM 0 HA SER A 59 -12.540 21.510 18.518 1.00 0.00 H new ATOM 0 HB2 SER A 59 -10.612 22.521 19.646 1.00 0.00 H new ATOM 0 HB3 SER A 59 -10.201 20.911 19.089 1.00 0.00 H new ATOM 0 HG SER A 59 -9.676 23.176 17.440 1.00 0.00 H new ATOM 949 N SER A 60 -13.363 23.581 17.355 1.00 0.00 N ATOM 950 CA SER A 60 -13.830 24.891 16.917 1.00 0.00 C ATOM 951 C SER A 60 -14.302 25.728 18.102 1.00 0.00 C ATOM 952 O SER A 60 -15.142 25.290 18.889 1.00 0.00 O ATOM 953 CB SER A 60 -14.965 24.737 15.903 1.00 0.00 C ATOM 954 OG SER A 60 -15.806 23.647 16.240 1.00 0.00 O ATOM 0 H SER A 60 -14.108 22.923 17.585 1.00 0.00 H new ATOM 0 HA SER A 60 -12.994 25.406 16.443 1.00 0.00 H new ATOM 0 HB2 SER A 60 -15.551 25.655 15.867 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.549 24.585 14.907 1.00 0.00 H new ATOM 0 HG SER A 60 -16.524 23.571 15.578 1.00 0.00 H new ATOM 960 N TYR A 61 -13.755 26.934 18.223 1.00 0.00 N ATOM 961 CA TYR A 61 -14.120 27.834 19.312 1.00 0.00 C ATOM 962 C TYR A 61 -13.838 27.193 20.667 1.00 0.00 C ATOM 963 O TYR A 61 -14.207 27.799 21.695 1.00 0.00 O ATOM 964 CB TYR A 61 -15.598 28.215 19.213 1.00 0.00 C ATOM 965 CG TYR A 61 -15.849 29.457 18.386 1.00 0.00 C ATOM 966 CD1 TYR A 61 -15.413 30.703 18.819 1.00 0.00 C ATOM 967 CD2 TYR A 61 -16.521 29.382 17.173 1.00 0.00 C ATOM 968 CE1 TYR A 61 -15.641 31.839 18.067 1.00 0.00 C ATOM 969 CE2 TYR A 61 -16.752 30.514 16.414 1.00 0.00 C ATOM 970 CZ TYR A 61 -16.310 31.740 16.866 1.00 0.00 C ATOM 971 OH TYR A 61 -16.539 32.869 16.114 1.00 0.00 O ATOM 972 OXT TYR A 61 -13.251 26.090 20.689 1.00 0.00 O ATOM 0 H TYR A 61 -13.058 27.310 17.581 1.00 0.00 H new ATOM 0 HA TYR A 61 -13.513 28.735 19.224 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -16.151 27.382 18.779 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -15.992 28.371 20.217 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -14.887 30.785 19.759 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -16.869 28.424 16.817 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -15.297 32.800 18.418 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -17.276 30.439 15.472 1.00 0.00 H new ATOM 0 HH TYR A 61 -17.021 32.625 15.296 1.00 0.00 H new TER 982 TYR A 61 ATOM 983 N MET B 1 -0.467 13.316 4.855 1.00 0.00 N ATOM 984 CA MET B 1 -0.447 11.873 5.209 1.00 0.00 C ATOM 985 C MET B 1 -1.690 11.482 6.003 1.00 0.00 C ATOM 986 O MET B 1 -2.197 12.264 6.807 1.00 0.00 O ATOM 987 CB MET B 1 0.813 11.590 6.029 1.00 0.00 C ATOM 988 CG MET B 1 0.868 12.354 7.341 1.00 0.00 C ATOM 989 SD MET B 1 1.613 11.393 8.673 1.00 0.00 S ATOM 990 CE MET B 1 0.886 12.181 10.107 1.00 0.00 C ATOM 0 H1 MET B 1 0.473 13.728 5.024 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.717 13.424 3.851 1.00 0.00 H new ATOM 0 H3 MET B 1 -1.171 13.808 5.441 1.00 0.00 H new ATOM 0 HA MET B 1 -0.442 11.280 4.294 1.00 0.00 H new ATOM 0 HB2 MET B 1 0.869 10.522 6.238 1.00 0.00 H new ATOM 0 HB3 MET B 1 1.689 11.844 5.433 1.00 0.00 H new ATOM 0 HG2 MET B 1 1.437 13.273 7.199 1.00 0.00 H new ATOM 0 HG3 MET B 1 -0.142 12.646 7.630 1.00 0.00 H new ATOM 0 HE1 MET B 1 1.251 11.696 11.013 1.00 0.00 H new ATOM 0 HE2 MET B 1 1.163 13.235 10.123 1.00 0.00 H new ATOM 0 HE3 MET B 1 -0.199 12.092 10.060 1.00 0.00 H new ATOM 1002 N LEU B 2 -2.176 10.267 5.770 1.00 0.00 N ATOM 1003 CA LEU B 2 -3.360 9.771 6.462 1.00 0.00 C ATOM 1004 C LEU B 2 -3.005 8.599 7.373 1.00 0.00 C ATOM 1005 O LEU B 2 -2.769 7.488 6.901 1.00 0.00 O ATOM 1006 CB LEU B 2 -4.419 9.337 5.446 1.00 0.00 C ATOM 1007 CG LEU B 2 -5.782 8.976 6.040 1.00 0.00 C ATOM 1008 CD1 LEU B 2 -6.904 9.460 5.134 1.00 0.00 C ATOM 1009 CD2 LEU B 2 -5.887 7.475 6.264 1.00 0.00 C ATOM 0 H LEU B 2 -1.768 9.608 5.107 1.00 0.00 H new ATOM 0 HA LEU B 2 -3.760 10.578 7.076 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -4.557 10.141 4.723 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -4.040 8.475 4.896 1.00 0.00 H new ATOM 0 HG LEU B 2 -5.879 9.475 7.004 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -7.866 9.194 5.572 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -6.842 10.543 5.024 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -6.809 8.990 4.155 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -6.863 7.238 6.687 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -5.768 6.956 5.313 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -5.106 7.154 6.953 1.00 0.00 H new ATOM 1021 N ILE B 3 -2.971 8.847 8.681 1.00 0.00 N ATOM 1022 CA ILE B 3 -2.646 7.796 9.638 1.00 0.00 C ATOM 1023 C ILE B 3 -3.908 7.248 10.299 1.00 0.00 C ATOM 1024 O ILE B 3 -4.500 7.885 11.170 1.00 0.00 O ATOM 1025 CB ILE B 3 -1.653 8.291 10.714 1.00 0.00 C ATOM 1026 CG1 ILE B 3 -1.138 7.116 11.547 1.00 0.00 C ATOM 1027 CG2 ILE B 3 -2.295 9.342 11.609 1.00 0.00 C ATOM 1028 CD1 ILE B 3 0.310 7.263 11.968 1.00 0.00 C ATOM 0 H ILE B 3 -3.163 9.758 9.098 1.00 0.00 H new ATOM 0 HA ILE B 3 -2.166 6.992 9.080 1.00 0.00 H new ATOM 0 HB ILE B 3 -0.807 8.754 10.207 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -1.758 7.012 12.437 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -1.250 6.197 10.972 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -1.574 9.673 12.357 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -2.607 10.194 11.004 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -3.164 8.913 12.108 1.00 0.00 H new ATOM 0 HD11 ILE B 3 0.608 6.394 12.555 1.00 0.00 H new ATOM 0 HD12 ILE B 3 0.941 7.336 11.082 1.00 0.00 H new ATOM 0 HD13 ILE B 3 0.424 8.164 12.570 1.00 0.00 H new ATOM 1040 N LEU B 4 -4.304 6.051 9.879 1.00 0.00 N ATOM 1041 CA LEU B 4 -5.483 5.389 10.426 1.00 0.00 C ATOM 1042 C LEU B 4 -5.132 3.998 10.944 1.00 0.00 C ATOM 1043 O LEU B 4 -4.675 3.147 10.181 1.00 0.00 O ATOM 1044 CB LEU B 4 -6.578 5.290 9.363 1.00 0.00 C ATOM 1045 CG LEU B 4 -8.008 5.322 9.903 1.00 0.00 C ATOM 1046 CD1 LEU B 4 -8.929 6.047 8.934 1.00 0.00 C ATOM 1047 CD2 LEU B 4 -8.510 3.910 10.164 1.00 0.00 C ATOM 0 H LEU B 4 -3.822 5.516 9.156 1.00 0.00 H new ATOM 0 HA LEU B 4 -5.851 5.986 11.260 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -6.454 6.111 8.657 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -6.438 4.365 8.803 1.00 0.00 H new ATOM 0 HG LEU B 4 -8.008 5.867 10.847 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -9.942 6.060 9.335 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -8.580 7.071 8.797 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -8.926 5.531 7.974 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -9.529 3.951 10.548 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -8.495 3.341 9.234 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -7.866 3.424 10.897 1.00 0.00 H new ATOM 1059 N THR B 5 -5.344 3.758 12.234 1.00 0.00 N ATOM 1060 CA THR B 5 -5.042 2.452 12.809 1.00 0.00 C ATOM 1061 C THR B 5 -5.817 1.359 12.094 1.00 0.00 C ATOM 1062 O THR B 5 -6.923 1.586 11.605 1.00 0.00 O ATOM 1063 CB THR B 5 -5.370 2.411 14.300 1.00 0.00 C ATOM 1064 OG1 THR B 5 -5.637 3.711 14.798 1.00 0.00 O ATOM 1065 CG2 THR B 5 -4.255 1.816 15.130 1.00 0.00 C ATOM 0 H THR B 5 -5.719 4.440 12.893 1.00 0.00 H new ATOM 0 HA THR B 5 -3.973 2.281 12.681 1.00 0.00 H new ATOM 0 HB THR B 5 -6.251 1.776 14.388 1.00 0.00 H new ATOM 0 HG1 THR B 5 -5.846 3.659 15.754 1.00 0.00 H new ATOM 0 HG21 THR B 5 -4.545 1.813 16.181 1.00 0.00 H new ATOM 0 HG22 THR B 5 -4.064 0.794 14.804 1.00 0.00 H new ATOM 0 HG23 THR B 5 -3.351 2.412 15.005 1.00 0.00 H new ATOM 1073 N ARG B 6 -5.233 0.170 12.048 1.00 0.00 N ATOM 1074 CA ARG B 6 -5.869 -0.967 11.402 1.00 0.00 C ATOM 1075 C ARG B 6 -4.960 -2.187 11.428 1.00 0.00 C ATOM 1076 O ARG B 6 -3.738 -2.077 11.310 1.00 0.00 O ATOM 1077 CB ARG B 6 -6.243 -0.633 9.954 1.00 0.00 C ATOM 1078 CG ARG B 6 -7.564 -1.244 9.512 1.00 0.00 C ATOM 1079 CD ARG B 6 -8.731 -0.698 10.321 1.00 0.00 C ATOM 1080 NE ARG B 6 -9.209 -1.659 11.313 1.00 0.00 N ATOM 1081 CZ ARG B 6 -10.139 -2.580 11.070 1.00 0.00 C ATOM 1082 NH1 ARG B 6 -10.691 -2.680 9.867 1.00 0.00 N ATOM 1083 NH2 ARG B 6 -10.517 -3.408 12.035 1.00 0.00 N ATOM 0 H ARG B 6 -4.318 -0.032 12.451 1.00 0.00 H new ATOM 0 HA ARG B 6 -6.778 -1.195 11.958 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -6.297 0.450 9.842 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -5.451 -0.983 9.292 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -7.725 -1.037 8.454 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -7.519 -2.328 9.622 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -8.425 0.220 10.824 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -9.547 -0.436 9.648 1.00 0.00 H new ATOM 0 HE ARG B 6 -8.805 -1.622 12.249 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -10.403 -2.048 9.120 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -11.403 -3.389 9.690 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -10.095 -3.338 12.961 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -11.229 -4.114 11.851 1.00 0.00 H new ATOM 1097 N ARG B 7 -5.573 -3.349 11.578 1.00 0.00 N ATOM 1098 CA ARG B 7 -4.844 -4.610 11.609 1.00 0.00 C ATOM 1099 C ARG B 7 -5.793 -5.785 11.396 1.00 0.00 C ATOM 1100 O ARG B 7 -5.527 -6.901 11.842 1.00 0.00 O ATOM 1101 CB ARG B 7 -4.102 -4.772 12.935 1.00 0.00 C ATOM 1102 CG ARG B 7 -3.083 -5.900 12.923 1.00 0.00 C ATOM 1103 CD ARG B 7 -3.034 -6.622 14.260 1.00 0.00 C ATOM 1104 NE ARG B 7 -1.668 -6.755 14.759 1.00 0.00 N ATOM 1105 CZ ARG B 7 -1.349 -7.379 15.891 1.00 0.00 C ATOM 1106 NH1 ARG B 7 -2.295 -7.930 16.642 1.00 0.00 N ATOM 1107 NH2 ARG B 7 -0.081 -7.454 16.272 1.00 0.00 N ATOM 0 H ARG B 7 -6.583 -3.447 11.681 1.00 0.00 H new ATOM 0 HA ARG B 7 -4.114 -4.598 10.799 1.00 0.00 H new ATOM 0 HB2 ARG B 7 -3.595 -3.837 13.176 1.00 0.00 H new ATOM 0 HB3 ARG B 7 -4.827 -4.955 13.728 1.00 0.00 H new ATOM 0 HG2 ARG B 7 -3.334 -6.609 12.134 1.00 0.00 H new ATOM 0 HG3 ARG B 7 -2.097 -5.498 12.689 1.00 0.00 H new ATOM 0 HD2 ARG B 7 -3.635 -6.078 14.988 1.00 0.00 H new ATOM 0 HD3 ARG B 7 -3.480 -7.611 14.155 1.00 0.00 H new ATOM 0 HE ARG B 7 -0.914 -6.346 14.208 1.00 0.00 H new ATOM 0 HH11 ARG B 7 -3.272 -7.876 16.353 1.00 0.00 H new ATOM 0 HH12 ARG B 7 -2.045 -8.407 17.508 1.00 0.00 H new ATOM 0 HH21 ARG B 7 0.650 -7.034 15.698 1.00 0.00 H new ATOM 0 HH22 ARG B 7 0.164 -7.932 17.139 1.00 0.00 H new ATOM 1121 N VAL B 8 -6.906 -5.522 10.718 1.00 0.00 N ATOM 1122 CA VAL B 8 -7.901 -6.552 10.454 1.00 0.00 C ATOM 1123 C VAL B 8 -8.308 -6.554 8.985 1.00 0.00 C ATOM 1124 O VAL B 8 -8.270 -7.590 8.321 1.00 0.00 O ATOM 1125 CB VAL B 8 -9.157 -6.356 11.327 1.00 0.00 C ATOM 1126 CG1 VAL B 8 -9.913 -7.667 11.477 1.00 0.00 C ATOM 1127 CG2 VAL B 8 -8.782 -5.788 12.692 1.00 0.00 C ATOM 0 H VAL B 8 -7.140 -4.603 10.342 1.00 0.00 H new ATOM 0 HA VAL B 8 -7.443 -7.510 10.703 1.00 0.00 H new ATOM 0 HB VAL B 8 -9.811 -5.639 10.830 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -10.796 -7.509 12.096 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -10.218 -8.025 10.494 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -9.267 -8.408 11.949 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -9.683 -5.658 13.292 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -8.105 -6.476 13.199 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -8.290 -4.824 12.562 1.00 0.00 H new ATOM 1137 N GLY B 9 -8.698 -5.386 8.481 1.00 0.00 N ATOM 1138 CA GLY B 9 -9.106 -5.279 7.092 1.00 0.00 C ATOM 1139 C GLY B 9 -9.146 -3.843 6.604 1.00 0.00 C ATOM 1140 O GLY B 9 -10.180 -3.180 6.688 1.00 0.00 O ATOM 0 H GLY B 9 -8.739 -4.514 9.009 1.00 0.00 H new ATOM 0 HA2 GLY B 9 -8.418 -5.851 6.470 1.00 0.00 H new ATOM 0 HA3 GLY B 9 -10.092 -5.727 6.971 1.00 0.00 H new ATOM 1144 N GLU B 10 -8.018 -3.363 6.088 1.00 0.00 N ATOM 1145 CA GLU B 10 -7.928 -1.998 5.580 1.00 0.00 C ATOM 1146 C GLU B 10 -7.829 -1.996 4.057 1.00 0.00 C ATOM 1147 O GLU B 10 -6.891 -1.443 3.483 1.00 0.00 O ATOM 1148 CB GLU B 10 -6.716 -1.284 6.183 1.00 0.00 C ATOM 1149 CG GLU B 10 -6.947 0.196 6.440 1.00 0.00 C ATOM 1150 CD GLU B 10 -6.106 1.083 5.543 1.00 0.00 C ATOM 1151 OE1 GLU B 10 -4.868 1.093 5.710 1.00 0.00 O ATOM 1152 OE2 GLU B 10 -6.685 1.768 4.674 1.00 0.00 O ATOM 0 H GLU B 10 -7.154 -3.899 6.011 1.00 0.00 H new ATOM 0 HA GLU B 10 -8.833 -1.466 5.871 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -6.449 -1.770 7.121 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -5.866 -1.399 5.511 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -8.001 0.427 6.287 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -6.719 0.420 7.482 1.00 0.00 H new ATOM 1159 N THR B 11 -8.802 -2.628 3.409 1.00 0.00 N ATOM 1160 CA THR B 11 -8.827 -2.711 1.953 1.00 0.00 C ATOM 1161 C THR B 11 -8.917 -1.328 1.315 1.00 0.00 C ATOM 1162 O THR B 11 -9.991 -0.729 1.254 1.00 0.00 O ATOM 1163 CB THR B 11 -10.005 -3.572 1.494 1.00 0.00 C ATOM 1164 OG1 THR B 11 -10.009 -4.818 2.168 1.00 0.00 O ATOM 1165 CG2 THR B 11 -9.995 -3.855 0.007 1.00 0.00 C ATOM 0 H THR B 11 -9.585 -3.091 3.870 1.00 0.00 H new ATOM 0 HA THR B 11 -7.893 -3.172 1.631 1.00 0.00 H new ATOM 0 HB THR B 11 -10.897 -2.992 1.732 1.00 0.00 H new ATOM 0 HG1 THR B 11 -10.771 -5.353 1.862 1.00 0.00 H new ATOM 0 HG21 THR B 11 -10.857 -4.470 -0.252 1.00 0.00 H new ATOM 0 HG22 THR B 11 -10.042 -2.915 -0.543 1.00 0.00 H new ATOM 0 HG23 THR B 11 -9.079 -4.384 -0.257 1.00 0.00 H new ATOM 1173 N LEU B 12 -7.783 -0.833 0.830 1.00 0.00 N ATOM 1174 CA LEU B 12 -7.730 0.473 0.180 1.00 0.00 C ATOM 1175 C LEU B 12 -7.459 0.303 -1.313 1.00 0.00 C ATOM 1176 O LEU B 12 -6.865 -0.691 -1.730 1.00 0.00 O ATOM 1177 CB LEU B 12 -6.656 1.356 0.844 1.00 0.00 C ATOM 1178 CG LEU B 12 -5.444 1.727 -0.024 1.00 0.00 C ATOM 1179 CD1 LEU B 12 -5.669 3.065 -0.713 1.00 0.00 C ATOM 1180 CD2 LEU B 12 -4.178 1.771 0.817 1.00 0.00 C ATOM 0 H LEU B 12 -6.886 -1.317 0.875 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.693 0.970 0.297 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -7.131 2.278 1.179 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -6.294 0.842 1.734 1.00 0.00 H new ATOM 0 HG LEU B 12 -5.324 0.960 -0.789 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -4.800 3.311 -1.323 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -6.553 3.003 -1.348 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -5.816 3.841 0.038 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.330 2.035 0.185 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -4.290 2.516 1.604 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -4.005 0.793 1.266 1.00 0.00 H new ATOM 1192 N MET B 13 -7.887 1.272 -2.117 1.00 0.00 N ATOM 1193 CA MET B 13 -7.668 1.200 -3.555 1.00 0.00 C ATOM 1194 C MET B 13 -7.133 2.519 -4.100 1.00 0.00 C ATOM 1195 O MET B 13 -7.889 3.460 -4.335 1.00 0.00 O ATOM 1196 CB MET B 13 -8.969 0.831 -4.269 1.00 0.00 C ATOM 1197 CG MET B 13 -8.769 0.394 -5.712 1.00 0.00 C ATOM 1198 SD MET B 13 -9.293 1.647 -6.899 1.00 0.00 S ATOM 1199 CE MET B 13 -10.539 0.744 -7.815 1.00 0.00 C ATOM 0 H MET B 13 -8.381 2.106 -1.801 1.00 0.00 H new ATOM 0 HA MET B 13 -6.922 0.427 -3.742 1.00 0.00 H new ATOM 0 HB2 MET B 13 -9.460 0.028 -3.720 1.00 0.00 H new ATOM 0 HB3 MET B 13 -9.641 1.689 -4.248 1.00 0.00 H new ATOM 0 HG2 MET B 13 -7.716 0.163 -5.875 1.00 0.00 H new ATOM 0 HG3 MET B 13 -9.328 -0.525 -5.890 1.00 0.00 H new ATOM 0 HE1 MET B 13 -10.729 1.246 -8.764 1.00 0.00 H new ATOM 0 HE2 MET B 13 -10.187 -0.270 -8.005 1.00 0.00 H new ATOM 0 HE3 MET B 13 -11.461 0.705 -7.234 1.00 0.00 H new ATOM 1209 N ILE B 14 -5.823 2.573 -4.306 1.00 0.00 N ATOM 1210 CA ILE B 14 -5.179 3.765 -4.832 1.00 0.00 C ATOM 1211 C ILE B 14 -4.511 3.471 -6.173 1.00 0.00 C ATOM 1212 O ILE B 14 -3.892 2.421 -6.348 1.00 0.00 O ATOM 1213 CB ILE B 14 -4.128 4.317 -3.847 1.00 0.00 C ATOM 1214 CG1 ILE B 14 -3.567 5.645 -4.358 1.00 0.00 C ATOM 1215 CG2 ILE B 14 -3.009 3.306 -3.630 1.00 0.00 C ATOM 1216 CD1 ILE B 14 -4.627 6.707 -4.549 1.00 0.00 C ATOM 0 H ILE B 14 -5.185 1.800 -4.115 1.00 0.00 H new ATOM 0 HA ILE B 14 -5.955 4.517 -4.972 1.00 0.00 H new ATOM 0 HB ILE B 14 -4.613 4.494 -2.887 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -2.819 6.010 -3.655 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -3.057 5.475 -5.306 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -2.279 3.716 -2.932 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -3.425 2.385 -3.221 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -2.522 3.093 -4.581 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -4.162 7.623 -4.913 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -5.363 6.360 -5.275 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -5.121 6.904 -3.597 1.00 0.00 H new ATOM 1228 N GLY B 15 -4.638 4.398 -7.116 1.00 0.00 N ATOM 1229 CA GLY B 15 -4.040 4.209 -8.426 1.00 0.00 C ATOM 1230 C GLY B 15 -5.061 4.271 -9.545 1.00 0.00 C ATOM 1231 O GLY B 15 -5.575 5.342 -9.866 1.00 0.00 O ATOM 0 H GLY B 15 -5.143 5.276 -6.998 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -3.281 4.974 -8.589 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -3.533 3.245 -8.454 1.00 0.00 H new ATOM 1235 N ASP B 16 -5.353 3.120 -10.142 1.00 0.00 N ATOM 1236 CA ASP B 16 -6.318 3.052 -11.236 1.00 0.00 C ATOM 1237 C ASP B 16 -7.151 1.768 -11.189 1.00 0.00 C ATOM 1238 O ASP B 16 -8.080 1.606 -11.979 1.00 0.00 O ATOM 1239 CB ASP B 16 -5.594 3.149 -12.580 1.00 0.00 C ATOM 1240 CG ASP B 16 -5.243 4.578 -12.946 1.00 0.00 C ATOM 1241 OD1 ASP B 16 -4.495 5.220 -12.179 1.00 0.00 O ATOM 1242 OD2 ASP B 16 -5.716 5.055 -13.999 1.00 0.00 O ATOM 0 H ASP B 16 -4.937 2.224 -9.888 1.00 0.00 H new ATOM 0 HA ASP B 16 -7.000 3.894 -11.122 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -4.683 2.552 -12.543 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -6.223 2.721 -13.360 1.00 0.00 H new ATOM 1247 N GLU B 17 -6.822 0.864 -10.261 1.00 0.00 N ATOM 1248 CA GLU B 17 -7.540 -0.405 -10.107 1.00 0.00 C ATOM 1249 C GLU B 17 -6.705 -1.380 -9.280 1.00 0.00 C ATOM 1250 O GLU B 17 -6.256 -2.411 -9.782 1.00 0.00 O ATOM 1251 CB GLU B 17 -7.866 -1.028 -11.474 1.00 0.00 C ATOM 1252 CG GLU B 17 -8.441 -2.434 -11.388 1.00 0.00 C ATOM 1253 CD GLU B 17 -9.541 -2.677 -12.402 1.00 0.00 C ATOM 1254 OE1 GLU B 17 -10.474 -1.850 -12.475 1.00 0.00 O ATOM 1255 OE2 GLU B 17 -9.470 -3.694 -13.124 1.00 0.00 O ATOM 0 H GLU B 17 -6.056 0.990 -9.600 1.00 0.00 H new ATOM 0 HA GLU B 17 -8.479 -0.202 -9.592 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -8.577 -0.386 -11.995 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -6.958 -1.053 -12.077 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -7.642 -3.159 -11.543 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -8.833 -2.601 -10.385 1.00 0.00 H new ATOM 1262 N VAL B 18 -6.486 -1.041 -8.014 1.00 0.00 N ATOM 1263 CA VAL B 18 -5.696 -1.873 -7.129 1.00 0.00 C ATOM 1264 C VAL B 18 -6.530 -2.393 -5.953 1.00 0.00 C ATOM 1265 O VAL B 18 -7.759 -2.403 -6.008 1.00 0.00 O ATOM 1266 CB VAL B 18 -4.483 -1.085 -6.604 1.00 0.00 C ATOM 1267 CG1 VAL B 18 -3.704 -0.475 -7.759 1.00 0.00 C ATOM 1268 CG2 VAL B 18 -4.914 -0.010 -5.618 1.00 0.00 C ATOM 0 H VAL B 18 -6.848 -0.191 -7.581 1.00 0.00 H new ATOM 0 HA VAL B 18 -5.349 -2.733 -7.702 1.00 0.00 H new ATOM 0 HB VAL B 18 -3.830 -1.780 -6.076 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -2.850 0.079 -7.369 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -3.352 -1.268 -8.419 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -4.351 0.202 -8.317 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -4.037 0.531 -5.263 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -5.594 0.685 -6.111 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -5.421 -0.474 -4.772 1.00 0.00 H new ATOM 1278 N THR B 19 -5.846 -2.819 -4.894 1.00 0.00 N ATOM 1279 CA THR B 19 -6.495 -3.342 -3.695 1.00 0.00 C ATOM 1280 C THR B 19 -5.434 -3.839 -2.719 1.00 0.00 C ATOM 1281 O THR B 19 -4.833 -4.891 -2.930 1.00 0.00 O ATOM 1282 CB THR B 19 -7.458 -4.481 -4.047 1.00 0.00 C ATOM 1283 OG1 THR B 19 -7.092 -5.092 -5.274 1.00 0.00 O ATOM 1284 CG2 THR B 19 -8.901 -4.033 -4.158 1.00 0.00 C ATOM 0 H THR B 19 -4.827 -2.811 -4.843 1.00 0.00 H new ATOM 0 HA THR B 19 -7.072 -2.541 -3.232 1.00 0.00 H new ATOM 0 HB THR B 19 -7.381 -5.189 -3.222 1.00 0.00 H new ATOM 0 HG1 THR B 19 -7.719 -5.817 -5.478 1.00 0.00 H new ATOM 0 HG21 THR B 19 -9.529 -4.888 -4.409 1.00 0.00 H new ATOM 0 HG22 THR B 19 -9.225 -3.612 -3.207 1.00 0.00 H new ATOM 0 HG23 THR B 19 -8.988 -3.277 -4.938 1.00 0.00 H new ATOM 1292 N VAL B 20 -5.187 -3.072 -1.663 1.00 0.00 N ATOM 1293 CA VAL B 20 -4.173 -3.443 -0.682 1.00 0.00 C ATOM 1294 C VAL B 20 -4.773 -3.723 0.693 1.00 0.00 C ATOM 1295 O VAL B 20 -5.177 -2.803 1.407 1.00 0.00 O ATOM 1296 CB VAL B 20 -3.102 -2.345 -0.545 1.00 0.00 C ATOM 1297 CG1 VAL B 20 -2.348 -2.168 -1.854 1.00 0.00 C ATOM 1298 CG2 VAL B 20 -3.731 -1.031 -0.105 1.00 0.00 C ATOM 0 H VAL B 20 -5.671 -2.196 -1.465 1.00 0.00 H new ATOM 0 HA VAL B 20 -3.714 -4.359 -1.053 1.00 0.00 H new ATOM 0 HB VAL B 20 -2.391 -2.654 0.221 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -1.595 -1.388 -1.738 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -1.861 -3.105 -2.123 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -3.047 -1.884 -2.641 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -2.957 -0.269 -0.014 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -4.467 -0.714 -0.844 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -4.221 -1.167 0.859 1.00 0.00 H new ATOM 1308 N THR B 21 -4.818 -5.000 1.060 1.00 0.00 N ATOM 1309 CA THR B 21 -5.353 -5.411 2.354 1.00 0.00 C ATOM 1310 C THR B 21 -4.216 -5.694 3.334 1.00 0.00 C ATOM 1311 O THR B 21 -3.488 -6.677 3.188 1.00 0.00 O ATOM 1312 CB THR B 21 -6.231 -6.654 2.197 1.00 0.00 C ATOM 1313 OG1 THR B 21 -6.809 -6.699 0.904 1.00 0.00 O ATOM 1314 CG2 THR B 21 -7.358 -6.721 3.205 1.00 0.00 C ATOM 0 H THR B 21 -4.489 -5.770 0.478 1.00 0.00 H new ATOM 0 HA THR B 21 -5.963 -4.598 2.749 1.00 0.00 H new ATOM 0 HB THR B 21 -5.565 -7.501 2.362 1.00 0.00 H new ATOM 0 HG1 THR B 21 -7.365 -7.502 0.822 1.00 0.00 H new ATOM 0 HG21 THR B 21 -7.942 -7.626 3.038 1.00 0.00 H new ATOM 0 HG22 THR B 21 -6.944 -6.737 4.213 1.00 0.00 H new ATOM 0 HG23 THR B 21 -8.001 -5.848 3.090 1.00 0.00 H new ATOM 1322 N VAL B 22 -4.062 -4.822 4.326 1.00 0.00 N ATOM 1323 CA VAL B 22 -3.006 -4.974 5.322 1.00 0.00 C ATOM 1324 C VAL B 22 -3.363 -6.034 6.362 1.00 0.00 C ATOM 1325 O VAL B 22 -3.630 -5.718 7.522 1.00 0.00 O ATOM 1326 CB VAL B 22 -2.714 -3.638 6.035 1.00 0.00 C ATOM 1327 CG1 VAL B 22 -3.957 -3.125 6.750 1.00 0.00 C ATOM 1328 CG2 VAL B 22 -1.552 -3.791 7.007 1.00 0.00 C ATOM 0 H VAL B 22 -4.655 -4.003 4.462 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.113 -5.295 4.786 1.00 0.00 H new ATOM 0 HB VAL B 22 -2.431 -2.903 5.282 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -3.728 -2.182 7.246 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -4.756 -2.969 6.025 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -4.278 -3.856 7.492 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -1.362 -2.838 7.500 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -1.801 -4.543 7.756 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -0.661 -4.102 6.462 1.00 0.00 H new ATOM 1338 N LEU B 23 -3.362 -7.294 5.940 1.00 0.00 N ATOM 1339 CA LEU B 23 -3.681 -8.399 6.836 1.00 0.00 C ATOM 1340 C LEU B 23 -2.415 -8.906 7.537 1.00 0.00 C ATOM 1341 O LEU B 23 -1.508 -8.123 7.821 1.00 0.00 O ATOM 1342 CB LEU B 23 -4.368 -9.528 6.053 1.00 0.00 C ATOM 1343 CG LEU B 23 -5.265 -10.478 6.870 1.00 0.00 C ATOM 1344 CD1 LEU B 23 -5.426 -10.005 8.313 1.00 0.00 C ATOM 1345 CD2 LEU B 23 -6.626 -10.624 6.206 1.00 0.00 C ATOM 0 H LEU B 23 -3.144 -7.575 4.984 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.369 -8.045 7.604 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -4.973 -9.079 5.265 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -3.597 -10.123 5.563 1.00 0.00 H new ATOM 0 HG LEU B 23 -4.775 -11.451 6.895 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -6.065 -10.702 8.855 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -4.448 -9.961 8.793 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -5.880 -9.014 8.323 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -7.248 -11.298 6.795 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -7.107 -9.648 6.144 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -6.500 -11.031 5.203 1.00 0.00 H new ATOM 1357 N GLY B 24 -2.352 -10.208 7.822 1.00 0.00 N ATOM 1358 CA GLY B 24 -1.190 -10.763 8.489 1.00 0.00 C ATOM 1359 C GLY B 24 -1.002 -10.192 9.877 1.00 0.00 C ATOM 1360 O GLY B 24 -0.187 -9.292 10.080 1.00 0.00 O ATOM 0 H GLY B 24 -3.084 -10.883 7.602 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -1.293 -11.846 8.554 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -0.300 -10.563 7.892 1.00 0.00 H new ATOM 1364 N VAL B 25 -1.766 -10.703 10.836 1.00 0.00 N ATOM 1365 CA VAL B 25 -1.683 -10.223 12.203 1.00 0.00 C ATOM 1366 C VAL B 25 -0.582 -10.937 12.984 1.00 0.00 C ATOM 1367 O VAL B 25 -0.713 -12.109 13.338 1.00 0.00 O ATOM 1368 CB VAL B 25 -3.029 -10.412 12.932 1.00 0.00 C ATOM 1369 CG1 VAL B 25 -2.930 -9.971 14.386 1.00 0.00 C ATOM 1370 CG2 VAL B 25 -4.135 -9.655 12.210 1.00 0.00 C ATOM 0 H VAL B 25 -2.447 -11.448 10.689 1.00 0.00 H new ATOM 0 HA VAL B 25 -1.442 -9.161 12.154 1.00 0.00 H new ATOM 0 HB VAL B 25 -3.276 -11.474 12.923 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -3.893 -10.115 14.876 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.171 -10.565 14.895 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -2.655 -8.917 14.429 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -5.078 -9.799 12.737 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -3.892 -8.593 12.184 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -4.228 -10.031 11.191 1.00 0.00 H new ATOM 1380 N LYS B 26 0.504 -10.216 13.244 1.00 0.00 N ATOM 1381 CA LYS B 26 1.637 -10.769 13.979 1.00 0.00 C ATOM 1382 C LYS B 26 2.113 -9.796 15.054 1.00 0.00 C ATOM 1383 O LYS B 26 2.164 -8.587 14.831 1.00 0.00 O ATOM 1384 CB LYS B 26 2.784 -11.092 13.020 1.00 0.00 C ATOM 1385 CG LYS B 26 2.734 -12.507 12.466 1.00 0.00 C ATOM 1386 CD LYS B 26 3.649 -13.444 13.240 1.00 0.00 C ATOM 1387 CE LYS B 26 2.863 -14.549 13.929 1.00 0.00 C ATOM 1388 NZ LYS B 26 2.890 -15.818 13.151 1.00 0.00 N ATOM 0 H LYS B 26 0.624 -9.245 12.956 1.00 0.00 H new ATOM 0 HA LYS B 26 1.311 -11.688 14.466 1.00 0.00 H new ATOM 0 HB2 LYS B 26 2.763 -10.385 12.191 1.00 0.00 H new ATOM 0 HB3 LYS B 26 3.732 -10.947 13.538 1.00 0.00 H new ATOM 0 HG2 LYS B 26 1.710 -12.879 12.509 1.00 0.00 H new ATOM 0 HG3 LYS B 26 3.026 -12.498 11.416 1.00 0.00 H new ATOM 0 HD2 LYS B 26 4.379 -13.885 12.561 1.00 0.00 H new ATOM 0 HD3 LYS B 26 4.208 -12.876 13.984 1.00 0.00 H new ATOM 0 HE2 LYS B 26 3.277 -14.723 14.922 1.00 0.00 H new ATOM 0 HE3 LYS B 26 1.830 -14.229 14.065 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 2.343 -16.545 13.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 2.472 -15.659 12.212 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 3.874 -16.138 13.042 1.00 0.00 H new ATOM 1402 N GLY B 27 2.449 -10.334 16.224 1.00 0.00 N ATOM 1403 CA GLY B 27 2.906 -9.509 17.331 1.00 0.00 C ATOM 1404 C GLY B 27 3.901 -8.435 16.924 1.00 0.00 C ATOM 1405 O GLY B 27 3.731 -7.267 17.273 1.00 0.00 O ATOM 0 H GLY B 27 2.413 -11.333 16.426 1.00 0.00 H new ATOM 0 HA2 GLY B 27 2.043 -9.034 17.798 1.00 0.00 H new ATOM 0 HA3 GLY B 27 3.364 -10.149 18.084 1.00 0.00 H new ATOM 1409 N ASN B 28 4.946 -8.824 16.199 1.00 0.00 N ATOM 1410 CA ASN B 28 5.965 -7.872 15.769 1.00 0.00 C ATOM 1411 C ASN B 28 5.772 -7.470 14.306 1.00 0.00 C ATOM 1412 O ASN B 28 5.112 -6.474 14.012 1.00 0.00 O ATOM 1413 CB ASN B 28 7.363 -8.459 15.980 1.00 0.00 C ATOM 1414 CG ASN B 28 7.794 -8.416 17.433 1.00 0.00 C ATOM 1415 OD1 ASN B 28 8.273 -7.392 17.921 1.00 0.00 O ATOM 1416 ND2 ASN B 28 7.627 -9.532 18.134 1.00 0.00 N ATOM 0 H ASN B 28 5.109 -9.785 15.899 1.00 0.00 H new ATOM 0 HA ASN B 28 5.862 -6.974 16.378 1.00 0.00 H new ATOM 0 HB2 ASN B 28 7.377 -9.491 15.630 1.00 0.00 H new ATOM 0 HB3 ASN B 28 8.081 -7.907 15.374 1.00 0.00 H new ATOM 0 HD21 ASN B 28 7.900 -9.563 19.116 1.00 0.00 H new ATOM 0 HD22 ASN B 28 7.226 -10.358 17.690 1.00 0.00 H new ATOM 1423 N GLN B 29 6.353 -8.244 13.391 1.00 0.00 N ATOM 1424 CA GLN B 29 6.241 -7.954 11.966 1.00 0.00 C ATOM 1425 C GLN B 29 4.956 -8.540 11.392 1.00 0.00 C ATOM 1426 O GLN B 29 4.733 -9.749 11.447 1.00 0.00 O ATOM 1427 CB GLN B 29 7.454 -8.505 11.214 1.00 0.00 C ATOM 1428 CG GLN B 29 8.783 -7.993 11.745 1.00 0.00 C ATOM 1429 CD GLN B 29 9.358 -8.878 12.833 1.00 0.00 C ATOM 1430 OE1 GLN B 29 9.689 -8.408 13.922 1.00 0.00 O ATOM 1431 NE2 GLN B 29 9.481 -10.168 12.544 1.00 0.00 N ATOM 0 H GLN B 29 6.904 -9.074 13.612 1.00 0.00 H new ATOM 0 HA GLN B 29 6.210 -6.872 11.841 1.00 0.00 H new ATOM 0 HB2 GLN B 29 7.444 -9.593 11.273 1.00 0.00 H new ATOM 0 HB3 GLN B 29 7.368 -8.242 10.160 1.00 0.00 H new ATOM 0 HG2 GLN B 29 9.496 -7.925 10.923 1.00 0.00 H new ATOM 0 HG3 GLN B 29 8.649 -6.984 12.136 1.00 0.00 H new ATOM 0 HE21 GLN B 29 9.194 -10.515 11.629 1.00 0.00 H new ATOM 0 HE22 GLN B 29 9.862 -10.812 13.237 1.00 0.00 H new ATOM 1440 N VAL B 30 4.105 -7.669 10.859 1.00 0.00 N ATOM 1441 CA VAL B 30 2.828 -8.090 10.294 1.00 0.00 C ATOM 1442 C VAL B 30 2.934 -8.346 8.796 1.00 0.00 C ATOM 1443 O VAL B 30 3.542 -7.566 8.063 1.00 0.00 O ATOM 1444 CB VAL B 30 1.734 -7.035 10.543 1.00 0.00 C ATOM 1445 CG1 VAL B 30 1.395 -6.951 12.024 1.00 0.00 C ATOM 1446 CG2 VAL B 30 2.170 -5.678 10.009 1.00 0.00 C ATOM 0 H VAL B 30 4.277 -6.665 10.807 1.00 0.00 H new ATOM 0 HA VAL B 30 2.557 -9.019 10.795 1.00 0.00 H new ATOM 0 HB VAL B 30 0.835 -7.339 10.008 1.00 0.00 H new ATOM 0 HG11 VAL B 30 0.620 -6.200 12.178 1.00 0.00 H new ATOM 0 HG12 VAL B 30 1.035 -7.920 12.370 1.00 0.00 H new ATOM 0 HG13 VAL B 30 2.287 -6.673 12.586 1.00 0.00 H new ATOM 0 HG21 VAL B 30 1.385 -4.945 10.194 1.00 0.00 H new ATOM 0 HG22 VAL B 30 3.084 -5.365 10.513 1.00 0.00 H new ATOM 0 HG23 VAL B 30 2.354 -5.751 8.937 1.00 0.00 H new ATOM 1456 N ARG B 31 2.321 -9.438 8.343 1.00 0.00 N ATOM 1457 CA ARG B 31 2.327 -9.788 6.938 1.00 0.00 C ATOM 1458 C ARG B 31 1.334 -8.918 6.179 1.00 0.00 C ATOM 1459 O ARG B 31 0.123 -9.122 6.265 1.00 0.00 O ATOM 1460 CB ARG B 31 1.991 -11.270 6.753 1.00 0.00 C ATOM 1461 CG ARG B 31 3.165 -12.198 7.027 1.00 0.00 C ATOM 1462 CD ARG B 31 3.640 -12.893 5.761 1.00 0.00 C ATOM 1463 NE ARG B 31 4.669 -13.893 6.040 1.00 0.00 N ATOM 1464 CZ ARG B 31 5.511 -14.367 5.124 1.00 0.00 C ATOM 1465 NH1 ARG B 31 5.449 -13.937 3.870 1.00 0.00 N ATOM 1466 NH2 ARG B 31 6.416 -15.274 5.464 1.00 0.00 N ATOM 0 H ARG B 31 1.814 -10.093 8.938 1.00 0.00 H new ATOM 0 HA ARG B 31 3.325 -9.611 6.538 1.00 0.00 H new ATOM 0 HB2 ARG B 31 1.168 -11.533 7.417 1.00 0.00 H new ATOM 0 HB3 ARG B 31 1.642 -11.430 5.733 1.00 0.00 H new ATOM 0 HG2 ARG B 31 3.987 -11.627 7.459 1.00 0.00 H new ATOM 0 HG3 ARG B 31 2.874 -12.945 7.765 1.00 0.00 H new ATOM 0 HD2 ARG B 31 2.793 -13.372 5.270 1.00 0.00 H new ATOM 0 HD3 ARG B 31 4.034 -12.151 5.066 1.00 0.00 H new ATOM 0 HE ARG B 31 4.747 -14.249 6.993 1.00 0.00 H new ATOM 0 HH11 ARG B 31 4.754 -13.240 3.604 1.00 0.00 H new ATOM 0 HH12 ARG B 31 6.097 -14.304 3.173 1.00 0.00 H new ATOM 0 HH21 ARG B 31 6.467 -15.608 6.426 1.00 0.00 H new ATOM 0 HH22 ARG B 31 7.062 -15.638 4.763 1.00 0.00 H new ATOM 1480 N ILE B 32 1.849 -7.932 5.455 1.00 0.00 N ATOM 1481 CA ILE B 32 0.998 -7.015 4.707 1.00 0.00 C ATOM 1482 C ILE B 32 0.683 -7.556 3.319 1.00 0.00 C ATOM 1483 O ILE B 32 1.577 -7.980 2.589 1.00 0.00 O ATOM 1484 CB ILE B 32 1.658 -5.628 4.568 1.00 0.00 C ATOM 1485 CG1 ILE B 32 2.340 -5.225 5.879 1.00 0.00 C ATOM 1486 CG2 ILE B 32 0.625 -4.588 4.161 1.00 0.00 C ATOM 1487 CD1 ILE B 32 3.083 -3.910 5.795 1.00 0.00 C ATOM 0 H ILE B 32 2.848 -7.747 5.370 1.00 0.00 H new ATOM 0 HA ILE B 32 0.070 -6.917 5.270 1.00 0.00 H new ATOM 0 HB ILE B 32 2.418 -5.682 3.789 1.00 0.00 H new ATOM 0 HG12 ILE B 32 1.588 -5.158 6.665 1.00 0.00 H new ATOM 0 HG13 ILE B 32 3.038 -6.009 6.172 1.00 0.00 H new ATOM 0 HG21 ILE B 32 1.106 -3.615 4.067 1.00 0.00 H new ATOM 0 HG22 ILE B 32 0.184 -4.868 3.205 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -0.156 -4.535 4.919 1.00 0.00 H new ATOM 0 HD11 ILE B 32 3.541 -3.688 6.759 1.00 0.00 H new ATOM 0 HD12 ILE B 32 3.859 -3.978 5.032 1.00 0.00 H new ATOM 0 HD13 ILE B 32 2.386 -3.114 5.533 1.00 0.00 H new ATOM 1499 N GLY B 33 -0.598 -7.530 2.960 1.00 0.00 N ATOM 1500 CA GLY B 33 -1.018 -8.014 1.659 1.00 0.00 C ATOM 1501 C GLY B 33 -1.309 -6.885 0.696 1.00 0.00 C ATOM 1502 O GLY B 33 -2.283 -6.153 0.866 1.00 0.00 O ATOM 0 H GLY B 33 -1.353 -7.181 3.550 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -0.239 -8.653 1.242 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -1.909 -8.631 1.773 1.00 0.00 H new ATOM 1506 N VAL B 34 -0.461 -6.736 -0.314 1.00 0.00 N ATOM 1507 CA VAL B 34 -0.638 -5.679 -1.298 1.00 0.00 C ATOM 1508 C VAL B 34 -1.032 -6.242 -2.659 1.00 0.00 C ATOM 1509 O VAL B 34 -0.194 -6.765 -3.394 1.00 0.00 O ATOM 1510 CB VAL B 34 0.649 -4.845 -1.457 1.00 0.00 C ATOM 1511 CG1 VAL B 34 0.409 -3.649 -2.369 1.00 0.00 C ATOM 1512 CG2 VAL B 34 1.164 -4.396 -0.098 1.00 0.00 C ATOM 0 H VAL B 34 0.352 -7.331 -0.472 1.00 0.00 H new ATOM 0 HA VAL B 34 -1.441 -5.040 -0.930 1.00 0.00 H new ATOM 0 HB VAL B 34 1.410 -5.473 -1.920 1.00 0.00 H new ATOM 0 HG11 VAL B 34 1.331 -3.075 -2.467 1.00 0.00 H new ATOM 0 HG12 VAL B 34 0.093 -3.999 -3.352 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -0.369 -3.016 -1.942 1.00 0.00 H new ATOM 0 HG21 VAL B 34 2.073 -3.809 -0.229 1.00 0.00 H new ATOM 0 HG22 VAL B 34 0.406 -3.787 0.395 1.00 0.00 H new ATOM 0 HG23 VAL B 34 1.382 -5.270 0.515 1.00 0.00 H new ATOM 1522 N ASN B 35 -2.313 -6.123 -2.988 1.00 0.00 N ATOM 1523 CA ASN B 35 -2.817 -6.611 -4.264 1.00 0.00 C ATOM 1524 C ASN B 35 -2.870 -5.476 -5.280 1.00 0.00 C ATOM 1525 O ASN B 35 -3.713 -4.585 -5.191 1.00 0.00 O ATOM 1526 CB ASN B 35 -4.205 -7.234 -4.094 1.00 0.00 C ATOM 1527 CG ASN B 35 -4.357 -8.526 -4.873 1.00 0.00 C ATOM 1528 OD1 ASN B 35 -3.965 -8.613 -6.036 1.00 0.00 O ATOM 1529 ND2 ASN B 35 -4.929 -9.539 -4.233 1.00 0.00 N ATOM 0 H ASN B 35 -3.019 -5.694 -2.390 1.00 0.00 H new ATOM 0 HA ASN B 35 -2.137 -7.380 -4.631 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -4.387 -7.427 -3.037 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -4.963 -6.523 -4.423 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -5.058 -10.433 -4.706 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -5.239 -9.423 -3.268 1.00 0.00 H new ATOM 1536 N ALA B 36 -1.952 -5.513 -6.237 1.00 0.00 N ATOM 1537 CA ALA B 36 -1.881 -4.482 -7.265 1.00 0.00 C ATOM 1538 C ALA B 36 -1.652 -5.078 -8.651 1.00 0.00 C ATOM 1539 O ALA B 36 -0.961 -6.086 -8.798 1.00 0.00 O ATOM 1540 CB ALA B 36 -0.781 -3.485 -6.932 1.00 0.00 C ATOM 0 H ALA B 36 -1.247 -6.245 -6.323 1.00 0.00 H new ATOM 0 HA ALA B 36 -2.841 -3.966 -7.283 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -0.737 -2.719 -7.707 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -0.993 -3.017 -5.971 1.00 0.00 H new ATOM 0 HB3 ALA B 36 0.176 -4.003 -6.880 1.00 0.00 H new ATOM 1546 N PRO B 37 -2.231 -4.451 -9.691 1.00 0.00 N ATOM 1547 CA PRO B 37 -2.089 -4.909 -11.073 1.00 0.00 C ATOM 1548 C PRO B 37 -0.757 -4.489 -11.683 1.00 0.00 C ATOM 1549 O PRO B 37 -0.141 -3.518 -11.242 1.00 0.00 O ATOM 1550 CB PRO B 37 -3.245 -4.211 -11.784 1.00 0.00 C ATOM 1551 CG PRO B 37 -3.424 -2.936 -11.034 1.00 0.00 C ATOM 1552 CD PRO B 37 -3.068 -3.237 -9.600 1.00 0.00 C ATOM 0 HA PRO B 37 -2.109 -5.996 -11.155 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.013 -4.026 -12.833 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -4.151 -4.817 -11.760 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -2.782 -2.153 -11.438 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -4.451 -2.579 -11.113 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.525 -2.411 -9.141 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -3.958 -3.409 -8.995 1.00 0.00 H new ATOM 1560 N LYS B 38 -0.315 -5.222 -12.699 1.00 0.00 N ATOM 1561 CA LYS B 38 0.946 -4.920 -13.366 1.00 0.00 C ATOM 1562 C LYS B 38 0.728 -4.001 -14.567 1.00 0.00 C ATOM 1563 O LYS B 38 1.417 -4.119 -15.580 1.00 0.00 O ATOM 1564 CB LYS B 38 1.630 -6.211 -13.818 1.00 0.00 C ATOM 1565 CG LYS B 38 3.106 -6.038 -14.139 1.00 0.00 C ATOM 1566 CD LYS B 38 3.519 -6.873 -15.340 1.00 0.00 C ATOM 1567 CE LYS B 38 3.231 -6.151 -16.646 1.00 0.00 C ATOM 1568 NZ LYS B 38 1.857 -6.431 -17.146 1.00 0.00 N ATOM 0 H LYS B 38 -0.811 -6.029 -13.078 1.00 0.00 H new ATOM 0 HA LYS B 38 1.588 -4.405 -12.651 1.00 0.00 H new ATOM 0 HB2 LYS B 38 1.523 -6.962 -13.036 1.00 0.00 H new ATOM 0 HB3 LYS B 38 1.117 -6.594 -14.700 1.00 0.00 H new ATOM 0 HG2 LYS B 38 3.315 -4.987 -14.337 1.00 0.00 H new ATOM 0 HG3 LYS B 38 3.703 -6.324 -13.273 1.00 0.00 H new ATOM 0 HD2 LYS B 38 4.583 -7.102 -15.277 1.00 0.00 H new ATOM 0 HD3 LYS B 38 2.987 -7.824 -15.324 1.00 0.00 H new ATOM 0 HE2 LYS B 38 3.353 -5.077 -16.501 1.00 0.00 H new ATOM 0 HE3 LYS B 38 3.959 -6.456 -17.397 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 1.841 -6.349 -18.183 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 1.577 -7.394 -16.870 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 1.192 -5.746 -16.735 1.00 0.00 H new ATOM 1582 N GLU B 39 -0.232 -3.088 -14.450 1.00 0.00 N ATOM 1583 CA GLU B 39 -0.534 -2.154 -15.529 1.00 0.00 C ATOM 1584 C GLU B 39 -0.322 -0.711 -15.081 1.00 0.00 C ATOM 1585 O GLU B 39 0.169 0.119 -15.845 1.00 0.00 O ATOM 1586 CB GLU B 39 -1.974 -2.345 -16.008 1.00 0.00 C ATOM 1587 CG GLU B 39 -2.302 -3.777 -16.397 1.00 0.00 C ATOM 1588 CD GLU B 39 -3.422 -3.862 -17.415 1.00 0.00 C ATOM 1589 OE1 GLU B 39 -3.233 -3.373 -18.549 1.00 0.00 O ATOM 1590 OE2 GLU B 39 -4.489 -4.418 -17.079 1.00 0.00 O ATOM 0 H GLU B 39 -0.813 -2.975 -13.619 1.00 0.00 H new ATOM 0 HA GLU B 39 0.148 -2.361 -16.354 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -2.655 -2.027 -15.219 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -2.152 -1.695 -16.865 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -1.410 -4.253 -16.803 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.583 -4.337 -15.505 1.00 0.00 H new ATOM 1597 N VAL B 40 -0.696 -0.416 -13.839 1.00 0.00 N ATOM 1598 CA VAL B 40 -0.544 0.929 -13.296 1.00 0.00 C ATOM 1599 C VAL B 40 0.890 1.175 -12.839 1.00 0.00 C ATOM 1600 O VAL B 40 1.619 0.237 -12.518 1.00 0.00 O ATOM 1601 CB VAL B 40 -1.502 1.177 -12.112 1.00 0.00 C ATOM 1602 CG1 VAL B 40 -1.564 2.660 -11.778 1.00 0.00 C ATOM 1603 CG2 VAL B 40 -2.890 0.636 -12.423 1.00 0.00 C ATOM 0 H VAL B 40 -1.106 -1.089 -13.191 1.00 0.00 H new ATOM 0 HA VAL B 40 -0.793 1.623 -14.099 1.00 0.00 H new ATOM 0 HB VAL B 40 -1.118 0.646 -11.241 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -2.244 2.816 -10.941 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -0.569 3.014 -11.508 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -1.923 3.214 -12.646 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -3.551 0.821 -11.576 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -3.286 1.136 -13.307 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -2.829 -0.436 -12.609 1.00 0.00 H new ATOM 1613 N SER B 41 1.289 2.443 -12.815 1.00 0.00 N ATOM 1614 CA SER B 41 2.638 2.813 -12.402 1.00 0.00 C ATOM 1615 C SER B 41 2.923 2.345 -10.978 1.00 0.00 C ATOM 1616 O SER B 41 2.331 2.843 -10.021 1.00 0.00 O ATOM 1617 CB SER B 41 2.826 4.327 -12.500 1.00 0.00 C ATOM 1618 OG SER B 41 4.200 4.667 -12.586 1.00 0.00 O ATOM 0 H SER B 41 0.697 3.231 -13.077 1.00 0.00 H new ATOM 0 HA SER B 41 3.342 2.321 -13.073 1.00 0.00 H new ATOM 0 HB2 SER B 41 2.299 4.706 -13.376 1.00 0.00 H new ATOM 0 HB3 SER B 41 2.383 4.809 -11.628 1.00 0.00 H new ATOM 0 HG SER B 41 4.293 5.641 -12.649 1.00 0.00 H new ATOM 1624 N VAL B 42 3.836 1.388 -10.846 1.00 0.00 N ATOM 1625 CA VAL B 42 4.203 0.855 -9.540 1.00 0.00 C ATOM 1626 C VAL B 42 5.700 1.025 -9.283 1.00 0.00 C ATOM 1627 O VAL B 42 6.528 0.508 -10.034 1.00 0.00 O ATOM 1628 CB VAL B 42 3.833 -0.637 -9.417 1.00 0.00 C ATOM 1629 CG1 VAL B 42 4.590 -1.467 -10.444 1.00 0.00 C ATOM 1630 CG2 VAL B 42 4.105 -1.142 -8.007 1.00 0.00 C ATOM 0 H VAL B 42 4.335 0.966 -11.629 1.00 0.00 H new ATOM 0 HA VAL B 42 3.642 1.419 -8.795 1.00 0.00 H new ATOM 0 HB VAL B 42 2.767 -0.742 -9.617 1.00 0.00 H new ATOM 0 HG11 VAL B 42 4.314 -2.516 -10.339 1.00 0.00 H new ATOM 0 HG12 VAL B 42 4.337 -1.124 -11.447 1.00 0.00 H new ATOM 0 HG13 VAL B 42 5.662 -1.356 -10.282 1.00 0.00 H new ATOM 0 HG21 VAL B 42 3.838 -2.197 -7.940 1.00 0.00 H new ATOM 0 HG22 VAL B 42 5.163 -1.021 -7.775 1.00 0.00 H new ATOM 0 HG23 VAL B 42 3.509 -0.571 -7.295 1.00 0.00 H new ATOM 1640 N HIS B 43 6.044 1.737 -8.212 1.00 0.00 N ATOM 1641 CA HIS B 43 7.439 1.957 -7.851 1.00 0.00 C ATOM 1642 C HIS B 43 7.671 1.597 -6.387 1.00 0.00 C ATOM 1643 O HIS B 43 6.954 2.072 -5.507 1.00 0.00 O ATOM 1644 CB HIS B 43 7.832 3.414 -8.101 1.00 0.00 C ATOM 1645 CG HIS B 43 7.860 3.785 -9.551 1.00 0.00 C ATOM 1646 ND1 HIS B 43 8.956 4.358 -10.161 1.00 0.00 N ATOM 1647 CD2 HIS B 43 6.918 3.664 -10.517 1.00 0.00 C ATOM 1648 CE1 HIS B 43 8.689 4.573 -11.436 1.00 0.00 C ATOM 1649 NE2 HIS B 43 7.459 4.160 -11.678 1.00 0.00 N ATOM 0 H HIS B 43 5.373 2.172 -7.579 1.00 0.00 H new ATOM 0 HA HIS B 43 8.061 1.315 -8.474 1.00 0.00 H new ATOM 0 HB2 HIS B 43 7.130 4.066 -7.581 1.00 0.00 H new ATOM 0 HB3 HIS B 43 8.816 3.596 -7.669 1.00 0.00 H new ATOM 0 HD2 HIS B 43 5.926 3.254 -10.397 1.00 0.00 H new ATOM 0 HE1 HIS B 43 9.362 5.012 -12.158 1.00 0.00 H new ATOM 0 HE2 HIS B 43 6.987 4.202 -12.581 1.00 0.00 H new ATOM 1657 N ARG B 44 8.671 0.762 -6.125 1.00 0.00 N ATOM 1658 CA ARG B 44 8.979 0.355 -4.757 1.00 0.00 C ATOM 1659 C ARG B 44 10.204 -0.553 -4.718 1.00 0.00 C ATOM 1660 O ARG B 44 11.264 -0.158 -4.234 1.00 0.00 O ATOM 1661 CB ARG B 44 7.779 -0.355 -4.118 1.00 0.00 C ATOM 1662 CG ARG B 44 6.959 -1.194 -5.091 1.00 0.00 C ATOM 1663 CD ARG B 44 6.949 -2.665 -4.700 1.00 0.00 C ATOM 1664 NE ARG B 44 5.632 -3.101 -4.240 1.00 0.00 N ATOM 1665 CZ ARG B 44 5.209 -2.993 -2.981 1.00 0.00 C ATOM 1666 NH1 ARG B 44 5.992 -2.461 -2.050 1.00 0.00 N ATOM 1667 NH2 ARG B 44 3.996 -3.417 -2.653 1.00 0.00 N ATOM 0 H ARG B 44 9.279 0.356 -6.836 1.00 0.00 H new ATOM 0 HA ARG B 44 9.199 1.256 -4.185 1.00 0.00 H new ATOM 0 HB2 ARG B 44 8.137 -0.998 -3.314 1.00 0.00 H new ATOM 0 HB3 ARG B 44 7.129 0.392 -3.663 1.00 0.00 H new ATOM 0 HG2 ARG B 44 5.936 -0.819 -5.121 1.00 0.00 H new ATOM 0 HG3 ARG B 44 7.367 -1.088 -6.096 1.00 0.00 H new ATOM 0 HD2 ARG B 44 7.253 -3.269 -5.555 1.00 0.00 H new ATOM 0 HD3 ARG B 44 7.683 -2.836 -3.912 1.00 0.00 H new ATOM 0 HE ARG B 44 4.998 -3.513 -4.924 1.00 0.00 H new ATOM 0 HH11 ARG B 44 6.925 -2.131 -2.296 1.00 0.00 H new ATOM 0 HH12 ARG B 44 5.660 -2.382 -1.089 1.00 0.00 H new ATOM 0 HH21 ARG B 44 3.389 -3.825 -3.364 1.00 0.00 H new ATOM 0 HH22 ARG B 44 3.670 -3.335 -1.690 1.00 0.00 H new ATOM 1681 N GLU B 45 10.053 -1.770 -5.230 1.00 0.00 N ATOM 1682 CA GLU B 45 11.149 -2.731 -5.251 1.00 0.00 C ATOM 1683 C GLU B 45 10.930 -3.776 -6.340 1.00 0.00 C ATOM 1684 O GLU B 45 9.967 -4.545 -6.296 1.00 0.00 O ATOM 1685 CB GLU B 45 11.284 -3.412 -3.888 1.00 0.00 C ATOM 1686 CG GLU B 45 12.255 -2.713 -2.951 1.00 0.00 C ATOM 1687 CD GLU B 45 13.655 -2.622 -3.524 1.00 0.00 C ATOM 1688 OE1 GLU B 45 13.920 -1.678 -4.298 1.00 0.00 O ATOM 1689 OE2 GLU B 45 14.487 -3.495 -3.200 1.00 0.00 O ATOM 0 H GLU B 45 9.183 -2.114 -5.636 1.00 0.00 H new ATOM 0 HA GLU B 45 12.071 -2.193 -5.470 1.00 0.00 H new ATOM 0 HB2 GLU B 45 10.303 -3.456 -3.414 1.00 0.00 H new ATOM 0 HB3 GLU B 45 11.612 -4.441 -4.036 1.00 0.00 H new ATOM 0 HG2 GLU B 45 11.888 -1.709 -2.737 1.00 0.00 H new ATOM 0 HG3 GLU B 45 12.289 -3.249 -2.003 1.00 0.00 H new ATOM 1696 N GLU B 46 11.832 -3.801 -7.316 1.00 0.00 N ATOM 1697 CA GLU B 46 11.741 -4.752 -8.416 1.00 0.00 C ATOM 1698 C GLU B 46 11.809 -6.185 -7.902 1.00 0.00 C ATOM 1699 O GLU B 46 11.148 -7.077 -8.434 1.00 0.00 O ATOM 1700 CB GLU B 46 12.865 -4.506 -9.425 1.00 0.00 C ATOM 1701 CG GLU B 46 12.653 -3.267 -10.280 1.00 0.00 C ATOM 1702 CD GLU B 46 13.276 -3.396 -11.657 1.00 0.00 C ATOM 1703 OE1 GLU B 46 12.761 -4.193 -12.469 1.00 0.00 O ATOM 1704 OE2 GLU B 46 14.279 -2.700 -11.922 1.00 0.00 O ATOM 0 H GLU B 46 12.634 -3.173 -7.367 1.00 0.00 H new ATOM 0 HA GLU B 46 10.780 -4.607 -8.910 1.00 0.00 H new ATOM 0 HB2 GLU B 46 13.809 -4.410 -8.889 1.00 0.00 H new ATOM 0 HB3 GLU B 46 12.955 -5.376 -10.076 1.00 0.00 H new ATOM 0 HG2 GLU B 46 11.584 -3.081 -10.385 1.00 0.00 H new ATOM 0 HG3 GLU B 46 13.079 -2.402 -9.772 1.00 0.00 H new ATOM 1711 N ILE B 47 12.610 -6.399 -6.864 1.00 0.00 N ATOM 1712 CA ILE B 47 12.762 -7.724 -6.278 1.00 0.00 C ATOM 1713 C ILE B 47 11.537 -8.103 -5.451 1.00 0.00 C ATOM 1714 O ILE B 47 11.053 -9.231 -5.526 1.00 0.00 O ATOM 1715 CB ILE B 47 14.022 -7.806 -5.392 1.00 0.00 C ATOM 1716 CG1 ILE B 47 14.242 -9.240 -4.904 1.00 0.00 C ATOM 1717 CG2 ILE B 47 13.911 -6.850 -4.213 1.00 0.00 C ATOM 1718 CD1 ILE B 47 15.236 -10.017 -5.739 1.00 0.00 C ATOM 0 H ILE B 47 13.164 -5.671 -6.412 1.00 0.00 H new ATOM 0 HA ILE B 47 12.866 -8.427 -7.104 1.00 0.00 H new ATOM 0 HB ILE B 47 14.883 -7.511 -5.991 1.00 0.00 H new ATOM 0 HG12 ILE B 47 14.589 -9.214 -3.871 1.00 0.00 H new ATOM 0 HG13 ILE B 47 13.288 -9.766 -4.907 1.00 0.00 H new ATOM 0 HG21 ILE B 47 14.809 -6.923 -3.600 1.00 0.00 H new ATOM 0 HG22 ILE B 47 13.804 -5.830 -4.581 1.00 0.00 H new ATOM 0 HG23 ILE B 47 13.040 -7.112 -3.613 1.00 0.00 H new ATOM 0 HD11 ILE B 47 15.342 -11.024 -5.335 1.00 0.00 H new ATOM 0 HD12 ILE B 47 14.881 -10.074 -6.768 1.00 0.00 H new ATOM 0 HD13 ILE B 47 16.202 -9.514 -5.716 1.00 0.00 H new ATOM 1730 N TYR B 48 11.043 -7.155 -4.660 1.00 0.00 N ATOM 1731 CA TYR B 48 9.875 -7.388 -3.813 1.00 0.00 C ATOM 1732 C TYR B 48 8.714 -7.970 -4.616 1.00 0.00 C ATOM 1733 O TYR B 48 8.037 -8.894 -4.166 1.00 0.00 O ATOM 1734 CB TYR B 48 9.437 -6.083 -3.143 1.00 0.00 C ATOM 1735 CG TYR B 48 10.164 -5.791 -1.850 1.00 0.00 C ATOM 1736 CD1 TYR B 48 11.552 -5.731 -1.808 1.00 0.00 C ATOM 1737 CD2 TYR B 48 9.462 -5.574 -0.671 1.00 0.00 C ATOM 1738 CE1 TYR B 48 12.219 -5.464 -0.627 1.00 0.00 C ATOM 1739 CE2 TYR B 48 10.122 -5.306 0.513 1.00 0.00 C ATOM 1740 CZ TYR B 48 11.500 -5.253 0.530 1.00 0.00 C ATOM 1741 OH TYR B 48 12.160 -4.987 1.708 1.00 0.00 O ATOM 0 H TYR B 48 11.434 -6.216 -4.587 1.00 0.00 H new ATOM 0 HA TYR B 48 10.158 -8.111 -3.048 1.00 0.00 H new ATOM 0 HB2 TYR B 48 9.599 -5.257 -3.835 1.00 0.00 H new ATOM 0 HB3 TYR B 48 8.366 -6.128 -2.945 1.00 0.00 H new ATOM 0 HD1 TYR B 48 12.119 -5.896 -2.713 1.00 0.00 H new ATOM 0 HD2 TYR B 48 8.383 -5.615 -0.680 1.00 0.00 H new ATOM 0 HE1 TYR B 48 13.298 -5.421 -0.611 1.00 0.00 H new ATOM 0 HE2 TYR B 48 9.561 -5.139 1.421 1.00 0.00 H new ATOM 0 HH TYR B 48 11.507 -4.862 2.428 1.00 0.00 H new ATOM 1751 N GLN B 49 8.485 -7.419 -5.803 1.00 0.00 N ATOM 1752 CA GLN B 49 7.400 -7.882 -6.662 1.00 0.00 C ATOM 1753 C GLN B 49 7.812 -9.120 -7.454 1.00 0.00 C ATOM 1754 O GLN B 49 7.029 -10.058 -7.609 1.00 0.00 O ATOM 1755 CB GLN B 49 6.975 -6.769 -7.621 1.00 0.00 C ATOM 1756 CG GLN B 49 8.067 -6.356 -8.594 1.00 0.00 C ATOM 1757 CD GLN B 49 7.723 -5.089 -9.354 1.00 0.00 C ATOM 1758 OE1 GLN B 49 7.210 -5.141 -10.471 1.00 0.00 O ATOM 1759 NE2 GLN B 49 8.006 -3.941 -8.748 1.00 0.00 N ATOM 0 H GLN B 49 9.035 -6.653 -6.192 1.00 0.00 H new ATOM 0 HA GLN B 49 6.558 -8.150 -6.024 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.103 -7.100 -8.185 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.668 -5.899 -7.041 1.00 0.00 H new ATOM 0 HG2 GLN B 49 8.998 -6.206 -8.047 1.00 0.00 H new ATOM 0 HG3 GLN B 49 8.241 -7.165 -9.304 1.00 0.00 H new ATOM 0 HE21 GLN B 49 8.432 -3.945 -7.821 1.00 0.00 H new ATOM 0 HE22 GLN B 49 7.798 -3.056 -9.210 1.00 0.00 H new ATOM 1768 N ARG B 50 9.040 -9.110 -7.965 1.00 0.00 N ATOM 1769 CA ARG B 50 9.555 -10.223 -8.757 1.00 0.00 C ATOM 1770 C ARG B 50 9.865 -11.455 -7.902 1.00 0.00 C ATOM 1771 O ARG B 50 10.312 -12.476 -8.423 1.00 0.00 O ATOM 1772 CB ARG B 50 10.814 -9.791 -9.512 1.00 0.00 C ATOM 1773 CG ARG B 50 10.529 -8.902 -10.712 1.00 0.00 C ATOM 1774 CD ARG B 50 11.214 -9.419 -11.967 1.00 0.00 C ATOM 1775 NE ARG B 50 12.511 -8.782 -12.185 1.00 0.00 N ATOM 1776 CZ ARG B 50 13.452 -9.273 -12.988 1.00 0.00 C ATOM 1777 NH1 ARG B 50 13.246 -10.405 -13.650 1.00 0.00 N ATOM 1778 NH2 ARG B 50 14.603 -8.630 -13.129 1.00 0.00 N ATOM 0 H ARG B 50 9.699 -8.341 -7.844 1.00 0.00 H new ATOM 0 HA ARG B 50 8.773 -10.502 -9.463 1.00 0.00 H new ATOM 0 HB2 ARG B 50 11.475 -9.261 -8.826 1.00 0.00 H new ATOM 0 HB3 ARG B 50 11.349 -10.679 -9.847 1.00 0.00 H new ATOM 0 HG2 ARG B 50 9.453 -8.850 -10.879 1.00 0.00 H new ATOM 0 HG3 ARG B 50 10.869 -7.888 -10.503 1.00 0.00 H new ATOM 0 HD2 ARG B 50 11.349 -10.498 -11.888 1.00 0.00 H new ATOM 0 HD3 ARG B 50 10.573 -9.240 -12.830 1.00 0.00 H new ATOM 0 HE ARG B 50 12.707 -7.910 -11.693 1.00 0.00 H new ATOM 0 HH11 ARG B 50 12.363 -10.904 -13.545 1.00 0.00 H new ATOM 0 HH12 ARG B 50 13.971 -10.776 -14.264 1.00 0.00 H new ATOM 0 HH21 ARG B 50 14.767 -7.760 -12.622 1.00 0.00 H new ATOM 0 HH22 ARG B 50 15.325 -9.005 -13.744 1.00 0.00 H new ATOM 1792 N ILE B 51 9.632 -11.363 -6.594 1.00 0.00 N ATOM 1793 CA ILE B 51 9.897 -12.483 -5.697 1.00 0.00 C ATOM 1794 C ILE B 51 8.608 -13.009 -5.074 1.00 0.00 C ATOM 1795 O ILE B 51 8.380 -14.218 -5.025 1.00 0.00 O ATOM 1796 CB ILE B 51 10.885 -12.092 -4.577 1.00 0.00 C ATOM 1797 CG1 ILE B 51 11.318 -13.333 -3.795 1.00 0.00 C ATOM 1798 CG2 ILE B 51 10.265 -11.062 -3.642 1.00 0.00 C ATOM 1799 CD1 ILE B 51 12.663 -13.181 -3.117 1.00 0.00 C ATOM 0 H ILE B 51 9.263 -10.530 -6.135 1.00 0.00 H new ATOM 0 HA ILE B 51 10.347 -13.270 -6.302 1.00 0.00 H new ATOM 0 HB ILE B 51 11.766 -11.644 -5.038 1.00 0.00 H new ATOM 0 HG12 ILE B 51 10.564 -13.559 -3.041 1.00 0.00 H new ATOM 0 HG13 ILE B 51 11.356 -14.185 -4.474 1.00 0.00 H new ATOM 0 HG21 ILE B 51 10.980 -10.802 -2.861 1.00 0.00 H new ATOM 0 HG22 ILE B 51 10.004 -10.167 -4.208 1.00 0.00 H new ATOM 0 HG23 ILE B 51 9.366 -11.478 -3.187 1.00 0.00 H new ATOM 0 HD11 ILE B 51 12.906 -14.099 -2.581 1.00 0.00 H new ATOM 0 HD12 ILE B 51 13.429 -12.985 -3.868 1.00 0.00 H new ATOM 0 HD13 ILE B 51 12.624 -12.350 -2.413 1.00 0.00 H new ATOM 1811 N GLN B 52 7.767 -12.095 -4.600 1.00 0.00 N ATOM 1812 CA GLN B 52 6.502 -12.473 -3.984 1.00 0.00 C ATOM 1813 C GLN B 52 5.392 -12.539 -5.028 1.00 0.00 C ATOM 1814 O GLN B 52 4.663 -13.528 -5.110 1.00 0.00 O ATOM 1815 CB GLN B 52 6.128 -11.480 -2.883 1.00 0.00 C ATOM 1816 CG GLN B 52 6.913 -11.674 -1.596 1.00 0.00 C ATOM 1817 CD GLN B 52 6.435 -12.870 -0.797 1.00 0.00 C ATOM 1818 OE1 GLN B 52 5.583 -13.635 -1.251 1.00 0.00 O ATOM 1819 NE2 GLN B 52 6.981 -13.038 0.402 1.00 0.00 N ATOM 0 H GLN B 52 7.939 -11.090 -4.631 1.00 0.00 H new ATOM 0 HA GLN B 52 6.621 -13.462 -3.542 1.00 0.00 H new ATOM 0 HB2 GLN B 52 6.291 -10.466 -3.249 1.00 0.00 H new ATOM 0 HB3 GLN B 52 5.064 -11.574 -2.667 1.00 0.00 H new ATOM 0 HG2 GLN B 52 7.969 -11.799 -1.834 1.00 0.00 H new ATOM 0 HG3 GLN B 52 6.829 -10.776 -0.984 1.00 0.00 H new ATOM 0 HE21 GLN B 52 7.684 -12.380 0.739 1.00 0.00 H new ATOM 0 HE22 GLN B 52 6.698 -13.825 0.986 1.00 0.00 H new ATOM 1828 N ALA B 53 5.272 -11.484 -5.827 1.00 0.00 N ATOM 1829 CA ALA B 53 4.256 -11.426 -6.865 1.00 0.00 C ATOM 1830 C ALA B 53 4.638 -12.309 -8.047 1.00 0.00 C ATOM 1831 O ALA B 53 3.806 -13.038 -8.587 1.00 0.00 O ATOM 1832 CB ALA B 53 4.046 -9.990 -7.321 1.00 0.00 C ATOM 0 H ALA B 53 5.868 -10.658 -5.773 1.00 0.00 H new ATOM 0 HA ALA B 53 3.321 -11.800 -6.449 1.00 0.00 H new ATOM 0 HB1 ALA B 53 3.282 -9.963 -8.098 1.00 0.00 H new ATOM 0 HB2 ALA B 53 3.724 -9.383 -6.475 1.00 0.00 H new ATOM 0 HB3 ALA B 53 4.981 -9.594 -7.717 1.00 0.00 H new ATOM 1838 N GLU B 54 5.906 -12.240 -8.440 1.00 0.00 N ATOM 1839 CA GLU B 54 6.405 -13.034 -9.555 1.00 0.00 C ATOM 1840 C GLU B 54 7.220 -14.220 -9.051 1.00 0.00 C ATOM 1841 O GLU B 54 8.218 -14.049 -8.352 1.00 0.00 O ATOM 1842 CB GLU B 54 7.261 -12.168 -10.483 1.00 0.00 C ATOM 1843 CG GLU B 54 6.948 -12.363 -11.957 1.00 0.00 C ATOM 1844 CD GLU B 54 5.738 -11.568 -12.404 1.00 0.00 C ATOM 1845 OE1 GLU B 54 4.624 -11.857 -11.918 1.00 0.00 O ATOM 1846 OE2 GLU B 54 5.903 -10.655 -13.240 1.00 0.00 O ATOM 0 H GLU B 54 6.606 -11.642 -8.002 1.00 0.00 H new ATOM 0 HA GLU B 54 5.549 -13.413 -10.113 1.00 0.00 H new ATOM 0 HB2 GLU B 54 7.115 -11.119 -10.225 1.00 0.00 H new ATOM 0 HB3 GLU B 54 8.313 -12.395 -10.310 1.00 0.00 H new ATOM 0 HG2 GLU B 54 7.813 -12.067 -12.551 1.00 0.00 H new ATOM 0 HG3 GLU B 54 6.775 -13.422 -12.151 1.00 0.00 H new ATOM 1853 N LYS B 55 6.789 -15.422 -9.413 1.00 0.00 N ATOM 1854 CA LYS B 55 7.480 -16.639 -9.000 1.00 0.00 C ATOM 1855 C LYS B 55 8.928 -16.630 -9.478 1.00 0.00 C ATOM 1856 O LYS B 55 9.240 -17.133 -10.558 1.00 0.00 O ATOM 1857 CB LYS B 55 6.757 -17.872 -9.548 1.00 0.00 C ATOM 1858 CG LYS B 55 6.528 -17.825 -11.051 1.00 0.00 C ATOM 1859 CD LYS B 55 5.198 -18.457 -11.432 1.00 0.00 C ATOM 1860 CE LYS B 55 4.498 -17.668 -12.527 1.00 0.00 C ATOM 1861 NZ LYS B 55 3.385 -16.838 -11.990 1.00 0.00 N ATOM 0 H LYS B 55 5.964 -15.581 -9.992 1.00 0.00 H new ATOM 0 HA LYS B 55 7.476 -16.678 -7.911 1.00 0.00 H new ATOM 0 HB2 LYS B 55 7.338 -18.762 -9.305 1.00 0.00 H new ATOM 0 HB3 LYS B 55 5.795 -17.972 -9.045 1.00 0.00 H new ATOM 0 HG2 LYS B 55 6.551 -16.790 -11.391 1.00 0.00 H new ATOM 0 HG3 LYS B 55 7.339 -18.346 -11.560 1.00 0.00 H new ATOM 0 HD2 LYS B 55 5.364 -19.480 -11.769 1.00 0.00 H new ATOM 0 HD3 LYS B 55 4.555 -18.511 -10.554 1.00 0.00 H new ATOM 0 HE2 LYS B 55 5.221 -17.025 -13.029 1.00 0.00 H new ATOM 0 HE3 LYS B 55 4.108 -18.356 -13.277 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 2.934 -16.316 -12.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 2.682 -17.453 -11.533 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 3.760 -16.164 -11.293 1.00 0.00 H new ATOM 1875 N SER B 56 9.809 -16.051 -8.668 1.00 0.00 N ATOM 1876 CA SER B 56 11.224 -15.972 -9.009 1.00 0.00 C ATOM 1877 C SER B 56 11.838 -17.363 -9.122 1.00 0.00 C ATOM 1878 O SER B 56 11.142 -18.372 -9.006 1.00 0.00 O ATOM 1879 CB SER B 56 11.978 -15.153 -7.959 1.00 0.00 C ATOM 1880 OG SER B 56 12.263 -15.934 -6.811 1.00 0.00 O ATOM 0 H SER B 56 9.567 -15.630 -7.771 1.00 0.00 H new ATOM 0 HA SER B 56 11.310 -15.478 -9.977 1.00 0.00 H new ATOM 0 HB2 SER B 56 12.907 -14.776 -8.386 1.00 0.00 H new ATOM 0 HB3 SER B 56 11.383 -14.285 -7.674 1.00 0.00 H new ATOM 0 HG SER B 56 12.747 -15.388 -6.156 1.00 0.00 H new ATOM 1886 N GLN B 57 13.146 -17.408 -9.350 1.00 0.00 N ATOM 1887 CA GLN B 57 13.857 -18.674 -9.480 1.00 0.00 C ATOM 1888 C GLN B 57 15.363 -18.444 -9.559 1.00 0.00 C ATOM 1889 O GLN B 57 15.822 -17.307 -9.673 1.00 0.00 O ATOM 1890 CB GLN B 57 13.377 -19.425 -10.724 1.00 0.00 C ATOM 1891 CG GLN B 57 13.279 -20.929 -10.527 1.00 0.00 C ATOM 1892 CD GLN B 57 13.731 -21.707 -11.748 1.00 0.00 C ATOM 1893 OE1 GLN B 57 14.928 -21.860 -11.993 1.00 0.00 O ATOM 1894 NE2 GLN B 57 12.773 -22.203 -12.522 1.00 0.00 N ATOM 0 H GLN B 57 13.736 -16.582 -9.449 1.00 0.00 H new ATOM 0 HA GLN B 57 13.645 -19.276 -8.596 1.00 0.00 H new ATOM 0 HB2 GLN B 57 12.400 -19.041 -11.015 1.00 0.00 H new ATOM 0 HB3 GLN B 57 14.059 -19.219 -11.549 1.00 0.00 H new ATOM 0 HG2 GLN B 57 13.886 -21.220 -9.670 1.00 0.00 H new ATOM 0 HG3 GLN B 57 12.248 -21.195 -10.292 1.00 0.00 H new ATOM 0 HE21 GLN B 57 11.793 -22.052 -12.281 1.00 0.00 H new ATOM 0 HE22 GLN B 57 13.017 -22.735 -13.357 1.00 0.00 H new ATOM 1903 N GLN B 58 16.127 -19.530 -9.499 1.00 0.00 N ATOM 1904 CA GLN B 58 17.582 -19.446 -9.564 1.00 0.00 C ATOM 1905 C GLN B 58 18.033 -18.763 -10.852 1.00 0.00 C ATOM 1906 O GLN B 58 19.085 -18.126 -10.893 1.00 0.00 O ATOM 1907 CB GLN B 58 18.196 -20.844 -9.473 1.00 0.00 C ATOM 1908 CG GLN B 58 17.585 -21.841 -10.445 1.00 0.00 C ATOM 1909 CD GLN B 58 18.350 -23.149 -10.495 1.00 0.00 C ATOM 1910 OE1 GLN B 58 19.557 -23.167 -10.739 1.00 0.00 O ATOM 1911 NE2 GLN B 58 17.650 -24.253 -10.264 1.00 0.00 N ATOM 0 H GLN B 58 15.763 -20.478 -9.406 1.00 0.00 H new ATOM 0 HA GLN B 58 17.925 -18.848 -8.720 1.00 0.00 H new ATOM 0 HB2 GLN B 58 19.267 -20.774 -9.662 1.00 0.00 H new ATOM 0 HB3 GLN B 58 18.076 -21.219 -8.457 1.00 0.00 H new ATOM 0 HG2 GLN B 58 16.553 -22.039 -10.156 1.00 0.00 H new ATOM 0 HG3 GLN B 58 17.558 -21.401 -11.442 1.00 0.00 H new ATOM 0 HE21 GLN B 58 16.651 -24.192 -10.066 1.00 0.00 H new ATOM 0 HE22 GLN B 58 18.111 -25.163 -10.285 1.00 0.00 H new ATOM 1920 N SER B 59 17.229 -18.900 -11.902 1.00 0.00 N ATOM 1921 CA SER B 59 17.544 -18.296 -13.191 1.00 0.00 C ATOM 1922 C SER B 59 16.408 -18.517 -14.185 1.00 0.00 C ATOM 1923 O SER B 59 15.741 -19.552 -14.158 1.00 0.00 O ATOM 1924 CB SER B 59 18.844 -18.879 -13.748 1.00 0.00 C ATOM 1925 OG SER B 59 18.967 -20.253 -13.424 1.00 0.00 O ATOM 0 H SER B 59 16.354 -19.424 -11.885 1.00 0.00 H new ATOM 0 HA SER B 59 17.670 -17.224 -13.041 1.00 0.00 H new ATOM 0 HB2 SER B 59 18.868 -18.754 -14.831 1.00 0.00 H new ATOM 0 HB3 SER B 59 19.695 -18.330 -13.345 1.00 0.00 H new ATOM 0 HG SER B 59 19.805 -20.602 -13.793 1.00 0.00 H new ATOM 1931 N SER B 60 16.192 -17.541 -15.060 1.00 0.00 N ATOM 1932 CA SER B 60 15.134 -17.632 -16.061 1.00 0.00 C ATOM 1933 C SER B 60 15.707 -17.518 -17.470 1.00 0.00 C ATOM 1934 O SER B 60 16.518 -16.636 -17.751 1.00 0.00 O ATOM 1935 CB SER B 60 14.091 -16.537 -15.832 1.00 0.00 C ATOM 1936 OG SER B 60 14.709 -15.279 -15.625 1.00 0.00 O ATOM 0 H SER B 60 16.735 -16.678 -15.097 1.00 0.00 H new ATOM 0 HA SER B 60 14.656 -18.606 -15.960 1.00 0.00 H new ATOM 0 HB2 SER B 60 13.424 -16.481 -16.692 1.00 0.00 H new ATOM 0 HB3 SER B 60 13.477 -16.790 -14.968 1.00 0.00 H new ATOM 0 HG SER B 60 14.021 -14.596 -15.483 1.00 0.00 H new ATOM 1942 N TYR B 61 15.279 -18.415 -18.351 1.00 0.00 N ATOM 1943 CA TYR B 61 15.748 -18.416 -19.731 1.00 0.00 C ATOM 1944 C TYR B 61 15.368 -17.117 -20.436 1.00 0.00 C ATOM 1945 O TYR B 61 15.708 -16.970 -21.628 1.00 0.00 O ATOM 1946 CB TYR B 61 15.165 -19.609 -20.489 1.00 0.00 C ATOM 1947 CG TYR B 61 13.657 -19.579 -20.599 1.00 0.00 C ATOM 1948 CD1 TYR B 61 12.857 -20.067 -19.573 1.00 0.00 C ATOM 1949 CD2 TYR B 61 13.034 -19.061 -21.727 1.00 0.00 C ATOM 1950 CE1 TYR B 61 11.479 -20.040 -19.669 1.00 0.00 C ATOM 1951 CE2 TYR B 61 11.656 -19.031 -21.831 1.00 0.00 C ATOM 1952 CZ TYR B 61 10.883 -19.521 -20.800 1.00 0.00 C ATOM 1953 OH TYR B 61 9.511 -19.493 -20.899 1.00 0.00 O ATOM 1954 OXT TYR B 61 14.732 -16.258 -19.789 1.00 0.00 O ATOM 0 H TYR B 61 14.607 -19.151 -18.134 1.00 0.00 H new ATOM 0 HA TYR B 61 16.835 -18.498 -19.719 1.00 0.00 H new ATOM 0 HB2 TYR B 61 15.593 -19.637 -21.491 1.00 0.00 H new ATOM 0 HB3 TYR B 61 15.466 -20.529 -19.988 1.00 0.00 H new ATOM 0 HD1 TYR B 61 13.320 -20.474 -18.686 1.00 0.00 H new ATOM 0 HD2 TYR B 61 13.636 -18.675 -22.536 1.00 0.00 H new ATOM 0 HE1 TYR B 61 10.871 -20.423 -18.863 1.00 0.00 H new ATOM 0 HE2 TYR B 61 11.187 -18.626 -22.716 1.00 0.00 H new ATOM 0 HH TYR B 61 9.253 -19.096 -21.757 1.00 0.00 H new TER 1964 TYR B 61