USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1041 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 121 ASN : amide:sc= 0 X(o=-4.1,f=-4.1) USER MOD Set 1.2: A 142 ASN : amide:sc= -3.53! C(o=-4.1!,f=-13!) USER MOD Set 1.3: A 147 THR OG1 : rot -160:sc= -0.564 USER MOD Set 2.1: A 80 CYS SG : rot 148:sc= -1.61 USER MOD Set 2.2: A 103 ASN : amide:sc= -2 K(o=-3.6,f=-9.6!) USER MOD Set 3.1: A 32 TYR OH : rot 166:sc= 1.33 USER MOD Set 3.2: A 96 HIS : no HD1:sc= -1.74 K(o=-0.4,f=-10!) USER MOD Set 4.1: A 55 CYS SG : rot 180:sc= -0.095 USER MOD Set 4.2: A 56 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 38 TYR OH : rot 29:sc= -0.138 USER MOD Set 5.2: A 47 ASN : amide:sc= -1.58! C(o=-1.7!,f=-3.1!) USER MOD Set 6.1: A 35 THR OG1 : rot 144:sc= 0.288 USER MOD Set 6.2: A 66 TYR OH : rot 30:sc= -1.4 USER MOD Set 7.1: A 9 SER OG : rot -87:sc= 1.28 USER MOD Set 7.2: A 158 SER OG : rot 123:sc= 0.631 USER MOD Single : A 14 LYS NZ :NH3+ -154:sc= -1.51! (180deg=-4.11!) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -87:sc= 0.388 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 HIS : no HD1:sc= -4.78! C(o=-4.8!,f=-4.3!) USER MOD Single : A 45 CYS SG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= 0.0516 K(o=0.052,f=-3.7!) USER MOD Single : A 50 THR OG1 : rot 121:sc= 0.44 USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 57 ASN : amide:sc= -0.446 X(o=-0.45,f=-0.48) USER MOD Single : A 61 ASN : amide:sc= -0.133 K(o=-0.13,f=-2.2) USER MOD Single : A 65 ASN : amide:sc= -0.355 X(o=-0.35,f=-0.32) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot -160:sc= -0.585 USER MOD Single : A 84 CYS SG : rot -0:sc= -0.33 USER MOD Single : A 85 SER OG : rot 180:sc= -0.974 USER MOD Single : A 87 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0749) USER MOD Single : A 97 CYS SG : rot 180:sc= -0.0555 USER MOD Single : A 105 ASN : amide:sc= -0.176 K(o=-0.18,f=-1.8!) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -48:sc= 1.06 USER MOD Single : A 112 THR OG1 : rot 43:sc= 0.767 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl -103:sc= -0.619 (180deg=-3.11!) USER MOD Single : A 134 ASN : amide:sc= 0.00579 K(o=0.0058,f=-1.8) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -3.39 K(o=-3.4,f=-22!) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 CYS SG : rot 30:sc= -2.09! USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 9 -0.311 11.668 -8.001 1.00 0.00 N ATOM 81 CA SER A 9 -1.658 11.715 -7.443 1.00 0.00 C ATOM 82 C SER A 9 -2.187 10.308 -7.183 1.00 0.00 C ATOM 83 O SER A 9 -2.915 10.075 -6.218 1.00 0.00 O ATOM 84 CB SER A 9 -2.600 12.459 -8.391 1.00 0.00 C ATOM 85 OG SER A 9 -3.064 11.606 -9.423 1.00 0.00 O ATOM 0 HA SER A 9 -1.613 12.249 -6.494 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.448 12.852 -7.831 1.00 0.00 H new ATOM 0 HB3 SER A 9 -2.082 13.313 -8.827 1.00 0.00 H new ATOM 0 HG SER A 9 -2.429 11.620 -10.169 1.00 0.00 H new ATOM 91 N ALA A 10 -1.815 9.373 -8.051 1.00 0.00 N ATOM 92 CA ALA A 10 -2.250 7.988 -7.915 1.00 0.00 C ATOM 93 C ALA A 10 -1.059 7.054 -7.730 1.00 0.00 C ATOM 94 O ALA A 10 -0.133 7.044 -8.543 1.00 0.00 O ATOM 95 CB ALA A 10 -3.067 7.570 -9.128 1.00 0.00 C ATOM 0 H ALA A 10 -1.214 9.549 -8.856 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.877 7.916 -7.026 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -3.385 6.534 -9.013 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -3.944 8.211 -9.215 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.458 7.665 -10.027 1.00 0.00 H new ATOM 101 N LEU A 11 -1.087 6.271 -6.657 1.00 0.00 N ATOM 102 CA LEU A 11 -0.009 5.333 -6.365 1.00 0.00 C ATOM 103 C LEU A 11 -0.259 3.988 -7.040 1.00 0.00 C ATOM 104 O LEU A 11 -1.397 3.523 -7.117 1.00 0.00 O ATOM 105 CB LEU A 11 0.131 5.140 -4.854 1.00 0.00 C ATOM 106 CG LEU A 11 0.947 3.928 -4.405 1.00 0.00 C ATOM 107 CD1 LEU A 11 2.392 4.059 -4.863 1.00 0.00 C ATOM 108 CD2 LEU A 11 0.877 3.769 -2.893 1.00 0.00 C ATOM 0 H LEU A 11 -1.845 6.267 -5.975 1.00 0.00 H new ATOM 0 HA LEU A 11 0.918 5.750 -6.759 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.588 6.036 -4.434 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -0.867 5.060 -4.424 1.00 0.00 H new ATOM 0 HG LEU A 11 0.521 3.036 -4.864 1.00 0.00 H new ATOM 0 HD11 LEU A 11 2.958 3.187 -4.535 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.424 4.124 -5.951 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.830 4.959 -4.432 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.463 2.901 -2.591 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.278 4.662 -2.414 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.161 3.629 -2.590 1.00 0.00 H new ATOM 120 N ARG A 12 0.811 3.368 -7.526 1.00 0.00 N ATOM 121 CA ARG A 12 0.707 2.076 -8.193 1.00 0.00 C ATOM 122 C ARG A 12 1.976 1.253 -7.986 1.00 0.00 C ATOM 123 O ARG A 12 3.083 1.726 -8.246 1.00 0.00 O ATOM 124 CB ARG A 12 0.451 2.269 -9.689 1.00 0.00 C ATOM 125 CG ARG A 12 1.647 2.824 -10.445 1.00 0.00 C ATOM 126 CD ARG A 12 1.273 3.223 -11.864 1.00 0.00 C ATOM 127 NE ARG A 12 1.445 2.121 -12.806 1.00 0.00 N ATOM 128 CZ ARG A 12 0.807 2.042 -13.969 1.00 0.00 C ATOM 129 NH1 ARG A 12 -0.040 2.996 -14.330 1.00 0.00 N ATOM 130 NH2 ARG A 12 1.016 1.007 -14.773 1.00 0.00 N ATOM 0 H ARG A 12 1.759 3.739 -7.470 1.00 0.00 H new ATOM 0 HA ARG A 12 -0.132 1.536 -7.754 1.00 0.00 H new ATOM 0 HB2 ARG A 12 0.167 1.312 -10.127 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -0.396 2.943 -9.820 1.00 0.00 H new ATOM 0 HG2 ARG A 12 2.044 3.690 -9.915 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.440 2.077 -10.473 1.00 0.00 H new ATOM 0 HD2 ARG A 12 0.236 3.559 -11.885 1.00 0.00 H new ATOM 0 HD3 ARG A 12 1.888 4.067 -12.177 1.00 0.00 H new ATOM 0 HE ARG A 12 2.090 1.371 -12.558 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -0.203 3.793 -13.715 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -0.528 2.933 -15.223 1.00 0.00 H new ATOM 0 HH21 ARG A 12 1.667 0.271 -14.498 1.00 0.00 H new ATOM 0 HH22 ARG A 12 0.526 0.947 -15.665 1.00 0.00 H new ATOM 144 N ILE A 13 1.807 0.022 -7.516 1.00 0.00 N ATOM 145 CA ILE A 13 2.938 -0.865 -7.275 1.00 0.00 C ATOM 146 C ILE A 13 2.718 -2.226 -7.926 1.00 0.00 C ATOM 147 O ILE A 13 1.617 -2.777 -7.883 1.00 0.00 O ATOM 148 CB ILE A 13 3.186 -1.064 -5.768 1.00 0.00 C ATOM 149 CG1 ILE A 13 3.548 0.268 -5.108 1.00 0.00 C ATOM 150 CG2 ILE A 13 4.287 -2.089 -5.543 1.00 0.00 C ATOM 151 CD1 ILE A 13 3.293 0.294 -3.617 1.00 0.00 C ATOM 0 H ILE A 13 0.898 -0.384 -7.295 1.00 0.00 H new ATOM 0 HA ILE A 13 3.812 -0.389 -7.720 1.00 0.00 H new ATOM 0 HB ILE A 13 2.270 -1.437 -5.311 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.601 0.481 -5.292 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.975 1.066 -5.580 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.450 -2.218 -4.473 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.993 -3.042 -5.983 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.208 -1.742 -6.011 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.573 1.269 -3.217 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.235 0.113 -3.426 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.887 -0.481 -3.133 1.00 0.00 H new ATOM 163 N LYS A 14 3.772 -2.765 -8.528 1.00 0.00 N ATOM 164 CA LYS A 14 3.697 -4.064 -9.186 1.00 0.00 C ATOM 165 C LYS A 14 4.566 -5.091 -8.466 1.00 0.00 C ATOM 166 O LYS A 14 5.739 -4.839 -8.190 1.00 0.00 O ATOM 167 CB LYS A 14 4.136 -3.945 -10.648 1.00 0.00 C ATOM 168 CG LYS A 14 3.985 -5.234 -11.436 1.00 0.00 C ATOM 169 CD LYS A 14 4.785 -5.196 -12.727 1.00 0.00 C ATOM 170 CE LYS A 14 6.204 -5.702 -12.519 1.00 0.00 C ATOM 171 NZ LYS A 14 7.106 -4.631 -12.011 1.00 0.00 N ATOM 0 H LYS A 14 4.690 -2.322 -8.574 1.00 0.00 H new ATOM 0 HA LYS A 14 2.661 -4.401 -9.150 1.00 0.00 H new ATOM 0 HB2 LYS A 14 3.551 -3.163 -11.132 1.00 0.00 H new ATOM 0 HB3 LYS A 14 5.179 -3.629 -10.681 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.316 -6.075 -10.827 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.932 -5.401 -11.664 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.288 -5.805 -13.482 1.00 0.00 H new ATOM 0 HD3 LYS A 14 4.814 -4.175 -13.108 1.00 0.00 H new ATOM 0 HE2 LYS A 14 6.194 -6.533 -11.814 1.00 0.00 H new ATOM 0 HE3 LYS A 14 6.594 -6.088 -13.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 8.086 -4.842 -12.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 6.822 -3.716 -12.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 7.041 -4.585 -10.974 1.00 0.00 H new ATOM 185 N ILE A 15 3.983 -6.246 -8.166 1.00 0.00 N ATOM 186 CA ILE A 15 4.705 -7.311 -7.481 1.00 0.00 C ATOM 187 C ILE A 15 5.394 -8.237 -8.477 1.00 0.00 C ATOM 188 O ILE A 15 4.878 -8.491 -9.566 1.00 0.00 O ATOM 189 CB ILE A 15 3.767 -8.143 -6.587 1.00 0.00 C ATOM 190 CG1 ILE A 15 3.031 -7.236 -5.599 1.00 0.00 C ATOM 191 CG2 ILE A 15 4.553 -9.215 -5.847 1.00 0.00 C ATOM 192 CD1 ILE A 15 3.925 -6.669 -4.518 1.00 0.00 C ATOM 0 H ILE A 15 3.012 -6.469 -8.386 1.00 0.00 H new ATOM 0 HA ILE A 15 5.457 -6.830 -6.855 1.00 0.00 H new ATOM 0 HB ILE A 15 3.028 -8.634 -7.220 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.570 -6.414 -6.147 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.223 -7.800 -5.133 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.876 -9.795 -5.219 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.035 -9.876 -6.568 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.312 -8.744 -5.223 1.00 0.00 H new ATOM 0 HD11 ILE A 15 3.336 -6.036 -3.854 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.366 -7.485 -3.945 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.718 -6.077 -4.975 1.00 0.00 H new ATOM 204 N LEU A 16 6.563 -8.741 -8.096 1.00 0.00 N ATOM 205 CA LEU A 16 7.324 -9.642 -8.955 1.00 0.00 C ATOM 206 C LEU A 16 7.161 -11.090 -8.504 1.00 0.00 C ATOM 207 O LEU A 16 6.487 -11.884 -9.162 1.00 0.00 O ATOM 208 CB LEU A 16 8.804 -9.257 -8.948 1.00 0.00 C ATOM 209 CG LEU A 16 9.244 -8.265 -10.024 1.00 0.00 C ATOM 210 CD1 LEU A 16 9.171 -8.904 -11.402 1.00 0.00 C ATOM 211 CD2 LEU A 16 8.389 -7.007 -9.972 1.00 0.00 C ATOM 0 H LEU A 16 7.004 -8.541 -7.198 1.00 0.00 H new ATOM 0 HA LEU A 16 6.937 -9.551 -9.970 1.00 0.00 H new ATOM 0 HB2 LEU A 16 9.044 -8.834 -7.972 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.396 -10.166 -9.056 1.00 0.00 H new ATOM 0 HG LEU A 16 10.279 -7.985 -9.830 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.488 -8.182 -12.155 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.827 -9.774 -11.435 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.146 -9.214 -11.605 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.717 -6.312 -10.745 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.344 -7.270 -10.139 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.493 -6.537 -8.994 1.00 0.00 H new ATOM 223 N CYS A 17 7.781 -11.427 -7.379 1.00 0.00 N ATOM 224 CA CYS A 17 7.704 -12.780 -6.839 1.00 0.00 C ATOM 225 C CYS A 17 8.283 -12.837 -5.429 1.00 0.00 C ATOM 226 O CYS A 17 8.820 -11.849 -4.928 1.00 0.00 O ATOM 227 CB CYS A 17 8.449 -13.758 -7.749 1.00 0.00 C ATOM 228 SG CYS A 17 10.241 -13.517 -7.782 1.00 0.00 S ATOM 0 H CYS A 17 8.343 -10.782 -6.823 1.00 0.00 H new ATOM 0 HA CYS A 17 6.653 -13.066 -6.792 1.00 0.00 H new ATOM 0 HB2 CYS A 17 8.236 -14.776 -7.422 1.00 0.00 H new ATOM 0 HB3 CYS A 17 8.061 -13.661 -8.763 1.00 0.00 H new ATOM 0 HG CYS A 17 10.782 -14.392 -8.577 1.00 0.00 H new ATOM 234 N ALA A 18 8.169 -13.999 -4.794 1.00 0.00 N ATOM 235 CA ALA A 18 8.682 -14.184 -3.443 1.00 0.00 C ATOM 236 C ALA A 18 9.680 -15.335 -3.387 1.00 0.00 C ATOM 237 O ALA A 18 9.662 -16.229 -4.235 1.00 0.00 O ATOM 238 CB ALA A 18 7.535 -14.430 -2.473 1.00 0.00 C ATOM 0 H ALA A 18 7.726 -14.826 -5.194 1.00 0.00 H new ATOM 0 HA ALA A 18 9.203 -13.272 -3.150 1.00 0.00 H new ATOM 0 HB1 ALA A 18 7.932 -14.567 -1.467 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.860 -13.574 -2.483 1.00 0.00 H new ATOM 0 HB3 ALA A 18 6.991 -15.325 -2.773 1.00 0.00 H new ATOM 244 N THR A 19 10.552 -15.308 -2.384 1.00 0.00 N ATOM 245 CA THR A 19 11.560 -16.348 -2.219 1.00 0.00 C ATOM 246 C THR A 19 11.516 -16.939 -0.815 1.00 0.00 C ATOM 247 O THR A 19 10.938 -16.350 0.099 1.00 0.00 O ATOM 248 CB THR A 19 12.976 -15.807 -2.493 1.00 0.00 C ATOM 249 OG1 THR A 19 13.937 -16.861 -2.364 1.00 0.00 O ATOM 250 CG2 THR A 19 13.320 -14.680 -1.530 1.00 0.00 C ATOM 0 H THR A 19 10.580 -14.577 -1.673 1.00 0.00 H new ATOM 0 HA THR A 19 11.331 -17.128 -2.945 1.00 0.00 H new ATOM 0 HB THR A 19 13.001 -15.416 -3.510 1.00 0.00 H new ATOM 0 HG1 THR A 19 14.222 -16.931 -1.429 1.00 0.00 H new ATOM 0 HG21 THR A 19 14.324 -14.314 -1.742 1.00 0.00 H new ATOM 0 HG22 THR A 19 12.604 -13.867 -1.651 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.278 -15.051 -0.506 1.00 0.00 H new ATOM 258 N TYR A 20 12.131 -18.105 -0.649 1.00 0.00 N ATOM 259 CA TYR A 20 12.161 -18.776 0.645 1.00 0.00 C ATOM 260 C TYR A 20 10.752 -18.938 1.207 1.00 0.00 C ATOM 261 O TYR A 20 10.551 -18.938 2.422 1.00 0.00 O ATOM 262 CB TYR A 20 13.027 -17.990 1.631 1.00 0.00 C ATOM 263 CG TYR A 20 14.277 -17.410 1.010 1.00 0.00 C ATOM 264 CD1 TYR A 20 15.214 -18.229 0.391 1.00 0.00 C ATOM 265 CD2 TYR A 20 14.522 -16.042 1.040 1.00 0.00 C ATOM 266 CE1 TYR A 20 16.358 -17.703 -0.177 1.00 0.00 C ATOM 267 CE2 TYR A 20 15.662 -15.508 0.473 1.00 0.00 C ATOM 268 CZ TYR A 20 16.578 -16.342 -0.134 1.00 0.00 C ATOM 269 OH TYR A 20 17.715 -15.814 -0.700 1.00 0.00 O ATOM 0 H TYR A 20 12.615 -18.605 -1.395 1.00 0.00 H new ATOM 0 HA TYR A 20 12.593 -19.767 0.502 1.00 0.00 H new ATOM 0 HB2 TYR A 20 12.434 -17.181 2.057 1.00 0.00 H new ATOM 0 HB3 TYR A 20 13.311 -18.645 2.455 1.00 0.00 H new ATOM 0 HD1 TYR A 20 15.045 -19.295 0.353 1.00 0.00 H new ATOM 0 HD2 TYR A 20 13.808 -15.385 1.515 1.00 0.00 H new ATOM 0 HE1 TYR A 20 17.077 -18.354 -0.652 1.00 0.00 H new ATOM 0 HE2 TYR A 20 15.836 -14.443 0.505 1.00 0.00 H new ATOM 0 HH TYR A 20 17.716 -14.841 -0.584 1.00 0.00 H new ATOM 279 N VAL A 21 9.778 -19.078 0.313 1.00 0.00 N ATOM 280 CA VAL A 21 8.387 -19.244 0.717 1.00 0.00 C ATOM 281 C VAL A 21 8.237 -20.388 1.713 1.00 0.00 C ATOM 282 O VAL A 21 8.936 -21.396 1.626 1.00 0.00 O ATOM 283 CB VAL A 21 7.478 -19.512 -0.497 1.00 0.00 C ATOM 284 CG1 VAL A 21 6.045 -19.754 -0.048 1.00 0.00 C ATOM 285 CG2 VAL A 21 7.548 -18.353 -1.481 1.00 0.00 C ATOM 0 H VAL A 21 9.927 -19.080 -0.696 1.00 0.00 H new ATOM 0 HA VAL A 21 8.082 -18.311 1.191 1.00 0.00 H new ATOM 0 HB VAL A 21 7.832 -20.410 -1.003 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.417 -19.942 -0.919 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.013 -20.618 0.615 1.00 0.00 H new ATOM 0 HG13 VAL A 21 5.677 -18.876 0.482 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.900 -18.559 -2.333 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.220 -17.437 -0.989 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.574 -18.231 -1.827 1.00 0.00 H new ATOM 394 N ILE A 28 -1.277 -27.200 -0.470 1.00 0.00 N ATOM 395 CA ILE A 28 -1.734 -25.890 -0.917 1.00 0.00 C ATOM 396 C ILE A 28 -2.009 -25.887 -2.417 1.00 0.00 C ATOM 397 O ILE A 28 -1.192 -26.357 -3.209 1.00 0.00 O ATOM 398 CB ILE A 28 -0.703 -24.793 -0.593 1.00 0.00 C ATOM 399 CG1 ILE A 28 -0.455 -24.726 0.915 1.00 0.00 C ATOM 400 CG2 ILE A 28 -1.180 -23.447 -1.117 1.00 0.00 C ATOM 401 CD1 ILE A 28 0.934 -24.249 1.278 1.00 0.00 C ATOM 0 HA ILE A 28 -2.658 -25.678 -0.380 1.00 0.00 H new ATOM 0 HB ILE A 28 0.237 -25.041 -1.086 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -1.189 -24.059 1.367 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.615 -25.714 1.346 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -0.441 -22.682 -0.880 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.311 -23.503 -2.198 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.130 -23.190 -0.649 1.00 0.00 H new ATOM 0 HD11 ILE A 28 1.039 -24.226 2.363 1.00 0.00 H new ATOM 0 HD12 ILE A 28 1.674 -24.929 0.856 1.00 0.00 H new ATOM 0 HD13 ILE A 28 1.091 -23.248 0.877 1.00 0.00 H new ATOM 413 N ASP A 29 -3.163 -25.352 -2.801 1.00 0.00 N ATOM 414 CA ASP A 29 -3.545 -25.284 -4.206 1.00 0.00 C ATOM 415 C ASP A 29 -2.922 -24.065 -4.880 1.00 0.00 C ATOM 416 O ASP A 29 -2.279 -24.180 -5.923 1.00 0.00 O ATOM 417 CB ASP A 29 -5.067 -25.235 -4.342 1.00 0.00 C ATOM 418 CG ASP A 29 -5.514 -24.542 -5.614 1.00 0.00 C ATOM 419 OD1 ASP A 29 -5.423 -25.166 -6.693 1.00 0.00 O ATOM 420 OD2 ASP A 29 -5.955 -23.377 -5.531 1.00 0.00 O ATOM 0 H ASP A 29 -3.850 -24.959 -2.158 1.00 0.00 H new ATOM 0 HA ASP A 29 -3.173 -26.181 -4.701 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.463 -26.250 -4.327 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.489 -24.716 -3.482 1.00 0.00 H new ATOM 425 N LYS A 30 -3.120 -22.897 -4.278 1.00 0.00 N ATOM 426 CA LYS A 30 -2.579 -21.656 -4.818 1.00 0.00 C ATOM 427 C LYS A 30 -2.223 -20.684 -3.698 1.00 0.00 C ATOM 428 O LYS A 30 -2.427 -20.979 -2.520 1.00 0.00 O ATOM 429 CB LYS A 30 -3.587 -21.007 -5.769 1.00 0.00 C ATOM 430 CG LYS A 30 -3.783 -21.775 -7.065 1.00 0.00 C ATOM 431 CD LYS A 30 -2.683 -21.467 -8.067 1.00 0.00 C ATOM 432 CE LYS A 30 -2.580 -22.548 -9.132 1.00 0.00 C ATOM 433 NZ LYS A 30 -3.718 -22.493 -10.091 1.00 0.00 N ATOM 0 H LYS A 30 -3.652 -22.784 -3.415 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.670 -21.896 -5.370 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.547 -20.917 -5.261 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.254 -19.996 -6.003 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.797 -22.845 -6.857 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.751 -21.521 -7.497 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.880 -20.505 -8.541 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.730 -21.376 -7.546 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -1.642 -22.434 -9.675 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.555 -23.527 -8.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -3.611 -23.246 -10.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -4.612 -22.627 -9.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.727 -21.568 -10.566 1.00 0.00 H new ATOM 447 N ILE A 31 -1.692 -19.525 -4.072 1.00 0.00 N ATOM 448 CA ILE A 31 -1.310 -18.510 -3.098 1.00 0.00 C ATOM 449 C ILE A 31 -1.701 -17.116 -3.576 1.00 0.00 C ATOM 450 O ILE A 31 -2.176 -16.943 -4.699 1.00 0.00 O ATOM 451 CB ILE A 31 0.204 -18.539 -2.818 1.00 0.00 C ATOM 452 CG1 ILE A 31 0.986 -18.595 -4.132 1.00 0.00 C ATOM 453 CG2 ILE A 31 0.556 -19.726 -1.934 1.00 0.00 C ATOM 454 CD1 ILE A 31 2.411 -18.103 -4.007 1.00 0.00 C ATOM 0 H ILE A 31 -1.516 -19.265 -5.043 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.845 -18.739 -2.177 1.00 0.00 H new ATOM 0 HB ILE A 31 0.480 -17.625 -2.292 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.995 -19.622 -4.497 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.467 -17.996 -4.880 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.629 -19.733 -1.745 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.021 -19.646 -0.988 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.270 -20.651 -2.435 1.00 0.00 H new ATOM 0 HD11 ILE A 31 2.906 -18.171 -4.976 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.410 -17.066 -3.672 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.946 -18.717 -3.283 1.00 0.00 H new ATOM 466 N TYR A 32 -1.496 -16.123 -2.718 1.00 0.00 N ATOM 467 CA TYR A 32 -1.827 -14.743 -3.052 1.00 0.00 C ATOM 468 C TYR A 32 -1.262 -13.780 -2.012 1.00 0.00 C ATOM 469 O TYR A 32 -1.026 -14.156 -0.863 1.00 0.00 O ATOM 470 CB TYR A 32 -3.344 -14.570 -3.151 1.00 0.00 C ATOM 471 CG TYR A 32 -4.025 -14.419 -1.810 1.00 0.00 C ATOM 472 CD1 TYR A 32 -4.062 -13.190 -1.162 1.00 0.00 C ATOM 473 CD2 TYR A 32 -4.634 -15.504 -1.192 1.00 0.00 C ATOM 474 CE1 TYR A 32 -4.683 -13.048 0.063 1.00 0.00 C ATOM 475 CE2 TYR A 32 -5.258 -15.371 0.033 1.00 0.00 C ATOM 476 CZ TYR A 32 -5.280 -14.141 0.657 1.00 0.00 C ATOM 477 OH TYR A 32 -5.901 -14.002 1.877 1.00 0.00 O ATOM 0 H TYR A 32 -1.102 -16.248 -1.786 1.00 0.00 H new ATOM 0 HA TYR A 32 -1.377 -14.512 -4.018 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -3.562 -13.693 -3.761 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -3.766 -15.431 -3.669 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -3.597 -12.332 -1.624 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -4.619 -16.468 -1.678 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -4.701 -12.086 0.554 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -5.726 -16.225 0.500 1.00 0.00 H new ATOM 0 HH TYR A 32 -6.457 -14.790 2.053 1.00 0.00 H new ATOM 487 N VAL A 33 -1.046 -12.535 -2.424 1.00 0.00 N ATOM 488 CA VAL A 33 -0.510 -11.516 -1.529 1.00 0.00 C ATOM 489 C VAL A 33 -1.555 -10.450 -1.222 1.00 0.00 C ATOM 490 O VAL A 33 -2.314 -10.038 -2.099 1.00 0.00 O ATOM 491 CB VAL A 33 0.736 -10.839 -2.132 1.00 0.00 C ATOM 492 CG1 VAL A 33 1.289 -9.792 -1.177 1.00 0.00 C ATOM 493 CG2 VAL A 33 1.795 -11.877 -2.469 1.00 0.00 C ATOM 0 H VAL A 33 -1.234 -12.208 -3.372 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.229 -12.022 -0.605 1.00 0.00 H new ATOM 0 HB VAL A 33 0.445 -10.337 -3.055 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.169 -9.324 -1.619 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.530 -9.033 -0.990 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.566 -10.268 -0.236 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.668 -11.381 -2.894 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.085 -12.409 -1.563 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.392 -12.586 -3.192 1.00 0.00 H new ATOM 503 N ARG A 34 -1.588 -10.005 0.030 1.00 0.00 N ATOM 504 CA ARG A 34 -2.541 -8.987 0.455 1.00 0.00 C ATOM 505 C ARG A 34 -1.824 -7.693 0.829 1.00 0.00 C ATOM 506 O ARG A 34 -0.892 -7.697 1.634 1.00 0.00 O ATOM 507 CB ARG A 34 -3.362 -9.490 1.644 1.00 0.00 C ATOM 508 CG ARG A 34 -4.402 -8.494 2.131 1.00 0.00 C ATOM 509 CD ARG A 34 -5.468 -9.171 2.977 1.00 0.00 C ATOM 510 NE ARG A 34 -6.752 -8.479 2.897 1.00 0.00 N ATOM 511 CZ ARG A 34 -7.621 -8.655 1.908 1.00 0.00 C ATOM 512 NH1 ARG A 34 -7.346 -9.498 0.922 1.00 0.00 N ATOM 513 NH2 ARG A 34 -8.769 -7.989 1.905 1.00 0.00 N ATOM 0 H ARG A 34 -0.965 -10.334 0.768 1.00 0.00 H new ATOM 0 HA ARG A 34 -3.212 -8.782 -0.380 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -3.862 -10.417 1.363 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -2.687 -9.729 2.466 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -3.914 -7.713 2.715 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -4.870 -8.007 1.275 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -5.591 -10.203 2.647 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.139 -9.205 4.016 1.00 0.00 H new ATOM 0 HE ARG A 34 -6.994 -7.825 3.641 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -6.466 -10.013 0.922 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -8.015 -9.631 0.164 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -8.985 -7.341 2.663 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -9.436 -8.125 1.145 1.00 0.00 H new ATOM 527 N THR A 35 -2.264 -6.586 0.238 1.00 0.00 N ATOM 528 CA THR A 35 -1.663 -5.286 0.507 1.00 0.00 C ATOM 529 C THR A 35 -2.708 -4.288 0.995 1.00 0.00 C ATOM 530 O THR A 35 -3.908 -4.555 0.940 1.00 0.00 O ATOM 531 CB THR A 35 -0.971 -4.717 -0.745 1.00 0.00 C ATOM 532 OG1 THR A 35 -1.953 -4.305 -1.703 1.00 0.00 O ATOM 533 CG2 THR A 35 -0.047 -5.751 -1.370 1.00 0.00 C ATOM 0 H THR A 35 -3.035 -6.564 -0.430 1.00 0.00 H new ATOM 0 HA THR A 35 -0.917 -5.438 1.287 1.00 0.00 H new ATOM 0 HB THR A 35 -0.375 -3.856 -0.444 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.641 -3.500 -2.166 1.00 0.00 H new ATOM 0 HG21 THR A 35 0.430 -5.326 -2.253 1.00 0.00 H new ATOM 0 HG22 THR A 35 0.717 -6.040 -0.648 1.00 0.00 H new ATOM 0 HG23 THR A 35 -0.625 -6.629 -1.658 1.00 0.00 H new ATOM 541 N GLY A 36 -2.244 -3.137 1.471 1.00 0.00 N ATOM 542 CA GLY A 36 -3.152 -2.117 1.961 1.00 0.00 C ATOM 543 C GLY A 36 -2.488 -1.174 2.945 1.00 0.00 C ATOM 544 O GLY A 36 -1.761 -1.610 3.838 1.00 0.00 O ATOM 0 H GLY A 36 -1.255 -2.893 1.526 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.539 -1.544 1.118 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.006 -2.595 2.441 1.00 0.00 H new ATOM 548 N ILE A 37 -2.737 0.121 2.781 1.00 0.00 N ATOM 549 CA ILE A 37 -2.158 1.127 3.663 1.00 0.00 C ATOM 550 C ILE A 37 -2.961 1.256 4.952 1.00 0.00 C ATOM 551 O ILE A 37 -4.182 1.097 4.954 1.00 0.00 O ATOM 552 CB ILE A 37 -2.086 2.504 2.975 1.00 0.00 C ATOM 553 CG1 ILE A 37 -1.117 2.458 1.792 1.00 0.00 C ATOM 554 CG2 ILE A 37 -1.663 3.572 3.972 1.00 0.00 C ATOM 555 CD1 ILE A 37 -1.679 1.750 0.579 1.00 0.00 C ATOM 0 H ILE A 37 -3.335 0.498 2.046 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.147 0.795 3.900 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.077 2.758 2.598 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.846 3.477 1.515 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.200 1.957 2.103 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.617 4.539 3.471 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.388 3.619 4.785 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -0.681 3.325 4.375 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.939 1.755 -0.221 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.924 0.720 0.840 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.580 2.264 0.243 1.00 0.00 H new ATOM 567 N TYR A 38 -2.268 1.547 6.048 1.00 0.00 N ATOM 568 CA TYR A 38 -2.916 1.698 7.345 1.00 0.00 C ATOM 569 C TYR A 38 -2.299 2.849 8.132 1.00 0.00 C ATOM 570 O TYR A 38 -1.199 3.310 7.822 1.00 0.00 O ATOM 571 CB TYR A 38 -2.806 0.400 8.147 1.00 0.00 C ATOM 572 CG TYR A 38 -3.761 -0.679 7.687 1.00 0.00 C ATOM 573 CD1 TYR A 38 -3.504 -1.418 6.539 1.00 0.00 C ATOM 574 CD2 TYR A 38 -4.920 -0.958 8.400 1.00 0.00 C ATOM 575 CE1 TYR A 38 -4.374 -2.404 6.115 1.00 0.00 C ATOM 576 CE2 TYR A 38 -5.795 -1.943 7.984 1.00 0.00 C ATOM 577 CZ TYR A 38 -5.518 -2.663 6.841 1.00 0.00 C ATOM 578 OH TYR A 38 -6.387 -3.644 6.423 1.00 0.00 O ATOM 0 H TYR A 38 -1.257 1.683 6.063 1.00 0.00 H new ATOM 0 HA TYR A 38 -3.968 1.923 7.173 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -1.785 0.024 8.076 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -2.994 0.616 9.199 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -2.609 -1.218 5.968 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -5.141 -0.395 9.295 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -4.160 -2.969 5.220 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -6.691 -2.148 8.551 1.00 0.00 H new ATOM 0 HH TYR A 38 -5.891 -4.335 5.936 1.00 0.00 H new ATOM 588 N HIS A 39 -3.014 3.310 9.154 1.00 0.00 N ATOM 589 CA HIS A 39 -2.537 4.407 9.988 1.00 0.00 C ATOM 590 C HIS A 39 -2.696 4.073 11.468 1.00 0.00 C ATOM 591 O HIS A 39 -3.756 4.288 12.053 1.00 0.00 O ATOM 592 CB HIS A 39 -3.296 5.693 9.659 1.00 0.00 C ATOM 593 CG HIS A 39 -2.797 6.891 10.407 1.00 0.00 C ATOM 594 ND1 HIS A 39 -2.909 8.178 9.926 1.00 0.00 N ATOM 595 CD2 HIS A 39 -2.181 6.991 11.608 1.00 0.00 C ATOM 596 CE1 HIS A 39 -2.383 9.019 10.799 1.00 0.00 C ATOM 597 NE2 HIS A 39 -1.934 8.324 11.829 1.00 0.00 N ATOM 0 H HIS A 39 -3.926 2.941 9.424 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.478 4.556 9.779 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -3.221 5.886 8.589 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -4.353 5.549 9.883 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -1.930 6.175 12.269 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -2.329 10.092 10.689 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -1.478 8.714 12.654 1.00 0.00 H new ATOM 606 N GLY A 40 -1.634 3.544 12.068 1.00 0.00 N ATOM 607 CA GLY A 40 -1.677 3.187 13.474 1.00 0.00 C ATOM 608 C GLY A 40 -2.198 1.782 13.701 1.00 0.00 C ATOM 609 O GLY A 40 -1.780 1.100 14.636 1.00 0.00 O ATOM 0 H GLY A 40 -0.745 3.356 11.605 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.677 3.273 13.898 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.311 3.896 14.006 1.00 0.00 H new ATOM 613 N GLY A 41 -3.116 1.348 12.843 1.00 0.00 N ATOM 614 CA GLY A 41 -3.682 0.017 12.972 1.00 0.00 C ATOM 615 C GLY A 41 -4.976 -0.140 12.199 1.00 0.00 C ATOM 616 O GLY A 41 -5.297 -1.231 11.729 1.00 0.00 O ATOM 0 H GLY A 41 -3.478 1.894 12.061 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.959 -0.718 12.617 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.863 -0.197 14.025 1.00 0.00 H new ATOM 620 N GLU A 42 -5.723 0.953 12.068 1.00 0.00 N ATOM 621 CA GLU A 42 -6.991 0.929 11.349 1.00 0.00 C ATOM 622 C GLU A 42 -6.787 1.275 9.877 1.00 0.00 C ATOM 623 O GLU A 42 -5.853 1.985 9.503 1.00 0.00 O ATOM 624 CB GLU A 42 -7.980 1.909 11.982 1.00 0.00 C ATOM 625 CG GLU A 42 -8.266 1.624 13.447 1.00 0.00 C ATOM 626 CD GLU A 42 -7.303 2.334 14.379 1.00 0.00 C ATOM 627 OE1 GLU A 42 -7.399 3.573 14.498 1.00 0.00 O ATOM 628 OE2 GLU A 42 -6.453 1.650 14.988 1.00 0.00 O ATOM 0 H GLU A 42 -5.472 1.865 12.450 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.398 -0.080 11.415 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.586 2.921 11.888 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.916 1.878 11.425 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.285 1.932 13.681 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -8.209 0.550 13.622 1.00 0.00 H new ATOM 635 N PRO A 43 -7.682 0.762 9.019 1.00 0.00 N ATOM 636 CA PRO A 43 -7.623 1.002 7.575 1.00 0.00 C ATOM 637 C PRO A 43 -7.958 2.445 7.213 1.00 0.00 C ATOM 638 O PRO A 43 -8.637 3.144 7.967 1.00 0.00 O ATOM 639 CB PRO A 43 -8.682 0.051 7.013 1.00 0.00 C ATOM 640 CG PRO A 43 -9.640 -0.155 8.135 1.00 0.00 C ATOM 641 CD PRO A 43 -8.821 -0.092 9.395 1.00 0.00 C ATOM 0 HA PRO A 43 -6.623 0.833 7.175 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -9.178 0.481 6.143 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -8.238 -0.892 6.694 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.414 0.613 8.134 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -10.145 -1.117 8.045 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -9.388 0.336 10.222 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -8.494 -1.082 9.711 1.00 0.00 H new ATOM 649 N LEU A 44 -7.479 2.887 6.055 1.00 0.00 N ATOM 650 CA LEU A 44 -7.728 4.248 5.593 1.00 0.00 C ATOM 651 C LEU A 44 -8.748 4.259 4.459 1.00 0.00 C ATOM 652 O LEU A 44 -9.630 5.117 4.412 1.00 0.00 O ATOM 653 CB LEU A 44 -6.423 4.896 5.128 1.00 0.00 C ATOM 654 CG LEU A 44 -5.517 5.446 6.230 1.00 0.00 C ATOM 655 CD1 LEU A 44 -4.857 4.309 6.995 1.00 0.00 C ATOM 656 CD2 LEU A 44 -4.465 6.375 5.641 1.00 0.00 C ATOM 0 H LEU A 44 -6.916 2.322 5.419 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.133 4.821 6.427 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.859 4.160 4.555 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.668 5.711 4.446 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.130 6.018 6.926 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -4.216 4.719 7.775 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.625 3.682 7.449 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.257 3.710 6.310 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -3.829 6.757 6.439 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.856 5.826 4.923 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.956 7.208 5.138 1.00 0.00 H new ATOM 668 N CYS A 45 -8.622 3.301 3.547 1.00 0.00 N ATOM 669 CA CYS A 45 -9.533 3.200 2.413 1.00 0.00 C ATOM 670 C CYS A 45 -10.003 1.762 2.220 1.00 0.00 C ATOM 671 O CYS A 45 -11.180 1.452 2.408 1.00 0.00 O ATOM 672 CB CYS A 45 -8.853 3.702 1.139 1.00 0.00 C ATOM 673 SG CYS A 45 -8.790 5.503 0.996 1.00 0.00 S ATOM 0 H CYS A 45 -7.898 2.583 3.571 1.00 0.00 H new ATOM 0 HA CYS A 45 -10.403 3.823 2.621 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -7.837 3.310 1.104 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -9.381 3.298 0.275 1.00 0.00 H new ATOM 0 HG CYS A 45 -8.195 5.830 -0.113 1.00 0.00 H new ATOM 679 N ASP A 46 -9.077 0.888 1.843 1.00 0.00 N ATOM 680 CA ASP A 46 -9.396 -0.518 1.623 1.00 0.00 C ATOM 681 C ASP A 46 -8.131 -1.328 1.357 1.00 0.00 C ATOM 682 O ASP A 46 -7.046 -0.769 1.202 1.00 0.00 O ATOM 683 CB ASP A 46 -10.367 -0.666 0.451 1.00 0.00 C ATOM 684 CG ASP A 46 -11.169 -1.950 0.521 1.00 0.00 C ATOM 685 OD1 ASP A 46 -11.533 -2.363 1.642 1.00 0.00 O ATOM 686 OD2 ASP A 46 -11.433 -2.543 -0.546 1.00 0.00 O ATOM 0 H ASP A 46 -8.099 1.128 1.683 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.868 -0.903 2.527 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -11.049 0.184 0.439 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.809 -0.641 -0.485 1.00 0.00 H new ATOM 691 N ASN A 47 -8.279 -2.648 1.306 1.00 0.00 N ATOM 692 CA ASN A 47 -7.148 -3.535 1.060 1.00 0.00 C ATOM 693 C ASN A 47 -7.188 -4.086 -0.362 1.00 0.00 C ATOM 694 O ASN A 47 -8.260 -4.351 -0.906 1.00 0.00 O ATOM 695 CB ASN A 47 -7.149 -4.687 2.066 1.00 0.00 C ATOM 696 CG ASN A 47 -6.381 -4.352 3.330 1.00 0.00 C ATOM 697 OD1 ASN A 47 -5.694 -5.202 3.897 1.00 0.00 O ATOM 698 ND2 ASN A 47 -6.495 -3.107 3.779 1.00 0.00 N ATOM 0 H ASN A 47 -9.171 -3.127 1.432 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.232 -2.957 1.181 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -8.177 -4.939 2.325 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.712 -5.571 1.602 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -6.002 -2.823 4.626 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.075 -2.435 3.277 1.00 0.00 H new ATOM 705 N VAL A 48 -6.012 -4.257 -0.958 1.00 0.00 N ATOM 706 CA VAL A 48 -5.912 -4.778 -2.316 1.00 0.00 C ATOM 707 C VAL A 48 -5.309 -6.178 -2.324 1.00 0.00 C ATOM 708 O VAL A 48 -4.376 -6.467 -1.575 1.00 0.00 O ATOM 709 CB VAL A 48 -5.059 -3.858 -3.209 1.00 0.00 C ATOM 710 CG1 VAL A 48 -5.051 -4.364 -4.643 1.00 0.00 C ATOM 711 CG2 VAL A 48 -5.570 -2.427 -3.142 1.00 0.00 C ATOM 0 H VAL A 48 -5.115 -4.042 -0.522 1.00 0.00 H new ATOM 0 HA VAL A 48 -6.926 -4.820 -2.715 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.034 -3.870 -2.839 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.443 -3.701 -5.259 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.633 -5.370 -4.671 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.071 -4.383 -5.028 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.955 -1.791 -3.779 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.604 -2.393 -3.485 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.517 -2.070 -2.114 1.00 0.00 H new ATOM 721 N ASN A 49 -5.847 -7.044 -3.176 1.00 0.00 N ATOM 722 CA ASN A 49 -5.362 -8.415 -3.282 1.00 0.00 C ATOM 723 C ASN A 49 -4.877 -8.713 -4.698 1.00 0.00 C ATOM 724 O ASN A 49 -5.448 -8.230 -5.676 1.00 0.00 O ATOM 725 CB ASN A 49 -6.465 -9.401 -2.891 1.00 0.00 C ATOM 726 CG ASN A 49 -7.675 -9.305 -3.801 1.00 0.00 C ATOM 727 OD1 ASN A 49 -8.177 -8.214 -4.072 1.00 0.00 O ATOM 728 ND2 ASN A 49 -8.149 -10.451 -4.276 1.00 0.00 N ATOM 0 H ASN A 49 -6.619 -6.821 -3.803 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.522 -8.530 -2.597 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.069 -10.416 -2.923 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -6.771 -9.210 -1.862 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -8.962 -10.450 -4.892 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -7.700 -11.332 -4.024 1.00 0.00 H new ATOM 735 N THR A 50 -3.820 -9.513 -4.799 1.00 0.00 N ATOM 736 CA THR A 50 -3.257 -9.875 -6.094 1.00 0.00 C ATOM 737 C THR A 50 -3.819 -11.204 -6.585 1.00 0.00 C ATOM 738 O THR A 50 -4.328 -12.001 -5.797 1.00 0.00 O ATOM 739 CB THR A 50 -1.721 -9.971 -6.032 1.00 0.00 C ATOM 740 OG1 THR A 50 -1.331 -10.988 -5.103 1.00 0.00 O ATOM 741 CG2 THR A 50 -1.112 -8.639 -5.621 1.00 0.00 C ATOM 0 H THR A 50 -3.337 -9.922 -4.000 1.00 0.00 H new ATOM 0 HA THR A 50 -3.536 -9.086 -6.792 1.00 0.00 H new ATOM 0 HB THR A 50 -1.354 -10.228 -7.026 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.799 -11.668 -5.567 1.00 0.00 H new ATOM 0 HG21 THR A 50 -0.027 -8.731 -5.584 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.387 -7.874 -6.347 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.486 -8.356 -4.637 1.00 0.00 H new ATOM 749 N GLN A 51 -3.722 -11.437 -7.890 1.00 0.00 N ATOM 750 CA GLN A 51 -4.221 -12.671 -8.484 1.00 0.00 C ATOM 751 C GLN A 51 -3.707 -13.889 -7.723 1.00 0.00 C ATOM 752 O GLN A 51 -2.869 -13.766 -6.830 1.00 0.00 O ATOM 753 CB GLN A 51 -3.802 -12.760 -9.953 1.00 0.00 C ATOM 754 CG GLN A 51 -2.318 -13.026 -10.148 1.00 0.00 C ATOM 755 CD GLN A 51 -1.913 -13.031 -11.609 1.00 0.00 C ATOM 756 OE1 GLN A 51 -1.465 -14.048 -12.138 1.00 0.00 O ATOM 757 NE2 GLN A 51 -2.069 -11.890 -12.270 1.00 0.00 N ATOM 0 H GLN A 51 -3.303 -10.788 -8.555 1.00 0.00 H new ATOM 0 HA GLN A 51 -5.309 -12.660 -8.423 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -4.371 -13.553 -10.437 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -4.064 -11.828 -10.454 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.744 -12.266 -9.618 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -2.063 -13.987 -9.701 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.444 -11.071 -11.792 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.814 -11.833 -13.256 1.00 0.00 H new ATOM 766 N ARG A 52 -4.216 -15.063 -8.082 1.00 0.00 N ATOM 767 CA ARG A 52 -3.811 -16.303 -7.431 1.00 0.00 C ATOM 768 C ARG A 52 -2.803 -17.062 -8.288 1.00 0.00 C ATOM 769 O ARG A 52 -3.008 -17.249 -9.488 1.00 0.00 O ATOM 770 CB ARG A 52 -5.031 -17.184 -7.158 1.00 0.00 C ATOM 771 CG ARG A 52 -5.670 -16.936 -5.802 1.00 0.00 C ATOM 772 CD ARG A 52 -6.339 -15.571 -5.741 1.00 0.00 C ATOM 773 NE ARG A 52 -7.654 -15.578 -6.375 1.00 0.00 N ATOM 774 CZ ARG A 52 -8.260 -14.484 -6.822 1.00 0.00 C ATOM 775 NH1 ARG A 52 -7.671 -13.302 -6.707 1.00 0.00 N ATOM 776 NH2 ARG A 52 -9.458 -14.570 -7.387 1.00 0.00 N ATOM 0 H ARG A 52 -4.910 -15.181 -8.820 1.00 0.00 H new ATOM 0 HA ARG A 52 -3.337 -16.048 -6.483 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -5.774 -17.013 -7.937 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -4.735 -18.231 -7.225 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.407 -17.713 -5.599 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.911 -17.005 -5.023 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.440 -15.263 -4.700 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.704 -14.834 -6.232 1.00 0.00 H new ATOM 0 HE ARG A 52 -8.134 -16.472 -6.480 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.750 -13.231 -6.274 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -8.139 -12.463 -7.051 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.915 -15.477 -7.478 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.922 -13.729 -7.730 1.00 0.00 H new ATOM 790 N VAL A 53 -1.712 -17.498 -7.665 1.00 0.00 N ATOM 791 CA VAL A 53 -0.673 -18.238 -8.370 1.00 0.00 C ATOM 792 C VAL A 53 -0.204 -19.439 -7.556 1.00 0.00 C ATOM 793 O VAL A 53 -0.262 -19.447 -6.327 1.00 0.00 O ATOM 794 CB VAL A 53 0.539 -17.340 -8.685 1.00 0.00 C ATOM 795 CG1 VAL A 53 0.082 -15.941 -9.068 1.00 0.00 C ATOM 796 CG2 VAL A 53 1.490 -17.294 -7.498 1.00 0.00 C ATOM 0 H VAL A 53 -1.525 -17.351 -6.673 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.111 -18.586 -9.305 1.00 0.00 H new ATOM 0 HB VAL A 53 1.074 -17.766 -9.534 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.952 -15.321 -9.287 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.556 -15.995 -9.950 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.478 -15.502 -8.242 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.340 -16.655 -7.738 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.968 -16.893 -6.629 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.844 -18.301 -7.276 1.00 0.00 H new ATOM 806 N PRO A 54 0.272 -20.479 -8.257 1.00 0.00 N ATOM 807 CA PRO A 54 0.761 -21.705 -7.619 1.00 0.00 C ATOM 808 C PRO A 54 2.070 -21.485 -6.869 1.00 0.00 C ATOM 809 O PRO A 54 2.952 -20.766 -7.338 1.00 0.00 O ATOM 810 CB PRO A 54 0.974 -22.657 -8.799 1.00 0.00 C ATOM 811 CG PRO A 54 1.204 -21.765 -9.969 1.00 0.00 C ATOM 812 CD PRO A 54 0.370 -20.538 -9.725 1.00 0.00 C ATOM 0 HA PRO A 54 0.064 -22.081 -6.870 1.00 0.00 H new ATOM 0 HB2 PRO A 54 1.827 -23.314 -8.629 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.105 -23.296 -8.954 1.00 0.00 H new ATOM 0 HG2 PRO A 54 2.259 -21.507 -10.062 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.913 -22.256 -10.897 1.00 0.00 H new ATOM 0 HD2 PRO A 54 0.842 -19.644 -10.133 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -0.612 -20.621 -10.190 1.00 0.00 H new ATOM 820 N CYS A 55 2.189 -22.110 -5.702 1.00 0.00 N ATOM 821 CA CYS A 55 3.391 -21.982 -4.886 1.00 0.00 C ATOM 822 C CYS A 55 4.643 -22.243 -5.717 1.00 0.00 C ATOM 823 O CYS A 55 5.696 -21.654 -5.474 1.00 0.00 O ATOM 824 CB CYS A 55 3.337 -22.953 -3.706 1.00 0.00 C ATOM 825 SG CYS A 55 3.212 -24.692 -4.185 1.00 0.00 S ATOM 0 H CYS A 55 1.468 -22.710 -5.300 1.00 0.00 H new ATOM 0 HA CYS A 55 3.435 -20.961 -4.506 1.00 0.00 H new ATOM 0 HB2 CYS A 55 4.231 -22.818 -3.098 1.00 0.00 H new ATOM 0 HB3 CYS A 55 2.483 -22.698 -3.078 1.00 0.00 H new ATOM 0 HG CYS A 55 3.175 -25.434 -3.118 1.00 0.00 H new ATOM 831 N SER A 56 4.521 -23.131 -6.699 1.00 0.00 N ATOM 832 CA SER A 56 5.644 -23.474 -7.564 1.00 0.00 C ATOM 833 C SER A 56 6.105 -22.259 -8.363 1.00 0.00 C ATOM 834 O SER A 56 7.285 -22.126 -8.685 1.00 0.00 O ATOM 835 CB SER A 56 5.255 -24.607 -8.515 1.00 0.00 C ATOM 836 OG SER A 56 4.683 -25.693 -7.808 1.00 0.00 O ATOM 0 H SER A 56 3.656 -23.626 -6.915 1.00 0.00 H new ATOM 0 HA SER A 56 6.469 -23.806 -6.933 1.00 0.00 H new ATOM 0 HB2 SER A 56 4.546 -24.237 -9.255 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.136 -24.947 -9.060 1.00 0.00 H new ATOM 0 HG SER A 56 4.442 -26.403 -8.439 1.00 0.00 H new ATOM 842 N ASN A 57 5.165 -21.375 -8.680 1.00 0.00 N ATOM 843 CA ASN A 57 5.474 -20.171 -9.442 1.00 0.00 C ATOM 844 C ASN A 57 4.833 -18.943 -8.803 1.00 0.00 C ATOM 845 O ASN A 57 3.772 -18.478 -9.219 1.00 0.00 O ATOM 846 CB ASN A 57 4.991 -20.319 -10.887 1.00 0.00 C ATOM 847 CG ASN A 57 5.798 -19.476 -11.855 1.00 0.00 C ATOM 848 OD1 ASN A 57 5.261 -18.596 -12.527 1.00 0.00 O ATOM 849 ND2 ASN A 57 7.097 -19.744 -11.932 1.00 0.00 N ATOM 0 H ASN A 57 4.183 -21.470 -8.421 1.00 0.00 H new ATOM 0 HA ASN A 57 6.556 -20.037 -9.439 1.00 0.00 H new ATOM 0 HB2 ASN A 57 5.053 -21.366 -11.183 1.00 0.00 H new ATOM 0 HB3 ASN A 57 3.941 -20.032 -10.948 1.00 0.00 H new ATOM 0 HD21 ASN A 57 7.691 -19.211 -12.567 1.00 0.00 H new ATOM 0 HD22 ASN A 57 7.500 -20.483 -11.356 1.00 0.00 H new ATOM 856 N PRO A 58 5.492 -18.403 -7.766 1.00 0.00 N ATOM 857 CA PRO A 58 5.006 -17.222 -7.048 1.00 0.00 C ATOM 858 C PRO A 58 5.094 -15.954 -7.891 1.00 0.00 C ATOM 859 O PRO A 58 4.782 -14.861 -7.419 1.00 0.00 O ATOM 860 CB PRO A 58 5.944 -17.129 -5.842 1.00 0.00 C ATOM 861 CG PRO A 58 7.194 -17.810 -6.281 1.00 0.00 C ATOM 862 CD PRO A 58 6.762 -18.906 -7.217 1.00 0.00 C ATOM 0 HA PRO A 58 3.953 -17.312 -6.780 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.134 -16.091 -5.567 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.514 -17.617 -4.967 1.00 0.00 H new ATOM 0 HG2 PRO A 58 7.864 -17.111 -6.781 1.00 0.00 H new ATOM 0 HG3 PRO A 58 7.737 -18.217 -5.428 1.00 0.00 H new ATOM 0 HD2 PRO A 58 7.499 -19.078 -8.001 1.00 0.00 H new ATOM 0 HD3 PRO A 58 6.627 -19.852 -6.693 1.00 0.00 H new ATOM 870 N ARG A 59 5.522 -16.108 -9.139 1.00 0.00 N ATOM 871 CA ARG A 59 5.652 -14.974 -10.047 1.00 0.00 C ATOM 872 C ARG A 59 4.301 -14.304 -10.278 1.00 0.00 C ATOM 873 O ARG A 59 3.441 -14.842 -10.976 1.00 0.00 O ATOM 874 CB ARG A 59 6.243 -15.429 -11.383 1.00 0.00 C ATOM 875 CG ARG A 59 7.695 -15.868 -11.290 1.00 0.00 C ATOM 876 CD ARG A 59 8.251 -16.246 -12.653 1.00 0.00 C ATOM 877 NE ARG A 59 9.707 -16.134 -12.701 1.00 0.00 N ATOM 878 CZ ARG A 59 10.466 -16.785 -13.575 1.00 0.00 C ATOM 879 NH1 ARG A 59 9.910 -17.589 -14.471 1.00 0.00 N ATOM 880 NH2 ARG A 59 11.784 -16.631 -13.556 1.00 0.00 N ATOM 0 H ARG A 59 5.785 -17.006 -9.545 1.00 0.00 H new ATOM 0 HA ARG A 59 6.324 -14.248 -9.588 1.00 0.00 H new ATOM 0 HB2 ARG A 59 5.647 -16.255 -11.772 1.00 0.00 H new ATOM 0 HB3 ARG A 59 6.164 -14.613 -12.102 1.00 0.00 H new ATOM 0 HG2 ARG A 59 8.293 -15.063 -10.862 1.00 0.00 H new ATOM 0 HG3 ARG A 59 7.776 -16.719 -10.614 1.00 0.00 H new ATOM 0 HD2 ARG A 59 7.958 -17.268 -12.893 1.00 0.00 H new ATOM 0 HD3 ARG A 59 7.813 -15.601 -13.415 1.00 0.00 H new ATOM 0 HE ARG A 59 10.166 -15.522 -12.026 1.00 0.00 H new ATOM 0 HH11 ARG A 59 8.897 -17.709 -14.490 1.00 0.00 H new ATOM 0 HH12 ARG A 59 10.495 -18.088 -15.141 1.00 0.00 H new ATOM 0 HH21 ARG A 59 12.215 -16.012 -12.870 1.00 0.00 H new ATOM 0 HH22 ARG A 59 12.366 -17.132 -14.228 1.00 0.00 H new ATOM 894 N TRP A 60 4.121 -13.129 -9.687 1.00 0.00 N ATOM 895 CA TRP A 60 2.874 -12.385 -9.827 1.00 0.00 C ATOM 896 C TRP A 60 2.937 -11.437 -11.019 1.00 0.00 C ATOM 897 O TRP A 60 2.014 -11.382 -11.830 1.00 0.00 O ATOM 898 CB TRP A 60 2.578 -11.599 -8.549 1.00 0.00 C ATOM 899 CG TRP A 60 1.913 -12.422 -7.487 1.00 0.00 C ATOM 900 CD1 TRP A 60 0.607 -12.820 -7.456 1.00 0.00 C ATOM 901 CD2 TRP A 60 2.522 -12.944 -6.301 1.00 0.00 C ATOM 902 NE1 TRP A 60 0.368 -13.558 -6.322 1.00 0.00 N ATOM 903 CE2 TRP A 60 1.526 -13.650 -5.597 1.00 0.00 C ATOM 904 CE3 TRP A 60 3.812 -12.886 -5.766 1.00 0.00 C ATOM 905 CZ2 TRP A 60 1.782 -14.290 -4.388 1.00 0.00 C ATOM 906 CZ3 TRP A 60 4.064 -13.522 -4.565 1.00 0.00 C ATOM 907 CH2 TRP A 60 3.054 -14.217 -3.887 1.00 0.00 C ATOM 0 H TRP A 60 4.823 -12.670 -9.106 1.00 0.00 H new ATOM 0 HA TRP A 60 2.070 -13.101 -9.998 1.00 0.00 H new ATOM 0 HB2 TRP A 60 3.511 -11.195 -8.155 1.00 0.00 H new ATOM 0 HB3 TRP A 60 1.940 -10.749 -8.793 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -0.129 -12.589 -8.211 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -0.528 -13.971 -6.062 1.00 0.00 H new ATOM 0 HE3 TRP A 60 4.598 -12.354 -6.282 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 1.005 -14.825 -3.863 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 5.057 -13.483 -4.142 1.00 0.00 H new ATOM 0 HH2 TRP A 60 3.283 -14.705 -2.951 1.00 0.00 H new ATOM 918 N ASN A 61 4.033 -10.691 -11.119 1.00 0.00 N ATOM 919 CA ASN A 61 4.215 -9.744 -12.213 1.00 0.00 C ATOM 920 C ASN A 61 2.906 -9.031 -12.540 1.00 0.00 C ATOM 921 O ASN A 61 2.576 -8.826 -13.707 1.00 0.00 O ATOM 922 CB ASN A 61 4.742 -10.463 -13.456 1.00 0.00 C ATOM 923 CG ASN A 61 5.947 -11.333 -13.154 1.00 0.00 C ATOM 924 OD1 ASN A 61 6.664 -11.103 -12.180 1.00 0.00 O ATOM 925 ND2 ASN A 61 6.176 -12.338 -13.991 1.00 0.00 N ATOM 0 H ASN A 61 4.808 -10.724 -10.456 1.00 0.00 H new ATOM 0 HA ASN A 61 4.944 -8.998 -11.897 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.949 -11.080 -13.879 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.010 -9.726 -14.212 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.973 -12.957 -13.839 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.555 -12.491 -14.786 1.00 0.00 H new ATOM 932 N GLU A 62 2.167 -8.657 -11.500 1.00 0.00 N ATOM 933 CA GLU A 62 0.894 -7.968 -11.678 1.00 0.00 C ATOM 934 C GLU A 62 0.969 -6.541 -11.142 1.00 0.00 C ATOM 935 O GLU A 62 1.502 -6.301 -10.059 1.00 0.00 O ATOM 936 CB GLU A 62 -0.227 -8.732 -10.971 1.00 0.00 C ATOM 937 CG GLU A 62 -1.554 -7.990 -10.958 1.00 0.00 C ATOM 938 CD GLU A 62 -2.158 -7.850 -12.342 1.00 0.00 C ATOM 939 OE1 GLU A 62 -1.536 -7.186 -13.197 1.00 0.00 O ATOM 940 OE2 GLU A 62 -3.253 -8.406 -12.569 1.00 0.00 O ATOM 0 H GLU A 62 2.427 -8.819 -10.527 1.00 0.00 H new ATOM 0 HA GLU A 62 0.678 -7.926 -12.746 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.364 -9.696 -11.461 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.076 -8.937 -9.944 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.255 -8.518 -10.312 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.408 -6.999 -10.528 1.00 0.00 H new ATOM 947 N TRP A 63 0.432 -5.599 -11.909 1.00 0.00 N ATOM 948 CA TRP A 63 0.438 -4.195 -11.512 1.00 0.00 C ATOM 949 C TRP A 63 -0.730 -3.888 -10.581 1.00 0.00 C ATOM 950 O TRP A 63 -1.884 -3.842 -11.010 1.00 0.00 O ATOM 951 CB TRP A 63 0.372 -3.295 -12.746 1.00 0.00 C ATOM 952 CG TRP A 63 1.711 -3.046 -13.372 1.00 0.00 C ATOM 953 CD1 TRP A 63 2.297 -3.772 -14.369 1.00 0.00 C ATOM 954 CD2 TRP A 63 2.631 -2.000 -13.041 1.00 0.00 C ATOM 955 NE1 TRP A 63 3.526 -3.241 -14.678 1.00 0.00 N ATOM 956 CE2 TRP A 63 3.754 -2.153 -13.878 1.00 0.00 C ATOM 957 CE3 TRP A 63 2.615 -0.949 -12.121 1.00 0.00 C ATOM 958 CZ2 TRP A 63 4.848 -1.294 -13.819 1.00 0.00 C ATOM 959 CZ3 TRP A 63 3.702 -0.097 -12.063 1.00 0.00 C ATOM 960 CH2 TRP A 63 4.805 -0.273 -12.908 1.00 0.00 C ATOM 0 H TRP A 63 -0.013 -5.781 -12.809 1.00 0.00 H new ATOM 0 HA TRP A 63 1.367 -3.998 -10.977 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -0.287 -3.751 -13.485 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -0.074 -2.340 -12.467 1.00 0.00 H new ATOM 0 HD1 TRP A 63 1.859 -4.637 -14.845 1.00 0.00 H new ATOM 0 HE1 TRP A 63 4.165 -3.599 -15.388 1.00 0.00 H new ATOM 0 HE3 TRP A 63 1.768 -0.805 -11.466 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 5.700 -1.428 -14.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 3.701 0.718 -11.354 1.00 0.00 H new ATOM 0 HH2 TRP A 63 5.638 0.410 -12.840 1.00 0.00 H new ATOM 971 N LEU A 64 -0.424 -3.677 -9.305 1.00 0.00 N ATOM 972 CA LEU A 64 -1.449 -3.374 -8.313 1.00 0.00 C ATOM 973 C LEU A 64 -1.588 -1.867 -8.117 1.00 0.00 C ATOM 974 O LEU A 64 -0.630 -1.189 -7.749 1.00 0.00 O ATOM 975 CB LEU A 64 -1.111 -4.044 -6.980 1.00 0.00 C ATOM 976 CG LEU A 64 -2.303 -4.450 -6.112 1.00 0.00 C ATOM 977 CD1 LEU A 64 -3.191 -5.438 -6.852 1.00 0.00 C ATOM 978 CD2 LEU A 64 -1.825 -5.042 -4.794 1.00 0.00 C ATOM 0 H LEU A 64 0.525 -3.710 -8.934 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.399 -3.764 -8.678 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.516 -4.934 -7.184 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.482 -3.365 -6.404 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.891 -3.558 -5.895 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.034 -5.715 -6.218 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.562 -4.979 -7.768 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.615 -6.330 -7.100 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.686 -5.325 -4.189 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.214 -5.923 -4.991 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.232 -4.302 -4.257 1.00 0.00 H new ATOM 990 N ASN A 65 -2.788 -1.352 -8.363 1.00 0.00 N ATOM 991 CA ASN A 65 -3.053 0.075 -8.212 1.00 0.00 C ATOM 992 C ASN A 65 -3.680 0.370 -6.853 1.00 0.00 C ATOM 993 O ASN A 65 -4.528 -0.382 -6.372 1.00 0.00 O ATOM 994 CB ASN A 65 -3.975 0.565 -9.330 1.00 0.00 C ATOM 995 CG ASN A 65 -5.078 -0.427 -9.646 1.00 0.00 C ATOM 996 OD1 ASN A 65 -6.128 -0.429 -9.003 1.00 0.00 O ATOM 997 ND2 ASN A 65 -4.844 -1.276 -10.639 1.00 0.00 N ATOM 0 H ASN A 65 -3.592 -1.901 -8.668 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.103 0.605 -8.277 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.419 1.517 -9.040 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.386 0.748 -10.229 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.549 -1.966 -10.897 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -3.959 -1.238 -11.145 1.00 0.00 H new ATOM 1004 N TYR A 66 -3.259 1.471 -6.240 1.00 0.00 N ATOM 1005 CA TYR A 66 -3.778 1.866 -4.936 1.00 0.00 C ATOM 1006 C TYR A 66 -4.704 3.072 -5.061 1.00 0.00 C ATOM 1007 O TYR A 66 -4.323 4.107 -5.609 1.00 0.00 O ATOM 1008 CB TYR A 66 -2.627 2.188 -3.982 1.00 0.00 C ATOM 1009 CG TYR A 66 -1.895 0.964 -3.480 1.00 0.00 C ATOM 1010 CD1 TYR A 66 -0.929 0.340 -4.259 1.00 0.00 C ATOM 1011 CD2 TYR A 66 -2.169 0.432 -2.226 1.00 0.00 C ATOM 1012 CE1 TYR A 66 -0.258 -0.779 -3.805 1.00 0.00 C ATOM 1013 CE2 TYR A 66 -1.503 -0.686 -1.763 1.00 0.00 C ATOM 1014 CZ TYR A 66 -0.548 -1.288 -2.556 1.00 0.00 C ATOM 1015 OH TYR A 66 0.118 -2.402 -2.100 1.00 0.00 O ATOM 0 H TYR A 66 -2.560 2.106 -6.625 1.00 0.00 H new ATOM 0 HA TYR A 66 -4.352 1.031 -4.533 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -1.918 2.842 -4.489 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.018 2.742 -3.129 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.698 0.737 -5.237 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -2.916 0.901 -1.602 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.489 -1.253 -4.424 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -1.729 -1.087 -0.786 1.00 0.00 H new ATOM 0 HH TYR A 66 1.017 -2.428 -2.489 1.00 0.00 H new ATOM 1025 N ASP A 67 -5.921 2.931 -4.547 1.00 0.00 N ATOM 1026 CA ASP A 67 -6.902 4.008 -4.598 1.00 0.00 C ATOM 1027 C ASP A 67 -6.611 5.060 -3.532 1.00 0.00 C ATOM 1028 O ASP A 67 -7.514 5.510 -2.828 1.00 0.00 O ATOM 1029 CB ASP A 67 -8.314 3.451 -4.410 1.00 0.00 C ATOM 1030 CG ASP A 67 -9.364 4.281 -5.122 1.00 0.00 C ATOM 1031 OD1 ASP A 67 -9.092 4.740 -6.251 1.00 0.00 O ATOM 1032 OD2 ASP A 67 -10.458 4.470 -4.551 1.00 0.00 O ATOM 0 H ASP A 67 -6.251 2.081 -4.090 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.834 4.481 -5.578 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.350 2.427 -4.783 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -8.547 3.411 -3.346 1.00 0.00 H new ATOM 1037 N ILE A 68 -5.344 5.445 -3.420 1.00 0.00 N ATOM 1038 CA ILE A 68 -4.934 6.443 -2.440 1.00 0.00 C ATOM 1039 C ILE A 68 -4.464 7.724 -3.123 1.00 0.00 C ATOM 1040 O ILE A 68 -4.186 7.734 -4.322 1.00 0.00 O ATOM 1041 CB ILE A 68 -3.806 5.914 -1.535 1.00 0.00 C ATOM 1042 CG1 ILE A 68 -2.503 5.789 -2.328 1.00 0.00 C ATOM 1043 CG2 ILE A 68 -4.196 4.573 -0.932 1.00 0.00 C ATOM 1044 CD1 ILE A 68 -1.654 7.041 -2.297 1.00 0.00 C ATOM 0 H ILE A 68 -4.584 5.081 -3.995 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.809 6.660 -1.827 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.649 6.624 -0.723 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.923 4.957 -1.929 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.739 5.546 -3.364 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.389 4.212 -0.295 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.102 4.691 -0.338 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.377 3.854 -1.731 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.747 6.880 -2.879 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.216 7.872 -2.723 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.387 7.274 -1.266 1.00 0.00 H new ATOM 1056 N TYR A 69 -4.378 8.801 -2.351 1.00 0.00 N ATOM 1057 CA TYR A 69 -3.942 10.088 -2.881 1.00 0.00 C ATOM 1058 C TYR A 69 -2.667 10.559 -2.189 1.00 0.00 C ATOM 1059 O TYR A 69 -2.615 10.663 -0.963 1.00 0.00 O ATOM 1060 CB TYR A 69 -5.045 11.134 -2.709 1.00 0.00 C ATOM 1061 CG TYR A 69 -5.248 12.005 -3.928 1.00 0.00 C ATOM 1062 CD1 TYR A 69 -5.235 11.460 -5.206 1.00 0.00 C ATOM 1063 CD2 TYR A 69 -5.453 13.374 -3.801 1.00 0.00 C ATOM 1064 CE1 TYR A 69 -5.420 12.253 -6.322 1.00 0.00 C ATOM 1065 CE2 TYR A 69 -5.640 14.173 -4.912 1.00 0.00 C ATOM 1066 CZ TYR A 69 -5.622 13.608 -6.170 1.00 0.00 C ATOM 1067 OH TYR A 69 -5.807 14.402 -7.279 1.00 0.00 O ATOM 0 H TYR A 69 -4.604 8.809 -1.356 1.00 0.00 H new ATOM 0 HA TYR A 69 -3.732 9.962 -3.943 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -5.981 10.627 -2.475 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -4.803 11.768 -1.856 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.078 10.399 -5.329 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.466 13.820 -2.818 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -5.406 11.814 -7.308 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.800 15.235 -4.796 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.937 15.332 -6.998 1.00 0.00 H new ATOM 1077 N ILE A 70 -1.640 10.843 -2.984 1.00 0.00 N ATOM 1078 CA ILE A 70 -0.366 11.304 -2.449 1.00 0.00 C ATOM 1079 C ILE A 70 -0.561 12.489 -1.508 1.00 0.00 C ATOM 1080 O ILE A 70 -0.141 12.470 -0.351 1.00 0.00 O ATOM 1081 CB ILE A 70 0.603 11.711 -3.575 1.00 0.00 C ATOM 1082 CG1 ILE A 70 1.366 10.489 -4.087 1.00 0.00 C ATOM 1083 CG2 ILE A 70 1.570 12.778 -3.082 1.00 0.00 C ATOM 1084 CD1 ILE A 70 0.653 9.754 -5.200 1.00 0.00 C ATOM 0 H ILE A 70 -1.666 10.762 -4.000 1.00 0.00 H new ATOM 0 HA ILE A 70 0.064 10.470 -1.895 1.00 0.00 H new ATOM 0 HB ILE A 70 0.024 12.126 -4.400 1.00 0.00 H new ATOM 0 HG12 ILE A 70 2.347 10.806 -4.442 1.00 0.00 H new ATOM 0 HG13 ILE A 70 1.534 9.802 -3.258 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.248 13.055 -3.889 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.010 13.656 -2.761 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.145 12.388 -2.242 1.00 0.00 H new ATOM 0 HD11 ILE A 70 1.252 8.899 -5.514 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.317 9.407 -4.844 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.509 10.426 -6.046 1.00 0.00 H new ATOM 1096 N PRO A 71 -1.214 13.545 -2.014 1.00 0.00 N ATOM 1097 CA PRO A 71 -1.483 14.757 -1.235 1.00 0.00 C ATOM 1098 C PRO A 71 -2.512 14.524 -0.135 1.00 0.00 C ATOM 1099 O PRO A 71 -2.885 15.449 0.586 1.00 0.00 O ATOM 1100 CB PRO A 71 -2.028 15.736 -2.279 1.00 0.00 C ATOM 1101 CG PRO A 71 -2.602 14.870 -3.346 1.00 0.00 C ATOM 1102 CD PRO A 71 -1.743 13.636 -3.386 1.00 0.00 C ATOM 0 HA PRO A 71 -0.592 15.115 -0.718 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.786 16.391 -1.850 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -1.238 16.377 -2.671 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.639 14.616 -3.127 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.596 15.381 -4.309 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.322 12.752 -3.653 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -0.943 13.727 -4.120 1.00 0.00 H new ATOM 1110 N ASP A 72 -2.966 13.282 -0.010 1.00 0.00 N ATOM 1111 CA ASP A 72 -3.952 12.926 1.004 1.00 0.00 C ATOM 1112 C ASP A 72 -3.427 11.812 1.905 1.00 0.00 C ATOM 1113 O ASP A 72 -4.068 11.441 2.889 1.00 0.00 O ATOM 1114 CB ASP A 72 -5.261 12.490 0.344 1.00 0.00 C ATOM 1115 CG ASP A 72 -6.453 12.635 1.269 1.00 0.00 C ATOM 1116 OD1 ASP A 72 -6.578 13.698 1.913 1.00 0.00 O ATOM 1117 OD2 ASP A 72 -7.261 11.687 1.348 1.00 0.00 O ATOM 0 H ASP A 72 -2.667 12.504 -0.598 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.140 13.807 1.617 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.427 13.085 -0.554 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.176 11.451 0.026 1.00 0.00 H new ATOM 1122 N LEU A 73 -2.257 11.283 1.562 1.00 0.00 N ATOM 1123 CA LEU A 73 -1.646 10.211 2.339 1.00 0.00 C ATOM 1124 C LEU A 73 -0.873 10.772 3.528 1.00 0.00 C ATOM 1125 O LEU A 73 0.128 11.473 3.375 1.00 0.00 O ATOM 1126 CB LEU A 73 -0.713 9.382 1.455 1.00 0.00 C ATOM 1127 CG LEU A 73 -0.576 7.904 1.824 1.00 0.00 C ATOM 1128 CD1 LEU A 73 -0.079 7.754 3.253 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -1.903 7.183 1.640 1.00 0.00 C ATOM 0 H LEU A 73 -1.713 11.579 0.751 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.443 9.571 2.717 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.067 9.448 0.426 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.278 9.836 1.481 1.00 0.00 H new ATOM 0 HG LEU A 73 0.157 7.450 1.157 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.012 6.696 3.497 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.894 8.234 3.352 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.787 8.224 3.936 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.787 6.133 1.907 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -2.657 7.639 2.282 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.218 7.260 0.599 1.00 0.00 H new ATOM 1141 N PRO A 74 -1.345 10.457 4.744 1.00 0.00 N ATOM 1142 CA PRO A 74 -0.711 10.917 5.983 1.00 0.00 C ATOM 1143 C PRO A 74 0.639 10.251 6.226 1.00 0.00 C ATOM 1144 O PRO A 74 0.785 9.041 6.052 1.00 0.00 O ATOM 1145 CB PRO A 74 -1.712 10.508 7.066 1.00 0.00 C ATOM 1146 CG PRO A 74 -2.457 9.359 6.480 1.00 0.00 C ATOM 1147 CD PRO A 74 -2.532 9.625 5.002 1.00 0.00 C ATOM 0 HA PRO A 74 -0.500 11.986 5.960 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.204 10.222 7.987 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.384 11.330 7.315 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -1.945 8.418 6.682 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.454 9.279 6.913 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.507 8.700 4.426 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.452 10.144 4.733 1.00 0.00 H new ATOM 1155 N ARG A 75 1.623 11.048 6.630 1.00 0.00 N ATOM 1156 CA ARG A 75 2.961 10.535 6.896 1.00 0.00 C ATOM 1157 C ARG A 75 2.903 9.312 7.806 1.00 0.00 C ATOM 1158 O ARG A 75 3.583 8.315 7.566 1.00 0.00 O ATOM 1159 CB ARG A 75 3.828 11.620 7.537 1.00 0.00 C ATOM 1160 CG ARG A 75 4.537 12.508 6.528 1.00 0.00 C ATOM 1161 CD ARG A 75 3.550 13.354 5.739 1.00 0.00 C ATOM 1162 NE ARG A 75 3.121 14.534 6.485 1.00 0.00 N ATOM 1163 CZ ARG A 75 3.878 15.612 6.653 1.00 0.00 C ATOM 1164 NH1 ARG A 75 5.096 15.659 6.130 1.00 0.00 N ATOM 1165 NH2 ARG A 75 3.418 16.646 7.345 1.00 0.00 N ATOM 0 H ARG A 75 1.518 12.051 6.780 1.00 0.00 H new ATOM 0 HA ARG A 75 3.405 10.239 5.946 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.203 12.241 8.179 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.572 11.147 8.178 1.00 0.00 H new ATOM 0 HG2 ARG A 75 5.242 13.158 7.046 1.00 0.00 H new ATOM 0 HG3 ARG A 75 5.117 11.890 5.843 1.00 0.00 H new ATOM 0 HD2 ARG A 75 4.009 13.666 4.801 1.00 0.00 H new ATOM 0 HD3 ARG A 75 2.679 12.751 5.483 1.00 0.00 H new ATOM 0 HE ARG A 75 2.189 14.530 6.900 1.00 0.00 H new ATOM 0 HH11 ARG A 75 5.453 14.866 5.597 1.00 0.00 H new ATOM 0 HH12 ARG A 75 5.675 16.488 6.261 1.00 0.00 H new ATOM 0 HH21 ARG A 75 2.482 16.614 7.749 1.00 0.00 H new ATOM 0 HH22 ARG A 75 4.000 17.473 7.473 1.00 0.00 H new ATOM 1179 N ALA A 76 2.087 9.397 8.852 1.00 0.00 N ATOM 1180 CA ALA A 76 1.939 8.297 9.797 1.00 0.00 C ATOM 1181 C ALA A 76 1.608 6.994 9.076 1.00 0.00 C ATOM 1182 O ALA A 76 2.103 5.928 9.442 1.00 0.00 O ATOM 1183 CB ALA A 76 0.863 8.623 10.822 1.00 0.00 C ATOM 0 H ALA A 76 1.518 10.216 9.066 1.00 0.00 H new ATOM 0 HA ALA A 76 2.890 8.164 10.314 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.763 7.793 11.521 1.00 0.00 H new ATOM 0 HB2 ALA A 76 1.141 9.525 11.367 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.087 8.785 10.313 1.00 0.00 H new ATOM 1189 N ALA A 77 0.769 7.088 8.050 1.00 0.00 N ATOM 1190 CA ALA A 77 0.373 5.917 7.277 1.00 0.00 C ATOM 1191 C ALA A 77 1.568 5.310 6.549 1.00 0.00 C ATOM 1192 O ALA A 77 2.569 5.986 6.310 1.00 0.00 O ATOM 1193 CB ALA A 77 -0.721 6.284 6.285 1.00 0.00 C ATOM 0 H ALA A 77 0.350 7.963 7.735 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.015 5.170 7.969 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.007 5.400 5.715 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.589 6.664 6.824 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.352 7.051 5.604 1.00 0.00 H new ATOM 1199 N ARG A 78 1.456 4.033 6.200 1.00 0.00 N ATOM 1200 CA ARG A 78 2.529 3.335 5.501 1.00 0.00 C ATOM 1201 C ARG A 78 1.974 2.193 4.656 1.00 0.00 C ATOM 1202 O ARG A 78 0.770 1.931 4.660 1.00 0.00 O ATOM 1203 CB ARG A 78 3.551 2.794 6.502 1.00 0.00 C ATOM 1204 CG ARG A 78 3.009 1.681 7.383 1.00 0.00 C ATOM 1205 CD ARG A 78 2.228 2.236 8.564 1.00 0.00 C ATOM 1206 NE ARG A 78 3.107 2.746 9.612 1.00 0.00 N ATOM 1207 CZ ARG A 78 3.648 1.982 10.554 1.00 0.00 C ATOM 1208 NH1 ARG A 78 3.401 0.680 10.579 1.00 0.00 N ATOM 1209 NH2 ARG A 78 4.439 2.521 11.474 1.00 0.00 N ATOM 0 H ARG A 78 0.633 3.460 6.390 1.00 0.00 H new ATOM 0 HA ARG A 78 3.022 4.047 4.839 1.00 0.00 H new ATOM 0 HB2 ARG A 78 4.420 2.425 5.958 1.00 0.00 H new ATOM 0 HB3 ARG A 78 3.895 3.612 7.135 1.00 0.00 H new ATOM 0 HG2 ARG A 78 2.364 1.030 6.793 1.00 0.00 H new ATOM 0 HG3 ARG A 78 3.834 1.069 7.746 1.00 0.00 H new ATOM 0 HD2 ARG A 78 1.572 3.036 8.221 1.00 0.00 H new ATOM 0 HD3 ARG A 78 1.589 1.454 8.975 1.00 0.00 H new ATOM 0 HE ARG A 78 3.317 3.744 9.621 1.00 0.00 H new ATOM 0 HH11 ARG A 78 2.794 0.262 9.874 1.00 0.00 H new ATOM 0 HH12 ARG A 78 3.818 0.096 11.304 1.00 0.00 H new ATOM 0 HH21 ARG A 78 4.632 3.523 11.458 1.00 0.00 H new ATOM 0 HH22 ARG A 78 4.854 1.934 12.197 1.00 0.00 H new ATOM 1223 N LEU A 79 2.858 1.515 3.932 1.00 0.00 N ATOM 1224 CA LEU A 79 2.457 0.400 3.081 1.00 0.00 C ATOM 1225 C LEU A 79 2.595 -0.926 3.821 1.00 0.00 C ATOM 1226 O LEU A 79 3.564 -1.145 4.548 1.00 0.00 O ATOM 1227 CB LEU A 79 3.301 0.376 1.806 1.00 0.00 C ATOM 1228 CG LEU A 79 2.995 -0.750 0.819 1.00 0.00 C ATOM 1229 CD1 LEU A 79 1.590 -0.599 0.256 1.00 0.00 C ATOM 1230 CD2 LEU A 79 4.022 -0.770 -0.304 1.00 0.00 C ATOM 0 H LEU A 79 3.857 1.718 3.917 1.00 0.00 H new ATOM 0 HA LEU A 79 1.410 0.538 2.813 1.00 0.00 H new ATOM 0 HB2 LEU A 79 3.172 1.328 1.291 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.351 0.307 2.091 1.00 0.00 H new ATOM 0 HG LEU A 79 3.051 -1.699 1.352 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.390 -1.409 -0.445 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.866 -0.636 1.070 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.506 0.357 -0.261 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.788 -1.578 -0.997 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.999 0.182 -0.835 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.016 -0.928 0.115 1.00 0.00 H new ATOM 1242 N CYS A 80 1.621 -1.809 3.629 1.00 0.00 N ATOM 1243 CA CYS A 80 1.634 -3.116 4.277 1.00 0.00 C ATOM 1244 C CYS A 80 1.396 -4.229 3.262 1.00 0.00 C ATOM 1245 O CYS A 80 0.654 -4.053 2.294 1.00 0.00 O ATOM 1246 CB CYS A 80 0.571 -3.174 5.375 1.00 0.00 C ATOM 1247 SG CYS A 80 0.843 -2.007 6.729 1.00 0.00 S ATOM 0 H CYS A 80 0.812 -1.644 3.030 1.00 0.00 H new ATOM 0 HA CYS A 80 2.617 -3.262 4.725 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -0.405 -2.978 4.931 1.00 0.00 H new ATOM 0 HB3 CYS A 80 0.539 -4.185 5.782 1.00 0.00 H new ATOM 0 HG CYS A 80 -0.303 -1.622 7.207 1.00 0.00 H new ATOM 1253 N LEU A 81 2.030 -5.374 3.487 1.00 0.00 N ATOM 1254 CA LEU A 81 1.889 -6.516 2.591 1.00 0.00 C ATOM 1255 C LEU A 81 2.166 -7.823 3.327 1.00 0.00 C ATOM 1256 O LEU A 81 3.115 -7.920 4.105 1.00 0.00 O ATOM 1257 CB LEU A 81 2.840 -6.376 1.401 1.00 0.00 C ATOM 1258 CG LEU A 81 4.108 -5.559 1.647 1.00 0.00 C ATOM 1259 CD1 LEU A 81 5.261 -6.099 0.814 1.00 0.00 C ATOM 1260 CD2 LEU A 81 3.865 -4.090 1.336 1.00 0.00 C ATOM 0 H LEU A 81 2.647 -5.536 4.283 1.00 0.00 H new ATOM 0 HA LEU A 81 0.862 -6.536 2.227 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.133 -7.374 1.076 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.293 -5.920 0.576 1.00 0.00 H new ATOM 0 HG LEU A 81 4.375 -5.647 2.700 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.155 -5.505 1.002 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.451 -7.137 1.086 1.00 0.00 H new ATOM 0 HD13 LEU A 81 5.004 -6.042 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.779 -3.524 1.517 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.572 -3.983 0.291 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.069 -3.709 1.976 1.00 0.00 H new ATOM 1272 N SER A 82 1.332 -8.827 3.074 1.00 0.00 N ATOM 1273 CA SER A 82 1.487 -10.128 3.714 1.00 0.00 C ATOM 1274 C SER A 82 1.117 -11.253 2.753 1.00 0.00 C ATOM 1275 O SER A 82 0.148 -11.148 2.000 1.00 0.00 O ATOM 1276 CB SER A 82 0.617 -10.209 4.970 1.00 0.00 C ATOM 1277 OG SER A 82 0.803 -9.070 5.793 1.00 0.00 O ATOM 0 H SER A 82 0.543 -8.764 2.431 1.00 0.00 H new ATOM 0 HA SER A 82 2.533 -10.244 3.997 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.432 -10.288 4.685 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.864 -11.111 5.530 1.00 0.00 H new ATOM 0 HG SER A 82 0.505 -9.273 6.704 1.00 0.00 H new ATOM 1283 N ILE A 83 1.895 -12.330 2.784 1.00 0.00 N ATOM 1284 CA ILE A 83 1.649 -13.475 1.917 1.00 0.00 C ATOM 1285 C ILE A 83 0.696 -14.468 2.574 1.00 0.00 C ATOM 1286 O ILE A 83 0.700 -14.632 3.794 1.00 0.00 O ATOM 1287 CB ILE A 83 2.960 -14.200 1.557 1.00 0.00 C ATOM 1288 CG1 ILE A 83 3.966 -13.215 0.959 1.00 0.00 C ATOM 1289 CG2 ILE A 83 2.685 -15.340 0.587 1.00 0.00 C ATOM 1290 CD1 ILE A 83 5.354 -13.792 0.798 1.00 0.00 C ATOM 0 H ILE A 83 2.701 -12.433 3.400 1.00 0.00 H new ATOM 0 HA ILE A 83 1.194 -13.088 1.005 1.00 0.00 H new ATOM 0 HB ILE A 83 3.388 -14.619 2.468 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.604 -12.884 -0.014 1.00 0.00 H new ATOM 0 HG13 ILE A 83 4.020 -12.332 1.596 1.00 0.00 H new ATOM 0 HG21 ILE A 83 3.621 -15.843 0.342 1.00 0.00 H new ATOM 0 HG22 ILE A 83 2.000 -16.052 1.047 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.237 -14.943 -0.324 1.00 0.00 H new ATOM 0 HD11 ILE A 83 6.014 -13.038 0.369 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.737 -14.097 1.772 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.314 -14.658 0.137 1.00 0.00 H new ATOM 1302 N CYS A 84 -0.117 -15.128 1.757 1.00 0.00 N ATOM 1303 CA CYS A 84 -1.076 -16.106 2.259 1.00 0.00 C ATOM 1304 C CYS A 84 -1.262 -17.246 1.262 1.00 0.00 C ATOM 1305 O CYS A 84 -1.065 -17.070 0.060 1.00 0.00 O ATOM 1306 CB CYS A 84 -2.421 -15.435 2.541 1.00 0.00 C ATOM 1307 SG CYS A 84 -2.364 -14.191 3.852 1.00 0.00 S ATOM 0 H CYS A 84 -0.132 -15.004 0.745 1.00 0.00 H new ATOM 0 HA CYS A 84 -0.683 -16.520 3.188 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -2.780 -14.966 1.625 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.147 -16.201 2.813 1.00 0.00 H new ATOM 0 HG CYS A 84 -1.154 -14.108 4.319 1.00 0.00 H new ATOM 1313 N SER A 85 -1.640 -18.414 1.771 1.00 0.00 N ATOM 1314 CA SER A 85 -1.847 -19.584 0.926 1.00 0.00 C ATOM 1315 C SER A 85 -3.313 -20.008 0.934 1.00 0.00 C ATOM 1316 O SER A 85 -3.883 -20.290 1.988 1.00 0.00 O ATOM 1317 CB SER A 85 -0.967 -20.743 1.399 1.00 0.00 C ATOM 1318 OG SER A 85 0.397 -20.361 1.447 1.00 0.00 O ATOM 0 H SER A 85 -1.809 -18.575 2.764 1.00 0.00 H new ATOM 0 HA SER A 85 -1.569 -19.318 -0.094 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.291 -21.070 2.387 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.087 -21.593 0.727 1.00 0.00 H new ATOM 0 HG SER A 85 0.938 -21.118 1.754 1.00 0.00 H new ATOM 1324 N VAL A 86 -3.917 -20.049 -0.249 1.00 0.00 N ATOM 1325 CA VAL A 86 -5.316 -20.439 -0.380 1.00 0.00 C ATOM 1326 C VAL A 86 -5.442 -21.863 -0.911 1.00 0.00 C ATOM 1327 O VAL A 86 -4.862 -22.208 -1.940 1.00 0.00 O ATOM 1328 CB VAL A 86 -6.079 -19.484 -1.317 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -5.462 -19.494 -2.708 1.00 0.00 C ATOM 1330 CG2 VAL A 86 -7.552 -19.861 -1.376 1.00 0.00 C ATOM 0 H VAL A 86 -3.460 -19.817 -1.131 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.754 -20.386 0.617 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.001 -18.472 -0.918 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.014 -18.813 -3.356 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.422 -19.173 -2.647 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.507 -20.503 -3.119 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.076 -19.176 -2.042 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.652 -20.880 -1.751 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.984 -19.798 -0.377 1.00 0.00 H new ATOM 1340 N LYS A 87 -6.205 -22.687 -0.201 1.00 0.00 N ATOM 1341 CA LYS A 87 -6.411 -24.074 -0.600 1.00 0.00 C ATOM 1342 C LYS A 87 -7.850 -24.508 -0.340 1.00 0.00 C ATOM 1343 O LYS A 87 -8.404 -24.247 0.727 1.00 0.00 O ATOM 1344 CB LYS A 87 -5.447 -24.992 0.155 1.00 0.00 C ATOM 1345 CG LYS A 87 -5.738 -26.470 -0.036 1.00 0.00 C ATOM 1346 CD LYS A 87 -5.353 -26.938 -1.430 1.00 0.00 C ATOM 1347 CE LYS A 87 -5.802 -28.370 -1.680 1.00 0.00 C ATOM 1348 NZ LYS A 87 -5.166 -29.325 -0.731 1.00 0.00 N ATOM 0 H LYS A 87 -6.691 -22.418 0.654 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.215 -24.150 -1.669 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.429 -24.785 -0.175 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.492 -24.756 1.218 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.190 -27.049 0.708 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -6.798 -26.658 0.132 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -5.802 -26.279 -2.173 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.272 -26.867 -1.553 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.886 -28.432 -1.586 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -5.554 -28.655 -2.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -5.417 -30.298 -0.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -4.133 -29.212 -0.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -5.503 -29.132 0.234 1.00 0.00 H new ATOM 1454 N GLU A 94 -12.580 -22.477 0.235 1.00 0.00 N ATOM 1455 CA GLU A 94 -11.131 -22.473 0.391 1.00 0.00 C ATOM 1456 C GLU A 94 -10.732 -21.917 1.755 1.00 0.00 C ATOM 1457 O GLU A 94 -11.560 -21.360 2.475 1.00 0.00 O ATOM 1458 CB GLU A 94 -10.478 -21.648 -0.720 1.00 0.00 C ATOM 1459 CG GLU A 94 -10.886 -22.079 -2.118 1.00 0.00 C ATOM 1460 CD GLU A 94 -12.180 -21.434 -2.574 1.00 0.00 C ATOM 1461 OE1 GLU A 94 -12.161 -20.227 -2.895 1.00 0.00 O ATOM 1462 OE2 GLU A 94 -13.212 -22.136 -2.609 1.00 0.00 O ATOM 0 HA GLU A 94 -10.781 -23.503 0.322 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -10.738 -20.598 -0.582 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.395 -21.723 -0.628 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.091 -21.824 -2.819 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -10.997 -23.163 -2.142 1.00 0.00 H new ATOM 1469 N GLU A 95 -9.458 -22.073 2.101 1.00 0.00 N ATOM 1470 CA GLU A 95 -8.950 -21.587 3.379 1.00 0.00 C ATOM 1471 C GLU A 95 -7.726 -20.698 3.175 1.00 0.00 C ATOM 1472 O GLU A 95 -6.820 -21.035 2.412 1.00 0.00 O ATOM 1473 CB GLU A 95 -8.593 -22.762 4.291 1.00 0.00 C ATOM 1474 CG GLU A 95 -8.704 -22.439 5.772 1.00 0.00 C ATOM 1475 CD GLU A 95 -7.408 -21.904 6.350 1.00 0.00 C ATOM 1476 OE1 GLU A 95 -6.380 -22.606 6.252 1.00 0.00 O ATOM 1477 OE2 GLU A 95 -7.422 -20.784 6.901 1.00 0.00 O ATOM 0 H GLU A 95 -8.760 -22.531 1.515 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.734 -20.995 3.851 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.249 -23.602 4.061 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.575 -23.084 4.073 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.495 -21.704 5.922 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.996 -23.338 6.315 1.00 0.00 H new ATOM 1484 N HIS A 96 -7.708 -19.560 3.862 1.00 0.00 N ATOM 1485 CA HIS A 96 -6.596 -18.621 3.758 1.00 0.00 C ATOM 1486 C HIS A 96 -5.751 -18.637 5.028 1.00 0.00 C ATOM 1487 O HIS A 96 -6.266 -18.446 6.130 1.00 0.00 O ATOM 1488 CB HIS A 96 -7.117 -17.208 3.495 1.00 0.00 C ATOM 1489 CG HIS A 96 -7.825 -17.065 2.183 1.00 0.00 C ATOM 1490 ND1 HIS A 96 -7.830 -15.895 1.454 1.00 0.00 N ATOM 1491 CD2 HIS A 96 -8.554 -17.955 1.468 1.00 0.00 C ATOM 1492 CE1 HIS A 96 -8.532 -16.070 0.348 1.00 0.00 C ATOM 1493 NE2 HIS A 96 -8.982 -17.312 0.333 1.00 0.00 N ATOM 0 H HIS A 96 -8.450 -19.266 4.496 1.00 0.00 H new ATOM 0 HA HIS A 96 -5.969 -18.930 2.922 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -7.797 -16.925 4.298 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -6.281 -16.510 3.525 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -8.760 -18.980 1.740 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -8.708 -15.325 -0.414 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -9.555 -17.726 -0.403 1.00 0.00 H new ATOM 1502 N CYS A 97 -4.452 -18.866 4.865 1.00 0.00 N ATOM 1503 CA CYS A 97 -3.536 -18.907 5.999 1.00 0.00 C ATOM 1504 C CYS A 97 -2.330 -18.005 5.757 1.00 0.00 C ATOM 1505 O CYS A 97 -1.634 -18.115 4.747 1.00 0.00 O ATOM 1506 CB CYS A 97 -3.072 -20.342 6.254 1.00 0.00 C ATOM 1507 SG CYS A 97 -2.587 -20.669 7.965 1.00 0.00 S ATOM 0 H CYS A 97 -4.010 -19.026 3.960 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.068 -18.543 6.878 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.874 -21.026 5.978 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.228 -20.561 5.600 1.00 0.00 H new ATOM 0 HG CYS A 97 -2.213 -21.909 8.081 1.00 0.00 H new ATOM 1513 N PRO A 98 -2.076 -17.090 6.704 1.00 0.00 N ATOM 1514 CA PRO A 98 -0.954 -16.150 6.615 1.00 0.00 C ATOM 1515 C PRO A 98 0.395 -16.840 6.782 1.00 0.00 C ATOM 1516 O PRO A 98 0.497 -17.875 7.442 1.00 0.00 O ATOM 1517 CB PRO A 98 -1.209 -15.184 7.775 1.00 0.00 C ATOM 1518 CG PRO A 98 -2.014 -15.970 8.752 1.00 0.00 C ATOM 1519 CD PRO A 98 -2.863 -16.902 7.934 1.00 0.00 C ATOM 0 HA PRO A 98 -0.905 -15.664 5.641 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.274 -14.841 8.218 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.748 -14.297 7.441 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.368 -16.526 9.432 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -2.633 -15.314 9.365 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -3.034 -17.847 8.450 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -3.842 -16.472 7.723 1.00 0.00 H new ATOM 1527 N LEU A 99 1.429 -16.261 6.181 1.00 0.00 N ATOM 1528 CA LEU A 99 2.773 -16.820 6.264 1.00 0.00 C ATOM 1529 C LEU A 99 3.757 -15.794 6.817 1.00 0.00 C ATOM 1530 O LEU A 99 4.514 -16.082 7.744 1.00 0.00 O ATOM 1531 CB LEU A 99 3.235 -17.295 4.885 1.00 0.00 C ATOM 1532 CG LEU A 99 2.196 -18.044 4.050 1.00 0.00 C ATOM 1533 CD1 LEU A 99 2.787 -18.462 2.712 1.00 0.00 C ATOM 1534 CD2 LEU A 99 1.676 -19.256 4.808 1.00 0.00 C ATOM 0 H LEU A 99 1.362 -15.405 5.631 1.00 0.00 H new ATOM 0 HA LEU A 99 2.744 -17.671 6.944 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.571 -16.427 4.318 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.101 -17.943 5.018 1.00 0.00 H new ATOM 0 HG LEU A 99 1.358 -17.373 3.860 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.033 -18.994 2.131 1.00 0.00 H new ATOM 0 HD12 LEU A 99 3.109 -17.577 2.164 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.643 -19.116 2.881 1.00 0.00 H new ATOM 0 HD21 LEU A 99 0.938 -19.777 4.199 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.504 -19.929 5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.213 -18.931 5.740 1.00 0.00 H new ATOM 1546 N ALA A 100 3.738 -14.595 6.244 1.00 0.00 N ATOM 1547 CA ALA A 100 4.625 -13.525 6.682 1.00 0.00 C ATOM 1548 C ALA A 100 3.938 -12.167 6.584 1.00 0.00 C ATOM 1549 O ALA A 100 2.820 -12.062 6.079 1.00 0.00 O ATOM 1550 CB ALA A 100 5.906 -13.531 5.861 1.00 0.00 C ATOM 0 H ALA A 100 3.118 -14.341 5.475 1.00 0.00 H new ATOM 0 HA ALA A 100 4.876 -13.701 7.728 1.00 0.00 H new ATOM 0 HB1 ALA A 100 6.559 -12.726 6.199 1.00 0.00 H new ATOM 0 HB2 ALA A 100 6.414 -14.487 5.986 1.00 0.00 H new ATOM 0 HB3 ALA A 100 5.664 -13.384 4.808 1.00 0.00 H new ATOM 1556 N TRP A 101 4.612 -11.131 7.069 1.00 0.00 N ATOM 1557 CA TRP A 101 4.065 -9.780 7.036 1.00 0.00 C ATOM 1558 C TRP A 101 5.180 -8.743 6.961 1.00 0.00 C ATOM 1559 O TRP A 101 6.168 -8.826 7.688 1.00 0.00 O ATOM 1560 CB TRP A 101 3.200 -9.527 8.272 1.00 0.00 C ATOM 1561 CG TRP A 101 3.952 -9.662 9.561 1.00 0.00 C ATOM 1562 CD1 TRP A 101 4.108 -10.798 10.304 1.00 0.00 C ATOM 1563 CD2 TRP A 101 4.648 -8.625 10.260 1.00 0.00 C ATOM 1564 NE1 TRP A 101 4.859 -10.528 11.423 1.00 0.00 N ATOM 1565 CE2 TRP A 101 5.204 -9.202 11.418 1.00 0.00 C ATOM 1566 CE3 TRP A 101 4.858 -7.264 10.019 1.00 0.00 C ATOM 1567 CZ2 TRP A 101 5.953 -8.465 12.331 1.00 0.00 C ATOM 1568 CZ3 TRP A 101 5.601 -6.534 10.926 1.00 0.00 C ATOM 1569 CH2 TRP A 101 6.142 -7.135 12.070 1.00 0.00 C ATOM 0 H TRP A 101 5.538 -11.201 7.490 1.00 0.00 H new ATOM 0 HA TRP A 101 3.447 -9.687 6.143 1.00 0.00 H new ATOM 0 HB2 TRP A 101 2.775 -8.525 8.211 1.00 0.00 H new ATOM 0 HB3 TRP A 101 2.365 -10.228 8.272 1.00 0.00 H new ATOM 0 HD1 TRP A 101 3.701 -11.766 10.050 1.00 0.00 H new ATOM 0 HE1 TRP A 101 5.118 -11.205 12.141 1.00 0.00 H new ATOM 0 HE3 TRP A 101 4.447 -6.792 9.139 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.370 -8.926 13.214 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 5.768 -5.482 10.750 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.720 -6.537 12.759 1.00 0.00 H new ATOM 1580 N GLY A 102 5.014 -7.765 6.075 1.00 0.00 N ATOM 1581 CA GLY A 102 6.015 -6.726 5.921 1.00 0.00 C ATOM 1582 C GLY A 102 5.402 -5.361 5.677 1.00 0.00 C ATOM 1583 O GLY A 102 4.502 -5.217 4.850 1.00 0.00 O ATOM 0 H GLY A 102 4.204 -7.674 5.462 1.00 0.00 H new ATOM 0 HA2 GLY A 102 6.635 -6.688 6.817 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.672 -6.980 5.089 1.00 0.00 H new ATOM 1587 N ASN A 103 5.888 -4.357 6.399 1.00 0.00 N ATOM 1588 CA ASN A 103 5.380 -2.998 6.258 1.00 0.00 C ATOM 1589 C ASN A 103 6.492 -2.042 5.838 1.00 0.00 C ATOM 1590 O ASN A 103 7.569 -2.027 6.435 1.00 0.00 O ATOM 1591 CB ASN A 103 4.755 -2.525 7.572 1.00 0.00 C ATOM 1592 CG ASN A 103 3.625 -3.427 8.032 1.00 0.00 C ATOM 1593 OD1 ASN A 103 3.483 -4.554 7.558 1.00 0.00 O ATOM 1594 ND2 ASN A 103 2.815 -2.932 8.961 1.00 0.00 N ATOM 0 H ASN A 103 6.633 -4.459 7.088 1.00 0.00 H new ATOM 0 HA ASN A 103 4.616 -3.002 5.481 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.524 -2.487 8.344 1.00 0.00 H new ATOM 0 HB3 ASN A 103 4.378 -1.510 7.447 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.037 -3.492 9.310 1.00 0.00 H new ATOM 0 HD22 ASN A 103 2.971 -1.992 9.325 1.00 0.00 H new ATOM 1601 N ILE A 104 6.224 -1.246 4.809 1.00 0.00 N ATOM 1602 CA ILE A 104 7.201 -0.286 4.311 1.00 0.00 C ATOM 1603 C ILE A 104 6.726 1.147 4.529 1.00 0.00 C ATOM 1604 O ILE A 104 5.596 1.494 4.189 1.00 0.00 O ATOM 1605 CB ILE A 104 7.486 -0.498 2.812 1.00 0.00 C ATOM 1606 CG1 ILE A 104 7.906 -1.946 2.551 1.00 0.00 C ATOM 1607 CG2 ILE A 104 8.562 0.466 2.336 1.00 0.00 C ATOM 1608 CD1 ILE A 104 7.544 -2.440 1.168 1.00 0.00 C ATOM 0 H ILE A 104 5.338 -1.247 4.304 1.00 0.00 H new ATOM 0 HA ILE A 104 8.120 -0.451 4.874 1.00 0.00 H new ATOM 0 HB ILE A 104 6.573 -0.298 2.251 1.00 0.00 H new ATOM 0 HG12 ILE A 104 8.984 -2.034 2.689 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.436 -2.591 3.293 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.752 0.304 1.275 1.00 0.00 H new ATOM 0 HG22 ILE A 104 8.227 1.491 2.492 1.00 0.00 H new ATOM 0 HG23 ILE A 104 9.479 0.295 2.899 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.872 -3.473 1.053 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.464 -2.385 1.033 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.035 -1.818 0.419 1.00 0.00 H new ATOM 1620 N ASN A 105 7.597 1.974 5.097 1.00 0.00 N ATOM 1621 CA ASN A 105 7.266 3.370 5.359 1.00 0.00 C ATOM 1622 C ASN A 105 7.101 4.144 4.055 1.00 0.00 C ATOM 1623 O ASN A 105 8.077 4.616 3.472 1.00 0.00 O ATOM 1624 CB ASN A 105 8.354 4.021 6.216 1.00 0.00 C ATOM 1625 CG ASN A 105 8.109 3.832 7.701 1.00 0.00 C ATOM 1626 OD1 ASN A 105 6.968 3.696 8.141 1.00 0.00 O ATOM 1627 ND2 ASN A 105 9.184 3.824 8.481 1.00 0.00 N ATOM 0 H ASN A 105 8.537 1.702 5.385 1.00 0.00 H new ATOM 0 HA ASN A 105 6.320 3.398 5.900 1.00 0.00 H new ATOM 0 HB2 ASN A 105 9.323 3.596 5.953 1.00 0.00 H new ATOM 0 HB3 ASN A 105 8.401 5.086 5.991 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.082 3.702 9.488 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.111 3.940 8.073 1.00 0.00 H new ATOM 1634 N LEU A 106 5.858 4.270 3.602 1.00 0.00 N ATOM 1635 CA LEU A 106 5.563 4.988 2.367 1.00 0.00 C ATOM 1636 C LEU A 106 6.508 6.171 2.185 1.00 0.00 C ATOM 1637 O LEU A 106 7.014 6.412 1.089 1.00 0.00 O ATOM 1638 CB LEU A 106 4.113 5.475 2.371 1.00 0.00 C ATOM 1639 CG LEU A 106 3.074 4.493 1.827 1.00 0.00 C ATOM 1640 CD1 LEU A 106 1.671 5.056 1.992 1.00 0.00 C ATOM 1641 CD2 LEU A 106 3.354 4.174 0.366 1.00 0.00 C ATOM 0 H LEU A 106 5.039 3.884 4.071 1.00 0.00 H new ATOM 0 HA LEU A 106 5.707 4.301 1.533 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.840 5.732 3.394 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.057 6.393 1.786 1.00 0.00 H new ATOM 0 HG LEU A 106 3.142 3.568 2.399 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.945 4.344 1.600 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.472 5.232 3.049 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.589 5.996 1.446 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.605 3.474 -0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.314 5.092 -0.221 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.344 3.727 0.274 1.00 0.00 H new ATOM 1653 N PHE A 107 6.744 6.905 3.267 1.00 0.00 N ATOM 1654 CA PHE A 107 7.630 8.063 3.228 1.00 0.00 C ATOM 1655 C PHE A 107 8.948 7.763 3.936 1.00 0.00 C ATOM 1656 O PHE A 107 8.988 7.610 5.157 1.00 0.00 O ATOM 1657 CB PHE A 107 6.953 9.272 3.877 1.00 0.00 C ATOM 1658 CG PHE A 107 5.642 9.638 3.241 1.00 0.00 C ATOM 1659 CD1 PHE A 107 5.607 10.262 2.004 1.00 0.00 C ATOM 1660 CD2 PHE A 107 4.445 9.358 3.880 1.00 0.00 C ATOM 1661 CE1 PHE A 107 4.402 10.599 1.416 1.00 0.00 C ATOM 1662 CE2 PHE A 107 3.238 9.693 3.297 1.00 0.00 C ATOM 1663 CZ PHE A 107 3.216 10.315 2.064 1.00 0.00 C ATOM 0 H PHE A 107 6.334 6.719 4.182 1.00 0.00 H new ATOM 0 HA PHE A 107 7.842 8.292 2.184 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.789 9.062 4.934 1.00 0.00 H new ATOM 0 HB3 PHE A 107 7.626 10.128 3.822 1.00 0.00 H new ATOM 0 HD1 PHE A 107 6.532 10.488 1.494 1.00 0.00 H new ATOM 0 HD2 PHE A 107 4.456 8.872 4.845 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.388 11.084 0.451 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.312 9.469 3.805 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.273 10.579 1.608 1.00 0.00 H new ATOM 1673 N ASP A 108 10.023 7.681 3.160 1.00 0.00 N ATOM 1674 CA ASP A 108 11.344 7.400 3.712 1.00 0.00 C ATOM 1675 C ASP A 108 11.672 8.359 4.852 1.00 0.00 C ATOM 1676 O ASP A 108 10.852 9.198 5.227 1.00 0.00 O ATOM 1677 CB ASP A 108 12.409 7.504 2.619 1.00 0.00 C ATOM 1678 CG ASP A 108 12.589 8.924 2.120 1.00 0.00 C ATOM 1679 OD1 ASP A 108 12.230 9.864 2.860 1.00 0.00 O ATOM 1680 OD2 ASP A 108 13.089 9.096 0.989 1.00 0.00 O ATOM 0 H ASP A 108 10.006 7.805 2.148 1.00 0.00 H new ATOM 0 HA ASP A 108 11.337 6.384 4.107 1.00 0.00 H new ATOM 0 HB2 ASP A 108 13.359 7.134 3.005 1.00 0.00 H new ATOM 0 HB3 ASP A 108 12.132 6.861 1.784 1.00 0.00 H new ATOM 1685 N TYR A 109 12.874 8.228 5.401 1.00 0.00 N ATOM 1686 CA TYR A 109 13.309 9.081 6.501 1.00 0.00 C ATOM 1687 C TYR A 109 13.221 10.554 6.116 1.00 0.00 C ATOM 1688 O TYR A 109 12.860 11.402 6.933 1.00 0.00 O ATOM 1689 CB TYR A 109 14.742 8.733 6.907 1.00 0.00 C ATOM 1690 CG TYR A 109 15.794 9.453 6.094 1.00 0.00 C ATOM 1691 CD1 TYR A 109 16.146 9.006 4.826 1.00 0.00 C ATOM 1692 CD2 TYR A 109 16.436 10.580 6.593 1.00 0.00 C ATOM 1693 CE1 TYR A 109 17.107 9.660 4.079 1.00 0.00 C ATOM 1694 CE2 TYR A 109 17.397 11.241 5.852 1.00 0.00 C ATOM 1695 CZ TYR A 109 17.729 10.777 4.596 1.00 0.00 C ATOM 1696 OH TYR A 109 18.686 11.432 3.856 1.00 0.00 O ATOM 0 H TYR A 109 13.565 7.539 5.103 1.00 0.00 H new ATOM 0 HA TYR A 109 12.645 8.906 7.348 1.00 0.00 H new ATOM 0 HB2 TYR A 109 14.881 8.975 7.961 1.00 0.00 H new ATOM 0 HB3 TYR A 109 14.889 7.658 6.805 1.00 0.00 H new ATOM 0 HD1 TYR A 109 15.660 8.132 4.417 1.00 0.00 H new ATOM 0 HD2 TYR A 109 16.180 10.945 7.576 1.00 0.00 H new ATOM 0 HE1 TYR A 109 17.370 9.298 3.096 1.00 0.00 H new ATOM 0 HE2 TYR A 109 17.886 12.116 6.254 1.00 0.00 H new ATOM 0 HH TYR A 109 19.024 12.199 4.364 1.00 0.00 H new ATOM 1706 N THR A 110 13.553 10.853 4.864 1.00 0.00 N ATOM 1707 CA THR A 110 13.513 12.223 4.369 1.00 0.00 C ATOM 1708 C THR A 110 12.137 12.565 3.808 1.00 0.00 C ATOM 1709 O THR A 110 12.019 13.317 2.840 1.00 0.00 O ATOM 1710 CB THR A 110 14.572 12.457 3.275 1.00 0.00 C ATOM 1711 OG1 THR A 110 14.557 13.828 2.863 1.00 0.00 O ATOM 1712 CG2 THR A 110 14.318 11.559 2.074 1.00 0.00 C ATOM 0 H THR A 110 13.853 10.164 4.174 1.00 0.00 H new ATOM 0 HA THR A 110 13.729 12.872 5.218 1.00 0.00 H new ATOM 0 HB THR A 110 15.550 12.214 3.690 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.635 14.105 2.681 1.00 0.00 H new ATOM 0 HG21 THR A 110 15.079 11.743 1.315 1.00 0.00 H new ATOM 0 HG22 THR A 110 14.360 10.515 2.385 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.333 11.775 1.660 1.00 0.00 H new ATOM 1720 N ASP A 111 11.098 12.009 4.423 1.00 0.00 N ATOM 1721 CA ASP A 111 9.729 12.257 3.986 1.00 0.00 C ATOM 1722 C ASP A 111 9.658 12.388 2.468 1.00 0.00 C ATOM 1723 O ASP A 111 9.161 13.383 1.942 1.00 0.00 O ATOM 1724 CB ASP A 111 9.182 13.524 4.646 1.00 0.00 C ATOM 1725 CG ASP A 111 8.901 13.333 6.123 1.00 0.00 C ATOM 1726 OD1 ASP A 111 9.539 12.454 6.740 1.00 0.00 O ATOM 1727 OD2 ASP A 111 8.044 14.062 6.663 1.00 0.00 O ATOM 0 H ASP A 111 11.178 11.384 5.225 1.00 0.00 H new ATOM 0 HA ASP A 111 9.118 11.406 4.288 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.899 14.335 4.518 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.265 13.826 4.141 1.00 0.00 H new ATOM 1732 N THR A 112 10.161 11.375 1.768 1.00 0.00 N ATOM 1733 CA THR A 112 10.157 11.377 0.311 1.00 0.00 C ATOM 1734 C THR A 112 9.687 10.036 -0.240 1.00 0.00 C ATOM 1735 O THR A 112 10.395 9.032 -0.145 1.00 0.00 O ATOM 1736 CB THR A 112 11.555 11.690 -0.255 1.00 0.00 C ATOM 1737 OG1 THR A 112 11.971 12.995 0.162 1.00 0.00 O ATOM 1738 CG2 THR A 112 11.554 11.614 -1.774 1.00 0.00 C ATOM 0 H THR A 112 10.576 10.543 2.187 1.00 0.00 H new ATOM 0 HA THR A 112 9.464 12.158 -0.001 1.00 0.00 H new ATOM 0 HB THR A 112 12.253 10.946 0.129 1.00 0.00 H new ATOM 0 HG1 THR A 112 11.755 13.120 1.110 1.00 0.00 H new ATOM 0 HG21 THR A 112 12.552 11.839 -2.150 1.00 0.00 H new ATOM 0 HG22 THR A 112 11.265 10.611 -2.088 1.00 0.00 H new ATOM 0 HG23 THR A 112 10.844 12.338 -2.174 1.00 0.00 H new ATOM 1746 N LEU A 113 8.490 10.024 -0.816 1.00 0.00 N ATOM 1747 CA LEU A 113 7.925 8.805 -1.383 1.00 0.00 C ATOM 1748 C LEU A 113 9.018 7.928 -1.986 1.00 0.00 C ATOM 1749 O LEU A 113 9.937 8.423 -2.638 1.00 0.00 O ATOM 1750 CB LEU A 113 6.885 9.149 -2.451 1.00 0.00 C ATOM 1751 CG LEU A 113 5.536 9.651 -1.936 1.00 0.00 C ATOM 1752 CD1 LEU A 113 4.710 10.225 -3.076 1.00 0.00 C ATOM 1753 CD2 LEU A 113 4.780 8.529 -1.239 1.00 0.00 C ATOM 0 H LEU A 113 7.892 10.846 -0.903 1.00 0.00 H new ATOM 0 HA LEU A 113 7.441 8.251 -0.579 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.306 9.910 -3.108 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.712 8.262 -3.060 1.00 0.00 H new ATOM 0 HG LEU A 113 5.718 10.444 -1.211 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.753 10.577 -2.691 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.247 11.058 -3.531 1.00 0.00 H new ATOM 0 HD13 LEU A 113 4.537 9.452 -3.825 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.822 8.905 -0.879 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.609 7.714 -1.942 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.367 8.164 -0.396 1.00 0.00 H new ATOM 1765 N VAL A 114 8.911 6.621 -1.765 1.00 0.00 N ATOM 1766 CA VAL A 114 9.888 5.674 -2.289 1.00 0.00 C ATOM 1767 C VAL A 114 9.812 5.591 -3.809 1.00 0.00 C ATOM 1768 O VAL A 114 8.848 6.053 -4.419 1.00 0.00 O ATOM 1769 CB VAL A 114 9.679 4.268 -1.698 1.00 0.00 C ATOM 1770 CG1 VAL A 114 10.094 4.236 -0.235 1.00 0.00 C ATOM 1771 CG2 VAL A 114 8.231 3.832 -1.859 1.00 0.00 C ATOM 0 H VAL A 114 8.157 6.194 -1.226 1.00 0.00 H new ATOM 0 HA VAL A 114 10.872 6.040 -1.997 1.00 0.00 H new ATOM 0 HB VAL A 114 10.309 3.566 -2.245 1.00 0.00 H new ATOM 0 HG11 VAL A 114 9.939 3.234 0.165 1.00 0.00 H new ATOM 0 HG12 VAL A 114 11.148 4.502 -0.150 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.493 4.949 0.329 1.00 0.00 H new ATOM 0 HG21 VAL A 114 8.102 2.836 -1.436 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.580 4.535 -1.339 1.00 0.00 H new ATOM 0 HG23 VAL A 114 7.972 3.813 -2.918 1.00 0.00 H new ATOM 1781 N SER A 115 10.836 4.999 -4.416 1.00 0.00 N ATOM 1782 CA SER A 115 10.887 4.858 -5.866 1.00 0.00 C ATOM 1783 C SER A 115 11.856 3.750 -6.271 1.00 0.00 C ATOM 1784 O SER A 115 12.695 3.324 -5.478 1.00 0.00 O ATOM 1785 CB SER A 115 11.306 6.179 -6.514 1.00 0.00 C ATOM 1786 OG SER A 115 12.516 6.660 -5.956 1.00 0.00 O ATOM 0 H SER A 115 11.641 4.609 -3.926 1.00 0.00 H new ATOM 0 HA SER A 115 9.890 4.590 -6.215 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.428 6.038 -7.588 1.00 0.00 H new ATOM 0 HB3 SER A 115 10.519 6.920 -6.377 1.00 0.00 H new ATOM 0 HG SER A 115 12.763 7.504 -6.388 1.00 0.00 H new ATOM 1792 N GLY A 116 11.733 3.288 -7.511 1.00 0.00 N ATOM 1793 CA GLY A 116 12.603 2.235 -8.000 1.00 0.00 C ATOM 1794 C GLY A 116 12.346 0.907 -7.316 1.00 0.00 C ATOM 1795 O GLY A 116 12.067 0.860 -6.118 1.00 0.00 O ATOM 0 H GLY A 116 11.046 3.624 -8.186 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.461 2.120 -9.075 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.642 2.525 -7.845 1.00 0.00 H new ATOM 1799 N LYS A 117 12.439 -0.177 -8.079 1.00 0.00 N ATOM 1800 CA LYS A 117 12.214 -1.514 -7.540 1.00 0.00 C ATOM 1801 C LYS A 117 12.975 -1.708 -6.233 1.00 0.00 C ATOM 1802 O LYS A 117 14.044 -1.133 -6.035 1.00 0.00 O ATOM 1803 CB LYS A 117 12.645 -2.574 -8.556 1.00 0.00 C ATOM 1804 CG LYS A 117 11.956 -3.914 -8.366 1.00 0.00 C ATOM 1805 CD LYS A 117 12.253 -4.862 -9.516 1.00 0.00 C ATOM 1806 CE LYS A 117 13.493 -5.699 -9.243 1.00 0.00 C ATOM 1807 NZ LYS A 117 14.203 -6.066 -10.499 1.00 0.00 N ATOM 0 H LYS A 117 12.669 -0.156 -9.073 1.00 0.00 H new ATOM 0 HA LYS A 117 11.148 -1.624 -7.339 1.00 0.00 H new ATOM 0 HB2 LYS A 117 12.437 -2.207 -9.561 1.00 0.00 H new ATOM 0 HB3 LYS A 117 13.723 -2.716 -8.485 1.00 0.00 H new ATOM 0 HG2 LYS A 117 12.284 -4.363 -7.429 1.00 0.00 H new ATOM 0 HG3 LYS A 117 10.879 -3.763 -8.287 1.00 0.00 H new ATOM 0 HD2 LYS A 117 11.398 -5.519 -9.678 1.00 0.00 H new ATOM 0 HD3 LYS A 117 12.394 -4.290 -10.433 1.00 0.00 H new ATOM 0 HE2 LYS A 117 14.169 -5.144 -8.593 1.00 0.00 H new ATOM 0 HE3 LYS A 117 13.209 -6.605 -8.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 15.042 -6.636 -10.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 13.566 -6.617 -11.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 14.497 -5.202 -10.997 1.00 0.00 H new ATOM 1821 N MET A 118 12.416 -2.523 -5.344 1.00 0.00 N ATOM 1822 CA MET A 118 13.044 -2.795 -4.056 1.00 0.00 C ATOM 1823 C MET A 118 12.572 -4.132 -3.493 1.00 0.00 C ATOM 1824 O MET A 118 11.462 -4.579 -3.778 1.00 0.00 O ATOM 1825 CB MET A 118 12.731 -1.672 -3.065 1.00 0.00 C ATOM 1826 CG MET A 118 13.077 -2.018 -1.626 1.00 0.00 C ATOM 1827 SD MET A 118 13.305 -0.556 -0.596 1.00 0.00 S ATOM 1828 CE MET A 118 11.603 -0.123 -0.242 1.00 0.00 C ATOM 0 H MET A 118 11.530 -3.006 -5.492 1.00 0.00 H new ATOM 0 HA MET A 118 14.122 -2.845 -4.209 1.00 0.00 H new ATOM 0 HB2 MET A 118 13.280 -0.777 -3.357 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.670 -1.429 -3.127 1.00 0.00 H new ATOM 0 HG2 MET A 118 12.284 -2.635 -1.204 1.00 0.00 H new ATOM 0 HG3 MET A 118 13.989 -2.615 -1.609 1.00 0.00 H new ATOM 0 HE1 MET A 118 11.307 0.724 -0.861 1.00 0.00 H new ATOM 0 HE2 MET A 118 10.958 -0.975 -0.459 1.00 0.00 H new ATOM 0 HE3 MET A 118 11.507 0.146 0.810 1.00 0.00 H new ATOM 1838 N ALA A 119 13.423 -4.764 -2.691 1.00 0.00 N ATOM 1839 CA ALA A 119 13.093 -6.049 -2.087 1.00 0.00 C ATOM 1840 C ALA A 119 13.565 -6.112 -0.639 1.00 0.00 C ATOM 1841 O ALA A 119 14.705 -5.760 -0.331 1.00 0.00 O ATOM 1842 CB ALA A 119 13.704 -7.185 -2.894 1.00 0.00 C ATOM 0 H ALA A 119 14.346 -4.407 -2.445 1.00 0.00 H new ATOM 0 HA ALA A 119 12.008 -6.157 -2.093 1.00 0.00 H new ATOM 0 HB1 ALA A 119 13.449 -8.138 -2.431 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.313 -7.160 -3.911 1.00 0.00 H new ATOM 0 HB3 ALA A 119 14.788 -7.072 -2.919 1.00 0.00 H new ATOM 1848 N LEU A 120 12.683 -6.562 0.247 1.00 0.00 N ATOM 1849 CA LEU A 120 13.010 -6.670 1.665 1.00 0.00 C ATOM 1850 C LEU A 120 12.407 -7.935 2.267 1.00 0.00 C ATOM 1851 O LEU A 120 11.406 -8.453 1.775 1.00 0.00 O ATOM 1852 CB LEU A 120 12.504 -5.441 2.421 1.00 0.00 C ATOM 1853 CG LEU A 120 11.035 -5.077 2.204 1.00 0.00 C ATOM 1854 CD1 LEU A 120 10.148 -5.831 3.182 1.00 0.00 C ATOM 1855 CD2 LEU A 120 10.831 -3.575 2.345 1.00 0.00 C ATOM 0 H LEU A 120 11.736 -6.858 0.009 1.00 0.00 H new ATOM 0 HA LEU A 120 14.095 -6.725 1.759 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.664 -5.604 3.487 1.00 0.00 H new ATOM 0 HB3 LEU A 120 13.116 -4.586 2.134 1.00 0.00 H new ATOM 0 HG LEU A 120 10.754 -5.368 1.192 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.106 -5.559 3.012 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.272 -6.904 3.033 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.429 -5.572 4.203 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.780 -3.334 2.187 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.130 -3.260 3.345 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.438 -3.054 1.604 1.00 0.00 H new ATOM 1867 N ASN A 121 13.024 -8.427 3.337 1.00 0.00 N ATOM 1868 CA ASN A 121 12.547 -9.631 4.008 1.00 0.00 C ATOM 1869 C ASN A 121 11.286 -9.340 4.816 1.00 0.00 C ATOM 1870 O ASN A 121 11.074 -8.216 5.274 1.00 0.00 O ATOM 1871 CB ASN A 121 13.635 -10.194 4.925 1.00 0.00 C ATOM 1872 CG ASN A 121 14.863 -10.644 4.157 1.00 0.00 C ATOM 1873 OD1 ASN A 121 15.715 -9.832 3.796 1.00 0.00 O ATOM 1874 ND2 ASN A 121 14.958 -11.943 3.902 1.00 0.00 N ATOM 0 H ASN A 121 13.855 -8.011 3.758 1.00 0.00 H new ATOM 0 HA ASN A 121 12.306 -10.371 3.245 1.00 0.00 H new ATOM 0 HB2 ASN A 121 13.923 -9.434 5.652 1.00 0.00 H new ATOM 0 HB3 ASN A 121 13.232 -11.037 5.487 1.00 0.00 H new ATOM 0 HD21 ASN A 121 15.761 -12.304 3.388 1.00 0.00 H new ATOM 0 HD22 ASN A 121 14.228 -12.580 4.221 1.00 0.00 H new ATOM 1881 N LEU A 122 10.452 -10.360 4.988 1.00 0.00 N ATOM 1882 CA LEU A 122 9.211 -10.215 5.742 1.00 0.00 C ATOM 1883 C LEU A 122 9.275 -10.996 7.050 1.00 0.00 C ATOM 1884 O LEU A 122 9.817 -12.100 7.100 1.00 0.00 O ATOM 1885 CB LEU A 122 8.024 -10.695 4.905 1.00 0.00 C ATOM 1886 CG LEU A 122 8.074 -10.359 3.414 1.00 0.00 C ATOM 1887 CD1 LEU A 122 7.233 -11.343 2.616 1.00 0.00 C ATOM 1888 CD2 LEU A 122 7.601 -8.933 3.173 1.00 0.00 C ATOM 0 H LEU A 122 10.612 -11.296 4.616 1.00 0.00 H new ATOM 0 HA LEU A 122 9.078 -9.159 5.977 1.00 0.00 H new ATOM 0 HB2 LEU A 122 7.945 -11.777 5.011 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.113 -10.266 5.323 1.00 0.00 H new ATOM 0 HG LEU A 122 9.108 -10.440 3.078 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.281 -11.088 1.557 1.00 0.00 H new ATOM 0 HD12 LEU A 122 7.616 -12.353 2.764 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.198 -11.295 2.954 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.643 -8.711 2.107 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.575 -8.825 3.526 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.245 -8.240 3.714 1.00 0.00 H new ATOM 1900 N TRP A 123 8.716 -10.416 8.106 1.00 0.00 N ATOM 1901 CA TRP A 123 8.707 -11.059 9.415 1.00 0.00 C ATOM 1902 C TRP A 123 7.670 -12.176 9.466 1.00 0.00 C ATOM 1903 O TRP A 123 6.659 -12.148 8.765 1.00 0.00 O ATOM 1904 CB TRP A 123 8.420 -10.030 10.510 1.00 0.00 C ATOM 1905 CG TRP A 123 9.296 -8.816 10.429 1.00 0.00 C ATOM 1906 CD1 TRP A 123 9.204 -7.798 9.523 1.00 0.00 C ATOM 1907 CD2 TRP A 123 10.398 -8.496 11.285 1.00 0.00 C ATOM 1908 NE1 TRP A 123 10.183 -6.864 9.765 1.00 0.00 N ATOM 1909 CE2 TRP A 123 10.928 -7.269 10.841 1.00 0.00 C ATOM 1910 CE3 TRP A 123 10.988 -9.126 12.385 1.00 0.00 C ATOM 1911 CZ2 TRP A 123 12.018 -6.662 11.459 1.00 0.00 C ATOM 1912 CZ3 TRP A 123 12.070 -8.522 12.996 1.00 0.00 C ATOM 1913 CH2 TRP A 123 12.576 -7.300 12.533 1.00 0.00 C ATOM 0 H TRP A 123 8.263 -9.502 8.082 1.00 0.00 H new ATOM 0 HA TRP A 123 9.692 -11.495 9.585 1.00 0.00 H new ATOM 0 HB2 TRP A 123 7.377 -9.721 10.444 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.552 -10.500 11.484 1.00 0.00 H new ATOM 0 HD1 TRP A 123 8.470 -7.736 8.733 1.00 0.00 H new ATOM 0 HE1 TRP A 123 10.331 -6.008 9.230 1.00 0.00 H new ATOM 0 HE3 TRP A 123 10.605 -10.067 12.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 12.409 -5.720 11.103 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 12.534 -9.000 13.846 1.00 0.00 H new ATOM 0 HH2 TRP A 123 13.422 -6.853 13.033 1.00 0.00 H new ATOM 1924 N PRO A 124 7.925 -13.183 10.315 1.00 0.00 N ATOM 1925 CA PRO A 124 7.024 -14.328 10.478 1.00 0.00 C ATOM 1926 C PRO A 124 5.719 -13.945 11.168 1.00 0.00 C ATOM 1927 O PRO A 124 5.668 -12.979 11.930 1.00 0.00 O ATOM 1928 CB PRO A 124 7.830 -15.291 11.352 1.00 0.00 C ATOM 1929 CG PRO A 124 8.776 -14.420 12.104 1.00 0.00 C ATOM 1930 CD PRO A 124 9.111 -13.281 11.182 1.00 0.00 C ATOM 0 HA PRO A 124 6.724 -14.751 9.519 1.00 0.00 H new ATOM 0 HB2 PRO A 124 7.182 -15.848 12.029 1.00 0.00 H new ATOM 0 HB3 PRO A 124 8.363 -16.024 10.746 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.322 -14.056 13.026 1.00 0.00 H new ATOM 0 HG3 PRO A 124 9.673 -14.971 12.386 1.00 0.00 H new ATOM 0 HD2 PRO A 124 9.284 -12.356 11.732 1.00 0.00 H new ATOM 0 HD3 PRO A 124 10.014 -13.483 10.606 1.00 0.00 H new ATOM 1938 N VAL A 125 4.666 -14.710 10.898 1.00 0.00 N ATOM 1939 CA VAL A 125 3.361 -14.452 11.495 1.00 0.00 C ATOM 1940 C VAL A 125 3.207 -15.191 12.819 1.00 0.00 C ATOM 1941 O VAL A 125 3.382 -16.407 12.904 1.00 0.00 O ATOM 1942 CB VAL A 125 2.219 -14.870 10.550 1.00 0.00 C ATOM 1943 CG1 VAL A 125 0.867 -14.607 11.196 1.00 0.00 C ATOM 1944 CG2 VAL A 125 2.334 -14.141 9.220 1.00 0.00 C ATOM 0 H VAL A 125 4.691 -15.513 10.270 1.00 0.00 H new ATOM 0 HA VAL A 125 3.301 -13.378 11.673 1.00 0.00 H new ATOM 0 HB VAL A 125 2.302 -15.940 10.360 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.073 -14.909 10.513 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.788 -15.179 12.120 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.770 -13.544 11.418 1.00 0.00 H new ATOM 0 HG21 VAL A 125 1.519 -14.449 8.565 1.00 0.00 H new ATOM 0 HG22 VAL A 125 2.278 -13.066 9.389 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.288 -14.386 8.752 1.00 0.00 H new ATOM 2039 N LEU A 132 -5.330 -11.617 8.827 1.00 0.00 N ATOM 2040 CA LEU A 132 -4.306 -12.044 7.880 1.00 0.00 C ATOM 2041 C LEU A 132 -3.219 -10.983 7.740 1.00 0.00 C ATOM 2042 O LEU A 132 -2.045 -11.243 8.009 1.00 0.00 O ATOM 2043 CB LEU A 132 -4.934 -12.330 6.515 1.00 0.00 C ATOM 2044 CG LEU A 132 -6.153 -13.253 6.517 1.00 0.00 C ATOM 2045 CD1 LEU A 132 -7.045 -12.963 5.320 1.00 0.00 C ATOM 2046 CD2 LEU A 132 -5.719 -14.712 6.520 1.00 0.00 C ATOM 0 HA LEU A 132 -3.850 -12.957 8.262 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -5.223 -11.381 6.064 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -4.172 -12.769 5.872 1.00 0.00 H new ATOM 0 HG LEU A 132 -6.725 -13.063 7.425 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.907 -13.630 5.339 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.385 -11.928 5.362 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -6.483 -13.123 4.400 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -6.600 -15.354 6.521 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -5.123 -14.916 5.631 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -5.123 -14.912 7.410 1.00 0.00 H new ATOM 2058 N LEU A 133 -3.616 -9.788 7.319 1.00 0.00 N ATOM 2059 CA LEU A 133 -2.676 -8.686 7.145 1.00 0.00 C ATOM 2060 C LEU A 133 -2.366 -8.019 8.481 1.00 0.00 C ATOM 2061 O LEU A 133 -3.264 -7.763 9.282 1.00 0.00 O ATOM 2062 CB LEU A 133 -3.242 -7.656 6.167 1.00 0.00 C ATOM 2063 CG LEU A 133 -2.255 -6.612 5.645 1.00 0.00 C ATOM 2064 CD1 LEU A 133 -1.507 -7.143 4.432 1.00 0.00 C ATOM 2065 CD2 LEU A 133 -2.978 -5.317 5.304 1.00 0.00 C ATOM 0 H LEU A 133 -4.583 -9.557 7.092 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.750 -9.092 6.739 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -3.662 -8.188 5.313 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -4.066 -7.136 6.655 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.529 -6.403 6.430 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.809 -6.386 4.075 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.956 -8.042 4.709 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -2.219 -7.382 3.642 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -2.259 -4.586 4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.727 -5.510 4.536 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.466 -4.927 6.197 1.00 0.00 H new ATOM 2077 N ASN A 134 -1.088 -7.737 8.714 1.00 0.00 N ATOM 2078 CA ASN A 134 -0.659 -7.098 9.952 1.00 0.00 C ATOM 2079 C ASN A 134 -0.290 -5.637 9.711 1.00 0.00 C ATOM 2080 O ASN A 134 0.851 -5.304 9.389 1.00 0.00 O ATOM 2081 CB ASN A 134 0.535 -7.845 10.550 1.00 0.00 C ATOM 2082 CG ASN A 134 0.780 -7.477 12.000 1.00 0.00 C ATOM 2083 OD1 ASN A 134 -0.024 -6.781 12.620 1.00 0.00 O ATOM 2084 ND2 ASN A 134 1.897 -7.942 12.548 1.00 0.00 N ATOM 0 H ASN A 134 -0.331 -7.941 8.061 1.00 0.00 H new ATOM 0 HA ASN A 134 -1.490 -7.133 10.656 1.00 0.00 H new ATOM 0 HB2 ASN A 134 0.363 -8.919 10.475 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.428 -7.623 9.966 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.117 -7.726 13.520 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.535 -8.516 11.997 1.00 0.00 H new ATOM 2091 N PRO A 135 -1.278 -4.743 9.870 1.00 0.00 N ATOM 2092 CA PRO A 135 -1.081 -3.304 9.676 1.00 0.00 C ATOM 2093 C PRO A 135 -0.212 -2.685 10.766 1.00 0.00 C ATOM 2094 O PRO A 135 0.689 -1.896 10.480 1.00 0.00 O ATOM 2095 CB PRO A 135 -2.503 -2.740 9.740 1.00 0.00 C ATOM 2096 CG PRO A 135 -3.264 -3.726 10.557 1.00 0.00 C ATOM 2097 CD PRO A 135 -2.662 -5.069 10.253 1.00 0.00 C ATOM 0 HA PRO A 135 -0.563 -3.086 8.742 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.517 -1.751 10.199 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -2.933 -2.635 8.744 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -3.186 -3.495 11.619 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.324 -3.707 10.304 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.694 -5.729 11.120 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.194 -5.575 9.447 1.00 0.00 H new ATOM 2105 N ILE A 136 -0.489 -3.048 12.013 1.00 0.00 N ATOM 2106 CA ILE A 136 0.269 -2.529 13.145 1.00 0.00 C ATOM 2107 C ILE A 136 1.704 -3.045 13.128 1.00 0.00 C ATOM 2108 O ILE A 136 2.618 -2.385 13.622 1.00 0.00 O ATOM 2109 CB ILE A 136 -0.386 -2.913 14.485 1.00 0.00 C ATOM 2110 CG1 ILE A 136 -1.870 -2.539 14.477 1.00 0.00 C ATOM 2111 CG2 ILE A 136 0.332 -2.231 15.640 1.00 0.00 C ATOM 2112 CD1 ILE A 136 -2.640 -3.098 15.653 1.00 0.00 C ATOM 0 H ILE A 136 -1.232 -3.699 12.266 1.00 0.00 H new ATOM 0 HA ILE A 136 0.274 -1.443 13.050 1.00 0.00 H new ATOM 0 HB ILE A 136 -0.303 -3.992 14.618 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -1.963 -1.453 14.475 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -2.322 -2.899 13.553 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -0.142 -2.512 16.580 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.377 -2.542 15.653 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.277 -1.150 15.515 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -3.684 -2.793 15.582 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -2.578 -4.186 15.644 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -2.213 -2.718 16.581 1.00 0.00 H new ATOM 2124 N GLY A 137 1.896 -4.229 12.554 1.00 0.00 N ATOM 2125 CA GLY A 137 3.223 -4.812 12.482 1.00 0.00 C ATOM 2126 C GLY A 137 4.301 -3.773 12.249 1.00 0.00 C ATOM 2127 O GLY A 137 4.060 -2.750 11.608 1.00 0.00 O ATOM 0 H GLY A 137 1.156 -4.795 12.138 1.00 0.00 H new ATOM 0 HA2 GLY A 137 3.432 -5.347 13.409 1.00 0.00 H new ATOM 0 HA3 GLY A 137 3.251 -5.546 11.677 1.00 0.00 H new ATOM 2131 N VAL A 138 5.495 -4.033 12.772 1.00 0.00 N ATOM 2132 CA VAL A 138 6.615 -3.112 12.618 1.00 0.00 C ATOM 2133 C VAL A 138 6.824 -2.740 11.155 1.00 0.00 C ATOM 2134 O VAL A 138 6.249 -3.357 10.257 1.00 0.00 O ATOM 2135 CB VAL A 138 7.918 -3.716 13.174 1.00 0.00 C ATOM 2136 CG1 VAL A 138 7.657 -4.431 14.491 1.00 0.00 C ATOM 2137 CG2 VAL A 138 8.542 -4.661 12.159 1.00 0.00 C ATOM 0 H VAL A 138 5.712 -4.874 13.306 1.00 0.00 H new ATOM 0 HA VAL A 138 6.367 -2.215 13.186 1.00 0.00 H new ATOM 0 HB VAL A 138 8.622 -2.905 13.363 1.00 0.00 H new ATOM 0 HG11 VAL A 138 8.589 -4.851 14.868 1.00 0.00 H new ATOM 0 HG12 VAL A 138 7.259 -3.722 15.217 1.00 0.00 H new ATOM 0 HG13 VAL A 138 6.936 -5.233 14.333 1.00 0.00 H new ATOM 0 HG21 VAL A 138 9.462 -5.079 12.568 1.00 0.00 H new ATOM 0 HG22 VAL A 138 7.844 -5.468 11.937 1.00 0.00 H new ATOM 0 HG23 VAL A 138 8.768 -4.114 11.244 1.00 0.00 H new ATOM 2147 N THR A 139 7.651 -1.727 10.919 1.00 0.00 N ATOM 2148 CA THR A 139 7.936 -1.272 9.564 1.00 0.00 C ATOM 2149 C THR A 139 9.400 -1.498 9.205 1.00 0.00 C ATOM 2150 O THR A 139 10.222 -1.800 10.069 1.00 0.00 O ATOM 2151 CB THR A 139 7.602 0.222 9.392 1.00 0.00 C ATOM 2152 OG1 THR A 139 8.109 0.969 10.504 1.00 0.00 O ATOM 2153 CG2 THR A 139 6.100 0.431 9.277 1.00 0.00 C ATOM 0 H THR A 139 8.136 -1.205 11.649 1.00 0.00 H new ATOM 0 HA THR A 139 7.306 -1.857 8.894 1.00 0.00 H new ATOM 0 HB THR A 139 8.073 0.573 8.474 1.00 0.00 H new ATOM 0 HG1 THR A 139 7.894 1.918 10.386 1.00 0.00 H new ATOM 0 HG21 THR A 139 5.889 1.493 9.156 1.00 0.00 H new ATOM 0 HG22 THR A 139 5.722 -0.115 8.412 1.00 0.00 H new ATOM 0 HG23 THR A 139 5.611 0.064 10.180 1.00 0.00 H new ATOM 2161 N GLY A 140 9.720 -1.350 7.923 1.00 0.00 N ATOM 2162 CA GLY A 140 11.086 -1.541 7.472 1.00 0.00 C ATOM 2163 C GLY A 140 11.349 -2.960 7.006 1.00 0.00 C ATOM 2164 O GLY A 140 10.418 -3.748 6.838 1.00 0.00 O ATOM 0 H GLY A 140 9.057 -1.101 7.189 1.00 0.00 H new ATOM 0 HA2 GLY A 140 11.296 -0.849 6.657 1.00 0.00 H new ATOM 0 HA3 GLY A 140 11.771 -1.295 8.283 1.00 0.00 H new ATOM 2168 N SER A 141 12.620 -3.285 6.795 1.00 0.00 N ATOM 2169 CA SER A 141 13.003 -4.617 6.341 1.00 0.00 C ATOM 2170 C SER A 141 13.407 -5.498 7.519 1.00 0.00 C ATOM 2171 O SER A 141 13.934 -5.013 8.519 1.00 0.00 O ATOM 2172 CB SER A 141 14.156 -4.525 5.339 1.00 0.00 C ATOM 2173 OG SER A 141 15.265 -3.846 5.900 1.00 0.00 O ATOM 0 H SER A 141 13.402 -2.645 6.931 1.00 0.00 H new ATOM 0 HA SER A 141 12.140 -5.069 5.852 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.456 -5.527 5.032 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.822 -4.004 4.442 1.00 0.00 H new ATOM 0 HG SER A 141 15.989 -3.802 5.241 1.00 0.00 H new ATOM 2179 N ASN A 142 13.155 -6.797 7.392 1.00 0.00 N ATOM 2180 CA ASN A 142 13.491 -7.747 8.446 1.00 0.00 C ATOM 2181 C ASN A 142 14.947 -8.190 8.335 1.00 0.00 C ATOM 2182 O ASN A 142 15.465 -8.438 7.246 1.00 0.00 O ATOM 2183 CB ASN A 142 12.569 -8.966 8.376 1.00 0.00 C ATOM 2184 CG ASN A 142 13.231 -10.224 8.904 1.00 0.00 C ATOM 2185 OD1 ASN A 142 14.271 -10.649 8.400 1.00 0.00 O ATOM 2186 ND2 ASN A 142 12.631 -10.825 9.924 1.00 0.00 N ATOM 0 H ASN A 142 12.719 -7.215 6.570 1.00 0.00 H new ATOM 0 HA ASN A 142 13.353 -7.250 9.406 1.00 0.00 H new ATOM 0 HB2 ASN A 142 11.664 -8.767 8.950 1.00 0.00 H new ATOM 0 HB3 ASN A 142 12.262 -9.127 7.343 1.00 0.00 H new ATOM 0 HD21 ASN A 142 13.031 -11.675 10.322 1.00 0.00 H new ATOM 0 HD22 ASN A 142 11.770 -10.437 10.310 1.00 0.00 H new ATOM 2193 N PRO A 143 15.624 -8.292 9.488 1.00 0.00 N ATOM 2194 CA PRO A 143 17.029 -8.707 9.547 1.00 0.00 C ATOM 2195 C PRO A 143 17.215 -10.178 9.194 1.00 0.00 C ATOM 2196 O PRO A 143 18.074 -10.529 8.387 1.00 0.00 O ATOM 2197 CB PRO A 143 17.412 -8.455 11.008 1.00 0.00 C ATOM 2198 CG PRO A 143 16.126 -8.537 11.756 1.00 0.00 C ATOM 2199 CD PRO A 143 15.070 -8.012 10.823 1.00 0.00 C ATOM 0 HA PRO A 143 17.645 -8.163 8.830 1.00 0.00 H new ATOM 0 HB2 PRO A 143 18.125 -9.198 11.364 1.00 0.00 H new ATOM 0 HB3 PRO A 143 17.880 -7.479 11.132 1.00 0.00 H new ATOM 0 HG2 PRO A 143 15.911 -9.564 12.051 1.00 0.00 H new ATOM 0 HG3 PRO A 143 16.168 -7.945 12.670 1.00 0.00 H new ATOM 0 HD2 PRO A 143 14.114 -8.514 10.975 1.00 0.00 H new ATOM 0 HD3 PRO A 143 14.897 -6.946 10.971 1.00 0.00 H new ATOM 2207 N ASN A 144 16.402 -11.036 9.804 1.00 0.00 N ATOM 2208 CA ASN A 144 16.478 -12.470 9.553 1.00 0.00 C ATOM 2209 C ASN A 144 16.702 -12.753 8.071 1.00 0.00 C ATOM 2210 O ASN A 144 16.153 -12.068 7.207 1.00 0.00 O ATOM 2211 CB ASN A 144 15.197 -13.160 10.027 1.00 0.00 C ATOM 2212 CG ASN A 144 15.363 -14.662 10.158 1.00 0.00 C ATOM 2213 OD1 ASN A 144 16.025 -15.298 9.338 1.00 0.00 O ATOM 2214 ND2 ASN A 144 14.761 -15.235 11.194 1.00 0.00 N ATOM 0 H ASN A 144 15.684 -10.762 10.475 1.00 0.00 H new ATOM 0 HA ASN A 144 17.326 -12.866 10.112 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.899 -12.745 10.990 1.00 0.00 H new ATOM 0 HB3 ASN A 144 14.391 -12.946 9.325 1.00 0.00 H new ATOM 0 HD21 ASN A 144 14.837 -16.242 11.335 1.00 0.00 H new ATOM 0 HD22 ASN A 144 14.222 -14.668 11.849 1.00 0.00 H new ATOM 2221 N LYS A 145 17.511 -13.766 7.783 1.00 0.00 N ATOM 2222 CA LYS A 145 17.807 -14.142 6.406 1.00 0.00 C ATOM 2223 C LYS A 145 16.936 -15.313 5.962 1.00 0.00 C ATOM 2224 O LYS A 145 16.581 -15.424 4.789 1.00 0.00 O ATOM 2225 CB LYS A 145 19.286 -14.510 6.262 1.00 0.00 C ATOM 2226 CG LYS A 145 20.231 -13.459 6.821 1.00 0.00 C ATOM 2227 CD LYS A 145 20.132 -12.154 6.049 1.00 0.00 C ATOM 2228 CE LYS A 145 20.853 -11.025 6.769 1.00 0.00 C ATOM 2229 NZ LYS A 145 21.374 -10.004 5.818 1.00 0.00 N ATOM 0 H LYS A 145 17.974 -14.342 8.486 1.00 0.00 H new ATOM 0 HA LYS A 145 17.588 -13.286 5.768 1.00 0.00 H new ATOM 0 HB2 LYS A 145 19.467 -15.457 6.770 1.00 0.00 H new ATOM 0 HB3 LYS A 145 19.512 -14.666 5.207 1.00 0.00 H new ATOM 0 HG2 LYS A 145 19.998 -13.280 7.871 1.00 0.00 H new ATOM 0 HG3 LYS A 145 21.255 -13.830 6.780 1.00 0.00 H new ATOM 0 HD2 LYS A 145 20.560 -12.285 5.055 1.00 0.00 H new ATOM 0 HD3 LYS A 145 19.083 -11.889 5.913 1.00 0.00 H new ATOM 0 HE2 LYS A 145 20.171 -10.550 7.474 1.00 0.00 H new ATOM 0 HE3 LYS A 145 21.679 -11.434 7.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 21.859 -9.252 6.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 22.044 -10.452 5.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 20.583 -9.595 5.280 1.00 0.00 H new ATOM 2243 N GLU A 146 16.595 -16.183 6.907 1.00 0.00 N ATOM 2244 CA GLU A 146 15.764 -17.344 6.612 1.00 0.00 C ATOM 2245 C GLU A 146 14.286 -16.966 6.595 1.00 0.00 C ATOM 2246 O GLU A 146 13.437 -17.711 7.086 1.00 0.00 O ATOM 2247 CB GLU A 146 16.008 -18.448 7.643 1.00 0.00 C ATOM 2248 CG GLU A 146 15.632 -18.051 9.061 1.00 0.00 C ATOM 2249 CD GLU A 146 15.221 -19.238 9.910 1.00 0.00 C ATOM 2250 OE1 GLU A 146 14.205 -19.883 9.576 1.00 0.00 O ATOM 2251 OE2 GLU A 146 15.915 -19.521 10.909 1.00 0.00 O ATOM 0 H GLU A 146 16.881 -16.106 7.883 1.00 0.00 H new ATOM 0 HA GLU A 146 16.037 -17.713 5.623 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.437 -19.332 7.359 1.00 0.00 H new ATOM 0 HB3 GLU A 146 17.061 -18.728 7.620 1.00 0.00 H new ATOM 0 HG2 GLU A 146 16.478 -17.549 9.530 1.00 0.00 H new ATOM 0 HG3 GLU A 146 14.813 -17.332 9.028 1.00 0.00 H new ATOM 2258 N THR A 147 13.985 -15.803 6.026 1.00 0.00 N ATOM 2259 CA THR A 147 12.611 -15.324 5.946 1.00 0.00 C ATOM 2260 C THR A 147 12.217 -15.024 4.504 1.00 0.00 C ATOM 2261 O THR A 147 13.052 -14.688 3.664 1.00 0.00 O ATOM 2262 CB THR A 147 12.407 -14.056 6.796 1.00 0.00 C ATOM 2263 OG1 THR A 147 13.430 -13.099 6.501 1.00 0.00 O ATOM 2264 CG2 THR A 147 12.432 -14.391 8.280 1.00 0.00 C ATOM 0 H THR A 147 14.675 -15.175 5.614 1.00 0.00 H new ATOM 0 HA THR A 147 11.976 -16.119 6.336 1.00 0.00 H new ATOM 0 HB THR A 147 11.433 -13.633 6.551 1.00 0.00 H new ATOM 0 HG1 THR A 147 13.494 -12.452 7.235 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.286 -13.480 8.861 1.00 0.00 H new ATOM 0 HG22 THR A 147 11.634 -15.098 8.507 1.00 0.00 H new ATOM 0 HG23 THR A 147 13.394 -14.835 8.537 1.00 0.00 H new ATOM 2272 N PRO A 148 10.914 -15.146 4.208 1.00 0.00 N ATOM 2273 CA PRO A 148 10.380 -14.891 2.867 1.00 0.00 C ATOM 2274 C PRO A 148 10.426 -13.412 2.497 1.00 0.00 C ATOM 2275 O PRO A 148 9.781 -12.581 3.138 1.00 0.00 O ATOM 2276 CB PRO A 148 8.930 -15.372 2.966 1.00 0.00 C ATOM 2277 CG PRO A 148 8.590 -15.258 4.412 1.00 0.00 C ATOM 2278 CD PRO A 148 9.863 -15.542 5.160 1.00 0.00 C ATOM 0 HA PRO A 148 10.960 -15.396 2.094 1.00 0.00 H new ATOM 0 HB2 PRO A 148 8.267 -14.760 2.354 1.00 0.00 H new ATOM 0 HB3 PRO A 148 8.829 -16.399 2.616 1.00 0.00 H new ATOM 0 HG2 PRO A 148 8.213 -14.263 4.647 1.00 0.00 H new ATOM 0 HG3 PRO A 148 7.809 -15.968 4.687 1.00 0.00 H new ATOM 0 HD2 PRO A 148 9.922 -14.968 6.085 1.00 0.00 H new ATOM 0 HD3 PRO A 148 9.943 -16.595 5.432 1.00 0.00 H new ATOM 2286 N CYS A 149 11.190 -13.090 1.459 1.00 0.00 N ATOM 2287 CA CYS A 149 11.320 -11.711 1.004 1.00 0.00 C ATOM 2288 C CYS A 149 10.538 -11.489 -0.287 1.00 0.00 C ATOM 2289 O CYS A 149 10.560 -12.325 -1.191 1.00 0.00 O ATOM 2290 CB CYS A 149 12.793 -11.359 0.789 1.00 0.00 C ATOM 2291 SG CYS A 149 13.060 -9.784 -0.057 1.00 0.00 S ATOM 0 H CYS A 149 11.729 -13.765 0.917 1.00 0.00 H new ATOM 0 HA CYS A 149 10.907 -11.060 1.775 1.00 0.00 H new ATOM 0 HB2 CYS A 149 13.293 -11.328 1.757 1.00 0.00 H new ATOM 0 HB3 CYS A 149 13.265 -12.154 0.211 1.00 0.00 H new ATOM 0 HG CYS A 149 12.086 -8.970 0.224 1.00 0.00 H new ATOM 2297 N LEU A 150 9.847 -10.357 -0.366 1.00 0.00 N ATOM 2298 CA LEU A 150 9.056 -10.025 -1.546 1.00 0.00 C ATOM 2299 C LEU A 150 9.745 -8.947 -2.377 1.00 0.00 C ATOM 2300 O LEU A 150 10.630 -8.246 -1.890 1.00 0.00 O ATOM 2301 CB LEU A 150 7.661 -9.553 -1.133 1.00 0.00 C ATOM 2302 CG LEU A 150 6.592 -10.639 -1.016 1.00 0.00 C ATOM 2303 CD1 LEU A 150 5.548 -10.252 0.020 1.00 0.00 C ATOM 2304 CD2 LEU A 150 5.938 -10.892 -2.366 1.00 0.00 C ATOM 0 H LEU A 150 9.818 -9.654 0.373 1.00 0.00 H new ATOM 0 HA LEU A 150 8.963 -10.924 -2.156 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.741 -9.045 -0.172 1.00 0.00 H new ATOM 0 HB3 LEU A 150 7.321 -8.813 -1.857 1.00 0.00 H new ATOM 0 HG LEU A 150 7.073 -11.561 -0.690 1.00 0.00 H new ATOM 0 HD11 LEU A 150 4.795 -11.037 0.089 1.00 0.00 H new ATOM 0 HD12 LEU A 150 6.028 -10.123 0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 150 5.071 -9.318 -0.276 1.00 0.00 H new ATOM 0 HD21 LEU A 150 5.180 -11.668 -2.263 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.471 -9.974 -2.722 1.00 0.00 H new ATOM 0 HD23 LEU A 150 6.694 -11.216 -3.081 1.00 0.00 H new ATOM 2316 N GLU A 151 9.329 -8.821 -3.634 1.00 0.00 N ATOM 2317 CA GLU A 151 9.906 -7.827 -4.532 1.00 0.00 C ATOM 2318 C GLU A 151 8.812 -7.009 -5.212 1.00 0.00 C ATOM 2319 O GLU A 151 8.050 -7.528 -6.029 1.00 0.00 O ATOM 2320 CB GLU A 151 10.780 -8.507 -5.587 1.00 0.00 C ATOM 2321 CG GLU A 151 11.730 -7.556 -6.296 1.00 0.00 C ATOM 2322 CD GLU A 151 12.749 -8.281 -7.154 1.00 0.00 C ATOM 2323 OE1 GLU A 151 12.419 -8.616 -8.311 1.00 0.00 O ATOM 2324 OE2 GLU A 151 13.876 -8.513 -6.668 1.00 0.00 O ATOM 0 H GLU A 151 8.596 -9.394 -4.053 1.00 0.00 H new ATOM 0 HA GLU A 151 10.524 -7.153 -3.938 1.00 0.00 H new ATOM 0 HB2 GLU A 151 11.359 -9.298 -5.111 1.00 0.00 H new ATOM 0 HB3 GLU A 151 10.137 -8.984 -6.327 1.00 0.00 H new ATOM 0 HG2 GLU A 151 11.155 -6.873 -6.921 1.00 0.00 H new ATOM 0 HG3 GLU A 151 12.250 -6.949 -5.555 1.00 0.00 H new ATOM 2331 N LEU A 152 8.740 -5.727 -4.869 1.00 0.00 N ATOM 2332 CA LEU A 152 7.740 -4.836 -5.446 1.00 0.00 C ATOM 2333 C LEU A 152 8.403 -3.699 -6.217 1.00 0.00 C ATOM 2334 O LEU A 152 9.591 -3.428 -6.042 1.00 0.00 O ATOM 2335 CB LEU A 152 6.842 -4.266 -4.347 1.00 0.00 C ATOM 2336 CG LEU A 152 7.451 -3.154 -3.492 1.00 0.00 C ATOM 2337 CD1 LEU A 152 8.769 -3.608 -2.885 1.00 0.00 C ATOM 2338 CD2 LEU A 152 7.649 -1.893 -4.319 1.00 0.00 C ATOM 0 H LEU A 152 9.362 -5.282 -4.194 1.00 0.00 H new ATOM 0 HA LEU A 152 7.131 -5.415 -6.141 1.00 0.00 H new ATOM 0 HB2 LEU A 152 5.933 -3.884 -4.811 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.545 -5.082 -3.688 1.00 0.00 H new ATOM 0 HG LEU A 152 6.760 -2.927 -2.680 1.00 0.00 H new ATOM 0 HD11 LEU A 152 9.187 -2.803 -2.280 1.00 0.00 H new ATOM 0 HD12 LEU A 152 8.598 -4.483 -2.257 1.00 0.00 H new ATOM 0 HD13 LEU A 152 9.468 -3.864 -3.682 1.00 0.00 H new ATOM 0 HD21 LEU A 152 8.083 -1.113 -3.694 1.00 0.00 H new ATOM 0 HD22 LEU A 152 8.319 -2.106 -5.152 1.00 0.00 H new ATOM 0 HD23 LEU A 152 6.687 -1.556 -4.704 1.00 0.00 H new ATOM 2350 N GLU A 153 7.627 -3.036 -7.068 1.00 0.00 N ATOM 2351 CA GLU A 153 8.140 -1.927 -7.864 1.00 0.00 C ATOM 2352 C GLU A 153 7.398 -0.634 -7.537 1.00 0.00 C ATOM 2353 O GLU A 153 6.184 -0.538 -7.719 1.00 0.00 O ATOM 2354 CB GLU A 153 8.010 -2.239 -9.357 1.00 0.00 C ATOM 2355 CG GLU A 153 9.229 -2.932 -9.942 1.00 0.00 C ATOM 2356 CD GLU A 153 9.235 -2.919 -11.458 1.00 0.00 C ATOM 2357 OE1 GLU A 153 8.821 -1.898 -12.045 1.00 0.00 O ATOM 2358 OE2 GLU A 153 9.655 -3.931 -12.058 1.00 0.00 O ATOM 0 H GLU A 153 6.641 -3.247 -7.224 1.00 0.00 H new ATOM 0 HA GLU A 153 9.194 -1.793 -7.618 1.00 0.00 H new ATOM 0 HB2 GLU A 153 7.134 -2.869 -9.513 1.00 0.00 H new ATOM 0 HB3 GLU A 153 7.835 -1.310 -9.900 1.00 0.00 H new ATOM 0 HG2 GLU A 153 10.131 -2.443 -9.575 1.00 0.00 H new ATOM 0 HG3 GLU A 153 9.259 -3.963 -9.591 1.00 0.00 H new ATOM 2365 N PHE A 154 8.138 0.358 -7.053 1.00 0.00 N ATOM 2366 CA PHE A 154 7.552 1.646 -6.699 1.00 0.00 C ATOM 2367 C PHE A 154 7.514 2.577 -7.907 1.00 0.00 C ATOM 2368 O PHE A 154 8.547 3.087 -8.344 1.00 0.00 O ATOM 2369 CB PHE A 154 8.345 2.296 -5.563 1.00 0.00 C ATOM 2370 CG PHE A 154 8.110 1.656 -4.225 1.00 0.00 C ATOM 2371 CD1 PHE A 154 6.868 1.727 -3.616 1.00 0.00 C ATOM 2372 CD2 PHE A 154 9.133 0.982 -3.576 1.00 0.00 C ATOM 2373 CE1 PHE A 154 6.649 1.139 -2.385 1.00 0.00 C ATOM 2374 CE2 PHE A 154 8.919 0.391 -2.345 1.00 0.00 C ATOM 2375 CZ PHE A 154 7.676 0.471 -1.748 1.00 0.00 C ATOM 0 H PHE A 154 9.144 0.295 -6.897 1.00 0.00 H new ATOM 0 HA PHE A 154 6.529 1.472 -6.365 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.408 2.247 -5.798 1.00 0.00 H new ATOM 0 HB3 PHE A 154 8.080 3.352 -5.503 1.00 0.00 H new ATOM 0 HD1 PHE A 154 6.061 2.248 -4.109 1.00 0.00 H new ATOM 0 HD2 PHE A 154 10.107 0.918 -4.037 1.00 0.00 H new ATOM 0 HE1 PHE A 154 5.676 1.202 -1.921 1.00 0.00 H new ATOM 0 HE2 PHE A 154 9.723 -0.133 -1.850 1.00 0.00 H new ATOM 0 HZ PHE A 154 7.508 0.012 -0.785 1.00 0.00 H new ATOM 2385 N ASP A 155 6.318 2.795 -8.442 1.00 0.00 N ATOM 2386 CA ASP A 155 6.145 3.665 -9.599 1.00 0.00 C ATOM 2387 C ASP A 155 5.000 4.648 -9.373 1.00 0.00 C ATOM 2388 O ASP A 155 4.094 4.389 -8.581 1.00 0.00 O ATOM 2389 CB ASP A 155 5.879 2.833 -10.855 1.00 0.00 C ATOM 2390 CG ASP A 155 7.105 2.068 -11.312 1.00 0.00 C ATOM 2391 OD1 ASP A 155 7.886 2.623 -12.113 1.00 0.00 O ATOM 2392 OD2 ASP A 155 7.284 0.913 -10.871 1.00 0.00 O ATOM 0 H ASP A 155 5.454 2.381 -8.093 1.00 0.00 H new ATOM 0 HA ASP A 155 7.066 4.232 -9.737 1.00 0.00 H new ATOM 0 HB2 ASP A 155 5.069 2.131 -10.658 1.00 0.00 H new ATOM 0 HB3 ASP A 155 5.543 3.489 -11.658 1.00 0.00 H new ATOM 2397 N TRP A 156 5.049 5.776 -10.073 1.00 0.00 N ATOM 2398 CA TRP A 156 4.016 6.798 -9.948 1.00 0.00 C ATOM 2399 C TRP A 156 3.721 7.442 -11.298 1.00 0.00 C ATOM 2400 O TRP A 156 4.606 8.022 -11.927 1.00 0.00 O ATOM 2401 CB TRP A 156 4.447 7.867 -8.943 1.00 0.00 C ATOM 2402 CG TRP A 156 5.127 7.304 -7.731 1.00 0.00 C ATOM 2403 CD1 TRP A 156 6.404 6.825 -7.656 1.00 0.00 C ATOM 2404 CD2 TRP A 156 4.564 7.160 -6.423 1.00 0.00 C ATOM 2405 NE1 TRP A 156 6.668 6.392 -6.379 1.00 0.00 N ATOM 2406 CE2 TRP A 156 5.556 6.587 -5.603 1.00 0.00 C ATOM 2407 CE3 TRP A 156 3.319 7.460 -5.863 1.00 0.00 C ATOM 2408 CZ2 TRP A 156 5.340 6.309 -4.256 1.00 0.00 C ATOM 2409 CZ3 TRP A 156 3.106 7.184 -4.526 1.00 0.00 C ATOM 2410 CH2 TRP A 156 4.112 6.614 -3.735 1.00 0.00 C ATOM 0 H TRP A 156 5.792 6.006 -10.732 1.00 0.00 H new ATOM 0 HA TRP A 156 3.106 6.317 -9.589 1.00 0.00 H new ATOM 0 HB2 TRP A 156 5.121 8.568 -9.436 1.00 0.00 H new ATOM 0 HB3 TRP A 156 3.571 8.434 -8.629 1.00 0.00 H new ATOM 0 HD1 TRP A 156 7.103 6.792 -8.479 1.00 0.00 H new ATOM 0 HE1 TRP A 156 7.550 5.990 -6.060 1.00 0.00 H new ATOM 0 HE3 TRP A 156 2.537 7.900 -6.465 1.00 0.00 H new ATOM 0 HZ2 TRP A 156 6.114 5.869 -3.644 1.00 0.00 H new ATOM 0 HZ3 TRP A 156 2.148 7.412 -4.083 1.00 0.00 H new ATOM 0 HH2 TRP A 156 3.914 6.411 -2.693 1.00 0.00 H new ATOM 2421 N PHE A 157 2.472 7.335 -11.739 1.00 0.00 N ATOM 2422 CA PHE A 157 2.060 7.907 -13.016 1.00 0.00 C ATOM 2423 C PHE A 157 1.132 9.099 -12.804 1.00 0.00 C ATOM 2424 O PHE A 157 1.317 10.158 -13.405 1.00 0.00 O ATOM 2425 CB PHE A 157 1.362 6.848 -13.872 1.00 0.00 C ATOM 2426 CG PHE A 157 -0.067 6.605 -13.477 1.00 0.00 C ATOM 2427 CD1 PHE A 157 -0.371 5.918 -12.313 1.00 0.00 C ATOM 2428 CD2 PHE A 157 -1.106 7.064 -14.270 1.00 0.00 C ATOM 2429 CE1 PHE A 157 -1.685 5.693 -11.947 1.00 0.00 C ATOM 2430 CE2 PHE A 157 -2.422 6.843 -13.909 1.00 0.00 C ATOM 2431 CZ PHE A 157 -2.711 6.156 -12.746 1.00 0.00 C ATOM 0 H PHE A 157 1.727 6.858 -11.231 1.00 0.00 H new ATOM 0 HA PHE A 157 2.953 8.253 -13.536 1.00 0.00 H new ATOM 0 HB2 PHE A 157 1.394 7.157 -14.917 1.00 0.00 H new ATOM 0 HB3 PHE A 157 1.915 5.911 -13.800 1.00 0.00 H new ATOM 0 HD1 PHE A 157 0.428 5.554 -11.684 1.00 0.00 H new ATOM 0 HD2 PHE A 157 -0.885 7.601 -15.181 1.00 0.00 H new ATOM 0 HE1 PHE A 157 -1.908 5.156 -11.037 1.00 0.00 H new ATOM 0 HE2 PHE A 157 -3.223 7.207 -14.535 1.00 0.00 H new ATOM 0 HZ PHE A 157 -3.738 5.981 -12.462 1.00 0.00 H new ATOM 2441 N SER A 158 0.133 8.919 -11.947 1.00 0.00 N ATOM 2442 CA SER A 158 -0.828 9.977 -11.658 1.00 0.00 C ATOM 2443 C SER A 158 -1.748 10.215 -12.851 1.00 0.00 C ATOM 2444 O SER A 158 -1.983 11.355 -13.249 1.00 0.00 O ATOM 2445 CB SER A 158 -0.098 11.272 -11.296 1.00 0.00 C ATOM 2446 OG SER A 158 -0.984 12.210 -10.710 1.00 0.00 O ATOM 0 H SER A 158 -0.032 8.050 -11.440 1.00 0.00 H new ATOM 0 HA SER A 158 -1.436 9.661 -10.810 1.00 0.00 H new ATOM 0 HB2 SER A 158 0.715 11.053 -10.604 1.00 0.00 H new ATOM 0 HB3 SER A 158 0.352 11.702 -12.191 1.00 0.00 H new ATOM 0 HG SER A 158 -0.648 12.470 -9.827 1.00 0.00 H new