USER MOD reduce.3.24.130724 H: found=0, std=0, add=1560, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1558 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 134 ASN : amide:sc= 0.545 K(o=1.1,f=-0.62) USER MOD Set 1.2: A 145 ASN : amide:sc= 0.529 K(o=1.1,f=-0.62) USER MOD Set 2.1: A 77 SER OG : rot 160:sc= 0.908 USER MOD Set 2.2: A 79 LYS NZ :NH3+ -111:sc= 1.05 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc=0.000577 USER MOD Single : A 6 GLN : amide:sc= -0.272 X(o=-0.27,f=-0.035) USER MOD Single : A 8 LYS NZ :NH3+ -171:sc=-0.00943 (180deg=-0.13) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 HIS : no HD1:sc= -0.0127 X(o=-0.013,f=0) USER MOD Single : A 16 SER OG : rot 83:sc= 2.08 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= -0.0022 X(o=-0.0022,f=-0.0022) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 130:sc= -1.45! USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -1.63 K(o=-1.6,f=-3.8!) USER MOD Single : A 39 SER OG : rot 180:sc= 0.00181 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 MET CE :methyl 165:sc= -0.0055 (180deg=-0.195) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00394) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -1.37 X(o=-1.4,f=-1.6) USER MOD Single : A 68 ASN : amide:sc= -0.299 X(o=-0.3,f=-0.7) USER MOD Single : A 72 LYS NZ :NH3+ -149:sc= -0.207 (180deg=-0.862) USER MOD Single : A 75 SER OG : rot 87:sc= 0.0421 USER MOD Single : A 81 CYS SG : rot 180:sc= -0.0854 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 CYS SG : rot 0:sc= 0.0275 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 50:sc= 0.509 USER MOD Single : A 98 GLN : amide:sc= -1.08 K(o=-1.1,f=-0.021) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.0618 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot -46:sc= -2.05! USER MOD Single : A 115 HIS : no HD1:sc= -0.939 X(o=-0.94,f=-0.87) USER MOD Single : A 117 THR OG1 : rot 167:sc= 1.87 USER MOD Single : A 121 SER OG : rot -130:sc= -0.137 USER MOD Single : A 122 TYR OH : rot 137:sc= -0.0417 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 142:sc= 0.28 (180deg=0.00831) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= 0.819 K(o=0.82,f=-0.08) USER MOD Single : A 139 GLN : amide:sc= -0.106 K(o=-0.11,f=-1.6!) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 GLN : amide:sc= -1.49! K(o=-1.5!,f=-0.092) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ 172:sc= 1.19 (180deg=1.17) USER MOD Single : A 154 THR OG1 : rot -39:sc= 0.0719 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ -157:sc= 1.28 (180deg=1.11) USER MOD Single : A 166 THR OG1 : rot 180:sc= -0.0182 USER MOD Single : A 167 TYR OH : rot 43:sc= 0.561 USER MOD Single : A 171 LYS NZ :NH3+ 146:sc= 1.24 (180deg=0.911) USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N LEU A 2 -10.717 -15.005 3.904 1.00 0.61 N ATOM 21 CA LEU A 2 -10.870 -14.777 2.479 1.00 0.57 C ATOM 22 C LEU A 2 -9.932 -15.669 1.688 1.00 0.52 C ATOM 23 O LEU A 2 -9.032 -16.296 2.243 1.00 0.60 O ATOM 24 CB LEU A 2 -10.556 -13.319 2.118 1.00 0.59 C ATOM 25 CG LEU A 2 -11.512 -12.256 2.664 1.00 0.64 C ATOM 26 CD1 LEU A 2 -11.158 -11.888 4.099 1.00 1.05 C ATOM 27 CD2 LEU A 2 -11.477 -11.020 1.778 1.00 0.96 C ATOM 0 HA LEU A 2 -11.906 -15.006 2.228 1.00 0.57 H new ATOM 0 HB2 LEU A 2 -9.552 -13.089 2.474 1.00 0.59 H new ATOM 0 HB3 LEU A 2 -10.537 -13.234 1.032 1.00 0.59 H new ATOM 0 HG LEU A 2 -12.521 -12.668 2.661 1.00 0.64 H new ATOM 0 HD11 LEU A 2 -11.853 -11.131 4.462 1.00 1.05 H new ATOM 0 HD12 LEU A 2 -11.225 -12.775 4.729 1.00 1.05 H new ATOM 0 HD13 LEU A 2 -10.142 -11.495 4.134 1.00 1.05 H new ATOM 0 HD21 LEU A 2 -12.160 -10.269 2.174 1.00 0.96 H new ATOM 0 HD22 LEU A 2 -10.465 -10.615 1.758 1.00 0.96 H new ATOM 0 HD23 LEU A 2 -11.780 -11.289 0.766 1.00 0.96 H new ATOM 39 N THR A 3 -10.182 -15.742 0.402 1.00 0.46 N ATOM 40 CA THR A 3 -9.349 -16.498 -0.509 1.00 0.42 C ATOM 41 C THR A 3 -8.770 -15.543 -1.545 1.00 0.39 C ATOM 42 O THR A 3 -9.246 -14.410 -1.662 1.00 0.40 O ATOM 43 CB THR A 3 -10.157 -17.598 -1.216 1.00 0.44 C ATOM 44 OG1 THR A 3 -11.544 -17.225 -1.268 1.00 0.51 O ATOM 45 CG2 THR A 3 -10.014 -18.928 -0.494 1.00 0.52 C ATOM 0 H THR A 3 -10.972 -15.277 -0.046 1.00 0.46 H new ATOM 0 HA THR A 3 -8.550 -16.978 0.057 1.00 0.42 H new ATOM 0 HB THR A 3 -9.768 -17.711 -2.228 1.00 0.44 H new ATOM 0 HG1 THR A 3 -12.055 -17.928 -1.721 1.00 0.51 H new ATOM 0 HG21 THR A 3 -10.595 -19.689 -1.015 1.00 0.52 H new ATOM 0 HG22 THR A 3 -8.964 -19.222 -0.477 1.00 0.52 H new ATOM 0 HG23 THR A 3 -10.379 -18.828 0.528 1.00 0.52 H new ATOM 53 N LEU A 4 -7.751 -15.979 -2.280 1.00 0.39 N ATOM 54 CA LEU A 4 -7.133 -15.141 -3.308 1.00 0.40 C ATOM 55 C LEU A 4 -8.196 -14.621 -4.272 1.00 0.39 C ATOM 56 O LEU A 4 -8.209 -13.441 -4.633 1.00 0.41 O ATOM 57 CB LEU A 4 -6.076 -15.945 -4.073 1.00 0.43 C ATOM 58 CG LEU A 4 -4.803 -15.184 -4.465 1.00 0.63 C ATOM 59 CD1 LEU A 4 -3.941 -16.035 -5.380 1.00 1.14 C ATOM 60 CD2 LEU A 4 -5.134 -13.861 -5.137 1.00 1.69 C ATOM 0 H LEU A 4 -7.335 -16.905 -2.185 1.00 0.39 H new ATOM 0 HA LEU A 4 -6.651 -14.290 -2.827 1.00 0.40 H new ATOM 0 HB2 LEU A 4 -5.789 -16.802 -3.464 1.00 0.43 H new ATOM 0 HB3 LEU A 4 -6.534 -16.338 -4.981 1.00 0.43 H new ATOM 0 HG LEU A 4 -4.248 -14.968 -3.552 1.00 0.63 H new ATOM 0 HD11 LEU A 4 -3.041 -15.482 -5.650 1.00 1.14 H new ATOM 0 HD12 LEU A 4 -3.661 -16.954 -4.865 1.00 1.14 H new ATOM 0 HD13 LEU A 4 -4.501 -16.280 -6.283 1.00 1.14 H new ATOM 0 HD21 LEU A 4 -4.210 -13.347 -5.402 1.00 1.69 H new ATOM 0 HD22 LEU A 4 -5.718 -14.047 -6.039 1.00 1.69 H new ATOM 0 HD23 LEU A 4 -5.712 -13.240 -4.453 1.00 1.69 H new ATOM 72 N ILE A 5 -9.105 -15.507 -4.661 1.00 0.40 N ATOM 73 CA ILE A 5 -10.178 -15.146 -5.570 1.00 0.42 C ATOM 74 C ILE A 5 -11.041 -14.047 -4.961 1.00 0.40 C ATOM 75 O ILE A 5 -11.401 -13.077 -5.636 1.00 0.40 O ATOM 76 CB ILE A 5 -11.059 -16.365 -5.927 1.00 0.48 C ATOM 77 CG1 ILE A 5 -11.476 -17.126 -4.668 1.00 1.32 C ATOM 78 CG2 ILE A 5 -10.316 -17.289 -6.880 1.00 1.22 C ATOM 79 CD1 ILE A 5 -12.903 -17.630 -4.709 1.00 1.94 C ATOM 0 H ILE A 5 -9.118 -16.481 -4.359 1.00 0.40 H new ATOM 0 HA ILE A 5 -9.719 -14.780 -6.489 1.00 0.42 H new ATOM 0 HB ILE A 5 -11.961 -16.001 -6.418 1.00 0.48 H new ATOM 0 HG12 ILE A 5 -10.804 -17.973 -4.526 1.00 1.32 H new ATOM 0 HG13 ILE A 5 -11.354 -16.474 -3.803 1.00 1.32 H new ATOM 0 HG21 ILE A 5 -10.947 -18.144 -7.124 1.00 1.22 H new ATOM 0 HG22 ILE A 5 -10.069 -16.748 -7.793 1.00 1.22 H new ATOM 0 HG23 ILE A 5 -9.399 -17.639 -6.407 1.00 1.22 H new ATOM 0 HD11 ILE A 5 -13.129 -18.160 -3.783 1.00 1.94 H new ATOM 0 HD12 ILE A 5 -13.584 -16.786 -4.819 1.00 1.94 H new ATOM 0 HD13 ILE A 5 -13.025 -18.308 -5.554 1.00 1.94 H new ATOM 91 N GLN A 6 -11.339 -14.190 -3.669 1.00 0.38 N ATOM 92 CA GLN A 6 -12.154 -13.223 -2.950 1.00 0.38 C ATOM 93 C GLN A 6 -11.466 -11.872 -2.889 1.00 0.36 C ATOM 94 O GLN A 6 -12.071 -10.856 -3.220 1.00 0.37 O ATOM 95 CB GLN A 6 -12.431 -13.721 -1.532 1.00 0.40 C ATOM 96 CG GLN A 6 -13.546 -12.977 -0.817 1.00 0.77 C ATOM 97 CD GLN A 6 -14.906 -13.272 -1.401 1.00 0.81 C ATOM 98 OE1 GLN A 6 -15.588 -14.203 -0.980 1.00 1.38 O ATOM 99 NE2 GLN A 6 -15.310 -12.481 -2.379 1.00 0.99 N ATOM 0 H GLN A 6 -11.023 -14.975 -3.099 1.00 0.38 H new ATOM 0 HA GLN A 6 -13.096 -13.110 -3.486 1.00 0.38 H new ATOM 0 HB2 GLN A 6 -12.685 -14.780 -1.574 1.00 0.40 H new ATOM 0 HB3 GLN A 6 -11.517 -13.636 -0.944 1.00 0.40 H new ATOM 0 HG2 GLN A 6 -13.541 -13.249 0.239 1.00 0.77 H new ATOM 0 HG3 GLN A 6 -13.356 -11.905 -0.871 1.00 0.77 H new ATOM 0 HE21 GLN A 6 -14.712 -11.719 -2.699 1.00 0.99 H new ATOM 0 HE22 GLN A 6 -16.220 -12.632 -2.814 1.00 0.99 H new ATOM 108 N GLY A 7 -10.210 -11.868 -2.453 1.00 0.35 N ATOM 109 CA GLY A 7 -9.455 -10.632 -2.372 1.00 0.34 C ATOM 110 C GLY A 7 -9.457 -9.869 -3.681 1.00 0.33 C ATOM 111 O GLY A 7 -9.772 -8.675 -3.713 1.00 0.33 O ATOM 0 H GLY A 7 -9.702 -12.700 -2.154 1.00 0.35 H new ATOM 0 HA2 GLY A 7 -9.875 -10.003 -1.587 1.00 0.34 H new ATOM 0 HA3 GLY A 7 -8.427 -10.855 -2.086 1.00 0.34 H new ATOM 115 N LYS A 8 -9.166 -10.571 -4.768 1.00 0.35 N ATOM 116 CA LYS A 8 -9.130 -9.952 -6.088 1.00 0.38 C ATOM 117 C LYS A 8 -10.516 -9.446 -6.469 1.00 0.38 C ATOM 118 O LYS A 8 -10.657 -8.365 -7.044 1.00 0.38 O ATOM 119 CB LYS A 8 -8.625 -10.950 -7.138 1.00 0.44 C ATOM 120 CG LYS A 8 -8.062 -10.301 -8.398 1.00 0.76 C ATOM 121 CD LYS A 8 -9.162 -9.846 -9.355 1.00 0.74 C ATOM 122 CE LYS A 8 -8.587 -9.349 -10.674 1.00 1.24 C ATOM 123 NZ LYS A 8 -7.645 -8.216 -10.477 1.00 1.81 N ATOM 0 H LYS A 8 -8.952 -11.568 -4.763 1.00 0.35 H new ATOM 0 HA LYS A 8 -8.442 -9.107 -6.055 1.00 0.38 H new ATOM 0 HB2 LYS A 8 -7.853 -11.574 -6.688 1.00 0.44 H new ATOM 0 HB3 LYS A 8 -9.445 -11.611 -7.419 1.00 0.44 H new ATOM 0 HG2 LYS A 8 -7.448 -9.444 -8.120 1.00 0.76 H new ATOM 0 HG3 LYS A 8 -7.409 -11.009 -8.908 1.00 0.76 H new ATOM 0 HD2 LYS A 8 -9.846 -10.674 -9.544 1.00 0.74 H new ATOM 0 HD3 LYS A 8 -9.745 -9.051 -8.889 1.00 0.74 H new ATOM 0 HE2 LYS A 8 -8.071 -10.167 -11.176 1.00 1.24 H new ATOM 0 HE3 LYS A 8 -9.400 -9.035 -11.329 1.00 1.24 H new ATOM 0 HZ1 LYS A 8 -7.394 -7.809 -11.400 1.00 1.81 H new ATOM 0 HZ2 LYS A 8 -8.097 -7.487 -9.888 1.00 1.81 H new ATOM 0 HZ3 LYS A 8 -6.784 -8.558 -10.004 1.00 1.81 H new ATOM 137 N LYS A 9 -11.538 -10.216 -6.112 1.00 0.41 N ATOM 138 CA LYS A 9 -12.912 -9.857 -6.429 1.00 0.46 C ATOM 139 C LYS A 9 -13.338 -8.600 -5.682 1.00 0.43 C ATOM 140 O LYS A 9 -13.846 -7.645 -6.282 1.00 0.44 O ATOM 141 CB LYS A 9 -13.852 -11.010 -6.075 1.00 0.53 C ATOM 142 CG LYS A 9 -15.289 -10.794 -6.521 1.00 0.74 C ATOM 143 CD LYS A 9 -16.244 -11.716 -5.781 1.00 0.87 C ATOM 144 CE LYS A 9 -17.630 -11.696 -6.404 1.00 1.29 C ATOM 145 NZ LYS A 9 -18.511 -12.754 -5.836 1.00 1.69 N ATOM 0 H LYS A 9 -11.439 -11.094 -5.602 1.00 0.41 H new ATOM 0 HA LYS A 9 -12.969 -9.657 -7.499 1.00 0.46 H new ATOM 0 HB2 LYS A 9 -13.475 -11.926 -6.530 1.00 0.53 H new ATOM 0 HB3 LYS A 9 -13.836 -11.160 -4.996 1.00 0.53 H new ATOM 0 HG2 LYS A 9 -15.574 -9.756 -6.346 1.00 0.74 H new ATOM 0 HG3 LYS A 9 -15.369 -10.970 -7.594 1.00 0.74 H new ATOM 0 HD2 LYS A 9 -15.853 -12.733 -5.793 1.00 0.87 H new ATOM 0 HD3 LYS A 9 -16.309 -11.412 -4.736 1.00 0.87 H new ATOM 0 HE2 LYS A 9 -18.086 -10.719 -6.243 1.00 1.29 H new ATOM 0 HE3 LYS A 9 -17.545 -11.834 -7.482 1.00 1.29 H new ATOM 0 HZ1 LYS A 9 -19.447 -12.706 -6.288 1.00 1.69 H new ATOM 0 HZ2 LYS A 9 -18.089 -13.688 -6.012 1.00 1.69 H new ATOM 0 HZ3 LYS A 9 -18.613 -12.608 -4.811 1.00 1.69 H new ATOM 159 N ILE A 10 -13.117 -8.595 -4.376 1.00 0.41 N ATOM 160 CA ILE A 10 -13.503 -7.460 -3.560 1.00 0.42 C ATOM 161 C ILE A 10 -12.709 -6.220 -3.947 1.00 0.35 C ATOM 162 O ILE A 10 -13.287 -5.154 -4.081 1.00 0.38 O ATOM 163 CB ILE A 10 -13.388 -7.737 -2.037 1.00 0.46 C ATOM 164 CG1 ILE A 10 -11.938 -7.697 -1.546 1.00 0.45 C ATOM 165 CG2 ILE A 10 -14.018 -9.082 -1.707 1.00 0.57 C ATOM 166 CD1 ILE A 10 -11.812 -7.762 -0.039 1.00 0.58 C ATOM 0 H ILE A 10 -12.676 -9.359 -3.864 1.00 0.41 H new ATOM 0 HA ILE A 10 -14.559 -7.280 -3.761 1.00 0.42 H new ATOM 0 HB ILE A 10 -13.924 -6.942 -1.518 1.00 0.46 H new ATOM 0 HG12 ILE A 10 -11.390 -8.531 -1.985 1.00 0.45 H new ATOM 0 HG13 ILE A 10 -11.466 -6.782 -1.904 1.00 0.45 H new ATOM 0 HG21 ILE A 10 -13.934 -9.270 -0.637 1.00 0.57 H new ATOM 0 HG22 ILE A 10 -15.070 -9.071 -1.992 1.00 0.57 H new ATOM 0 HG23 ILE A 10 -13.502 -9.870 -2.256 1.00 0.57 H new ATOM 0 HD11 ILE A 10 -10.759 -7.729 0.240 1.00 0.58 H new ATOM 0 HD12 ILE A 10 -12.332 -6.914 0.406 1.00 0.58 H new ATOM 0 HD13 ILE A 10 -12.255 -8.690 0.323 1.00 0.58 H new ATOM 178 N VAL A 11 -11.400 -6.366 -4.165 1.00 0.31 N ATOM 179 CA VAL A 11 -10.572 -5.222 -4.552 1.00 0.30 C ATOM 180 C VAL A 11 -11.097 -4.598 -5.841 1.00 0.29 C ATOM 181 O VAL A 11 -11.220 -3.375 -5.947 1.00 0.30 O ATOM 182 CB VAL A 11 -9.090 -5.615 -4.740 1.00 0.35 C ATOM 183 CG1 VAL A 11 -8.307 -4.502 -5.430 1.00 0.39 C ATOM 184 CG2 VAL A 11 -8.461 -5.948 -3.401 1.00 0.41 C ATOM 0 H VAL A 11 -10.897 -7.250 -4.082 1.00 0.31 H new ATOM 0 HA VAL A 11 -10.630 -4.497 -3.740 1.00 0.30 H new ATOM 0 HB VAL A 11 -9.054 -6.498 -5.378 1.00 0.35 H new ATOM 0 HG11 VAL A 11 -7.268 -4.808 -5.548 1.00 0.39 H new ATOM 0 HG12 VAL A 11 -8.741 -4.305 -6.410 1.00 0.39 H new ATOM 0 HG13 VAL A 11 -8.352 -3.596 -4.825 1.00 0.39 H new ATOM 0 HG21 VAL A 11 -7.417 -6.223 -3.548 1.00 0.41 H new ATOM 0 HG22 VAL A 11 -8.518 -5.079 -2.746 1.00 0.41 H new ATOM 0 HG23 VAL A 11 -8.995 -6.782 -2.945 1.00 0.41 H new ATOM 194 N ASN A 12 -11.404 -5.447 -6.818 1.00 0.32 N ATOM 195 CA ASN A 12 -11.933 -4.990 -8.097 1.00 0.37 C ATOM 196 C ASN A 12 -13.188 -4.142 -7.890 1.00 0.36 C ATOM 197 O ASN A 12 -13.315 -3.043 -8.441 1.00 0.38 O ATOM 198 CB ASN A 12 -12.236 -6.186 -9.005 1.00 0.44 C ATOM 199 CG ASN A 12 -12.795 -5.761 -10.351 1.00 0.59 C ATOM 200 OD1 ASN A 12 -12.055 -5.348 -11.243 1.00 1.02 O ATOM 201 ND2 ASN A 12 -14.107 -5.861 -10.509 1.00 1.32 N ATOM 0 H ASN A 12 -11.295 -6.459 -6.746 1.00 0.32 H new ATOM 0 HA ASN A 12 -11.179 -4.369 -8.580 1.00 0.37 H new ATOM 0 HB2 ASN A 12 -11.324 -6.763 -9.159 1.00 0.44 H new ATOM 0 HB3 ASN A 12 -12.950 -6.844 -8.509 1.00 0.44 H new ATOM 0 HD21 ASN A 12 -14.536 -5.591 -11.394 1.00 1.32 H new ATOM 0 HD22 ASN A 12 -14.688 -6.208 -9.746 1.00 1.32 H new ATOM 208 N HIS A 13 -14.102 -4.639 -7.072 1.00 0.35 N ATOM 209 CA HIS A 13 -15.338 -3.913 -6.791 1.00 0.38 C ATOM 210 C HIS A 13 -15.041 -2.673 -5.953 1.00 0.33 C ATOM 211 O HIS A 13 -15.571 -1.590 -6.211 1.00 0.35 O ATOM 212 CB HIS A 13 -16.345 -4.818 -6.075 1.00 0.44 C ATOM 213 CG HIS A 13 -17.130 -5.689 -7.008 1.00 0.64 C ATOM 214 ND1 HIS A 13 -18.281 -5.240 -7.612 1.00 1.05 N ATOM 215 CD2 HIS A 13 -16.888 -6.961 -7.411 1.00 1.07 C ATOM 216 CE1 HIS A 13 -18.710 -6.238 -8.363 1.00 1.21 C ATOM 217 NE2 HIS A 13 -17.900 -7.303 -8.272 1.00 1.22 N ATOM 0 H HIS A 13 -14.016 -5.535 -6.592 1.00 0.35 H new ATOM 0 HA HIS A 13 -15.778 -3.597 -7.737 1.00 0.38 H new ATOM 0 HB2 HIS A 13 -15.813 -5.448 -5.362 1.00 0.44 H new ATOM 0 HB3 HIS A 13 -17.034 -4.199 -5.501 1.00 0.44 H new ATOM 0 HD2 HIS A 13 -16.059 -7.585 -7.112 1.00 1.07 H new ATOM 0 HE1 HIS A 13 -19.600 -6.201 -8.973 1.00 1.21 H new ATOM 0 HE2 HIS A 13 -18.014 -8.196 -8.751 1.00 1.22 H new ATOM 225 N LEU A 14 -14.160 -2.842 -4.978 1.00 0.30 N ATOM 226 CA LEU A 14 -13.760 -1.765 -4.083 1.00 0.31 C ATOM 227 C LEU A 14 -13.201 -0.581 -4.858 1.00 0.31 C ATOM 228 O LEU A 14 -13.556 0.562 -4.595 1.00 0.34 O ATOM 229 CB LEU A 14 -12.710 -2.274 -3.086 1.00 0.35 C ATOM 230 CG LEU A 14 -13.234 -3.212 -1.993 1.00 0.49 C ATOM 231 CD1 LEU A 14 -12.186 -3.410 -0.914 1.00 0.89 C ATOM 232 CD2 LEU A 14 -14.526 -2.680 -1.393 1.00 0.54 C ATOM 0 H LEU A 14 -13.701 -3.732 -4.784 1.00 0.30 H new ATOM 0 HA LEU A 14 -14.646 -1.431 -3.542 1.00 0.31 H new ATOM 0 HB2 LEU A 14 -11.929 -2.793 -3.642 1.00 0.35 H new ATOM 0 HB3 LEU A 14 -12.242 -1.414 -2.608 1.00 0.35 H new ATOM 0 HG LEU A 14 -13.447 -4.179 -2.450 1.00 0.49 H new ATOM 0 HD11 LEU A 14 -12.576 -4.079 -0.147 1.00 0.89 H new ATOM 0 HD12 LEU A 14 -11.289 -3.846 -1.354 1.00 0.89 H new ATOM 0 HD13 LEU A 14 -11.939 -2.448 -0.465 1.00 0.89 H new ATOM 0 HD21 LEU A 14 -14.877 -3.364 -0.620 1.00 0.54 H new ATOM 0 HD22 LEU A 14 -14.346 -1.698 -0.955 1.00 0.54 H new ATOM 0 HD23 LEU A 14 -15.282 -2.596 -2.174 1.00 0.54 H new ATOM 244 N ARG A 15 -12.353 -0.863 -5.837 1.00 0.32 N ATOM 245 CA ARG A 15 -11.742 0.192 -6.636 1.00 0.37 C ATOM 246 C ARG A 15 -12.757 0.835 -7.581 1.00 0.38 C ATOM 247 O ARG A 15 -12.692 2.028 -7.853 1.00 0.45 O ATOM 248 CB ARG A 15 -10.537 -0.348 -7.424 1.00 0.43 C ATOM 249 CG ARG A 15 -10.899 -1.267 -8.584 1.00 1.21 C ATOM 250 CD ARG A 15 -10.927 -0.519 -9.910 1.00 1.96 C ATOM 251 NE ARG A 15 -11.518 -1.317 -10.984 1.00 2.47 N ATOM 252 CZ ARG A 15 -10.845 -1.751 -12.053 1.00 3.14 C ATOM 253 NH1 ARG A 15 -9.550 -1.493 -12.181 1.00 3.59 N ATOM 254 NH2 ARG A 15 -11.467 -2.451 -12.992 1.00 3.77 N ATOM 0 H ARG A 15 -12.073 -1.809 -6.097 1.00 0.32 H new ATOM 0 HA ARG A 15 -11.389 0.962 -5.950 1.00 0.37 H new ATOM 0 HB2 ARG A 15 -9.965 0.495 -7.811 1.00 0.43 H new ATOM 0 HB3 ARG A 15 -9.884 -0.889 -6.739 1.00 0.43 H new ATOM 0 HG2 ARG A 15 -10.177 -2.082 -8.641 1.00 1.21 H new ATOM 0 HG3 ARG A 15 -11.874 -1.718 -8.400 1.00 1.21 H new ATOM 0 HD2 ARG A 15 -11.494 0.404 -9.792 1.00 1.96 H new ATOM 0 HD3 ARG A 15 -9.911 -0.236 -10.187 1.00 1.96 H new ATOM 0 HE ARG A 15 -12.507 -1.557 -10.912 1.00 2.47 H new ATOM 0 HH11 ARG A 15 -9.062 -0.960 -11.461 1.00 3.59 H new ATOM 0 HH12 ARG A 15 -9.042 -1.827 -13.000 1.00 3.59 H new ATOM 0 HH21 ARG A 15 -12.461 -2.659 -12.899 1.00 3.77 H new ATOM 0 HH22 ARG A 15 -10.951 -2.781 -13.808 1.00 3.77 H new ATOM 268 N SER A 16 -13.680 0.038 -8.100 1.00 0.36 N ATOM 269 CA SER A 16 -14.691 0.552 -9.016 1.00 0.41 C ATOM 270 C SER A 16 -15.813 1.292 -8.279 1.00 0.38 C ATOM 271 O SER A 16 -16.625 1.982 -8.899 1.00 0.41 O ATOM 272 CB SER A 16 -15.281 -0.607 -9.820 1.00 0.47 C ATOM 273 OG SER A 16 -14.257 -1.460 -10.312 1.00 1.10 O ATOM 0 H SER A 16 -13.751 -0.961 -7.905 1.00 0.36 H new ATOM 0 HA SER A 16 -14.207 1.268 -9.681 1.00 0.41 H new ATOM 0 HB2 SER A 16 -15.965 -1.179 -9.192 1.00 0.47 H new ATOM 0 HB3 SER A 16 -15.865 -0.216 -10.653 1.00 0.47 H new ATOM 0 HG SER A 16 -13.998 -2.097 -9.613 1.00 1.10 H new ATOM 279 N ARG A 17 -15.853 1.153 -6.964 1.00 0.34 N ATOM 280 CA ARG A 17 -16.905 1.774 -6.167 1.00 0.34 C ATOM 281 C ARG A 17 -16.392 2.802 -5.149 1.00 0.30 C ATOM 282 O ARG A 17 -17.181 3.279 -4.328 1.00 0.32 O ATOM 283 CB ARG A 17 -17.720 0.695 -5.452 1.00 0.40 C ATOM 284 CG ARG A 17 -18.606 -0.116 -6.391 1.00 0.60 C ATOM 285 CD ARG A 17 -19.177 -1.345 -5.701 1.00 1.17 C ATOM 286 NE ARG A 17 -20.108 -2.076 -6.562 1.00 1.61 N ATOM 287 CZ ARG A 17 -21.354 -2.396 -6.214 1.00 2.24 C ATOM 288 NH1 ARG A 17 -21.856 -1.988 -5.054 1.00 2.71 N ATOM 289 NH2 ARG A 17 -22.110 -3.107 -7.040 1.00 2.95 N ATOM 0 H ARG A 17 -15.173 0.618 -6.425 1.00 0.34 H new ATOM 0 HA ARG A 17 -17.531 2.327 -6.867 1.00 0.34 H new ATOM 0 HB2 ARG A 17 -17.039 0.020 -4.933 1.00 0.40 H new ATOM 0 HB3 ARG A 17 -18.344 1.165 -4.692 1.00 0.40 H new ATOM 0 HG2 ARG A 17 -19.421 0.510 -6.754 1.00 0.60 H new ATOM 0 HG3 ARG A 17 -18.028 -0.423 -7.263 1.00 0.60 H new ATOM 0 HD2 ARG A 17 -18.362 -2.006 -5.405 1.00 1.17 H new ATOM 0 HD3 ARG A 17 -19.689 -1.042 -4.788 1.00 1.17 H new ATOM 0 HE ARG A 17 -19.783 -2.358 -7.487 1.00 1.61 H new ATOM 0 HH11 ARG A 17 -21.287 -1.425 -4.422 1.00 2.71 H new ATOM 0 HH12 ARG A 17 -22.811 -2.237 -4.795 1.00 2.71 H new ATOM 0 HH21 ARG A 17 -21.738 -3.408 -7.941 1.00 2.95 H new ATOM 0 HH22 ARG A 17 -23.064 -3.353 -6.775 1.00 2.95 H new ATOM 303 N LEU A 18 -15.100 3.147 -5.174 1.00 0.27 N ATOM 304 CA LEU A 18 -14.582 4.078 -4.183 1.00 0.26 C ATOM 305 C LEU A 18 -14.910 5.513 -4.561 1.00 0.24 C ATOM 306 O LEU A 18 -14.831 5.890 -5.731 1.00 0.25 O ATOM 307 CB LEU A 18 -13.072 3.924 -4.029 1.00 0.30 C ATOM 308 CG LEU A 18 -12.609 2.985 -2.919 1.00 0.40 C ATOM 309 CD1 LEU A 18 -11.159 2.600 -3.140 1.00 0.63 C ATOM 310 CD2 LEU A 18 -12.780 3.635 -1.554 1.00 0.49 C ATOM 0 H LEU A 18 -14.417 2.805 -5.850 1.00 0.27 H new ATOM 0 HA LEU A 18 -15.061 3.845 -3.232 1.00 0.26 H new ATOM 0 HB2 LEU A 18 -12.664 3.567 -4.975 1.00 0.30 H new ATOM 0 HB3 LEU A 18 -12.642 4.909 -3.848 1.00 0.30 H new ATOM 0 HG LEU A 18 -13.225 2.086 -2.946 1.00 0.40 H new ATOM 0 HD11 LEU A 18 -10.835 1.930 -2.344 1.00 0.63 H new ATOM 0 HD12 LEU A 18 -11.059 2.097 -4.102 1.00 0.63 H new ATOM 0 HD13 LEU A 18 -10.539 3.497 -3.134 1.00 0.63 H new ATOM 0 HD21 LEU A 18 -12.443 2.947 -0.779 1.00 0.49 H new ATOM 0 HD22 LEU A 18 -12.188 4.549 -1.510 1.00 0.49 H new ATOM 0 HD23 LEU A 18 -13.831 3.875 -1.395 1.00 0.49 H new ATOM 322 N ALA A 19 -15.308 6.301 -3.571 1.00 0.25 N ATOM 323 CA ALA A 19 -15.608 7.708 -3.781 1.00 0.27 C ATOM 324 C ALA A 19 -15.511 8.452 -2.461 1.00 0.29 C ATOM 325 O ALA A 19 -16.009 7.986 -1.446 1.00 0.45 O ATOM 326 CB ALA A 19 -16.998 7.876 -4.383 1.00 0.32 C ATOM 0 H ALA A 19 -15.431 5.985 -2.609 1.00 0.25 H new ATOM 0 HA ALA A 19 -14.883 8.123 -4.480 1.00 0.27 H new ATOM 0 HB1 ALA A 19 -17.204 8.936 -4.533 1.00 0.32 H new ATOM 0 HB2 ALA A 19 -17.045 7.358 -5.341 1.00 0.32 H new ATOM 0 HB3 ALA A 19 -17.741 7.454 -3.706 1.00 0.32 H new ATOM 332 N PHE A 20 -14.870 9.600 -2.458 1.00 0.28 N ATOM 333 CA PHE A 20 -14.750 10.375 -1.241 1.00 0.29 C ATOM 334 C PHE A 20 -15.322 11.759 -1.451 1.00 0.33 C ATOM 335 O PHE A 20 -15.439 12.219 -2.584 1.00 0.35 O ATOM 336 CB PHE A 20 -13.284 10.439 -0.794 1.00 0.31 C ATOM 337 CG PHE A 20 -12.396 11.276 -1.669 1.00 0.32 C ATOM 338 CD1 PHE A 20 -12.292 12.641 -1.469 1.00 1.22 C ATOM 339 CD2 PHE A 20 -11.654 10.696 -2.680 1.00 1.20 C ATOM 340 CE1 PHE A 20 -11.466 13.409 -2.260 1.00 1.25 C ATOM 341 CE2 PHE A 20 -10.828 11.459 -3.478 1.00 1.21 C ATOM 342 CZ PHE A 20 -10.732 12.818 -3.267 1.00 0.41 C ATOM 0 H PHE A 20 -14.427 10.016 -3.277 1.00 0.28 H new ATOM 0 HA PHE A 20 -15.320 9.889 -0.449 1.00 0.29 H new ATOM 0 HB2 PHE A 20 -13.245 10.833 0.222 1.00 0.31 H new ATOM 0 HB3 PHE A 20 -12.885 9.425 -0.759 1.00 0.31 H new ATOM 0 HD1 PHE A 20 -12.865 13.110 -0.683 1.00 1.22 H new ATOM 0 HD2 PHE A 20 -11.722 9.631 -2.847 1.00 1.20 H new ATOM 0 HE1 PHE A 20 -11.393 14.473 -2.092 1.00 1.25 H new ATOM 0 HE2 PHE A 20 -10.257 10.993 -4.267 1.00 1.21 H new ATOM 0 HZ PHE A 20 -10.084 13.418 -3.888 1.00 0.41 H new ATOM 352 N GLU A 21 -15.694 12.420 -0.373 1.00 0.37 N ATOM 353 CA GLU A 21 -16.242 13.752 -0.487 1.00 0.43 C ATOM 354 C GLU A 21 -15.279 14.773 0.095 1.00 0.46 C ATOM 355 O GLU A 21 -14.687 14.578 1.172 1.00 0.44 O ATOM 356 CB GLU A 21 -17.627 13.861 0.164 1.00 0.48 C ATOM 357 CG GLU A 21 -18.675 12.990 -0.502 1.00 1.11 C ATOM 358 CD GLU A 21 -19.977 12.935 0.267 1.00 1.40 C ATOM 359 OE1 GLU A 21 -20.461 13.996 0.718 1.00 1.92 O ATOM 360 OE2 GLU A 21 -20.530 11.827 0.418 1.00 1.89 O ATOM 0 H GLU A 21 -15.627 12.061 0.579 1.00 0.37 H new ATOM 0 HA GLU A 21 -16.374 13.966 -1.548 1.00 0.43 H new ATOM 0 HB2 GLU A 21 -17.549 13.584 1.215 1.00 0.48 H new ATOM 0 HB3 GLU A 21 -17.955 14.900 0.132 1.00 0.48 H new ATOM 0 HG2 GLU A 21 -18.869 13.368 -1.506 1.00 1.11 H new ATOM 0 HG3 GLU A 21 -18.282 11.979 -0.612 1.00 1.11 H new ATOM 367 N TYR A 22 -15.131 15.853 -0.653 1.00 0.52 N ATOM 368 CA TYR A 22 -14.263 16.955 -0.296 1.00 0.59 C ATOM 369 C TYR A 22 -15.018 18.258 -0.523 1.00 0.65 C ATOM 370 O TYR A 22 -15.477 18.525 -1.635 1.00 0.65 O ATOM 371 CB TYR A 22 -12.974 16.926 -1.131 1.00 0.60 C ATOM 372 CG TYR A 22 -12.286 18.274 -1.219 1.00 0.74 C ATOM 373 CD1 TYR A 22 -11.808 18.911 -0.077 1.00 1.53 C ATOM 374 CD2 TYR A 22 -12.132 18.915 -2.441 1.00 1.38 C ATOM 375 CE1 TYR A 22 -11.201 20.150 -0.153 1.00 1.69 C ATOM 376 CE2 TYR A 22 -11.521 20.152 -2.525 1.00 1.48 C ATOM 377 CZ TYR A 22 -11.058 20.766 -1.379 1.00 1.16 C ATOM 378 OH TYR A 22 -10.457 22.005 -1.458 1.00 1.40 O ATOM 0 H TYR A 22 -15.619 15.988 -1.538 1.00 0.52 H new ATOM 0 HA TYR A 22 -13.977 16.871 0.752 1.00 0.59 H new ATOM 0 HB2 TYR A 22 -12.285 16.202 -0.697 1.00 0.60 H new ATOM 0 HB3 TYR A 22 -13.209 16.579 -2.137 1.00 0.60 H new ATOM 0 HD1 TYR A 22 -11.913 18.429 0.884 1.00 1.53 H new ATOM 0 HD2 TYR A 22 -12.495 18.440 -3.340 1.00 1.38 H new ATOM 0 HE1 TYR A 22 -10.840 20.634 0.743 1.00 1.69 H new ATOM 0 HE2 TYR A 22 -11.406 20.636 -3.484 1.00 1.48 H new ATOM 0 HH TYR A 22 -10.434 22.298 -2.393 1.00 1.40 H new ATOM 388 N ASN A 23 -15.172 19.046 0.537 1.00 0.72 N ATOM 389 CA ASN A 23 -15.886 20.320 0.471 1.00 0.80 C ATOM 390 C ASN A 23 -17.304 20.127 -0.051 1.00 0.78 C ATOM 391 O ASN A 23 -17.876 21.014 -0.686 1.00 0.83 O ATOM 392 CB ASN A 23 -15.136 21.311 -0.419 1.00 0.87 C ATOM 393 CG ASN A 23 -15.098 22.695 0.185 1.00 1.09 C ATOM 394 OD1 ASN A 23 -15.967 23.529 -0.075 1.00 1.72 O ATOM 395 ND2 ASN A 23 -14.096 22.947 1.007 1.00 1.37 N ATOM 0 H ASN A 23 -14.808 18.822 1.463 1.00 0.72 H new ATOM 0 HA ASN A 23 -15.941 20.722 1.483 1.00 0.80 H new ATOM 0 HB2 ASN A 23 -14.118 20.957 -0.579 1.00 0.87 H new ATOM 0 HB3 ASN A 23 -15.615 21.355 -1.397 1.00 0.87 H new ATOM 0 HD21 ASN A 23 -14.020 23.861 1.454 1.00 1.37 H new ATOM 0 HD22 ASN A 23 -13.397 22.228 1.195 1.00 1.37 H new ATOM 402 N GLY A 24 -17.868 18.963 0.227 1.00 0.73 N ATOM 403 CA GLY A 24 -19.209 18.664 -0.219 1.00 0.73 C ATOM 404 C GLY A 24 -19.257 18.112 -1.633 1.00 0.68 C ATOM 405 O GLY A 24 -20.318 17.703 -2.102 1.00 0.70 O ATOM 0 H GLY A 24 -17.417 18.217 0.757 1.00 0.73 H new ATOM 0 HA2 GLY A 24 -19.660 17.942 0.462 1.00 0.73 H new ATOM 0 HA3 GLY A 24 -19.813 19.570 -0.168 1.00 0.73 H new ATOM 409 N GLN A 25 -18.122 18.103 -2.324 1.00 0.64 N ATOM 410 CA GLN A 25 -18.077 17.589 -3.687 1.00 0.60 C ATOM 411 C GLN A 25 -17.605 16.143 -3.686 1.00 0.54 C ATOM 412 O GLN A 25 -16.663 15.794 -2.977 1.00 0.53 O ATOM 413 CB GLN A 25 -17.136 18.425 -4.556 1.00 0.63 C ATOM 414 CG GLN A 25 -17.452 19.915 -4.573 1.00 0.76 C ATOM 415 CD GLN A 25 -18.780 20.230 -5.238 1.00 1.16 C ATOM 416 OE1 GLN A 25 -18.865 20.334 -6.464 1.00 1.91 O ATOM 417 NE2 GLN A 25 -19.820 20.395 -4.436 1.00 1.56 N ATOM 0 H GLN A 25 -17.229 18.442 -1.967 1.00 0.64 H new ATOM 0 HA GLN A 25 -19.084 17.647 -4.101 1.00 0.60 H new ATOM 0 HB2 GLN A 25 -16.115 18.287 -4.201 1.00 0.63 H new ATOM 0 HB3 GLN A 25 -17.172 18.047 -5.578 1.00 0.63 H new ATOM 0 HG2 GLN A 25 -17.466 20.290 -3.550 1.00 0.76 H new ATOM 0 HG3 GLN A 25 -16.655 20.444 -5.096 1.00 0.76 H new ATOM 0 HE21 GLN A 25 -19.706 20.300 -3.427 1.00 1.56 H new ATOM 0 HE22 GLN A 25 -20.735 20.617 -4.827 1.00 1.56 H new ATOM 426 N LEU A 26 -18.265 15.307 -4.470 1.00 0.50 N ATOM 427 CA LEU A 26 -17.902 13.904 -4.556 1.00 0.46 C ATOM 428 C LEU A 26 -16.775 13.681 -5.552 1.00 0.43 C ATOM 429 O LEU A 26 -16.833 14.139 -6.697 1.00 0.47 O ATOM 430 CB LEU A 26 -19.108 13.060 -4.957 1.00 0.49 C ATOM 431 CG LEU A 26 -19.655 12.160 -3.857 1.00 0.54 C ATOM 432 CD1 LEU A 26 -20.856 11.383 -4.360 1.00 0.59 C ATOM 433 CD2 LEU A 26 -18.584 11.199 -3.359 1.00 0.61 C ATOM 0 H LEU A 26 -19.055 15.576 -5.056 1.00 0.50 H new ATOM 0 HA LEU A 26 -17.558 13.597 -3.568 1.00 0.46 H new ATOM 0 HB2 LEU A 26 -19.904 13.726 -5.291 1.00 0.49 H new ATOM 0 HB3 LEU A 26 -18.832 12.440 -5.810 1.00 0.49 H new ATOM 0 HG LEU A 26 -19.965 12.792 -3.025 1.00 0.54 H new ATOM 0 HD11 LEU A 26 -21.236 10.744 -3.563 1.00 0.59 H new ATOM 0 HD12 LEU A 26 -21.636 12.079 -4.670 1.00 0.59 H new ATOM 0 HD13 LEU A 26 -20.561 10.767 -5.209 1.00 0.59 H new ATOM 0 HD21 LEU A 26 -18.999 10.567 -2.574 1.00 0.61 H new ATOM 0 HD22 LEU A 26 -18.243 10.575 -4.185 1.00 0.61 H new ATOM 0 HD23 LEU A 26 -17.743 11.766 -2.961 1.00 0.61 H new ATOM 445 N ILE A 27 -15.756 12.977 -5.099 1.00 0.39 N ATOM 446 CA ILE A 27 -14.598 12.654 -5.917 1.00 0.39 C ATOM 447 C ILE A 27 -14.404 11.132 -5.941 1.00 0.36 C ATOM 448 O ILE A 27 -14.020 10.530 -4.938 1.00 0.42 O ATOM 449 CB ILE A 27 -13.310 13.333 -5.386 1.00 0.41 C ATOM 450 CG1 ILE A 27 -13.594 14.755 -4.870 1.00 0.46 C ATOM 451 CG2 ILE A 27 -12.241 13.360 -6.471 1.00 0.48 C ATOM 452 CD1 ILE A 27 -13.919 15.766 -5.952 1.00 0.78 C ATOM 0 H ILE A 27 -15.706 12.610 -4.149 1.00 0.39 H new ATOM 0 HA ILE A 27 -14.780 13.029 -6.924 1.00 0.39 H new ATOM 0 HB ILE A 27 -12.943 12.745 -4.545 1.00 0.41 H new ATOM 0 HG12 ILE A 27 -14.427 14.713 -4.168 1.00 0.46 H new ATOM 0 HG13 ILE A 27 -12.725 15.105 -4.313 1.00 0.46 H new ATOM 0 HG21 ILE A 27 -11.342 13.840 -6.084 1.00 0.48 H new ATOM 0 HG22 ILE A 27 -12.006 12.340 -6.775 1.00 0.48 H new ATOM 0 HG23 ILE A 27 -12.609 13.920 -7.331 1.00 0.48 H new ATOM 0 HD11 ILE A 27 -14.105 16.739 -5.497 1.00 0.78 H new ATOM 0 HD12 ILE A 27 -13.079 15.843 -6.642 1.00 0.78 H new ATOM 0 HD13 ILE A 27 -14.807 15.444 -6.496 1.00 0.78 H new ATOM 464 N LYS A 28 -14.700 10.519 -7.081 1.00 0.31 N ATOM 465 CA LYS A 28 -14.584 9.069 -7.254 1.00 0.30 C ATOM 466 C LYS A 28 -13.125 8.610 -7.294 1.00 0.30 C ATOM 467 O LYS A 28 -12.269 9.282 -7.868 1.00 0.35 O ATOM 468 CB LYS A 28 -15.312 8.643 -8.535 1.00 0.32 C ATOM 469 CG LYS A 28 -15.051 9.565 -9.720 1.00 0.66 C ATOM 470 CD LYS A 28 -15.745 9.078 -10.984 1.00 1.05 C ATOM 471 CE LYS A 28 -15.104 7.810 -11.521 1.00 1.84 C ATOM 472 NZ LYS A 28 -15.708 7.384 -12.810 1.00 2.41 N ATOM 0 H LYS A 28 -15.027 11.009 -7.913 1.00 0.31 H new ATOM 0 HA LYS A 28 -15.048 8.591 -6.391 1.00 0.30 H new ATOM 0 HB2 LYS A 28 -15.005 7.631 -8.798 1.00 0.32 H new ATOM 0 HB3 LYS A 28 -16.384 8.610 -8.340 1.00 0.32 H new ATOM 0 HG2 LYS A 28 -15.397 10.570 -9.480 1.00 0.66 H new ATOM 0 HG3 LYS A 28 -13.978 9.632 -9.898 1.00 0.66 H new ATOM 0 HD2 LYS A 28 -16.798 8.893 -10.773 1.00 1.05 H new ATOM 0 HD3 LYS A 28 -15.705 9.857 -11.745 1.00 1.05 H new ATOM 0 HE2 LYS A 28 -14.035 7.974 -11.658 1.00 1.84 H new ATOM 0 HE3 LYS A 28 -15.212 7.011 -10.788 1.00 1.84 H new ATOM 0 HZ1 LYS A 28 -15.242 6.515 -13.141 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -16.723 7.202 -12.675 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -15.582 8.136 -13.518 1.00 2.41 H new ATOM 486 N ILE A 29 -12.853 7.457 -6.687 1.00 0.28 N ATOM 487 CA ILE A 29 -11.498 6.907 -6.649 1.00 0.31 C ATOM 488 C ILE A 29 -11.450 5.458 -7.157 1.00 0.29 C ATOM 489 O ILE A 29 -12.194 4.571 -6.691 1.00 0.31 O ATOM 490 CB ILE A 29 -10.881 6.966 -5.230 1.00 0.34 C ATOM 491 CG1 ILE A 29 -11.916 7.429 -4.203 1.00 0.31 C ATOM 492 CG2 ILE A 29 -9.678 7.896 -5.221 1.00 0.43 C ATOM 493 CD1 ILE A 29 -11.491 7.231 -2.762 1.00 0.36 C ATOM 0 H ILE A 29 -13.552 6.885 -6.214 1.00 0.28 H new ATOM 0 HA ILE A 29 -10.907 7.536 -7.315 1.00 0.31 H new ATOM 0 HB ILE A 29 -10.556 5.962 -4.956 1.00 0.34 H new ATOM 0 HG12 ILE A 29 -12.126 8.486 -4.366 1.00 0.31 H new ATOM 0 HG13 ILE A 29 -12.847 6.889 -4.373 1.00 0.31 H new ATOM 0 HG21 ILE A 29 -9.252 7.930 -4.218 1.00 0.43 H new ATOM 0 HG22 ILE A 29 -8.928 7.528 -5.922 1.00 0.43 H new ATOM 0 HG23 ILE A 29 -9.990 8.898 -5.517 1.00 0.43 H new ATOM 0 HD11 ILE A 29 -12.280 7.584 -2.098 1.00 0.36 H new ATOM 0 HD12 ILE A 29 -11.310 6.172 -2.578 1.00 0.36 H new ATOM 0 HD13 ILE A 29 -10.577 7.794 -2.572 1.00 0.36 H new ATOM 505 N LEU A 30 -10.623 5.266 -8.182 1.00 0.30 N ATOM 506 CA LEU A 30 -10.401 3.959 -8.803 1.00 0.31 C ATOM 507 C LEU A 30 -9.047 3.375 -8.400 1.00 0.29 C ATOM 508 O LEU A 30 -8.273 4.017 -7.689 1.00 0.28 O ATOM 509 CB LEU A 30 -10.531 4.012 -10.329 1.00 0.36 C ATOM 510 CG LEU A 30 -9.814 5.161 -11.038 1.00 1.41 C ATOM 511 CD1 LEU A 30 -9.492 4.770 -12.473 1.00 1.97 C ATOM 512 CD2 LEU A 30 -10.676 6.416 -11.015 1.00 2.00 C ATOM 0 H LEU A 30 -10.083 6.018 -8.610 1.00 0.30 H new ATOM 0 HA LEU A 30 -11.186 3.300 -8.431 1.00 0.31 H new ATOM 0 HB2 LEU A 30 -10.155 3.073 -10.736 1.00 0.36 H new ATOM 0 HB3 LEU A 30 -11.591 4.066 -10.579 1.00 0.36 H new ATOM 0 HG LEU A 30 -8.882 5.370 -10.513 1.00 1.41 H new ATOM 0 HD11 LEU A 30 -8.981 5.595 -12.969 1.00 1.97 H new ATOM 0 HD12 LEU A 30 -8.847 3.891 -12.475 1.00 1.97 H new ATOM 0 HD13 LEU A 30 -10.416 4.543 -13.004 1.00 1.97 H new ATOM 0 HD21 LEU A 30 -10.153 7.226 -11.523 1.00 2.00 H new ATOM 0 HD22 LEU A 30 -11.620 6.218 -11.523 1.00 2.00 H new ATOM 0 HD23 LEU A 30 -10.873 6.703 -9.982 1.00 2.00 H new ATOM 524 N SER A 31 -8.755 2.165 -8.890 1.00 0.31 N ATOM 525 CA SER A 31 -7.496 1.470 -8.602 1.00 0.33 C ATOM 526 C SER A 31 -6.270 2.236 -9.113 1.00 0.33 C ATOM 527 O SER A 31 -5.141 1.908 -8.759 1.00 0.36 O ATOM 528 CB SER A 31 -7.519 0.081 -9.231 1.00 0.41 C ATOM 529 OG SER A 31 -7.985 0.142 -10.572 1.00 1.16 O ATOM 0 H SER A 31 -9.385 1.640 -9.497 1.00 0.31 H new ATOM 0 HA SER A 31 -7.411 1.398 -7.518 1.00 0.33 H new ATOM 0 HB2 SER A 31 -6.518 -0.350 -9.208 1.00 0.41 H new ATOM 0 HB3 SER A 31 -8.163 -0.577 -8.647 1.00 0.41 H new ATOM 0 HG SER A 31 -7.363 -0.339 -11.157 1.00 1.16 H new ATOM 535 N LYS A 32 -6.486 3.230 -9.970 1.00 0.34 N ATOM 536 CA LYS A 32 -5.388 4.038 -10.485 1.00 0.38 C ATOM 537 C LYS A 32 -4.712 4.766 -9.332 1.00 0.36 C ATOM 538 O LYS A 32 -3.549 5.168 -9.409 1.00 0.40 O ATOM 539 CB LYS A 32 -5.908 5.054 -11.500 1.00 0.45 C ATOM 540 CG LYS A 32 -4.892 5.421 -12.548 1.00 1.10 C ATOM 541 CD LYS A 32 -4.655 4.254 -13.482 1.00 1.55 C ATOM 542 CE LYS A 32 -4.382 4.732 -14.890 1.00 1.94 C ATOM 543 NZ LYS A 32 -3.049 5.382 -15.004 1.00 2.47 N ATOM 0 H LYS A 32 -7.407 3.493 -10.320 1.00 0.34 H new ATOM 0 HA LYS A 32 -4.668 3.386 -10.979 1.00 0.38 H new ATOM 0 HB2 LYS A 32 -6.794 4.648 -11.989 1.00 0.45 H new ATOM 0 HB3 LYS A 32 -6.219 5.956 -10.974 1.00 0.45 H new ATOM 0 HG2 LYS A 32 -5.240 6.284 -13.115 1.00 1.10 H new ATOM 0 HG3 LYS A 32 -3.955 5.710 -12.071 1.00 1.10 H new ATOM 0 HD2 LYS A 32 -3.811 3.664 -13.125 1.00 1.55 H new ATOM 0 HD3 LYS A 32 -5.526 3.599 -13.479 1.00 1.55 H new ATOM 0 HE2 LYS A 32 -4.435 3.887 -15.577 1.00 1.94 H new ATOM 0 HE3 LYS A 32 -5.157 5.437 -15.191 1.00 1.94 H new ATOM 0 HZ1 LYS A 32 -2.899 5.696 -15.984 1.00 2.47 H new ATOM 0 HZ2 LYS A 32 -3.007 6.203 -14.367 1.00 2.47 H new ATOM 0 HZ3 LYS A 32 -2.307 4.702 -14.741 1.00 2.47 H new ATOM 557 N ASN A 33 -5.476 4.933 -8.269 1.00 0.31 N ATOM 558 CA ASN A 33 -5.022 5.598 -7.065 1.00 0.33 C ATOM 559 C ASN A 33 -4.764 4.586 -5.957 1.00 0.30 C ATOM 560 O ASN A 33 -3.839 4.741 -5.170 1.00 0.38 O ATOM 561 CB ASN A 33 -6.090 6.605 -6.615 1.00 0.36 C ATOM 562 CG ASN A 33 -6.367 7.688 -7.644 1.00 0.75 C ATOM 563 OD1 ASN A 33 -7.387 8.372 -7.582 1.00 1.28 O ATOM 564 ND2 ASN A 33 -5.479 7.834 -8.612 1.00 1.12 N ATOM 0 H ASN A 33 -6.441 4.606 -8.218 1.00 0.31 H new ATOM 0 HA ASN A 33 -4.088 6.119 -7.276 1.00 0.33 H new ATOM 0 HB2 ASN A 33 -7.016 6.071 -6.402 1.00 0.36 H new ATOM 0 HB3 ASN A 33 -5.770 7.072 -5.684 1.00 0.36 H new ATOM 0 HD21 ASN A 33 -5.629 8.532 -9.340 1.00 1.12 H new ATOM 0 HD22 ASN A 33 -4.644 7.248 -8.631 1.00 1.12 H new ATOM 571 N ILE A 34 -5.577 3.538 -5.914 1.00 0.33 N ATOM 572 CA ILE A 34 -5.451 2.517 -4.880 1.00 0.33 C ATOM 573 C ILE A 34 -4.786 1.257 -5.419 1.00 0.29 C ATOM 574 O ILE A 34 -5.312 0.615 -6.328 1.00 0.30 O ATOM 575 CB ILE A 34 -6.822 2.111 -4.309 1.00 0.35 C ATOM 576 CG1 ILE A 34 -7.877 3.163 -4.645 1.00 0.53 C ATOM 577 CG2 ILE A 34 -6.726 1.894 -2.807 1.00 0.58 C ATOM 578 CD1 ILE A 34 -7.808 4.418 -3.800 1.00 0.59 C ATOM 0 H ILE A 34 -6.330 3.372 -6.582 1.00 0.33 H new ATOM 0 HA ILE A 34 -4.838 2.960 -4.095 1.00 0.33 H new ATOM 0 HB ILE A 34 -7.127 1.171 -4.770 1.00 0.35 H new ATOM 0 HG12 ILE A 34 -7.773 3.441 -5.694 1.00 0.53 H new ATOM 0 HG13 ILE A 34 -8.865 2.717 -4.530 1.00 0.53 H new ATOM 0 HG21 ILE A 34 -7.703 1.608 -2.418 1.00 0.58 H new ATOM 0 HG22 ILE A 34 -6.006 1.102 -2.599 1.00 0.58 H new ATOM 0 HG23 ILE A 34 -6.400 2.816 -2.326 1.00 0.58 H new ATOM 0 HD11 ILE A 34 -8.594 5.108 -4.108 1.00 0.59 H new ATOM 0 HD12 ILE A 34 -7.945 4.158 -2.750 1.00 0.59 H new ATOM 0 HD13 ILE A 34 -6.836 4.893 -3.932 1.00 0.59 H new ATOM 590 N VAL A 35 -3.655 0.888 -4.843 1.00 0.27 N ATOM 591 CA VAL A 35 -2.950 -0.312 -5.269 1.00 0.26 C ATOM 592 C VAL A 35 -3.055 -1.388 -4.193 1.00 0.25 C ATOM 593 O VAL A 35 -2.661 -1.178 -3.043 1.00 0.26 O ATOM 594 CB VAL A 35 -1.463 -0.042 -5.602 1.00 0.30 C ATOM 595 CG1 VAL A 35 -0.698 -1.348 -5.773 1.00 0.45 C ATOM 596 CG2 VAL A 35 -1.350 0.800 -6.863 1.00 0.51 C ATOM 0 H VAL A 35 -3.206 1.398 -4.083 1.00 0.27 H new ATOM 0 HA VAL A 35 -3.428 -0.656 -6.186 1.00 0.26 H new ATOM 0 HB VAL A 35 -1.022 0.506 -4.769 1.00 0.30 H new ATOM 0 HG11 VAL A 35 0.344 -1.131 -6.006 1.00 0.45 H new ATOM 0 HG12 VAL A 35 -0.751 -1.924 -4.849 1.00 0.45 H new ATOM 0 HG13 VAL A 35 -1.140 -1.925 -6.586 1.00 0.45 H new ATOM 0 HG21 VAL A 35 -0.299 0.982 -7.086 1.00 0.51 H new ATOM 0 HG22 VAL A 35 -1.811 0.270 -7.697 1.00 0.51 H new ATOM 0 HG23 VAL A 35 -1.859 1.752 -6.712 1.00 0.51 H new ATOM 606 N ALA A 36 -3.609 -2.528 -4.577 1.00 0.25 N ATOM 607 CA ALA A 36 -3.792 -3.646 -3.667 1.00 0.25 C ATOM 608 C ALA A 36 -2.494 -4.391 -3.431 1.00 0.24 C ATOM 609 O ALA A 36 -1.754 -4.696 -4.368 1.00 0.27 O ATOM 610 CB ALA A 36 -4.849 -4.596 -4.200 1.00 0.30 C ATOM 0 H ALA A 36 -3.943 -2.703 -5.525 1.00 0.25 H new ATOM 0 HA ALA A 36 -4.125 -3.241 -2.711 1.00 0.25 H new ATOM 0 HB1 ALA A 36 -4.974 -5.428 -3.507 1.00 0.30 H new ATOM 0 HB2 ALA A 36 -5.796 -4.066 -4.304 1.00 0.30 H new ATOM 0 HB3 ALA A 36 -4.538 -4.978 -5.172 1.00 0.30 H new ATOM 616 N VAL A 37 -2.233 -4.679 -2.172 1.00 0.23 N ATOM 617 CA VAL A 37 -1.040 -5.387 -1.777 1.00 0.24 C ATOM 618 C VAL A 37 -1.351 -6.357 -0.651 1.00 0.25 C ATOM 619 O VAL A 37 -2.304 -6.167 0.133 1.00 0.25 O ATOM 620 CB VAL A 37 0.077 -4.430 -1.324 1.00 0.27 C ATOM 621 CG1 VAL A 37 0.750 -3.780 -2.522 1.00 0.29 C ATOM 622 CG2 VAL A 37 -0.480 -3.379 -0.378 1.00 0.30 C ATOM 0 H VAL A 37 -2.845 -4.427 -1.396 1.00 0.23 H new ATOM 0 HA VAL A 37 -0.688 -5.932 -2.653 1.00 0.24 H new ATOM 0 HB VAL A 37 0.831 -5.008 -0.790 1.00 0.27 H new ATOM 0 HG11 VAL A 37 1.536 -3.108 -2.177 1.00 0.29 H new ATOM 0 HG12 VAL A 37 1.185 -4.551 -3.158 1.00 0.29 H new ATOM 0 HG13 VAL A 37 0.012 -3.214 -3.091 1.00 0.29 H new ATOM 0 HG21 VAL A 37 0.321 -2.709 -0.066 1.00 0.30 H new ATOM 0 HG22 VAL A 37 -1.255 -2.806 -0.887 1.00 0.30 H new ATOM 0 HG23 VAL A 37 -0.907 -3.867 0.498 1.00 0.30 H new ATOM 632 N GLY A 38 -0.600 -7.435 -0.626 1.00 0.27 N ATOM 633 CA GLY A 38 -0.785 -8.424 0.397 1.00 0.30 C ATOM 634 C GLY A 38 -0.371 -9.801 -0.055 1.00 0.32 C ATOM 635 O GLY A 38 0.390 -9.963 -1.024 1.00 0.32 O ATOM 0 H GLY A 38 0.138 -7.643 -1.299 1.00 0.27 H new ATOM 0 HA2 GLY A 38 -0.207 -8.144 1.278 1.00 0.30 H new ATOM 0 HA3 GLY A 38 -1.833 -8.442 0.696 1.00 0.30 H new ATOM 639 N SER A 39 -0.891 -10.803 0.631 1.00 0.38 N ATOM 640 CA SER A 39 -0.626 -12.179 0.281 1.00 0.43 C ATOM 641 C SER A 39 -1.160 -12.454 -1.118 1.00 0.43 C ATOM 642 O SER A 39 -0.653 -13.319 -1.822 1.00 0.44 O ATOM 643 CB SER A 39 -1.269 -13.097 1.302 1.00 0.57 C ATOM 644 OG SER A 39 -0.953 -12.666 2.612 1.00 1.40 O ATOM 0 H SER A 39 -1.503 -10.684 1.438 1.00 0.38 H new ATOM 0 HA SER A 39 0.448 -12.366 0.285 1.00 0.43 H new ATOM 0 HB2 SER A 39 -2.350 -13.105 1.165 1.00 0.57 H new ATOM 0 HB3 SER A 39 -0.921 -14.119 1.153 1.00 0.57 H new ATOM 0 HG SER A 39 -1.374 -13.264 3.264 1.00 1.40 H new ATOM 650 N LEU A 40 -2.187 -11.693 -1.512 1.00 0.45 N ATOM 651 CA LEU A 40 -2.769 -11.810 -2.845 1.00 0.51 C ATOM 652 C LEU A 40 -1.704 -11.494 -3.885 1.00 0.47 C ATOM 653 O LEU A 40 -1.664 -12.087 -4.963 1.00 0.52 O ATOM 654 CB LEU A 40 -3.965 -10.855 -2.995 1.00 0.63 C ATOM 655 CG LEU A 40 -3.967 -9.973 -4.251 1.00 0.97 C ATOM 656 CD1 LEU A 40 -5.212 -10.232 -5.092 1.00 1.24 C ATOM 657 CD2 LEU A 40 -3.879 -8.504 -3.866 1.00 2.02 C ATOM 0 H LEU A 40 -2.630 -10.989 -0.922 1.00 0.45 H new ATOM 0 HA LEU A 40 -3.129 -12.828 -2.993 1.00 0.51 H new ATOM 0 HB2 LEU A 40 -4.880 -11.447 -2.989 1.00 0.63 H new ATOM 0 HB3 LEU A 40 -3.999 -10.207 -2.120 1.00 0.63 H new ATOM 0 HG LEU A 40 -3.093 -10.228 -4.851 1.00 0.97 H new ATOM 0 HD11 LEU A 40 -5.192 -9.596 -5.977 1.00 1.24 H new ATOM 0 HD12 LEU A 40 -5.234 -11.278 -5.397 1.00 1.24 H new ATOM 0 HD13 LEU A 40 -6.102 -10.007 -4.504 1.00 1.24 H new ATOM 0 HD21 LEU A 40 -3.881 -7.891 -4.767 1.00 2.02 H new ATOM 0 HD22 LEU A 40 -4.734 -8.239 -3.244 1.00 2.02 H new ATOM 0 HD23 LEU A 40 -2.958 -8.328 -3.310 1.00 2.02 H new ATOM 669 N ARG A 41 -0.827 -10.558 -3.533 1.00 0.43 N ATOM 670 CA ARG A 41 0.259 -10.169 -4.408 1.00 0.47 C ATOM 671 C ARG A 41 1.275 -11.302 -4.437 1.00 0.47 C ATOM 672 O ARG A 41 1.861 -11.604 -5.478 1.00 0.54 O ATOM 673 CB ARG A 41 0.900 -8.861 -3.910 1.00 0.50 C ATOM 674 CG ARG A 41 1.955 -8.278 -4.843 1.00 0.92 C ATOM 675 CD ARG A 41 3.328 -8.873 -4.575 1.00 1.30 C ATOM 676 NE ARG A 41 4.370 -8.263 -5.397 1.00 1.82 N ATOM 677 CZ ARG A 41 4.767 -8.740 -6.575 1.00 2.29 C ATOM 678 NH1 ARG A 41 4.194 -9.830 -7.081 1.00 2.67 N ATOM 679 NH2 ARG A 41 5.738 -8.126 -7.245 1.00 2.98 N ATOM 0 H ARG A 41 -0.853 -10.058 -2.645 1.00 0.43 H new ATOM 0 HA ARG A 41 -0.112 -9.988 -5.417 1.00 0.47 H new ATOM 0 HB2 ARG A 41 0.115 -8.120 -3.762 1.00 0.50 H new ATOM 0 HB3 ARG A 41 1.355 -9.042 -2.936 1.00 0.50 H new ATOM 0 HG2 ARG A 41 1.671 -8.468 -5.878 1.00 0.92 H new ATOM 0 HG3 ARG A 41 1.996 -7.196 -4.717 1.00 0.92 H new ATOM 0 HD2 ARG A 41 3.578 -8.744 -3.522 1.00 1.30 H new ATOM 0 HD3 ARG A 41 3.300 -9.946 -4.766 1.00 1.30 H new ATOM 0 HE ARG A 41 4.822 -7.418 -5.047 1.00 1.82 H new ATOM 0 HH11 ARG A 41 3.450 -10.301 -6.566 1.00 2.67 H new ATOM 0 HH12 ARG A 41 4.499 -10.194 -7.984 1.00 2.67 H new ATOM 0 HH21 ARG A 41 6.177 -7.291 -6.856 1.00 2.98 H new ATOM 0 HH22 ARG A 41 6.044 -8.490 -8.148 1.00 2.98 H new ATOM 693 N ARG A 42 1.494 -11.920 -3.275 1.00 0.43 N ATOM 694 CA ARG A 42 2.424 -13.044 -3.158 1.00 0.48 C ATOM 695 C ARG A 42 1.819 -14.377 -3.662 1.00 0.47 C ATOM 696 O ARG A 42 2.524 -15.390 -3.727 1.00 0.52 O ATOM 697 CB ARG A 42 2.885 -13.175 -1.707 1.00 0.52 C ATOM 698 CG ARG A 42 4.007 -14.177 -1.508 1.00 1.06 C ATOM 699 CD ARG A 42 4.193 -14.510 -0.043 1.00 1.93 C ATOM 700 NE ARG A 42 4.536 -15.917 0.154 1.00 2.68 N ATOM 701 CZ ARG A 42 4.658 -16.496 1.345 1.00 3.60 C ATOM 702 NH1 ARG A 42 4.440 -15.804 2.459 1.00 3.96 N ATOM 703 NH2 ARG A 42 4.984 -17.777 1.423 1.00 4.52 N ATOM 0 H ARG A 42 1.039 -11.660 -2.400 1.00 0.43 H new ATOM 0 HA ARG A 42 3.279 -12.833 -3.800 1.00 0.48 H new ATOM 0 HB2 ARG A 42 3.215 -12.199 -1.351 1.00 0.52 H new ATOM 0 HB3 ARG A 42 2.035 -13.468 -1.091 1.00 0.52 H new ATOM 0 HG2 ARG A 42 3.787 -15.088 -2.065 1.00 1.06 H new ATOM 0 HG3 ARG A 42 4.935 -13.772 -1.912 1.00 1.06 H new ATOM 0 HD2 ARG A 42 4.979 -13.882 0.376 1.00 1.93 H new ATOM 0 HD3 ARG A 42 3.277 -14.279 0.501 1.00 1.93 H new ATOM 0 HE ARG A 42 4.692 -16.491 -0.674 1.00 2.68 H new ATOM 0 HH11 ARG A 42 4.177 -14.820 2.405 1.00 3.96 H new ATOM 0 HH12 ARG A 42 4.536 -16.257 3.368 1.00 3.96 H new ATOM 0 HH21 ARG A 42 5.141 -18.316 0.571 1.00 4.52 H new ATOM 0 HH22 ARG A 42 5.079 -18.225 2.335 1.00 4.52 H new ATOM 717 N GLU A 43 0.514 -14.376 -3.990 1.00 0.46 N ATOM 718 CA GLU A 43 -0.168 -15.566 -4.530 1.00 0.50 C ATOM 719 C GLU A 43 -0.464 -16.624 -3.446 1.00 0.47 C ATOM 720 O GLU A 43 -0.011 -17.769 -3.528 1.00 0.52 O ATOM 721 CB GLU A 43 0.630 -16.139 -5.710 1.00 0.59 C ATOM 722 CG GLU A 43 0.899 -15.081 -6.772 1.00 0.67 C ATOM 723 CD GLU A 43 1.880 -15.527 -7.836 1.00 0.95 C ATOM 724 OE1 GLU A 43 3.100 -15.334 -7.650 1.00 1.53 O ATOM 725 OE2 GLU A 43 1.432 -16.065 -8.870 1.00 1.60 O ATOM 0 H GLU A 43 -0.091 -13.561 -3.890 1.00 0.46 H new ATOM 0 HA GLU A 43 -1.145 -15.255 -4.901 1.00 0.50 H new ATOM 0 HB2 GLU A 43 1.576 -16.541 -5.349 1.00 0.59 H new ATOM 0 HB3 GLU A 43 0.079 -16.969 -6.153 1.00 0.59 H new ATOM 0 HG2 GLU A 43 -0.043 -14.809 -7.249 1.00 0.67 H new ATOM 0 HG3 GLU A 43 1.283 -14.183 -6.289 1.00 0.67 H new ATOM 732 N GLU A 44 -1.191 -16.206 -2.414 1.00 0.43 N ATOM 733 CA GLU A 44 -1.570 -17.050 -1.278 1.00 0.43 C ATOM 734 C GLU A 44 -2.862 -17.843 -1.526 1.00 0.43 C ATOM 735 O GLU A 44 -3.625 -17.544 -2.445 1.00 0.52 O ATOM 736 CB GLU A 44 -1.715 -16.179 -0.030 1.00 0.48 C ATOM 737 CG GLU A 44 -3.154 -15.854 0.380 1.00 1.24 C ATOM 738 CD GLU A 44 -3.967 -15.157 -0.706 1.00 1.94 C ATOM 739 OE1 GLU A 44 -3.365 -14.457 -1.541 1.00 2.47 O ATOM 740 OE2 GLU A 44 -5.208 -15.333 -0.731 1.00 2.57 O ATOM 0 H GLU A 44 -1.542 -15.251 -2.340 1.00 0.43 H new ATOM 0 HA GLU A 44 -0.778 -17.786 -1.137 1.00 0.43 H new ATOM 0 HB2 GLU A 44 -1.223 -16.682 0.802 1.00 0.48 H new ATOM 0 HB3 GLU A 44 -1.182 -15.243 -0.197 1.00 0.48 H new ATOM 0 HG2 GLU A 44 -3.659 -16.779 0.660 1.00 1.24 H new ATOM 0 HG3 GLU A 44 -3.134 -15.221 1.267 1.00 1.24 H new ATOM 747 N LYS A 45 -3.042 -18.924 -0.764 1.00 0.46 N ATOM 748 CA LYS A 45 -4.245 -19.746 -0.863 1.00 0.50 C ATOM 749 C LYS A 45 -5.388 -19.162 -0.020 1.00 0.49 C ATOM 750 O LYS A 45 -6.545 -19.186 -0.438 1.00 0.56 O ATOM 751 CB LYS A 45 -3.970 -21.192 -0.429 1.00 0.59 C ATOM 752 CG LYS A 45 -3.957 -22.187 -1.587 1.00 1.14 C ATOM 753 CD LYS A 45 -2.544 -22.570 -2.002 1.00 1.28 C ATOM 754 CE LYS A 45 -1.716 -21.356 -2.389 1.00 1.42 C ATOM 755 NZ LYS A 45 -0.432 -21.740 -3.030 1.00 2.10 N ATOM 0 H LYS A 45 -2.368 -19.249 -0.071 1.00 0.46 H new ATOM 0 HA LYS A 45 -4.546 -19.747 -1.911 1.00 0.50 H new ATOM 0 HB2 LYS A 45 -3.009 -21.232 0.084 1.00 0.59 H new ATOM 0 HB3 LYS A 45 -4.729 -21.496 0.292 1.00 0.59 H new ATOM 0 HG2 LYS A 45 -4.505 -23.084 -1.299 1.00 1.14 H new ATOM 0 HG3 LYS A 45 -4.480 -21.755 -2.440 1.00 1.14 H new ATOM 0 HD2 LYS A 45 -2.055 -23.096 -1.182 1.00 1.28 H new ATOM 0 HD3 LYS A 45 -2.588 -23.262 -2.843 1.00 1.28 H new ATOM 0 HE2 LYS A 45 -2.289 -20.729 -3.072 1.00 1.42 H new ATOM 0 HE3 LYS A 45 -1.513 -20.757 -1.501 1.00 1.42 H new ATOM 0 HZ1 LYS A 45 0.102 -20.883 -3.278 1.00 2.10 H new ATOM 0 HZ2 LYS A 45 0.127 -22.317 -2.369 1.00 2.10 H new ATOM 0 HZ3 LYS A 45 -0.625 -22.289 -3.892 1.00 2.10 H new ATOM 769 N MET A 46 -5.053 -18.638 1.159 1.00 0.46 N ATOM 770 CA MET A 46 -6.056 -18.052 2.048 1.00 0.48 C ATOM 771 C MET A 46 -5.573 -16.721 2.617 1.00 0.46 C ATOM 772 O MET A 46 -4.438 -16.613 3.082 1.00 0.67 O ATOM 773 CB MET A 46 -6.372 -19.012 3.201 1.00 0.60 C ATOM 774 CG MET A 46 -7.490 -18.532 4.114 1.00 0.67 C ATOM 775 SD MET A 46 -7.586 -19.468 5.654 1.00 1.15 S ATOM 776 CE MET A 46 -6.165 -18.825 6.540 1.00 2.00 C ATOM 0 H MET A 46 -4.099 -18.607 1.519 1.00 0.46 H new ATOM 0 HA MET A 46 -6.958 -17.877 1.462 1.00 0.48 H new ATOM 0 HB2 MET A 46 -6.645 -19.983 2.788 1.00 0.60 H new ATOM 0 HB3 MET A 46 -5.470 -19.161 3.795 1.00 0.60 H new ATOM 0 HG2 MET A 46 -7.338 -17.478 4.344 1.00 0.67 H new ATOM 0 HG3 MET A 46 -8.441 -18.609 3.587 1.00 0.67 H new ATOM 0 HE1 MET A 46 -6.238 -19.099 7.592 1.00 2.00 H new ATOM 0 HE2 MET A 46 -5.252 -19.246 6.118 1.00 2.00 H new ATOM 0 HE3 MET A 46 -6.140 -17.739 6.449 1.00 2.00 H new ATOM 786 N LEU A 47 -6.463 -15.736 2.627 1.00 0.49 N ATOM 787 CA LEU A 47 -6.143 -14.411 3.140 1.00 0.56 C ATOM 788 C LEU A 47 -7.024 -14.034 4.337 1.00 0.55 C ATOM 789 O LEU A 47 -8.034 -14.686 4.624 1.00 0.59 O ATOM 790 CB LEU A 47 -6.270 -13.367 2.015 1.00 0.82 C ATOM 791 CG LEU A 47 -4.983 -12.582 1.731 1.00 0.43 C ATOM 792 CD1 LEU A 47 -5.074 -11.759 0.455 1.00 1.09 C ATOM 793 CD2 LEU A 47 -4.670 -11.666 2.882 1.00 1.09 C ATOM 0 H LEU A 47 -7.418 -15.832 2.283 1.00 0.49 H new ATOM 0 HA LEU A 47 -5.113 -14.427 3.495 1.00 0.56 H new ATOM 0 HB2 LEU A 47 -6.582 -13.872 1.101 1.00 0.82 H new ATOM 0 HB3 LEU A 47 -7.060 -12.663 2.276 1.00 0.82 H new ATOM 0 HG LEU A 47 -4.188 -13.317 1.603 1.00 0.43 H new ATOM 0 HD11 LEU A 47 -4.138 -11.223 0.300 1.00 1.09 H new ATOM 0 HD12 LEU A 47 -5.258 -12.420 -0.392 1.00 1.09 H new ATOM 0 HD13 LEU A 47 -5.892 -11.043 0.541 1.00 1.09 H new ATOM 0 HD21 LEU A 47 -3.754 -11.114 2.669 1.00 1.09 H new ATOM 0 HD22 LEU A 47 -5.492 -10.964 3.023 1.00 1.09 H new ATOM 0 HD23 LEU A 47 -4.536 -12.255 3.790 1.00 1.09 H new ATOM 805 N ASN A 48 -6.621 -12.984 5.040 1.00 0.61 N ATOM 806 CA ASN A 48 -7.354 -12.509 6.210 1.00 0.64 C ATOM 807 C ASN A 48 -7.820 -11.079 6.005 1.00 0.52 C ATOM 808 O ASN A 48 -8.978 -10.743 6.249 1.00 0.54 O ATOM 809 CB ASN A 48 -6.465 -12.576 7.457 1.00 0.77 C ATOM 810 CG ASN A 48 -7.242 -12.351 8.743 1.00 1.47 C ATOM 811 OD1 ASN A 48 -8.038 -13.192 9.150 1.00 2.03 O ATOM 812 ND2 ASN A 48 -7.000 -11.224 9.403 1.00 2.14 N ATOM 0 H ASN A 48 -5.786 -12.441 4.820 1.00 0.61 H new ATOM 0 HA ASN A 48 -8.223 -13.152 6.348 1.00 0.64 H new ATOM 0 HB2 ASN A 48 -5.976 -13.549 7.498 1.00 0.77 H new ATOM 0 HB3 ASN A 48 -5.677 -11.827 7.377 1.00 0.77 H new ATOM 0 HD21 ASN A 48 -7.483 -11.033 10.281 1.00 2.14 H new ATOM 0 HD22 ASN A 48 -6.331 -10.549 9.032 1.00 2.14 H new ATOM 819 N ASP A 49 -6.909 -10.248 5.540 1.00 0.49 N ATOM 820 CA ASP A 49 -7.192 -8.850 5.315 1.00 0.39 C ATOM 821 C ASP A 49 -6.539 -8.398 4.026 1.00 0.34 C ATOM 822 O ASP A 49 -5.446 -8.846 3.702 1.00 0.42 O ATOM 823 CB ASP A 49 -6.669 -8.024 6.499 1.00 0.43 C ATOM 824 CG ASP A 49 -5.180 -7.673 6.413 1.00 0.52 C ATOM 825 OD1 ASP A 49 -4.311 -8.590 6.343 1.00 1.02 O ATOM 826 OD2 ASP A 49 -4.854 -6.471 6.449 1.00 1.05 O ATOM 0 H ASP A 49 -5.955 -10.525 5.309 1.00 0.49 H new ATOM 0 HA ASP A 49 -8.269 -8.704 5.231 1.00 0.39 H new ATOM 0 HB2 ASP A 49 -7.245 -7.101 6.566 1.00 0.43 H new ATOM 0 HB3 ASP A 49 -6.847 -8.578 7.421 1.00 0.43 H new ATOM 831 N VAL A 50 -7.204 -7.532 3.283 1.00 0.28 N ATOM 832 CA VAL A 50 -6.629 -7.043 2.042 1.00 0.27 C ATOM 833 C VAL A 50 -6.090 -5.661 2.282 1.00 0.24 C ATOM 834 O VAL A 50 -6.779 -4.802 2.840 1.00 0.26 O ATOM 835 CB VAL A 50 -7.629 -7.022 0.877 1.00 0.36 C ATOM 836 CG1 VAL A 50 -6.929 -6.600 -0.407 1.00 0.88 C ATOM 837 CG2 VAL A 50 -8.269 -8.389 0.719 1.00 0.90 C ATOM 0 H VAL A 50 -8.125 -7.158 3.510 1.00 0.28 H new ATOM 0 HA VAL A 50 -5.836 -7.730 1.748 1.00 0.27 H new ATOM 0 HB VAL A 50 -8.414 -6.297 1.092 1.00 0.36 H new ATOM 0 HG11 VAL A 50 -7.648 -6.589 -1.226 1.00 0.88 H new ATOM 0 HG12 VAL A 50 -6.507 -5.603 -0.281 1.00 0.88 H new ATOM 0 HG13 VAL A 50 -6.130 -7.306 -0.635 1.00 0.88 H new ATOM 0 HG21 VAL A 50 -8.977 -8.366 -0.109 1.00 0.90 H new ATOM 0 HG22 VAL A 50 -7.497 -9.131 0.516 1.00 0.90 H new ATOM 0 HG23 VAL A 50 -8.793 -8.654 1.637 1.00 0.90 H new ATOM 847 N ASP A 51 -4.856 -5.441 1.898 1.00 0.24 N ATOM 848 CA ASP A 51 -4.242 -4.181 2.143 1.00 0.24 C ATOM 849 C ASP A 51 -4.112 -3.382 0.849 1.00 0.24 C ATOM 850 O ASP A 51 -3.897 -3.942 -0.224 1.00 0.26 O ATOM 851 CB ASP A 51 -2.936 -4.498 2.848 1.00 0.27 C ATOM 852 CG ASP A 51 -3.186 -5.402 4.075 1.00 0.31 C ATOM 853 OD1 ASP A 51 -3.306 -6.658 3.944 1.00 0.40 O ATOM 854 OD2 ASP A 51 -3.247 -4.875 5.208 1.00 0.38 O ATOM 0 H ASP A 51 -4.268 -6.122 1.417 1.00 0.24 H new ATOM 0 HA ASP A 51 -4.833 -3.525 2.782 1.00 0.24 H new ATOM 0 HB2 ASP A 51 -2.255 -4.994 2.157 1.00 0.27 H new ATOM 0 HB3 ASP A 51 -2.453 -3.573 3.163 1.00 0.27 H new ATOM 859 N LEU A 52 -4.292 -2.073 0.950 1.00 0.26 N ATOM 860 CA LEU A 52 -4.272 -1.202 -0.218 1.00 0.31 C ATOM 861 C LEU A 52 -3.692 0.181 0.078 1.00 0.25 C ATOM 862 O LEU A 52 -4.110 0.858 1.019 1.00 0.32 O ATOM 863 CB LEU A 52 -5.703 -1.022 -0.728 1.00 0.41 C ATOM 864 CG LEU A 52 -6.282 -2.200 -1.505 1.00 0.64 C ATOM 865 CD1 LEU A 52 -7.471 -2.798 -0.775 1.00 1.28 C ATOM 866 CD2 LEU A 52 -6.680 -1.755 -2.898 1.00 1.07 C ATOM 0 H LEU A 52 -4.454 -1.588 1.833 1.00 0.26 H new ATOM 0 HA LEU A 52 -3.632 -1.679 -0.961 1.00 0.31 H new ATOM 0 HB2 LEU A 52 -6.350 -0.820 0.125 1.00 0.41 H new ATOM 0 HB3 LEU A 52 -5.733 -0.139 -1.367 1.00 0.41 H new ATOM 0 HG LEU A 52 -5.517 -2.972 -1.587 1.00 0.64 H new ATOM 0 HD11 LEU A 52 -7.866 -3.636 -1.349 1.00 1.28 H new ATOM 0 HD12 LEU A 52 -7.156 -3.148 0.208 1.00 1.28 H new ATOM 0 HD13 LEU A 52 -8.246 -2.040 -0.659 1.00 1.28 H new ATOM 0 HD21 LEU A 52 -7.093 -2.602 -3.447 1.00 1.07 H new ATOM 0 HD22 LEU A 52 -7.431 -0.968 -2.828 1.00 1.07 H new ATOM 0 HD23 LEU A 52 -5.804 -1.375 -3.423 1.00 1.07 H new ATOM 878 N LEU A 53 -2.723 0.602 -0.719 1.00 0.27 N ATOM 879 CA LEU A 53 -2.138 1.927 -0.552 1.00 0.31 C ATOM 880 C LEU A 53 -2.693 2.891 -1.595 1.00 0.26 C ATOM 881 O LEU A 53 -2.880 2.528 -2.756 1.00 0.26 O ATOM 882 CB LEU A 53 -0.612 1.873 -0.639 1.00 0.48 C ATOM 883 CG LEU A 53 -0.051 1.071 -1.811 1.00 0.79 C ATOM 884 CD1 LEU A 53 0.961 1.897 -2.587 1.00 1.59 C ATOM 885 CD2 LEU A 53 0.584 -0.214 -1.312 1.00 1.06 C ATOM 0 H LEU A 53 -2.326 0.053 -1.482 1.00 0.27 H new ATOM 0 HA LEU A 53 -2.408 2.289 0.440 1.00 0.31 H new ATOM 0 HB2 LEU A 53 -0.232 2.893 -0.704 1.00 0.48 H new ATOM 0 HB3 LEU A 53 -0.227 1.448 0.288 1.00 0.48 H new ATOM 0 HG LEU A 53 -0.872 0.817 -2.481 1.00 0.79 H new ATOM 0 HD11 LEU A 53 1.350 1.309 -3.418 1.00 1.59 H new ATOM 0 HD12 LEU A 53 0.479 2.795 -2.972 1.00 1.59 H new ATOM 0 HD13 LEU A 53 1.782 2.180 -1.928 1.00 1.59 H new ATOM 0 HD21 LEU A 53 0.980 -0.776 -2.158 1.00 1.06 H new ATOM 0 HD22 LEU A 53 1.394 0.024 -0.623 1.00 1.06 H new ATOM 0 HD23 LEU A 53 -0.166 -0.814 -0.796 1.00 1.06 H new ATOM 897 N ILE A 54 -2.961 4.113 -1.168 1.00 0.26 N ATOM 898 CA ILE A 54 -3.498 5.140 -2.049 1.00 0.25 C ATOM 899 C ILE A 54 -2.397 6.107 -2.462 1.00 0.25 C ATOM 900 O ILE A 54 -1.905 6.880 -1.637 1.00 0.27 O ATOM 901 CB ILE A 54 -4.625 5.937 -1.358 1.00 0.29 C ATOM 902 CG1 ILE A 54 -5.681 4.994 -0.776 1.00 0.52 C ATOM 903 CG2 ILE A 54 -5.264 6.919 -2.331 1.00 0.41 C ATOM 904 CD1 ILE A 54 -6.685 5.687 0.124 1.00 0.58 C ATOM 0 H ILE A 54 -2.814 4.422 -0.207 1.00 0.26 H new ATOM 0 HA ILE A 54 -3.905 4.639 -2.927 1.00 0.25 H new ATOM 0 HB ILE A 54 -4.184 6.503 -0.538 1.00 0.29 H new ATOM 0 HG12 ILE A 54 -6.213 4.509 -1.594 1.00 0.52 H new ATOM 0 HG13 ILE A 54 -5.181 4.207 -0.211 1.00 0.52 H new ATOM 0 HG21 ILE A 54 -6.056 7.470 -1.824 1.00 0.41 H new ATOM 0 HG22 ILE A 54 -4.509 7.617 -2.692 1.00 0.41 H new ATOM 0 HG23 ILE A 54 -5.685 6.373 -3.175 1.00 0.41 H new ATOM 0 HD11 ILE A 54 -7.402 4.957 0.499 1.00 0.58 H new ATOM 0 HD12 ILE A 54 -6.164 6.148 0.963 1.00 0.58 H new ATOM 0 HD13 ILE A 54 -7.212 6.455 -0.442 1.00 0.58 H new ATOM 916 N ILE A 55 -2.004 6.052 -3.724 1.00 0.25 N ATOM 917 CA ILE A 55 -0.963 6.920 -4.249 1.00 0.26 C ATOM 918 C ILE A 55 -1.574 8.138 -4.918 1.00 0.25 C ATOM 919 O ILE A 55 -2.291 8.018 -5.914 1.00 0.29 O ATOM 920 CB ILE A 55 -0.085 6.192 -5.287 1.00 0.30 C ATOM 921 CG1 ILE A 55 0.290 4.796 -4.800 1.00 0.35 C ATOM 922 CG2 ILE A 55 1.159 6.999 -5.602 1.00 0.48 C ATOM 923 CD1 ILE A 55 -0.647 3.731 -5.308 1.00 0.44 C ATOM 0 H ILE A 55 -2.396 5.407 -4.411 1.00 0.25 H new ATOM 0 HA ILE A 55 -0.345 7.220 -3.403 1.00 0.26 H new ATOM 0 HB ILE A 55 -0.666 6.088 -6.203 1.00 0.30 H new ATOM 0 HG12 ILE A 55 1.305 4.564 -5.122 1.00 0.35 H new ATOM 0 HG13 ILE A 55 0.290 4.784 -3.710 1.00 0.35 H new ATOM 0 HG21 ILE A 55 1.763 6.465 -6.336 1.00 0.48 H new ATOM 0 HG22 ILE A 55 0.871 7.970 -6.006 1.00 0.48 H new ATOM 0 HG23 ILE A 55 1.740 7.143 -4.691 1.00 0.48 H new ATOM 0 HD11 ILE A 55 -0.332 2.759 -4.930 1.00 0.44 H new ATOM 0 HD12 ILE A 55 -1.659 3.943 -4.964 1.00 0.44 H new ATOM 0 HD13 ILE A 55 -0.629 3.720 -6.398 1.00 0.44 H new ATOM 935 N VAL A 56 -1.291 9.304 -4.374 1.00 0.24 N ATOM 936 CA VAL A 56 -1.814 10.543 -4.924 1.00 0.26 C ATOM 937 C VAL A 56 -0.675 11.491 -5.305 1.00 0.27 C ATOM 938 O VAL A 56 0.266 11.687 -4.532 1.00 0.25 O ATOM 939 CB VAL A 56 -2.768 11.238 -3.923 1.00 0.28 C ATOM 940 CG1 VAL A 56 -3.510 12.391 -4.581 1.00 0.34 C ATOM 941 CG2 VAL A 56 -3.753 10.232 -3.341 1.00 0.33 C ATOM 0 H VAL A 56 -0.701 9.422 -3.550 1.00 0.24 H new ATOM 0 HA VAL A 56 -2.379 10.293 -5.822 1.00 0.26 H new ATOM 0 HB VAL A 56 -2.165 11.647 -3.112 1.00 0.28 H new ATOM 0 HG11 VAL A 56 -4.173 12.860 -3.853 1.00 0.34 H new ATOM 0 HG12 VAL A 56 -2.792 13.126 -4.944 1.00 0.34 H new ATOM 0 HG13 VAL A 56 -4.098 12.015 -5.418 1.00 0.34 H new ATOM 0 HG21 VAL A 56 -4.417 10.737 -2.639 1.00 0.33 H new ATOM 0 HG22 VAL A 56 -4.342 9.793 -4.146 1.00 0.33 H new ATOM 0 HG23 VAL A 56 -3.206 9.446 -2.821 1.00 0.33 H new ATOM 951 N PRO A 57 -0.730 12.070 -6.523 1.00 0.31 N ATOM 952 CA PRO A 57 0.299 13.001 -7.013 1.00 0.34 C ATOM 953 C PRO A 57 0.303 14.335 -6.274 1.00 0.34 C ATOM 954 O PRO A 57 1.182 15.168 -6.493 1.00 0.37 O ATOM 955 CB PRO A 57 -0.078 13.212 -8.484 1.00 0.39 C ATOM 956 CG PRO A 57 -1.529 12.896 -8.567 1.00 0.41 C ATOM 957 CD PRO A 57 -1.783 11.834 -7.534 1.00 0.37 C ATOM 0 HA PRO A 57 1.300 12.598 -6.862 1.00 0.34 H new ATOM 0 HB2 PRO A 57 0.120 14.237 -8.797 1.00 0.39 H new ATOM 0 HB3 PRO A 57 0.504 12.561 -9.136 1.00 0.39 H new ATOM 0 HG2 PRO A 57 -2.133 13.782 -8.372 1.00 0.41 H new ATOM 0 HG3 PRO A 57 -1.795 12.542 -9.563 1.00 0.41 H new ATOM 0 HD2 PRO A 57 -2.780 11.925 -7.103 1.00 0.37 H new ATOM 0 HD3 PRO A 57 -1.711 10.834 -7.962 1.00 0.37 H new ATOM 965 N GLU A 58 -0.673 14.531 -5.400 1.00 0.33 N ATOM 966 CA GLU A 58 -0.775 15.761 -4.637 1.00 0.36 C ATOM 967 C GLU A 58 -1.045 15.465 -3.173 1.00 0.35 C ATOM 968 O GLU A 58 -1.923 14.666 -2.841 1.00 0.34 O ATOM 969 CB GLU A 58 -1.884 16.656 -5.186 1.00 0.40 C ATOM 970 CG GLU A 58 -1.602 17.201 -6.574 1.00 0.64 C ATOM 971 CD GLU A 58 -2.734 18.054 -7.103 1.00 1.32 C ATOM 972 OE1 GLU A 58 -3.256 18.897 -6.340 1.00 1.99 O ATOM 973 OE2 GLU A 58 -3.106 17.890 -8.284 1.00 2.00 O ATOM 0 H GLU A 58 -1.407 13.850 -5.203 1.00 0.33 H new ATOM 0 HA GLU A 58 0.178 16.283 -4.728 1.00 0.36 H new ATOM 0 HB2 GLU A 58 -2.816 16.090 -5.210 1.00 0.40 H new ATOM 0 HB3 GLU A 58 -2.036 17.491 -4.502 1.00 0.40 H new ATOM 0 HG2 GLU A 58 -0.687 17.792 -6.549 1.00 0.64 H new ATOM 0 HG3 GLU A 58 -1.427 16.371 -7.258 1.00 0.64 H new ATOM 980 N LYS A 59 -0.306 16.141 -2.308 1.00 0.36 N ATOM 981 CA LYS A 59 -0.455 15.976 -0.867 1.00 0.37 C ATOM 982 C LYS A 59 -1.822 16.485 -0.447 1.00 0.37 C ATOM 983 O LYS A 59 -2.435 15.979 0.495 1.00 0.37 O ATOM 984 CB LYS A 59 0.649 16.742 -0.128 1.00 0.42 C ATOM 985 CG LYS A 59 0.841 16.317 1.319 1.00 1.10 C ATOM 986 CD LYS A 59 2.235 16.682 1.811 1.00 1.46 C ATOM 987 CE LYS A 59 2.558 16.023 3.142 1.00 2.16 C ATOM 988 NZ LYS A 59 4.024 15.932 3.376 1.00 2.64 N ATOM 0 H LYS A 59 0.409 16.815 -2.580 1.00 0.36 H new ATOM 0 HA LYS A 59 -0.368 14.920 -0.611 1.00 0.37 H new ATOM 0 HB2 LYS A 59 1.589 16.607 -0.662 1.00 0.42 H new ATOM 0 HB3 LYS A 59 0.417 17.807 -0.155 1.00 0.42 H new ATOM 0 HG2 LYS A 59 0.091 16.799 1.947 1.00 1.10 H new ATOM 0 HG3 LYS A 59 0.689 15.242 1.410 1.00 1.10 H new ATOM 0 HD2 LYS A 59 2.973 16.380 1.068 1.00 1.46 H new ATOM 0 HD3 LYS A 59 2.312 17.764 1.914 1.00 1.46 H new ATOM 0 HE2 LYS A 59 2.096 16.591 3.950 1.00 2.16 H new ATOM 0 HE3 LYS A 59 2.124 15.023 3.167 1.00 2.16 H new ATOM 0 HZ1 LYS A 59 4.201 15.477 4.294 1.00 2.64 H new ATOM 0 HZ2 LYS A 59 4.462 15.368 2.620 1.00 2.64 H new ATOM 0 HZ3 LYS A 59 4.435 16.887 3.378 1.00 2.64 H new ATOM 1002 N LYS A 60 -2.305 17.469 -1.198 1.00 0.40 N ATOM 1003 CA LYS A 60 -3.593 18.073 -0.931 1.00 0.42 C ATOM 1004 C LYS A 60 -4.700 17.070 -1.190 1.00 0.40 C ATOM 1005 O LYS A 60 -5.405 16.677 -0.264 1.00 0.41 O ATOM 1006 CB LYS A 60 -3.797 19.323 -1.798 1.00 0.48 C ATOM 1007 CG LYS A 60 -2.905 20.495 -1.411 1.00 0.69 C ATOM 1008 CD LYS A 60 -1.493 20.346 -1.964 1.00 0.79 C ATOM 1009 CE LYS A 60 -0.450 20.919 -1.018 1.00 0.94 C ATOM 1010 NZ LYS A 60 -0.602 22.386 -0.835 1.00 1.50 N ATOM 0 H LYS A 60 -1.815 17.863 -2.001 1.00 0.40 H new ATOM 0 HA LYS A 60 -3.623 18.374 0.116 1.00 0.42 H new ATOM 0 HB2 LYS A 60 -3.609 19.065 -2.840 1.00 0.48 H new ATOM 0 HB3 LYS A 60 -4.839 19.634 -1.730 1.00 0.48 H new ATOM 0 HG2 LYS A 60 -3.343 21.422 -1.781 1.00 0.69 H new ATOM 0 HG3 LYS A 60 -2.862 20.575 -0.325 1.00 0.69 H new ATOM 0 HD2 LYS A 60 -1.282 19.291 -2.141 1.00 0.79 H new ATOM 0 HD3 LYS A 60 -1.425 20.851 -2.928 1.00 0.79 H new ATOM 0 HE2 LYS A 60 -0.529 20.424 -0.050 1.00 0.94 H new ATOM 0 HE3 LYS A 60 0.546 20.704 -1.405 1.00 0.94 H new ATOM 0 HZ1 LYS A 60 0.151 22.738 -0.209 1.00 1.50 H new ATOM 0 HZ2 LYS A 60 -0.534 22.860 -1.758 1.00 1.50 H new ATOM 0 HZ3 LYS A 60 -1.529 22.589 -0.409 1.00 1.50 H new ATOM 1024 N LEU A 61 -4.816 16.612 -2.438 1.00 0.40 N ATOM 1025 CA LEU A 61 -5.837 15.638 -2.809 1.00 0.40 C ATOM 1026 C LEU A 61 -5.745 14.386 -1.952 1.00 0.37 C ATOM 1027 O LEU A 61 -6.750 13.719 -1.710 1.00 0.42 O ATOM 1028 CB LEU A 61 -5.708 15.257 -4.282 1.00 0.42 C ATOM 1029 CG LEU A 61 -5.861 16.405 -5.278 1.00 0.45 C ATOM 1030 CD1 LEU A 61 -5.638 15.908 -6.695 1.00 0.57 C ATOM 1031 CD2 LEU A 61 -7.237 17.047 -5.152 1.00 0.52 C ATOM 0 H LEU A 61 -4.213 16.902 -3.208 1.00 0.40 H new ATOM 0 HA LEU A 61 -6.808 16.104 -2.641 1.00 0.40 H new ATOM 0 HB2 LEU A 61 -4.733 14.795 -4.435 1.00 0.42 H new ATOM 0 HB3 LEU A 61 -6.458 14.500 -4.510 1.00 0.42 H new ATOM 0 HG LEU A 61 -5.108 17.160 -5.050 1.00 0.45 H new ATOM 0 HD11 LEU A 61 -5.750 16.737 -7.393 1.00 0.57 H new ATOM 0 HD12 LEU A 61 -4.633 15.494 -6.782 1.00 0.57 H new ATOM 0 HD13 LEU A 61 -6.370 15.135 -6.929 1.00 0.57 H new ATOM 0 HD21 LEU A 61 -7.325 17.862 -5.870 1.00 0.52 H new ATOM 0 HD22 LEU A 61 -8.006 16.301 -5.353 1.00 0.52 H new ATOM 0 HD23 LEU A 61 -7.365 17.437 -4.142 1.00 0.52 H new ATOM 1043 N LEU A 62 -4.541 14.070 -1.490 1.00 0.32 N ATOM 1044 CA LEU A 62 -4.331 12.908 -0.647 1.00 0.31 C ATOM 1045 C LEU A 62 -5.059 13.093 0.669 1.00 0.34 C ATOM 1046 O LEU A 62 -5.753 12.202 1.149 1.00 0.36 O ATOM 1047 CB LEU A 62 -2.841 12.715 -0.395 1.00 0.31 C ATOM 1048 CG LEU A 62 -2.480 11.606 0.584 1.00 0.40 C ATOM 1049 CD1 LEU A 62 -2.272 10.300 -0.157 1.00 0.65 C ATOM 1050 CD2 LEU A 62 -1.242 11.983 1.379 1.00 0.58 C ATOM 0 H LEU A 62 -3.696 14.606 -1.688 1.00 0.32 H new ATOM 0 HA LEU A 62 -4.723 12.024 -1.150 1.00 0.31 H new ATOM 0 HB2 LEU A 62 -2.353 12.508 -1.347 1.00 0.31 H new ATOM 0 HB3 LEU A 62 -2.429 13.653 -0.023 1.00 0.31 H new ATOM 0 HG LEU A 62 -3.304 11.473 1.285 1.00 0.40 H new ATOM 0 HD11 LEU A 62 -2.014 9.515 0.554 1.00 0.65 H new ATOM 0 HD12 LEU A 62 -3.189 10.029 -0.680 1.00 0.65 H new ATOM 0 HD13 LEU A 62 -1.463 10.416 -0.878 1.00 0.65 H new ATOM 0 HD21 LEU A 62 -0.997 11.180 2.074 1.00 0.58 H new ATOM 0 HD22 LEU A 62 -0.406 12.140 0.698 1.00 0.58 H new ATOM 0 HD23 LEU A 62 -1.433 12.900 1.937 1.00 0.58 H new ATOM 1062 N LYS A 63 -4.892 14.267 1.252 1.00 0.37 N ATOM 1063 CA LYS A 63 -5.539 14.589 2.509 1.00 0.43 C ATOM 1064 C LYS A 63 -7.028 14.863 2.310 1.00 0.46 C ATOM 1065 O LYS A 63 -7.798 14.813 3.264 1.00 0.52 O ATOM 1066 CB LYS A 63 -4.881 15.804 3.157 1.00 0.47 C ATOM 1067 CG LYS A 63 -3.481 15.541 3.684 1.00 1.14 C ATOM 1068 CD LYS A 63 -2.999 16.680 4.567 1.00 1.36 C ATOM 1069 CE LYS A 63 -3.773 16.747 5.876 1.00 1.86 C ATOM 1070 NZ LYS A 63 -3.390 17.932 6.685 1.00 2.13 N ATOM 0 H LYS A 63 -4.311 15.015 0.872 1.00 0.37 H new ATOM 0 HA LYS A 63 -5.427 13.726 3.165 1.00 0.43 H new ATOM 0 HB2 LYS A 63 -4.838 16.613 2.428 1.00 0.47 H new ATOM 0 HB3 LYS A 63 -5.509 16.149 3.979 1.00 0.47 H new ATOM 0 HG2 LYS A 63 -3.473 14.610 4.251 1.00 1.14 H new ATOM 0 HG3 LYS A 63 -2.794 15.411 2.848 1.00 1.14 H new ATOM 0 HD2 LYS A 63 -1.937 16.552 4.779 1.00 1.36 H new ATOM 0 HD3 LYS A 63 -3.106 17.624 4.033 1.00 1.36 H new ATOM 0 HE2 LYS A 63 -4.842 16.782 5.665 1.00 1.86 H new ATOM 0 HE3 LYS A 63 -3.591 15.840 6.452 1.00 1.86 H new ATOM 0 HZ1 LYS A 63 -3.939 17.942 7.568 1.00 2.13 H new ATOM 0 HZ2 LYS A 63 -2.375 17.886 6.909 1.00 2.13 H new ATOM 0 HZ3 LYS A 63 -3.587 18.799 6.146 1.00 2.13 H new ATOM 1084 N HIS A 64 -7.432 15.143 1.070 1.00 0.45 N ATOM 1085 CA HIS A 64 -8.833 15.444 0.761 1.00 0.51 C ATOM 1086 C HIS A 64 -9.731 14.225 0.934 1.00 0.38 C ATOM 1087 O HIS A 64 -10.949 14.353 1.041 1.00 0.37 O ATOM 1088 CB HIS A 64 -8.969 15.972 -0.673 1.00 0.69 C ATOM 1089 CG HIS A 64 -8.466 17.372 -0.862 1.00 0.96 C ATOM 1090 ND1 HIS A 64 -8.648 18.046 -2.047 1.00 1.60 N ATOM 1091 CD2 HIS A 64 -7.793 18.170 0.001 1.00 0.76 C ATOM 1092 CE1 HIS A 64 -8.092 19.231 -1.878 1.00 1.71 C ATOM 1093 NE2 HIS A 64 -7.563 19.353 -0.653 1.00 1.18 N ATOM 0 H HIS A 64 -6.810 15.168 0.262 1.00 0.45 H new ATOM 0 HA HIS A 64 -9.155 16.209 1.468 1.00 0.51 H new ATOM 0 HB2 HIS A 64 -8.426 15.309 -1.346 1.00 0.69 H new ATOM 0 HB3 HIS A 64 -10.018 15.932 -0.965 1.00 0.69 H new ATOM 0 HD2 HIS A 64 -7.495 17.922 1.009 1.00 0.76 H new ATOM 0 HE1 HIS A 64 -8.067 20.004 -2.632 1.00 1.71 H new ATOM 0 HE2 HIS A 64 -7.081 20.170 -0.278 1.00 1.18 H new ATOM 1101 N VAL A 65 -9.130 13.048 0.953 1.00 0.36 N ATOM 1102 CA VAL A 65 -9.882 11.810 1.117 1.00 0.35 C ATOM 1103 C VAL A 65 -10.329 11.633 2.574 1.00 0.37 C ATOM 1104 O VAL A 65 -11.319 10.964 2.858 1.00 0.43 O ATOM 1105 CB VAL A 65 -9.072 10.570 0.650 1.00 0.41 C ATOM 1106 CG1 VAL A 65 -8.481 10.804 -0.735 1.00 1.04 C ATOM 1107 CG2 VAL A 65 -7.978 10.206 1.646 1.00 1.09 C ATOM 0 H VAL A 65 -8.123 12.920 0.857 1.00 0.36 H new ATOM 0 HA VAL A 65 -10.765 11.886 0.482 1.00 0.35 H new ATOM 0 HB VAL A 65 -9.762 9.728 0.596 1.00 0.41 H new ATOM 0 HG11 VAL A 65 -7.917 9.924 -1.044 1.00 1.04 H new ATOM 0 HG12 VAL A 65 -9.285 10.988 -1.447 1.00 1.04 H new ATOM 0 HG13 VAL A 65 -7.817 11.668 -0.706 1.00 1.04 H new ATOM 0 HG21 VAL A 65 -7.433 9.334 1.285 1.00 1.09 H new ATOM 0 HG22 VAL A 65 -7.290 11.045 1.754 1.00 1.09 H new ATOM 0 HG23 VAL A 65 -8.427 9.979 2.613 1.00 1.09 H new ATOM 1117 N LEU A 66 -9.576 12.245 3.483 1.00 0.41 N ATOM 1118 CA LEU A 66 -9.840 12.163 4.923 1.00 0.52 C ATOM 1119 C LEU A 66 -11.203 12.754 5.351 1.00 0.51 C ATOM 1120 O LEU A 66 -11.930 12.099 6.097 1.00 0.56 O ATOM 1121 CB LEU A 66 -8.707 12.843 5.705 1.00 0.67 C ATOM 1122 CG LEU A 66 -7.662 11.904 6.322 1.00 0.86 C ATOM 1123 CD1 LEU A 66 -8.266 11.108 7.468 1.00 1.65 C ATOM 1124 CD2 LEU A 66 -7.084 10.967 5.269 1.00 0.83 C ATOM 0 H LEU A 66 -8.763 12.814 3.245 1.00 0.41 H new ATOM 0 HA LEU A 66 -9.884 11.100 5.159 1.00 0.52 H new ATOM 0 HB2 LEU A 66 -8.195 13.536 5.037 1.00 0.67 H new ATOM 0 HB3 LEU A 66 -9.149 13.438 6.504 1.00 0.67 H new ATOM 0 HG LEU A 66 -6.850 12.516 6.716 1.00 0.86 H new ATOM 0 HD11 LEU A 66 -7.509 10.448 7.892 1.00 1.65 H new ATOM 0 HD12 LEU A 66 -8.623 11.792 8.238 1.00 1.65 H new ATOM 0 HD13 LEU A 66 -9.100 10.512 7.097 1.00 1.65 H new ATOM 0 HD21 LEU A 66 -6.346 10.312 5.731 1.00 0.83 H new ATOM 0 HD22 LEU A 66 -7.885 10.365 4.839 1.00 0.83 H new ATOM 0 HD23 LEU A 66 -6.608 11.553 4.483 1.00 0.83 H new ATOM 1136 N PRO A 67 -11.567 13.999 4.926 1.00 0.50 N ATOM 1137 CA PRO A 67 -12.844 14.632 5.309 1.00 0.53 C ATOM 1138 C PRO A 67 -14.048 13.707 5.176 1.00 0.46 C ATOM 1139 O PRO A 67 -14.858 13.601 6.101 1.00 0.54 O ATOM 1140 CB PRO A 67 -12.965 15.806 4.346 1.00 0.58 C ATOM 1141 CG PRO A 67 -11.564 16.175 4.025 1.00 0.68 C ATOM 1142 CD PRO A 67 -10.770 14.893 4.065 1.00 0.55 C ATOM 0 HA PRO A 67 -12.840 14.917 6.361 1.00 0.53 H new ATOM 0 HB2 PRO A 67 -13.517 15.527 3.448 1.00 0.58 H new ATOM 0 HB3 PRO A 67 -13.499 16.639 4.802 1.00 0.58 H new ATOM 0 HG2 PRO A 67 -11.500 16.642 3.042 1.00 0.68 H new ATOM 0 HG3 PRO A 67 -11.177 16.895 4.746 1.00 0.68 H new ATOM 0 HD2 PRO A 67 -10.641 14.474 3.067 1.00 0.55 H new ATOM 0 HD3 PRO A 67 -9.773 15.055 4.474 1.00 0.55 H new ATOM 1150 N ASN A 68 -14.184 13.058 4.030 1.00 0.38 N ATOM 1151 CA ASN A 68 -15.286 12.139 3.826 1.00 0.43 C ATOM 1152 C ASN A 68 -14.912 11.067 2.816 1.00 0.40 C ATOM 1153 O ASN A 68 -14.306 11.355 1.794 1.00 0.35 O ATOM 1154 CB ASN A 68 -16.528 12.890 3.364 1.00 0.53 C ATOM 1155 CG ASN A 68 -17.768 12.012 3.354 1.00 0.99 C ATOM 1156 OD1 ASN A 68 -18.017 11.277 2.400 1.00 1.73 O ATOM 1157 ND2 ASN A 68 -18.561 12.095 4.412 1.00 1.40 N ATOM 0 H ASN A 68 -13.551 13.151 3.236 1.00 0.38 H new ATOM 0 HA ASN A 68 -15.506 11.654 4.777 1.00 0.43 H new ATOM 0 HB2 ASN A 68 -16.697 13.744 4.019 1.00 0.53 H new ATOM 0 HB3 ASN A 68 -16.358 13.285 2.362 1.00 0.53 H new ATOM 0 HD21 ASN A 68 -19.414 11.537 4.455 1.00 1.40 H new ATOM 0 HD22 ASN A 68 -18.319 12.717 5.183 1.00 1.40 H new ATOM 1164 N ILE A 69 -15.284 9.835 3.120 1.00 0.46 N ATOM 1165 CA ILE A 69 -15.010 8.693 2.263 1.00 0.48 C ATOM 1166 C ILE A 69 -16.246 7.800 2.229 1.00 0.58 C ATOM 1167 O ILE A 69 -16.887 7.583 3.258 1.00 0.79 O ATOM 1168 CB ILE A 69 -13.775 7.895 2.757 1.00 0.56 C ATOM 1169 CG1 ILE A 69 -13.550 6.656 1.887 1.00 0.60 C ATOM 1170 CG2 ILE A 69 -13.933 7.503 4.224 1.00 0.70 C ATOM 1171 CD1 ILE A 69 -12.235 5.955 2.154 1.00 0.71 C ATOM 0 H ILE A 69 -15.788 9.597 3.974 1.00 0.46 H new ATOM 0 HA ILE A 69 -14.780 9.050 1.259 1.00 0.48 H new ATOM 0 HB ILE A 69 -12.899 8.537 2.671 1.00 0.56 H new ATOM 0 HG12 ILE A 69 -14.366 5.953 2.053 1.00 0.60 H new ATOM 0 HG13 ILE A 69 -13.589 6.948 0.838 1.00 0.60 H new ATOM 0 HG21 ILE A 69 -13.055 6.944 4.548 1.00 0.70 H new ATOM 0 HG22 ILE A 69 -14.036 8.402 4.832 1.00 0.70 H new ATOM 0 HG23 ILE A 69 -14.821 6.882 4.341 1.00 0.70 H new ATOM 0 HD11 ILE A 69 -12.146 5.087 1.501 1.00 0.71 H new ATOM 0 HD12 ILE A 69 -11.411 6.641 1.960 1.00 0.71 H new ATOM 0 HD13 ILE A 69 -12.200 5.631 3.194 1.00 0.71 H new ATOM 1183 N ARG A 70 -16.601 7.311 1.055 1.00 0.48 N ATOM 1184 CA ARG A 70 -17.777 6.475 0.916 1.00 0.61 C ATOM 1185 C ARG A 70 -17.563 5.373 -0.114 1.00 0.41 C ATOM 1186 O ARG A 70 -16.636 5.423 -0.929 1.00 0.34 O ATOM 1187 CB ARG A 70 -18.971 7.334 0.491 1.00 0.82 C ATOM 1188 CG ARG A 70 -20.276 6.952 1.169 1.00 1.23 C ATOM 1189 CD ARG A 70 -20.457 7.696 2.480 1.00 1.41 C ATOM 1190 NE ARG A 70 -20.636 9.133 2.268 1.00 1.74 N ATOM 1191 CZ ARG A 70 -21.359 9.919 3.060 1.00 2.19 C ATOM 1192 NH1 ARG A 70 -21.951 9.422 4.139 1.00 2.55 N ATOM 1193 NH2 ARG A 70 -21.486 11.205 2.772 1.00 2.92 N ATOM 0 H ARG A 70 -16.093 7.478 0.187 1.00 0.48 H new ATOM 0 HA ARG A 70 -17.971 6.008 1.882 1.00 0.61 H new ATOM 0 HB2 ARG A 70 -18.751 8.379 0.711 1.00 0.82 H new ATOM 0 HB3 ARG A 70 -19.097 7.255 -0.589 1.00 0.82 H new ATOM 0 HG2 ARG A 70 -21.111 7.173 0.505 1.00 1.23 H new ATOM 0 HG3 ARG A 70 -20.291 5.878 1.353 1.00 1.23 H new ATOM 0 HD2 ARG A 70 -21.322 7.296 3.009 1.00 1.41 H new ATOM 0 HD3 ARG A 70 -19.588 7.528 3.117 1.00 1.41 H new ATOM 0 HE ARG A 70 -20.177 9.558 1.462 1.00 1.74 H new ATOM 0 HH11 ARG A 70 -21.853 8.432 4.364 1.00 2.55 H new ATOM 0 HH12 ARG A 70 -22.504 10.030 4.743 1.00 2.55 H new ATOM 0 HH21 ARG A 70 -21.030 11.590 1.945 1.00 2.92 H new ATOM 0 HH22 ARG A 70 -22.040 11.811 3.377 1.00 2.92 H new ATOM 1207 N ILE A 71 -18.421 4.368 -0.050 1.00 0.62 N ATOM 1208 CA ILE A 71 -18.391 3.263 -0.987 1.00 0.48 C ATOM 1209 C ILE A 71 -19.805 3.028 -1.488 1.00 0.45 C ATOM 1210 O ILE A 71 -20.760 3.054 -0.706 1.00 0.58 O ATOM 1211 CB ILE A 71 -17.837 1.963 -0.369 1.00 0.56 C ATOM 1212 CG1 ILE A 71 -16.543 2.233 0.398 1.00 0.96 C ATOM 1213 CG2 ILE A 71 -17.586 0.937 -1.468 1.00 0.76 C ATOM 1214 CD1 ILE A 71 -16.119 1.090 1.296 1.00 1.09 C ATOM 0 H ILE A 71 -19.156 4.298 0.653 1.00 0.62 H new ATOM 0 HA ILE A 71 -17.718 3.530 -1.802 1.00 0.48 H new ATOM 0 HB ILE A 71 -18.574 1.571 0.332 1.00 0.56 H new ATOM 0 HG12 ILE A 71 -15.745 2.439 -0.315 1.00 0.96 H new ATOM 0 HG13 ILE A 71 -16.670 3.131 1.003 1.00 0.96 H new ATOM 0 HG21 ILE A 71 -17.195 0.020 -1.027 1.00 0.76 H new ATOM 0 HG22 ILE A 71 -18.521 0.721 -1.985 1.00 0.76 H new ATOM 0 HG23 ILE A 71 -16.862 1.335 -2.179 1.00 0.76 H new ATOM 0 HD11 ILE A 71 -15.193 1.353 1.808 1.00 1.09 H new ATOM 0 HD12 ILE A 71 -16.899 0.898 2.033 1.00 1.09 H new ATOM 0 HD13 ILE A 71 -15.959 0.195 0.695 1.00 1.09 H new ATOM 1226 N LYS A 72 -19.938 2.820 -2.782 1.00 0.38 N ATOM 1227 CA LYS A 72 -21.243 2.627 -3.403 1.00 0.47 C ATOM 1228 C LYS A 72 -21.930 1.329 -2.966 1.00 0.43 C ATOM 1229 O LYS A 72 -21.503 0.235 -3.338 1.00 0.49 O ATOM 1230 CB LYS A 72 -21.096 2.650 -4.924 1.00 0.64 C ATOM 1231 CG LYS A 72 -20.672 4.003 -5.473 1.00 0.87 C ATOM 1232 CD LYS A 72 -20.410 3.935 -6.968 1.00 1.57 C ATOM 1233 CE LYS A 72 -20.784 5.237 -7.662 1.00 1.96 C ATOM 1234 NZ LYS A 72 -22.225 5.565 -7.490 1.00 2.63 N ATOM 0 H LYS A 72 -19.154 2.779 -3.433 1.00 0.38 H new ATOM 0 HA LYS A 72 -21.879 3.447 -3.070 1.00 0.47 H new ATOM 0 HB2 LYS A 72 -20.363 1.900 -5.221 1.00 0.64 H new ATOM 0 HB3 LYS A 72 -22.045 2.365 -5.377 1.00 0.64 H new ATOM 0 HG2 LYS A 72 -21.450 4.740 -5.271 1.00 0.87 H new ATOM 0 HG3 LYS A 72 -19.772 4.341 -4.959 1.00 0.87 H new ATOM 0 HD2 LYS A 72 -19.356 3.718 -7.144 1.00 1.57 H new ATOM 0 HD3 LYS A 72 -20.981 3.114 -7.401 1.00 1.57 H new ATOM 0 HE2 LYS A 72 -20.177 6.049 -7.262 1.00 1.96 H new ATOM 0 HE3 LYS A 72 -20.554 5.161 -8.725 1.00 1.96 H new ATOM 0 HZ1 LYS A 72 -22.564 6.086 -8.324 1.00 2.63 H new ATOM 0 HZ2 LYS A 72 -22.771 4.686 -7.385 1.00 2.63 H new ATOM 0 HZ3 LYS A 72 -22.348 6.153 -6.641 1.00 2.63 H new ATOM 1248 N GLY A 73 -22.989 1.469 -2.163 1.00 0.46 N ATOM 1249 CA GLY A 73 -23.767 0.318 -1.720 1.00 0.53 C ATOM 1250 C GLY A 73 -23.029 -0.615 -0.777 1.00 0.47 C ATOM 1251 O GLY A 73 -23.272 -1.821 -0.787 1.00 0.52 O ATOM 0 H GLY A 73 -23.323 2.366 -1.810 1.00 0.46 H new ATOM 0 HA2 GLY A 73 -24.670 0.675 -1.225 1.00 0.53 H new ATOM 0 HA3 GLY A 73 -24.086 -0.248 -2.595 1.00 0.53 H new ATOM 1255 N LEU A 74 -22.133 -0.077 0.035 1.00 0.40 N ATOM 1256 CA LEU A 74 -21.356 -0.902 0.956 1.00 0.36 C ATOM 1257 C LEU A 74 -21.400 -0.372 2.388 1.00 0.34 C ATOM 1258 O LEU A 74 -21.628 0.819 2.606 1.00 0.35 O ATOM 1259 CB LEU A 74 -19.901 -0.932 0.499 1.00 0.38 C ATOM 1260 CG LEU A 74 -19.427 -2.237 -0.124 1.00 0.47 C ATOM 1261 CD1 LEU A 74 -19.677 -2.250 -1.624 1.00 0.70 C ATOM 1262 CD2 LEU A 74 -17.953 -2.439 0.180 1.00 0.56 C ATOM 0 H LEU A 74 -21.924 0.920 0.078 1.00 0.40 H new ATOM 0 HA LEU A 74 -21.795 -1.899 0.948 1.00 0.36 H new ATOM 0 HB2 LEU A 74 -19.751 -0.131 -0.225 1.00 0.38 H new ATOM 0 HB3 LEU A 74 -19.266 -0.710 1.357 1.00 0.38 H new ATOM 0 HG LEU A 74 -19.996 -3.060 0.309 1.00 0.47 H new ATOM 0 HD11 LEU A 74 -19.329 -3.194 -2.043 1.00 0.70 H new ATOM 0 HD12 LEU A 74 -20.744 -2.140 -1.816 1.00 0.70 H new ATOM 0 HD13 LEU A 74 -19.138 -1.425 -2.090 1.00 0.70 H new ATOM 0 HD21 LEU A 74 -17.614 -3.374 -0.266 1.00 0.56 H new ATOM 0 HD22 LEU A 74 -17.379 -1.610 -0.234 1.00 0.56 H new ATOM 0 HD23 LEU A 74 -17.806 -2.478 1.259 1.00 0.56 H new ATOM 1274 N SER A 75 -21.187 -1.264 3.359 1.00 0.33 N ATOM 1275 CA SER A 75 -21.141 -0.868 4.763 1.00 0.33 C ATOM 1276 C SER A 75 -19.678 -0.831 5.180 1.00 0.31 C ATOM 1277 O SER A 75 -18.921 -1.739 4.832 1.00 0.35 O ATOM 1278 CB SER A 75 -21.922 -1.857 5.631 1.00 0.37 C ATOM 1279 OG SER A 75 -23.086 -2.313 4.962 1.00 0.99 O ATOM 0 H SER A 75 -21.045 -2.261 3.197 1.00 0.33 H new ATOM 0 HA SER A 75 -21.601 0.111 4.895 1.00 0.33 H new ATOM 0 HB2 SER A 75 -21.287 -2.706 5.882 1.00 0.37 H new ATOM 0 HB3 SER A 75 -22.202 -1.380 6.570 1.00 0.37 H new ATOM 0 HG SER A 75 -22.861 -3.086 4.404 1.00 0.99 H new ATOM 1285 N PHE A 76 -19.255 0.205 5.892 1.00 0.32 N ATOM 1286 CA PHE A 76 -17.853 0.302 6.276 1.00 0.31 C ATOM 1287 C PHE A 76 -17.656 1.042 7.593 1.00 0.32 C ATOM 1288 O PHE A 76 -18.558 1.725 8.079 1.00 0.38 O ATOM 1289 CB PHE A 76 -17.060 1.005 5.167 1.00 0.32 C ATOM 1290 CG PHE A 76 -17.761 2.208 4.603 1.00 0.35 C ATOM 1291 CD1 PHE A 76 -18.700 2.065 3.597 1.00 1.26 C ATOM 1292 CD2 PHE A 76 -17.493 3.474 5.088 1.00 1.24 C ATOM 1293 CE1 PHE A 76 -19.358 3.161 3.084 1.00 1.29 C ATOM 1294 CE2 PHE A 76 -18.147 4.576 4.577 1.00 1.28 C ATOM 1295 CZ PHE A 76 -19.081 4.420 3.575 1.00 0.53 C ATOM 0 H PHE A 76 -19.846 0.973 6.209 1.00 0.32 H new ATOM 0 HA PHE A 76 -17.487 -0.715 6.417 1.00 0.31 H new ATOM 0 HB2 PHE A 76 -16.091 1.310 5.561 1.00 0.32 H new ATOM 0 HB3 PHE A 76 -16.868 0.295 4.362 1.00 0.32 H new ATOM 0 HD1 PHE A 76 -18.920 1.081 3.209 1.00 1.26 H new ATOM 0 HD2 PHE A 76 -16.764 3.602 5.875 1.00 1.24 H new ATOM 0 HE1 PHE A 76 -20.089 3.035 2.299 1.00 1.29 H new ATOM 0 HE2 PHE A 76 -17.927 5.561 4.962 1.00 1.28 H new ATOM 0 HZ PHE A 76 -19.595 5.282 3.175 1.00 0.53 H new ATOM 1305 N SER A 77 -16.461 0.899 8.155 1.00 0.30 N ATOM 1306 CA SER A 77 -16.098 1.550 9.409 1.00 0.32 C ATOM 1307 C SER A 77 -14.732 2.212 9.239 1.00 0.30 C ATOM 1308 O SER A 77 -13.861 1.649 8.579 1.00 0.29 O ATOM 1309 CB SER A 77 -16.064 0.529 10.550 1.00 0.36 C ATOM 1310 OG SER A 77 -16.138 1.165 11.814 1.00 1.18 O ATOM 0 H SER A 77 -15.716 0.329 7.754 1.00 0.30 H new ATOM 0 HA SER A 77 -16.841 2.307 9.660 1.00 0.32 H new ATOM 0 HB2 SER A 77 -16.895 -0.168 10.442 1.00 0.36 H new ATOM 0 HB3 SER A 77 -15.147 -0.057 10.489 1.00 0.36 H new ATOM 0 HG SER A 77 -16.434 0.519 12.489 1.00 1.18 H new ATOM 1316 N VAL A 78 -14.535 3.384 9.844 1.00 0.32 N ATOM 1317 CA VAL A 78 -13.278 4.119 9.697 1.00 0.33 C ATOM 1318 C VAL A 78 -12.430 4.058 10.972 1.00 0.34 C ATOM 1319 O VAL A 78 -12.853 4.517 12.035 1.00 0.38 O ATOM 1320 CB VAL A 78 -13.539 5.598 9.328 1.00 0.38 C ATOM 1321 CG1 VAL A 78 -12.230 6.360 9.176 1.00 0.41 C ATOM 1322 CG2 VAL A 78 -14.363 5.691 8.050 1.00 0.40 C ATOM 0 H VAL A 78 -15.226 3.843 10.438 1.00 0.32 H new ATOM 0 HA VAL A 78 -12.726 3.637 8.890 1.00 0.33 H new ATOM 0 HB VAL A 78 -14.105 6.056 10.140 1.00 0.38 H new ATOM 0 HG11 VAL A 78 -12.441 7.397 8.916 1.00 0.41 H new ATOM 0 HG12 VAL A 78 -11.678 6.326 10.115 1.00 0.41 H new ATOM 0 HG13 VAL A 78 -11.632 5.903 8.387 1.00 0.41 H new ATOM 0 HG21 VAL A 78 -14.537 6.739 7.805 1.00 0.40 H new ATOM 0 HG22 VAL A 78 -13.823 5.212 7.233 1.00 0.40 H new ATOM 0 HG23 VAL A 78 -15.319 5.189 8.196 1.00 0.40 H new ATOM 1332 N LYS A 79 -11.245 3.470 10.859 1.00 0.32 N ATOM 1333 CA LYS A 79 -10.309 3.349 11.972 1.00 0.34 C ATOM 1334 C LYS A 79 -8.966 3.970 11.588 1.00 0.34 C ATOM 1335 O LYS A 79 -8.649 4.091 10.404 1.00 0.33 O ATOM 1336 CB LYS A 79 -10.111 1.879 12.361 1.00 0.35 C ATOM 1337 CG LYS A 79 -10.971 1.424 13.530 1.00 0.48 C ATOM 1338 CD LYS A 79 -12.450 1.430 13.184 1.00 0.69 C ATOM 1339 CE LYS A 79 -13.255 2.179 14.232 1.00 0.89 C ATOM 1340 NZ LYS A 79 -14.686 2.313 13.859 1.00 1.48 N ATOM 0 H LYS A 79 -10.904 3.061 9.989 1.00 0.32 H new ATOM 0 HA LYS A 79 -10.722 3.879 12.830 1.00 0.34 H new ATOM 0 HB2 LYS A 79 -10.331 1.253 11.496 1.00 0.35 H new ATOM 0 HB3 LYS A 79 -9.062 1.719 12.611 1.00 0.35 H new ATOM 0 HG2 LYS A 79 -10.673 0.419 13.830 1.00 0.48 H new ATOM 0 HG3 LYS A 79 -10.796 2.077 14.385 1.00 0.48 H new ATOM 0 HD2 LYS A 79 -12.596 1.894 12.209 1.00 0.69 H new ATOM 0 HD3 LYS A 79 -12.813 0.405 13.107 1.00 0.69 H new ATOM 0 HE2 LYS A 79 -13.179 1.657 15.186 1.00 0.89 H new ATOM 0 HE3 LYS A 79 -12.826 3.171 14.376 1.00 0.89 H new ATOM 0 HZ1 LYS A 79 -14.898 3.309 13.647 1.00 1.48 H new ATOM 0 HZ2 LYS A 79 -14.882 1.731 13.019 1.00 1.48 H new ATOM 0 HZ3 LYS A 79 -15.282 1.993 14.649 1.00 1.48 H new ATOM 1354 N VAL A 80 -8.173 4.348 12.582 1.00 0.38 N ATOM 1355 CA VAL A 80 -6.870 4.947 12.323 1.00 0.40 C ATOM 1356 C VAL A 80 -5.747 4.009 12.752 1.00 0.41 C ATOM 1357 O VAL A 80 -5.935 3.170 13.632 1.00 0.43 O ATOM 1358 CB VAL A 80 -6.690 6.306 13.036 1.00 0.48 C ATOM 1359 CG1 VAL A 80 -6.022 7.294 12.096 1.00 1.43 C ATOM 1360 CG2 VAL A 80 -8.019 6.856 13.532 1.00 1.30 C ATOM 0 H VAL A 80 -8.407 4.251 13.570 1.00 0.38 H new ATOM 0 HA VAL A 80 -6.822 5.118 11.248 1.00 0.40 H new ATOM 0 HB VAL A 80 -6.054 6.153 13.908 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -5.897 8.251 12.603 1.00 1.43 H new ATOM 0 HG12 VAL A 80 -5.046 6.911 11.799 1.00 1.43 H new ATOM 0 HG13 VAL A 80 -6.643 7.431 11.211 1.00 1.43 H new ATOM 0 HG21 VAL A 80 -7.855 7.812 14.028 1.00 1.30 H new ATOM 0 HG22 VAL A 80 -8.693 6.997 12.687 1.00 1.30 H new ATOM 0 HG23 VAL A 80 -8.463 6.153 14.237 1.00 1.30 H new ATOM 1370 N CYS A 81 -4.584 4.146 12.128 1.00 0.42 N ATOM 1371 CA CYS A 81 -3.445 3.305 12.453 1.00 0.46 C ATOM 1372 C CYS A 81 -2.142 4.112 12.442 1.00 0.49 C ATOM 1373 O CYS A 81 -1.835 4.809 11.475 1.00 0.45 O ATOM 1374 CB CYS A 81 -3.354 2.138 11.463 1.00 0.47 C ATOM 1375 SG CYS A 81 -1.997 0.984 11.782 1.00 0.89 S ATOM 0 H CYS A 81 -4.407 4.832 11.394 1.00 0.42 H new ATOM 0 HA CYS A 81 -3.589 2.910 13.459 1.00 0.46 H new ATOM 0 HB2 CYS A 81 -4.294 1.587 11.483 1.00 0.47 H new ATOM 0 HB3 CYS A 81 -3.242 2.541 10.456 1.00 0.47 H new ATOM 0 HG CYS A 81 -2.013 0.038 10.891 1.00 0.89 H new ATOM 1381 N GLY A 82 -1.383 4.035 13.524 1.00 0.67 N ATOM 1382 CA GLY A 82 -0.126 4.752 13.592 1.00 0.76 C ATOM 1383 C GLY A 82 -0.302 6.243 13.426 1.00 0.76 C ATOM 1384 O GLY A 82 -1.161 6.854 14.063 1.00 0.88 O ATOM 0 H GLY A 82 -1.614 3.490 14.355 1.00 0.67 H new ATOM 0 HA2 GLY A 82 0.353 4.550 14.550 1.00 0.76 H new ATOM 0 HA3 GLY A 82 0.544 4.380 12.817 1.00 0.76 H new ATOM 1388 N GLU A 83 0.519 6.826 12.573 1.00 0.76 N ATOM 1389 CA GLU A 83 0.447 8.250 12.312 1.00 0.82 C ATOM 1390 C GLU A 83 -0.353 8.534 11.048 1.00 0.69 C ATOM 1391 O GLU A 83 -1.311 9.304 11.070 1.00 0.89 O ATOM 1392 CB GLU A 83 1.844 8.854 12.152 1.00 1.01 C ATOM 1393 CG GLU A 83 2.763 8.649 13.341 1.00 1.35 C ATOM 1394 CD GLU A 83 4.097 9.344 13.154 1.00 1.90 C ATOM 1395 OE1 GLU A 83 4.190 10.551 13.458 1.00 2.46 O ATOM 1396 OE2 GLU A 83 5.055 8.690 12.689 1.00 2.50 O ATOM 0 H GLU A 83 1.243 6.335 12.049 1.00 0.76 H new ATOM 0 HA GLU A 83 -0.049 8.706 13.169 1.00 0.82 H new ATOM 0 HB2 GLU A 83 2.313 8.421 11.269 1.00 1.01 H new ATOM 0 HB3 GLU A 83 1.744 9.924 11.968 1.00 1.01 H new ATOM 0 HG2 GLU A 83 2.280 9.028 14.242 1.00 1.35 H new ATOM 0 HG3 GLU A 83 2.928 7.582 13.492 1.00 1.35 H new ATOM 1403 N ARG A 84 0.034 7.895 9.946 1.00 0.58 N ATOM 1404 CA ARG A 84 -0.622 8.131 8.658 1.00 0.72 C ATOM 1405 C ARG A 84 -1.303 6.883 8.097 1.00 0.64 C ATOM 1406 O ARG A 84 -1.801 6.899 6.973 1.00 0.81 O ATOM 1407 CB ARG A 84 0.404 8.639 7.646 1.00 0.98 C ATOM 1408 CG ARG A 84 1.230 9.828 8.132 1.00 1.09 C ATOM 1409 CD ARG A 84 0.422 11.124 8.161 1.00 1.37 C ATOM 1410 NE ARG A 84 -0.557 11.141 9.247 1.00 1.46 N ATOM 1411 CZ ARG A 84 -1.207 12.224 9.673 1.00 2.05 C ATOM 1412 NH1 ARG A 84 -0.963 13.416 9.141 1.00 2.51 N ATOM 1413 NH2 ARG A 84 -2.092 12.107 10.653 1.00 2.36 N ATOM 0 H ARG A 84 0.793 7.214 9.917 1.00 0.58 H new ATOM 0 HA ARG A 84 -1.399 8.875 8.831 1.00 0.72 H new ATOM 0 HB2 ARG A 84 1.079 7.823 7.390 1.00 0.98 H new ATOM 0 HB3 ARG A 84 -0.115 8.922 6.730 1.00 0.98 H new ATOM 0 HG2 ARG A 84 1.611 9.618 9.131 1.00 1.09 H new ATOM 0 HG3 ARG A 84 2.095 9.957 7.481 1.00 1.09 H new ATOM 0 HD2 ARG A 84 1.100 11.970 8.272 1.00 1.37 H new ATOM 0 HD3 ARG A 84 -0.092 11.251 7.208 1.00 1.37 H new ATOM 0 HE ARG A 84 -0.758 10.257 9.714 1.00 1.46 H new ATOM 0 HH11 ARG A 84 -0.271 13.511 8.397 1.00 2.51 H new ATOM 0 HH12 ARG A 84 -1.467 14.237 9.476 1.00 2.51 H new ATOM 0 HH21 ARG A 84 -2.270 11.195 11.073 1.00 2.36 H new ATOM 0 HH22 ARG A 84 -2.595 12.929 10.987 1.00 2.36 H new ATOM 1427 N LYS A 85 -1.329 5.811 8.864 1.00 0.46 N ATOM 1428 CA LYS A 85 -1.966 4.582 8.406 1.00 0.41 C ATOM 1429 C LYS A 85 -3.437 4.582 8.814 1.00 0.38 C ATOM 1430 O LYS A 85 -3.824 5.232 9.784 1.00 0.39 O ATOM 1431 CB LYS A 85 -1.251 3.346 8.964 1.00 0.42 C ATOM 1432 CG LYS A 85 0.239 3.296 8.655 1.00 0.55 C ATOM 1433 CD LYS A 85 0.942 2.204 9.453 1.00 0.88 C ATOM 1434 CE LYS A 85 1.362 1.039 8.568 1.00 1.17 C ATOM 1435 NZ LYS A 85 2.102 -0.001 9.329 1.00 1.22 N ATOM 0 H LYS A 85 -0.922 5.761 9.798 1.00 0.46 H new ATOM 0 HA LYS A 85 -1.897 4.540 7.319 1.00 0.41 H new ATOM 0 HB2 LYS A 85 -1.388 3.318 10.045 1.00 0.42 H new ATOM 0 HB3 LYS A 85 -1.725 2.452 8.559 1.00 0.42 H new ATOM 0 HG2 LYS A 85 0.384 3.119 7.589 1.00 0.55 H new ATOM 0 HG3 LYS A 85 0.691 4.262 8.882 1.00 0.55 H new ATOM 0 HD2 LYS A 85 1.820 2.622 9.945 1.00 0.88 H new ATOM 0 HD3 LYS A 85 0.278 1.843 10.238 1.00 0.88 H new ATOM 0 HE2 LYS A 85 0.478 0.594 8.112 1.00 1.17 H new ATOM 0 HE3 LYS A 85 1.988 1.408 7.756 1.00 1.17 H new ATOM 0 HZ1 LYS A 85 2.369 -0.776 8.689 1.00 1.22 H new ATOM 0 HZ2 LYS A 85 2.959 0.417 9.744 1.00 1.22 H new ATOM 0 HZ3 LYS A 85 1.496 -0.373 10.088 1.00 1.22 H new ATOM 1449 N CYS A 86 -4.267 3.912 8.039 1.00 0.36 N ATOM 1450 CA CYS A 86 -5.687 3.860 8.332 1.00 0.34 C ATOM 1451 C CYS A 86 -6.213 2.443 8.184 1.00 0.32 C ATOM 1452 O CYS A 86 -5.680 1.647 7.412 1.00 0.32 O ATOM 1453 CB CYS A 86 -6.459 4.815 7.424 1.00 0.38 C ATOM 1454 SG CYS A 86 -6.019 6.558 7.639 1.00 1.14 S ATOM 0 H CYS A 86 -3.985 3.398 7.205 1.00 0.36 H new ATOM 0 HA CYS A 86 -5.834 4.174 9.365 1.00 0.34 H new ATOM 0 HB2 CYS A 86 -6.284 4.533 6.386 1.00 0.38 H new ATOM 0 HB3 CYS A 86 -7.526 4.695 7.612 1.00 0.38 H new ATOM 0 HG CYS A 86 -5.102 6.664 8.554 1.00 1.14 H new ATOM 1460 N VAL A 87 -7.260 2.134 8.931 1.00 0.32 N ATOM 1461 CA VAL A 87 -7.868 0.812 8.891 1.00 0.34 C ATOM 1462 C VAL A 87 -9.362 0.950 8.654 1.00 0.32 C ATOM 1463 O VAL A 87 -10.021 1.745 9.307 1.00 0.36 O ATOM 1464 CB VAL A 87 -7.652 0.031 10.206 1.00 0.40 C ATOM 1465 CG1 VAL A 87 -8.081 -1.422 10.052 1.00 0.80 C ATOM 1466 CG2 VAL A 87 -6.206 0.114 10.657 1.00 0.95 C ATOM 0 H VAL A 87 -7.709 2.784 9.576 1.00 0.32 H new ATOM 0 HA VAL A 87 -7.391 0.259 8.082 1.00 0.34 H new ATOM 0 HB VAL A 87 -8.274 0.492 10.973 1.00 0.40 H new ATOM 0 HG11 VAL A 87 -7.919 -1.951 10.991 1.00 0.80 H new ATOM 0 HG12 VAL A 87 -9.138 -1.463 9.790 1.00 0.80 H new ATOM 0 HG13 VAL A 87 -7.493 -1.893 9.264 1.00 0.80 H new ATOM 0 HG21 VAL A 87 -6.082 -0.444 11.585 1.00 0.95 H new ATOM 0 HG22 VAL A 87 -5.560 -0.311 9.889 1.00 0.95 H new ATOM 0 HG23 VAL A 87 -5.936 1.157 10.822 1.00 0.95 H new ATOM 1476 N LEU A 88 -9.900 0.199 7.719 1.00 0.30 N ATOM 1477 CA LEU A 88 -11.320 0.265 7.446 1.00 0.31 C ATOM 1478 C LEU A 88 -11.913 -1.126 7.407 1.00 0.30 C ATOM 1479 O LEU A 88 -11.225 -2.105 7.129 1.00 0.33 O ATOM 1480 CB LEU A 88 -11.605 1.009 6.137 1.00 0.33 C ATOM 1481 CG LEU A 88 -12.170 2.425 6.310 1.00 0.43 C ATOM 1482 CD1 LEU A 88 -11.089 3.393 6.760 1.00 0.89 C ATOM 1483 CD2 LEU A 88 -12.820 2.911 5.027 1.00 0.48 C ATOM 0 H LEU A 88 -9.381 -0.460 7.138 1.00 0.30 H new ATOM 0 HA LEU A 88 -11.791 0.825 8.254 1.00 0.31 H new ATOM 0 HB2 LEU A 88 -10.681 1.070 5.562 1.00 0.33 H new ATOM 0 HB3 LEU A 88 -12.309 0.422 5.548 1.00 0.33 H new ATOM 0 HG LEU A 88 -12.934 2.385 7.086 1.00 0.43 H new ATOM 0 HD11 LEU A 88 -11.517 4.389 6.875 1.00 0.89 H new ATOM 0 HD12 LEU A 88 -10.679 3.062 7.714 1.00 0.89 H new ATOM 0 HD13 LEU A 88 -10.294 3.423 6.014 1.00 0.89 H new ATOM 0 HD21 LEU A 88 -13.212 3.917 5.176 1.00 0.48 H new ATOM 0 HD22 LEU A 88 -12.080 2.925 4.227 1.00 0.48 H new ATOM 0 HD23 LEU A 88 -13.635 2.240 4.755 1.00 0.48 H new ATOM 1495 N PHE A 89 -13.186 -1.215 7.718 1.00 0.30 N ATOM 1496 CA PHE A 89 -13.882 -2.482 7.707 1.00 0.31 C ATOM 1497 C PHE A 89 -14.969 -2.417 6.657 1.00 0.30 C ATOM 1498 O PHE A 89 -15.555 -1.360 6.461 1.00 0.30 O ATOM 1499 CB PHE A 89 -14.509 -2.762 9.072 1.00 0.34 C ATOM 1500 CG PHE A 89 -13.518 -2.969 10.181 1.00 0.89 C ATOM 1501 CD1 PHE A 89 -12.475 -3.867 10.041 1.00 1.75 C ATOM 1502 CD2 PHE A 89 -13.639 -2.267 11.370 1.00 1.75 C ATOM 1503 CE1 PHE A 89 -11.568 -4.061 11.067 1.00 2.42 C ATOM 1504 CE2 PHE A 89 -12.735 -2.455 12.397 1.00 2.40 C ATOM 1505 CZ PHE A 89 -11.699 -3.354 12.246 1.00 2.50 C ATOM 0 H PHE A 89 -13.765 -0.418 7.984 1.00 0.30 H new ATOM 0 HA PHE A 89 -13.178 -3.283 7.482 1.00 0.31 H new ATOM 0 HB2 PHE A 89 -15.162 -1.930 9.336 1.00 0.34 H new ATOM 0 HB3 PHE A 89 -15.138 -3.648 8.994 1.00 0.34 H new ATOM 0 HD1 PHE A 89 -12.368 -4.422 9.121 1.00 1.75 H new ATOM 0 HD2 PHE A 89 -14.450 -1.565 11.495 1.00 1.75 H new ATOM 0 HE1 PHE A 89 -10.758 -4.765 10.946 1.00 2.42 H new ATOM 0 HE2 PHE A 89 -12.839 -1.899 13.317 1.00 2.40 H new ATOM 0 HZ PHE A 89 -10.992 -3.504 13.048 1.00 2.50 H new ATOM 1515 N ILE A 90 -15.230 -3.517 5.980 1.00 0.30 N ATOM 1516 CA ILE A 90 -16.278 -3.533 4.967 1.00 0.31 C ATOM 1517 C ILE A 90 -17.221 -4.687 5.217 1.00 0.31 C ATOM 1518 O ILE A 90 -16.789 -5.800 5.509 1.00 0.33 O ATOM 1519 CB ILE A 90 -15.727 -3.625 3.529 1.00 0.32 C ATOM 1520 CG1 ILE A 90 -14.432 -4.442 3.490 1.00 0.39 C ATOM 1521 CG2 ILE A 90 -15.508 -2.229 2.955 1.00 0.37 C ATOM 1522 CD1 ILE A 90 -13.947 -4.753 2.088 1.00 0.48 C ATOM 0 H ILE A 90 -14.741 -4.403 6.107 1.00 0.30 H new ATOM 0 HA ILE A 90 -16.806 -2.583 5.051 1.00 0.31 H new ATOM 0 HB ILE A 90 -16.463 -4.139 2.911 1.00 0.32 H new ATOM 0 HG12 ILE A 90 -13.653 -3.896 4.021 1.00 0.39 H new ATOM 0 HG13 ILE A 90 -14.588 -5.378 4.027 1.00 0.39 H new ATOM 0 HG21 ILE A 90 -15.119 -2.310 1.940 1.00 0.37 H new ATOM 0 HG22 ILE A 90 -16.455 -1.690 2.939 1.00 0.37 H new ATOM 0 HG23 ILE A 90 -14.793 -1.689 3.575 1.00 0.37 H new ATOM 0 HD11 ILE A 90 -13.026 -5.334 2.142 1.00 0.48 H new ATOM 0 HD12 ILE A 90 -14.708 -5.327 1.559 1.00 0.48 H new ATOM 0 HD13 ILE A 90 -13.758 -3.822 1.553 1.00 0.48 H new ATOM 1534 N GLU A 91 -18.508 -4.417 5.115 1.00 0.31 N ATOM 1535 CA GLU A 91 -19.523 -5.432 5.350 1.00 0.34 C ATOM 1536 C GLU A 91 -20.538 -5.455 4.219 1.00 0.38 C ATOM 1537 O GLU A 91 -21.079 -4.401 3.829 1.00 0.41 O ATOM 1538 CB GLU A 91 -20.242 -5.170 6.678 1.00 0.39 C ATOM 1539 CG GLU A 91 -19.394 -4.433 7.701 1.00 1.34 C ATOM 1540 CD GLU A 91 -20.152 -4.138 8.976 1.00 1.32 C ATOM 1541 OE1 GLU A 91 -20.934 -5.005 9.420 1.00 1.72 O ATOM 1542 OE2 GLU A 91 -19.960 -3.042 9.545 1.00 1.74 O ATOM 0 H GLU A 91 -18.879 -3.499 4.870 1.00 0.31 H new ATOM 0 HA GLU A 91 -19.025 -6.400 5.395 1.00 0.34 H new ATOM 0 HB2 GLU A 91 -21.145 -4.591 6.483 1.00 0.39 H new ATOM 0 HB3 GLU A 91 -20.560 -6.122 7.102 1.00 0.39 H new ATOM 0 HG2 GLU A 91 -18.513 -5.030 7.936 1.00 1.34 H new ATOM 0 HG3 GLU A 91 -19.039 -3.498 7.268 1.00 1.34 H new ATOM 1549 N TRP A 92 -20.751 -6.649 3.666 1.00 0.41 N ATOM 1550 CA TRP A 92 -21.704 -6.843 2.582 1.00 0.51 C ATOM 1551 C TRP A 92 -21.976 -8.328 2.382 1.00 0.52 C ATOM 1552 O TRP A 92 -21.131 -9.160 2.718 1.00 0.50 O ATOM 1553 CB TRP A 92 -21.235 -6.186 1.284 1.00 0.66 C ATOM 1554 CG TRP A 92 -19.763 -6.264 1.049 1.00 0.82 C ATOM 1555 CD1 TRP A 92 -18.850 -5.279 1.252 1.00 1.79 C ATOM 1556 CD2 TRP A 92 -19.039 -7.389 0.569 1.00 0.89 C ATOM 1557 NE1 TRP A 92 -17.598 -5.713 0.895 1.00 1.87 N ATOM 1558 CE2 TRP A 92 -17.688 -7.013 0.481 1.00 1.04 C ATOM 1559 CE3 TRP A 92 -19.406 -8.676 0.205 1.00 1.87 C ATOM 1560 CZ2 TRP A 92 -16.705 -7.883 0.033 1.00 1.14 C ATOM 1561 CZ3 TRP A 92 -18.437 -9.544 -0.233 1.00 2.35 C ATOM 1562 CH2 TRP A 92 -17.097 -9.149 -0.315 1.00 1.76 C ATOM 0 H TRP A 92 -20.270 -7.500 3.956 1.00 0.41 H new ATOM 0 HA TRP A 92 -22.636 -6.352 2.863 1.00 0.51 H new ATOM 0 HB2 TRP A 92 -21.750 -6.657 0.446 1.00 0.66 H new ATOM 0 HB3 TRP A 92 -21.534 -5.138 1.293 1.00 0.66 H new ATOM 0 HD1 TRP A 92 -19.077 -4.296 1.638 1.00 1.79 H new ATOM 0 HE1 TRP A 92 -16.743 -5.158 0.932 1.00 1.87 H new ATOM 0 HE3 TRP A 92 -20.438 -8.990 0.265 1.00 1.87 H new ATOM 0 HZ2 TRP A 92 -15.672 -7.575 -0.039 1.00 1.14 H new ATOM 0 HZ3 TRP A 92 -18.713 -10.548 -0.519 1.00 2.35 H new ATOM 0 HH2 TRP A 92 -16.357 -9.856 -0.659 1.00 1.76 H new ATOM 1573 N GLU A 93 -23.181 -8.654 1.912 1.00 0.61 N ATOM 1574 CA GLU A 93 -23.585 -10.039 1.673 1.00 0.67 C ATOM 1575 C GLU A 93 -23.604 -10.819 2.977 1.00 0.61 C ATOM 1576 O GLU A 93 -23.296 -12.014 3.010 1.00 0.64 O ATOM 1577 CB GLU A 93 -22.647 -10.712 0.667 1.00 0.74 C ATOM 1578 CG GLU A 93 -22.696 -10.109 -0.725 1.00 0.88 C ATOM 1579 CD GLU A 93 -22.289 -11.096 -1.804 1.00 1.08 C ATOM 1580 OE1 GLU A 93 -21.082 -11.386 -1.941 1.00 1.63 O ATOM 1581 OE2 GLU A 93 -23.186 -11.597 -2.515 1.00 1.58 O ATOM 0 H GLU A 93 -23.901 -7.968 1.687 1.00 0.61 H new ATOM 0 HA GLU A 93 -24.591 -10.032 1.254 1.00 0.67 H new ATOM 0 HB2 GLU A 93 -21.625 -10.651 1.042 1.00 0.74 H new ATOM 0 HB3 GLU A 93 -22.900 -11.770 0.602 1.00 0.74 H new ATOM 0 HG2 GLU A 93 -23.706 -9.752 -0.927 1.00 0.88 H new ATOM 0 HG3 GLU A 93 -22.037 -9.241 -0.764 1.00 0.88 H new ATOM 1588 N LYS A 94 -23.998 -10.127 4.044 1.00 0.59 N ATOM 1589 CA LYS A 94 -24.068 -10.703 5.379 1.00 0.61 C ATOM 1590 C LYS A 94 -22.680 -11.114 5.854 1.00 0.55 C ATOM 1591 O LYS A 94 -22.537 -12.030 6.662 1.00 0.63 O ATOM 1592 CB LYS A 94 -25.023 -11.907 5.420 1.00 0.71 C ATOM 1593 CG LYS A 94 -26.446 -11.596 4.966 1.00 0.85 C ATOM 1594 CD LYS A 94 -27.079 -10.469 5.772 1.00 0.93 C ATOM 1595 CE LYS A 94 -26.939 -10.693 7.269 1.00 1.23 C ATOM 1596 NZ LYS A 94 -27.634 -9.643 8.057 1.00 1.79 N ATOM 0 H LYS A 94 -24.278 -9.147 4.003 1.00 0.59 H new ATOM 0 HA LYS A 94 -24.460 -9.940 6.051 1.00 0.61 H new ATOM 0 HB2 LYS A 94 -24.618 -12.699 4.790 1.00 0.71 H new ATOM 0 HB3 LYS A 94 -25.056 -12.295 6.438 1.00 0.71 H new ATOM 0 HG2 LYS A 94 -26.436 -11.323 3.911 1.00 0.85 H new ATOM 0 HG3 LYS A 94 -27.058 -12.493 5.058 1.00 0.85 H new ATOM 0 HD2 LYS A 94 -26.611 -9.522 5.502 1.00 0.93 H new ATOM 0 HD3 LYS A 94 -28.135 -10.388 5.515 1.00 0.93 H new ATOM 0 HE2 LYS A 94 -27.346 -11.670 7.529 1.00 1.23 H new ATOM 0 HE3 LYS A 94 -25.882 -10.707 7.536 1.00 1.23 H new ATOM 0 HZ1 LYS A 94 -27.513 -9.834 9.072 1.00 1.79 H new ATOM 0 HZ2 LYS A 94 -27.229 -8.713 7.829 1.00 1.79 H new ATOM 0 HZ3 LYS A 94 -28.647 -9.646 7.822 1.00 1.79 H new ATOM 1610 N LYS A 95 -21.656 -10.434 5.355 1.00 0.47 N ATOM 1611 CA LYS A 95 -20.288 -10.748 5.732 1.00 0.46 C ATOM 1612 C LYS A 95 -19.493 -9.481 6.019 1.00 0.42 C ATOM 1613 O LYS A 95 -19.854 -8.395 5.580 1.00 0.42 O ATOM 1614 CB LYS A 95 -19.593 -11.547 4.637 1.00 0.52 C ATOM 1615 CG LYS A 95 -18.647 -12.615 5.161 1.00 0.63 C ATOM 1616 CD LYS A 95 -19.393 -13.856 5.619 1.00 0.77 C ATOM 1617 CE LYS A 95 -20.012 -14.605 4.448 1.00 0.94 C ATOM 1618 NZ LYS A 95 -20.507 -15.948 4.849 1.00 1.29 N ATOM 0 H LYS A 95 -21.748 -9.665 4.691 1.00 0.47 H new ATOM 0 HA LYS A 95 -20.330 -11.350 6.640 1.00 0.46 H new ATOM 0 HB2 LYS A 95 -20.349 -12.021 4.011 1.00 0.52 H new ATOM 0 HB3 LYS A 95 -19.034 -10.862 3.999 1.00 0.52 H new ATOM 0 HG2 LYS A 95 -17.937 -12.886 4.380 1.00 0.63 H new ATOM 0 HG3 LYS A 95 -18.068 -12.212 5.992 1.00 0.63 H new ATOM 0 HD2 LYS A 95 -18.709 -14.516 6.152 1.00 0.77 H new ATOM 0 HD3 LYS A 95 -20.175 -13.571 6.323 1.00 0.77 H new ATOM 0 HE2 LYS A 95 -20.837 -14.021 4.039 1.00 0.94 H new ATOM 0 HE3 LYS A 95 -19.273 -14.713 3.654 1.00 0.94 H new ATOM 0 HZ1 LYS A 95 -20.921 -16.426 4.023 1.00 1.29 H new ATOM 0 HZ2 LYS A 95 -19.716 -16.514 5.216 1.00 1.29 H new ATOM 0 HZ3 LYS A 95 -21.231 -15.845 5.589 1.00 1.29 H new ATOM 1632 N THR A 96 -18.401 -9.650 6.744 1.00 0.43 N ATOM 1633 CA THR A 96 -17.530 -8.550 7.139 1.00 0.41 C ATOM 1634 C THR A 96 -16.065 -8.873 6.824 1.00 0.40 C ATOM 1635 O THR A 96 -15.603 -9.989 7.066 1.00 0.45 O ATOM 1636 CB THR A 96 -17.662 -8.259 8.648 1.00 0.45 C ATOM 1637 OG1 THR A 96 -17.339 -9.434 9.403 1.00 0.73 O ATOM 1638 CG2 THR A 96 -19.069 -7.802 9.003 1.00 0.55 C ATOM 0 H THR A 96 -18.089 -10.561 7.079 1.00 0.43 H new ATOM 0 HA THR A 96 -17.838 -7.672 6.572 1.00 0.41 H new ATOM 0 HB THR A 96 -16.966 -7.457 8.895 1.00 0.45 H new ATOM 0 HG1 THR A 96 -17.423 -9.241 10.360 1.00 0.73 H new ATOM 0 HG21 THR A 96 -19.128 -7.605 10.073 1.00 0.55 H new ATOM 0 HG22 THR A 96 -19.305 -6.891 8.453 1.00 0.55 H new ATOM 0 HG23 THR A 96 -19.783 -8.582 8.737 1.00 0.55 H new ATOM 1646 N TYR A 97 -15.347 -7.899 6.279 1.00 0.38 N ATOM 1647 CA TYR A 97 -13.941 -8.080 5.925 1.00 0.40 C ATOM 1648 C TYR A 97 -13.109 -6.887 6.391 1.00 0.35 C ATOM 1649 O TYR A 97 -13.653 -5.806 6.662 1.00 0.33 O ATOM 1650 CB TYR A 97 -13.782 -8.272 4.411 1.00 0.47 C ATOM 1651 CG TYR A 97 -14.825 -9.185 3.794 1.00 0.56 C ATOM 1652 CD1 TYR A 97 -16.103 -8.720 3.514 1.00 1.37 C ATOM 1653 CD2 TYR A 97 -14.531 -10.509 3.498 1.00 1.37 C ATOM 1654 CE1 TYR A 97 -17.058 -9.546 2.963 1.00 1.54 C ATOM 1655 CE2 TYR A 97 -15.482 -11.345 2.941 1.00 1.54 C ATOM 1656 CZ TYR A 97 -16.743 -10.858 2.676 1.00 1.13 C ATOM 1657 OH TYR A 97 -17.694 -11.684 2.119 1.00 1.45 O ATOM 0 H TYR A 97 -15.715 -6.971 6.071 1.00 0.38 H new ATOM 0 HA TYR A 97 -13.580 -8.976 6.430 1.00 0.40 H new ATOM 0 HB2 TYR A 97 -13.832 -7.298 3.924 1.00 0.47 H new ATOM 0 HB3 TYR A 97 -12.791 -8.679 4.208 1.00 0.47 H new ATOM 0 HD1 TYR A 97 -16.353 -7.692 3.732 1.00 1.37 H new ATOM 0 HD2 TYR A 97 -13.543 -10.893 3.706 1.00 1.37 H new ATOM 0 HE1 TYR A 97 -18.049 -9.168 2.757 1.00 1.54 H new ATOM 0 HE2 TYR A 97 -15.237 -12.372 2.715 1.00 1.54 H new ATOM 0 HH TYR A 97 -18.096 -11.243 1.342 1.00 1.45 H new ATOM 1667 N GLN A 98 -11.793 -7.083 6.459 1.00 0.37 N ATOM 1668 CA GLN A 98 -10.873 -6.043 6.915 1.00 0.34 C ATOM 1669 C GLN A 98 -10.084 -5.445 5.754 1.00 0.31 C ATOM 1670 O GLN A 98 -9.491 -6.169 4.938 1.00 0.31 O ATOM 1671 CB GLN A 98 -9.910 -6.603 7.966 1.00 0.40 C ATOM 1672 CG GLN A 98 -10.607 -7.108 9.219 1.00 0.80 C ATOM 1673 CD GLN A 98 -9.641 -7.507 10.319 1.00 1.21 C ATOM 1674 OE1 GLN A 98 -9.903 -8.442 11.075 1.00 1.83 O ATOM 1675 NE2 GLN A 98 -8.522 -6.800 10.429 1.00 1.84 N ATOM 0 H GLN A 98 -11.338 -7.959 6.202 1.00 0.37 H new ATOM 0 HA GLN A 98 -11.471 -5.249 7.363 1.00 0.34 H new ATOM 0 HB2 GLN A 98 -9.337 -7.419 7.525 1.00 0.40 H new ATOM 0 HB3 GLN A 98 -9.197 -5.827 8.244 1.00 0.40 H new ATOM 0 HG2 GLN A 98 -11.274 -6.332 9.594 1.00 0.80 H new ATOM 0 HG3 GLN A 98 -11.228 -7.966 8.961 1.00 0.80 H new ATOM 0 HE21 GLN A 98 -8.339 -6.032 9.784 1.00 1.84 H new ATOM 0 HE22 GLN A 98 -7.846 -7.026 11.159 1.00 1.84 H new ATOM 1684 N LEU A 99 -10.069 -4.119 5.707 1.00 0.29 N ATOM 1685 CA LEU A 99 -9.385 -3.381 4.663 1.00 0.28 C ATOM 1686 C LEU A 99 -8.343 -2.435 5.252 1.00 0.26 C ATOM 1687 O LEU A 99 -8.675 -1.543 6.030 1.00 0.28 O ATOM 1688 CB LEU A 99 -10.413 -2.570 3.874 1.00 0.31 C ATOM 1689 CG LEU A 99 -10.103 -2.366 2.392 1.00 0.37 C ATOM 1690 CD1 LEU A 99 -8.928 -1.411 2.204 1.00 0.46 C ATOM 1691 CD2 LEU A 99 -9.828 -3.705 1.721 1.00 0.48 C ATOM 0 H LEU A 99 -10.533 -3.527 6.396 1.00 0.29 H new ATOM 0 HA LEU A 99 -8.875 -4.090 4.011 1.00 0.28 H new ATOM 0 HB2 LEU A 99 -11.381 -3.065 3.959 1.00 0.31 H new ATOM 0 HB3 LEU A 99 -10.513 -1.591 4.343 1.00 0.31 H new ATOM 0 HG LEU A 99 -10.975 -1.915 1.918 1.00 0.37 H new ATOM 0 HD11 LEU A 99 -8.729 -1.284 1.140 1.00 0.46 H new ATOM 0 HD12 LEU A 99 -9.170 -0.444 2.646 1.00 0.46 H new ATOM 0 HD13 LEU A 99 -8.044 -1.821 2.692 1.00 0.46 H new ATOM 0 HD21 LEU A 99 -9.609 -3.545 0.665 1.00 0.48 H new ATOM 0 HD22 LEU A 99 -8.974 -4.184 2.200 1.00 0.48 H new ATOM 0 HD23 LEU A 99 -10.704 -4.346 1.816 1.00 0.48 H new ATOM 1703 N ASP A 100 -7.092 -2.628 4.888 1.00 0.25 N ATOM 1704 CA ASP A 100 -6.028 -1.753 5.362 1.00 0.26 C ATOM 1705 C ASP A 100 -5.693 -0.759 4.273 1.00 0.25 C ATOM 1706 O ASP A 100 -5.422 -1.148 3.143 1.00 0.26 O ATOM 1707 CB ASP A 100 -4.775 -2.542 5.704 1.00 0.32 C ATOM 1708 CG ASP A 100 -4.682 -2.951 7.157 1.00 0.41 C ATOM 1709 OD1 ASP A 100 -4.906 -2.119 8.046 1.00 0.74 O ATOM 1710 OD2 ASP A 100 -4.350 -4.132 7.406 1.00 0.43 O ATOM 0 H ASP A 100 -6.783 -3.378 4.269 1.00 0.25 H new ATOM 0 HA ASP A 100 -6.374 -1.246 6.262 1.00 0.26 H new ATOM 0 HB2 ASP A 100 -4.741 -3.437 5.083 1.00 0.32 H new ATOM 0 HB3 ASP A 100 -3.900 -1.943 5.449 1.00 0.32 H new ATOM 1715 N LEU A 101 -5.714 0.515 4.595 1.00 0.25 N ATOM 1716 CA LEU A 101 -5.408 1.529 3.606 1.00 0.25 C ATOM 1717 C LEU A 101 -4.337 2.474 4.122 1.00 0.25 C ATOM 1718 O LEU A 101 -4.334 2.869 5.289 1.00 0.27 O ATOM 1719 CB LEU A 101 -6.671 2.291 3.189 1.00 0.28 C ATOM 1720 CG LEU A 101 -7.159 3.373 4.153 1.00 0.34 C ATOM 1721 CD1 LEU A 101 -6.608 4.737 3.756 1.00 0.33 C ATOM 1722 CD2 LEU A 101 -8.675 3.403 4.177 1.00 0.51 C ATOM 0 H LEU A 101 -5.937 0.873 5.524 1.00 0.25 H new ATOM 0 HA LEU A 101 -5.017 1.032 2.718 1.00 0.25 H new ATOM 0 HB2 LEU A 101 -6.487 2.754 2.220 1.00 0.28 H new ATOM 0 HB3 LEU A 101 -7.476 1.569 3.049 1.00 0.28 H new ATOM 0 HG LEU A 101 -6.795 3.136 5.153 1.00 0.34 H new ATOM 0 HD11 LEU A 101 -6.968 5.492 4.455 1.00 0.33 H new ATOM 0 HD12 LEU A 101 -5.519 4.710 3.779 1.00 0.33 H new ATOM 0 HD13 LEU A 101 -6.943 4.986 2.749 1.00 0.33 H new ATOM 0 HD21 LEU A 101 -9.013 4.177 4.866 1.00 0.51 H new ATOM 0 HD22 LEU A 101 -9.051 3.619 3.177 1.00 0.51 H new ATOM 0 HD23 LEU A 101 -9.053 2.435 4.505 1.00 0.51 H new ATOM 1734 N PHE A 102 -3.407 2.807 3.250 1.00 0.24 N ATOM 1735 CA PHE A 102 -2.322 3.700 3.593 1.00 0.25 C ATOM 1736 C PHE A 102 -2.262 4.836 2.585 1.00 0.24 C ATOM 1737 O PHE A 102 -2.436 4.615 1.390 1.00 0.24 O ATOM 1738 CB PHE A 102 -1.005 2.923 3.609 1.00 0.28 C ATOM 1739 CG PHE A 102 -1.143 1.536 4.177 1.00 0.39 C ATOM 1740 CD1 PHE A 102 -1.107 1.325 5.545 1.00 1.27 C ATOM 1741 CD2 PHE A 102 -1.329 0.446 3.339 1.00 1.29 C ATOM 1742 CE1 PHE A 102 -1.251 0.052 6.068 1.00 1.36 C ATOM 1743 CE2 PHE A 102 -1.473 -0.826 3.853 1.00 1.40 C ATOM 1744 CZ PHE A 102 -1.434 -1.026 5.219 1.00 0.81 C ATOM 0 H PHE A 102 -3.383 2.467 2.288 1.00 0.24 H new ATOM 0 HA PHE A 102 -2.490 4.121 4.584 1.00 0.25 H new ATOM 0 HB2 PHE A 102 -0.618 2.856 2.592 1.00 0.28 H new ATOM 0 HB3 PHE A 102 -0.271 3.477 4.194 1.00 0.28 H new ATOM 0 HD1 PHE A 102 -0.965 2.163 6.211 1.00 1.27 H new ATOM 0 HD2 PHE A 102 -1.361 0.595 2.270 1.00 1.29 H new ATOM 0 HE1 PHE A 102 -1.221 -0.100 7.137 1.00 1.36 H new ATOM 0 HE2 PHE A 102 -1.616 -1.665 3.188 1.00 1.40 H new ATOM 0 HZ PHE A 102 -1.546 -2.021 5.624 1.00 0.81 H new ATOM 1754 N THR A 103 -2.029 6.044 3.063 1.00 0.25 N ATOM 1755 CA THR A 103 -1.956 7.199 2.188 1.00 0.25 C ATOM 1756 C THR A 103 -0.507 7.470 1.795 1.00 0.25 C ATOM 1757 O THR A 103 0.365 7.568 2.659 1.00 0.28 O ATOM 1758 CB THR A 103 -2.556 8.441 2.874 1.00 0.29 C ATOM 1759 OG1 THR A 103 -2.403 8.330 4.296 1.00 0.37 O ATOM 1760 CG2 THR A 103 -4.032 8.595 2.529 1.00 0.38 C ATOM 0 H THR A 103 -1.887 6.251 4.052 1.00 0.25 H new ATOM 0 HA THR A 103 -2.535 6.986 1.290 1.00 0.25 H new ATOM 0 HB THR A 103 -2.024 9.322 2.514 1.00 0.29 H new ATOM 0 HG1 THR A 103 -2.784 9.122 4.729 1.00 0.37 H new ATOM 0 HG21 THR A 103 -4.431 9.479 3.026 1.00 0.38 H new ATOM 0 HG22 THR A 103 -4.144 8.703 1.450 1.00 0.38 H new ATOM 0 HG23 THR A 103 -4.578 7.713 2.864 1.00 0.38 H new ATOM 1768 N ALA A 104 -0.243 7.576 0.496 1.00 0.26 N ATOM 1769 CA ALA A 104 1.110 7.809 0.019 1.00 0.28 C ATOM 1770 C ALA A 104 1.120 8.791 -1.147 1.00 0.26 C ATOM 1771 O ALA A 104 0.105 8.998 -1.811 1.00 0.25 O ATOM 1772 CB ALA A 104 1.744 6.493 -0.400 1.00 0.34 C ATOM 0 H ALA A 104 -0.946 7.504 -0.239 1.00 0.26 H new ATOM 0 HA ALA A 104 1.689 8.245 0.833 1.00 0.28 H new ATOM 0 HB1 ALA A 104 2.758 6.675 -0.756 1.00 0.34 H new ATOM 0 HB2 ALA A 104 1.775 5.816 0.454 1.00 0.34 H new ATOM 0 HB3 ALA A 104 1.154 6.043 -1.198 1.00 0.34 H new ATOM 1778 N LEU A 105 2.274 9.385 -1.398 1.00 0.27 N ATOM 1779 CA LEU A 105 2.415 10.337 -2.485 1.00 0.27 C ATOM 1780 C LEU A 105 2.858 9.616 -3.742 1.00 0.26 C ATOM 1781 O LEU A 105 3.301 8.471 -3.677 1.00 0.27 O ATOM 1782 CB LEU A 105 3.433 11.419 -2.130 1.00 0.32 C ATOM 1783 CG LEU A 105 3.056 12.333 -0.961 1.00 0.39 C ATOM 1784 CD1 LEU A 105 3.852 13.624 -1.022 1.00 0.57 C ATOM 1785 CD2 LEU A 105 1.565 12.629 -0.962 1.00 0.49 C ATOM 0 H LEU A 105 3.127 9.224 -0.863 1.00 0.27 H new ATOM 0 HA LEU A 105 1.449 10.812 -2.655 1.00 0.27 H new ATOM 0 HB2 LEU A 105 4.382 10.936 -1.897 1.00 0.32 H new ATOM 0 HB3 LEU A 105 3.599 12.038 -3.012 1.00 0.32 H new ATOM 0 HG LEU A 105 3.299 11.816 -0.033 1.00 0.39 H new ATOM 0 HD11 LEU A 105 3.573 14.263 -0.185 1.00 0.57 H new ATOM 0 HD12 LEU A 105 4.917 13.398 -0.967 1.00 0.57 H new ATOM 0 HD13 LEU A 105 3.639 14.139 -1.959 1.00 0.57 H new ATOM 0 HD21 LEU A 105 1.323 13.280 -0.122 1.00 0.49 H new ATOM 0 HD22 LEU A 105 1.293 13.123 -1.895 1.00 0.49 H new ATOM 0 HD23 LEU A 105 1.009 11.696 -0.870 1.00 0.49 H new ATOM 1797 N ALA A 106 2.733 10.282 -4.883 1.00 0.27 N ATOM 1798 CA ALA A 106 3.137 9.701 -6.159 1.00 0.30 C ATOM 1799 C ALA A 106 4.618 9.369 -6.159 1.00 0.31 C ATOM 1800 O ALA A 106 5.075 8.505 -6.907 1.00 0.36 O ATOM 1801 CB ALA A 106 2.802 10.638 -7.305 1.00 0.34 C ATOM 0 H ALA A 106 2.354 11.227 -4.952 1.00 0.27 H new ATOM 0 HA ALA A 106 2.581 8.774 -6.298 1.00 0.30 H new ATOM 0 HB1 ALA A 106 3.111 10.186 -8.247 1.00 0.34 H new ATOM 0 HB2 ALA A 106 1.727 10.819 -7.325 1.00 0.34 H new ATOM 0 HB3 ALA A 106 3.326 11.584 -7.167 1.00 0.34 H new ATOM 1807 N GLU A 107 5.361 10.067 -5.316 1.00 0.31 N ATOM 1808 CA GLU A 107 6.792 9.837 -5.197 1.00 0.35 C ATOM 1809 C GLU A 107 7.053 8.567 -4.394 1.00 0.36 C ATOM 1810 O GLU A 107 7.991 7.837 -4.672 1.00 0.43 O ATOM 1811 CB GLU A 107 7.504 11.036 -4.550 1.00 0.40 C ATOM 1812 CG GLU A 107 6.617 11.893 -3.657 1.00 0.44 C ATOM 1813 CD GLU A 107 5.906 12.990 -4.423 1.00 0.67 C ATOM 1814 OE1 GLU A 107 6.539 14.025 -4.716 1.00 1.35 O ATOM 1815 OE2 GLU A 107 4.712 12.821 -4.746 1.00 1.38 O ATOM 0 H GLU A 107 4.997 10.797 -4.704 1.00 0.31 H new ATOM 0 HA GLU A 107 7.198 9.715 -6.201 1.00 0.35 H new ATOM 0 HB2 GLU A 107 8.344 10.668 -3.960 1.00 0.40 H new ATOM 0 HB3 GLU A 107 7.919 11.664 -5.338 1.00 0.40 H new ATOM 0 HG2 GLU A 107 5.878 11.258 -3.169 1.00 0.44 H new ATOM 0 HG3 GLU A 107 7.224 12.340 -2.869 1.00 0.44 H new ATOM 1822 N GLU A 108 6.160 8.268 -3.460 1.00 0.33 N ATOM 1823 CA GLU A 108 6.289 7.094 -2.591 1.00 0.36 C ATOM 1824 C GLU A 108 5.699 5.855 -3.266 1.00 0.39 C ATOM 1825 O GLU A 108 5.320 4.889 -2.602 1.00 0.59 O ATOM 1826 CB GLU A 108 5.578 7.338 -1.254 1.00 0.39 C ATOM 1827 CG GLU A 108 6.216 8.414 -0.381 1.00 0.75 C ATOM 1828 CD GLU A 108 7.630 8.761 -0.797 1.00 1.62 C ATOM 1829 OE1 GLU A 108 8.527 7.907 -0.640 1.00 2.31 O ATOM 1830 OE2 GLU A 108 7.839 9.892 -1.282 1.00 2.35 O ATOM 0 H GLU A 108 5.326 8.827 -3.280 1.00 0.33 H new ATOM 0 HA GLU A 108 7.350 6.925 -2.407 1.00 0.36 H new ATOM 0 HB2 GLU A 108 4.543 7.617 -1.454 1.00 0.39 H new ATOM 0 HB3 GLU A 108 5.553 6.403 -0.695 1.00 0.39 H new ATOM 0 HG2 GLU A 108 5.602 9.314 -0.419 1.00 0.75 H new ATOM 0 HG3 GLU A 108 6.222 8.075 0.655 1.00 0.75 H new ATOM 1837 N LYS A 109 5.655 5.886 -4.591 1.00 0.37 N ATOM 1838 CA LYS A 109 5.051 4.816 -5.375 1.00 0.38 C ATOM 1839 C LYS A 109 5.843 3.502 -5.274 1.00 0.34 C ATOM 1840 O LYS A 109 5.317 2.514 -4.762 1.00 0.35 O ATOM 1841 CB LYS A 109 4.878 5.255 -6.836 1.00 0.44 C ATOM 1842 CG LYS A 109 3.665 4.641 -7.515 1.00 0.74 C ATOM 1843 CD LYS A 109 4.016 3.348 -8.237 1.00 1.00 C ATOM 1844 CE LYS A 109 2.771 2.624 -8.724 1.00 1.73 C ATOM 1845 NZ LYS A 109 3.109 1.441 -9.557 1.00 2.18 N ATOM 0 H LYS A 109 6.035 6.649 -5.151 1.00 0.37 H new ATOM 0 HA LYS A 109 4.065 4.616 -4.955 1.00 0.38 H new ATOM 0 HB2 LYS A 109 4.794 6.341 -6.873 1.00 0.44 H new ATOM 0 HB3 LYS A 109 5.773 4.985 -7.396 1.00 0.44 H new ATOM 0 HG2 LYS A 109 2.893 4.444 -6.771 1.00 0.74 H new ATOM 0 HG3 LYS A 109 3.248 5.353 -8.227 1.00 0.74 H new ATOM 0 HD2 LYS A 109 4.665 3.568 -9.085 1.00 1.00 H new ATOM 0 HD3 LYS A 109 4.578 2.697 -7.567 1.00 1.00 H new ATOM 0 HE2 LYS A 109 2.177 2.307 -7.867 1.00 1.73 H new ATOM 0 HE3 LYS A 109 2.154 3.311 -9.303 1.00 1.73 H new ATOM 0 HZ1 LYS A 109 2.233 0.975 -9.869 1.00 2.18 H new ATOM 0 HZ2 LYS A 109 3.654 1.746 -10.388 1.00 2.18 H new ATOM 0 HZ3 LYS A 109 3.676 0.773 -8.997 1.00 2.18 H new ATOM 1859 N PRO A 110 7.118 3.453 -5.732 1.00 0.34 N ATOM 1860 CA PRO A 110 7.912 2.219 -5.674 1.00 0.35 C ATOM 1861 C PRO A 110 8.206 1.776 -4.248 1.00 0.30 C ATOM 1862 O PRO A 110 8.138 0.589 -3.936 1.00 0.31 O ATOM 1863 CB PRO A 110 9.216 2.595 -6.376 1.00 0.42 C ATOM 1864 CG PRO A 110 9.304 4.067 -6.248 1.00 0.41 C ATOM 1865 CD PRO A 110 7.892 4.565 -6.325 1.00 0.37 C ATOM 0 HA PRO A 110 7.381 1.385 -6.133 1.00 0.35 H new ATOM 0 HB2 PRO A 110 10.071 2.106 -5.910 1.00 0.42 H new ATOM 0 HB3 PRO A 110 9.205 2.289 -7.422 1.00 0.42 H new ATOM 0 HG2 PRO A 110 9.769 4.351 -5.304 1.00 0.41 H new ATOM 0 HG3 PRO A 110 9.914 4.494 -7.044 1.00 0.41 H new ATOM 0 HD2 PRO A 110 7.759 5.492 -5.767 1.00 0.37 H new ATOM 0 HD3 PRO A 110 7.589 4.765 -7.353 1.00 0.37 H new ATOM 1873 N TYR A 111 8.534 2.736 -3.391 1.00 0.29 N ATOM 1874 CA TYR A 111 8.856 2.451 -1.993 1.00 0.27 C ATOM 1875 C TYR A 111 7.736 1.712 -1.288 1.00 0.26 C ATOM 1876 O TYR A 111 7.951 0.644 -0.708 1.00 0.26 O ATOM 1877 CB TYR A 111 9.154 3.746 -1.245 1.00 0.31 C ATOM 1878 CG TYR A 111 10.534 4.278 -1.509 1.00 0.27 C ATOM 1879 CD1 TYR A 111 11.241 3.886 -2.634 1.00 1.20 C ATOM 1880 CD2 TYR A 111 11.133 5.164 -0.633 1.00 1.24 C ATOM 1881 CE1 TYR A 111 12.510 4.364 -2.878 1.00 1.21 C ATOM 1882 CE2 TYR A 111 12.401 5.647 -0.870 1.00 1.27 C ATOM 1883 CZ TYR A 111 13.083 5.242 -1.996 1.00 0.41 C ATOM 1884 OH TYR A 111 14.342 5.723 -2.243 1.00 0.53 O ATOM 0 H TYR A 111 8.585 3.724 -3.639 1.00 0.29 H new ATOM 0 HA TYR A 111 9.737 1.809 -1.993 1.00 0.27 H new ATOM 0 HB2 TYR A 111 8.420 4.500 -1.530 1.00 0.31 H new ATOM 0 HB3 TYR A 111 9.036 3.575 -0.175 1.00 0.31 H new ATOM 0 HD1 TYR A 111 10.790 3.195 -3.331 1.00 1.20 H new ATOM 0 HD2 TYR A 111 10.599 5.482 0.250 1.00 1.24 H new ATOM 0 HE1 TYR A 111 13.050 4.049 -3.759 1.00 1.21 H new ATOM 0 HE2 TYR A 111 12.857 6.339 -0.177 1.00 1.27 H new ATOM 0 HH TYR A 111 14.929 4.983 -2.504 1.00 0.53 H new ATOM 1894 N ALA A 112 6.546 2.283 -1.342 1.00 0.26 N ATOM 1895 CA ALA A 112 5.388 1.683 -0.699 1.00 0.27 C ATOM 1896 C ALA A 112 5.162 0.263 -1.209 1.00 0.26 C ATOM 1897 O ALA A 112 4.939 -0.664 -0.427 1.00 0.26 O ATOM 1898 CB ALA A 112 4.149 2.533 -0.928 1.00 0.30 C ATOM 0 H ALA A 112 6.355 3.161 -1.824 1.00 0.26 H new ATOM 0 HA ALA A 112 5.581 1.635 0.373 1.00 0.27 H new ATOM 0 HB1 ALA A 112 3.293 2.068 -0.439 1.00 0.30 H new ATOM 0 HB2 ALA A 112 4.308 3.528 -0.512 1.00 0.30 H new ATOM 0 HB3 ALA A 112 3.956 2.614 -1.998 1.00 0.30 H new ATOM 1904 N ILE A 113 5.239 0.098 -2.527 1.00 0.27 N ATOM 1905 CA ILE A 113 5.052 -1.209 -3.138 1.00 0.29 C ATOM 1906 C ILE A 113 6.131 -2.177 -2.686 1.00 0.29 C ATOM 1907 O ILE A 113 5.839 -3.324 -2.405 1.00 0.31 O ATOM 1908 CB ILE A 113 5.052 -1.145 -4.683 1.00 0.33 C ATOM 1909 CG1 ILE A 113 3.959 -0.200 -5.190 1.00 0.35 C ATOM 1910 CG2 ILE A 113 4.863 -2.537 -5.273 1.00 0.37 C ATOM 1911 CD1 ILE A 113 2.567 -0.574 -4.733 1.00 0.39 C ATOM 0 H ILE A 113 5.429 0.852 -3.188 1.00 0.27 H new ATOM 0 HA ILE A 113 4.074 -1.561 -2.810 1.00 0.29 H new ATOM 0 HB ILE A 113 6.017 -0.756 -5.007 1.00 0.33 H new ATOM 0 HG12 ILE A 113 4.182 0.812 -4.853 1.00 0.35 H new ATOM 0 HG13 ILE A 113 3.982 -0.185 -6.280 1.00 0.35 H new ATOM 0 HG21 ILE A 113 4.865 -2.474 -6.361 1.00 0.37 H new ATOM 0 HG22 ILE A 113 5.676 -3.185 -4.945 1.00 0.37 H new ATOM 0 HG23 ILE A 113 3.912 -2.949 -4.935 1.00 0.37 H new ATOM 0 HD11 ILE A 113 1.848 0.142 -5.132 1.00 0.39 H new ATOM 0 HD12 ILE A 113 2.322 -1.573 -5.093 1.00 0.39 H new ATOM 0 HD13 ILE A 113 2.526 -0.560 -3.644 1.00 0.39 H new ATOM 1923 N PHE A 114 7.370 -1.708 -2.607 1.00 0.28 N ATOM 1924 CA PHE A 114 8.489 -2.545 -2.181 1.00 0.31 C ATOM 1925 C PHE A 114 8.209 -3.178 -0.827 1.00 0.31 C ATOM 1926 O PHE A 114 8.403 -4.378 -0.634 1.00 0.33 O ATOM 1927 CB PHE A 114 9.760 -1.710 -2.088 1.00 0.34 C ATOM 1928 CG PHE A 114 10.995 -2.526 -1.849 1.00 0.36 C ATOM 1929 CD1 PHE A 114 11.422 -3.436 -2.798 1.00 1.27 C ATOM 1930 CD2 PHE A 114 11.724 -2.384 -0.681 1.00 1.24 C ATOM 1931 CE1 PHE A 114 12.559 -4.194 -2.588 1.00 1.33 C ATOM 1932 CE2 PHE A 114 12.861 -3.137 -0.462 1.00 1.26 C ATOM 1933 CZ PHE A 114 13.279 -4.043 -1.417 1.00 0.55 C ATOM 0 H PHE A 114 7.628 -0.747 -2.833 1.00 0.28 H new ATOM 0 HA PHE A 114 8.619 -3.335 -2.921 1.00 0.31 H new ATOM 0 HB2 PHE A 114 9.881 -1.143 -3.011 1.00 0.34 H new ATOM 0 HB3 PHE A 114 9.651 -0.985 -1.281 1.00 0.34 H new ATOM 0 HD1 PHE A 114 10.861 -3.556 -3.713 1.00 1.27 H new ATOM 0 HD2 PHE A 114 11.400 -1.676 0.068 1.00 1.24 H new ATOM 0 HE1 PHE A 114 12.884 -4.902 -3.336 1.00 1.33 H new ATOM 0 HE2 PHE A 114 13.422 -3.018 0.453 1.00 1.26 H new ATOM 0 HZ PHE A 114 14.168 -4.633 -1.249 1.00 0.55 H new ATOM 1943 N HIS A 115 7.749 -2.352 0.093 1.00 0.30 N ATOM 1944 CA HIS A 115 7.424 -2.783 1.439 1.00 0.33 C ATOM 1945 C HIS A 115 6.315 -3.836 1.426 1.00 0.32 C ATOM 1946 O HIS A 115 6.509 -4.951 1.904 1.00 0.34 O ATOM 1947 CB HIS A 115 7.052 -1.550 2.275 1.00 0.38 C ATOM 1948 CG HIS A 115 7.002 -1.845 3.728 1.00 0.42 C ATOM 1949 ND1 HIS A 115 7.903 -1.326 4.628 1.00 0.45 N ATOM 1950 CD2 HIS A 115 6.194 -2.685 4.356 1.00 0.47 C ATOM 1951 CE1 HIS A 115 7.617 -1.888 5.786 1.00 0.49 C ATOM 1952 NE2 HIS A 115 6.590 -2.725 5.666 1.00 0.51 N ATOM 0 H HIS A 115 7.589 -1.358 -0.073 1.00 0.30 H new ATOM 0 HA HIS A 115 8.290 -3.263 1.896 1.00 0.33 H new ATOM 0 HB2 HIS A 115 7.779 -0.758 2.093 1.00 0.38 H new ATOM 0 HB3 HIS A 115 6.082 -1.173 1.950 1.00 0.38 H new ATOM 0 HD2 HIS A 115 5.375 -3.236 3.917 1.00 0.47 H new ATOM 0 HE1 HIS A 115 8.145 -1.695 6.708 1.00 0.49 H new ATOM 0 HE2 HIS A 115 6.176 -3.289 6.408 1.00 0.51 H new ATOM 1960 N PHE A 116 5.170 -3.495 0.872 1.00 0.32 N ATOM 1961 CA PHE A 116 4.040 -4.426 0.827 1.00 0.33 C ATOM 1962 C PHE A 116 4.162 -5.496 -0.262 1.00 0.33 C ATOM 1963 O PHE A 116 3.267 -6.327 -0.404 1.00 0.36 O ATOM 1964 CB PHE A 116 2.729 -3.675 0.675 1.00 0.35 C ATOM 1965 CG PHE A 116 2.479 -2.721 1.808 1.00 0.37 C ATOM 1966 CD1 PHE A 116 2.992 -1.437 1.784 1.00 1.29 C ATOM 1967 CD2 PHE A 116 1.757 -3.128 2.916 1.00 1.21 C ATOM 1968 CE1 PHE A 116 2.792 -0.574 2.842 1.00 1.31 C ATOM 1969 CE2 PHE A 116 1.549 -2.269 3.976 1.00 1.25 C ATOM 1970 CZ PHE A 116 2.069 -0.991 3.941 1.00 0.50 C ATOM 0 H PHE A 116 4.988 -2.586 0.446 1.00 0.32 H new ATOM 0 HA PHE A 116 4.055 -4.953 1.781 1.00 0.33 H new ATOM 0 HB2 PHE A 116 2.737 -3.124 -0.265 1.00 0.35 H new ATOM 0 HB3 PHE A 116 1.908 -4.390 0.619 1.00 0.35 H new ATOM 0 HD1 PHE A 116 3.557 -1.105 0.925 1.00 1.29 H new ATOM 0 HD2 PHE A 116 1.352 -4.129 2.952 1.00 1.21 H new ATOM 0 HE1 PHE A 116 3.200 0.425 2.810 1.00 1.31 H new ATOM 0 HE2 PHE A 116 0.979 -2.597 4.833 1.00 1.25 H new ATOM 0 HZ PHE A 116 1.910 -0.319 4.772 1.00 0.50 H new ATOM 1980 N THR A 117 5.230 -5.469 -1.042 1.00 0.33 N ATOM 1981 CA THR A 117 5.378 -6.427 -2.121 1.00 0.37 C ATOM 1982 C THR A 117 5.571 -7.867 -1.604 1.00 0.36 C ATOM 1983 O THR A 117 4.791 -8.749 -1.972 1.00 0.47 O ATOM 1984 CB THR A 117 6.465 -5.994 -3.157 1.00 0.63 C ATOM 1985 OG1 THR A 117 6.059 -6.358 -4.487 1.00 1.18 O ATOM 1986 CG2 THR A 117 7.830 -6.593 -2.877 1.00 0.92 C ATOM 0 H THR A 117 5.997 -4.803 -0.949 1.00 0.33 H new ATOM 0 HA THR A 117 4.435 -6.432 -2.667 1.00 0.37 H new ATOM 0 HB THR A 117 6.556 -4.912 -3.066 1.00 0.63 H new ATOM 0 HG1 THR A 117 6.637 -5.911 -5.140 1.00 1.18 H new ATOM 0 HG21 THR A 117 8.538 -6.253 -3.632 1.00 0.92 H new ATOM 0 HG22 THR A 117 8.171 -6.277 -1.891 1.00 0.92 H new ATOM 0 HG23 THR A 117 7.763 -7.681 -2.906 1.00 0.92 H new ATOM 1994 N GLY A 118 6.572 -8.149 -0.765 1.00 0.43 N ATOM 1995 CA GLY A 118 6.705 -9.518 -0.313 1.00 0.59 C ATOM 1996 C GLY A 118 6.747 -9.741 1.191 1.00 0.49 C ATOM 1997 O GLY A 118 5.738 -9.567 1.880 1.00 0.54 O ATOM 0 H GLY A 118 7.260 -7.486 -0.408 1.00 0.43 H new ATOM 0 HA2 GLY A 118 5.872 -10.092 -0.719 1.00 0.59 H new ATOM 0 HA3 GLY A 118 7.617 -9.931 -0.744 1.00 0.59 H new ATOM 2001 N PRO A 119 7.902 -10.165 1.739 1.00 0.51 N ATOM 2002 CA PRO A 119 8.055 -10.394 3.164 1.00 0.52 C ATOM 2003 C PRO A 119 8.804 -9.276 3.874 1.00 0.43 C ATOM 2004 O PRO A 119 9.846 -8.809 3.405 1.00 0.42 O ATOM 2005 CB PRO A 119 8.887 -11.682 3.203 1.00 0.65 C ATOM 2006 CG PRO A 119 9.397 -11.896 1.806 1.00 0.72 C ATOM 2007 CD PRO A 119 9.092 -10.635 1.039 1.00 0.70 C ATOM 0 HA PRO A 119 7.092 -10.449 3.672 1.00 0.52 H new ATOM 0 HB2 PRO A 119 9.713 -11.591 3.909 1.00 0.65 H new ATOM 0 HB3 PRO A 119 8.281 -12.527 3.529 1.00 0.65 H new ATOM 0 HG2 PRO A 119 10.468 -12.097 1.811 1.00 0.72 H new ATOM 0 HG3 PRO A 119 8.913 -12.757 1.344 1.00 0.72 H new ATOM 0 HD2 PRO A 119 9.909 -9.916 1.086 1.00 0.70 H new ATOM 0 HD3 PRO A 119 8.900 -10.830 -0.016 1.00 0.70 H new ATOM 2015 N VAL A 120 8.262 -8.855 5.009 1.00 0.43 N ATOM 2016 CA VAL A 120 8.867 -7.811 5.827 1.00 0.42 C ATOM 2017 C VAL A 120 10.313 -8.169 6.185 1.00 0.38 C ATOM 2018 O VAL A 120 11.177 -7.297 6.281 1.00 0.37 O ATOM 2019 CB VAL A 120 8.037 -7.521 7.104 1.00 0.49 C ATOM 2020 CG1 VAL A 120 7.941 -8.742 8.007 1.00 0.58 C ATOM 2021 CG2 VAL A 120 8.615 -6.334 7.862 1.00 0.53 C ATOM 0 H VAL A 120 7.391 -9.227 5.389 1.00 0.43 H new ATOM 0 HA VAL A 120 8.875 -6.897 5.233 1.00 0.42 H new ATOM 0 HB VAL A 120 7.025 -7.272 6.786 1.00 0.49 H new ATOM 0 HG11 VAL A 120 7.351 -8.496 8.890 1.00 0.58 H new ATOM 0 HG12 VAL A 120 7.461 -9.558 7.466 1.00 0.58 H new ATOM 0 HG13 VAL A 120 8.942 -9.048 8.313 1.00 0.58 H new ATOM 0 HG21 VAL A 120 8.018 -6.147 8.755 1.00 0.53 H new ATOM 0 HG22 VAL A 120 9.643 -6.553 8.152 1.00 0.53 H new ATOM 0 HG23 VAL A 120 8.598 -5.451 7.223 1.00 0.53 H new ATOM 2031 N SER A 121 10.560 -9.458 6.395 1.00 0.40 N ATOM 2032 CA SER A 121 11.889 -9.956 6.724 1.00 0.40 C ATOM 2033 C SER A 121 12.931 -9.457 5.723 1.00 0.36 C ATOM 2034 O SER A 121 14.014 -9.010 6.108 1.00 0.37 O ATOM 2035 CB SER A 121 11.857 -11.479 6.727 1.00 0.46 C ATOM 2036 OG SER A 121 10.558 -11.945 7.045 1.00 1.24 O ATOM 0 H SER A 121 9.846 -10.184 6.342 1.00 0.40 H new ATOM 0 HA SER A 121 12.171 -9.584 7.709 1.00 0.40 H new ATOM 0 HB2 SER A 121 12.157 -11.857 5.750 1.00 0.46 H new ATOM 0 HB3 SER A 121 12.575 -11.863 7.451 1.00 0.46 H new ATOM 0 HG SER A 121 10.616 -12.617 7.756 1.00 1.24 H new ATOM 2042 N TYR A 122 12.592 -9.531 4.434 1.00 0.36 N ATOM 2043 CA TYR A 122 13.477 -9.072 3.375 1.00 0.35 C ATOM 2044 C TYR A 122 13.789 -7.588 3.543 1.00 0.33 C ATOM 2045 O TYR A 122 14.929 -7.158 3.365 1.00 0.34 O ATOM 2046 CB TYR A 122 12.835 -9.323 2.014 1.00 0.38 C ATOM 2047 CG TYR A 122 13.766 -9.083 0.854 1.00 0.44 C ATOM 2048 CD1 TYR A 122 15.020 -9.666 0.828 1.00 1.29 C ATOM 2049 CD2 TYR A 122 13.393 -8.274 -0.210 1.00 1.29 C ATOM 2050 CE1 TYR A 122 15.882 -9.453 -0.227 1.00 1.35 C ATOM 2051 CE2 TYR A 122 14.249 -8.053 -1.273 1.00 1.36 C ATOM 2052 CZ TYR A 122 15.494 -8.646 -1.276 1.00 0.73 C ATOM 2053 OH TYR A 122 16.354 -8.436 -2.330 1.00 0.91 O ATOM 0 H TYR A 122 11.704 -9.908 4.103 1.00 0.36 H new ATOM 0 HA TYR A 122 14.411 -9.630 3.436 1.00 0.35 H new ATOM 0 HB2 TYR A 122 12.477 -10.352 1.975 1.00 0.38 H new ATOM 0 HB3 TYR A 122 11.963 -8.678 1.909 1.00 0.38 H new ATOM 0 HD1 TYR A 122 15.329 -10.298 1.647 1.00 1.29 H new ATOM 0 HD2 TYR A 122 12.418 -7.809 -0.208 1.00 1.29 H new ATOM 0 HE1 TYR A 122 16.857 -9.916 -0.232 1.00 1.35 H new ATOM 0 HE2 TYR A 122 13.945 -7.421 -2.094 1.00 1.36 H new ATOM 0 HH TYR A 122 15.859 -8.500 -3.174 1.00 0.91 H new ATOM 2063 N LEU A 123 12.768 -6.820 3.904 1.00 0.31 N ATOM 2064 CA LEU A 123 12.909 -5.384 4.112 1.00 0.31 C ATOM 2065 C LEU A 123 13.934 -5.111 5.206 1.00 0.31 C ATOM 2066 O LEU A 123 14.835 -4.292 5.037 1.00 0.31 O ATOM 2067 CB LEU A 123 11.557 -4.775 4.488 1.00 0.32 C ATOM 2068 CG LEU A 123 10.398 -5.164 3.570 1.00 0.34 C ATOM 2069 CD1 LEU A 123 9.082 -4.666 4.134 1.00 0.43 C ATOM 2070 CD2 LEU A 123 10.620 -4.610 2.172 1.00 0.34 C ATOM 0 H LEU A 123 11.824 -7.173 4.060 1.00 0.31 H new ATOM 0 HA LEU A 123 13.256 -4.924 3.187 1.00 0.31 H new ATOM 0 HB2 LEU A 123 11.311 -5.075 5.507 1.00 0.32 H new ATOM 0 HB3 LEU A 123 11.652 -3.689 4.489 1.00 0.32 H new ATOM 0 HG LEU A 123 10.357 -6.252 3.509 1.00 0.34 H new ATOM 0 HD11 LEU A 123 8.269 -4.952 3.467 1.00 0.43 H new ATOM 0 HD12 LEU A 123 8.917 -5.107 5.117 1.00 0.43 H new ATOM 0 HD13 LEU A 123 9.112 -3.580 4.224 1.00 0.43 H new ATOM 0 HD21 LEU A 123 9.786 -4.896 1.531 1.00 0.34 H new ATOM 0 HD22 LEU A 123 10.687 -3.523 2.218 1.00 0.34 H new ATOM 0 HD23 LEU A 123 11.547 -5.013 1.764 1.00 0.34 H new ATOM 2082 N ILE A 124 13.774 -5.803 6.329 1.00 0.36 N ATOM 2083 CA ILE A 124 14.693 -5.679 7.459 1.00 0.41 C ATOM 2084 C ILE A 124 16.131 -5.949 7.024 1.00 0.38 C ATOM 2085 O ILE A 124 17.057 -5.223 7.403 1.00 0.38 O ATOM 2086 CB ILE A 124 14.311 -6.644 8.603 1.00 0.52 C ATOM 2087 CG1 ILE A 124 12.887 -6.369 9.077 1.00 0.76 C ATOM 2088 CG2 ILE A 124 15.280 -6.512 9.764 1.00 1.01 C ATOM 2089 CD1 ILE A 124 12.355 -7.406 10.046 1.00 1.08 C ATOM 0 H ILE A 124 13.010 -6.461 6.483 1.00 0.36 H new ATOM 0 HA ILE A 124 14.617 -4.655 7.826 1.00 0.41 H new ATOM 0 HB ILE A 124 14.365 -7.663 8.220 1.00 0.52 H new ATOM 0 HG12 ILE A 124 12.855 -5.389 9.554 1.00 0.76 H new ATOM 0 HG13 ILE A 124 12.228 -6.323 8.210 1.00 0.76 H new ATOM 0 HG21 ILE A 124 14.992 -7.201 10.558 1.00 1.01 H new ATOM 0 HG22 ILE A 124 16.288 -6.750 9.425 1.00 1.01 H new ATOM 0 HG23 ILE A 124 15.256 -5.490 10.143 1.00 1.01 H new ATOM 0 HD11 ILE A 124 11.338 -7.143 10.338 1.00 1.08 H new ATOM 0 HD12 ILE A 124 12.353 -8.385 9.567 1.00 1.08 H new ATOM 0 HD13 ILE A 124 12.990 -7.437 10.931 1.00 1.08 H new ATOM 2101 N ARG A 125 16.305 -6.980 6.206 1.00 0.38 N ATOM 2102 CA ARG A 125 17.622 -7.351 5.704 1.00 0.41 C ATOM 2103 C ARG A 125 18.211 -6.210 4.876 1.00 0.36 C ATOM 2104 O ARG A 125 19.399 -5.899 4.976 1.00 0.38 O ATOM 2105 CB ARG A 125 17.529 -8.628 4.863 1.00 0.46 C ATOM 2106 CG ARG A 125 18.878 -9.225 4.509 1.00 1.30 C ATOM 2107 CD ARG A 125 19.476 -9.962 5.691 1.00 1.31 C ATOM 2108 NE ARG A 125 18.857 -11.273 5.894 1.00 2.16 N ATOM 2109 CZ ARG A 125 19.526 -12.430 5.885 1.00 2.81 C ATOM 2110 NH1 ARG A 125 20.844 -12.448 5.723 1.00 2.83 N ATOM 2111 NH2 ARG A 125 18.873 -13.573 6.062 1.00 3.80 N ATOM 0 H ARG A 125 15.547 -7.576 5.875 1.00 0.38 H new ATOM 0 HA ARG A 125 18.280 -7.542 6.552 1.00 0.41 H new ATOM 0 HB2 ARG A 125 16.945 -9.370 5.408 1.00 0.46 H new ATOM 0 HB3 ARG A 125 16.986 -8.408 3.944 1.00 0.46 H new ATOM 0 HG2 ARG A 125 18.767 -9.910 3.668 1.00 1.30 H new ATOM 0 HG3 ARG A 125 19.556 -8.434 4.189 1.00 1.30 H new ATOM 0 HD2 ARG A 125 20.547 -10.088 5.535 1.00 1.31 H new ATOM 0 HD3 ARG A 125 19.354 -9.361 6.592 1.00 1.31 H new ATOM 0 HE ARG A 125 17.850 -11.306 6.053 1.00 2.16 H new ATOM 0 HH11 ARG A 125 21.355 -11.573 5.604 1.00 2.83 H new ATOM 0 HH12 ARG A 125 21.345 -13.336 5.718 1.00 2.83 H new ATOM 0 HH21 ARG A 125 17.863 -13.567 6.204 1.00 3.80 H new ATOM 0 HH22 ARG A 125 19.382 -14.457 6.055 1.00 3.80 H new ATOM 2125 N ILE A 126 17.360 -5.584 4.073 1.00 0.34 N ATOM 2126 CA ILE A 126 17.765 -4.467 3.228 1.00 0.33 C ATOM 2127 C ILE A 126 18.148 -3.265 4.087 1.00 0.31 C ATOM 2128 O ILE A 126 19.121 -2.567 3.794 1.00 0.31 O ATOM 2129 CB ILE A 126 16.642 -4.106 2.215 1.00 0.34 C ATOM 2130 CG1 ILE A 126 16.928 -4.753 0.859 1.00 0.39 C ATOM 2131 CG2 ILE A 126 16.476 -2.600 2.051 1.00 0.38 C ATOM 2132 CD1 ILE A 126 16.934 -6.263 0.895 1.00 0.46 C ATOM 0 H ILE A 126 16.375 -5.834 3.989 1.00 0.34 H new ATOM 0 HA ILE A 126 18.642 -4.764 2.653 1.00 0.33 H new ATOM 0 HB ILE A 126 15.706 -4.495 2.616 1.00 0.34 H new ATOM 0 HG12 ILE A 126 16.178 -4.419 0.142 1.00 0.39 H new ATOM 0 HG13 ILE A 126 17.895 -4.403 0.496 1.00 0.39 H new ATOM 0 HG21 ILE A 126 15.680 -2.398 1.334 1.00 0.38 H new ATOM 0 HG22 ILE A 126 16.220 -2.155 3.013 1.00 0.38 H new ATOM 0 HG23 ILE A 126 17.409 -2.168 1.689 1.00 0.38 H new ATOM 0 HD11 ILE A 126 17.144 -6.650 -0.102 1.00 0.46 H new ATOM 0 HD12 ILE A 126 17.703 -6.607 1.587 1.00 0.46 H new ATOM 0 HD13 ILE A 126 15.960 -6.623 1.227 1.00 0.46 H new ATOM 2144 N ARG A 127 17.402 -3.056 5.166 1.00 0.31 N ATOM 2145 CA ARG A 127 17.660 -1.958 6.077 1.00 0.33 C ATOM 2146 C ARG A 127 19.064 -2.084 6.660 1.00 0.33 C ATOM 2147 O ARG A 127 19.805 -1.102 6.745 1.00 0.34 O ATOM 2148 CB ARG A 127 16.601 -1.947 7.189 1.00 0.38 C ATOM 2149 CG ARG A 127 17.047 -1.263 8.472 1.00 1.09 C ATOM 2150 CD ARG A 127 17.006 0.255 8.359 1.00 1.30 C ATOM 2151 NE ARG A 127 15.664 0.789 8.599 1.00 1.79 N ATOM 2152 CZ ARG A 127 15.410 1.904 9.288 1.00 2.32 C ATOM 2153 NH1 ARG A 127 16.404 2.604 9.826 1.00 2.76 N ATOM 2154 NH2 ARG A 127 14.157 2.308 9.448 1.00 2.94 N ATOM 0 H ARG A 127 16.608 -3.640 5.429 1.00 0.31 H new ATOM 0 HA ARG A 127 17.600 -1.014 5.535 1.00 0.33 H new ATOM 0 HB2 ARG A 127 15.706 -1.448 6.817 1.00 0.38 H new ATOM 0 HB3 ARG A 127 16.321 -2.975 7.418 1.00 0.38 H new ATOM 0 HG2 ARG A 127 16.406 -1.582 9.294 1.00 1.09 H new ATOM 0 HG3 ARG A 127 18.061 -1.580 8.717 1.00 1.09 H new ATOM 0 HD2 ARG A 127 17.702 0.690 9.076 1.00 1.30 H new ATOM 0 HD3 ARG A 127 17.342 0.553 7.366 1.00 1.30 H new ATOM 0 HE ARG A 127 14.871 0.275 8.215 1.00 1.79 H new ATOM 0 HH11 ARG A 127 17.368 2.290 9.714 1.00 2.76 H new ATOM 0 HH12 ARG A 127 16.203 3.455 10.351 1.00 2.76 H new ATOM 0 HH21 ARG A 127 13.391 1.767 9.045 1.00 2.94 H new ATOM 0 HH22 ARG A 127 13.959 3.159 9.974 1.00 2.94 H new ATOM 2168 N ALA A 128 19.425 -3.304 7.034 1.00 0.35 N ATOM 2169 CA ALA A 128 20.738 -3.574 7.600 1.00 0.38 C ATOM 2170 C ALA A 128 21.832 -3.418 6.552 1.00 0.37 C ATOM 2171 O ALA A 128 22.893 -2.865 6.833 1.00 0.39 O ATOM 2172 CB ALA A 128 20.777 -4.970 8.201 1.00 0.42 C ATOM 0 H ALA A 128 18.824 -4.124 6.955 1.00 0.35 H new ATOM 0 HA ALA A 128 20.921 -2.845 8.389 1.00 0.38 H new ATOM 0 HB1 ALA A 128 21.765 -5.158 8.621 1.00 0.42 H new ATOM 0 HB2 ALA A 128 20.028 -5.048 8.989 1.00 0.42 H new ATOM 0 HB3 ALA A 128 20.566 -5.706 7.425 1.00 0.42 H new ATOM 2178 N ALA A 129 21.564 -3.891 5.341 1.00 0.36 N ATOM 2179 CA ALA A 129 22.529 -3.801 4.249 1.00 0.38 C ATOM 2180 C ALA A 129 22.870 -2.346 3.945 1.00 0.36 C ATOM 2181 O ALA A 129 24.049 -1.967 3.842 1.00 0.40 O ATOM 2182 CB ALA A 129 21.989 -4.497 3.011 1.00 0.40 C ATOM 0 H ALA A 129 20.685 -4.342 5.089 1.00 0.36 H new ATOM 0 HA ALA A 129 23.446 -4.303 4.557 1.00 0.38 H new ATOM 0 HB1 ALA A 129 22.718 -4.422 2.204 1.00 0.40 H new ATOM 0 HB2 ALA A 129 21.803 -5.547 3.236 1.00 0.40 H new ATOM 0 HB3 ALA A 129 21.058 -4.021 2.703 1.00 0.40 H new ATOM 2188 N LEU A 130 21.836 -1.522 3.802 1.00 0.33 N ATOM 2189 CA LEU A 130 22.036 -0.112 3.537 1.00 0.32 C ATOM 2190 C LEU A 130 22.770 0.529 4.711 1.00 0.33 C ATOM 2191 O LEU A 130 23.661 1.359 4.529 1.00 0.35 O ATOM 2192 CB LEU A 130 20.697 0.571 3.279 1.00 0.32 C ATOM 2193 CG LEU A 130 19.975 0.080 2.025 1.00 0.36 C ATOM 2194 CD1 LEU A 130 18.477 0.244 2.187 1.00 0.38 C ATOM 2195 CD2 LEU A 130 20.470 0.811 0.782 1.00 0.41 C ATOM 0 H LEU A 130 20.859 -1.809 3.866 1.00 0.33 H new ATOM 0 HA LEU A 130 22.647 0.008 2.642 1.00 0.32 H new ATOM 0 HB2 LEU A 130 20.050 0.415 4.142 1.00 0.32 H new ATOM 0 HB3 LEU A 130 20.860 1.645 3.194 1.00 0.32 H new ATOM 0 HG LEU A 130 20.198 -0.979 1.894 1.00 0.36 H new ATOM 0 HD11 LEU A 130 17.973 -0.109 1.287 1.00 0.38 H new ATOM 0 HD12 LEU A 130 18.138 -0.337 3.045 1.00 0.38 H new ATOM 0 HD13 LEU A 130 18.241 1.296 2.346 1.00 0.38 H new ATOM 0 HD21 LEU A 130 19.938 0.440 -0.094 1.00 0.41 H new ATOM 0 HD22 LEU A 130 20.288 1.880 0.892 1.00 0.41 H new ATOM 0 HD23 LEU A 130 21.539 0.636 0.658 1.00 0.41 H new ATOM 2207 N LYS A 131 22.424 0.098 5.916 1.00 0.33 N ATOM 2208 CA LYS A 131 23.063 0.606 7.122 1.00 0.37 C ATOM 2209 C LYS A 131 24.568 0.367 7.053 1.00 0.39 C ATOM 2210 O LYS A 131 25.365 1.201 7.485 1.00 0.43 O ATOM 2211 CB LYS A 131 22.488 -0.084 8.356 1.00 0.40 C ATOM 2212 CG LYS A 131 21.782 0.851 9.325 1.00 0.53 C ATOM 2213 CD LYS A 131 22.762 1.570 10.243 1.00 0.69 C ATOM 2214 CE LYS A 131 23.152 2.935 9.698 1.00 0.82 C ATOM 2215 NZ LYS A 131 23.869 3.752 10.713 1.00 1.09 N ATOM 0 H LYS A 131 21.703 -0.604 6.085 1.00 0.33 H new ATOM 0 HA LYS A 131 22.872 1.677 7.195 1.00 0.37 H new ATOM 0 HB2 LYS A 131 21.785 -0.852 8.034 1.00 0.40 H new ATOM 0 HB3 LYS A 131 23.296 -0.592 8.883 1.00 0.40 H new ATOM 0 HG2 LYS A 131 21.205 1.586 8.764 1.00 0.53 H new ATOM 0 HG3 LYS A 131 21.073 0.282 9.926 1.00 0.53 H new ATOM 0 HD2 LYS A 131 22.315 1.687 11.230 1.00 0.69 H new ATOM 0 HD3 LYS A 131 23.657 0.960 10.368 1.00 0.69 H new ATOM 0 HE2 LYS A 131 23.786 2.808 8.820 1.00 0.82 H new ATOM 0 HE3 LYS A 131 22.257 3.465 9.371 1.00 0.82 H new ATOM 0 HZ1 LYS A 131 24.118 4.675 10.303 1.00 1.09 H new ATOM 0 HZ2 LYS A 131 23.255 3.895 11.540 1.00 1.09 H new ATOM 0 HZ3 LYS A 131 24.736 3.258 11.006 1.00 1.09 H new ATOM 2229 N LYS A 132 24.945 -0.782 6.496 1.00 0.40 N ATOM 2230 CA LYS A 132 26.348 -1.136 6.347 1.00 0.45 C ATOM 2231 C LYS A 132 27.022 -0.229 5.325 1.00 0.44 C ATOM 2232 O LYS A 132 28.202 0.089 5.453 1.00 0.47 O ATOM 2233 CB LYS A 132 26.504 -2.602 5.926 1.00 0.49 C ATOM 2234 CG LYS A 132 25.863 -3.600 6.882 1.00 0.53 C ATOM 2235 CD LYS A 132 26.250 -3.337 8.331 1.00 0.59 C ATOM 2236 CE LYS A 132 27.727 -3.595 8.579 1.00 0.92 C ATOM 2237 NZ LYS A 132 28.147 -3.148 9.932 1.00 1.39 N ATOM 0 H LYS A 132 24.294 -1.483 6.141 1.00 0.40 H new ATOM 0 HA LYS A 132 26.831 -1.001 7.315 1.00 0.45 H new ATOM 0 HB2 LYS A 132 26.066 -2.732 4.936 1.00 0.49 H new ATOM 0 HB3 LYS A 132 27.566 -2.832 5.838 1.00 0.49 H new ATOM 0 HG2 LYS A 132 24.779 -3.551 6.783 1.00 0.53 H new ATOM 0 HG3 LYS A 132 26.163 -4.611 6.605 1.00 0.53 H new ATOM 0 HD2 LYS A 132 26.014 -2.304 8.588 1.00 0.59 H new ATOM 0 HD3 LYS A 132 25.655 -3.973 8.987 1.00 0.59 H new ATOM 0 HE2 LYS A 132 27.933 -4.659 8.468 1.00 0.92 H new ATOM 0 HE3 LYS A 132 28.318 -3.075 7.825 1.00 0.92 H new ATOM 0 HZ1 LYS A 132 29.161 -3.341 10.062 1.00 1.39 H new ATOM 0 HZ2 LYS A 132 27.974 -2.127 10.030 1.00 1.39 H new ATOM 0 HZ3 LYS A 132 27.601 -3.662 10.653 1.00 1.39 H new ATOM 2251 N LYS A 133 26.276 0.186 4.305 1.00 0.42 N ATOM 2252 CA LYS A 133 26.845 1.073 3.289 1.00 0.44 C ATOM 2253 C LYS A 133 26.626 2.542 3.662 1.00 0.42 C ATOM 2254 O LYS A 133 26.957 3.442 2.886 1.00 0.45 O ATOM 2255 CB LYS A 133 26.293 0.772 1.887 1.00 0.49 C ATOM 2256 CG LYS A 133 24.786 0.863 1.776 1.00 1.05 C ATOM 2257 CD LYS A 133 24.334 1.045 0.336 1.00 1.48 C ATOM 2258 CE LYS A 133 24.103 -0.290 -0.354 1.00 2.08 C ATOM 2259 NZ LYS A 133 23.906 -0.129 -1.821 1.00 2.52 N ATOM 0 H LYS A 133 25.299 -0.069 4.159 1.00 0.42 H new ATOM 0 HA LYS A 133 27.918 0.883 3.259 1.00 0.44 H new ATOM 0 HB2 LYS A 133 26.740 1.467 1.177 1.00 0.49 H new ATOM 0 HB3 LYS A 133 26.607 -0.230 1.593 1.00 0.49 H new ATOM 0 HG2 LYS A 133 24.336 -0.041 2.186 1.00 1.05 H new ATOM 0 HG3 LYS A 133 24.427 1.698 2.377 1.00 1.05 H new ATOM 0 HD2 LYS A 133 23.414 1.630 0.314 1.00 1.48 H new ATOM 0 HD3 LYS A 133 25.086 1.613 -0.212 1.00 1.48 H new ATOM 0 HE2 LYS A 133 24.955 -0.945 -0.172 1.00 2.08 H new ATOM 0 HE3 LYS A 133 23.229 -0.776 0.079 1.00 2.08 H new ATOM 0 HZ1 LYS A 133 24.369 -0.914 -2.322 1.00 2.52 H new ATOM 0 HZ2 LYS A 133 22.889 -0.133 -2.037 1.00 2.52 H new ATOM 0 HZ3 LYS A 133 24.322 0.772 -2.130 1.00 2.52 H new ATOM 2273 N ASN A 134 26.062 2.759 4.853 1.00 0.41 N ATOM 2274 CA ASN A 134 25.817 4.103 5.401 1.00 0.42 C ATOM 2275 C ASN A 134 24.660 4.793 4.684 1.00 0.40 C ATOM 2276 O ASN A 134 24.663 6.007 4.461 1.00 0.44 O ATOM 2277 CB ASN A 134 27.088 4.966 5.334 1.00 0.48 C ATOM 2278 CG ASN A 134 27.239 5.892 6.528 1.00 0.78 C ATOM 2279 OD1 ASN A 134 26.260 6.305 7.150 1.00 1.08 O ATOM 2280 ND2 ASN A 134 28.477 6.230 6.852 1.00 1.06 N ATOM 0 H ASN A 134 25.760 2.006 5.470 1.00 0.41 H new ATOM 0 HA ASN A 134 25.539 3.984 6.448 1.00 0.42 H new ATOM 0 HB2 ASN A 134 27.960 4.315 5.273 1.00 0.48 H new ATOM 0 HB3 ASN A 134 27.070 5.560 4.420 1.00 0.48 H new ATOM 0 HD21 ASN A 134 28.645 6.853 7.642 1.00 1.06 H new ATOM 0 HD22 ASN A 134 29.263 5.867 6.312 1.00 1.06 H new ATOM 2287 N TYR A 135 23.664 3.998 4.343 1.00 0.36 N ATOM 2288 CA TYR A 135 22.465 4.481 3.686 1.00 0.35 C ATOM 2289 C TYR A 135 21.262 4.074 4.526 1.00 0.34 C ATOM 2290 O TYR A 135 21.339 3.123 5.302 1.00 0.35 O ATOM 2291 CB TYR A 135 22.341 3.879 2.289 1.00 0.37 C ATOM 2292 CG TYR A 135 22.322 4.888 1.162 1.00 0.55 C ATOM 2293 CD1 TYR A 135 21.264 5.778 1.011 1.00 1.44 C ATOM 2294 CD2 TYR A 135 23.354 4.933 0.233 1.00 1.30 C ATOM 2295 CE1 TYR A 135 21.241 6.685 -0.031 1.00 1.66 C ATOM 2296 CE2 TYR A 135 23.339 5.839 -0.808 1.00 1.46 C ATOM 2297 CZ TYR A 135 22.279 6.711 -0.937 1.00 1.17 C ATOM 2298 OH TYR A 135 22.258 7.609 -1.980 1.00 1.51 O ATOM 0 H TYR A 135 23.664 2.993 4.515 1.00 0.36 H new ATOM 0 HA TYR A 135 22.513 5.566 3.588 1.00 0.35 H new ATOM 0 HB2 TYR A 135 23.173 3.193 2.129 1.00 0.37 H new ATOM 0 HB3 TYR A 135 21.427 3.287 2.244 1.00 0.37 H new ATOM 0 HD1 TYR A 135 20.448 5.760 1.719 1.00 1.44 H new ATOM 0 HD2 TYR A 135 24.183 4.247 0.327 1.00 1.30 H new ATOM 0 HE1 TYR A 135 20.413 7.371 -0.135 1.00 1.66 H new ATOM 0 HE2 TYR A 135 24.153 5.865 -1.517 1.00 1.46 H new ATOM 0 HH TYR A 135 23.065 7.496 -2.525 1.00 1.51 H new ATOM 2308 N LYS A 136 20.164 4.788 4.397 1.00 0.34 N ATOM 2309 CA LYS A 136 18.974 4.457 5.147 1.00 0.35 C ATOM 2310 C LYS A 136 17.741 4.648 4.282 1.00 0.34 C ATOM 2311 O LYS A 136 17.554 5.697 3.676 1.00 0.36 O ATOM 2312 CB LYS A 136 18.882 5.319 6.408 1.00 0.39 C ATOM 2313 CG LYS A 136 17.586 5.133 7.177 1.00 1.36 C ATOM 2314 CD LYS A 136 17.174 6.398 7.914 1.00 1.43 C ATOM 2315 CE LYS A 136 18.199 6.803 8.962 1.00 1.18 C ATOM 2316 NZ LYS A 136 17.686 7.880 9.849 1.00 1.36 N ATOM 0 H LYS A 136 20.072 5.597 3.783 1.00 0.34 H new ATOM 0 HA LYS A 136 19.030 3.411 5.449 1.00 0.35 H new ATOM 0 HB2 LYS A 136 19.721 5.082 7.063 1.00 0.39 H new ATOM 0 HB3 LYS A 136 18.982 6.368 6.129 1.00 0.39 H new ATOM 0 HG2 LYS A 136 16.794 4.841 6.487 1.00 1.36 H new ATOM 0 HG3 LYS A 136 17.702 4.319 7.892 1.00 1.36 H new ATOM 0 HD2 LYS A 136 17.046 7.210 7.198 1.00 1.43 H new ATOM 0 HD3 LYS A 136 16.208 6.241 8.393 1.00 1.43 H new ATOM 0 HE2 LYS A 136 18.467 5.934 9.563 1.00 1.18 H new ATOM 0 HE3 LYS A 136 19.110 7.142 8.468 1.00 1.18 H new ATOM 0 HZ1 LYS A 136 18.413 8.128 10.550 1.00 1.36 H new ATOM 0 HZ2 LYS A 136 17.454 8.718 9.279 1.00 1.36 H new ATOM 0 HZ3 LYS A 136 16.831 7.548 10.340 1.00 1.36 H new ATOM 2330 N LEU A 137 16.922 3.620 4.201 1.00 0.34 N ATOM 2331 CA LEU A 137 15.704 3.683 3.423 1.00 0.36 C ATOM 2332 C LEU A 137 14.549 4.073 4.334 1.00 0.35 C ATOM 2333 O LEU A 137 14.504 3.668 5.496 1.00 0.36 O ATOM 2334 CB LEU A 137 15.442 2.328 2.750 1.00 0.43 C ATOM 2335 CG LEU A 137 14.027 2.111 2.203 1.00 0.40 C ATOM 2336 CD1 LEU A 137 13.880 2.723 0.820 1.00 0.66 C ATOM 2337 CD2 LEU A 137 13.697 0.626 2.170 1.00 0.64 C ATOM 0 H LEU A 137 17.080 2.727 4.667 1.00 0.34 H new ATOM 0 HA LEU A 137 15.802 4.435 2.640 1.00 0.36 H new ATOM 0 HB2 LEU A 137 16.149 2.210 1.929 1.00 0.43 H new ATOM 0 HB3 LEU A 137 15.656 1.539 3.471 1.00 0.43 H new ATOM 0 HG LEU A 137 13.322 2.610 2.868 1.00 0.40 H new ATOM 0 HD11 LEU A 137 12.867 2.556 0.454 1.00 0.66 H new ATOM 0 HD12 LEU A 137 14.074 3.794 0.874 1.00 0.66 H new ATOM 0 HD13 LEU A 137 14.593 2.259 0.139 1.00 0.66 H new ATOM 0 HD21 LEU A 137 12.689 0.486 1.779 1.00 0.64 H new ATOM 0 HD22 LEU A 137 14.410 0.109 1.528 1.00 0.64 H new ATOM 0 HD23 LEU A 137 13.755 0.218 3.179 1.00 0.64 H new ATOM 2349 N ASN A 138 13.627 4.859 3.812 1.00 0.35 N ATOM 2350 CA ASN A 138 12.476 5.303 4.579 1.00 0.37 C ATOM 2351 C ASN A 138 11.286 5.425 3.646 1.00 0.40 C ATOM 2352 O ASN A 138 11.462 5.567 2.441 1.00 0.40 O ATOM 2353 CB ASN A 138 12.747 6.638 5.283 1.00 0.40 C ATOM 2354 CG ASN A 138 12.812 6.503 6.798 1.00 0.52 C ATOM 2355 OD1 ASN A 138 12.308 7.352 7.532 1.00 0.68 O ATOM 2356 ND2 ASN A 138 13.447 5.448 7.276 1.00 0.81 N ATOM 0 H ASN A 138 13.652 5.206 2.853 1.00 0.35 H new ATOM 0 HA ASN A 138 12.266 4.569 5.357 1.00 0.37 H new ATOM 0 HB2 ASN A 138 13.688 7.051 4.919 1.00 0.40 H new ATOM 0 HB3 ASN A 138 11.963 7.348 5.019 1.00 0.40 H new ATOM 0 HD21 ASN A 138 13.532 5.317 8.284 1.00 0.81 H new ATOM 0 HD22 ASN A 138 13.853 4.764 6.637 1.00 0.81 H new ATOM 2363 N GLN A 139 10.088 5.404 4.205 1.00 0.45 N ATOM 2364 CA GLN A 139 8.854 5.481 3.419 1.00 0.53 C ATOM 2365 C GLN A 139 8.628 6.879 2.824 1.00 0.60 C ATOM 2366 O GLN A 139 7.525 7.202 2.396 1.00 0.92 O ATOM 2367 CB GLN A 139 7.672 5.082 4.307 1.00 0.63 C ATOM 2368 CG GLN A 139 7.739 3.629 4.762 1.00 1.09 C ATOM 2369 CD GLN A 139 6.971 3.363 6.043 1.00 1.95 C ATOM 2370 OE1 GLN A 139 6.770 4.260 6.866 1.00 2.36 O ATOM 2371 NE2 GLN A 139 6.557 2.119 6.234 1.00 2.87 N ATOM 0 H GLN A 139 9.936 5.334 5.211 1.00 0.45 H new ATOM 0 HA GLN A 139 8.942 4.793 2.578 1.00 0.53 H new ATOM 0 HB2 GLN A 139 7.646 5.731 5.182 1.00 0.63 H new ATOM 0 HB3 GLN A 139 6.742 5.245 3.761 1.00 0.63 H new ATOM 0 HG2 GLN A 139 7.345 2.990 3.972 1.00 1.09 H new ATOM 0 HG3 GLN A 139 8.782 3.349 4.908 1.00 1.09 H new ATOM 0 HE21 GLN A 139 6.743 1.406 5.529 1.00 2.87 H new ATOM 0 HE22 GLN A 139 6.052 1.875 7.086 1.00 2.87 H new ATOM 2380 N TYR A 140 9.667 7.711 2.845 1.00 0.47 N ATOM 2381 CA TYR A 140 9.590 9.062 2.293 1.00 0.53 C ATOM 2382 C TYR A 140 10.760 9.326 1.346 1.00 0.49 C ATOM 2383 O TYR A 140 10.767 10.320 0.616 1.00 0.54 O ATOM 2384 CB TYR A 140 9.582 10.106 3.414 1.00 0.60 C ATOM 2385 CG TYR A 140 8.975 9.596 4.699 1.00 0.63 C ATOM 2386 CD1 TYR A 140 7.614 9.710 4.946 1.00 1.37 C ATOM 2387 CD2 TYR A 140 9.765 8.975 5.651 1.00 1.33 C ATOM 2388 CE1 TYR A 140 7.059 9.217 6.112 1.00 1.42 C ATOM 2389 CE2 TYR A 140 9.224 8.483 6.818 1.00 1.38 C ATOM 2390 CZ TYR A 140 7.867 8.602 7.046 1.00 0.80 C ATOM 2391 OH TYR A 140 7.317 8.106 8.207 1.00 0.92 O ATOM 0 H TYR A 140 10.576 7.472 3.240 1.00 0.47 H new ATOM 0 HA TYR A 140 8.659 9.142 1.732 1.00 0.53 H new ATOM 0 HB2 TYR A 140 10.605 10.430 3.607 1.00 0.60 H new ATOM 0 HB3 TYR A 140 9.027 10.983 3.081 1.00 0.60 H new ATOM 0 HD1 TYR A 140 6.979 10.191 4.216 1.00 1.37 H new ATOM 0 HD2 TYR A 140 10.826 8.874 5.475 1.00 1.33 H new ATOM 0 HE1 TYR A 140 5.998 9.313 6.291 1.00 1.42 H new ATOM 0 HE2 TYR A 140 9.858 8.006 7.551 1.00 1.38 H new ATOM 0 HH TYR A 140 8.021 7.703 8.757 1.00 0.92 H new ATOM 2401 N GLY A 141 11.772 8.460 1.397 1.00 0.43 N ATOM 2402 CA GLY A 141 12.923 8.627 0.530 1.00 0.42 C ATOM 2403 C GLY A 141 14.150 7.894 1.041 1.00 0.38 C ATOM 2404 O GLY A 141 14.040 6.982 1.868 1.00 0.37 O ATOM 0 H GLY A 141 11.813 7.653 2.019 1.00 0.43 H new ATOM 0 HA2 GLY A 141 12.677 8.264 -0.468 1.00 0.42 H new ATOM 0 HA3 GLY A 141 13.151 9.689 0.436 1.00 0.42 H new ATOM 2408 N LEU A 142 15.319 8.290 0.549 1.00 0.38 N ATOM 2409 CA LEU A 142 16.576 7.680 0.966 1.00 0.37 C ATOM 2410 C LEU A 142 17.336 8.639 1.862 1.00 0.38 C ATOM 2411 O LEU A 142 17.167 9.845 1.767 1.00 0.54 O ATOM 2412 CB LEU A 142 17.456 7.340 -0.239 1.00 0.40 C ATOM 2413 CG LEU A 142 17.072 6.092 -1.024 1.00 0.47 C ATOM 2414 CD1 LEU A 142 18.247 5.620 -1.861 1.00 0.85 C ATOM 2415 CD2 LEU A 142 16.594 4.981 -0.098 1.00 0.50 C ATOM 0 H LEU A 142 15.422 9.034 -0.142 1.00 0.38 H new ATOM 0 HA LEU A 142 16.339 6.761 1.501 1.00 0.37 H new ATOM 0 HB2 LEU A 142 17.445 8.190 -0.921 1.00 0.40 H new ATOM 0 HB3 LEU A 142 18.482 7.223 0.109 1.00 0.40 H new ATOM 0 HG LEU A 142 16.246 6.349 -1.687 1.00 0.47 H new ATOM 0 HD11 LEU A 142 17.962 4.728 -2.418 1.00 0.85 H new ATOM 0 HD12 LEU A 142 18.536 6.406 -2.559 1.00 0.85 H new ATOM 0 HD13 LEU A 142 19.088 5.387 -1.208 1.00 0.85 H new ATOM 0 HD21 LEU A 142 16.328 4.104 -0.689 1.00 0.50 H new ATOM 0 HD22 LEU A 142 17.390 4.720 0.599 1.00 0.50 H new ATOM 0 HD23 LEU A 142 15.721 5.322 0.459 1.00 0.50 H new ATOM 2427 N PHE A 143 18.151 8.103 2.742 1.00 0.37 N ATOM 2428 CA PHE A 143 18.948 8.922 3.635 1.00 0.39 C ATOM 2429 C PHE A 143 20.403 8.503 3.583 1.00 0.40 C ATOM 2430 O PHE A 143 20.776 7.482 4.159 1.00 0.40 O ATOM 2431 CB PHE A 143 18.445 8.801 5.072 1.00 0.41 C ATOM 2432 CG PHE A 143 17.320 9.729 5.410 1.00 0.44 C ATOM 2433 CD1 PHE A 143 17.560 11.073 5.628 1.00 1.30 C ATOM 2434 CD2 PHE A 143 16.026 9.253 5.521 1.00 1.26 C ATOM 2435 CE1 PHE A 143 16.527 11.930 5.950 1.00 1.34 C ATOM 2436 CE2 PHE A 143 14.989 10.104 5.840 1.00 1.28 C ATOM 2437 CZ PHE A 143 15.238 11.444 6.057 1.00 0.58 C ATOM 0 H PHE A 143 18.282 7.098 2.861 1.00 0.37 H new ATOM 0 HA PHE A 143 18.856 9.958 3.308 1.00 0.39 H new ATOM 0 HB2 PHE A 143 18.119 7.775 5.246 1.00 0.41 H new ATOM 0 HB3 PHE A 143 19.275 8.992 5.753 1.00 0.41 H new ATOM 0 HD1 PHE A 143 18.566 11.456 5.545 1.00 1.30 H new ATOM 0 HD2 PHE A 143 15.826 8.205 5.356 1.00 1.26 H new ATOM 0 HE1 PHE A 143 16.726 12.978 6.118 1.00 1.34 H new ATOM 0 HE2 PHE A 143 13.982 9.722 5.920 1.00 1.28 H new ATOM 0 HZ PHE A 143 14.427 12.111 6.310 1.00 0.58 H new ATOM 2447 N LYS A 144 21.223 9.262 2.874 1.00 0.42 N ATOM 2448 CA LYS A 144 22.636 8.948 2.806 1.00 0.45 C ATOM 2449 C LYS A 144 23.309 9.560 4.020 1.00 0.56 C ATOM 2450 O LYS A 144 23.562 10.765 4.049 1.00 0.64 O ATOM 2451 CB LYS A 144 23.244 9.502 1.513 1.00 0.55 C ATOM 2452 CG LYS A 144 24.501 8.770 1.060 1.00 0.80 C ATOM 2453 CD LYS A 144 25.747 9.268 1.775 1.00 0.97 C ATOM 2454 CE LYS A 144 25.968 10.750 1.532 1.00 1.96 C ATOM 2455 NZ LYS A 144 27.413 11.098 1.465 1.00 2.30 N ATOM 0 H LYS A 144 20.938 10.087 2.346 1.00 0.42 H new ATOM 0 HA LYS A 144 22.784 7.868 2.802 1.00 0.45 H new ATOM 0 HB2 LYS A 144 22.498 9.448 0.720 1.00 0.55 H new ATOM 0 HB3 LYS A 144 23.481 10.556 1.657 1.00 0.55 H new ATOM 0 HG2 LYS A 144 24.383 7.702 1.242 1.00 0.80 H new ATOM 0 HG3 LYS A 144 24.626 8.898 -0.015 1.00 0.80 H new ATOM 0 HD2 LYS A 144 25.653 9.083 2.845 1.00 0.97 H new ATOM 0 HD3 LYS A 144 26.616 8.707 1.430 1.00 0.97 H new ATOM 0 HE2 LYS A 144 25.482 11.040 0.600 1.00 1.96 H new ATOM 0 HE3 LYS A 144 25.495 11.322 2.330 1.00 1.96 H new ATOM 0 HZ1 LYS A 144 27.517 12.119 1.298 1.00 2.30 H new ATOM 0 HZ2 LYS A 144 27.873 10.846 2.363 1.00 2.30 H new ATOM 0 HZ3 LYS A 144 27.861 10.573 0.687 1.00 2.30 H new ATOM 2469 N ASN A 145 23.615 8.704 4.993 1.00 0.62 N ATOM 2470 CA ASN A 145 24.241 9.090 6.261 1.00 0.81 C ATOM 2471 C ASN A 145 23.356 10.045 7.075 1.00 0.99 C ATOM 2472 O ASN A 145 23.027 9.760 8.229 1.00 1.97 O ATOM 2473 CB ASN A 145 25.628 9.699 6.034 1.00 0.92 C ATOM 2474 CG ASN A 145 26.339 9.983 7.339 1.00 1.20 C ATOM 2475 OD1 ASN A 145 26.387 11.123 7.799 1.00 1.57 O ATOM 2476 ND2 ASN A 145 26.875 8.942 7.957 1.00 1.70 N ATOM 0 H ASN A 145 23.432 7.703 4.923 1.00 0.62 H new ATOM 0 HA ASN A 145 24.359 8.177 6.844 1.00 0.81 H new ATOM 0 HB2 ASN A 145 26.230 9.017 5.433 1.00 0.92 H new ATOM 0 HB3 ASN A 145 25.530 10.624 5.465 1.00 0.92 H new ATOM 0 HD21 ASN A 145 27.351 9.069 8.850 1.00 1.70 H new ATOM 0 HD22 ASN A 145 26.812 8.013 7.540 1.00 1.70 H new ATOM 2483 N GLN A 146 22.980 11.169 6.478 1.00 0.56 N ATOM 2484 CA GLN A 146 22.141 12.165 7.134 1.00 0.58 C ATOM 2485 C GLN A 146 21.424 13.047 6.111 1.00 0.55 C ATOM 2486 O GLN A 146 20.600 13.886 6.478 1.00 0.60 O ATOM 2487 CB GLN A 146 22.994 13.046 8.054 1.00 0.66 C ATOM 2488 CG GLN A 146 24.206 13.653 7.358 1.00 1.54 C ATOM 2489 CD GLN A 146 24.093 15.153 7.145 1.00 2.42 C ATOM 2490 OE1 GLN A 146 25.094 15.866 7.168 1.00 2.97 O ATOM 2491 NE2 GLN A 146 22.883 15.644 6.920 1.00 3.02 N ATOM 0 H GLN A 146 23.248 11.416 5.525 1.00 0.56 H new ATOM 0 HA GLN A 146 21.391 11.635 7.721 1.00 0.58 H new ATOM 0 HB2 GLN A 146 22.374 13.849 8.453 1.00 0.66 H new ATOM 0 HB3 GLN A 146 23.332 12.452 8.903 1.00 0.66 H new ATOM 0 HG2 GLN A 146 25.097 13.444 7.949 1.00 1.54 H new ATOM 0 HG3 GLN A 146 24.343 13.166 6.392 1.00 1.54 H new ATOM 0 HE21 GLN A 146 22.074 15.022 6.908 1.00 3.02 H new ATOM 0 HE22 GLN A 146 22.760 16.644 6.759 1.00 3.02 H new ATOM 2500 N THR A 147 21.740 12.869 4.835 1.00 0.51 N ATOM 2501 CA THR A 147 21.139 13.679 3.782 1.00 0.52 C ATOM 2502 C THR A 147 20.020 12.931 3.061 1.00 0.47 C ATOM 2503 O THR A 147 20.225 11.815 2.581 1.00 0.46 O ATOM 2504 CB THR A 147 22.203 14.103 2.753 1.00 0.56 C ATOM 2505 OG1 THR A 147 23.350 14.644 3.428 1.00 0.64 O ATOM 2506 CG2 THR A 147 21.643 15.130 1.779 1.00 0.62 C ATOM 0 H THR A 147 22.408 12.173 4.504 1.00 0.51 H new ATOM 0 HA THR A 147 20.715 14.561 4.261 1.00 0.52 H new ATOM 0 HB THR A 147 22.499 13.220 2.186 1.00 0.56 H new ATOM 0 HG1 THR A 147 24.023 14.910 2.767 1.00 0.64 H new ATOM 0 HG21 THR A 147 22.415 15.412 1.063 1.00 0.62 H new ATOM 0 HG22 THR A 147 20.794 14.701 1.246 1.00 0.62 H new ATOM 0 HG23 THR A 147 21.318 16.013 2.329 1.00 0.62 H new ATOM 2514 N LEU A 148 18.838 13.540 3.005 1.00 0.47 N ATOM 2515 CA LEU A 148 17.707 12.933 2.318 1.00 0.44 C ATOM 2516 C LEU A 148 17.925 12.970 0.812 1.00 0.44 C ATOM 2517 O LEU A 148 18.360 13.979 0.255 1.00 0.50 O ATOM 2518 CB LEU A 148 16.393 13.636 2.663 1.00 0.47 C ATOM 2519 CG LEU A 148 15.166 13.105 1.921 1.00 0.49 C ATOM 2520 CD1 LEU A 148 14.767 11.747 2.457 1.00 0.58 C ATOM 2521 CD2 LEU A 148 14.007 14.076 2.034 1.00 0.78 C ATOM 0 H LEU A 148 18.642 14.448 3.425 1.00 0.47 H new ATOM 0 HA LEU A 148 17.637 11.898 2.653 1.00 0.44 H new ATOM 0 HB2 LEU A 148 16.219 13.544 3.735 1.00 0.47 H new ATOM 0 HB3 LEU A 148 16.499 14.699 2.447 1.00 0.47 H new ATOM 0 HG LEU A 148 15.426 13.001 0.868 1.00 0.49 H new ATOM 0 HD11 LEU A 148 13.892 11.385 1.917 1.00 0.58 H new ATOM 0 HD12 LEU A 148 15.591 11.046 2.323 1.00 0.58 H new ATOM 0 HD13 LEU A 148 14.530 11.830 3.518 1.00 0.58 H new ATOM 0 HD21 LEU A 148 13.145 13.678 1.499 1.00 0.78 H new ATOM 0 HD22 LEU A 148 13.750 14.215 3.084 1.00 0.78 H new ATOM 0 HD23 LEU A 148 14.292 15.035 1.601 1.00 0.78 H new ATOM 2533 N VAL A 149 17.627 11.858 0.174 1.00 0.40 N ATOM 2534 CA VAL A 149 17.775 11.712 -1.261 1.00 0.41 C ATOM 2535 C VAL A 149 16.472 11.184 -1.870 1.00 0.39 C ATOM 2536 O VAL A 149 15.976 10.128 -1.466 1.00 0.43 O ATOM 2537 CB VAL A 149 18.929 10.742 -1.605 1.00 0.44 C ATOM 2538 CG1 VAL A 149 19.144 10.664 -3.110 1.00 0.52 C ATOM 2539 CG2 VAL A 149 20.213 11.158 -0.899 1.00 0.48 C ATOM 0 H VAL A 149 17.272 11.022 0.639 1.00 0.40 H new ATOM 0 HA VAL A 149 18.007 12.692 -1.677 1.00 0.41 H new ATOM 0 HB VAL A 149 18.651 9.749 -1.251 1.00 0.44 H new ATOM 0 HG11 VAL A 149 19.961 9.975 -3.326 1.00 0.52 H new ATOM 0 HG12 VAL A 149 18.233 10.307 -3.590 1.00 0.52 H new ATOM 0 HG13 VAL A 149 19.393 11.653 -3.494 1.00 0.52 H new ATOM 0 HG21 VAL A 149 21.011 10.462 -1.155 1.00 0.48 H new ATOM 0 HG22 VAL A 149 20.493 12.163 -1.215 1.00 0.48 H new ATOM 0 HG23 VAL A 149 20.055 11.148 0.179 1.00 0.48 H new ATOM 2549 N PRO A 150 15.884 11.926 -2.824 1.00 0.40 N ATOM 2550 CA PRO A 150 14.644 11.517 -3.488 1.00 0.42 C ATOM 2551 C PRO A 150 14.855 10.333 -4.428 1.00 0.35 C ATOM 2552 O PRO A 150 15.927 10.171 -5.012 1.00 0.42 O ATOM 2553 CB PRO A 150 14.224 12.756 -4.295 1.00 0.53 C ATOM 2554 CG PRO A 150 15.119 13.866 -3.855 1.00 0.68 C ATOM 2555 CD PRO A 150 16.366 13.223 -3.321 1.00 0.48 C ATOM 0 HA PRO A 150 13.896 11.191 -2.765 1.00 0.42 H new ATOM 0 HB2 PRO A 150 14.326 12.576 -5.365 1.00 0.53 H new ATOM 0 HB3 PRO A 150 13.178 13.004 -4.111 1.00 0.53 H new ATOM 0 HG2 PRO A 150 15.351 14.530 -4.688 1.00 0.68 H new ATOM 0 HG3 PRO A 150 14.637 14.472 -3.088 1.00 0.68 H new ATOM 0 HD2 PRO A 150 17.122 13.102 -4.097 1.00 0.48 H new ATOM 0 HD3 PRO A 150 16.818 13.817 -2.526 1.00 0.48 H new ATOM 2563 N LEU A 151 13.833 9.505 -4.556 1.00 0.43 N ATOM 2564 CA LEU A 151 13.878 8.339 -5.421 1.00 0.40 C ATOM 2565 C LEU A 151 13.607 8.732 -6.876 1.00 0.39 C ATOM 2566 O LEU A 151 12.793 9.613 -7.156 1.00 0.56 O ATOM 2567 CB LEU A 151 12.879 7.277 -4.927 1.00 0.62 C ATOM 2568 CG LEU A 151 11.376 7.547 -5.138 1.00 0.87 C ATOM 2569 CD1 LEU A 151 10.565 6.555 -4.342 1.00 1.11 C ATOM 2570 CD2 LEU A 151 10.977 8.961 -4.739 1.00 1.31 C ATOM 0 H LEU A 151 12.948 9.622 -4.063 1.00 0.43 H new ATOM 0 HA LEU A 151 14.878 7.908 -5.382 1.00 0.40 H new ATOM 0 HB2 LEU A 151 13.122 6.335 -5.419 1.00 0.62 H new ATOM 0 HB3 LEU A 151 13.046 7.132 -3.860 1.00 0.62 H new ATOM 0 HG LEU A 151 11.174 7.437 -6.204 1.00 0.87 H new ATOM 0 HD11 LEU A 151 9.503 6.749 -4.493 1.00 1.11 H new ATOM 0 HD12 LEU A 151 10.800 5.544 -4.673 1.00 1.11 H new ATOM 0 HD13 LEU A 151 10.805 6.655 -3.283 1.00 1.11 H new ATOM 0 HD21 LEU A 151 9.909 9.099 -4.907 1.00 1.31 H new ATOM 0 HD22 LEU A 151 11.201 9.118 -3.684 1.00 1.31 H new ATOM 0 HD23 LEU A 151 11.535 9.680 -5.340 1.00 1.31 H new ATOM 2582 N LYS A 152 14.309 8.089 -7.798 1.00 0.40 N ATOM 2583 CA LYS A 152 14.150 8.386 -9.218 1.00 0.53 C ATOM 2584 C LYS A 152 13.633 7.181 -9.986 1.00 0.50 C ATOM 2585 O LYS A 152 13.973 6.985 -11.153 1.00 0.58 O ATOM 2586 CB LYS A 152 15.478 8.830 -9.820 1.00 0.72 C ATOM 2587 CG LYS A 152 16.155 9.954 -9.058 1.00 0.84 C ATOM 2588 CD LYS A 152 17.547 9.546 -8.620 1.00 1.45 C ATOM 2589 CE LYS A 152 17.545 8.949 -7.223 1.00 1.66 C ATOM 2590 NZ LYS A 152 18.892 8.474 -6.818 1.00 2.55 N ATOM 0 H LYS A 152 14.992 7.360 -7.591 1.00 0.40 H new ATOM 0 HA LYS A 152 13.420 9.191 -9.301 1.00 0.53 H new ATOM 0 HB2 LYS A 152 16.152 7.974 -9.859 1.00 0.72 H new ATOM 0 HB3 LYS A 152 15.310 9.151 -10.848 1.00 0.72 H new ATOM 0 HG2 LYS A 152 16.213 10.842 -9.687 1.00 0.84 H new ATOM 0 HG3 LYS A 152 15.558 10.219 -8.186 1.00 0.84 H new ATOM 0 HD2 LYS A 152 17.952 8.820 -9.325 1.00 1.45 H new ATOM 0 HD3 LYS A 152 18.205 10.415 -8.643 1.00 1.45 H new ATOM 0 HE2 LYS A 152 17.195 9.696 -6.510 1.00 1.66 H new ATOM 0 HE3 LYS A 152 16.841 8.118 -7.185 1.00 1.66 H new ATOM 0 HZ1 LYS A 152 18.876 8.200 -5.815 1.00 2.55 H new ATOM 0 HZ2 LYS A 152 19.159 7.653 -7.397 1.00 2.55 H new ATOM 0 HZ3 LYS A 152 19.585 9.236 -6.958 1.00 2.55 H new ATOM 2604 N ILE A 153 12.796 6.394 -9.342 1.00 0.43 N ATOM 2605 CA ILE A 153 12.251 5.197 -9.970 1.00 0.43 C ATOM 2606 C ILE A 153 10.760 5.075 -9.732 1.00 0.45 C ATOM 2607 O ILE A 153 10.207 5.741 -8.857 1.00 0.48 O ATOM 2608 CB ILE A 153 12.920 3.906 -9.455 1.00 0.39 C ATOM 2609 CG1 ILE A 153 12.751 3.771 -7.934 1.00 0.38 C ATOM 2610 CG2 ILE A 153 14.389 3.866 -9.856 1.00 0.42 C ATOM 2611 CD1 ILE A 153 13.901 4.330 -7.130 1.00 0.40 C ATOM 0 H ILE A 153 12.476 6.556 -8.387 1.00 0.43 H new ATOM 0 HA ILE A 153 12.455 5.308 -11.035 1.00 0.43 H new ATOM 0 HB ILE A 153 12.424 3.053 -9.919 1.00 0.39 H new ATOM 0 HG12 ILE A 153 11.834 4.278 -7.635 1.00 0.38 H new ATOM 0 HG13 ILE A 153 12.628 2.717 -7.686 1.00 0.38 H new ATOM 0 HG21 ILE A 153 14.843 2.948 -9.483 1.00 0.42 H new ATOM 0 HG22 ILE A 153 14.471 3.896 -10.943 1.00 0.42 H new ATOM 0 HG23 ILE A 153 14.906 4.725 -9.429 1.00 0.42 H new ATOM 0 HD11 ILE A 153 13.702 4.194 -6.067 1.00 0.40 H new ATOM 0 HD12 ILE A 153 14.819 3.807 -7.397 1.00 0.40 H new ATOM 0 HD13 ILE A 153 14.013 5.393 -7.345 1.00 0.40 H new ATOM 2623 N THR A 154 10.121 4.217 -10.511 1.00 0.47 N ATOM 2624 CA THR A 154 8.690 3.990 -10.371 1.00 0.52 C ATOM 2625 C THR A 154 8.359 2.493 -10.435 1.00 0.53 C ATOM 2626 O THR A 154 7.234 2.079 -10.152 1.00 0.74 O ATOM 2627 CB THR A 154 7.890 4.770 -11.445 1.00 0.61 C ATOM 2628 OG1 THR A 154 6.508 4.858 -11.074 1.00 0.70 O ATOM 2629 CG2 THR A 154 8.008 4.116 -12.814 1.00 0.71 C ATOM 0 H THR A 154 10.568 3.667 -11.245 1.00 0.47 H new ATOM 0 HA THR A 154 8.394 4.363 -9.391 1.00 0.52 H new ATOM 0 HB THR A 154 8.315 5.772 -11.505 1.00 0.61 H new ATOM 0 HG1 THR A 154 6.225 4.014 -10.665 1.00 0.70 H new ATOM 0 HG21 THR A 154 7.435 4.690 -13.542 1.00 0.71 H new ATOM 0 HG22 THR A 154 9.055 4.090 -13.116 1.00 0.71 H new ATOM 0 HG23 THR A 154 7.619 3.099 -12.766 1.00 0.71 H new ATOM 2637 N THR A 155 9.346 1.677 -10.795 1.00 0.45 N ATOM 2638 CA THR A 155 9.142 0.238 -10.890 1.00 0.46 C ATOM 2639 C THR A 155 9.973 -0.497 -9.840 1.00 0.42 C ATOM 2640 O THR A 155 11.050 -0.033 -9.468 1.00 0.40 O ATOM 2641 CB THR A 155 9.502 -0.256 -12.302 1.00 0.51 C ATOM 2642 OG1 THR A 155 9.169 0.758 -13.263 1.00 0.62 O ATOM 2643 CG2 THR A 155 8.757 -1.538 -12.637 1.00 0.56 C ATOM 0 H THR A 155 10.290 1.988 -11.024 1.00 0.45 H new ATOM 0 HA THR A 155 8.090 0.025 -10.701 1.00 0.46 H new ATOM 0 HB THR A 155 10.572 -0.462 -12.334 1.00 0.51 H new ATOM 0 HG1 THR A 155 9.400 0.445 -14.162 1.00 0.62 H new ATOM 0 HG21 THR A 155 9.029 -1.866 -13.640 1.00 0.56 H new ATOM 0 HG22 THR A 155 9.023 -2.312 -11.918 1.00 0.56 H new ATOM 0 HG23 THR A 155 7.683 -1.357 -12.594 1.00 0.56 H new ATOM 2651 N GLU A 156 9.466 -1.639 -9.366 1.00 0.44 N ATOM 2652 CA GLU A 156 10.154 -2.432 -8.343 1.00 0.43 C ATOM 2653 C GLU A 156 11.565 -2.803 -8.784 1.00 0.41 C ATOM 2654 O GLU A 156 12.516 -2.681 -8.015 1.00 0.39 O ATOM 2655 CB GLU A 156 9.361 -3.704 -8.018 1.00 0.50 C ATOM 2656 CG GLU A 156 7.945 -3.439 -7.533 1.00 0.53 C ATOM 2657 CD GLU A 156 7.024 -4.623 -7.757 1.00 1.06 C ATOM 2658 OE1 GLU A 156 7.061 -5.578 -6.950 1.00 1.75 O ATOM 2659 OE2 GLU A 156 6.268 -4.606 -8.753 1.00 1.72 O ATOM 0 H GLU A 156 8.579 -2.036 -9.676 1.00 0.44 H new ATOM 0 HA GLU A 156 10.224 -1.817 -7.446 1.00 0.43 H new ATOM 0 HB2 GLU A 156 9.318 -4.331 -8.908 1.00 0.50 H new ATOM 0 HB3 GLU A 156 9.896 -4.269 -7.255 1.00 0.50 H new ATOM 0 HG2 GLU A 156 7.968 -3.196 -6.471 1.00 0.53 H new ATOM 0 HG3 GLU A 156 7.544 -2.568 -8.051 1.00 0.53 H new ATOM 2666 N LYS A 157 11.692 -3.259 -10.026 1.00 0.44 N ATOM 2667 CA LYS A 157 12.989 -3.636 -10.575 1.00 0.44 C ATOM 2668 C LYS A 157 13.929 -2.436 -10.595 1.00 0.40 C ATOM 2669 O LYS A 157 15.086 -2.512 -10.159 1.00 0.39 O ATOM 2670 CB LYS A 157 12.831 -4.205 -11.982 1.00 0.49 C ATOM 2671 CG LYS A 157 12.196 -5.585 -12.012 1.00 0.69 C ATOM 2672 CD LYS A 157 13.180 -6.659 -11.588 1.00 1.05 C ATOM 2673 CE LYS A 157 14.121 -7.027 -12.720 1.00 1.58 C ATOM 2674 NZ LYS A 157 13.490 -7.962 -13.686 1.00 2.00 N ATOM 0 H LYS A 157 10.911 -3.376 -10.672 1.00 0.44 H new ATOM 0 HA LYS A 157 13.420 -4.406 -9.935 1.00 0.44 H new ATOM 0 HB2 LYS A 157 12.223 -3.522 -12.575 1.00 0.49 H new ATOM 0 HB3 LYS A 157 13.811 -4.255 -12.457 1.00 0.49 H new ATOM 0 HG2 LYS A 157 11.330 -5.602 -11.351 1.00 0.69 H new ATOM 0 HG3 LYS A 157 11.834 -5.798 -13.018 1.00 0.69 H new ATOM 0 HD2 LYS A 157 13.757 -6.308 -10.733 1.00 1.05 H new ATOM 0 HD3 LYS A 157 12.635 -7.546 -11.263 1.00 1.05 H new ATOM 0 HE2 LYS A 157 14.432 -6.122 -13.242 1.00 1.58 H new ATOM 0 HE3 LYS A 157 15.022 -7.483 -12.309 1.00 1.58 H new ATOM 0 HZ1 LYS A 157 14.166 -8.188 -14.443 1.00 2.00 H new ATOM 0 HZ2 LYS A 157 13.216 -8.837 -13.194 1.00 2.00 H new ATOM 0 HZ3 LYS A 157 12.645 -7.517 -14.098 1.00 2.00 H new ATOM 2688 N GLU A 158 13.419 -1.320 -11.082 1.00 0.41 N ATOM 2689 CA GLU A 158 14.194 -0.100 -11.143 1.00 0.39 C ATOM 2690 C GLU A 158 14.613 0.307 -9.737 1.00 0.35 C ATOM 2691 O GLU A 158 15.736 0.748 -9.510 1.00 0.34 O ATOM 2692 CB GLU A 158 13.368 0.999 -11.802 1.00 0.43 C ATOM 2693 CG GLU A 158 14.136 1.790 -12.839 1.00 0.53 C ATOM 2694 CD GLU A 158 14.873 0.893 -13.818 1.00 1.06 C ATOM 2695 OE1 GLU A 158 14.236 0.407 -14.778 1.00 1.71 O ATOM 2696 OE2 GLU A 158 16.089 0.666 -13.630 1.00 1.71 O ATOM 0 H GLU A 158 12.468 -1.236 -11.442 1.00 0.41 H new ATOM 0 HA GLU A 158 15.092 -0.262 -11.740 1.00 0.39 H new ATOM 0 HB2 GLU A 158 12.492 0.552 -12.272 1.00 0.43 H new ATOM 0 HB3 GLU A 158 13.004 1.680 -11.033 1.00 0.43 H new ATOM 0 HG2 GLU A 158 13.447 2.433 -13.387 1.00 0.53 H new ATOM 0 HG3 GLU A 158 14.851 2.443 -12.339 1.00 0.53 H new ATOM 2703 N LEU A 159 13.695 0.118 -8.801 1.00 0.35 N ATOM 2704 CA LEU A 159 13.926 0.441 -7.404 1.00 0.32 C ATOM 2705 C LEU A 159 15.046 -0.408 -6.814 1.00 0.31 C ATOM 2706 O LEU A 159 16.010 0.124 -6.263 1.00 0.30 O ATOM 2707 CB LEU A 159 12.642 0.229 -6.608 1.00 0.34 C ATOM 2708 CG LEU A 159 12.799 0.280 -5.095 1.00 0.36 C ATOM 2709 CD1 LEU A 159 13.162 1.682 -4.645 1.00 0.55 C ATOM 2710 CD2 LEU A 159 11.526 -0.185 -4.423 1.00 0.41 C ATOM 0 H LEU A 159 12.768 -0.264 -8.990 1.00 0.35 H new ATOM 0 HA LEU A 159 14.229 1.486 -7.344 1.00 0.32 H new ATOM 0 HB2 LEU A 159 11.919 0.988 -6.908 1.00 0.34 H new ATOM 0 HB3 LEU A 159 12.220 -0.739 -6.881 1.00 0.34 H new ATOM 0 HG LEU A 159 13.608 -0.390 -4.804 1.00 0.36 H new ATOM 0 HD11 LEU A 159 13.270 1.699 -3.561 1.00 0.55 H new ATOM 0 HD12 LEU A 159 14.102 1.981 -5.108 1.00 0.55 H new ATOM 0 HD13 LEU A 159 12.375 2.375 -4.942 1.00 0.55 H new ATOM 0 HD21 LEU A 159 11.650 -0.144 -3.341 1.00 0.41 H new ATOM 0 HD22 LEU A 159 10.701 0.463 -4.718 1.00 0.41 H new ATOM 0 HD23 LEU A 159 11.308 -1.210 -4.725 1.00 0.41 H new ATOM 2722 N ILE A 160 14.915 -1.729 -6.922 1.00 0.33 N ATOM 2723 CA ILE A 160 15.930 -2.633 -6.395 1.00 0.34 C ATOM 2724 C ILE A 160 17.286 -2.330 -7.021 1.00 0.33 C ATOM 2725 O ILE A 160 18.312 -2.347 -6.337 1.00 0.33 O ATOM 2726 CB ILE A 160 15.559 -4.127 -6.577 1.00 0.38 C ATOM 2727 CG1 ILE A 160 15.191 -4.447 -8.022 1.00 0.40 C ATOM 2728 CG2 ILE A 160 14.407 -4.490 -5.653 1.00 0.43 C ATOM 2729 CD1 ILE A 160 16.264 -5.206 -8.774 1.00 0.42 C ATOM 0 H ILE A 160 14.122 -2.192 -7.366 1.00 0.33 H new ATOM 0 HA ILE A 160 15.985 -2.458 -5.321 1.00 0.34 H new ATOM 0 HB ILE A 160 16.436 -4.722 -6.320 1.00 0.38 H new ATOM 0 HG12 ILE A 160 14.271 -5.032 -8.032 1.00 0.40 H new ATOM 0 HG13 ILE A 160 14.982 -3.516 -8.548 1.00 0.40 H new ATOM 0 HG21 ILE A 160 14.151 -5.541 -5.786 1.00 0.43 H new ATOM 0 HG22 ILE A 160 14.702 -4.316 -4.618 1.00 0.43 H new ATOM 0 HG23 ILE A 160 13.541 -3.873 -5.892 1.00 0.43 H new ATOM 0 HD11 ILE A 160 15.928 -5.396 -9.793 1.00 0.42 H new ATOM 0 HD12 ILE A 160 17.179 -4.615 -8.798 1.00 0.42 H new ATOM 0 HD13 ILE A 160 16.458 -6.154 -8.273 1.00 0.42 H new ATOM 2741 N LYS A 161 17.287 -2.034 -8.316 1.00 0.34 N ATOM 2742 CA LYS A 161 18.526 -1.699 -9.010 1.00 0.35 C ATOM 2743 C LYS A 161 19.082 -0.375 -8.485 1.00 0.34 C ATOM 2744 O LYS A 161 20.287 -0.237 -8.280 1.00 0.37 O ATOM 2745 CB LYS A 161 18.295 -1.622 -10.514 1.00 0.41 C ATOM 2746 CG LYS A 161 18.168 -2.983 -11.173 1.00 0.78 C ATOM 2747 CD LYS A 161 17.501 -2.878 -12.530 1.00 1.43 C ATOM 2748 CE LYS A 161 18.379 -2.133 -13.524 1.00 1.61 C ATOM 2749 NZ LYS A 161 17.577 -1.387 -14.531 1.00 2.63 N ATOM 0 H LYS A 161 16.452 -2.019 -8.902 1.00 0.34 H new ATOM 0 HA LYS A 161 19.256 -2.486 -8.817 1.00 0.35 H new ATOM 0 HB2 LYS A 161 17.389 -1.047 -10.706 1.00 0.41 H new ATOM 0 HB3 LYS A 161 19.121 -1.079 -10.974 1.00 0.41 H new ATOM 0 HG2 LYS A 161 19.156 -3.429 -11.285 1.00 0.78 H new ATOM 0 HG3 LYS A 161 17.589 -3.647 -10.531 1.00 0.78 H new ATOM 0 HD2 LYS A 161 17.286 -3.877 -12.910 1.00 1.43 H new ATOM 0 HD3 LYS A 161 16.546 -2.363 -12.429 1.00 1.43 H new ATOM 0 HE2 LYS A 161 19.023 -1.437 -12.987 1.00 1.61 H new ATOM 0 HE3 LYS A 161 19.031 -2.842 -14.034 1.00 1.61 H new ATOM 0 HZ1 LYS A 161 18.152 -1.227 -15.383 1.00 2.63 H new ATOM 0 HZ2 LYS A 161 16.733 -1.940 -14.781 1.00 2.63 H new ATOM 0 HZ3 LYS A 161 17.285 -0.471 -14.133 1.00 2.63 H new ATOM 2763 N GLU A 162 18.190 0.585 -8.265 1.00 0.33 N ATOM 2764 CA GLU A 162 18.563 1.898 -7.745 1.00 0.35 C ATOM 2765 C GLU A 162 19.163 1.767 -6.344 1.00 0.34 C ATOM 2766 O GLU A 162 20.129 2.451 -6.003 1.00 0.37 O ATOM 2767 CB GLU A 162 17.327 2.803 -7.707 1.00 0.36 C ATOM 2768 CG GLU A 162 17.595 4.224 -7.230 1.00 0.66 C ATOM 2769 CD GLU A 162 18.461 5.022 -8.180 1.00 0.92 C ATOM 2770 OE1 GLU A 162 18.487 4.707 -9.386 1.00 1.62 O ATOM 2771 OE2 GLU A 162 19.109 5.987 -7.724 1.00 1.73 O ATOM 0 H GLU A 162 17.191 0.477 -8.441 1.00 0.33 H new ATOM 0 HA GLU A 162 19.314 2.340 -8.400 1.00 0.35 H new ATOM 0 HB2 GLU A 162 16.893 2.845 -8.706 1.00 0.36 H new ATOM 0 HB3 GLU A 162 16.581 2.350 -7.054 1.00 0.36 H new ATOM 0 HG2 GLU A 162 16.644 4.740 -7.096 1.00 0.66 H new ATOM 0 HG3 GLU A 162 18.078 4.187 -6.254 1.00 0.66 H new ATOM 2778 N LEU A 163 18.586 0.880 -5.541 1.00 0.32 N ATOM 2779 CA LEU A 163 19.057 0.655 -4.176 1.00 0.33 C ATOM 2780 C LEU A 163 20.348 -0.160 -4.159 1.00 0.34 C ATOM 2781 O LEU A 163 21.145 -0.070 -3.220 1.00 0.36 O ATOM 2782 CB LEU A 163 17.987 -0.070 -3.365 1.00 0.33 C ATOM 2783 CG LEU A 163 16.675 0.694 -3.183 1.00 0.35 C ATOM 2784 CD1 LEU A 163 15.607 -0.218 -2.608 1.00 0.35 C ATOM 2785 CD2 LEU A 163 16.879 1.902 -2.285 1.00 0.46 C ATOM 0 H LEU A 163 17.789 0.303 -5.811 1.00 0.32 H new ATOM 0 HA LEU A 163 19.260 1.629 -3.730 1.00 0.33 H new ATOM 0 HB2 LEU A 163 17.770 -1.022 -3.850 1.00 0.33 H new ATOM 0 HB3 LEU A 163 18.394 -0.300 -2.380 1.00 0.33 H new ATOM 0 HG LEU A 163 16.344 1.045 -4.160 1.00 0.35 H new ATOM 0 HD11 LEU A 163 14.679 0.341 -2.484 1.00 0.35 H new ATOM 0 HD12 LEU A 163 15.439 -1.055 -3.286 1.00 0.35 H new ATOM 0 HD13 LEU A 163 15.934 -0.596 -1.640 1.00 0.35 H new ATOM 0 HD21 LEU A 163 15.934 2.432 -2.168 1.00 0.46 H new ATOM 0 HD22 LEU A 163 17.234 1.573 -1.308 1.00 0.46 H new ATOM 0 HD23 LEU A 163 17.616 2.568 -2.733 1.00 0.46 H new ATOM 2797 N GLY A 164 20.552 -0.961 -5.191 1.00 0.33 N ATOM 2798 CA GLY A 164 21.751 -1.767 -5.269 1.00 0.35 C ATOM 2799 C GLY A 164 21.535 -3.185 -4.786 1.00 0.37 C ATOM 2800 O GLY A 164 22.417 -3.772 -4.154 1.00 0.43 O ATOM 0 H GLY A 164 19.910 -1.068 -5.976 1.00 0.33 H new ATOM 0 HA2 GLY A 164 22.103 -1.789 -6.300 1.00 0.35 H new ATOM 0 HA3 GLY A 164 22.536 -1.301 -4.674 1.00 0.35 H new ATOM 2804 N PHE A 165 20.364 -3.739 -5.080 1.00 0.35 N ATOM 2805 CA PHE A 165 20.030 -5.095 -4.666 1.00 0.38 C ATOM 2806 C PHE A 165 19.475 -5.903 -5.831 1.00 0.41 C ATOM 2807 O PHE A 165 19.245 -5.370 -6.917 1.00 0.45 O ATOM 2808 CB PHE A 165 19.010 -5.068 -3.526 1.00 0.38 C ATOM 2809 CG PHE A 165 19.525 -4.400 -2.287 1.00 0.37 C ATOM 2810 CD1 PHE A 165 20.505 -5.006 -1.518 1.00 1.23 C ATOM 2811 CD2 PHE A 165 19.036 -3.165 -1.894 1.00 1.23 C ATOM 2812 CE1 PHE A 165 20.987 -4.391 -0.381 1.00 1.25 C ATOM 2813 CE2 PHE A 165 19.513 -2.547 -0.758 1.00 1.25 C ATOM 2814 CZ PHE A 165 20.491 -3.160 0.000 1.00 0.48 C ATOM 0 H PHE A 165 19.628 -3.267 -5.606 1.00 0.35 H new ATOM 0 HA PHE A 165 20.946 -5.572 -4.318 1.00 0.38 H new ATOM 0 HB2 PHE A 165 18.112 -4.550 -3.863 1.00 0.38 H new ATOM 0 HB3 PHE A 165 18.717 -6.090 -3.285 1.00 0.38 H new ATOM 0 HD1 PHE A 165 20.895 -5.969 -1.811 1.00 1.23 H new ATOM 0 HD2 PHE A 165 18.272 -2.681 -2.484 1.00 1.23 H new ATOM 0 HE1 PHE A 165 21.752 -4.872 0.211 1.00 1.25 H new ATOM 0 HE2 PHE A 165 19.122 -1.585 -0.461 1.00 1.25 H new ATOM 0 HZ PHE A 165 20.867 -2.677 0.890 1.00 0.48 H new ATOM 2824 N THR A 166 19.273 -7.191 -5.599 1.00 0.47 N ATOM 2825 CA THR A 166 18.732 -8.077 -6.616 1.00 0.52 C ATOM 2826 C THR A 166 17.248 -8.302 -6.372 1.00 0.51 C ATOM 2827 O THR A 166 16.792 -8.261 -5.229 1.00 0.51 O ATOM 2828 CB THR A 166 19.452 -9.442 -6.620 1.00 0.61 C ATOM 2829 OG1 THR A 166 19.285 -10.100 -5.355 1.00 1.46 O ATOM 2830 CG2 THR A 166 20.932 -9.269 -6.903 1.00 1.43 C ATOM 0 H THR A 166 19.477 -7.647 -4.710 1.00 0.47 H new ATOM 0 HA THR A 166 18.887 -7.600 -7.584 1.00 0.52 H new ATOM 0 HB THR A 166 19.008 -10.052 -7.407 1.00 0.61 H new ATOM 0 HG1 THR A 166 19.745 -10.965 -5.373 1.00 1.46 H new ATOM 0 HG21 THR A 166 21.419 -10.244 -6.901 1.00 1.43 H new ATOM 0 HG22 THR A 166 21.064 -8.800 -7.878 1.00 1.43 H new ATOM 0 HG23 THR A 166 21.378 -8.639 -6.134 1.00 1.43 H new ATOM 2838 N TYR A 167 16.491 -8.519 -7.434 1.00 0.55 N ATOM 2839 CA TYR A 167 15.068 -8.754 -7.292 1.00 0.57 C ATOM 2840 C TYR A 167 14.797 -10.245 -7.174 1.00 0.57 C ATOM 2841 O TYR A 167 14.984 -10.999 -8.130 1.00 0.67 O ATOM 2842 CB TYR A 167 14.305 -8.179 -8.488 1.00 0.68 C ATOM 2843 CG TYR A 167 12.811 -8.087 -8.275 1.00 0.74 C ATOM 2844 CD1 TYR A 167 12.287 -7.378 -7.202 1.00 1.43 C ATOM 2845 CD2 TYR A 167 11.926 -8.700 -9.153 1.00 1.41 C ATOM 2846 CE1 TYR A 167 10.919 -7.284 -7.008 1.00 1.49 C ATOM 2847 CE2 TYR A 167 10.561 -8.611 -8.969 1.00 1.49 C ATOM 2848 CZ TYR A 167 10.060 -7.903 -7.897 1.00 0.95 C ATOM 2849 OH TYR A 167 8.696 -7.818 -7.710 1.00 1.08 O ATOM 0 H TYR A 167 16.835 -8.537 -8.394 1.00 0.55 H new ATOM 0 HA TYR A 167 14.723 -8.254 -6.387 1.00 0.57 H new ATOM 0 HB2 TYR A 167 14.692 -7.185 -8.709 1.00 0.68 H new ATOM 0 HB3 TYR A 167 14.500 -8.799 -9.363 1.00 0.68 H new ATOM 0 HD1 TYR A 167 12.957 -6.892 -6.508 1.00 1.43 H new ATOM 0 HD2 TYR A 167 12.313 -9.256 -9.994 1.00 1.41 H new ATOM 0 HE1 TYR A 167 10.526 -6.731 -6.168 1.00 1.49 H new ATOM 0 HE2 TYR A 167 9.888 -9.094 -9.662 1.00 1.49 H new ATOM 0 HH TYR A 167 8.456 -6.900 -7.466 1.00 1.08 H new ATOM 2859 N ARG A 168 14.369 -10.668 -5.998 1.00 0.58 N ATOM 2860 CA ARG A 168 14.054 -12.065 -5.766 1.00 0.64 C ATOM 2861 C ARG A 168 12.545 -12.235 -5.700 1.00 0.61 C ATOM 2862 O ARG A 168 11.804 -11.281 -5.936 1.00 0.65 O ATOM 2863 CB ARG A 168 14.709 -12.570 -4.490 1.00 0.78 C ATOM 2864 CG ARG A 168 16.213 -12.411 -4.510 1.00 1.05 C ATOM 2865 CD ARG A 168 16.670 -11.483 -3.418 1.00 1.59 C ATOM 2866 NE ARG A 168 16.805 -12.174 -2.135 1.00 2.25 N ATOM 2867 CZ ARG A 168 17.752 -11.910 -1.236 1.00 3.01 C ATOM 2868 NH1 ARG A 168 18.615 -10.918 -1.436 1.00 3.43 N ATOM 2869 NH2 ARG A 168 17.811 -12.625 -0.120 1.00 3.74 N ATOM 0 H ARG A 168 14.232 -10.063 -5.188 1.00 0.58 H new ATOM 0 HA ARG A 168 14.448 -12.658 -6.591 1.00 0.64 H new ATOM 0 HB2 ARG A 168 14.301 -12.028 -3.637 1.00 0.78 H new ATOM 0 HB3 ARG A 168 14.460 -13.622 -4.349 1.00 0.78 H new ATOM 0 HG2 ARG A 168 16.687 -13.385 -4.387 1.00 1.05 H new ATOM 0 HG3 ARG A 168 16.529 -12.023 -5.478 1.00 1.05 H new ATOM 0 HD2 ARG A 168 17.627 -11.041 -3.694 1.00 1.59 H new ATOM 0 HD3 ARG A 168 15.958 -10.664 -3.316 1.00 1.59 H new ATOM 0 HE ARG A 168 16.130 -12.906 -1.915 1.00 2.25 H new ATOM 0 HH11 ARG A 168 18.555 -10.353 -2.283 1.00 3.43 H new ATOM 0 HH12 ARG A 168 19.337 -10.723 -0.743 1.00 3.43 H new ATOM 0 HH21 ARG A 168 17.134 -13.370 0.045 1.00 3.74 H new ATOM 0 HH22 ARG A 168 18.533 -12.429 0.573 1.00 3.74 H new ATOM 2883 N ILE A 169 12.078 -13.431 -5.381 1.00 0.63 N ATOM 2884 CA ILE A 169 10.649 -13.665 -5.304 1.00 0.61 C ATOM 2885 C ILE A 169 10.206 -13.823 -3.856 1.00 0.59 C ATOM 2886 O ILE A 169 10.777 -14.606 -3.091 1.00 0.56 O ATOM 2887 CB ILE A 169 10.206 -14.892 -6.127 1.00 0.63 C ATOM 2888 CG1 ILE A 169 10.810 -16.181 -5.560 1.00 0.61 C ATOM 2889 CG2 ILE A 169 10.593 -14.707 -7.586 1.00 0.71 C ATOM 2890 CD1 ILE A 169 10.457 -17.421 -6.350 1.00 0.67 C ATOM 0 H ILE A 169 12.659 -14.243 -5.174 1.00 0.63 H new ATOM 0 HA ILE A 169 10.166 -12.789 -5.737 1.00 0.61 H new ATOM 0 HB ILE A 169 9.121 -14.980 -6.062 1.00 0.63 H new ATOM 0 HG12 ILE A 169 11.895 -16.079 -5.528 1.00 0.61 H new ATOM 0 HG13 ILE A 169 10.471 -16.308 -4.532 1.00 0.61 H new ATOM 0 HG21 ILE A 169 10.276 -15.578 -8.160 1.00 0.71 H new ATOM 0 HG22 ILE A 169 10.106 -13.816 -7.981 1.00 0.71 H new ATOM 0 HG23 ILE A 169 11.674 -14.595 -7.664 1.00 0.71 H new ATOM 0 HD11 ILE A 169 10.921 -18.292 -5.887 1.00 0.67 H new ATOM 0 HD12 ILE A 169 9.375 -17.549 -6.361 1.00 0.67 H new ATOM 0 HD13 ILE A 169 10.820 -17.317 -7.372 1.00 0.67 H new ATOM 2902 N PRO A 170 9.162 -13.090 -3.467 1.00 0.65 N ATOM 2903 CA PRO A 170 8.631 -13.129 -2.103 1.00 0.69 C ATOM 2904 C PRO A 170 7.984 -14.459 -1.769 1.00 0.63 C ATOM 2905 O PRO A 170 7.813 -14.811 -0.602 1.00 0.66 O ATOM 2906 CB PRO A 170 7.584 -12.025 -2.119 1.00 0.83 C ATOM 2907 CG PRO A 170 7.170 -11.889 -3.537 1.00 0.83 C ATOM 2908 CD PRO A 170 8.410 -12.156 -4.331 1.00 0.76 C ATOM 0 HA PRO A 170 9.412 -12.999 -1.354 1.00 0.69 H new ATOM 0 HB2 PRO A 170 6.735 -12.281 -1.485 1.00 0.83 H new ATOM 0 HB3 PRO A 170 7.995 -11.090 -1.739 1.00 0.83 H new ATOM 0 HG2 PRO A 170 6.381 -12.598 -3.787 1.00 0.83 H new ATOM 0 HG3 PRO A 170 6.779 -10.892 -3.740 1.00 0.83 H new ATOM 0 HD2 PRO A 170 8.181 -12.598 -5.301 1.00 0.76 H new ATOM 0 HD3 PRO A 170 8.972 -11.242 -4.522 1.00 0.76 H new ATOM 2916 N LYS A 171 7.653 -15.196 -2.811 1.00 0.62 N ATOM 2917 CA LYS A 171 7.001 -16.486 -2.686 1.00 0.63 C ATOM 2918 C LYS A 171 7.850 -17.482 -1.911 1.00 0.63 C ATOM 2919 O LYS A 171 7.331 -18.277 -1.131 1.00 0.73 O ATOM 2920 CB LYS A 171 6.697 -17.021 -4.078 1.00 0.65 C ATOM 2921 CG LYS A 171 5.546 -16.291 -4.752 1.00 0.76 C ATOM 2922 CD LYS A 171 6.013 -15.523 -5.977 1.00 0.79 C ATOM 2923 CE LYS A 171 6.323 -16.462 -7.128 1.00 0.81 C ATOM 2924 NZ LYS A 171 5.089 -17.088 -7.677 1.00 1.03 N ATOM 0 H LYS A 171 7.830 -14.915 -3.775 1.00 0.62 H new ATOM 0 HA LYS A 171 6.077 -16.352 -2.124 1.00 0.63 H new ATOM 0 HB2 LYS A 171 7.589 -16.934 -4.698 1.00 0.65 H new ATOM 0 HB3 LYS A 171 6.458 -18.082 -4.010 1.00 0.65 H new ATOM 0 HG2 LYS A 171 4.779 -17.009 -5.042 1.00 0.76 H new ATOM 0 HG3 LYS A 171 5.086 -15.602 -4.043 1.00 0.76 H new ATOM 0 HD2 LYS A 171 5.243 -14.814 -6.280 1.00 0.79 H new ATOM 0 HD3 LYS A 171 6.901 -14.942 -5.729 1.00 0.79 H new ATOM 0 HE2 LYS A 171 6.834 -15.912 -7.918 1.00 0.81 H new ATOM 0 HE3 LYS A 171 7.006 -17.241 -6.788 1.00 0.81 H new ATOM 0 HZ1 LYS A 171 5.195 -17.224 -8.703 1.00 1.03 H new ATOM 0 HZ2 LYS A 171 4.934 -18.009 -7.220 1.00 1.03 H new ATOM 0 HZ3 LYS A 171 4.274 -16.469 -7.492 1.00 1.03 H new ATOM 2938 N LYS A 172 9.154 -17.425 -2.121 1.00 0.59 N ATOM 2939 CA LYS A 172 10.070 -18.335 -1.448 1.00 0.66 C ATOM 2940 C LYS A 172 10.776 -17.645 -0.284 1.00 0.70 C ATOM 2941 O LYS A 172 11.744 -18.179 0.262 1.00 0.80 O ATOM 2942 CB LYS A 172 11.095 -18.878 -2.447 1.00 0.70 C ATOM 2943 CG LYS A 172 10.664 -20.168 -3.128 1.00 0.77 C ATOM 2944 CD LYS A 172 9.282 -20.044 -3.752 1.00 0.71 C ATOM 2945 CE LYS A 172 8.930 -21.275 -4.562 1.00 0.82 C ATOM 2946 NZ LYS A 172 7.515 -21.260 -5.020 1.00 1.16 N ATOM 0 H LYS A 172 9.603 -16.760 -2.751 1.00 0.59 H new ATOM 0 HA LYS A 172 9.492 -19.165 -1.043 1.00 0.66 H new ATOM 0 HB2 LYS A 172 11.283 -18.121 -3.209 1.00 0.70 H new ATOM 0 HB3 LYS A 172 12.038 -19.049 -1.929 1.00 0.70 H new ATOM 0 HG2 LYS A 172 11.388 -20.432 -3.899 1.00 0.77 H new ATOM 0 HG3 LYS A 172 10.663 -20.980 -2.401 1.00 0.77 H new ATOM 0 HD2 LYS A 172 8.539 -19.897 -2.968 1.00 0.71 H new ATOM 0 HD3 LYS A 172 9.248 -19.163 -4.393 1.00 0.71 H new ATOM 0 HE2 LYS A 172 9.590 -21.339 -5.427 1.00 0.82 H new ATOM 0 HE3 LYS A 172 9.106 -22.167 -3.960 1.00 0.82 H new ATOM 0 HZ1 LYS A 172 7.319 -22.121 -5.570 1.00 1.16 H new ATOM 0 HZ2 LYS A 172 6.883 -21.225 -4.195 1.00 1.16 H new ATOM 0 HZ3 LYS A 172 7.352 -20.424 -5.616 1.00 1.16 H new ATOM 2960 N ARG A 173 10.262 -16.469 0.100 1.00 0.68 N ATOM 2961 CA ARG A 173 10.817 -15.668 1.199 1.00 0.76 C ATOM 2962 C ARG A 173 12.207 -15.127 0.867 1.00 0.61 C ATOM 2963 O ARG A 173 13.091 -15.874 0.441 1.00 0.97 O ATOM 2964 CB ARG A 173 10.863 -16.473 2.504 1.00 1.36 C ATOM 2965 CG ARG A 173 9.501 -16.954 2.983 1.00 1.98 C ATOM 2966 CD ARG A 173 8.583 -15.795 3.333 1.00 2.47 C ATOM 2967 NE ARG A 173 8.963 -15.146 4.586 1.00 2.99 N ATOM 2968 CZ ARG A 173 8.152 -14.362 5.293 1.00 3.79 C ATOM 2969 NH1 ARG A 173 6.904 -14.151 4.891 1.00 4.07 N ATOM 2970 NH2 ARG A 173 8.583 -13.800 6.411 1.00 4.60 N ATOM 0 H ARG A 173 9.447 -16.045 -0.344 1.00 0.68 H new ATOM 0 HA ARG A 173 10.149 -14.817 1.335 1.00 0.76 H new ATOM 0 HB2 ARG A 173 11.513 -17.337 2.363 1.00 1.36 H new ATOM 0 HB3 ARG A 173 11.314 -15.858 3.283 1.00 1.36 H new ATOM 0 HG2 ARG A 173 9.037 -17.563 2.207 1.00 1.98 H new ATOM 0 HG3 ARG A 173 9.628 -17.593 3.857 1.00 1.98 H new ATOM 0 HD2 ARG A 173 8.603 -15.062 2.526 1.00 2.47 H new ATOM 0 HD3 ARG A 173 7.558 -16.157 3.410 1.00 2.47 H new ATOM 0 HE ARG A 173 9.907 -15.303 4.940 1.00 2.99 H new ATOM 0 HH11 ARG A 173 6.562 -14.591 4.036 1.00 4.07 H new ATOM 0 HH12 ARG A 173 6.287 -13.549 5.437 1.00 4.07 H new ATOM 0 HH21 ARG A 173 9.537 -13.967 6.731 1.00 4.60 H new ATOM 0 HH22 ARG A 173 7.961 -13.199 6.952 1.00 4.60 H new ATOM 2984 N LEU A 174 12.393 -13.824 1.102 1.00 0.60 N ATOM 2985 CA LEU A 174 13.660 -13.145 0.832 1.00 1.13 C ATOM 2986 C LEU A 174 14.183 -13.471 -0.564 1.00 1.70 C ATOM 2987 O LEU A 174 13.465 -13.198 -1.543 1.00 2.14 O ATOM 2988 CB LEU A 174 14.699 -13.524 1.886 1.00 1.32 C ATOM 2989 CG LEU A 174 14.623 -12.738 3.194 1.00 1.64 C ATOM 2990 CD1 LEU A 174 13.785 -13.486 4.220 1.00 1.79 C ATOM 2991 CD2 LEU A 174 16.019 -12.469 3.731 1.00 2.09 C ATOM 2992 OXT LEU A 174 15.311 -14.001 -0.674 1.00 2.37 O ATOM 0 H LEU A 174 11.670 -13.214 1.484 1.00 0.60 H new ATOM 0 HA LEU A 174 13.478 -12.071 0.879 1.00 1.13 H new ATOM 0 HB2 LEU A 174 14.591 -14.585 2.113 1.00 1.32 H new ATOM 0 HB3 LEU A 174 15.692 -13.389 1.458 1.00 1.32 H new ATOM 0 HG LEU A 174 14.141 -11.781 2.996 1.00 1.64 H new ATOM 0 HD11 LEU A 174 13.743 -12.910 5.145 1.00 1.79 H new ATOM 0 HD12 LEU A 174 12.776 -13.626 3.833 1.00 1.79 H new ATOM 0 HD13 LEU A 174 14.235 -14.459 4.418 1.00 1.79 H new ATOM 0 HD21 LEU A 174 15.949 -11.908 4.663 1.00 2.09 H new ATOM 0 HD22 LEU A 174 16.527 -13.416 3.915 1.00 2.09 H new ATOM 0 HD23 LEU A 174 16.584 -11.890 3.001 1.00 2.09 H new