USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1180 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 140 MET CE :methyl 177:sc= -0.338 (180deg=-0.369) USER MOD Set 1.2: A 141 MET CE :methyl -179:sc= -0.257 (180deg=-0.19) USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0.427 K(o=1.5,f=-0.81) USER MOD Set 2.2: A 107 ASN : amide:sc= 1.09 K(o=1.5,f=-0.03) USER MOD Set 3.1: A 97 SER OG : rot 180:sc= 0.0382 USER MOD Set 3.2: A 131 GLN : amide:sc= -0.333 K(o=-0.29,f=0.42) USER MOD Set 4.1: A 73 LYS NZ :NH3+ -170:sc= 1.25 (180deg=1.1) USER MOD Set 4.2: A 75 THR OG1 : rot 180:sc= 0.0602 USER MOD Set 5.1: A 68 MET CE :methyl 175:sc= -0.25 (180deg=-0.0646) USER MOD Set 5.2: B 9 HIS : no HD1:sc= -0.874 K(o=-1.1,f=-0.22) USER MOD Set 6.1: A 45 GLN : amide:sc= 1.48 K(o=2.5,f=-1.6) USER MOD Set 6.2: A 49 ASN : amide:sc= 1.03 K(o=2.5,f=-2.8) USER MOD Set 7.1: A 32 MET CE :methyl -176:sc= 0 (180deg=-0.0512) USER MOD Set 7.2: A 47 MET CE :methyl -164:sc= 0 (180deg=-0.004) USER MOD Set 8.1: A 25 THR OG1 : rot 180:sc= 0.0247 USER MOD Set 8.2: A 26 LYS NZ :NH3+ -130:sc= 0.0246 (180deg=0) USER MOD Single : A 4 GLN : amide:sc=-0.000848 X(o=-0.00085,f=-0.5) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 72:sc= 0.165 USER MOD Single : A 17 LYS NZ :NH3+ -175:sc= 1.02 (180deg=0.995) USER MOD Single : A 22 THR OG1 : rot 25:sc= 0.389 USER MOD Single : A 24 THR OG1 : rot -66:sc= 0.948 USER MOD Single : A 30 THR OG1 : rot 62:sc= 1.04 USER MOD Single : A 34 SER OG : rot 59:sc= 1.25 USER MOD Single : A 37 GLN : amide:sc= -0.777 K(o=-0.78,f=-0.029) USER MOD Single : A 38 ASN : amide:sc= 0.0453 K(o=0.045,f=-1.1) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= 0.281 K(o=0.28,f=-3.1!) USER MOD Single : A 58 THR OG1 : rot -150:sc= 0 USER MOD Single : A 66 THR OG1 : rot 75:sc= 0.538 USER MOD Single : A 67 MET CE :methyl -172:sc= 0 (180deg=-0.0704) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= -0.131 K(o=-0.13,f=-1) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl -144:sc= -0.339 (180deg=-1.95!) USER MOD Single : A 106 THR OG1 : rot 82:sc= 1.22 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 159:sc= 0.557 USER MOD Single : A 120 MET CE :methyl 165:sc= -0.0469 (180deg=-0.703) USER MOD Single : A 133 ASN : amide:sc= 0.026 K(o=0.026,f=-4.6!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 142 THR OG1 : rot 80:sc= 1.28 USER MOD Single : B 1 ARG N :NH3+ 153:sc= 0.636 (180deg=0.38) USER MOD Single : B 3 LYS NZ :NH3+ -176:sc= 1.3 (180deg=1.11) USER MOD Single : B 5 GLN : amide:sc= -0.104 K(o=-0.1,f=-0.62) USER MOD Single : B 6 LYS NZ :NH3+ -172:sc= 1.17 (180deg=1.16) USER MOD Single : B 7 THR OG1 : rot 110:sc= 0.237 USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 1.448 1.278 17.600 1.00 0.00 N ATOM 30 CA GLU A 3 0.376 0.599 16.939 1.00 0.00 C ATOM 31 C GLU A 3 0.613 0.651 15.469 1.00 0.00 C ATOM 32 O GLU A 3 0.346 -0.303 14.741 1.00 0.00 O ATOM 33 CB GLU A 3 -0.972 1.153 17.431 1.00 0.00 C ATOM 34 CG GLU A 3 -1.475 2.543 17.037 1.00 0.00 C ATOM 35 CD GLU A 3 -0.606 3.694 17.521 1.00 0.00 C ATOM 36 OE1 GLU A 3 0.260 3.493 18.415 1.00 0.00 O ATOM 37 OE2 GLU A 3 -0.826 4.808 16.975 1.00 0.00 O ATOM 0 HA GLU A 3 0.337 -0.461 17.189 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -1.736 0.442 17.116 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.942 1.128 18.520 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -1.549 2.593 15.951 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -2.482 2.675 17.432 1.00 0.00 H new ATOM 44 N GLN A 4 1.112 1.797 14.973 1.00 0.00 N ATOM 45 CA GLN A 4 1.557 2.120 13.653 1.00 0.00 C ATOM 46 C GLN A 4 2.730 1.289 13.262 1.00 0.00 C ATOM 47 O GLN A 4 2.602 0.592 12.256 1.00 0.00 O ATOM 48 CB GLN A 4 1.783 3.629 13.463 1.00 0.00 C ATOM 49 CG GLN A 4 2.073 4.088 12.032 1.00 0.00 C ATOM 50 CD GLN A 4 1.929 5.601 11.958 1.00 0.00 C ATOM 51 OE1 GLN A 4 1.258 6.367 12.648 1.00 0.00 O ATOM 52 NE2 GLN A 4 2.641 6.076 10.900 1.00 0.00 N ATOM 0 H GLN A 4 1.215 2.605 15.587 1.00 0.00 H new ATOM 0 HA GLN A 4 0.754 1.865 12.961 1.00 0.00 H new ATOM 0 HB2 GLN A 4 0.899 4.157 13.821 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.615 3.935 14.097 1.00 0.00 H new ATOM 0 HG2 GLN A 4 3.080 3.791 11.738 1.00 0.00 H new ATOM 0 HG3 GLN A 4 1.384 3.610 11.336 1.00 0.00 H new ATOM 0 HE21 GLN A 4 3.196 5.437 10.331 1.00 0.00 H new ATOM 0 HE22 GLN A 4 2.620 7.071 10.676 1.00 0.00 H new ATOM 61 N ILE A 5 3.784 1.257 14.097 1.00 0.00 N ATOM 62 CA ILE A 5 4.809 0.262 14.035 1.00 0.00 C ATOM 63 C ILE A 5 4.331 -1.124 13.768 1.00 0.00 C ATOM 64 O ILE A 5 4.782 -1.855 12.888 1.00 0.00 O ATOM 65 CB ILE A 5 5.704 0.255 15.239 1.00 0.00 C ATOM 66 CG1 ILE A 5 6.206 1.681 15.518 1.00 0.00 C ATOM 67 CG2 ILE A 5 6.882 -0.733 15.213 1.00 0.00 C ATOM 68 CD1 ILE A 5 6.871 2.390 14.339 1.00 0.00 C ATOM 0 H ILE A 5 3.927 1.944 14.837 1.00 0.00 H new ATOM 0 HA ILE A 5 5.385 0.574 13.164 1.00 0.00 H new ATOM 0 HB ILE A 5 5.074 -0.113 16.049 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.363 2.285 15.853 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.917 1.642 16.343 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.453 -0.643 16.137 1.00 0.00 H new ATOM 0 HG22 ILE A 5 6.502 -1.750 15.119 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.527 -0.507 14.364 1.00 0.00 H new ATOM 0 HD11 ILE A 5 7.187 3.387 14.645 1.00 0.00 H new ATOM 0 HD12 ILE A 5 7.740 1.818 14.014 1.00 0.00 H new ATOM 0 HD13 ILE A 5 6.161 2.471 13.516 1.00 0.00 H new ATOM 80 N ALA A 6 3.403 -1.657 14.583 1.00 0.00 N ATOM 81 CA ALA A 6 2.807 -2.957 14.584 1.00 0.00 C ATOM 82 C ALA A 6 2.152 -3.278 13.285 1.00 0.00 C ATOM 83 O ALA A 6 2.215 -4.415 12.820 1.00 0.00 O ATOM 84 CB ALA A 6 1.890 -3.166 15.801 1.00 0.00 C ATOM 0 H ALA A 6 3.022 -1.094 15.344 1.00 0.00 H new ATOM 0 HA ALA A 6 3.613 -3.683 14.690 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.458 -4.166 15.763 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.470 -3.056 16.717 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.091 -2.424 15.786 1.00 0.00 H new ATOM 90 N GLU A 7 1.536 -2.271 12.640 1.00 0.00 N ATOM 91 CA GLU A 7 0.938 -2.390 11.347 1.00 0.00 C ATOM 92 C GLU A 7 1.996 -2.737 10.357 1.00 0.00 C ATOM 93 O GLU A 7 1.880 -3.764 9.691 1.00 0.00 O ATOM 94 CB GLU A 7 0.050 -1.148 11.158 1.00 0.00 C ATOM 95 CG GLU A 7 -0.898 -1.136 9.957 1.00 0.00 C ATOM 96 CD GLU A 7 -1.973 -0.067 10.092 1.00 0.00 C ATOM 97 OE1 GLU A 7 -2.821 -0.271 11.002 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.085 0.982 9.404 1.00 0.00 O ATOM 0 H GLU A 7 1.451 -1.335 13.036 1.00 0.00 H new ATOM 0 HA GLU A 7 0.244 -3.218 11.200 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -0.548 -1.021 12.060 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.701 -0.277 11.082 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.326 -0.963 9.045 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.369 -2.114 9.857 1.00 0.00 H new ATOM 105 N PHE A 8 3.032 -1.885 10.250 1.00 0.00 N ATOM 106 CA PHE A 8 3.989 -2.002 9.194 1.00 0.00 C ATOM 107 C PHE A 8 4.871 -3.189 9.375 1.00 0.00 C ATOM 108 O PHE A 8 5.247 -3.820 8.388 1.00 0.00 O ATOM 109 CB PHE A 8 4.672 -0.772 8.571 1.00 0.00 C ATOM 110 CG PHE A 8 5.470 0.003 9.561 1.00 0.00 C ATOM 111 CD1 PHE A 8 6.760 -0.460 9.676 1.00 0.00 C ATOM 112 CD2 PHE A 8 5.131 1.168 10.209 1.00 0.00 C ATOM 113 CE1 PHE A 8 7.722 0.244 10.361 1.00 0.00 C ATOM 114 CE2 PHE A 8 6.078 1.866 10.920 1.00 0.00 C ATOM 115 CZ PHE A 8 7.360 1.384 11.039 1.00 0.00 C ATOM 0 H PHE A 8 3.207 -1.115 10.895 1.00 0.00 H new ATOM 0 HA PHE A 8 3.312 -2.158 8.354 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.323 -1.095 7.758 1.00 0.00 H new ATOM 0 HB3 PHE A 8 3.914 -0.123 8.133 1.00 0.00 H new ATOM 0 HD1 PHE A 8 7.024 -1.401 9.216 1.00 0.00 H new ATOM 0 HD2 PHE A 8 4.117 1.536 10.159 1.00 0.00 H new ATOM 0 HE1 PHE A 8 8.748 -0.094 10.366 1.00 0.00 H new ATOM 0 HE2 PHE A 8 5.812 2.802 11.389 1.00 0.00 H new ATOM 0 HZ PHE A 8 8.078 1.898 11.661 1.00 0.00 H new ATOM 125 N LYS A 9 5.139 -3.671 10.601 1.00 0.00 N ATOM 126 CA LYS A 9 5.772 -4.936 10.811 1.00 0.00 C ATOM 127 C LYS A 9 5.038 -6.204 10.538 1.00 0.00 C ATOM 128 O LYS A 9 5.570 -7.145 9.952 1.00 0.00 O ATOM 129 CB LYS A 9 6.270 -4.901 12.266 1.00 0.00 C ATOM 130 CG LYS A 9 6.955 -6.149 12.827 1.00 0.00 C ATOM 131 CD LYS A 9 8.245 -6.568 12.119 1.00 0.00 C ATOM 132 CE LYS A 9 9.273 -7.426 12.861 1.00 0.00 C ATOM 133 NZ LYS A 9 8.634 -8.627 13.443 1.00 0.00 N ATOM 0 H LYS A 9 4.912 -3.174 11.462 1.00 0.00 H new ATOM 0 HA LYS A 9 6.538 -5.007 10.039 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.967 -4.068 12.359 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.416 -4.675 12.905 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.179 -5.977 13.880 1.00 0.00 H new ATOM 0 HG3 LYS A 9 6.251 -6.980 12.782 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.960 -7.109 11.216 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.751 -5.657 11.799 1.00 0.00 H new ATOM 0 HE2 LYS A 9 10.065 -7.726 12.175 1.00 0.00 H new ATOM 0 HE3 LYS A 9 9.741 -6.839 13.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 9.349 -9.194 13.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 7.894 -8.336 14.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.209 -9.196 12.684 1.00 0.00 H new ATOM 147 N GLU A 10 3.745 -6.290 10.898 1.00 0.00 N ATOM 148 CA GLU A 10 2.901 -7.331 10.401 1.00 0.00 C ATOM 149 C GLU A 10 2.621 -7.284 8.939 1.00 0.00 C ATOM 150 O GLU A 10 2.343 -8.266 8.252 1.00 0.00 O ATOM 151 CB GLU A 10 1.599 -7.232 11.213 1.00 0.00 C ATOM 152 CG GLU A 10 0.636 -8.419 11.289 1.00 0.00 C ATOM 153 CD GLU A 10 -0.503 -8.182 12.271 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.188 -7.809 13.433 1.00 0.00 O ATOM 155 OE2 GLU A 10 -1.710 -8.398 11.982 1.00 0.00 O ATOM 0 H GLU A 10 3.284 -5.638 11.533 1.00 0.00 H new ATOM 0 HA GLU A 10 3.415 -8.284 10.523 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.877 -6.978 12.236 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.036 -6.387 10.816 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.224 -8.612 10.299 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.187 -9.312 11.585 1.00 0.00 H new ATOM 162 N ALA A 11 2.873 -6.090 8.375 1.00 0.00 N ATOM 163 CA ALA A 11 2.895 -5.979 6.949 1.00 0.00 C ATOM 164 C ALA A 11 4.129 -6.493 6.292 1.00 0.00 C ATOM 165 O ALA A 11 4.032 -7.105 5.230 1.00 0.00 O ATOM 166 CB ALA A 11 2.641 -4.528 6.507 1.00 0.00 C ATOM 0 H ALA A 11 3.056 -5.226 8.886 1.00 0.00 H new ATOM 0 HA ALA A 11 2.087 -6.629 6.614 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.663 -4.470 5.419 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.665 -4.203 6.868 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.415 -3.881 6.920 1.00 0.00 H new ATOM 172 N PHE A 12 5.279 -6.402 6.985 1.00 0.00 N ATOM 173 CA PHE A 12 6.534 -6.966 6.595 1.00 0.00 C ATOM 174 C PHE A 12 6.569 -8.451 6.709 1.00 0.00 C ATOM 175 O PHE A 12 7.048 -9.143 5.811 1.00 0.00 O ATOM 176 CB PHE A 12 7.632 -6.300 7.441 1.00 0.00 C ATOM 177 CG PHE A 12 9.007 -6.616 6.962 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.547 -5.990 5.863 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.790 -7.544 7.608 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.822 -6.267 5.429 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.099 -7.765 7.249 1.00 0.00 C ATOM 182 CZ PHE A 12 11.594 -7.180 6.108 1.00 0.00 C ATOM 0 H PHE A 12 5.335 -5.903 7.873 1.00 0.00 H new ATOM 0 HA PHE A 12 6.699 -6.767 5.536 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.488 -5.220 7.428 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.531 -6.623 8.477 1.00 0.00 H new ATOM 0 HD1 PHE A 12 8.955 -5.263 5.327 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.365 -8.115 8.420 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.216 -5.768 4.556 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.732 -8.393 7.858 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.580 -7.435 5.748 1.00 0.00 H new ATOM 192 N SER A 13 5.863 -9.001 7.713 1.00 0.00 N ATOM 193 CA SER A 13 5.568 -10.395 7.836 1.00 0.00 C ATOM 194 C SER A 13 4.785 -11.059 6.757 1.00 0.00 C ATOM 195 O SER A 13 4.818 -12.289 6.785 1.00 0.00 O ATOM 196 CB SER A 13 4.810 -10.594 9.159 1.00 0.00 C ATOM 197 OG SER A 13 5.619 -10.259 10.278 1.00 0.00 O ATOM 0 H SER A 13 5.479 -8.445 8.477 1.00 0.00 H new ATOM 0 HA SER A 13 6.545 -10.875 7.776 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.911 -9.977 9.161 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.485 -11.631 9.241 1.00 0.00 H new ATOM 0 HG SER A 13 5.729 -9.286 10.323 1.00 0.00 H new ATOM 203 N LEU A 14 4.160 -10.375 5.782 1.00 0.00 N ATOM 204 CA LEU A 14 3.610 -10.971 4.604 1.00 0.00 C ATOM 205 C LEU A 14 4.624 -11.462 3.629 1.00 0.00 C ATOM 206 O LEU A 14 4.311 -12.359 2.847 1.00 0.00 O ATOM 207 CB LEU A 14 2.544 -10.022 4.029 1.00 0.00 C ATOM 208 CG LEU A 14 1.364 -9.735 4.972 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.735 -8.434 4.444 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.323 -10.856 5.133 1.00 0.00 C ATOM 0 H LEU A 14 4.033 -9.364 5.816 1.00 0.00 H new ATOM 0 HA LEU A 14 3.116 -11.904 4.875 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.021 -9.077 3.768 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.157 -10.450 3.104 1.00 0.00 H new ATOM 0 HG LEU A 14 1.744 -9.652 5.990 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.117 -8.163 5.067 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.475 -7.634 4.473 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.401 -8.582 3.417 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.457 -10.532 5.822 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.120 -11.083 4.163 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.808 -11.749 5.528 1.00 0.00 H new ATOM 222 N PHE A 15 5.827 -10.861 3.619 1.00 0.00 N ATOM 223 CA PHE A 15 6.858 -11.129 2.665 1.00 0.00 C ATOM 224 C PHE A 15 7.812 -12.161 3.161 1.00 0.00 C ATOM 225 O PHE A 15 8.255 -13.011 2.389 1.00 0.00 O ATOM 226 CB PHE A 15 7.662 -9.837 2.441 1.00 0.00 C ATOM 227 CG PHE A 15 6.825 -8.765 1.832 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.989 -7.938 2.544 1.00 0.00 C ATOM 229 CD2 PHE A 15 7.021 -8.507 0.496 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.312 -6.913 1.926 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.408 -7.443 -0.121 1.00 0.00 C ATOM 232 CZ PHE A 15 5.588 -6.618 0.612 1.00 0.00 C ATOM 0 H PHE A 15 6.093 -10.156 4.307 1.00 0.00 H new ATOM 0 HA PHE A 15 6.385 -11.487 1.751 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.063 -9.489 3.393 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.513 -10.046 1.793 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.862 -8.096 3.605 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.669 -9.152 -0.079 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.570 -6.345 2.468 1.00 0.00 H new ATOM 0 HE2 PHE A 15 6.569 -7.256 -1.173 1.00 0.00 H new ATOM 0 HZ PHE A 15 5.160 -5.738 0.155 1.00 0.00 H new ATOM 242 N ASP A 16 8.243 -12.069 4.432 1.00 0.00 N ATOM 243 CA ASP A 16 9.269 -12.917 4.954 1.00 0.00 C ATOM 244 C ASP A 16 8.869 -14.296 5.353 1.00 0.00 C ATOM 245 O ASP A 16 8.260 -14.498 6.402 1.00 0.00 O ATOM 246 CB ASP A 16 9.971 -12.151 6.088 1.00 0.00 C ATOM 247 CG ASP A 16 11.392 -12.637 6.333 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.231 -12.690 5.394 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.678 -13.063 7.484 1.00 0.00 O ATOM 0 H ASP A 16 7.875 -11.398 5.106 1.00 0.00 H new ATOM 0 HA ASP A 16 9.950 -13.130 4.130 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.992 -11.089 5.845 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.392 -12.257 7.005 1.00 0.00 H new ATOM 254 N LYS A 17 9.070 -15.294 4.473 1.00 0.00 N ATOM 255 CA LYS A 17 8.417 -16.562 4.582 1.00 0.00 C ATOM 256 C LYS A 17 8.954 -17.377 5.708 1.00 0.00 C ATOM 257 O LYS A 17 8.210 -18.085 6.385 1.00 0.00 O ATOM 258 CB LYS A 17 8.502 -17.309 3.241 1.00 0.00 C ATOM 259 CG LYS A 17 7.848 -16.573 2.070 1.00 0.00 C ATOM 260 CD LYS A 17 6.458 -16.073 2.466 1.00 0.00 C ATOM 261 CE LYS A 17 5.623 -15.641 1.259 1.00 0.00 C ATOM 262 NZ LYS A 17 4.399 -14.893 1.620 1.00 0.00 N ATOM 0 H LYS A 17 9.697 -15.219 3.672 1.00 0.00 H new ATOM 0 HA LYS A 17 7.367 -16.386 4.814 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.551 -17.487 3.003 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.030 -18.285 3.351 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.471 -15.732 1.767 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.771 -17.239 1.211 1.00 0.00 H new ATOM 0 HD2 LYS A 17 5.932 -16.862 3.004 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.560 -15.232 3.152 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.238 -15.021 0.606 1.00 0.00 H new ATOM 0 HE3 LYS A 17 5.342 -16.525 0.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 3.841 -14.706 0.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 3.832 -15.455 2.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.662 -13.991 2.065 1.00 0.00 H new ATOM 276 N ASP A 18 10.276 -17.324 5.948 1.00 0.00 N ATOM 277 CA ASP A 18 10.940 -17.893 7.079 1.00 0.00 C ATOM 278 C ASP A 18 10.642 -17.238 8.384 1.00 0.00 C ATOM 279 O ASP A 18 9.893 -17.827 9.162 1.00 0.00 O ATOM 280 CB ASP A 18 12.468 -17.926 6.907 1.00 0.00 C ATOM 281 CG ASP A 18 13.055 -16.690 6.241 1.00 0.00 C ATOM 282 OD1 ASP A 18 12.922 -15.561 6.785 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.733 -16.865 5.193 1.00 0.00 O ATOM 0 H ASP A 18 10.921 -16.854 5.312 1.00 0.00 H new ATOM 0 HA ASP A 18 10.533 -18.903 7.113 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.929 -18.048 7.887 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.736 -18.803 6.317 1.00 0.00 H new ATOM 288 N GLY A 19 11.255 -16.090 8.724 1.00 0.00 N ATOM 289 CA GLY A 19 11.075 -15.243 9.862 1.00 0.00 C ATOM 290 C GLY A 19 12.376 -14.701 10.344 1.00 0.00 C ATOM 291 O GLY A 19 12.514 -14.523 11.554 1.00 0.00 O ATOM 0 H GLY A 19 11.976 -15.708 8.112 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.409 -14.420 9.604 1.00 0.00 H new ATOM 0 HA3 GLY A 19 10.593 -15.804 10.663 1.00 0.00 H new ATOM 295 N ASP A 20 13.330 -14.355 9.461 1.00 0.00 N ATOM 296 CA ASP A 20 14.643 -13.961 9.867 1.00 0.00 C ATOM 297 C ASP A 20 14.718 -12.475 9.788 1.00 0.00 C ATOM 298 O ASP A 20 15.687 -11.844 10.206 1.00 0.00 O ATOM 299 CB ASP A 20 15.748 -14.656 9.054 1.00 0.00 C ATOM 300 CG ASP A 20 15.611 -14.571 7.541 1.00 0.00 C ATOM 301 OD1 ASP A 20 15.006 -13.590 7.033 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.198 -15.419 6.816 1.00 0.00 O ATOM 0 H ASP A 20 13.188 -14.349 8.451 1.00 0.00 H new ATOM 0 HA ASP A 20 14.820 -14.281 10.894 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.708 -14.224 9.338 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.775 -15.708 9.339 1.00 0.00 H new ATOM 307 N GLY A 21 13.751 -11.846 9.096 1.00 0.00 N ATOM 308 CA GLY A 21 13.668 -10.424 8.970 1.00 0.00 C ATOM 309 C GLY A 21 14.450 -9.912 7.810 1.00 0.00 C ATOM 310 O GLY A 21 14.635 -8.706 7.650 1.00 0.00 O ATOM 0 H GLY A 21 13.004 -12.342 8.609 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.624 -10.132 8.859 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.033 -9.959 9.885 1.00 0.00 H new ATOM 314 N THR A 22 14.993 -10.744 6.904 1.00 0.00 N ATOM 315 CA THR A 22 15.696 -10.461 5.691 1.00 0.00 C ATOM 316 C THR A 22 15.036 -11.098 4.518 1.00 0.00 C ATOM 317 O THR A 22 15.201 -12.311 4.400 1.00 0.00 O ATOM 318 CB THR A 22 17.151 -10.822 5.624 1.00 0.00 C ATOM 319 OG1 THR A 22 17.387 -12.024 6.343 1.00 0.00 O ATOM 320 CG2 THR A 22 17.971 -9.672 6.233 1.00 0.00 C ATOM 0 H THR A 22 14.927 -11.752 7.047 1.00 0.00 H new ATOM 0 HA THR A 22 15.652 -9.372 5.671 1.00 0.00 H new ATOM 0 HB THR A 22 17.447 -10.978 4.587 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.559 -12.547 6.386 1.00 0.00 H new ATOM 0 HG21 THR A 22 19.032 -9.920 6.192 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.790 -8.757 5.669 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.674 -9.523 7.271 1.00 0.00 H new ATOM 328 N ILE A 23 14.212 -10.397 3.719 1.00 0.00 N ATOM 329 CA ILE A 23 13.466 -10.963 2.638 1.00 0.00 C ATOM 330 C ILE A 23 14.324 -11.155 1.435 1.00 0.00 C ATOM 331 O ILE A 23 14.973 -10.236 0.939 1.00 0.00 O ATOM 332 CB ILE A 23 12.202 -10.277 2.214 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.401 -9.679 3.383 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.281 -11.197 1.395 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.816 -8.322 2.996 1.00 0.00 C ATOM 0 H ILE A 23 14.059 -9.395 3.831 1.00 0.00 H new ATOM 0 HA ILE A 23 13.135 -11.906 3.073 1.00 0.00 H new ATOM 0 HB ILE A 23 12.543 -9.455 1.585 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.598 -10.360 3.666 1.00 0.00 H new ATOM 0 HG13 ILE A 23 12.047 -9.568 4.254 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.380 -10.652 1.113 1.00 0.00 H new ATOM 0 HG22 ILE A 23 11.802 -11.527 0.496 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.007 -12.065 1.995 1.00 0.00 H new ATOM 0 HD11 ILE A 23 10.253 -7.916 3.836 1.00 0.00 H new ATOM 0 HD12 ILE A 23 11.624 -7.638 2.736 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.153 -8.443 2.139 1.00 0.00 H new ATOM 347 N THR A 24 14.407 -12.402 0.936 1.00 0.00 N ATOM 348 CA THR A 24 15.298 -12.696 -0.143 1.00 0.00 C ATOM 349 C THR A 24 14.568 -12.594 -1.438 1.00 0.00 C ATOM 350 O THR A 24 13.373 -12.308 -1.484 1.00 0.00 O ATOM 351 CB THR A 24 15.971 -14.034 -0.064 1.00 0.00 C ATOM 352 OG1 THR A 24 15.009 -15.076 0.004 1.00 0.00 O ATOM 353 CG2 THR A 24 16.789 -14.098 1.237 1.00 0.00 C ATOM 0 H THR A 24 13.865 -13.197 1.274 1.00 0.00 H new ATOM 0 HA THR A 24 16.094 -11.955 -0.069 1.00 0.00 H new ATOM 0 HB THR A 24 16.596 -14.157 -0.948 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.518 -15.013 0.850 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.284 -15.066 1.308 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.538 -13.306 1.235 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.125 -13.967 2.091 1.00 0.00 H new ATOM 361 N THR A 25 15.236 -12.796 -2.588 1.00 0.00 N ATOM 362 CA THR A 25 14.649 -12.761 -3.891 1.00 0.00 C ATOM 363 C THR A 25 13.683 -13.857 -4.187 1.00 0.00 C ATOM 364 O THR A 25 12.734 -13.637 -4.937 1.00 0.00 O ATOM 365 CB THR A 25 15.727 -12.726 -4.934 1.00 0.00 C ATOM 366 OG1 THR A 25 16.627 -13.813 -4.781 1.00 0.00 O ATOM 367 CG2 THR A 25 16.507 -11.404 -4.836 1.00 0.00 C ATOM 0 H THR A 25 16.236 -12.994 -2.609 1.00 0.00 H new ATOM 0 HA THR A 25 14.053 -11.849 -3.913 1.00 0.00 H new ATOM 0 HB THR A 25 15.250 -12.805 -5.911 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.318 -13.766 -5.475 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.288 -11.385 -5.596 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.826 -10.567 -4.994 1.00 0.00 H new ATOM 0 HG23 THR A 25 16.960 -11.321 -3.848 1.00 0.00 H new ATOM 375 N LYS A 26 13.738 -15.007 -3.492 1.00 0.00 N ATOM 376 CA LYS A 26 12.924 -16.167 -3.680 1.00 0.00 C ATOM 377 C LYS A 26 11.613 -15.871 -3.037 1.00 0.00 C ATOM 378 O LYS A 26 10.588 -16.119 -3.670 1.00 0.00 O ATOM 379 CB LYS A 26 13.462 -17.425 -2.978 1.00 0.00 C ATOM 380 CG LYS A 26 14.965 -17.690 -3.098 1.00 0.00 C ATOM 381 CD LYS A 26 15.445 -18.042 -4.508 1.00 0.00 C ATOM 382 CE LYS A 26 16.954 -18.188 -4.717 1.00 0.00 C ATOM 383 NZ LYS A 26 17.613 -16.863 -4.688 1.00 0.00 N ATOM 0 H LYS A 26 14.410 -15.134 -2.735 1.00 0.00 H new ATOM 0 HA LYS A 26 12.883 -16.369 -4.750 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.212 -17.357 -1.919 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.931 -18.290 -3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.504 -16.806 -2.756 1.00 0.00 H new ATOM 0 HG3 LYS A 26 15.231 -18.505 -2.425 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.971 -18.978 -4.802 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.082 -17.273 -5.190 1.00 0.00 H new ATOM 0 HE2 LYS A 26 17.374 -18.827 -3.940 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.149 -18.677 -5.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 18.229 -16.764 -5.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.890 -16.115 -4.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.183 -16.778 -3.822 1.00 0.00 H new ATOM 397 N GLU A 27 11.659 -15.219 -1.862 1.00 0.00 N ATOM 398 CA GLU A 27 10.453 -14.958 -1.140 1.00 0.00 C ATOM 399 C GLU A 27 9.666 -13.827 -1.708 1.00 0.00 C ATOM 400 O GLU A 27 8.438 -13.882 -1.713 1.00 0.00 O ATOM 401 CB GLU A 27 10.952 -14.614 0.274 1.00 0.00 C ATOM 402 CG GLU A 27 11.819 -15.597 1.063 1.00 0.00 C ATOM 403 CD GLU A 27 12.395 -15.110 2.385 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.527 -14.559 2.343 1.00 0.00 O ATOM 405 OE2 GLU A 27 11.891 -15.276 3.528 1.00 0.00 O ATOM 0 H GLU A 27 12.512 -14.878 -1.419 1.00 0.00 H new ATOM 0 HA GLU A 27 9.772 -15.809 -1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.514 -13.683 0.197 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.071 -14.406 0.882 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.224 -16.488 1.262 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.648 -15.903 0.425 1.00 0.00 H new ATOM 412 N LEU A 28 10.427 -12.844 -2.222 1.00 0.00 N ATOM 413 CA LEU A 28 9.868 -11.796 -3.018 1.00 0.00 C ATOM 414 C LEU A 28 9.276 -12.240 -4.311 1.00 0.00 C ATOM 415 O LEU A 28 8.197 -11.742 -4.631 1.00 0.00 O ATOM 416 CB LEU A 28 10.925 -10.713 -3.293 1.00 0.00 C ATOM 417 CG LEU A 28 11.386 -9.872 -2.090 1.00 0.00 C ATOM 418 CD1 LEU A 28 12.606 -9.052 -2.544 1.00 0.00 C ATOM 419 CD2 LEU A 28 10.247 -9.024 -1.499 1.00 0.00 C ATOM 0 H LEU A 28 11.435 -12.775 -2.085 1.00 0.00 H new ATOM 0 HA LEU A 28 9.044 -11.400 -2.425 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.801 -11.196 -3.726 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.528 -10.035 -4.049 1.00 0.00 H new ATOM 0 HG LEU A 28 11.682 -10.515 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 28 12.962 -8.441 -1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 28 13.399 -9.727 -2.864 1.00 0.00 H new ATOM 0 HD13 LEU A 28 12.322 -8.406 -3.375 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.623 -8.449 -0.653 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.868 -8.343 -2.261 1.00 0.00 H new ATOM 0 HD23 LEU A 28 9.442 -9.678 -1.164 1.00 0.00 H new ATOM 431 N GLY A 29 9.936 -13.206 -4.975 1.00 0.00 N ATOM 432 CA GLY A 29 9.441 -13.732 -6.210 1.00 0.00 C ATOM 433 C GLY A 29 8.217 -14.568 -6.063 1.00 0.00 C ATOM 434 O GLY A 29 7.425 -14.703 -6.995 1.00 0.00 O ATOM 0 H GLY A 29 10.811 -13.623 -4.657 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.225 -12.904 -6.885 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.223 -14.330 -6.678 1.00 0.00 H new ATOM 438 N THR A 30 8.219 -15.190 -4.871 1.00 0.00 N ATOM 439 CA THR A 30 7.054 -15.859 -4.379 1.00 0.00 C ATOM 440 C THR A 30 5.853 -14.993 -4.216 1.00 0.00 C ATOM 441 O THR A 30 4.798 -15.293 -4.771 1.00 0.00 O ATOM 442 CB THR A 30 7.215 -16.672 -3.129 1.00 0.00 C ATOM 443 OG1 THR A 30 8.256 -17.632 -3.247 1.00 0.00 O ATOM 444 CG2 THR A 30 5.967 -17.472 -2.721 1.00 0.00 C ATOM 0 H THR A 30 9.026 -15.230 -4.248 1.00 0.00 H new ATOM 0 HA THR A 30 6.895 -16.556 -5.202 1.00 0.00 H new ATOM 0 HB THR A 30 7.431 -15.915 -2.375 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.108 -17.173 -3.399 1.00 0.00 H new ATOM 0 HG21 THR A 30 6.175 -18.029 -1.807 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.137 -16.788 -2.548 1.00 0.00 H new ATOM 0 HG23 THR A 30 5.704 -18.167 -3.518 1.00 0.00 H new ATOM 452 N VAL A 31 5.956 -13.903 -3.434 1.00 0.00 N ATOM 453 CA VAL A 31 5.034 -12.822 -3.272 1.00 0.00 C ATOM 454 C VAL A 31 4.650 -12.257 -4.596 1.00 0.00 C ATOM 455 O VAL A 31 3.450 -12.261 -4.869 1.00 0.00 O ATOM 456 CB VAL A 31 5.587 -11.778 -2.347 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.883 -10.412 -2.395 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.568 -12.343 -0.917 1.00 0.00 C ATOM 0 H VAL A 31 6.781 -13.768 -2.850 1.00 0.00 H new ATOM 0 HA VAL A 31 4.125 -13.206 -2.808 1.00 0.00 H new ATOM 0 HB VAL A 31 6.601 -11.567 -2.688 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.360 -9.732 -1.689 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.956 -10.000 -3.402 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.833 -10.534 -2.128 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.966 -11.599 -0.227 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.544 -12.587 -0.636 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.181 -13.244 -0.873 1.00 0.00 H new ATOM 468 N MET A 32 5.559 -11.967 -5.543 1.00 0.00 N ATOM 469 CA MET A 32 5.183 -11.540 -6.855 1.00 0.00 C ATOM 470 C MET A 32 4.295 -12.482 -7.593 1.00 0.00 C ATOM 471 O MET A 32 3.244 -12.056 -8.068 1.00 0.00 O ATOM 472 CB MET A 32 6.508 -11.307 -7.601 1.00 0.00 C ATOM 473 CG MET A 32 7.188 -9.992 -7.216 1.00 0.00 C ATOM 474 SD MET A 32 6.950 -8.574 -8.328 1.00 0.00 S ATOM 475 CE MET A 32 8.347 -7.702 -7.564 1.00 0.00 C ATOM 0 H MET A 32 6.567 -12.029 -5.397 1.00 0.00 H new ATOM 0 HA MET A 32 4.573 -10.640 -6.783 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.186 -12.135 -7.393 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.320 -11.311 -8.675 1.00 0.00 H new ATOM 0 HG2 MET A 32 6.834 -9.707 -6.225 1.00 0.00 H new ATOM 0 HG3 MET A 32 8.259 -10.178 -7.131 1.00 0.00 H new ATOM 0 HE1 MET A 32 8.435 -6.706 -7.998 1.00 0.00 H new ATOM 0 HE2 MET A 32 8.180 -7.617 -6.490 1.00 0.00 H new ATOM 0 HE3 MET A 32 9.266 -8.259 -7.745 1.00 0.00 H new ATOM 485 N ARG A 33 4.563 -13.795 -7.711 1.00 0.00 N ATOM 486 CA ARG A 33 3.623 -14.672 -8.337 1.00 0.00 C ATOM 487 C ARG A 33 2.313 -14.871 -7.655 1.00 0.00 C ATOM 488 O ARG A 33 1.302 -15.265 -8.234 1.00 0.00 O ATOM 489 CB ARG A 33 4.319 -16.035 -8.492 1.00 0.00 C ATOM 490 CG ARG A 33 3.766 -17.041 -9.503 1.00 0.00 C ATOM 491 CD ARG A 33 4.451 -16.897 -10.863 1.00 0.00 C ATOM 492 NE ARG A 33 4.025 -18.081 -11.661 1.00 0.00 N ATOM 493 CZ ARG A 33 4.195 -18.138 -13.014 1.00 0.00 C ATOM 494 NH1 ARG A 33 4.933 -17.199 -13.676 1.00 0.00 N ATOM 495 NH2 ARG A 33 3.658 -19.133 -13.779 1.00 0.00 N ATOM 0 H ARG A 33 5.417 -14.244 -7.379 1.00 0.00 H new ATOM 0 HA ARG A 33 3.350 -14.192 -9.277 1.00 0.00 H new ATOM 0 HB2 ARG A 33 5.360 -15.845 -8.753 1.00 0.00 H new ATOM 0 HB3 ARG A 33 4.319 -16.517 -7.515 1.00 0.00 H new ATOM 0 HG2 ARG A 33 3.909 -18.054 -9.127 1.00 0.00 H new ATOM 0 HG3 ARG A 33 2.692 -16.892 -9.617 1.00 0.00 H new ATOM 0 HD2 ARG A 33 4.156 -15.969 -11.353 1.00 0.00 H new ATOM 0 HD3 ARG A 33 5.535 -16.869 -10.754 1.00 0.00 H new ATOM 0 HE ARG A 33 3.594 -18.872 -11.182 1.00 0.00 H new ATOM 0 HH11 ARG A 33 5.370 -16.436 -13.159 1.00 0.00 H new ATOM 0 HH12 ARG A 33 5.047 -17.260 -14.688 1.00 0.00 H new ATOM 0 HH21 ARG A 33 3.106 -19.871 -13.342 1.00 0.00 H new ATOM 0 HH22 ARG A 33 3.809 -19.139 -14.788 1.00 0.00 H new ATOM 509 N SER A 34 2.307 -14.567 -6.345 1.00 0.00 N ATOM 510 CA SER A 34 1.234 -14.919 -5.468 1.00 0.00 C ATOM 511 C SER A 34 0.049 -14.039 -5.675 1.00 0.00 C ATOM 512 O SER A 34 -1.137 -14.361 -5.714 1.00 0.00 O ATOM 513 CB SER A 34 1.513 -15.000 -3.957 1.00 0.00 C ATOM 514 OG SER A 34 2.415 -16.053 -3.652 1.00 0.00 O ATOM 0 H SER A 34 3.066 -14.065 -5.884 1.00 0.00 H new ATOM 0 HA SER A 34 1.054 -15.951 -5.770 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.927 -14.053 -3.611 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.577 -15.154 -3.420 1.00 0.00 H new ATOM 0 HG SER A 34 3.258 -15.911 -4.132 1.00 0.00 H new ATOM 520 N LEU A 35 0.432 -12.785 -5.977 1.00 0.00 N ATOM 521 CA LEU A 35 -0.407 -11.768 -6.530 1.00 0.00 C ATOM 522 C LEU A 35 -0.657 -11.957 -7.987 1.00 0.00 C ATOM 523 O LEU A 35 -1.684 -12.533 -8.341 1.00 0.00 O ATOM 524 CB LEU A 35 0.304 -10.419 -6.336 1.00 0.00 C ATOM 525 CG LEU A 35 0.658 -10.096 -4.875 1.00 0.00 C ATOM 526 CD1 LEU A 35 1.565 -8.856 -4.816 1.00 0.00 C ATOM 527 CD2 LEU A 35 -0.616 -9.991 -4.019 1.00 0.00 C ATOM 0 H LEU A 35 1.388 -12.462 -5.825 1.00 0.00 H new ATOM 0 HA LEU A 35 -1.371 -11.811 -6.022 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.219 -10.415 -6.929 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.333 -9.626 -6.727 1.00 0.00 H new ATOM 0 HG LEU A 35 1.233 -10.912 -4.438 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.811 -8.634 -3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.482 -9.049 -5.373 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.046 -8.004 -5.256 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.344 -9.762 -2.989 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.253 -9.198 -4.411 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.154 -10.938 -4.050 1.00 0.00 H new ATOM 539 N GLY A 36 0.269 -11.590 -8.891 1.00 0.00 N ATOM 540 CA GLY A 36 0.218 -12.048 -10.245 1.00 0.00 C ATOM 541 C GLY A 36 1.217 -11.372 -11.119 1.00 0.00 C ATOM 542 O GLY A 36 0.859 -10.539 -11.950 1.00 0.00 O ATOM 0 H GLY A 36 1.055 -10.974 -8.683 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.391 -13.124 -10.267 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.782 -11.878 -10.644 1.00 0.00 H new ATOM 546 N GLN A 37 2.503 -11.661 -10.850 1.00 0.00 N ATOM 547 CA GLN A 37 3.577 -10.958 -11.482 1.00 0.00 C ATOM 548 C GLN A 37 4.634 -11.932 -11.876 1.00 0.00 C ATOM 549 O GLN A 37 4.633 -13.040 -11.342 1.00 0.00 O ATOM 550 CB GLN A 37 4.133 -9.898 -10.517 1.00 0.00 C ATOM 551 CG GLN A 37 3.369 -8.575 -10.597 1.00 0.00 C ATOM 552 CD GLN A 37 3.400 -7.895 -9.235 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.683 -8.379 -8.360 1.00 0.00 O ATOM 554 NE2 GLN A 37 4.125 -6.757 -9.066 1.00 0.00 N ATOM 0 H GLN A 37 2.800 -12.383 -10.193 1.00 0.00 H new ATOM 0 HA GLN A 37 3.220 -10.451 -12.378 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.086 -10.280 -9.497 1.00 0.00 H new ATOM 0 HB3 GLN A 37 5.184 -9.721 -10.743 1.00 0.00 H new ATOM 0 HG2 GLN A 37 3.818 -7.927 -11.350 1.00 0.00 H new ATOM 0 HG3 GLN A 37 2.339 -8.754 -10.904 1.00 0.00 H new ATOM 0 HE21 GLN A 37 4.703 -6.402 -9.828 1.00 0.00 H new ATOM 0 HE22 GLN A 37 4.091 -6.258 -8.177 1.00 0.00 H new ATOM 563 N ASN A 38 5.538 -11.615 -12.820 1.00 0.00 N ATOM 564 CA ASN A 38 6.743 -12.357 -13.028 1.00 0.00 C ATOM 565 C ASN A 38 7.934 -11.465 -13.092 1.00 0.00 C ATOM 566 O ASN A 38 8.157 -10.765 -14.079 1.00 0.00 O ATOM 567 CB ASN A 38 6.514 -13.100 -14.355 1.00 0.00 C ATOM 568 CG ASN A 38 7.398 -14.336 -14.269 1.00 0.00 C ATOM 569 OD1 ASN A 38 7.176 -15.148 -13.372 1.00 0.00 O ATOM 570 ND2 ASN A 38 8.459 -14.472 -15.109 1.00 0.00 N ATOM 0 H ASN A 38 5.429 -10.824 -13.454 1.00 0.00 H new ATOM 0 HA ASN A 38 6.950 -13.043 -12.206 1.00 0.00 H new ATOM 0 HB2 ASN A 38 5.466 -13.372 -14.480 1.00 0.00 H new ATOM 0 HB3 ASN A 38 6.786 -12.478 -15.208 1.00 0.00 H new ATOM 0 HD21 ASN A 38 9.095 -15.263 -15.004 1.00 0.00 H new ATOM 0 HD22 ASN A 38 8.619 -13.783 -15.844 1.00 0.00 H new ATOM 577 N PRO A 39 8.773 -11.267 -12.119 1.00 0.00 N ATOM 578 CA PRO A 39 10.086 -10.706 -12.252 1.00 0.00 C ATOM 579 C PRO A 39 11.099 -11.751 -12.570 1.00 0.00 C ATOM 580 O PRO A 39 10.848 -12.956 -12.584 1.00 0.00 O ATOM 581 CB PRO A 39 10.249 -10.013 -10.901 1.00 0.00 C ATOM 582 CG PRO A 39 9.674 -11.069 -9.944 1.00 0.00 C ATOM 583 CD PRO A 39 8.469 -11.602 -10.736 1.00 0.00 C ATOM 0 HA PRO A 39 10.226 -10.013 -13.081 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.292 -9.784 -10.681 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.699 -9.073 -10.853 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.396 -11.855 -9.723 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.375 -10.634 -8.990 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.350 -12.677 -10.604 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.540 -11.136 -10.409 1.00 0.00 H new ATOM 591 N THR A 40 12.363 -11.446 -12.913 1.00 0.00 N ATOM 592 CA THR A 40 13.439 -12.387 -12.945 1.00 0.00 C ATOM 593 C THR A 40 14.422 -11.905 -11.934 1.00 0.00 C ATOM 594 O THR A 40 14.443 -10.740 -11.541 1.00 0.00 O ATOM 595 CB THR A 40 14.005 -12.729 -14.291 1.00 0.00 C ATOM 596 OG1 THR A 40 14.755 -13.934 -14.313 1.00 0.00 O ATOM 597 CG2 THR A 40 14.915 -11.606 -14.817 1.00 0.00 C ATOM 0 H THR A 40 12.647 -10.503 -13.179 1.00 0.00 H new ATOM 0 HA THR A 40 13.065 -13.378 -12.686 1.00 0.00 H new ATOM 0 HB THR A 40 13.130 -12.858 -14.928 1.00 0.00 H new ATOM 0 HG1 THR A 40 15.091 -14.094 -15.220 1.00 0.00 H new ATOM 0 HG21 THR A 40 15.309 -11.885 -15.794 1.00 0.00 H new ATOM 0 HG22 THR A 40 14.340 -10.684 -14.907 1.00 0.00 H new ATOM 0 HG23 THR A 40 15.741 -11.452 -14.123 1.00 0.00 H new ATOM 605 N GLU A 41 15.313 -12.803 -11.476 1.00 0.00 N ATOM 606 CA GLU A 41 16.315 -12.622 -10.473 1.00 0.00 C ATOM 607 C GLU A 41 17.122 -11.374 -10.573 1.00 0.00 C ATOM 608 O GLU A 41 17.001 -10.525 -9.691 1.00 0.00 O ATOM 609 CB GLU A 41 17.235 -13.815 -10.162 1.00 0.00 C ATOM 610 CG GLU A 41 18.261 -13.798 -9.027 1.00 0.00 C ATOM 611 CD GLU A 41 18.968 -15.144 -8.960 1.00 0.00 C ATOM 612 OE1 GLU A 41 18.565 -16.045 -9.743 1.00 0.00 O ATOM 613 OE2 GLU A 41 20.038 -15.256 -8.305 1.00 0.00 O ATOM 0 H GLU A 41 15.330 -13.752 -11.849 1.00 0.00 H new ATOM 0 HA GLU A 41 15.650 -12.525 -9.615 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.584 -14.669 -9.978 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.788 -14.027 -11.077 1.00 0.00 H new ATOM 0 HG2 GLU A 41 18.987 -13.002 -9.191 1.00 0.00 H new ATOM 0 HG3 GLU A 41 17.766 -13.588 -8.079 1.00 0.00 H new ATOM 620 N ALA A 42 17.882 -11.174 -11.665 1.00 0.00 N ATOM 621 CA ALA A 42 18.720 -10.029 -11.840 1.00 0.00 C ATOM 622 C ALA A 42 18.046 -8.709 -11.690 1.00 0.00 C ATOM 623 O ALA A 42 18.542 -7.862 -10.949 1.00 0.00 O ATOM 624 CB ALA A 42 19.660 -9.925 -13.053 1.00 0.00 C ATOM 0 H ALA A 42 17.914 -11.827 -12.448 1.00 0.00 H new ATOM 0 HA ALA A 42 19.362 -10.259 -10.990 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.211 -8.986 -13.007 1.00 0.00 H new ATOM 0 HB2 ALA A 42 20.362 -10.758 -13.041 1.00 0.00 H new ATOM 0 HB3 ALA A 42 19.074 -9.957 -13.971 1.00 0.00 H new ATOM 630 N GLU A 43 16.971 -8.421 -12.446 1.00 0.00 N ATOM 631 CA GLU A 43 15.864 -7.527 -12.314 1.00 0.00 C ATOM 632 C GLU A 43 15.306 -7.260 -10.958 1.00 0.00 C ATOM 633 O GLU A 43 15.130 -6.127 -10.513 1.00 0.00 O ATOM 634 CB GLU A 43 14.774 -7.907 -13.331 1.00 0.00 C ATOM 635 CG GLU A 43 13.635 -6.919 -13.589 1.00 0.00 C ATOM 636 CD GLU A 43 12.731 -7.245 -14.768 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.957 -6.702 -15.883 1.00 0.00 O ATOM 638 OE2 GLU A 43 11.642 -7.819 -14.498 1.00 0.00 O ATOM 0 H GLU A 43 16.871 -8.926 -13.327 1.00 0.00 H new ATOM 0 HA GLU A 43 16.298 -6.551 -12.534 1.00 0.00 H new ATOM 0 HB2 GLU A 43 15.265 -8.102 -14.284 1.00 0.00 H new ATOM 0 HB3 GLU A 43 14.329 -8.847 -13.003 1.00 0.00 H new ATOM 0 HG2 GLU A 43 13.021 -6.859 -12.690 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.066 -5.930 -13.748 1.00 0.00 H new ATOM 645 N LEU A 44 14.974 -8.325 -10.206 1.00 0.00 N ATOM 646 CA LEU A 44 14.549 -8.214 -8.845 1.00 0.00 C ATOM 647 C LEU A 44 15.585 -7.704 -7.903 1.00 0.00 C ATOM 648 O LEU A 44 15.339 -6.759 -7.155 1.00 0.00 O ATOM 649 CB LEU A 44 13.893 -9.503 -8.321 1.00 0.00 C ATOM 650 CG LEU A 44 13.281 -9.520 -6.910 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.449 -8.285 -6.523 1.00 0.00 C ATOM 652 CD2 LEU A 44 12.348 -10.740 -6.830 1.00 0.00 C ATOM 0 H LEU A 44 15.002 -9.284 -10.551 1.00 0.00 H new ATOM 0 HA LEU A 44 13.784 -7.439 -8.874 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.105 -9.777 -9.022 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.644 -10.292 -8.361 1.00 0.00 H new ATOM 0 HG LEU A 44 14.124 -9.543 -6.220 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.068 -8.406 -5.509 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.076 -7.394 -6.571 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.613 -8.178 -7.215 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.894 -10.786 -5.840 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.566 -10.650 -7.584 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.922 -11.649 -7.008 1.00 0.00 H new ATOM 664 N GLN A 45 16.794 -8.283 -8.006 1.00 0.00 N ATOM 665 CA GLN A 45 17.963 -7.894 -7.280 1.00 0.00 C ATOM 666 C GLN A 45 18.291 -6.450 -7.440 1.00 0.00 C ATOM 667 O GLN A 45 18.651 -5.724 -6.514 1.00 0.00 O ATOM 668 CB GLN A 45 19.289 -8.655 -7.449 1.00 0.00 C ATOM 669 CG GLN A 45 20.429 -8.230 -6.522 1.00 0.00 C ATOM 670 CD GLN A 45 20.014 -8.165 -5.059 1.00 0.00 C ATOM 671 OE1 GLN A 45 19.208 -9.012 -4.678 1.00 0.00 O ATOM 672 NE2 GLN A 45 20.578 -7.251 -4.225 1.00 0.00 N ATOM 0 H GLN A 45 16.965 -9.069 -8.633 1.00 0.00 H new ATOM 0 HA GLN A 45 17.601 -8.171 -6.290 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.098 -9.717 -7.294 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.623 -8.538 -8.480 1.00 0.00 H new ATOM 0 HG2 GLN A 45 21.257 -8.931 -6.628 1.00 0.00 H new ATOM 0 HG3 GLN A 45 20.797 -7.252 -6.833 1.00 0.00 H new ATOM 0 HE21 GLN A 45 21.242 -6.568 -4.591 1.00 0.00 H new ATOM 0 HE22 GLN A 45 20.337 -7.248 -3.234 1.00 0.00 H new ATOM 681 N ASP A 46 17.984 -5.958 -8.654 1.00 0.00 N ATOM 682 CA ASP A 46 18.041 -4.568 -8.983 1.00 0.00 C ATOM 683 C ASP A 46 17.121 -3.657 -8.245 1.00 0.00 C ATOM 684 O ASP A 46 17.467 -2.535 -7.879 1.00 0.00 O ATOM 685 CB ASP A 46 17.841 -4.395 -10.498 1.00 0.00 C ATOM 686 CG ASP A 46 18.567 -3.125 -10.918 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.810 -3.126 -11.129 1.00 0.00 O ATOM 688 OD2 ASP A 46 17.911 -2.054 -11.013 1.00 0.00 O ATOM 0 H ASP A 46 17.686 -6.547 -9.432 1.00 0.00 H new ATOM 0 HA ASP A 46 19.033 -4.255 -8.656 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.235 -5.257 -11.037 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.780 -4.326 -10.738 1.00 0.00 H new ATOM 693 N MET A 47 15.869 -4.106 -8.048 1.00 0.00 N ATOM 694 CA MET A 47 14.898 -3.320 -7.353 1.00 0.00 C ATOM 695 C MET A 47 15.367 -3.150 -5.949 1.00 0.00 C ATOM 696 O MET A 47 15.378 -2.027 -5.447 1.00 0.00 O ATOM 697 CB MET A 47 13.468 -3.880 -7.252 1.00 0.00 C ATOM 698 CG MET A 47 12.810 -4.343 -8.553 1.00 0.00 C ATOM 699 SD MET A 47 11.267 -5.273 -8.311 1.00 0.00 S ATOM 700 CE MET A 47 11.085 -6.101 -9.918 1.00 0.00 C ATOM 0 H MET A 47 15.529 -5.012 -8.370 1.00 0.00 H new ATOM 0 HA MET A 47 14.824 -2.409 -7.947 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.482 -4.723 -6.561 1.00 0.00 H new ATOM 0 HB3 MET A 47 12.835 -3.113 -6.806 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.603 -3.471 -9.174 1.00 0.00 H new ATOM 0 HG3 MET A 47 13.515 -4.966 -9.103 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.065 -6.470 -10.024 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.300 -5.393 -10.718 1.00 0.00 H new ATOM 0 HE3 MET A 47 11.781 -6.938 -9.977 1.00 0.00 H new ATOM 710 N ILE A 48 15.913 -4.220 -5.343 1.00 0.00 N ATOM 711 CA ILE A 48 16.483 -4.278 -4.032 1.00 0.00 C ATOM 712 C ILE A 48 17.716 -3.451 -3.906 1.00 0.00 C ATOM 713 O ILE A 48 17.849 -2.651 -2.981 1.00 0.00 O ATOM 714 CB ILE A 48 16.623 -5.673 -3.498 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.377 -6.573 -3.461 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.100 -5.615 -2.036 1.00 0.00 C ATOM 717 CD1 ILE A 48 14.143 -5.948 -2.812 1.00 0.00 C ATOM 0 H ILE A 48 15.959 -5.124 -5.814 1.00 0.00 H new ATOM 0 HA ILE A 48 15.755 -3.812 -3.369 1.00 0.00 H new ATOM 0 HB ILE A 48 17.313 -6.117 -4.216 1.00 0.00 H new ATOM 0 HG12 ILE A 48 15.125 -6.860 -4.482 1.00 0.00 H new ATOM 0 HG13 ILE A 48 15.626 -7.489 -2.925 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.202 -6.628 -1.646 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.064 -5.108 -1.988 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.372 -5.068 -1.437 1.00 0.00 H new ATOM 0 HD11 ILE A 48 13.319 -6.661 -2.835 1.00 0.00 H new ATOM 0 HD12 ILE A 48 14.368 -5.687 -1.778 1.00 0.00 H new ATOM 0 HD13 ILE A 48 13.860 -5.049 -3.359 1.00 0.00 H new ATOM 729 N ASN A 49 18.679 -3.562 -4.839 1.00 0.00 N ATOM 730 CA ASN A 49 19.911 -2.851 -4.985 1.00 0.00 C ATOM 731 C ASN A 49 19.761 -1.381 -4.788 1.00 0.00 C ATOM 732 O ASN A 49 20.656 -0.773 -4.203 1.00 0.00 O ATOM 733 CB ASN A 49 20.628 -3.130 -6.317 1.00 0.00 C ATOM 734 CG ASN A 49 21.525 -4.358 -6.382 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.727 -5.195 -5.504 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.223 -4.506 -7.540 1.00 0.00 N ATOM 0 H ASN A 49 18.574 -4.244 -5.590 1.00 0.00 H new ATOM 0 HA ASN A 49 20.540 -3.241 -4.184 1.00 0.00 H new ATOM 0 HB2 ASN A 49 19.870 -3.224 -7.095 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.232 -2.257 -6.564 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.875 -5.283 -7.647 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.094 -3.840 -8.302 1.00 0.00 H new ATOM 743 N GLU A 50 18.669 -0.752 -5.257 1.00 0.00 N ATOM 744 CA GLU A 50 18.405 0.646 -5.118 1.00 0.00 C ATOM 745 C GLU A 50 18.010 1.060 -3.742 1.00 0.00 C ATOM 746 O GLU A 50 18.490 2.031 -3.158 1.00 0.00 O ATOM 747 CB GLU A 50 17.252 0.999 -6.073 1.00 0.00 C ATOM 748 CG GLU A 50 16.996 2.500 -6.220 1.00 0.00 C ATOM 749 CD GLU A 50 15.896 2.817 -7.223 1.00 0.00 C ATOM 750 OE1 GLU A 50 14.786 2.228 -7.127 1.00 0.00 O ATOM 751 OE2 GLU A 50 16.193 3.570 -8.189 1.00 0.00 O ATOM 0 H GLU A 50 17.931 -1.245 -5.760 1.00 0.00 H new ATOM 0 HA GLU A 50 19.332 1.172 -5.347 1.00 0.00 H new ATOM 0 HB2 GLU A 50 17.469 0.581 -7.056 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.340 0.520 -5.717 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.726 2.914 -5.249 1.00 0.00 H new ATOM 0 HG3 GLU A 50 17.918 2.992 -6.531 1.00 0.00 H new ATOM 758 N VAL A 51 17.097 0.318 -3.091 1.00 0.00 N ATOM 759 CA VAL A 51 16.600 0.690 -1.803 1.00 0.00 C ATOM 760 C VAL A 51 17.406 0.084 -0.706 1.00 0.00 C ATOM 761 O VAL A 51 17.209 0.531 0.423 1.00 0.00 O ATOM 762 CB VAL A 51 15.178 0.259 -1.600 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.208 1.167 -2.375 1.00 0.00 C ATOM 764 CG2 VAL A 51 14.855 -1.188 -2.012 1.00 0.00 C ATOM 0 H VAL A 51 16.700 -0.546 -3.460 1.00 0.00 H new ATOM 0 HA VAL A 51 16.668 1.777 -1.770 1.00 0.00 H new ATOM 0 HB VAL A 51 15.050 0.334 -0.520 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.184 0.831 -2.209 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.314 2.194 -2.026 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.438 1.120 -3.440 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.801 -1.394 -1.823 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.066 -1.320 -3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.469 -1.877 -1.432 1.00 0.00 H new ATOM 774 N ASP A 52 18.319 -0.858 -1.004 1.00 0.00 N ATOM 775 CA ASP A 52 19.271 -1.245 -0.009 1.00 0.00 C ATOM 776 C ASP A 52 20.264 -0.202 0.373 1.00 0.00 C ATOM 777 O ASP A 52 21.016 0.358 -0.423 1.00 0.00 O ATOM 778 CB ASP A 52 19.960 -2.512 -0.544 1.00 0.00 C ATOM 779 CG ASP A 52 21.022 -3.154 0.337 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.704 -3.583 1.478 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.210 -3.268 -0.066 1.00 0.00 O ATOM 0 H ASP A 52 18.399 -1.337 -1.901 1.00 0.00 H new ATOM 0 HA ASP A 52 18.738 -1.419 0.926 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.189 -3.257 -0.741 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.419 -2.267 -1.502 1.00 0.00 H new ATOM 786 N ALA A 53 20.244 0.128 1.676 1.00 0.00 N ATOM 787 CA ALA A 53 21.031 1.044 2.443 1.00 0.00 C ATOM 788 C ALA A 53 22.278 0.357 2.882 1.00 0.00 C ATOM 789 O ALA A 53 23.319 0.711 2.331 1.00 0.00 O ATOM 790 CB ALA A 53 20.352 1.678 3.669 1.00 0.00 C ATOM 0 H ALA A 53 19.562 -0.326 2.284 1.00 0.00 H new ATOM 0 HA ALA A 53 21.218 1.880 1.769 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.051 2.352 4.164 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.473 2.238 3.349 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.050 0.894 4.363 1.00 0.00 H new ATOM 796 N ASP A 54 22.268 -0.578 3.849 1.00 0.00 N ATOM 797 CA ASP A 54 23.428 -1.228 4.374 1.00 0.00 C ATOM 798 C ASP A 54 24.476 -1.786 3.473 1.00 0.00 C ATOM 799 O ASP A 54 25.641 -1.391 3.475 1.00 0.00 O ATOM 800 CB ASP A 54 23.070 -2.201 5.510 1.00 0.00 C ATOM 801 CG ASP A 54 21.999 -3.236 5.197 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.110 -3.973 4.181 1.00 0.00 O ATOM 803 OD2 ASP A 54 20.936 -3.183 5.872 1.00 0.00 O ATOM 0 H ASP A 54 21.404 -0.897 4.287 1.00 0.00 H new ATOM 0 HA ASP A 54 23.967 -0.355 4.742 1.00 0.00 H new ATOM 0 HB2 ASP A 54 23.977 -2.726 5.809 1.00 0.00 H new ATOM 0 HB3 ASP A 54 22.741 -1.617 6.370 1.00 0.00 H new ATOM 808 N GLY A 55 24.210 -2.882 2.741 1.00 0.00 N ATOM 809 CA GLY A 55 25.164 -3.552 1.913 1.00 0.00 C ATOM 810 C GLY A 55 24.964 -5.028 1.869 1.00 0.00 C ATOM 811 O GLY A 55 25.648 -5.723 1.120 1.00 0.00 O ATOM 0 H GLY A 55 23.289 -3.321 2.726 1.00 0.00 H new ATOM 0 HA2 GLY A 55 25.102 -3.152 0.901 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.168 -3.338 2.279 1.00 0.00 H new ATOM 815 N ASN A 56 23.874 -5.529 2.477 1.00 0.00 N ATOM 816 CA ASN A 56 23.627 -6.938 2.481 1.00 0.00 C ATOM 817 C ASN A 56 23.047 -7.536 1.246 1.00 0.00 C ATOM 818 O ASN A 56 23.227 -8.732 1.023 1.00 0.00 O ATOM 819 CB ASN A 56 22.960 -7.522 3.737 1.00 0.00 C ATOM 820 CG ASN A 56 21.572 -6.979 4.047 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.004 -6.327 3.172 1.00 0.00 O ATOM 822 ND2 ASN A 56 20.993 -7.295 5.236 1.00 0.00 N ATOM 0 H ASN A 56 23.172 -4.968 2.960 1.00 0.00 H new ATOM 0 HA ASN A 56 24.667 -7.264 2.505 1.00 0.00 H new ATOM 0 HB2 ASN A 56 22.892 -8.604 3.623 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.607 -7.332 4.594 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.041 -6.988 5.437 1.00 0.00 H new ATOM 0 HD22 ASN A 56 21.510 -7.839 5.927 1.00 0.00 H new ATOM 829 N GLY A 57 22.268 -6.744 0.488 1.00 0.00 N ATOM 830 CA GLY A 57 21.620 -7.324 -0.647 1.00 0.00 C ATOM 831 C GLY A 57 20.174 -7.653 -0.502 1.00 0.00 C ATOM 832 O GLY A 57 19.437 -7.703 -1.485 1.00 0.00 O ATOM 0 H GLY A 57 22.092 -5.752 0.647 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.729 -6.638 -1.487 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.151 -8.239 -0.911 1.00 0.00 H new ATOM 836 N THR A 58 19.812 -7.957 0.757 1.00 0.00 N ATOM 837 CA THR A 58 18.442 -8.184 1.100 1.00 0.00 C ATOM 838 C THR A 58 17.855 -6.899 1.574 1.00 0.00 C ATOM 839 O THR A 58 18.579 -6.068 2.119 1.00 0.00 O ATOM 840 CB THR A 58 18.233 -9.230 2.154 1.00 0.00 C ATOM 841 OG1 THR A 58 19.102 -9.135 3.273 1.00 0.00 O ATOM 842 CG2 THR A 58 18.393 -10.643 1.568 1.00 0.00 C ATOM 0 H THR A 58 20.465 -8.046 1.535 1.00 0.00 H new ATOM 0 HA THR A 58 17.953 -8.557 0.200 1.00 0.00 H new ATOM 0 HB THR A 58 17.218 -9.047 2.505 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.254 -10.028 3.646 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.236 -11.382 2.353 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.659 -10.794 0.776 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.397 -10.756 1.159 1.00 0.00 H new ATOM 850 N ILE A 59 16.511 -6.864 1.587 1.00 0.00 N ATOM 851 CA ILE A 59 15.815 -5.815 2.265 1.00 0.00 C ATOM 852 C ILE A 59 15.647 -6.172 3.702 1.00 0.00 C ATOM 853 O ILE A 59 15.240 -7.271 4.075 1.00 0.00 O ATOM 854 CB ILE A 59 14.604 -5.283 1.558 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.772 -4.162 2.204 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.694 -6.395 1.010 1.00 0.00 C ATOM 857 CD1 ILE A 59 13.027 -3.262 1.218 1.00 0.00 C ATOM 0 H ILE A 59 15.911 -7.554 1.134 1.00 0.00 H new ATOM 0 HA ILE A 59 16.440 -4.923 2.238 1.00 0.00 H new ATOM 0 HB ILE A 59 15.098 -4.752 0.744 1.00 0.00 H new ATOM 0 HG12 ILE A 59 13.047 -4.612 2.881 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.433 -3.543 2.811 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.835 -5.948 0.509 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.252 -7.004 0.299 1.00 0.00 H new ATOM 0 HG23 ILE A 59 13.349 -7.021 1.833 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.470 -2.503 1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.744 -2.777 0.555 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.336 -3.863 0.627 1.00 0.00 H new ATOM 869 N ASP A 60 15.881 -5.155 4.550 1.00 0.00 N ATOM 870 CA ASP A 60 15.741 -5.187 5.973 1.00 0.00 C ATOM 871 C ASP A 60 14.568 -4.356 6.366 1.00 0.00 C ATOM 872 O ASP A 60 14.003 -3.651 5.532 1.00 0.00 O ATOM 873 CB ASP A 60 17.078 -4.676 6.536 1.00 0.00 C ATOM 874 CG ASP A 60 18.201 -5.674 6.298 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.787 -5.617 5.183 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.627 -6.429 7.212 1.00 0.00 O ATOM 0 H ASP A 60 16.191 -4.243 4.215 1.00 0.00 H new ATOM 0 HA ASP A 60 15.545 -6.182 6.371 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.331 -3.724 6.069 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.976 -4.489 7.605 1.00 0.00 H new ATOM 881 N PHE A 61 14.199 -4.440 7.657 1.00 0.00 N ATOM 882 CA PHE A 61 13.026 -3.756 8.106 1.00 0.00 C ATOM 883 C PHE A 61 13.165 -2.273 8.119 1.00 0.00 C ATOM 884 O PHE A 61 12.187 -1.634 7.735 1.00 0.00 O ATOM 885 CB PHE A 61 12.514 -4.297 9.451 1.00 0.00 C ATOM 886 CG PHE A 61 11.131 -3.881 9.818 1.00 0.00 C ATOM 887 CD1 PHE A 61 10.067 -3.906 8.948 1.00 0.00 C ATOM 888 CD2 PHE A 61 10.962 -3.479 11.122 1.00 0.00 C ATOM 889 CE1 PHE A 61 8.863 -3.363 9.331 1.00 0.00 C ATOM 890 CE2 PHE A 61 9.753 -2.980 11.545 1.00 0.00 C ATOM 891 CZ PHE A 61 8.733 -2.917 10.625 1.00 0.00 C ATOM 0 H PHE A 61 14.698 -4.967 8.374 1.00 0.00 H new ATOM 0 HA PHE A 61 12.264 -3.973 7.358 1.00 0.00 H new ATOM 0 HB2 PHE A 61 12.554 -5.386 9.425 1.00 0.00 H new ATOM 0 HB3 PHE A 61 13.195 -3.972 10.238 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.176 -4.350 7.969 1.00 0.00 H new ATOM 0 HD2 PHE A 61 11.784 -3.556 11.818 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.041 -3.289 8.634 1.00 0.00 H new ATOM 0 HE2 PHE A 61 9.609 -2.649 12.563 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.786 -2.498 10.933 1.00 0.00 H new ATOM 901 N PRO A 62 14.227 -1.573 8.389 1.00 0.00 N ATOM 902 CA PRO A 62 14.144 -0.144 8.308 1.00 0.00 C ATOM 903 C PRO A 62 14.156 0.335 6.897 1.00 0.00 C ATOM 904 O PRO A 62 13.770 1.484 6.685 1.00 0.00 O ATOM 905 CB PRO A 62 15.399 0.396 8.990 1.00 0.00 C ATOM 906 CG PRO A 62 15.964 -0.769 9.817 1.00 0.00 C ATOM 907 CD PRO A 62 15.184 -2.022 9.389 1.00 0.00 C ATOM 0 HA PRO A 62 13.216 0.192 8.772 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.125 0.741 8.254 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.161 1.248 9.627 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.031 -0.894 9.633 1.00 0.00 H new ATOM 0 HG3 PRO A 62 15.844 -0.582 10.884 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.853 -2.777 8.978 1.00 0.00 H new ATOM 0 HD3 PRO A 62 14.676 -2.476 10.240 1.00 0.00 H new ATOM 915 N GLU A 63 14.618 -0.453 5.910 1.00 0.00 N ATOM 916 CA GLU A 63 14.812 -0.095 4.539 1.00 0.00 C ATOM 917 C GLU A 63 13.464 -0.108 3.904 1.00 0.00 C ATOM 918 O GLU A 63 13.075 0.901 3.318 1.00 0.00 O ATOM 919 CB GLU A 63 15.759 -1.126 3.901 1.00 0.00 C ATOM 920 CG GLU A 63 17.219 -0.846 4.263 1.00 0.00 C ATOM 921 CD GLU A 63 18.170 -1.921 3.755 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.795 -3.011 3.247 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.417 -1.759 3.837 1.00 0.00 O ATOM 0 H GLU A 63 14.878 -1.423 6.088 1.00 0.00 H new ATOM 0 HA GLU A 63 15.262 0.890 4.414 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.486 -2.127 4.234 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.642 -1.108 2.817 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.513 0.118 3.848 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.311 -0.768 5.346 1.00 0.00 H new ATOM 930 N PHE A 64 12.636 -1.138 4.151 1.00 0.00 N ATOM 931 CA PHE A 64 11.212 -1.104 4.022 1.00 0.00 C ATOM 932 C PHE A 64 10.442 0.087 4.480 1.00 0.00 C ATOM 933 O PHE A 64 9.595 0.641 3.781 1.00 0.00 O ATOM 934 CB PHE A 64 10.709 -2.420 4.638 1.00 0.00 C ATOM 935 CG PHE A 64 9.255 -2.582 4.356 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.763 -3.101 3.182 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.399 -2.221 5.370 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.413 -3.241 2.961 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.075 -2.058 5.036 1.00 0.00 C ATOM 940 CZ PHE A 64 6.591 -2.661 3.898 1.00 0.00 C ATOM 0 H PHE A 64 12.981 -2.047 4.459 1.00 0.00 H new ATOM 0 HA PHE A 64 11.009 -0.997 2.956 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.265 -3.262 4.226 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.883 -2.419 5.714 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.456 -3.407 2.412 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.750 -2.073 6.381 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.023 -3.773 2.106 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.423 -1.464 5.659 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.524 -2.679 3.734 1.00 0.00 H new ATOM 950 N LEU A 65 10.662 0.538 5.727 1.00 0.00 N ATOM 951 CA LEU A 65 10.255 1.773 6.324 1.00 0.00 C ATOM 952 C LEU A 65 10.552 2.975 5.495 1.00 0.00 C ATOM 953 O LEU A 65 9.674 3.797 5.240 1.00 0.00 O ATOM 954 CB LEU A 65 10.535 1.950 7.826 1.00 0.00 C ATOM 955 CG LEU A 65 10.001 3.247 8.457 1.00 0.00 C ATOM 956 CD1 LEU A 65 8.480 3.453 8.355 1.00 0.00 C ATOM 957 CD2 LEU A 65 10.519 3.287 9.905 1.00 0.00 C ATOM 0 H LEU A 65 11.186 -0.031 6.392 1.00 0.00 H new ATOM 0 HA LEU A 65 9.169 1.677 6.319 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.102 1.104 8.359 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.613 1.909 7.983 1.00 0.00 H new ATOM 0 HG LEU A 65 10.378 4.093 7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.208 4.396 8.830 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.186 3.477 7.306 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.967 2.633 8.857 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.163 4.194 10.394 1.00 0.00 H new ATOM 0 HD22 LEU A 65 10.152 2.415 10.447 1.00 0.00 H new ATOM 0 HD23 LEU A 65 11.609 3.280 9.902 1.00 0.00 H new ATOM 969 N THR A 66 11.860 3.248 5.339 1.00 0.00 N ATOM 970 CA THR A 66 12.411 4.318 4.566 1.00 0.00 C ATOM 971 C THR A 66 11.728 4.472 3.250 1.00 0.00 C ATOM 972 O THR A 66 11.262 5.533 2.838 1.00 0.00 O ATOM 973 CB THR A 66 13.858 4.077 4.253 1.00 0.00 C ATOM 974 OG1 THR A 66 14.641 4.021 5.437 1.00 0.00 O ATOM 975 CG2 THR A 66 14.419 5.190 3.352 1.00 0.00 C ATOM 0 H THR A 66 12.582 2.681 5.784 1.00 0.00 H new ATOM 0 HA THR A 66 12.277 5.211 5.177 1.00 0.00 H new ATOM 0 HB THR A 66 13.913 3.119 3.736 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.484 3.168 5.893 1.00 0.00 H new ATOM 0 HG21 THR A 66 15.470 4.992 3.140 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.859 5.218 2.417 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.326 6.150 3.859 1.00 0.00 H new ATOM 983 N MET A 67 11.448 3.329 2.599 1.00 0.00 N ATOM 984 CA MET A 67 10.852 3.251 1.302 1.00 0.00 C ATOM 985 C MET A 67 9.413 3.617 1.174 1.00 0.00 C ATOM 986 O MET A 67 9.004 4.404 0.322 1.00 0.00 O ATOM 987 CB MET A 67 11.065 1.779 0.912 1.00 0.00 C ATOM 988 CG MET A 67 10.345 1.408 -0.386 1.00 0.00 C ATOM 989 SD MET A 67 10.572 -0.316 -0.916 1.00 0.00 S ATOM 990 CE MET A 67 9.208 -1.056 0.027 1.00 0.00 C ATOM 0 H MET A 67 11.648 2.412 2.999 1.00 0.00 H new ATOM 0 HA MET A 67 11.317 3.997 0.658 1.00 0.00 H new ATOM 0 HB2 MET A 67 12.132 1.587 0.800 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.708 1.137 1.718 1.00 0.00 H new ATOM 0 HG2 MET A 67 9.279 1.598 -0.261 1.00 0.00 H new ATOM 0 HG3 MET A 67 10.695 2.067 -1.181 1.00 0.00 H new ATOM 0 HE1 MET A 67 9.260 -2.142 -0.049 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.287 -0.761 1.073 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.257 -0.710 -0.377 1.00 0.00 H new ATOM 1000 N MET A 68 8.645 3.140 2.170 1.00 0.00 N ATOM 1001 CA MET A 68 7.250 3.425 2.301 1.00 0.00 C ATOM 1002 C MET A 68 7.024 4.757 2.929 1.00 0.00 C ATOM 1003 O MET A 68 6.035 5.422 2.626 1.00 0.00 O ATOM 1004 CB MET A 68 6.464 2.338 3.053 1.00 0.00 C ATOM 1005 CG MET A 68 6.452 1.004 2.304 1.00 0.00 C ATOM 1006 SD MET A 68 6.051 1.064 0.532 1.00 0.00 S ATOM 1007 CE MET A 68 4.349 1.671 0.709 1.00 0.00 C ATOM 0 H MET A 68 9.007 2.536 2.908 1.00 0.00 H new ATOM 0 HA MET A 68 6.861 3.440 1.283 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.903 2.193 4.040 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.439 2.675 3.206 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.433 0.543 2.415 1.00 0.00 H new ATOM 0 HG3 MET A 68 5.734 0.346 2.793 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.929 1.869 -0.277 1.00 0.00 H new ATOM 0 HE2 MET A 68 3.745 0.919 1.216 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.350 2.591 1.294 1.00 0.00 H new ATOM 1017 N ALA A 69 7.840 5.226 3.890 1.00 0.00 N ATOM 1018 CA ALA A 69 7.754 6.450 4.624 1.00 0.00 C ATOM 1019 C ALA A 69 7.917 7.654 3.761 1.00 0.00 C ATOM 1020 O ALA A 69 7.305 8.685 4.037 1.00 0.00 O ATOM 1021 CB ALA A 69 8.792 6.507 5.758 1.00 0.00 C ATOM 0 H ALA A 69 8.652 4.682 4.183 1.00 0.00 H new ATOM 0 HA ALA A 69 6.749 6.463 5.047 1.00 0.00 H new ATOM 0 HB1 ALA A 69 8.695 7.452 6.293 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.623 5.681 6.448 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.795 6.429 5.338 1.00 0.00 H new ATOM 1027 N ARG A 70 8.534 7.461 2.582 1.00 0.00 N ATOM 1028 CA ARG A 70 8.718 8.440 1.555 1.00 0.00 C ATOM 1029 C ARG A 70 7.351 8.828 1.110 1.00 0.00 C ATOM 1030 O ARG A 70 6.593 8.003 0.602 1.00 0.00 O ATOM 1031 CB ARG A 70 9.637 7.932 0.431 1.00 0.00 C ATOM 1032 CG ARG A 70 9.784 8.937 -0.713 1.00 0.00 C ATOM 1033 CD ARG A 70 10.956 8.566 -1.625 1.00 0.00 C ATOM 1034 NE ARG A 70 10.743 9.466 -2.793 1.00 0.00 N ATOM 1035 CZ ARG A 70 11.619 9.611 -3.830 1.00 0.00 C ATOM 1036 NH1 ARG A 70 12.723 8.823 -3.983 1.00 0.00 N ATOM 1037 NH2 ARG A 70 11.099 10.554 -4.669 1.00 0.00 N ATOM 0 H ARG A 70 8.932 6.557 2.329 1.00 0.00 H new ATOM 0 HA ARG A 70 9.244 9.322 1.920 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.621 7.712 0.844 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.240 6.996 0.038 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.863 8.968 -1.294 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.938 9.936 -0.306 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.918 8.744 -1.144 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.932 7.515 -1.911 1.00 0.00 H new ATOM 0 HE ARG A 70 9.882 10.012 -2.820 1.00 0.00 H new ATOM 0 HH11 ARG A 70 12.922 8.087 -3.305 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.349 8.970 -4.775 1.00 0.00 H new ATOM 0 HH21 ARG A 70 10.207 10.997 -4.448 1.00 0.00 H new ATOM 0 HH22 ARG A 70 11.602 10.816 -5.517 1.00 0.00 H new ATOM 1051 N LYS A 71 7.063 10.138 1.210 1.00 0.00 N ATOM 1052 CA LYS A 71 5.770 10.699 0.969 1.00 0.00 C ATOM 1053 C LYS A 71 5.637 11.286 -0.394 1.00 0.00 C ATOM 1054 O LYS A 71 6.257 12.308 -0.682 1.00 0.00 O ATOM 1055 CB LYS A 71 5.071 11.531 2.057 1.00 0.00 C ATOM 1056 CG LYS A 71 3.541 11.519 2.043 1.00 0.00 C ATOM 1057 CD LYS A 71 2.786 12.532 2.906 1.00 0.00 C ATOM 1058 CE LYS A 71 2.734 12.133 4.382 1.00 0.00 C ATOM 1059 NZ LYS A 71 1.581 12.820 5.006 1.00 0.00 N ATOM 0 H LYS A 71 7.761 10.835 1.470 1.00 0.00 H new ATOM 0 HA LYS A 71 5.168 9.793 1.034 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.407 11.173 3.030 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.406 12.564 1.965 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.220 11.661 1.011 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.216 10.523 2.344 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.264 13.507 2.815 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.769 12.639 2.527 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.631 11.052 4.480 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.660 12.412 4.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.526 12.562 6.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.701 13.849 4.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.704 12.532 4.527 1.00 0.00 H new ATOM 1073 N MET A 72 4.868 10.668 -1.308 1.00 0.00 N ATOM 1074 CA MET A 72 4.655 11.204 -2.617 1.00 0.00 C ATOM 1075 C MET A 72 3.608 12.264 -2.597 1.00 0.00 C ATOM 1076 O MET A 72 2.917 12.267 -1.579 1.00 0.00 O ATOM 1077 CB MET A 72 4.255 10.125 -3.637 1.00 0.00 C ATOM 1078 CG MET A 72 5.195 8.917 -3.648 1.00 0.00 C ATOM 1079 SD MET A 72 6.910 9.319 -4.098 1.00 0.00 S ATOM 1080 CE MET A 72 7.460 7.592 -3.986 1.00 0.00 C ATOM 0 H MET A 72 4.388 9.785 -1.137 1.00 0.00 H new ATOM 0 HA MET A 72 5.608 11.632 -2.928 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.243 9.786 -3.417 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.233 10.568 -4.633 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.188 8.455 -2.661 1.00 0.00 H new ATOM 0 HG3 MET A 72 4.810 8.176 -4.349 1.00 0.00 H new ATOM 0 HE1 MET A 72 8.522 7.532 -4.222 1.00 0.00 H new ATOM 0 HE2 MET A 72 7.292 7.221 -2.975 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.896 6.984 -4.694 1.00 0.00 H new ATOM 1090 N LYS A 73 3.479 13.111 -3.634 1.00 0.00 N ATOM 1091 CA LYS A 73 2.361 13.975 -3.854 1.00 0.00 C ATOM 1092 C LYS A 73 1.063 13.246 -3.897 1.00 0.00 C ATOM 1093 O LYS A 73 0.970 12.041 -4.128 1.00 0.00 O ATOM 1094 CB LYS A 73 2.610 14.957 -5.011 1.00 0.00 C ATOM 1095 CG LYS A 73 2.780 14.381 -6.418 1.00 0.00 C ATOM 1096 CD LYS A 73 3.005 15.549 -7.381 1.00 0.00 C ATOM 1097 CE LYS A 73 3.860 15.330 -8.631 1.00 0.00 C ATOM 1098 NZ LYS A 73 3.182 14.404 -9.565 1.00 0.00 N ATOM 0 H LYS A 73 4.193 13.197 -4.357 1.00 0.00 H new ATOM 0 HA LYS A 73 2.260 14.612 -2.976 1.00 0.00 H new ATOM 0 HB2 LYS A 73 1.778 15.661 -5.037 1.00 0.00 H new ATOM 0 HB3 LYS A 73 3.506 15.531 -4.775 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.625 13.693 -6.449 1.00 0.00 H new ATOM 0 HG3 LYS A 73 1.896 13.813 -6.707 1.00 0.00 H new ATOM 0 HD2 LYS A 73 2.026 15.897 -7.710 1.00 0.00 H new ATOM 0 HD3 LYS A 73 3.457 16.361 -6.812 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.044 16.284 -9.125 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.831 14.925 -8.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 3.840 14.132 -10.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 2.877 13.553 -9.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 2.352 14.875 -9.979 1.00 0.00 H new ATOM 1112 N ASP A 74 -0.033 13.999 -3.694 1.00 0.00 N ATOM 1113 CA ASP A 74 -1.310 13.381 -3.513 1.00 0.00 C ATOM 1114 C ASP A 74 -1.845 12.698 -4.723 1.00 0.00 C ATOM 1115 O ASP A 74 -2.571 11.708 -4.634 1.00 0.00 O ATOM 1116 CB ASP A 74 -2.338 14.440 -3.080 1.00 0.00 C ATOM 1117 CG ASP A 74 -2.048 15.095 -1.737 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -1.366 14.443 -0.902 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -2.616 16.197 -1.511 1.00 0.00 O ATOM 0 H ASP A 74 -0.037 15.018 -3.655 1.00 0.00 H new ATOM 0 HA ASP A 74 -1.154 12.616 -2.753 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -2.385 15.215 -3.845 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -3.323 13.975 -3.037 1.00 0.00 H new ATOM 1124 N THR A 75 -1.407 13.124 -5.921 1.00 0.00 N ATOM 1125 CA THR A 75 -1.852 12.502 -7.130 1.00 0.00 C ATOM 1126 C THR A 75 -1.227 11.158 -7.282 1.00 0.00 C ATOM 1127 O THR A 75 -1.760 10.157 -7.759 1.00 0.00 O ATOM 1128 CB THR A 75 -1.419 13.274 -8.340 1.00 0.00 C ATOM 1129 OG1 THR A 75 -0.214 14.003 -8.153 1.00 0.00 O ATOM 1130 CG2 THR A 75 -2.480 14.319 -8.722 1.00 0.00 C ATOM 0 H THR A 75 -0.750 13.893 -6.053 1.00 0.00 H new ATOM 0 HA THR A 75 -2.939 12.451 -7.062 1.00 0.00 H new ATOM 0 HB THR A 75 -1.273 12.517 -9.111 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.011 14.481 -8.979 1.00 0.00 H new ATOM 0 HG21 THR A 75 -2.148 14.869 -9.602 1.00 0.00 H new ATOM 0 HG22 THR A 75 -3.422 13.817 -8.942 1.00 0.00 H new ATOM 0 HG23 THR A 75 -2.623 15.012 -7.893 1.00 0.00 H new ATOM 1138 N ASP A 76 0.079 11.096 -6.964 1.00 0.00 N ATOM 1139 CA ASP A 76 0.780 9.854 -7.067 1.00 0.00 C ATOM 1140 C ASP A 76 0.412 8.851 -6.028 1.00 0.00 C ATOM 1141 O ASP A 76 0.510 7.629 -6.125 1.00 0.00 O ATOM 1142 CB ASP A 76 2.310 9.996 -7.138 1.00 0.00 C ATOM 1143 CG ASP A 76 2.629 10.760 -8.416 1.00 0.00 C ATOM 1144 OD1 ASP A 76 2.718 10.096 -9.483 1.00 0.00 O ATOM 1145 OD2 ASP A 76 2.849 11.999 -8.354 1.00 0.00 O ATOM 0 H ASP A 76 0.639 11.886 -6.643 1.00 0.00 H new ATOM 0 HA ASP A 76 0.438 9.471 -8.028 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.688 10.529 -6.266 1.00 0.00 H new ATOM 0 HB3 ASP A 76 2.788 9.016 -7.145 1.00 0.00 H new ATOM 1150 N SER A 77 -0.008 9.390 -4.869 1.00 0.00 N ATOM 1151 CA SER A 77 -0.502 8.599 -3.785 1.00 0.00 C ATOM 1152 C SER A 77 -1.802 7.952 -4.117 1.00 0.00 C ATOM 1153 O SER A 77 -2.087 6.760 -4.006 1.00 0.00 O ATOM 1154 CB SER A 77 -0.500 9.389 -2.465 1.00 0.00 C ATOM 1155 OG SER A 77 0.806 9.600 -1.948 1.00 0.00 O ATOM 0 H SER A 77 -0.004 10.393 -4.682 1.00 0.00 H new ATOM 0 HA SER A 77 0.187 7.770 -3.624 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.982 10.353 -2.624 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.095 8.853 -1.726 1.00 0.00 H new ATOM 0 HG SER A 77 0.749 10.107 -1.111 1.00 0.00 H new ATOM 1161 N GLU A 78 -2.738 8.770 -4.630 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.973 8.356 -5.219 1.00 0.00 C ATOM 1163 C GLU A 78 -3.926 7.234 -6.199 1.00 0.00 C ATOM 1164 O GLU A 78 -4.679 6.263 -6.232 1.00 0.00 O ATOM 1165 CB GLU A 78 -4.782 9.528 -5.801 1.00 0.00 C ATOM 1166 CG GLU A 78 -6.203 9.118 -6.196 1.00 0.00 C ATOM 1167 CD GLU A 78 -7.002 10.235 -6.851 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -6.612 10.710 -7.951 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -8.127 10.480 -6.339 1.00 0.00 O ATOM 0 H GLU A 78 -2.624 9.784 -4.633 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.487 7.941 -4.352 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.830 10.333 -5.067 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -4.265 9.924 -6.675 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.150 8.271 -6.880 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.734 8.777 -5.307 1.00 0.00 H new ATOM 1176 N GLU A 79 -2.872 7.258 -7.034 1.00 0.00 N ATOM 1177 CA GLU A 79 -2.529 6.287 -8.027 1.00 0.00 C ATOM 1178 C GLU A 79 -1.865 5.043 -7.545 1.00 0.00 C ATOM 1179 O GLU A 79 -2.056 3.942 -8.058 1.00 0.00 O ATOM 1180 CB GLU A 79 -1.601 7.032 -9.002 1.00 0.00 C ATOM 1181 CG GLU A 79 -1.346 6.356 -10.351 1.00 0.00 C ATOM 1182 CD GLU A 79 -0.701 7.298 -11.357 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -1.300 8.332 -11.755 1.00 0.00 O ATOM 1184 OE2 GLU A 79 0.476 7.017 -11.709 1.00 0.00 O ATOM 0 H GLU A 79 -2.201 8.026 -7.011 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.454 5.912 -8.466 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -2.024 8.019 -9.189 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.641 7.185 -8.510 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.702 5.489 -10.204 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -2.289 5.988 -10.754 1.00 0.00 H new ATOM 1191 N GLU A 80 -1.036 5.068 -6.486 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.455 3.924 -5.855 1.00 0.00 C ATOM 1193 C GLU A 80 -1.545 3.035 -5.364 1.00 0.00 C ATOM 1194 O GLU A 80 -1.485 1.807 -5.309 1.00 0.00 O ATOM 1195 CB GLU A 80 0.348 4.317 -4.603 1.00 0.00 C ATOM 1196 CG GLU A 80 1.123 3.194 -3.911 1.00 0.00 C ATOM 1197 CD GLU A 80 2.222 3.860 -3.096 1.00 0.00 C ATOM 1198 OE1 GLU A 80 1.918 4.229 -1.930 1.00 0.00 O ATOM 1199 OE2 GLU A 80 3.387 3.948 -3.566 1.00 0.00 O ATOM 0 H GLU A 80 -0.754 5.943 -6.043 1.00 0.00 H new ATOM 0 HA GLU A 80 0.190 3.443 -6.590 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.055 5.098 -4.882 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.340 4.754 -3.879 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.465 2.609 -3.269 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.547 2.507 -4.644 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.635 3.641 -4.862 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.895 3.062 -4.515 1.00 0.00 C ATOM 1208 C ILE A 81 -4.624 2.416 -5.642 1.00 0.00 C ATOM 1209 O ILE A 81 -4.829 1.203 -5.631 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.670 4.037 -3.679 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.904 4.413 -2.399 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -6.047 3.452 -3.319 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -4.766 5.189 -1.404 1.00 0.00 C ATOM 0 H ILE A 81 -2.630 4.645 -4.681 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.719 2.185 -3.891 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.808 4.945 -4.267 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.533 3.506 -1.922 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.033 5.012 -2.664 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.600 4.169 -2.712 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.604 3.244 -4.233 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.914 2.528 -2.757 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.175 5.428 -0.520 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.115 6.112 -1.867 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -5.623 4.581 -1.114 1.00 0.00 H new ATOM 1225 N ARG A 82 -5.010 3.207 -6.659 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.543 2.765 -7.910 1.00 0.00 C ATOM 1227 C ARG A 82 -4.888 1.572 -8.517 1.00 0.00 C ATOM 1228 O ARG A 82 -5.488 0.528 -8.770 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.558 3.926 -8.918 1.00 0.00 C ATOM 1230 CG ARG A 82 -6.544 4.945 -8.344 1.00 0.00 C ATOM 1231 CD ARG A 82 -6.576 6.190 -9.233 1.00 0.00 C ATOM 1232 NE ARG A 82 -7.741 7.054 -8.895 1.00 0.00 N ATOM 1233 CZ ARG A 82 -8.580 7.619 -9.812 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -8.187 8.000 -11.063 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -9.856 7.918 -9.433 1.00 0.00 N ATOM 0 H ARG A 82 -4.945 4.223 -6.602 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.554 2.433 -7.673 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -4.565 4.361 -9.032 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.873 3.586 -9.905 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.540 4.506 -8.281 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -6.251 5.218 -7.330 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.652 6.754 -9.109 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.630 5.893 -10.280 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.925 7.237 -7.909 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -7.219 7.867 -11.356 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -8.861 8.417 -11.704 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -10.165 7.719 -8.482 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -10.501 8.341 -10.101 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.569 1.649 -8.772 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.704 0.549 -9.067 1.00 0.00 C ATOM 1251 C GLU A 83 -2.816 -0.615 -8.144 1.00 0.00 C ATOM 1252 O GLU A 83 -2.868 -1.760 -8.592 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.258 1.073 -9.088 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.172 0.106 -9.564 1.00 0.00 C ATOM 1255 CD GLU A 83 -0.441 -0.196 -11.032 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -0.093 0.614 -11.932 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -1.070 -1.259 -11.279 1.00 0.00 O ATOM 0 H GLU A 83 -3.075 2.541 -8.772 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.014 0.157 -10.036 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.228 1.956 -9.726 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.002 1.399 -8.080 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.817 0.547 -9.438 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.189 -0.811 -8.974 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.922 -0.459 -6.813 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.117 -1.554 -5.914 1.00 0.00 C ATOM 1266 C ALA A 84 -4.523 -2.021 -5.757 1.00 0.00 C ATOM 1267 O ALA A 84 -4.751 -3.134 -5.285 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.614 -1.103 -4.532 1.00 0.00 C ATOM 0 H ALA A 84 -2.871 0.449 -6.350 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.573 -2.398 -6.339 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.746 -1.913 -3.815 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.557 -0.843 -4.596 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.182 -0.232 -4.204 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.524 -1.310 -6.307 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.814 -1.865 -6.575 1.00 0.00 C ATOM 1276 C PHE A 85 -6.754 -3.045 -7.483 1.00 0.00 C ATOM 1277 O PHE A 85 -7.203 -4.136 -7.138 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.836 -0.876 -7.160 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.242 -1.367 -7.212 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.991 -1.253 -6.065 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.945 -1.772 -8.322 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.357 -1.406 -6.070 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.298 -2.016 -8.300 1.00 0.00 C ATOM 1284 CZ PHE A 85 -12.046 -1.902 -7.152 1.00 0.00 C ATOM 0 H PHE A 85 -5.435 -0.329 -6.571 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.157 -2.161 -5.584 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.810 0.039 -6.569 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.524 -0.612 -8.170 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.491 -1.037 -5.132 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.411 -1.904 -9.252 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.912 -1.125 -5.187 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.790 -2.307 -9.216 1.00 0.00 H new ATOM 0 HZ PHE A 85 -13.089 -2.179 -7.104 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.122 -2.966 -8.668 1.00 0.00 N ATOM 1295 CA ARG A 86 -6.107 -3.958 -9.697 1.00 0.00 C ATOM 1296 C ARG A 86 -5.327 -5.192 -9.400 1.00 0.00 C ATOM 1297 O ARG A 86 -5.346 -6.081 -10.250 1.00 0.00 O ATOM 1298 CB ARG A 86 -5.837 -3.306 -11.064 1.00 0.00 C ATOM 1299 CG ARG A 86 -4.500 -2.592 -11.270 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.533 -1.905 -12.636 1.00 0.00 C ATOM 1301 NE ARG A 86 -3.224 -1.243 -12.899 1.00 0.00 N ATOM 1302 CZ ARG A 86 -2.963 -0.576 -14.061 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -3.808 -0.577 -15.133 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -1.843 0.203 -14.096 1.00 0.00 N ATOM 0 H ARG A 86 -5.579 -2.142 -8.925 1.00 0.00 H new ATOM 0 HA ARG A 86 -7.111 -4.380 -9.742 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.922 -4.081 -11.826 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -6.633 -2.585 -11.253 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.334 -1.860 -10.480 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -3.677 -3.305 -11.222 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.745 -2.636 -13.416 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.336 -1.168 -12.664 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.497 -1.290 -12.185 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.686 -1.095 -15.090 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -3.562 -0.060 -15.977 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.241 0.268 -13.275 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.608 0.720 -14.943 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.667 -5.312 -8.235 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.090 -6.546 -7.798 1.00 0.00 C ATOM 1320 C VAL A 87 -5.165 -7.365 -7.172 1.00 0.00 C ATOM 1321 O VAL A 87 -5.243 -8.566 -7.426 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.950 -6.291 -6.856 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.412 -7.568 -6.190 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.828 -5.503 -7.552 1.00 0.00 C ATOM 0 H VAL A 87 -4.531 -4.539 -7.584 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.674 -7.095 -8.643 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.350 -5.681 -6.047 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.590 -7.311 -5.522 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.209 -8.044 -5.618 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.055 -8.256 -6.957 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.014 -5.331 -6.848 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.457 -6.073 -8.404 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.217 -4.545 -7.898 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.036 -6.786 -6.326 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.222 -7.459 -5.893 1.00 0.00 C ATOM 1336 C PHE A 88 -8.231 -7.933 -6.881 1.00 0.00 C ATOM 1337 O PHE A 88 -8.570 -9.110 -6.991 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.921 -6.669 -4.774 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.100 -6.369 -3.567 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -6.837 -7.380 -2.672 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.650 -5.093 -3.324 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -5.996 -7.174 -1.604 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -5.804 -4.886 -2.260 1.00 0.00 C ATOM 1344 CZ PHE A 88 -5.486 -5.913 -1.403 1.00 0.00 C ATOM 0 H PHE A 88 -5.919 -5.849 -5.941 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.793 -8.402 -5.555 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.275 -5.726 -5.190 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.802 -7.229 -4.459 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.297 -8.347 -2.810 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.954 -4.271 -3.955 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -5.742 -7.985 -0.938 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.384 -3.905 -2.095 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.830 -5.728 -0.565 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.694 -7.028 -7.762 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.491 -7.410 -8.887 1.00 0.00 C ATOM 1356 C ASP A 89 -8.791 -8.258 -9.893 1.00 0.00 C ATOM 1357 O ASP A 89 -7.884 -7.762 -10.558 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.033 -6.091 -9.462 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.238 -6.403 -10.338 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -11.604 -7.583 -10.582 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.895 -5.424 -10.784 1.00 0.00 O ATOM 0 H ASP A 89 -8.515 -6.026 -7.695 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.296 -8.074 -8.573 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.316 -5.415 -8.656 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.262 -5.587 -10.045 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.250 -9.514 -10.037 1.00 0.00 N ATOM 1367 CA LYS A 90 -8.642 -10.488 -10.890 1.00 0.00 C ATOM 1368 C LYS A 90 -9.129 -10.340 -12.290 1.00 0.00 C ATOM 1369 O LYS A 90 -8.298 -10.196 -13.186 1.00 0.00 O ATOM 1370 CB LYS A 90 -8.841 -11.932 -10.399 1.00 0.00 C ATOM 1371 CG LYS A 90 -7.986 -12.946 -11.161 1.00 0.00 C ATOM 1372 CD LYS A 90 -6.492 -12.621 -11.109 1.00 0.00 C ATOM 1373 CE LYS A 90 -5.784 -13.687 -11.948 1.00 0.00 C ATOM 1374 NZ LYS A 90 -4.338 -13.378 -12.017 1.00 0.00 N ATOM 0 H LYS A 90 -10.071 -9.863 -9.544 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.570 -10.295 -10.861 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.599 -11.986 -9.338 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.892 -12.203 -10.500 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.152 -13.940 -10.744 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.310 -12.978 -12.201 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -6.298 -11.624 -11.505 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -6.128 -12.632 -10.081 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.936 -14.672 -11.508 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -6.209 -13.717 -12.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.855 -14.102 -12.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.203 -12.445 -12.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.938 -13.370 -11.057 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.455 -10.223 -12.477 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.047 -10.118 -13.774 1.00 0.00 C ATOM 1390 C ASP A 91 -10.823 -8.731 -14.272 1.00 0.00 C ATOM 1391 O ASP A 91 -10.415 -8.511 -15.411 1.00 0.00 O ATOM 1392 CB ASP A 91 -12.447 -10.755 -13.814 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.322 -10.173 -12.714 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.485 -8.925 -12.644 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -13.917 -10.924 -11.895 1.00 0.00 O ATOM 0 H ASP A 91 -11.130 -10.201 -11.712 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.567 -10.734 -14.534 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.907 -10.578 -14.786 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.366 -11.835 -13.691 1.00 0.00 H new ATOM 1400 N GLY A 92 -10.928 -7.727 -13.384 1.00 0.00 N ATOM 1401 CA GLY A 92 -10.796 -6.346 -13.731 1.00 0.00 C ATOM 1402 C GLY A 92 -12.078 -5.658 -14.051 1.00 0.00 C ATOM 1403 O GLY A 92 -12.018 -4.619 -14.707 1.00 0.00 O ATOM 0 H GLY A 92 -11.111 -7.881 -12.392 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.315 -5.822 -12.905 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -10.131 -6.264 -14.591 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.249 -6.156 -13.615 1.00 0.00 N ATOM 1408 CA ASN A 93 -14.481 -5.483 -13.887 1.00 0.00 C ATOM 1409 C ASN A 93 -14.652 -4.131 -13.286 1.00 0.00 C ATOM 1410 O ASN A 93 -15.293 -3.263 -13.877 1.00 0.00 O ATOM 1411 CB ASN A 93 -15.668 -6.438 -13.676 1.00 0.00 C ATOM 1412 CG ASN A 93 -15.947 -6.844 -12.236 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.114 -6.900 -11.333 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.184 -7.392 -12.099 1.00 0.00 N ATOM 0 H ASN A 93 -13.343 -7.018 -13.078 1.00 0.00 H new ATOM 0 HA ASN A 93 -14.445 -5.217 -14.943 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -16.564 -5.968 -14.081 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.491 -7.341 -14.260 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.440 -7.864 -11.231 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.856 -7.331 -12.864 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.035 -3.786 -12.142 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.393 -2.656 -11.341 1.00 0.00 C ATOM 1423 C GLY A 94 -14.916 -2.960 -9.980 1.00 0.00 C ATOM 1424 O GLY A 94 -15.492 -2.134 -9.273 1.00 0.00 O ATOM 0 H GLY A 94 -13.253 -4.317 -11.759 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.516 -2.017 -11.237 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.146 -2.079 -11.878 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.914 -4.253 -9.611 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.421 -4.788 -8.385 1.00 0.00 C ATOM 1430 C TYR A 95 -14.502 -5.847 -7.880 1.00 0.00 C ATOM 1431 O TYR A 95 -14.075 -6.773 -8.567 1.00 0.00 O ATOM 1432 CB TYR A 95 -16.845 -5.368 -8.349 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.872 -4.533 -9.033 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.059 -4.516 -10.395 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.753 -3.809 -8.265 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -19.016 -3.714 -10.973 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.801 -3.075 -8.766 1.00 0.00 C ATOM 1438 CZ TYR A 95 -19.896 -3.067 -10.138 1.00 0.00 C ATOM 1439 OH TYR A 95 -20.907 -2.305 -10.762 1.00 0.00 O ATOM 0 H TYR A 95 -14.529 -4.978 -10.216 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.478 -3.893 -7.765 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -16.833 -6.356 -8.810 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.141 -5.505 -7.309 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.444 -5.144 -11.023 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.612 -3.818 -7.194 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.074 -3.597 -12.045 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -20.496 -2.545 -8.132 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.474 -1.891 -10.078 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.120 -5.808 -6.591 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.346 -6.846 -5.984 1.00 0.00 C ATOM 1451 C ILE A 96 -14.271 -7.838 -5.365 1.00 0.00 C ATOM 1452 O ILE A 96 -15.064 -7.405 -4.530 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.532 -6.249 -4.875 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.606 -5.213 -5.535 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.688 -7.313 -4.154 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.737 -4.419 -4.561 1.00 0.00 C ATOM 0 H ILE A 96 -14.353 -5.042 -5.959 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.710 -7.317 -6.734 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.184 -5.802 -4.125 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.957 -5.726 -6.244 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.215 -4.515 -6.109 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -11.112 -6.842 -3.357 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.345 -8.071 -3.728 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.008 -7.781 -4.865 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.118 -3.714 -5.117 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.375 -3.873 -3.866 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.097 -5.103 -4.004 1.00 0.00 H new ATOM 1468 N SER A 97 -14.173 -9.150 -5.642 1.00 0.00 N ATOM 1469 CA SER A 97 -15.094 -10.165 -5.234 1.00 0.00 C ATOM 1470 C SER A 97 -14.539 -10.818 -4.015 1.00 0.00 C ATOM 1471 O SER A 97 -13.311 -10.865 -3.964 1.00 0.00 O ATOM 1472 CB SER A 97 -15.455 -11.233 -6.280 1.00 0.00 C ATOM 1473 OG SER A 97 -16.429 -10.698 -7.163 1.00 0.00 O ATOM 0 H SER A 97 -13.398 -9.526 -6.188 1.00 0.00 H new ATOM 0 HA SER A 97 -16.040 -9.653 -5.056 1.00 0.00 H new ATOM 0 HB2 SER A 97 -14.566 -11.533 -6.835 1.00 0.00 H new ATOM 0 HB3 SER A 97 -15.841 -12.127 -5.789 1.00 0.00 H new ATOM 0 HG SER A 97 -16.665 -11.371 -7.835 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.372 -11.226 -3.041 1.00 0.00 N ATOM 1480 CA ALA A 98 -14.983 -11.983 -1.892 1.00 0.00 C ATOM 1481 C ALA A 98 -13.980 -13.048 -2.175 1.00 0.00 C ATOM 1482 O ALA A 98 -12.965 -13.013 -1.481 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.222 -12.563 -1.188 1.00 0.00 C ATOM 0 H ALA A 98 -16.370 -11.016 -3.056 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.480 -11.283 -1.225 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.909 -13.137 -0.315 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.875 -11.750 -0.873 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.760 -13.214 -1.877 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.273 -13.908 -3.167 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.449 -14.970 -3.656 1.00 0.00 C ATOM 1491 C ALA A 99 -12.181 -14.522 -4.297 1.00 0.00 C ATOM 1492 O ALA A 99 -11.153 -15.108 -3.964 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.263 -15.928 -4.543 1.00 0.00 C ATOM 0 H ALA A 99 -15.160 -13.855 -3.667 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.114 -15.524 -2.779 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -13.616 -16.728 -4.904 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.080 -16.356 -3.962 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.670 -15.380 -5.392 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.194 -13.476 -5.143 1.00 0.00 N ATOM 1500 CA GLU A 100 -10.971 -12.837 -5.517 1.00 0.00 C ATOM 1501 C GLU A 100 -10.086 -12.423 -4.392 1.00 0.00 C ATOM 1502 O GLU A 100 -8.891 -12.716 -4.392 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.210 -11.572 -6.359 1.00 0.00 C ATOM 1504 CG GLU A 100 -11.851 -11.882 -7.713 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.213 -10.647 -8.525 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -12.920 -9.710 -8.067 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -11.924 -10.543 -9.747 1.00 0.00 O ATOM 0 H GLU A 100 -13.035 -13.079 -5.561 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.469 -13.623 -6.082 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.852 -10.887 -5.805 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.261 -11.061 -6.519 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.166 -12.499 -8.295 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.752 -12.474 -7.550 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.651 -11.766 -3.364 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.048 -11.105 -2.248 1.00 0.00 C ATOM 1516 C LEU A 101 -9.428 -12.145 -1.380 1.00 0.00 C ATOM 1517 O LEU A 101 -8.277 -12.081 -0.952 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.072 -10.265 -1.466 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.431 -9.421 -0.351 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.339 -8.445 -0.819 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.589 -8.750 0.406 1.00 0.00 C ATOM 0 H LEU A 101 -11.667 -11.691 -3.313 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.287 -10.409 -2.600 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.596 -9.605 -2.157 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.819 -10.927 -1.029 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.861 -10.069 0.315 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -8.949 -7.897 0.039 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.530 -9.003 -1.291 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.762 -7.742 -1.537 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.189 -8.136 1.213 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.157 -8.122 -0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.243 -9.516 0.823 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.226 -13.138 -0.948 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.888 -14.322 -0.221 1.00 0.00 C ATOM 1535 C ARG A 102 -8.751 -15.105 -0.782 1.00 0.00 C ATOM 1536 O ARG A 102 -7.749 -15.338 -0.109 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.148 -15.203 -0.171 1.00 0.00 C ATOM 1538 CG ARG A 102 -11.088 -16.474 0.679 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.385 -17.271 0.830 1.00 0.00 C ATOM 1540 NE ARG A 102 -12.359 -18.318 1.890 1.00 0.00 N ATOM 1541 CZ ARG A 102 -13.466 -18.879 2.459 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -14.687 -18.354 2.145 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -13.400 -19.750 3.508 1.00 0.00 N ATOM 0 H ARG A 102 -11.228 -13.102 -1.133 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.549 -14.009 0.767 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.972 -14.591 0.196 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.397 -15.493 -1.192 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.334 -17.133 0.250 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.741 -16.199 1.675 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.198 -16.577 1.045 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.615 -17.746 -0.124 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.447 -18.639 2.214 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.753 -17.565 1.502 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.533 -18.751 2.554 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.495 -20.008 3.901 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -14.256 -20.143 3.899 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.837 -15.475 -2.073 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.804 -16.227 -2.714 1.00 0.00 C ATOM 1559 C HIS A 103 -6.522 -15.483 -2.866 1.00 0.00 C ATOM 1560 O HIS A 103 -5.449 -16.083 -2.809 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.221 -16.698 -4.118 1.00 0.00 C ATOM 1562 CG HIS A 103 -7.281 -17.763 -4.599 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -7.325 -19.017 -4.025 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.431 -17.860 -5.656 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -6.398 -19.770 -4.675 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.812 -19.093 -5.646 1.00 0.00 N ATOM 0 H HIS A 103 -9.629 -15.251 -2.676 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.647 -17.075 -2.047 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.240 -17.084 -4.094 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.215 -15.856 -4.810 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -6.265 -17.088 -6.393 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -6.169 -20.796 -4.428 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -5.062 -19.413 -6.258 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.539 -14.151 -3.053 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.331 -13.396 -3.175 1.00 0.00 C ATOM 1576 C VAL A 104 -4.564 -13.296 -1.901 1.00 0.00 C ATOM 1577 O VAL A 104 -3.393 -13.647 -1.767 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.413 -12.160 -4.020 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -6.243 -10.973 -3.502 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -4.008 -11.617 -4.332 1.00 0.00 C ATOM 0 H VAL A 104 -7.392 -13.596 -3.120 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.685 -14.006 -3.807 1.00 0.00 H new ATOM 0 HB VAL A 104 -5.949 -12.535 -4.892 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -6.203 -10.158 -4.225 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.278 -11.286 -3.364 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -5.837 -10.633 -2.549 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -4.093 -10.720 -4.946 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -3.497 -11.372 -3.401 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -3.437 -12.373 -4.871 1.00 0.00 H new ATOM 1590 N MET A 105 -5.358 -13.016 -0.853 1.00 0.00 N ATOM 1591 CA MET A 105 -4.827 -12.830 0.462 1.00 0.00 C ATOM 1592 C MET A 105 -4.300 -14.112 1.008 1.00 0.00 C ATOM 1593 O MET A 105 -3.325 -14.034 1.754 1.00 0.00 O ATOM 1594 CB MET A 105 -5.797 -12.111 1.414 1.00 0.00 C ATOM 1595 CG MET A 105 -5.996 -10.621 1.126 1.00 0.00 C ATOM 1596 SD MET A 105 -6.384 -9.774 2.687 1.00 0.00 S ATOM 1597 CE MET A 105 -7.065 -8.191 2.114 1.00 0.00 C ATOM 0 H MET A 105 -6.371 -12.918 -0.916 1.00 0.00 H new ATOM 0 HA MET A 105 -3.981 -12.148 0.376 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.766 -12.608 1.366 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.432 -12.223 2.435 1.00 0.00 H new ATOM 0 HG2 MET A 105 -5.095 -10.198 0.680 1.00 0.00 H new ATOM 0 HG3 MET A 105 -6.804 -10.479 0.408 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.761 -7.396 2.795 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.691 -7.975 1.113 1.00 0.00 H new ATOM 0 HE3 MET A 105 -8.153 -8.251 2.089 1.00 0.00 H new ATOM 1607 N THR A 106 -4.986 -15.241 0.752 1.00 0.00 N ATOM 1608 CA THR A 106 -4.610 -16.553 1.177 1.00 0.00 C ATOM 1609 C THR A 106 -3.310 -16.972 0.581 1.00 0.00 C ATOM 1610 O THR A 106 -2.577 -17.638 1.311 1.00 0.00 O ATOM 1611 CB THR A 106 -5.710 -17.536 0.905 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.896 -17.223 1.620 1.00 0.00 O ATOM 1613 CG2 THR A 106 -5.276 -18.983 1.198 1.00 0.00 C ATOM 0 H THR A 106 -5.854 -15.236 0.217 1.00 0.00 H new ATOM 0 HA THR A 106 -4.458 -16.530 2.256 1.00 0.00 H new ATOM 0 HB THR A 106 -5.929 -17.457 -0.160 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.396 -16.532 1.138 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.103 -19.661 0.987 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.425 -19.242 0.568 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.992 -19.072 2.247 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.988 -16.683 -0.693 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.737 -16.964 -1.325 1.00 0.00 C ATOM 1623 C ASN A 107 -0.659 -16.021 -0.913 1.00 0.00 C ATOM 1624 O ASN A 107 0.533 -16.325 -0.904 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.778 -16.771 -2.850 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.461 -17.964 -3.504 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -1.917 -19.066 -3.562 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.698 -17.867 -4.060 1.00 0.00 N ATOM 0 H ASN A 107 -3.646 -16.223 -1.322 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.544 -17.995 -1.030 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.314 -15.854 -3.095 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.766 -16.662 -3.239 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.127 -18.684 -4.496 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.197 -16.978 -4.042 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.085 -14.769 -0.668 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.165 -13.767 -0.229 1.00 0.00 C ATOM 1637 C LEU A 108 0.425 -13.905 1.132 1.00 0.00 C ATOM 1638 O LEU A 108 1.621 -13.659 1.278 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.838 -12.395 -0.405 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.004 -11.106 -0.325 1.00 0.00 C ATOM 1641 CD1 LEU A 108 0.095 -10.632 1.134 1.00 0.00 C ATOM 1642 CD2 LEU A 108 1.362 -11.078 -1.032 1.00 0.00 C ATOM 0 H LEU A 108 -2.050 -14.454 -0.772 1.00 0.00 H new ATOM 0 HA LEU A 108 0.714 -13.893 -0.861 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.332 -12.400 -1.377 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.621 -12.320 0.350 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.571 -10.398 -0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.688 -9.718 1.180 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.905 -10.436 1.522 1.00 0.00 H new ATOM 0 HD13 LEU A 108 0.572 -11.405 1.736 1.00 0.00 H new ATOM 0 HD21 LEU A 108 1.828 -10.104 -0.885 1.00 0.00 H new ATOM 0 HD22 LEU A 108 2.004 -11.854 -0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.224 -11.257 -2.098 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.310 -14.495 2.092 1.00 0.00 N ATOM 1655 CA GLY A 109 0.192 -14.825 3.390 1.00 0.00 C ATOM 1656 C GLY A 109 -0.793 -15.062 4.483 1.00 0.00 C ATOM 1657 O GLY A 109 -0.575 -15.874 5.381 1.00 0.00 O ATOM 0 H GLY A 109 -1.288 -14.751 1.960 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.805 -15.721 3.293 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.854 -14.019 3.706 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.017 -14.506 4.491 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.917 -14.599 5.599 1.00 0.00 C ATOM 1663 C GLU A 110 -3.699 -15.868 5.594 1.00 0.00 C ATOM 1664 O GLU A 110 -3.784 -16.560 4.581 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.802 -13.342 5.616 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.053 -12.034 5.879 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.586 -12.075 7.327 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.379 -12.171 8.301 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -1.356 -12.128 7.598 1.00 0.00 O ATOM 0 H GLU A 110 -2.392 -13.976 3.704 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.347 -14.637 6.527 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.316 -13.264 4.658 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.569 -13.465 6.380 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.204 -11.932 5.202 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.703 -11.176 5.707 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.258 -16.277 6.746 1.00 0.00 N ATOM 1677 CA LYS A 111 -5.106 -17.428 6.755 1.00 0.00 C ATOM 1678 C LYS A 111 -6.406 -16.926 7.282 1.00 0.00 C ATOM 1679 O LYS A 111 -6.632 -16.505 8.416 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.412 -18.519 7.587 1.00 0.00 C ATOM 1681 CG LYS A 111 -4.265 -18.185 9.072 1.00 0.00 C ATOM 1682 CD LYS A 111 -3.398 -19.204 9.815 1.00 0.00 C ATOM 1683 CE LYS A 111 -1.908 -19.246 9.472 1.00 0.00 C ATOM 1684 NZ LYS A 111 -1.120 -18.135 10.052 1.00 0.00 N ATOM 0 H LYS A 111 -4.128 -15.824 7.651 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.293 -17.898 5.789 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.976 -19.446 7.490 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -3.422 -18.703 7.169 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.826 -17.193 9.177 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -5.252 -18.147 9.533 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -3.492 -19.010 10.884 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -3.813 -20.195 9.633 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.493 -20.192 9.821 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -1.796 -19.229 8.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -0.123 -18.235 9.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -1.488 -17.228 9.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -1.195 -18.161 11.089 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.402 -16.896 6.378 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.749 -16.491 6.637 1.00 0.00 C ATOM 1700 C LEU A 112 -9.740 -17.572 6.896 1.00 0.00 C ATOM 1701 O LEU A 112 -9.559 -18.752 6.600 1.00 0.00 O ATOM 1702 CB LEU A 112 -9.189 -15.561 5.493 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.527 -14.173 5.514 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.070 -13.708 4.121 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -9.243 -12.985 6.178 1.00 0.00 C ATOM 0 H LEU A 112 -7.257 -17.172 5.407 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.737 -15.974 7.596 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.964 -16.043 4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.271 -15.435 5.539 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.702 -14.410 6.186 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.611 -12.723 4.199 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.344 -14.416 3.721 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.931 -13.655 3.454 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.623 -12.093 6.093 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.198 -12.812 5.681 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.417 -13.207 7.231 1.00 0.00 H new ATOM 1717 N THR A 113 -10.938 -17.286 7.437 1.00 0.00 N ATOM 1718 CA THR A 113 -12.066 -18.163 7.468 1.00 0.00 C ATOM 1719 C THR A 113 -13.219 -17.377 6.944 1.00 0.00 C ATOM 1720 O THR A 113 -13.097 -16.198 6.613 1.00 0.00 O ATOM 1721 CB THR A 113 -12.453 -18.747 8.795 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.542 -17.723 9.774 1.00 0.00 O ATOM 1723 CG2 THR A 113 -11.316 -19.721 9.145 1.00 0.00 C ATOM 0 H THR A 113 -11.129 -16.387 7.879 1.00 0.00 H new ATOM 0 HA THR A 113 -11.785 -19.034 6.876 1.00 0.00 H new ATOM 0 HB THR A 113 -13.423 -19.242 8.761 1.00 0.00 H new ATOM 0 HG1 THR A 113 -13.097 -18.031 10.520 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.523 -20.192 10.106 1.00 0.00 H new ATOM 0 HG22 THR A 113 -11.243 -20.487 8.373 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.374 -19.175 9.204 1.00 0.00 H new ATOM 1731 N ASP A 114 -14.434 -17.950 6.884 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.616 -17.298 6.410 1.00 0.00 C ATOM 1733 C ASP A 114 -16.152 -16.280 7.357 1.00 0.00 C ATOM 1734 O ASP A 114 -16.419 -15.168 6.906 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.633 -18.436 6.215 1.00 0.00 C ATOM 1736 CG ASP A 114 -16.184 -19.386 5.114 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.410 -20.368 5.269 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -16.517 -18.929 3.988 1.00 0.00 O ATOM 0 H ASP A 114 -14.600 -18.912 7.179 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.405 -16.741 5.497 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.752 -18.986 7.149 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.608 -18.018 5.964 1.00 0.00 H new ATOM 1743 N GLU A 115 -16.141 -16.524 8.680 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.157 -15.534 9.711 1.00 0.00 C ATOM 1745 C GLU A 115 -15.361 -14.285 9.546 1.00 0.00 C ATOM 1746 O GLU A 115 -15.834 -13.188 9.839 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.776 -16.102 11.088 1.00 0.00 C ATOM 1748 CG GLU A 115 -16.525 -17.404 11.379 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.635 -18.551 10.922 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -14.584 -18.837 11.555 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -15.969 -19.165 9.874 1.00 0.00 O ATOM 0 H GLU A 115 -16.120 -17.474 9.052 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.203 -15.239 9.627 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.702 -16.282 11.125 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.003 -15.369 11.862 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.747 -17.490 12.443 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.479 -17.424 10.852 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.071 -14.346 9.173 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.194 -13.248 8.906 1.00 0.00 C ATOM 1760 C GLU A 116 -13.420 -12.562 7.602 1.00 0.00 C ATOM 1761 O GLU A 116 -13.334 -11.335 7.602 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.717 -13.675 8.902 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.171 -14.420 10.121 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.676 -14.350 10.399 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.051 -13.307 10.065 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.163 -15.330 11.002 1.00 0.00 O ATOM 0 H GLU A 116 -13.602 -15.243 9.048 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.425 -12.559 9.719 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.556 -14.306 8.028 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.113 -12.778 8.763 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.691 -14.043 11.002 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.441 -15.471 10.017 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.554 -13.216 6.434 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.896 -12.800 5.109 1.00 0.00 C ATOM 1775 C VAL A 117 -15.173 -12.036 5.188 1.00 0.00 C ATOM 1776 O VAL A 117 -15.200 -10.882 4.761 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.825 -13.883 4.073 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.569 -13.534 2.773 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.350 -14.275 3.890 1.00 0.00 C ATOM 0 H VAL A 117 -13.390 -14.223 6.430 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.130 -12.129 4.721 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.368 -14.762 4.420 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.477 -14.360 2.068 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.622 -13.360 2.992 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -14.136 -12.634 2.336 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.273 -15.062 3.140 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.780 -13.405 3.563 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.949 -14.636 4.837 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.247 -12.556 5.807 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.452 -11.833 6.076 1.00 0.00 C ATOM 1791 C ASP A 118 -17.281 -10.500 6.719 1.00 0.00 C ATOM 1792 O ASP A 118 -17.785 -9.458 6.302 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.417 -12.847 6.714 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.758 -12.223 7.069 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.450 -11.783 6.113 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.097 -12.140 8.280 1.00 0.00 O ATOM 0 H ASP A 118 -16.278 -13.522 6.134 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.910 -11.458 5.161 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.576 -13.677 6.025 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.962 -13.262 7.614 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.579 -10.474 7.866 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.208 -9.260 8.525 1.00 0.00 C ATOM 1803 C GLU A 119 -15.492 -8.297 7.642 1.00 0.00 C ATOM 1804 O GLU A 119 -15.901 -7.142 7.542 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.415 -9.648 9.785 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.070 -8.461 10.686 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.220 -8.811 11.899 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -14.513 -9.771 12.661 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -13.163 -8.136 12.026 1.00 0.00 O ATOM 0 H GLU A 119 -16.262 -11.316 8.347 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.103 -8.707 8.810 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -15.994 -10.372 10.359 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.492 -10.144 9.484 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.543 -7.713 10.093 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -15.997 -8.001 11.029 1.00 0.00 H new ATOM 1816 N MET A 120 -14.422 -8.724 6.947 1.00 0.00 N ATOM 1817 CA MET A 120 -13.556 -7.994 6.074 1.00 0.00 C ATOM 1818 C MET A 120 -14.325 -7.359 4.967 1.00 0.00 C ATOM 1819 O MET A 120 -14.101 -6.184 4.680 1.00 0.00 O ATOM 1820 CB MET A 120 -12.423 -8.835 5.462 1.00 0.00 C ATOM 1821 CG MET A 120 -11.384 -8.178 4.551 1.00 0.00 C ATOM 1822 SD MET A 120 -9.840 -9.070 4.198 1.00 0.00 S ATOM 1823 CE MET A 120 -10.643 -10.558 3.538 1.00 0.00 C ATOM 0 H MET A 120 -14.133 -9.700 7.008 1.00 0.00 H new ATOM 0 HA MET A 120 -13.095 -7.238 6.709 1.00 0.00 H new ATOM 0 HB2 MET A 120 -11.882 -9.299 6.287 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.889 -9.640 4.894 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.868 -7.966 3.598 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.117 -7.218 4.993 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.909 -11.161 3.003 1.00 0.00 H new ATOM 0 HE2 MET A 120 -11.062 -11.140 4.359 1.00 0.00 H new ATOM 0 HE3 MET A 120 -11.441 -10.268 2.855 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.227 -8.105 4.305 1.00 0.00 N ATOM 1834 CA ILE A 121 -15.998 -7.442 3.300 1.00 0.00 C ATOM 1835 C ILE A 121 -16.867 -6.303 3.713 1.00 0.00 C ATOM 1836 O ILE A 121 -16.918 -5.240 3.096 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.858 -8.418 2.554 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.971 -9.254 1.616 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.973 -7.742 1.738 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.218 -8.507 0.516 1.00 0.00 C ATOM 0 H ILE A 121 -15.416 -9.097 4.449 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.214 -6.997 2.687 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.349 -9.049 3.295 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.239 -9.784 2.226 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.598 -10.010 1.143 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.559 -8.503 1.222 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.621 -7.176 2.407 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.530 -7.067 1.006 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.633 -9.216 -0.070 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.932 -8.001 -0.134 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.552 -7.771 0.966 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.534 -6.496 4.864 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.483 -5.624 5.484 1.00 0.00 C ATOM 1854 C ARG A 122 -17.886 -4.382 6.050 1.00 0.00 C ATOM 1855 O ARG A 122 -18.496 -3.314 6.072 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.259 -6.399 6.563 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.435 -5.718 7.266 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.238 -6.485 8.320 1.00 0.00 C ATOM 1859 NE ARG A 122 -22.002 -7.569 7.642 1.00 0.00 N ATOM 1860 CZ ARG A 122 -21.636 -8.884 7.607 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -20.653 -9.416 8.390 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -22.261 -9.691 6.701 1.00 0.00 N ATOM 0 H ARG A 122 -17.394 -7.345 5.412 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.161 -5.285 4.700 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.635 -7.314 6.104 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.545 -6.698 7.331 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.051 -4.816 7.742 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.134 -5.398 6.494 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -20.570 -6.906 9.071 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.919 -5.811 8.841 1.00 0.00 H new ATOM 0 HE ARG A 122 -22.866 -7.309 7.167 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -20.147 -8.822 9.047 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -20.424 -10.407 8.318 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -22.974 -9.306 6.081 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -22.016 -10.679 6.644 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.632 -4.404 6.534 1.00 0.00 N ATOM 1877 CA GLU A 123 -15.954 -3.282 7.105 1.00 0.00 C ATOM 1878 C GLU A 123 -15.672 -2.219 6.099 1.00 0.00 C ATOM 1879 O GLU A 123 -15.602 -1.044 6.457 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.626 -3.809 7.675 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.950 -2.918 8.719 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.770 -3.623 9.373 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -11.677 -3.517 8.755 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -12.911 -4.327 10.409 1.00 0.00 O ATOM 0 H GLU A 123 -16.061 -5.249 6.527 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.584 -2.831 7.872 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.806 -4.787 8.121 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -13.932 -3.959 6.848 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.609 -1.997 8.247 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.675 -2.635 9.482 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.478 -2.642 4.838 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.202 -1.858 3.674 1.00 0.00 C ATOM 1893 C ALA A 124 -16.466 -1.412 3.023 1.00 0.00 C ATOM 1894 O ALA A 124 -16.681 -0.223 2.794 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.440 -2.712 2.646 1.00 0.00 C ATOM 0 H ALA A 124 -15.519 -3.636 4.613 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.615 -0.994 3.987 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.230 -2.113 1.760 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.502 -3.055 3.082 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.047 -3.573 2.367 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.347 -2.373 2.692 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.541 -2.119 1.946 1.00 0.00 C ATOM 1903 C ASP A 125 -19.608 -1.269 2.546 1.00 0.00 C ATOM 1904 O ASP A 125 -19.957 -1.445 3.712 1.00 0.00 O ATOM 1905 CB ASP A 125 -18.991 -3.500 1.439 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.185 -3.583 0.500 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.535 -2.505 -0.050 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -20.679 -4.715 0.248 1.00 0.00 O ATOM 0 H ASP A 125 -17.226 -3.352 2.950 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.304 -1.430 1.135 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.141 -3.959 0.934 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.214 -4.115 2.311 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.977 -0.185 1.840 1.00 0.00 N ATOM 1914 CA ILE A 126 -21.050 0.640 2.302 1.00 0.00 C ATOM 1915 C ILE A 126 -22.312 0.515 1.520 1.00 0.00 C ATOM 1916 O ILE A 126 -23.378 0.992 1.907 1.00 0.00 O ATOM 1917 CB ILE A 126 -20.682 2.081 2.493 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -21.557 2.921 3.438 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.443 2.678 1.096 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -21.663 2.417 4.877 1.00 0.00 C ATOM 0 H ILE A 126 -19.543 0.116 0.967 1.00 0.00 H new ATOM 0 HA ILE A 126 -21.254 0.228 3.290 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.764 2.118 3.080 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -21.164 3.937 3.458 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -22.561 2.976 3.018 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.172 3.729 1.191 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.635 2.138 0.603 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -21.353 2.590 0.502 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -22.304 3.086 5.451 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -22.090 1.414 4.881 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -20.671 2.390 5.327 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.250 -0.269 0.429 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.434 -0.471 -0.347 1.00 0.00 C ATOM 1934 C ASP A 127 -24.207 -1.591 0.260 1.00 0.00 C ATOM 1935 O ASP A 127 -25.408 -1.457 0.488 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.034 -1.077 -1.703 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.156 -0.210 -2.594 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.536 0.940 -2.943 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.032 -0.658 -2.945 1.00 0.00 O ATOM 0 H ASP A 127 -21.414 -0.747 0.093 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.971 0.476 -0.412 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -22.513 -2.016 -1.518 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -23.944 -1.320 -2.251 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.508 -2.668 0.662 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.024 -3.880 1.215 1.00 0.00 C ATOM 1946 C GLY A 128 -24.157 -4.925 0.161 1.00 0.00 C ATOM 1947 O GLY A 128 -24.992 -5.816 0.304 1.00 0.00 O ATOM 0 H GLY A 128 -22.491 -2.689 0.592 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.363 -4.236 2.005 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -24.995 -3.692 1.673 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.344 -4.794 -0.903 1.00 0.00 N ATOM 1952 CA ASP A 129 -23.555 -5.601 -2.064 1.00 0.00 C ATOM 1953 C ASP A 129 -22.754 -6.858 -2.099 1.00 0.00 C ATOM 1954 O ASP A 129 -23.138 -7.768 -2.832 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.339 -4.835 -3.380 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.904 -4.381 -3.605 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.135 -4.030 -2.670 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.613 -4.238 -4.822 1.00 0.00 O ATOM 0 H ASP A 129 -22.559 -4.146 -0.960 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.605 -5.880 -1.979 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.643 -5.470 -4.212 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -23.991 -3.962 -3.391 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.679 -6.942 -1.296 1.00 0.00 N ATOM 1964 CA GLY A 130 -20.815 -8.059 -1.071 1.00 0.00 C ATOM 1965 C GLY A 130 -19.516 -7.832 -1.764 1.00 0.00 C ATOM 1966 O GLY A 130 -18.642 -8.689 -1.886 1.00 0.00 O ATOM 0 H GLY A 130 -21.385 -6.136 -0.744 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.650 -8.195 -0.002 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.281 -8.973 -1.440 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.376 -6.629 -2.349 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.198 -6.250 -3.066 1.00 0.00 C ATOM 1972 C GLN A 131 -17.581 -4.990 -2.565 1.00 0.00 C ATOM 1973 O GLN A 131 -18.212 -4.237 -1.825 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.403 -6.111 -4.584 1.00 0.00 C ATOM 1975 CG GLN A 131 -18.871 -7.458 -5.138 1.00 0.00 C ATOM 1976 CD GLN A 131 -18.900 -7.484 -6.659 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -19.820 -6.960 -7.285 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -17.889 -8.167 -7.260 1.00 0.00 N ATOM 0 H GLN A 131 -20.095 -5.906 -2.324 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.523 -7.085 -2.880 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.141 -5.337 -4.797 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.474 -5.806 -5.065 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.209 -8.245 -4.777 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.867 -7.678 -4.755 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -17.149 -8.584 -6.695 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -17.871 -8.263 -8.275 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.367 -4.787 -3.108 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.598 -3.609 -2.853 1.00 0.00 C ATOM 1989 C VAL A 132 -15.310 -2.836 -4.094 1.00 0.00 C ATOM 1990 O VAL A 132 -14.923 -3.414 -5.108 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.400 -3.929 -2.008 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.759 -2.590 -1.604 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -14.838 -4.781 -0.805 1.00 0.00 C ATOM 0 H VAL A 132 -15.912 -5.452 -3.734 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.200 -2.921 -2.259 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.657 -4.519 -2.545 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.881 -2.779 -0.986 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.462 -2.044 -2.499 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.479 -1.997 -1.040 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -13.969 -5.015 -0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.565 -4.226 -0.211 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -15.291 -5.707 -1.160 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.642 -1.533 -4.122 1.00 0.00 N ATOM 2004 CA ASN A 133 -15.532 -0.760 -5.320 1.00 0.00 C ATOM 2005 C ASN A 133 -14.479 0.274 -5.113 1.00 0.00 C ATOM 2006 O ASN A 133 -14.072 0.462 -3.968 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.835 -0.120 -5.827 1.00 0.00 C ATOM 2008 CG ASN A 133 -17.446 0.892 -4.868 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.817 1.793 -4.315 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -18.777 0.741 -4.635 1.00 0.00 N ATOM 0 H ASN A 133 -15.987 -1.014 -3.314 1.00 0.00 H new ATOM 0 HA ASN A 133 -15.265 -1.458 -6.113 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -16.639 0.371 -6.780 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.563 -0.908 -6.019 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -19.259 1.377 -3.999 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.294 -0.008 -5.096 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.044 1.025 -6.140 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.015 2.011 -6.021 1.00 0.00 C ATOM 2019 C TYR A 134 -13.085 3.017 -4.924 1.00 0.00 C ATOM 2020 O TYR A 134 -12.192 3.299 -4.127 1.00 0.00 O ATOM 2021 CB TYR A 134 -12.922 2.735 -7.375 1.00 0.00 C ATOM 2022 CG TYR A 134 -12.496 1.854 -8.499 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -11.169 1.560 -8.705 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -13.341 1.629 -9.560 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -10.696 0.816 -9.760 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -12.910 0.934 -10.665 1.00 0.00 C ATOM 2027 CZ TYR A 134 -11.581 0.607 -10.792 1.00 0.00 C ATOM 2028 OH TYR A 134 -11.087 -0.117 -11.899 1.00 0.00 O ATOM 0 H TYR A 134 -14.421 0.944 -7.084 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.131 1.440 -5.737 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.894 3.168 -7.613 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -12.218 3.562 -7.287 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -10.451 1.938 -7.992 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -14.354 2.002 -9.525 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -9.691 0.420 -9.777 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -13.614 0.646 -11.432 1.00 0.00 H new ATOM 0 HH TYR A 134 -11.794 -0.209 -12.571 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.277 3.637 -4.852 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.611 4.684 -3.937 1.00 0.00 C ATOM 2040 C GLU A 135 -14.473 4.252 -2.518 1.00 0.00 C ATOM 2041 O GLU A 135 -13.977 4.998 -1.674 1.00 0.00 O ATOM 2042 CB GLU A 135 -16.036 5.229 -4.137 1.00 0.00 C ATOM 2043 CG GLU A 135 -16.398 5.558 -5.587 1.00 0.00 C ATOM 2044 CD GLU A 135 -15.606 6.739 -6.131 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -15.716 7.818 -5.490 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -15.091 6.644 -7.277 1.00 0.00 O ATOM 0 H GLU A 135 -15.052 3.393 -5.469 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.897 5.479 -4.154 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.747 4.496 -3.757 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.154 6.130 -3.534 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -16.215 4.683 -6.211 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -17.464 5.778 -5.651 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.914 3.004 -2.283 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.870 2.371 -1.001 1.00 0.00 C ATOM 2055 C GLU A 136 -13.435 2.201 -0.637 1.00 0.00 C ATOM 2056 O GLU A 136 -13.008 2.438 0.492 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.549 0.991 -0.983 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.069 1.168 -0.968 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.879 -0.039 -1.419 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.467 -0.985 -2.142 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.075 -0.064 -1.022 1.00 0.00 O ATOM 0 H GLU A 136 -15.316 2.414 -3.011 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.412 2.999 -0.294 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.248 0.415 -1.858 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.229 0.428 -0.106 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.376 1.430 0.045 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -17.324 2.013 -1.607 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.654 1.691 -1.606 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.259 1.400 -1.488 1.00 0.00 C ATOM 2070 C PHE A 137 -10.356 2.558 -1.240 1.00 0.00 C ATOM 2071 O PHE A 137 -9.496 2.461 -0.367 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.809 0.764 -2.814 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.531 0.016 -2.644 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.385 -1.274 -2.191 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.434 0.640 -3.189 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.188 -1.923 -2.377 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.289 -0.046 -3.520 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.151 -1.335 -3.062 1.00 0.00 C ATOM 0 H PHE A 137 -13.021 1.468 -2.531 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.173 0.760 -0.610 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.583 0.089 -3.178 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.682 1.540 -3.569 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.204 -1.773 -1.693 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.473 1.705 -3.363 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -8.059 -2.917 -1.976 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.520 0.415 -4.123 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.236 -1.881 -3.239 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.622 3.673 -1.945 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.827 4.860 -1.885 1.00 0.00 C ATOM 2090 C VAL A 138 -10.052 5.644 -0.638 1.00 0.00 C ATOM 2091 O VAL A 138 -9.187 6.333 -0.101 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.802 5.741 -3.099 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -11.161 6.436 -3.284 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -8.653 6.755 -2.976 1.00 0.00 C ATOM 0 H VAL A 138 -11.418 3.750 -2.578 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.819 4.446 -1.864 1.00 0.00 H new ATOM 0 HB VAL A 138 -9.625 5.135 -3.988 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -11.127 7.072 -4.169 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -11.940 5.684 -3.407 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -11.380 7.046 -2.407 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.636 7.394 -3.859 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.802 7.368 -2.087 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -7.705 6.223 -2.895 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.310 5.665 -0.162 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.577 6.291 1.096 1.00 0.00 C ATOM 2106 C GLN A 139 -10.912 5.547 2.202 1.00 0.00 C ATOM 2107 O GLN A 139 -10.378 6.160 3.125 1.00 0.00 O ATOM 2108 CB GLN A 139 -13.104 6.336 1.273 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.723 7.118 2.434 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.515 8.620 2.306 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -12.564 9.222 2.800 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -14.558 9.283 1.739 1.00 0.00 N ATOM 0 H GLN A 139 -12.121 5.262 -0.631 1.00 0.00 H new ATOM 0 HA GLN A 139 -11.175 7.304 1.121 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.524 6.739 0.352 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.450 5.306 1.357 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -14.791 6.906 2.481 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.288 6.773 3.372 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -15.336 8.761 1.336 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.563 10.303 1.717 1.00 0.00 H new ATOM 2121 N MET A 140 -10.997 4.205 2.181 1.00 0.00 N ATOM 2122 CA MET A 140 -10.462 3.229 3.079 1.00 0.00 C ATOM 2123 C MET A 140 -8.981 3.159 3.228 1.00 0.00 C ATOM 2124 O MET A 140 -8.416 3.063 4.316 1.00 0.00 O ATOM 2125 CB MET A 140 -10.882 1.784 2.763 1.00 0.00 C ATOM 2126 CG MET A 140 -10.544 0.814 3.897 1.00 0.00 C ATOM 2127 SD MET A 140 -11.519 -0.720 3.897 1.00 0.00 S ATOM 2128 CE MET A 140 -11.008 -1.290 2.250 1.00 0.00 C ATOM 0 H MET A 140 -11.513 3.747 1.429 1.00 0.00 H new ATOM 0 HA MET A 140 -10.898 3.612 4.002 1.00 0.00 H new ATOM 0 HB2 MET A 140 -11.955 1.754 2.572 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.386 1.457 1.849 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.487 0.557 3.834 1.00 0.00 H new ATOM 0 HG3 MET A 140 -10.692 1.323 4.849 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.451 -2.265 2.049 1.00 0.00 H new ATOM 0 HE2 MET A 140 -11.344 -0.576 1.498 1.00 0.00 H new ATOM 0 HE3 MET A 140 -9.922 -1.371 2.214 1.00 0.00 H new ATOM 2138 N MET A 141 -8.230 3.029 2.120 1.00 0.00 N ATOM 2139 CA MET A 141 -6.825 2.763 2.092 1.00 0.00 C ATOM 2140 C MET A 141 -6.011 4.005 2.210 1.00 0.00 C ATOM 2141 O MET A 141 -4.848 3.835 2.572 1.00 0.00 O ATOM 2142 CB MET A 141 -6.415 2.094 0.770 1.00 0.00 C ATOM 2143 CG MET A 141 -7.047 0.717 0.555 1.00 0.00 C ATOM 2144 SD MET A 141 -6.677 -0.383 1.954 1.00 0.00 S ATOM 2145 CE MET A 141 -7.160 -1.924 1.123 1.00 0.00 C ATOM 0 H MET A 141 -8.630 3.115 1.185 1.00 0.00 H new ATOM 0 HA MET A 141 -6.636 2.109 2.943 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.694 2.745 -0.058 1.00 0.00 H new ATOM 0 HB3 MET A 141 -5.330 1.994 0.745 1.00 0.00 H new ATOM 0 HG2 MET A 141 -8.126 0.820 0.442 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.670 0.278 -0.369 1.00 0.00 H new ATOM 0 HE1 MET A 141 -7.034 -2.762 1.809 1.00 0.00 H new ATOM 0 HE2 MET A 141 -8.204 -1.860 0.816 1.00 0.00 H new ATOM 0 HE3 MET A 141 -6.532 -2.076 0.245 1.00 0.00 H new ATOM 2155 N THR A 142 -6.586 5.162 1.836 1.00 0.00 N ATOM 2156 CA THR A 142 -5.989 6.432 2.112 1.00 0.00 C ATOM 2157 C THR A 142 -5.926 6.619 3.621 1.00 0.00 C ATOM 2158 O THR A 142 -4.824 6.709 4.225 1.00 0.00 O ATOM 2159 CB THR A 142 -6.818 7.557 1.567 1.00 0.00 C ATOM 2160 OG1 THR A 142 -6.907 7.477 0.152 1.00 0.00 O ATOM 2161 CG2 THR A 142 -6.236 8.918 1.985 1.00 0.00 C ATOM 0 H THR A 142 -7.474 5.217 1.337 1.00 0.00 H new ATOM 0 HA THR A 142 -5.002 6.448 1.649 1.00 0.00 H new ATOM 0 HB THR A 142 -7.821 7.466 1.984 1.00 0.00 H new ATOM 0 HG1 THR A 142 -7.583 6.812 -0.096 1.00 0.00 H new ATOM 0 HG21 THR A 142 -6.854 9.718 1.578 1.00 0.00 H new ATOM 0 HG22 THR A 142 -6.221 8.989 3.073 1.00 0.00 H new ATOM 0 HG23 THR A 142 -5.220 9.013 1.601 1.00 0.00 H new ATOM 2170 N ARG B 1 -10.134 -2.510 10.761 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.750 -2.187 10.347 1.00 0.00 C ATOM 2172 C ARG B 1 -7.759 -3.214 9.918 1.00 0.00 C ATOM 2173 O ARG B 1 -7.171 -3.096 8.844 1.00 0.00 O ATOM 2174 CB ARG B 1 -8.162 -1.225 11.392 1.00 0.00 C ATOM 2175 CG ARG B 1 -6.888 -0.575 10.847 1.00 0.00 C ATOM 2176 CD ARG B 1 -6.128 0.369 11.780 1.00 0.00 C ATOM 2177 NE ARG B 1 -4.994 0.987 11.036 1.00 0.00 N ATOM 2178 CZ ARG B 1 -5.137 2.215 10.458 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -6.283 2.956 10.448 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -4.136 2.702 9.669 1.00 0.00 N ATOM 0 H1 ARG B 1 -10.478 -1.782 11.419 1.00 0.00 H new ATOM 0 H2 ARG B 1 -10.749 -2.538 9.923 1.00 0.00 H new ATOM 0 H3 ARG B 1 -10.148 -3.437 11.232 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.916 -1.770 9.354 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.893 -0.457 11.643 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -7.939 -1.766 12.312 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -6.207 -1.370 10.544 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -7.151 -0.020 9.947 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -6.796 1.143 12.156 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -5.755 -0.179 12.646 1.00 0.00 H new ATOM 0 HE ARG B 1 -4.107 0.490 10.958 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -7.125 2.599 10.899 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -6.297 3.867 9.990 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -3.292 2.150 9.517 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -4.231 3.619 9.232 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.529 -4.223 10.778 1.00 0.00 N ATOM 2194 CA ARG B 2 -6.400 -5.100 10.738 1.00 0.00 C ATOM 2195 C ARG B 2 -6.176 -5.828 9.457 1.00 0.00 C ATOM 2196 O ARG B 2 -5.003 -5.936 9.104 1.00 0.00 O ATOM 2197 CB ARG B 2 -6.478 -6.136 11.871 1.00 0.00 C ATOM 2198 CG ARG B 2 -5.128 -6.791 12.171 1.00 0.00 C ATOM 2199 CD ARG B 2 -5.094 -7.612 13.461 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.716 -8.085 13.773 1.00 0.00 N ATOM 2201 CZ ARG B 2 -3.331 -8.409 15.042 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -4.087 -8.254 16.168 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -2.038 -8.784 15.265 1.00 0.00 N ATOM 0 H ARG B 2 -8.167 -4.438 11.544 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.552 -4.425 10.854 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -6.850 -5.652 12.774 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -7.199 -6.908 11.602 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -4.859 -7.438 11.336 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -4.366 -6.014 12.230 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -5.468 -7.008 14.288 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -5.761 -8.469 13.365 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.039 -8.169 13.015 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -5.028 -7.866 16.101 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -3.711 -8.526 17.076 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -1.376 -8.819 14.490 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.733 -9.029 16.207 1.00 0.00 H new ATOM 2217 N LYS B 3 -7.208 -6.448 8.856 1.00 0.00 N ATOM 2218 CA LYS B 3 -7.007 -7.364 7.777 1.00 0.00 C ATOM 2219 C LYS B 3 -6.699 -6.653 6.504 1.00 0.00 C ATOM 2220 O LYS B 3 -5.814 -7.069 5.758 1.00 0.00 O ATOM 2221 CB LYS B 3 -8.276 -8.213 7.591 1.00 0.00 C ATOM 2222 CG LYS B 3 -8.788 -8.791 8.911 1.00 0.00 C ATOM 2223 CD LYS B 3 -9.966 -9.741 8.685 1.00 0.00 C ATOM 2224 CE LYS B 3 -10.620 -10.157 10.004 1.00 0.00 C ATOM 2225 NZ LYS B 3 -9.698 -10.879 10.910 1.00 0.00 N ATOM 0 H LYS B 3 -8.184 -6.314 9.119 1.00 0.00 H new ATOM 0 HA LYS B 3 -6.156 -7.999 8.024 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -9.056 -7.601 7.138 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -8.067 -9.027 6.897 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -7.981 -9.323 9.414 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -9.095 -7.979 9.571 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -10.707 -9.257 8.049 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -9.621 -10.628 8.154 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -10.996 -9.269 10.512 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -11.481 -10.791 9.791 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -10.217 -11.193 11.755 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -9.305 -11.707 10.418 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -8.924 -10.245 11.194 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.381 -5.511 6.308 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.165 -4.711 5.142 1.00 0.00 C ATOM 2241 C TRP B 4 -5.851 -4.009 5.162 1.00 0.00 C ATOM 2242 O TRP B 4 -5.107 -4.262 4.216 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.262 -3.635 5.088 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.589 -4.159 4.595 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.766 -4.160 5.287 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.888 -4.563 3.246 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.765 -4.593 4.455 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.263 -4.819 3.195 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.125 -4.659 2.114 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.917 -5.163 2.044 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.800 -5.012 0.969 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.160 -5.201 0.897 1.00 0.00 C ATOM 0 H TRP B 4 -8.079 -5.142 6.954 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.184 -5.376 4.279 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.394 -3.210 6.083 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -7.935 -2.825 4.437 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.889 -3.868 6.319 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.738 -4.728 4.730 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.062 -4.470 2.119 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.972 -5.393 2.037 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.223 -5.150 0.066 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.632 -5.379 -0.058 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.519 -3.128 6.123 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.438 -2.200 6.001 1.00 0.00 C ATOM 2265 C GLN B 5 -3.091 -2.798 5.780 1.00 0.00 C ATOM 2266 O GLN B 5 -2.543 -2.404 4.752 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.213 -1.319 7.242 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.315 -0.276 7.437 1.00 0.00 C ATOM 2269 CD GLN B 5 -5.462 0.652 6.240 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -4.513 0.907 5.500 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -6.726 1.081 5.977 1.00 0.00 N ATOM 0 H GLN B 5 -6.017 -3.059 7.010 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.782 -1.641 5.131 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -4.159 -1.953 8.127 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.252 -0.813 7.153 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -6.263 -0.784 7.617 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -5.097 0.316 8.326 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -7.487 0.849 6.616 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -6.913 1.635 5.141 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.642 -3.840 6.502 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.302 -4.332 6.424 1.00 0.00 C ATOM 2282 C LYS B 6 -1.064 -4.916 5.074 1.00 0.00 C ATOM 2283 O LYS B 6 -0.002 -5.010 4.461 1.00 0.00 O ATOM 2284 CB LYS B 6 -0.990 -5.271 7.602 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.856 -6.527 7.478 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.653 -7.557 8.590 1.00 0.00 C ATOM 2287 CE LYS B 6 -2.792 -8.579 8.573 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.448 -9.657 9.527 1.00 0.00 N ATOM 0 H LYS B 6 -3.228 -4.355 7.159 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.588 -3.515 6.530 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.066 -5.540 7.600 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.189 -4.768 8.548 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.904 -6.229 7.465 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.648 -7.002 6.519 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.697 -8.064 8.457 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -1.617 -7.057 9.558 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -3.733 -8.106 8.854 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -2.926 -8.985 7.570 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -3.136 -10.432 9.438 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.494 -10.015 9.317 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.472 -9.283 10.497 1.00 0.00 H new ATOM 2302 N THR B 7 -2.158 -5.433 4.486 1.00 0.00 N ATOM 2303 CA THR B 7 -2.165 -6.322 3.366 1.00 0.00 C ATOM 2304 C THR B 7 -2.268 -5.499 2.128 1.00 0.00 C ATOM 2305 O THR B 7 -1.619 -5.815 1.132 1.00 0.00 O ATOM 2306 CB THR B 7 -3.225 -7.383 3.321 1.00 0.00 C ATOM 2307 OG1 THR B 7 -3.198 -8.138 4.523 1.00 0.00 O ATOM 2308 CG2 THR B 7 -2.956 -8.394 2.193 1.00 0.00 C ATOM 0 H THR B 7 -3.098 -5.215 4.815 1.00 0.00 H new ATOM 0 HA THR B 7 -1.236 -6.885 3.459 1.00 0.00 H new ATOM 0 HB THR B 7 -4.177 -6.874 3.169 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.001 -7.942 5.050 1.00 0.00 H new ATOM 0 HG21 THR B 7 -3.741 -9.150 2.187 1.00 0.00 H new ATOM 0 HG22 THR B 7 -2.944 -7.875 1.235 1.00 0.00 H new ATOM 0 HG23 THR B 7 -1.992 -8.874 2.357 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.034 -4.393 2.141 1.00 0.00 N ATOM 2317 CA GLY B 8 -2.904 -3.349 1.172 1.00 0.00 C ATOM 2318 C GLY B 8 -1.556 -2.729 1.038 1.00 0.00 C ATOM 2319 O GLY B 8 -1.029 -2.269 0.026 1.00 0.00 O ATOM 0 H GLY B 8 -3.758 -4.221 2.838 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.194 -3.748 0.200 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.618 -2.563 1.420 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.941 -2.521 2.216 1.00 0.00 N ATOM 2324 CA HIS B 9 0.354 -1.938 2.377 1.00 0.00 C ATOM 2325 C HIS B 9 1.486 -2.671 1.743 1.00 0.00 C ATOM 2326 O HIS B 9 2.400 -2.188 1.077 1.00 0.00 O ATOM 2327 CB HIS B 9 0.717 -1.718 3.856 1.00 0.00 C ATOM 2328 CG HIS B 9 1.892 -0.821 4.112 1.00 0.00 C ATOM 2329 ND1 HIS B 9 2.137 0.430 3.585 1.00 0.00 N ATOM 2330 CD2 HIS B 9 3.013 -1.115 4.824 1.00 0.00 C ATOM 2331 CE1 HIS B 9 3.378 0.797 4.004 1.00 0.00 C ATOM 2332 NE2 HIS B 9 3.927 -0.081 4.824 1.00 0.00 N ATOM 0 H HIS B 9 -1.372 -2.774 3.105 1.00 0.00 H new ATOM 0 HA HIS B 9 0.242 -0.992 1.848 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -0.152 -1.302 4.366 1.00 0.00 H new ATOM 0 HB3 HIS B 9 0.919 -2.688 4.310 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.170 -2.054 5.333 1.00 0.00 H new ATOM 0 HE1 HIS B 9 3.864 1.712 3.698 1.00 0.00 H new ATOM 0 HE2 HIS B 9 4.809 -0.012 5.332 1.00 0.00 H new ATOM 2340 N ALA B 10 1.353 -4.002 1.882 1.00 0.00 N ATOM 2341 CA ALA B 10 2.146 -4.950 1.163 1.00 0.00 C ATOM 2342 C ALA B 10 2.100 -4.910 -0.326 1.00 0.00 C ATOM 2343 O ALA B 10 3.066 -5.080 -1.068 1.00 0.00 O ATOM 2344 CB ALA B 10 1.919 -6.354 1.749 1.00 0.00 C ATOM 0 H ALA B 10 0.675 -4.431 2.512 1.00 0.00 H new ATOM 0 HA ALA B 10 3.177 -4.636 1.325 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.523 -7.078 1.202 1.00 0.00 H new ATOM 0 HB2 ALA B 10 2.208 -6.361 2.800 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.865 -6.619 1.661 1.00 0.00 H new ATOM 2350 N VAL B 11 0.858 -4.881 -0.841 1.00 0.00 N ATOM 2351 CA VAL B 11 0.514 -4.704 -2.218 1.00 0.00 C ATOM 2352 C VAL B 11 1.002 -3.371 -2.671 1.00 0.00 C ATOM 2353 O VAL B 11 1.761 -3.349 -3.639 1.00 0.00 O ATOM 2354 CB VAL B 11 -0.963 -4.715 -2.479 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -1.484 -4.707 -3.926 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.475 -6.110 -2.082 1.00 0.00 C ATOM 0 H VAL B 11 0.034 -4.989 -0.250 1.00 0.00 H new ATOM 0 HA VAL B 11 0.970 -5.540 -2.749 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.280 -3.809 -1.963 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.574 -4.717 -3.920 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -1.132 -3.810 -4.435 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -1.116 -5.589 -4.450 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.550 -6.166 -2.255 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -0.971 -6.867 -2.683 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.268 -6.287 -1.027 1.00 0.00 H new ATOM 2366 N ARG B 12 0.671 -2.286 -1.950 1.00 0.00 N ATOM 2367 CA ARG B 12 1.218 -1.028 -2.355 1.00 0.00 C ATOM 2368 C ARG B 12 2.703 -0.937 -2.444 1.00 0.00 C ATOM 2369 O ARG B 12 3.254 -0.347 -3.372 1.00 0.00 O ATOM 2370 CB ARG B 12 0.722 0.055 -1.382 1.00 0.00 C ATOM 2371 CG ARG B 12 -0.763 0.380 -1.557 1.00 0.00 C ATOM 2372 CD ARG B 12 -1.335 1.479 -0.659 1.00 0.00 C ATOM 2373 NE ARG B 12 -0.654 2.771 -0.952 1.00 0.00 N ATOM 2374 CZ ARG B 12 -1.099 3.981 -0.504 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -2.140 4.129 0.368 1.00 0.00 N ATOM 2376 NH2 ARG B 12 -0.444 5.127 -0.849 1.00 0.00 N ATOM 0 H ARG B 12 0.061 -2.272 -1.133 1.00 0.00 H new ATOM 0 HA ARG B 12 0.870 -0.891 -3.379 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.898 -0.276 -0.358 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.307 0.963 -1.529 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -0.929 0.668 -2.595 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -1.334 -0.532 -1.384 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -2.408 1.576 -0.825 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -1.198 1.214 0.389 1.00 0.00 H new ATOM 0 HE ARG B 12 0.193 2.750 -1.520 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -2.631 3.307 0.721 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -2.427 5.061 0.667 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.383 5.082 -1.445 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -0.781 6.028 -0.511 1.00 0.00 H new ATOM 2390 N ALA B 13 3.404 -1.564 -1.483 1.00 0.00 N ATOM 2391 CA ALA B 13 4.833 -1.600 -1.453 1.00 0.00 C ATOM 2392 C ALA B 13 5.400 -2.277 -2.653 1.00 0.00 C ATOM 2393 O ALA B 13 6.440 -1.814 -3.119 1.00 0.00 O ATOM 2394 CB ALA B 13 5.395 -2.252 -0.178 1.00 0.00 C ATOM 0 H ALA B 13 2.966 -2.059 -0.706 1.00 0.00 H new ATOM 0 HA ALA B 13 5.144 -0.555 -1.456 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.484 -2.248 -0.217 1.00 0.00 H new ATOM 0 HB2 ALA B 13 5.061 -1.691 0.695 1.00 0.00 H new ATOM 0 HB3 ALA B 13 5.038 -3.279 -0.107 1.00 0.00 H new ATOM 2400 N ILE B 14 4.785 -3.394 -3.081 1.00 0.00 N ATOM 2401 CA ILE B 14 5.032 -4.102 -4.299 1.00 0.00 C ATOM 2402 C ILE B 14 5.022 -3.253 -5.523 1.00 0.00 C ATOM 2403 O ILE B 14 5.942 -3.326 -6.336 1.00 0.00 O ATOM 2404 CB ILE B 14 4.006 -5.196 -4.312 1.00 0.00 C ATOM 2405 CG1 ILE B 14 4.650 -6.521 -3.870 1.00 0.00 C ATOM 2406 CG2 ILE B 14 3.346 -5.444 -5.679 1.00 0.00 C ATOM 2407 CD1 ILE B 14 5.894 -6.965 -4.638 1.00 0.00 C ATOM 0 H ILE B 14 4.053 -3.838 -2.527 1.00 0.00 H new ATOM 0 HA ILE B 14 6.048 -4.497 -4.324 1.00 0.00 H new ATOM 0 HB ILE B 14 3.228 -4.857 -3.628 1.00 0.00 H new ATOM 0 HG12 ILE B 14 4.912 -6.438 -2.815 1.00 0.00 H new ATOM 0 HG13 ILE B 14 3.900 -7.308 -3.951 1.00 0.00 H new ATOM 0 HG21 ILE B 14 2.619 -6.252 -5.591 1.00 0.00 H new ATOM 0 HG22 ILE B 14 2.841 -4.536 -6.009 1.00 0.00 H new ATOM 0 HG23 ILE B 14 4.109 -5.720 -6.407 1.00 0.00 H new ATOM 0 HD11 ILE B 14 6.253 -7.911 -4.233 1.00 0.00 H new ATOM 0 HD12 ILE B 14 5.645 -7.093 -5.691 1.00 0.00 H new ATOM 0 HD13 ILE B 14 6.672 -6.209 -4.538 1.00 0.00 H new ATOM 2419 N GLY B 15 4.027 -2.368 -5.711 1.00 0.00 N ATOM 2420 CA GLY B 15 3.772 -1.477 -6.800 1.00 0.00 C ATOM 2421 C GLY B 15 4.863 -0.469 -6.917 1.00 0.00 C ATOM 2422 O GLY B 15 5.240 -0.015 -7.996 1.00 0.00 O ATOM 0 H GLY B 15 3.305 -2.268 -4.998 1.00 0.00 H new ATOM 0 HA2 GLY B 15 3.690 -2.042 -7.728 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.818 -0.973 -6.649 1.00 0.00 H new ATOM 2426 N ARG B 16 5.452 -0.012 -5.797 1.00 0.00 N ATOM 2427 CA ARG B 16 6.377 1.058 -5.590 1.00 0.00 C ATOM 2428 C ARG B 16 7.716 0.507 -5.941 1.00 0.00 C ATOM 2429 O ARG B 16 8.434 1.036 -6.787 1.00 0.00 O ATOM 2430 CB ARG B 16 6.301 1.557 -4.137 1.00 0.00 C ATOM 2431 CG ARG B 16 7.289 2.714 -3.974 1.00 0.00 C ATOM 2432 CD ARG B 16 7.306 3.302 -2.562 1.00 0.00 C ATOM 2433 NE ARG B 16 6.018 4.019 -2.338 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.734 4.967 -1.398 1.00 0.00 C ATOM 2435 NH1 ARG B 16 6.677 5.400 -0.512 1.00 0.00 N ATOM 2436 NH2 ARG B 16 4.469 5.479 -1.393 1.00 0.00 N ATOM 0 H ARG B 16 5.243 -0.466 -4.908 1.00 0.00 H new ATOM 0 HA ARG B 16 6.155 1.928 -6.208 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.289 1.886 -3.901 1.00 0.00 H new ATOM 0 HB3 ARG B 16 6.544 0.750 -3.445 1.00 0.00 H new ATOM 0 HG2 ARG B 16 8.290 2.366 -4.227 1.00 0.00 H new ATOM 0 HG3 ARG B 16 7.036 3.501 -4.685 1.00 0.00 H new ATOM 0 HD2 ARG B 16 7.434 2.511 -1.823 1.00 0.00 H new ATOM 0 HD3 ARG B 16 8.147 3.986 -2.446 1.00 0.00 H new ATOM 0 HE ARG B 16 5.254 3.770 -2.966 1.00 0.00 H new ATOM 0 HH11 ARG B 16 7.621 5.014 -0.542 1.00 0.00 H new ATOM 0 HH12 ARG B 16 6.438 6.110 0.181 1.00 0.00 H new ATOM 0 HH21 ARG B 16 3.783 5.151 -2.073 1.00 0.00 H new ATOM 0 HH22 ARG B 16 4.209 6.190 -0.709 1.00 0.00 H new