USER MOD reduce.3.24.130724 H: found=0, std=0, add=1013, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 1011 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 HIS :FLIP no HD1:sc= -0.0231 F(o=-1.6,f=-0.023) USER MOD Set 1.2: A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 21 THR OG1 : rot 165:sc= -1.99! USER MOD Set 2.2: A 32 LYS NZ :NH3+ 161:sc=-0.00193 (180deg=-0.386) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -6.08! C(o=-6.1!,f=-10!) USER MOD Single : A 13 ASN : amide:sc= -0.617 X(o=-0.62,f=-0.39) USER MOD Single : A 15 ASN : amide:sc= -0.232 K(o=-0.23,f=-2.2!) USER MOD Single : A 16 ASN : amide:sc= -10.7! C(o=-11!,f=-13!) USER MOD Single : A 31 ASN :FLIP amide:sc= 0.729 F(o=-2.1,f=0.73) USER MOD Single : A 39 LYS NZ :NH3+ -149:sc= -1.62 (180deg=-2.16) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc=-0.00733 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN : amide:sc= -2.25 K(o=-2.2,f=-9.3!) USER MOD Single : A 61 THR OG1 : rot 20:sc= 1.11 USER MOD Single : A 63 GLN :FLIP amide:sc= -9.23! C(o=-9.9!,f=-9.2!) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 66 SER OG : rot 23:sc= 0.445 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS :FLIP no HD1:sc= -0.331 F(o=-0.91,f=-0.33) USER MOD Single : A 81 THR OG1 : rot -161:sc= -2.19! USER MOD Single : A 97 LYS NZ :NH3+ 163:sc= -2.1 (180deg=-2.97!) USER MOD Single : A 100 GLN : amide:sc= -2.34 X(o=-2.3,f=-2.7!) USER MOD Single : A 105 MET CE :methyl -145:sc= -0.342 (180deg=-1.26) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 ASN : amide:sc= -6.53! C(o=-6.5!,f=-14!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 42 N LYS A 3 14.873 10.989 3.699 1.00 0.00 N ATOM 43 CA LYS A 3 13.759 10.545 2.824 1.00 0.00 C ATOM 44 C LYS A 3 13.248 9.185 3.319 1.00 0.00 C ATOM 45 O LYS A 3 13.973 8.418 3.921 1.00 0.00 O ATOM 46 CB LYS A 3 14.270 10.438 1.375 1.00 0.00 C ATOM 47 CG LYS A 3 13.630 9.240 0.663 1.00 0.00 C ATOM 48 CD LYS A 3 14.362 7.959 1.074 1.00 0.00 C ATOM 49 CE LYS A 3 15.280 7.497 -0.058 1.00 0.00 C ATOM 50 NZ LYS A 3 16.697 7.769 0.310 1.00 0.00 N ATOM 0 HA LYS A 3 12.940 11.263 2.856 1.00 0.00 H new ATOM 0 HB2 LYS A 3 14.039 11.355 0.834 1.00 0.00 H new ATOM 0 HB3 LYS A 3 15.355 10.332 1.373 1.00 0.00 H new ATOM 0 HG2 LYS A 3 12.574 9.169 0.923 1.00 0.00 H new ATOM 0 HG3 LYS A 3 13.684 9.373 -0.418 1.00 0.00 H new ATOM 0 HD2 LYS A 3 14.946 8.137 1.977 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.640 7.177 1.310 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.139 6.432 -0.243 1.00 0.00 H new ATOM 0 HE3 LYS A 3 15.027 8.017 -0.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 17.322 7.455 -0.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 16.825 8.789 0.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 16.935 7.253 1.181 1.00 0.00 H new ATOM 64 N LEU A 4 12.012 8.882 3.049 1.00 0.00 N ATOM 65 CA LEU A 4 11.448 7.573 3.476 1.00 0.00 C ATOM 66 C LEU A 4 10.505 7.085 2.380 1.00 0.00 C ATOM 67 O LEU A 4 9.530 7.719 2.071 1.00 0.00 O ATOM 68 CB LEU A 4 10.721 7.759 4.836 1.00 0.00 C ATOM 69 CG LEU A 4 9.350 7.053 4.911 1.00 0.00 C ATOM 70 CD1 LEU A 4 8.290 7.866 4.176 1.00 0.00 C ATOM 71 CD2 LEU A 4 9.415 5.633 4.333 1.00 0.00 C ATOM 0 H LEU A 4 11.363 9.488 2.547 1.00 0.00 H new ATOM 0 HA LEU A 4 12.227 6.824 3.619 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.359 7.379 5.634 1.00 0.00 H new ATOM 0 HB3 LEU A 4 10.581 8.824 5.020 1.00 0.00 H new ATOM 0 HG LEU A 4 9.077 6.977 5.964 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.330 7.354 4.239 1.00 0.00 H new ATOM 0 HD12 LEU A 4 8.206 8.852 4.633 1.00 0.00 H new ATOM 0 HD13 LEU A 4 8.575 7.974 3.130 1.00 0.00 H new ATOM 0 HD21 LEU A 4 8.432 5.167 4.402 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.722 5.679 3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.137 5.043 4.897 1.00 0.00 H new ATOM 83 N GLN A 5 10.775 5.952 1.796 1.00 0.00 N ATOM 84 CA GLN A 5 9.855 5.442 0.745 1.00 0.00 C ATOM 85 C GLN A 5 8.990 4.364 1.368 1.00 0.00 C ATOM 86 O GLN A 5 9.309 3.821 2.408 1.00 0.00 O ATOM 87 CB GLN A 5 10.629 4.859 -0.439 1.00 0.00 C ATOM 88 CG GLN A 5 11.335 5.996 -1.178 1.00 0.00 C ATOM 89 CD GLN A 5 12.850 5.833 -1.048 1.00 0.00 C ATOM 90 OE1 GLN A 5 13.342 5.439 -0.009 1.00 0.00 O ATOM 91 NE2 GLN A 5 13.615 6.120 -2.066 1.00 0.00 N ATOM 0 H GLN A 5 11.583 5.363 1.998 1.00 0.00 H new ATOM 0 HA GLN A 5 9.247 6.264 0.368 1.00 0.00 H new ATOM 0 HB2 GLN A 5 11.357 4.127 -0.089 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.950 4.336 -1.112 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.048 5.993 -2.230 1.00 0.00 H new ATOM 0 HG3 GLN A 5 11.026 6.957 -0.767 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.201 6.451 -2.938 1.00 0.00 H new ATOM 0 HE22 GLN A 5 14.627 6.014 -1.990 1.00 0.00 H new ATOM 100 N ILE A 6 7.893 4.058 0.761 1.00 0.00 N ATOM 101 CA ILE A 6 7.009 3.028 1.340 1.00 0.00 C ATOM 102 C ILE A 6 6.788 1.918 0.314 1.00 0.00 C ATOM 103 O ILE A 6 6.238 2.138 -0.748 1.00 0.00 O ATOM 104 CB ILE A 6 5.687 3.699 1.723 1.00 0.00 C ATOM 105 CG1 ILE A 6 5.832 4.301 3.137 1.00 0.00 C ATOM 106 CG2 ILE A 6 4.537 2.686 1.677 1.00 0.00 C ATOM 107 CD1 ILE A 6 4.746 3.773 4.092 1.00 0.00 C ATOM 0 H ILE A 6 7.569 4.476 -0.111 1.00 0.00 H new ATOM 0 HA ILE A 6 7.455 2.581 2.228 1.00 0.00 H new ATOM 0 HB ILE A 6 5.455 4.492 1.012 1.00 0.00 H new ATOM 0 HG12 ILE A 6 6.817 4.060 3.536 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.769 5.388 3.079 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.605 3.180 1.952 1.00 0.00 H new ATOM 0 HG22 ILE A 6 4.449 2.281 0.669 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.738 1.875 2.377 1.00 0.00 H new ATOM 0 HD11 ILE A 6 4.880 4.219 5.078 1.00 0.00 H new ATOM 0 HD12 ILE A 6 3.762 4.037 3.705 1.00 0.00 H new ATOM 0 HD13 ILE A 6 4.826 2.689 4.170 1.00 0.00 H new ATOM 119 N ALA A 7 7.206 0.726 0.630 1.00 0.00 N ATOM 120 CA ALA A 7 7.010 -0.401 -0.315 1.00 0.00 C ATOM 121 C ALA A 7 5.639 -1.007 -0.049 1.00 0.00 C ATOM 122 O ALA A 7 5.512 -2.173 0.271 1.00 0.00 O ATOM 123 CB ALA A 7 8.097 -1.456 -0.095 1.00 0.00 C ATOM 0 H ALA A 7 7.675 0.485 1.503 1.00 0.00 H new ATOM 0 HA ALA A 7 7.073 -0.048 -1.344 1.00 0.00 H new ATOM 0 HB1 ALA A 7 7.949 -2.282 -0.791 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.077 -1.010 -0.265 1.00 0.00 H new ATOM 0 HB3 ALA A 7 8.040 -1.829 0.928 1.00 0.00 H new ATOM 129 N VAL A 8 4.609 -0.217 -0.163 1.00 0.00 N ATOM 130 CA VAL A 8 3.246 -0.748 0.100 1.00 0.00 C ATOM 131 C VAL A 8 2.771 -1.556 -1.108 1.00 0.00 C ATOM 132 O VAL A 8 2.709 -2.765 -1.064 1.00 0.00 O ATOM 133 CB VAL A 8 2.256 0.402 0.390 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.521 1.597 -0.531 1.00 0.00 C ATOM 135 CG2 VAL A 8 0.817 -0.087 0.172 1.00 0.00 C ATOM 0 H VAL A 8 4.652 0.768 -0.425 1.00 0.00 H new ATOM 0 HA VAL A 8 3.285 -1.393 0.978 1.00 0.00 H new ATOM 0 HB VAL A 8 2.393 0.716 1.425 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.811 2.393 -0.307 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.536 1.961 -0.372 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.405 1.289 -1.570 1.00 0.00 H new ATOM 0 HG21 VAL A 8 0.121 0.727 0.377 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.697 -0.415 -0.860 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.610 -0.920 0.844 1.00 0.00 H new ATOM 145 N GLY A 9 2.418 -0.917 -2.181 1.00 0.00 N ATOM 146 CA GLY A 9 1.934 -1.694 -3.344 1.00 0.00 C ATOM 147 C GLY A 9 0.707 -2.467 -2.900 1.00 0.00 C ATOM 148 O GLY A 9 0.772 -3.627 -2.548 1.00 0.00 O ATOM 0 H GLY A 9 2.443 0.095 -2.302 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.689 -1.030 -4.173 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.708 -2.375 -3.699 1.00 0.00 H new ATOM 152 N ILE A 10 -0.409 -1.810 -2.902 1.00 0.00 N ATOM 153 CA ILE A 10 -1.663 -2.475 -2.463 1.00 0.00 C ATOM 154 C ILE A 10 -1.721 -3.836 -3.130 1.00 0.00 C ATOM 155 O ILE A 10 -1.049 -4.080 -4.106 1.00 0.00 O ATOM 156 CB ILE A 10 -2.921 -1.668 -2.839 1.00 0.00 C ATOM 157 CG1 ILE A 10 -2.567 -0.254 -3.331 1.00 0.00 C ATOM 158 CG2 ILE A 10 -3.825 -1.554 -1.602 1.00 0.00 C ATOM 159 CD1 ILE A 10 -3.795 0.373 -3.991 1.00 0.00 C ATOM 0 H ILE A 10 -0.511 -0.837 -3.189 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.651 -2.557 -1.376 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.430 -2.190 -3.649 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.235 0.362 -2.495 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.741 -0.300 -4.041 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.719 -0.985 -1.856 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.112 -2.551 -1.268 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.286 -1.045 -0.803 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.548 1.375 -4.341 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.106 -0.240 -4.837 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.607 0.432 -3.267 1.00 0.00 H new ATOM 171 N ILE A 11 -2.498 -4.726 -2.610 1.00 0.00 N ATOM 172 CA ILE A 11 -2.574 -6.076 -3.218 1.00 0.00 C ATOM 173 C ILE A 11 -4.014 -6.344 -3.650 1.00 0.00 C ATOM 174 O ILE A 11 -4.834 -6.775 -2.867 1.00 0.00 O ATOM 175 CB ILE A 11 -2.115 -7.113 -2.188 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.481 -6.635 -0.783 1.00 0.00 C ATOM 177 CG2 ILE A 11 -0.595 -7.274 -2.264 1.00 0.00 C ATOM 178 CD1 ILE A 11 -1.814 -7.546 0.247 1.00 0.00 C ATOM 0 H ILE A 11 -3.086 -4.582 -1.789 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.926 -6.140 -4.092 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.603 -8.064 -2.400 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.155 -5.605 -0.640 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.563 -6.648 -0.652 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.270 -8.012 -1.531 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.314 -7.607 -3.263 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.117 -6.318 -2.053 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.072 -7.210 1.251 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.162 -8.569 0.107 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.732 -7.510 0.119 1.00 0.00 H new ATOM 190 N ARG A 12 -4.321 -6.090 -4.897 1.00 0.00 N ATOM 191 CA ARG A 12 -5.714 -6.309 -5.394 1.00 0.00 C ATOM 192 C ARG A 12 -5.939 -7.807 -5.546 1.00 0.00 C ATOM 193 O ARG A 12 -5.032 -8.590 -5.339 1.00 0.00 O ATOM 194 CB ARG A 12 -5.886 -5.607 -6.747 1.00 0.00 C ATOM 195 CG ARG A 12 -5.597 -4.118 -6.564 1.00 0.00 C ATOM 196 CD ARG A 12 -6.228 -3.295 -7.700 1.00 0.00 C ATOM 197 NE ARG A 12 -6.105 -4.052 -8.978 1.00 0.00 N ATOM 198 CZ ARG A 12 -6.767 -3.669 -10.033 1.00 0.00 C ATOM 199 NH1 ARG A 12 -8.046 -3.423 -9.951 1.00 0.00 N ATOM 200 NH2 ARG A 12 -6.149 -3.528 -11.175 1.00 0.00 N ATOM 0 H ARG A 12 -3.665 -5.739 -5.595 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.440 -5.899 -4.692 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.208 -6.036 -7.485 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -6.899 -5.752 -7.123 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.990 -3.782 -5.604 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.520 -3.952 -6.544 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.277 -3.095 -7.481 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -5.730 -2.329 -7.786 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.501 -4.872 -9.027 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -8.530 -3.530 -9.060 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -8.562 -3.123 -10.778 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -5.149 -3.718 -11.241 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.666 -3.228 -12.001 1.00 0.00 H new ATOM 214 N ASN A 13 -7.134 -8.241 -5.841 1.00 0.00 N ATOM 215 CA ASN A 13 -7.324 -9.709 -5.906 1.00 0.00 C ATOM 216 C ASN A 13 -8.431 -10.162 -6.883 1.00 0.00 C ATOM 217 O ASN A 13 -8.155 -10.855 -7.808 1.00 0.00 O ATOM 218 CB ASN A 13 -7.617 -10.188 -4.479 1.00 0.00 C ATOM 219 CG ASN A 13 -8.532 -11.419 -4.478 1.00 0.00 C ATOM 220 OD1 ASN A 13 -8.167 -12.464 -4.979 1.00 0.00 O ATOM 221 ND2 ASN A 13 -9.712 -11.336 -3.928 1.00 0.00 N ATOM 0 H ASN A 13 -7.955 -7.666 -6.032 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.414 -10.158 -6.305 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.681 -10.428 -3.975 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -8.086 -9.384 -3.913 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -10.329 -12.149 -3.918 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -10.018 -10.459 -3.507 1.00 0.00 H new ATOM 228 N GLU A 14 -9.673 -9.847 -6.683 1.00 0.00 N ATOM 229 CA GLU A 14 -10.709 -10.411 -7.622 1.00 0.00 C ATOM 230 C GLU A 14 -10.984 -9.478 -8.797 1.00 0.00 C ATOM 231 O GLU A 14 -11.267 -9.906 -9.898 1.00 0.00 O ATOM 232 CB GLU A 14 -12.008 -10.606 -6.836 1.00 0.00 C ATOM 233 CG GLU A 14 -13.008 -11.396 -7.683 1.00 0.00 C ATOM 234 CD GLU A 14 -12.645 -12.881 -7.647 1.00 0.00 C ATOM 235 OE1 GLU A 14 -12.757 -13.472 -6.585 1.00 0.00 O ATOM 236 OE2 GLU A 14 -12.260 -13.402 -8.681 1.00 0.00 O ATOM 0 H GLU A 14 -10.023 -9.244 -5.939 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.334 -11.353 -8.023 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.806 -11.136 -5.906 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.430 -9.638 -6.566 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -14.019 -11.248 -7.303 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.997 -11.033 -8.711 1.00 0.00 H new ATOM 243 N ASN A 15 -10.891 -8.225 -8.568 1.00 0.00 N ATOM 244 CA ASN A 15 -11.127 -7.224 -9.641 1.00 0.00 C ATOM 245 C ASN A 15 -10.486 -5.962 -9.146 1.00 0.00 C ATOM 246 O ASN A 15 -9.765 -5.269 -9.837 1.00 0.00 O ATOM 247 CB ASN A 15 -12.630 -7.017 -9.830 1.00 0.00 C ATOM 248 CG ASN A 15 -12.951 -6.879 -11.319 1.00 0.00 C ATOM 249 OD1 ASN A 15 -12.070 -6.655 -12.125 1.00 0.00 O ATOM 250 ND2 ASN A 15 -14.187 -7.007 -11.719 1.00 0.00 N ATOM 0 H ASN A 15 -10.655 -7.825 -7.660 1.00 0.00 H new ATOM 0 HA ASN A 15 -10.717 -7.538 -10.601 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -13.178 -7.859 -9.407 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -12.954 -6.124 -9.295 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -14.414 -6.919 -12.709 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -14.926 -7.195 -11.041 1.00 0.00 H new ATOM 257 N ASN A 16 -10.729 -5.709 -7.914 1.00 0.00 N ATOM 258 CA ASN A 16 -10.156 -4.559 -7.242 1.00 0.00 C ATOM 259 C ASN A 16 -10.177 -4.901 -5.769 1.00 0.00 C ATOM 260 O ASN A 16 -10.412 -4.051 -4.933 1.00 0.00 O ATOM 261 CB ASN A 16 -11.021 -3.332 -7.506 1.00 0.00 C ATOM 262 CG ASN A 16 -10.801 -2.837 -8.936 1.00 0.00 C ATOM 263 OD1 ASN A 16 -11.227 -3.469 -9.882 1.00 0.00 O ATOM 264 ND2 ASN A 16 -10.154 -1.723 -9.136 1.00 0.00 N ATOM 0 H ASN A 16 -11.331 -6.284 -7.324 1.00 0.00 H new ATOM 0 HA ASN A 16 -9.147 -4.338 -7.590 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -12.072 -3.578 -7.355 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -10.773 -2.542 -6.797 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -10.006 -1.383 -10.086 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -9.796 -1.192 -8.342 1.00 0.00 H new ATOM 271 N GLU A 17 -9.965 -6.156 -5.426 1.00 0.00 N ATOM 272 CA GLU A 17 -10.022 -6.497 -3.986 1.00 0.00 C ATOM 273 C GLU A 17 -8.648 -6.310 -3.362 1.00 0.00 C ATOM 274 O GLU A 17 -7.876 -7.238 -3.223 1.00 0.00 O ATOM 275 CB GLU A 17 -10.512 -7.929 -3.799 1.00 0.00 C ATOM 276 CG GLU A 17 -11.750 -8.158 -4.665 1.00 0.00 C ATOM 277 CD GLU A 17 -12.495 -9.404 -4.181 1.00 0.00 C ATOM 278 OE1 GLU A 17 -12.023 -10.029 -3.247 1.00 0.00 O ATOM 279 OE2 GLU A 17 -13.528 -9.711 -4.754 1.00 0.00 O ATOM 0 H GLU A 17 -9.763 -6.925 -6.064 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.727 -5.832 -3.487 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.727 -8.633 -4.074 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.749 -8.110 -2.751 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.406 -7.289 -4.616 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.458 -8.279 -5.708 1.00 0.00 H new ATOM 286 N ILE A 18 -8.340 -5.102 -2.982 1.00 0.00 N ATOM 287 CA ILE A 18 -7.021 -4.832 -2.363 1.00 0.00 C ATOM 288 C ILE A 18 -7.063 -5.252 -0.892 1.00 0.00 C ATOM 289 O ILE A 18 -8.093 -5.189 -0.251 1.00 0.00 O ATOM 290 CB ILE A 18 -6.701 -3.333 -2.476 1.00 0.00 C ATOM 291 CG1 ILE A 18 -7.493 -2.544 -1.428 1.00 0.00 C ATOM 292 CG2 ILE A 18 -7.083 -2.843 -3.872 1.00 0.00 C ATOM 293 CD1 ILE A 18 -7.443 -1.045 -1.749 1.00 0.00 C ATOM 0 H ILE A 18 -8.950 -4.290 -3.075 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.245 -5.399 -2.877 1.00 0.00 H new ATOM 0 HB ILE A 18 -5.635 -3.180 -2.305 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.528 -2.886 -1.410 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -7.080 -2.725 -0.436 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -6.858 -1.780 -3.959 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -6.515 -3.396 -4.620 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -8.149 -3.003 -4.035 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -8.009 -0.493 -0.998 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.407 -0.706 -1.744 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -7.878 -0.869 -2.733 1.00 0.00 H new ATOM 305 N PHE A 19 -5.950 -5.677 -0.357 1.00 0.00 N ATOM 306 CA PHE A 19 -5.906 -6.088 1.085 1.00 0.00 C ATOM 307 C PHE A 19 -5.764 -4.831 1.950 1.00 0.00 C ATOM 308 O PHE A 19 -4.977 -4.782 2.873 1.00 0.00 O ATOM 309 CB PHE A 19 -4.696 -6.993 1.312 1.00 0.00 C ATOM 310 CG PHE A 19 -4.842 -7.750 2.611 1.00 0.00 C ATOM 311 CD1 PHE A 19 -6.044 -8.397 2.918 1.00 0.00 C ATOM 312 CD2 PHE A 19 -3.766 -7.813 3.506 1.00 0.00 C ATOM 313 CE1 PHE A 19 -6.171 -9.102 4.120 1.00 0.00 C ATOM 314 CE2 PHE A 19 -3.895 -8.519 4.709 1.00 0.00 C ATOM 315 CZ PHE A 19 -5.097 -9.163 5.015 1.00 0.00 C ATOM 0 H PHE A 19 -5.064 -5.759 -0.855 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.818 -6.623 1.350 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.598 -7.695 0.484 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.785 -6.395 1.333 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.873 -8.352 2.228 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.837 -7.317 3.268 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.100 -9.600 4.357 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.066 -8.566 5.400 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.197 -9.708 5.942 1.00 0.00 H new ATOM 325 N ILE A 20 -6.507 -3.809 1.634 1.00 0.00 N ATOM 326 CA ILE A 20 -6.430 -2.537 2.392 1.00 0.00 C ATOM 327 C ILE A 20 -7.291 -2.600 3.639 1.00 0.00 C ATOM 328 O ILE A 20 -8.233 -3.360 3.731 1.00 0.00 O ATOM 329 CB ILE A 20 -6.958 -1.400 1.521 1.00 0.00 C ATOM 330 CG1 ILE A 20 -6.875 -0.074 2.287 1.00 0.00 C ATOM 331 CG2 ILE A 20 -8.422 -1.682 1.177 1.00 0.00 C ATOM 332 CD1 ILE A 20 -5.429 0.206 2.703 1.00 0.00 C ATOM 0 H ILE A 20 -7.178 -3.805 0.865 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.390 -2.370 2.672 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.360 -1.331 0.613 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -7.245 0.739 1.663 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.514 -0.115 3.169 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -8.811 -0.876 0.555 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -8.493 -2.625 0.636 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -9.006 -1.745 2.095 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.383 1.150 3.246 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.073 -0.600 3.345 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.800 0.267 1.815 1.00 0.00 H new ATOM 344 N THR A 21 -7.009 -1.749 4.569 1.00 0.00 N ATOM 345 CA THR A 21 -7.840 -1.687 5.798 1.00 0.00 C ATOM 346 C THR A 21 -9.195 -1.102 5.392 1.00 0.00 C ATOM 347 O THR A 21 -9.335 0.089 5.229 1.00 0.00 O ATOM 348 CB THR A 21 -7.162 -0.766 6.803 1.00 0.00 C ATOM 349 OG1 THR A 21 -7.955 -0.667 7.983 1.00 0.00 O ATOM 350 CG2 THR A 21 -6.992 0.618 6.177 1.00 0.00 C ATOM 0 H THR A 21 -6.234 -1.087 4.536 1.00 0.00 H new ATOM 0 HA THR A 21 -7.965 -2.672 6.249 1.00 0.00 H new ATOM 0 HB THR A 21 -6.186 -1.172 7.068 1.00 0.00 H new ATOM 0 HG1 THR A 21 -7.418 -0.281 8.706 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.507 1.283 6.891 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.378 0.539 5.280 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.970 1.020 5.913 1.00 0.00 H new ATOM 358 N ARG A 22 -10.177 -1.928 5.183 1.00 0.00 N ATOM 359 CA ARG A 22 -11.502 -1.418 4.735 1.00 0.00 C ATOM 360 C ARG A 22 -12.475 -1.316 5.910 1.00 0.00 C ATOM 361 O ARG A 22 -13.321 -2.167 6.097 1.00 0.00 O ATOM 362 CB ARG A 22 -12.060 -2.377 3.679 1.00 0.00 C ATOM 363 CG ARG A 22 -13.492 -1.978 3.313 1.00 0.00 C ATOM 364 CD ARG A 22 -13.495 -0.575 2.710 1.00 0.00 C ATOM 365 NE ARG A 22 -14.896 -0.199 2.362 1.00 0.00 N ATOM 366 CZ ARG A 22 -15.194 1.033 2.051 1.00 0.00 C ATOM 367 NH1 ARG A 22 -14.313 1.982 2.216 1.00 0.00 N ATOM 368 NH2 ARG A 22 -16.372 1.316 1.568 1.00 0.00 N ATOM 0 H ARG A 22 -10.121 -2.939 5.303 1.00 0.00 H new ATOM 0 HA ARG A 22 -11.380 -0.420 4.314 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.430 -2.358 2.790 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.044 -3.398 4.059 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -13.908 -2.691 2.602 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -14.126 -2.005 4.200 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.078 0.140 3.419 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.865 -0.546 1.821 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.627 -0.910 2.367 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.389 1.761 2.589 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -14.548 2.944 1.972 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -17.060 0.575 1.434 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -16.606 2.279 1.325 1.00 0.00 H new ATOM 382 N ARG A 23 -12.369 -0.264 6.686 1.00 0.00 N ATOM 383 CA ARG A 23 -13.297 -0.064 7.846 1.00 0.00 C ATOM 384 C ARG A 23 -13.697 -1.418 8.441 1.00 0.00 C ATOM 385 O ARG A 23 -14.731 -1.969 8.118 1.00 0.00 O ATOM 386 CB ARG A 23 -14.560 0.689 7.383 1.00 0.00 C ATOM 387 CG ARG A 23 -14.524 0.913 5.864 1.00 0.00 C ATOM 388 CD ARG A 23 -15.684 1.822 5.448 1.00 0.00 C ATOM 389 NE ARG A 23 -16.657 1.035 4.639 1.00 0.00 N ATOM 390 CZ ARG A 23 -17.847 1.514 4.393 1.00 0.00 C ATOM 391 NH1 ARG A 23 -18.232 2.632 4.949 1.00 0.00 N ATOM 392 NH2 ARG A 23 -18.653 0.872 3.593 1.00 0.00 N ATOM 0 H ARG A 23 -11.673 0.472 6.565 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.785 0.523 8.608 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -15.450 0.119 7.652 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.628 1.648 7.897 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -13.575 1.364 5.576 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.594 -0.043 5.344 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.175 2.233 6.331 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -15.310 2.667 4.869 1.00 0.00 H new ATOM 0 HE ARG A 23 -16.393 0.119 4.276 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -17.603 3.133 5.577 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -19.162 3.004 4.755 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -18.353 -0.002 3.161 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -19.583 1.244 3.399 1.00 0.00 H new ATOM 406 N ALA A 24 -12.881 -1.963 9.300 1.00 0.00 N ATOM 407 CA ALA A 24 -13.205 -3.286 9.907 1.00 0.00 C ATOM 408 C ALA A 24 -14.680 -3.331 10.313 1.00 0.00 C ATOM 409 O ALA A 24 -15.393 -4.262 9.994 1.00 0.00 O ATOM 410 CB ALA A 24 -12.338 -3.501 11.147 1.00 0.00 C ATOM 0 H ALA A 24 -12.002 -1.549 9.609 1.00 0.00 H new ATOM 0 HA ALA A 24 -13.009 -4.070 9.175 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -12.573 -4.468 11.592 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -11.286 -3.479 10.864 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -12.536 -2.710 11.871 1.00 0.00 H new ATOM 416 N ALA A 25 -15.145 -2.333 11.015 1.00 0.00 N ATOM 417 CA ALA A 25 -16.569 -2.323 11.439 1.00 0.00 C ATOM 418 C ALA A 25 -17.425 -1.853 10.270 1.00 0.00 C ATOM 419 O ALA A 25 -16.922 -1.534 9.211 1.00 0.00 O ATOM 420 CB ALA A 25 -16.746 -1.366 12.620 1.00 0.00 C ATOM 0 H ALA A 25 -14.598 -1.525 11.312 1.00 0.00 H new ATOM 0 HA ALA A 25 -16.872 -3.325 11.743 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -17.791 -1.360 12.930 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -16.123 -1.695 13.452 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -16.450 -0.360 12.321 1.00 0.00 H new ATOM 426 N ASP A 26 -18.713 -1.805 10.446 1.00 0.00 N ATOM 427 CA ASP A 26 -19.579 -1.351 9.330 1.00 0.00 C ATOM 428 C ASP A 26 -19.151 0.055 8.912 1.00 0.00 C ATOM 429 O ASP A 26 -19.264 0.437 7.764 1.00 0.00 O ATOM 430 CB ASP A 26 -21.042 -1.332 9.783 1.00 0.00 C ATOM 431 CG ASP A 26 -21.743 -2.613 9.323 1.00 0.00 C ATOM 432 OD1 ASP A 26 -21.261 -3.682 9.657 1.00 0.00 O ATOM 433 OD2 ASP A 26 -22.753 -2.500 8.648 1.00 0.00 O ATOM 0 H ASP A 26 -19.199 -2.058 11.306 1.00 0.00 H new ATOM 0 HA ASP A 26 -19.479 -2.034 8.486 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -21.095 -1.247 10.868 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -21.549 -0.460 9.370 1.00 0.00 H new ATOM 438 N ALA A 27 -18.656 0.828 9.838 1.00 0.00 N ATOM 439 CA ALA A 27 -18.215 2.209 9.503 1.00 0.00 C ATOM 440 C ALA A 27 -19.388 2.991 8.912 1.00 0.00 C ATOM 441 O ALA A 27 -20.340 2.424 8.417 1.00 0.00 O ATOM 442 CB ALA A 27 -17.084 2.154 8.473 1.00 0.00 C ATOM 0 H ALA A 27 -18.538 0.561 10.815 1.00 0.00 H new ATOM 0 HA ALA A 27 -17.862 2.701 10.410 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -16.764 3.167 8.230 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -16.243 1.597 8.885 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -17.439 1.659 7.569 1.00 0.00 H new ATOM 448 N HIS A 28 -19.317 4.291 8.950 1.00 0.00 N ATOM 449 CA HIS A 28 -20.417 5.112 8.379 1.00 0.00 C ATOM 450 C HIS A 28 -19.809 6.184 7.475 1.00 0.00 C ATOM 451 O HIS A 28 -20.386 7.231 7.256 1.00 0.00 O ATOM 452 CB HIS A 28 -21.215 5.769 9.509 1.00 0.00 C ATOM 453 CG HIS A 28 -20.308 6.626 10.345 1.00 0.00 C ATOM 454 ND1 HIS A 28 -19.159 6.342 11.040 1.00 0.00 N flip ATOM 455 CD2 HIS A 28 -20.556 7.972 10.557 1.00 0.00 C flip ATOM 456 CE1 HIS A 28 -18.699 7.491 11.675 1.00 0.00 C flip ATOM 457 NE2 HIS A 28 -19.577 8.444 11.351 1.00 0.00 N flip ATOM 0 H HIS A 28 -18.544 4.820 9.352 1.00 0.00 H new ATOM 0 HA HIS A 28 -21.091 4.481 7.800 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -22.020 6.375 9.093 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -21.680 5.003 10.130 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -21.384 8.539 10.158 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.821 7.591 12.296 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -19.513 9.412 11.667 1.00 0.00 H new ATOM 465 N MET A 29 -18.643 5.923 6.945 1.00 0.00 N ATOM 466 CA MET A 29 -17.989 6.916 6.050 1.00 0.00 C ATOM 467 C MET A 29 -17.567 6.224 4.752 1.00 0.00 C ATOM 468 O MET A 29 -18.360 6.083 3.845 1.00 0.00 O ATOM 469 CB MET A 29 -16.761 7.508 6.747 1.00 0.00 C ATOM 470 CG MET A 29 -17.129 8.848 7.382 1.00 0.00 C ATOM 471 SD MET A 29 -15.664 9.560 8.172 1.00 0.00 S ATOM 472 CE MET A 29 -15.973 8.934 9.840 1.00 0.00 C ATOM 0 H MET A 29 -18.116 5.063 7.095 1.00 0.00 H new ATOM 0 HA MET A 29 -18.689 7.720 5.821 1.00 0.00 H new ATOM 0 HB2 MET A 29 -16.397 6.820 7.510 1.00 0.00 H new ATOM 0 HB3 MET A 29 -15.953 7.644 6.028 1.00 0.00 H new ATOM 0 HG2 MET A 29 -17.514 9.529 6.623 1.00 0.00 H new ATOM 0 HG3 MET A 29 -17.921 8.709 8.117 1.00 0.00 H new ATOM 0 HE1 MET A 29 -15.174 9.261 10.505 1.00 0.00 H new ATOM 0 HE2 MET A 29 -16.927 9.318 10.202 1.00 0.00 H new ATOM 0 HE3 MET A 29 -16.005 7.845 9.820 1.00 0.00 H new ATOM 482 N ALA A 30 -16.325 5.786 4.675 1.00 0.00 N ATOM 483 CA ALA A 30 -15.803 5.085 3.453 1.00 0.00 C ATOM 484 C ALA A 30 -14.394 5.594 3.136 1.00 0.00 C ATOM 485 O ALA A 30 -13.733 5.103 2.243 1.00 0.00 O ATOM 486 CB ALA A 30 -16.702 5.333 2.242 1.00 0.00 C ATOM 0 H ALA A 30 -15.640 5.888 5.424 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.786 4.015 3.660 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.296 4.812 1.375 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.705 4.962 2.452 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.747 6.402 2.035 1.00 0.00 H new ATOM 492 N ASN A 31 -13.922 6.566 3.869 1.00 0.00 N ATOM 493 CA ASN A 31 -12.550 7.095 3.619 1.00 0.00 C ATOM 494 C ASN A 31 -11.543 6.235 4.382 1.00 0.00 C ATOM 495 O ASN A 31 -10.400 6.607 4.563 1.00 0.00 O ATOM 496 CB ASN A 31 -12.457 8.542 4.112 1.00 0.00 C ATOM 497 CG ASN A 31 -13.205 8.684 5.441 1.00 0.00 C ATOM 498 OD1 ASN A 31 -12.855 7.948 6.462 1.00 0.00 O flip ATOM 499 ND2 ASN A 31 -14.120 9.475 5.550 1.00 0.00 N flip ATOM 0 H ASN A 31 -14.428 7.017 4.631 1.00 0.00 H new ATOM 0 HA ASN A 31 -12.334 7.065 2.551 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -11.413 8.826 4.239 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -12.883 9.217 3.370 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -14.394 10.050 4.754 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -14.614 9.564 6.438 1.00 0.00 H new ATOM 506 N LYS A 32 -11.967 5.089 4.840 1.00 0.00 N ATOM 507 CA LYS A 32 -11.058 4.196 5.604 1.00 0.00 C ATOM 508 C LYS A 32 -10.167 3.394 4.657 1.00 0.00 C ATOM 509 O LYS A 32 -9.762 2.302 4.979 1.00 0.00 O ATOM 510 CB LYS A 32 -11.902 3.224 6.432 1.00 0.00 C ATOM 511 CG LYS A 32 -11.325 3.102 7.843 1.00 0.00 C ATOM 512 CD LYS A 32 -9.904 2.539 7.770 1.00 0.00 C ATOM 513 CE LYS A 32 -9.256 2.610 9.154 1.00 0.00 C ATOM 514 NZ LYS A 32 -7.773 2.660 9.008 1.00 0.00 N ATOM 0 H LYS A 32 -12.914 4.732 4.715 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.426 4.805 6.250 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -12.933 3.575 6.481 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.921 2.246 5.952 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.316 4.078 8.329 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.954 2.450 8.449 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.928 1.507 7.420 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.313 3.106 7.050 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.609 3.492 9.688 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -9.544 1.742 9.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.350 3.025 9.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.410 1.704 8.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -7.523 3.286 8.216 1.00 0.00 H new ATOM 528 N LEU A 33 -9.852 3.900 3.498 1.00 0.00 N ATOM 529 CA LEU A 33 -8.989 3.105 2.581 1.00 0.00 C ATOM 530 C LEU A 33 -7.585 3.708 2.528 1.00 0.00 C ATOM 531 O LEU A 33 -7.255 4.459 1.639 1.00 0.00 O ATOM 532 CB LEU A 33 -9.619 3.084 1.185 1.00 0.00 C ATOM 533 CG LEU A 33 -10.851 2.179 1.207 1.00 0.00 C ATOM 534 CD1 LEU A 33 -11.305 1.912 -0.227 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.504 0.846 1.874 1.00 0.00 C ATOM 0 H LEU A 33 -10.148 4.812 3.150 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.908 2.083 2.950 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.899 4.093 0.883 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.898 2.721 0.452 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.647 2.670 1.767 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -12.184 1.267 -0.216 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.554 2.856 -0.712 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.502 1.422 -0.778 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.386 0.205 1.887 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.707 0.356 1.315 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.172 1.026 2.896 1.00 0.00 H new ATOM 547 N GLU A 34 -6.752 3.371 3.475 1.00 0.00 N ATOM 548 CA GLU A 34 -5.363 3.907 3.474 1.00 0.00 C ATOM 549 C GLU A 34 -4.501 3.001 2.587 1.00 0.00 C ATOM 550 O GLU A 34 -4.959 2.509 1.579 1.00 0.00 O ATOM 551 CB GLU A 34 -4.825 3.914 4.910 1.00 0.00 C ATOM 552 CG GLU A 34 -4.047 5.208 5.163 1.00 0.00 C ATOM 553 CD GLU A 34 -3.046 4.992 6.301 1.00 0.00 C ATOM 554 OE1 GLU A 34 -2.060 4.311 6.075 1.00 0.00 O ATOM 555 OE2 GLU A 34 -3.283 5.513 7.379 1.00 0.00 O ATOM 0 H GLU A 34 -6.975 2.747 4.250 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.342 4.926 3.088 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.649 3.830 5.618 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.178 3.052 5.070 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.523 5.512 4.257 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.735 6.014 5.419 1.00 0.00 H new ATOM 562 N PHE A 35 -3.269 2.764 2.943 1.00 0.00 N ATOM 563 CA PHE A 35 -2.420 1.876 2.097 1.00 0.00 C ATOM 564 C PHE A 35 -1.517 1.020 2.991 1.00 0.00 C ATOM 565 O PHE A 35 -0.811 1.544 3.830 1.00 0.00 O ATOM 566 CB PHE A 35 -1.547 2.728 1.170 1.00 0.00 C ATOM 567 CG PHE A 35 -2.370 3.210 0.000 1.00 0.00 C ATOM 568 CD1 PHE A 35 -3.049 2.287 -0.803 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.453 4.579 -0.282 1.00 0.00 C ATOM 570 CE1 PHE A 35 -3.811 2.733 -1.888 1.00 0.00 C ATOM 571 CE2 PHE A 35 -3.217 5.024 -1.369 1.00 0.00 C ATOM 572 CZ PHE A 35 -3.896 4.098 -2.171 1.00 0.00 C ATOM 0 H PHE A 35 -2.816 3.142 3.775 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.064 1.229 1.501 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -1.141 3.579 1.717 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.698 2.143 0.814 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -2.985 1.231 -0.585 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.929 5.291 0.338 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.335 2.020 -2.508 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.282 6.080 -1.588 1.00 0.00 H new ATOM 0 HZ PHE A 35 -4.486 4.440 -3.009 1.00 0.00 H new ATOM 582 N PRO A 36 -1.552 -0.275 2.779 1.00 0.00 N ATOM 583 CA PRO A 36 -0.721 -1.211 3.554 1.00 0.00 C ATOM 584 C PRO A 36 0.759 -0.876 3.331 1.00 0.00 C ATOM 585 O PRO A 36 1.356 -1.289 2.359 1.00 0.00 O ATOM 586 CB PRO A 36 -1.071 -2.594 2.985 1.00 0.00 C ATOM 587 CG PRO A 36 -1.974 -2.378 1.748 1.00 0.00 C ATOM 588 CD PRO A 36 -2.410 -0.910 1.758 1.00 0.00 C ATOM 0 HA PRO A 36 -0.899 -1.163 4.628 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.166 -3.134 2.708 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.585 -3.197 3.734 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.433 -2.613 0.831 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.841 -3.037 1.785 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.271 -0.448 0.780 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.466 -0.811 2.010 1.00 0.00 H new ATOM 596 N GLY A 37 1.339 -0.105 4.214 1.00 0.00 N ATOM 597 CA GLY A 37 2.769 0.297 4.059 1.00 0.00 C ATOM 598 C GLY A 37 3.682 -0.923 3.894 1.00 0.00 C ATOM 599 O GLY A 37 3.304 -1.942 3.352 1.00 0.00 O ATOM 0 H GLY A 37 0.878 0.267 5.044 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.872 0.950 3.192 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.083 0.872 4.930 1.00 0.00 H new ATOM 603 N GLY A 38 4.897 -0.808 4.353 1.00 0.00 N ATOM 604 CA GLY A 38 5.873 -1.925 4.228 1.00 0.00 C ATOM 605 C GLY A 38 7.282 -1.349 4.376 1.00 0.00 C ATOM 606 O GLY A 38 8.150 -1.956 4.972 1.00 0.00 O ATOM 0 H GLY A 38 5.260 0.025 4.816 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.688 -2.678 4.994 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.764 -2.419 3.262 1.00 0.00 H new ATOM 610 N LYS A 39 7.490 -0.166 3.845 1.00 0.00 N ATOM 611 CA LYS A 39 8.821 0.513 3.943 1.00 0.00 C ATOM 612 C LYS A 39 9.845 -0.164 3.036 1.00 0.00 C ATOM 613 O LYS A 39 10.450 -1.151 3.399 1.00 0.00 O ATOM 614 CB LYS A 39 9.323 0.471 5.388 1.00 0.00 C ATOM 615 CG LYS A 39 10.670 1.195 5.490 1.00 0.00 C ATOM 616 CD LYS A 39 10.457 2.705 5.350 1.00 0.00 C ATOM 617 CE LYS A 39 11.789 3.383 5.010 1.00 0.00 C ATOM 618 NZ LYS A 39 12.205 3.004 3.630 1.00 0.00 N ATOM 0 H LYS A 39 6.781 0.365 3.340 1.00 0.00 H new ATOM 0 HA LYS A 39 8.698 1.548 3.624 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.596 0.942 6.049 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.430 -0.563 5.716 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.142 0.972 6.447 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.345 0.840 4.711 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.724 2.908 4.569 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.056 3.113 6.278 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.687 4.466 5.086 1.00 0.00 H new ATOM 0 HE3 LYS A 39 12.554 3.084 5.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.243 2.988 3.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.831 2.061 3.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 11.831 3.698 2.952 1.00 0.00 H new ATOM 632 N ILE A 40 10.074 0.376 1.870 1.00 0.00 N ATOM 633 CA ILE A 40 11.097 -0.235 0.976 1.00 0.00 C ATOM 634 C ILE A 40 12.472 0.253 1.418 1.00 0.00 C ATOM 635 O ILE A 40 12.699 1.433 1.597 1.00 0.00 O ATOM 636 CB ILE A 40 10.841 0.115 -0.504 1.00 0.00 C ATOM 637 CG1 ILE A 40 12.173 0.282 -1.262 1.00 0.00 C ATOM 638 CG2 ILE A 40 10.011 1.395 -0.635 1.00 0.00 C ATOM 639 CD1 ILE A 40 12.778 1.667 -0.990 1.00 0.00 C ATOM 0 H ILE A 40 9.604 1.203 1.502 1.00 0.00 H new ATOM 0 HA ILE A 40 11.041 -1.321 1.055 1.00 0.00 H new ATOM 0 HB ILE A 40 10.280 -0.710 -0.944 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.873 -0.494 -0.953 1.00 0.00 H new ATOM 0 HG13 ILE A 40 12.008 0.155 -2.332 1.00 0.00 H new ATOM 0 HG21 ILE A 40 9.847 1.616 -1.690 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.050 1.258 -0.139 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.544 2.224 -0.169 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.718 1.767 -1.533 1.00 0.00 H new ATOM 0 HD12 ILE A 40 12.084 2.439 -1.322 1.00 0.00 H new ATOM 0 HD13 ILE A 40 12.963 1.780 0.078 1.00 0.00 H new ATOM 651 N GLU A 41 13.388 -0.645 1.594 1.00 0.00 N ATOM 652 CA GLU A 41 14.747 -0.235 2.031 1.00 0.00 C ATOM 653 C GLU A 41 15.701 -1.427 1.940 1.00 0.00 C ATOM 654 O GLU A 41 16.875 -1.274 1.671 1.00 0.00 O ATOM 655 CB GLU A 41 14.671 0.264 3.474 1.00 0.00 C ATOM 656 CG GLU A 41 14.407 -0.914 4.414 1.00 0.00 C ATOM 657 CD GLU A 41 14.160 -0.392 5.830 1.00 0.00 C ATOM 658 OE1 GLU A 41 14.296 0.804 6.032 1.00 0.00 O ATOM 659 OE2 GLU A 41 13.840 -1.197 6.689 1.00 0.00 O ATOM 0 H GLU A 41 13.258 -1.647 1.455 1.00 0.00 H new ATOM 0 HA GLU A 41 15.119 0.561 1.386 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.603 0.758 3.748 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.877 1.005 3.572 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.543 -1.482 4.069 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.258 -1.595 4.409 1.00 0.00 H new ATOM 666 N MET A 42 15.206 -2.614 2.159 1.00 0.00 N ATOM 667 CA MET A 42 16.086 -3.812 2.080 1.00 0.00 C ATOM 668 C MET A 42 16.804 -3.826 0.730 1.00 0.00 C ATOM 669 O MET A 42 16.425 -3.128 -0.191 1.00 0.00 O ATOM 670 CB MET A 42 15.237 -5.077 2.218 1.00 0.00 C ATOM 671 CG MET A 42 14.456 -5.025 3.531 1.00 0.00 C ATOM 672 SD MET A 42 14.501 -6.653 4.321 1.00 0.00 S ATOM 673 CE MET A 42 14.813 -6.071 6.006 1.00 0.00 C ATOM 0 H MET A 42 14.231 -2.805 2.389 1.00 0.00 H new ATOM 0 HA MET A 42 16.821 -3.778 2.884 1.00 0.00 H new ATOM 0 HB2 MET A 42 14.549 -5.160 1.376 1.00 0.00 H new ATOM 0 HB3 MET A 42 15.875 -5.960 2.197 1.00 0.00 H new ATOM 0 HG2 MET A 42 14.887 -4.275 4.194 1.00 0.00 H new ATOM 0 HG3 MET A 42 13.424 -4.729 3.342 1.00 0.00 H new ATOM 0 HE1 MET A 42 14.880 -6.925 6.680 1.00 0.00 H new ATOM 0 HE2 MET A 42 15.750 -5.515 6.031 1.00 0.00 H new ATOM 0 HE3 MET A 42 13.997 -5.422 6.324 1.00 0.00 H new ATOM 683 N GLY A 43 17.838 -4.613 0.604 1.00 0.00 N ATOM 684 CA GLY A 43 18.578 -4.665 -0.688 1.00 0.00 C ATOM 685 C GLY A 43 18.800 -3.243 -1.198 1.00 0.00 C ATOM 686 O GLY A 43 19.386 -2.414 -0.531 1.00 0.00 O ATOM 0 H GLY A 43 18.201 -5.221 1.338 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.535 -5.169 -0.552 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.014 -5.243 -1.420 1.00 0.00 H new ATOM 690 N GLU A 44 18.326 -2.955 -2.376 1.00 0.00 N ATOM 691 CA GLU A 44 18.494 -1.589 -2.935 1.00 0.00 C ATOM 692 C GLU A 44 17.564 -1.425 -4.134 1.00 0.00 C ATOM 693 O GLU A 44 17.799 -0.619 -5.011 1.00 0.00 O ATOM 694 CB GLU A 44 19.947 -1.390 -3.379 1.00 0.00 C ATOM 695 CG GLU A 44 20.230 -2.241 -4.618 1.00 0.00 C ATOM 696 CD GLU A 44 21.718 -2.595 -4.668 1.00 0.00 C ATOM 697 OE1 GLU A 44 22.347 -2.574 -3.623 1.00 0.00 O ATOM 698 OE2 GLU A 44 22.204 -2.883 -5.750 1.00 0.00 O ATOM 0 H GLU A 44 17.827 -3.611 -2.978 1.00 0.00 H new ATOM 0 HA GLU A 44 18.248 -0.847 -2.175 1.00 0.00 H new ATOM 0 HB2 GLU A 44 20.129 -0.338 -3.599 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.625 -1.669 -2.572 1.00 0.00 H new ATOM 0 HG2 GLU A 44 19.630 -3.151 -4.592 1.00 0.00 H new ATOM 0 HG3 GLU A 44 19.945 -1.697 -5.518 1.00 0.00 H new ATOM 705 N THR A 45 16.511 -2.192 -4.182 1.00 0.00 N ATOM 706 CA THR A 45 15.570 -2.091 -5.325 1.00 0.00 C ATOM 707 C THR A 45 14.149 -2.315 -4.815 1.00 0.00 C ATOM 708 O THR A 45 13.935 -3.149 -3.969 1.00 0.00 O ATOM 709 CB THR A 45 15.934 -3.177 -6.343 1.00 0.00 C ATOM 710 OG1 THR A 45 17.276 -2.986 -6.768 1.00 0.00 O ATOM 711 CG2 THR A 45 15.003 -3.104 -7.554 1.00 0.00 C ATOM 0 H THR A 45 16.263 -2.885 -3.476 1.00 0.00 H new ATOM 0 HA THR A 45 15.633 -1.109 -5.793 1.00 0.00 H new ATOM 0 HB THR A 45 15.826 -4.155 -5.874 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.515 -3.679 -7.418 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.274 -3.881 -8.268 1.00 0.00 H new ATOM 0 HG22 THR A 45 13.973 -3.252 -7.230 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.098 -2.127 -8.028 1.00 0.00 H new ATOM 719 N PRO A 46 13.209 -1.583 -5.352 1.00 0.00 N ATOM 720 CA PRO A 46 11.797 -1.728 -4.961 1.00 0.00 C ATOM 721 C PRO A 46 11.401 -3.207 -4.986 1.00 0.00 C ATOM 722 O PRO A 46 10.430 -3.608 -4.381 1.00 0.00 O ATOM 723 CB PRO A 46 11.023 -0.916 -6.007 1.00 0.00 C ATOM 724 CG PRO A 46 12.063 -0.137 -6.857 1.00 0.00 C ATOM 725 CD PRO A 46 13.465 -0.560 -6.381 1.00 0.00 C ATOM 0 HA PRO A 46 11.592 -1.374 -3.951 1.00 0.00 H new ATOM 0 HB2 PRO A 46 10.427 -1.574 -6.639 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.331 -0.227 -5.522 1.00 0.00 H new ATOM 0 HG2 PRO A 46 11.935 -0.359 -7.916 1.00 0.00 H new ATOM 0 HG3 PRO A 46 11.927 0.938 -6.738 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.059 -0.962 -7.202 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.018 0.286 -5.972 1.00 0.00 H new ATOM 733 N GLU A 47 12.161 -4.025 -5.666 1.00 0.00 N ATOM 734 CA GLU A 47 11.844 -5.475 -5.708 1.00 0.00 C ATOM 735 C GLU A 47 12.256 -6.108 -4.379 1.00 0.00 C ATOM 736 O GLU A 47 11.473 -6.206 -3.473 1.00 0.00 O ATOM 737 CB GLU A 47 12.617 -6.136 -6.851 1.00 0.00 C ATOM 738 CG GLU A 47 11.707 -6.264 -8.075 1.00 0.00 C ATOM 739 CD GLU A 47 12.308 -5.475 -9.241 1.00 0.00 C ATOM 740 OE1 GLU A 47 12.451 -4.272 -9.106 1.00 0.00 O ATOM 741 OE2 GLU A 47 12.615 -6.090 -10.250 1.00 0.00 O ATOM 0 H GLU A 47 12.988 -3.747 -6.194 1.00 0.00 H new ATOM 0 HA GLU A 47 10.776 -5.616 -5.871 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.497 -5.543 -7.099 1.00 0.00 H new ATOM 0 HB3 GLU A 47 12.971 -7.120 -6.543 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.595 -7.313 -8.351 1.00 0.00 H new ATOM 0 HG3 GLU A 47 10.711 -5.888 -7.842 1.00 0.00 H new ATOM 748 N GLN A 48 13.479 -6.536 -4.251 1.00 0.00 N ATOM 749 CA GLN A 48 13.909 -7.161 -2.964 1.00 0.00 C ATOM 750 C GLN A 48 13.367 -6.362 -1.793 1.00 0.00 C ATOM 751 O GLN A 48 13.036 -6.901 -0.766 1.00 0.00 O ATOM 752 CB GLN A 48 15.431 -7.181 -2.865 1.00 0.00 C ATOM 753 CG GLN A 48 15.971 -8.377 -3.648 1.00 0.00 C ATOM 754 CD GLN A 48 17.340 -8.777 -3.096 1.00 0.00 C ATOM 755 OE1 GLN A 48 18.335 -8.145 -3.391 1.00 0.00 O ATOM 756 NE2 GLN A 48 17.433 -9.807 -2.302 1.00 0.00 N ATOM 0 H GLN A 48 14.197 -6.483 -4.973 1.00 0.00 H new ATOM 0 HA GLN A 48 13.523 -8.180 -2.937 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.845 -6.254 -3.262 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.738 -7.246 -1.821 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.279 -9.216 -3.574 1.00 0.00 H new ATOM 0 HG3 GLN A 48 16.054 -8.125 -4.705 1.00 0.00 H new ATOM 0 HE21 GLN A 48 16.598 -10.337 -2.055 1.00 0.00 H new ATOM 0 HE22 GLN A 48 18.341 -10.082 -1.928 1.00 0.00 H new ATOM 765 N ALA A 49 13.285 -5.082 -1.935 1.00 0.00 N ATOM 766 CA ALA A 49 12.773 -4.250 -0.824 1.00 0.00 C ATOM 767 C ALA A 49 11.306 -4.585 -0.559 1.00 0.00 C ATOM 768 O ALA A 49 10.958 -5.055 0.493 1.00 0.00 O ATOM 769 CB ALA A 49 12.899 -2.776 -1.196 1.00 0.00 C ATOM 0 H ALA A 49 13.551 -4.570 -2.776 1.00 0.00 H new ATOM 0 HA ALA A 49 13.355 -4.452 0.075 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.522 -2.161 -0.379 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.946 -2.535 -1.379 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.319 -2.577 -2.097 1.00 0.00 H new ATOM 775 N VAL A 50 10.442 -4.337 -1.500 1.00 0.00 N ATOM 776 CA VAL A 50 8.991 -4.625 -1.282 1.00 0.00 C ATOM 777 C VAL A 50 8.750 -6.133 -1.129 1.00 0.00 C ATOM 778 O VAL A 50 8.087 -6.576 -0.215 1.00 0.00 O ATOM 779 CB VAL A 50 8.191 -4.071 -2.468 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.197 -5.064 -3.634 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.752 -3.820 -2.030 1.00 0.00 C ATOM 0 H VAL A 50 10.674 -3.947 -2.413 1.00 0.00 H new ATOM 0 HA VAL A 50 8.663 -4.143 -0.361 1.00 0.00 H new ATOM 0 HB VAL A 50 8.652 -3.140 -2.798 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.624 -4.653 -4.465 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.223 -5.243 -3.954 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.747 -6.004 -3.314 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.180 -3.426 -2.870 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.306 -4.756 -1.694 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.741 -3.098 -1.213 1.00 0.00 H new ATOM 791 N VAL A 51 9.277 -6.908 -2.025 1.00 0.00 N ATOM 792 CA VAL A 51 9.099 -8.389 -1.979 1.00 0.00 C ATOM 793 C VAL A 51 9.592 -8.943 -0.634 1.00 0.00 C ATOM 794 O VAL A 51 8.949 -9.768 -0.019 1.00 0.00 O ATOM 795 CB VAL A 51 9.906 -9.002 -3.128 1.00 0.00 C ATOM 796 CG1 VAL A 51 11.382 -9.064 -2.745 1.00 0.00 C ATOM 797 CG2 VAL A 51 9.406 -10.412 -3.424 1.00 0.00 C ATOM 0 H VAL A 51 9.838 -6.574 -2.809 1.00 0.00 H new ATOM 0 HA VAL A 51 8.044 -8.642 -2.083 1.00 0.00 H new ATOM 0 HB VAL A 51 9.782 -8.381 -4.015 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.953 -9.501 -3.565 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.748 -8.057 -2.544 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.501 -9.679 -1.853 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.986 -10.839 -4.242 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.520 -11.033 -2.535 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.354 -10.373 -3.706 1.00 0.00 H new ATOM 807 N ARG A 52 10.725 -8.486 -0.174 1.00 0.00 N ATOM 808 CA ARG A 52 11.259 -8.970 1.130 1.00 0.00 C ATOM 809 C ARG A 52 10.423 -8.338 2.238 1.00 0.00 C ATOM 810 O ARG A 52 10.220 -8.910 3.290 1.00 0.00 O ATOM 811 CB ARG A 52 12.732 -8.567 1.256 1.00 0.00 C ATOM 812 CG ARG A 52 13.544 -9.282 0.172 1.00 0.00 C ATOM 813 CD ARG A 52 13.753 -10.745 0.574 1.00 0.00 C ATOM 814 NE ARG A 52 14.505 -10.802 1.857 1.00 0.00 N ATOM 815 CZ ARG A 52 14.526 -11.905 2.553 1.00 0.00 C ATOM 816 NH1 ARG A 52 14.852 -13.033 1.983 1.00 0.00 N ATOM 817 NH2 ARG A 52 14.222 -11.882 3.821 1.00 0.00 N ATOM 0 H ARG A 52 11.306 -7.795 -0.648 1.00 0.00 H new ATOM 0 HA ARG A 52 11.200 -10.056 1.202 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.836 -7.487 1.152 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.110 -8.830 2.244 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.023 -9.227 -0.784 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.507 -8.789 0.039 1.00 0.00 H new ATOM 0 HD2 ARG A 52 12.791 -11.245 0.681 1.00 0.00 H new ATOM 0 HD3 ARG A 52 14.302 -11.273 -0.206 1.00 0.00 H new ATOM 0 HE ARG A 52 15.004 -9.978 2.192 1.00 0.00 H new ATOM 0 HH11 ARG A 52 15.091 -13.053 0.992 1.00 0.00 H new ATOM 0 HH12 ARG A 52 14.868 -13.894 2.529 1.00 0.00 H new ATOM 0 HH21 ARG A 52 13.968 -11.001 4.269 1.00 0.00 H new ATOM 0 HH22 ARG A 52 14.238 -12.745 4.365 1.00 0.00 H new ATOM 831 N GLU A 53 9.886 -7.177 1.975 1.00 0.00 N ATOM 832 CA GLU A 53 9.001 -6.516 2.969 1.00 0.00 C ATOM 833 C GLU A 53 7.653 -7.225 2.908 1.00 0.00 C ATOM 834 O GLU A 53 6.814 -7.090 3.773 1.00 0.00 O ATOM 835 CB GLU A 53 8.806 -5.048 2.598 1.00 0.00 C ATOM 836 CG GLU A 53 10.135 -4.313 2.724 1.00 0.00 C ATOM 837 CD GLU A 53 10.269 -3.718 4.125 1.00 0.00 C ATOM 838 OE1 GLU A 53 9.370 -3.927 4.919 1.00 0.00 O ATOM 839 OE2 GLU A 53 11.274 -3.078 4.382 1.00 0.00 O ATOM 0 H GLU A 53 10.025 -6.657 1.108 1.00 0.00 H new ATOM 0 HA GLU A 53 9.437 -6.570 3.966 1.00 0.00 H new ATOM 0 HB2 GLU A 53 8.428 -4.966 1.579 1.00 0.00 H new ATOM 0 HB3 GLU A 53 8.062 -4.592 3.252 1.00 0.00 H new ATOM 0 HG2 GLU A 53 10.960 -4.999 2.530 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.196 -3.522 1.976 1.00 0.00 H new ATOM 846 N LEU A 54 7.455 -7.979 1.864 1.00 0.00 N ATOM 847 CA LEU A 54 6.189 -8.720 1.675 1.00 0.00 C ATOM 848 C LEU A 54 6.214 -9.989 2.528 1.00 0.00 C ATOM 849 O LEU A 54 5.337 -10.235 3.331 1.00 0.00 O ATOM 850 CB LEU A 54 6.079 -9.084 0.187 1.00 0.00 C ATOM 851 CG LEU A 54 5.014 -8.223 -0.501 1.00 0.00 C ATOM 852 CD1 LEU A 54 3.740 -8.196 0.341 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.545 -6.798 -0.672 1.00 0.00 C ATOM 0 H LEU A 54 8.138 -8.112 1.118 1.00 0.00 H new ATOM 0 HA LEU A 54 5.334 -8.116 1.978 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.043 -8.939 -0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.825 -10.139 0.083 1.00 0.00 H new ATOM 0 HG LEU A 54 4.786 -8.649 -1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.989 -7.582 -0.155 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.360 -9.211 0.458 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.961 -7.776 1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.789 -6.184 -1.161 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.777 -6.377 0.306 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.448 -6.817 -1.283 1.00 0.00 H new ATOM 865 N GLN A 55 7.219 -10.797 2.339 1.00 0.00 N ATOM 866 CA GLN A 55 7.333 -12.072 3.118 1.00 0.00 C ATOM 867 C GLN A 55 7.623 -11.780 4.592 1.00 0.00 C ATOM 868 O GLN A 55 7.093 -12.425 5.474 1.00 0.00 O ATOM 869 CB GLN A 55 8.471 -12.938 2.554 1.00 0.00 C ATOM 870 CG GLN A 55 9.562 -12.056 1.938 1.00 0.00 C ATOM 871 CD GLN A 55 10.937 -12.639 2.270 1.00 0.00 C ATOM 872 OE1 GLN A 55 11.788 -11.954 2.802 1.00 0.00 O ATOM 873 NE2 GLN A 55 11.192 -13.885 1.976 1.00 0.00 N ATOM 0 H GLN A 55 7.975 -10.632 1.674 1.00 0.00 H new ATOM 0 HA GLN A 55 6.385 -12.603 3.033 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.897 -13.552 3.348 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.078 -13.620 1.800 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.431 -11.998 0.857 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.483 -11.039 2.323 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.478 -14.460 1.529 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.106 -14.284 2.193 1.00 0.00 H new ATOM 882 N GLU A 56 8.474 -10.835 4.871 1.00 0.00 N ATOM 883 CA GLU A 56 8.806 -10.534 6.293 1.00 0.00 C ATOM 884 C GLU A 56 7.547 -10.139 7.072 1.00 0.00 C ATOM 885 O GLU A 56 7.516 -10.214 8.284 1.00 0.00 O ATOM 886 CB GLU A 56 9.834 -9.399 6.353 1.00 0.00 C ATOM 887 CG GLU A 56 9.300 -8.161 5.633 1.00 0.00 C ATOM 888 CD GLU A 56 8.522 -7.277 6.613 1.00 0.00 C ATOM 889 OE1 GLU A 56 8.230 -7.745 7.700 1.00 0.00 O ATOM 890 OE2 GLU A 56 8.233 -6.143 6.257 1.00 0.00 O ATOM 0 H GLU A 56 8.954 -10.258 4.180 1.00 0.00 H new ATOM 0 HA GLU A 56 9.226 -11.430 6.750 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.057 -9.156 7.392 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.768 -9.721 5.893 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.127 -7.598 5.200 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.653 -8.461 4.809 1.00 0.00 H new ATOM 897 N GLU A 57 6.511 -9.715 6.402 1.00 0.00 N ATOM 898 CA GLU A 57 5.275 -9.321 7.138 1.00 0.00 C ATOM 899 C GLU A 57 4.460 -10.563 7.520 1.00 0.00 C ATOM 900 O GLU A 57 4.641 -11.139 8.574 1.00 0.00 O ATOM 901 CB GLU A 57 4.431 -8.393 6.260 1.00 0.00 C ATOM 902 CG GLU A 57 5.248 -7.154 5.896 1.00 0.00 C ATOM 903 CD GLU A 57 4.836 -5.977 6.781 1.00 0.00 C ATOM 904 OE1 GLU A 57 3.829 -6.096 7.460 1.00 0.00 O ATOM 905 OE2 GLU A 57 5.536 -4.974 6.765 1.00 0.00 O ATOM 0 H GLU A 57 6.465 -9.625 5.387 1.00 0.00 H new ATOM 0 HA GLU A 57 5.559 -8.798 8.052 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.119 -8.915 5.355 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.523 -8.101 6.788 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.311 -7.359 6.022 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.094 -6.902 4.847 1.00 0.00 H new ATOM 912 N VAL A 58 3.551 -10.965 6.673 1.00 0.00 N ATOM 913 CA VAL A 58 2.700 -12.149 6.968 1.00 0.00 C ATOM 914 C VAL A 58 3.488 -13.440 6.727 1.00 0.00 C ATOM 915 O VAL A 58 3.994 -14.043 7.652 1.00 0.00 O ATOM 916 CB VAL A 58 1.488 -12.084 6.046 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.617 -13.321 6.217 1.00 0.00 C ATOM 918 CG2 VAL A 58 0.673 -10.835 6.381 1.00 0.00 C ATOM 0 H VAL A 58 3.361 -10.515 5.777 1.00 0.00 H new ATOM 0 HA VAL A 58 2.384 -12.144 8.011 1.00 0.00 H new ATOM 0 HB VAL A 58 1.830 -12.042 5.012 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.243 -13.256 5.550 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.197 -14.211 5.974 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.272 -13.383 7.249 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.196 -10.781 5.726 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.343 -10.884 7.419 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.291 -9.948 6.238 1.00 0.00 H new ATOM 928 N GLY A 59 3.613 -13.871 5.496 1.00 0.00 N ATOM 929 CA GLY A 59 4.390 -15.122 5.237 1.00 0.00 C ATOM 930 C GLY A 59 3.757 -15.962 4.114 1.00 0.00 C ATOM 931 O GLY A 59 3.844 -17.175 4.126 1.00 0.00 O ATOM 0 H GLY A 59 3.218 -13.419 4.671 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.414 -14.865 4.966 1.00 0.00 H new ATOM 0 HA3 GLY A 59 4.441 -15.715 6.150 1.00 0.00 H new ATOM 935 N ILE A 60 3.145 -15.349 3.134 1.00 0.00 N ATOM 936 CA ILE A 60 2.549 -16.151 2.020 1.00 0.00 C ATOM 937 C ILE A 60 3.620 -16.338 0.933 1.00 0.00 C ATOM 938 O ILE A 60 4.764 -16.607 1.239 1.00 0.00 O ATOM 939 CB ILE A 60 1.327 -15.424 1.450 1.00 0.00 C ATOM 940 CG1 ILE A 60 1.747 -14.045 0.954 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.266 -15.279 2.543 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.204 -13.822 -0.459 1.00 0.00 C ATOM 0 H ILE A 60 3.032 -14.338 3.055 1.00 0.00 H new ATOM 0 HA ILE A 60 2.223 -17.125 2.387 1.00 0.00 H new ATOM 0 HB ILE A 60 0.913 -15.996 0.620 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.369 -13.275 1.626 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.834 -13.962 0.954 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.604 -14.762 2.139 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.030 -16.267 2.896 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.676 -14.705 3.374 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.505 -12.836 -0.813 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.604 -14.585 -1.127 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.116 -13.886 -0.445 1.00 0.00 H new ATOM 954 N THR A 61 3.287 -16.198 -0.328 1.00 0.00 N ATOM 955 CA THR A 61 4.344 -16.375 -1.371 1.00 0.00 C ATOM 956 C THR A 61 3.997 -15.591 -2.655 1.00 0.00 C ATOM 957 O THR A 61 4.641 -14.600 -2.937 1.00 0.00 O ATOM 958 CB THR A 61 4.546 -17.870 -1.663 1.00 0.00 C ATOM 959 OG1 THR A 61 5.395 -18.424 -0.667 1.00 0.00 O ATOM 960 CG2 THR A 61 5.199 -18.059 -3.040 1.00 0.00 C ATOM 0 H THR A 61 2.354 -15.975 -0.673 1.00 0.00 H new ATOM 0 HA THR A 61 5.281 -15.969 -0.991 1.00 0.00 H new ATOM 0 HB THR A 61 3.577 -18.370 -1.657 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.398 -17.842 0.121 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.337 -19.123 -3.235 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.557 -17.629 -3.809 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.168 -17.559 -3.055 1.00 0.00 H new ATOM 968 N PRO A 62 3.012 -16.033 -3.412 1.00 0.00 N ATOM 969 CA PRO A 62 2.638 -15.334 -4.654 1.00 0.00 C ATOM 970 C PRO A 62 2.121 -13.936 -4.339 1.00 0.00 C ATOM 971 O PRO A 62 2.120 -13.500 -3.207 1.00 0.00 O ATOM 972 CB PRO A 62 1.517 -16.172 -5.267 1.00 0.00 C ATOM 973 CG PRO A 62 1.155 -17.277 -4.248 1.00 0.00 C ATOM 974 CD PRO A 62 2.195 -17.226 -3.114 1.00 0.00 C ATOM 0 HA PRO A 62 3.488 -15.225 -5.327 1.00 0.00 H new ATOM 0 HB2 PRO A 62 0.648 -15.551 -5.484 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.839 -16.611 -6.211 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.151 -17.120 -3.854 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.159 -18.256 -4.727 1.00 0.00 H new ATOM 0 HD2 PRO A 62 1.715 -17.144 -2.139 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.805 -18.129 -3.094 1.00 0.00 H new ATOM 982 N GLN A 63 1.671 -13.257 -5.354 1.00 0.00 N ATOM 983 CA GLN A 63 1.128 -11.879 -5.204 1.00 0.00 C ATOM 984 C GLN A 63 1.356 -11.143 -6.522 1.00 0.00 C ATOM 985 O GLN A 63 0.680 -10.188 -6.842 1.00 0.00 O ATOM 986 CB GLN A 63 1.831 -11.134 -4.066 1.00 0.00 C ATOM 987 CG GLN A 63 3.344 -11.301 -4.195 1.00 0.00 C ATOM 988 CD GLN A 63 4.051 -10.046 -3.662 1.00 0.00 C ATOM 989 OE1 GLN A 63 3.529 -8.865 -3.862 1.00 0.00 O flip ATOM 990 NE2 GLN A 63 5.105 -10.138 -3.065 1.00 0.00 N flip ATOM 0 H GLN A 63 1.657 -13.611 -6.311 1.00 0.00 H new ATOM 0 HA GLN A 63 0.066 -11.926 -4.963 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.569 -10.076 -4.095 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.494 -11.520 -3.104 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.671 -12.179 -3.638 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.614 -11.467 -5.238 1.00 0.00 H new ATOM 0 HE21 GLN A 63 5.521 -11.055 -2.903 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.574 -9.298 -2.725 1.00 0.00 H new ATOM 999 N HIS A 64 2.300 -11.604 -7.302 1.00 0.00 N ATOM 1000 CA HIS A 64 2.572 -10.957 -8.615 1.00 0.00 C ATOM 1001 C HIS A 64 2.685 -9.448 -8.432 1.00 0.00 C ATOM 1002 O HIS A 64 2.055 -8.677 -9.129 1.00 0.00 O ATOM 1003 CB HIS A 64 1.422 -11.273 -9.561 1.00 0.00 C ATOM 1004 CG HIS A 64 1.972 -11.685 -10.899 1.00 0.00 C ATOM 1005 ND1 HIS A 64 2.833 -10.874 -11.624 1.00 0.00 N ATOM 1006 CD2 HIS A 64 1.795 -12.816 -11.657 1.00 0.00 C ATOM 1007 CE1 HIS A 64 3.137 -11.521 -12.763 1.00 0.00 C ATOM 1008 NE2 HIS A 64 2.532 -12.711 -12.834 1.00 0.00 N ATOM 0 H HIS A 64 2.895 -12.403 -7.083 1.00 0.00 H new ATOM 0 HA HIS A 64 3.508 -11.334 -9.027 1.00 0.00 H new ATOM 0 HB2 HIS A 64 0.806 -12.072 -9.148 1.00 0.00 H new ATOM 0 HB3 HIS A 64 0.779 -10.400 -9.673 1.00 0.00 H new ATOM 0 HD2 HIS A 64 1.178 -13.659 -11.382 1.00 0.00 H new ATOM 0 HE1 HIS A 64 3.790 -11.127 -13.527 1.00 0.00 H new ATOM 0 HE2 HIS A 64 2.596 -13.395 -13.588 1.00 0.00 H new ATOM 1016 N PHE A 65 3.483 -9.025 -7.500 1.00 0.00 N ATOM 1017 CA PHE A 65 3.642 -7.568 -7.263 1.00 0.00 C ATOM 1018 C PHE A 65 3.896 -6.833 -8.576 1.00 0.00 C ATOM 1019 O PHE A 65 4.467 -7.365 -9.508 1.00 0.00 O ATOM 1020 CB PHE A 65 4.802 -7.330 -6.297 1.00 0.00 C ATOM 1021 CG PHE A 65 6.138 -7.659 -6.941 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.223 -8.528 -8.041 1.00 0.00 C ATOM 1023 CD2 PHE A 65 7.306 -7.094 -6.412 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.470 -8.824 -8.606 1.00 0.00 C ATOM 1025 CE2 PHE A 65 8.549 -7.390 -6.978 1.00 0.00 C ATOM 1026 CZ PHE A 65 8.632 -8.256 -8.074 1.00 0.00 C ATOM 0 H PHE A 65 4.035 -9.627 -6.889 1.00 0.00 H new ATOM 0 HA PHE A 65 2.721 -7.181 -6.827 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.799 -6.289 -5.973 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.666 -7.942 -5.405 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.326 -8.968 -8.451 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.245 -6.428 -5.564 1.00 0.00 H new ATOM 0 HE1 PHE A 65 7.534 -9.491 -9.453 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.446 -6.950 -6.569 1.00 0.00 H new ATOM 0 HZ PHE A 65 9.593 -8.486 -8.509 1.00 0.00 H new ATOM 1036 N SER A 66 3.463 -5.606 -8.649 1.00 0.00 N ATOM 1037 CA SER A 66 3.653 -4.806 -9.887 1.00 0.00 C ATOM 1038 C SER A 66 3.679 -3.322 -9.505 1.00 0.00 C ATOM 1039 O SER A 66 2.863 -2.866 -8.743 1.00 0.00 O ATOM 1040 CB SER A 66 2.488 -5.082 -10.838 1.00 0.00 C ATOM 1041 OG SER A 66 2.778 -6.233 -11.625 1.00 0.00 O ATOM 0 H SER A 66 2.980 -5.119 -7.894 1.00 0.00 H new ATOM 0 HA SER A 66 4.588 -5.073 -10.380 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.571 -5.239 -10.270 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.320 -4.220 -11.484 1.00 0.00 H new ATOM 0 HG SER A 66 3.446 -6.784 -11.166 1.00 0.00 H new ATOM 1047 N LEU A 67 4.615 -2.570 -10.010 1.00 0.00 N ATOM 1048 CA LEU A 67 4.685 -1.121 -9.643 1.00 0.00 C ATOM 1049 C LEU A 67 3.363 -0.419 -9.975 1.00 0.00 C ATOM 1050 O LEU A 67 2.619 -0.039 -9.104 1.00 0.00 O ATOM 1051 CB LEU A 67 5.819 -0.455 -10.427 1.00 0.00 C ATOM 1052 CG LEU A 67 6.414 0.704 -9.622 1.00 0.00 C ATOM 1053 CD1 LEU A 67 7.075 1.684 -10.587 1.00 0.00 C ATOM 1054 CD2 LEU A 67 5.315 1.436 -8.846 1.00 0.00 C ATOM 0 H LEU A 67 5.334 -2.890 -10.659 1.00 0.00 H new ATOM 0 HA LEU A 67 4.870 -1.038 -8.572 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.595 -1.187 -10.650 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.443 -0.088 -11.382 1.00 0.00 H new ATOM 0 HG LEU A 67 7.144 0.310 -8.915 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.503 2.515 -10.026 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.865 1.174 -11.139 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.330 2.064 -11.286 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.755 2.257 -8.279 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.578 1.832 -9.545 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.829 0.741 -8.161 1.00 0.00 H new ATOM 1066 N PHE A 68 3.093 -0.231 -11.234 1.00 0.00 N ATOM 1067 CA PHE A 68 1.841 0.452 -11.681 1.00 0.00 C ATOM 1068 C PHE A 68 2.062 1.970 -11.661 1.00 0.00 C ATOM 1069 O PHE A 68 1.831 2.638 -12.647 1.00 0.00 O ATOM 1070 CB PHE A 68 0.646 0.019 -10.795 1.00 0.00 C ATOM 1071 CG PHE A 68 -0.077 1.212 -10.201 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -1.088 1.849 -10.929 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.258 1.669 -8.920 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -1.764 2.943 -10.379 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.419 2.766 -8.371 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.431 3.402 -9.100 1.00 0.00 C ATOM 0 H PHE A 68 3.703 -0.529 -11.996 1.00 0.00 H new ATOM 0 HA PHE A 68 1.598 0.160 -12.702 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.052 -0.570 -11.390 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.004 -0.626 -9.992 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.347 1.496 -11.916 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.037 1.177 -8.356 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.544 3.434 -10.942 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.160 3.121 -7.385 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.954 4.246 -8.675 1.00 0.00 H new ATOM 1086 N GLU A 69 2.522 2.503 -10.559 1.00 0.00 N ATOM 1087 CA GLU A 69 2.783 3.977 -10.465 1.00 0.00 C ATOM 1088 C GLU A 69 2.696 4.407 -9.002 1.00 0.00 C ATOM 1089 O GLU A 69 1.835 3.970 -8.271 1.00 0.00 O ATOM 1090 CB GLU A 69 1.751 4.764 -11.287 1.00 0.00 C ATOM 1091 CG GLU A 69 1.807 6.253 -10.919 1.00 0.00 C ATOM 1092 CD GLU A 69 2.219 7.073 -12.146 1.00 0.00 C ATOM 1093 OE1 GLU A 69 2.425 6.483 -13.193 1.00 0.00 O ATOM 1094 OE2 GLU A 69 2.323 8.281 -12.015 1.00 0.00 O ATOM 0 H GLU A 69 2.731 1.978 -9.710 1.00 0.00 H new ATOM 0 HA GLU A 69 3.777 4.185 -10.861 1.00 0.00 H new ATOM 0 HB2 GLU A 69 1.949 4.637 -12.351 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.751 4.373 -11.100 1.00 0.00 H new ATOM 0 HG2 GLU A 69 0.834 6.585 -10.558 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.519 6.411 -10.109 1.00 0.00 H new ATOM 1101 N LYS A 70 3.581 5.258 -8.567 1.00 0.00 N ATOM 1102 CA LYS A 70 3.546 5.705 -7.145 1.00 0.00 C ATOM 1103 C LYS A 70 3.575 7.229 -7.079 1.00 0.00 C ATOM 1104 O LYS A 70 3.538 7.909 -8.085 1.00 0.00 O ATOM 1105 CB LYS A 70 4.760 5.158 -6.383 1.00 0.00 C ATOM 1106 CG LYS A 70 5.829 4.655 -7.360 1.00 0.00 C ATOM 1107 CD LYS A 70 6.603 5.842 -7.939 1.00 0.00 C ATOM 1108 CE LYS A 70 7.348 6.569 -6.817 1.00 0.00 C ATOM 1109 NZ LYS A 70 8.703 6.968 -7.299 1.00 0.00 N ATOM 0 H LYS A 70 4.327 5.664 -9.132 1.00 0.00 H new ATOM 0 HA LYS A 70 2.630 5.329 -6.690 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.179 5.938 -5.747 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.448 4.345 -5.727 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.513 3.978 -6.848 1.00 0.00 H new ATOM 0 HG3 LYS A 70 5.361 4.087 -8.164 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.310 5.495 -8.693 1.00 0.00 H new ATOM 0 HD3 LYS A 70 5.917 6.528 -8.437 1.00 0.00 H new ATOM 0 HE2 LYS A 70 6.787 7.450 -6.504 1.00 0.00 H new ATOM 0 HE3 LYS A 70 7.436 5.921 -5.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.211 7.462 -6.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 9.236 6.120 -7.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.607 7.601 -8.119 1.00 0.00 H new ATOM 1123 N LEU A 71 3.647 7.768 -5.895 1.00 0.00 N ATOM 1124 CA LEU A 71 3.685 9.246 -5.757 1.00 0.00 C ATOM 1125 C LEU A 71 4.911 9.654 -4.947 1.00 0.00 C ATOM 1126 O LEU A 71 5.777 8.854 -4.654 1.00 0.00 O ATOM 1127 CB LEU A 71 2.418 9.736 -5.042 1.00 0.00 C ATOM 1128 CG LEU A 71 2.164 8.934 -3.753 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.343 9.079 -2.777 1.00 0.00 C ATOM 1130 CD2 LEU A 71 0.895 9.466 -3.081 1.00 0.00 C ATOM 0 H LEU A 71 3.681 7.248 -5.018 1.00 0.00 H new ATOM 0 HA LEU A 71 3.737 9.694 -6.749 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.519 10.794 -4.802 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.561 9.641 -5.708 1.00 0.00 H new ATOM 0 HG LEU A 71 2.051 7.881 -4.011 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.140 8.504 -1.874 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.253 8.707 -3.248 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.473 10.129 -2.517 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.705 8.905 -2.166 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.026 10.521 -2.839 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.049 9.352 -3.759 1.00 0.00 H new ATOM 1142 N GLU A 72 4.968 10.893 -4.565 1.00 0.00 N ATOM 1143 CA GLU A 72 6.107 11.378 -3.750 1.00 0.00 C ATOM 1144 C GLU A 72 5.639 12.613 -2.984 1.00 0.00 C ATOM 1145 O GLU A 72 5.856 13.735 -3.395 1.00 0.00 O ATOM 1146 CB GLU A 72 7.288 11.729 -4.655 1.00 0.00 C ATOM 1147 CG GLU A 72 8.601 11.346 -3.961 1.00 0.00 C ATOM 1148 CD GLU A 72 9.686 11.113 -5.013 1.00 0.00 C ATOM 1149 OE1 GLU A 72 9.336 10.773 -6.131 1.00 0.00 O ATOM 1150 OE2 GLU A 72 10.849 11.282 -4.684 1.00 0.00 O ATOM 0 H GLU A 72 4.265 11.599 -4.785 1.00 0.00 H new ATOM 0 HA GLU A 72 6.436 10.605 -3.055 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.200 11.202 -5.605 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.282 12.795 -4.880 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.907 12.137 -3.277 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.460 10.445 -3.364 1.00 0.00 H new ATOM 1157 N TYR A 73 4.992 12.406 -1.871 1.00 0.00 N ATOM 1158 CA TYR A 73 4.499 13.553 -1.070 1.00 0.00 C ATOM 1159 C TYR A 73 5.681 14.115 -0.292 1.00 0.00 C ATOM 1160 O TYR A 73 6.160 13.518 0.651 1.00 0.00 O ATOM 1161 CB TYR A 73 3.405 13.068 -0.110 1.00 0.00 C ATOM 1162 CG TYR A 73 2.318 14.110 -0.005 1.00 0.00 C ATOM 1163 CD1 TYR A 73 2.652 15.466 0.079 1.00 0.00 C ATOM 1164 CD2 TYR A 73 0.975 13.715 0.013 1.00 0.00 C ATOM 1165 CE1 TYR A 73 1.640 16.429 0.179 1.00 0.00 C ATOM 1166 CE2 TYR A 73 -0.036 14.678 0.113 1.00 0.00 C ATOM 1167 CZ TYR A 73 0.296 16.036 0.196 1.00 0.00 C ATOM 1168 OH TYR A 73 -0.700 16.985 0.297 1.00 0.00 O ATOM 0 H TYR A 73 4.784 11.486 -1.483 1.00 0.00 H new ATOM 0 HA TYR A 73 4.074 14.326 -1.710 1.00 0.00 H new ATOM 0 HB2 TYR A 73 2.986 12.127 -0.467 1.00 0.00 H new ATOM 0 HB3 TYR A 73 3.832 12.874 0.874 1.00 0.00 H new ATOM 0 HD1 TYR A 73 3.688 15.770 0.067 1.00 0.00 H new ATOM 0 HD2 TYR A 73 0.719 12.668 -0.050 1.00 0.00 H new ATOM 0 HE1 TYR A 73 1.896 17.476 0.243 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -1.072 14.374 0.126 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.575 16.543 0.294 1.00 0.00 H new ATOM 1178 N GLU A 74 6.175 15.251 -0.697 1.00 0.00 N ATOM 1179 CA GLU A 74 7.343 15.832 -0.003 1.00 0.00 C ATOM 1180 C GLU A 74 6.867 16.701 1.149 1.00 0.00 C ATOM 1181 O GLU A 74 5.705 16.697 1.507 1.00 0.00 O ATOM 1182 CB GLU A 74 8.154 16.678 -0.986 1.00 0.00 C ATOM 1183 CG GLU A 74 9.435 15.934 -1.360 1.00 0.00 C ATOM 1184 CD GLU A 74 9.858 16.320 -2.777 1.00 0.00 C ATOM 1185 OE1 GLU A 74 9.164 15.940 -3.706 1.00 0.00 O ATOM 1186 OE2 GLU A 74 10.869 16.990 -2.911 1.00 0.00 O ATOM 0 H GLU A 74 5.816 15.798 -1.480 1.00 0.00 H new ATOM 0 HA GLU A 74 7.971 15.030 0.385 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.565 16.882 -1.880 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.398 17.642 -0.539 1.00 0.00 H new ATOM 0 HG2 GLU A 74 10.229 16.178 -0.654 1.00 0.00 H new ATOM 0 HG3 GLU A 74 9.273 14.858 -1.298 1.00 0.00 H new ATOM 1193 N PHE A 75 7.753 17.441 1.741 1.00 0.00 N ATOM 1194 CA PHE A 75 7.345 18.299 2.875 1.00 0.00 C ATOM 1195 C PHE A 75 8.387 19.400 3.078 1.00 0.00 C ATOM 1196 O PHE A 75 9.459 19.347 2.505 1.00 0.00 O ATOM 1197 CB PHE A 75 7.261 17.435 4.134 1.00 0.00 C ATOM 1198 CG PHE A 75 5.854 16.917 4.310 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.784 17.807 4.474 1.00 0.00 C ATOM 1200 CD2 PHE A 75 5.621 15.537 4.312 1.00 0.00 C ATOM 1201 CE1 PHE A 75 3.484 17.315 4.638 1.00 0.00 C ATOM 1202 CE2 PHE A 75 4.321 15.045 4.477 1.00 0.00 C ATOM 1203 CZ PHE A 75 3.253 15.934 4.641 1.00 0.00 C ATOM 0 H PHE A 75 8.740 17.488 1.489 1.00 0.00 H new ATOM 0 HA PHE A 75 6.376 18.755 2.672 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.958 16.600 4.060 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.554 18.019 5.006 1.00 0.00 H new ATOM 0 HD1 PHE A 75 4.962 18.872 4.474 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.445 14.851 4.186 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.659 18.001 4.762 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.142 13.980 4.478 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.250 15.555 4.770 1.00 0.00 H new ATOM 1213 N PRO A 76 8.055 20.357 3.903 1.00 0.00 N ATOM 1214 CA PRO A 76 8.965 21.470 4.211 1.00 0.00 C ATOM 1215 C PRO A 76 10.335 20.918 4.608 1.00 0.00 C ATOM 1216 O PRO A 76 11.358 21.541 4.405 1.00 0.00 O ATOM 1217 CB PRO A 76 8.302 22.189 5.390 1.00 0.00 C ATOM 1218 CG PRO A 76 6.900 21.560 5.597 1.00 0.00 C ATOM 1219 CD PRO A 76 6.758 20.405 4.599 1.00 0.00 C ATOM 0 HA PRO A 76 9.126 22.139 3.366 1.00 0.00 H new ATOM 0 HB2 PRO A 76 8.906 22.083 6.291 1.00 0.00 H new ATOM 0 HB3 PRO A 76 8.216 23.257 5.188 1.00 0.00 H new ATOM 0 HG2 PRO A 76 6.790 21.198 6.619 1.00 0.00 H new ATOM 0 HG3 PRO A 76 6.119 22.303 5.436 1.00 0.00 H new ATOM 0 HD2 PRO A 76 6.546 19.465 5.108 1.00 0.00 H new ATOM 0 HD3 PRO A 76 5.939 20.582 3.901 1.00 0.00 H new ATOM 1227 N ASP A 77 10.351 19.740 5.165 1.00 0.00 N ATOM 1228 CA ASP A 77 11.631 19.108 5.580 1.00 0.00 C ATOM 1229 C ASP A 77 11.369 17.618 5.751 1.00 0.00 C ATOM 1230 O ASP A 77 11.803 16.998 6.701 1.00 0.00 O ATOM 1231 CB ASP A 77 12.097 19.709 6.908 1.00 0.00 C ATOM 1232 CG ASP A 77 13.243 20.689 6.656 1.00 0.00 C ATOM 1233 OD1 ASP A 77 14.227 20.279 6.062 1.00 0.00 O ATOM 1234 OD2 ASP A 77 13.118 21.834 7.059 1.00 0.00 O ATOM 0 H ASP A 77 9.518 19.181 5.352 1.00 0.00 H new ATOM 0 HA ASP A 77 12.407 19.279 4.834 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.268 20.221 7.397 1.00 0.00 H new ATOM 0 HB3 ASP A 77 12.424 18.917 7.582 1.00 0.00 H new ATOM 1239 N ARG A 78 10.625 17.052 4.842 1.00 0.00 N ATOM 1240 CA ARG A 78 10.283 15.614 4.939 1.00 0.00 C ATOM 1241 C ARG A 78 10.059 15.039 3.534 1.00 0.00 C ATOM 1242 O ARG A 78 8.968 15.093 3.000 1.00 0.00 O ATOM 1243 CB ARG A 78 8.995 15.494 5.754 1.00 0.00 C ATOM 1244 CG ARG A 78 9.289 14.781 7.070 1.00 0.00 C ATOM 1245 CD ARG A 78 9.616 15.815 8.151 1.00 0.00 C ATOM 1246 NE ARG A 78 8.969 15.431 9.441 1.00 0.00 N ATOM 1247 CZ ARG A 78 7.773 14.903 9.449 1.00 0.00 C ATOM 1248 NH1 ARG A 78 6.863 15.337 8.622 1.00 0.00 N ATOM 1249 NH2 ARG A 78 7.489 13.942 10.285 1.00 0.00 N ATOM 0 H ARG A 78 10.238 17.533 4.030 1.00 0.00 H new ATOM 0 HA ARG A 78 11.092 15.061 5.417 1.00 0.00 H new ATOM 0 HB2 ARG A 78 8.582 16.484 5.949 1.00 0.00 H new ATOM 0 HB3 ARG A 78 8.245 14.941 5.189 1.00 0.00 H new ATOM 0 HG2 ARG A 78 8.429 14.184 7.372 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.126 14.094 6.944 1.00 0.00 H new ATOM 0 HD2 ARG A 78 10.696 15.885 8.283 1.00 0.00 H new ATOM 0 HD3 ARG A 78 9.268 16.800 7.840 1.00 0.00 H new ATOM 0 HE ARG A 78 9.463 15.581 10.321 1.00 0.00 H new ATOM 0 HH11 ARG A 78 7.084 16.088 7.969 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.930 14.925 8.628 1.00 0.00 H new ATOM 0 HH21 ARG A 78 8.200 13.603 10.933 1.00 0.00 H new ATOM 0 HH22 ARG A 78 6.556 13.530 10.291 1.00 0.00 H new ATOM 1263 N HIS A 79 11.077 14.487 2.929 1.00 0.00 N ATOM 1264 CA HIS A 79 10.909 13.911 1.562 1.00 0.00 C ATOM 1265 C HIS A 79 10.338 12.500 1.682 1.00 0.00 C ATOM 1266 O HIS A 79 11.033 11.573 2.052 1.00 0.00 O ATOM 1267 CB HIS A 79 12.268 13.851 0.867 1.00 0.00 C ATOM 1268 CG HIS A 79 12.857 15.233 0.794 1.00 0.00 C ATOM 1269 ND1 HIS A 79 12.443 16.435 1.312 1.00 0.00 N flip ATOM 1270 CD2 HIS A 79 14.035 15.497 0.116 1.00 0.00 C flip ATOM 1271 CE1 HIS A 79 13.350 17.432 0.962 1.00 0.00 C flip ATOM 1272 NE2 HIS A 79 14.289 16.813 0.241 1.00 0.00 N flip ATOM 0 H HIS A 79 12.016 14.410 3.321 1.00 0.00 H new ATOM 0 HA HIS A 79 10.231 14.535 0.980 1.00 0.00 H new ATOM 0 HB2 HIS A 79 12.938 13.187 1.413 1.00 0.00 H new ATOM 0 HB3 HIS A 79 12.157 13.438 -0.136 1.00 0.00 H new ATOM 0 HD2 HIS A 79 14.640 14.778 -0.416 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.304 18.480 1.218 1.00 0.00 H new ATOM 0 HE2 HIS A 79 15.099 17.281 -0.165 1.00 0.00 H new ATOM 1280 N ILE A 80 9.078 12.321 1.389 1.00 0.00 N ATOM 1281 CA ILE A 80 8.485 10.960 1.511 1.00 0.00 C ATOM 1282 C ILE A 80 8.060 10.441 0.135 1.00 0.00 C ATOM 1283 O ILE A 80 7.462 11.143 -0.656 1.00 0.00 O ATOM 1284 CB ILE A 80 7.237 10.991 2.412 1.00 0.00 C ATOM 1285 CG1 ILE A 80 7.605 11.211 3.891 1.00 0.00 C ATOM 1286 CG2 ILE A 80 6.508 9.650 2.295 1.00 0.00 C ATOM 1287 CD1 ILE A 80 8.800 12.153 4.024 1.00 0.00 C ATOM 0 H ILE A 80 8.440 13.051 1.073 1.00 0.00 H new ATOM 0 HA ILE A 80 9.242 10.307 1.945 1.00 0.00 H new ATOM 0 HB ILE A 80 6.607 11.818 2.084 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.750 11.626 4.424 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.838 10.254 4.358 1.00 0.00 H new ATOM 0 HG21 ILE A 80 5.622 9.661 2.930 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.211 9.487 1.259 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.172 8.846 2.613 1.00 0.00 H new ATOM 0 HD11 ILE A 80 9.039 12.291 5.079 1.00 0.00 H new ATOM 0 HD12 ILE A 80 9.660 11.724 3.510 1.00 0.00 H new ATOM 0 HD13 ILE A 80 8.555 13.117 3.578 1.00 0.00 H new ATOM 1299 N THR A 81 8.325 9.193 -0.120 1.00 0.00 N ATOM 1300 CA THR A 81 7.905 8.570 -1.400 1.00 0.00 C ATOM 1301 C THR A 81 6.841 7.526 -1.069 1.00 0.00 C ATOM 1302 O THR A 81 6.501 7.330 0.081 1.00 0.00 O ATOM 1303 CB THR A 81 9.097 7.876 -2.050 1.00 0.00 C ATOM 1304 OG1 THR A 81 10.286 8.588 -1.735 1.00 0.00 O ATOM 1305 CG2 THR A 81 8.905 7.844 -3.566 1.00 0.00 C ATOM 0 H THR A 81 8.823 8.569 0.515 1.00 0.00 H new ATOM 0 HA THR A 81 7.519 9.325 -2.085 1.00 0.00 H new ATOM 0 HB THR A 81 9.174 6.856 -1.675 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.991 8.344 -2.370 1.00 0.00 H new ATOM 0 HG21 THR A 81 9.757 7.348 -4.030 1.00 0.00 H new ATOM 0 HG22 THR A 81 7.993 7.298 -3.806 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.828 8.863 -3.945 1.00 0.00 H new ATOM 1313 N LEU A 82 6.309 6.847 -2.043 1.00 0.00 N ATOM 1314 CA LEU A 82 5.277 5.826 -1.725 1.00 0.00 C ATOM 1315 C LEU A 82 5.138 4.832 -2.878 1.00 0.00 C ATOM 1316 O LEU A 82 4.159 4.835 -3.598 1.00 0.00 O ATOM 1317 CB LEU A 82 3.940 6.520 -1.475 1.00 0.00 C ATOM 1318 CG LEU A 82 3.185 5.790 -0.363 1.00 0.00 C ATOM 1319 CD1 LEU A 82 3.529 6.418 0.988 1.00 0.00 C ATOM 1320 CD2 LEU A 82 1.681 5.907 -0.609 1.00 0.00 C ATOM 0 H LEU A 82 6.539 6.952 -3.031 1.00 0.00 H new ATOM 0 HA LEU A 82 5.579 5.280 -0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.105 7.560 -1.194 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.346 6.527 -2.389 1.00 0.00 H new ATOM 0 HG LEU A 82 3.474 4.739 -0.358 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.990 5.897 1.779 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.601 6.336 1.165 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.241 7.469 0.985 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.141 5.387 0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.394 6.958 -0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.434 5.459 -1.571 1.00 0.00 H new ATOM 1332 N TRP A 83 6.102 3.971 -3.052 1.00 0.00 N ATOM 1333 CA TRP A 83 6.006 2.970 -4.154 1.00 0.00 C ATOM 1334 C TRP A 83 4.658 2.250 -4.056 1.00 0.00 C ATOM 1335 O TRP A 83 4.274 1.783 -3.005 1.00 0.00 O ATOM 1336 CB TRP A 83 7.130 1.939 -4.017 1.00 0.00 C ATOM 1337 CG TRP A 83 8.454 2.617 -4.131 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.094 3.239 -3.118 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.310 2.749 -5.301 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.293 3.743 -3.591 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.471 3.467 -4.932 1.00 0.00 C ATOM 1342 CE3 TRP A 83 9.195 2.316 -6.635 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.482 3.749 -5.851 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 10.211 2.598 -7.565 1.00 0.00 C ATOM 1345 CH2 TRP A 83 11.352 3.312 -7.172 1.00 0.00 C ATOM 0 H TRP A 83 6.947 3.916 -2.484 1.00 0.00 H new ATOM 0 HA TRP A 83 6.094 3.478 -5.114 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.054 1.430 -3.056 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.033 1.177 -4.791 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.730 3.329 -2.105 1.00 0.00 H new ATOM 0 HE1 TRP A 83 10.964 4.256 -3.019 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.321 1.764 -6.946 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.358 4.301 -5.544 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 10.112 2.263 -8.587 1.00 0.00 H new ATOM 0 HH2 TRP A 83 12.130 3.524 -7.890 1.00 0.00 H new ATOM 1356 N PHE A 84 3.939 2.148 -5.141 1.00 0.00 N ATOM 1357 CA PHE A 84 2.624 1.447 -5.094 1.00 0.00 C ATOM 1358 C PHE A 84 2.731 0.136 -5.855 1.00 0.00 C ATOM 1359 O PHE A 84 2.178 -0.015 -6.918 1.00 0.00 O ATOM 1360 CB PHE A 84 1.549 2.309 -5.748 1.00 0.00 C ATOM 1361 CG PHE A 84 0.952 3.223 -4.709 1.00 0.00 C ATOM 1362 CD1 PHE A 84 1.574 4.439 -4.406 1.00 0.00 C ATOM 1363 CD2 PHE A 84 -0.221 2.850 -4.040 1.00 0.00 C ATOM 1364 CE1 PHE A 84 1.023 5.283 -3.436 1.00 0.00 C ATOM 1365 CE2 PHE A 84 -0.770 3.694 -3.069 1.00 0.00 C ATOM 1366 CZ PHE A 84 -0.150 4.911 -2.767 1.00 0.00 C ATOM 0 H PHE A 84 4.204 2.518 -6.054 1.00 0.00 H new ATOM 0 HA PHE A 84 2.356 1.260 -4.054 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.979 2.894 -6.561 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.774 1.678 -6.184 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.479 4.726 -4.921 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.701 1.911 -4.274 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.502 6.222 -3.203 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.673 3.406 -2.552 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.575 5.563 -2.019 1.00 0.00 H new ATOM 1376 N TRP A 85 3.419 -0.820 -5.311 1.00 0.00 N ATOM 1377 CA TRP A 85 3.545 -2.121 -6.010 1.00 0.00 C ATOM 1378 C TRP A 85 2.203 -2.852 -5.978 1.00 0.00 C ATOM 1379 O TRP A 85 1.954 -3.673 -5.118 1.00 0.00 O ATOM 1380 CB TRP A 85 4.606 -2.972 -5.312 1.00 0.00 C ATOM 1381 CG TRP A 85 5.950 -2.638 -5.871 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.766 -1.667 -5.401 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.646 -3.250 -6.994 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.918 -1.645 -6.164 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.891 -2.602 -7.158 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.319 -4.295 -7.877 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.784 -2.978 -8.163 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.215 -4.676 -8.890 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.445 -4.018 -9.031 1.00 0.00 C ATOM 0 H TRP A 85 3.899 -0.758 -4.413 1.00 0.00 H new ATOM 0 HA TRP A 85 3.838 -1.949 -7.046 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.589 -2.786 -4.238 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.392 -4.031 -5.456 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.552 -1.016 -4.566 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.693 -1.000 -6.011 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.374 -4.807 -7.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.730 -2.468 -8.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 6.955 -5.479 -9.563 1.00 0.00 H new ATOM 0 HH2 TRP A 85 9.130 -4.315 -9.811 1.00 0.00 H new ATOM 1400 N LEU A 86 1.330 -2.567 -6.904 1.00 0.00 N ATOM 1401 CA LEU A 86 0.027 -3.275 -6.898 1.00 0.00 C ATOM 1402 C LEU A 86 0.247 -4.722 -7.303 1.00 0.00 C ATOM 1403 O LEU A 86 0.787 -5.018 -8.350 1.00 0.00 O ATOM 1404 CB LEU A 86 -0.949 -2.625 -7.875 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.679 -1.492 -7.170 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.303 -2.020 -5.877 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -0.680 -0.375 -6.858 1.00 0.00 C ATOM 0 H LEU A 86 1.462 -1.886 -7.652 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.396 -3.220 -5.895 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.413 -2.244 -8.744 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.663 -3.363 -8.240 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.470 -1.099 -7.809 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.827 -1.211 -5.369 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.008 -2.817 -6.112 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.519 -2.409 -5.227 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.194 0.442 -6.352 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.109 -0.762 -6.213 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.242 -0.009 -7.787 1.00 0.00 H new ATOM 1419 N VAL A 87 -0.174 -5.621 -6.477 1.00 0.00 N ATOM 1420 CA VAL A 87 -0.010 -7.065 -6.789 1.00 0.00 C ATOM 1421 C VAL A 87 -1.412 -7.651 -6.987 1.00 0.00 C ATOM 1422 O VAL A 87 -2.387 -7.068 -6.555 1.00 0.00 O ATOM 1423 CB VAL A 87 0.746 -7.760 -5.631 1.00 0.00 C ATOM 1424 CG1 VAL A 87 1.445 -6.704 -4.760 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.225 -8.564 -4.754 1.00 0.00 C ATOM 0 H VAL A 87 -0.631 -5.421 -5.587 1.00 0.00 H new ATOM 0 HA VAL A 87 0.577 -7.218 -7.695 1.00 0.00 H new ATOM 0 HB VAL A 87 1.483 -8.438 -6.062 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.976 -7.197 -3.946 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.154 -6.142 -5.368 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.701 -6.022 -4.347 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.327 -9.044 -3.946 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.975 -7.894 -4.333 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.717 -9.325 -5.360 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.548 -8.771 -7.644 1.00 0.00 N ATOM 1436 CA GLU A 88 -2.931 -9.303 -7.851 1.00 0.00 C ATOM 1437 C GLU A 88 -2.981 -10.839 -7.898 1.00 0.00 C ATOM 1438 O GLU A 88 -3.769 -11.399 -8.635 1.00 0.00 O ATOM 1439 CB GLU A 88 -3.479 -8.755 -9.175 1.00 0.00 C ATOM 1440 CG GLU A 88 -3.384 -7.224 -9.192 1.00 0.00 C ATOM 1441 CD GLU A 88 -1.971 -6.799 -9.599 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -1.400 -7.456 -10.455 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -1.485 -5.822 -9.053 1.00 0.00 O ATOM 0 H GLU A 88 -0.789 -9.328 -8.037 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.533 -8.981 -7.001 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.916 -9.171 -10.010 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.516 -9.064 -9.304 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.113 -6.813 -9.890 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.625 -6.824 -8.207 1.00 0.00 H new ATOM 1450 N ARG A 89 -2.195 -11.546 -7.125 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.303 -13.038 -7.187 1.00 0.00 C ATOM 1452 C ARG A 89 -1.694 -13.699 -5.943 1.00 0.00 C ATOM 1453 O ARG A 89 -1.192 -14.799 -6.003 1.00 0.00 O ATOM 1454 CB ARG A 89 -1.645 -13.558 -8.488 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.219 -14.083 -8.242 1.00 0.00 C ATOM 1456 CD ARG A 89 -0.231 -15.613 -8.170 1.00 0.00 C ATOM 1457 NE ARG A 89 0.265 -16.178 -9.456 1.00 0.00 N ATOM 1458 CZ ARG A 89 0.626 -17.430 -9.523 1.00 0.00 C ATOM 1459 NH1 ARG A 89 0.337 -18.246 -8.545 1.00 0.00 N ATOM 1460 NH2 ARG A 89 1.275 -17.865 -10.567 1.00 0.00 N ATOM 0 H ARG A 89 -1.505 -11.172 -6.474 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.359 -13.309 -7.201 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.257 -14.355 -8.911 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -1.614 -12.755 -9.225 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.442 -13.753 -9.043 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.175 -13.670 -7.313 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.396 -15.953 -7.346 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.241 -15.970 -7.970 1.00 0.00 H new ATOM 0 HE ARG A 89 0.322 -15.586 -10.285 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -0.171 -17.904 -7.729 1.00 0.00 H new ATOM 0 HH12 ARG A 89 0.619 -19.225 -8.597 1.00 0.00 H new ATOM 0 HH21 ARG A 89 1.500 -17.227 -11.330 1.00 0.00 H new ATOM 0 HH22 ARG A 89 1.558 -18.844 -10.620 1.00 0.00 H new ATOM 1474 N TRP A 90 -1.755 -13.070 -4.807 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.181 -13.731 -3.602 1.00 0.00 C ATOM 1476 C TRP A 90 -1.828 -15.109 -3.457 1.00 0.00 C ATOM 1477 O TRP A 90 -2.814 -15.407 -4.103 1.00 0.00 O ATOM 1478 CB TRP A 90 -1.417 -12.888 -2.340 1.00 0.00 C ATOM 1479 CG TRP A 90 -2.839 -12.995 -1.894 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -3.395 -14.099 -1.351 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -3.886 -11.980 -1.918 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -4.718 -13.835 -1.052 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -5.069 -12.542 -1.383 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -3.926 -10.643 -2.353 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -6.247 -11.805 -1.280 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -5.112 -9.897 -2.250 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -6.270 -10.478 -1.716 1.00 0.00 C ATOM 0 H TRP A 90 -2.167 -12.149 -4.658 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.103 -13.834 -3.722 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -0.754 -13.224 -1.543 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -1.171 -11.845 -2.541 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -2.888 -15.037 -1.178 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -5.357 -14.513 -0.637 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.040 -10.187 -2.769 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.136 -12.257 -0.866 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -5.131 -8.870 -2.584 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.180 -9.900 -1.642 1.00 0.00 H new ATOM 1498 N GLU A 91 -1.273 -15.964 -2.649 1.00 0.00 N ATOM 1499 CA GLU A 91 -1.860 -17.335 -2.513 1.00 0.00 C ATOM 1500 C GLU A 91 -3.117 -17.295 -1.626 1.00 0.00 C ATOM 1501 O GLU A 91 -4.056 -16.580 -1.914 1.00 0.00 O ATOM 1502 CB GLU A 91 -0.820 -18.281 -1.904 1.00 0.00 C ATOM 1503 CG GLU A 91 -0.274 -17.672 -0.616 1.00 0.00 C ATOM 1504 CD GLU A 91 0.579 -18.709 0.115 1.00 0.00 C ATOM 1505 OE1 GLU A 91 0.004 -19.603 0.714 1.00 0.00 O ATOM 1506 OE2 GLU A 91 1.792 -18.594 0.063 1.00 0.00 O ATOM 0 H GLU A 91 -0.447 -15.782 -2.079 1.00 0.00 H new ATOM 0 HA GLU A 91 -2.144 -17.698 -3.501 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.272 -19.251 -1.698 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -0.008 -18.451 -2.611 1.00 0.00 H new ATOM 0 HG2 GLU A 91 0.323 -16.789 -0.843 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.096 -17.346 0.022 1.00 0.00 H new ATOM 1513 N GLY A 92 -3.162 -18.065 -0.568 1.00 0.00 N ATOM 1514 CA GLY A 92 -4.375 -18.063 0.296 1.00 0.00 C ATOM 1515 C GLY A 92 -4.550 -16.694 0.951 1.00 0.00 C ATOM 1516 O GLY A 92 -5.614 -16.110 0.910 1.00 0.00 O ATOM 0 H GLY A 92 -2.414 -18.691 -0.269 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.255 -18.305 -0.299 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.287 -18.833 1.062 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.522 -16.176 1.565 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.651 -14.848 2.228 1.00 0.00 C ATOM 1522 C GLU A 93 -2.605 -13.872 1.672 1.00 0.00 C ATOM 1523 O GLU A 93 -1.583 -14.280 1.166 1.00 0.00 O ATOM 1524 CB GLU A 93 -3.436 -15.009 3.733 1.00 0.00 C ATOM 1525 CG GLU A 93 -4.112 -16.293 4.221 1.00 0.00 C ATOM 1526 CD GLU A 93 -4.668 -16.070 5.628 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -5.038 -14.945 5.925 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -4.714 -17.025 6.386 1.00 0.00 O ATOM 0 H GLU A 93 -2.603 -16.612 1.636 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.648 -14.452 2.034 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.369 -15.042 3.955 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.845 -14.148 4.262 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.916 -16.575 3.541 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.396 -17.115 4.227 1.00 0.00 H new ATOM 1535 N PRO A 94 -2.901 -12.603 1.797 1.00 0.00 N ATOM 1536 CA PRO A 94 -2.003 -11.524 1.336 1.00 0.00 C ATOM 1537 C PRO A 94 -0.805 -11.392 2.288 1.00 0.00 C ATOM 1538 O PRO A 94 -0.499 -12.292 3.039 1.00 0.00 O ATOM 1539 CB PRO A 94 -2.863 -10.258 1.403 1.00 0.00 C ATOM 1540 CG PRO A 94 -4.165 -10.624 2.159 1.00 0.00 C ATOM 1541 CD PRO A 94 -4.166 -12.140 2.387 1.00 0.00 C ATOM 0 HA PRO A 94 -1.605 -11.710 0.338 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -2.331 -9.459 1.919 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -3.090 -9.894 0.401 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -4.215 -10.095 3.111 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -5.039 -10.324 1.581 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -4.220 -12.381 3.449 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -5.024 -12.613 1.908 1.00 0.00 H new ATOM 1549 N TRP A 95 -0.134 -10.267 2.271 1.00 0.00 N ATOM 1550 CA TRP A 95 1.033 -10.082 3.179 1.00 0.00 C ATOM 1551 C TRP A 95 1.713 -8.731 2.933 1.00 0.00 C ATOM 1552 O TRP A 95 2.916 -8.657 2.804 1.00 0.00 O ATOM 1553 CB TRP A 95 2.049 -11.201 2.948 1.00 0.00 C ATOM 1554 CG TRP A 95 2.545 -11.197 1.534 1.00 0.00 C ATOM 1555 CD1 TRP A 95 1.991 -10.525 0.494 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.692 -11.909 0.996 1.00 0.00 C ATOM 1557 NE1 TRP A 95 2.733 -10.787 -0.647 1.00 0.00 N ATOM 1558 CE2 TRP A 95 3.790 -11.638 -0.387 1.00 0.00 C ATOM 1559 CE3 TRP A 95 4.646 -12.762 1.575 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 4.804 -12.197 -1.169 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 5.665 -13.324 0.793 1.00 0.00 C ATOM 1562 CH2 TRP A 95 5.744 -13.044 -0.576 1.00 0.00 C ATOM 0 H TRP A 95 -0.345 -9.472 1.668 1.00 0.00 H new ATOM 0 HA TRP A 95 0.670 -10.111 4.206 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.889 -11.080 3.632 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.591 -12.164 3.173 1.00 0.00 H new ATOM 0 HD1 TRP A 95 1.118 -9.892 0.546 1.00 0.00 H new ATOM 0 HE1 TRP A 95 2.524 -10.399 -1.567 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.594 -12.987 2.630 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.861 -11.976 -2.225 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 6.394 -13.977 1.250 1.00 0.00 H new ATOM 0 HH2 TRP A 95 6.530 -13.482 -1.173 1.00 0.00 H new ATOM 1573 N GLY A 96 0.970 -7.662 2.882 1.00 0.00 N ATOM 1574 CA GLY A 96 1.611 -6.334 2.651 1.00 0.00 C ATOM 1575 C GLY A 96 1.075 -5.307 3.654 1.00 0.00 C ATOM 1576 O GLY A 96 1.420 -4.144 3.604 1.00 0.00 O ATOM 0 H GLY A 96 -0.044 -7.647 2.989 1.00 0.00 H new ATOM 0 HA2 GLY A 96 2.693 -6.422 2.752 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.412 -5.998 1.633 1.00 0.00 H new ATOM 1580 N LYS A 97 0.231 -5.726 4.553 1.00 0.00 N ATOM 1581 CA LYS A 97 -0.338 -4.759 5.549 1.00 0.00 C ATOM 1582 C LYS A 97 0.650 -4.492 6.691 1.00 0.00 C ATOM 1583 O LYS A 97 0.689 -5.202 7.677 1.00 0.00 O ATOM 1584 CB LYS A 97 -1.654 -5.286 6.140 1.00 0.00 C ATOM 1585 CG LYS A 97 -1.747 -6.809 6.014 1.00 0.00 C ATOM 1586 CD LYS A 97 -0.536 -7.467 6.679 1.00 0.00 C ATOM 1587 CE LYS A 97 -0.833 -7.695 8.162 1.00 0.00 C ATOM 1588 NZ LYS A 97 -0.215 -8.979 8.599 1.00 0.00 N ATOM 0 H LYS A 97 -0.092 -6.689 4.647 1.00 0.00 H new ATOM 0 HA LYS A 97 -0.529 -3.828 5.016 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.724 -5.000 7.190 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.497 -4.824 5.627 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -2.666 -7.165 6.480 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -1.793 -7.093 4.963 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.310 -8.416 6.192 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.344 -6.834 6.566 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.439 -6.869 8.754 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -1.910 -7.722 8.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -0.160 -9.002 9.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -0.795 -9.775 8.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 0.742 -9.057 8.200 1.00 0.00 H new ATOM 1602 N GLU A 98 1.421 -3.445 6.580 1.00 0.00 N ATOM 1603 CA GLU A 98 2.380 -3.098 7.669 1.00 0.00 C ATOM 1604 C GLU A 98 1.683 -3.292 9.018 1.00 0.00 C ATOM 1605 O GLU A 98 1.721 -4.356 9.604 1.00 0.00 O ATOM 1606 CB GLU A 98 2.782 -1.636 7.521 1.00 0.00 C ATOM 1607 CG GLU A 98 4.150 -1.547 6.850 1.00 0.00 C ATOM 1608 CD GLU A 98 5.224 -2.029 7.824 1.00 0.00 C ATOM 1609 OE1 GLU A 98 4.881 -2.317 8.958 1.00 0.00 O ATOM 1610 OE2 GLU A 98 6.371 -2.104 7.420 1.00 0.00 O ATOM 0 H GLU A 98 1.429 -2.813 5.780 1.00 0.00 H new ATOM 0 HA GLU A 98 3.263 -3.734 7.612 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.039 -1.102 6.928 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.814 -1.156 8.499 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.164 -2.155 5.945 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.353 -0.520 6.547 1.00 0.00 H new ATOM 1617 N GLY A 99 1.022 -2.272 9.496 1.00 0.00 N ATOM 1618 CA GLY A 99 0.285 -2.380 10.779 1.00 0.00 C ATOM 1619 C GLY A 99 -1.218 -2.299 10.484 1.00 0.00 C ATOM 1620 O GLY A 99 -2.046 -2.335 11.374 1.00 0.00 O ATOM 0 H GLY A 99 0.963 -1.360 9.044 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.524 -3.321 11.275 1.00 0.00 H new ATOM 0 HA3 GLY A 99 0.582 -1.579 11.455 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.563 -2.192 9.229 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.992 -2.108 8.817 1.00 0.00 C ATOM 1626 C GLN A 100 -3.644 -3.490 8.957 1.00 0.00 C ATOM 1627 O GLN A 100 -2.998 -4.493 8.730 1.00 0.00 O ATOM 1628 CB GLN A 100 -3.022 -1.695 7.340 1.00 0.00 C ATOM 1629 CG GLN A 100 -3.879 -0.447 7.146 1.00 0.00 C ATOM 1630 CD GLN A 100 -3.036 0.804 7.378 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -1.938 0.728 7.894 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -3.510 1.965 7.017 1.00 0.00 N ATOM 0 H GLN A 100 -0.898 -2.159 8.456 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.529 -1.391 9.438 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -2.008 -1.504 6.990 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -3.418 -2.512 6.737 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -4.295 -0.434 6.139 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -4.721 -0.462 7.838 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -4.431 2.027 6.584 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -2.959 2.810 7.168 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.911 -3.510 9.292 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.648 -4.775 9.414 1.00 0.00 C ATOM 1643 C PRO A 101 -5.529 -5.516 8.088 1.00 0.00 C ATOM 1644 O PRO A 101 -5.543 -6.730 8.027 1.00 0.00 O ATOM 1645 CB PRO A 101 -7.103 -4.360 9.679 1.00 0.00 C ATOM 1646 CG PRO A 101 -7.120 -2.821 9.864 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.702 -2.301 9.569 1.00 0.00 C ATOM 0 HA PRO A 101 -5.276 -5.428 10.204 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.743 -4.654 8.847 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.488 -4.858 10.569 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.844 -2.362 9.190 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -7.420 -2.561 10.879 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.699 -1.622 8.717 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -5.298 -1.749 10.418 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.399 -4.771 7.025 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.265 -5.384 5.680 1.00 0.00 C ATOM 1657 C GLY A 102 -6.436 -6.327 5.428 1.00 0.00 C ATOM 1658 O GLY A 102 -6.547 -7.372 6.035 1.00 0.00 O ATOM 0 H GLY A 102 -5.380 -3.751 7.035 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.240 -4.607 4.916 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.324 -5.930 5.610 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.310 -5.975 4.534 1.00 0.00 N ATOM 1663 CA GLU A 103 -8.462 -6.874 4.244 1.00 0.00 C ATOM 1664 C GLU A 103 -8.912 -6.663 2.802 1.00 0.00 C ATOM 1665 O GLU A 103 -9.148 -5.549 2.376 1.00 0.00 O ATOM 1666 CB GLU A 103 -9.621 -6.593 5.207 1.00 0.00 C ATOM 1667 CG GLU A 103 -9.801 -5.089 5.392 1.00 0.00 C ATOM 1668 CD GLU A 103 -10.392 -4.819 6.777 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -9.875 -5.365 7.738 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -11.355 -4.074 6.854 1.00 0.00 O ATOM 0 H GLU A 103 -7.281 -5.111 3.993 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.151 -7.910 4.381 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.540 -7.031 4.819 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.425 -7.064 6.170 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -8.843 -4.580 5.287 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.459 -4.692 4.619 1.00 0.00 H new ATOM 1677 N TRP A 104 -9.021 -7.726 2.046 1.00 0.00 N ATOM 1678 CA TRP A 104 -9.446 -7.586 0.622 1.00 0.00 C ATOM 1679 C TRP A 104 -10.577 -6.565 0.543 1.00 0.00 C ATOM 1680 O TRP A 104 -11.435 -6.503 1.402 1.00 0.00 O ATOM 1681 CB TRP A 104 -9.932 -8.933 0.063 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.177 -10.062 0.696 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -7.834 -10.104 0.873 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.700 -11.307 1.237 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.501 -11.302 1.487 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.620 -12.077 1.732 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.998 -11.837 1.343 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -8.824 -13.332 2.312 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -11.206 -13.097 1.926 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -10.121 -13.843 2.410 1.00 0.00 C ATOM 0 H TRP A 104 -8.835 -8.681 2.353 1.00 0.00 H new ATOM 0 HA TRP A 104 -8.594 -7.254 0.028 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -10.999 -9.049 0.252 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -9.795 -8.956 -1.018 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.137 -9.331 0.583 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.549 -11.577 1.728 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.840 -11.271 0.974 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.985 -13.903 2.682 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -12.207 -13.494 2.002 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -10.288 -14.811 2.858 1.00 0.00 H new ATOM 1701 N MET A 105 -10.578 -5.756 -0.473 1.00 0.00 N ATOM 1702 CA MET A 105 -11.643 -4.730 -0.605 1.00 0.00 C ATOM 1703 C MET A 105 -12.075 -4.650 -2.063 1.00 0.00 C ATOM 1704 O MET A 105 -11.453 -3.982 -2.861 1.00 0.00 O ATOM 1705 CB MET A 105 -11.092 -3.375 -0.159 1.00 0.00 C ATOM 1706 CG MET A 105 -12.230 -2.512 0.380 1.00 0.00 C ATOM 1707 SD MET A 105 -13.508 -2.328 -0.887 1.00 0.00 S ATOM 1708 CE MET A 105 -14.809 -3.241 -0.022 1.00 0.00 C ATOM 0 H MET A 105 -9.885 -5.761 -1.221 1.00 0.00 H new ATOM 0 HA MET A 105 -12.498 -4.997 0.016 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.333 -3.515 0.610 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.608 -2.874 -0.997 1.00 0.00 H new ATOM 0 HG2 MET A 105 -12.654 -2.969 1.274 1.00 0.00 H new ATOM 0 HG3 MET A 105 -11.850 -1.533 0.672 1.00 0.00 H new ATOM 0 HE1 MET A 105 -15.414 -3.786 -0.746 1.00 0.00 H new ATOM 0 HE2 MET A 105 -14.357 -3.946 0.676 1.00 0.00 H new ATOM 0 HE3 MET A 105 -15.441 -2.542 0.526 1.00 0.00 H new ATOM 1718 N SER A 106 -13.125 -5.335 -2.421 1.00 0.00 N ATOM 1719 CA SER A 106 -13.588 -5.303 -3.836 1.00 0.00 C ATOM 1720 C SER A 106 -14.354 -4.006 -4.090 1.00 0.00 C ATOM 1721 O SER A 106 -15.562 -4.009 -4.228 1.00 0.00 O ATOM 1722 CB SER A 106 -14.515 -6.492 -4.091 1.00 0.00 C ATOM 1723 OG SER A 106 -14.735 -6.627 -5.489 1.00 0.00 O ATOM 0 H SER A 106 -13.683 -5.916 -1.795 1.00 0.00 H new ATOM 0 HA SER A 106 -12.727 -5.357 -4.503 1.00 0.00 H new ATOM 0 HB2 SER A 106 -14.073 -7.405 -3.691 1.00 0.00 H new ATOM 0 HB3 SER A 106 -15.464 -6.345 -3.575 1.00 0.00 H new ATOM 0 HG SER A 106 -15.328 -7.390 -5.655 1.00 0.00 H new ATOM 1729 N LEU A 107 -13.674 -2.892 -4.152 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.401 -1.613 -4.394 1.00 0.00 C ATOM 1731 C LEU A 107 -14.712 -1.465 -5.883 1.00 0.00 C ATOM 1732 O LEU A 107 -15.472 -0.609 -6.291 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.609 -0.407 -3.833 1.00 0.00 C ATOM 1734 CG LEU A 107 -12.307 -0.059 -4.592 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -11.130 -0.227 -3.634 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -12.066 -0.944 -5.810 1.00 0.00 C ATOM 0 H LEU A 107 -12.663 -2.812 -4.047 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.350 -1.635 -3.858 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -14.259 0.468 -3.840 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -13.359 -0.610 -2.792 1.00 0.00 H new ATOM 0 HG LEU A 107 -12.405 0.966 -4.950 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -10.202 0.014 -4.152 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -11.255 0.442 -2.783 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -11.092 -1.258 -3.282 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -11.137 -0.648 -6.297 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.994 -1.985 -5.495 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -12.894 -0.833 -6.510 1.00 0.00 H new ATOM 1748 N VAL A 108 -14.130 -2.308 -6.690 1.00 0.00 N ATOM 1749 CA VAL A 108 -14.381 -2.257 -8.150 1.00 0.00 C ATOM 1750 C VAL A 108 -13.847 -0.943 -8.710 1.00 0.00 C ATOM 1751 O VAL A 108 -14.248 0.121 -8.282 1.00 0.00 O ATOM 1752 CB VAL A 108 -15.887 -2.371 -8.394 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -16.254 -1.681 -9.705 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -16.267 -3.849 -8.465 1.00 0.00 C ATOM 0 H VAL A 108 -13.483 -3.038 -6.392 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.872 -3.081 -8.651 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.428 -1.889 -7.579 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -17.328 -1.766 -9.873 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.977 -0.628 -9.652 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -15.720 -2.156 -10.528 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -17.339 -3.941 -8.639 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -15.725 -4.325 -9.282 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -16.009 -4.337 -7.525 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.950 -1.017 -9.670 1.00 0.00 N ATOM 1765 CA GLY A 109 -12.372 0.224 -10.273 1.00 0.00 C ATOM 1766 C GLY A 109 -12.284 1.297 -9.197 1.00 0.00 C ATOM 1767 O GLY A 109 -13.170 2.117 -9.054 1.00 0.00 O ATOM 0 H GLY A 109 -12.594 -1.889 -10.061 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.383 0.019 -10.683 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.995 0.568 -11.099 1.00 0.00 H new ATOM 1771 N LEU A 110 -11.247 1.265 -8.412 1.00 0.00 N ATOM 1772 CA LEU A 110 -11.114 2.251 -7.314 1.00 0.00 C ATOM 1773 C LEU A 110 -11.553 3.639 -7.803 1.00 0.00 C ATOM 1774 O LEU A 110 -11.695 3.873 -8.988 1.00 0.00 O ATOM 1775 CB LEU A 110 -9.664 2.311 -6.860 1.00 0.00 C ATOM 1776 CG LEU A 110 -9.581 1.890 -5.402 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -8.404 0.931 -5.204 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -9.380 3.132 -4.545 1.00 0.00 C ATOM 0 H LEU A 110 -10.483 0.594 -8.486 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.747 1.947 -6.481 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -9.050 1.655 -7.476 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.273 3.321 -6.982 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.501 1.383 -5.112 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.350 0.633 -4.157 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -8.546 0.047 -5.826 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.477 1.429 -5.488 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -9.319 2.844 -3.496 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -8.457 3.631 -4.839 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -10.221 3.811 -4.686 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.786 4.562 -6.905 1.00 0.00 N ATOM 1791 CA ASN A 111 -12.243 5.915 -7.345 1.00 0.00 C ATOM 1792 C ASN A 111 -11.665 7.027 -6.464 1.00 0.00 C ATOM 1793 O ASN A 111 -11.905 8.191 -6.710 1.00 0.00 O ATOM 1794 CB ASN A 111 -13.765 5.959 -7.236 1.00 0.00 C ATOM 1795 CG ASN A 111 -14.330 6.913 -8.290 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -14.615 8.059 -8.001 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -14.504 6.486 -9.511 1.00 0.00 N ATOM 0 H ASN A 111 -11.681 4.440 -5.898 1.00 0.00 H new ATOM 0 HA ASN A 111 -11.902 6.079 -8.367 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -14.178 4.960 -7.377 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -14.058 6.288 -6.239 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -14.879 7.114 -10.222 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -14.265 5.525 -9.754 1.00 0.00 H new ATOM 1804 N ALA A 112 -10.957 6.693 -5.417 1.00 0.00 N ATOM 1805 CA ALA A 112 -10.422 7.747 -4.498 1.00 0.00 C ATOM 1806 C ALA A 112 -11.541 8.171 -3.537 1.00 0.00 C ATOM 1807 O ALA A 112 -11.295 8.605 -2.429 1.00 0.00 O ATOM 1808 CB ALA A 112 -9.934 8.964 -5.292 1.00 0.00 C ATOM 0 H ALA A 112 -10.725 5.735 -5.156 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.576 7.344 -3.941 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -9.550 9.717 -4.604 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.142 8.659 -5.975 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -10.763 9.383 -5.862 1.00 0.00 H new ATOM 1814 N ASP A 113 -12.775 8.023 -3.952 1.00 0.00 N ATOM 1815 CA ASP A 113 -13.924 8.380 -3.087 1.00 0.00 C ATOM 1816 C ASP A 113 -13.819 7.585 -1.795 1.00 0.00 C ATOM 1817 O ASP A 113 -14.074 8.077 -0.713 1.00 0.00 O ATOM 1818 CB ASP A 113 -15.206 7.985 -3.818 1.00 0.00 C ATOM 1819 CG ASP A 113 -16.184 9.161 -3.822 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -16.101 9.971 -4.731 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -16.999 9.232 -2.918 1.00 0.00 O ATOM 0 H ASP A 113 -13.031 7.663 -4.871 1.00 0.00 H new ATOM 0 HA ASP A 113 -13.930 9.447 -2.865 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -14.975 7.689 -4.841 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.662 7.123 -3.331 1.00 0.00 H new ATOM 1826 N ASP A 114 -13.441 6.349 -1.913 1.00 0.00 N ATOM 1827 CA ASP A 114 -13.302 5.482 -0.720 1.00 0.00 C ATOM 1828 C ASP A 114 -11.902 5.662 -0.133 1.00 0.00 C ATOM 1829 O ASP A 114 -11.623 5.245 0.973 1.00 0.00 O ATOM 1830 CB ASP A 114 -13.509 4.032 -1.158 1.00 0.00 C ATOM 1831 CG ASP A 114 -15.009 3.738 -1.262 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.775 4.432 -0.615 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -15.364 2.823 -1.986 1.00 0.00 O ATOM 0 H ASP A 114 -13.219 5.896 -2.800 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.038 5.745 0.039 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -13.026 3.859 -2.120 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -13.044 3.355 -0.442 1.00 0.00 H new ATOM 1838 N PHE A 115 -11.018 6.283 -0.868 1.00 0.00 N ATOM 1839 CA PHE A 115 -9.635 6.489 -0.358 1.00 0.00 C ATOM 1840 C PHE A 115 -9.464 7.926 0.153 1.00 0.00 C ATOM 1841 O PHE A 115 -10.044 8.848 -0.383 1.00 0.00 O ATOM 1842 CB PHE A 115 -8.638 6.231 -1.484 1.00 0.00 C ATOM 1843 CG PHE A 115 -8.143 4.812 -1.394 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -8.948 3.763 -1.842 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -6.880 4.547 -0.862 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -8.488 2.442 -1.761 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -6.421 3.231 -0.776 1.00 0.00 C ATOM 1848 CZ PHE A 115 -7.224 2.177 -1.224 1.00 0.00 C ATOM 0 H PHE A 115 -11.196 6.656 -1.800 1.00 0.00 H new ATOM 0 HA PHE A 115 -9.454 5.797 0.465 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -9.111 6.403 -2.451 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -7.801 6.926 -1.411 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -9.926 3.970 -2.251 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -6.258 5.360 -0.517 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -9.108 1.630 -2.112 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -5.444 3.027 -0.363 1.00 0.00 H new ATOM 0 HZ PHE A 115 -6.868 1.160 -1.155 1.00 0.00 H new ATOM 1858 N PRO A 116 -8.658 8.065 1.179 1.00 0.00 N ATOM 1859 CA PRO A 116 -8.377 9.376 1.792 1.00 0.00 C ATOM 1860 C PRO A 116 -7.729 10.316 0.766 1.00 0.00 C ATOM 1861 O PRO A 116 -6.918 9.891 -0.031 1.00 0.00 O ATOM 1862 CB PRO A 116 -7.390 9.070 2.928 1.00 0.00 C ATOM 1863 CG PRO A 116 -7.169 7.538 2.967 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.967 6.925 1.809 1.00 0.00 C ATOM 0 HA PRO A 116 -9.282 9.869 2.148 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -6.445 9.588 2.762 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.784 9.423 3.881 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -6.109 7.301 2.870 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.501 7.127 3.921 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -7.310 6.420 1.100 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -8.678 6.182 2.169 1.00 0.00 H new ATOM 1872 N PRO A 117 -8.106 11.571 0.820 1.00 0.00 N ATOM 1873 CA PRO A 117 -7.566 12.592 -0.098 1.00 0.00 C ATOM 1874 C PRO A 117 -6.063 12.784 0.132 1.00 0.00 C ATOM 1875 O PRO A 117 -5.397 13.478 -0.611 1.00 0.00 O ATOM 1876 CB PRO A 117 -8.325 13.878 0.257 1.00 0.00 C ATOM 1877 CG PRO A 117 -9.263 13.560 1.449 1.00 0.00 C ATOM 1878 CD PRO A 117 -9.097 12.070 1.790 1.00 0.00 C ATOM 0 HA PRO A 117 -7.691 12.310 -1.143 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -7.627 14.673 0.521 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -8.901 14.231 -0.599 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -9.011 14.180 2.310 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -10.299 13.780 1.190 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.751 11.935 2.815 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -10.043 11.536 1.700 1.00 0.00 H new ATOM 1886 N ALA A 118 -5.524 12.185 1.157 1.00 0.00 N ATOM 1887 CA ALA A 118 -4.067 12.348 1.434 1.00 0.00 C ATOM 1888 C ALA A 118 -3.243 11.766 0.284 1.00 0.00 C ATOM 1889 O ALA A 118 -2.386 12.423 -0.272 1.00 0.00 O ATOM 1890 CB ALA A 118 -3.711 11.610 2.725 1.00 0.00 C ATOM 0 H ALA A 118 -6.028 11.590 1.815 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.843 13.410 1.536 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -2.647 11.728 2.930 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -4.288 12.025 3.552 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.944 10.551 2.615 1.00 0.00 H new ATOM 1896 N ASN A 119 -3.488 10.536 -0.068 1.00 0.00 N ATOM 1897 CA ASN A 119 -2.709 9.907 -1.173 1.00 0.00 C ATOM 1898 C ASN A 119 -3.385 10.201 -2.516 1.00 0.00 C ATOM 1899 O ASN A 119 -3.499 9.342 -3.355 1.00 0.00 O ATOM 1900 CB ASN A 119 -2.657 8.393 -0.955 1.00 0.00 C ATOM 1901 CG ASN A 119 -1.344 8.010 -0.271 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.295 8.047 -0.883 1.00 0.00 O ATOM 1903 ND2 ASN A 119 -1.356 7.638 0.981 1.00 0.00 N ATOM 0 H ASN A 119 -4.194 9.938 0.361 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.698 10.315 -1.180 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -3.502 8.076 -0.343 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.743 7.876 -1.911 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -0.485 7.379 1.444 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -2.236 7.607 1.495 1.00 0.00 H new ATOM 1910 N GLU A 120 -3.831 11.407 -2.726 1.00 0.00 N ATOM 1911 CA GLU A 120 -4.496 11.749 -4.019 1.00 0.00 C ATOM 1912 C GLU A 120 -3.579 11.477 -5.219 1.00 0.00 C ATOM 1913 O GLU A 120 -4.030 10.963 -6.214 1.00 0.00 O ATOM 1914 CB GLU A 120 -4.857 13.225 -4.032 1.00 0.00 C ATOM 1915 CG GLU A 120 -6.333 13.380 -4.418 1.00 0.00 C ATOM 1916 CD GLU A 120 -7.201 13.422 -3.162 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -6.871 14.176 -2.262 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -8.184 12.702 -3.124 1.00 0.00 O ATOM 0 H GLU A 120 -3.765 12.175 -2.058 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.386 11.125 -4.102 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -4.677 13.664 -3.051 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.225 13.760 -4.741 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.472 14.293 -4.996 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.640 12.550 -5.054 1.00 0.00 H new ATOM 1925 N PRO A 121 -2.332 11.865 -5.118 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.370 11.688 -6.223 1.00 0.00 C ATOM 1927 C PRO A 121 -1.407 10.277 -6.833 1.00 0.00 C ATOM 1928 O PRO A 121 -1.399 10.130 -8.039 1.00 0.00 O ATOM 1929 CB PRO A 121 -0.014 12.002 -5.587 1.00 0.00 C ATOM 1930 CG PRO A 121 -0.284 12.724 -4.246 1.00 0.00 C ATOM 1931 CD PRO A 121 -1.766 12.512 -3.912 1.00 0.00 C ATOM 0 HA PRO A 121 -1.601 12.339 -7.066 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.553 11.086 -5.422 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.583 12.631 -6.248 1.00 0.00 H new ATOM 0 HG2 PRO A 121 0.351 12.321 -3.457 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -0.055 13.787 -4.327 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.888 11.883 -3.030 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -2.264 13.458 -3.699 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.443 9.241 -6.045 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.474 7.871 -6.642 1.00 0.00 C ATOM 1941 C VAL A 122 -2.927 7.383 -6.711 1.00 0.00 C ATOM 1942 O VAL A 122 -3.322 6.717 -7.646 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.617 6.932 -5.785 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -1.207 5.517 -5.771 1.00 0.00 C ATOM 1945 CG2 VAL A 122 0.807 6.878 -6.353 1.00 0.00 C ATOM 0 H VAL A 122 -1.452 9.277 -5.026 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.067 7.886 -7.653 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.600 7.315 -4.765 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.582 4.868 -5.157 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.215 5.547 -5.358 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.244 5.128 -6.789 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.417 6.211 -5.744 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.776 6.508 -7.378 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.241 7.878 -6.342 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.725 7.724 -5.739 1.00 0.00 N ATOM 1956 CA ILE A 123 -5.153 7.304 -5.768 1.00 0.00 C ATOM 1957 C ILE A 123 -5.793 7.950 -6.997 1.00 0.00 C ATOM 1958 O ILE A 123 -6.831 7.530 -7.464 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.866 7.784 -4.489 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -5.699 6.739 -3.381 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -7.362 7.988 -4.754 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -5.476 7.446 -2.044 1.00 0.00 C ATOM 0 H ILE A 123 -3.450 8.275 -4.926 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.236 6.218 -5.817 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.421 8.730 -4.181 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -6.585 6.106 -3.327 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.855 6.087 -3.605 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.850 8.327 -3.840 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.494 8.736 -5.535 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.806 7.046 -5.075 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -5.357 6.703 -1.255 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.577 8.060 -2.103 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.334 8.079 -1.820 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.157 8.961 -7.529 1.00 0.00 N ATOM 1975 CA ALA A 124 -5.692 9.644 -8.736 1.00 0.00 C ATOM 1976 C ALA A 124 -5.702 8.633 -9.870 1.00 0.00 C ATOM 1977 O ALA A 124 -6.574 8.612 -10.715 1.00 0.00 O ATOM 1978 CB ALA A 124 -4.776 10.812 -9.102 1.00 0.00 C ATOM 0 H ALA A 124 -4.281 9.344 -7.172 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.697 10.025 -8.553 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.165 11.316 -9.987 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.736 11.517 -8.272 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.774 10.437 -9.309 1.00 0.00 H new ATOM 1984 N LYS A 125 -4.713 7.798 -9.872 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.585 6.757 -10.922 1.00 0.00 C ATOM 1986 C LYS A 125 -5.603 5.632 -10.696 1.00 0.00 C ATOM 1987 O LYS A 125 -6.219 5.157 -11.629 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.167 6.202 -10.861 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.194 7.330 -11.191 1.00 0.00 C ATOM 1990 CD LYS A 125 -2.398 7.779 -12.638 1.00 0.00 C ATOM 1991 CE LYS A 125 -1.038 7.905 -13.326 1.00 0.00 C ATOM 1992 NZ LYS A 125 -0.547 9.307 -13.204 1.00 0.00 N ATOM 0 H LYS A 125 -3.969 7.791 -9.175 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.783 7.191 -11.902 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.959 5.800 -9.869 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -3.050 5.381 -11.569 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.352 8.169 -10.514 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.168 6.992 -11.046 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -3.022 7.060 -13.169 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -2.921 8.735 -12.664 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -0.324 7.218 -12.872 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -1.123 7.628 -14.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 0.378 9.393 -13.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -1.225 9.953 -13.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.451 9.555 -12.199 1.00 0.00 H new ATOM 2006 N LEU A 126 -5.796 5.199 -9.476 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.792 4.108 -9.242 1.00 0.00 C ATOM 2008 C LEU A 126 -8.175 4.644 -9.586 1.00 0.00 C ATOM 2009 O LEU A 126 -9.097 3.906 -9.871 1.00 0.00 O ATOM 2010 CB LEU A 126 -6.767 3.647 -7.780 1.00 0.00 C ATOM 2011 CG LEU A 126 -5.375 3.116 -7.367 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.370 3.183 -8.526 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -4.851 3.962 -6.207 1.00 0.00 C ATOM 0 H LEU A 126 -5.317 5.546 -8.645 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.544 3.251 -9.869 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.045 4.478 -7.132 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.512 2.865 -7.633 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.483 2.071 -7.075 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.405 2.801 -8.193 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.733 2.579 -9.358 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.258 4.217 -8.851 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.869 3.598 -5.906 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.771 5.002 -6.522 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.539 3.890 -5.364 1.00 0.00 H new ATOM 2025 N LYS A 127 -8.316 5.932 -9.592 1.00 0.00 N ATOM 2026 CA LYS A 127 -9.621 6.527 -9.962 1.00 0.00 C ATOM 2027 C LYS A 127 -9.952 6.035 -11.353 1.00 0.00 C ATOM 2028 O LYS A 127 -11.084 5.754 -11.694 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.474 8.036 -9.997 1.00 0.00 C ATOM 2030 CG LYS A 127 -8.845 8.496 -8.690 1.00 0.00 C ATOM 2031 CD LYS A 127 -9.565 9.747 -8.179 1.00 0.00 C ATOM 2032 CE LYS A 127 -9.479 10.856 -9.228 1.00 0.00 C ATOM 2033 NZ LYS A 127 -9.622 12.181 -8.560 1.00 0.00 N ATOM 0 H LYS A 127 -7.583 6.601 -9.356 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.400 6.252 -9.251 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.853 8.336 -10.841 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.447 8.507 -10.134 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -8.906 7.701 -7.947 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -7.787 8.710 -8.841 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.608 9.516 -7.965 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -9.114 10.081 -7.245 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.525 10.802 -9.753 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.262 10.727 -9.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -9.564 12.937 -9.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -10.542 12.229 -8.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -8.860 12.302 -7.863 1.00 0.00 H new ATOM 2047 N ARG A 128 -8.938 5.923 -12.151 1.00 0.00 N ATOM 2048 CA ARG A 128 -9.110 5.441 -13.536 1.00 0.00 C ATOM 2049 C ARG A 128 -9.213 3.914 -13.499 1.00 0.00 C ATOM 2050 O ARG A 128 -9.768 3.292 -14.382 1.00 0.00 O ATOM 2051 CB ARG A 128 -7.892 5.860 -14.374 1.00 0.00 C ATOM 2052 CG ARG A 128 -7.202 7.084 -13.752 1.00 0.00 C ATOM 2053 CD ARG A 128 -6.613 7.954 -14.862 1.00 0.00 C ATOM 2054 NE ARG A 128 -7.233 9.310 -14.806 1.00 0.00 N ATOM 2055 CZ ARG A 128 -6.714 10.303 -15.480 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -5.478 10.241 -15.901 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -7.433 11.361 -15.734 1.00 0.00 N ATOM 0 H ARG A 128 -7.977 6.150 -11.895 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.009 5.867 -13.981 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -7.186 5.032 -14.439 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -8.206 6.091 -15.392 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -7.918 7.659 -13.165 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -6.415 6.764 -13.070 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -5.532 8.031 -14.745 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -6.797 7.497 -15.834 1.00 0.00 H new ATOM 0 HE ARG A 128 -8.067 9.463 -14.239 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -4.913 9.415 -15.704 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -5.079 11.019 -16.426 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -8.398 11.412 -15.407 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -7.031 12.137 -16.260 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.680 3.309 -12.467 1.00 0.00 N ATOM 2072 CA LEU A 129 -8.741 1.825 -12.348 1.00 0.00 C ATOM 2073 C LEU A 129 -10.150 1.342 -12.692 1.00 0.00 C ATOM 2074 O LEU A 129 -11.095 1.928 -12.190 1.00 0.00 O ATOM 2075 CB LEU A 129 -8.391 1.402 -10.919 1.00 0.00 C ATOM 2076 CG LEU A 129 -7.320 0.319 -10.964 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -5.965 0.963 -11.262 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -7.258 -0.396 -9.614 1.00 0.00 C ATOM 2079 OXT LEU A 129 -10.262 0.396 -13.453 1.00 0.00 O ATOM 0 H LEU A 129 -8.204 3.784 -11.700 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.024 1.381 -13.039 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.033 2.260 -10.350 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -9.280 1.030 -10.409 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.563 -0.403 -11.744 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.195 0.192 -11.295 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -6.009 1.474 -12.224 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -5.724 1.683 -10.480 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.492 -1.170 -9.647 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -7.013 0.323 -8.832 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.225 -0.851 -9.399 1.00 0.00 H new