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 105 MET CE :methyl -170:sc= -0.0204 (180deg=0) USER MOD Set 1.2: A 120 MET CE :methyl 170:sc= -0.0197 (180deg=-0.32) USER MOD Set 1.3: B 7 THR OG1 : rot 84:sc= 1.04 USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0 X(o=-0.016,f=-0.041) USER MOD Set 2.2: A 107 ASN : amide:sc= -0.0159 K(o=-0.016,f=-2!) USER MOD Set 3.1: A 56 ASN : amide:sc= 0.0676 X(o=0.14,f=0.048) USER MOD Set 3.2: A 58 THR OG1 : rot -84:sc= 0.0693 USER MOD Set 4.1: A 25 THR OG1 : rot 126:sc= 1.23 USER MOD Set 4.2: A 26 LYS NZ :NH3+ -161:sc= 1.18 (180deg=1.02) USER MOD Single : A 4 GLN : amide:sc= -0.0223 K(o=-0.022,f=-1.1) USER MOD Single : A 9 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0108) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot -96:sc= 1.19 USER MOD Single : A 24 THR OG1 : rot -77:sc= 0.996 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 MET CE :methyl 169:sc= 0 (180deg=-0.13) USER MOD Single : A 34 SER OG : rot 76:sc= 0.366 USER MOD Single : A 37 GLN : amide:sc= 0.915 K(o=0.91,f=-5!) USER MOD Single : A 38 ASN : amide:sc= -0.0419 K(o=-0.042,f=-1.9!) USER MOD Single : A 40 THR OG1 : rot -70:sc= 1.13 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 MET CE :methyl 177:sc= -1.12 (180deg=-1.16) USER MOD Single : A 49 ASN : amide:sc= -0.721 K(o=-0.72,f=-2.2) USER MOD Single : A 66 THR OG1 : rot 71:sc= 0.0118 USER MOD Single : A 67 MET CE :methyl -106:sc= 0 (180deg=-0.0342) USER MOD Single : A 68 MET CE :methyl -121:sc= -0.057 (180deg=-0.492) 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 73 LYS NZ :NH3+ 169:sc= 1.28 (180deg=1.17) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0241) USER MOD Single : A 93 ASN : amide:sc= 0.584 K(o=0.58,f=-4!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0.00288 USER MOD Single : A 106 THR OG1 : rot 64:sc= 0.962 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 1.25 USER MOD Single : A 131 GLN : amide:sc=-0.00851 X(o=-0.0085,f=-0.018) USER MOD Single : A 133 ASN : amide:sc= -0.0427 K(o=-0.043,f=-2.1!) USER MOD Single : A 134 TYR OH : rot 180:sc=-0.00919 USER MOD Single : A 139 GLN : amide:sc= -0.0737 X(o=-0.074,f=-0.074) USER MOD Single : A 140 MET CE :methyl -150:sc= -0.531 (180deg=-1.89) USER MOD Single : A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 ARG N :NH3+ -162:sc= 0.853 (180deg=-0.313!) USER MOD Single : B 3 LYS NZ :NH3+ 137:sc= 3.1 (180deg=0.649) USER MOD Single : B 5 GLN : amide:sc= 0.487 K(o=0.49,f=-0.091) USER MOD Single : B 6 LYS NZ :NH3+ -138:sc= 0.742 (180deg=0.109) USER MOD Single : B 9 HIS : no HD1:sc= -1.25 K(o=-1.2,f=-0.28) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 2.219 0.062 19.015 1.00 0.00 N ATOM 30 CA GLU A 3 1.235 -0.760 18.382 1.00 0.00 C ATOM 31 C GLU A 3 1.482 -0.771 16.913 1.00 0.00 C ATOM 32 O GLU A 3 1.273 -1.758 16.210 1.00 0.00 O ATOM 33 CB GLU A 3 -0.127 -0.288 18.920 1.00 0.00 C ATOM 34 CG GLU A 3 -1.277 -1.289 18.791 1.00 0.00 C ATOM 35 CD GLU A 3 -2.591 -0.764 19.351 1.00 0.00 C ATOM 36 OE1 GLU A 3 -2.643 0.468 19.613 1.00 0.00 O ATOM 37 OE2 GLU A 3 -3.594 -1.496 19.567 1.00 0.00 O ATOM 0 HA GLU A 3 1.273 -1.824 18.618 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -0.011 -0.030 19.973 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.406 0.627 18.397 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -1.413 -1.544 17.740 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -1.010 -2.209 19.310 1.00 0.00 H new ATOM 44 N GLN A 4 1.854 0.431 16.439 1.00 0.00 N ATOM 45 CA GLN A 4 1.914 0.785 15.054 1.00 0.00 C ATOM 46 C GLN A 4 3.092 0.205 14.350 1.00 0.00 C ATOM 47 O GLN A 4 2.999 -0.410 13.289 1.00 0.00 O ATOM 48 CB GLN A 4 1.999 2.310 14.878 1.00 0.00 C ATOM 49 CG GLN A 4 0.667 3.041 15.060 1.00 0.00 C ATOM 50 CD GLN A 4 0.880 4.548 15.079 1.00 0.00 C ATOM 51 OE1 GLN A 4 1.911 5.055 15.517 1.00 0.00 O ATOM 52 NE2 GLN A 4 -0.111 5.339 14.586 1.00 0.00 N ATOM 0 H GLN A 4 2.128 1.197 17.055 1.00 0.00 H new ATOM 0 HA GLN A 4 0.999 0.381 14.621 1.00 0.00 H new ATOM 0 HB2 GLN A 4 2.718 2.707 15.594 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.386 2.528 13.883 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -0.013 2.775 14.251 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.196 2.723 15.990 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -0.966 4.918 14.223 1.00 0.00 H new ATOM 0 HE22 GLN A 4 0.001 6.353 14.580 1.00 0.00 H new ATOM 61 N ILE A 5 4.268 0.266 15.002 1.00 0.00 N ATOM 62 CA ILE A 5 5.537 -0.322 14.707 1.00 0.00 C ATOM 63 C ILE A 5 5.406 -1.806 14.752 1.00 0.00 C ATOM 64 O ILE A 5 5.804 -2.536 13.846 1.00 0.00 O ATOM 65 CB ILE A 5 6.668 0.030 15.627 1.00 0.00 C ATOM 66 CG1 ILE A 5 6.811 1.561 15.595 1.00 0.00 C ATOM 67 CG2 ILE A 5 7.936 -0.725 15.194 1.00 0.00 C ATOM 68 CD1 ILE A 5 7.279 2.346 14.370 1.00 0.00 C ATOM 0 H ILE A 5 4.329 0.810 15.862 1.00 0.00 H new ATOM 0 HA ILE A 5 5.792 0.081 13.727 1.00 0.00 H new ATOM 0 HB ILE A 5 6.484 -0.274 16.658 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.834 1.965 15.861 1.00 0.00 H new ATOM 0 HG13 ILE A 5 7.494 1.821 16.403 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.758 -0.469 15.863 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.753 -1.799 15.238 1.00 0.00 H new ATOM 0 HG23 ILE A 5 8.197 -0.443 14.174 1.00 0.00 H new ATOM 0 HD11 ILE A 5 7.295 3.410 14.604 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.281 2.021 14.091 1.00 0.00 H new ATOM 0 HD13 ILE A 5 6.595 2.167 13.540 1.00 0.00 H new ATOM 80 N ALA A 6 4.724 -2.315 15.794 1.00 0.00 N ATOM 81 CA ALA A 6 4.353 -3.692 15.892 1.00 0.00 C ATOM 82 C ALA A 6 3.508 -4.157 14.756 1.00 0.00 C ATOM 83 O ALA A 6 3.628 -5.293 14.301 1.00 0.00 O ATOM 84 CB ALA A 6 3.691 -3.907 17.264 1.00 0.00 C ATOM 0 H ALA A 6 4.423 -1.753 16.590 1.00 0.00 H new ATOM 0 HA ALA A 6 5.247 -4.312 15.818 1.00 0.00 H new ATOM 0 HB1 ALA A 6 3.397 -4.952 17.366 1.00 0.00 H new ATOM 0 HB2 ALA A 6 4.397 -3.650 18.053 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.809 -3.272 17.346 1.00 0.00 H new ATOM 90 N GLU A 7 2.622 -3.300 14.218 1.00 0.00 N ATOM 91 CA GLU A 7 1.714 -3.494 13.130 1.00 0.00 C ATOM 92 C GLU A 7 2.469 -3.564 11.848 1.00 0.00 C ATOM 93 O GLU A 7 2.310 -4.484 11.047 1.00 0.00 O ATOM 94 CB GLU A 7 0.579 -2.466 12.990 1.00 0.00 C ATOM 95 CG GLU A 7 -0.442 -2.766 11.890 1.00 0.00 C ATOM 96 CD GLU A 7 -1.732 -1.962 11.960 1.00 0.00 C ATOM 97 OE1 GLU A 7 -1.674 -0.705 12.037 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.799 -2.618 12.093 1.00 0.00 O ATOM 0 H GLU A 7 2.535 -2.356 14.595 1.00 0.00 H new ATOM 0 HA GLU A 7 1.214 -4.433 13.367 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.053 -2.398 13.942 1.00 0.00 H new ATOM 0 HB3 GLU A 7 1.019 -1.487 12.798 1.00 0.00 H new ATOM 0 HG2 GLU A 7 0.027 -2.585 10.923 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.692 -3.826 11.929 1.00 0.00 H new ATOM 105 N PHE A 8 3.372 -2.590 11.639 1.00 0.00 N ATOM 106 CA PHE A 8 4.324 -2.520 10.574 1.00 0.00 C ATOM 107 C PHE A 8 5.169 -3.746 10.511 1.00 0.00 C ATOM 108 O PHE A 8 5.255 -4.446 9.503 1.00 0.00 O ATOM 109 CB PHE A 8 5.247 -1.300 10.731 1.00 0.00 C ATOM 110 CG PHE A 8 4.540 -0.096 10.211 1.00 0.00 C ATOM 111 CD1 PHE A 8 4.000 -0.007 8.949 1.00 0.00 C ATOM 112 CD2 PHE A 8 4.546 0.995 11.047 1.00 0.00 C ATOM 113 CE1 PHE A 8 3.355 1.137 8.543 1.00 0.00 C ATOM 114 CE2 PHE A 8 3.912 2.142 10.632 1.00 0.00 C ATOM 115 CZ PHE A 8 3.388 2.239 9.365 1.00 0.00 C ATOM 0 H PHE A 8 3.441 -1.788 12.265 1.00 0.00 H new ATOM 0 HA PHE A 8 3.749 -2.430 9.652 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.512 -1.159 11.779 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.177 -1.457 10.185 1.00 0.00 H new ATOM 0 HD1 PHE A 8 4.084 -0.844 8.271 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.037 0.952 12.008 1.00 0.00 H new ATOM 0 HE1 PHE A 8 2.833 1.170 7.598 1.00 0.00 H new ATOM 0 HE2 PHE A 8 3.824 2.978 11.310 1.00 0.00 H new ATOM 0 HZ PHE A 8 3.001 3.184 9.014 1.00 0.00 H new ATOM 125 N LYS A 9 5.693 -4.198 11.664 1.00 0.00 N ATOM 126 CA LYS A 9 6.521 -5.355 11.809 1.00 0.00 C ATOM 127 C LYS A 9 5.922 -6.683 11.496 1.00 0.00 C ATOM 128 O LYS A 9 6.525 -7.680 11.102 1.00 0.00 O ATOM 129 CB LYS A 9 6.978 -5.324 13.277 1.00 0.00 C ATOM 130 CG LYS A 9 8.181 -6.210 13.603 1.00 0.00 C ATOM 131 CD LYS A 9 8.754 -5.780 14.955 1.00 0.00 C ATOM 132 CE LYS A 9 9.098 -6.924 15.910 1.00 0.00 C ATOM 133 NZ LYS A 9 10.225 -7.661 15.295 1.00 0.00 N ATOM 0 H LYS A 9 5.527 -3.724 12.552 1.00 0.00 H new ATOM 0 HA LYS A 9 7.313 -5.283 11.064 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.222 -4.296 13.543 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.142 -5.627 13.908 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.881 -7.257 13.635 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.939 -6.119 12.825 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.654 -5.191 14.779 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.035 -5.123 15.444 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.375 -6.540 16.892 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.239 -7.579 16.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 10.542 -8.412 15.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.914 -8.085 14.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 11.011 -7.005 15.114 1.00 0.00 H new ATOM 147 N GLU A 10 4.587 -6.783 11.619 1.00 0.00 N ATOM 148 CA GLU A 10 3.736 -7.914 11.416 1.00 0.00 C ATOM 149 C GLU A 10 3.312 -8.008 9.990 1.00 0.00 C ATOM 150 O GLU A 10 3.347 -9.082 9.390 1.00 0.00 O ATOM 151 CB GLU A 10 2.497 -7.745 12.312 1.00 0.00 C ATOM 152 CG GLU A 10 1.464 -8.873 12.337 1.00 0.00 C ATOM 153 CD GLU A 10 1.926 -10.018 13.228 1.00 0.00 C ATOM 154 OE1 GLU A 10 2.656 -10.945 12.784 1.00 0.00 O ATOM 155 OE2 GLU A 10 1.526 -9.993 14.422 1.00 0.00 O ATOM 0 H GLU A 10 4.040 -5.967 11.895 1.00 0.00 H new ATOM 0 HA GLU A 10 4.275 -8.827 11.669 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.844 -7.588 13.333 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.986 -6.832 12.005 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.510 -8.489 12.698 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.297 -9.240 11.324 1.00 0.00 H new ATOM 162 N ALA A 11 2.862 -6.900 9.377 1.00 0.00 N ATOM 163 CA ALA A 11 2.675 -6.745 7.967 1.00 0.00 C ATOM 164 C ALA A 11 3.873 -7.060 7.139 1.00 0.00 C ATOM 165 O ALA A 11 3.746 -7.550 6.019 1.00 0.00 O ATOM 166 CB ALA A 11 2.221 -5.313 7.638 1.00 0.00 C ATOM 0 H ALA A 11 2.613 -6.059 9.898 1.00 0.00 H new ATOM 0 HA ALA A 11 1.910 -7.477 7.709 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.084 -5.213 6.561 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.279 -5.105 8.145 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.978 -4.605 7.974 1.00 0.00 H new ATOM 172 N PHE A 12 5.077 -6.711 7.627 1.00 0.00 N ATOM 173 CA PHE A 12 6.314 -7.121 7.037 1.00 0.00 C ATOM 174 C PHE A 12 6.741 -8.544 7.144 1.00 0.00 C ATOM 175 O PHE A 12 7.076 -9.084 6.090 1.00 0.00 O ATOM 176 CB PHE A 12 7.308 -6.099 7.614 1.00 0.00 C ATOM 177 CG PHE A 12 8.729 -6.318 7.222 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.233 -5.841 6.034 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.550 -7.063 8.035 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.539 -6.083 5.679 1.00 0.00 C ATOM 181 CE2 PHE A 12 10.867 -7.285 7.710 1.00 0.00 C ATOM 182 CZ PHE A 12 11.379 -6.695 6.578 1.00 0.00 C ATOM 0 H PHE A 12 5.194 -6.127 8.455 1.00 0.00 H new ATOM 0 HA PHE A 12 6.228 -7.116 5.950 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.008 -5.101 7.295 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.239 -6.120 8.702 1.00 0.00 H new ATOM 0 HD1 PHE A 12 8.596 -5.271 5.374 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.152 -7.482 8.947 1.00 0.00 H new ATOM 0 HE1 PHE A 12 10.901 -5.795 4.703 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.489 -7.912 8.332 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.443 -6.713 6.395 1.00 0.00 H new ATOM 192 N SER A 13 6.715 -9.193 8.322 1.00 0.00 N ATOM 193 CA SER A 13 7.173 -10.546 8.401 1.00 0.00 C ATOM 194 C SER A 13 6.195 -11.500 7.807 1.00 0.00 C ATOM 195 O SER A 13 6.355 -12.720 7.809 1.00 0.00 O ATOM 196 CB SER A 13 7.433 -10.989 9.851 1.00 0.00 C ATOM 197 OG SER A 13 8.610 -10.391 10.375 1.00 0.00 O ATOM 0 H SER A 13 6.385 -8.793 9.201 1.00 0.00 H new ATOM 0 HA SER A 13 8.105 -10.566 7.837 1.00 0.00 H new ATOM 0 HB2 SER A 13 6.579 -10.720 10.473 1.00 0.00 H new ATOM 0 HB3 SER A 13 7.527 -12.074 9.890 1.00 0.00 H new ATOM 0 HG SER A 13 8.746 -10.691 11.298 1.00 0.00 H new ATOM 203 N LEU A 14 5.074 -11.001 7.257 1.00 0.00 N ATOM 204 CA LEU A 14 4.076 -11.727 6.534 1.00 0.00 C ATOM 205 C LEU A 14 4.748 -12.349 5.359 1.00 0.00 C ATOM 206 O LEU A 14 4.534 -13.531 5.095 1.00 0.00 O ATOM 207 CB LEU A 14 2.951 -10.835 5.981 1.00 0.00 C ATOM 208 CG LEU A 14 1.812 -11.510 5.199 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.964 -12.564 5.931 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.860 -10.467 4.588 1.00 0.00 C ATOM 0 H LEU A 14 4.848 -10.009 7.324 1.00 0.00 H new ATOM 0 HA LEU A 14 3.629 -12.444 7.222 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.508 -10.298 6.820 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.406 -10.089 5.330 1.00 0.00 H new ATOM 0 HG LEU A 14 2.365 -12.066 4.442 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.202 -12.951 5.255 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.605 -13.381 6.262 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.483 -12.107 6.796 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.066 -10.975 4.042 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.424 -9.862 5.383 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.415 -9.823 3.906 1.00 0.00 H new ATOM 222 N PHE A 15 5.615 -11.592 4.662 1.00 0.00 N ATOM 223 CA PHE A 15 6.390 -11.928 3.509 1.00 0.00 C ATOM 224 C PHE A 15 7.638 -12.711 3.732 1.00 0.00 C ATOM 225 O PHE A 15 8.003 -13.492 2.854 1.00 0.00 O ATOM 226 CB PHE A 15 6.794 -10.644 2.764 1.00 0.00 C ATOM 227 CG PHE A 15 5.646 -9.855 2.235 1.00 0.00 C ATOM 228 CD1 PHE A 15 4.803 -10.511 1.369 1.00 0.00 C ATOM 229 CD2 PHE A 15 5.290 -8.566 2.554 1.00 0.00 C ATOM 230 CE1 PHE A 15 3.700 -9.922 0.797 1.00 0.00 C ATOM 231 CE2 PHE A 15 4.112 -7.987 2.144 1.00 0.00 C ATOM 232 CZ PHE A 15 3.385 -8.638 1.175 1.00 0.00 C ATOM 0 H PHE A 15 5.790 -10.628 4.945 1.00 0.00 H new ATOM 0 HA PHE A 15 5.723 -12.579 2.944 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.373 -10.013 3.439 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.450 -10.910 1.935 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.018 -11.541 1.126 1.00 0.00 H new ATOM 0 HD2 PHE A 15 5.968 -7.980 3.156 1.00 0.00 H new ATOM 0 HE1 PHE A 15 3.099 -10.452 0.073 1.00 0.00 H new ATOM 0 HE2 PHE A 15 3.770 -7.054 2.568 1.00 0.00 H new ATOM 0 HZ PHE A 15 2.554 -8.133 0.704 1.00 0.00 H new ATOM 242 N ASP A 16 8.279 -12.563 4.905 1.00 0.00 N ATOM 243 CA ASP A 16 9.522 -13.162 5.282 1.00 0.00 C ATOM 244 C ASP A 16 9.421 -14.642 5.421 1.00 0.00 C ATOM 245 O ASP A 16 8.650 -15.055 6.286 1.00 0.00 O ATOM 246 CB ASP A 16 10.065 -12.543 6.581 1.00 0.00 C ATOM 247 CG ASP A 16 11.541 -12.913 6.621 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.059 -14.057 6.525 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.312 -11.919 6.552 1.00 0.00 O ATOM 0 H ASP A 16 7.897 -11.978 5.648 1.00 0.00 H new ATOM 0 HA ASP A 16 10.222 -12.956 4.473 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.931 -11.461 6.586 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.539 -12.934 7.452 1.00 0.00 H new ATOM 254 N LYS A 17 10.059 -15.462 4.567 1.00 0.00 N ATOM 255 CA LYS A 17 9.999 -16.890 4.586 1.00 0.00 C ATOM 256 C LYS A 17 10.932 -17.583 5.519 1.00 0.00 C ATOM 257 O LYS A 17 10.833 -18.791 5.728 1.00 0.00 O ATOM 258 CB LYS A 17 10.209 -17.460 3.173 1.00 0.00 C ATOM 259 CG LYS A 17 9.150 -17.139 2.116 1.00 0.00 C ATOM 260 CD LYS A 17 7.666 -17.445 2.333 1.00 0.00 C ATOM 261 CE LYS A 17 6.762 -16.707 1.344 1.00 0.00 C ATOM 262 NZ LYS A 17 5.391 -17.131 1.707 1.00 0.00 N ATOM 0 H LYS A 17 10.653 -15.105 3.818 1.00 0.00 H new ATOM 0 HA LYS A 17 8.998 -17.093 4.967 1.00 0.00 H new ATOM 0 HB2 LYS A 17 11.170 -17.101 2.805 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.284 -18.544 3.256 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.224 -16.071 1.912 1.00 0.00 H new ATOM 0 HG3 LYS A 17 9.448 -17.659 1.205 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.503 -18.518 2.238 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.387 -17.169 3.350 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.879 -15.627 1.429 1.00 0.00 H new ATOM 0 HE3 LYS A 17 7.000 -16.973 0.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.706 -16.669 1.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.310 -18.163 1.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.193 -16.859 2.691 1.00 0.00 H new ATOM 276 N ASP A 18 11.928 -16.860 6.062 1.00 0.00 N ATOM 277 CA ASP A 18 12.772 -17.355 7.106 1.00 0.00 C ATOM 278 C ASP A 18 12.271 -16.975 8.457 1.00 0.00 C ATOM 279 O ASP A 18 12.096 -17.769 9.379 1.00 0.00 O ATOM 280 CB ASP A 18 14.173 -16.733 6.981 1.00 0.00 C ATOM 281 CG ASP A 18 14.648 -16.715 5.535 1.00 0.00 C ATOM 282 OD1 ASP A 18 14.946 -17.769 4.911 1.00 0.00 O ATOM 283 OD2 ASP A 18 14.624 -15.560 5.033 1.00 0.00 O ATOM 0 H ASP A 18 12.152 -15.909 5.769 1.00 0.00 H new ATOM 0 HA ASP A 18 12.788 -18.440 7.003 1.00 0.00 H new ATOM 0 HB2 ASP A 18 14.157 -15.716 7.373 1.00 0.00 H new ATOM 0 HB3 ASP A 18 14.879 -17.298 7.590 1.00 0.00 H new ATOM 288 N GLY A 19 12.028 -15.661 8.610 1.00 0.00 N ATOM 289 CA GLY A 19 11.672 -15.012 9.834 1.00 0.00 C ATOM 290 C GLY A 19 12.749 -14.228 10.502 1.00 0.00 C ATOM 291 O GLY A 19 12.891 -14.140 11.721 1.00 0.00 O ATOM 0 H GLY A 19 12.084 -15.010 7.827 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.834 -14.343 9.636 1.00 0.00 H new ATOM 0 HA3 GLY A 19 11.317 -15.770 10.532 1.00 0.00 H new ATOM 295 N ASP A 20 13.691 -13.615 9.763 1.00 0.00 N ATOM 296 CA ASP A 20 14.835 -12.915 10.258 1.00 0.00 C ATOM 297 C ASP A 20 14.343 -11.509 10.205 1.00 0.00 C ATOM 298 O ASP A 20 14.283 -10.835 11.232 1.00 0.00 O ATOM 299 CB ASP A 20 16.075 -13.261 9.416 1.00 0.00 C ATOM 300 CG ASP A 20 15.984 -12.967 7.925 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.881 -13.208 7.365 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.953 -12.450 7.308 1.00 0.00 O ATOM 0 H ASP A 20 13.648 -13.609 8.744 1.00 0.00 H new ATOM 0 HA ASP A 20 15.185 -13.162 11.260 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.926 -12.714 9.821 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.289 -14.322 9.543 1.00 0.00 H new ATOM 307 N GLY A 21 13.881 -11.091 9.013 1.00 0.00 N ATOM 308 CA GLY A 21 13.215 -9.837 8.845 1.00 0.00 C ATOM 309 C GLY A 21 13.928 -9.029 7.816 1.00 0.00 C ATOM 310 O GLY A 21 14.316 -7.898 8.105 1.00 0.00 O ATOM 0 H GLY A 21 13.971 -11.632 8.153 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.181 -10.000 8.542 1.00 0.00 H new ATOM 0 HA3 GLY A 21 13.188 -9.298 9.792 1.00 0.00 H new ATOM 314 N THR A 22 13.979 -9.617 6.607 1.00 0.00 N ATOM 315 CA THR A 22 14.695 -9.061 5.501 1.00 0.00 C ATOM 316 C THR A 22 14.084 -9.839 4.386 1.00 0.00 C ATOM 317 O THR A 22 14.187 -11.062 4.304 1.00 0.00 O ATOM 318 CB THR A 22 16.170 -9.328 5.545 1.00 0.00 C ATOM 319 OG1 THR A 22 16.806 -8.582 6.573 1.00 0.00 O ATOM 320 CG2 THR A 22 16.860 -8.957 4.221 1.00 0.00 C ATOM 0 H THR A 22 13.512 -10.498 6.393 1.00 0.00 H new ATOM 0 HA THR A 22 14.622 -7.975 5.446 1.00 0.00 H new ATOM 0 HB THR A 22 16.269 -10.397 5.733 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.182 -7.759 6.196 1.00 0.00 H new ATOM 0 HG21 THR A 22 17.927 -9.166 4.296 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.431 -9.545 3.410 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.711 -7.896 4.018 1.00 0.00 H new ATOM 328 N ILE A 23 13.495 -9.095 3.433 1.00 0.00 N ATOM 329 CA ILE A 23 12.804 -9.705 2.340 1.00 0.00 C ATOM 330 C ILE A 23 13.714 -9.761 1.161 1.00 0.00 C ATOM 331 O ILE A 23 13.855 -8.819 0.384 1.00 0.00 O ATOM 332 CB ILE A 23 11.498 -9.093 1.929 1.00 0.00 C ATOM 333 CG1 ILE A 23 10.542 -8.832 3.105 1.00 0.00 C ATOM 334 CG2 ILE A 23 10.874 -9.992 0.849 1.00 0.00 C ATOM 335 CD1 ILE A 23 9.298 -7.970 2.896 1.00 0.00 C ATOM 0 H ILE A 23 13.497 -8.075 3.419 1.00 0.00 H new ATOM 0 HA ILE A 23 12.528 -10.692 2.712 1.00 0.00 H new ATOM 0 HB ILE A 23 11.687 -8.099 1.523 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.207 -9.802 3.473 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.126 -8.372 3.903 1.00 0.00 H new ATOM 0 HG21 ILE A 23 9.921 -9.570 0.531 1.00 0.00 H new ATOM 0 HG22 ILE A 23 11.547 -10.054 -0.006 1.00 0.00 H new ATOM 0 HG23 ILE A 23 10.711 -10.990 1.256 1.00 0.00 H new ATOM 0 HD11 ILE A 23 8.745 -7.896 3.832 1.00 0.00 H new ATOM 0 HD12 ILE A 23 9.596 -6.973 2.571 1.00 0.00 H new ATOM 0 HD13 ILE A 23 8.664 -8.425 2.135 1.00 0.00 H new ATOM 347 N THR A 24 14.275 -10.970 0.983 1.00 0.00 N ATOM 348 CA THR A 24 15.096 -11.270 -0.149 1.00 0.00 C ATOM 349 C THR A 24 14.340 -11.503 -1.412 1.00 0.00 C ATOM 350 O THR A 24 13.178 -11.903 -1.370 1.00 0.00 O ATOM 351 CB THR A 24 16.019 -12.440 0.025 1.00 0.00 C ATOM 352 OG1 THR A 24 15.327 -13.673 0.158 1.00 0.00 O ATOM 353 CG2 THR A 24 16.902 -12.348 1.281 1.00 0.00 C ATOM 0 H THR A 24 14.158 -11.749 1.632 1.00 0.00 H new ATOM 0 HA THR A 24 15.683 -10.355 -0.225 1.00 0.00 H new ATOM 0 HB THR A 24 16.622 -12.407 -0.882 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.967 -13.750 1.066 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.543 -13.228 1.341 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.520 -11.452 1.226 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.270 -12.299 2.167 1.00 0.00 H new ATOM 361 N THR A 25 15.023 -11.464 -2.570 1.00 0.00 N ATOM 362 CA THR A 25 14.376 -11.551 -3.842 1.00 0.00 C ATOM 363 C THR A 25 13.690 -12.850 -4.095 1.00 0.00 C ATOM 364 O THR A 25 12.757 -12.859 -4.896 1.00 0.00 O ATOM 365 CB THR A 25 15.344 -11.352 -4.970 1.00 0.00 C ATOM 366 OG1 THR A 25 16.496 -12.181 -4.920 1.00 0.00 O ATOM 367 CG2 THR A 25 15.784 -9.879 -4.984 1.00 0.00 C ATOM 0 H THR A 25 16.037 -11.371 -2.624 1.00 0.00 H new ATOM 0 HA THR A 25 13.630 -10.758 -3.804 1.00 0.00 H new ATOM 0 HB THR A 25 14.815 -11.635 -5.880 1.00 0.00 H new ATOM 0 HG1 THR A 25 16.585 -12.668 -5.765 1.00 0.00 H new ATOM 0 HG21 THR A 25 16.489 -9.718 -5.800 1.00 0.00 H new ATOM 0 HG22 THR A 25 14.912 -9.240 -5.126 1.00 0.00 H new ATOM 0 HG23 THR A 25 16.263 -9.633 -4.036 1.00 0.00 H new ATOM 375 N LYS A 26 14.123 -13.919 -3.404 1.00 0.00 N ATOM 376 CA LYS A 26 13.630 -15.257 -3.518 1.00 0.00 C ATOM 377 C LYS A 26 12.305 -15.272 -2.838 1.00 0.00 C ATOM 378 O LYS A 26 11.334 -15.844 -3.332 1.00 0.00 O ATOM 379 CB LYS A 26 14.591 -16.341 -3.002 1.00 0.00 C ATOM 380 CG LYS A 26 16.041 -16.199 -3.470 1.00 0.00 C ATOM 381 CD LYS A 26 16.272 -16.068 -4.977 1.00 0.00 C ATOM 382 CE LYS A 26 17.747 -16.346 -5.272 1.00 0.00 C ATOM 383 NZ LYS A 26 18.472 -15.063 -5.412 1.00 0.00 N ATOM 0 H LYS A 26 14.872 -13.842 -2.716 1.00 0.00 H new ATOM 0 HA LYS A 26 13.534 -15.523 -4.571 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.575 -16.330 -1.912 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.218 -17.315 -3.317 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.470 -15.323 -2.984 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.598 -17.066 -3.115 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.639 -16.771 -5.519 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.001 -15.068 -5.316 1.00 0.00 H new ATOM 0 HE2 LYS A 26 18.185 -16.938 -4.468 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.842 -16.932 -6.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 19.367 -15.223 -5.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.888 -14.391 -5.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.671 -14.672 -4.469 1.00 0.00 H new ATOM 397 N GLU A 27 12.200 -14.671 -1.640 1.00 0.00 N ATOM 398 CA GLU A 27 11.091 -14.599 -0.740 1.00 0.00 C ATOM 399 C GLU A 27 9.984 -13.783 -1.313 1.00 0.00 C ATOM 400 O GLU A 27 8.799 -14.101 -1.227 1.00 0.00 O ATOM 401 CB GLU A 27 11.549 -14.056 0.624 1.00 0.00 C ATOM 402 CG GLU A 27 12.550 -14.918 1.398 1.00 0.00 C ATOM 403 CD GLU A 27 13.005 -14.180 2.649 1.00 0.00 C ATOM 404 OE1 GLU A 27 12.231 -14.119 3.642 1.00 0.00 O ATOM 405 OE2 GLU A 27 14.155 -13.669 2.697 1.00 0.00 O ATOM 0 H GLU A 27 13.002 -14.171 -1.256 1.00 0.00 H new ATOM 0 HA GLU A 27 10.700 -15.605 -0.590 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.993 -13.073 0.469 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.667 -13.913 1.248 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.091 -15.868 1.672 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.409 -15.149 0.768 1.00 0.00 H new ATOM 412 N LEU A 28 10.404 -12.812 -2.142 1.00 0.00 N ATOM 413 CA LEU A 28 9.490 -11.993 -2.876 1.00 0.00 C ATOM 414 C LEU A 28 8.983 -12.591 -4.143 1.00 0.00 C ATOM 415 O LEU A 28 7.772 -12.659 -4.349 1.00 0.00 O ATOM 416 CB LEU A 28 10.013 -10.547 -2.924 1.00 0.00 C ATOM 417 CG LEU A 28 8.857 -9.577 -3.221 1.00 0.00 C ATOM 418 CD1 LEU A 28 8.020 -9.376 -1.946 1.00 0.00 C ATOM 419 CD2 LEU A 28 9.561 -8.321 -3.761 1.00 0.00 C ATOM 0 H LEU A 28 11.387 -12.592 -2.305 1.00 0.00 H new ATOM 0 HA LEU A 28 8.547 -11.943 -2.332 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.480 -10.289 -1.973 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.782 -10.455 -3.691 1.00 0.00 H new ATOM 0 HG LEU A 28 8.129 -9.923 -3.955 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.200 -8.689 -2.154 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.616 -10.335 -1.621 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.650 -8.962 -1.159 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.817 -7.563 -4.004 1.00 0.00 H new ATOM 0 HD22 LEU A 28 10.242 -7.931 -3.004 1.00 0.00 H new ATOM 0 HD23 LEU A 28 10.125 -8.577 -4.658 1.00 0.00 H new ATOM 431 N GLY A 29 9.831 -13.111 -5.048 1.00 0.00 N ATOM 432 CA GLY A 29 9.537 -13.742 -6.297 1.00 0.00 C ATOM 433 C GLY A 29 8.574 -14.877 -6.225 1.00 0.00 C ATOM 434 O GLY A 29 7.978 -15.097 -7.278 1.00 0.00 O ATOM 0 H GLY A 29 10.837 -13.084 -4.882 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.139 -12.992 -6.980 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.469 -14.105 -6.731 1.00 0.00 H new ATOM 438 N THR A 30 8.376 -15.557 -5.082 1.00 0.00 N ATOM 439 CA THR A 30 7.359 -16.519 -4.793 1.00 0.00 C ATOM 440 C THR A 30 6.026 -15.862 -4.680 1.00 0.00 C ATOM 441 O THR A 30 5.097 -16.270 -5.375 1.00 0.00 O ATOM 442 CB THR A 30 7.678 -17.456 -3.666 1.00 0.00 C ATOM 443 OG1 THR A 30 6.718 -18.451 -3.342 1.00 0.00 O ATOM 444 CG2 THR A 30 7.948 -16.608 -2.411 1.00 0.00 C ATOM 0 H THR A 30 8.992 -15.417 -4.281 1.00 0.00 H new ATOM 0 HA THR A 30 7.318 -17.190 -5.651 1.00 0.00 H new ATOM 0 HB THR A 30 8.536 -18.028 -4.018 1.00 0.00 H new ATOM 0 HG1 THR A 30 7.048 -18.993 -2.595 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.183 -17.264 -1.573 1.00 0.00 H new ATOM 0 HG22 THR A 30 8.789 -15.940 -2.597 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.063 -16.018 -2.173 1.00 0.00 H new ATOM 452 N VAL A 31 5.922 -14.788 -3.877 1.00 0.00 N ATOM 453 CA VAL A 31 4.697 -14.120 -3.566 1.00 0.00 C ATOM 454 C VAL A 31 4.173 -13.464 -4.797 1.00 0.00 C ATOM 455 O VAL A 31 2.995 -13.545 -5.141 1.00 0.00 O ATOM 456 CB VAL A 31 4.847 -13.081 -2.494 1.00 0.00 C ATOM 457 CG1 VAL A 31 3.427 -12.520 -2.306 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.362 -13.678 -1.174 1.00 0.00 C ATOM 0 H VAL A 31 6.732 -14.365 -3.423 1.00 0.00 H new ATOM 0 HA VAL A 31 4.008 -14.877 -3.191 1.00 0.00 H new ATOM 0 HB VAL A 31 5.576 -12.322 -2.776 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.440 -11.749 -1.536 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.079 -12.090 -3.245 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.755 -13.324 -2.004 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.454 -12.888 -0.429 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.661 -14.433 -0.818 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.337 -14.137 -1.338 1.00 0.00 H new ATOM 468 N MET A 32 5.045 -12.787 -5.564 1.00 0.00 N ATOM 469 CA MET A 32 4.823 -12.074 -6.784 1.00 0.00 C ATOM 470 C MET A 32 4.255 -12.981 -7.821 1.00 0.00 C ATOM 471 O MET A 32 3.212 -12.680 -8.398 1.00 0.00 O ATOM 472 CB MET A 32 6.111 -11.334 -7.183 1.00 0.00 C ATOM 473 CG MET A 32 6.398 -10.072 -6.366 1.00 0.00 C ATOM 474 SD MET A 32 5.111 -8.791 -6.281 1.00 0.00 S ATOM 475 CE MET A 32 6.054 -7.486 -5.440 1.00 0.00 C ATOM 0 H MET A 32 6.027 -12.735 -5.292 1.00 0.00 H new ATOM 0 HA MET A 32 4.067 -11.300 -6.657 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.954 -12.017 -7.080 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.047 -11.063 -8.237 1.00 0.00 H new ATOM 0 HG2 MET A 32 6.628 -10.381 -5.346 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.299 -9.612 -6.770 1.00 0.00 H new ATOM 0 HE1 MET A 32 5.493 -6.552 -5.473 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.223 -7.771 -4.402 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.013 -7.351 -5.940 1.00 0.00 H new ATOM 485 N ARG A 33 4.935 -14.111 -8.083 1.00 0.00 N ATOM 486 CA ARG A 33 4.539 -15.081 -9.056 1.00 0.00 C ATOM 487 C ARG A 33 3.221 -15.671 -8.688 1.00 0.00 C ATOM 488 O ARG A 33 2.383 -15.962 -9.539 1.00 0.00 O ATOM 489 CB ARG A 33 5.510 -16.272 -9.125 1.00 0.00 C ATOM 490 CG ARG A 33 5.388 -17.027 -10.449 1.00 0.00 C ATOM 491 CD ARG A 33 6.476 -18.092 -10.603 1.00 0.00 C ATOM 492 NE ARG A 33 6.315 -19.192 -9.612 1.00 0.00 N ATOM 493 CZ ARG A 33 5.267 -20.065 -9.549 1.00 0.00 C ATOM 494 NH1 ARG A 33 4.583 -20.390 -10.684 1.00 0.00 N ATOM 495 NH2 ARG A 33 4.946 -20.683 -8.375 1.00 0.00 N ATOM 0 H ARG A 33 5.797 -14.359 -7.597 1.00 0.00 H new ATOM 0 HA ARG A 33 4.513 -14.551 -10.008 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.533 -15.915 -9.003 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.309 -16.953 -8.298 1.00 0.00 H new ATOM 0 HG2 ARG A 33 4.407 -17.499 -10.508 1.00 0.00 H new ATOM 0 HG3 ARG A 33 5.452 -16.321 -11.277 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.442 -18.503 -11.612 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.456 -17.631 -10.479 1.00 0.00 H new ATOM 0 HE ARG A 33 7.054 -19.303 -8.918 1.00 0.00 H new ATOM 0 HH11 ARG A 33 4.855 -19.981 -11.578 1.00 0.00 H new ATOM 0 HH12 ARG A 33 3.800 -21.042 -10.638 1.00 0.00 H new ATOM 0 HH21 ARG A 33 5.491 -20.494 -7.534 1.00 0.00 H new ATOM 0 HH22 ARG A 33 4.161 -21.333 -8.339 1.00 0.00 H new ATOM 509 N SER A 34 3.027 -15.977 -7.393 1.00 0.00 N ATOM 510 CA SER A 34 1.779 -16.536 -6.975 1.00 0.00 C ATOM 511 C SER A 34 0.572 -15.697 -7.218 1.00 0.00 C ATOM 512 O SER A 34 -0.412 -16.276 -7.676 1.00 0.00 O ATOM 513 CB SER A 34 1.700 -16.910 -5.485 1.00 0.00 C ATOM 514 OG SER A 34 2.618 -17.977 -5.298 1.00 0.00 O ATOM 0 H SER A 34 3.715 -15.842 -6.652 1.00 0.00 H new ATOM 0 HA SER A 34 1.765 -17.420 -7.613 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.958 -16.059 -4.855 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.689 -17.213 -5.212 1.00 0.00 H new ATOM 0 HG SER A 34 3.532 -17.625 -5.293 1.00 0.00 H new ATOM 520 N LEU A 35 0.655 -14.373 -6.997 1.00 0.00 N ATOM 521 CA LEU A 35 -0.353 -13.391 -7.251 1.00 0.00 C ATOM 522 C LEU A 35 -0.569 -13.313 -8.723 1.00 0.00 C ATOM 523 O LEU A 35 -1.667 -13.445 -9.262 1.00 0.00 O ATOM 524 CB LEU A 35 0.041 -11.987 -6.761 1.00 0.00 C ATOM 525 CG LEU A 35 -0.027 -11.805 -5.236 1.00 0.00 C ATOM 526 CD1 LEU A 35 0.494 -10.404 -4.877 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.383 -12.128 -4.585 1.00 0.00 C ATOM 0 H LEU A 35 1.500 -13.956 -6.607 1.00 0.00 H new ATOM 0 HA LEU A 35 -1.249 -13.697 -6.711 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.055 -11.770 -7.096 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.614 -11.254 -7.232 1.00 0.00 H new ATOM 0 HG LEU A 35 0.622 -12.564 -4.799 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.450 -10.265 -3.797 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.526 -10.302 -5.214 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.123 -9.650 -5.365 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.318 -11.966 -3.509 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -2.152 -11.479 -5.004 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.641 -13.169 -4.780 1.00 0.00 H new ATOM 539 N GLY A 36 0.558 -13.065 -9.413 1.00 0.00 N ATOM 540 CA GLY A 36 0.674 -13.440 -10.788 1.00 0.00 C ATOM 541 C GLY A 36 1.623 -12.586 -11.556 1.00 0.00 C ATOM 542 O GLY A 36 1.300 -12.237 -12.690 1.00 0.00 O ATOM 0 H GLY A 36 1.383 -12.609 -9.023 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.001 -14.478 -10.847 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.309 -13.388 -11.255 1.00 0.00 H new ATOM 546 N GLN A 37 2.864 -12.248 -11.161 1.00 0.00 N ATOM 547 CA GLN A 37 3.738 -11.493 -12.004 1.00 0.00 C ATOM 548 C GLN A 37 5.117 -12.044 -12.135 1.00 0.00 C ATOM 549 O GLN A 37 5.559 -12.646 -11.158 1.00 0.00 O ATOM 550 CB GLN A 37 3.803 -10.012 -11.595 1.00 0.00 C ATOM 551 CG GLN A 37 4.322 -9.096 -12.705 1.00 0.00 C ATOM 552 CD GLN A 37 3.715 -7.729 -12.424 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.538 -7.510 -12.707 1.00 0.00 O ATOM 554 NE2 GLN A 37 4.394 -6.841 -11.649 1.00 0.00 N ATOM 0 H GLN A 37 3.262 -12.498 -10.256 1.00 0.00 H new ATOM 0 HA GLN A 37 3.281 -11.577 -12.990 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.808 -9.681 -11.297 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.447 -9.912 -10.721 1.00 0.00 H new ATOM 0 HG2 GLN A 37 5.411 -9.050 -12.698 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.024 -9.463 -13.687 1.00 0.00 H new ATOM 0 HE21 GLN A 37 5.370 -7.015 -11.410 1.00 0.00 H new ATOM 0 HE22 GLN A 37 3.927 -6.001 -11.307 1.00 0.00 H new ATOM 563 N ASN A 38 5.806 -11.795 -13.263 1.00 0.00 N ATOM 564 CA ASN A 38 7.116 -12.316 -13.502 1.00 0.00 C ATOM 565 C ASN A 38 8.156 -11.284 -13.768 1.00 0.00 C ATOM 566 O ASN A 38 8.289 -10.948 -14.945 1.00 0.00 O ATOM 567 CB ASN A 38 6.962 -13.235 -14.726 1.00 0.00 C ATOM 568 CG ASN A 38 6.172 -14.450 -14.263 1.00 0.00 C ATOM 569 OD1 ASN A 38 6.407 -15.024 -13.200 1.00 0.00 O ATOM 570 ND2 ASN A 38 5.154 -14.880 -15.055 1.00 0.00 N ATOM 0 H ASN A 38 5.446 -11.220 -14.025 1.00 0.00 H new ATOM 0 HA ASN A 38 7.469 -12.827 -12.606 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.442 -12.720 -15.534 1.00 0.00 H new ATOM 0 HB3 ASN A 38 7.937 -13.532 -15.113 1.00 0.00 H new ATOM 0 HD21 ASN A 38 4.586 -15.677 -14.768 1.00 0.00 H new ATOM 0 HD22 ASN A 38 4.958 -14.405 -15.936 1.00 0.00 H new ATOM 577 N PRO A 39 8.814 -10.724 -12.797 1.00 0.00 N ATOM 578 CA PRO A 39 9.906 -9.831 -13.054 1.00 0.00 C ATOM 579 C PRO A 39 11.060 -10.767 -13.155 1.00 0.00 C ATOM 580 O PRO A 39 10.991 -11.923 -12.739 1.00 0.00 O ATOM 581 CB PRO A 39 9.890 -8.821 -11.909 1.00 0.00 C ATOM 582 CG PRO A 39 9.423 -9.737 -10.767 1.00 0.00 C ATOM 583 CD PRO A 39 8.352 -10.625 -11.420 1.00 0.00 C ATOM 0 HA PRO A 39 9.903 -9.215 -13.953 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.871 -8.385 -11.721 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.203 -7.994 -12.090 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.246 -10.331 -10.369 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.013 -9.163 -9.936 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.291 -11.603 -10.942 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.361 -10.176 -11.357 1.00 0.00 H new ATOM 591 N THR A 40 12.252 -10.292 -13.557 1.00 0.00 N ATOM 592 CA THR A 40 13.495 -10.995 -13.487 1.00 0.00 C ATOM 593 C THR A 40 14.107 -10.542 -12.207 1.00 0.00 C ATOM 594 O THR A 40 13.617 -9.664 -11.498 1.00 0.00 O ATOM 595 CB THR A 40 14.496 -10.666 -14.555 1.00 0.00 C ATOM 596 OG1 THR A 40 14.624 -9.268 -14.773 1.00 0.00 O ATOM 597 CG2 THR A 40 13.915 -11.230 -15.863 1.00 0.00 C ATOM 0 H THR A 40 12.353 -9.359 -13.956 1.00 0.00 H new ATOM 0 HA THR A 40 13.276 -12.058 -13.590 1.00 0.00 H new ATOM 0 HB THR A 40 15.464 -11.070 -14.259 1.00 0.00 H new ATOM 0 HG1 THR A 40 13.808 -8.927 -15.195 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.600 -11.022 -16.685 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.780 -12.307 -15.766 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.952 -10.761 -16.066 1.00 0.00 H new ATOM 605 N GLU A 41 15.166 -11.231 -11.746 1.00 0.00 N ATOM 606 CA GLU A 41 15.787 -10.831 -10.521 1.00 0.00 C ATOM 607 C GLU A 41 16.587 -9.580 -10.640 1.00 0.00 C ATOM 608 O GLU A 41 16.520 -8.718 -9.765 1.00 0.00 O ATOM 609 CB GLU A 41 16.798 -11.910 -10.098 1.00 0.00 C ATOM 610 CG GLU A 41 17.428 -11.728 -8.716 1.00 0.00 C ATOM 611 CD GLU A 41 17.897 -13.046 -8.114 1.00 0.00 C ATOM 612 OE1 GLU A 41 18.937 -13.616 -8.537 1.00 0.00 O ATOM 613 OE2 GLU A 41 17.194 -13.542 -7.194 1.00 0.00 O ATOM 0 H GLU A 41 15.583 -12.041 -12.205 1.00 0.00 H new ATOM 0 HA GLU A 41 14.973 -10.679 -9.813 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.299 -12.879 -10.124 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.597 -11.943 -10.839 1.00 0.00 H new ATOM 0 HG2 GLU A 41 18.274 -11.045 -8.792 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.703 -11.264 -8.047 1.00 0.00 H new ATOM 620 N ALA A 42 17.335 -9.356 -11.735 1.00 0.00 N ATOM 621 CA ALA A 42 17.847 -8.073 -12.104 1.00 0.00 C ATOM 622 C ALA A 42 16.880 -6.942 -12.037 1.00 0.00 C ATOM 623 O ALA A 42 17.158 -5.834 -11.582 1.00 0.00 O ATOM 624 CB ALA A 42 18.640 -8.154 -13.420 1.00 0.00 C ATOM 0 H ALA A 42 17.593 -10.096 -12.388 1.00 0.00 H new ATOM 0 HA ALA A 42 18.549 -7.801 -11.316 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.018 -7.165 -13.678 1.00 0.00 H new ATOM 0 HB2 ALA A 42 19.476 -8.842 -13.299 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.988 -8.512 -14.216 1.00 0.00 H new ATOM 630 N GLU A 43 15.683 -7.198 -12.594 1.00 0.00 N ATOM 631 CA GLU A 43 14.634 -6.226 -12.569 1.00 0.00 C ATOM 632 C GLU A 43 14.059 -5.936 -11.226 1.00 0.00 C ATOM 633 O GLU A 43 13.817 -4.790 -10.852 1.00 0.00 O ATOM 634 CB GLU A 43 13.381 -6.625 -13.367 1.00 0.00 C ATOM 635 CG GLU A 43 13.464 -6.258 -14.849 1.00 0.00 C ATOM 636 CD GLU A 43 12.318 -6.930 -15.591 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.216 -8.183 -15.675 1.00 0.00 O ATOM 638 OE2 GLU A 43 11.434 -6.120 -15.980 1.00 0.00 O ATOM 0 H GLU A 43 15.442 -8.073 -13.059 1.00 0.00 H new ATOM 0 HA GLU A 43 15.169 -5.374 -12.988 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.227 -7.700 -13.274 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.510 -6.139 -12.928 1.00 0.00 H new ATOM 0 HG2 GLU A 43 13.410 -5.176 -14.973 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.420 -6.578 -15.263 1.00 0.00 H new ATOM 645 N LEU A 44 13.745 -6.961 -10.413 1.00 0.00 N ATOM 646 CA LEU A 44 13.166 -6.893 -9.107 1.00 0.00 C ATOM 647 C LEU A 44 14.068 -6.244 -8.114 1.00 0.00 C ATOM 648 O LEU A 44 13.640 -5.377 -7.353 1.00 0.00 O ATOM 649 CB LEU A 44 12.800 -8.307 -8.627 1.00 0.00 C ATOM 650 CG LEU A 44 12.013 -8.560 -7.330 1.00 0.00 C ATOM 651 CD1 LEU A 44 10.898 -7.512 -7.180 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.495 -9.993 -7.117 1.00 0.00 C ATOM 0 H LEU A 44 13.913 -7.926 -10.699 1.00 0.00 H new ATOM 0 HA LEU A 44 12.270 -6.276 -9.183 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.232 -8.773 -9.432 1.00 0.00 H new ATOM 0 HB3 LEU A 44 13.736 -8.858 -8.537 1.00 0.00 H new ATOM 0 HG LEU A 44 12.741 -8.447 -6.527 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.345 -7.698 -6.259 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.338 -6.515 -7.144 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.219 -7.579 -8.030 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.957 -10.048 -6.171 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.824 -10.262 -7.932 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.337 -10.685 -7.097 1.00 0.00 H new ATOM 664 N GLN A 45 15.370 -6.574 -8.169 1.00 0.00 N ATOM 665 CA GLN A 45 16.341 -5.912 -7.354 1.00 0.00 C ATOM 666 C GLN A 45 16.504 -4.485 -7.751 1.00 0.00 C ATOM 667 O GLN A 45 16.758 -3.692 -6.846 1.00 0.00 O ATOM 668 CB GLN A 45 17.616 -6.759 -7.507 1.00 0.00 C ATOM 669 CG GLN A 45 18.735 -6.379 -6.536 1.00 0.00 C ATOM 670 CD GLN A 45 19.784 -7.472 -6.685 1.00 0.00 C ATOM 671 OE1 GLN A 45 19.674 -8.598 -6.203 1.00 0.00 O ATOM 672 NE2 GLN A 45 20.975 -7.104 -7.229 1.00 0.00 N ATOM 0 H GLN A 45 15.751 -7.299 -8.777 1.00 0.00 H new ATOM 0 HA GLN A 45 16.050 -5.849 -6.305 1.00 0.00 H new ATOM 0 HB2 GLN A 45 17.362 -7.809 -7.360 1.00 0.00 H new ATOM 0 HB3 GLN A 45 17.985 -6.660 -8.528 1.00 0.00 H new ATOM 0 HG2 GLN A 45 19.150 -5.400 -6.777 1.00 0.00 H new ATOM 0 HG3 GLN A 45 18.366 -6.325 -5.512 1.00 0.00 H new ATOM 0 HE21 GLN A 45 21.085 -6.174 -7.634 1.00 0.00 H new ATOM 0 HE22 GLN A 45 21.758 -7.758 -7.232 1.00 0.00 H new ATOM 681 N ASP A 46 16.400 -4.067 -9.025 1.00 0.00 N ATOM 682 CA ASP A 46 16.461 -2.680 -9.368 1.00 0.00 C ATOM 683 C ASP A 46 15.421 -1.877 -8.665 1.00 0.00 C ATOM 684 O ASP A 46 15.768 -0.778 -8.233 1.00 0.00 O ATOM 685 CB ASP A 46 16.382 -2.604 -10.902 1.00 0.00 C ATOM 686 CG ASP A 46 16.721 -1.280 -11.573 1.00 0.00 C ATOM 687 OD1 ASP A 46 17.892 -0.883 -11.814 1.00 0.00 O ATOM 688 OD2 ASP A 46 15.746 -0.640 -12.051 1.00 0.00 O ATOM 0 H ASP A 46 16.273 -4.692 -9.821 1.00 0.00 H new ATOM 0 HA ASP A 46 17.395 -2.230 -9.031 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.049 -3.364 -11.308 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.369 -2.878 -11.198 1.00 0.00 H new ATOM 693 N MET A 47 14.273 -2.534 -8.424 1.00 0.00 N ATOM 694 CA MET A 47 13.125 -1.931 -7.821 1.00 0.00 C ATOM 695 C MET A 47 13.222 -1.957 -6.334 1.00 0.00 C ATOM 696 O MET A 47 12.560 -1.141 -5.695 1.00 0.00 O ATOM 697 CB MET A 47 11.731 -2.533 -8.065 1.00 0.00 C ATOM 698 CG MET A 47 11.441 -2.478 -9.567 1.00 0.00 C ATOM 699 SD MET A 47 9.759 -3.107 -9.847 1.00 0.00 S ATOM 700 CE MET A 47 9.904 -4.856 -9.383 1.00 0.00 C ATOM 0 H MET A 47 14.139 -3.518 -8.657 1.00 0.00 H new ATOM 0 HA MET A 47 13.170 -0.958 -8.310 1.00 0.00 H new ATOM 0 HB2 MET A 47 11.694 -3.562 -7.708 1.00 0.00 H new ATOM 0 HB3 MET A 47 10.975 -1.977 -7.511 1.00 0.00 H new ATOM 0 HG2 MET A 47 11.530 -1.455 -9.934 1.00 0.00 H new ATOM 0 HG3 MET A 47 12.167 -3.078 -10.116 1.00 0.00 H new ATOM 0 HE1 MET A 47 8.928 -5.335 -9.461 1.00 0.00 H new ATOM 0 HE2 MET A 47 10.606 -5.353 -10.052 1.00 0.00 H new ATOM 0 HE3 MET A 47 10.265 -4.932 -8.357 1.00 0.00 H new ATOM 710 N ILE A 48 13.991 -2.878 -5.727 1.00 0.00 N ATOM 711 CA ILE A 48 14.355 -2.945 -4.346 1.00 0.00 C ATOM 712 C ILE A 48 15.416 -1.951 -4.021 1.00 0.00 C ATOM 713 O ILE A 48 15.354 -1.360 -2.944 1.00 0.00 O ATOM 714 CB ILE A 48 14.649 -4.317 -3.814 1.00 0.00 C ATOM 715 CG1 ILE A 48 13.434 -5.246 -3.977 1.00 0.00 C ATOM 716 CG2 ILE A 48 15.150 -4.299 -2.360 1.00 0.00 C ATOM 717 CD1 ILE A 48 13.594 -6.730 -3.653 1.00 0.00 C ATOM 0 H ILE A 48 14.396 -3.650 -6.257 1.00 0.00 H new ATOM 0 HA ILE A 48 13.452 -2.668 -3.802 1.00 0.00 H new ATOM 0 HB ILE A 48 15.467 -4.716 -4.415 1.00 0.00 H new ATOM 0 HG12 ILE A 48 12.633 -4.855 -3.349 1.00 0.00 H new ATOM 0 HG13 ILE A 48 13.095 -5.168 -5.010 1.00 0.00 H new ATOM 0 HG21 ILE A 48 15.346 -5.319 -2.030 1.00 0.00 H new ATOM 0 HG22 ILE A 48 16.068 -3.715 -2.299 1.00 0.00 H new ATOM 0 HG23 ILE A 48 14.391 -3.850 -1.719 1.00 0.00 H new ATOM 0 HD11 ILE A 48 12.647 -7.243 -3.820 1.00 0.00 H new ATOM 0 HD12 ILE A 48 14.359 -7.163 -4.297 1.00 0.00 H new ATOM 0 HD13 ILE A 48 13.890 -6.845 -2.610 1.00 0.00 H new ATOM 729 N ASN A 49 16.435 -1.734 -4.872 1.00 0.00 N ATOM 730 CA ASN A 49 17.473 -0.762 -4.729 1.00 0.00 C ATOM 731 C ASN A 49 17.176 0.664 -4.418 1.00 0.00 C ATOM 732 O ASN A 49 18.006 1.345 -3.817 1.00 0.00 O ATOM 733 CB ASN A 49 18.338 -0.768 -6.001 1.00 0.00 C ATOM 734 CG ASN A 49 19.087 -2.090 -6.081 1.00 0.00 C ATOM 735 OD1 ASN A 49 19.306 -2.857 -5.145 1.00 0.00 O ATOM 736 ND2 ASN A 49 19.624 -2.390 -7.294 1.00 0.00 N ATOM 0 H ASN A 49 16.539 -2.282 -5.726 1.00 0.00 H new ATOM 0 HA ASN A 49 17.939 -1.113 -3.808 1.00 0.00 H new ATOM 0 HB2 ASN A 49 17.712 -0.635 -6.883 1.00 0.00 H new ATOM 0 HB3 ASN A 49 19.042 0.064 -5.982 1.00 0.00 H new ATOM 0 HD21 ASN A 49 20.190 -3.231 -7.407 1.00 0.00 H new ATOM 0 HD22 ASN A 49 19.461 -1.774 -8.090 1.00 0.00 H new ATOM 743 N GLU A 50 15.977 1.165 -4.765 1.00 0.00 N ATOM 744 CA GLU A 50 15.626 2.499 -4.390 1.00 0.00 C ATOM 745 C GLU A 50 15.299 2.624 -2.941 1.00 0.00 C ATOM 746 O GLU A 50 15.514 3.702 -2.388 1.00 0.00 O ATOM 747 CB GLU A 50 14.398 3.000 -5.169 1.00 0.00 C ATOM 748 CG GLU A 50 14.576 2.969 -6.688 1.00 0.00 C ATOM 749 CD GLU A 50 15.661 3.983 -7.021 1.00 0.00 C ATOM 750 OE1 GLU A 50 15.775 5.017 -6.310 1.00 0.00 O ATOM 751 OE2 GLU A 50 16.487 3.633 -7.907 1.00 0.00 O ATOM 0 H GLU A 50 15.265 0.660 -5.293 1.00 0.00 H new ATOM 0 HA GLU A 50 16.507 3.097 -4.622 1.00 0.00 H new ATOM 0 HB2 GLU A 50 13.536 2.390 -4.901 1.00 0.00 H new ATOM 0 HB3 GLU A 50 14.175 4.021 -4.859 1.00 0.00 H new ATOM 0 HG2 GLU A 50 14.861 1.972 -7.024 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.643 3.221 -7.192 1.00 0.00 H new ATOM 758 N VAL A 51 14.917 1.486 -2.335 1.00 0.00 N ATOM 759 CA VAL A 51 14.553 1.421 -0.954 1.00 0.00 C ATOM 760 C VAL A 51 15.688 0.913 -0.133 1.00 0.00 C ATOM 761 O VAL A 51 15.890 1.474 0.943 1.00 0.00 O ATOM 762 CB VAL A 51 13.293 0.611 -0.870 1.00 0.00 C ATOM 763 CG1 VAL A 51 12.851 0.535 0.601 1.00 0.00 C ATOM 764 CG2 VAL A 51 12.170 1.244 -1.709 1.00 0.00 C ATOM 0 H VAL A 51 14.860 0.589 -2.817 1.00 0.00 H new ATOM 0 HA VAL A 51 14.345 2.404 -0.532 1.00 0.00 H new ATOM 0 HB VAL A 51 13.490 -0.387 -1.263 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.935 -0.052 0.676 1.00 0.00 H new ATOM 0 HG12 VAL A 51 13.635 0.062 1.192 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.669 1.541 0.979 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.269 0.636 -1.629 1.00 0.00 H new ATOM 0 HG22 VAL A 51 11.963 2.249 -1.341 1.00 0.00 H new ATOM 0 HG23 VAL A 51 12.481 1.297 -2.752 1.00 0.00 H new ATOM 774 N ASP A 52 16.383 -0.151 -0.573 1.00 0.00 N ATOM 775 CA ASP A 52 17.669 -0.503 -0.056 1.00 0.00 C ATOM 776 C ASP A 52 18.745 0.527 -0.072 1.00 0.00 C ATOM 777 O ASP A 52 19.055 1.114 -1.108 1.00 0.00 O ATOM 778 CB ASP A 52 18.065 -1.832 -0.721 1.00 0.00 C ATOM 779 CG ASP A 52 19.475 -2.350 -0.481 1.00 0.00 C ATOM 780 OD1 ASP A 52 19.728 -2.740 0.690 1.00 0.00 O ATOM 781 OD2 ASP A 52 20.282 -2.363 -1.449 1.00 0.00 O ATOM 0 H ASP A 52 16.045 -0.779 -1.302 1.00 0.00 H new ATOM 0 HA ASP A 52 17.561 -0.602 1.024 1.00 0.00 H new ATOM 0 HB2 ASP A 52 17.365 -2.597 -0.385 1.00 0.00 H new ATOM 0 HB3 ASP A 52 17.926 -1.723 -1.797 1.00 0.00 H new ATOM 786 N ALA A 53 19.266 0.824 1.132 1.00 0.00 N ATOM 787 CA ALA A 53 20.185 1.904 1.320 1.00 0.00 C ATOM 788 C ALA A 53 21.578 1.375 1.305 1.00 0.00 C ATOM 789 O ALA A 53 22.538 2.001 0.860 1.00 0.00 O ATOM 790 CB ALA A 53 19.813 2.678 2.595 1.00 0.00 C ATOM 0 H ALA A 53 19.047 0.309 1.985 1.00 0.00 H new ATOM 0 HA ALA A 53 20.125 2.624 0.504 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.513 3.501 2.738 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.802 3.074 2.498 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.859 2.008 3.454 1.00 0.00 H new ATOM 796 N ASP A 54 21.666 0.086 1.678 1.00 0.00 N ATOM 797 CA ASP A 54 22.868 -0.689 1.709 1.00 0.00 C ATOM 798 C ASP A 54 23.655 -0.809 0.450 1.00 0.00 C ATOM 799 O ASP A 54 24.871 -0.671 0.575 1.00 0.00 O ATOM 800 CB ASP A 54 22.671 -2.079 2.337 1.00 0.00 C ATOM 801 CG ASP A 54 22.026 -2.108 3.716 1.00 0.00 C ATOM 802 OD1 ASP A 54 20.768 -2.185 3.743 1.00 0.00 O ATOM 803 OD2 ASP A 54 22.777 -2.138 4.727 1.00 0.00 O ATOM 0 H ASP A 54 20.849 -0.447 1.976 1.00 0.00 H new ATOM 0 HA ASP A 54 23.487 -0.066 2.354 1.00 0.00 H new ATOM 0 HB2 ASP A 54 22.061 -2.677 1.661 1.00 0.00 H new ATOM 0 HB3 ASP A 54 23.644 -2.566 2.403 1.00 0.00 H new ATOM 808 N GLY A 55 23.039 -1.013 -0.728 1.00 0.00 N ATOM 809 CA GLY A 55 23.715 -1.409 -1.924 1.00 0.00 C ATOM 810 C GLY A 55 23.979 -2.875 -1.886 1.00 0.00 C ATOM 811 O GLY A 55 25.116 -3.330 -2.004 1.00 0.00 O ATOM 0 H GLY A 55 22.033 -0.898 -0.852 1.00 0.00 H new ATOM 0 HA2 GLY A 55 23.109 -1.161 -2.796 1.00 0.00 H new ATOM 0 HA3 GLY A 55 24.653 -0.863 -2.022 1.00 0.00 H new ATOM 815 N ASN A 56 22.919 -3.673 -1.669 1.00 0.00 N ATOM 816 CA ASN A 56 22.867 -5.084 -1.440 1.00 0.00 C ATOM 817 C ASN A 56 21.720 -5.631 -2.218 1.00 0.00 C ATOM 818 O ASN A 56 21.800 -6.728 -2.767 1.00 0.00 O ATOM 819 CB ASN A 56 22.723 -5.331 0.071 1.00 0.00 C ATOM 820 CG ASN A 56 22.876 -6.758 0.580 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.870 -7.409 0.858 1.00 0.00 O ATOM 822 ND2 ASN A 56 24.080 -7.390 0.601 1.00 0.00 N ATOM 0 H ASN A 56 21.981 -3.274 -1.653 1.00 0.00 H new ATOM 0 HA ASN A 56 23.776 -5.588 -1.770 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.461 -4.713 0.582 1.00 0.00 H new ATOM 0 HB3 ASN A 56 21.740 -4.971 0.376 1.00 0.00 H new ATOM 0 HD21 ASN A 56 24.132 -8.379 0.843 1.00 0.00 H new ATOM 0 HD22 ASN A 56 24.931 -6.875 0.375 1.00 0.00 H new ATOM 829 N GLY A 57 20.567 -4.938 -2.243 1.00 0.00 N ATOM 830 CA GLY A 57 19.431 -5.397 -2.981 1.00 0.00 C ATOM 831 C GLY A 57 18.309 -6.069 -2.268 1.00 0.00 C ATOM 832 O GLY A 57 17.397 -6.642 -2.862 1.00 0.00 O ATOM 0 H GLY A 57 20.421 -4.057 -1.750 1.00 0.00 H new ATOM 0 HA2 GLY A 57 19.015 -4.537 -3.506 1.00 0.00 H new ATOM 0 HA3 GLY A 57 19.794 -6.089 -3.741 1.00 0.00 H new ATOM 836 N THR A 58 18.302 -6.043 -0.923 1.00 0.00 N ATOM 837 CA THR A 58 17.267 -6.524 -0.062 1.00 0.00 C ATOM 838 C THR A 58 16.768 -5.510 0.909 1.00 0.00 C ATOM 839 O THR A 58 17.528 -4.697 1.433 1.00 0.00 O ATOM 840 CB THR A 58 17.678 -7.757 0.687 1.00 0.00 C ATOM 841 OG1 THR A 58 18.791 -7.445 1.512 1.00 0.00 O ATOM 842 CG2 THR A 58 18.197 -8.890 -0.214 1.00 0.00 C ATOM 0 H THR A 58 19.084 -5.654 -0.397 1.00 0.00 H new ATOM 0 HA THR A 58 16.448 -6.765 -0.740 1.00 0.00 H new ATOM 0 HB THR A 58 16.783 -8.079 1.220 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.615 -7.502 0.985 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.474 -9.746 0.401 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.416 -9.184 -0.915 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.070 -8.544 -0.768 1.00 0.00 H new ATOM 850 N ILE A 59 15.432 -5.429 1.040 1.00 0.00 N ATOM 851 CA ILE A 59 14.734 -4.566 1.941 1.00 0.00 C ATOM 852 C ILE A 59 14.711 -5.163 3.306 1.00 0.00 C ATOM 853 O ILE A 59 14.072 -6.155 3.655 1.00 0.00 O ATOM 854 CB ILE A 59 13.335 -4.157 1.586 1.00 0.00 C ATOM 855 CG1 ILE A 59 12.670 -3.275 2.656 1.00 0.00 C ATOM 856 CG2 ILE A 59 12.347 -5.202 1.040 1.00 0.00 C ATOM 857 CD1 ILE A 59 11.597 -2.446 1.953 1.00 0.00 C ATOM 0 H ILE A 59 14.800 -6.003 0.481 1.00 0.00 H new ATOM 0 HA ILE A 59 15.313 -3.645 1.879 1.00 0.00 H new ATOM 0 HB ILE A 59 13.555 -3.572 0.693 1.00 0.00 H new ATOM 0 HG12 ILE A 59 12.229 -3.889 3.441 1.00 0.00 H new ATOM 0 HG13 ILE A 59 13.406 -2.627 3.133 1.00 0.00 H new ATOM 0 HG21 ILE A 59 11.387 -4.726 0.840 1.00 0.00 H new ATOM 0 HG22 ILE A 59 12.741 -5.627 0.117 1.00 0.00 H new ATOM 0 HG23 ILE A 59 12.212 -5.995 1.776 1.00 0.00 H new ATOM 0 HD11 ILE A 59 11.099 -1.804 2.680 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.060 -1.830 1.182 1.00 0.00 H new ATOM 0 HD13 ILE A 59 10.865 -3.111 1.495 1.00 0.00 H new ATOM 869 N ASP A 60 15.359 -4.470 4.260 1.00 0.00 N ATOM 870 CA ASP A 60 15.373 -4.780 5.655 1.00 0.00 C ATOM 871 C ASP A 60 14.227 -4.097 6.320 1.00 0.00 C ATOM 872 O ASP A 60 13.562 -3.276 5.692 1.00 0.00 O ATOM 873 CB ASP A 60 16.720 -4.502 6.343 1.00 0.00 C ATOM 874 CG ASP A 60 17.853 -5.115 5.532 1.00 0.00 C ATOM 875 OD1 ASP A 60 17.914 -6.373 5.561 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.567 -4.380 4.798 1.00 0.00 O ATOM 0 H ASP A 60 15.909 -3.639 4.041 1.00 0.00 H new ATOM 0 HA ASP A 60 15.250 -5.858 5.759 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.872 -3.427 6.442 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.716 -4.918 7.351 1.00 0.00 H new ATOM 881 N PHE A 61 13.961 -4.306 7.622 1.00 0.00 N ATOM 882 CA PHE A 61 13.004 -3.688 8.486 1.00 0.00 C ATOM 883 C PHE A 61 13.177 -2.222 8.689 1.00 0.00 C ATOM 884 O PHE A 61 12.187 -1.550 8.405 1.00 0.00 O ATOM 885 CB PHE A 61 12.787 -4.488 9.782 1.00 0.00 C ATOM 886 CG PHE A 61 11.618 -4.057 10.598 1.00 0.00 C ATOM 887 CD1 PHE A 61 10.359 -3.849 10.085 1.00 0.00 C ATOM 888 CD2 PHE A 61 11.776 -3.806 11.941 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.356 -3.249 10.809 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.741 -3.320 12.705 1.00 0.00 C ATOM 891 CZ PHE A 61 9.548 -2.943 12.136 1.00 0.00 C ATOM 0 H PHE A 61 14.495 -5.008 8.135 1.00 0.00 H new ATOM 0 HA PHE A 61 12.062 -3.734 7.939 1.00 0.00 H new ATOM 0 HB2 PHE A 61 12.664 -5.540 9.526 1.00 0.00 H new ATOM 0 HB3 PHE A 61 13.686 -4.412 10.393 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.150 -4.169 9.075 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.733 -3.994 12.405 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.414 -3.017 10.334 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.868 -3.233 13.774 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.791 -2.427 12.708 1.00 0.00 H new ATOM 901 N PRO A 62 14.328 -1.677 8.951 1.00 0.00 N ATOM 902 CA PRO A 62 14.503 -0.256 9.038 1.00 0.00 C ATOM 903 C PRO A 62 14.210 0.425 7.746 1.00 0.00 C ATOM 904 O PRO A 62 14.093 1.650 7.766 1.00 0.00 O ATOM 905 CB PRO A 62 15.973 0.047 9.320 1.00 0.00 C ATOM 906 CG PRO A 62 16.262 -1.193 10.180 1.00 0.00 C ATOM 907 CD PRO A 62 15.500 -2.341 9.499 1.00 0.00 C ATOM 0 HA PRO A 62 13.827 0.096 9.818 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.582 0.094 8.417 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.123 0.985 9.855 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.331 -1.401 10.224 1.00 0.00 H new ATOM 0 HG3 PRO A 62 15.923 -1.049 11.206 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.097 -2.815 8.719 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.226 -3.121 10.209 1.00 0.00 H new ATOM 915 N GLU A 63 14.300 -0.215 6.566 1.00 0.00 N ATOM 916 CA GLU A 63 14.137 0.381 5.277 1.00 0.00 C ATOM 917 C GLU A 63 12.698 0.385 4.888 1.00 0.00 C ATOM 918 O GLU A 63 12.134 1.408 4.505 1.00 0.00 O ATOM 919 CB GLU A 63 14.967 -0.312 4.183 1.00 0.00 C ATOM 920 CG GLU A 63 16.477 -0.218 4.413 1.00 0.00 C ATOM 921 CD GLU A 63 17.252 -1.205 3.553 1.00 0.00 C ATOM 922 OE1 GLU A 63 16.815 -2.360 3.302 1.00 0.00 O ATOM 923 OE2 GLU A 63 18.422 -0.897 3.200 1.00 0.00 O ATOM 0 H GLU A 63 14.500 -1.214 6.510 1.00 0.00 H new ATOM 0 HA GLU A 63 14.506 1.403 5.360 1.00 0.00 H new ATOM 0 HB2 GLU A 63 14.680 -1.362 4.130 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.726 0.133 3.218 1.00 0.00 H new ATOM 0 HG2 GLU A 63 16.814 0.795 4.193 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.695 -0.406 5.464 1.00 0.00 H new ATOM 930 N PHE A 64 11.983 -0.718 5.175 1.00 0.00 N ATOM 931 CA PHE A 64 10.560 -0.851 5.162 1.00 0.00 C ATOM 932 C PHE A 64 9.884 0.222 5.944 1.00 0.00 C ATOM 933 O PHE A 64 9.068 0.893 5.315 1.00 0.00 O ATOM 934 CB PHE A 64 10.149 -2.249 5.656 1.00 0.00 C ATOM 935 CG PHE A 64 8.690 -2.466 5.450 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.239 -2.828 4.202 1.00 0.00 C ATOM 937 CD2 PHE A 64 7.814 -2.298 6.496 1.00 0.00 C ATOM 938 CE1 PHE A 64 6.916 -3.188 4.101 1.00 0.00 C ATOM 939 CE2 PHE A 64 6.481 -2.617 6.392 1.00 0.00 C ATOM 940 CZ PHE A 64 6.062 -3.104 5.176 1.00 0.00 C ATOM 0 H PHE A 64 12.442 -1.590 5.438 1.00 0.00 H new ATOM 0 HA PHE A 64 10.228 -0.736 4.130 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.715 -3.011 5.121 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.393 -2.354 6.713 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.893 -2.829 3.342 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.185 -1.902 7.430 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.538 -3.545 3.155 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.800 -2.492 7.220 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.038 -3.428 5.062 1.00 0.00 H new ATOM 950 N LEU A 65 10.244 0.540 7.200 1.00 0.00 N ATOM 951 CA LEU A 65 9.807 1.665 7.968 1.00 0.00 C ATOM 952 C LEU A 65 9.878 2.936 7.194 1.00 0.00 C ATOM 953 O LEU A 65 8.914 3.696 7.110 1.00 0.00 O ATOM 954 CB LEU A 65 10.576 1.747 9.298 1.00 0.00 C ATOM 955 CG LEU A 65 9.958 0.738 10.280 1.00 0.00 C ATOM 956 CD1 LEU A 65 11.076 0.175 11.173 1.00 0.00 C ATOM 957 CD2 LEU A 65 8.869 1.314 11.201 1.00 0.00 C ATOM 0 H LEU A 65 10.898 -0.042 7.723 1.00 0.00 H new ATOM 0 HA LEU A 65 8.753 1.517 8.205 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.631 1.525 9.140 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.521 2.756 9.706 1.00 0.00 H new ATOM 0 HG LEU A 65 9.477 -0.021 9.662 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.653 -0.543 11.876 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.822 -0.321 10.552 1.00 0.00 H new ATOM 0 HD13 LEU A 65 11.546 0.989 11.725 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.494 0.528 11.857 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.290 2.119 11.803 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.050 1.704 10.596 1.00 0.00 H new ATOM 969 N THR A 66 10.986 3.213 6.484 1.00 0.00 N ATOM 970 CA THR A 66 11.157 4.414 5.727 1.00 0.00 C ATOM 971 C THR A 66 10.258 4.447 4.539 1.00 0.00 C ATOM 972 O THR A 66 9.651 5.471 4.228 1.00 0.00 O ATOM 973 CB THR A 66 12.569 4.637 5.275 1.00 0.00 C ATOM 974 OG1 THR A 66 13.463 4.576 6.377 1.00 0.00 O ATOM 975 CG2 THR A 66 12.802 6.047 4.708 1.00 0.00 C ATOM 0 H THR A 66 11.787 2.583 6.435 1.00 0.00 H new ATOM 0 HA THR A 66 10.893 5.219 6.412 1.00 0.00 H new ATOM 0 HB THR A 66 12.740 3.867 4.523 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.535 3.650 6.689 1.00 0.00 H new ATOM 0 HG21 THR A 66 13.842 6.147 4.398 1.00 0.00 H new ATOM 0 HG22 THR A 66 12.150 6.206 3.849 1.00 0.00 H new ATOM 0 HG23 THR A 66 12.579 6.789 5.475 1.00 0.00 H new ATOM 983 N MET A 67 10.148 3.291 3.859 1.00 0.00 N ATOM 984 CA MET A 67 9.304 3.151 2.714 1.00 0.00 C ATOM 985 C MET A 67 7.850 3.430 2.882 1.00 0.00 C ATOM 986 O MET A 67 7.165 3.972 2.016 1.00 0.00 O ATOM 987 CB MET A 67 9.438 1.688 2.259 1.00 0.00 C ATOM 988 CG MET A 67 8.863 1.272 0.903 1.00 0.00 C ATOM 989 SD MET A 67 9.431 -0.343 0.293 1.00 0.00 S ATOM 990 CE MET A 67 8.239 -0.386 -1.077 1.00 0.00 C ATOM 0 H MET A 67 10.653 2.441 4.109 1.00 0.00 H new ATOM 0 HA MET A 67 9.644 3.910 2.010 1.00 0.00 H new ATOM 0 HB2 MET A 67 10.500 1.442 2.255 1.00 0.00 H new ATOM 0 HB3 MET A 67 8.969 1.064 3.020 1.00 0.00 H new ATOM 0 HG2 MET A 67 7.776 1.254 0.976 1.00 0.00 H new ATOM 0 HG3 MET A 67 9.121 2.033 0.167 1.00 0.00 H new ATOM 0 HE1 MET A 67 7.446 -1.098 -0.847 1.00 0.00 H new ATOM 0 HE2 MET A 67 7.808 0.605 -1.215 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.747 -0.692 -1.992 1.00 0.00 H new ATOM 1000 N MET A 68 7.317 2.967 4.028 1.00 0.00 N ATOM 1001 CA MET A 68 5.996 3.332 4.435 1.00 0.00 C ATOM 1002 C MET A 68 5.684 4.752 4.759 1.00 0.00 C ATOM 1003 O MET A 68 4.522 5.112 4.580 1.00 0.00 O ATOM 1004 CB MET A 68 5.764 2.468 5.686 1.00 0.00 C ATOM 1005 CG MET A 68 5.998 0.960 5.575 1.00 0.00 C ATOM 1006 SD MET A 68 4.491 -0.011 5.267 1.00 0.00 S ATOM 1007 CE MET A 68 4.488 0.217 3.466 1.00 0.00 C ATOM 0 H MET A 68 7.801 2.341 4.672 1.00 0.00 H new ATOM 0 HA MET A 68 5.346 3.175 3.574 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.410 2.848 6.478 1.00 0.00 H new ATOM 0 HB3 MET A 68 4.735 2.623 6.012 1.00 0.00 H new ATOM 0 HG2 MET A 68 6.708 0.773 4.769 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.461 0.607 6.496 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.559 0.699 3.162 1.00 0.00 H new ATOM 0 HE2 MET A 68 5.333 0.842 3.177 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.570 -0.753 2.976 1.00 0.00 H new ATOM 1017 N ALA A 69 6.716 5.509 5.175 1.00 0.00 N ATOM 1018 CA ALA A 69 6.449 6.828 5.659 1.00 0.00 C ATOM 1019 C ALA A 69 6.688 7.876 4.627 1.00 0.00 C ATOM 1020 O ALA A 69 6.056 8.931 4.601 1.00 0.00 O ATOM 1021 CB ALA A 69 7.495 7.006 6.772 1.00 0.00 C ATOM 0 H ALA A 69 7.695 5.224 5.178 1.00 0.00 H new ATOM 0 HA ALA A 69 5.409 6.932 5.970 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.384 7.993 7.221 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.348 6.242 7.535 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.495 6.909 6.350 1.00 0.00 H new ATOM 1027 N ARG A 70 7.533 7.467 3.664 1.00 0.00 N ATOM 1028 CA ARG A 70 7.979 8.264 2.564 1.00 0.00 C ATOM 1029 C ARG A 70 7.082 8.116 1.384 1.00 0.00 C ATOM 1030 O ARG A 70 6.946 6.982 0.928 1.00 0.00 O ATOM 1031 CB ARG A 70 9.456 8.167 2.147 1.00 0.00 C ATOM 1032 CG ARG A 70 9.832 9.249 1.133 1.00 0.00 C ATOM 1033 CD ARG A 70 11.281 9.110 0.662 1.00 0.00 C ATOM 1034 NE ARG A 70 11.462 10.161 -0.378 1.00 0.00 N ATOM 1035 CZ ARG A 70 12.569 10.293 -1.166 1.00 0.00 C ATOM 1036 NH1 ARG A 70 13.563 9.356 -1.152 1.00 0.00 N ATOM 1037 NH2 ARG A 70 12.736 11.316 -2.054 1.00 0.00 N ATOM 0 H ARG A 70 7.927 6.526 3.653 1.00 0.00 H new ATOM 0 HA ARG A 70 7.914 9.271 2.975 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.090 8.260 3.029 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.649 7.184 1.718 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.164 9.190 0.274 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.689 10.232 1.581 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.978 9.251 1.488 1.00 0.00 H new ATOM 0 HD3 ARG A 70 11.468 8.117 0.253 1.00 0.00 H new ATOM 0 HE ARG A 70 10.704 10.830 -0.511 1.00 0.00 H new ATOM 0 HH11 ARG A 70 13.486 8.540 -0.545 1.00 0.00 H new ATOM 0 HH12 ARG A 70 14.382 9.473 -1.748 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.013 12.029 -2.152 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.584 11.367 -2.619 1.00 0.00 H new ATOM 1051 N LYS A 71 6.511 9.234 0.901 1.00 0.00 N ATOM 1052 CA LYS A 71 5.645 9.227 -0.237 1.00 0.00 C ATOM 1053 C LYS A 71 6.261 9.920 -1.403 1.00 0.00 C ATOM 1054 O LYS A 71 6.951 10.926 -1.243 1.00 0.00 O ATOM 1055 CB LYS A 71 4.259 9.814 0.080 1.00 0.00 C ATOM 1056 CG LYS A 71 4.336 11.342 0.095 1.00 0.00 C ATOM 1057 CD LYS A 71 3.258 12.101 0.871 1.00 0.00 C ATOM 1058 CE LYS A 71 1.795 11.966 0.444 1.00 0.00 C ATOM 1059 NZ LYS A 71 0.914 12.577 1.464 1.00 0.00 N ATOM 0 H LYS A 71 6.653 10.159 1.308 1.00 0.00 H new ATOM 0 HA LYS A 71 5.500 8.181 -0.506 1.00 0.00 H new ATOM 0 HB2 LYS A 71 3.535 9.484 -0.665 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.911 9.448 1.046 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.306 11.625 0.504 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.313 11.689 -0.938 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.325 11.791 1.914 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.513 13.160 0.836 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.642 12.452 -0.519 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.541 10.914 0.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -0.078 12.482 1.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.051 12.095 2.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.149 13.585 1.567 1.00 0.00 H new ATOM 1073 N MET A 72 6.104 9.460 -2.657 1.00 0.00 N ATOM 1074 CA MET A 72 6.751 9.987 -3.818 1.00 0.00 C ATOM 1075 C MET A 72 5.900 11.050 -4.423 1.00 0.00 C ATOM 1076 O MET A 72 5.159 11.807 -3.797 1.00 0.00 O ATOM 1077 CB MET A 72 7.214 8.808 -4.690 1.00 0.00 C ATOM 1078 CG MET A 72 8.278 7.943 -4.012 1.00 0.00 C ATOM 1079 SD MET A 72 9.837 8.802 -3.642 1.00 0.00 S ATOM 1080 CE MET A 72 10.813 7.296 -3.361 1.00 0.00 C ATOM 0 H MET A 72 5.490 8.675 -2.872 1.00 0.00 H new ATOM 0 HA MET A 72 7.675 10.527 -3.612 1.00 0.00 H new ATOM 0 HB2 MET A 72 6.353 8.187 -4.938 1.00 0.00 H new ATOM 0 HB3 MET A 72 7.611 9.192 -5.630 1.00 0.00 H new ATOM 0 HG2 MET A 72 7.867 7.549 -3.082 1.00 0.00 H new ATOM 0 HG3 MET A 72 8.494 7.088 -4.653 1.00 0.00 H new ATOM 0 HE1 MET A 72 11.838 7.568 -3.111 1.00 0.00 H new ATOM 0 HE2 MET A 72 10.377 6.728 -2.539 1.00 0.00 H new ATOM 0 HE3 MET A 72 10.810 6.687 -4.265 1.00 0.00 H new ATOM 1090 N LYS A 73 5.941 11.284 -5.747 1.00 0.00 N ATOM 1091 CA LYS A 73 5.234 12.261 -6.514 1.00 0.00 C ATOM 1092 C LYS A 73 3.939 11.681 -6.969 1.00 0.00 C ATOM 1093 O LYS A 73 3.677 10.480 -6.958 1.00 0.00 O ATOM 1094 CB LYS A 73 6.101 12.791 -7.669 1.00 0.00 C ATOM 1095 CG LYS A 73 6.399 11.748 -8.747 1.00 0.00 C ATOM 1096 CD LYS A 73 7.290 12.289 -9.867 1.00 0.00 C ATOM 1097 CE LYS A 73 7.593 11.346 -11.033 1.00 0.00 C ATOM 1098 NZ LYS A 73 8.466 10.252 -10.553 1.00 0.00 N ATOM 0 H LYS A 73 6.542 10.719 -6.347 1.00 0.00 H new ATOM 0 HA LYS A 73 5.008 13.129 -5.895 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.597 13.641 -8.129 1.00 0.00 H new ATOM 0 HB3 LYS A 73 7.043 13.160 -7.264 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.884 10.886 -8.288 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.460 11.396 -9.174 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.819 13.186 -10.270 1.00 0.00 H new ATOM 0 HD3 LYS A 73 8.238 12.597 -9.426 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.667 10.938 -11.438 1.00 0.00 H new ATOM 0 HE3 LYS A 73 8.082 11.891 -11.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 8.526 9.511 -11.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 9.417 10.626 -10.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.069 9.849 -9.680 1.00 0.00 H new ATOM 1112 N ASP A 74 2.944 12.563 -7.170 1.00 0.00 N ATOM 1113 CA ASP A 74 1.578 12.150 -7.078 1.00 0.00 C ATOM 1114 C ASP A 74 1.290 11.179 -8.170 1.00 0.00 C ATOM 1115 O ASP A 74 0.401 10.346 -8.000 1.00 0.00 O ATOM 1116 CB ASP A 74 0.790 13.469 -7.157 1.00 0.00 C ATOM 1117 CG ASP A 74 0.826 14.227 -5.838 1.00 0.00 C ATOM 1118 OD1 ASP A 74 1.771 14.077 -5.018 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -0.075 15.096 -5.691 1.00 0.00 O ATOM 0 H ASP A 74 3.081 13.549 -7.393 1.00 0.00 H new ATOM 0 HA ASP A 74 1.309 11.618 -6.165 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.206 14.094 -7.947 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.245 13.259 -7.428 1.00 0.00 H new ATOM 1124 N THR A 75 1.991 11.121 -9.316 1.00 0.00 N ATOM 1125 CA THR A 75 1.902 10.140 -10.353 1.00 0.00 C ATOM 1126 C THR A 75 2.246 8.758 -9.917 1.00 0.00 C ATOM 1127 O THR A 75 1.527 7.791 -10.166 1.00 0.00 O ATOM 1128 CB THR A 75 2.605 10.407 -11.651 1.00 0.00 C ATOM 1129 OG1 THR A 75 3.934 10.871 -11.468 1.00 0.00 O ATOM 1130 CG2 THR A 75 1.844 11.557 -12.332 1.00 0.00 C ATOM 0 H THR A 75 2.688 11.832 -9.536 1.00 0.00 H new ATOM 0 HA THR A 75 0.837 10.229 -10.566 1.00 0.00 H new ATOM 0 HB THR A 75 2.633 9.479 -12.222 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.349 11.028 -12.342 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.317 11.792 -13.285 1.00 0.00 H new ATOM 0 HG22 THR A 75 0.810 11.258 -12.504 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.865 12.438 -11.690 1.00 0.00 H new ATOM 1138 N ASP A 76 3.343 8.668 -9.144 1.00 0.00 N ATOM 1139 CA ASP A 76 3.908 7.497 -8.549 1.00 0.00 C ATOM 1140 C ASP A 76 2.950 6.893 -7.580 1.00 0.00 C ATOM 1141 O ASP A 76 2.680 5.693 -7.600 1.00 0.00 O ATOM 1142 CB ASP A 76 5.330 7.655 -7.986 1.00 0.00 C ATOM 1143 CG ASP A 76 6.244 7.922 -9.173 1.00 0.00 C ATOM 1144 OD1 ASP A 76 5.978 7.600 -10.362 1.00 0.00 O ATOM 1145 OD2 ASP A 76 7.309 8.520 -8.865 1.00 0.00 O ATOM 0 H ASP A 76 3.887 9.500 -8.914 1.00 0.00 H new ATOM 0 HA ASP A 76 4.062 6.793 -9.367 1.00 0.00 H new ATOM 0 HB2 ASP A 76 5.374 8.477 -7.271 1.00 0.00 H new ATOM 0 HB3 ASP A 76 5.638 6.754 -7.455 1.00 0.00 H new ATOM 1150 N SER A 77 2.442 7.746 -6.673 1.00 0.00 N ATOM 1151 CA SER A 77 1.543 7.490 -5.591 1.00 0.00 C ATOM 1152 C SER A 77 0.192 7.009 -5.998 1.00 0.00 C ATOM 1153 O SER A 77 -0.524 6.315 -5.278 1.00 0.00 O ATOM 1154 CB SER A 77 1.319 8.791 -4.802 1.00 0.00 C ATOM 1155 OG SER A 77 2.453 9.247 -4.079 1.00 0.00 O ATOM 0 H SER A 77 2.695 8.734 -6.706 1.00 0.00 H new ATOM 0 HA SER A 77 2.019 6.700 -5.010 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.009 9.572 -5.496 1.00 0.00 H new ATOM 0 HB3 SER A 77 0.496 8.640 -4.104 1.00 0.00 H new ATOM 0 HG SER A 77 2.229 10.077 -3.608 1.00 0.00 H new ATOM 1161 N GLU A 78 -0.260 7.344 -7.219 1.00 0.00 N ATOM 1162 CA GLU A 78 -1.462 6.872 -7.832 1.00 0.00 C ATOM 1163 C GLU A 78 -1.226 5.551 -8.480 1.00 0.00 C ATOM 1164 O GLU A 78 -1.975 4.605 -8.238 1.00 0.00 O ATOM 1165 CB GLU A 78 -1.976 7.917 -8.837 1.00 0.00 C ATOM 1166 CG GLU A 78 -3.325 7.437 -9.375 1.00 0.00 C ATOM 1167 CD GLU A 78 -4.335 8.480 -9.831 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.073 9.078 -10.909 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -5.450 8.597 -9.256 1.00 0.00 O ATOM 0 H GLU A 78 0.252 7.991 -7.820 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.229 6.730 -7.071 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.083 8.889 -8.354 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.264 8.043 -9.653 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -3.129 6.774 -10.218 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.797 6.835 -8.598 1.00 0.00 H new ATOM 1176 N GLU A 79 -0.119 5.335 -9.213 1.00 0.00 N ATOM 1177 CA GLU A 79 0.141 4.076 -9.840 1.00 0.00 C ATOM 1178 C GLU A 79 0.295 2.928 -8.903 1.00 0.00 C ATOM 1179 O GLU A 79 -0.105 1.790 -9.145 1.00 0.00 O ATOM 1180 CB GLU A 79 1.239 4.112 -10.917 1.00 0.00 C ATOM 1181 CG GLU A 79 0.878 4.830 -12.219 1.00 0.00 C ATOM 1182 CD GLU A 79 -0.493 4.560 -12.823 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -0.934 3.401 -13.047 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -1.228 5.551 -13.080 1.00 0.00 O ATOM 0 H GLU A 79 0.602 6.039 -9.372 1.00 0.00 H new ATOM 0 HA GLU A 79 -0.788 3.882 -10.377 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.121 4.592 -10.493 1.00 0.00 H new ATOM 0 HB3 GLU A 79 1.519 3.086 -11.157 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.961 5.903 -12.044 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.629 4.569 -12.964 1.00 0.00 H new ATOM 1191 N GLU A 80 0.941 3.249 -7.768 1.00 0.00 N ATOM 1192 CA GLU A 80 1.134 2.486 -6.574 1.00 0.00 C ATOM 1193 C GLU A 80 -0.138 1.897 -6.068 1.00 0.00 C ATOM 1194 O GLU A 80 -0.248 0.684 -5.897 1.00 0.00 O ATOM 1195 CB GLU A 80 1.740 3.368 -5.470 1.00 0.00 C ATOM 1196 CG GLU A 80 2.240 2.675 -4.200 1.00 0.00 C ATOM 1197 CD GLU A 80 2.846 3.705 -3.258 1.00 0.00 C ATOM 1198 OE1 GLU A 80 2.829 4.941 -3.501 1.00 0.00 O ATOM 1199 OE2 GLU A 80 3.294 3.317 -2.146 1.00 0.00 O ATOM 0 H GLU A 80 1.384 4.164 -7.681 1.00 0.00 H new ATOM 0 HA GLU A 80 1.813 1.672 -6.828 1.00 0.00 H new ATOM 0 HB2 GLU A 80 2.575 3.920 -5.902 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.990 4.103 -5.178 1.00 0.00 H new ATOM 0 HG2 GLU A 80 1.416 2.158 -3.708 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.983 1.920 -4.455 1.00 0.00 H new ATOM 1206 N ILE A 81 -1.152 2.741 -5.805 1.00 0.00 N ATOM 1207 CA ILE A 81 -2.417 2.322 -5.286 1.00 0.00 C ATOM 1208 C ILE A 81 -3.223 1.592 -6.304 1.00 0.00 C ATOM 1209 O ILE A 81 -3.953 0.642 -6.024 1.00 0.00 O ATOM 1210 CB ILE A 81 -3.201 3.467 -4.717 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -2.407 4.147 -3.588 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -4.670 3.162 -4.383 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -2.203 3.306 -2.328 1.00 0.00 C ATOM 0 H ILE A 81 -1.089 3.747 -5.959 1.00 0.00 H new ATOM 0 HA ILE A 81 -2.198 1.631 -4.472 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.317 4.196 -5.519 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -1.429 4.432 -3.976 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -2.920 5.068 -3.310 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.144 4.056 -3.979 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.192 2.852 -5.288 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -4.717 2.361 -3.645 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.632 3.879 -1.597 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.173 3.042 -1.906 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -1.658 2.397 -2.582 1.00 0.00 H new ATOM 1225 N ARG A 82 -3.090 1.910 -7.604 1.00 0.00 N ATOM 1226 CA ARG A 82 -3.599 1.136 -8.694 1.00 0.00 C ATOM 1227 C ARG A 82 -3.091 -0.249 -8.908 1.00 0.00 C ATOM 1228 O ARG A 82 -3.836 -1.162 -9.259 1.00 0.00 O ATOM 1229 CB ARG A 82 -3.463 1.909 -10.016 1.00 0.00 C ATOM 1230 CG ARG A 82 -4.184 3.258 -10.052 1.00 0.00 C ATOM 1231 CD ARG A 82 -3.821 4.077 -11.292 1.00 0.00 C ATOM 1232 NE ARG A 82 -5.011 4.936 -11.545 1.00 0.00 N ATOM 1233 CZ ARG A 82 -4.974 6.031 -12.360 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -3.938 6.245 -13.222 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -6.049 6.873 -12.369 1.00 0.00 N ATOM 0 H ARG A 82 -2.602 2.751 -7.911 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.631 0.985 -8.377 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -2.404 2.074 -10.216 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -3.847 1.287 -10.825 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.261 3.092 -10.031 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.931 3.827 -9.157 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -2.928 4.679 -11.121 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -3.611 3.431 -12.145 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.892 4.696 -11.090 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.167 5.579 -13.268 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.935 7.071 -13.820 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.855 6.677 -11.776 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.046 7.698 -12.969 1.00 0.00 H new ATOM 1249 N GLU A 83 -1.792 -0.527 -8.702 1.00 0.00 N ATOM 1250 CA GLU A 83 -1.249 -1.845 -8.817 1.00 0.00 C ATOM 1251 C GLU A 83 -1.668 -2.717 -7.684 1.00 0.00 C ATOM 1252 O GLU A 83 -2.126 -3.820 -7.975 1.00 0.00 O ATOM 1253 CB GLU A 83 0.280 -1.685 -8.878 1.00 0.00 C ATOM 1254 CG GLU A 83 0.738 -1.337 -10.296 1.00 0.00 C ATOM 1255 CD GLU A 83 0.372 -2.476 -11.236 1.00 0.00 C ATOM 1256 OE1 GLU A 83 1.050 -3.533 -11.130 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -0.613 -2.352 -12.013 1.00 0.00 O ATOM 0 H GLU A 83 -1.102 0.181 -8.449 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.622 -2.338 -9.715 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.595 -0.903 -8.188 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.759 -2.609 -8.553 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.266 -0.412 -10.626 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.815 -1.169 -10.312 1.00 0.00 H new ATOM 1264 N ALA A 84 -1.670 -2.202 -6.441 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.226 -2.787 -5.261 1.00 0.00 C ATOM 1266 C ALA A 84 -3.668 -3.130 -5.413 1.00 0.00 C ATOM 1267 O ALA A 84 -4.057 -4.178 -4.898 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.137 -1.769 -4.111 1.00 0.00 C ATOM 0 H ALA A 84 -1.244 -1.296 -6.247 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.661 -3.699 -5.066 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.559 -2.205 -3.205 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.093 -1.508 -3.936 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.696 -0.871 -4.376 1.00 0.00 H new ATOM 1274 N PHE A 85 -4.428 -2.316 -6.167 1.00 0.00 N ATOM 1275 CA PHE A 85 -5.779 -2.521 -6.587 1.00 0.00 C ATOM 1276 C PHE A 85 -5.746 -3.658 -7.549 1.00 0.00 C ATOM 1277 O PHE A 85 -6.559 -4.569 -7.401 1.00 0.00 O ATOM 1278 CB PHE A 85 -6.390 -1.256 -7.213 1.00 0.00 C ATOM 1279 CG PHE A 85 -7.873 -1.301 -7.347 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -8.738 -1.114 -6.295 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -8.431 -1.503 -8.588 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.102 -1.145 -6.468 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -9.790 -1.497 -8.797 1.00 0.00 C ATOM 1284 CZ PHE A 85 -10.632 -1.355 -7.719 1.00 0.00 C ATOM 0 H PHE A 85 -4.059 -1.431 -6.514 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.419 -2.749 -5.735 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.117 -0.394 -6.605 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -5.951 -1.103 -8.199 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.336 -0.938 -5.308 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -7.777 -1.673 -9.430 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -10.757 -1.004 -5.621 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -10.191 -1.602 -9.794 1.00 0.00 H new ATOM 0 HZ PHE A 85 -11.702 -1.408 -7.854 1.00 0.00 H new ATOM 1294 N ARG A 86 -4.836 -3.772 -8.533 1.00 0.00 N ATOM 1295 CA ARG A 86 -4.677 -4.768 -9.547 1.00 0.00 C ATOM 1296 C ARG A 86 -4.358 -6.131 -9.039 1.00 0.00 C ATOM 1297 O ARG A 86 -4.691 -7.148 -9.646 1.00 0.00 O ATOM 1298 CB ARG A 86 -3.732 -4.368 -10.693 1.00 0.00 C ATOM 1299 CG ARG A 86 -3.851 -5.215 -11.962 1.00 0.00 C ATOM 1300 CD ARG A 86 -3.135 -4.727 -13.223 1.00 0.00 C ATOM 1301 NE ARG A 86 -1.669 -4.734 -12.960 1.00 0.00 N ATOM 1302 CZ ARG A 86 -0.834 -5.789 -13.194 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -1.250 -6.982 -13.711 1.00 0.00 N ATOM 1304 NH2 ARG A 86 0.478 -5.604 -12.865 1.00 0.00 N ATOM 0 H ARG A 86 -4.111 -3.061 -8.625 1.00 0.00 H new ATOM 0 HA ARG A 86 -5.679 -4.825 -9.973 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.921 -3.326 -10.952 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.705 -4.425 -10.332 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.479 -6.214 -11.733 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.910 -5.316 -12.198 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.372 -5.373 -14.068 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -3.469 -3.723 -13.485 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.256 -3.884 -12.575 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -2.233 -7.121 -13.945 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.578 -7.734 -13.863 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.784 -4.715 -12.469 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.152 -6.354 -13.016 1.00 0.00 H new ATOM 1318 N VAL A 87 -3.685 -6.232 -7.879 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.489 -7.444 -7.145 1.00 0.00 C ATOM 1320 C VAL A 87 -4.745 -8.207 -6.903 1.00 0.00 C ATOM 1321 O VAL A 87 -4.831 -9.407 -7.156 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.843 -7.169 -5.820 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.724 -8.479 -5.023 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.475 -6.529 -6.112 1.00 0.00 C ATOM 0 H VAL A 87 -3.254 -5.424 -7.429 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.841 -8.055 -7.773 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.433 -6.487 -5.208 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.254 -8.278 -4.060 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.717 -8.898 -4.862 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.116 -9.191 -5.582 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.967 -6.311 -5.172 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.869 -7.218 -6.700 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.618 -5.604 -6.670 1.00 0.00 H new ATOM 1334 N PHE A 88 -5.764 -7.527 -6.347 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.075 -8.054 -6.128 1.00 0.00 C ATOM 1336 C PHE A 88 -7.923 -8.277 -7.333 1.00 0.00 C ATOM 1337 O PHE A 88 -8.342 -9.408 -7.570 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.760 -7.096 -5.139 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.141 -7.058 -3.784 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.169 -8.256 -3.109 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.750 -5.869 -3.215 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -6.974 -8.216 -1.748 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.379 -5.919 -1.892 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.486 -7.075 -1.155 1.00 0.00 C ATOM 0 H PHE A 88 -5.668 -6.561 -6.035 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.958 -9.067 -5.744 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.746 -6.090 -5.559 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.806 -7.385 -5.038 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.337 -9.189 -3.626 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.735 -4.946 -3.776 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -7.204 -9.081 -1.144 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.994 -5.028 -1.420 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.189 -7.087 -0.117 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.194 -7.225 -8.127 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.094 -7.304 -9.236 1.00 0.00 C ATOM 1356 C ASP A 89 -8.458 -8.105 -10.320 1.00 0.00 C ATOM 1357 O ASP A 89 -7.373 -7.792 -10.809 1.00 0.00 O ATOM 1358 CB ASP A 89 -9.460 -5.859 -9.615 1.00 0.00 C ATOM 1359 CG ASP A 89 -10.648 -5.803 -10.565 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -11.735 -6.259 -10.120 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -10.385 -5.535 -11.768 1.00 0.00 O ATOM 0 H ASP A 89 -7.780 -6.302 -7.996 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.025 -7.824 -9.010 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.691 -5.295 -8.712 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.600 -5.377 -10.081 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.146 -9.198 -10.692 1.00 0.00 N ATOM 1367 CA LYS A 90 -8.562 -10.284 -11.418 1.00 0.00 C ATOM 1368 C LYS A 90 -8.982 -10.239 -12.847 1.00 0.00 C ATOM 1369 O LYS A 90 -8.240 -10.398 -13.815 1.00 0.00 O ATOM 1370 CB LYS A 90 -8.953 -11.618 -10.759 1.00 0.00 C ATOM 1371 CG LYS A 90 -8.254 -12.923 -11.144 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.813 -14.204 -10.520 1.00 0.00 C ATOM 1373 CE LYS A 90 -7.997 -15.436 -10.918 1.00 0.00 C ATOM 1374 NZ LYS A 90 -6.634 -15.472 -10.344 1.00 0.00 N ATOM 0 H LYS A 90 -10.135 -9.331 -10.483 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.476 -10.194 -11.391 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.824 -11.492 -9.684 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.019 -11.762 -10.938 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.295 -13.025 -12.228 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.202 -12.841 -10.871 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.818 -14.107 -9.434 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -9.849 -14.338 -10.832 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.535 -16.331 -10.605 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.923 -15.473 -12.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.171 -16.366 -10.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.080 -14.674 -10.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.692 -15.400 -9.308 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.269 -9.886 -13.008 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.089 -9.828 -14.178 1.00 0.00 C ATOM 1390 C ASP A 91 -10.864 -8.675 -15.095 1.00 0.00 C ATOM 1391 O ASP A 91 -10.547 -8.828 -16.273 1.00 0.00 O ATOM 1392 CB ASP A 91 -12.568 -9.989 -13.790 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.071 -9.138 -12.633 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -12.407 -8.126 -12.282 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.132 -9.472 -12.041 1.00 0.00 O ATOM 0 H ASP A 91 -10.809 -9.600 -12.192 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.770 -10.672 -14.789 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.175 -9.764 -14.667 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.742 -11.036 -13.542 1.00 0.00 H new ATOM 1400 N GLY A 92 -10.848 -7.458 -14.522 1.00 0.00 N ATOM 1401 CA GLY A 92 -10.551 -6.153 -15.026 1.00 0.00 C ATOM 1402 C GLY A 92 -11.653 -5.170 -14.830 1.00 0.00 C ATOM 1403 O GLY A 92 -11.591 -4.058 -15.354 1.00 0.00 O ATOM 0 H GLY A 92 -11.086 -7.388 -13.533 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -9.652 -5.780 -14.536 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -10.327 -6.227 -16.090 1.00 0.00 H new ATOM 1407 N ASN A 93 -12.699 -5.546 -14.073 1.00 0.00 N ATOM 1408 CA ASN A 93 -13.891 -4.757 -14.061 1.00 0.00 C ATOM 1409 C ASN A 93 -13.777 -3.600 -13.129 1.00 0.00 C ATOM 1410 O ASN A 93 -14.505 -2.609 -13.172 1.00 0.00 O ATOM 1411 CB ASN A 93 -15.157 -5.605 -13.855 1.00 0.00 C ATOM 1412 CG ASN A 93 -15.272 -6.313 -12.513 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -14.475 -6.275 -11.576 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -16.411 -7.025 -12.301 1.00 0.00 N ATOM 0 H ASN A 93 -12.722 -6.377 -13.482 1.00 0.00 H new ATOM 0 HA ASN A 93 -14.006 -4.324 -15.055 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -16.027 -4.960 -13.979 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.201 -6.355 -14.645 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -16.564 -7.488 -11.405 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.113 -7.096 -13.038 1.00 0.00 H new ATOM 1421 N GLY A 94 -12.893 -3.767 -12.129 1.00 0.00 N ATOM 1422 CA GLY A 94 -12.803 -2.735 -11.143 1.00 0.00 C ATOM 1423 C GLY A 94 -13.817 -2.806 -10.053 1.00 0.00 C ATOM 1424 O GLY A 94 -14.097 -1.715 -9.559 1.00 0.00 O ATOM 0 H GLY A 94 -12.273 -4.567 -12.004 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.810 -2.768 -10.696 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.896 -1.770 -11.641 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.298 -4.004 -9.675 1.00 0.00 N ATOM 1429 CA TYR A 95 -14.845 -4.144 -8.362 1.00 0.00 C ATOM 1430 C TYR A 95 -14.241 -5.372 -7.771 1.00 0.00 C ATOM 1431 O TYR A 95 -14.252 -6.435 -8.390 1.00 0.00 O ATOM 1432 CB TYR A 95 -16.363 -4.362 -8.475 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.083 -3.179 -9.025 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -17.215 -3.036 -10.386 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -17.592 -2.246 -8.152 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -17.612 -1.801 -10.841 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -18.130 -1.075 -8.632 1.00 0.00 C ATOM 1438 CZ TYR A 95 -18.055 -0.822 -9.982 1.00 0.00 C ATOM 1439 OH TYR A 95 -18.423 0.437 -10.500 1.00 0.00 O ATOM 0 H TYR A 95 -14.310 -4.845 -10.252 1.00 0.00 H new ATOM 0 HA TYR A 95 -14.642 -3.261 -7.756 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -16.554 -5.225 -9.113 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -16.765 -4.599 -7.490 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.017 -3.853 -11.064 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.569 -2.433 -7.089 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -17.575 -1.594 -11.900 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -18.601 -0.369 -7.964 1.00 0.00 H new ATOM 0 HH TYR A 95 -18.715 1.019 -9.768 1.00 0.00 H new ATOM 1449 N ILE A 96 -13.715 -5.301 -6.536 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.078 -6.376 -5.839 1.00 0.00 C ATOM 1451 C ILE A 96 -14.116 -7.085 -5.039 1.00 0.00 C ATOM 1452 O ILE A 96 -14.887 -6.538 -4.252 1.00 0.00 O ATOM 1453 CB ILE A 96 -11.946 -5.914 -4.971 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -10.798 -5.302 -5.791 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.403 -6.990 -4.016 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -9.888 -4.375 -4.986 1.00 0.00 C ATOM 0 H ILE A 96 -13.736 -4.440 -5.990 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.630 -7.052 -6.567 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.385 -5.137 -4.345 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.197 -6.107 -6.214 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -11.219 -4.745 -6.628 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.587 -6.574 -3.425 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.200 -7.322 -3.351 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.036 -7.838 -4.594 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.103 -3.983 -5.633 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -10.474 -3.548 -4.585 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.436 -4.932 -4.165 1.00 0.00 H new ATOM 1468 N SER A 97 -14.272 -8.382 -5.360 1.00 0.00 N ATOM 1469 CA SER A 97 -15.122 -9.342 -4.727 1.00 0.00 C ATOM 1470 C SER A 97 -14.393 -10.040 -3.631 1.00 0.00 C ATOM 1471 O SER A 97 -13.192 -10.018 -3.363 1.00 0.00 O ATOM 1472 CB SER A 97 -15.838 -10.358 -5.632 1.00 0.00 C ATOM 1473 OG SER A 97 -15.068 -11.497 -5.986 1.00 0.00 O ATOM 0 H SER A 97 -13.754 -8.795 -6.135 1.00 0.00 H new ATOM 0 HA SER A 97 -15.939 -8.736 -4.336 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.745 -10.694 -5.129 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.150 -9.851 -6.545 1.00 0.00 H new ATOM 0 HG SER A 97 -15.601 -12.087 -6.559 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.192 -10.737 -2.804 1.00 0.00 N ATOM 1480 CA ALA A 98 -14.707 -11.585 -1.759 1.00 0.00 C ATOM 1481 C ALA A 98 -13.888 -12.705 -2.301 1.00 0.00 C ATOM 1482 O ALA A 98 -12.903 -13.170 -1.730 1.00 0.00 O ATOM 1483 CB ALA A 98 -15.847 -12.042 -0.834 1.00 0.00 C ATOM 0 H ALA A 98 -16.210 -10.710 -2.864 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.031 -11.004 -1.131 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.445 -12.685 -0.051 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.320 -11.170 -0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.586 -12.595 -1.413 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.227 -13.290 -3.464 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.544 -14.325 -4.176 1.00 0.00 C ATOM 1491 C ALA A 99 -12.205 -13.936 -4.700 1.00 0.00 C ATOM 1492 O ALA A 99 -11.256 -14.711 -4.806 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.495 -14.860 -5.261 1.00 0.00 C ATOM 0 H ALA A 99 -15.073 -13.004 -3.956 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.298 -15.123 -3.476 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -13.999 -15.653 -5.821 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.396 -15.256 -4.792 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.765 -14.051 -5.939 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.102 -12.664 -5.124 1.00 0.00 N ATOM 1500 CA GLU A 100 -10.828 -12.124 -5.485 1.00 0.00 C ATOM 1501 C GLU A 100 -9.934 -11.928 -4.309 1.00 0.00 C ATOM 1502 O GLU A 100 -8.798 -12.397 -4.346 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.098 -10.838 -6.283 1.00 0.00 C ATOM 1504 CG GLU A 100 -11.509 -11.096 -7.734 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.007 -9.871 -8.488 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -12.771 -9.073 -7.881 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -11.764 -9.758 -9.719 1.00 0.00 O ATOM 0 H GLU A 100 -12.886 -12.018 -5.216 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.273 -12.826 -6.107 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.885 -10.270 -5.786 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.202 -10.218 -6.272 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -10.655 -11.512 -8.269 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.292 -11.854 -7.745 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.500 -11.366 -3.226 1.00 0.00 N ATOM 1515 CA LEU A 101 -9.805 -11.076 -2.010 1.00 0.00 C ATOM 1516 C LEU A 101 -9.314 -12.288 -1.296 1.00 0.00 C ATOM 1517 O LEU A 101 -8.158 -12.466 -0.916 1.00 0.00 O ATOM 1518 CB LEU A 101 -10.693 -10.275 -1.044 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.158 -9.890 0.346 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.107 -8.354 0.394 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -10.919 -10.543 1.511 1.00 0.00 C ATOM 0 H LEU A 101 -11.485 -11.102 -3.197 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.937 -10.491 -2.314 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -10.975 -9.352 -1.551 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.608 -10.848 -0.893 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.155 -10.291 0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.732 -8.033 1.366 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.445 -7.987 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -11.108 -7.952 0.240 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -10.482 -10.222 2.457 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -11.966 -10.243 1.475 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -10.849 -11.628 1.429 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.142 -13.342 -1.182 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.857 -14.606 -0.578 1.00 0.00 C ATOM 1535 C ARG A 102 -8.712 -15.346 -1.180 1.00 0.00 C ATOM 1536 O ARG A 102 -8.010 -16.088 -0.495 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.013 -15.622 -0.596 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.782 -16.788 0.366 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.059 -17.596 0.603 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.940 -18.456 1.814 1.00 0.00 N ATOM 1541 CZ ARG A 102 -13.066 -19.060 2.294 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -14.260 -19.037 1.631 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -12.933 -19.794 3.436 1.00 0.00 N ATOM 0 H ARG A 102 -11.094 -13.304 -1.545 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.636 -14.276 0.437 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.942 -15.116 -0.332 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.137 -16.009 -1.608 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.008 -17.442 -0.036 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.413 -16.405 1.318 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.905 -16.918 0.718 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.265 -18.218 -0.268 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.039 -18.590 2.273 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.337 -18.553 0.736 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.074 -19.504 2.031 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.023 -19.871 3.890 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.744 -20.266 3.836 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.530 -15.229 -2.507 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.517 -15.973 -3.189 1.00 0.00 C ATOM 1559 C HIS A 103 -6.179 -15.371 -2.932 1.00 0.00 C ATOM 1560 O HIS A 103 -5.134 -16.017 -2.867 1.00 0.00 O ATOM 1561 CB HIS A 103 -7.795 -16.048 -4.700 1.00 0.00 C ATOM 1562 CG HIS A 103 -7.083 -17.116 -5.476 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -5.745 -17.043 -5.808 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -7.491 -18.323 -5.952 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -5.410 -18.218 -6.405 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -6.431 -19.054 -6.449 1.00 0.00 N ATOM 0 H HIS A 103 -9.084 -14.619 -3.108 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.528 -16.992 -2.802 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.867 -16.187 -4.840 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -7.539 -15.084 -5.139 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -8.515 -18.666 -5.942 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -4.428 -18.440 -6.796 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -6.435 -20.020 -6.776 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.118 -14.028 -2.961 1.00 0.00 N ATOM 1575 CA VAL A 104 -4.970 -13.236 -2.645 1.00 0.00 C ATOM 1576 C VAL A 104 -4.516 -13.486 -1.248 1.00 0.00 C ATOM 1577 O VAL A 104 -3.325 -13.615 -0.972 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.235 -11.771 -2.831 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.092 -10.884 -2.310 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -5.497 -11.588 -4.335 1.00 0.00 C ATOM 0 H VAL A 104 -6.923 -13.459 -3.222 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.182 -13.534 -3.337 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.093 -11.450 -2.241 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.342 -9.836 -2.472 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -3.950 -11.062 -1.244 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.173 -11.125 -2.844 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.699 -10.537 -4.544 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.621 -11.908 -4.899 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.358 -12.188 -4.630 1.00 0.00 H new ATOM 1590 N MET A 105 -5.491 -13.671 -0.340 1.00 0.00 N ATOM 1591 CA MET A 105 -5.199 -13.849 1.049 1.00 0.00 C ATOM 1592 C MET A 105 -4.551 -15.173 1.262 1.00 0.00 C ATOM 1593 O MET A 105 -3.601 -15.323 2.029 1.00 0.00 O ATOM 1594 CB MET A 105 -6.429 -13.856 1.973 1.00 0.00 C ATOM 1595 CG MET A 105 -7.021 -12.454 2.128 1.00 0.00 C ATOM 1596 SD MET A 105 -6.359 -11.324 3.389 1.00 0.00 S ATOM 1597 CE MET A 105 -6.973 -9.771 2.676 1.00 0.00 C ATOM 0 H MET A 105 -6.485 -13.697 -0.569 1.00 0.00 H new ATOM 0 HA MET A 105 -4.569 -12.996 1.301 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.185 -14.529 1.569 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.148 -14.244 2.952 1.00 0.00 H new ATOM 0 HG2 MET A 105 -6.928 -11.954 1.164 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.087 -12.572 2.325 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.526 -8.927 3.202 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.704 -9.724 1.621 1.00 0.00 H new ATOM 0 HE3 MET A 105 -8.058 -9.728 2.777 1.00 0.00 H new ATOM 1607 N THR A 106 -4.939 -16.103 0.371 1.00 0.00 N ATOM 1608 CA THR A 106 -4.330 -17.387 0.214 1.00 0.00 C ATOM 1609 C THR A 106 -2.908 -17.310 -0.225 1.00 0.00 C ATOM 1610 O THR A 106 -2.007 -17.845 0.419 1.00 0.00 O ATOM 1611 CB THR A 106 -5.126 -18.430 -0.513 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.481 -18.426 -0.086 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.634 -19.865 -0.257 1.00 0.00 C ATOM 0 H THR A 106 -5.716 -15.951 -0.272 1.00 0.00 H new ATOM 0 HA THR A 106 -4.326 -17.774 1.233 1.00 0.00 H new ATOM 0 HB THR A 106 -5.012 -18.171 -1.565 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.894 -17.568 -0.317 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.255 -20.567 -0.814 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.598 -19.958 -0.584 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.700 -20.088 0.808 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.491 -16.523 -1.232 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.123 -16.369 -1.618 1.00 0.00 C ATOM 1623 C ASN A 107 -0.248 -15.615 -0.676 1.00 0.00 C ATOM 1624 O ASN A 107 0.950 -15.883 -0.602 1.00 0.00 O ATOM 1625 CB ASN A 107 -0.972 -15.756 -3.021 1.00 0.00 C ATOM 1626 CG ASN A 107 -1.953 -16.349 -4.022 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.625 -15.579 -4.706 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -2.120 -17.695 -4.120 1.00 0.00 N ATOM 0 H ASN A 107 -3.133 -15.971 -1.801 1.00 0.00 H new ATOM 0 HA ASN A 107 -0.771 -17.401 -1.605 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -1.124 -14.678 -2.962 1.00 0.00 H new ATOM 0 HB3 ASN A 107 0.046 -15.915 -3.376 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.810 -18.078 -4.767 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -1.556 -18.322 -3.547 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.708 -14.581 0.051 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.112 -13.864 1.136 1.00 0.00 C ATOM 1637 C LEU A 108 0.214 -14.768 2.275 1.00 0.00 C ATOM 1638 O LEU A 108 1.276 -14.752 2.896 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.035 -12.748 1.654 1.00 0.00 C ATOM 1640 CG LEU A 108 -1.292 -11.530 0.750 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -2.243 -10.569 1.483 1.00 0.00 C ATOM 1642 CD2 LEU A 108 0.050 -10.845 0.441 1.00 0.00 C ATOM 0 H LEU A 108 -1.630 -14.198 -0.157 1.00 0.00 H new ATOM 0 HA LEU A 108 0.805 -13.425 0.742 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.000 -13.198 1.887 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -0.619 -12.382 2.593 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.751 -11.834 -0.191 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -2.436 -9.699 0.855 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -3.183 -11.079 1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.785 -10.247 2.418 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.122 -9.980 -0.200 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.516 -10.521 1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.709 -11.548 -0.068 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.770 -15.641 2.555 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.803 -16.617 3.599 1.00 0.00 C ATOM 1656 C GLY A 109 -1.491 -16.115 4.821 1.00 0.00 C ATOM 1657 O GLY A 109 -0.910 -16.273 5.893 1.00 0.00 O ATOM 0 H GLY A 109 -1.623 -15.663 1.996 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.311 -17.512 3.240 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.216 -16.909 3.853 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.723 -15.584 4.722 1.00 0.00 N ATOM 1662 CA GLU A 110 -3.501 -15.173 5.849 1.00 0.00 C ATOM 1663 C GLU A 110 -4.630 -16.075 6.213 1.00 0.00 C ATOM 1664 O GLU A 110 -5.421 -16.439 5.345 1.00 0.00 O ATOM 1665 CB GLU A 110 -4.046 -13.764 5.562 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.004 -12.651 5.438 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.809 -12.103 6.845 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -2.419 -12.871 7.764 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.095 -10.918 7.164 1.00 0.00 O ATOM 0 H GLU A 110 -3.193 -15.436 3.829 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.832 -15.201 6.709 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.621 -13.801 4.636 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.741 -13.496 6.358 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.067 -13.036 5.036 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.346 -11.870 4.759 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.606 -16.609 7.447 1.00 0.00 N ATOM 1677 CA LYS A 111 -5.418 -17.719 7.840 1.00 0.00 C ATOM 1678 C LYS A 111 -6.795 -17.282 8.205 1.00 0.00 C ATOM 1679 O LYS A 111 -6.999 -16.991 9.382 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.821 -18.513 9.014 1.00 0.00 C ATOM 1681 CG LYS A 111 -3.528 -19.191 8.557 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.992 -20.050 9.705 1.00 0.00 C ATOM 1683 CE LYS A 111 -2.420 -19.295 10.906 1.00 0.00 C ATOM 1684 NZ LYS A 111 -1.194 -18.536 10.570 1.00 0.00 N ATOM 0 H LYS A 111 -4.005 -16.259 8.193 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.456 -18.375 6.970 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.620 -17.848 9.854 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.534 -19.260 9.363 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.715 -19.809 7.679 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.790 -18.442 8.269 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -3.799 -20.692 10.057 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.214 -20.703 9.309 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -3.174 -18.608 11.291 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -2.197 -20.004 11.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -0.848 -18.043 11.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.463 -19.191 10.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -1.409 -17.839 9.828 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.725 -17.220 7.235 1.00 0.00 N ATOM 1699 CA LEU A 112 -9.108 -16.901 7.408 1.00 0.00 C ATOM 1700 C LEU A 112 -10.063 -18.029 7.224 1.00 0.00 C ATOM 1701 O LEU A 112 -9.763 -18.929 6.440 1.00 0.00 O ATOM 1702 CB LEU A 112 -9.622 -15.773 6.498 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.783 -14.490 6.373 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -9.405 -13.542 5.335 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -8.479 -13.672 7.639 1.00 0.00 C ATOM 0 H LEU A 112 -7.492 -17.407 6.260 1.00 0.00 H new ATOM 0 HA LEU A 112 -9.098 -16.592 8.453 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.747 -16.186 5.497 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.613 -15.488 6.851 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.815 -14.895 6.078 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.800 -12.639 5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.441 -14.038 4.365 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.416 -13.276 5.645 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.879 -12.801 7.374 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.414 -13.344 8.093 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.928 -14.290 8.348 1.00 0.00 H new ATOM 1717 N THR A 113 -11.257 -17.861 7.819 1.00 0.00 N ATOM 1718 CA THR A 113 -12.444 -18.600 7.518 1.00 0.00 C ATOM 1719 C THR A 113 -13.374 -17.939 6.559 1.00 0.00 C ATOM 1720 O THR A 113 -13.065 -16.928 5.930 1.00 0.00 O ATOM 1721 CB THR A 113 -13.263 -18.946 8.726 1.00 0.00 C ATOM 1722 OG1 THR A 113 -13.775 -17.780 9.355 1.00 0.00 O ATOM 1723 CG2 THR A 113 -12.402 -19.560 9.842 1.00 0.00 C ATOM 0 H THR A 113 -11.402 -17.168 8.554 1.00 0.00 H new ATOM 0 HA THR A 113 -12.026 -19.497 7.060 1.00 0.00 H new ATOM 0 HB THR A 113 -14.033 -19.620 8.351 1.00 0.00 H new ATOM 0 HG1 THR A 113 -14.306 -18.037 10.137 1.00 0.00 H new ATOM 0 HG21 THR A 113 -13.032 -19.797 10.699 1.00 0.00 H new ATOM 0 HG22 THR A 113 -11.929 -20.472 9.477 1.00 0.00 H new ATOM 0 HG23 THR A 113 -11.634 -18.848 10.142 1.00 0.00 H new ATOM 1731 N ASP A 114 -14.569 -18.536 6.407 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.548 -17.962 5.536 1.00 0.00 C ATOM 1733 C ASP A 114 -16.209 -16.721 6.030 1.00 0.00 C ATOM 1734 O ASP A 114 -16.443 -15.804 5.244 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.539 -19.106 5.266 1.00 0.00 C ATOM 1736 CG ASP A 114 -16.081 -20.075 4.185 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.097 -20.833 4.395 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -16.658 -20.028 3.066 1.00 0.00 O ATOM 0 H ASP A 114 -14.854 -19.396 6.875 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.069 -17.591 4.630 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.701 -19.659 6.191 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.500 -18.681 4.976 1.00 0.00 H new ATOM 1743 N GLU A 115 -16.428 -16.758 7.356 1.00 0.00 N ATOM 1744 CA GLU A 115 -17.009 -15.693 8.113 1.00 0.00 C ATOM 1745 C GLU A 115 -16.169 -14.466 8.018 1.00 0.00 C ATOM 1746 O GLU A 115 -16.651 -13.413 7.605 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.991 -16.056 9.607 1.00 0.00 C ATOM 1748 CG GLU A 115 -17.573 -17.388 10.084 1.00 0.00 C ATOM 1749 CD GLU A 115 -16.687 -18.584 9.764 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -15.755 -18.890 10.555 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -16.945 -19.290 8.753 1.00 0.00 O ATOM 0 H GLU A 115 -16.189 -17.568 7.927 1.00 0.00 H new ATOM 0 HA GLU A 115 -18.015 -15.532 7.725 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.952 -16.022 9.935 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -17.519 -15.264 10.138 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -17.733 -17.341 11.161 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -18.550 -17.535 9.623 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.860 -14.656 8.259 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.778 -13.721 8.222 1.00 0.00 C ATOM 1760 C GLU A 116 -13.687 -12.892 6.987 1.00 0.00 C ATOM 1761 O GLU A 116 -13.486 -11.680 7.035 1.00 0.00 O ATOM 1762 CB GLU A 116 -12.441 -14.434 8.485 1.00 0.00 C ATOM 1763 CG GLU A 116 -12.273 -14.831 9.953 1.00 0.00 C ATOM 1764 CD GLU A 116 -12.276 -13.587 10.830 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -11.371 -12.721 10.694 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -13.169 -13.398 11.698 1.00 0.00 O ATOM 0 H GLU A 116 -14.522 -15.585 8.512 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.998 -13.012 9.020 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -12.378 -15.325 7.861 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.619 -13.781 8.191 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -13.080 -15.500 10.253 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.340 -15.378 10.086 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.910 -13.632 5.886 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.888 -13.140 4.543 1.00 0.00 C ATOM 1775 C VAL A 117 -15.018 -12.210 4.263 1.00 0.00 C ATOM 1776 O VAL A 117 -14.827 -11.064 3.858 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.807 -14.276 3.567 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.371 -13.894 2.188 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.330 -14.694 3.477 1.00 0.00 C ATOM 0 H VAL A 117 -14.117 -14.629 5.936 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.986 -12.542 4.417 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.420 -15.109 3.912 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.292 -14.747 1.514 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.418 -13.608 2.290 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.804 -13.057 1.782 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.228 -15.521 2.774 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.733 -13.849 3.132 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.980 -15.008 4.460 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.279 -12.613 4.504 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.409 -11.795 4.188 1.00 0.00 C ATOM 1791 C ASP A 118 -17.482 -10.583 5.052 1.00 0.00 C ATOM 1792 O ASP A 118 -17.876 -9.503 4.613 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.661 -12.682 4.294 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.804 -11.861 3.715 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -19.703 -11.390 2.551 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.758 -11.534 4.471 1.00 0.00 O ATOM 0 H ASP A 118 -16.517 -13.513 4.921 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.324 -11.404 3.174 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.529 -13.612 3.741 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.861 -12.953 5.331 1.00 0.00 H new ATOM 1801 N GLU A 119 -17.112 -10.690 6.340 1.00 0.00 N ATOM 1802 CA GLU A 119 -17.074 -9.634 7.304 1.00 0.00 C ATOM 1803 C GLU A 119 -16.224 -8.432 7.075 1.00 0.00 C ATOM 1804 O GLU A 119 -16.564 -7.287 7.370 1.00 0.00 O ATOM 1805 CB GLU A 119 -16.539 -10.281 8.592 1.00 0.00 C ATOM 1806 CG GLU A 119 -16.613 -9.476 9.891 1.00 0.00 C ATOM 1807 CD GLU A 119 -15.843 -10.101 11.046 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -14.585 -10.043 11.001 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -16.388 -10.679 12.023 1.00 0.00 O ATOM 0 H GLU A 119 -16.817 -11.582 6.737 1.00 0.00 H new ATOM 0 HA GLU A 119 -18.088 -9.234 7.293 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -17.082 -11.213 8.747 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -15.495 -10.545 8.423 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -16.226 -8.474 9.709 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -17.658 -9.366 10.180 1.00 0.00 H new ATOM 1816 N MET A 120 -15.079 -8.721 6.432 1.00 0.00 N ATOM 1817 CA MET A 120 -14.012 -7.937 5.893 1.00 0.00 C ATOM 1818 C MET A 120 -14.509 -7.137 4.738 1.00 0.00 C ATOM 1819 O MET A 120 -14.386 -5.917 4.653 1.00 0.00 O ATOM 1820 CB MET A 120 -12.833 -8.821 5.452 1.00 0.00 C ATOM 1821 CG MET A 120 -11.553 -8.066 5.085 1.00 0.00 C ATOM 1822 SD MET A 120 -10.014 -9.032 5.130 1.00 0.00 S ATOM 1823 CE MET A 120 -8.970 -7.587 4.782 1.00 0.00 C ATOM 0 H MET A 120 -14.872 -9.705 6.262 1.00 0.00 H new ATOM 0 HA MET A 120 -13.654 -7.267 6.675 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.605 -9.522 6.255 1.00 0.00 H new ATOM 0 HB3 MET A 120 -13.146 -9.413 4.592 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.672 -7.657 4.082 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.447 -7.220 5.764 1.00 0.00 H new ATOM 0 HE1 MET A 120 -7.922 -7.852 4.924 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.126 -7.265 3.753 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.234 -6.776 5.460 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.161 -7.767 3.745 1.00 0.00 N ATOM 1834 CA ILE A 121 -15.715 -7.029 2.653 1.00 0.00 C ATOM 1835 C ILE A 121 -16.860 -6.128 2.964 1.00 0.00 C ATOM 1836 O ILE A 121 -17.038 -5.080 2.344 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.146 -7.915 1.522 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.030 -8.781 0.913 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -16.746 -7.139 0.337 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -13.846 -8.111 0.217 1.00 0.00 C ATOM 0 H ILE A 121 -15.304 -8.776 3.697 1.00 0.00 H new ATOM 0 HA ILE A 121 -14.872 -6.396 2.377 1.00 0.00 H new ATOM 0 HB ILE A 121 -16.886 -8.548 2.012 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.628 -9.403 1.712 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -15.496 -9.451 0.191 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -17.037 -7.839 -0.446 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -17.622 -6.584 0.672 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -16.004 -6.443 -0.055 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -13.160 -8.875 -0.150 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -14.207 -7.514 -0.621 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -13.326 -7.466 0.925 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.644 -6.522 3.983 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.772 -5.888 4.593 1.00 0.00 C ATOM 1854 C ARG A 122 -18.362 -4.688 5.375 1.00 0.00 C ATOM 1855 O ARG A 122 -19.017 -3.647 5.352 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.615 -6.769 5.530 1.00 0.00 C ATOM 1857 CG ARG A 122 -21.063 -6.407 5.866 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.646 -7.330 6.938 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.577 -8.780 6.599 1.00 0.00 N ATOM 1860 CZ ARG A 122 -21.306 -9.732 7.538 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -21.541 -9.616 8.878 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -20.732 -10.855 7.015 1.00 0.00 N ATOM 0 H ARG A 122 -17.455 -7.414 4.441 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.396 -5.633 3.736 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.629 -7.770 5.099 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -19.076 -6.836 6.475 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -21.108 -5.374 6.212 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.672 -6.468 4.964 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -21.115 -7.162 7.875 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -22.687 -7.057 7.109 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.738 -9.070 5.634 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -21.953 -8.761 9.251 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -21.304 -10.384 9.506 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -20.549 -10.915 6.013 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -20.486 -11.634 7.626 1.00 0.00 H new ATOM 1876 N GLU A 123 -17.213 -4.788 6.066 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.474 -3.683 6.594 1.00 0.00 C ATOM 1878 C GLU A 123 -16.070 -2.618 5.633 1.00 0.00 C ATOM 1879 O GLU A 123 -16.238 -1.433 5.918 1.00 0.00 O ATOM 1880 CB GLU A 123 -15.197 -4.200 7.278 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.731 -3.360 8.469 1.00 0.00 C ATOM 1882 CD GLU A 123 -13.308 -3.717 8.875 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -13.106 -4.687 9.653 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -12.349 -3.005 8.475 1.00 0.00 O ATOM 0 H GLU A 123 -16.776 -5.688 6.267 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.177 -3.209 7.279 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -15.369 -5.222 7.615 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -14.395 -4.238 6.541 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.784 -2.302 8.213 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.403 -3.518 9.313 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.464 -3.000 4.495 1.00 0.00 N ATOM 1892 CA ALA A 124 -14.962 -2.137 3.471 1.00 0.00 C ATOM 1893 C ALA A 124 -15.951 -1.397 2.637 1.00 0.00 C ATOM 1894 O ALA A 124 -15.651 -0.402 1.980 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.128 -3.043 2.550 1.00 0.00 C ATOM 0 H ALA A 124 -15.314 -3.985 4.275 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.420 -1.339 3.978 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -13.709 -2.449 1.738 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.319 -3.497 3.122 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -14.764 -3.826 2.137 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.183 -1.933 2.563 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.215 -1.427 1.712 1.00 0.00 C ATOM 1903 C ASP A 125 -18.948 -0.286 2.330 1.00 0.00 C ATOM 1904 O ASP A 125 -19.236 -0.290 3.526 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.056 -2.697 1.500 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.317 -2.490 0.673 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.262 -1.946 -0.462 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.421 -2.736 1.228 1.00 0.00 O ATOM 0 H ASP A 125 -17.470 -2.743 3.112 1.00 0.00 H new ATOM 0 HA ASP A 125 -17.875 -0.983 0.777 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.437 -3.450 1.012 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.337 -3.098 2.474 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.305 0.753 1.554 1.00 0.00 N ATOM 1914 CA ILE A 126 -19.927 1.982 1.938 1.00 0.00 C ATOM 1915 C ILE A 126 -21.300 1.964 1.359 1.00 0.00 C ATOM 1916 O ILE A 126 -22.261 1.796 2.109 1.00 0.00 O ATOM 1917 CB ILE A 126 -19.206 3.206 1.457 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -17.739 3.142 1.913 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -19.922 4.400 2.110 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -16.972 4.378 1.445 1.00 0.00 C ATOM 0 H ILE A 126 -19.138 0.725 0.548 1.00 0.00 H new ATOM 0 HA ILE A 126 -19.921 2.044 3.026 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.214 3.291 0.370 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -17.694 3.070 3.000 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.268 2.243 1.514 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -19.442 5.327 1.798 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -20.967 4.411 1.801 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -19.865 4.309 3.195 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -15.936 4.312 1.779 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.000 4.433 0.357 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -17.432 5.272 1.865 1.00 0.00 H new ATOM 1932 N ASP A 127 -21.427 1.965 0.020 1.00 0.00 N ATOM 1933 CA ASP A 127 -22.670 1.890 -0.684 1.00 0.00 C ATOM 1934 C ASP A 127 -23.638 0.828 -0.290 1.00 0.00 C ATOM 1935 O ASP A 127 -24.830 1.110 -0.169 1.00 0.00 O ATOM 1936 CB ASP A 127 -22.402 2.014 -2.193 1.00 0.00 C ATOM 1937 CG ASP A 127 -21.663 0.818 -2.774 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.034 -0.376 -2.615 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -20.513 1.010 -3.252 1.00 0.00 O ATOM 0 H ASP A 127 -20.622 2.021 -0.603 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.253 2.749 -0.351 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -23.351 2.134 -2.715 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -21.820 2.917 -2.378 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.272 -0.460 -0.162 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.218 -1.471 0.198 1.00 0.00 C ATOM 1946 C GLY A 128 -24.438 -2.536 -0.821 1.00 0.00 C ATOM 1947 O GLY A 128 -25.263 -3.433 -0.655 1.00 0.00 O ATOM 0 H GLY A 128 -22.322 -0.801 -0.308 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.886 -1.941 1.124 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.174 -0.991 0.409 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.642 -2.550 -1.905 1.00 0.00 N ATOM 1952 CA ASP A 129 -23.604 -3.605 -2.869 1.00 0.00 C ATOM 1953 C ASP A 129 -22.926 -4.847 -2.404 1.00 0.00 C ATOM 1954 O ASP A 129 -23.246 -5.965 -2.805 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.236 -3.153 -4.293 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.785 -2.707 -4.406 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -20.950 -2.839 -3.472 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.430 -2.223 -5.513 1.00 0.00 O ATOM 0 H ASP A 129 -22.995 -1.791 -2.119 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.645 -3.913 -2.964 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.416 -3.972 -4.989 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -23.889 -2.333 -4.591 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.911 -4.703 -1.533 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.069 -5.728 -0.999 1.00 0.00 C ATOM 1965 C GLY A 130 -19.883 -6.066 -1.835 1.00 0.00 C ATOM 1966 O GLY A 130 -19.201 -7.061 -1.596 1.00 0.00 O ATOM 0 H GLY A 130 -21.658 -3.784 -1.171 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.723 -5.417 -0.013 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.664 -6.630 -0.858 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.541 -5.182 -2.790 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.299 -5.266 -3.492 1.00 0.00 C ATOM 1972 C GLN A 131 -17.515 -4.032 -3.203 1.00 0.00 C ATOM 1973 O GLN A 131 -18.050 -3.194 -2.478 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.517 -5.296 -5.015 1.00 0.00 C ATOM 1975 CG GLN A 131 -18.709 -6.722 -5.534 1.00 0.00 C ATOM 1976 CD GLN A 131 -18.498 -6.803 -7.039 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -17.509 -7.438 -7.401 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -19.437 -6.340 -7.908 1.00 0.00 N ATOM 0 H GLN A 131 -20.132 -4.402 -3.077 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.791 -6.176 -3.173 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.391 -4.696 -5.269 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.662 -4.840 -5.514 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.010 -7.390 -5.031 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.713 -7.068 -5.288 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -20.241 -5.818 -7.560 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -19.337 -6.515 -8.908 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.237 -3.898 -3.602 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.373 -2.830 -3.207 1.00 0.00 C ATOM 1989 C VAL A 132 -15.009 -2.149 -4.482 1.00 0.00 C ATOM 1990 O VAL A 132 -14.336 -2.803 -5.277 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.224 -3.336 -2.387 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -12.906 -2.557 -2.537 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -14.553 -3.531 -0.898 1.00 0.00 C ATOM 0 H VAL A 132 -15.786 -4.565 -4.228 1.00 0.00 H new ATOM 0 HA VAL A 132 -15.839 -2.109 -2.535 1.00 0.00 H new ATOM 0 HB VAL A 132 -14.055 -4.317 -2.831 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.143 -3.007 -1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.579 -2.592 -3.576 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -13.061 -1.520 -2.240 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -13.670 -3.899 -0.375 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -14.860 -2.579 -0.466 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -15.362 -4.254 -0.796 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.333 -0.869 -4.735 1.00 0.00 N ATOM 2004 CA ASN A 133 -14.778 -0.149 -5.839 1.00 0.00 C ATOM 2005 C ASN A 133 -13.554 0.625 -5.487 1.00 0.00 C ATOM 2006 O ASN A 133 -13.020 0.448 -4.393 1.00 0.00 O ATOM 2007 CB ASN A 133 -15.899 0.691 -6.473 1.00 0.00 C ATOM 2008 CG ASN A 133 -16.331 1.856 -5.594 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -15.767 2.911 -5.310 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -17.615 1.739 -5.160 1.00 0.00 N ATOM 0 H ASN A 133 -15.986 -0.328 -4.169 1.00 0.00 H new ATOM 0 HA ASN A 133 -14.408 -0.853 -6.585 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -15.560 1.074 -7.436 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -16.759 0.051 -6.670 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.047 2.500 -4.636 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.145 0.891 -5.359 1.00 0.00 H new ATOM 2017 N TYR A 134 -12.958 1.454 -6.363 1.00 0.00 N ATOM 2018 CA TYR A 134 -11.707 2.098 -6.106 1.00 0.00 C ATOM 2019 C TYR A 134 -11.806 3.190 -5.097 1.00 0.00 C ATOM 2020 O TYR A 134 -11.044 3.235 -4.132 1.00 0.00 O ATOM 2021 CB TYR A 134 -11.117 2.631 -7.422 1.00 0.00 C ATOM 2022 CG TYR A 134 -9.709 3.116 -7.395 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -8.628 2.277 -7.529 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -9.490 4.473 -7.356 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -7.388 2.811 -7.790 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -8.211 4.976 -7.407 1.00 0.00 C ATOM 2027 CZ TYR A 134 -7.138 4.157 -7.668 1.00 0.00 C ATOM 2028 OH TYR A 134 -5.843 4.713 -7.739 1.00 0.00 O ATOM 0 H TYR A 134 -13.356 1.682 -7.274 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.042 1.347 -5.678 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.186 1.839 -8.167 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -11.749 3.449 -7.767 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -8.752 1.209 -7.430 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -10.329 5.149 -7.285 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -6.588 2.154 -8.099 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -8.047 6.030 -7.239 1.00 0.00 H new ATOM 0 HH TYR A 134 -5.898 5.685 -7.628 1.00 0.00 H new ATOM 2038 N GLU A 135 -12.858 4.026 -5.038 1.00 0.00 N ATOM 2039 CA GLU A 135 -13.106 5.005 -4.025 1.00 0.00 C ATOM 2040 C GLU A 135 -13.247 4.371 -2.684 1.00 0.00 C ATOM 2041 O GLU A 135 -12.680 4.830 -1.694 1.00 0.00 O ATOM 2042 CB GLU A 135 -14.289 5.965 -4.235 1.00 0.00 C ATOM 2043 CG GLU A 135 -14.125 6.909 -5.428 1.00 0.00 C ATOM 2044 CD GLU A 135 -15.283 7.890 -5.539 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -16.352 7.517 -6.092 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -15.183 9.110 -5.239 1.00 0.00 O ATOM 0 H GLU A 135 -13.588 4.016 -5.751 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.216 5.631 -4.096 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.198 5.379 -4.371 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -14.425 6.559 -3.331 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -13.190 7.461 -5.329 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.055 6.325 -6.346 1.00 0.00 H new ATOM 2053 N GLU A 136 -13.898 3.196 -2.602 1.00 0.00 N ATOM 2054 CA GLU A 136 -13.866 2.408 -1.410 1.00 0.00 C ATOM 2055 C GLU A 136 -12.538 1.935 -0.926 1.00 0.00 C ATOM 2056 O GLU A 136 -12.102 1.904 0.223 1.00 0.00 O ATOM 2057 CB GLU A 136 -14.931 1.303 -1.512 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.389 1.759 -1.605 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.421 0.674 -1.880 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.266 -0.149 -2.822 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -18.503 0.686 -1.235 1.00 0.00 O ATOM 0 H GLU A 136 -14.446 2.792 -3.362 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.115 3.091 -0.598 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -14.708 0.696 -2.389 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -14.832 0.654 -0.642 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -16.653 2.253 -0.670 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -16.463 2.509 -2.393 1.00 0.00 H new ATOM 2068 N PHE A 137 -11.696 1.545 -1.900 1.00 0.00 N ATOM 2069 CA PHE A 137 -10.377 1.045 -1.663 1.00 0.00 C ATOM 2070 C PHE A 137 -9.429 2.090 -1.185 1.00 0.00 C ATOM 2071 O PHE A 137 -8.687 1.856 -0.233 1.00 0.00 O ATOM 2072 CB PHE A 137 -9.797 0.521 -2.988 1.00 0.00 C ATOM 2073 CG PHE A 137 -8.597 -0.332 -2.757 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -8.765 -1.630 -2.338 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -7.340 0.173 -2.996 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.688 -2.480 -2.237 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.260 -0.655 -2.803 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.428 -1.976 -2.460 1.00 0.00 C ATOM 0 H PHE A 137 -11.943 1.579 -2.889 1.00 0.00 H new ATOM 0 HA PHE A 137 -10.476 0.275 -0.898 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -10.557 -0.053 -3.518 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -9.530 1.362 -3.628 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.753 -1.986 -2.085 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -7.205 1.192 -3.326 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.829 -3.521 -1.988 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -5.262 -0.261 -2.923 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.567 -2.621 -2.365 1.00 0.00 H new ATOM 2088 N VAL A 138 -9.498 3.327 -1.709 1.00 0.00 N ATOM 2089 CA VAL A 138 -8.723 4.437 -1.249 1.00 0.00 C ATOM 2090 C VAL A 138 -8.950 4.852 0.164 1.00 0.00 C ATOM 2091 O VAL A 138 -8.052 5.216 0.921 1.00 0.00 O ATOM 2092 CB VAL A 138 -8.912 5.564 -2.221 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -8.020 6.755 -1.828 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -8.368 5.064 -3.570 1.00 0.00 C ATOM 0 H VAL A 138 -10.118 3.563 -2.484 1.00 0.00 H new ATOM 0 HA VAL A 138 -7.682 4.115 -1.222 1.00 0.00 H new ATOM 0 HB VAL A 138 -9.960 5.863 -2.247 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.164 7.568 -2.540 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -8.288 7.096 -0.828 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -6.975 6.446 -1.838 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.480 5.847 -4.320 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.313 4.810 -3.465 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -8.925 4.180 -3.882 1.00 0.00 H new ATOM 2104 N GLN A 139 -10.225 4.853 0.594 1.00 0.00 N ATOM 2105 CA GLN A 139 -10.726 5.222 1.881 1.00 0.00 C ATOM 2106 C GLN A 139 -10.118 4.665 3.122 1.00 0.00 C ATOM 2107 O GLN A 139 -9.829 5.256 4.161 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.257 5.080 1.909 1.00 0.00 C ATOM 2109 CG GLN A 139 -12.863 6.043 2.932 1.00 0.00 C ATOM 2110 CD GLN A 139 -12.656 7.530 2.684 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -11.824 8.173 3.321 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -13.324 8.129 1.661 1.00 0.00 N ATOM 0 H GLN A 139 -10.981 4.565 -0.027 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.388 6.256 1.951 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -12.666 5.286 0.920 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -12.529 4.055 2.160 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.935 5.854 2.983 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -12.450 5.802 3.911 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -14.016 7.603 1.127 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -13.133 9.103 1.428 1.00 0.00 H new ATOM 2121 N MET A 140 -9.816 3.354 3.114 1.00 0.00 N ATOM 2122 CA MET A 140 -9.343 2.482 4.145 1.00 0.00 C ATOM 2123 C MET A 140 -7.953 2.828 4.554 1.00 0.00 C ATOM 2124 O MET A 140 -7.552 2.726 5.712 1.00 0.00 O ATOM 2125 CB MET A 140 -9.359 1.032 3.634 1.00 0.00 C ATOM 2126 CG MET A 140 -10.792 0.573 3.355 1.00 0.00 C ATOM 2127 SD MET A 140 -11.078 -1.221 3.283 1.00 0.00 S ATOM 2128 CE MET A 140 -10.545 -1.541 1.576 1.00 0.00 C ATOM 0 H MET A 140 -9.923 2.831 2.245 1.00 0.00 H new ATOM 0 HA MET A 140 -9.999 2.594 5.008 1.00 0.00 H new ATOM 0 HB2 MET A 140 -8.764 0.955 2.724 1.00 0.00 H new ATOM 0 HB3 MET A 140 -8.899 0.376 4.373 1.00 0.00 H new ATOM 0 HG2 MET A 140 -11.439 0.989 4.127 1.00 0.00 H new ATOM 0 HG3 MET A 140 -11.109 1.006 2.406 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.103 -2.386 1.173 1.00 0.00 H new ATOM 0 HE2 MET A 140 -10.732 -0.658 0.965 1.00 0.00 H new ATOM 0 HE3 MET A 140 -9.480 -1.771 1.565 1.00 0.00 H new ATOM 2138 N MET A 141 -7.115 3.365 3.649 1.00 0.00 N ATOM 2139 CA MET A 141 -5.732 3.680 3.824 1.00 0.00 C ATOM 2140 C MET A 141 -5.488 4.992 4.486 1.00 0.00 C ATOM 2141 O MET A 141 -4.469 5.206 5.141 1.00 0.00 O ATOM 2142 CB MET A 141 -5.083 3.499 2.441 1.00 0.00 C ATOM 2143 CG MET A 141 -5.585 2.312 1.616 1.00 0.00 C ATOM 2144 SD MET A 141 -5.119 0.725 2.370 1.00 0.00 S ATOM 2145 CE MET A 141 -5.786 -0.173 0.939 1.00 0.00 C ATOM 0 H MET A 141 -7.438 3.599 2.710 1.00 0.00 H new ATOM 0 HA MET A 141 -5.259 3.007 4.539 1.00 0.00 H new ATOM 0 HB2 MET A 141 -5.242 4.410 1.865 1.00 0.00 H new ATOM 0 HB3 MET A 141 -4.007 3.392 2.578 1.00 0.00 H new ATOM 0 HG2 MET A 141 -6.670 2.366 1.523 1.00 0.00 H new ATOM 0 HG3 MET A 141 -5.175 2.370 0.608 1.00 0.00 H new ATOM 0 HE1 MET A 141 -5.652 -1.245 1.087 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.848 0.049 0.833 1.00 0.00 H new ATOM 0 HE3 MET A 141 -5.259 0.137 0.037 1.00 0.00 H new ATOM 2155 N THR A 142 -6.474 5.901 4.377 1.00 0.00 N ATOM 2156 CA THR A 142 -6.524 7.221 4.926 1.00 0.00 C ATOM 2157 C THR A 142 -6.589 7.202 6.446 1.00 0.00 C ATOM 2158 O THR A 142 -5.703 7.845 7.071 1.00 0.00 O ATOM 2159 CB THR A 142 -7.665 8.052 4.418 1.00 0.00 C ATOM 2160 OG1 THR A 142 -7.467 8.348 3.044 1.00 0.00 O ATOM 2161 CG2 THR A 142 -7.680 9.395 5.168 1.00 0.00 C ATOM 0 H THR A 142 -7.321 5.687 3.850 1.00 0.00 H new ATOM 0 HA THR A 142 -5.595 7.682 4.591 1.00 0.00 H new ATOM 0 HB THR A 142 -8.594 7.501 4.566 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.215 8.889 2.715 1.00 0.00 H new ATOM 0 HG21 THR A 142 -8.507 10.005 4.805 1.00 0.00 H new ATOM 0 HG22 THR A 142 -7.804 9.214 6.236 1.00 0.00 H new ATOM 0 HG23 THR A 142 -6.740 9.918 4.996 1.00 0.00 H new ATOM 2170 N ARG B 1 -10.707 -1.611 9.970 1.00 0.00 N ATOM 2171 CA ARG B 1 -9.886 -1.994 11.141 1.00 0.00 C ATOM 2172 C ARG B 1 -8.799 -2.966 10.836 1.00 0.00 C ATOM 2173 O ARG B 1 -8.246 -2.984 9.737 1.00 0.00 O ATOM 2174 CB ARG B 1 -10.929 -2.504 12.151 1.00 0.00 C ATOM 2175 CG ARG B 1 -12.077 -1.542 12.462 1.00 0.00 C ATOM 2176 CD ARG B 1 -13.128 -1.992 13.479 1.00 0.00 C ATOM 2177 NE ARG B 1 -14.358 -1.157 13.378 1.00 0.00 N ATOM 2178 CZ ARG B 1 -15.466 -1.609 12.722 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -15.584 -2.761 11.999 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -16.598 -0.848 12.790 1.00 0.00 N ATOM 0 H1 ARG B 1 -11.223 -0.733 10.180 1.00 0.00 H new ATOM 0 H2 ARG B 1 -10.089 -1.461 9.147 1.00 0.00 H new ATOM 0 H3 ARG B 1 -11.386 -2.370 9.759 1.00 0.00 H new ATOM 0 HA ARG B 1 -9.306 -1.158 11.532 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -11.352 -3.434 11.771 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -10.418 -2.744 13.083 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -11.644 -0.608 12.819 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -12.590 -1.319 11.526 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -13.379 -3.039 13.309 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -12.718 -1.922 14.487 1.00 0.00 H new ATOM 0 HE ARG B 1 -14.372 -0.232 13.807 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -14.786 -3.389 11.907 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -16.470 -2.993 11.551 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -16.595 0.025 13.318 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -17.447 -1.152 12.313 1.00 0.00 H new ATOM 2193 N ARG B 2 -8.369 -3.698 11.879 1.00 0.00 N ATOM 2194 CA ARG B 2 -7.245 -4.573 12.008 1.00 0.00 C ATOM 2195 C ARG B 2 -6.839 -5.231 10.735 1.00 0.00 C ATOM 2196 O ARG B 2 -5.687 -5.170 10.307 1.00 0.00 O ATOM 2197 CB ARG B 2 -7.512 -5.598 13.123 1.00 0.00 C ATOM 2198 CG ARG B 2 -6.214 -6.302 13.524 1.00 0.00 C ATOM 2199 CD ARG B 2 -6.363 -7.320 14.656 1.00 0.00 C ATOM 2200 NE ARG B 2 -5.139 -8.059 15.074 1.00 0.00 N ATOM 2201 CZ ARG B 2 -5.081 -8.897 16.150 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -6.220 -9.349 16.751 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -3.863 -9.363 16.555 1.00 0.00 N ATOM 0 H ARG B 2 -8.889 -3.667 12.756 1.00 0.00 H new ATOM 0 HA ARG B 2 -6.390 -3.955 12.282 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -7.944 -5.098 13.990 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -8.241 -6.333 12.783 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -5.806 -6.809 12.649 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -5.486 -5.549 13.824 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -6.757 -6.799 15.529 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -7.113 -8.052 14.355 1.00 0.00 H new ATOM 0 HE ARG B 2 -4.291 -7.931 14.522 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -7.132 -9.061 16.397 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -6.159 -9.975 17.554 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -3.018 -9.084 16.056 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -3.798 -9.990 17.357 1.00 0.00 H new ATOM 2217 N LYS B 3 -7.736 -5.937 10.024 1.00 0.00 N ATOM 2218 CA LYS B 3 -7.492 -6.854 8.954 1.00 0.00 C ATOM 2219 C LYS B 3 -7.138 -6.114 7.710 1.00 0.00 C ATOM 2220 O LYS B 3 -6.259 -6.554 6.972 1.00 0.00 O ATOM 2221 CB LYS B 3 -8.692 -7.785 8.714 1.00 0.00 C ATOM 2222 CG LYS B 3 -9.056 -8.597 9.958 1.00 0.00 C ATOM 2223 CD LYS B 3 -10.009 -9.773 9.736 1.00 0.00 C ATOM 2224 CE LYS B 3 -11.459 -9.312 9.571 1.00 0.00 C ATOM 2225 NZ LYS B 3 -12.365 -10.480 9.484 1.00 0.00 N ATOM 0 H LYS B 3 -8.733 -5.855 10.221 1.00 0.00 H new ATOM 0 HA LYS B 3 -6.649 -7.483 9.241 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -9.553 -7.192 8.406 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -8.463 -8.465 7.893 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -8.136 -8.979 10.400 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -9.505 -7.924 10.688 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -9.701 -10.327 8.849 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -9.941 -10.460 10.580 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -11.746 -8.683 10.414 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -11.554 -8.703 8.672 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -13.212 -10.306 10.061 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -12.645 -10.629 8.494 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -11.874 -11.327 9.836 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.801 -4.973 7.449 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.427 -4.169 6.326 1.00 0.00 C ATOM 2241 C TRP B 4 -6.187 -3.364 6.510 1.00 0.00 C ATOM 2242 O TRP B 4 -5.423 -3.052 5.597 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.550 -3.185 5.957 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.651 -3.921 5.231 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.875 -4.250 5.739 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.592 -4.348 3.857 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.613 -4.827 4.740 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -10.849 -4.907 3.600 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -8.665 -4.255 2.855 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.198 -5.341 2.351 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.038 -4.646 1.590 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -10.294 -5.144 1.334 1.00 0.00 C ATOM 0 H TRP B 4 -8.579 -4.612 8.001 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.239 -4.898 5.538 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.946 -2.715 6.857 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.156 -2.387 5.328 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.204 -4.084 6.754 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.578 -5.147 4.828 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -7.669 -3.885 3.052 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.149 -5.821 2.170 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -8.329 -4.560 0.780 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -10.574 -5.384 0.319 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.933 -2.863 7.732 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.713 -2.223 8.115 1.00 0.00 C ATOM 2265 C GLN B 5 -3.457 -2.944 7.765 1.00 0.00 C ATOM 2266 O GLN B 5 -2.604 -2.474 7.015 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.666 -1.782 9.588 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.540 -0.573 9.927 1.00 0.00 C ATOM 2269 CD GLN B 5 -6.012 -0.474 11.370 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -7.047 0.171 11.526 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -5.269 -1.092 12.328 1.00 0.00 N ATOM 0 H GLN B 5 -6.613 -2.907 8.491 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.741 -1.333 7.487 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -4.973 -2.621 10.213 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.634 -1.550 9.850 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -4.983 0.332 9.685 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -6.417 -0.591 9.279 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -4.423 -1.600 12.069 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -5.558 -1.047 13.305 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.273 -4.182 8.259 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.176 -5.062 8.000 1.00 0.00 C ATOM 2282 C LYS B 6 -1.904 -5.283 6.551 1.00 0.00 C ATOM 2283 O LYS B 6 -0.835 -5.252 5.944 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.477 -6.414 8.669 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.268 -7.349 8.743 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.820 -8.752 9.005 1.00 0.00 C ATOM 2287 CE LYS B 6 -0.684 -9.776 8.966 1.00 0.00 C ATOM 2288 NZ LYS B 6 -1.153 -11.056 9.543 1.00 0.00 N ATOM 0 H LYS B 6 -3.952 -4.601 8.894 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.282 -4.590 8.408 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.848 -6.235 9.678 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.276 -6.911 8.119 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -0.700 -7.323 7.813 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.590 -7.044 9.540 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -2.315 -8.782 9.976 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.572 -9.002 8.256 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -0.352 -9.928 7.939 1.00 0.00 H new ATOM 0 HE3 LYS B 6 0.174 -9.405 9.527 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -0.411 -11.455 10.153 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -2.011 -10.889 10.106 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.367 -11.725 8.776 1.00 0.00 H new ATOM 2302 N THR B 7 -3.066 -5.527 5.919 1.00 0.00 N ATOM 2303 CA THR B 7 -2.987 -5.855 4.530 1.00 0.00 C ATOM 2304 C THR B 7 -2.624 -4.657 3.722 1.00 0.00 C ATOM 2305 O THR B 7 -1.733 -4.642 2.874 1.00 0.00 O ATOM 2306 CB THR B 7 -4.280 -6.312 3.921 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.783 -7.365 4.729 1.00 0.00 O ATOM 2308 CG2 THR B 7 -3.894 -6.942 2.572 1.00 0.00 C ATOM 0 H THR B 7 -3.998 -5.501 6.332 1.00 0.00 H new ATOM 0 HA THR B 7 -2.248 -6.655 4.504 1.00 0.00 H new ATOM 0 HB THR B 7 -5.004 -5.503 3.827 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.280 -6.988 5.485 1.00 0.00 H new ATOM 0 HG21 THR B 7 -4.791 -7.300 2.068 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.401 -6.195 1.949 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.215 -7.778 2.742 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.270 -3.533 4.080 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.305 -2.283 3.386 1.00 0.00 C ATOM 2318 C GLY B 8 -2.019 -1.536 3.476 1.00 0.00 C ATOM 2319 O GLY B 8 -1.679 -0.680 2.661 1.00 0.00 O ATOM 0 H GLY B 8 -3.820 -3.499 4.938 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.544 -2.461 2.337 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -4.107 -1.668 3.795 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.189 -1.879 4.478 1.00 0.00 N ATOM 2324 CA HIS B 9 0.193 -1.513 4.522 1.00 0.00 C ATOM 2325 C HIS B 9 1.079 -2.312 3.630 1.00 0.00 C ATOM 2326 O HIS B 9 1.713 -1.776 2.722 1.00 0.00 O ATOM 2327 CB HIS B 9 0.791 -1.657 5.931 1.00 0.00 C ATOM 2328 CG HIS B 9 0.104 -0.828 6.975 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.515 -0.822 8.293 1.00 0.00 N ATOM 2330 CD2 HIS B 9 -1.056 -0.121 6.902 1.00 0.00 C ATOM 2331 CE1 HIS B 9 -0.511 -0.197 8.929 1.00 0.00 C ATOM 2332 NE2 HIS B 9 -1.467 0.284 8.156 1.00 0.00 N ATOM 0 H HIS B 9 -1.489 -2.429 5.283 1.00 0.00 H new ATOM 0 HA HIS B 9 0.172 -0.476 4.186 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.747 -2.705 6.227 1.00 0.00 H new ATOM 0 HB3 HIS B 9 1.845 -1.379 5.897 1.00 0.00 H new ATOM 0 HD2 HIS B 9 -1.585 0.095 5.985 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.542 -0.100 10.004 1.00 0.00 H new ATOM 0 HE2 HIS B 9 -2.296 0.818 8.418 1.00 0.00 H new ATOM 2340 N ALA B 10 1.034 -3.640 3.838 1.00 0.00 N ATOM 2341 CA ALA B 10 1.791 -4.617 3.119 1.00 0.00 C ATOM 2342 C ALA B 10 1.623 -4.660 1.639 1.00 0.00 C ATOM 2343 O ALA B 10 2.561 -4.744 0.848 1.00 0.00 O ATOM 2344 CB ALA B 10 1.548 -5.961 3.826 1.00 0.00 C ATOM 0 H ALA B 10 0.434 -4.055 4.550 1.00 0.00 H new ATOM 0 HA ALA B 10 2.841 -4.329 3.159 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.105 -6.747 3.316 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.882 -5.893 4.861 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.484 -6.197 3.803 1.00 0.00 H new ATOM 2350 N VAL B 11 0.368 -4.685 1.157 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.020 -4.713 -0.219 1.00 0.00 C ATOM 2352 C VAL B 11 0.386 -3.471 -0.935 1.00 0.00 C ATOM 2353 O VAL B 11 0.518 -3.479 -2.158 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.444 -5.095 -0.499 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -2.553 -4.061 -0.240 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.728 -5.658 -1.901 1.00 0.00 C ATOM 0 H VAL B 11 -0.439 -4.686 1.781 1.00 0.00 H new ATOM 0 HA VAL B 11 0.546 -5.549 -0.631 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.503 -5.867 0.268 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -3.521 -4.494 -0.493 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.546 -3.776 0.812 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.379 -3.179 -0.856 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.787 -5.899 -1.989 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.461 -4.915 -2.652 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.137 -6.560 -2.057 1.00 0.00 H new ATOM 2366 N ARG B 12 0.624 -2.358 -0.218 1.00 0.00 N ATOM 2367 CA ARG B 12 0.992 -1.127 -0.847 1.00 0.00 C ATOM 2368 C ARG B 12 2.413 -1.127 -1.297 1.00 0.00 C ATOM 2369 O ARG B 12 2.769 -0.516 -2.303 1.00 0.00 O ATOM 2370 CB ARG B 12 0.808 0.110 0.048 1.00 0.00 C ATOM 2371 CG ARG B 12 1.143 1.455 -0.597 1.00 0.00 C ATOM 2372 CD ARG B 12 0.805 2.668 0.273 1.00 0.00 C ATOM 2373 NE ARG B 12 1.371 3.876 -0.390 1.00 0.00 N ATOM 2374 CZ ARG B 12 0.741 5.078 -0.534 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -0.377 5.444 0.158 1.00 0.00 N ATOM 2376 NH2 ARG B 12 1.185 5.817 -1.593 1.00 0.00 N ATOM 0 H ARG B 12 0.562 -2.310 0.799 1.00 0.00 H new ATOM 0 HA ARG B 12 0.312 -1.061 -1.696 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.228 0.139 0.387 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.430 -0.011 0.935 1.00 0.00 H new ATOM 0 HG2 ARG B 12 2.207 1.477 -0.834 1.00 0.00 H new ATOM 0 HG3 ARG B 12 0.604 1.537 -1.541 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -0.274 2.766 0.389 1.00 0.00 H new ATOM 0 HD3 ARG B 12 1.223 2.550 1.273 1.00 0.00 H new ATOM 0 HE ARG B 12 2.314 3.798 -0.771 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -0.792 4.802 0.833 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -0.797 6.360 0.001 1.00 0.00 H new ATOM 0 HH21 ARG B 12 1.926 5.455 -2.193 1.00 0.00 H new ATOM 0 HH22 ARG B 12 0.776 6.731 -1.784 1.00 0.00 H new ATOM 2390 N ALA B 13 3.269 -1.983 -0.711 1.00 0.00 N ATOM 2391 CA ALA B 13 4.570 -2.373 -1.157 1.00 0.00 C ATOM 2392 C ALA B 13 4.543 -3.163 -2.420 1.00 0.00 C ATOM 2393 O ALA B 13 5.315 -3.057 -3.371 1.00 0.00 O ATOM 2394 CB ALA B 13 5.237 -3.230 -0.068 1.00 0.00 C ATOM 0 H ALA B 13 3.022 -2.447 0.163 1.00 0.00 H new ATOM 0 HA ALA B 13 5.127 -1.456 -1.351 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.230 -3.532 -0.400 1.00 0.00 H new ATOM 0 HB2 ALA B 13 5.322 -2.649 0.850 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.632 -4.117 0.119 1.00 0.00 H new ATOM 2400 N ILE B 14 3.539 -4.054 -2.504 1.00 0.00 N ATOM 2401 CA ILE B 14 3.318 -4.882 -3.649 1.00 0.00 C ATOM 2402 C ILE B 14 2.856 -4.106 -4.834 1.00 0.00 C ATOM 2403 O ILE B 14 3.277 -4.405 -5.951 1.00 0.00 O ATOM 2404 CB ILE B 14 2.265 -5.908 -3.352 1.00 0.00 C ATOM 2405 CG1 ILE B 14 2.650 -6.802 -2.162 1.00 0.00 C ATOM 2406 CG2 ILE B 14 1.930 -6.848 -4.523 1.00 0.00 C ATOM 2407 CD1 ILE B 14 3.927 -7.639 -2.208 1.00 0.00 C ATOM 0 H ILE B 14 2.862 -4.203 -1.755 1.00 0.00 H new ATOM 0 HA ILE B 14 4.277 -5.347 -3.876 1.00 0.00 H new ATOM 0 HB ILE B 14 1.387 -5.301 -3.131 1.00 0.00 H new ATOM 0 HG12 ILE B 14 2.717 -6.159 -1.284 1.00 0.00 H new ATOM 0 HG13 ILE B 14 1.820 -7.488 -1.992 1.00 0.00 H new ATOM 0 HG21 ILE B 14 1.159 -7.554 -4.214 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.567 -6.262 -5.368 1.00 0.00 H new ATOM 0 HG23 ILE B 14 2.826 -7.395 -4.818 1.00 0.00 H new ATOM 0 HD11 ILE B 14 4.027 -8.201 -1.280 1.00 0.00 H new ATOM 0 HD12 ILE B 14 3.878 -8.332 -3.048 1.00 0.00 H new ATOM 0 HD13 ILE B 14 4.788 -6.982 -2.329 1.00 0.00 H new ATOM 2419 N GLY B 15 2.022 -3.114 -4.476 1.00 0.00 N ATOM 2420 CA GLY B 15 1.674 -2.073 -5.393 1.00 0.00 C ATOM 2421 C GLY B 15 2.819 -1.316 -5.971 1.00 0.00 C ATOM 2422 O GLY B 15 2.806 -0.742 -7.058 1.00 0.00 O ATOM 0 H GLY B 15 1.590 -3.032 -3.556 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.101 -2.510 -6.211 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.016 -1.369 -4.883 1.00 0.00 H new ATOM 2426 N ARG B 16 3.814 -1.064 -5.101 1.00 0.00 N ATOM 2427 CA ARG B 16 4.974 -0.289 -5.414 1.00 0.00 C ATOM 2428 C ARG B 16 6.089 -0.994 -6.109 1.00 0.00 C ATOM 2429 O ARG B 16 6.618 -0.424 -7.061 1.00 0.00 O ATOM 2430 CB ARG B 16 5.534 0.308 -4.112 1.00 0.00 C ATOM 2431 CG ARG B 16 6.692 1.293 -4.279 1.00 0.00 C ATOM 2432 CD ARG B 16 6.358 2.626 -4.951 1.00 0.00 C ATOM 2433 NE ARG B 16 7.693 3.265 -5.122 1.00 0.00 N ATOM 2434 CZ ARG B 16 8.049 4.132 -6.114 1.00 0.00 C ATOM 2435 NH1 ARG B 16 7.085 4.632 -6.942 1.00 0.00 N ATOM 2436 NH2 ARG B 16 9.326 4.609 -6.179 1.00 0.00 N ATOM 0 H ARG B 16 3.810 -1.414 -4.143 1.00 0.00 H new ATOM 0 HA ARG B 16 4.617 0.455 -6.126 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.723 0.814 -3.588 1.00 0.00 H new ATOM 0 HB3 ARG B 16 5.866 -0.510 -3.472 1.00 0.00 H new ATOM 0 HG2 ARG B 16 7.108 1.502 -3.293 1.00 0.00 H new ATOM 0 HG3 ARG B 16 7.475 0.805 -4.859 1.00 0.00 H new ATOM 0 HD2 ARG B 16 5.856 2.480 -5.907 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.697 3.234 -4.333 1.00 0.00 H new ATOM 0 HE ARG B 16 8.408 3.033 -4.433 1.00 0.00 H new ATOM 0 HH11 ARG B 16 6.111 4.357 -6.815 1.00 0.00 H new ATOM 0 HH12 ARG B 16 7.339 5.281 -7.687 1.00 0.00 H new ATOM 0 HH21 ARG B 16 10.015 4.318 -5.486 1.00 0.00 H new ATOM 0 HH22 ARG B 16 9.591 5.257 -6.921 1.00 0.00 H new