USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1180 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 140 MET CE :methyl -157:sc= -0.14 (180deg=-0.788) USER MOD Set 1.2: A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 105 MET CE :methyl 159:sc= -0.305 (180deg=-1.03) USER MOD Set 2.2: B 7 THR OG1 : rot 90:sc= 1.21 USER MOD Set 3.1: A 68 MET CE :methyl -146:sc= -0.358 (180deg=-1.08) USER MOD Set 3.2: B 9 HIS :FLIP no HD1:sc= -0.107 F(o=-1.3,f=-0.46) USER MOD Set 4.1: A 56 ASN : amide:sc= 0.568 K(o=0.58,f=-4.4!) USER MOD Set 4.2: A 58 THR OG1 : rot 22:sc= 0.017 USER MOD Set 5.1: A 25 THR OG1 : rot 180:sc= 0.0224 USER MOD Set 5.2: A 45 GLN : amide:sc= 0 K(o=0.022,f=-2.3) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 9 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0255) USER MOD Single : A 13 SER OG : rot -96:sc= 0.51 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot -79:sc= 1.16 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 68:sc= 0.674 USER MOD Single : A 32 MET CE :methyl -107:sc= -0.584 (180deg=-1.74!) USER MOD Single : A 34 SER OG : rot 83:sc= 1.26 USER MOD Single : A 37 GLN : amide:sc= -0.0178 X(o=-0.018,f=-0.048) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.008) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl 158:sc= 0 (180deg=-0.102) USER MOD Single : A 49 ASN : amide:sc= 0.971 K(o=0.97,f=0) USER MOD Single : A 66 THR OG1 : rot 79:sc= 0.37 USER MOD Single : A 67 MET CE :methyl -153:sc= -0.926 (180deg=-2.09!) USER MOD Single : A 71 LYS NZ :NH3+ 170:sc= -0.034 (180deg=-0.173) USER MOD Single : A 72 MET CE :methyl -117:sc= -0.0763 (180deg=-1.25) USER MOD Single : A 73 LYS NZ :NH3+ -130:sc= 1.28 (180deg=0.3) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 70:sc= 1.01 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= -0.167 K(o=-0.17,f=-3.1!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -67:sc= 0.136 USER MOD Single : A 103 HIS : no HD1:sc= -0.114 X(o=-0.11,f=0) USER MOD Single : A 106 THR OG1 : rot 64:sc= 0.694 USER MOD Single : A 107 ASN : amide:sc= 0.218 X(o=0.22,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 166:sc= 0.495 USER MOD Single : A 120 MET CE :methyl 178:sc= -0.0458 (180deg=-0.0521) USER MOD Single : A 131 GLN : amide:sc= 0.733 K(o=0.73,f=-0.037) USER MOD Single : A 133 ASN : amide:sc= 1.23 K(o=1.2,f=-2.8!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 142 THR OG1 : rot 58:sc= 0.736 USER MOD Single : B 1 ARG N :NH3+ -173:sc= 0 (180deg=-0.0141) USER MOD Single : B 3 LYS NZ :NH3+ -175:sc= 1.19 (180deg=1.04) USER MOD Single : B 5 GLN : amide:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : B 6 LYS NZ :NH3+ -173:sc= 1.55 (180deg=1.38) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 0.728 -1.462 19.214 1.00 0.00 N ATOM 30 CA GLU A 3 0.158 -1.552 17.905 1.00 0.00 C ATOM 31 C GLU A 3 1.143 -1.659 16.792 1.00 0.00 C ATOM 32 O GLU A 3 1.109 -2.568 15.964 1.00 0.00 O ATOM 33 CB GLU A 3 -0.778 -0.352 17.686 1.00 0.00 C ATOM 34 CG GLU A 3 -2.013 -0.228 18.581 1.00 0.00 C ATOM 35 CD GLU A 3 -1.880 0.908 19.584 1.00 0.00 C ATOM 36 OE1 GLU A 3 -0.731 1.318 19.901 1.00 0.00 O ATOM 37 OE2 GLU A 3 -2.898 1.301 20.215 1.00 0.00 O ATOM 0 HA GLU A 3 -0.392 -2.493 17.874 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -0.188 0.557 17.804 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -1.118 -0.379 16.651 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -2.894 -0.063 17.961 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -2.170 -1.166 19.114 1.00 0.00 H new ATOM 44 N GLN A 4 2.023 -0.650 16.666 1.00 0.00 N ATOM 45 CA GLN A 4 3.053 -0.530 15.682 1.00 0.00 C ATOM 46 C GLN A 4 4.012 -1.655 15.494 1.00 0.00 C ATOM 47 O GLN A 4 4.224 -2.201 14.413 1.00 0.00 O ATOM 48 CB GLN A 4 3.833 0.740 16.061 1.00 0.00 C ATOM 49 CG GLN A 4 3.083 2.026 15.710 1.00 0.00 C ATOM 50 CD GLN A 4 4.100 3.120 16.005 1.00 0.00 C ATOM 51 OE1 GLN A 4 4.727 3.224 17.057 1.00 0.00 O ATOM 52 NE2 GLN A 4 4.198 4.026 14.996 1.00 0.00 N ATOM 0 H GLN A 4 2.012 0.145 17.305 1.00 0.00 H new ATOM 0 HA GLN A 4 2.541 -0.514 14.720 1.00 0.00 H new ATOM 0 HB2 GLN A 4 4.041 0.727 17.131 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.795 0.735 15.549 1.00 0.00 H new ATOM 0 HG2 GLN A 4 2.772 2.037 14.665 1.00 0.00 H new ATOM 0 HG3 GLN A 4 2.182 2.142 16.312 1.00 0.00 H new ATOM 0 HE21 GLN A 4 3.657 3.897 14.141 1.00 0.00 H new ATOM 0 HE22 GLN A 4 4.812 4.834 15.094 1.00 0.00 H new ATOM 61 N ILE A 5 4.489 -2.171 16.641 1.00 0.00 N ATOM 62 CA ILE A 5 5.368 -3.299 16.621 1.00 0.00 C ATOM 63 C ILE A 5 4.612 -4.538 16.286 1.00 0.00 C ATOM 64 O ILE A 5 5.184 -5.354 15.565 1.00 0.00 O ATOM 65 CB ILE A 5 6.176 -3.412 17.880 1.00 0.00 C ATOM 66 CG1 ILE A 5 5.425 -3.703 19.190 1.00 0.00 C ATOM 67 CG2 ILE A 5 7.020 -2.130 17.973 1.00 0.00 C ATOM 68 CD1 ILE A 5 6.230 -4.217 20.383 1.00 0.00 C ATOM 0 H ILE A 5 4.270 -1.813 17.571 1.00 0.00 H new ATOM 0 HA ILE A 5 6.103 -3.150 15.830 1.00 0.00 H new ATOM 0 HB ILE A 5 6.777 -4.317 17.788 1.00 0.00 H new ATOM 0 HG12 ILE A 5 4.923 -2.786 19.497 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.647 -4.435 18.973 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.630 -2.161 18.876 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.668 -2.057 17.100 1.00 0.00 H new ATOM 0 HG23 ILE A 5 6.361 -1.262 18.010 1.00 0.00 H new ATOM 0 HD11 ILE A 5 5.563 -4.375 21.231 1.00 0.00 H new ATOM 0 HD12 ILE A 5 6.711 -5.159 20.119 1.00 0.00 H new ATOM 0 HD13 ILE A 5 6.991 -3.484 20.651 1.00 0.00 H new ATOM 80 N ALA A 6 3.345 -4.656 16.723 1.00 0.00 N ATOM 81 CA ALA A 6 2.498 -5.659 16.157 1.00 0.00 C ATOM 82 C ALA A 6 2.264 -5.560 14.689 1.00 0.00 C ATOM 83 O ALA A 6 2.388 -6.504 13.910 1.00 0.00 O ATOM 84 CB ALA A 6 1.216 -5.693 17.007 1.00 0.00 C ATOM 0 H ALA A 6 2.917 -4.077 17.445 1.00 0.00 H new ATOM 0 HA ALA A 6 3.010 -6.620 16.205 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.537 -6.447 16.611 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.470 -5.939 18.038 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.732 -4.717 16.975 1.00 0.00 H new ATOM 90 N GLU A 7 2.040 -4.339 14.172 1.00 0.00 N ATOM 91 CA GLU A 7 1.825 -4.136 12.772 1.00 0.00 C ATOM 92 C GLU A 7 3.040 -4.296 11.924 1.00 0.00 C ATOM 93 O GLU A 7 3.008 -4.863 10.833 1.00 0.00 O ATOM 94 CB GLU A 7 1.052 -2.837 12.493 1.00 0.00 C ATOM 95 CG GLU A 7 -0.404 -2.909 12.959 1.00 0.00 C ATOM 96 CD GLU A 7 -1.031 -1.530 12.804 1.00 0.00 C ATOM 97 OE1 GLU A 7 -0.533 -0.597 13.489 1.00 0.00 O ATOM 98 OE2 GLU A 7 -1.990 -1.330 12.012 1.00 0.00 O ATOM 0 H GLU A 7 2.008 -3.485 14.729 1.00 0.00 H new ATOM 0 HA GLU A 7 1.185 -4.960 12.457 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.550 -2.007 12.994 1.00 0.00 H new ATOM 0 HB3 GLU A 7 1.078 -2.625 11.424 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.954 -3.643 12.370 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.453 -3.233 13.999 1.00 0.00 H new ATOM 105 N PHE A 8 4.228 -3.903 12.417 1.00 0.00 N ATOM 106 CA PHE A 8 5.480 -4.108 11.758 1.00 0.00 C ATOM 107 C PHE A 8 5.832 -5.556 11.720 1.00 0.00 C ATOM 108 O PHE A 8 6.480 -6.034 10.790 1.00 0.00 O ATOM 109 CB PHE A 8 6.612 -3.330 12.450 1.00 0.00 C ATOM 110 CG PHE A 8 7.969 -3.388 11.838 1.00 0.00 C ATOM 111 CD1 PHE A 8 8.123 -3.447 10.472 1.00 0.00 C ATOM 112 CD2 PHE A 8 9.082 -3.388 12.645 1.00 0.00 C ATOM 113 CE1 PHE A 8 9.398 -3.515 9.961 1.00 0.00 C ATOM 114 CE2 PHE A 8 10.349 -3.602 12.156 1.00 0.00 C ATOM 115 CZ PHE A 8 10.479 -3.697 10.790 1.00 0.00 C ATOM 0 H PHE A 8 4.320 -3.422 13.312 1.00 0.00 H new ATOM 0 HA PHE A 8 5.369 -3.737 10.739 1.00 0.00 H new ATOM 0 HB2 PHE A 8 6.314 -2.283 12.505 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.691 -3.694 13.475 1.00 0.00 H new ATOM 0 HD1 PHE A 8 7.264 -3.440 9.817 1.00 0.00 H new ATOM 0 HD2 PHE A 8 8.956 -3.213 13.703 1.00 0.00 H new ATOM 0 HE1 PHE A 8 9.552 -3.424 8.896 1.00 0.00 H new ATOM 0 HE2 PHE A 8 11.201 -3.691 12.813 1.00 0.00 H new ATOM 0 HZ PHE A 8 11.446 -3.918 10.362 1.00 0.00 H new ATOM 125 N LYS A 9 5.527 -6.340 12.770 1.00 0.00 N ATOM 126 CA LYS A 9 5.640 -7.765 12.823 1.00 0.00 C ATOM 127 C LYS A 9 4.847 -8.469 11.776 1.00 0.00 C ATOM 128 O LYS A 9 5.252 -9.507 11.256 1.00 0.00 O ATOM 129 CB LYS A 9 5.277 -8.250 14.236 1.00 0.00 C ATOM 130 CG LYS A 9 5.481 -9.739 14.520 1.00 0.00 C ATOM 131 CD LYS A 9 6.241 -9.973 15.827 1.00 0.00 C ATOM 132 CE LYS A 9 6.481 -11.405 16.311 1.00 0.00 C ATOM 133 NZ LYS A 9 6.906 -12.262 15.182 1.00 0.00 N ATOM 0 H LYS A 9 5.176 -5.949 13.644 1.00 0.00 H new ATOM 0 HA LYS A 9 6.677 -8.020 12.603 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.868 -7.682 14.954 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.231 -8.008 14.422 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.512 -10.235 14.570 1.00 0.00 H new ATOM 0 HG3 LYS A 9 6.029 -10.194 13.695 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.215 -9.493 15.729 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.704 -9.447 16.616 1.00 0.00 H new ATOM 0 HE2 LYS A 9 7.245 -11.410 17.089 1.00 0.00 H new ATOM 0 HE3 LYS A 9 5.570 -11.804 16.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.147 -13.209 15.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 6.131 -12.338 14.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.739 -11.842 14.722 1.00 0.00 H new ATOM 147 N GLU A 10 3.694 -7.895 11.389 1.00 0.00 N ATOM 148 CA GLU A 10 2.946 -8.458 10.308 1.00 0.00 C ATOM 149 C GLU A 10 3.618 -8.182 9.007 1.00 0.00 C ATOM 150 O GLU A 10 3.796 -9.108 8.217 1.00 0.00 O ATOM 151 CB GLU A 10 1.440 -8.149 10.267 1.00 0.00 C ATOM 152 CG GLU A 10 0.663 -8.766 11.431 1.00 0.00 C ATOM 153 CD GLU A 10 -0.739 -8.286 11.779 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.901 -7.048 11.949 1.00 0.00 O ATOM 155 OE2 GLU A 10 -1.714 -9.066 11.616 1.00 0.00 O ATOM 0 H GLU A 10 3.287 -7.061 11.812 1.00 0.00 H new ATOM 0 HA GLU A 10 2.953 -9.530 10.506 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.298 -7.068 10.277 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.026 -8.517 9.328 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.595 -9.837 11.238 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.274 -8.641 12.325 1.00 0.00 H new ATOM 162 N ALA A 11 3.890 -6.912 8.658 1.00 0.00 N ATOM 163 CA ALA A 11 4.148 -6.397 7.350 1.00 0.00 C ATOM 164 C ALA A 11 5.414 -6.940 6.784 1.00 0.00 C ATOM 165 O ALA A 11 5.560 -7.220 5.595 1.00 0.00 O ATOM 166 CB ALA A 11 4.309 -4.872 7.466 1.00 0.00 C ATOM 0 H ALA A 11 3.933 -6.176 9.363 1.00 0.00 H new ATOM 0 HA ALA A 11 3.322 -6.682 6.698 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.507 -4.451 6.480 1.00 0.00 H new ATOM 0 HB2 ALA A 11 3.393 -4.439 7.868 1.00 0.00 H new ATOM 0 HB3 ALA A 11 5.141 -4.644 8.132 1.00 0.00 H new ATOM 172 N PHE A 12 6.471 -7.093 7.602 1.00 0.00 N ATOM 173 CA PHE A 12 7.746 -7.548 7.141 1.00 0.00 C ATOM 174 C PHE A 12 7.699 -8.969 6.696 1.00 0.00 C ATOM 175 O PHE A 12 8.282 -9.311 5.669 1.00 0.00 O ATOM 176 CB PHE A 12 8.718 -7.505 8.332 1.00 0.00 C ATOM 177 CG PHE A 12 10.163 -7.528 7.967 1.00 0.00 C ATOM 178 CD1 PHE A 12 10.805 -6.344 7.691 1.00 0.00 C ATOM 179 CD2 PHE A 12 10.925 -8.672 8.000 1.00 0.00 C ATOM 180 CE1 PHE A 12 12.122 -6.313 7.298 1.00 0.00 C ATOM 181 CE2 PHE A 12 12.260 -8.638 7.674 1.00 0.00 C ATOM 182 CZ PHE A 12 12.834 -7.484 7.193 1.00 0.00 C ATOM 0 H PHE A 12 6.439 -6.897 8.602 1.00 0.00 H new ATOM 0 HA PHE A 12 8.050 -6.914 6.308 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.519 -6.603 8.911 1.00 0.00 H new ATOM 0 HB3 PHE A 12 8.509 -8.354 8.983 1.00 0.00 H new ATOM 0 HD1 PHE A 12 10.261 -5.416 7.785 1.00 0.00 H new ATOM 0 HD2 PHE A 12 10.469 -9.609 8.285 1.00 0.00 H new ATOM 0 HE1 PHE A 12 12.597 -5.370 7.072 1.00 0.00 H new ATOM 0 HE2 PHE A 12 12.864 -9.525 7.797 1.00 0.00 H new ATOM 0 HZ PHE A 12 13.817 -7.498 6.745 1.00 0.00 H new ATOM 192 N SER A 13 6.852 -9.797 7.334 1.00 0.00 N ATOM 193 CA SER A 13 6.743 -11.220 7.254 1.00 0.00 C ATOM 194 C SER A 13 5.592 -11.695 6.436 1.00 0.00 C ATOM 195 O SER A 13 5.362 -12.895 6.287 1.00 0.00 O ATOM 196 CB SER A 13 6.729 -11.912 8.628 1.00 0.00 C ATOM 197 OG SER A 13 5.482 -11.700 9.272 1.00 0.00 O ATOM 0 H SER A 13 6.162 -9.418 7.983 1.00 0.00 H new ATOM 0 HA SER A 13 7.656 -11.514 6.736 1.00 0.00 H new ATOM 0 HB2 SER A 13 6.907 -12.981 8.507 1.00 0.00 H new ATOM 0 HB3 SER A 13 7.537 -11.523 9.247 1.00 0.00 H new ATOM 0 HG SER A 13 5.555 -10.938 9.884 1.00 0.00 H new ATOM 203 N LEU A 14 4.841 -10.784 5.792 1.00 0.00 N ATOM 204 CA LEU A 14 4.318 -11.057 4.490 1.00 0.00 C ATOM 205 C LEU A 14 5.337 -11.282 3.427 1.00 0.00 C ATOM 206 O LEU A 14 5.266 -12.230 2.646 1.00 0.00 O ATOM 207 CB LEU A 14 3.349 -9.933 4.086 1.00 0.00 C ATOM 208 CG LEU A 14 2.129 -9.750 5.005 1.00 0.00 C ATOM 209 CD1 LEU A 14 1.265 -8.631 4.398 1.00 0.00 C ATOM 210 CD2 LEU A 14 1.373 -11.077 5.185 1.00 0.00 C ATOM 0 H LEU A 14 4.598 -9.868 6.168 1.00 0.00 H new ATOM 0 HA LEU A 14 3.798 -12.012 4.571 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.902 -8.994 4.054 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.994 -10.129 3.074 1.00 0.00 H new ATOM 0 HG LEU A 14 2.428 -9.457 6.011 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.386 -8.470 5.023 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.846 -7.710 4.345 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.949 -8.919 3.395 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.515 -10.921 5.839 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.029 -11.435 4.214 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.038 -11.817 5.630 1.00 0.00 H new ATOM 222 N PHE A 15 6.474 -10.570 3.518 1.00 0.00 N ATOM 223 CA PHE A 15 7.482 -10.669 2.509 1.00 0.00 C ATOM 224 C PHE A 15 8.585 -11.615 2.838 1.00 0.00 C ATOM 225 O PHE A 15 8.834 -12.498 2.019 1.00 0.00 O ATOM 226 CB PHE A 15 8.088 -9.289 2.200 1.00 0.00 C ATOM 227 CG PHE A 15 7.095 -8.313 1.669 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.608 -8.485 0.395 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.507 -7.355 2.462 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.646 -7.680 -0.169 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.536 -6.513 1.975 1.00 0.00 C ATOM 232 CZ PHE A 15 5.121 -6.737 0.683 1.00 0.00 C ATOM 0 H PHE A 15 6.694 -9.932 4.282 1.00 0.00 H new ATOM 0 HA PHE A 15 6.966 -11.068 1.636 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.534 -8.884 3.109 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.893 -9.408 1.475 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.003 -9.298 -0.196 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.816 -7.262 3.493 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.329 -7.780 -1.197 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.121 -5.717 2.575 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.317 -6.122 0.307 1.00 0.00 H new ATOM 242 N ASP A 16 9.192 -11.502 4.033 1.00 0.00 N ATOM 243 CA ASP A 16 10.202 -12.448 4.394 1.00 0.00 C ATOM 244 C ASP A 16 9.645 -13.823 4.535 1.00 0.00 C ATOM 245 O ASP A 16 8.625 -14.107 5.161 1.00 0.00 O ATOM 246 CB ASP A 16 10.856 -12.074 5.735 1.00 0.00 C ATOM 247 CG ASP A 16 12.247 -12.685 5.825 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.426 -13.895 6.127 1.00 0.00 O ATOM 249 OD2 ASP A 16 13.210 -11.958 5.460 1.00 0.00 O ATOM 0 H ASP A 16 8.994 -10.782 4.728 1.00 0.00 H new ATOM 0 HA ASP A 16 10.939 -12.428 3.591 1.00 0.00 H new ATOM 0 HB2 ASP A 16 10.920 -10.990 5.828 1.00 0.00 H new ATOM 0 HB3 ASP A 16 10.240 -12.429 6.561 1.00 0.00 H new ATOM 254 N LYS A 17 10.399 -14.780 3.966 1.00 0.00 N ATOM 255 CA LYS A 17 9.899 -16.113 3.831 1.00 0.00 C ATOM 256 C LYS A 17 10.278 -16.980 4.982 1.00 0.00 C ATOM 257 O LYS A 17 9.428 -17.737 5.446 1.00 0.00 O ATOM 258 CB LYS A 17 10.188 -16.774 2.472 1.00 0.00 C ATOM 259 CG LYS A 17 9.286 -17.982 2.212 1.00 0.00 C ATOM 260 CD LYS A 17 7.869 -17.634 1.751 1.00 0.00 C ATOM 261 CE LYS A 17 7.244 -18.811 0.998 1.00 0.00 C ATOM 262 NZ LYS A 17 5.854 -18.471 0.622 1.00 0.00 N ATOM 0 H LYS A 17 11.342 -14.635 3.604 1.00 0.00 H new ATOM 0 HA LYS A 17 8.815 -16.004 3.853 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.049 -16.041 1.677 1.00 0.00 H new ATOM 0 HB3 LYS A 17 11.231 -17.088 2.437 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.755 -18.612 1.456 1.00 0.00 H new ATOM 0 HG3 LYS A 17 9.221 -18.573 3.125 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.253 -17.378 2.613 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.896 -16.756 1.106 1.00 0.00 H new ATOM 0 HE2 LYS A 17 7.828 -19.038 0.106 1.00 0.00 H new ATOM 0 HE3 LYS A 17 7.255 -19.704 1.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 5.428 -19.270 0.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.300 -18.275 1.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.856 -17.629 0.011 1.00 0.00 H new ATOM 276 N ASP A 18 11.529 -16.842 5.457 1.00 0.00 N ATOM 277 CA ASP A 18 12.118 -17.478 6.594 1.00 0.00 C ATOM 278 C ASP A 18 11.522 -16.977 7.864 1.00 0.00 C ATOM 279 O ASP A 18 11.160 -17.712 8.782 1.00 0.00 O ATOM 280 CB ASP A 18 13.635 -17.230 6.650 1.00 0.00 C ATOM 281 CG ASP A 18 14.280 -17.282 5.273 1.00 0.00 C ATOM 282 OD1 ASP A 18 14.614 -18.399 4.795 1.00 0.00 O ATOM 283 OD2 ASP A 18 14.574 -16.216 4.669 1.00 0.00 O ATOM 0 H ASP A 18 12.193 -16.221 4.995 1.00 0.00 H new ATOM 0 HA ASP A 18 11.921 -18.545 6.488 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.825 -16.256 7.101 1.00 0.00 H new ATOM 0 HB3 ASP A 18 14.099 -17.976 7.295 1.00 0.00 H new ATOM 288 N GLY A 19 11.442 -15.637 7.945 1.00 0.00 N ATOM 289 CA GLY A 19 11.066 -14.865 9.089 1.00 0.00 C ATOM 290 C GLY A 19 12.223 -14.457 9.934 1.00 0.00 C ATOM 291 O GLY A 19 12.193 -14.364 11.161 1.00 0.00 O ATOM 0 H GLY A 19 11.659 -15.046 7.143 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.535 -13.973 8.757 1.00 0.00 H new ATOM 0 HA3 GLY A 19 10.369 -15.443 9.695 1.00 0.00 H new ATOM 295 N ASP A 20 13.365 -14.297 9.242 1.00 0.00 N ATOM 296 CA ASP A 20 14.627 -14.122 9.891 1.00 0.00 C ATOM 297 C ASP A 20 14.925 -12.681 10.129 1.00 0.00 C ATOM 298 O ASP A 20 14.849 -12.198 11.258 1.00 0.00 O ATOM 299 CB ASP A 20 15.755 -14.815 9.108 1.00 0.00 C ATOM 300 CG ASP A 20 15.776 -14.586 7.604 1.00 0.00 C ATOM 301 OD1 ASP A 20 15.235 -13.623 6.998 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.521 -15.336 6.918 1.00 0.00 O ATOM 0 H ASP A 20 13.414 -14.289 8.223 1.00 0.00 H new ATOM 0 HA ASP A 20 14.565 -14.601 10.868 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.709 -14.482 9.517 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.687 -15.888 9.289 1.00 0.00 H new ATOM 307 N GLY A 21 15.209 -11.898 9.073 1.00 0.00 N ATOM 308 CA GLY A 21 15.431 -10.497 9.258 1.00 0.00 C ATOM 309 C GLY A 21 15.650 -9.701 8.018 1.00 0.00 C ATOM 310 O GLY A 21 15.709 -8.474 8.091 1.00 0.00 O ATOM 0 H GLY A 21 15.284 -12.225 8.110 1.00 0.00 H new ATOM 0 HA2 GLY A 21 14.574 -10.080 9.787 1.00 0.00 H new ATOM 0 HA3 GLY A 21 16.298 -10.369 9.906 1.00 0.00 H new ATOM 314 N THR A 22 15.762 -10.333 6.836 1.00 0.00 N ATOM 315 CA THR A 22 16.212 -9.836 5.574 1.00 0.00 C ATOM 316 C THR A 22 15.396 -10.269 4.405 1.00 0.00 C ATOM 317 O THR A 22 15.554 -11.418 3.996 1.00 0.00 O ATOM 318 CB THR A 22 17.686 -9.995 5.345 1.00 0.00 C ATOM 319 OG1 THR A 22 18.230 -11.296 5.515 1.00 0.00 O ATOM 320 CG2 THR A 22 18.434 -9.221 6.443 1.00 0.00 C ATOM 0 H THR A 22 15.503 -11.317 6.761 1.00 0.00 H new ATOM 0 HA THR A 22 16.039 -8.763 5.652 1.00 0.00 H new ATOM 0 HB THR A 22 17.805 -9.673 4.310 1.00 0.00 H new ATOM 0 HG1 THR A 22 19.194 -11.273 5.338 1.00 0.00 H new ATOM 0 HG21 THR A 22 19.509 -9.325 6.293 1.00 0.00 H new ATOM 0 HG22 THR A 22 18.161 -8.167 6.395 1.00 0.00 H new ATOM 0 HG23 THR A 22 18.163 -9.622 7.420 1.00 0.00 H new ATOM 328 N ILE A 23 14.663 -9.320 3.795 1.00 0.00 N ATOM 329 CA ILE A 23 13.966 -9.606 2.580 1.00 0.00 C ATOM 330 C ILE A 23 14.955 -9.609 1.465 1.00 0.00 C ATOM 331 O ILE A 23 15.609 -8.626 1.123 1.00 0.00 O ATOM 332 CB ILE A 23 12.777 -8.721 2.349 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.856 -8.590 3.574 1.00 0.00 C ATOM 334 CG2 ILE A 23 12.060 -9.135 1.053 1.00 0.00 C ATOM 335 CD1 ILE A 23 11.337 -7.155 3.657 1.00 0.00 C ATOM 0 H ILE A 23 14.554 -8.366 4.138 1.00 0.00 H new ATOM 0 HA ILE A 23 13.515 -10.596 2.646 1.00 0.00 H new ATOM 0 HB ILE A 23 13.136 -7.702 2.207 1.00 0.00 H new ATOM 0 HG12 ILE A 23 11.022 -9.288 3.494 1.00 0.00 H new ATOM 0 HG13 ILE A 23 12.400 -8.846 4.483 1.00 0.00 H new ATOM 0 HG21 ILE A 23 11.198 -8.488 0.892 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.746 -9.041 0.212 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.727 -10.170 1.136 1.00 0.00 H new ATOM 0 HD11 ILE A 23 10.683 -7.054 4.523 1.00 0.00 H new ATOM 0 HD12 ILE A 23 12.178 -6.469 3.756 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.779 -6.917 2.751 1.00 0.00 H new ATOM 347 N THR A 24 15.081 -10.754 0.771 1.00 0.00 N ATOM 348 CA THR A 24 16.009 -10.864 -0.311 1.00 0.00 C ATOM 349 C THR A 24 15.277 -10.535 -1.567 1.00 0.00 C ATOM 350 O THR A 24 14.051 -10.488 -1.659 1.00 0.00 O ATOM 351 CB THR A 24 16.717 -12.186 -0.335 1.00 0.00 C ATOM 352 OG1 THR A 24 15.763 -13.230 -0.459 1.00 0.00 O ATOM 353 CG2 THR A 24 17.539 -12.428 0.942 1.00 0.00 C ATOM 0 H THR A 24 14.543 -11.600 0.958 1.00 0.00 H new ATOM 0 HA THR A 24 16.824 -10.152 -0.187 1.00 0.00 H new ATOM 0 HB THR A 24 17.399 -12.173 -1.185 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.348 -13.399 0.412 1.00 0.00 H new ATOM 0 HG21 THR A 24 18.033 -13.397 0.878 1.00 0.00 H new ATOM 0 HG22 THR A 24 18.289 -11.644 1.046 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.878 -12.414 1.808 1.00 0.00 H new ATOM 361 N THR A 25 15.973 -10.261 -2.685 1.00 0.00 N ATOM 362 CA THR A 25 15.467 -10.305 -4.021 1.00 0.00 C ATOM 363 C THR A 25 14.524 -11.424 -4.301 1.00 0.00 C ATOM 364 O THR A 25 13.438 -11.190 -4.830 1.00 0.00 O ATOM 365 CB THR A 25 16.484 -10.120 -5.108 1.00 0.00 C ATOM 366 OG1 THR A 25 17.439 -9.157 -4.685 1.00 0.00 O ATOM 367 CG2 THR A 25 15.786 -9.458 -6.307 1.00 0.00 C ATOM 0 H THR A 25 16.956 -9.991 -2.652 1.00 0.00 H new ATOM 0 HA THR A 25 14.861 -9.399 -4.055 1.00 0.00 H new ATOM 0 HB THR A 25 16.934 -11.084 -5.345 1.00 0.00 H new ATOM 0 HG1 THR A 25 18.109 -9.030 -5.388 1.00 0.00 H new ATOM 0 HG21 THR A 25 16.506 -9.313 -7.112 1.00 0.00 H new ATOM 0 HG22 THR A 25 14.976 -10.099 -6.656 1.00 0.00 H new ATOM 0 HG23 THR A 25 15.380 -8.493 -6.004 1.00 0.00 H new ATOM 375 N LYS A 26 14.894 -12.701 -4.101 1.00 0.00 N ATOM 376 CA LYS A 26 14.102 -13.878 -4.285 1.00 0.00 C ATOM 377 C LYS A 26 12.855 -13.795 -3.474 1.00 0.00 C ATOM 378 O LYS A 26 11.775 -14.053 -4.003 1.00 0.00 O ATOM 379 CB LYS A 26 14.892 -15.118 -3.832 1.00 0.00 C ATOM 380 CG LYS A 26 14.298 -16.462 -4.258 1.00 0.00 C ATOM 381 CD LYS A 26 14.709 -17.525 -3.238 1.00 0.00 C ATOM 382 CE LYS A 26 16.217 -17.694 -3.039 1.00 0.00 C ATOM 383 NZ LYS A 26 16.401 -18.640 -1.916 1.00 0.00 N ATOM 0 H LYS A 26 15.835 -12.929 -3.781 1.00 0.00 H new ATOM 0 HA LYS A 26 13.850 -13.957 -5.343 1.00 0.00 H new ATOM 0 HB2 LYS A 26 15.906 -15.046 -4.225 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.970 -15.102 -2.745 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.212 -16.394 -4.316 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.654 -16.734 -5.252 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.258 -17.276 -2.277 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.291 -18.483 -3.548 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.685 -18.076 -3.946 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.687 -16.736 -2.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.417 -18.784 -1.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 15.958 -18.252 -1.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 15.957 -19.550 -2.153 1.00 0.00 H new ATOM 397 N GLU A 27 12.861 -13.540 -2.154 1.00 0.00 N ATOM 398 CA GLU A 27 11.724 -13.609 -1.290 1.00 0.00 C ATOM 399 C GLU A 27 10.680 -12.575 -1.533 1.00 0.00 C ATOM 400 O GLU A 27 9.468 -12.728 -1.386 1.00 0.00 O ATOM 401 CB GLU A 27 12.160 -13.363 0.164 1.00 0.00 C ATOM 402 CG GLU A 27 12.870 -14.608 0.701 1.00 0.00 C ATOM 403 CD GLU A 27 13.506 -14.242 2.034 1.00 0.00 C ATOM 404 OE1 GLU A 27 12.850 -14.320 3.107 1.00 0.00 O ATOM 405 OE2 GLU A 27 14.622 -13.657 2.037 1.00 0.00 O ATOM 0 H GLU A 27 13.712 -13.269 -1.661 1.00 0.00 H new ATOM 0 HA GLU A 27 11.310 -14.598 -1.485 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.826 -12.501 0.215 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.292 -13.132 0.781 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.162 -15.427 0.828 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.629 -14.949 -0.003 1.00 0.00 H new ATOM 412 N LEU A 28 11.192 -11.404 -1.951 1.00 0.00 N ATOM 413 CA LEU A 28 10.251 -10.431 -2.414 1.00 0.00 C ATOM 414 C LEU A 28 9.337 -10.842 -3.516 1.00 0.00 C ATOM 415 O LEU A 28 8.112 -10.756 -3.600 1.00 0.00 O ATOM 416 CB LEU A 28 11.044 -9.152 -2.732 1.00 0.00 C ATOM 417 CG LEU A 28 10.101 -7.976 -3.033 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.097 -7.580 -1.937 1.00 0.00 C ATOM 419 CD2 LEU A 28 11.019 -6.760 -3.244 1.00 0.00 C ATOM 0 H LEU A 28 12.177 -11.141 -1.971 1.00 0.00 H new ATOM 0 HA LEU A 28 9.530 -10.271 -1.612 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.687 -8.900 -1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.696 -9.328 -3.588 1.00 0.00 H new ATOM 0 HG LEU A 28 9.489 -8.287 -3.880 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.496 -6.738 -2.281 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.445 -8.426 -1.718 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.637 -7.295 -1.034 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.413 -5.881 -3.464 1.00 0.00 H new ATOM 0 HD22 LEU A 28 11.602 -6.583 -2.340 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.694 -6.954 -4.078 1.00 0.00 H new ATOM 431 N GLY A 29 10.035 -11.483 -4.470 1.00 0.00 N ATOM 432 CA GLY A 29 9.395 -11.877 -5.687 1.00 0.00 C ATOM 433 C GLY A 29 8.538 -13.081 -5.501 1.00 0.00 C ATOM 434 O GLY A 29 7.644 -13.312 -6.313 1.00 0.00 O ATOM 0 H GLY A 29 11.024 -11.725 -4.403 1.00 0.00 H new ATOM 0 HA2 GLY A 29 8.787 -11.053 -6.060 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.151 -12.084 -6.444 1.00 0.00 H new ATOM 438 N THR A 30 8.818 -13.919 -4.487 1.00 0.00 N ATOM 439 CA THR A 30 8.103 -15.100 -4.114 1.00 0.00 C ATOM 440 C THR A 30 6.679 -14.759 -3.835 1.00 0.00 C ATOM 441 O THR A 30 5.768 -15.433 -4.314 1.00 0.00 O ATOM 442 CB THR A 30 8.866 -15.900 -3.100 1.00 0.00 C ATOM 443 OG1 THR A 30 10.097 -16.412 -3.589 1.00 0.00 O ATOM 444 CG2 THR A 30 8.033 -17.074 -2.557 1.00 0.00 C ATOM 0 H THR A 30 9.617 -13.753 -3.875 1.00 0.00 H new ATOM 0 HA THR A 30 8.030 -15.812 -4.936 1.00 0.00 H new ATOM 0 HB THR A 30 9.086 -15.193 -2.300 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.717 -15.671 -3.755 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.620 -17.629 -1.825 1.00 0.00 H new ATOM 0 HG22 THR A 30 7.130 -16.690 -2.082 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.758 -17.735 -3.378 1.00 0.00 H new ATOM 452 N VAL A 31 6.416 -13.670 -3.092 1.00 0.00 N ATOM 453 CA VAL A 31 5.067 -13.225 -2.923 1.00 0.00 C ATOM 454 C VAL A 31 4.351 -12.901 -4.189 1.00 0.00 C ATOM 455 O VAL A 31 3.273 -13.439 -4.435 1.00 0.00 O ATOM 456 CB VAL A 31 4.932 -11.944 -2.154 1.00 0.00 C ATOM 457 CG1 VAL A 31 3.608 -11.629 -1.439 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.960 -11.840 -1.015 1.00 0.00 C ATOM 0 H VAL A 31 7.121 -13.107 -2.616 1.00 0.00 H new ATOM 0 HA VAL A 31 4.645 -14.087 -2.407 1.00 0.00 H new ATOM 0 HB VAL A 31 5.055 -11.248 -2.984 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.687 -10.666 -0.934 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.800 -11.591 -2.170 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.397 -12.407 -0.705 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.824 -10.896 -0.487 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.819 -12.668 -0.321 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.967 -11.882 -1.429 1.00 0.00 H new ATOM 468 N MET A 32 5.045 -12.140 -5.054 1.00 0.00 N ATOM 469 CA MET A 32 4.586 -11.871 -6.381 1.00 0.00 C ATOM 470 C MET A 32 4.184 -13.005 -7.259 1.00 0.00 C ATOM 471 O MET A 32 3.196 -13.075 -7.989 1.00 0.00 O ATOM 472 CB MET A 32 5.498 -10.862 -7.098 1.00 0.00 C ATOM 473 CG MET A 32 5.859 -9.649 -6.238 1.00 0.00 C ATOM 474 SD MET A 32 6.787 -8.344 -7.098 1.00 0.00 S ATOM 475 CE MET A 32 7.418 -7.558 -5.587 1.00 0.00 C ATOM 0 H MET A 32 5.939 -11.704 -4.828 1.00 0.00 H new ATOM 0 HA MET A 32 3.610 -11.427 -6.188 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.415 -11.366 -7.404 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.004 -10.519 -8.007 1.00 0.00 H new ATOM 0 HG2 MET A 32 4.940 -9.218 -5.841 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.446 -9.989 -5.385 1.00 0.00 H new ATOM 0 HE1 MET A 32 6.897 -6.615 -5.423 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.250 -8.218 -4.736 1.00 0.00 H new ATOM 0 HE3 MET A 32 8.486 -7.369 -5.694 1.00 0.00 H new ATOM 485 N ARG A 33 5.100 -13.985 -7.352 1.00 0.00 N ATOM 486 CA ARG A 33 4.856 -15.124 -8.182 1.00 0.00 C ATOM 487 C ARG A 33 3.951 -16.117 -7.539 1.00 0.00 C ATOM 488 O ARG A 33 3.464 -17.054 -8.170 1.00 0.00 O ATOM 489 CB ARG A 33 6.171 -15.843 -8.528 1.00 0.00 C ATOM 490 CG ARG A 33 7.135 -14.922 -9.280 1.00 0.00 C ATOM 491 CD ARG A 33 8.513 -15.530 -9.547 1.00 0.00 C ATOM 492 NE ARG A 33 9.261 -15.662 -8.265 1.00 0.00 N ATOM 493 CZ ARG A 33 10.238 -14.763 -7.950 1.00 0.00 C ATOM 494 NH1 ARG A 33 10.716 -13.807 -8.800 1.00 0.00 N ATOM 495 NH2 ARG A 33 10.995 -14.974 -6.834 1.00 0.00 N ATOM 0 H ARG A 33 5.995 -13.991 -6.862 1.00 0.00 H new ATOM 0 HA ARG A 33 4.378 -14.738 -9.082 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.645 -16.197 -7.612 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.957 -16.722 -9.136 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.684 -14.644 -10.232 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.262 -14.003 -8.707 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.405 -16.507 -10.018 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.070 -14.901 -10.241 1.00 0.00 H new ATOM 0 HE ARG A 33 9.043 -16.424 -7.623 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.339 -13.730 -9.745 1.00 0.00 H new ATOM 0 HH12 ARG A 33 11.450 -13.170 -8.490 1.00 0.00 H new ATOM 0 HH21 ARG A 33 10.826 -15.793 -6.251 1.00 0.00 H new ATOM 0 HH22 ARG A 33 11.730 -14.312 -6.583 1.00 0.00 H new ATOM 509 N SER A 34 3.808 -15.976 -6.209 1.00 0.00 N ATOM 510 CA SER A 34 2.826 -16.790 -5.563 1.00 0.00 C ATOM 511 C SER A 34 1.445 -16.417 -5.982 1.00 0.00 C ATOM 512 O SER A 34 0.675 -17.297 -6.361 1.00 0.00 O ATOM 513 CB SER A 34 2.955 -16.607 -4.042 1.00 0.00 C ATOM 514 OG SER A 34 4.111 -17.294 -3.587 1.00 0.00 O ATOM 0 H SER A 34 4.336 -15.340 -5.611 1.00 0.00 H new ATOM 0 HA SER A 34 2.998 -17.828 -5.847 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.026 -15.548 -3.796 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.067 -16.992 -3.540 1.00 0.00 H new ATOM 0 HG SER A 34 4.901 -16.731 -3.724 1.00 0.00 H new ATOM 520 N LEU A 35 1.159 -15.108 -5.861 1.00 0.00 N ATOM 521 CA LEU A 35 0.015 -14.492 -6.458 1.00 0.00 C ATOM 522 C LEU A 35 -0.152 -14.653 -7.930 1.00 0.00 C ATOM 523 O LEU A 35 -1.074 -15.271 -8.461 1.00 0.00 O ATOM 524 CB LEU A 35 -0.054 -12.995 -6.116 1.00 0.00 C ATOM 525 CG LEU A 35 -0.364 -12.725 -4.634 1.00 0.00 C ATOM 526 CD1 LEU A 35 0.448 -11.535 -4.096 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.886 -12.611 -4.439 1.00 0.00 C ATOM 0 H LEU A 35 1.741 -14.459 -5.332 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.809 -15.049 -6.012 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.896 -12.526 -6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.819 -12.523 -6.732 1.00 0.00 H new ATOM 0 HG LEU A 35 -0.039 -13.568 -4.024 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.204 -11.373 -3.046 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.513 -11.748 -4.192 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.204 -10.640 -4.668 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.105 -12.420 -3.388 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -2.270 -11.790 -5.045 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -2.363 -13.542 -4.745 1.00 0.00 H new ATOM 539 N GLY A 36 0.864 -14.256 -8.716 1.00 0.00 N ATOM 540 CA GLY A 36 1.062 -14.656 -10.075 1.00 0.00 C ATOM 541 C GLY A 36 1.490 -13.684 -11.120 1.00 0.00 C ATOM 542 O GLY A 36 0.833 -13.512 -12.145 1.00 0.00 O ATOM 0 H GLY A 36 1.589 -13.620 -8.384 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.802 -15.456 -10.065 1.00 0.00 H new ATOM 0 HA3 GLY A 36 0.124 -15.094 -10.416 1.00 0.00 H new ATOM 546 N GLN A 37 2.629 -13.051 -10.787 1.00 0.00 N ATOM 547 CA GLN A 37 3.273 -12.188 -11.727 1.00 0.00 C ATOM 548 C GLN A 37 4.746 -12.154 -11.503 1.00 0.00 C ATOM 549 O GLN A 37 5.218 -12.105 -10.368 1.00 0.00 O ATOM 550 CB GLN A 37 2.708 -10.758 -11.736 1.00 0.00 C ATOM 551 CG GLN A 37 3.042 -9.876 -12.940 1.00 0.00 C ATOM 552 CD GLN A 37 2.373 -10.337 -14.227 1.00 0.00 C ATOM 553 OE1 GLN A 37 1.586 -11.243 -14.496 1.00 0.00 O ATOM 554 NE2 GLN A 37 2.496 -9.462 -15.262 1.00 0.00 N ATOM 0 H GLN A 37 3.097 -13.134 -9.884 1.00 0.00 H new ATOM 0 HA GLN A 37 3.065 -12.615 -12.708 1.00 0.00 H new ATOM 0 HB2 GLN A 37 1.623 -10.824 -11.658 1.00 0.00 H new ATOM 0 HB3 GLN A 37 3.062 -10.251 -10.838 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.737 -8.851 -12.727 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.122 -9.864 -13.084 1.00 0.00 H new ATOM 0 HE21 GLN A 37 3.118 -8.658 -15.179 1.00 0.00 H new ATOM 0 HE22 GLN A 37 1.966 -9.610 -16.121 1.00 0.00 H new ATOM 563 N ASN A 38 5.495 -12.174 -12.620 1.00 0.00 N ATOM 564 CA ASN A 38 6.920 -12.100 -12.531 1.00 0.00 C ATOM 565 C ASN A 38 7.300 -10.665 -12.668 1.00 0.00 C ATOM 566 O ASN A 38 6.974 -10.103 -13.712 1.00 0.00 O ATOM 567 CB ASN A 38 7.573 -12.942 -13.639 1.00 0.00 C ATOM 568 CG ASN A 38 7.222 -14.420 -13.554 1.00 0.00 C ATOM 569 OD1 ASN A 38 6.186 -14.759 -14.123 1.00 0.00 O ATOM 570 ND2 ASN A 38 7.988 -15.371 -12.955 1.00 0.00 N ATOM 0 H ASN A 38 5.123 -12.240 -13.568 1.00 0.00 H new ATOM 0 HA ASN A 38 7.266 -12.496 -11.576 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.262 -12.557 -14.610 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.656 -12.828 -13.583 1.00 0.00 H new ATOM 0 HD21 ASN A 38 7.700 -16.349 -12.982 1.00 0.00 H new ATOM 0 HD22 ASN A 38 8.850 -15.106 -12.479 1.00 0.00 H new ATOM 577 N PRO A 39 8.031 -10.031 -11.801 1.00 0.00 N ATOM 578 CA PRO A 39 8.712 -8.798 -12.071 1.00 0.00 C ATOM 579 C PRO A 39 10.003 -8.971 -12.794 1.00 0.00 C ATOM 580 O PRO A 39 10.444 -10.110 -12.940 1.00 0.00 O ATOM 581 CB PRO A 39 8.999 -8.259 -10.672 1.00 0.00 C ATOM 582 CG PRO A 39 9.074 -9.510 -9.782 1.00 0.00 C ATOM 583 CD PRO A 39 7.933 -10.346 -10.384 1.00 0.00 C ATOM 0 HA PRO A 39 8.112 -8.153 -12.713 1.00 0.00 H new ATOM 0 HB2 PRO A 39 9.933 -7.698 -10.647 1.00 0.00 H new ATOM 0 HB3 PRO A 39 8.212 -7.582 -10.339 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.039 -10.012 -9.852 1.00 0.00 H new ATOM 0 HG3 PRO A 39 8.910 -9.281 -8.729 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.066 -11.411 -10.194 1.00 0.00 H new ATOM 0 HD3 PRO A 39 6.963 -10.067 -9.972 1.00 0.00 H new ATOM 591 N THR A 40 10.658 -7.886 -13.244 1.00 0.00 N ATOM 592 CA THR A 40 11.960 -7.852 -13.833 1.00 0.00 C ATOM 593 C THR A 40 12.905 -7.834 -12.681 1.00 0.00 C ATOM 594 O THR A 40 13.025 -6.874 -11.921 1.00 0.00 O ATOM 595 CB THR A 40 12.092 -6.611 -14.665 1.00 0.00 C ATOM 596 OG1 THR A 40 11.067 -6.635 -15.647 1.00 0.00 O ATOM 597 CG2 THR A 40 13.472 -6.672 -15.341 1.00 0.00 C ATOM 0 H THR A 40 10.241 -6.957 -13.190 1.00 0.00 H new ATOM 0 HA THR A 40 12.156 -8.700 -14.489 1.00 0.00 H new ATOM 0 HB THR A 40 12.002 -5.701 -14.072 1.00 0.00 H new ATOM 0 HG1 THR A 40 11.130 -5.832 -16.205 1.00 0.00 H new ATOM 0 HG21 THR A 40 13.614 -5.786 -15.960 1.00 0.00 H new ATOM 0 HG22 THR A 40 14.250 -6.710 -14.578 1.00 0.00 H new ATOM 0 HG23 THR A 40 13.532 -7.564 -15.965 1.00 0.00 H new ATOM 605 N GLU A 41 13.706 -8.900 -12.507 1.00 0.00 N ATOM 606 CA GLU A 41 14.452 -9.113 -11.305 1.00 0.00 C ATOM 607 C GLU A 41 15.555 -8.147 -11.039 1.00 0.00 C ATOM 608 O GLU A 41 15.775 -7.795 -9.882 1.00 0.00 O ATOM 609 CB GLU A 41 14.776 -10.611 -11.172 1.00 0.00 C ATOM 610 CG GLU A 41 13.570 -11.550 -11.119 1.00 0.00 C ATOM 611 CD GLU A 41 14.075 -12.897 -10.621 1.00 0.00 C ATOM 612 OE1 GLU A 41 14.418 -13.011 -9.414 1.00 0.00 O ATOM 613 OE2 GLU A 41 14.165 -13.800 -11.495 1.00 0.00 O ATOM 0 H GLU A 41 13.838 -9.626 -13.211 1.00 0.00 H new ATOM 0 HA GLU A 41 13.819 -8.853 -10.457 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.404 -10.904 -12.013 1.00 0.00 H new ATOM 0 HB3 GLU A 41 15.366 -10.757 -10.267 1.00 0.00 H new ATOM 0 HG2 GLU A 41 12.803 -11.155 -10.452 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.115 -11.649 -12.105 1.00 0.00 H new ATOM 620 N ALA A 42 16.221 -7.671 -12.106 1.00 0.00 N ATOM 621 CA ALA A 42 17.236 -6.666 -12.036 1.00 0.00 C ATOM 622 C ALA A 42 16.611 -5.370 -11.649 1.00 0.00 C ATOM 623 O ALA A 42 17.262 -4.510 -11.058 1.00 0.00 O ATOM 624 CB ALA A 42 18.156 -6.542 -13.262 1.00 0.00 C ATOM 0 H ALA A 42 16.045 -7.999 -13.056 1.00 0.00 H new ATOM 0 HA ALA A 42 17.934 -6.992 -11.265 1.00 0.00 H new ATOM 0 HB1 ALA A 42 18.884 -5.748 -13.092 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.678 -7.485 -13.422 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.559 -6.304 -14.142 1.00 0.00 H new ATOM 630 N GLU A 43 15.323 -5.145 -11.966 1.00 0.00 N ATOM 631 CA GLU A 43 14.725 -3.889 -11.637 1.00 0.00 C ATOM 632 C GLU A 43 14.125 -3.852 -10.274 1.00 0.00 C ATOM 633 O GLU A 43 14.194 -2.871 -9.535 1.00 0.00 O ATOM 634 CB GLU A 43 13.668 -3.628 -12.723 1.00 0.00 C ATOM 635 CG GLU A 43 12.838 -2.346 -12.634 1.00 0.00 C ATOM 636 CD GLU A 43 11.865 -2.222 -13.798 1.00 0.00 C ATOM 637 OE1 GLU A 43 10.956 -3.092 -13.869 1.00 0.00 O ATOM 638 OE2 GLU A 43 12.156 -1.365 -14.674 1.00 0.00 O ATOM 0 H GLU A 43 14.711 -5.811 -12.437 1.00 0.00 H new ATOM 0 HA GLU A 43 15.489 -3.111 -11.613 1.00 0.00 H new ATOM 0 HB2 GLU A 43 14.175 -3.629 -13.688 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.978 -4.472 -12.725 1.00 0.00 H new ATOM 0 HG2 GLU A 43 12.285 -2.335 -11.695 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.503 -1.482 -12.622 1.00 0.00 H new ATOM 645 N LEU A 44 13.552 -4.981 -9.820 1.00 0.00 N ATOM 646 CA LEU A 44 13.138 -5.241 -8.476 1.00 0.00 C ATOM 647 C LEU A 44 14.245 -5.036 -7.500 1.00 0.00 C ATOM 648 O LEU A 44 14.204 -4.309 -6.509 1.00 0.00 O ATOM 649 CB LEU A 44 12.672 -6.705 -8.419 1.00 0.00 C ATOM 650 CG LEU A 44 12.035 -7.106 -7.077 1.00 0.00 C ATOM 651 CD1 LEU A 44 10.860 -6.190 -6.696 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.527 -8.546 -6.890 1.00 0.00 C ATOM 0 H LEU A 44 13.365 -5.770 -10.439 1.00 0.00 H new ATOM 0 HA LEU A 44 12.341 -4.549 -8.205 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.951 -6.878 -9.218 1.00 0.00 H new ATOM 0 HB3 LEU A 44 13.525 -7.355 -8.614 1.00 0.00 H new ATOM 0 HG LEU A 44 12.908 -7.004 -6.432 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.442 -6.512 -5.742 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.213 -5.162 -6.610 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.091 -6.246 -7.466 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.109 -8.657 -5.890 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.757 -8.759 -7.631 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.355 -9.243 -7.017 1.00 0.00 H new ATOM 664 N GLN A 45 15.387 -5.661 -7.838 1.00 0.00 N ATOM 665 CA GLN A 45 16.646 -5.570 -7.166 1.00 0.00 C ATOM 666 C GLN A 45 17.178 -4.190 -6.980 1.00 0.00 C ATOM 667 O GLN A 45 17.809 -3.786 -6.004 1.00 0.00 O ATOM 668 CB GLN A 45 17.675 -6.537 -7.775 1.00 0.00 C ATOM 669 CG GLN A 45 18.986 -6.492 -6.988 1.00 0.00 C ATOM 670 CD GLN A 45 19.954 -7.535 -7.527 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.012 -8.671 -7.059 1.00 0.00 O ATOM 672 NE2 GLN A 45 20.764 -7.238 -8.578 1.00 0.00 N ATOM 0 H GLN A 45 15.432 -6.280 -8.647 1.00 0.00 H new ATOM 0 HA GLN A 45 16.445 -5.892 -6.144 1.00 0.00 H new ATOM 0 HB2 GLN A 45 17.276 -7.551 -7.770 1.00 0.00 H new ATOM 0 HB3 GLN A 45 17.860 -6.272 -8.816 1.00 0.00 H new ATOM 0 HG2 GLN A 45 19.430 -5.499 -7.062 1.00 0.00 H new ATOM 0 HG3 GLN A 45 18.792 -6.676 -5.931 1.00 0.00 H new ATOM 0 HE21 GLN A 45 20.742 -6.306 -8.991 1.00 0.00 H new ATOM 0 HE22 GLN A 45 21.393 -7.948 -8.953 1.00 0.00 H new ATOM 681 N ASP A 46 16.980 -3.240 -7.911 1.00 0.00 N ATOM 682 CA ASP A 46 17.322 -1.855 -7.810 1.00 0.00 C ATOM 683 C ASP A 46 16.483 -1.136 -6.811 1.00 0.00 C ATOM 684 O ASP A 46 17.017 -0.304 -6.080 1.00 0.00 O ATOM 685 CB ASP A 46 17.345 -1.240 -9.219 1.00 0.00 C ATOM 686 CG ASP A 46 18.336 -0.086 -9.186 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.501 -0.321 -8.766 1.00 0.00 O ATOM 688 OD2 ASP A 46 17.899 1.037 -9.554 1.00 0.00 O ATOM 0 H ASP A 46 16.545 -3.460 -8.807 1.00 0.00 H new ATOM 0 HA ASP A 46 18.328 -1.745 -7.406 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.643 -1.983 -9.959 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.353 -0.888 -9.502 1.00 0.00 H new ATOM 693 N MET A 47 15.182 -1.466 -6.721 1.00 0.00 N ATOM 694 CA MET A 47 14.275 -0.975 -5.731 1.00 0.00 C ATOM 695 C MET A 47 14.827 -1.220 -4.368 1.00 0.00 C ATOM 696 O MET A 47 14.969 -0.370 -3.491 1.00 0.00 O ATOM 697 CB MET A 47 12.906 -1.622 -6.003 1.00 0.00 C ATOM 698 CG MET A 47 11.824 -1.016 -5.107 1.00 0.00 C ATOM 699 SD MET A 47 11.502 -1.857 -3.528 1.00 0.00 S ATOM 700 CE MET A 47 10.261 -0.657 -2.964 1.00 0.00 C ATOM 0 H MET A 47 14.739 -2.111 -7.376 1.00 0.00 H new ATOM 0 HA MET A 47 14.141 0.106 -5.783 1.00 0.00 H new ATOM 0 HB2 MET A 47 12.636 -1.483 -7.050 1.00 0.00 H new ATOM 0 HB3 MET A 47 12.967 -2.696 -5.829 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.100 0.016 -4.892 1.00 0.00 H new ATOM 0 HG3 MET A 47 10.892 -0.986 -5.672 1.00 0.00 H new ATOM 0 HE1 MET A 47 9.621 -1.121 -2.213 1.00 0.00 H new ATOM 0 HE2 MET A 47 10.762 0.208 -2.530 1.00 0.00 H new ATOM 0 HE3 MET A 47 9.653 -0.337 -3.810 1.00 0.00 H new ATOM 710 N ILE A 48 15.250 -2.479 -4.159 1.00 0.00 N ATOM 711 CA ILE A 48 15.926 -2.942 -2.987 1.00 0.00 C ATOM 712 C ILE A 48 17.140 -2.159 -2.624 1.00 0.00 C ATOM 713 O ILE A 48 17.330 -1.687 -1.504 1.00 0.00 O ATOM 714 CB ILE A 48 16.208 -4.416 -2.987 1.00 0.00 C ATOM 715 CG1 ILE A 48 14.930 -5.262 -3.111 1.00 0.00 C ATOM 716 CG2 ILE A 48 16.954 -4.798 -1.697 1.00 0.00 C ATOM 717 CD1 ILE A 48 15.195 -6.761 -3.245 1.00 0.00 C ATOM 0 H ILE A 48 15.112 -3.217 -4.849 1.00 0.00 H new ATOM 0 HA ILE A 48 15.198 -2.760 -2.196 1.00 0.00 H new ATOM 0 HB ILE A 48 16.824 -4.628 -3.861 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.305 -5.090 -2.235 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.364 -4.923 -3.979 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.158 -5.869 -1.698 1.00 0.00 H new ATOM 0 HG22 ILE A 48 17.894 -4.249 -1.644 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.339 -4.547 -0.833 1.00 0.00 H new ATOM 0 HD11 ILE A 48 14.247 -7.292 -3.328 1.00 0.00 H new ATOM 0 HD12 ILE A 48 15.794 -6.946 -4.137 1.00 0.00 H new ATOM 0 HD13 ILE A 48 15.734 -7.115 -2.366 1.00 0.00 H new ATOM 729 N ASN A 49 18.116 -2.170 -3.550 1.00 0.00 N ATOM 730 CA ASN A 49 19.345 -1.455 -3.402 1.00 0.00 C ATOM 731 C ASN A 49 19.316 0.030 -3.289 1.00 0.00 C ATOM 732 O ASN A 49 20.330 0.615 -2.912 1.00 0.00 O ATOM 733 CB ASN A 49 20.415 -1.872 -4.425 1.00 0.00 C ATOM 734 CG ASN A 49 20.969 -3.263 -4.152 1.00 0.00 C ATOM 735 OD1 ASN A 49 22.041 -3.348 -3.555 1.00 0.00 O ATOM 736 ND2 ASN A 49 20.271 -4.329 -4.627 1.00 0.00 N ATOM 0 H ASN A 49 18.048 -2.690 -4.425 1.00 0.00 H new ATOM 0 HA ASN A 49 19.611 -1.782 -2.397 1.00 0.00 H new ATOM 0 HB2 ASN A 49 19.986 -1.845 -5.427 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.231 -1.149 -4.408 1.00 0.00 H new ATOM 0 HD21 ASN A 49 20.632 -5.274 -4.496 1.00 0.00 H new ATOM 0 HD22 ASN A 49 19.387 -4.184 -5.114 1.00 0.00 H new ATOM 743 N GLU A 50 18.214 0.687 -3.695 1.00 0.00 N ATOM 744 CA GLU A 50 18.047 2.076 -3.402 1.00 0.00 C ATOM 745 C GLU A 50 18.015 2.442 -1.958 1.00 0.00 C ATOM 746 O GLU A 50 18.788 3.252 -1.450 1.00 0.00 O ATOM 747 CB GLU A 50 16.821 2.547 -4.203 1.00 0.00 C ATOM 748 CG GLU A 50 16.407 3.989 -3.901 1.00 0.00 C ATOM 749 CD GLU A 50 15.201 4.455 -4.706 1.00 0.00 C ATOM 750 OE1 GLU A 50 14.030 4.142 -4.364 1.00 0.00 O ATOM 751 OE2 GLU A 50 15.467 5.228 -5.664 1.00 0.00 O ATOM 0 H GLU A 50 17.449 0.263 -4.219 1.00 0.00 H new ATOM 0 HA GLU A 50 18.943 2.613 -3.713 1.00 0.00 H new ATOM 0 HB2 GLU A 50 17.036 2.455 -5.268 1.00 0.00 H new ATOM 0 HB3 GLU A 50 15.982 1.885 -3.989 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.182 4.079 -2.838 1.00 0.00 H new ATOM 0 HG3 GLU A 50 17.248 4.651 -4.106 1.00 0.00 H new ATOM 758 N VAL A 51 17.091 1.804 -1.216 1.00 0.00 N ATOM 759 CA VAL A 51 16.782 1.841 0.180 1.00 0.00 C ATOM 760 C VAL A 51 17.870 1.326 1.056 1.00 0.00 C ATOM 761 O VAL A 51 18.070 1.715 2.206 1.00 0.00 O ATOM 762 CB VAL A 51 15.459 1.210 0.502 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.901 1.475 1.911 1.00 0.00 C ATOM 764 CG2 VAL A 51 14.431 1.765 -0.498 1.00 0.00 C ATOM 0 H VAL A 51 16.458 1.155 -1.683 1.00 0.00 H new ATOM 0 HA VAL A 51 16.695 2.902 0.412 1.00 0.00 H new ATOM 0 HB VAL A 51 15.628 0.135 0.444 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.943 0.968 2.024 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.601 1.098 2.656 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.763 2.547 2.052 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.453 1.328 -0.295 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.372 2.849 -0.396 1.00 0.00 H new ATOM 0 HG23 VAL A 51 14.738 1.512 -1.513 1.00 0.00 H new ATOM 774 N ASP A 52 18.616 0.389 0.443 1.00 0.00 N ATOM 775 CA ASP A 52 19.773 -0.208 1.034 1.00 0.00 C ATOM 776 C ASP A 52 20.817 0.686 1.608 1.00 0.00 C ATOM 777 O ASP A 52 21.654 1.264 0.916 1.00 0.00 O ATOM 778 CB ASP A 52 20.352 -1.299 0.117 1.00 0.00 C ATOM 779 CG ASP A 52 21.178 -2.291 0.922 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.641 -3.027 1.793 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.384 -2.332 0.559 1.00 0.00 O ATOM 0 H ASP A 52 18.408 0.037 -0.491 1.00 0.00 H new ATOM 0 HA ASP A 52 19.381 -0.659 1.946 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.542 -1.821 -0.393 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.972 -0.842 -0.654 1.00 0.00 H new ATOM 786 N ALA A 53 20.819 0.741 2.952 1.00 0.00 N ATOM 787 CA ALA A 53 21.611 1.558 3.818 1.00 0.00 C ATOM 788 C ALA A 53 23.004 1.106 4.093 1.00 0.00 C ATOM 789 O ALA A 53 24.026 1.767 3.909 1.00 0.00 O ATOM 790 CB ALA A 53 20.759 1.559 5.098 1.00 0.00 C ATOM 0 H ALA A 53 20.192 0.143 3.490 1.00 0.00 H new ATOM 0 HA ALA A 53 21.803 2.529 3.361 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.253 2.158 5.863 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.778 1.983 4.882 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.641 0.537 5.457 1.00 0.00 H new ATOM 796 N ASP A 54 23.030 -0.126 4.630 1.00 0.00 N ATOM 797 CA ASP A 54 24.213 -0.787 5.087 1.00 0.00 C ATOM 798 C ASP A 54 25.231 -1.096 4.044 1.00 0.00 C ATOM 799 O ASP A 54 26.330 -0.552 4.142 1.00 0.00 O ATOM 800 CB ASP A 54 23.950 -2.021 5.966 1.00 0.00 C ATOM 801 CG ASP A 54 22.818 -2.904 5.461 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.826 -3.350 4.282 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.897 -3.201 6.267 1.00 0.00 O ATOM 0 H ASP A 54 22.187 -0.688 4.751 1.00 0.00 H new ATOM 0 HA ASP A 54 24.656 -0.016 5.717 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.862 -2.614 6.026 1.00 0.00 H new ATOM 0 HB3 ASP A 54 23.717 -1.691 6.979 1.00 0.00 H new ATOM 808 N GLY A 55 24.900 -2.097 3.209 1.00 0.00 N ATOM 809 CA GLY A 55 25.897 -2.753 2.420 1.00 0.00 C ATOM 810 C GLY A 55 25.437 -4.024 1.793 1.00 0.00 C ATOM 811 O GLY A 55 26.068 -4.424 0.816 1.00 0.00 O ATOM 0 H GLY A 55 23.952 -2.450 3.080 1.00 0.00 H new ATOM 0 HA2 GLY A 55 26.230 -2.073 1.636 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.763 -2.963 3.048 1.00 0.00 H new ATOM 815 N ASN A 56 24.409 -4.709 2.326 1.00 0.00 N ATOM 816 CA ASN A 56 24.193 -6.059 1.907 1.00 0.00 C ATOM 817 C ASN A 56 23.286 -6.287 0.747 1.00 0.00 C ATOM 818 O ASN A 56 23.289 -7.432 0.298 1.00 0.00 O ATOM 819 CB ASN A 56 23.805 -6.952 3.097 1.00 0.00 C ATOM 820 CG ASN A 56 22.446 -6.628 3.701 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.579 -5.890 3.234 1.00 0.00 O ATOM 822 ND2 ASN A 56 22.240 -7.296 4.868 1.00 0.00 N ATOM 0 H ASN A 56 23.752 -4.348 3.018 1.00 0.00 H new ATOM 0 HA ASN A 56 25.167 -6.347 1.511 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.807 -7.993 2.772 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.566 -6.858 3.871 1.00 0.00 H new ATOM 0 HD21 ASN A 56 21.358 -7.189 5.368 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.968 -7.904 5.243 1.00 0.00 H new ATOM 829 N GLY A 57 22.424 -5.335 0.348 1.00 0.00 N ATOM 830 CA GLY A 57 21.516 -5.444 -0.752 1.00 0.00 C ATOM 831 C GLY A 57 20.367 -6.354 -0.481 1.00 0.00 C ATOM 832 O GLY A 57 19.786 -6.895 -1.420 1.00 0.00 O ATOM 0 H GLY A 57 22.357 -4.435 0.822 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.135 -4.453 -0.999 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.057 -5.805 -1.627 1.00 0.00 H new ATOM 836 N THR A 58 19.980 -6.523 0.796 1.00 0.00 N ATOM 837 CA THR A 58 18.798 -7.199 1.231 1.00 0.00 C ATOM 838 C THR A 58 18.129 -6.173 2.080 1.00 0.00 C ATOM 839 O THR A 58 18.800 -5.437 2.802 1.00 0.00 O ATOM 840 CB THR A 58 19.005 -8.397 2.109 1.00 0.00 C ATOM 841 OG1 THR A 58 19.896 -8.255 3.206 1.00 0.00 O ATOM 842 CG2 THR A 58 19.561 -9.589 1.311 1.00 0.00 C ATOM 0 H THR A 58 20.530 -6.163 1.576 1.00 0.00 H new ATOM 0 HA THR A 58 18.267 -7.572 0.355 1.00 0.00 H new ATOM 0 HB THR A 58 17.999 -8.544 2.502 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.987 -7.306 3.433 1.00 0.00 H new ATOM 0 HG21 THR A 58 19.699 -10.440 1.978 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.860 -9.857 0.521 1.00 0.00 H new ATOM 0 HG23 THR A 58 20.519 -9.316 0.868 1.00 0.00 H new ATOM 850 N ILE A 59 16.789 -6.170 2.186 1.00 0.00 N ATOM 851 CA ILE A 59 16.012 -5.261 2.970 1.00 0.00 C ATOM 852 C ILE A 59 16.005 -5.721 4.387 1.00 0.00 C ATOM 853 O ILE A 59 15.385 -6.750 4.655 1.00 0.00 O ATOM 854 CB ILE A 59 14.585 -5.154 2.521 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.384 -5.342 1.007 1.00 0.00 C ATOM 856 CG2 ILE A 59 14.287 -3.677 2.829 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.954 -5.309 0.471 1.00 0.00 C ATOM 0 H ILE A 59 16.210 -6.848 1.691 1.00 0.00 H new ATOM 0 HA ILE A 59 16.475 -4.281 2.854 1.00 0.00 H new ATOM 0 HB ILE A 59 13.965 -5.912 3.000 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.952 -4.566 0.494 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.825 -6.298 0.726 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.259 -3.447 2.548 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.421 -3.493 3.895 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.969 -3.043 2.263 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.967 -5.455 -0.609 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.372 -6.104 0.937 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.501 -4.345 0.702 1.00 0.00 H new ATOM 869 N ASP A 60 16.671 -5.001 5.307 1.00 0.00 N ATOM 870 CA ASP A 60 16.646 -5.114 6.733 1.00 0.00 C ATOM 871 C ASP A 60 15.502 -4.372 7.333 1.00 0.00 C ATOM 872 O ASP A 60 14.684 -3.661 6.752 1.00 0.00 O ATOM 873 CB ASP A 60 17.960 -4.562 7.312 1.00 0.00 C ATOM 874 CG ASP A 60 19.102 -5.461 6.858 1.00 0.00 C ATOM 875 OD1 ASP A 60 19.341 -6.404 7.657 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.781 -5.295 5.809 1.00 0.00 O ATOM 0 H ASP A 60 17.300 -4.253 5.014 1.00 0.00 H new ATOM 0 HA ASP A 60 16.529 -6.170 6.978 1.00 0.00 H new ATOM 0 HB2 ASP A 60 18.124 -3.540 6.972 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.911 -4.532 8.400 1.00 0.00 H new ATOM 881 N PHE A 61 15.348 -4.486 8.665 1.00 0.00 N ATOM 882 CA PHE A 61 14.327 -3.799 9.393 1.00 0.00 C ATOM 883 C PHE A 61 14.215 -2.319 9.264 1.00 0.00 C ATOM 884 O PHE A 61 13.104 -1.968 8.868 1.00 0.00 O ATOM 885 CB PHE A 61 14.279 -4.271 10.857 1.00 0.00 C ATOM 886 CG PHE A 61 14.130 -5.736 11.079 1.00 0.00 C ATOM 887 CD1 PHE A 61 12.911 -6.349 10.901 1.00 0.00 C ATOM 888 CD2 PHE A 61 15.086 -6.525 11.674 1.00 0.00 C ATOM 889 CE1 PHE A 61 12.634 -7.661 11.207 1.00 0.00 C ATOM 890 CE2 PHE A 61 14.855 -7.820 12.073 1.00 0.00 C ATOM 891 CZ PHE A 61 13.597 -8.350 11.905 1.00 0.00 C ATOM 0 H PHE A 61 15.947 -5.069 9.249 1.00 0.00 H new ATOM 0 HA PHE A 61 13.424 -4.105 8.865 1.00 0.00 H new ATOM 0 HB2 PHE A 61 15.193 -3.942 11.351 1.00 0.00 H new ATOM 0 HB3 PHE A 61 13.450 -3.765 11.351 1.00 0.00 H new ATOM 0 HD1 PHE A 61 12.110 -5.754 10.489 1.00 0.00 H new ATOM 0 HD2 PHE A 61 16.068 -6.106 11.836 1.00 0.00 H new ATOM 0 HE1 PHE A 61 11.705 -8.127 10.913 1.00 0.00 H new ATOM 0 HE2 PHE A 61 15.647 -8.410 12.510 1.00 0.00 H new ATOM 0 HZ PHE A 61 13.364 -9.317 12.326 1.00 0.00 H new ATOM 901 N PRO A 62 15.096 -1.400 9.526 1.00 0.00 N ATOM 902 CA PRO A 62 14.814 -0.005 9.351 1.00 0.00 C ATOM 903 C PRO A 62 14.836 0.420 7.923 1.00 0.00 C ATOM 904 O PRO A 62 14.536 1.587 7.677 1.00 0.00 O ATOM 905 CB PRO A 62 15.962 0.695 10.075 1.00 0.00 C ATOM 906 CG PRO A 62 17.161 -0.213 9.755 1.00 0.00 C ATOM 907 CD PRO A 62 16.489 -1.586 9.906 1.00 0.00 C ATOM 0 HA PRO A 62 13.818 0.232 9.725 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.113 1.711 9.709 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.782 0.766 11.148 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.555 -0.048 8.752 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.989 -0.073 10.450 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.971 -2.327 9.269 1.00 0.00 H new ATOM 0 HD3 PRO A 62 16.568 -1.947 10.931 1.00 0.00 H new ATOM 915 N GLU A 63 15.192 -0.458 6.969 1.00 0.00 N ATOM 916 CA GLU A 63 15.085 -0.192 5.568 1.00 0.00 C ATOM 917 C GLU A 63 13.700 -0.406 5.062 1.00 0.00 C ATOM 918 O GLU A 63 13.138 0.427 4.353 1.00 0.00 O ATOM 919 CB GLU A 63 16.043 -1.184 4.888 1.00 0.00 C ATOM 920 CG GLU A 63 17.513 -0.817 5.098 1.00 0.00 C ATOM 921 CD GLU A 63 18.555 -1.840 4.669 1.00 0.00 C ATOM 922 OE1 GLU A 63 18.172 -2.966 4.255 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.757 -1.478 4.783 1.00 0.00 O ATOM 0 H GLU A 63 15.567 -1.383 7.179 1.00 0.00 H new ATOM 0 HA GLU A 63 15.332 0.848 5.357 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.862 -2.185 5.280 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.829 -1.216 3.820 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.709 0.111 4.560 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.661 -0.609 6.158 1.00 0.00 H new ATOM 930 N PHE A 64 13.073 -1.548 5.399 1.00 0.00 N ATOM 931 CA PHE A 64 11.651 -1.682 5.328 1.00 0.00 C ATOM 932 C PHE A 64 10.767 -0.644 5.928 1.00 0.00 C ATOM 933 O PHE A 64 9.753 -0.182 5.407 1.00 0.00 O ATOM 934 CB PHE A 64 11.342 -3.099 5.841 1.00 0.00 C ATOM 935 CG PHE A 64 9.997 -3.555 5.389 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.878 -3.185 6.097 1.00 0.00 C ATOM 937 CD2 PHE A 64 9.848 -4.227 4.199 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.632 -3.605 5.693 1.00 0.00 C ATOM 939 CE2 PHE A 64 8.610 -4.615 3.744 1.00 0.00 C ATOM 940 CZ PHE A 64 7.511 -4.265 4.493 1.00 0.00 C ATOM 0 H PHE A 64 13.557 -2.385 5.723 1.00 0.00 H new ATOM 0 HA PHE A 64 11.386 -1.509 4.285 1.00 0.00 H new ATOM 0 HB2 PHE A 64 12.103 -3.792 5.483 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.386 -3.112 6.930 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.978 -2.562 6.974 1.00 0.00 H new ATOM 0 HD2 PHE A 64 10.723 -4.455 3.608 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.764 -3.419 6.308 1.00 0.00 H new ATOM 0 HE2 PHE A 64 8.504 -5.177 2.828 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.526 -4.516 4.129 1.00 0.00 H new ATOM 950 N LEU A 65 11.151 -0.158 7.122 1.00 0.00 N ATOM 951 CA LEU A 65 10.452 0.922 7.747 1.00 0.00 C ATOM 952 C LEU A 65 10.520 2.221 7.021 1.00 0.00 C ATOM 953 O LEU A 65 9.524 2.941 6.980 1.00 0.00 O ATOM 954 CB LEU A 65 10.868 1.098 9.217 1.00 0.00 C ATOM 955 CG LEU A 65 10.514 -0.029 10.202 1.00 0.00 C ATOM 956 CD1 LEU A 65 11.256 -0.013 11.549 1.00 0.00 C ATOM 957 CD2 LEU A 65 9.005 0.004 10.498 1.00 0.00 C ATOM 0 H LEU A 65 11.945 -0.513 7.655 1.00 0.00 H new ATOM 0 HA LEU A 65 9.405 0.621 7.706 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.948 1.240 9.245 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.416 2.019 9.585 1.00 0.00 H new ATOM 0 HG LEU A 65 10.833 -0.938 9.693 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.923 -0.854 12.158 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.329 -0.093 11.374 1.00 0.00 H new ATOM 0 HD13 LEU A 65 11.042 0.920 12.071 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.754 -0.795 11.196 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.741 0.966 10.937 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.449 -0.136 9.571 1.00 0.00 H new ATOM 969 N THR A 66 11.620 2.549 6.320 1.00 0.00 N ATOM 970 CA THR A 66 11.750 3.612 5.373 1.00 0.00 C ATOM 971 C THR A 66 10.962 3.521 4.112 1.00 0.00 C ATOM 972 O THR A 66 10.581 4.540 3.539 1.00 0.00 O ATOM 973 CB THR A 66 13.194 3.908 5.096 1.00 0.00 C ATOM 974 OG1 THR A 66 13.915 4.221 6.279 1.00 0.00 O ATOM 975 CG2 THR A 66 13.385 5.112 4.158 1.00 0.00 C ATOM 0 H THR A 66 12.489 2.026 6.426 1.00 0.00 H new ATOM 0 HA THR A 66 11.276 4.451 5.882 1.00 0.00 H new ATOM 0 HB THR A 66 13.569 2.995 4.634 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.132 3.394 6.758 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.449 5.279 3.993 1.00 0.00 H new ATOM 0 HG22 THR A 66 12.897 4.911 3.204 1.00 0.00 H new ATOM 0 HG23 THR A 66 12.944 6.000 4.611 1.00 0.00 H new ATOM 983 N MET A 67 10.613 2.321 3.614 1.00 0.00 N ATOM 984 CA MET A 67 9.763 2.072 2.491 1.00 0.00 C ATOM 985 C MET A 67 8.368 2.456 2.849 1.00 0.00 C ATOM 986 O MET A 67 7.701 3.112 2.051 1.00 0.00 O ATOM 987 CB MET A 67 9.724 0.645 1.921 1.00 0.00 C ATOM 988 CG MET A 67 11.113 0.138 1.527 1.00 0.00 C ATOM 989 SD MET A 67 11.196 -1.664 1.298 1.00 0.00 S ATOM 990 CE MET A 67 12.707 -1.682 0.291 1.00 0.00 C ATOM 0 H MET A 67 10.954 1.455 4.032 1.00 0.00 H new ATOM 0 HA MET A 67 10.208 2.674 1.698 1.00 0.00 H new ATOM 0 HB2 MET A 67 9.291 -0.028 2.661 1.00 0.00 H new ATOM 0 HB3 MET A 67 9.071 0.622 1.049 1.00 0.00 H new ATOM 0 HG2 MET A 67 11.420 0.627 0.603 1.00 0.00 H new ATOM 0 HG3 MET A 67 11.828 0.431 2.295 1.00 0.00 H new ATOM 0 HE1 MET A 67 12.704 -2.561 -0.354 1.00 0.00 H new ATOM 0 HE2 MET A 67 12.746 -0.782 -0.322 1.00 0.00 H new ATOM 0 HE3 MET A 67 13.579 -1.714 0.944 1.00 0.00 H new ATOM 1000 N MET A 68 7.862 2.053 4.029 1.00 0.00 N ATOM 1001 CA MET A 68 6.581 2.385 4.569 1.00 0.00 C ATOM 1002 C MET A 68 6.518 3.840 4.885 1.00 0.00 C ATOM 1003 O MET A 68 5.583 4.527 4.476 1.00 0.00 O ATOM 1004 CB MET A 68 6.351 1.660 5.906 1.00 0.00 C ATOM 1005 CG MET A 68 6.409 0.132 5.858 1.00 0.00 C ATOM 1006 SD MET A 68 5.099 -0.566 4.808 1.00 0.00 S ATOM 1007 CE MET A 68 3.617 0.169 5.556 1.00 0.00 C ATOM 0 H MET A 68 8.393 1.446 4.654 1.00 0.00 H new ATOM 0 HA MET A 68 5.837 2.097 3.826 1.00 0.00 H new ATOM 0 HB2 MET A 68 7.097 2.010 6.620 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.376 1.955 6.294 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.382 -0.182 5.481 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.315 -0.266 6.868 1.00 0.00 H new ATOM 0 HE1 MET A 68 2.788 -0.536 5.489 1.00 0.00 H new ATOM 0 HE2 MET A 68 3.814 0.399 6.603 1.00 0.00 H new ATOM 0 HE3 MET A 68 3.358 1.085 5.025 1.00 0.00 H new ATOM 1017 N ALA A 69 7.560 4.386 5.537 1.00 0.00 N ATOM 1018 CA ALA A 69 7.622 5.786 5.824 1.00 0.00 C ATOM 1019 C ALA A 69 7.490 6.684 4.642 1.00 0.00 C ATOM 1020 O ALA A 69 6.511 7.427 4.638 1.00 0.00 O ATOM 1021 CB ALA A 69 8.901 6.079 6.627 1.00 0.00 C ATOM 0 H ALA A 69 8.365 3.854 5.868 1.00 0.00 H new ATOM 0 HA ALA A 69 6.739 6.020 6.419 1.00 0.00 H new ATOM 0 HB1 ALA A 69 8.955 7.145 6.849 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.883 5.514 7.559 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.773 5.786 6.042 1.00 0.00 H new ATOM 1027 N ARG A 70 8.302 6.527 3.581 1.00 0.00 N ATOM 1028 CA ARG A 70 8.194 7.304 2.386 1.00 0.00 C ATOM 1029 C ARG A 70 6.981 7.187 1.528 1.00 0.00 C ATOM 1030 O ARG A 70 6.400 6.136 1.260 1.00 0.00 O ATOM 1031 CB ARG A 70 9.478 7.061 1.575 1.00 0.00 C ATOM 1032 CG ARG A 70 9.592 5.871 0.620 1.00 0.00 C ATOM 1033 CD ARG A 70 10.976 5.413 0.156 1.00 0.00 C ATOM 1034 NE ARG A 70 10.675 4.208 -0.668 1.00 0.00 N ATOM 1035 CZ ARG A 70 11.362 3.958 -1.820 1.00 0.00 C ATOM 1036 NH1 ARG A 70 12.496 4.646 -2.142 1.00 0.00 N ATOM 1037 NH2 ARG A 70 10.943 2.923 -2.606 1.00 0.00 N ATOM 0 H ARG A 70 9.055 5.840 3.554 1.00 0.00 H new ATOM 0 HA ARG A 70 8.067 8.328 2.737 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.660 7.961 0.987 1.00 0.00 H new ATOM 0 HB3 ARG A 70 10.296 6.976 2.290 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.109 5.019 1.099 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.010 6.109 -0.270 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.481 6.184 -0.426 1.00 0.00 H new ATOM 0 HD3 ARG A 70 11.625 5.173 0.999 1.00 0.00 H new ATOM 0 HE ARG A 70 9.946 3.562 -0.367 1.00 0.00 H new ATOM 0 HH11 ARG A 70 12.850 5.368 -1.514 1.00 0.00 H new ATOM 0 HH12 ARG A 70 12.989 4.438 -3.010 1.00 0.00 H new ATOM 0 HH21 ARG A 70 10.138 2.363 -2.325 1.00 0.00 H new ATOM 0 HH22 ARG A 70 11.435 2.710 -3.474 1.00 0.00 H new ATOM 1051 N LYS A 71 6.697 8.338 0.892 1.00 0.00 N ATOM 1052 CA LYS A 71 5.637 8.284 -0.067 1.00 0.00 C ATOM 1053 C LYS A 71 6.163 8.725 -1.389 1.00 0.00 C ATOM 1054 O LYS A 71 7.246 9.307 -1.420 1.00 0.00 O ATOM 1055 CB LYS A 71 4.483 9.233 0.298 1.00 0.00 C ATOM 1056 CG LYS A 71 3.952 8.935 1.702 1.00 0.00 C ATOM 1057 CD LYS A 71 2.811 9.833 2.186 1.00 0.00 C ATOM 1058 CE LYS A 71 2.274 9.427 3.560 1.00 0.00 C ATOM 1059 NZ LYS A 71 3.348 9.255 4.564 1.00 0.00 N ATOM 0 H LYS A 71 7.158 9.238 1.024 1.00 0.00 H new ATOM 0 HA LYS A 71 5.266 7.259 -0.089 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.827 10.266 0.247 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.678 9.129 -0.429 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.611 7.900 1.729 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.779 9.017 2.408 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.161 10.865 2.229 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.998 9.802 1.460 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.573 10.185 3.910 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.716 8.495 3.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.926 9.148 5.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.905 8.407 4.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.969 10.089 4.555 1.00 0.00 H new ATOM 1073 N MET A 72 5.406 8.488 -2.476 1.00 0.00 N ATOM 1074 CA MET A 72 5.722 8.937 -3.796 1.00 0.00 C ATOM 1075 C MET A 72 5.089 10.264 -4.039 1.00 0.00 C ATOM 1076 O MET A 72 4.121 10.615 -3.367 1.00 0.00 O ATOM 1077 CB MET A 72 5.431 7.981 -4.966 1.00 0.00 C ATOM 1078 CG MET A 72 6.006 6.569 -4.836 1.00 0.00 C ATOM 1079 SD MET A 72 5.423 5.378 -6.080 1.00 0.00 S ATOM 1080 CE MET A 72 6.768 4.213 -5.720 1.00 0.00 C ATOM 0 H MET A 72 4.535 7.960 -2.432 1.00 0.00 H new ATOM 0 HA MET A 72 6.810 8.996 -3.796 1.00 0.00 H new ATOM 0 HB2 MET A 72 4.350 7.902 -5.085 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.821 8.428 -5.880 1.00 0.00 H new ATOM 0 HG2 MET A 72 7.093 6.630 -4.896 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.762 6.184 -3.846 1.00 0.00 H new ATOM 0 HE1 MET A 72 7.393 4.094 -6.605 1.00 0.00 H new ATOM 0 HE2 MET A 72 7.372 4.597 -4.898 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.348 3.247 -5.440 1.00 0.00 H new ATOM 1090 N LYS A 73 5.590 10.973 -5.066 1.00 0.00 N ATOM 1091 CA LYS A 73 4.870 12.059 -5.655 1.00 0.00 C ATOM 1092 C LYS A 73 3.551 11.804 -6.300 1.00 0.00 C ATOM 1093 O LYS A 73 3.272 10.691 -6.743 1.00 0.00 O ATOM 1094 CB LYS A 73 5.744 12.832 -6.658 1.00 0.00 C ATOM 1095 CG LYS A 73 5.938 12.121 -7.998 1.00 0.00 C ATOM 1096 CD LYS A 73 6.790 13.004 -8.912 1.00 0.00 C ATOM 1097 CE LYS A 73 6.915 12.533 -10.362 1.00 0.00 C ATOM 1098 NZ LYS A 73 7.447 11.153 -10.400 1.00 0.00 N ATOM 0 H LYS A 73 6.500 10.793 -5.491 1.00 0.00 H new ATOM 0 HA LYS A 73 4.622 12.629 -4.760 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.293 13.808 -6.839 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.721 13.011 -6.209 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.424 11.157 -7.846 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.972 11.921 -8.461 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.369 14.009 -8.911 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.791 13.077 -8.486 1.00 0.00 H new ATOM 0 HE2 LYS A 73 5.941 12.570 -10.851 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.575 13.202 -10.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 8.244 11.107 -11.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.772 10.880 -9.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.699 10.501 -10.710 1.00 0.00 H new ATOM 1112 N ASP A 74 2.608 12.762 -6.345 1.00 0.00 N ATOM 1113 CA ASP A 74 1.222 12.491 -6.576 1.00 0.00 C ATOM 1114 C ASP A 74 0.898 11.828 -7.871 1.00 0.00 C ATOM 1115 O ASP A 74 0.131 10.871 -7.964 1.00 0.00 O ATOM 1116 CB ASP A 74 0.383 13.765 -6.380 1.00 0.00 C ATOM 1117 CG ASP A 74 0.365 14.282 -4.949 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -0.375 13.709 -4.106 1.00 0.00 O ATOM 1119 OD2 ASP A 74 1.175 15.187 -4.613 1.00 0.00 O ATOM 0 H ASP A 74 2.815 13.753 -6.217 1.00 0.00 H new ATOM 0 HA ASP A 74 0.955 11.748 -5.824 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.771 14.547 -7.033 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.641 13.565 -6.696 1.00 0.00 H new ATOM 1124 N THR A 75 1.540 12.333 -8.940 1.00 0.00 N ATOM 1125 CA THR A 75 1.476 11.837 -10.279 1.00 0.00 C ATOM 1126 C THR A 75 1.582 10.352 -10.337 1.00 0.00 C ATOM 1127 O THR A 75 0.877 9.649 -11.060 1.00 0.00 O ATOM 1128 CB THR A 75 2.516 12.319 -11.247 1.00 0.00 C ATOM 1129 OG1 THR A 75 2.792 13.709 -11.150 1.00 0.00 O ATOM 1130 CG2 THR A 75 1.925 12.193 -12.661 1.00 0.00 C ATOM 0 H THR A 75 2.148 13.148 -8.860 1.00 0.00 H new ATOM 0 HA THR A 75 0.506 12.231 -10.582 1.00 0.00 H new ATOM 0 HB THR A 75 3.412 11.735 -11.038 1.00 0.00 H new ATOM 0 HG1 THR A 75 3.478 13.953 -11.806 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.656 12.536 -13.393 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.674 11.151 -12.859 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.025 12.803 -12.735 1.00 0.00 H new ATOM 1138 N ASP A 76 2.519 9.719 -9.608 1.00 0.00 N ATOM 1139 CA ASP A 76 2.839 8.326 -9.595 1.00 0.00 C ATOM 1140 C ASP A 76 1.971 7.568 -8.650 1.00 0.00 C ATOM 1141 O ASP A 76 1.728 6.367 -8.760 1.00 0.00 O ATOM 1142 CB ASP A 76 4.283 7.951 -9.221 1.00 0.00 C ATOM 1143 CG ASP A 76 5.177 8.375 -10.378 1.00 0.00 C ATOM 1144 OD1 ASP A 76 5.266 9.598 -10.669 1.00 0.00 O ATOM 1145 OD2 ASP A 76 5.892 7.504 -10.942 1.00 0.00 O ATOM 0 H ASP A 76 3.112 10.240 -8.962 1.00 0.00 H new ATOM 0 HA ASP A 76 2.680 8.059 -10.640 1.00 0.00 H new ATOM 0 HB2 ASP A 76 4.583 8.451 -8.300 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.368 6.879 -9.043 1.00 0.00 H new ATOM 1150 N SER A 77 1.399 8.297 -7.675 1.00 0.00 N ATOM 1151 CA SER A 77 0.685 7.749 -6.564 1.00 0.00 C ATOM 1152 C SER A 77 -0.693 7.307 -6.919 1.00 0.00 C ATOM 1153 O SER A 77 -1.296 6.411 -6.330 1.00 0.00 O ATOM 1154 CB SER A 77 0.451 8.831 -5.497 1.00 0.00 C ATOM 1155 OG SER A 77 1.678 9.249 -4.917 1.00 0.00 O ATOM 0 H SER A 77 1.436 9.316 -7.661 1.00 0.00 H new ATOM 0 HA SER A 77 1.296 6.913 -6.224 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.053 9.687 -5.946 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.209 8.444 -4.721 1.00 0.00 H new ATOM 0 HG SER A 77 2.195 9.757 -5.576 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.193 7.952 -7.987 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.367 7.574 -8.712 1.00 0.00 C ATOM 1163 C GLU A 78 -2.281 6.233 -9.357 1.00 0.00 C ATOM 1164 O GLU A 78 -3.147 5.369 -9.236 1.00 0.00 O ATOM 1165 CB GLU A 78 -2.709 8.632 -9.774 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.157 8.548 -10.261 1.00 0.00 C ATOM 1167 CD GLU A 78 -4.539 9.772 -11.081 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.174 10.916 -10.698 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -5.194 9.567 -12.138 1.00 0.00 O ATOM 0 H GLU A 78 -0.751 8.789 -8.368 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.160 7.510 -7.967 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.528 9.624 -9.361 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.038 8.514 -10.625 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.288 7.649 -10.863 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -4.826 8.458 -9.405 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.115 5.974 -9.977 1.00 0.00 N ATOM 1177 CA GLU A 79 -0.793 4.740 -10.623 1.00 0.00 C ATOM 1178 C GLU A 79 -0.737 3.563 -9.711 1.00 0.00 C ATOM 1179 O GLU A 79 -1.119 2.434 -10.014 1.00 0.00 O ATOM 1180 CB GLU A 79 0.560 4.852 -11.347 1.00 0.00 C ATOM 1181 CG GLU A 79 0.474 5.752 -12.581 1.00 0.00 C ATOM 1182 CD GLU A 79 1.523 5.387 -13.622 1.00 0.00 C ATOM 1183 OE1 GLU A 79 1.667 4.164 -13.892 1.00 0.00 O ATOM 1184 OE2 GLU A 79 2.210 6.300 -14.152 1.00 0.00 O ATOM 0 H GLU A 79 -0.361 6.659 -10.030 1.00 0.00 H new ATOM 0 HA GLU A 79 -1.610 4.568 -11.324 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.308 5.248 -10.660 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.896 3.859 -11.645 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.519 5.670 -13.022 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.605 6.792 -12.282 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.201 3.784 -8.497 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.162 2.810 -7.451 1.00 0.00 C ATOM 1193 C GLU A 80 -1.443 2.094 -7.192 1.00 0.00 C ATOM 1194 O GLU A 80 -1.478 0.868 -7.094 1.00 0.00 O ATOM 1195 CB GLU A 80 0.173 3.479 -6.107 1.00 0.00 C ATOM 1196 CG GLU A 80 1.632 3.934 -6.026 1.00 0.00 C ATOM 1197 CD GLU A 80 2.113 4.372 -4.650 1.00 0.00 C ATOM 1198 OE1 GLU A 80 1.594 5.437 -4.220 1.00 0.00 O ATOM 1199 OE2 GLU A 80 2.824 3.598 -3.955 1.00 0.00 O ATOM 0 H GLU A 80 0.221 4.675 -8.234 1.00 0.00 H new ATOM 0 HA GLU A 80 0.586 2.100 -7.804 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.481 4.339 -5.960 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.032 2.780 -5.296 1.00 0.00 H new ATOM 0 HG2 GLU A 80 2.267 3.118 -6.369 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.774 4.762 -6.720 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.535 2.859 -7.012 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.860 2.403 -6.727 1.00 0.00 C ATOM 1208 C ILE A 81 -4.415 1.588 -7.844 1.00 0.00 C ATOM 1209 O ILE A 81 -5.054 0.562 -7.619 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.727 3.548 -6.295 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -4.076 4.476 -5.256 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -6.052 3.040 -5.701 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -3.366 3.874 -4.043 1.00 0.00 C ATOM 0 H ILE A 81 -2.486 3.876 -7.071 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.829 1.717 -5.880 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.892 4.125 -7.205 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.351 5.097 -5.783 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.854 5.142 -4.881 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.663 3.889 -5.395 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.588 2.459 -6.451 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.845 2.411 -4.835 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.968 4.675 -3.420 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.074 3.281 -3.464 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.549 3.236 -4.379 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.169 1.881 -9.134 1.00 0.00 N ATOM 1226 CA ARG A 82 -4.490 1.171 -10.333 1.00 0.00 C ATOM 1227 C ARG A 82 -3.776 -0.135 -10.411 1.00 0.00 C ATOM 1228 O ARG A 82 -4.383 -1.172 -10.673 1.00 0.00 O ATOM 1229 CB ARG A 82 -4.178 2.036 -11.565 1.00 0.00 C ATOM 1230 CG ARG A 82 -4.594 1.488 -12.932 1.00 0.00 C ATOM 1231 CD ARG A 82 -3.566 0.529 -13.536 1.00 0.00 C ATOM 1232 NE ARG A 82 -4.101 0.202 -14.888 1.00 0.00 N ATOM 1233 CZ ARG A 82 -3.426 -0.023 -16.053 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -2.063 -0.041 -16.128 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -4.136 -0.022 -17.219 1.00 0.00 N ATOM 0 H ARG A 82 -3.673 2.742 -9.362 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.558 0.955 -10.315 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -4.661 3.004 -11.429 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -3.103 2.216 -11.587 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.549 0.972 -12.834 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.751 2.321 -13.618 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -2.582 0.993 -13.601 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -3.455 -0.368 -12.927 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.117 0.137 -14.952 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -1.504 0.118 -15.290 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -1.604 -0.214 -17.022 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -5.142 0.144 -17.203 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -3.660 -0.187 -18.106 1.00 0.00 H new ATOM 1249 N GLU A 83 -2.472 -0.179 -10.084 1.00 0.00 N ATOM 1250 CA GLU A 83 -1.819 -1.446 -10.198 1.00 0.00 C ATOM 1251 C GLU A 83 -2.047 -2.343 -9.030 1.00 0.00 C ATOM 1252 O GLU A 83 -1.785 -3.534 -9.191 1.00 0.00 O ATOM 1253 CB GLU A 83 -0.304 -1.251 -10.376 1.00 0.00 C ATOM 1254 CG GLU A 83 0.129 -0.457 -11.609 1.00 0.00 C ATOM 1255 CD GLU A 83 -0.359 -1.037 -12.929 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -0.791 -2.217 -13.028 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -0.279 -0.344 -13.978 1.00 0.00 O ATOM 0 H GLU A 83 -1.902 0.603 -9.762 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.258 -1.927 -11.072 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.084 -0.749 -9.490 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.166 -2.233 -10.417 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.238 0.565 -11.516 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.218 -0.404 -11.629 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.550 -1.853 -7.882 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.874 -2.612 -6.715 1.00 0.00 C ATOM 1266 C ALA A 84 -4.159 -3.343 -6.903 1.00 0.00 C ATOM 1267 O ALA A 84 -4.296 -4.531 -6.614 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.077 -1.705 -5.490 1.00 0.00 C ATOM 0 H ALA A 84 -2.743 -0.858 -7.763 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.041 -3.296 -6.557 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.322 -2.316 -4.621 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.161 -1.147 -5.295 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.892 -1.008 -5.685 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.098 -2.700 -7.619 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.381 -3.067 -8.135 1.00 0.00 C ATOM 1276 C PHE A 85 -6.236 -4.144 -9.154 1.00 0.00 C ATOM 1277 O PHE A 85 -7.161 -4.946 -9.271 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.064 -1.871 -8.820 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.538 -2.085 -8.875 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.287 -1.851 -7.746 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.189 -2.568 -9.986 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.647 -2.052 -7.767 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.549 -2.752 -10.062 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.266 -2.450 -8.928 1.00 0.00 C ATOM 0 H PHE A 85 -4.909 -1.733 -7.882 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.984 -3.408 -7.293 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.842 -0.954 -8.274 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -6.669 -1.745 -9.828 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.806 -1.509 -6.841 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.595 -2.818 -10.852 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.229 -1.897 -6.871 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.027 -3.113 -10.961 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.343 -2.528 -8.950 1.00 0.00 H new ATOM 1294 N ARG A 86 -5.224 -4.151 -10.040 1.00 0.00 N ATOM 1295 CA ARG A 86 -4.894 -5.243 -10.902 1.00 0.00 C ATOM 1296 C ARG A 86 -4.633 -6.556 -10.247 1.00 0.00 C ATOM 1297 O ARG A 86 -4.978 -7.610 -10.778 1.00 0.00 O ATOM 1298 CB ARG A 86 -3.793 -4.809 -11.885 1.00 0.00 C ATOM 1299 CG ARG A 86 -4.319 -3.689 -12.784 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.070 -3.885 -14.281 1.00 0.00 C ATOM 1301 NE ARG A 86 -2.637 -3.544 -14.507 1.00 0.00 N ATOM 1302 CZ ARG A 86 -1.810 -3.984 -15.499 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -2.268 -4.826 -16.471 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -0.514 -3.554 -15.487 1.00 0.00 N ATOM 0 H ARG A 86 -4.603 -3.351 -10.161 1.00 0.00 H new ATOM 0 HA ARG A 86 -5.804 -5.470 -11.458 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -2.916 -4.466 -11.336 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.478 -5.658 -12.492 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -5.392 -3.587 -12.621 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -3.859 -2.750 -12.475 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.278 -4.912 -14.580 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.722 -3.242 -14.872 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.221 -2.900 -13.834 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.240 -5.134 -16.462 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -1.638 -5.147 -17.206 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.192 -2.924 -14.752 1.00 0.00 H new ATOM 0 HH22 ARG A 86 0.132 -3.863 -16.213 1.00 0.00 H new ATOM 1318 N VAL A 87 -3.976 -6.596 -9.074 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.862 -7.768 -8.263 1.00 0.00 C ATOM 1320 C VAL A 87 -5.217 -8.268 -7.896 1.00 0.00 C ATOM 1321 O VAL A 87 -5.430 -9.475 -8.006 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.065 -7.469 -7.028 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.610 -8.719 -6.257 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.720 -6.815 -7.387 1.00 0.00 C ATOM 0 H VAL A 87 -3.507 -5.782 -8.676 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.344 -8.541 -8.831 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.741 -6.848 -6.440 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.040 -8.417 -5.378 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.483 -9.291 -5.944 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.984 -9.336 -6.901 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.161 -6.608 -6.474 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.144 -7.490 -8.020 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.900 -5.882 -7.921 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.171 -7.437 -7.439 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.432 -7.826 -6.888 1.00 0.00 C ATOM 1336 C PHE A 88 -8.299 -8.430 -7.938 1.00 0.00 C ATOM 1337 O PHE A 88 -8.568 -9.629 -7.999 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.207 -6.712 -6.164 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.637 -6.635 -4.790 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.727 -7.662 -3.880 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -7.019 -5.478 -4.376 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -7.218 -7.574 -2.606 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.483 -5.377 -3.114 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.598 -6.411 -2.215 1.00 0.00 C ATOM 0 H PHE A 88 -6.052 -6.424 -7.456 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.179 -8.558 -6.121 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.098 -5.761 -6.684 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.273 -6.937 -6.131 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.218 -8.576 -4.179 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.954 -4.638 -5.051 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -7.304 -8.406 -1.923 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.965 -4.474 -2.825 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.206 -6.311 -1.214 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.698 -7.574 -8.896 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.806 -7.907 -9.737 1.00 0.00 C ATOM 1356 C ASP A 89 -9.496 -8.849 -10.849 1.00 0.00 C ATOM 1357 O ASP A 89 -8.516 -8.598 -11.547 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.569 -6.656 -10.203 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.679 -6.885 -11.218 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.825 -7.227 -10.820 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.492 -6.704 -12.451 1.00 0.00 O ATOM 0 H ASP A 89 -8.265 -6.670 -9.086 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.479 -8.480 -9.099 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -11.001 -6.172 -9.327 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.851 -5.957 -10.632 1.00 0.00 H new ATOM 1366 N LYS A 90 -10.259 -9.951 -10.962 1.00 0.00 N ATOM 1367 CA LYS A 90 -10.025 -10.990 -11.916 1.00 0.00 C ATOM 1368 C LYS A 90 -10.792 -10.878 -13.189 1.00 0.00 C ATOM 1369 O LYS A 90 -10.330 -11.118 -14.304 1.00 0.00 O ATOM 1370 CB LYS A 90 -10.227 -12.353 -11.233 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.832 -13.610 -12.011 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.381 -13.528 -12.488 1.00 0.00 C ATOM 1373 CE LYS A 90 -8.125 -14.820 -13.267 1.00 0.00 C ATOM 1374 NZ LYS A 90 -6.696 -14.818 -13.653 1.00 0.00 N ATOM 0 H LYS A 90 -11.069 -10.125 -10.367 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.991 -10.882 -12.244 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.663 -12.346 -10.300 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -11.281 -12.441 -10.968 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.961 -14.489 -11.379 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.494 -13.734 -12.868 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.226 -12.653 -13.120 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.697 -13.438 -11.645 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.358 -15.692 -12.655 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -8.763 -14.871 -14.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.479 -15.684 -14.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.498 -13.987 -14.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.105 -14.782 -12.798 1.00 0.00 H new ATOM 1388 N ASP A 91 -12.107 -10.624 -13.068 1.00 0.00 N ATOM 1389 CA ASP A 91 -13.036 -10.865 -14.128 1.00 0.00 C ATOM 1390 C ASP A 91 -12.941 -9.735 -15.094 1.00 0.00 C ATOM 1391 O ASP A 91 -12.548 -9.870 -16.252 1.00 0.00 O ATOM 1392 CB ASP A 91 -14.487 -11.119 -13.684 1.00 0.00 C ATOM 1393 CG ASP A 91 -14.874 -10.249 -12.497 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -14.883 -8.994 -12.609 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.969 -10.775 -11.356 1.00 0.00 O ATOM 0 H ASP A 91 -12.532 -10.246 -12.222 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.752 -11.806 -14.599 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -15.162 -10.920 -14.516 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -14.608 -12.170 -13.420 1.00 0.00 H new ATOM 1400 N GLY A 92 -13.150 -8.470 -14.690 1.00 0.00 N ATOM 1401 CA GLY A 92 -13.127 -7.358 -15.589 1.00 0.00 C ATOM 1402 C GLY A 92 -14.190 -6.390 -15.199 1.00 0.00 C ATOM 1403 O GLY A 92 -14.295 -5.357 -15.859 1.00 0.00 O ATOM 0 H GLY A 92 -13.339 -8.214 -13.721 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -12.151 -6.874 -15.563 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -13.287 -7.699 -16.612 1.00 0.00 H new ATOM 1407 N ASN A 93 -15.042 -6.666 -14.196 1.00 0.00 N ATOM 1408 CA ASN A 93 -16.200 -5.866 -13.946 1.00 0.00 C ATOM 1409 C ASN A 93 -15.782 -4.613 -13.257 1.00 0.00 C ATOM 1410 O ASN A 93 -16.438 -3.573 -13.305 1.00 0.00 O ATOM 1411 CB ASN A 93 -17.396 -6.607 -13.325 1.00 0.00 C ATOM 1412 CG ASN A 93 -17.129 -7.067 -11.899 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -16.039 -7.054 -11.328 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -18.275 -7.347 -11.222 1.00 0.00 N ATOM 0 H ASN A 93 -14.927 -7.450 -13.553 1.00 0.00 H new ATOM 0 HA ASN A 93 -16.635 -5.588 -14.906 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -18.267 -5.952 -13.334 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -17.641 -7.472 -13.941 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -18.240 -7.551 -10.223 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -19.169 -7.353 -11.713 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.659 -4.611 -12.517 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.115 -3.424 -11.935 1.00 0.00 C ATOM 1423 C GLY A 94 -14.778 -3.231 -10.614 1.00 0.00 C ATOM 1424 O GLY A 94 -14.718 -2.238 -9.892 1.00 0.00 O ATOM 0 H GLY A 94 -14.117 -5.452 -12.319 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.036 -3.516 -11.813 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.290 -2.564 -12.582 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.471 -4.279 -10.133 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.797 -4.383 -8.745 1.00 0.00 C ATOM 1430 C TYR A 95 -15.076 -5.566 -8.197 1.00 0.00 C ATOM 1431 O TYR A 95 -15.100 -6.678 -8.721 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.299 -4.665 -8.566 1.00 0.00 C ATOM 1433 CG TYR A 95 -18.101 -3.459 -8.915 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.528 -3.252 -10.205 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.545 -2.636 -7.906 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -19.314 -2.160 -10.489 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.434 -1.612 -8.137 1.00 0.00 C ATOM 1438 CZ TYR A 95 -19.810 -1.415 -9.445 1.00 0.00 C ATOM 1439 OH TYR A 95 -20.790 -0.444 -9.743 1.00 0.00 O ATOM 0 H TYR A 95 -15.805 -5.054 -10.706 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.526 -3.453 -8.245 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.596 -5.502 -9.198 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.500 -4.957 -7.535 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -18.249 -3.941 -10.989 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.184 -2.799 -6.901 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.537 -1.893 -11.511 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.816 -0.997 -7.335 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.059 0.013 -8.919 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.404 -5.400 -7.043 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.716 -6.442 -6.348 1.00 0.00 C ATOM 1451 C ILE A 96 -14.538 -7.247 -5.401 1.00 0.00 C ATOM 1452 O ILE A 96 -15.038 -6.676 -4.433 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.575 -5.951 -5.507 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.595 -5.134 -6.365 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.749 -7.064 -4.839 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.662 -4.278 -5.508 1.00 0.00 C ATOM 0 H ILE A 96 -14.338 -4.497 -6.574 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.393 -7.054 -7.190 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.048 -5.357 -4.725 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.003 -5.810 -6.982 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.156 -4.491 -7.044 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.946 -6.619 -4.251 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.393 -7.653 -4.186 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.322 -7.710 -5.606 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.986 -3.717 -6.154 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.252 -3.583 -4.910 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.081 -4.922 -4.848 1.00 0.00 H new ATOM 1468 N SER A 97 -14.746 -8.551 -5.655 1.00 0.00 N ATOM 1469 CA SER A 97 -15.507 -9.417 -4.809 1.00 0.00 C ATOM 1470 C SER A 97 -14.763 -10.122 -3.728 1.00 0.00 C ATOM 1471 O SER A 97 -13.542 -10.254 -3.651 1.00 0.00 O ATOM 1472 CB SER A 97 -16.320 -10.405 -5.663 1.00 0.00 C ATOM 1473 OG SER A 97 -15.402 -11.265 -6.322 1.00 0.00 O ATOM 0 H SER A 97 -14.371 -9.020 -6.480 1.00 0.00 H new ATOM 0 HA SER A 97 -16.167 -8.748 -4.257 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.001 -10.981 -5.037 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.931 -9.869 -6.390 1.00 0.00 H new ATOM 0 HG SER A 97 -14.886 -10.752 -6.979 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.590 -10.561 -2.763 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.124 -11.448 -1.743 1.00 0.00 C ATOM 1481 C ALA A 98 -14.265 -12.619 -2.077 1.00 0.00 C ATOM 1482 O ALA A 98 -13.262 -12.991 -1.470 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.238 -11.778 -0.734 1.00 0.00 C ATOM 0 H ALA A 98 -16.574 -10.304 -2.689 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.353 -10.829 -1.284 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.850 -12.454 0.028 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.584 -10.859 -0.261 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.070 -12.255 -1.253 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.597 -13.166 -3.259 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.909 -14.247 -3.895 1.00 0.00 C ATOM 1491 C ALA A 99 -12.504 -13.885 -4.233 1.00 0.00 C ATOM 1492 O ALA A 99 -11.531 -14.438 -3.722 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.591 -14.556 -5.238 1.00 0.00 C ATOM 0 H ALA A 99 -15.393 -12.834 -3.803 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.929 -15.089 -3.203 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.072 -15.379 -5.729 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.630 -14.835 -5.063 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.555 -13.673 -5.876 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.367 -12.804 -5.022 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.132 -12.190 -5.398 1.00 0.00 C ATOM 1501 C GLU A 100 -10.238 -11.757 -4.288 1.00 0.00 C ATOM 1502 O GLU A 100 -9.141 -12.307 -4.200 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.435 -11.079 -6.417 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.301 -11.498 -7.606 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.959 -10.398 -8.427 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.669 -9.501 -7.899 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.729 -10.415 -9.666 1.00 0.00 O ATOM 0 H GLU A 100 -13.175 -12.328 -5.424 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.519 -12.966 -5.857 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.932 -10.259 -5.898 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.490 -10.690 -6.797 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.682 -12.093 -8.278 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.088 -12.154 -7.233 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.830 -10.912 -3.426 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.209 -10.373 -2.256 1.00 0.00 C ATOM 1516 C LEU A 101 -9.672 -11.463 -1.393 1.00 0.00 C ATOM 1517 O LEU A 101 -8.479 -11.436 -1.093 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.300 -9.615 -1.481 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.999 -9.057 -0.079 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.321 -7.677 -0.067 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -12.227 -9.028 0.846 1.00 0.00 C ATOM 0 H LEU A 101 -11.789 -10.589 -3.551 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.381 -9.722 -2.536 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.617 -8.777 -2.102 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.156 -10.284 -1.387 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.280 -9.776 0.313 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -10.148 -7.365 0.963 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.368 -7.735 -0.593 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.965 -6.951 -0.562 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.942 -8.623 1.817 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -13.001 -8.400 0.404 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.611 -10.040 0.973 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.489 -12.430 -0.939 1.00 0.00 N ATOM 1534 CA ARG A 102 -10.057 -13.599 -0.237 1.00 0.00 C ATOM 1535 C ARG A 102 -8.941 -14.367 -0.856 1.00 0.00 C ATOM 1536 O ARG A 102 -7.974 -14.819 -0.245 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.259 -14.537 -0.042 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.987 -15.508 1.109 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.258 -16.258 1.512 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.904 -17.009 2.749 1.00 0.00 N ATOM 1541 CZ ARG A 102 -12.824 -17.797 3.378 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -14.174 -17.734 3.182 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -12.480 -18.979 3.967 1.00 0.00 N ATOM 0 H ARG A 102 -11.500 -12.395 -1.068 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.653 -13.226 0.704 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -12.155 -13.953 0.168 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.449 -15.093 -0.960 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.219 -16.222 0.812 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.598 -14.959 1.967 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.080 -15.566 1.695 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.581 -16.935 0.721 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.961 -16.933 3.131 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.563 -17.059 2.523 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -14.794 -18.362 3.694 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -11.511 -19.297 3.945 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.192 -19.545 4.429 1.00 0.00 H new ATOM 1557 N HIS A 103 -9.007 -14.657 -2.168 1.00 0.00 N ATOM 1558 CA HIS A 103 -8.053 -15.419 -2.913 1.00 0.00 C ATOM 1559 C HIS A 103 -6.747 -14.704 -2.848 1.00 0.00 C ATOM 1560 O HIS A 103 -5.702 -15.300 -2.591 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.636 -15.543 -4.331 1.00 0.00 C ATOM 1562 CG HIS A 103 -7.652 -15.796 -5.434 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -7.319 -17.026 -5.965 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.993 -14.873 -6.184 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -6.503 -16.755 -7.019 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -6.292 -15.467 -7.213 1.00 0.00 N ATOM 0 H HIS A 103 -9.782 -14.336 -2.748 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.870 -16.422 -2.528 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.366 -16.353 -4.331 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -9.178 -14.625 -4.560 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.016 -13.809 -5.998 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -6.068 -17.524 -7.640 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -5.743 -15.019 -7.947 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.718 -13.363 -2.949 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.604 -12.470 -2.865 1.00 0.00 C ATOM 1576 C VAL A 104 -4.956 -12.458 -1.524 1.00 0.00 C ATOM 1577 O VAL A 104 -3.747 -12.608 -1.359 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.694 -11.123 -3.519 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.676 -10.052 -3.092 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -5.773 -11.329 -5.041 1.00 0.00 C ATOM 0 H VAL A 104 -7.583 -12.846 -3.109 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.914 -12.951 -3.558 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.609 -10.665 -3.142 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.862 -9.132 -3.646 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.778 -9.859 -2.024 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.666 -10.405 -3.302 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.839 -10.360 -5.536 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.880 -11.852 -5.384 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.656 -11.921 -5.283 1.00 0.00 H new ATOM 1590 N MET A 105 -5.773 -12.352 -0.460 1.00 0.00 N ATOM 1591 CA MET A 105 -5.300 -12.359 0.889 1.00 0.00 C ATOM 1592 C MET A 105 -4.692 -13.645 1.334 1.00 0.00 C ATOM 1593 O MET A 105 -3.670 -13.613 2.018 1.00 0.00 O ATOM 1594 CB MET A 105 -6.482 -11.943 1.781 1.00 0.00 C ATOM 1595 CG MET A 105 -6.922 -10.480 1.697 1.00 0.00 C ATOM 1596 SD MET A 105 -8.211 -10.051 2.905 1.00 0.00 S ATOM 1597 CE MET A 105 -7.006 -9.998 4.263 1.00 0.00 C ATOM 0 H MET A 105 -6.786 -12.259 -0.540 1.00 0.00 H new ATOM 0 HA MET A 105 -4.471 -11.655 0.967 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.337 -12.571 1.529 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.221 -12.161 2.816 1.00 0.00 H new ATOM 0 HG2 MET A 105 -6.056 -9.837 1.855 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.292 -10.275 0.692 1.00 0.00 H new ATOM 0 HE1 MET A 105 -7.408 -9.404 5.084 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.806 -11.011 4.612 1.00 0.00 H new ATOM 0 HE3 MET A 105 -6.079 -9.547 3.909 1.00 0.00 H new ATOM 1607 N THR A 106 -5.176 -14.789 0.819 1.00 0.00 N ATOM 1608 CA THR A 106 -4.567 -16.083 0.793 1.00 0.00 C ATOM 1609 C THR A 106 -3.150 -16.176 0.343 1.00 0.00 C ATOM 1610 O THR A 106 -2.252 -16.368 1.162 1.00 0.00 O ATOM 1611 CB THR A 106 -5.420 -17.194 0.258 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.759 -17.285 0.723 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.741 -18.566 0.407 1.00 0.00 C ATOM 0 H THR A 106 -6.093 -14.806 0.373 1.00 0.00 H new ATOM 0 HA THR A 106 -4.494 -16.253 1.867 1.00 0.00 H new ATOM 0 HB THR A 106 -5.511 -16.906 -0.789 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.257 -16.488 0.445 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.395 -19.341 0.006 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.799 -18.567 -0.141 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.548 -18.764 1.461 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.921 -15.776 -0.920 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.619 -15.829 -1.511 1.00 0.00 C ATOM 1623 C ASN A 107 -0.662 -14.831 -0.956 1.00 0.00 C ATOM 1624 O ASN A 107 0.538 -15.073 -0.835 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.763 -15.768 -3.041 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.230 -17.155 -3.458 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -1.412 -18.050 -3.664 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.565 -17.355 -3.622 1.00 0.00 N ATOM 0 H ASN A 107 -3.646 -15.412 -1.538 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.159 -16.780 -1.244 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.483 -15.005 -3.338 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.815 -15.513 -3.515 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -3.911 -18.266 -3.923 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.220 -16.594 -3.444 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.148 -13.625 -0.613 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.491 -12.639 0.188 1.00 0.00 C ATOM 1637 C LEU A 108 0.126 -13.155 1.443 1.00 0.00 C ATOM 1638 O LEU A 108 1.265 -12.760 1.683 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.445 -11.475 0.505 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.884 -10.345 1.384 1.00 0.00 C ATOM 1641 CD1 LEU A 108 0.166 -9.564 0.576 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -2.001 -9.401 1.861 1.00 0.00 C ATOM 0 H LEU A 108 -2.071 -13.317 -0.920 1.00 0.00 H new ATOM 0 HA LEU A 108 0.342 -12.290 -0.423 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.777 -11.040 -0.438 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.328 -11.883 0.997 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.424 -10.781 2.271 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.572 -8.759 1.189 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.971 -10.236 0.280 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.300 -9.142 -0.315 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -1.572 -8.613 2.480 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.494 -8.956 0.997 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -2.729 -9.965 2.444 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.645 -13.858 2.292 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.083 -14.651 3.341 1.00 0.00 C ATOM 1656 C GLY A 109 -1.003 -14.873 4.491 1.00 0.00 C ATOM 1657 O GLY A 109 -0.701 -15.392 5.564 1.00 0.00 O ATOM 0 H GLY A 109 -1.664 -13.877 2.251 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.213 -15.618 2.933 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.824 -14.167 3.703 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.259 -14.398 4.407 1.00 0.00 N ATOM 1662 CA GLU A 110 -3.176 -14.545 5.495 1.00 0.00 C ATOM 1663 C GLU A 110 -4.001 -15.780 5.605 1.00 0.00 C ATOM 1664 O GLU A 110 -4.327 -16.453 4.628 1.00 0.00 O ATOM 1665 CB GLU A 110 -4.202 -13.402 5.404 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.579 -12.010 5.523 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.866 -11.857 6.859 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.483 -11.597 7.926 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -1.612 -11.972 6.884 1.00 0.00 O ATOM 0 H GLU A 110 -2.638 -13.916 3.592 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.507 -14.564 6.355 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.731 -13.474 4.454 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.944 -13.527 6.192 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.874 -11.850 4.707 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.354 -11.249 5.428 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.214 -16.218 6.859 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.944 -17.391 7.225 1.00 0.00 C ATOM 1678 C LYS A 111 -6.410 -17.265 7.455 1.00 0.00 C ATOM 1679 O LYS A 111 -6.960 -17.400 8.546 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.218 -17.863 8.497 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.738 -18.179 8.271 1.00 0.00 C ATOM 1682 CD LYS A 111 -1.801 -17.836 9.430 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.340 -17.891 8.977 1.00 0.00 C ATOM 1684 NZ LYS A 111 0.553 -17.040 9.795 1.00 0.00 N ATOM 0 H LYS A 111 -3.851 -15.718 7.671 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.942 -18.085 6.384 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.304 -17.092 9.263 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.717 -18.752 8.882 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.642 -19.243 8.053 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.402 -17.641 7.385 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.032 -16.841 9.809 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.959 -18.535 10.251 1.00 0.00 H new ATOM 0 HE2 LYS A 111 0.010 -18.922 9.022 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.277 -17.578 7.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 1.528 -17.119 9.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 0.241 -16.050 9.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 0.519 -17.353 10.786 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.149 -16.941 6.378 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.496 -16.484 6.524 1.00 0.00 C ATOM 1700 C LEU A 112 -9.592 -17.494 6.545 1.00 0.00 C ATOM 1701 O LEU A 112 -9.639 -18.437 5.757 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.925 -15.595 5.345 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.127 -14.286 5.221 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.574 -13.685 3.878 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -8.332 -13.320 6.400 1.00 0.00 C ATOM 0 H LEU A 112 -6.817 -16.995 5.415 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.414 -16.006 7.500 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.819 -16.161 4.420 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.983 -15.354 5.452 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.054 -14.477 5.251 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.051 -12.744 3.709 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.340 -14.381 3.072 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.649 -13.504 3.900 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.737 -12.420 6.241 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.386 -13.051 6.471 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.018 -13.803 7.325 1.00 0.00 H new ATOM 1717 N THR A 113 -10.526 -17.395 7.508 1.00 0.00 N ATOM 1718 CA THR A 113 -11.713 -18.193 7.502 1.00 0.00 C ATOM 1719 C THR A 113 -12.748 -17.286 6.933 1.00 0.00 C ATOM 1720 O THR A 113 -12.513 -16.166 6.482 1.00 0.00 O ATOM 1721 CB THR A 113 -12.136 -18.513 8.905 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.386 -17.425 9.782 1.00 0.00 O ATOM 1723 CG2 THR A 113 -11.139 -19.391 9.680 1.00 0.00 C ATOM 0 H THR A 113 -10.457 -16.755 8.299 1.00 0.00 H new ATOM 0 HA THR A 113 -11.569 -19.126 6.957 1.00 0.00 H new ATOM 0 HB THR A 113 -13.072 -19.021 8.674 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.863 -17.747 10.575 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.521 -19.575 10.684 1.00 0.00 H new ATOM 0 HG22 THR A 113 -11.011 -20.341 9.161 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.178 -18.880 9.745 1.00 0.00 H new ATOM 1731 N ASP A 114 -14.008 -17.738 7.066 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.143 -17.050 6.535 1.00 0.00 C ATOM 1733 C ASP A 114 -15.479 -15.884 7.400 1.00 0.00 C ATOM 1734 O ASP A 114 -15.879 -14.850 6.868 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.293 -18.071 6.559 1.00 0.00 C ATOM 1736 CG ASP A 114 -16.054 -19.192 5.558 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -16.125 -18.943 4.325 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.868 -20.360 5.993 1.00 0.00 O ATOM 0 H ASP A 114 -14.243 -18.602 7.554 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.957 -16.673 5.529 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.391 -18.489 7.561 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.233 -17.569 6.330 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.295 -16.021 8.725 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.548 -15.105 9.794 1.00 0.00 C ATOM 1745 C GLU A 115 -14.829 -13.810 9.634 1.00 0.00 C ATOM 1746 O GLU A 115 -15.376 -12.730 9.851 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.165 -15.674 11.170 1.00 0.00 C ATOM 1748 CG GLU A 115 -15.876 -16.988 11.504 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.183 -18.263 11.046 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -14.130 -18.607 11.647 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -15.645 -18.889 10.055 1.00 0.00 O ATOM 0 H GLU A 115 -14.917 -16.895 9.091 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.624 -14.938 9.746 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.087 -15.834 11.201 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.400 -14.937 11.938 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.010 -17.040 12.585 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -16.871 -16.961 11.061 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.531 -13.862 9.285 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.740 -12.699 9.027 1.00 0.00 C ATOM 1760 C GLU A 116 -13.177 -11.963 7.807 1.00 0.00 C ATOM 1761 O GLU A 116 -13.504 -10.780 7.893 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.226 -12.968 8.988 1.00 0.00 C ATOM 1763 CG GLU A 116 -10.715 -13.688 10.237 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.224 -13.990 10.215 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -8.394 -13.069 9.989 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -8.888 -15.117 10.668 1.00 0.00 O ATOM 0 H GLU A 116 -13.018 -14.737 9.179 1.00 0.00 H new ATOM 0 HA GLU A 116 -12.919 -12.057 9.889 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.992 -13.567 8.108 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.697 -12.021 8.879 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.938 -13.077 11.112 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.262 -14.623 10.353 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.321 -12.629 6.648 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.836 -12.012 5.465 1.00 0.00 C ATOM 1775 C VAL A 117 -15.140 -11.322 5.676 1.00 0.00 C ATOM 1776 O VAL A 117 -15.319 -10.204 5.196 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.818 -12.894 4.252 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.351 -12.196 2.990 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.394 -13.446 4.064 1.00 0.00 C ATOM 0 H VAL A 117 -13.076 -13.612 6.530 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.121 -11.221 5.238 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.506 -13.724 4.415 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.312 -12.887 2.148 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.382 -11.883 3.155 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.738 -11.322 2.771 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.366 -14.090 3.185 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.698 -12.618 3.930 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.108 -14.022 4.944 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.153 -11.932 6.316 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.414 -11.386 6.712 1.00 0.00 C ATOM 1791 C ASP A 118 -17.356 -10.060 7.389 1.00 0.00 C ATOM 1792 O ASP A 118 -18.047 -9.111 7.022 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.001 -12.533 7.552 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.449 -12.167 7.846 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.237 -12.045 6.871 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -19.904 -12.230 9.020 1.00 0.00 O ATOM 0 H ASP A 118 -16.077 -12.913 6.583 1.00 0.00 H new ATOM 0 HA ASP A 118 -18.044 -11.108 5.867 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -17.943 -13.477 7.011 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.439 -12.661 8.477 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.506 -10.058 8.431 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.278 -8.967 9.327 1.00 0.00 C ATOM 1803 C GLU A 119 -15.557 -7.833 8.685 1.00 0.00 C ATOM 1804 O GLU A 119 -15.766 -6.664 9.006 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.589 -9.566 10.565 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.345 -8.616 11.739 1.00 0.00 C ATOM 1807 CD GLU A 119 -15.115 -9.415 13.014 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -16.141 -10.004 13.448 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -13.975 -9.576 13.525 1.00 0.00 O ATOM 0 H GLU A 119 -15.940 -10.874 8.662 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.212 -8.495 9.632 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.194 -10.400 10.921 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.629 -9.978 10.255 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.480 -7.985 11.534 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -16.201 -7.952 11.865 1.00 0.00 H new ATOM 1816 N MET A 120 -14.767 -8.129 7.638 1.00 0.00 N ATOM 1817 CA MET A 120 -14.045 -7.163 6.869 1.00 0.00 C ATOM 1818 C MET A 120 -14.957 -6.279 6.089 1.00 0.00 C ATOM 1819 O MET A 120 -14.855 -5.056 6.173 1.00 0.00 O ATOM 1820 CB MET A 120 -13.121 -7.842 5.845 1.00 0.00 C ATOM 1821 CG MET A 120 -11.760 -8.063 6.508 1.00 0.00 C ATOM 1822 SD MET A 120 -10.548 -8.860 5.411 1.00 0.00 S ATOM 1823 CE MET A 120 -10.025 -7.312 4.618 1.00 0.00 C ATOM 0 H MET A 120 -14.625 -9.085 7.313 1.00 0.00 H new ATOM 0 HA MET A 120 -13.473 -6.582 7.592 1.00 0.00 H new ATOM 0 HB2 MET A 120 -13.545 -8.792 5.520 1.00 0.00 H new ATOM 0 HB3 MET A 120 -13.015 -7.220 4.956 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.364 -7.103 6.839 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.893 -8.677 7.399 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.232 -7.521 3.899 1.00 0.00 H new ATOM 0 HE2 MET A 120 -10.874 -6.863 4.102 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.655 -6.622 5.376 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.858 -6.903 5.310 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.725 -6.343 4.321 1.00 0.00 C ATOM 1835 C ILE A 121 -17.813 -5.526 4.929 1.00 0.00 C ATOM 1836 O ILE A 121 -17.943 -4.335 4.652 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.191 -7.312 3.275 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.053 -7.552 2.269 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.530 -6.863 2.665 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -16.331 -8.741 1.351 1.00 0.00 C ATOM 0 H ILE A 121 -15.991 -7.912 5.384 1.00 0.00 H new ATOM 0 HA ILE A 121 -16.109 -5.648 3.750 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.415 -8.284 3.714 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.910 -6.656 1.665 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -15.123 -7.724 2.810 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.845 -7.583 1.910 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -19.285 -6.805 3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -18.409 -5.883 2.204 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -15.498 -8.869 0.659 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.447 -9.644 1.950 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -17.246 -8.559 0.787 1.00 0.00 H new ATOM 1852 N ARG A 122 -18.623 -6.151 5.802 1.00 0.00 N ATOM 1853 CA ARG A 122 -19.695 -5.503 6.492 1.00 0.00 C ATOM 1854 C ARG A 122 -19.320 -4.263 7.228 1.00 0.00 C ATOM 1855 O ARG A 122 -20.069 -3.305 7.040 1.00 0.00 O ATOM 1856 CB ARG A 122 -20.358 -6.492 7.465 1.00 0.00 C ATOM 1857 CG ARG A 122 -21.598 -5.968 8.192 1.00 0.00 C ATOM 1858 CD ARG A 122 -22.448 -7.028 8.897 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.614 -7.908 9.762 1.00 0.00 N ATOM 1860 CZ ARG A 122 -21.306 -9.200 9.446 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -21.664 -9.764 8.256 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -20.358 -9.873 10.161 1.00 0.00 N ATOM 0 H ARG A 122 -18.529 -7.139 6.035 1.00 0.00 H new ATOM 0 HA ARG A 122 -20.386 -5.183 5.712 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -20.635 -7.389 6.911 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -19.621 -6.792 8.210 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -21.280 -5.232 8.931 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -22.226 -5.445 7.471 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -23.212 -6.540 9.502 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -22.968 -7.633 8.154 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.254 -7.525 10.636 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -22.180 -9.217 7.567 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -21.416 -10.733 8.056 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -19.878 -9.411 10.933 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -20.130 -10.838 9.923 1.00 0.00 H new ATOM 1876 N GLU A 123 -18.229 -4.194 8.011 1.00 0.00 N ATOM 1877 CA GLU A 123 -17.818 -2.938 8.559 1.00 0.00 C ATOM 1878 C GLU A 123 -17.582 -1.877 7.540 1.00 0.00 C ATOM 1879 O GLU A 123 -17.922 -0.704 7.695 1.00 0.00 O ATOM 1880 CB GLU A 123 -16.592 -3.259 9.430 1.00 0.00 C ATOM 1881 CG GLU A 123 -16.178 -2.097 10.335 1.00 0.00 C ATOM 1882 CD GLU A 123 -15.057 -2.600 11.234 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -15.295 -3.415 12.165 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -13.867 -2.201 11.122 1.00 0.00 O ATOM 0 H GLU A 123 -17.642 -4.989 8.261 1.00 0.00 H new ATOM 0 HA GLU A 123 -18.614 -2.492 9.155 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.810 -4.132 10.046 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -15.755 -3.525 8.785 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -15.842 -1.248 9.740 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -17.024 -1.754 10.931 1.00 0.00 H new ATOM 1891 N ALA A 124 -17.037 -2.275 6.378 1.00 0.00 N ATOM 1892 CA ALA A 124 -16.433 -1.338 5.482 1.00 0.00 C ATOM 1893 C ALA A 124 -17.527 -0.712 4.687 1.00 0.00 C ATOM 1894 O ALA A 124 -17.609 0.507 4.548 1.00 0.00 O ATOM 1895 CB ALA A 124 -15.307 -1.956 4.637 1.00 0.00 C ATOM 0 H ALA A 124 -17.014 -3.243 6.058 1.00 0.00 H new ATOM 0 HA ALA A 124 -15.914 -0.559 6.041 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.888 -1.196 3.977 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -14.525 -2.336 5.295 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.708 -2.774 4.039 1.00 0.00 H new ATOM 1901 N ASP A 125 -18.476 -1.490 4.136 1.00 0.00 N ATOM 1902 CA ASP A 125 -19.385 -1.179 3.077 1.00 0.00 C ATOM 1903 C ASP A 125 -20.625 -0.467 3.498 1.00 0.00 C ATOM 1904 O ASP A 125 -21.569 -1.124 3.934 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.730 -2.461 2.301 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.070 -2.142 0.852 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.630 -1.059 0.535 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -19.667 -2.917 -0.057 1.00 0.00 O ATOM 0 H ASP A 125 -18.619 -2.442 4.473 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.864 -0.469 2.435 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.887 -3.151 2.338 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.574 -2.962 2.775 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.623 0.872 3.378 1.00 0.00 N ATOM 1914 CA ILE A 126 -21.779 1.671 3.643 1.00 0.00 C ATOM 1915 C ILE A 126 -22.762 1.618 2.525 1.00 0.00 C ATOM 1916 O ILE A 126 -23.955 1.493 2.797 1.00 0.00 O ATOM 1917 CB ILE A 126 -21.400 3.070 4.031 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -22.554 3.972 4.500 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.465 3.790 3.045 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -23.360 3.484 5.702 1.00 0.00 C ATOM 0 H ILE A 126 -19.805 1.410 3.092 1.00 0.00 H new ATOM 0 HA ILE A 126 -22.289 1.241 4.505 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.806 2.886 4.926 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -22.143 4.953 4.741 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -23.240 4.110 3.664 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.250 4.793 3.414 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.534 3.230 2.951 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.947 3.858 2.070 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -24.142 4.207 5.933 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -23.813 2.520 5.469 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -22.700 3.376 6.563 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.316 1.577 1.256 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.203 1.546 0.135 1.00 0.00 C ATOM 1934 C ASP A 127 -23.962 0.280 -0.067 1.00 0.00 C ATOM 1935 O ASP A 127 -24.966 0.225 -0.775 1.00 0.00 O ATOM 1936 CB ASP A 127 -22.634 2.010 -1.216 1.00 0.00 C ATOM 1937 CG ASP A 127 -21.575 1.064 -1.764 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -21.936 0.014 -2.360 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -20.396 1.478 -1.603 1.00 0.00 O ATOM 0 H ASP A 127 -21.327 1.565 1.005 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.903 2.312 0.470 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -23.447 2.096 -1.937 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -22.203 3.004 -1.102 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.443 -0.809 0.528 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.240 -1.939 0.891 1.00 0.00 C ATOM 1946 C GLY A 128 -24.188 -3.158 0.036 1.00 0.00 C ATOM 1947 O GLY A 128 -24.688 -4.212 0.428 1.00 0.00 O ATOM 0 H GLY A 128 -22.455 -0.906 0.761 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.956 -2.232 1.902 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.278 -1.610 0.934 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.605 -3.107 -1.175 1.00 0.00 N ATOM 1952 CA ASP A 129 -23.465 -4.152 -2.141 1.00 0.00 C ATOM 1953 C ASP A 129 -22.663 -5.301 -1.634 1.00 0.00 C ATOM 1954 O ASP A 129 -22.876 -6.427 -2.080 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.159 -3.707 -3.581 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.886 -2.882 -3.707 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.175 -2.649 -2.693 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.627 -2.500 -4.880 1.00 0.00 O ATOM 0 H ASP A 129 -23.188 -2.239 -1.510 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.474 -4.545 -2.266 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.074 -4.590 -4.215 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -23.999 -3.124 -3.958 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.673 -5.043 -0.761 1.00 0.00 N ATOM 1964 CA GLY A 130 -20.677 -6.004 -0.400 1.00 0.00 C ATOM 1965 C GLY A 130 -19.575 -6.258 -1.370 1.00 0.00 C ATOM 1966 O GLY A 130 -18.804 -7.211 -1.264 1.00 0.00 O ATOM 0 H GLY A 130 -21.562 -4.143 -0.294 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.229 -5.685 0.541 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.180 -6.952 -0.208 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.428 -5.347 -2.349 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.348 -5.270 -3.282 1.00 0.00 C ATOM 1972 C GLN A 131 -17.613 -3.991 -3.071 1.00 0.00 C ATOM 1973 O GLN A 131 -18.163 -3.052 -2.497 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.991 -5.094 -4.668 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.999 -6.153 -5.118 1.00 0.00 C ATOM 1976 CD GLN A 131 -20.577 -5.790 -6.478 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -20.637 -6.566 -7.430 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -21.066 -4.529 -6.628 1.00 0.00 N ATOM 0 H GLN A 131 -20.117 -4.610 -2.498 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.702 -6.142 -3.181 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.490 -4.125 -4.687 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.191 -5.055 -5.407 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.514 -7.128 -5.170 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.801 -6.236 -4.385 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.026 -3.870 -5.850 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -21.473 -4.242 -7.518 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.327 -4.022 -3.462 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.490 -2.893 -3.199 1.00 0.00 C ATOM 1989 C VAL A 132 -15.304 -2.124 -4.462 1.00 0.00 C ATOM 1990 O VAL A 132 -14.585 -2.543 -5.367 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.155 -3.307 -2.655 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.436 -2.072 -2.086 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -14.335 -4.347 -1.537 1.00 0.00 C ATOM 0 H VAL A 132 -15.878 -4.800 -3.944 1.00 0.00 H new ATOM 0 HA VAL A 132 -15.974 -2.273 -2.445 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.565 -3.747 -3.458 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.465 -2.367 -1.689 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.296 -1.336 -2.877 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.037 -1.637 -1.288 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -13.358 -4.639 -1.151 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -14.930 -3.916 -0.731 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -14.845 -5.224 -1.935 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.955 -0.958 -4.625 1.00 0.00 N ATOM 2004 CA ASN A 133 -15.770 -0.173 -5.805 1.00 0.00 C ATOM 2005 C ASN A 133 -14.540 0.664 -5.712 1.00 0.00 C ATOM 2006 O ASN A 133 -13.788 0.604 -4.741 1.00 0.00 O ATOM 2007 CB ASN A 133 -17.066 0.553 -6.204 1.00 0.00 C ATOM 2008 CG ASN A 133 -17.303 1.916 -5.568 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.857 2.887 -6.177 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -17.771 1.969 -4.292 1.00 0.00 N ATOM 0 H ASN A 133 -16.604 -0.562 -3.945 1.00 0.00 H new ATOM 0 HA ASN A 133 -15.572 -0.827 -6.654 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -17.069 0.676 -7.287 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.909 -0.091 -5.955 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -17.765 2.853 -3.783 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.128 1.125 -3.844 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.216 1.370 -6.810 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.105 2.251 -6.992 1.00 0.00 C ATOM 2019 C TYR A 134 -12.980 3.188 -5.840 1.00 0.00 C ATOM 2020 O TYR A 134 -11.922 3.241 -5.214 1.00 0.00 O ATOM 2021 CB TYR A 134 -13.108 2.924 -8.375 1.00 0.00 C ATOM 2022 CG TYR A 134 -11.727 2.845 -8.928 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -11.171 1.683 -9.409 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -10.937 3.969 -8.869 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.932 1.667 -10.004 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -9.649 3.921 -9.346 1.00 0.00 C ATOM 2027 CZ TYR A 134 -9.161 2.806 -9.985 1.00 0.00 C ATOM 2028 OH TYR A 134 -7.846 2.676 -10.478 1.00 0.00 O ATOM 0 H TYR A 134 -14.790 1.317 -7.651 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.190 1.659 -6.994 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.814 2.426 -9.040 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.427 3.963 -8.293 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.722 0.759 -9.317 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -11.327 4.885 -8.450 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -9.568 0.769 -10.481 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -9.006 4.779 -9.216 1.00 0.00 H new ATOM 0 HH TYR A 134 -7.388 3.540 -10.420 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.098 3.807 -5.420 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.166 4.851 -4.445 1.00 0.00 C ATOM 2040 C GLU A 135 -13.820 4.345 -3.087 1.00 0.00 C ATOM 2041 O GLU A 135 -13.032 4.953 -2.364 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.555 5.511 -4.467 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.698 6.807 -3.666 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.962 7.568 -4.040 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -18.066 7.126 -3.626 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -16.883 8.572 -4.798 1.00 0.00 O ATOM 0 H GLU A 135 -15.017 3.560 -5.788 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.427 5.610 -4.700 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.820 5.718 -5.504 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.282 4.792 -4.089 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -15.715 6.576 -2.601 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.828 7.440 -3.841 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.438 3.208 -2.720 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.102 2.401 -1.589 1.00 0.00 C ATOM 2055 C GLU A 136 -12.661 2.126 -1.326 1.00 0.00 C ATOM 2056 O GLU A 136 -12.184 2.185 -0.193 1.00 0.00 O ATOM 2057 CB GLU A 136 -14.986 1.144 -1.533 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.423 1.459 -1.111 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.368 0.285 -1.325 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.672 -0.136 -2.473 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -17.945 -0.237 -0.334 1.00 0.00 O ATOM 0 H GLU A 136 -15.224 2.829 -3.249 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.333 3.044 -0.739 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -14.995 0.665 -2.512 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -14.553 0.430 -0.833 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -16.435 1.742 -0.059 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -16.783 2.318 -1.677 1.00 0.00 H new ATOM 2068 N PHE A 137 -11.959 1.830 -2.434 1.00 0.00 N ATOM 2069 CA PHE A 137 -10.588 1.428 -2.497 1.00 0.00 C ATOM 2070 C PHE A 137 -9.611 2.517 -2.214 1.00 0.00 C ATOM 2071 O PHE A 137 -8.832 2.359 -1.275 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.465 0.671 -3.831 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.267 -0.210 -3.914 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.278 -1.468 -3.357 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.106 0.235 -4.501 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.171 -2.277 -3.466 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.990 -0.557 -4.632 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.047 -1.831 -4.120 1.00 0.00 C ATOM 0 H PHE A 137 -12.386 1.876 -3.359 1.00 0.00 H new ATOM 0 HA PHE A 137 -10.302 0.760 -1.684 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.360 0.067 -3.979 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.430 1.394 -4.646 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.155 -1.820 -2.835 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.069 1.248 -4.874 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -8.185 -3.267 -3.036 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.099 -0.191 -5.120 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.199 -2.490 -4.233 1.00 0.00 H new ATOM 2088 N VAL A 138 -9.648 3.637 -2.958 1.00 0.00 N ATOM 2089 CA VAL A 138 -8.786 4.740 -2.664 1.00 0.00 C ATOM 2090 C VAL A 138 -8.828 5.232 -1.259 1.00 0.00 C ATOM 2091 O VAL A 138 -7.810 5.566 -0.656 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.181 5.919 -3.503 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -8.123 7.035 -3.508 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.476 5.494 -4.952 1.00 0.00 C ATOM 0 H VAL A 138 -10.268 3.779 -3.755 1.00 0.00 H new ATOM 0 HA VAL A 138 -7.786 4.354 -2.864 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.085 6.319 -3.044 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.467 7.860 -4.132 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -7.965 7.392 -2.490 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.186 6.646 -3.905 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.760 6.369 -5.537 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.585 5.040 -5.387 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -10.292 4.772 -4.960 1.00 0.00 H new ATOM 2104 N GLN A 139 -10.048 5.301 -0.696 1.00 0.00 N ATOM 2105 CA GLN A 139 -10.306 5.703 0.652 1.00 0.00 C ATOM 2106 C GLN A 139 -9.772 4.804 1.713 1.00 0.00 C ATOM 2107 O GLN A 139 -9.293 5.187 2.779 1.00 0.00 O ATOM 2108 CB GLN A 139 -11.788 5.981 0.958 1.00 0.00 C ATOM 2109 CG GLN A 139 -12.462 7.210 0.343 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.893 7.499 0.773 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -14.655 7.579 -0.189 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -14.261 7.642 2.074 1.00 0.00 N ATOM 0 H GLN A 139 -10.898 5.064 -1.208 1.00 0.00 H new ATOM 0 HA GLN A 139 -9.744 6.636 0.694 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -12.357 5.105 0.646 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -11.890 6.059 2.040 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -11.854 8.084 0.579 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -12.450 7.096 -0.741 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -13.563 7.560 2.813 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -15.235 7.831 2.311 1.00 0.00 H new ATOM 2121 N MET A 140 -9.761 3.504 1.365 1.00 0.00 N ATOM 2122 CA MET A 140 -9.214 2.482 2.202 1.00 0.00 C ATOM 2123 C MET A 140 -7.751 2.671 2.413 1.00 0.00 C ATOM 2124 O MET A 140 -7.166 2.432 3.468 1.00 0.00 O ATOM 2125 CB MET A 140 -9.432 1.054 1.675 1.00 0.00 C ATOM 2126 CG MET A 140 -8.737 -0.118 2.371 1.00 0.00 C ATOM 2127 SD MET A 140 -6.996 -0.436 1.955 1.00 0.00 S ATOM 2128 CE MET A 140 -7.310 -0.967 0.247 1.00 0.00 C ATOM 0 H MET A 140 -10.140 3.156 0.484 1.00 0.00 H new ATOM 0 HA MET A 140 -9.759 2.586 3.140 1.00 0.00 H new ATOM 0 HB2 MET A 140 -10.504 0.858 1.696 1.00 0.00 H new ATOM 0 HB3 MET A 140 -9.126 1.041 0.629 1.00 0.00 H new ATOM 0 HG2 MET A 140 -8.800 0.046 3.447 1.00 0.00 H new ATOM 0 HG3 MET A 140 -9.305 -1.022 2.152 1.00 0.00 H new ATOM 0 HE1 MET A 140 -6.485 -1.591 -0.097 1.00 0.00 H new ATOM 0 HE2 MET A 140 -8.238 -1.538 0.208 1.00 0.00 H new ATOM 0 HE3 MET A 140 -7.395 -0.091 -0.396 1.00 0.00 H new ATOM 2138 N MET A 141 -7.070 3.245 1.404 1.00 0.00 N ATOM 2139 CA MET A 141 -5.653 3.430 1.461 1.00 0.00 C ATOM 2140 C MET A 141 -5.350 4.653 2.256 1.00 0.00 C ATOM 2141 O MET A 141 -4.420 4.639 3.061 1.00 0.00 O ATOM 2142 CB MET A 141 -5.220 3.645 0.001 1.00 0.00 C ATOM 2143 CG MET A 141 -5.356 2.442 -0.935 1.00 0.00 C ATOM 2144 SD MET A 141 -3.998 1.234 -0.960 1.00 0.00 S ATOM 2145 CE MET A 141 -4.350 0.111 -2.343 1.00 0.00 C ATOM 0 H MET A 141 -7.504 3.582 0.545 1.00 0.00 H new ATOM 0 HA MET A 141 -5.140 2.587 1.923 1.00 0.00 H new ATOM 0 HB2 MET A 141 -5.806 4.466 -0.411 1.00 0.00 H new ATOM 0 HB3 MET A 141 -4.178 3.964 -0.002 1.00 0.00 H new ATOM 0 HG2 MET A 141 -6.271 1.913 -0.670 1.00 0.00 H new ATOM 0 HG3 MET A 141 -5.488 2.819 -1.949 1.00 0.00 H new ATOM 0 HE1 MET A 141 -3.564 -0.642 -2.410 1.00 0.00 H new ATOM 0 HE2 MET A 141 -5.309 -0.379 -2.178 1.00 0.00 H new ATOM 0 HE3 MET A 141 -4.388 0.679 -3.272 1.00 0.00 H new ATOM 2155 N THR A 142 -6.112 5.756 2.152 1.00 0.00 N ATOM 2156 CA THR A 142 -5.717 6.999 2.740 1.00 0.00 C ATOM 2157 C THR A 142 -5.978 7.081 4.237 1.00 0.00 C ATOM 2158 O THR A 142 -7.109 7.381 4.704 1.00 0.00 O ATOM 2159 CB THR A 142 -6.372 8.205 2.133 1.00 0.00 C ATOM 2160 OG1 THR A 142 -7.759 7.903 2.146 1.00 0.00 O ATOM 2161 CG2 THR A 142 -5.806 8.356 0.711 1.00 0.00 C ATOM 0 H THR A 142 -7.005 5.787 1.659 1.00 0.00 H new ATOM 0 HA THR A 142 -4.646 7.013 2.536 1.00 0.00 H new ATOM 0 HB THR A 142 -6.195 9.145 2.656 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.045 7.721 3.065 1.00 0.00 H new ATOM 0 HG21 THR A 142 -6.257 9.224 0.230 1.00 0.00 H new ATOM 0 HG22 THR A 142 -4.725 8.489 0.762 1.00 0.00 H new ATOM 0 HG23 THR A 142 -6.034 7.461 0.132 1.00 0.00 H new ATOM 2170 N ARG B 1 -8.535 0.011 11.962 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.702 -0.997 10.891 1.00 0.00 C ATOM 2172 C ARG B 1 -7.493 -1.807 10.571 1.00 0.00 C ATOM 2173 O ARG B 1 -6.734 -1.447 9.673 1.00 0.00 O ATOM 2174 CB ARG B 1 -9.263 -0.402 9.588 1.00 0.00 C ATOM 2175 CG ARG B 1 -10.655 0.199 9.792 1.00 0.00 C ATOM 2176 CD ARG B 1 -11.429 0.458 8.498 1.00 0.00 C ATOM 2177 NE ARG B 1 -12.839 0.683 8.926 1.00 0.00 N ATOM 2178 CZ ARG B 1 -13.753 1.135 8.018 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -13.481 1.386 6.704 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -14.988 1.407 8.531 1.00 0.00 N ATOM 0 H1 ARG B 1 -9.458 0.434 12.187 1.00 0.00 H new ATOM 0 H2 ARG B 1 -8.147 -0.446 12.812 1.00 0.00 H new ATOM 0 H3 ARG B 1 -7.883 0.754 11.640 1.00 0.00 H new ATOM 0 HA ARG B 1 -9.430 -1.679 11.331 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.585 0.368 9.218 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -9.310 -1.179 8.825 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -11.239 -0.473 10.421 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -10.555 1.139 10.335 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -11.034 1.326 7.970 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -11.354 -0.390 7.818 1.00 0.00 H new ATOM 0 HE ARG B 1 -13.119 0.501 9.890 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -12.540 1.237 6.340 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -14.219 1.723 6.086 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -15.169 1.268 9.525 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -15.730 1.749 7.920 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.211 -2.985 11.157 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.967 -3.686 11.077 1.00 0.00 C ATOM 2195 C ARG B 2 -5.760 -4.436 9.806 1.00 0.00 C ATOM 2196 O ARG B 2 -4.792 -4.208 9.083 1.00 0.00 O ATOM 2197 CB ARG B 2 -5.825 -4.628 12.285 1.00 0.00 C ATOM 2198 CG ARG B 2 -5.560 -3.973 13.642 1.00 0.00 C ATOM 2199 CD ARG B 2 -4.171 -3.417 13.962 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.104 -4.427 13.715 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.635 -5.237 14.709 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -3.119 -5.225 15.985 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.695 -6.169 14.376 1.00 0.00 N ATOM 0 H ARG B 2 -7.899 -3.480 11.724 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.188 -2.923 11.091 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -6.738 -5.218 12.365 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -5.012 -5.324 12.079 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -6.271 -3.154 13.751 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -5.800 -4.708 14.410 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -3.983 -2.533 13.353 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -4.137 -3.099 15.004 1.00 0.00 H new ATOM 0 HE ARG B 2 -2.713 -4.516 12.777 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -3.873 -4.586 16.239 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -2.727 -5.855 16.685 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -1.368 -6.242 13.413 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.320 -6.793 15.090 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.705 -5.330 9.463 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.684 -6.137 8.283 1.00 0.00 C ATOM 2219 C LYS B 3 -6.661 -5.389 6.994 1.00 0.00 C ATOM 2220 O LYS B 3 -5.791 -5.704 6.184 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.719 -7.271 8.185 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.570 -8.112 9.455 1.00 0.00 C ATOM 2223 CD LYS B 3 -8.652 -9.192 9.523 1.00 0.00 C ATOM 2224 CE LYS B 3 -8.807 -9.719 10.951 1.00 0.00 C ATOM 2225 NZ LYS B 3 -7.799 -10.776 11.189 1.00 0.00 N ATOM 0 H LYS B 3 -7.528 -5.498 10.041 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.714 -6.612 8.432 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.728 -6.868 8.104 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -7.546 -7.878 7.296 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -6.584 -8.577 9.475 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -7.637 -7.469 10.332 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -9.601 -8.784 9.176 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.395 -10.013 8.854 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -8.677 -8.908 11.667 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -9.811 -10.117 11.098 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -7.953 -11.197 12.127 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -7.889 -11.512 10.460 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -6.846 -10.362 11.147 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.519 -4.364 6.845 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.575 -3.585 5.647 1.00 0.00 C ATOM 2241 C TRP B 4 -6.325 -2.784 5.525 1.00 0.00 C ATOM 2242 O TRP B 4 -5.726 -2.930 4.461 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.793 -2.654 5.526 1.00 0.00 C ATOM 2244 CG TRP B 4 -10.131 -3.242 5.145 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -11.241 -3.415 5.920 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.506 -3.611 3.805 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -12.300 -3.922 5.213 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.830 -4.048 3.927 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.779 -3.576 2.647 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -12.429 -4.458 2.767 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -10.407 -4.089 1.536 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.713 -4.515 1.595 1.00 0.00 C ATOM 0 H TRP B 4 -8.181 -4.072 7.564 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.679 -4.304 4.834 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.917 -2.149 6.484 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.549 -1.888 4.790 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.280 -3.179 6.973 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -13.230 -4.154 5.563 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.778 -3.172 2.608 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -13.472 -4.739 2.772 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.866 -4.158 0.604 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -12.185 -4.902 0.704 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.836 -2.021 6.518 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.652 -1.233 6.367 1.00 0.00 C ATOM 2265 C GLN B 5 -3.490 -2.026 5.875 1.00 0.00 C ATOM 2266 O GLN B 5 -2.820 -1.689 4.900 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.337 -0.408 7.626 1.00 0.00 C ATOM 2268 CG GLN B 5 -3.151 0.554 7.542 1.00 0.00 C ATOM 2269 CD GLN B 5 -3.082 1.426 8.788 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -2.916 1.090 9.960 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -3.218 2.736 8.448 1.00 0.00 N ATOM 0 H GLN B 5 -6.268 -1.950 7.439 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.860 -0.509 5.580 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -5.225 0.169 7.885 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -4.156 -1.100 8.449 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -2.225 -0.010 7.434 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -3.247 1.182 6.656 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -3.355 2.998 7.472 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -3.183 3.456 9.169 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.167 -3.087 6.635 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.147 -4.016 6.257 1.00 0.00 C ATOM 2282 C LYS B 6 -2.004 -4.457 4.841 1.00 0.00 C ATOM 2283 O LYS B 6 -1.019 -4.196 4.152 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.127 -5.242 7.185 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.006 -6.254 6.937 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.031 -7.506 7.817 1.00 0.00 C ATOM 2287 CE LYS B 6 -2.284 -8.381 7.759 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.093 -9.498 8.712 1.00 0.00 N ATOM 0 H LYS B 6 -3.619 -3.304 7.523 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.274 -3.374 6.376 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.052 -4.892 8.215 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.082 -5.758 7.092 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.048 -6.566 5.893 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.050 -5.751 7.081 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.175 -8.125 7.547 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.885 -7.194 8.851 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -3.169 -7.801 8.021 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -2.439 -8.761 6.749 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.874 -10.177 8.612 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.191 -9.975 8.511 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.079 -9.127 9.683 1.00 0.00 H new ATOM 2302 N THR B 7 -3.155 -5.034 4.455 1.00 0.00 N ATOM 2303 CA THR B 7 -3.359 -5.691 3.201 1.00 0.00 C ATOM 2304 C THR B 7 -3.244 -4.756 2.047 1.00 0.00 C ATOM 2305 O THR B 7 -2.603 -5.068 1.044 1.00 0.00 O ATOM 2306 CB THR B 7 -4.698 -6.365 3.150 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.843 -7.229 4.268 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.928 -7.236 1.903 1.00 0.00 C ATOM 0 H THR B 7 -3.985 -5.043 5.047 1.00 0.00 H new ATOM 0 HA THR B 7 -2.570 -6.439 3.121 1.00 0.00 H new ATOM 0 HB THR B 7 -5.420 -5.548 3.138 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.239 -6.734 5.015 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.921 -7.684 1.950 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.851 -6.618 1.008 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.176 -8.024 1.866 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.771 -3.538 2.268 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.682 -2.391 1.419 1.00 0.00 C ATOM 2318 C GLY B 8 -2.272 -1.955 1.211 1.00 0.00 C ATOM 2319 O GLY B 8 -1.889 -1.648 0.083 1.00 0.00 O ATOM 0 H GLY B 8 -4.305 -3.341 3.114 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -4.137 -2.618 0.455 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -4.253 -1.572 1.856 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.461 -1.863 2.280 1.00 0.00 N ATOM 2324 CA HIS B 9 -0.112 -1.392 2.230 1.00 0.00 C ATOM 2325 C HIS B 9 0.684 -2.386 1.456 1.00 0.00 C ATOM 2326 O HIS B 9 1.523 -2.010 0.638 1.00 0.00 O ATOM 2327 CB HIS B 9 0.515 -1.231 3.625 1.00 0.00 C ATOM 2328 CG HIS B 9 0.269 0.040 4.382 1.00 0.00 C ATOM 2329 ND1 HIS B 9 -0.410 0.288 5.534 1.00 0.00 N flip ATOM 2330 CD2 HIS B 9 0.727 1.284 4.001 1.00 0.00 C flip ATOM 2331 CE1 HIS B 9 -0.293 1.607 5.923 1.00 0.00 C flip ATOM 2332 NE2 HIS B 9 0.389 2.193 4.956 1.00 0.00 N flip ATOM 0 H HIS B 9 -1.758 -2.128 3.219 1.00 0.00 H new ATOM 0 HA HIS B 9 -0.110 -0.407 1.763 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.163 -2.057 4.243 1.00 0.00 H new ATOM 0 HB3 HIS B 9 1.593 -1.349 3.518 1.00 0.00 H new ATOM 0 HD2 HIS B 9 1.267 1.502 3.091 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.677 2.062 6.824 1.00 0.00 H new ATOM 0 HE2 HIS B 9 0.628 3.184 4.929 1.00 0.00 H new ATOM 2340 N ALA B 10 0.454 -3.700 1.625 1.00 0.00 N ATOM 2341 CA ALA B 10 1.095 -4.671 0.793 1.00 0.00 C ATOM 2342 C ALA B 10 0.871 -4.630 -0.679 1.00 0.00 C ATOM 2343 O ALA B 10 1.834 -4.684 -1.443 1.00 0.00 O ATOM 2344 CB ALA B 10 0.682 -6.066 1.293 1.00 0.00 C ATOM 0 H ALA B 10 -0.171 -4.088 2.332 1.00 0.00 H new ATOM 0 HA ALA B 10 2.153 -4.427 0.892 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.157 -6.829 0.676 1.00 0.00 H new ATOM 0 HB2 ALA B 10 0.997 -6.189 2.329 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.401 -6.170 1.229 1.00 0.00 H new ATOM 2350 N VAL B 11 -0.414 -4.628 -1.077 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.807 -4.593 -2.451 1.00 0.00 C ATOM 2352 C VAL B 11 -0.352 -3.351 -3.136 1.00 0.00 C ATOM 2353 O VAL B 11 -0.095 -3.426 -4.336 1.00 0.00 O ATOM 2354 CB VAL B 11 -2.236 -5.022 -2.605 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -3.121 -3.908 -2.020 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.592 -5.424 -4.046 1.00 0.00 C ATOM 0 H VAL B 11 -1.199 -4.651 -0.427 1.00 0.00 H new ATOM 0 HA VAL B 11 -0.270 -5.348 -3.026 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.415 -5.941 -2.047 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -4.170 -4.188 -2.116 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.878 -3.766 -0.967 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.943 -2.979 -2.562 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.639 -5.724 -4.092 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -2.428 -4.576 -4.711 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.962 -6.257 -4.358 1.00 0.00 H new ATOM 2366 N ARG B 12 -0.163 -2.180 -2.502 1.00 0.00 N ATOM 2367 CA ARG B 12 0.281 -0.987 -3.155 1.00 0.00 C ATOM 2368 C ARG B 12 1.727 -1.053 -3.507 1.00 0.00 C ATOM 2369 O ARG B 12 2.104 -0.595 -4.585 1.00 0.00 O ATOM 2370 CB ARG B 12 0.034 0.107 -2.103 1.00 0.00 C ATOM 2371 CG ARG B 12 0.164 1.536 -2.633 1.00 0.00 C ATOM 2372 CD ARG B 12 -0.045 2.662 -1.619 1.00 0.00 C ATOM 2373 NE ARG B 12 0.109 3.957 -2.338 1.00 0.00 N ATOM 2374 CZ ARG B 12 -0.392 5.136 -1.866 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -1.079 5.252 -0.692 1.00 0.00 N ATOM 2376 NH2 ARG B 12 -0.364 6.230 -2.681 1.00 0.00 N ATOM 0 H ARG B 12 -0.324 -2.059 -1.502 1.00 0.00 H new ATOM 0 HA ARG B 12 -0.239 -0.813 -4.097 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.966 -0.024 -1.688 1.00 0.00 H new ATOM 0 HB3 ARG B 12 0.739 -0.029 -1.283 1.00 0.00 H new ATOM 0 HG2 ARG B 12 1.157 1.649 -3.069 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -0.556 1.667 -3.441 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -1.035 2.591 -1.168 1.00 0.00 H new ATOM 0 HD3 ARG B 12 0.681 2.586 -0.809 1.00 0.00 H new ATOM 0 HE ARG B 12 0.613 3.963 -3.225 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -1.243 4.428 -0.113 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -1.429 6.163 -0.393 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.025 6.156 -3.621 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -0.733 7.122 -2.350 1.00 0.00 H new ATOM 2390 N ALA B 13 2.516 -1.808 -2.722 1.00 0.00 N ATOM 2391 CA ALA B 13 3.833 -2.279 -3.020 1.00 0.00 C ATOM 2392 C ALA B 13 3.838 -3.301 -4.104 1.00 0.00 C ATOM 2393 O ALA B 13 4.273 -2.988 -5.211 1.00 0.00 O ATOM 2394 CB ALA B 13 4.540 -2.803 -1.758 1.00 0.00 C ATOM 0 H ALA B 13 2.204 -2.114 -1.800 1.00 0.00 H new ATOM 0 HA ALA B 13 4.396 -1.422 -3.390 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.539 -3.153 -2.019 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.617 -2.000 -1.025 1.00 0.00 H new ATOM 0 HB3 ALA B 13 3.966 -3.627 -1.335 1.00 0.00 H new ATOM 2400 N ILE B 14 3.219 -4.474 -3.880 1.00 0.00 N ATOM 2401 CA ILE B 14 3.158 -5.620 -4.733 1.00 0.00 C ATOM 2402 C ILE B 14 2.772 -5.365 -6.150 1.00 0.00 C ATOM 2403 O ILE B 14 3.366 -5.866 -7.104 1.00 0.00 O ATOM 2404 CB ILE B 14 2.331 -6.688 -4.082 1.00 0.00 C ATOM 2405 CG1 ILE B 14 3.120 -7.325 -2.926 1.00 0.00 C ATOM 2406 CG2 ILE B 14 1.903 -7.798 -5.056 1.00 0.00 C ATOM 2407 CD1 ILE B 14 2.256 -8.059 -1.901 1.00 0.00 C ATOM 0 H ILE B 14 2.710 -4.633 -3.011 1.00 0.00 H new ATOM 0 HA ILE B 14 4.185 -5.968 -4.840 1.00 0.00 H new ATOM 0 HB ILE B 14 1.426 -6.200 -3.719 1.00 0.00 H new ATOM 0 HG12 ILE B 14 3.845 -8.025 -3.340 1.00 0.00 H new ATOM 0 HG13 ILE B 14 3.685 -6.546 -2.415 1.00 0.00 H new ATOM 0 HG21 ILE B 14 1.308 -8.540 -4.523 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.309 -7.366 -5.861 1.00 0.00 H new ATOM 0 HG23 ILE B 14 2.789 -8.276 -5.475 1.00 0.00 H new ATOM 0 HD11 ILE B 14 2.893 -8.477 -1.121 1.00 0.00 H new ATOM 0 HD12 ILE B 14 1.548 -7.361 -1.455 1.00 0.00 H new ATOM 0 HD13 ILE B 14 1.710 -8.863 -2.394 1.00 0.00 H new ATOM 2419 N GLY B 15 1.765 -4.482 -6.263 1.00 0.00 N ATOM 2420 CA GLY B 15 1.130 -4.223 -7.518 1.00 0.00 C ATOM 2421 C GLY B 15 1.958 -3.398 -8.442 1.00 0.00 C ATOM 2422 O GLY B 15 2.094 -3.759 -9.610 1.00 0.00 O ATOM 0 H GLY B 15 1.389 -3.945 -5.482 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.896 -5.172 -8.001 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.183 -3.714 -7.339 1.00 0.00 H new ATOM 2426 N ARG B 16 2.582 -2.295 -7.990 1.00 0.00 N ATOM 2427 CA ARG B 16 3.528 -1.502 -8.711 1.00 0.00 C ATOM 2428 C ARG B 16 4.813 -2.155 -9.089 1.00 0.00 C ATOM 2429 O ARG B 16 5.381 -2.030 -10.173 1.00 0.00 O ATOM 2430 CB ARG B 16 3.853 -0.202 -7.957 1.00 0.00 C ATOM 2431 CG ARG B 16 4.647 0.819 -8.774 1.00 0.00 C ATOM 2432 CD ARG B 16 5.059 2.065 -7.988 1.00 0.00 C ATOM 2433 NE ARG B 16 5.864 2.977 -8.849 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.449 4.018 -9.628 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.128 4.325 -9.778 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.332 4.693 -10.420 1.00 0.00 N ATOM 0 H ARG B 16 2.412 -1.933 -7.052 1.00 0.00 H new ATOM 0 HA ARG B 16 3.006 -1.315 -9.650 1.00 0.00 H new ATOM 0 HB2 ARG B 16 2.920 0.258 -7.631 1.00 0.00 H new ATOM 0 HB3 ARG B 16 4.418 -0.449 -7.058 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.543 0.337 -9.166 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.049 1.125 -9.632 1.00 0.00 H new ATOM 0 HD2 ARG B 16 4.172 2.585 -7.626 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.639 1.775 -7.112 1.00 0.00 H new ATOM 0 HE ARG B 16 6.868 2.798 -8.857 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.418 3.770 -9.301 1.00 0.00 H new ATOM 0 HH12 ARG B 16 3.851 5.110 -10.368 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.315 4.421 -10.434 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.009 5.469 -10.997 1.00 0.00 H new