USER MOD reduce.3.24.130724 H: found=0, std=0, add=933, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 935 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 NoAdj-H: A 83 HIS HE2 : A 83 HIS NE2 : A1159 ZNZN :(H bumps) USER MOD NoAdj-H: A 86 HIS HE2 : A 86 HIS NE2 : A1159 ZNZN :(H bumps) USER MOD NoAdj-H: A 88 HIS HD1 : A 88 HIS ND1 : A1159 ZNZN :(H bumps) USER MOD Set 1.1: A 137 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 139 LYS NZ :NH3+ 168:sc= -0.0476 (180deg=-0.27) USER MOD Set 2.1: A 73 LYS NZ :NH3+ -170:sc= 1.22 (180deg=1.16) USER MOD Set 2.2: A 89 TYR OH : rot -119:sc= 0.0542 USER MOD Set 3.1: A 87 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 61 LYS NZ :NH3+ 160:sc= 2.29 (180deg=1.06) USER MOD Set 4.2: A 66 ASN : amide:sc= 0.56 K(o=2.8,f=-6.1!) USER MOD Set 5.1: A 60 SER OG : rot 86:sc= 0.989 USER MOD Set 5.2: A 69 GLN : amide:sc= 1.17 K(o=3.8,f=-7.8!) USER MOD Set 5.3: A 81 THR OG1 : rot -159:sc= 1.24 USER MOD Set 5.4: A 90 TYR OH : rot -177:sc= 0.382 USER MOD Set 6.1: A 46 GLN : amide:sc= 0.0384 X(o=-1.5,f=-1.6) USER MOD Set 6.2: A 77 GLN : amide:sc= -1.55! C(o=-1.5!,f=-1.6!) USER MOD Single : A 40 SER OG : rot 28:sc= 0.166 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 50 LYS NZ :NH3+ -156:sc= -0.0953 (180deg=-0.648) USER MOD Single : A 53 ASN : amide:sc= -0.0972 K(o=-0.097,f=-2.3!) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.0977 USER MOD Single : A 75 THR OG1 : rot -31:sc= 1.26 USER MOD Single : A 79 TYR OH : rot 103:sc= -3.7! USER MOD Single : A 82 SER OG : rot -85:sc= -2.67! USER MOD Single : A 91 ASN : amide:sc= -0.538 K(o=-0.54,f=-8.1!) USER MOD Single : A 93 LYS NZ :NH3+ 170:sc=-0.00384 (180deg=-0.114) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.0665 USER MOD Single : A 106 MET CE :methyl -156:sc= -0.126 (180deg=-1) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 TYR OH : rot 23:sc= 1.18 USER MOD Single : A 112 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 114 LYS NZ :NH3+ -161:sc= -0.0772 (180deg=-0.471) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -0.749 X(o=-0.75,f=-1) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot -32:sc= 0.187 USER MOD Single : A 129 LYS NZ :NH3+ 158:sc= 1.24 (180deg=1.03) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= -3.32! USER MOD Single : A 135 TYR OH : rot 180:sc= -0.496 USER MOD Single : A 143 HIS : no HE2:sc= 0.146 K(o=0.15,f=-4.1!) USER MOD Single : A 146 ASN :FLIP amide:sc= -1.2 F(o=-2,f=-1.2) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0.382 USER MOD Single : A 150 LYS NZ :NH3+ -171:sc= 1.2 (180deg=1.12) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 GLN :FLIP amide:sc= -0.202 F(o=-0.94!,f=-0.2) USER MOD Single : A 158 GLN :FLIP amide:sc= -2.07 F(o=-2.8!,f=-2.1) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 40 -0.328 -17.846 15.162 1.00 13.12 N ATOM 2 CA SER A 40 1.139 -17.962 15.071 1.00 12.82 C ATOM 3 C SER A 40 1.614 -17.586 13.672 1.00 12.18 C ATOM 4 O SER A 40 1.551 -18.403 12.755 1.00 11.93 O ATOM 5 CB SER A 40 1.564 -19.393 15.399 1.00 13.03 C ATOM 6 OG SER A 40 1.017 -19.820 16.636 1.00 13.46 O ATOM 0 HA SER A 40 1.593 -17.278 15.789 1.00 12.82 H new ATOM 0 HB2 SER A 40 1.238 -20.063 14.604 1.00 13.03 H new ATOM 0 HB3 SER A 40 2.652 -19.452 15.440 1.00 13.03 H new ATOM 0 HG SER A 40 0.180 -19.340 16.806 1.00 13.46 H new ATOM 13 N TYR A 41 2.071 -16.343 13.521 1.00 12.10 N ATOM 14 CA TYR A 41 2.572 -15.840 12.241 1.00 11.74 C ATOM 15 C TYR A 41 1.526 -16.004 11.143 1.00 11.26 C ATOM 16 O TYR A 41 1.767 -16.652 10.122 1.00 11.61 O ATOM 17 CB TYR A 41 3.875 -16.548 11.855 1.00 12.43 C ATOM 18 CG TYR A 41 4.979 -16.363 12.865 1.00 13.20 C ATOM 19 CD1 TYR A 41 5.692 -15.174 12.935 1.00 13.55 C ATOM 20 CD2 TYR A 41 5.302 -17.375 13.753 1.00 13.72 C ATOM 21 CE1 TYR A 41 6.698 -15.004 13.863 1.00 14.41 C ATOM 22 CE2 TYR A 41 6.305 -17.212 14.685 1.00 14.56 C ATOM 23 CZ TYR A 41 7.000 -16.024 14.735 1.00 14.90 C ATOM 24 OH TYR A 41 8.001 -15.855 15.666 1.00 15.87 O ATOM 0 H TYR A 41 2.105 -15.660 14.277 1.00 12.10 H new ATOM 0 HA TYR A 41 2.779 -14.776 12.354 1.00 11.74 H new ATOM 0 HB2 TYR A 41 3.679 -17.613 11.733 1.00 12.43 H new ATOM 0 HB3 TYR A 41 4.211 -16.173 10.888 1.00 12.43 H new ATOM 0 HD1 TYR A 41 5.456 -14.371 12.253 1.00 13.55 H new ATOM 0 HD2 TYR A 41 4.759 -18.308 13.715 1.00 13.72 H new ATOM 0 HE1 TYR A 41 7.246 -14.074 13.905 1.00 14.41 H new ATOM 0 HE2 TYR A 41 6.544 -18.011 15.371 1.00 14.56 H new ATOM 0 HH TYR A 41 8.087 -16.669 16.205 1.00 15.87 H new ATOM 34 N ILE A 42 0.359 -15.415 11.369 1.00 10.66 N ATOM 35 CA ILE A 42 -0.749 -15.524 10.432 1.00 10.40 C ATOM 36 C ILE A 42 -1.792 -14.428 10.672 1.00 10.44 C ATOM 37 O ILE A 42 -2.156 -13.702 9.745 1.00 10.49 O ATOM 38 CB ILE A 42 -1.414 -16.928 10.491 1.00 9.97 C ATOM 39 CG1 ILE A 42 -2.639 -16.982 9.575 1.00 9.82 C ATOM 40 CG2 ILE A 42 -1.787 -17.304 11.919 1.00 10.25 C ATOM 41 CD1 ILE A 42 -3.304 -18.339 9.520 1.00 10.06 C ATOM 0 H ILE A 42 0.156 -14.855 12.197 1.00 10.66 H new ATOM 0 HA ILE A 42 -0.335 -15.390 9.433 1.00 10.40 H new ATOM 0 HB ILE A 42 -0.687 -17.659 10.137 1.00 9.97 H new ATOM 0 HG12 ILE A 42 -3.367 -16.245 9.914 1.00 9.82 H new ATOM 0 HG13 ILE A 42 -2.340 -16.694 8.567 1.00 9.82 H new ATOM 0 HG21 ILE A 42 -2.250 -18.291 11.926 1.00 10.25 H new ATOM 0 HG22 ILE A 42 -0.890 -17.319 12.537 1.00 10.25 H new ATOM 0 HG23 ILE A 42 -2.489 -16.571 12.317 1.00 10.25 H new ATOM 0 HD11 ILE A 42 -4.163 -18.296 8.851 1.00 10.06 H new ATOM 0 HD12 ILE A 42 -2.593 -19.078 9.151 1.00 10.06 H new ATOM 0 HD13 ILE A 42 -3.636 -18.622 10.519 1.00 10.06 H new ATOM 53 N ASP A 43 -2.244 -14.291 11.915 1.00 10.68 N ATOM 54 CA ASP A 43 -3.269 -13.307 12.253 1.00 11.02 C ATOM 55 C ASP A 43 -2.714 -11.895 12.153 1.00 11.08 C ATOM 56 O ASP A 43 -1.773 -11.534 12.858 1.00 11.69 O ATOM 57 CB ASP A 43 -3.818 -13.552 13.660 1.00 11.24 C ATOM 58 CG ASP A 43 -4.808 -12.483 14.090 1.00 11.95 C ATOM 59 OD1 ASP A 43 -5.863 -12.340 13.431 1.00 12.25 O ATOM 60 OD2 ASP A 43 -4.537 -11.780 15.086 1.00 12.35 O ATOM 0 H ASP A 43 -1.917 -14.848 12.705 1.00 10.68 H new ATOM 0 HA ASP A 43 -4.084 -13.416 11.537 1.00 11.02 H new ATOM 0 HB2 ASP A 43 -4.304 -14.527 13.693 1.00 11.24 H new ATOM 0 HB3 ASP A 43 -2.991 -13.584 14.369 1.00 11.24 H new ATOM 65 N GLY A 44 -3.292 -11.106 11.259 1.00 10.65 N ATOM 66 CA GLY A 44 -2.804 -9.759 11.032 1.00 10.86 C ATOM 67 C GLY A 44 -1.460 -9.757 10.332 1.00 10.53 C ATOM 68 O GLY A 44 -0.786 -8.727 10.252 1.00 10.64 O ATOM 0 H GLY A 44 -4.092 -11.374 10.685 1.00 10.65 H new ATOM 0 HA2 GLY A 44 -3.527 -9.207 10.432 1.00 10.86 H new ATOM 0 HA3 GLY A 44 -2.718 -9.238 11.986 1.00 10.86 H new ATOM 72 N ASP A 45 -1.069 -10.918 9.826 1.00 10.35 N ATOM 73 CA ASP A 45 0.204 -11.062 9.142 1.00 10.29 C ATOM 74 C ASP A 45 -0.023 -11.521 7.706 1.00 9.54 C ATOM 75 O ASP A 45 -0.085 -10.700 6.793 1.00 9.39 O ATOM 76 CB ASP A 45 1.115 -12.038 9.899 1.00 10.94 C ATOM 77 CG ASP A 45 2.503 -12.132 9.295 1.00 11.21 C ATOM 78 OD1 ASP A 45 3.367 -11.307 9.658 1.00 11.45 O ATOM 79 OD2 ASP A 45 2.741 -13.032 8.468 1.00 11.37 O ATOM 0 H ASP A 45 -1.619 -11.776 9.878 1.00 10.35 H new ATOM 0 HA ASP A 45 0.703 -10.093 9.116 1.00 10.29 H new ATOM 0 HB2 ASP A 45 1.196 -11.720 10.939 1.00 10.94 H new ATOM 0 HB3 ASP A 45 0.657 -13.027 9.903 1.00 10.94 H new ATOM 84 N GLN A 46 -0.201 -12.820 7.511 1.00 9.30 N ATOM 85 CA GLN A 46 -0.416 -13.362 6.178 1.00 8.82 C ATOM 86 C GLN A 46 -1.908 -13.503 5.895 1.00 7.96 C ATOM 87 O GLN A 46 -2.341 -13.491 4.743 1.00 7.83 O ATOM 88 CB GLN A 46 0.281 -14.714 6.036 1.00 9.37 C ATOM 89 CG GLN A 46 -0.444 -15.826 6.747 1.00 9.97 C ATOM 90 CD GLN A 46 0.203 -17.184 6.560 1.00 10.63 C ATOM 91 OE1 GLN A 46 0.098 -18.056 7.423 1.00 11.07 O ATOM 92 NE2 GLN A 46 0.859 -17.383 5.429 1.00 10.92 N ATOM 0 H GLN A 46 -0.201 -13.516 8.257 1.00 9.30 H new ATOM 0 HA GLN A 46 0.011 -12.672 5.450 1.00 8.82 H new ATOM 0 HB2 GLN A 46 0.368 -14.962 4.978 1.00 9.37 H new ATOM 0 HB3 GLN A 46 1.294 -14.638 6.430 1.00 9.37 H new ATOM 0 HG2 GLN A 46 -0.490 -15.597 7.812 1.00 9.97 H new ATOM 0 HG3 GLN A 46 -1.472 -15.869 6.386 1.00 9.97 H new ATOM 0 HE21 GLN A 46 0.924 -16.635 4.738 1.00 10.92 H new ATOM 0 HE22 GLN A 46 1.300 -18.284 5.247 1.00 10.92 H new ATOM 101 N ALA A 47 -2.692 -13.617 6.956 1.00 7.63 N ATOM 102 CA ALA A 47 -4.125 -13.803 6.830 1.00 7.10 C ATOM 103 C ALA A 47 -4.867 -12.534 7.221 1.00 6.23 C ATOM 104 O ALA A 47 -4.258 -11.474 7.380 1.00 6.37 O ATOM 105 CB ALA A 47 -4.578 -14.975 7.684 1.00 7.70 C ATOM 0 H ALA A 47 -2.355 -13.583 7.918 1.00 7.63 H new ATOM 0 HA ALA A 47 -4.357 -14.023 5.788 1.00 7.10 H new ATOM 0 HB1 ALA A 47 -5.655 -15.105 7.581 1.00 7.70 H new ATOM 0 HB2 ALA A 47 -4.070 -15.882 7.356 1.00 7.70 H new ATOM 0 HB3 ALA A 47 -4.334 -14.780 8.728 1.00 7.70 H new ATOM 111 N GLY A 48 -6.175 -12.650 7.376 1.00 5.65 N ATOM 112 CA GLY A 48 -6.997 -11.507 7.700 1.00 5.11 C ATOM 113 C GLY A 48 -8.286 -11.531 6.916 1.00 4.06 C ATOM 114 O GLY A 48 -8.411 -12.286 5.947 1.00 4.07 O ATOM 0 H GLY A 48 -6.687 -13.527 7.282 1.00 5.65 H new ATOM 0 HA2 GLY A 48 -7.216 -11.503 8.768 1.00 5.11 H new ATOM 0 HA3 GLY A 48 -6.452 -10.589 7.483 1.00 5.11 H new ATOM 118 N GLN A 49 -9.255 -10.734 7.328 1.00 3.63 N ATOM 119 CA GLN A 49 -10.515 -10.655 6.609 1.00 2.96 C ATOM 120 C GLN A 49 -10.378 -9.719 5.420 1.00 2.13 C ATOM 121 O GLN A 49 -9.557 -8.799 5.446 1.00 2.55 O ATOM 122 CB GLN A 49 -11.646 -10.193 7.526 1.00 3.66 C ATOM 123 CG GLN A 49 -11.901 -11.133 8.692 1.00 4.66 C ATOM 124 CD GLN A 49 -13.216 -10.855 9.390 1.00 5.45 C ATOM 125 OE1 GLN A 49 -13.697 -9.722 9.410 1.00 5.88 O ATOM 126 NE2 GLN A 49 -13.806 -11.889 9.964 1.00 6.04 N ATOM 0 H GLN A 49 -9.195 -10.135 8.152 1.00 3.63 H new ATOM 0 HA GLN A 49 -10.766 -11.653 6.248 1.00 2.96 H new ATOM 0 HB2 GLN A 49 -11.408 -9.202 7.913 1.00 3.66 H new ATOM 0 HB3 GLN A 49 -12.561 -10.095 6.941 1.00 3.66 H new ATOM 0 HG2 GLN A 49 -11.896 -12.162 8.332 1.00 4.66 H new ATOM 0 HG3 GLN A 49 -11.087 -11.043 9.411 1.00 4.66 H new ATOM 0 HE21 GLN A 49 -13.372 -12.811 9.923 1.00 6.04 H new ATOM 0 HE22 GLN A 49 -14.695 -11.765 10.448 1.00 6.04 H new ATOM 135 N LYS A 50 -11.189 -9.971 4.390 1.00 1.67 N ATOM 136 CA LYS A 50 -11.133 -9.246 3.118 1.00 1.23 C ATOM 137 C LYS A 50 -9.930 -9.673 2.296 1.00 1.14 C ATOM 138 O LYS A 50 -8.875 -10.009 2.833 1.00 1.86 O ATOM 139 CB LYS A 50 -11.114 -7.726 3.315 1.00 1.57 C ATOM 140 CG LYS A 50 -12.403 -7.176 3.868 1.00 1.90 C ATOM 141 CD LYS A 50 -13.528 -7.239 2.860 1.00 2.73 C ATOM 142 CE LYS A 50 -14.856 -6.934 3.523 1.00 3.21 C ATOM 143 NZ LYS A 50 -15.207 -7.950 4.550 1.00 4.04 N ATOM 0 H LYS A 50 -11.911 -10.691 4.416 1.00 1.67 H new ATOM 0 HA LYS A 50 -12.044 -9.502 2.577 1.00 1.23 H new ATOM 0 HB2 LYS A 50 -10.298 -7.465 3.989 1.00 1.57 H new ATOM 0 HB3 LYS A 50 -10.904 -7.246 2.359 1.00 1.57 H new ATOM 0 HG2 LYS A 50 -12.683 -7.738 4.759 1.00 1.90 H new ATOM 0 HG3 LYS A 50 -12.252 -6.142 4.178 1.00 1.90 H new ATOM 0 HD2 LYS A 50 -13.344 -6.526 2.057 1.00 2.73 H new ATOM 0 HD3 LYS A 50 -13.561 -8.229 2.405 1.00 2.73 H new ATOM 0 HE2 LYS A 50 -14.813 -5.948 3.987 1.00 3.21 H new ATOM 0 HE3 LYS A 50 -15.640 -6.896 2.766 1.00 3.21 H new ATOM 0 HZ1 LYS A 50 -16.238 -7.964 4.687 1.00 4.04 H new ATOM 0 HZ2 LYS A 50 -14.887 -8.888 4.234 1.00 4.04 H new ATOM 0 HZ3 LYS A 50 -14.742 -7.710 5.449 1.00 4.04 H new ATOM 157 N ALA A 51 -10.128 -9.683 0.995 1.00 0.80 N ATOM 158 CA ALA A 51 -9.069 -9.952 0.029 1.00 0.75 C ATOM 159 C ALA A 51 -9.642 -9.884 -1.377 1.00 0.83 C ATOM 160 O ALA A 51 -9.955 -10.908 -1.989 1.00 1.01 O ATOM 161 CB ALA A 51 -8.397 -11.301 0.273 1.00 0.84 C ATOM 0 H ALA A 51 -11.037 -9.503 0.568 1.00 0.80 H new ATOM 0 HA ALA A 51 -8.298 -9.191 0.149 1.00 0.75 H new ATOM 0 HB1 ALA A 51 -7.615 -11.458 -0.470 1.00 0.84 H new ATOM 0 HB2 ALA A 51 -7.957 -11.313 1.270 1.00 0.84 H new ATOM 0 HB3 ALA A 51 -9.138 -12.096 0.194 1.00 0.84 H new ATOM 167 N GLU A 52 -9.814 -8.662 -1.861 1.00 0.75 N ATOM 168 CA GLU A 52 -10.331 -8.418 -3.202 1.00 0.86 C ATOM 169 C GLU A 52 -9.435 -9.075 -4.252 1.00 0.97 C ATOM 170 O GLU A 52 -8.214 -9.150 -4.087 1.00 1.04 O ATOM 171 CB GLU A 52 -10.407 -6.915 -3.478 1.00 0.83 C ATOM 172 CG GLU A 52 -11.065 -6.099 -2.373 1.00 0.91 C ATOM 173 CD GLU A 52 -12.495 -6.515 -2.108 1.00 1.63 C ATOM 174 OE1 GLU A 52 -13.277 -6.612 -3.073 1.00 2.04 O ATOM 175 OE2 GLU A 52 -12.846 -6.744 -0.934 1.00 1.98 O ATOM 0 H GLU A 52 -9.600 -7.813 -1.337 1.00 0.75 H new ATOM 0 HA GLU A 52 -11.330 -8.850 -3.261 1.00 0.86 H new ATOM 0 HB2 GLU A 52 -9.397 -6.537 -3.638 1.00 0.83 H new ATOM 0 HB3 GLU A 52 -10.958 -6.757 -4.405 1.00 0.83 H new ATOM 0 HG2 GLU A 52 -10.485 -6.204 -1.456 1.00 0.91 H new ATOM 0 HG3 GLU A 52 -11.043 -5.044 -2.645 1.00 0.91 H new ATOM 182 N ASN A 53 -10.049 -9.551 -5.323 1.00 1.07 N ATOM 183 CA ASN A 53 -9.318 -10.189 -6.412 1.00 1.20 C ATOM 184 C ASN A 53 -9.030 -9.179 -7.509 1.00 1.20 C ATOM 185 O ASN A 53 -8.017 -9.266 -8.208 1.00 1.34 O ATOM 186 CB ASN A 53 -10.117 -11.362 -6.990 1.00 1.31 C ATOM 187 CG ASN A 53 -10.280 -12.517 -6.016 1.00 1.88 C ATOM 188 OD1 ASN A 53 -10.301 -12.329 -4.798 1.00 2.59 O ATOM 189 ND2 ASN A 53 -10.401 -13.720 -6.548 1.00 2.43 N ATOM 0 H ASN A 53 -11.058 -9.508 -5.464 1.00 1.07 H new ATOM 0 HA ASN A 53 -8.378 -10.570 -6.014 1.00 1.20 H new ATOM 0 HB2 ASN A 53 -11.103 -11.008 -7.291 1.00 1.31 H new ATOM 0 HB3 ASN A 53 -9.620 -11.723 -7.890 1.00 1.31 H new ATOM 0 HD21 ASN A 53 -10.517 -14.535 -5.945 1.00 2.43 H new ATOM 0 HD22 ASN A 53 -10.379 -13.834 -7.561 1.00 2.43 H new ATOM 196 N LEU A 54 -9.935 -8.220 -7.647 1.00 1.12 N ATOM 197 CA LEU A 54 -9.804 -7.161 -8.640 1.00 1.15 C ATOM 198 C LEU A 54 -8.870 -6.056 -8.146 1.00 1.13 C ATOM 199 O LEU A 54 -8.276 -6.160 -7.068 1.00 1.13 O ATOM 200 CB LEU A 54 -11.180 -6.584 -9.046 1.00 1.18 C ATOM 201 CG LEU A 54 -11.895 -5.684 -8.033 1.00 1.18 C ATOM 202 CD1 LEU A 54 -13.376 -5.607 -8.362 1.00 1.28 C ATOM 203 CD2 LEU A 54 -11.685 -6.161 -6.617 1.00 1.81 C ATOM 0 H LEU A 54 -10.778 -8.153 -7.076 1.00 1.12 H new ATOM 0 HA LEU A 54 -9.361 -7.605 -9.531 1.00 1.15 H new ATOM 0 HB2 LEU A 54 -11.048 -6.016 -9.967 1.00 1.18 H new ATOM 0 HB3 LEU A 54 -11.840 -7.420 -9.279 1.00 1.18 H new ATOM 0 HG LEU A 54 -11.463 -4.686 -8.104 1.00 1.18 H new ATOM 0 HD11 LEU A 54 -13.877 -4.965 -7.637 1.00 1.28 H new ATOM 0 HD12 LEU A 54 -13.505 -5.194 -9.362 1.00 1.28 H new ATOM 0 HD13 LEU A 54 -13.810 -6.606 -8.323 1.00 1.28 H new ATOM 0 HD21 LEU A 54 -12.207 -5.497 -5.928 1.00 1.81 H new ATOM 0 HD22 LEU A 54 -12.076 -7.173 -6.512 1.00 1.81 H new ATOM 0 HD23 LEU A 54 -10.620 -6.158 -6.386 1.00 1.81 H new ATOM 215 N THR A 55 -8.729 -5.015 -8.945 1.00 1.16 N ATOM 216 CA THR A 55 -7.808 -3.932 -8.636 1.00 1.21 C ATOM 217 C THR A 55 -8.367 -3.042 -7.528 1.00 1.14 C ATOM 218 O THR A 55 -9.578 -2.980 -7.334 1.00 1.09 O ATOM 219 CB THR A 55 -7.529 -3.066 -9.880 1.00 1.31 C ATOM 220 OG1 THR A 55 -8.732 -2.412 -10.303 1.00 1.30 O ATOM 221 CG2 THR A 55 -6.985 -3.913 -11.020 1.00 1.40 C ATOM 0 H THR A 55 -9.243 -4.894 -9.818 1.00 1.16 H new ATOM 0 HA THR A 55 -6.876 -4.388 -8.301 1.00 1.21 H new ATOM 0 HB THR A 55 -6.782 -2.319 -9.612 1.00 1.31 H new ATOM 0 HG1 THR A 55 -8.545 -1.863 -11.093 1.00 1.30 H new ATOM 0 HG21 THR A 55 -6.796 -3.279 -11.886 1.00 1.40 H new ATOM 0 HG22 THR A 55 -6.055 -4.388 -10.708 1.00 1.40 H new ATOM 0 HG23 THR A 55 -7.714 -4.680 -11.283 1.00 1.40 H new ATOM 229 N PRO A 56 -7.488 -2.349 -6.782 1.00 1.18 N ATOM 230 CA PRO A 56 -7.890 -1.428 -5.711 1.00 1.10 C ATOM 231 C PRO A 56 -8.863 -0.348 -6.187 1.00 1.05 C ATOM 232 O PRO A 56 -9.681 0.151 -5.411 1.00 0.97 O ATOM 233 CB PRO A 56 -6.575 -0.792 -5.246 1.00 1.21 C ATOM 234 CG PRO A 56 -5.561 -1.155 -6.274 1.00 1.38 C ATOM 235 CD PRO A 56 -6.030 -2.429 -6.909 1.00 1.34 C ATOM 0 HA PRO A 56 -8.421 -1.958 -4.920 1.00 1.10 H new ATOM 0 HB2 PRO A 56 -6.674 0.290 -5.159 1.00 1.21 H new ATOM 0 HB3 PRO A 56 -6.286 -1.165 -4.263 1.00 1.21 H new ATOM 0 HG2 PRO A 56 -5.464 -0.364 -7.018 1.00 1.38 H new ATOM 0 HG3 PRO A 56 -4.579 -1.287 -5.820 1.00 1.38 H new ATOM 0 HD2 PRO A 56 -5.720 -2.497 -7.952 1.00 1.34 H new ATOM 0 HD3 PRO A 56 -5.629 -3.305 -6.399 1.00 1.34 H new ATOM 243 N ASP A 57 -8.775 0.010 -7.462 1.00 1.13 N ATOM 244 CA ASP A 57 -9.706 0.972 -8.038 1.00 1.14 C ATOM 245 C ASP A 57 -11.076 0.334 -8.177 1.00 1.07 C ATOM 246 O ASP A 57 -12.093 0.911 -7.787 1.00 1.05 O ATOM 247 CB ASP A 57 -9.223 1.462 -9.401 1.00 1.30 C ATOM 248 CG ASP A 57 -10.173 2.476 -10.004 1.00 1.61 C ATOM 249 OD1 ASP A 57 -10.050 3.675 -9.676 1.00 1.67 O ATOM 250 OD2 ASP A 57 -11.056 2.079 -10.795 1.00 2.15 O ATOM 0 H ASP A 57 -8.075 -0.348 -8.112 1.00 1.13 H new ATOM 0 HA ASP A 57 -9.765 1.832 -7.371 1.00 1.14 H new ATOM 0 HB2 ASP A 57 -8.234 1.908 -9.297 1.00 1.30 H new ATOM 0 HB3 ASP A 57 -9.121 0.613 -10.077 1.00 1.30 H new ATOM 255 N GLU A 58 -11.083 -0.876 -8.721 1.00 1.09 N ATOM 256 CA GLU A 58 -12.294 -1.669 -8.839 1.00 1.05 C ATOM 257 C GLU A 58 -12.883 -1.958 -7.460 1.00 0.93 C ATOM 258 O GLU A 58 -14.091 -2.089 -7.312 1.00 0.93 O ATOM 259 CB GLU A 58 -11.976 -2.975 -9.562 1.00 1.12 C ATOM 260 CG GLU A 58 -11.760 -2.826 -11.045 1.00 1.26 C ATOM 261 CD GLU A 58 -13.000 -2.361 -11.774 1.00 1.83 C ATOM 262 OE1 GLU A 58 -13.901 -3.190 -12.013 1.00 2.54 O ATOM 263 OE2 GLU A 58 -13.078 -1.166 -12.124 1.00 2.17 O ATOM 0 H GLU A 58 -10.249 -1.332 -9.092 1.00 1.09 H new ATOM 0 HA GLU A 58 -13.032 -1.108 -9.413 1.00 1.05 H new ATOM 0 HB2 GLU A 58 -11.082 -3.414 -9.119 1.00 1.12 H new ATOM 0 HB3 GLU A 58 -12.792 -3.678 -9.394 1.00 1.12 H new ATOM 0 HG2 GLU A 58 -10.953 -2.115 -11.220 1.00 1.26 H new ATOM 0 HG3 GLU A 58 -11.438 -3.782 -11.458 1.00 1.26 H new ATOM 270 N VAL A 59 -12.012 -2.058 -6.462 1.00 0.86 N ATOM 271 CA VAL A 59 -12.425 -2.261 -5.074 1.00 0.75 C ATOM 272 C VAL A 59 -13.303 -1.120 -4.585 1.00 0.71 C ATOM 273 O VAL A 59 -14.454 -1.314 -4.190 1.00 0.71 O ATOM 274 CB VAL A 59 -11.199 -2.342 -4.134 1.00 0.72 C ATOM 275 CG1 VAL A 59 -11.624 -2.403 -2.673 1.00 0.63 C ATOM 276 CG2 VAL A 59 -10.324 -3.528 -4.484 1.00 0.82 C ATOM 0 H VAL A 59 -11.002 -2.001 -6.589 1.00 0.86 H new ATOM 0 HA VAL A 59 -12.982 -3.198 -5.052 1.00 0.75 H new ATOM 0 HB VAL A 59 -10.616 -1.432 -4.277 1.00 0.72 H new ATOM 0 HG11 VAL A 59 -10.739 -2.459 -2.039 1.00 0.63 H new ATOM 0 HG12 VAL A 59 -12.194 -1.508 -2.422 1.00 0.63 H new ATOM 0 HG13 VAL A 59 -12.243 -3.285 -2.511 1.00 0.63 H new ATOM 0 HG21 VAL A 59 -9.469 -3.562 -3.808 1.00 0.82 H new ATOM 0 HG22 VAL A 59 -10.901 -4.447 -4.385 1.00 0.82 H new ATOM 0 HG23 VAL A 59 -9.971 -3.429 -5.511 1.00 0.82 H new ATOM 286 N SER A 60 -12.735 0.066 -4.624 1.00 0.70 N ATOM 287 CA SER A 60 -13.303 1.232 -4.018 1.00 0.70 C ATOM 288 C SER A 60 -14.597 1.669 -4.686 1.00 0.74 C ATOM 289 O SER A 60 -15.658 1.691 -4.063 1.00 0.72 O ATOM 290 CB SER A 60 -12.261 2.321 -4.149 1.00 0.76 C ATOM 291 OG SER A 60 -10.999 1.885 -3.667 1.00 0.97 O ATOM 0 H SER A 60 -11.845 0.241 -5.091 1.00 0.70 H new ATOM 0 HA SER A 60 -13.559 1.021 -2.980 1.00 0.70 H new ATOM 0 HB2 SER A 60 -12.171 2.618 -5.194 1.00 0.76 H new ATOM 0 HB3 SER A 60 -12.581 3.203 -3.593 1.00 0.76 H new ATOM 0 HG SER A 60 -10.521 1.414 -4.381 1.00 0.97 H new ATOM 297 N LYS A 61 -14.488 2.022 -5.952 1.00 0.87 N ATOM 298 CA LYS A 61 -15.634 2.468 -6.739 1.00 0.96 C ATOM 299 C LYS A 61 -16.779 1.449 -6.708 1.00 0.94 C ATOM 300 O LYS A 61 -17.943 1.806 -6.892 1.00 1.01 O ATOM 301 CB LYS A 61 -15.205 2.747 -8.177 1.00 1.10 C ATOM 302 CG LYS A 61 -14.279 3.948 -8.304 1.00 1.17 C ATOM 303 CD LYS A 61 -13.895 4.211 -9.751 1.00 1.36 C ATOM 304 CE LYS A 61 -13.126 5.515 -9.901 1.00 2.01 C ATOM 305 NZ LYS A 61 -11.864 5.519 -9.114 1.00 2.54 N ATOM 0 H LYS A 61 -13.608 2.010 -6.468 1.00 0.87 H new ATOM 0 HA LYS A 61 -16.007 3.389 -6.291 1.00 0.96 H new ATOM 0 HB2 LYS A 61 -14.704 1.866 -8.577 1.00 1.10 H new ATOM 0 HB3 LYS A 61 -16.092 2.914 -8.788 1.00 1.10 H new ATOM 0 HG2 LYS A 61 -14.768 4.830 -7.891 1.00 1.17 H new ATOM 0 HG3 LYS A 61 -13.379 3.777 -7.714 1.00 1.17 H new ATOM 0 HD2 LYS A 61 -13.288 3.386 -10.122 1.00 1.36 H new ATOM 0 HD3 LYS A 61 -14.795 4.246 -10.366 1.00 1.36 H new ATOM 0 HE2 LYS A 61 -12.896 5.680 -10.954 1.00 2.01 H new ATOM 0 HE3 LYS A 61 -13.755 6.345 -9.579 1.00 2.01 H new ATOM 0 HZ1 LYS A 61 -11.222 6.245 -9.491 1.00 2.54 H new ATOM 0 HZ2 LYS A 61 -12.077 5.729 -8.118 1.00 2.54 H new ATOM 0 HZ3 LYS A 61 -11.410 4.586 -9.182 1.00 2.54 H new ATOM 319 N ARG A 62 -16.440 0.184 -6.487 1.00 0.88 N ATOM 320 CA ARG A 62 -17.438 -0.855 -6.282 1.00 0.89 C ATOM 321 C ARG A 62 -18.242 -0.595 -5.013 1.00 0.77 C ATOM 322 O ARG A 62 -19.470 -0.510 -5.045 1.00 0.82 O ATOM 323 CB ARG A 62 -16.765 -2.220 -6.153 1.00 0.93 C ATOM 324 CG ARG A 62 -17.136 -3.211 -7.235 1.00 1.21 C ATOM 325 CD ARG A 62 -16.501 -4.563 -6.969 1.00 1.21 C ATOM 326 NE ARG A 62 -16.928 -5.128 -5.687 1.00 1.85 N ATOM 327 CZ ARG A 62 -16.094 -5.597 -4.758 1.00 2.40 C ATOM 328 NH1 ARG A 62 -14.784 -5.580 -4.965 1.00 2.53 N ATOM 329 NH2 ARG A 62 -16.575 -6.084 -3.619 1.00 3.33 N ATOM 0 H ARG A 62 -15.476 -0.146 -6.445 1.00 0.88 H new ATOM 0 HA ARG A 62 -18.104 -0.845 -7.145 1.00 0.89 H new ATOM 0 HB2 ARG A 62 -15.684 -2.080 -6.162 1.00 0.93 H new ATOM 0 HB3 ARG A 62 -17.023 -2.647 -5.184 1.00 0.93 H new ATOM 0 HG2 ARG A 62 -18.220 -3.316 -7.282 1.00 1.21 H new ATOM 0 HG3 ARG A 62 -16.810 -2.836 -8.205 1.00 1.21 H new ATOM 0 HD2 ARG A 62 -16.763 -5.251 -7.773 1.00 1.21 H new ATOM 0 HD3 ARG A 62 -15.416 -4.461 -6.977 1.00 1.21 H new ATOM 0 HE ARG A 62 -17.928 -5.165 -5.492 1.00 1.85 H new ATOM 0 HH11 ARG A 62 -14.410 -5.207 -5.838 1.00 2.53 H new ATOM 0 HH12 ARG A 62 -14.150 -5.940 -4.251 1.00 2.53 H new ATOM 0 HH21 ARG A 62 -17.582 -6.099 -3.456 1.00 3.33 H new ATOM 0 HH22 ARG A 62 -15.937 -6.443 -2.908 1.00 3.33 H new ATOM 343 N GLU A 63 -17.532 -0.454 -3.901 1.00 0.68 N ATOM 344 CA GLU A 63 -18.161 -0.393 -2.589 1.00 0.63 C ATOM 345 C GLU A 63 -18.727 0.984 -2.275 1.00 0.66 C ATOM 346 O GLU A 63 -19.706 1.103 -1.540 1.00 0.73 O ATOM 347 CB GLU A 63 -17.177 -0.829 -1.507 1.00 0.59 C ATOM 348 CG GLU A 63 -15.865 -0.079 -1.484 1.00 0.58 C ATOM 349 CD GLU A 63 -15.093 -0.378 -0.222 1.00 0.65 C ATOM 350 OE1 GLU A 63 -15.354 -1.390 0.425 1.00 1.21 O ATOM 351 OE2 GLU A 63 -14.187 0.405 0.093 1.00 1.25 O ATOM 0 H GLU A 63 -16.515 -0.379 -3.883 1.00 0.68 H new ATOM 0 HA GLU A 63 -19.004 -1.084 -2.606 1.00 0.63 H new ATOM 0 HB2 GLU A 63 -17.658 -0.716 -0.535 1.00 0.59 H new ATOM 0 HB3 GLU A 63 -16.967 -1.891 -1.637 1.00 0.59 H new ATOM 0 HG2 GLU A 63 -15.269 -0.356 -2.353 1.00 0.58 H new ATOM 0 HG3 GLU A 63 -16.053 0.992 -1.554 1.00 0.58 H new ATOM 358 N GLY A 64 -18.112 2.022 -2.809 1.00 0.69 N ATOM 359 CA GLY A 64 -18.644 3.351 -2.608 1.00 0.74 C ATOM 360 C GLY A 64 -17.575 4.400 -2.429 1.00 0.72 C ATOM 361 O GLY A 64 -17.572 5.405 -3.138 1.00 0.86 O ATOM 0 H GLY A 64 -17.263 1.972 -3.372 1.00 0.69 H new ATOM 0 HA2 GLY A 64 -19.267 3.619 -3.462 1.00 0.74 H new ATOM 0 HA3 GLY A 64 -19.290 3.347 -1.730 1.00 0.74 H new ATOM 365 N ILE A 65 -16.666 4.182 -1.488 1.00 0.62 N ATOM 366 CA ILE A 65 -15.624 5.168 -1.219 1.00 0.67 C ATOM 367 C ILE A 65 -14.595 5.187 -2.340 1.00 0.81 C ATOM 368 O ILE A 65 -14.241 4.147 -2.884 1.00 1.76 O ATOM 369 CB ILE A 65 -14.908 4.935 0.132 1.00 0.61 C ATOM 370 CG1 ILE A 65 -14.258 3.555 0.200 1.00 0.53 C ATOM 371 CG2 ILE A 65 -15.878 5.110 1.283 1.00 0.89 C ATOM 372 CD1 ILE A 65 -13.511 3.311 1.495 1.00 0.49 C ATOM 0 H ILE A 65 -16.627 3.346 -0.906 1.00 0.62 H new ATOM 0 HA ILE A 65 -16.128 6.133 -1.163 1.00 0.67 H new ATOM 0 HB ILE A 65 -14.117 5.680 0.213 1.00 0.61 H new ATOM 0 HG12 ILE A 65 -15.027 2.792 0.082 1.00 0.53 H new ATOM 0 HG13 ILE A 65 -13.568 3.444 -0.637 1.00 0.53 H new ATOM 0 HG21 ILE A 65 -15.358 4.942 2.226 1.00 0.89 H new ATOM 0 HG22 ILE A 65 -16.283 6.122 1.267 1.00 0.89 H new ATOM 0 HG23 ILE A 65 -16.692 4.392 1.185 1.00 0.89 H new ATOM 0 HD11 ILE A 65 -13.073 2.313 1.480 1.00 0.49 H new ATOM 0 HD12 ILE A 65 -12.720 4.053 1.604 1.00 0.49 H new ATOM 0 HD13 ILE A 65 -14.202 3.391 2.334 1.00 0.49 H new ATOM 384 N ASN A 66 -14.130 6.374 -2.688 1.00 0.75 N ATOM 385 CA ASN A 66 -13.141 6.528 -3.747 1.00 0.69 C ATOM 386 C ASN A 66 -11.889 7.190 -3.178 1.00 0.61 C ATOM 387 O ASN A 66 -11.072 7.762 -3.905 1.00 0.64 O ATOM 388 CB ASN A 66 -13.717 7.365 -4.896 1.00 0.83 C ATOM 389 CG ASN A 66 -12.835 7.359 -6.135 1.00 1.38 C ATOM 390 OD1 ASN A 66 -12.132 6.387 -6.409 1.00 2.09 O ATOM 391 ND2 ASN A 66 -12.868 8.445 -6.893 1.00 2.10 N ATOM 0 H ASN A 66 -14.421 7.249 -2.253 1.00 0.75 H new ATOM 0 HA ASN A 66 -12.878 5.546 -4.141 1.00 0.69 H new ATOM 0 HB2 ASN A 66 -14.704 6.983 -5.157 1.00 0.83 H new ATOM 0 HB3 ASN A 66 -13.852 8.392 -4.558 1.00 0.83 H new ATOM 0 HD21 ASN A 66 -12.298 8.495 -7.737 1.00 2.10 H new ATOM 0 HD22 ASN A 66 -13.464 9.231 -6.633 1.00 2.10 H new ATOM 398 N ALA A 67 -11.753 7.107 -1.860 1.00 0.54 N ATOM 399 CA ALA A 67 -10.633 7.722 -1.157 1.00 0.49 C ATOM 400 C ALA A 67 -9.298 7.066 -1.517 1.00 0.44 C ATOM 401 O ALA A 67 -9.258 6.007 -2.154 1.00 0.45 O ATOM 402 CB ALA A 67 -10.869 7.656 0.341 1.00 0.47 C ATOM 0 H ALA A 67 -12.409 6.616 -1.253 1.00 0.54 H new ATOM 0 HA ALA A 67 -10.573 8.764 -1.471 1.00 0.49 H new ATOM 0 HB1 ALA A 67 -10.030 8.117 0.862 1.00 0.47 H new ATOM 0 HB2 ALA A 67 -11.787 8.189 0.589 1.00 0.47 H new ATOM 0 HB3 ALA A 67 -10.960 6.615 0.649 1.00 0.47 H new ATOM 408 N GLU A 68 -8.212 7.708 -1.099 1.00 0.44 N ATOM 409 CA GLU A 68 -6.863 7.223 -1.369 1.00 0.42 C ATOM 410 C GLU A 68 -6.590 5.934 -0.610 1.00 0.34 C ATOM 411 O GLU A 68 -6.866 5.840 0.586 1.00 0.35 O ATOM 412 CB GLU A 68 -5.832 8.276 -0.959 1.00 0.50 C ATOM 413 CG GLU A 68 -5.937 9.576 -1.735 1.00 0.78 C ATOM 414 CD GLU A 68 -5.064 10.667 -1.153 1.00 1.79 C ATOM 415 OE1 GLU A 68 -3.833 10.628 -1.359 1.00 2.28 O ATOM 416 OE2 GLU A 68 -5.608 11.580 -0.492 1.00 2.59 O ATOM 0 H GLU A 68 -8.242 8.577 -0.565 1.00 0.44 H new ATOM 0 HA GLU A 68 -6.783 7.029 -2.439 1.00 0.42 H new ATOM 0 HB2 GLU A 68 -5.948 8.489 0.104 1.00 0.50 H new ATOM 0 HB3 GLU A 68 -4.832 7.863 -1.095 1.00 0.50 H new ATOM 0 HG2 GLU A 68 -5.652 9.401 -2.772 1.00 0.78 H new ATOM 0 HG3 GLU A 68 -6.975 9.909 -1.742 1.00 0.78 H new ATOM 423 N GLN A 69 -6.037 4.953 -1.301 1.00 0.31 N ATOM 424 CA GLN A 69 -5.720 3.676 -0.686 1.00 0.24 C ATOM 425 C GLN A 69 -4.331 3.708 -0.077 1.00 0.21 C ATOM 426 O GLN A 69 -3.329 3.697 -0.789 1.00 0.27 O ATOM 427 CB GLN A 69 -5.833 2.541 -1.700 1.00 0.29 C ATOM 428 CG GLN A 69 -7.268 2.213 -2.067 1.00 0.43 C ATOM 429 CD GLN A 69 -7.549 0.729 -2.011 1.00 0.80 C ATOM 430 OE1 GLN A 69 -6.901 -0.003 -1.269 1.00 1.64 O ATOM 431 NE2 GLN A 69 -8.533 0.276 -2.765 1.00 0.76 N ATOM 0 H GLN A 69 -5.798 5.016 -2.290 1.00 0.31 H new ATOM 0 HA GLN A 69 -6.443 3.494 0.110 1.00 0.24 H new ATOM 0 HB2 GLN A 69 -5.286 2.812 -2.603 1.00 0.29 H new ATOM 0 HB3 GLN A 69 -5.355 1.650 -1.294 1.00 0.29 H new ATOM 0 HG2 GLN A 69 -7.943 2.734 -1.388 1.00 0.43 H new ATOM 0 HG3 GLN A 69 -7.478 2.583 -3.071 1.00 0.43 H new ATOM 0 HE21 GLN A 69 -9.049 0.916 -3.369 1.00 0.76 H new ATOM 0 HE22 GLN A 69 -8.778 -0.714 -2.744 1.00 0.76 H new ATOM 440 N ILE A 70 -4.284 3.761 1.244 1.00 0.19 N ATOM 441 CA ILE A 70 -3.025 3.831 1.965 1.00 0.17 C ATOM 442 C ILE A 70 -2.613 2.448 2.457 1.00 0.14 C ATOM 443 O ILE A 70 -3.111 1.974 3.475 1.00 0.14 O ATOM 444 CB ILE A 70 -3.132 4.787 3.168 1.00 0.21 C ATOM 445 CG1 ILE A 70 -3.719 6.128 2.718 1.00 0.27 C ATOM 446 CG2 ILE A 70 -1.766 4.989 3.810 1.00 0.21 C ATOM 447 CD1 ILE A 70 -4.029 7.066 3.860 1.00 0.36 C ATOM 0 H ILE A 70 -5.110 3.757 1.842 1.00 0.19 H new ATOM 0 HA ILE A 70 -2.270 4.210 1.276 1.00 0.17 H new ATOM 0 HB ILE A 70 -3.796 4.346 3.912 1.00 0.21 H new ATOM 0 HG12 ILE A 70 -3.017 6.614 2.041 1.00 0.27 H new ATOM 0 HG13 ILE A 70 -4.632 5.944 2.152 1.00 0.27 H new ATOM 0 HG21 ILE A 70 -1.859 5.667 4.658 1.00 0.21 H new ATOM 0 HG22 ILE A 70 -1.380 4.029 4.153 1.00 0.21 H new ATOM 0 HG23 ILE A 70 -1.080 5.416 3.078 1.00 0.21 H new ATOM 0 HD11 ILE A 70 -4.441 7.995 3.466 1.00 0.36 H new ATOM 0 HD12 ILE A 70 -4.755 6.600 4.526 1.00 0.36 H new ATOM 0 HD13 ILE A 70 -3.115 7.281 4.413 1.00 0.36 H new ATOM 459 N VAL A 71 -1.720 1.797 1.725 1.00 0.15 N ATOM 460 CA VAL A 71 -1.243 0.473 2.103 1.00 0.15 C ATOM 461 C VAL A 71 -0.475 0.557 3.423 1.00 0.14 C ATOM 462 O VAL A 71 0.591 1.174 3.493 1.00 0.17 O ATOM 463 CB VAL A 71 -0.333 -0.149 1.013 1.00 0.18 C ATOM 464 CG1 VAL A 71 0.053 -1.575 1.377 1.00 0.19 C ATOM 465 CG2 VAL A 71 -1.007 -0.124 -0.353 1.00 0.20 C ATOM 0 H VAL A 71 -1.311 2.164 0.866 1.00 0.15 H new ATOM 0 HA VAL A 71 -2.115 -0.171 2.217 1.00 0.15 H new ATOM 0 HB VAL A 71 0.572 0.457 0.960 1.00 0.18 H new ATOM 0 HG11 VAL A 71 0.691 -1.990 0.597 1.00 0.19 H new ATOM 0 HG12 VAL A 71 0.591 -1.576 2.325 1.00 0.19 H new ATOM 0 HG13 VAL A 71 -0.847 -2.183 1.471 1.00 0.19 H new ATOM 0 HG21 VAL A 71 -0.343 -0.567 -1.095 1.00 0.20 H new ATOM 0 HG22 VAL A 71 -1.935 -0.693 -0.311 1.00 0.20 H new ATOM 0 HG23 VAL A 71 -1.226 0.907 -0.632 1.00 0.20 H new ATOM 475 N ILE A 72 -1.039 -0.033 4.470 1.00 0.14 N ATOM 476 CA ILE A 72 -0.429 -0.004 5.793 1.00 0.17 C ATOM 477 C ILE A 72 0.282 -1.312 6.099 1.00 0.22 C ATOM 478 O ILE A 72 1.172 -1.364 6.948 1.00 0.29 O ATOM 479 CB ILE A 72 -1.474 0.251 6.886 1.00 0.18 C ATOM 480 CG1 ILE A 72 -2.628 -0.745 6.723 1.00 0.19 C ATOM 481 CG2 ILE A 72 -1.958 1.691 6.812 1.00 0.19 C ATOM 482 CD1 ILE A 72 -3.545 -0.843 7.915 1.00 0.21 C ATOM 0 H ILE A 72 -1.923 -0.540 4.427 1.00 0.14 H new ATOM 0 HA ILE A 72 0.293 0.812 5.786 1.00 0.17 H new ATOM 0 HB ILE A 72 -1.032 0.102 7.871 1.00 0.18 H new ATOM 0 HG12 ILE A 72 -3.216 -0.460 5.851 1.00 0.19 H new ATOM 0 HG13 ILE A 72 -2.213 -1.732 6.518 1.00 0.19 H new ATOM 0 HG21 ILE A 72 -2.700 1.866 7.591 1.00 0.19 H new ATOM 0 HG22 ILE A 72 -1.115 2.366 6.956 1.00 0.19 H new ATOM 0 HG23 ILE A 72 -2.407 1.874 5.836 1.00 0.19 H new ATOM 0 HD11 ILE A 72 -4.331 -1.570 7.711 1.00 0.21 H new ATOM 0 HD12 ILE A 72 -2.975 -1.161 8.788 1.00 0.21 H new ATOM 0 HD13 ILE A 72 -3.994 0.131 8.110 1.00 0.21 H new ATOM 494 N LYS A 73 -0.117 -2.366 5.409 1.00 0.21 N ATOM 495 CA LYS A 73 0.528 -3.652 5.561 1.00 0.26 C ATOM 496 C LYS A 73 0.711 -4.314 4.211 1.00 0.24 C ATOM 497 O LYS A 73 -0.206 -4.339 3.394 1.00 0.25 O ATOM 498 CB LYS A 73 -0.267 -4.558 6.503 1.00 0.35 C ATOM 499 CG LYS A 73 0.358 -5.925 6.689 1.00 0.41 C ATOM 500 CD LYS A 73 -0.372 -7.030 5.946 1.00 0.59 C ATOM 501 CE LYS A 73 -1.471 -7.627 6.809 1.00 1.22 C ATOM 502 NZ LYS A 73 -2.020 -8.888 6.237 1.00 1.94 N ATOM 0 H LYS A 73 -0.885 -2.353 4.738 1.00 0.21 H new ATOM 0 HA LYS A 73 1.511 -3.489 6.004 1.00 0.26 H new ATOM 0 HB2 LYS A 73 -0.356 -4.072 7.474 1.00 0.35 H new ATOM 0 HB3 LYS A 73 -1.278 -4.678 6.113 1.00 0.35 H new ATOM 0 HG2 LYS A 73 1.393 -5.892 6.349 1.00 0.41 H new ATOM 0 HG3 LYS A 73 0.379 -6.165 7.752 1.00 0.41 H new ATOM 0 HD2 LYS A 73 -0.801 -6.633 5.026 1.00 0.59 H new ATOM 0 HD3 LYS A 73 0.334 -7.809 5.659 1.00 0.59 H new ATOM 0 HE2 LYS A 73 -1.079 -7.824 7.807 1.00 1.22 H new ATOM 0 HE3 LYS A 73 -2.276 -6.901 6.921 1.00 1.22 H new ATOM 0 HZ1 LYS A 73 -2.873 -9.166 6.763 1.00 1.94 H new ATOM 0 HZ2 LYS A 73 -2.264 -8.738 5.237 1.00 1.94 H new ATOM 0 HZ3 LYS A 73 -1.307 -9.642 6.311 1.00 1.94 H new ATOM 516 N ILE A 74 1.899 -4.844 3.988 1.00 0.28 N ATOM 517 CA ILE A 74 2.239 -5.470 2.718 1.00 0.31 C ATOM 518 C ILE A 74 2.627 -6.927 2.945 1.00 0.38 C ATOM 519 O ILE A 74 3.365 -7.228 3.884 1.00 0.41 O ATOM 520 CB ILE A 74 3.450 -4.798 2.038 1.00 0.35 C ATOM 521 CG1 ILE A 74 3.442 -3.277 2.170 1.00 0.38 C ATOM 522 CG2 ILE A 74 3.487 -5.182 0.576 1.00 0.40 C ATOM 523 CD1 ILE A 74 4.756 -2.655 1.746 1.00 0.44 C ATOM 0 H ILE A 74 2.653 -4.855 4.675 1.00 0.28 H new ATOM 0 HA ILE A 74 1.358 -5.372 2.084 1.00 0.31 H new ATOM 0 HB ILE A 74 4.343 -5.156 2.551 1.00 0.35 H new ATOM 0 HG12 ILE A 74 2.636 -2.866 1.562 1.00 0.38 H new ATOM 0 HG13 ILE A 74 3.231 -3.006 3.204 1.00 0.38 H new ATOM 0 HG21 ILE A 74 4.343 -4.707 0.097 1.00 0.40 H new ATOM 0 HG22 ILE A 74 3.576 -6.265 0.486 1.00 0.40 H new ATOM 0 HG23 ILE A 74 2.569 -4.852 0.090 1.00 0.40 H new ATOM 0 HD11 ILE A 74 4.699 -1.572 1.859 1.00 0.44 H new ATOM 0 HD12 ILE A 74 5.561 -3.043 2.371 1.00 0.44 H new ATOM 0 HD13 ILE A 74 4.955 -2.901 0.703 1.00 0.44 H new ATOM 535 N THR A 75 2.148 -7.821 2.092 1.00 0.45 N ATOM 536 CA THR A 75 2.588 -9.213 2.110 1.00 0.54 C ATOM 537 C THR A 75 2.680 -9.747 0.683 1.00 0.60 C ATOM 538 O THR A 75 2.333 -9.044 -0.269 1.00 0.71 O ATOM 539 CB THR A 75 1.650 -10.133 2.940 1.00 0.69 C ATOM 540 OG1 THR A 75 0.316 -10.104 2.421 1.00 0.79 O ATOM 541 CG2 THR A 75 1.627 -9.733 4.406 1.00 0.72 C ATOM 0 H THR A 75 1.453 -7.609 1.376 1.00 0.45 H new ATOM 0 HA THR A 75 3.567 -9.226 2.589 1.00 0.54 H new ATOM 0 HB THR A 75 2.047 -11.145 2.861 1.00 0.69 H new ATOM 0 HG1 THR A 75 0.134 -9.222 2.035 1.00 0.79 H new ATOM 0 HG21 THR A 75 0.961 -10.399 4.954 1.00 0.72 H new ATOM 0 HG22 THR A 75 2.633 -9.806 4.819 1.00 0.72 H new ATOM 0 HG23 THR A 75 1.271 -8.707 4.498 1.00 0.72 H new ATOM 549 N ASP A 76 3.145 -10.978 0.530 1.00 0.70 N ATOM 550 CA ASP A 76 3.179 -11.622 -0.779 1.00 0.82 C ATOM 551 C ASP A 76 1.780 -12.092 -1.155 1.00 0.90 C ATOM 552 O ASP A 76 1.478 -12.346 -2.322 1.00 1.08 O ATOM 553 CB ASP A 76 4.140 -12.817 -0.784 1.00 1.00 C ATOM 554 CG ASP A 76 5.600 -12.417 -0.806 1.00 1.46 C ATOM 555 OD1 ASP A 76 6.127 -12.128 -1.901 1.00 2.01 O ATOM 556 OD2 ASP A 76 6.235 -12.413 0.268 1.00 2.15 O ATOM 0 H ASP A 76 3.504 -11.552 1.293 1.00 0.70 H new ATOM 0 HA ASP A 76 3.534 -10.894 -1.508 1.00 0.82 H new ATOM 0 HB2 ASP A 76 3.952 -13.428 0.099 1.00 1.00 H new ATOM 0 HB3 ASP A 76 3.929 -13.440 -1.653 1.00 1.00 H new ATOM 561 N GLN A 77 0.927 -12.183 -0.145 1.00 0.94 N ATOM 562 CA GLN A 77 -0.438 -12.661 -0.313 1.00 1.14 C ATOM 563 C GLN A 77 -1.399 -11.488 -0.440 1.00 1.11 C ATOM 564 O GLN A 77 -2.600 -11.619 -0.208 1.00 1.49 O ATOM 565 CB GLN A 77 -0.827 -13.514 0.885 1.00 1.36 C ATOM 566 CG GLN A 77 0.151 -14.643 1.168 1.00 1.89 C ATOM 567 CD GLN A 77 -0.210 -15.436 2.407 1.00 2.52 C ATOM 568 OE1 GLN A 77 0.668 -15.941 3.106 1.00 2.98 O ATOM 569 NE2 GLN A 77 -1.499 -15.562 2.681 1.00 3.19 N ATOM 0 H GLN A 77 1.162 -11.928 0.814 1.00 0.94 H new ATOM 0 HA GLN A 77 -0.494 -13.259 -1.223 1.00 1.14 H new ATOM 0 HB2 GLN A 77 -0.899 -12.877 1.767 1.00 1.36 H new ATOM 0 HB3 GLN A 77 -1.817 -13.936 0.714 1.00 1.36 H new ATOM 0 HG2 GLN A 77 0.183 -15.314 0.309 1.00 1.89 H new ATOM 0 HG3 GLN A 77 1.152 -14.229 1.286 1.00 1.89 H new ATOM 0 HE21 GLN A 77 -2.194 -15.127 2.075 1.00 3.19 H new ATOM 0 HE22 GLN A 77 -1.797 -16.094 3.499 1.00 3.19 H new ATOM 578 N GLY A 78 -0.851 -10.340 -0.783 1.00 0.78 N ATOM 579 CA GLY A 78 -1.653 -9.149 -0.952 1.00 0.78 C ATOM 580 C GLY A 78 -1.288 -8.101 0.069 1.00 0.72 C ATOM 581 O GLY A 78 -0.294 -8.246 0.775 1.00 0.99 O ATOM 0 H GLY A 78 0.147 -10.208 -0.950 1.00 0.78 H new ATOM 0 HA2 GLY A 78 -1.509 -8.749 -1.956 1.00 0.78 H new ATOM 0 HA3 GLY A 78 -2.709 -9.401 -0.858 1.00 0.78 H new ATOM 585 N TYR A 79 -2.063 -7.038 0.156 1.00 0.43 N ATOM 586 CA TYR A 79 -1.782 -5.999 1.132 1.00 0.36 C ATOM 587 C TYR A 79 -3.065 -5.502 1.765 1.00 0.28 C ATOM 588 O TYR A 79 -4.163 -5.791 1.286 1.00 0.28 O ATOM 589 CB TYR A 79 -1.028 -4.823 0.521 1.00 0.40 C ATOM 590 CG TYR A 79 -0.364 -5.131 -0.785 1.00 1.14 C ATOM 591 CD1 TYR A 79 0.819 -5.843 -0.844 1.00 2.36 C ATOM 592 CD2 TYR A 79 -0.934 -4.705 -1.954 1.00 1.23 C ATOM 593 CE1 TYR A 79 1.422 -6.121 -2.049 1.00 3.09 C ATOM 594 CE2 TYR A 79 -0.347 -4.973 -3.169 1.00 1.86 C ATOM 595 CZ TYR A 79 0.838 -5.682 -3.210 1.00 2.67 C ATOM 596 OH TYR A 79 1.446 -5.948 -4.411 1.00 3.47 O ATOM 0 H TYR A 79 -2.882 -6.870 -0.428 1.00 0.43 H new ATOM 0 HA TYR A 79 -1.145 -6.447 1.895 1.00 0.36 H new ATOM 0 HB2 TYR A 79 -1.723 -3.996 0.376 1.00 0.40 H new ATOM 0 HB3 TYR A 79 -0.272 -4.483 1.229 1.00 0.40 H new ATOM 0 HD1 TYR A 79 1.278 -6.187 0.071 1.00 2.36 H new ATOM 0 HD2 TYR A 79 -1.860 -4.149 -1.922 1.00 1.23 H new ATOM 0 HE1 TYR A 79 2.346 -6.679 -2.081 1.00 3.09 H new ATOM 0 HE2 TYR A 79 -0.809 -4.632 -4.084 1.00 1.86 H new ATOM 0 HH TYR A 79 0.978 -6.684 -4.859 1.00 3.47 H new ATOM 606 N VAL A 80 -2.917 -4.763 2.848 1.00 0.29 N ATOM 607 CA VAL A 80 -4.051 -4.195 3.545 1.00 0.27 C ATOM 608 C VAL A 80 -3.901 -2.688 3.587 1.00 0.21 C ATOM 609 O VAL A 80 -2.863 -2.172 4.008 1.00 0.19 O ATOM 610 CB VAL A 80 -4.173 -4.741 4.980 1.00 0.28 C ATOM 611 CG1 VAL A 80 -5.537 -4.423 5.570 1.00 0.28 C ATOM 612 CG2 VAL A 80 -3.905 -6.235 5.004 1.00 0.40 C ATOM 0 H VAL A 80 -2.013 -4.542 3.266 1.00 0.29 H new ATOM 0 HA VAL A 80 -4.957 -4.474 3.006 1.00 0.27 H new ATOM 0 HB VAL A 80 -3.422 -4.249 5.598 1.00 0.28 H new ATOM 0 HG11 VAL A 80 -5.596 -4.820 6.584 1.00 0.28 H new ATOM 0 HG12 VAL A 80 -5.680 -3.343 5.594 1.00 0.28 H new ATOM 0 HG13 VAL A 80 -6.314 -4.878 4.956 1.00 0.28 H new ATOM 0 HG21 VAL A 80 -3.995 -6.604 6.025 1.00 0.40 H new ATOM 0 HG22 VAL A 80 -4.629 -6.745 4.368 1.00 0.40 H new ATOM 0 HG23 VAL A 80 -2.898 -6.430 4.635 1.00 0.40 H new ATOM 622 N THR A 81 -4.916 -1.990 3.127 1.00 0.22 N ATOM 623 CA THR A 81 -4.865 -0.549 3.028 1.00 0.22 C ATOM 624 C THR A 81 -5.806 0.103 4.030 1.00 0.22 C ATOM 625 O THR A 81 -6.852 -0.444 4.361 1.00 0.35 O ATOM 626 CB THR A 81 -5.247 -0.096 1.608 1.00 0.32 C ATOM 627 OG1 THR A 81 -6.543 -0.608 1.276 1.00 0.36 O ATOM 628 CG2 THR A 81 -4.229 -0.588 0.587 1.00 0.40 C ATOM 0 H THR A 81 -5.794 -2.403 2.813 1.00 0.22 H new ATOM 0 HA THR A 81 -3.844 -0.239 3.250 1.00 0.22 H new ATOM 0 HB THR A 81 -5.260 0.994 1.585 1.00 0.32 H new ATOM 0 HG1 THR A 81 -6.651 -0.618 0.302 1.00 0.36 H new ATOM 0 HG21 THR A 81 -4.522 -0.255 -0.409 1.00 0.40 H new ATOM 0 HG22 THR A 81 -3.246 -0.185 0.830 1.00 0.40 H new ATOM 0 HG23 THR A 81 -4.190 -1.677 0.608 1.00 0.40 H new ATOM 636 N SER A 82 -5.418 1.256 4.535 1.00 0.19 N ATOM 637 CA SER A 82 -6.303 2.063 5.346 1.00 0.20 C ATOM 638 C SER A 82 -6.865 3.174 4.481 1.00 0.24 C ATOM 639 O SER A 82 -6.275 4.250 4.375 1.00 0.29 O ATOM 640 CB SER A 82 -5.539 2.644 6.531 1.00 0.25 C ATOM 641 OG SER A 82 -4.875 1.628 7.235 1.00 1.19 O ATOM 0 H SER A 82 -4.490 1.656 4.396 1.00 0.19 H new ATOM 0 HA SER A 82 -7.118 1.453 5.735 1.00 0.20 H new ATOM 0 HB2 SER A 82 -4.818 3.382 6.179 1.00 0.25 H new ATOM 0 HB3 SER A 82 -6.229 3.164 7.196 1.00 0.25 H new ATOM 0 HG SER A 82 -5.491 1.220 7.879 1.00 1.19 H new ATOM 647 N HIS A 83 -7.993 2.910 3.846 1.00 0.24 N ATOM 648 CA HIS A 83 -8.536 3.851 2.894 1.00 0.30 C ATOM 649 C HIS A 83 -9.976 4.202 3.234 1.00 0.29 C ATOM 650 O HIS A 83 -10.698 3.410 3.849 1.00 0.27 O ATOM 651 CB HIS A 83 -8.385 3.319 1.453 1.00 0.33 C ATOM 652 CG HIS A 83 -9.460 2.388 0.977 1.00 0.32 C ATOM 653 ND1 HIS A 83 -9.893 2.329 -0.345 1.00 0.39 N ATOM 654 CD2 HIS A 83 -10.226 1.499 1.660 1.00 0.28 C ATOM 655 CE1 HIS A 83 -10.890 1.435 -0.410 1.00 0.39 C ATOM 656 NE2 HIS A 83 -11.111 0.942 0.769 1.00 0.33 N ATOM 0 H HIS A 83 -8.543 2.060 3.973 1.00 0.24 H new ATOM 0 HA HIS A 83 -7.964 4.777 2.956 1.00 0.30 H new ATOM 0 HB2 HIS A 83 -8.345 4.172 0.775 1.00 0.33 H new ATOM 0 HB3 HIS A 83 -7.427 2.805 1.376 1.00 0.33 H new ATOM 0 HD1 HIS A 83 -9.519 2.869 -1.125 1.00 0.39 H new ATOM 0 HD2 HIS A 83 -10.153 1.271 2.713 1.00 0.28 H new ATOM 0 HE1 HIS A 83 -11.427 1.166 -1.308 1.00 0.39 H new ATOM 664 N GLY A 84 -10.381 5.404 2.855 1.00 0.35 N ATOM 665 CA GLY A 84 -11.709 5.872 3.178 1.00 0.36 C ATOM 666 C GLY A 84 -11.880 6.086 4.664 1.00 0.36 C ATOM 667 O GLY A 84 -11.582 7.160 5.182 1.00 0.42 O ATOM 0 H GLY A 84 -9.810 6.065 2.328 1.00 0.35 H new ATOM 0 HA2 GLY A 84 -11.904 6.806 2.651 1.00 0.36 H new ATOM 0 HA3 GLY A 84 -12.445 5.149 2.827 1.00 0.36 H new ATOM 671 N ASP A 85 -12.366 5.060 5.338 1.00 0.33 N ATOM 672 CA ASP A 85 -12.558 5.093 6.782 1.00 0.36 C ATOM 673 C ASP A 85 -12.020 3.825 7.431 1.00 0.33 C ATOM 674 O ASP A 85 -11.829 3.763 8.645 1.00 0.38 O ATOM 675 CB ASP A 85 -14.052 5.250 7.085 1.00 0.42 C ATOM 676 CG ASP A 85 -14.415 4.973 8.532 1.00 0.89 C ATOM 677 OD1 ASP A 85 -14.210 5.859 9.386 1.00 0.85 O ATOM 678 OD2 ASP A 85 -14.935 3.872 8.822 1.00 1.59 O ATOM 0 H ASP A 85 -12.640 4.179 4.903 1.00 0.33 H new ATOM 0 HA ASP A 85 -12.008 5.939 7.194 1.00 0.36 H new ATOM 0 HB2 ASP A 85 -14.360 6.264 6.830 1.00 0.42 H new ATOM 0 HB3 ASP A 85 -14.617 4.574 6.443 1.00 0.42 H new ATOM 683 N HIS A 86 -11.732 2.826 6.613 1.00 0.29 N ATOM 684 CA HIS A 86 -11.503 1.485 7.121 1.00 0.27 C ATOM 685 C HIS A 86 -10.260 0.846 6.543 1.00 0.23 C ATOM 686 O HIS A 86 -9.525 1.453 5.765 1.00 0.21 O ATOM 687 CB HIS A 86 -12.720 0.604 6.817 1.00 0.29 C ATOM 688 CG HIS A 86 -13.090 0.536 5.359 1.00 0.27 C ATOM 689 ND1 HIS A 86 -14.368 0.800 4.880 1.00 0.30 N ATOM 690 CD2 HIS A 86 -12.342 0.192 4.268 1.00 0.26 C ATOM 691 CE1 HIS A 86 -14.362 0.608 3.550 1.00 0.30 C ATOM 692 NE2 HIS A 86 -13.171 0.233 3.159 1.00 0.28 N ATOM 0 H HIS A 86 -11.652 2.918 5.600 1.00 0.29 H new ATOM 0 HA HIS A 86 -11.353 1.570 8.197 1.00 0.27 H new ATOM 0 HB2 HIS A 86 -12.521 -0.406 7.176 1.00 0.29 H new ATOM 0 HB3 HIS A 86 -13.575 0.980 7.379 1.00 0.29 H new ATOM 0 HD1 HIS A 86 -15.170 1.089 5.440 1.00 0.30 H new ATOM 0 HD2 HIS A 86 -11.293 -0.065 4.270 1.00 0.26 H new ATOM 0 HE1 HIS A 86 -15.214 0.743 2.900 1.00 0.30 H new ATOM 700 N TYR A 87 -10.035 -0.388 6.952 1.00 0.24 N ATOM 701 CA TYR A 87 -8.957 -1.178 6.416 1.00 0.22 C ATOM 702 C TYR A 87 -9.518 -2.107 5.360 1.00 0.22 C ATOM 703 O TYR A 87 -10.488 -2.823 5.612 1.00 0.26 O ATOM 704 CB TYR A 87 -8.294 -1.993 7.527 1.00 0.25 C ATOM 705 CG TYR A 87 -7.877 -1.156 8.708 1.00 0.29 C ATOM 706 CD1 TYR A 87 -7.206 0.031 8.512 1.00 0.27 C ATOM 707 CD2 TYR A 87 -8.149 -1.552 10.009 1.00 0.38 C ATOM 708 CE1 TYR A 87 -6.813 0.812 9.567 1.00 0.32 C ATOM 709 CE2 TYR A 87 -7.760 -0.772 11.083 1.00 0.43 C ATOM 710 CZ TYR A 87 -7.090 0.412 10.854 1.00 0.40 C ATOM 711 OH TYR A 87 -6.704 1.198 11.913 1.00 0.46 O ATOM 0 H TYR A 87 -10.594 -0.863 7.661 1.00 0.24 H new ATOM 0 HA TYR A 87 -8.205 -0.523 5.976 1.00 0.22 H new ATOM 0 HB2 TYR A 87 -8.985 -2.766 7.863 1.00 0.25 H new ATOM 0 HB3 TYR A 87 -7.419 -2.502 7.123 1.00 0.25 H new ATOM 0 HD1 TYR A 87 -6.985 0.353 7.505 1.00 0.27 H new ATOM 0 HD2 TYR A 87 -8.671 -2.481 10.186 1.00 0.38 H new ATOM 0 HE1 TYR A 87 -6.288 1.739 9.389 1.00 0.32 H new ATOM 0 HE2 TYR A 87 -7.979 -1.087 12.092 1.00 0.43 H new ATOM 0 HH TYR A 87 -6.977 0.773 12.753 1.00 0.46 H new ATOM 721 N HIS A 88 -8.913 -2.104 4.194 1.00 0.21 N ATOM 722 CA HIS A 88 -9.374 -2.949 3.120 1.00 0.25 C ATOM 723 C HIS A 88 -8.241 -3.849 2.658 1.00 0.26 C ATOM 724 O HIS A 88 -7.129 -3.394 2.396 1.00 0.28 O ATOM 725 CB HIS A 88 -9.937 -2.115 1.965 1.00 0.29 C ATOM 726 CG HIS A 88 -11.092 -2.785 1.293 1.00 0.35 C ATOM 727 ND1 HIS A 88 -12.267 -2.138 1.000 1.00 0.38 N ATOM 728 CD2 HIS A 88 -11.226 -4.082 0.901 1.00 0.43 C ATOM 729 CE1 HIS A 88 -13.082 -3.012 0.459 1.00 0.47 C ATOM 730 NE2 HIS A 88 -12.494 -4.219 0.374 1.00 0.51 N ATOM 0 H HIS A 88 -8.103 -1.527 3.967 1.00 0.21 H new ATOM 0 HA HIS A 88 -10.188 -3.576 3.485 1.00 0.25 H new ATOM 0 HB2 HIS A 88 -10.253 -1.142 2.342 1.00 0.29 H new ATOM 0 HB3 HIS A 88 -9.150 -1.933 1.234 1.00 0.29 H new ATOM 0 HD2 HIS A 88 -10.480 -4.858 0.986 1.00 0.43 H new ATOM 0 HE1 HIS A 88 -14.086 -2.793 0.128 1.00 0.47 H new ATOM 0 HE2 HIS A 88 -12.906 -5.071 -0.007 1.00 0.51 H new ATOM 738 N TYR A 89 -8.532 -5.129 2.584 1.00 0.28 N ATOM 739 CA TYR A 89 -7.531 -6.143 2.319 1.00 0.31 C ATOM 740 C TYR A 89 -7.772 -6.741 0.933 1.00 0.36 C ATOM 741 O TYR A 89 -8.919 -6.985 0.556 1.00 0.44 O ATOM 742 CB TYR A 89 -7.656 -7.215 3.413 1.00 0.45 C ATOM 743 CG TYR A 89 -6.483 -8.162 3.581 1.00 0.45 C ATOM 744 CD1 TYR A 89 -5.680 -8.521 2.515 1.00 0.45 C ATOM 745 CD2 TYR A 89 -6.214 -8.729 4.819 1.00 0.59 C ATOM 746 CE1 TYR A 89 -4.642 -9.405 2.665 1.00 0.50 C ATOM 747 CE2 TYR A 89 -5.169 -9.615 4.984 1.00 0.62 C ATOM 748 CZ TYR A 89 -4.384 -9.951 3.905 1.00 0.53 C ATOM 749 OH TYR A 89 -3.337 -10.829 4.067 1.00 0.60 O ATOM 0 H TYR A 89 -9.474 -5.499 2.706 1.00 0.28 H new ATOM 0 HA TYR A 89 -6.526 -5.722 2.332 1.00 0.31 H new ATOM 0 HB2 TYR A 89 -7.824 -6.711 4.365 1.00 0.45 H new ATOM 0 HB3 TYR A 89 -8.546 -7.810 3.206 1.00 0.45 H new ATOM 0 HD1 TYR A 89 -5.874 -8.096 1.541 1.00 0.45 H new ATOM 0 HD2 TYR A 89 -6.832 -8.473 5.667 1.00 0.59 H new ATOM 0 HE1 TYR A 89 -4.030 -9.672 1.816 1.00 0.50 H new ATOM 0 HE2 TYR A 89 -4.968 -10.043 5.955 1.00 0.62 H new ATOM 0 HH TYR A 89 -3.680 -11.693 4.377 1.00 0.60 H new ATOM 759 N TYR A 90 -6.707 -6.942 0.165 1.00 0.45 N ATOM 760 CA TYR A 90 -6.816 -7.610 -1.125 1.00 0.69 C ATOM 761 C TYR A 90 -5.491 -8.204 -1.564 1.00 0.55 C ATOM 762 O TYR A 90 -4.458 -7.966 -0.943 1.00 0.47 O ATOM 763 CB TYR A 90 -7.345 -6.669 -2.205 1.00 1.04 C ATOM 764 CG TYR A 90 -6.686 -5.318 -2.263 1.00 0.95 C ATOM 765 CD1 TYR A 90 -5.381 -5.163 -2.716 1.00 1.70 C ATOM 766 CD2 TYR A 90 -7.389 -4.192 -1.883 1.00 1.32 C ATOM 767 CE1 TYR A 90 -4.799 -3.915 -2.784 1.00 2.40 C ATOM 768 CE2 TYR A 90 -6.818 -2.946 -1.945 1.00 2.07 C ATOM 769 CZ TYR A 90 -5.521 -2.808 -2.395 1.00 2.47 C ATOM 770 OH TYR A 90 -4.952 -1.559 -2.469 1.00 3.42 O ATOM 0 H TYR A 90 -5.761 -6.652 0.413 1.00 0.45 H new ATOM 0 HA TYR A 90 -7.531 -8.422 -0.993 1.00 0.69 H new ATOM 0 HB2 TYR A 90 -7.228 -7.154 -3.174 1.00 1.04 H new ATOM 0 HB3 TYR A 90 -8.414 -6.527 -2.047 1.00 1.04 H new ATOM 0 HD1 TYR A 90 -4.815 -6.032 -3.019 1.00 1.70 H new ATOM 0 HD2 TYR A 90 -8.405 -4.294 -1.531 1.00 1.32 H new ATOM 0 HE1 TYR A 90 -3.785 -3.806 -3.139 1.00 2.40 H new ATOM 0 HE2 TYR A 90 -7.382 -2.076 -1.643 1.00 2.07 H new ATOM 0 HH TYR A 90 -5.577 -0.893 -2.114 1.00 3.42 H new ATOM 780 N ASN A 91 -5.533 -8.964 -2.649 1.00 0.67 N ATOM 781 CA ASN A 91 -4.349 -9.619 -3.177 1.00 0.59 C ATOM 782 C ASN A 91 -4.070 -9.095 -4.580 1.00 0.49 C ATOM 783 O ASN A 91 -4.996 -8.748 -5.318 1.00 0.69 O ATOM 784 CB ASN A 91 -4.554 -11.139 -3.205 1.00 0.85 C ATOM 785 CG ASN A 91 -3.261 -11.930 -3.356 1.00 1.27 C ATOM 786 OD1 ASN A 91 -2.294 -11.476 -3.966 1.00 1.58 O ATOM 787 ND2 ASN A 91 -3.235 -13.126 -2.793 1.00 2.04 N ATOM 0 H ASN A 91 -6.383 -9.142 -3.184 1.00 0.67 H new ATOM 0 HA ASN A 91 -3.495 -9.401 -2.535 1.00 0.59 H new ATOM 0 HB2 ASN A 91 -5.052 -11.446 -2.285 1.00 0.85 H new ATOM 0 HB3 ASN A 91 -5.222 -11.391 -4.029 1.00 0.85 H new ATOM 0 HD21 ASN A 91 -2.396 -13.702 -2.857 1.00 2.04 H new ATOM 0 HD22 ASN A 91 -4.054 -13.473 -2.294 1.00 2.04 H new ATOM 794 N GLY A 92 -2.804 -9.045 -4.942 1.00 0.40 N ATOM 795 CA GLY A 92 -2.410 -8.493 -6.218 1.00 0.41 C ATOM 796 C GLY A 92 -1.188 -7.616 -6.085 1.00 0.33 C ATOM 797 O GLY A 92 -0.349 -7.854 -5.218 1.00 0.47 O ATOM 0 H GLY A 92 -2.031 -9.381 -4.368 1.00 0.40 H new ATOM 0 HA2 GLY A 92 -2.204 -9.302 -6.918 1.00 0.41 H new ATOM 0 HA3 GLY A 92 -3.233 -7.912 -6.635 1.00 0.41 H new ATOM 801 N LYS A 93 -1.084 -6.609 -6.942 1.00 0.40 N ATOM 802 CA LYS A 93 0.012 -5.650 -6.878 1.00 0.35 C ATOM 803 C LYS A 93 -0.498 -4.247 -6.574 1.00 0.35 C ATOM 804 O LYS A 93 -1.609 -3.879 -6.965 1.00 0.47 O ATOM 805 CB LYS A 93 0.788 -5.640 -8.192 1.00 0.36 C ATOM 806 CG LYS A 93 1.661 -6.850 -8.393 1.00 0.39 C ATOM 807 CD LYS A 93 3.115 -6.497 -8.128 1.00 0.63 C ATOM 808 CE LYS A 93 4.007 -7.693 -8.278 1.00 1.42 C ATOM 809 NZ LYS A 93 4.015 -8.228 -9.663 1.00 2.03 N ATOM 0 H LYS A 93 -1.750 -6.434 -7.695 1.00 0.40 H new ATOM 0 HA LYS A 93 0.675 -5.959 -6.070 1.00 0.35 H new ATOM 0 HB2 LYS A 93 0.082 -5.572 -9.019 1.00 0.36 H new ATOM 0 HB3 LYS A 93 1.409 -4.745 -8.229 1.00 0.36 H new ATOM 0 HG2 LYS A 93 1.346 -7.650 -7.724 1.00 0.39 H new ATOM 0 HG3 LYS A 93 1.549 -7.223 -9.411 1.00 0.39 H new ATOM 0 HD2 LYS A 93 3.433 -5.716 -8.819 1.00 0.63 H new ATOM 0 HD3 LYS A 93 3.214 -6.092 -7.121 1.00 0.63 H new ATOM 0 HE2 LYS A 93 5.023 -7.422 -7.991 1.00 1.42 H new ATOM 0 HE3 LYS A 93 3.680 -8.474 -7.592 1.00 1.42 H new ATOM 0 HZ1 LYS A 93 4.767 -8.940 -9.756 1.00 2.03 H new ATOM 0 HZ2 LYS A 93 3.095 -8.667 -9.871 1.00 2.03 H new ATOM 0 HZ3 LYS A 93 4.188 -7.452 -10.334 1.00 2.03 H new ATOM 823 N VAL A 94 0.318 -3.485 -5.850 1.00 0.31 N ATOM 824 CA VAL A 94 0.039 -2.081 -5.573 1.00 0.29 C ATOM 825 C VAL A 94 0.048 -1.292 -6.879 1.00 0.28 C ATOM 826 O VAL A 94 0.988 -1.417 -7.667 1.00 0.30 O ATOM 827 CB VAL A 94 1.096 -1.469 -4.614 1.00 0.29 C ATOM 828 CG1 VAL A 94 0.792 -0.012 -4.333 1.00 0.32 C ATOM 829 CG2 VAL A 94 1.181 -2.241 -3.306 1.00 0.41 C ATOM 0 H VAL A 94 1.189 -3.824 -5.440 1.00 0.31 H new ATOM 0 HA VAL A 94 -0.939 -2.023 -5.096 1.00 0.29 H new ATOM 0 HB VAL A 94 2.062 -1.540 -5.114 1.00 0.29 H new ATOM 0 HG11 VAL A 94 1.547 0.394 -3.659 1.00 0.32 H new ATOM 0 HG12 VAL A 94 0.801 0.548 -5.268 1.00 0.32 H new ATOM 0 HG13 VAL A 94 -0.191 0.072 -3.870 1.00 0.32 H new ATOM 0 HG21 VAL A 94 1.931 -1.783 -2.661 1.00 0.41 H new ATOM 0 HG22 VAL A 94 0.212 -2.220 -2.807 1.00 0.41 H new ATOM 0 HG23 VAL A 94 1.461 -3.274 -3.511 1.00 0.41 H new ATOM 839 N PRO A 95 -0.988 -0.480 -7.142 1.00 0.27 N ATOM 840 CA PRO A 95 -1.044 0.328 -8.351 1.00 0.28 C ATOM 841 C PRO A 95 -0.031 1.452 -8.313 1.00 0.25 C ATOM 842 O PRO A 95 0.444 1.819 -7.236 1.00 0.27 O ATOM 843 CB PRO A 95 -2.458 0.892 -8.369 1.00 0.33 C ATOM 844 CG PRO A 95 -2.909 0.856 -6.958 1.00 0.33 C ATOM 845 CD PRO A 95 -2.166 -0.274 -6.285 1.00 0.30 C ATOM 0 HA PRO A 95 -0.811 -0.259 -9.239 1.00 0.28 H new ATOM 0 HB2 PRO A 95 -2.471 1.909 -8.761 1.00 0.33 H new ATOM 0 HB3 PRO A 95 -3.111 0.296 -9.007 1.00 0.33 H new ATOM 0 HG2 PRO A 95 -2.700 1.804 -6.462 1.00 0.33 H new ATOM 0 HG3 PRO A 95 -3.986 0.697 -6.901 1.00 0.33 H new ATOM 0 HD2 PRO A 95 -1.879 -0.013 -5.266 1.00 0.30 H new ATOM 0 HD3 PRO A 95 -2.778 -1.174 -6.223 1.00 0.30 H new ATOM 853 N TYR A 96 0.284 2.011 -9.459 1.00 0.26 N ATOM 854 CA TYR A 96 1.360 2.980 -9.557 1.00 0.27 C ATOM 855 C TYR A 96 1.111 4.180 -8.634 1.00 0.26 C ATOM 856 O TYR A 96 2.029 4.666 -7.970 1.00 0.30 O ATOM 857 CB TYR A 96 1.516 3.434 -11.011 1.00 0.33 C ATOM 858 CG TYR A 96 2.907 3.913 -11.357 1.00 0.38 C ATOM 859 CD1 TYR A 96 3.450 5.015 -10.724 1.00 0.30 C ATOM 860 CD2 TYR A 96 3.673 3.268 -12.320 1.00 0.61 C ATOM 861 CE1 TYR A 96 4.712 5.467 -11.031 1.00 0.35 C ATOM 862 CE2 TYR A 96 4.943 3.714 -12.634 1.00 0.68 C ATOM 863 CZ TYR A 96 5.459 4.816 -11.986 1.00 0.51 C ATOM 864 OH TYR A 96 6.725 5.266 -12.291 1.00 0.59 O ATOM 0 H TYR A 96 -0.189 1.813 -10.341 1.00 0.26 H new ATOM 0 HA TYR A 96 2.286 2.505 -9.233 1.00 0.27 H new ATOM 0 HB2 TYR A 96 1.253 2.607 -11.670 1.00 0.33 H new ATOM 0 HB3 TYR A 96 0.806 4.237 -11.209 1.00 0.33 H new ATOM 0 HD1 TYR A 96 2.871 5.532 -9.973 1.00 0.30 H new ATOM 0 HD2 TYR A 96 3.270 2.406 -12.831 1.00 0.61 H new ATOM 0 HE1 TYR A 96 5.116 6.331 -10.524 1.00 0.35 H new ATOM 0 HE2 TYR A 96 5.528 3.202 -13.383 1.00 0.68 H new ATOM 0 HH TYR A 96 7.117 4.695 -12.984 1.00 0.59 H new ATOM 874 N ASP A 97 -0.137 4.623 -8.545 1.00 0.28 N ATOM 875 CA ASP A 97 -0.441 5.852 -7.813 1.00 0.33 C ATOM 876 C ASP A 97 -1.038 5.581 -6.430 1.00 0.32 C ATOM 877 O ASP A 97 -1.663 6.462 -5.840 1.00 0.38 O ATOM 878 CB ASP A 97 -1.386 6.752 -8.623 1.00 0.43 C ATOM 879 CG ASP A 97 -2.741 6.122 -8.887 1.00 1.07 C ATOM 880 OD1 ASP A 97 -2.832 5.257 -9.785 1.00 1.82 O ATOM 881 OD2 ASP A 97 -3.727 6.513 -8.226 1.00 1.07 O ATOM 0 H ASP A 97 -0.945 4.161 -8.962 1.00 0.28 H new ATOM 0 HA ASP A 97 0.509 6.366 -7.665 1.00 0.33 H new ATOM 0 HB2 ASP A 97 -1.528 7.691 -8.088 1.00 0.43 H new ATOM 0 HB3 ASP A 97 -0.915 6.996 -9.575 1.00 0.43 H new ATOM 886 N ALA A 98 -0.845 4.375 -5.905 1.00 0.27 N ATOM 887 CA ALA A 98 -1.334 4.049 -4.565 1.00 0.27 C ATOM 888 C ALA A 98 -0.530 4.772 -3.493 1.00 0.26 C ATOM 889 O ALA A 98 0.600 5.204 -3.725 1.00 0.40 O ATOM 890 CB ALA A 98 -1.285 2.556 -4.315 1.00 0.30 C ATOM 0 H ALA A 98 -0.359 3.613 -6.379 1.00 0.27 H new ATOM 0 HA ALA A 98 -2.370 4.383 -4.511 1.00 0.27 H new ATOM 0 HB1 ALA A 98 -1.654 2.343 -3.312 1.00 0.30 H new ATOM 0 HB2 ALA A 98 -1.909 2.044 -5.048 1.00 0.30 H new ATOM 0 HB3 ALA A 98 -0.257 2.205 -4.405 1.00 0.30 H new ATOM 896 N ILE A 99 -1.126 4.897 -2.317 1.00 0.18 N ATOM 897 CA ILE A 99 -0.506 5.589 -1.205 1.00 0.17 C ATOM 898 C ILE A 99 0.019 4.589 -0.177 1.00 0.16 C ATOM 899 O ILE A 99 -0.584 3.542 0.043 1.00 0.16 O ATOM 900 CB ILE A 99 -1.510 6.541 -0.537 1.00 0.21 C ATOM 901 CG1 ILE A 99 -2.153 7.447 -1.591 1.00 0.21 C ATOM 902 CG2 ILE A 99 -0.829 7.370 0.539 1.00 0.26 C ATOM 903 CD1 ILE A 99 -1.173 8.343 -2.319 1.00 0.29 C ATOM 0 H ILE A 99 -2.051 4.521 -2.110 1.00 0.18 H new ATOM 0 HA ILE A 99 0.331 6.171 -1.591 1.00 0.17 H new ATOM 0 HB ILE A 99 -2.291 5.948 -0.062 1.00 0.21 H new ATOM 0 HG12 ILE A 99 -2.671 6.825 -2.321 1.00 0.21 H new ATOM 0 HG13 ILE A 99 -2.907 8.069 -1.109 1.00 0.21 H new ATOM 0 HG21 ILE A 99 -1.557 8.037 1.000 1.00 0.26 H new ATOM 0 HG22 ILE A 99 -0.412 6.709 1.298 1.00 0.26 H new ATOM 0 HG23 ILE A 99 -0.029 7.959 0.092 1.00 0.26 H new ATOM 0 HD11 ILE A 99 -1.709 8.952 -3.047 1.00 0.29 H new ATOM 0 HD12 ILE A 99 -0.672 8.993 -1.602 1.00 0.29 H new ATOM 0 HD13 ILE A 99 -0.432 7.730 -2.833 1.00 0.29 H new ATOM 915 N ILE A 100 1.148 4.907 0.431 1.00 0.17 N ATOM 916 CA ILE A 100 1.767 4.036 1.411 1.00 0.18 C ATOM 917 C ILE A 100 1.807 4.697 2.786 1.00 0.18 C ATOM 918 O ILE A 100 1.850 5.925 2.905 1.00 0.20 O ATOM 919 CB ILE A 100 3.206 3.688 0.984 1.00 0.20 C ATOM 920 CG1 ILE A 100 3.209 3.095 -0.425 1.00 0.21 C ATOM 921 CG2 ILE A 100 3.846 2.720 1.972 1.00 0.22 C ATOM 922 CD1 ILE A 100 2.552 1.736 -0.511 1.00 0.23 C ATOM 0 H ILE A 100 1.659 5.773 0.259 1.00 0.17 H new ATOM 0 HA ILE A 100 1.168 3.128 1.470 1.00 0.18 H new ATOM 0 HB ILE A 100 3.795 4.605 0.980 1.00 0.20 H new ATOM 0 HG12 ILE A 100 2.696 3.781 -1.100 1.00 0.21 H new ATOM 0 HG13 ILE A 100 4.238 3.014 -0.774 1.00 0.21 H new ATOM 0 HG21 ILE A 100 4.861 2.489 1.649 1.00 0.22 H new ATOM 0 HG22 ILE A 100 3.875 3.176 2.962 1.00 0.22 H new ATOM 0 HG23 ILE A 100 3.261 1.801 2.013 1.00 0.22 H new ATOM 0 HD11 ILE A 100 2.591 1.377 -1.540 1.00 0.23 H new ATOM 0 HD12 ILE A 100 3.078 1.036 0.138 1.00 0.23 H new ATOM 0 HD13 ILE A 100 1.512 1.814 -0.193 1.00 0.23 H new ATOM 934 N SER A 101 1.762 3.870 3.817 1.00 0.20 N ATOM 935 CA SER A 101 1.966 4.317 5.179 1.00 0.20 C ATOM 936 C SER A 101 3.446 4.608 5.420 1.00 0.20 C ATOM 937 O SER A 101 4.324 3.880 4.947 1.00 0.23 O ATOM 938 CB SER A 101 1.473 3.237 6.145 1.00 0.22 C ATOM 939 OG SER A 101 1.907 3.481 7.474 1.00 0.89 O ATOM 0 H SER A 101 1.583 2.870 3.730 1.00 0.20 H new ATOM 0 HA SER A 101 1.402 5.235 5.348 1.00 0.20 H new ATOM 0 HB2 SER A 101 0.384 3.196 6.120 1.00 0.22 H new ATOM 0 HB3 SER A 101 1.836 2.263 5.817 1.00 0.22 H new ATOM 0 HG SER A 101 1.572 2.773 8.063 1.00 0.89 H new ATOM 945 N GLU A 102 3.704 5.678 6.164 1.00 0.20 N ATOM 946 CA GLU A 102 5.061 6.098 6.506 1.00 0.21 C ATOM 947 C GLU A 102 5.782 5.007 7.288 1.00 0.24 C ATOM 948 O GLU A 102 7.012 4.976 7.340 1.00 0.29 O ATOM 949 CB GLU A 102 5.003 7.373 7.345 1.00 0.25 C ATOM 950 CG GLU A 102 4.427 7.134 8.730 1.00 0.31 C ATOM 951 CD GLU A 102 4.798 8.205 9.731 1.00 0.94 C ATOM 952 OE1 GLU A 102 5.870 8.823 9.582 1.00 1.22 O ATOM 953 OE2 GLU A 102 4.027 8.413 10.687 1.00 1.71 O ATOM 0 H GLU A 102 2.977 6.281 6.549 1.00 0.20 H new ATOM 0 HA GLU A 102 5.611 6.286 5.584 1.00 0.21 H new ATOM 0 HB2 GLU A 102 6.007 7.788 7.439 1.00 0.25 H new ATOM 0 HB3 GLU A 102 4.398 8.117 6.827 1.00 0.25 H new ATOM 0 HG2 GLU A 102 3.341 7.076 8.658 1.00 0.31 H new ATOM 0 HG3 GLU A 102 4.774 6.168 9.098 1.00 0.31 H new ATOM 960 N GLU A 103 5.006 4.127 7.911 1.00 0.27 N ATOM 961 CA GLU A 103 5.563 3.001 8.642 1.00 0.34 C ATOM 962 C GLU A 103 6.222 1.990 7.702 1.00 0.31 C ATOM 963 O GLU A 103 7.132 1.264 8.102 1.00 0.41 O ATOM 964 CB GLU A 103 4.485 2.298 9.466 1.00 0.43 C ATOM 965 CG GLU A 103 4.111 3.001 10.759 1.00 0.67 C ATOM 966 CD GLU A 103 3.442 2.059 11.742 1.00 1.15 C ATOM 967 OE1 GLU A 103 4.160 1.393 12.516 1.00 1.48 O ATOM 968 OE2 GLU A 103 2.196 1.969 11.739 1.00 1.42 O ATOM 0 H GLU A 103 3.987 4.174 7.923 1.00 0.27 H new ATOM 0 HA GLU A 103 6.324 3.402 9.311 1.00 0.34 H new ATOM 0 HB2 GLU A 103 3.589 2.194 8.853 1.00 0.43 H new ATOM 0 HB3 GLU A 103 4.828 1.291 9.703 1.00 0.43 H new ATOM 0 HG2 GLU A 103 5.006 3.425 11.214 1.00 0.67 H new ATOM 0 HG3 GLU A 103 3.441 3.832 10.540 1.00 0.67 H new ATOM 975 N LEU A 104 5.774 1.953 6.453 1.00 0.23 N ATOM 976 CA LEU A 104 6.234 0.936 5.510 1.00 0.25 C ATOM 977 C LEU A 104 7.362 1.428 4.617 1.00 0.27 C ATOM 978 O LEU A 104 8.145 0.627 4.109 1.00 0.29 O ATOM 979 CB LEU A 104 5.087 0.461 4.628 1.00 0.27 C ATOM 980 CG LEU A 104 4.043 -0.394 5.323 1.00 0.28 C ATOM 981 CD1 LEU A 104 2.949 -0.768 4.343 1.00 0.33 C ATOM 982 CD2 LEU A 104 4.695 -1.636 5.897 1.00 0.30 C ATOM 0 H LEU A 104 5.096 2.611 6.069 1.00 0.23 H new ATOM 0 HA LEU A 104 6.613 0.113 6.116 1.00 0.25 H new ATOM 0 HB2 LEU A 104 4.592 1.334 4.203 1.00 0.27 H new ATOM 0 HB3 LEU A 104 5.502 -0.107 3.796 1.00 0.27 H new ATOM 0 HG LEU A 104 3.597 0.172 6.140 1.00 0.28 H new ATOM 0 HD11 LEU A 104 2.203 -1.382 4.848 1.00 0.33 H new ATOM 0 HD12 LEU A 104 2.477 0.137 3.962 1.00 0.33 H new ATOM 0 HD13 LEU A 104 3.380 -1.329 3.514 1.00 0.33 H new ATOM 0 HD21 LEU A 104 3.941 -2.246 6.395 1.00 0.30 H new ATOM 0 HD22 LEU A 104 5.154 -2.211 5.093 1.00 0.30 H new ATOM 0 HD23 LEU A 104 5.460 -1.346 6.617 1.00 0.30 H new ATOM 994 N LEU A 105 7.443 2.732 4.405 1.00 0.43 N ATOM 995 CA LEU A 105 8.430 3.277 3.505 1.00 0.54 C ATOM 996 C LEU A 105 9.847 2.980 4.002 1.00 0.46 C ATOM 997 O LEU A 105 10.077 2.782 5.198 1.00 0.53 O ATOM 998 CB LEU A 105 8.157 4.772 3.265 1.00 0.88 C ATOM 999 CG LEU A 105 8.304 5.700 4.461 1.00 0.30 C ATOM 1000 CD1 LEU A 105 9.753 5.814 4.808 1.00 1.01 C ATOM 1001 CD2 LEU A 105 7.737 7.068 4.153 1.00 1.09 C ATOM 0 H LEU A 105 6.837 3.425 4.845 1.00 0.43 H new ATOM 0 HA LEU A 105 8.351 2.787 2.534 1.00 0.54 H new ATOM 0 HB2 LEU A 105 8.832 5.118 2.482 1.00 0.88 H new ATOM 0 HB3 LEU A 105 7.143 4.874 2.880 1.00 0.88 H new ATOM 0 HG LEU A 105 7.750 5.288 5.304 1.00 0.30 H new ATOM 0 HD11 LEU A 105 9.871 6.477 5.665 1.00 1.01 H new ATOM 0 HD12 LEU A 105 10.146 4.828 5.056 1.00 1.01 H new ATOM 0 HD13 LEU A 105 10.300 6.220 3.957 1.00 1.01 H new ATOM 0 HD21 LEU A 105 7.853 7.714 5.023 1.00 1.09 H new ATOM 0 HD22 LEU A 105 8.270 7.500 3.306 1.00 1.09 H new ATOM 0 HD23 LEU A 105 6.679 6.977 3.908 1.00 1.09 H new ATOM 1013 N MET A 106 10.778 2.917 3.067 1.00 0.41 N ATOM 1014 CA MET A 106 12.157 2.568 3.363 1.00 0.45 C ATOM 1015 C MET A 106 13.053 3.796 3.380 1.00 0.92 C ATOM 1016 O MET A 106 13.366 4.360 2.326 1.00 1.28 O ATOM 1017 CB MET A 106 12.702 1.583 2.322 1.00 0.27 C ATOM 1018 CG MET A 106 14.206 1.341 2.450 1.00 0.30 C ATOM 1019 SD MET A 106 14.619 0.183 3.761 1.00 1.05 S ATOM 1020 CE MET A 106 14.417 -1.351 2.869 1.00 0.50 C ATOM 0 H MET A 106 10.600 3.106 2.081 1.00 0.41 H new ATOM 0 HA MET A 106 12.162 2.108 4.351 1.00 0.45 H new ATOM 0 HB2 MET A 106 12.178 0.632 2.422 1.00 0.27 H new ATOM 0 HB3 MET A 106 12.486 1.963 1.324 1.00 0.27 H new ATOM 0 HG2 MET A 106 14.590 0.962 1.503 1.00 0.30 H new ATOM 0 HG3 MET A 106 14.707 2.290 2.640 1.00 0.30 H new ATOM 0 HE1 MET A 106 14.210 -2.157 3.573 1.00 0.50 H new ATOM 0 HE2 MET A 106 13.586 -1.258 2.169 1.00 0.50 H new ATOM 0 HE3 MET A 106 15.331 -1.575 2.319 1.00 0.50 H new ATOM 1030 N LYS A 107 13.452 4.219 4.563 1.00 1.28 N ATOM 1031 CA LYS A 107 14.570 5.129 4.678 1.00 1.66 C ATOM 1032 C LYS A 107 15.681 4.414 5.421 1.00 1.09 C ATOM 1033 O LYS A 107 15.636 4.269 6.642 1.00 1.52 O ATOM 1034 CB LYS A 107 14.173 6.400 5.434 1.00 2.68 C ATOM 1035 CG LYS A 107 13.126 7.244 4.725 1.00 3.57 C ATOM 1036 CD LYS A 107 12.768 8.479 5.539 1.00 4.57 C ATOM 1037 CE LYS A 107 13.973 9.387 5.734 1.00 5.18 C ATOM 1038 NZ LYS A 107 13.676 10.516 6.655 1.00 5.65 N ATOM 0 H LYS A 107 13.023 3.950 5.448 1.00 1.28 H new ATOM 0 HA LYS A 107 14.900 5.427 3.683 1.00 1.66 H new ATOM 0 HB2 LYS A 107 13.794 6.121 6.417 1.00 2.68 H new ATOM 0 HB3 LYS A 107 15.064 7.007 5.596 1.00 2.68 H new ATOM 0 HG2 LYS A 107 13.501 7.546 3.747 1.00 3.57 H new ATOM 0 HG3 LYS A 107 12.230 6.647 4.553 1.00 3.57 H new ATOM 0 HD2 LYS A 107 11.974 9.030 5.036 1.00 4.57 H new ATOM 0 HD3 LYS A 107 12.379 8.175 6.511 1.00 4.57 H new ATOM 0 HE2 LYS A 107 14.805 8.805 6.130 1.00 5.18 H new ATOM 0 HE3 LYS A 107 14.290 9.781 4.768 1.00 5.18 H new ATOM 0 HZ1 LYS A 107 14.523 11.110 6.760 1.00 5.65 H new ATOM 0 HZ2 LYS A 107 12.899 11.087 6.265 1.00 5.65 H new ATOM 0 HZ3 LYS A 107 13.398 10.142 7.585 1.00 5.65 H new ATOM 1052 N ASP A 108 16.665 3.952 4.675 1.00 1.16 N ATOM 1053 CA ASP A 108 17.805 3.266 5.254 1.00 1.22 C ATOM 1054 C ASP A 108 19.079 3.981 4.845 1.00 1.17 C ATOM 1055 O ASP A 108 19.225 4.365 3.685 1.00 1.12 O ATOM 1056 CB ASP A 108 17.833 1.809 4.795 1.00 1.88 C ATOM 1057 CG ASP A 108 18.740 0.945 5.648 1.00 2.55 C ATOM 1058 OD1 ASP A 108 19.956 0.892 5.374 1.00 3.03 O ATOM 1059 OD2 ASP A 108 18.234 0.311 6.600 1.00 2.80 O ATOM 0 H ASP A 108 16.698 4.040 3.659 1.00 1.16 H new ATOM 0 HA ASP A 108 17.724 3.277 6.341 1.00 1.22 H new ATOM 0 HB2 ASP A 108 16.821 1.404 4.822 1.00 1.88 H new ATOM 0 HB3 ASP A 108 18.166 1.765 3.758 1.00 1.88 H new ATOM 1064 N PRO A 109 20.011 4.185 5.777 1.00 1.79 N ATOM 1065 CA PRO A 109 21.253 4.891 5.487 1.00 2.23 C ATOM 1066 C PRO A 109 22.235 4.047 4.687 1.00 2.02 C ATOM 1067 O PRO A 109 23.177 4.575 4.093 1.00 2.25 O ATOM 1068 CB PRO A 109 21.811 5.206 6.872 1.00 3.08 C ATOM 1069 CG PRO A 109 21.277 4.128 7.750 1.00 3.14 C ATOM 1070 CD PRO A 109 19.927 3.765 7.190 1.00 2.41 C ATOM 0 HA PRO A 109 21.084 5.774 4.871 1.00 2.23 H new ATOM 0 HB2 PRO A 109 22.901 5.210 6.868 1.00 3.08 H new ATOM 0 HB3 PRO A 109 21.490 6.190 7.214 1.00 3.08 H new ATOM 0 HG2 PRO A 109 21.942 3.264 7.755 1.00 3.14 H new ATOM 0 HG3 PRO A 109 21.192 4.471 8.781 1.00 3.14 H new ATOM 0 HD2 PRO A 109 19.730 2.697 7.279 1.00 2.41 H new ATOM 0 HD3 PRO A 109 19.123 4.282 7.715 1.00 2.41 H new ATOM 1078 N ASN A 110 22.018 2.742 4.665 1.00 1.75 N ATOM 1079 CA ASN A 110 22.899 1.852 3.931 1.00 1.67 C ATOM 1080 C ASN A 110 22.200 1.276 2.703 1.00 1.25 C ATOM 1081 O ASN A 110 22.857 0.855 1.753 1.00 1.26 O ATOM 1082 CB ASN A 110 23.396 0.722 4.842 1.00 1.96 C ATOM 1083 CG ASN A 110 24.427 -0.170 4.169 1.00 2.05 C ATOM 1084 OD1 ASN A 110 24.087 -1.182 3.556 1.00 2.18 O ATOM 1085 ND2 ASN A 110 25.697 0.194 4.288 1.00 2.57 N ATOM 0 H ASN A 110 21.245 2.279 5.143 1.00 1.75 H new ATOM 0 HA ASN A 110 23.757 2.432 3.590 1.00 1.67 H new ATOM 0 HB2 ASN A 110 23.830 1.154 5.744 1.00 1.96 H new ATOM 0 HB3 ASN A 110 22.547 0.115 5.156 1.00 1.96 H new ATOM 0 HD21 ASN A 110 26.432 -0.372 3.863 1.00 2.57 H new ATOM 0 HD22 ASN A 110 25.939 1.040 4.804 1.00 2.57 H new ATOM 1092 N TYR A 111 20.871 1.291 2.698 1.00 0.95 N ATOM 1093 CA TYR A 111 20.129 0.605 1.642 1.00 0.70 C ATOM 1094 C TYR A 111 19.819 1.523 0.476 1.00 0.60 C ATOM 1095 O TYR A 111 19.295 2.622 0.649 1.00 0.80 O ATOM 1096 CB TYR A 111 18.815 -0.008 2.147 1.00 0.70 C ATOM 1097 CG TYR A 111 18.143 -0.885 1.112 1.00 0.76 C ATOM 1098 CD1 TYR A 111 18.581 -2.184 0.886 1.00 0.94 C ATOM 1099 CD2 TYR A 111 17.082 -0.412 0.353 1.00 0.89 C ATOM 1100 CE1 TYR A 111 17.980 -2.985 -0.067 1.00 1.18 C ATOM 1101 CE2 TYR A 111 16.476 -1.207 -0.603 1.00 1.12 C ATOM 1102 CZ TYR A 111 16.930 -2.492 -0.810 1.00 1.23 C ATOM 1103 OH TYR A 111 16.342 -3.277 -1.774 1.00 1.57 O ATOM 0 H TYR A 111 20.294 1.760 3.397 1.00 0.95 H new ATOM 0 HA TYR A 111 20.786 -0.198 1.307 1.00 0.70 H new ATOM 0 HB2 TYR A 111 19.014 -0.597 3.042 1.00 0.70 H new ATOM 0 HB3 TYR A 111 18.134 0.792 2.437 1.00 0.70 H new ATOM 0 HD1 TYR A 111 19.405 -2.575 1.465 1.00 0.94 H new ATOM 0 HD2 TYR A 111 16.723 0.594 0.511 1.00 0.89 H new ATOM 0 HE1 TYR A 111 18.332 -3.993 -0.228 1.00 1.18 H new ATOM 0 HE2 TYR A 111 15.651 -0.823 -1.185 1.00 1.12 H new ATOM 0 HH TYR A 111 16.503 -4.222 -1.569 1.00 1.57 H new ATOM 1113 N GLN A 112 20.159 1.051 -0.708 1.00 0.53 N ATOM 1114 CA GLN A 112 19.731 1.649 -1.932 1.00 0.55 C ATOM 1115 C GLN A 112 18.865 0.659 -2.687 1.00 0.45 C ATOM 1116 O GLN A 112 19.021 -0.553 -2.537 1.00 0.47 O ATOM 1117 CB GLN A 112 20.941 2.064 -2.749 1.00 0.70 C ATOM 1118 CG GLN A 112 20.610 2.328 -4.182 1.00 1.30 C ATOM 1119 CD GLN A 112 21.757 2.932 -4.967 1.00 1.42 C ATOM 1120 OE1 GLN A 112 22.577 3.672 -4.425 1.00 1.64 O ATOM 1121 NE2 GLN A 112 21.827 2.611 -6.247 1.00 2.05 N ATOM 0 H GLN A 112 20.749 0.229 -0.835 1.00 0.53 H new ATOM 0 HA GLN A 112 19.142 2.544 -1.731 1.00 0.55 H new ATOM 0 HB2 GLN A 112 21.379 2.961 -2.311 1.00 0.70 H new ATOM 0 HB3 GLN A 112 21.697 1.281 -2.694 1.00 0.70 H new ATOM 0 HG2 GLN A 112 20.309 1.393 -4.655 1.00 1.30 H new ATOM 0 HG3 GLN A 112 19.753 3.000 -4.231 1.00 1.30 H new ATOM 0 HE21 GLN A 112 21.126 1.994 -6.657 1.00 2.05 H new ATOM 0 HE22 GLN A 112 22.582 2.980 -6.825 1.00 2.05 H new ATOM 1130 N LEU A 113 17.951 1.190 -3.478 1.00 0.40 N ATOM 1131 CA LEU A 113 16.956 0.391 -4.169 1.00 0.33 C ATOM 1132 C LEU A 113 17.603 -0.682 -5.034 1.00 0.36 C ATOM 1133 O LEU A 113 18.307 -0.378 -6.000 1.00 0.43 O ATOM 1134 CB LEU A 113 16.093 1.296 -5.030 1.00 0.32 C ATOM 1135 CG LEU A 113 14.994 0.588 -5.810 1.00 0.30 C ATOM 1136 CD1 LEU A 113 13.895 0.129 -4.869 1.00 0.25 C ATOM 1137 CD2 LEU A 113 14.445 1.498 -6.889 1.00 0.35 C ATOM 0 H LEU A 113 17.878 2.191 -3.660 1.00 0.40 H new ATOM 0 HA LEU A 113 16.341 -0.110 -3.422 1.00 0.33 H new ATOM 0 HB2 LEU A 113 15.635 2.051 -4.391 1.00 0.32 H new ATOM 0 HB3 LEU A 113 16.736 1.823 -5.735 1.00 0.32 H new ATOM 0 HG LEU A 113 15.415 -0.293 -6.295 1.00 0.30 H new ATOM 0 HD11 LEU A 113 13.115 -0.376 -5.439 1.00 0.25 H new ATOM 0 HD12 LEU A 113 14.310 -0.560 -4.133 1.00 0.25 H new ATOM 0 HD13 LEU A 113 13.469 0.993 -4.358 1.00 0.25 H new ATOM 0 HD21 LEU A 113 13.660 0.978 -7.439 1.00 0.35 H new ATOM 0 HD22 LEU A 113 14.033 2.398 -6.431 1.00 0.35 H new ATOM 0 HD23 LEU A 113 15.246 1.774 -7.575 1.00 0.35 H new ATOM 1149 N LYS A 114 17.360 -1.932 -4.682 1.00 0.40 N ATOM 1150 CA LYS A 114 17.928 -3.047 -5.415 1.00 0.47 C ATOM 1151 C LYS A 114 16.849 -3.776 -6.190 1.00 0.37 C ATOM 1152 O LYS A 114 15.788 -4.098 -5.654 1.00 0.33 O ATOM 1153 CB LYS A 114 18.619 -4.017 -4.474 1.00 0.63 C ATOM 1154 CG LYS A 114 19.651 -4.891 -5.146 1.00 0.90 C ATOM 1155 CD LYS A 114 20.777 -4.055 -5.733 1.00 1.14 C ATOM 1156 CE LYS A 114 21.913 -4.918 -6.250 1.00 1.51 C ATOM 1157 NZ LYS A 114 22.515 -5.754 -5.178 1.00 2.09 N ATOM 0 H LYS A 114 16.773 -2.200 -3.892 1.00 0.40 H new ATOM 0 HA LYS A 114 18.665 -2.648 -6.112 1.00 0.47 H new ATOM 0 HB2 LYS A 114 19.100 -3.453 -3.675 1.00 0.63 H new ATOM 0 HB3 LYS A 114 17.867 -4.653 -4.007 1.00 0.63 H new ATOM 0 HG2 LYS A 114 20.058 -5.599 -4.424 1.00 0.90 H new ATOM 0 HG3 LYS A 114 19.179 -5.476 -5.935 1.00 0.90 H new ATOM 0 HD2 LYS A 114 20.388 -3.442 -6.546 1.00 1.14 H new ATOM 0 HD3 LYS A 114 21.157 -3.373 -4.973 1.00 1.14 H new ATOM 0 HE2 LYS A 114 21.543 -5.563 -7.047 1.00 1.51 H new ATOM 0 HE3 LYS A 114 22.682 -4.281 -6.686 1.00 1.51 H new ATOM 0 HZ1 LYS A 114 23.459 -6.072 -5.475 1.00 2.09 H new ATOM 0 HZ2 LYS A 114 22.597 -5.194 -4.306 1.00 2.09 H new ATOM 0 HZ3 LYS A 114 21.910 -6.582 -5.002 1.00 2.09 H new ATOM 1171 N ASP A 115 17.147 -4.057 -7.447 1.00 0.40 N ATOM 1172 CA ASP A 115 16.203 -4.725 -8.343 1.00 0.41 C ATOM 1173 C ASP A 115 15.943 -6.151 -7.884 1.00 0.38 C ATOM 1174 O ASP A 115 14.995 -6.798 -8.330 1.00 0.42 O ATOM 1175 CB ASP A 115 16.726 -4.735 -9.783 1.00 0.53 C ATOM 1176 CG ASP A 115 16.874 -3.342 -10.364 1.00 1.12 C ATOM 1177 OD1 ASP A 115 17.921 -2.706 -10.128 1.00 1.88 O ATOM 1178 OD2 ASP A 115 15.951 -2.876 -11.060 1.00 1.11 O ATOM 0 H ASP A 115 18.043 -3.832 -7.879 1.00 0.40 H new ATOM 0 HA ASP A 115 15.268 -4.166 -8.314 1.00 0.41 H new ATOM 0 HB2 ASP A 115 17.692 -5.240 -9.810 1.00 0.53 H new ATOM 0 HB3 ASP A 115 16.046 -5.314 -10.408 1.00 0.53 H new ATOM 1183 N SER A 116 16.797 -6.631 -6.990 1.00 0.38 N ATOM 1184 CA SER A 116 16.668 -7.966 -6.431 1.00 0.44 C ATOM 1185 C SER A 116 15.538 -8.014 -5.404 1.00 0.40 C ATOM 1186 O SER A 116 14.983 -9.078 -5.123 1.00 0.51 O ATOM 1187 CB SER A 116 18.000 -8.377 -5.792 1.00 0.54 C ATOM 1188 OG SER A 116 17.888 -9.581 -5.049 1.00 0.92 O ATOM 0 H SER A 116 17.596 -6.106 -6.634 1.00 0.38 H new ATOM 0 HA SER A 116 16.421 -8.667 -7.228 1.00 0.44 H new ATOM 0 HB2 SER A 116 18.752 -8.501 -6.571 1.00 0.54 H new ATOM 0 HB3 SER A 116 18.349 -7.579 -5.137 1.00 0.54 H new ATOM 0 HG SER A 116 18.759 -9.808 -4.660 1.00 0.92 H new ATOM 1194 N ASP A 117 15.186 -6.856 -4.858 1.00 0.28 N ATOM 1195 CA ASP A 117 14.158 -6.788 -3.832 1.00 0.28 C ATOM 1196 C ASP A 117 12.884 -6.165 -4.380 1.00 0.22 C ATOM 1197 O ASP A 117 11.803 -6.339 -3.815 1.00 0.24 O ATOM 1198 CB ASP A 117 14.655 -5.991 -2.627 1.00 0.34 C ATOM 1199 CG ASP A 117 15.813 -6.666 -1.921 1.00 1.08 C ATOM 1200 OD1 ASP A 117 15.735 -7.886 -1.658 1.00 1.90 O ATOM 1201 OD2 ASP A 117 16.818 -5.981 -1.637 1.00 1.04 O ATOM 0 H ASP A 117 15.596 -5.956 -5.108 1.00 0.28 H new ATOM 0 HA ASP A 117 13.934 -7.806 -3.513 1.00 0.28 H new ATOM 0 HB2 ASP A 117 14.963 -4.998 -2.954 1.00 0.34 H new ATOM 0 HB3 ASP A 117 13.834 -5.854 -1.923 1.00 0.34 H new ATOM 1206 N ILE A 118 13.018 -5.440 -5.481 1.00 0.23 N ATOM 1207 CA ILE A 118 11.881 -4.806 -6.133 1.00 0.22 C ATOM 1208 C ILE A 118 10.868 -5.838 -6.606 1.00 0.26 C ATOM 1209 O ILE A 118 11.182 -6.705 -7.422 1.00 0.34 O ATOM 1210 CB ILE A 118 12.336 -3.965 -7.341 1.00 0.26 C ATOM 1211 CG1 ILE A 118 13.218 -2.812 -6.873 1.00 0.26 C ATOM 1212 CG2 ILE A 118 11.134 -3.439 -8.116 1.00 0.31 C ATOM 1213 CD1 ILE A 118 13.966 -2.131 -7.995 1.00 0.32 C ATOM 0 H ILE A 118 13.911 -5.275 -5.945 1.00 0.23 H new ATOM 0 HA ILE A 118 11.412 -4.157 -5.393 1.00 0.22 H new ATOM 0 HB ILE A 118 12.916 -4.602 -8.009 1.00 0.26 H new ATOM 0 HG12 ILE A 118 12.598 -2.076 -6.361 1.00 0.26 H new ATOM 0 HG13 ILE A 118 13.936 -3.187 -6.144 1.00 0.26 H new ATOM 0 HG21 ILE A 118 11.479 -2.848 -8.965 1.00 0.31 H new ATOM 0 HG22 ILE A 118 10.538 -4.278 -8.476 1.00 0.31 H new ATOM 0 HG23 ILE A 118 10.525 -2.815 -7.463 1.00 0.31 H new ATOM 0 HD11 ILE A 118 14.573 -1.321 -7.589 1.00 0.32 H new ATOM 0 HD12 ILE A 118 14.612 -2.854 -8.493 1.00 0.32 H new ATOM 0 HD13 ILE A 118 13.254 -1.725 -8.714 1.00 0.32 H new ATOM 1225 N VAL A 119 9.660 -5.748 -6.075 1.00 0.24 N ATOM 1226 CA VAL A 119 8.566 -6.573 -6.542 1.00 0.31 C ATOM 1227 C VAL A 119 7.698 -5.767 -7.501 1.00 0.27 C ATOM 1228 O VAL A 119 7.226 -6.278 -8.518 1.00 0.31 O ATOM 1229 CB VAL A 119 7.705 -7.094 -5.372 1.00 0.36 C ATOM 1230 CG1 VAL A 119 6.592 -7.985 -5.891 1.00 0.47 C ATOM 1231 CG2 VAL A 119 8.570 -7.829 -4.358 1.00 0.38 C ATOM 0 H VAL A 119 9.415 -5.109 -5.318 1.00 0.24 H new ATOM 0 HA VAL A 119 8.988 -7.437 -7.055 1.00 0.31 H new ATOM 0 HB VAL A 119 7.249 -6.242 -4.867 1.00 0.36 H new ATOM 0 HG11 VAL A 119 5.994 -8.345 -5.054 1.00 0.47 H new ATOM 0 HG12 VAL A 119 5.959 -7.417 -6.572 1.00 0.47 H new ATOM 0 HG13 VAL A 119 7.023 -8.835 -6.420 1.00 0.47 H new ATOM 0 HG21 VAL A 119 7.946 -8.189 -3.540 1.00 0.38 H new ATOM 0 HG22 VAL A 119 9.058 -8.675 -4.842 1.00 0.38 H new ATOM 0 HG23 VAL A 119 9.327 -7.150 -3.965 1.00 0.38 H new ATOM 1241 N ASN A 120 7.513 -4.495 -7.175 1.00 0.25 N ATOM 1242 CA ASN A 120 6.714 -3.595 -8.004 1.00 0.24 C ATOM 1243 C ASN A 120 7.142 -2.143 -7.788 1.00 0.23 C ATOM 1244 O ASN A 120 7.838 -1.827 -6.823 1.00 0.26 O ATOM 1245 CB ASN A 120 5.228 -3.781 -7.675 1.00 0.31 C ATOM 1246 CG ASN A 120 4.300 -2.984 -8.566 1.00 0.54 C ATOM 1247 OD1 ASN A 120 3.964 -3.410 -9.671 1.00 1.17 O ATOM 1248 ND2 ASN A 120 3.851 -1.840 -8.077 1.00 0.36 N ATOM 0 H ASN A 120 7.906 -4.060 -6.340 1.00 0.25 H new ATOM 0 HA ASN A 120 6.876 -3.837 -9.054 1.00 0.24 H new ATOM 0 HB2 ASN A 120 4.977 -4.838 -7.758 1.00 0.31 H new ATOM 0 HB3 ASN A 120 5.056 -3.493 -6.638 1.00 0.31 H new ATOM 0 HD21 ASN A 120 3.200 -1.273 -8.621 1.00 0.36 H new ATOM 0 HD22 ASN A 120 4.156 -1.524 -7.156 1.00 0.36 H new ATOM 1255 N GLU A 121 6.725 -1.270 -8.690 1.00 0.24 N ATOM 1256 CA GLU A 121 7.078 0.143 -8.627 1.00 0.25 C ATOM 1257 C GLU A 121 5.832 1.010 -8.542 1.00 0.25 C ATOM 1258 O GLU A 121 4.841 0.765 -9.231 1.00 0.32 O ATOM 1259 CB GLU A 121 7.903 0.551 -9.851 1.00 0.31 C ATOM 1260 CG GLU A 121 8.002 2.063 -10.056 1.00 0.35 C ATOM 1261 CD GLU A 121 8.657 2.449 -11.367 1.00 0.71 C ATOM 1262 OE1 GLU A 121 8.476 1.723 -12.366 1.00 1.17 O ATOM 1263 OE2 GLU A 121 9.359 3.479 -11.406 1.00 1.24 O ATOM 0 H GLU A 121 6.135 -1.517 -9.484 1.00 0.24 H new ATOM 0 HA GLU A 121 7.676 0.295 -7.728 1.00 0.25 H new ATOM 0 HB2 GLU A 121 8.908 0.141 -9.752 1.00 0.31 H new ATOM 0 HB3 GLU A 121 7.461 0.102 -10.741 1.00 0.31 H new ATOM 0 HG2 GLU A 121 7.002 2.494 -10.017 1.00 0.35 H new ATOM 0 HG3 GLU A 121 8.569 2.498 -9.233 1.00 0.35 H new ATOM 1270 N ILE A 122 5.891 2.021 -7.697 1.00 0.21 N ATOM 1271 CA ILE A 122 4.834 3.004 -7.602 1.00 0.23 C ATOM 1272 C ILE A 122 5.417 4.384 -7.873 1.00 0.26 C ATOM 1273 O ILE A 122 6.594 4.502 -8.208 1.00 0.25 O ATOM 1274 CB ILE A 122 4.113 2.959 -6.240 1.00 0.26 C ATOM 1275 CG1 ILE A 122 5.097 3.144 -5.088 1.00 0.27 C ATOM 1276 CG2 ILE A 122 3.367 1.643 -6.100 1.00 0.27 C ATOM 1277 CD1 ILE A 122 4.477 2.936 -3.726 1.00 0.31 C ATOM 0 H ILE A 122 6.671 2.182 -7.060 1.00 0.21 H new ATOM 0 HA ILE A 122 4.077 2.772 -8.351 1.00 0.23 H new ATOM 0 HB ILE A 122 3.399 3.782 -6.198 1.00 0.26 H new ATOM 0 HG12 ILE A 122 5.925 2.446 -5.212 1.00 0.27 H new ATOM 0 HG13 ILE A 122 5.517 4.148 -5.137 1.00 0.27 H new ATOM 0 HG21 ILE A 122 2.858 1.614 -5.136 1.00 0.27 H new ATOM 0 HG22 ILE A 122 2.633 1.554 -6.901 1.00 0.27 H new ATOM 0 HG23 ILE A 122 4.074 0.816 -6.162 1.00 0.27 H new ATOM 0 HD11 ILE A 122 5.234 3.083 -2.955 1.00 0.31 H new ATOM 0 HD12 ILE A 122 3.668 3.652 -3.581 1.00 0.31 H new ATOM 0 HD13 ILE A 122 4.082 1.923 -3.657 1.00 0.31 H new ATOM 1289 N LYS A 123 4.606 5.414 -7.774 1.00 0.30 N ATOM 1290 CA LYS A 123 5.050 6.751 -8.121 1.00 0.34 C ATOM 1291 C LYS A 123 6.019 7.289 -7.089 1.00 0.36 C ATOM 1292 O LYS A 123 5.661 7.529 -5.946 1.00 0.42 O ATOM 1293 CB LYS A 123 3.847 7.669 -8.273 1.00 0.39 C ATOM 1294 CG LYS A 123 4.213 9.038 -8.779 1.00 0.48 C ATOM 1295 CD LYS A 123 2.989 9.816 -9.215 1.00 0.75 C ATOM 1296 CE LYS A 123 1.907 9.786 -8.153 1.00 1.35 C ATOM 1297 NZ LYS A 123 0.679 10.508 -8.578 1.00 2.15 N ATOM 0 H LYS A 123 3.638 5.355 -7.457 1.00 0.30 H new ATOM 0 HA LYS A 123 5.580 6.708 -9.072 1.00 0.34 H new ATOM 0 HB2 LYS A 123 3.133 7.213 -8.959 1.00 0.39 H new ATOM 0 HB3 LYS A 123 3.346 7.765 -7.310 1.00 0.39 H new ATOM 0 HG2 LYS A 123 4.735 9.588 -7.996 1.00 0.48 H new ATOM 0 HG3 LYS A 123 4.903 8.944 -9.617 1.00 0.48 H new ATOM 0 HD2 LYS A 123 3.268 10.849 -9.423 1.00 0.75 H new ATOM 0 HD3 LYS A 123 2.601 9.397 -10.144 1.00 0.75 H new ATOM 0 HE2 LYS A 123 1.656 8.751 -7.923 1.00 1.35 H new ATOM 0 HE3 LYS A 123 2.289 10.233 -7.235 1.00 1.35 H new ATOM 0 HZ1 LYS A 123 -0.032 10.460 -7.820 1.00 2.15 H new ATOM 0 HZ2 LYS A 123 0.911 11.503 -8.773 1.00 2.15 H new ATOM 0 HZ3 LYS A 123 0.297 10.067 -9.439 1.00 2.15 H new ATOM 1311 N GLY A 124 7.260 7.461 -7.502 1.00 0.37 N ATOM 1312 CA GLY A 124 8.270 7.981 -6.613 1.00 0.42 C ATOM 1313 C GLY A 124 8.842 6.918 -5.698 1.00 0.38 C ATOM 1314 O GLY A 124 10.026 6.953 -5.363 1.00 0.42 O ATOM 0 H GLY A 124 7.588 7.248 -8.444 1.00 0.37 H new ATOM 0 HA2 GLY A 124 9.075 8.421 -7.201 1.00 0.42 H new ATOM 0 HA3 GLY A 124 7.841 8.782 -6.010 1.00 0.42 H new ATOM 1318 N GLY A 125 8.006 5.981 -5.275 1.00 0.34 N ATOM 1319 CA GLY A 125 8.480 4.914 -4.417 1.00 0.31 C ATOM 1320 C GLY A 125 8.448 3.551 -5.077 1.00 0.25 C ATOM 1321 O GLY A 125 7.879 3.376 -6.148 1.00 0.29 O ATOM 0 H GLY A 125 7.014 5.940 -5.509 1.00 0.34 H new ATOM 0 HA2 GLY A 125 9.501 5.135 -4.106 1.00 0.31 H new ATOM 0 HA3 GLY A 125 7.870 4.886 -3.514 1.00 0.31 H new ATOM 1325 N TYR A 126 9.079 2.585 -4.436 1.00 0.19 N ATOM 1326 CA TYR A 126 9.055 1.211 -4.895 1.00 0.16 C ATOM 1327 C TYR A 126 8.566 0.304 -3.791 1.00 0.16 C ATOM 1328 O TYR A 126 9.163 0.259 -2.719 1.00 0.17 O ATOM 1329 CB TYR A 126 10.453 0.763 -5.310 1.00 0.15 C ATOM 1330 CG TYR A 126 10.782 1.017 -6.755 1.00 0.18 C ATOM 1331 CD1 TYR A 126 10.890 2.304 -7.246 1.00 0.24 C ATOM 1332 CD2 TYR A 126 10.976 -0.038 -7.629 1.00 0.21 C ATOM 1333 CE1 TYR A 126 11.184 2.540 -8.570 1.00 0.29 C ATOM 1334 CE2 TYR A 126 11.275 0.182 -8.958 1.00 0.27 C ATOM 1335 CZ TYR A 126 11.380 1.472 -9.425 1.00 0.30 C ATOM 1336 OH TYR A 126 11.682 1.694 -10.750 1.00 0.38 O ATOM 0 H TYR A 126 9.621 2.731 -3.584 1.00 0.19 H new ATOM 0 HA TYR A 126 8.383 1.151 -5.751 1.00 0.16 H new ATOM 0 HB2 TYR A 126 11.186 1.276 -4.687 1.00 0.15 H new ATOM 0 HB3 TYR A 126 10.555 -0.303 -5.109 1.00 0.15 H new ATOM 0 HD1 TYR A 126 10.741 3.140 -6.579 1.00 0.24 H new ATOM 0 HD2 TYR A 126 10.892 -1.051 -7.265 1.00 0.21 H new ATOM 0 HE1 TYR A 126 11.261 3.552 -8.938 1.00 0.29 H new ATOM 0 HE2 TYR A 126 11.426 -0.652 -9.627 1.00 0.27 H new ATOM 0 HH TYR A 126 11.247 2.519 -11.051 1.00 0.38 H new ATOM 1346 N VAL A 127 7.491 -0.417 -4.040 1.00 0.18 N ATOM 1347 CA VAL A 127 7.060 -1.425 -3.096 1.00 0.20 C ATOM 1348 C VAL A 127 7.977 -2.636 -3.250 1.00 0.17 C ATOM 1349 O VAL A 127 7.967 -3.336 -4.267 1.00 0.20 O ATOM 1350 CB VAL A 127 5.561 -1.791 -3.270 1.00 0.29 C ATOM 1351 CG1 VAL A 127 5.201 -2.024 -4.731 1.00 0.55 C ATOM 1352 CG2 VAL A 127 5.197 -3.001 -2.420 1.00 0.60 C ATOM 0 H VAL A 127 6.910 -0.326 -4.873 1.00 0.18 H new ATOM 0 HA VAL A 127 7.138 -1.035 -2.081 1.00 0.20 H new ATOM 0 HB VAL A 127 4.975 -0.940 -2.924 1.00 0.29 H new ATOM 0 HG11 VAL A 127 4.144 -2.278 -4.809 1.00 0.55 H new ATOM 0 HG12 VAL A 127 5.400 -1.118 -5.304 1.00 0.55 H new ATOM 0 HG13 VAL A 127 5.801 -2.843 -5.127 1.00 0.55 H new ATOM 0 HG21 VAL A 127 4.142 -3.239 -2.558 1.00 0.60 H new ATOM 0 HG22 VAL A 127 5.804 -3.854 -2.723 1.00 0.60 H new ATOM 0 HG23 VAL A 127 5.384 -2.777 -1.370 1.00 0.60 H new ATOM 1362 N ILE A 128 8.791 -2.854 -2.232 1.00 0.14 N ATOM 1363 CA ILE A 128 9.915 -3.767 -2.330 1.00 0.12 C ATOM 1364 C ILE A 128 9.920 -4.768 -1.195 1.00 0.13 C ATOM 1365 O ILE A 128 9.414 -4.498 -0.111 1.00 0.16 O ATOM 1366 CB ILE A 128 11.258 -2.998 -2.316 1.00 0.13 C ATOM 1367 CG1 ILE A 128 11.357 -2.093 -1.075 1.00 0.16 C ATOM 1368 CG2 ILE A 128 11.406 -2.177 -3.588 1.00 0.16 C ATOM 1369 CD1 ILE A 128 12.663 -1.336 -0.968 1.00 0.19 C ATOM 0 H ILE A 128 8.692 -2.407 -1.321 1.00 0.14 H new ATOM 0 HA ILE A 128 9.804 -4.298 -3.275 1.00 0.12 H new ATOM 0 HB ILE A 128 12.070 -3.724 -2.271 1.00 0.13 H new ATOM 0 HG12 ILE A 128 10.535 -1.378 -1.093 1.00 0.16 H new ATOM 0 HG13 ILE A 128 11.229 -2.704 -0.181 1.00 0.16 H new ATOM 0 HG21 ILE A 128 12.355 -1.641 -3.566 1.00 0.16 H new ATOM 0 HG22 ILE A 128 11.383 -2.839 -4.453 1.00 0.16 H new ATOM 0 HG23 ILE A 128 10.586 -1.462 -3.657 1.00 0.16 H new ATOM 0 HD11 ILE A 128 12.655 -0.721 -0.068 1.00 0.19 H new ATOM 0 HD12 ILE A 128 13.491 -2.044 -0.917 1.00 0.19 H new ATOM 0 HD13 ILE A 128 12.786 -0.697 -1.842 1.00 0.19 H new ATOM 1381 N LYS A 129 10.496 -5.922 -1.451 1.00 0.15 N ATOM 1382 CA LYS A 129 10.650 -6.934 -0.428 1.00 0.18 C ATOM 1383 C LYS A 129 12.127 -7.182 -0.174 1.00 0.19 C ATOM 1384 O LYS A 129 12.801 -7.844 -0.964 1.00 0.20 O ATOM 1385 CB LYS A 129 9.961 -8.229 -0.853 1.00 0.22 C ATOM 1386 CG LYS A 129 10.107 -9.356 0.153 1.00 0.28 C ATOM 1387 CD LYS A 129 9.376 -10.602 -0.307 1.00 0.40 C ATOM 1388 CE LYS A 129 9.531 -11.733 0.691 1.00 0.51 C ATOM 1389 NZ LYS A 129 8.802 -12.949 0.253 1.00 0.76 N ATOM 0 H LYS A 129 10.867 -6.184 -2.364 1.00 0.15 H new ATOM 0 HA LYS A 129 10.183 -6.583 0.492 1.00 0.18 H new ATOM 0 HB2 LYS A 129 8.901 -8.031 -1.012 1.00 0.22 H new ATOM 0 HB3 LYS A 129 10.372 -8.552 -1.809 1.00 0.22 H new ATOM 0 HG2 LYS A 129 11.163 -9.584 0.297 1.00 0.28 H new ATOM 0 HG3 LYS A 129 9.715 -9.037 1.119 1.00 0.28 H new ATOM 0 HD2 LYS A 129 8.318 -10.376 -0.442 1.00 0.40 H new ATOM 0 HD3 LYS A 129 9.762 -10.915 -1.277 1.00 0.40 H new ATOM 0 HE2 LYS A 129 10.588 -11.967 0.816 1.00 0.51 H new ATOM 0 HE3 LYS A 129 9.158 -11.414 1.664 1.00 0.51 H new ATOM 0 HZ1 LYS A 129 9.207 -13.784 0.722 1.00 0.76 H new ATOM 0 HZ2 LYS A 129 7.797 -12.862 0.508 1.00 0.76 H new ATOM 0 HZ3 LYS A 129 8.890 -13.054 -0.778 1.00 0.76 H new ATOM 1403 N VAL A 130 12.621 -6.656 0.934 1.00 0.21 N ATOM 1404 CA VAL A 130 14.018 -6.777 1.285 1.00 0.24 C ATOM 1405 C VAL A 130 14.151 -7.435 2.654 1.00 0.29 C ATOM 1406 O VAL A 130 13.360 -7.158 3.561 1.00 0.29 O ATOM 1407 CB VAL A 130 14.732 -5.393 1.269 1.00 0.24 C ATOM 1408 CG1 VAL A 130 13.923 -4.376 0.484 1.00 0.26 C ATOM 1409 CG2 VAL A 130 15.010 -4.855 2.665 1.00 0.26 C ATOM 0 H VAL A 130 12.063 -6.135 1.611 1.00 0.21 H new ATOM 0 HA VAL A 130 14.505 -7.404 0.538 1.00 0.24 H new ATOM 0 HB VAL A 130 15.693 -5.553 0.781 1.00 0.24 H new ATOM 0 HG11 VAL A 130 14.442 -3.418 0.487 1.00 0.26 H new ATOM 0 HG12 VAL A 130 13.804 -4.721 -0.543 1.00 0.26 H new ATOM 0 HG13 VAL A 130 12.942 -4.259 0.944 1.00 0.26 H new ATOM 0 HG21 VAL A 130 15.509 -3.889 2.590 1.00 0.26 H new ATOM 0 HG22 VAL A 130 14.070 -4.737 3.204 1.00 0.26 H new ATOM 0 HG23 VAL A 130 15.651 -5.553 3.203 1.00 0.26 H new ATOM 1419 N ASP A 131 15.109 -8.350 2.772 1.00 0.36 N ATOM 1420 CA ASP A 131 15.432 -8.991 4.047 1.00 0.44 C ATOM 1421 C ASP A 131 14.241 -9.802 4.572 1.00 0.43 C ATOM 1422 O ASP A 131 14.109 -10.065 5.768 1.00 0.50 O ATOM 1423 CB ASP A 131 15.881 -7.921 5.055 1.00 0.48 C ATOM 1424 CG ASP A 131 16.425 -8.495 6.351 1.00 0.59 C ATOM 1425 OD1 ASP A 131 17.545 -9.045 6.342 1.00 0.74 O ATOM 1426 OD2 ASP A 131 15.748 -8.382 7.393 1.00 0.59 O ATOM 0 H ASP A 131 15.682 -8.668 1.991 1.00 0.36 H new ATOM 0 HA ASP A 131 16.251 -9.694 3.900 1.00 0.44 H new ATOM 0 HB2 ASP A 131 16.647 -7.298 4.594 1.00 0.48 H new ATOM 0 HB3 ASP A 131 15.036 -7.271 5.282 1.00 0.48 H new ATOM 1431 N GLY A 132 13.377 -10.209 3.654 1.00 0.39 N ATOM 1432 CA GLY A 132 12.214 -10.993 4.017 1.00 0.40 C ATOM 1433 C GLY A 132 11.076 -10.129 4.513 1.00 0.40 C ATOM 1434 O GLY A 132 10.106 -10.626 5.089 1.00 0.59 O ATOM 0 H GLY A 132 13.462 -10.009 2.657 1.00 0.39 H new ATOM 0 HA2 GLY A 132 11.881 -11.568 3.153 1.00 0.40 H new ATOM 0 HA3 GLY A 132 12.488 -11.710 4.791 1.00 0.40 H new ATOM 1438 N LYS A 133 11.197 -8.830 4.296 1.00 0.30 N ATOM 1439 CA LYS A 133 10.186 -7.877 4.714 1.00 0.29 C ATOM 1440 C LYS A 133 9.825 -6.957 3.569 1.00 0.26 C ATOM 1441 O LYS A 133 10.550 -6.857 2.590 1.00 0.33 O ATOM 1442 CB LYS A 133 10.685 -7.061 5.907 1.00 0.33 C ATOM 1443 CG LYS A 133 10.647 -7.828 7.215 1.00 0.40 C ATOM 1444 CD LYS A 133 11.430 -7.128 8.315 1.00 0.80 C ATOM 1445 CE LYS A 133 12.924 -7.141 8.033 1.00 0.62 C ATOM 1446 NZ LYS A 133 13.689 -6.356 9.040 1.00 1.15 N ATOM 0 H LYS A 133 11.998 -8.408 3.826 1.00 0.30 H new ATOM 0 HA LYS A 133 9.295 -8.428 5.015 1.00 0.29 H new ATOM 0 HB2 LYS A 133 11.707 -6.736 5.714 1.00 0.33 H new ATOM 0 HB3 LYS A 133 10.077 -6.161 6.003 1.00 0.33 H new ATOM 0 HG2 LYS A 133 9.611 -7.952 7.531 1.00 0.40 H new ATOM 0 HG3 LYS A 133 11.055 -8.827 7.060 1.00 0.40 H new ATOM 0 HD2 LYS A 133 11.086 -6.098 8.409 1.00 0.80 H new ATOM 0 HD3 LYS A 133 11.235 -7.617 9.269 1.00 0.80 H new ATOM 0 HE2 LYS A 133 13.283 -8.170 8.027 1.00 0.62 H new ATOM 0 HE3 LYS A 133 13.109 -6.733 7.039 1.00 0.62 H new ATOM 0 HZ1 LYS A 133 14.703 -6.391 8.810 1.00 1.15 H new ATOM 0 HZ2 LYS A 133 13.365 -5.368 9.029 1.00 1.15 H new ATOM 0 HZ3 LYS A 133 13.534 -6.760 9.986 1.00 1.15 H new ATOM 1460 N TYR A 134 8.704 -6.285 3.701 1.00 0.25 N ATOM 1461 CA TYR A 134 8.208 -5.432 2.637 1.00 0.23 C ATOM 1462 C TYR A 134 8.287 -3.970 3.026 1.00 0.22 C ATOM 1463 O TYR A 134 7.920 -3.588 4.138 1.00 0.26 O ATOM 1464 CB TYR A 134 6.777 -5.801 2.295 1.00 0.28 C ATOM 1465 CG TYR A 134 6.609 -6.334 0.896 1.00 0.46 C ATOM 1466 CD1 TYR A 134 6.470 -5.478 -0.184 1.00 0.64 C ATOM 1467 CD2 TYR A 134 6.568 -7.694 0.664 1.00 0.63 C ATOM 1468 CE1 TYR A 134 6.287 -5.966 -1.459 1.00 0.88 C ATOM 1469 CE2 TYR A 134 6.378 -8.193 -0.615 1.00 0.86 C ATOM 1470 CZ TYR A 134 6.237 -7.323 -1.664 1.00 0.91 C ATOM 1471 OH TYR A 134 6.019 -7.813 -2.921 1.00 1.22 O ATOM 0 H TYR A 134 8.116 -6.310 4.534 1.00 0.25 H new ATOM 0 HA TYR A 134 8.838 -5.586 1.761 1.00 0.23 H new ATOM 0 HB2 TYR A 134 6.424 -6.549 3.005 1.00 0.28 H new ATOM 0 HB3 TYR A 134 6.145 -4.922 2.418 1.00 0.28 H new ATOM 0 HD1 TYR A 134 6.506 -4.411 -0.024 1.00 0.64 H new ATOM 0 HD2 TYR A 134 6.686 -8.379 1.491 1.00 0.63 H new ATOM 0 HE1 TYR A 134 6.184 -5.286 -2.292 1.00 0.88 H new ATOM 0 HE2 TYR A 134 6.341 -9.259 -0.783 1.00 0.86 H new ATOM 0 HH TYR A 134 6.014 -8.793 -2.894 1.00 1.22 H new ATOM 1481 N TYR A 135 8.767 -3.165 2.099 1.00 0.19 N ATOM 1482 CA TYR A 135 8.939 -1.743 2.315 1.00 0.20 C ATOM 1483 C TYR A 135 8.529 -0.985 1.076 1.00 0.19 C ATOM 1484 O TYR A 135 8.170 -1.578 0.062 1.00 0.21 O ATOM 1485 CB TYR A 135 10.401 -1.409 2.614 1.00 0.19 C ATOM 1486 CG TYR A 135 11.015 -2.213 3.717 1.00 0.21 C ATOM 1487 CD1 TYR A 135 11.627 -3.423 3.447 1.00 0.22 C ATOM 1488 CD2 TYR A 135 10.998 -1.756 5.022 1.00 0.28 C ATOM 1489 CE1 TYR A 135 12.203 -4.157 4.437 1.00 0.26 C ATOM 1490 CE2 TYR A 135 11.576 -2.490 6.031 1.00 0.32 C ATOM 1491 CZ TYR A 135 12.180 -3.693 5.734 1.00 0.31 C ATOM 1492 OH TYR A 135 12.763 -4.430 6.735 1.00 0.37 O ATOM 0 H TYR A 135 9.050 -3.481 1.171 1.00 0.19 H new ATOM 0 HA TYR A 135 8.319 -1.457 3.164 1.00 0.20 H new ATOM 0 HB2 TYR A 135 10.986 -1.557 1.706 1.00 0.19 H new ATOM 0 HB3 TYR A 135 10.473 -0.352 2.870 1.00 0.19 H new ATOM 0 HD1 TYR A 135 11.648 -3.792 2.432 1.00 0.22 H new ATOM 0 HD2 TYR A 135 10.526 -0.812 5.251 1.00 0.28 H new ATOM 0 HE1 TYR A 135 12.677 -5.100 4.207 1.00 0.26 H new ATOM 0 HE2 TYR A 135 11.557 -2.127 7.048 1.00 0.32 H new ATOM 0 HH TYR A 135 12.660 -3.961 7.589 1.00 0.37 H new ATOM 1502 N VAL A 136 8.587 0.326 1.166 1.00 0.21 N ATOM 1503 CA VAL A 136 8.374 1.176 0.019 1.00 0.22 C ATOM 1504 C VAL A 136 9.498 2.192 -0.085 1.00 0.23 C ATOM 1505 O VAL A 136 9.613 3.107 0.726 1.00 0.31 O ATOM 1506 CB VAL A 136 7.005 1.876 0.074 1.00 0.25 C ATOM 1507 CG1 VAL A 136 6.890 2.935 -1.016 1.00 0.26 C ATOM 1508 CG2 VAL A 136 5.899 0.842 -0.070 1.00 0.26 C ATOM 0 H VAL A 136 8.782 0.829 2.032 1.00 0.21 H new ATOM 0 HA VAL A 136 8.376 0.550 -0.873 1.00 0.22 H new ATOM 0 HB VAL A 136 6.906 2.377 1.037 1.00 0.25 H new ATOM 0 HG11 VAL A 136 5.913 3.415 -0.955 1.00 0.26 H new ATOM 0 HG12 VAL A 136 7.671 3.683 -0.880 1.00 0.26 H new ATOM 0 HG13 VAL A 136 7.003 2.465 -1.993 1.00 0.26 H new ATOM 0 HG21 VAL A 136 4.929 1.338 -0.031 1.00 0.26 H new ATOM 0 HG22 VAL A 136 6.005 0.327 -1.025 1.00 0.26 H new ATOM 0 HG23 VAL A 136 5.969 0.119 0.742 1.00 0.26 H new ATOM 1518 N TYR A 137 10.318 2.021 -1.098 1.00 0.20 N ATOM 1519 CA TYR A 137 11.491 2.848 -1.290 1.00 0.24 C ATOM 1520 C TYR A 137 11.108 4.179 -1.861 1.00 0.27 C ATOM 1521 O TYR A 137 10.806 4.298 -3.039 1.00 0.46 O ATOM 1522 CB TYR A 137 12.471 2.152 -2.231 1.00 0.35 C ATOM 1523 CG TYR A 137 13.495 3.093 -2.803 1.00 0.50 C ATOM 1524 CD1 TYR A 137 14.414 3.684 -1.978 1.00 0.59 C ATOM 1525 CD2 TYR A 137 13.532 3.395 -4.156 1.00 0.63 C ATOM 1526 CE1 TYR A 137 15.356 4.556 -2.466 1.00 0.76 C ATOM 1527 CE2 TYR A 137 14.472 4.268 -4.661 1.00 0.78 C ATOM 1528 CZ TYR A 137 15.385 4.847 -3.811 1.00 0.77 C ATOM 1529 OH TYR A 137 16.333 5.715 -4.303 1.00 1.01 O ATOM 0 H TYR A 137 10.191 1.305 -1.813 1.00 0.20 H new ATOM 0 HA TYR A 137 11.966 3.003 -0.321 1.00 0.24 H new ATOM 0 HB2 TYR A 137 12.979 1.352 -1.693 1.00 0.35 H new ATOM 0 HB3 TYR A 137 11.917 1.686 -3.046 1.00 0.35 H new ATOM 0 HD1 TYR A 137 14.398 3.460 -0.922 1.00 0.59 H new ATOM 0 HD2 TYR A 137 12.815 2.940 -4.823 1.00 0.63 H new ATOM 0 HE1 TYR A 137 16.071 5.012 -1.797 1.00 0.76 H new ATOM 0 HE2 TYR A 137 14.491 4.496 -5.717 1.00 0.78 H new ATOM 0 HH TYR A 137 16.217 5.812 -5.271 1.00 1.01 H new ATOM 1539 N LEU A 138 11.125 5.178 -1.017 1.00 0.29 N ATOM 1540 CA LEU A 138 10.767 6.495 -1.444 1.00 0.38 C ATOM 1541 C LEU A 138 11.983 7.251 -1.925 1.00 0.44 C ATOM 1542 O LEU A 138 12.944 7.451 -1.182 1.00 0.50 O ATOM 1543 CB LEU A 138 10.100 7.230 -0.309 1.00 0.48 C ATOM 1544 CG LEU A 138 8.960 8.130 -0.745 1.00 0.64 C ATOM 1545 CD1 LEU A 138 7.916 7.318 -1.499 1.00 0.72 C ATOM 1546 CD2 LEU A 138 8.343 8.828 0.449 1.00 0.72 C ATOM 0 H LEU A 138 11.383 5.100 -0.033 1.00 0.29 H new ATOM 0 HA LEU A 138 10.069 6.419 -2.278 1.00 0.38 H new ATOM 0 HB2 LEU A 138 9.721 6.503 0.409 1.00 0.48 H new ATOM 0 HB3 LEU A 138 10.847 7.831 0.210 1.00 0.48 H new ATOM 0 HG LEU A 138 9.353 8.896 -1.413 1.00 0.64 H new ATOM 0 HD11 LEU A 138 7.101 7.972 -1.809 1.00 0.72 H new ATOM 0 HD12 LEU A 138 8.373 6.866 -2.379 1.00 0.72 H new ATOM 0 HD13 LEU A 138 7.526 6.534 -0.850 1.00 0.72 H new ATOM 0 HD21 LEU A 138 7.527 9.469 0.114 1.00 0.72 H new ATOM 0 HD22 LEU A 138 7.958 8.084 1.146 1.00 0.72 H new ATOM 0 HD23 LEU A 138 9.100 9.434 0.947 1.00 0.72 H new ATOM 1558 N LYS A 139 11.937 7.648 -3.178 1.00 0.46 N ATOM 1559 CA LYS A 139 13.004 8.435 -3.768 1.00 0.54 C ATOM 1560 C LYS A 139 12.931 9.868 -3.261 1.00 0.64 C ATOM 1561 O LYS A 139 13.927 10.591 -3.249 1.00 0.74 O ATOM 1562 CB LYS A 139 12.920 8.400 -5.290 1.00 0.56 C ATOM 1563 CG LYS A 139 13.111 7.010 -5.872 1.00 0.50 C ATOM 1564 CD LYS A 139 13.204 7.039 -7.389 1.00 0.59 C ATOM 1565 CE LYS A 139 14.389 7.866 -7.863 1.00 1.51 C ATOM 1566 NZ LYS A 139 15.671 7.395 -7.275 1.00 2.31 N ATOM 0 H LYS A 139 11.167 7.438 -3.814 1.00 0.46 H new ATOM 0 HA LYS A 139 13.961 8.005 -3.473 1.00 0.54 H new ATOM 0 HB2 LYS A 139 11.950 8.787 -5.602 1.00 0.56 H new ATOM 0 HB3 LYS A 139 13.677 9.066 -5.704 1.00 0.56 H new ATOM 0 HG2 LYS A 139 14.018 6.566 -5.461 1.00 0.50 H new ATOM 0 HG3 LYS A 139 12.279 6.373 -5.571 1.00 0.50 H new ATOM 0 HD2 LYS A 139 13.296 6.021 -7.768 1.00 0.59 H new ATOM 0 HD3 LYS A 139 12.284 7.451 -7.802 1.00 0.59 H new ATOM 0 HE2 LYS A 139 14.451 7.820 -8.950 1.00 1.51 H new ATOM 0 HE3 LYS A 139 14.231 8.911 -7.597 1.00 1.51 H new ATOM 0 HZ1 LYS A 139 16.467 7.844 -7.772 1.00 2.31 H new ATOM 0 HZ2 LYS A 139 15.705 7.649 -6.267 1.00 2.31 H new ATOM 0 HZ3 LYS A 139 15.740 6.362 -7.374 1.00 2.31 H new ATOM 1580 N ASP A 140 11.746 10.260 -2.811 1.00 0.66 N ATOM 1581 CA ASP A 140 11.535 11.586 -2.262 1.00 0.78 C ATOM 1582 C ASP A 140 10.772 11.475 -0.952 1.00 0.77 C ATOM 1583 O ASP A 140 9.540 11.507 -0.925 1.00 0.88 O ATOM 1584 CB ASP A 140 10.764 12.459 -3.248 1.00 1.00 C ATOM 1585 CG ASP A 140 10.655 13.901 -2.794 1.00 1.24 C ATOM 1586 OD1 ASP A 140 9.892 14.181 -1.852 1.00 1.58 O ATOM 1587 OD2 ASP A 140 11.328 14.769 -3.387 1.00 1.57 O ATOM 0 H ASP A 140 10.913 9.671 -2.817 1.00 0.66 H new ATOM 0 HA ASP A 140 12.503 12.052 -2.079 1.00 0.78 H new ATOM 0 HB2 ASP A 140 11.257 12.425 -4.219 1.00 1.00 H new ATOM 0 HB3 ASP A 140 9.763 12.049 -3.384 1.00 1.00 H new ATOM 1592 N ALA A 141 11.512 11.314 0.130 1.00 0.73 N ATOM 1593 CA ALA A 141 10.916 11.159 1.446 1.00 0.79 C ATOM 1594 C ALA A 141 10.510 12.507 2.030 1.00 0.97 C ATOM 1595 O ALA A 141 9.865 12.570 3.072 1.00 1.12 O ATOM 1596 CB ALA A 141 11.884 10.451 2.379 1.00 0.86 C ATOM 0 H ALA A 141 12.532 11.287 0.124 1.00 0.73 H new ATOM 0 HA ALA A 141 10.016 10.554 1.341 1.00 0.79 H new ATOM 0 HB1 ALA A 141 11.427 10.340 3.362 1.00 0.86 H new ATOM 0 HB2 ALA A 141 12.122 9.466 1.977 1.00 0.86 H new ATOM 0 HB3 ALA A 141 12.798 11.038 2.468 1.00 0.86 H new ATOM 1602 N ALA A 142 10.876 13.580 1.343 1.00 1.02 N ATOM 1603 CA ALA A 142 10.692 14.922 1.875 1.00 1.26 C ATOM 1604 C ALA A 142 9.317 15.494 1.545 1.00 1.37 C ATOM 1605 O ALA A 142 8.647 16.054 2.411 1.00 1.60 O ATOM 1606 CB ALA A 142 11.777 15.845 1.344 1.00 1.38 C ATOM 0 H ALA A 142 11.302 13.547 0.417 1.00 1.02 H new ATOM 0 HA ALA A 142 10.763 14.852 2.960 1.00 1.26 H new ATOM 0 HB1 ALA A 142 11.632 16.847 1.747 1.00 1.38 H new ATOM 0 HB2 ALA A 142 12.754 15.470 1.648 1.00 1.38 H new ATOM 0 HB3 ALA A 142 11.724 15.881 0.256 1.00 1.38 H new ATOM 1612 N HIS A 143 8.889 15.348 0.298 1.00 1.30 N ATOM 1613 CA HIS A 143 7.655 15.984 -0.159 1.00 1.50 C ATOM 1614 C HIS A 143 6.513 14.984 -0.207 1.00 1.25 C ATOM 1615 O HIS A 143 5.435 15.281 -0.722 1.00 1.33 O ATOM 1616 CB HIS A 143 7.842 16.596 -1.545 1.00 1.74 C ATOM 1617 CG HIS A 143 9.068 17.447 -1.672 1.00 2.20 C ATOM 1618 ND1 HIS A 143 10.181 17.068 -2.394 1.00 2.83 N ATOM 1619 CD2 HIS A 143 9.352 18.669 -1.166 1.00 2.47 C ATOM 1620 CE1 HIS A 143 11.089 18.020 -2.330 1.00 3.41 C ATOM 1621 NE2 HIS A 143 10.613 19.001 -1.592 1.00 3.11 N ATOM 0 H HIS A 143 9.372 14.799 -0.413 1.00 1.30 H new ATOM 0 HA HIS A 143 7.411 16.772 0.554 1.00 1.50 H new ATOM 0 HB2 HIS A 143 7.890 15.794 -2.282 1.00 1.74 H new ATOM 0 HB3 HIS A 143 6.967 17.199 -1.786 1.00 1.74 H new ATOM 0 HD1 HIS A 143 10.285 16.188 -2.899 1.00 2.83 H new ATOM 0 HD2 HIS A 143 8.707 19.271 -0.543 1.00 2.47 H new ATOM 0 HE1 HIS A 143 12.060 17.999 -2.803 1.00 3.41 H new ATOM 1630 N ALA A 144 6.779 13.797 0.328 1.00 0.99 N ATOM 1631 CA ALA A 144 5.808 12.714 0.385 1.00 0.77 C ATOM 1632 C ALA A 144 5.420 12.204 -0.992 1.00 0.76 C ATOM 1633 O ALA A 144 4.478 12.689 -1.622 1.00 1.13 O ATOM 1634 CB ALA A 144 4.573 13.133 1.143 1.00 0.88 C ATOM 0 H ALA A 144 7.683 13.559 0.737 1.00 0.99 H new ATOM 0 HA ALA A 144 6.294 11.895 0.914 1.00 0.77 H new ATOM 0 HB1 ALA A 144 3.864 12.305 1.170 1.00 0.88 H new ATOM 0 HB2 ALA A 144 4.847 13.410 2.161 1.00 0.88 H new ATOM 0 HB3 ALA A 144 4.114 13.988 0.646 1.00 0.88 H new ATOM 1640 N ASP A 145 6.130 11.193 -1.424 1.00 0.59 N ATOM 1641 CA ASP A 145 5.815 10.484 -2.645 1.00 0.87 C ATOM 1642 C ASP A 145 4.862 9.368 -2.319 1.00 0.66 C ATOM 1643 O ASP A 145 5.220 8.194 -2.355 1.00 0.75 O ATOM 1644 CB ASP A 145 7.063 9.971 -3.366 1.00 1.23 C ATOM 1645 CG ASP A 145 7.338 10.735 -4.651 1.00 1.79 C ATOM 1646 OD1 ASP A 145 6.654 10.479 -5.663 1.00 1.99 O ATOM 1647 OD2 ASP A 145 8.238 11.597 -4.659 1.00 2.20 O ATOM 0 H ASP A 145 6.951 10.833 -0.936 1.00 0.59 H new ATOM 0 HA ASP A 145 5.343 11.178 -3.341 1.00 0.87 H new ATOM 0 HB2 ASP A 145 7.924 10.056 -2.703 1.00 1.23 H new ATOM 0 HB3 ASP A 145 6.940 8.912 -3.594 1.00 1.23 H new ATOM 1652 N ASN A 146 3.665 9.795 -1.914 1.00 0.48 N ATOM 1653 CA ASN A 146 2.535 8.921 -1.614 1.00 0.32 C ATOM 1654 C ASN A 146 2.611 8.417 -0.186 1.00 0.25 C ATOM 1655 O ASN A 146 2.341 7.248 0.070 1.00 0.37 O ATOM 1656 CB ASN A 146 2.545 7.697 -2.507 1.00 0.38 C ATOM 1657 CG ASN A 146 2.693 7.951 -3.981 1.00 0.76 C ATOM 1658 OD1 ASN A 146 3.513 7.114 -4.583 1.00 1.69 O flip ATOM 1659 ND2 ASN A 146 2.134 8.888 -4.552 1.00 0.65 N flip ATOM 0 H ASN A 146 3.451 10.784 -1.783 1.00 0.48 H new ATOM 0 HA ASN A 146 1.632 9.510 -1.774 1.00 0.32 H new ATOM 0 HB2 ASN A 146 3.360 7.047 -2.188 1.00 0.38 H new ATOM 0 HB3 ASN A 146 1.617 7.148 -2.346 1.00 0.38 H new ATOM 0 HD21 ASN A 146 1.509 9.503 -4.031 1.00 0.65 H new ATOM 0 HD22 ASN A 146 2.296 9.049 -5.546 1.00 0.65 H new ATOM 1666 N ILE A 147 2.970 9.276 0.752 1.00 0.30 N ATOM 1667 CA ILE A 147 3.105 8.827 2.128 1.00 0.34 C ATOM 1668 C ILE A 147 2.251 9.631 3.086 1.00 0.38 C ATOM 1669 O ILE A 147 2.393 10.848 3.207 1.00 0.46 O ATOM 1670 CB ILE A 147 4.560 8.866 2.623 1.00 0.42 C ATOM 1671 CG1 ILE A 147 5.455 8.004 1.728 1.00 0.46 C ATOM 1672 CG2 ILE A 147 4.623 8.395 4.066 1.00 0.49 C ATOM 1673 CD1 ILE A 147 5.084 6.535 1.713 1.00 0.50 C ATOM 0 H ILE A 147 3.169 10.264 0.594 1.00 0.30 H new ATOM 0 HA ILE A 147 2.759 7.793 2.118 1.00 0.34 H new ATOM 0 HB ILE A 147 4.926 9.892 2.573 1.00 0.42 H new ATOM 0 HG12 ILE A 147 5.411 8.389 0.709 1.00 0.46 H new ATOM 0 HG13 ILE A 147 6.488 8.103 2.062 1.00 0.46 H new ATOM 0 HG21 ILE A 147 5.656 8.424 4.413 1.00 0.49 H new ATOM 0 HG22 ILE A 147 4.012 9.048 4.689 1.00 0.49 H new ATOM 0 HG23 ILE A 147 4.246 7.374 4.132 1.00 0.49 H new ATOM 0 HD11 ILE A 147 5.765 5.994 1.056 1.00 0.50 H new ATOM 0 HD12 ILE A 147 5.157 6.131 2.723 1.00 0.50 H new ATOM 0 HD13 ILE A 147 4.063 6.421 1.349 1.00 0.50 H new ATOM 1685 N ARG A 148 1.355 8.926 3.745 1.00 0.36 N ATOM 1686 CA ARG A 148 0.618 9.454 4.868 1.00 0.38 C ATOM 1687 C ARG A 148 1.265 8.957 6.153 1.00 0.36 C ATOM 1688 O ARG A 148 1.524 7.759 6.299 1.00 0.39 O ATOM 1689 CB ARG A 148 -0.830 8.975 4.817 1.00 0.45 C ATOM 1690 CG ARG A 148 -1.779 9.829 3.985 1.00 0.62 C ATOM 1691 CD ARG A 148 -1.365 9.969 2.529 1.00 0.83 C ATOM 1692 NE ARG A 148 -0.513 11.132 2.287 1.00 0.98 N ATOM 1693 CZ ARG A 148 -0.286 11.645 1.076 1.00 1.03 C ATOM 1694 NH1 ARG A 148 -0.900 11.134 0.014 1.00 1.40 N ATOM 1695 NH2 ARG A 148 0.533 12.680 0.931 1.00 1.78 N ATOM 0 H ARG A 148 1.118 7.962 3.512 1.00 0.36 H new ATOM 0 HA ARG A 148 0.632 10.543 4.833 1.00 0.38 H new ATOM 0 HB2 ARG A 148 -0.844 7.959 4.422 1.00 0.45 H new ATOM 0 HB3 ARG A 148 -1.213 8.926 5.836 1.00 0.45 H new ATOM 0 HG2 ARG A 148 -2.777 9.393 4.028 1.00 0.62 H new ATOM 0 HG3 ARG A 148 -1.845 10.821 4.431 1.00 0.62 H new ATOM 0 HD2 ARG A 148 -0.837 9.068 2.219 1.00 0.83 H new ATOM 0 HD3 ARG A 148 -2.258 10.044 1.909 1.00 0.83 H new ATOM 0 HE ARG A 148 -0.067 11.577 3.089 1.00 0.98 H new ATOM 0 HH11 ARG A 148 -1.544 10.351 0.125 1.00 1.40 H new ATOM 0 HH12 ARG A 148 -0.727 11.525 -0.912 1.00 1.40 H new ATOM 0 HH21 ARG A 148 0.991 13.086 1.747 1.00 1.78 H new ATOM 0 HH22 ARG A 148 0.704 13.069 0.004 1.00 1.78 H new ATOM 1709 N THR A 149 1.559 9.871 7.060 1.00 0.33 N ATOM 1710 CA THR A 149 2.037 9.497 8.380 1.00 0.31 C ATOM 1711 C THR A 149 0.958 8.743 9.122 1.00 0.28 C ATOM 1712 O THR A 149 -0.202 8.799 8.738 1.00 0.29 O ATOM 1713 CB THR A 149 2.421 10.734 9.210 1.00 0.34 C ATOM 1714 OG1 THR A 149 1.365 11.699 9.164 1.00 0.37 O ATOM 1715 CG2 THR A 149 3.705 11.349 8.692 1.00 0.40 C ATOM 0 H THR A 149 1.476 10.876 6.908 1.00 0.33 H new ATOM 0 HA THR A 149 2.919 8.871 8.244 1.00 0.31 H new ATOM 0 HB THR A 149 2.579 10.422 10.242 1.00 0.34 H new ATOM 0 HG1 THR A 149 1.615 12.483 9.696 1.00 0.37 H new ATOM 0 HG21 THR A 149 3.958 12.222 9.293 1.00 0.40 H new ATOM 0 HG22 THR A 149 4.511 10.618 8.757 1.00 0.40 H new ATOM 0 HG23 THR A 149 3.571 11.650 7.653 1.00 0.40 H new ATOM 1723 N LYS A 150 1.325 8.061 10.184 1.00 0.31 N ATOM 1724 CA LYS A 150 0.346 7.368 11.005 1.00 0.34 C ATOM 1725 C LYS A 150 -0.684 8.369 11.513 1.00 0.31 C ATOM 1726 O LYS A 150 -1.875 8.069 11.616 1.00 0.39 O ATOM 1727 CB LYS A 150 1.050 6.669 12.155 1.00 0.41 C ATOM 1728 CG LYS A 150 2.164 5.756 11.700 1.00 0.63 C ATOM 1729 CD LYS A 150 2.894 5.176 12.887 1.00 1.48 C ATOM 1730 CE LYS A 150 3.504 6.262 13.761 1.00 2.24 C ATOM 1731 NZ LYS A 150 4.496 7.086 13.021 1.00 3.02 N ATOM 0 H LYS A 150 2.290 7.969 10.502 1.00 0.31 H new ATOM 0 HA LYS A 150 -0.172 6.612 10.415 1.00 0.34 H new ATOM 0 HB2 LYS A 150 1.457 7.419 12.834 1.00 0.41 H new ATOM 0 HB3 LYS A 150 0.321 6.089 12.721 1.00 0.41 H new ATOM 0 HG2 LYS A 150 1.755 4.951 11.089 1.00 0.63 H new ATOM 0 HG3 LYS A 150 2.862 6.310 11.072 1.00 0.63 H new ATOM 0 HD2 LYS A 150 2.204 4.577 13.481 1.00 1.48 H new ATOM 0 HD3 LYS A 150 3.680 4.506 12.538 1.00 1.48 H new ATOM 0 HE2 LYS A 150 2.712 6.906 14.143 1.00 2.24 H new ATOM 0 HE3 LYS A 150 3.987 5.803 14.624 1.00 2.24 H new ATOM 0 HZ1 LYS A 150 4.995 7.709 13.687 1.00 3.02 H new ATOM 0 HZ2 LYS A 150 5.182 6.463 12.549 1.00 3.02 H new ATOM 0 HZ3 LYS A 150 4.005 7.663 12.308 1.00 3.02 H new ATOM 1745 N GLU A 151 -0.206 9.576 11.787 1.00 0.29 N ATOM 1746 CA GLU A 151 -1.071 10.680 12.161 1.00 0.34 C ATOM 1747 C GLU A 151 -1.972 11.090 10.999 1.00 0.36 C ATOM 1748 O GLU A 151 -3.187 11.232 11.162 1.00 0.48 O ATOM 1749 CB GLU A 151 -0.233 11.872 12.621 1.00 0.44 C ATOM 1750 CG GLU A 151 0.528 11.623 13.906 1.00 0.56 C ATOM 1751 CD GLU A 151 1.619 12.643 14.141 1.00 1.01 C ATOM 1752 OE1 GLU A 151 1.328 13.727 14.691 1.00 1.19 O ATOM 1753 OE2 GLU A 151 2.780 12.368 13.775 1.00 1.36 O ATOM 0 H GLU A 151 0.786 9.813 11.756 1.00 0.29 H new ATOM 0 HA GLU A 151 -1.706 10.350 12.983 1.00 0.34 H new ATOM 0 HB2 GLU A 151 0.475 12.132 11.834 1.00 0.44 H new ATOM 0 HB3 GLU A 151 -0.887 12.733 12.758 1.00 0.44 H new ATOM 0 HG2 GLU A 151 -0.167 11.640 14.745 1.00 0.56 H new ATOM 0 HG3 GLU A 151 0.968 10.626 13.877 1.00 0.56 H new ATOM 1760 N GLU A 152 -1.372 11.260 9.823 1.00 0.34 N ATOM 1761 CA GLU A 152 -2.108 11.702 8.646 1.00 0.40 C ATOM 1762 C GLU A 152 -3.091 10.652 8.187 1.00 0.40 C ATOM 1763 O GLU A 152 -4.171 10.982 7.726 1.00 0.50 O ATOM 1764 CB GLU A 152 -1.165 12.019 7.495 1.00 0.44 C ATOM 1765 CG GLU A 152 -1.860 12.675 6.315 1.00 0.54 C ATOM 1766 CD GLU A 152 -0.885 13.260 5.317 1.00 0.67 C ATOM 1767 OE1 GLU A 152 -0.169 12.486 4.651 1.00 0.83 O ATOM 1768 OE2 GLU A 152 -0.815 14.499 5.208 1.00 0.76 O ATOM 0 H GLU A 152 -0.378 11.098 9.662 1.00 0.34 H new ATOM 0 HA GLU A 152 -2.649 12.604 8.934 1.00 0.40 H new ATOM 0 HB2 GLU A 152 -0.373 12.677 7.853 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.688 11.098 7.161 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -2.489 11.939 5.814 1.00 0.54 H new ATOM 0 HG3 GLU A 152 -2.519 13.464 6.679 1.00 0.54 H new ATOM 1775 N ILE A 153 -2.706 9.393 8.289 1.00 0.34 N ATOM 1776 CA ILE A 153 -3.570 8.302 7.883 1.00 0.35 C ATOM 1777 C ILE A 153 -4.918 8.405 8.585 1.00 0.39 C ATOM 1778 O ILE A 153 -5.971 8.267 7.963 1.00 0.43 O ATOM 1779 CB ILE A 153 -2.946 6.917 8.178 1.00 0.35 C ATOM 1780 CG1 ILE A 153 -1.692 6.704 7.331 1.00 0.39 C ATOM 1781 CG2 ILE A 153 -3.955 5.804 7.920 1.00 0.43 C ATOM 1782 CD1 ILE A 153 -0.978 5.401 7.619 1.00 0.47 C ATOM 0 H ILE A 153 -1.798 9.101 8.651 1.00 0.34 H new ATOM 0 HA ILE A 153 -3.702 8.389 6.805 1.00 0.35 H new ATOM 0 HB ILE A 153 -2.664 6.888 9.231 1.00 0.35 H new ATOM 0 HG12 ILE A 153 -1.967 6.732 6.277 1.00 0.39 H new ATOM 0 HG13 ILE A 153 -1.003 7.531 7.503 1.00 0.39 H new ATOM 0 HG21 ILE A 153 -3.495 4.839 8.134 1.00 0.43 H new ATOM 0 HG22 ILE A 153 -4.823 5.943 8.565 1.00 0.43 H new ATOM 0 HG23 ILE A 153 -4.270 5.833 6.877 1.00 0.43 H new ATOM 0 HD11 ILE A 153 -0.098 5.319 6.981 1.00 0.47 H new ATOM 0 HD12 ILE A 153 -0.671 5.378 8.665 1.00 0.47 H new ATOM 0 HD13 ILE A 153 -1.650 4.566 7.419 1.00 0.47 H new ATOM 1794 N LYS A 154 -4.875 8.675 9.883 1.00 0.42 N ATOM 1795 CA LYS A 154 -6.094 8.837 10.667 1.00 0.50 C ATOM 1796 C LYS A 154 -6.838 10.114 10.272 1.00 0.56 C ATOM 1797 O LYS A 154 -8.047 10.210 10.445 1.00 0.64 O ATOM 1798 CB LYS A 154 -5.765 8.871 12.157 1.00 0.57 C ATOM 1799 CG LYS A 154 -5.032 7.634 12.648 1.00 1.42 C ATOM 1800 CD LYS A 154 -4.767 7.699 14.144 1.00 1.77 C ATOM 1801 CE LYS A 154 -6.064 7.750 14.937 1.00 2.57 C ATOM 1802 NZ LYS A 154 -5.819 7.737 16.402 1.00 3.43 N ATOM 0 H LYS A 154 -4.012 8.786 10.415 1.00 0.42 H new ATOM 0 HA LYS A 154 -6.740 7.984 10.461 1.00 0.50 H new ATOM 0 HB2 LYS A 154 -5.156 9.750 12.366 1.00 0.57 H new ATOM 0 HB3 LYS A 154 -6.690 8.983 12.722 1.00 0.57 H new ATOM 0 HG2 LYS A 154 -5.622 6.746 12.420 1.00 1.42 H new ATOM 0 HG3 LYS A 154 -4.087 7.534 12.114 1.00 1.42 H new ATOM 0 HD2 LYS A 154 -4.186 6.829 14.450 1.00 1.77 H new ATOM 0 HD3 LYS A 154 -4.166 8.580 14.370 1.00 1.77 H new ATOM 0 HE2 LYS A 154 -6.618 8.650 14.670 1.00 2.57 H new ATOM 0 HE3 LYS A 154 -6.689 6.899 14.666 1.00 2.57 H new ATOM 0 HZ1 LYS A 154 -6.728 7.773 16.906 1.00 3.43 H new ATOM 0 HZ2 LYS A 154 -5.313 6.866 16.662 1.00 3.43 H new ATOM 0 HZ3 LYS A 154 -5.244 8.563 16.665 1.00 3.43 H new ATOM 1816 N ARG A 155 -6.115 11.090 9.748 1.00 0.54 N ATOM 1817 CA ARG A 155 -6.739 12.313 9.260 1.00 0.63 C ATOM 1818 C ARG A 155 -7.337 12.085 7.875 1.00 0.66 C ATOM 1819 O ARG A 155 -8.391 12.623 7.533 1.00 0.80 O ATOM 1820 CB ARG A 155 -5.727 13.446 9.209 1.00 0.65 C ATOM 1821 CG ARG A 155 -6.362 14.797 8.948 1.00 1.21 C ATOM 1822 CD ARG A 155 -5.329 15.902 8.922 1.00 1.31 C ATOM 1823 NE ARG A 155 -5.933 17.204 8.644 1.00 2.28 N ATOM 1824 CZ ARG A 155 -5.260 18.353 8.643 1.00 2.71 C ATOM 1825 NH1 ARG A 155 -3.960 18.367 8.912 1.00 2.34 N ATOM 1826 NH2 ARG A 155 -5.892 19.492 8.386 1.00 3.70 N ATOM 0 H ARG A 155 -5.100 11.062 9.649 1.00 0.54 H new ATOM 0 HA ARG A 155 -7.537 12.590 9.949 1.00 0.63 H new ATOM 0 HB2 ARG A 155 -5.183 13.483 10.153 1.00 0.65 H new ATOM 0 HB3 ARG A 155 -4.996 13.238 8.428 1.00 0.65 H new ATOM 0 HG2 ARG A 155 -6.893 14.772 7.997 1.00 1.21 H new ATOM 0 HG3 ARG A 155 -7.102 15.008 9.721 1.00 1.21 H new ATOM 0 HD2 ARG A 155 -4.812 15.939 9.881 1.00 1.31 H new ATOM 0 HD3 ARG A 155 -4.579 15.680 8.163 1.00 1.31 H new ATOM 0 HE ARG A 155 -6.932 17.234 8.438 1.00 2.28 H new ATOM 0 HH11 ARG A 155 -3.473 17.495 9.120 1.00 2.34 H new ATOM 0 HH12 ARG A 155 -3.448 19.249 8.910 1.00 2.34 H new ATOM 0 HH21 ARG A 155 -6.893 19.487 8.189 1.00 3.70 H new ATOM 0 HH22 ARG A 155 -5.377 20.372 8.385 1.00 3.70 H new ATOM 1840 N GLN A 156 -6.656 11.265 7.094 1.00 0.58 N ATOM 1841 CA GLN A 156 -7.080 10.925 5.747 1.00 0.70 C ATOM 1842 C GLN A 156 -8.276 9.978 5.777 1.00 0.67 C ATOM 1843 O GLN A 156 -8.987 9.832 4.782 1.00 0.80 O ATOM 1844 CB GLN A 156 -5.917 10.293 4.985 1.00 0.77 C ATOM 1845 CG GLN A 156 -4.813 11.285 4.651 1.00 0.85 C ATOM 1846 CD GLN A 156 -4.931 11.859 3.250 1.00 1.05 C ATOM 1847 OE1 GLN A 156 -5.440 11.064 2.320 1.00 1.88 O flip ATOM 1848 NE2 GLN A 156 -4.552 13.004 3.003 1.00 0.92 N flip ATOM 0 H GLN A 156 -5.787 10.813 7.379 1.00 0.58 H new ATOM 0 HA GLN A 156 -7.387 11.838 5.236 1.00 0.70 H new ATOM 0 HB2 GLN A 156 -5.499 9.481 5.580 1.00 0.77 H new ATOM 0 HB3 GLN A 156 -6.292 9.852 4.062 1.00 0.77 H new ATOM 0 HG2 GLN A 156 -4.835 12.100 5.374 1.00 0.85 H new ATOM 0 HG3 GLN A 156 -3.846 10.792 4.755 1.00 0.85 H new ATOM 0 HE21 GLN A 156 -4.166 13.585 3.747 1.00 0.92 H new ATOM 0 HE22 GLN A 156 -4.624 13.372 2.054 1.00 0.92 H new ATOM 1857 N LYS A 157 -8.491 9.338 6.922 1.00 0.55 N ATOM 1858 CA LYS A 157 -9.601 8.406 7.075 1.00 0.54 C ATOM 1859 C LYS A 157 -10.838 9.116 7.626 1.00 0.62 C ATOM 1860 O LYS A 157 -11.884 8.497 7.828 1.00 0.67 O ATOM 1861 CB LYS A 157 -9.213 7.230 7.978 1.00 0.50 C ATOM 1862 CG LYS A 157 -9.161 7.571 9.450 1.00 0.81 C ATOM 1863 CD LYS A 157 -9.098 6.317 10.305 1.00 1.02 C ATOM 1864 CE LYS A 157 -7.955 5.412 9.878 1.00 0.68 C ATOM 1865 NZ LYS A 157 -7.845 4.208 10.745 1.00 0.90 N ATOM 0 H LYS A 157 -7.913 9.448 7.755 1.00 0.55 H new ATOM 0 HA LYS A 157 -9.842 8.012 6.087 1.00 0.54 H new ATOM 0 HB2 LYS A 157 -9.928 6.421 7.829 1.00 0.50 H new ATOM 0 HB3 LYS A 157 -8.237 6.855 7.669 1.00 0.50 H new ATOM 0 HG2 LYS A 157 -8.290 8.195 9.650 1.00 0.81 H new ATOM 0 HG3 LYS A 157 -10.040 8.155 9.721 1.00 0.81 H new ATOM 0 HD2 LYS A 157 -8.973 6.594 11.352 1.00 1.02 H new ATOM 0 HD3 LYS A 157 -10.041 5.775 10.229 1.00 1.02 H new ATOM 0 HE2 LYS A 157 -8.105 5.102 8.844 1.00 0.68 H new ATOM 0 HE3 LYS A 157 -7.019 5.970 9.911 1.00 0.68 H new ATOM 0 HZ1 LYS A 157 -7.053 3.617 10.420 1.00 0.90 H new ATOM 0 HZ2 LYS A 157 -7.676 4.502 11.728 1.00 0.90 H new ATOM 0 HZ3 LYS A 157 -8.728 3.662 10.694 1.00 0.90 H new ATOM 1879 N GLN A 158 -10.709 10.412 7.882 1.00 0.74 N ATOM 1880 CA GLN A 158 -11.818 11.213 8.372 1.00 0.91 C ATOM 1881 C GLN A 158 -12.720 11.649 7.223 1.00 1.15 C ATOM 1882 O GLN A 158 -13.775 11.012 7.017 1.00 1.78 O ATOM 1883 CB GLN A 158 -11.283 12.432 9.113 1.00 1.18 C ATOM 1884 CG GLN A 158 -10.466 12.076 10.341 1.00 1.48 C ATOM 1885 CD GLN A 158 -9.866 13.287 11.025 1.00 1.88 C ATOM 1886 OE1 GLN A 158 -8.729 13.092 11.671 1.00 2.12 O flip ATOM 1887 NE2 GLN A 158 -10.418 14.387 10.974 1.00 2.52 N flip ATOM 0 H GLN A 158 -9.840 10.931 7.756 1.00 0.74 H new ATOM 0 HA GLN A 158 -12.410 10.607 9.057 1.00 0.91 H new ATOM 0 HB2 GLN A 158 -10.667 13.021 8.433 1.00 1.18 H new ATOM 0 HB3 GLN A 158 -12.120 13.063 9.412 1.00 1.18 H new ATOM 0 HG2 GLN A 158 -11.099 11.542 11.050 1.00 1.48 H new ATOM 0 HG3 GLN A 158 -9.665 11.395 10.053 1.00 1.48 H new ATOM 0 HE21 GLN A 158 -11.295 14.494 10.464 1.00 2.52 H new ATOM 0 HE22 GLN A 158 -9.998 15.191 11.441 1.00 2.52 H new ATOM 1896 N GLU A 159 -12.363 12.619 6.519 1.00 1.48 N TER 1897 GLU A 159 HETATM 1898 ZN ZN A1159 -12.673 -0.177 1.259 1.00 0.33 ZN