USER MOD reduce.3.24.130724 H: found=0, std=0, add=1012, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 1020 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 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 62 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 102 HIS : no HD1:sc= -2.45! C(o=-6.8!,f=-10!) USER MOD Set 2.3: A 106 HIS : no HE2:sc= -4.31! C(o=-6.8!,f=-11!) USER MOD Set 3.1: A 90 ASN : amide:sc= -0.488 X(o=-0.49,f=-0.29) USER MOD Set 3.2: A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= -0.0227 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.468 K(o=-0.47,f=-1.4) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 168:sc= 0.111 (180deg=0.0858) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -0.419 X(o=-0.42,f=0.077) USER MOD Single : A 35 ASN : amide:sc= -4.05! C(o=-4.1!,f=-8!) USER MOD Single : A 40 SER OG : rot 180:sc= -0.32 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -0.424 K(o=-0.42,f=-3.4) USER MOD Single : A 49 GLN : amide:sc= -0.175 X(o=-0.17,f=-0.0053) USER MOD Single : A 50 GLN : amide:sc= -1.16 K(o=-1.2,f=-2.4) USER MOD Single : A 54 GLN : amide:sc= -0.471 K(o=-0.47,f=-3.3!) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.19 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 CYS SG : rot 179:sc= -7.22! USER MOD Single : A 84 ASN : amide:sc= 0.481 K(o=0.48,f=-0.14) USER MOD Single : A 89 ASN : amide:sc= 0.697 K(o=0.7,f=-0.94) USER MOD Single : A 91 THR OG1 : rot 133:sc= -2.94! USER MOD Single : A 126 GLN :FLIP amide:sc= -1.85 F(o=-2.7,f=-1.8) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= -0.972 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 ASN : amide:sc= -1.42 X(o=-1.4,f=-1.6) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N ILE A 2 0.078 -3.451 11.632 1.00 0.00 N ATOM 19 CA ILE A 2 0.901 -3.161 10.471 1.00 0.00 C ATOM 20 C ILE A 2 2.376 -3.192 10.876 1.00 0.00 C ATOM 21 O ILE A 2 2.711 -2.951 12.035 1.00 0.00 O ATOM 22 CB ILE A 2 0.469 -1.844 9.823 1.00 0.00 C ATOM 23 CG1 ILE A 2 -1.055 -1.765 9.706 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.159 -1.645 8.472 1.00 0.00 C ATOM 25 CD1 ILE A 2 -1.639 -0.838 10.774 1.00 0.00 C ATOM 0 HA ILE A 2 0.764 -3.926 9.707 1.00 0.00 H new ATOM 0 HB ILE A 2 0.785 -1.025 10.469 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -1.329 -1.402 8.715 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -1.484 -2.762 9.811 1.00 0.00 H new ATOM 0 HG21 ILE A 2 0.834 -0.702 8.033 1.00 0.00 H new ATOM 0 HG22 ILE A 2 2.239 -1.626 8.615 1.00 0.00 H new ATOM 0 HG23 ILE A 2 0.895 -2.465 7.805 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -2.723 -0.799 10.669 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -1.384 -1.217 11.764 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -1.227 0.164 10.651 1.00 0.00 H new ATOM 37 N ARG A 3 3.219 -3.491 9.898 1.00 0.00 N ATOM 38 CA ARG A 3 4.651 -3.556 10.138 1.00 0.00 C ATOM 39 C ARG A 3 5.419 -3.083 8.902 1.00 0.00 C ATOM 40 O ARG A 3 5.017 -3.361 7.774 1.00 0.00 O ATOM 41 CB ARG A 3 5.086 -4.981 10.486 1.00 0.00 C ATOM 42 CG ARG A 3 6.271 -4.972 11.454 1.00 0.00 C ATOM 43 CD ARG A 3 5.792 -4.962 12.907 1.00 0.00 C ATOM 44 NE ARG A 3 6.874 -4.479 13.794 1.00 0.00 N ATOM 45 CZ ARG A 3 6.708 -4.189 15.102 1.00 0.00 C ATOM 46 NH1 ARG A 3 5.500 -4.331 15.687 1.00 0.00 N ATOM 47 NH2 ARG A 3 7.745 -3.765 15.800 1.00 0.00 N ATOM 0 H ARG A 3 2.938 -3.691 8.938 1.00 0.00 H new ATOM 0 HA ARG A 3 4.876 -2.903 10.981 1.00 0.00 H new ATOM 0 HB2 ARG A 3 4.251 -5.521 10.933 1.00 0.00 H new ATOM 0 HB3 ARG A 3 5.360 -5.514 9.575 1.00 0.00 H new ATOM 0 HG2 ARG A 3 6.895 -5.849 11.279 1.00 0.00 H new ATOM 0 HG3 ARG A 3 6.892 -4.096 11.266 1.00 0.00 H new ATOM 0 HD2 ARG A 3 4.916 -4.320 13.005 1.00 0.00 H new ATOM 0 HD3 ARG A 3 5.487 -5.965 13.205 1.00 0.00 H new ATOM 0 HE ARG A 3 7.803 -4.358 13.392 1.00 0.00 H new ATOM 0 HH11 ARG A 3 4.704 -4.660 15.140 1.00 0.00 H new ATOM 0 HH12 ARG A 3 5.383 -4.110 16.676 1.00 0.00 H new ATOM 0 HH21 ARG A 3 8.654 -3.661 15.350 1.00 0.00 H new ATOM 0 HH22 ARG A 3 7.637 -3.541 16.789 1.00 0.00 H new ATOM 60 N ILE A 4 6.510 -2.376 9.158 1.00 0.00 N ATOM 61 CA ILE A 4 7.337 -1.861 8.080 1.00 0.00 C ATOM 62 C ILE A 4 8.729 -2.490 8.167 1.00 0.00 C ATOM 63 O ILE A 4 9.225 -2.760 9.260 1.00 0.00 O ATOM 64 CB ILE A 4 7.351 -0.331 8.099 1.00 0.00 C ATOM 65 CG1 ILE A 4 7.235 0.200 9.529 1.00 0.00 C ATOM 66 CG2 ILE A 4 6.264 0.238 7.185 1.00 0.00 C ATOM 67 CD1 ILE A 4 5.769 0.355 9.939 1.00 0.00 C ATOM 0 H ILE A 4 6.840 -2.148 10.096 1.00 0.00 H new ATOM 0 HA ILE A 4 6.920 -2.140 7.113 1.00 0.00 H new ATOM 0 HB ILE A 4 8.310 0.008 7.707 1.00 0.00 H new ATOM 0 HG12 ILE A 4 7.738 -0.481 10.215 1.00 0.00 H new ATOM 0 HG13 ILE A 4 7.741 1.162 9.606 1.00 0.00 H new ATOM 0 HG21 ILE A 4 6.295 1.327 7.217 1.00 0.00 H new ATOM 0 HG22 ILE A 4 6.434 -0.100 6.163 1.00 0.00 H new ATOM 0 HG23 ILE A 4 5.287 -0.107 7.523 1.00 0.00 H new ATOM 0 HD11 ILE A 4 5.715 0.734 10.960 1.00 0.00 H new ATOM 0 HD12 ILE A 4 5.275 1.055 9.265 1.00 0.00 H new ATOM 0 HD13 ILE A 4 5.272 -0.613 9.885 1.00 0.00 H new ATOM 79 N LEU A 5 9.320 -2.705 7.001 1.00 0.00 N ATOM 80 CA LEU A 5 10.645 -3.297 6.931 1.00 0.00 C ATOM 81 C LEU A 5 11.376 -2.758 5.700 1.00 0.00 C ATOM 82 O LEU A 5 10.752 -2.203 4.797 1.00 0.00 O ATOM 83 CB LEU A 5 10.553 -4.824 6.972 1.00 0.00 C ATOM 84 CG LEU A 5 9.793 -5.481 5.818 1.00 0.00 C ATOM 85 CD1 LEU A 5 10.552 -6.697 5.285 1.00 0.00 C ATOM 86 CD2 LEU A 5 8.363 -5.833 6.233 1.00 0.00 C ATOM 0 H LEU A 5 8.905 -2.480 6.097 1.00 0.00 H new ATOM 0 HA LEU A 5 11.235 -3.013 7.802 1.00 0.00 H new ATOM 0 HB2 LEU A 5 11.565 -5.229 6.992 1.00 0.00 H new ATOM 0 HB3 LEU A 5 10.075 -5.114 7.908 1.00 0.00 H new ATOM 0 HG LEU A 5 9.723 -4.762 5.001 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.991 -7.146 4.466 1.00 0.00 H new ATOM 0 HD12 LEU A 5 11.532 -6.385 4.925 1.00 0.00 H new ATOM 0 HD13 LEU A 5 10.675 -7.428 6.084 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.845 -6.299 5.395 1.00 0.00 H new ATOM 0 HD22 LEU A 5 8.388 -6.526 7.074 1.00 0.00 H new ATOM 0 HD23 LEU A 5 7.836 -4.925 6.527 1.00 0.00 H new ATOM 98 N GLY A 6 12.689 -2.940 5.703 1.00 0.00 N ATOM 99 CA GLY A 6 13.511 -2.479 4.598 1.00 0.00 C ATOM 100 C GLY A 6 13.835 -0.990 4.739 1.00 0.00 C ATOM 101 O GLY A 6 14.228 -0.536 5.812 1.00 0.00 O ATOM 0 H GLY A 6 13.203 -3.401 6.454 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.436 -3.054 4.564 1.00 0.00 H new ATOM 0 HA3 GLY A 6 12.991 -2.654 3.656 1.00 0.00 H new ATOM 105 N GLU A 7 13.657 -0.272 3.640 1.00 0.00 N ATOM 106 CA GLU A 7 13.926 1.156 3.628 1.00 0.00 C ATOM 107 C GLU A 7 13.323 1.799 2.377 1.00 0.00 C ATOM 108 O GLU A 7 13.335 1.203 1.301 1.00 0.00 O ATOM 109 CB GLU A 7 15.428 1.432 3.716 1.00 0.00 C ATOM 110 CG GLU A 7 16.233 0.294 3.086 1.00 0.00 C ATOM 111 CD GLU A 7 17.731 0.476 3.338 1.00 0.00 C ATOM 112 OE1 GLU A 7 18.223 1.615 3.355 1.00 0.00 O ATOM 113 OE2 GLU A 7 18.390 -0.617 3.523 1.00 0.00 O ATOM 0 H GLU A 7 13.330 -0.652 2.752 1.00 0.00 H new ATOM 0 HA GLU A 7 13.456 1.602 4.505 1.00 0.00 H new ATOM 0 HB2 GLU A 7 15.659 2.369 3.210 1.00 0.00 H new ATOM 0 HB3 GLU A 7 15.718 1.553 4.760 1.00 0.00 H new ATOM 0 HG2 GLU A 7 15.905 -0.660 3.499 1.00 0.00 H new ATOM 0 HG3 GLU A 7 16.043 0.260 2.013 1.00 0.00 H new ATOM 121 N GLY A 8 12.809 3.006 2.560 1.00 0.00 N ATOM 122 CA GLY A 8 12.203 3.736 1.460 1.00 0.00 C ATOM 123 C GLY A 8 11.003 4.555 1.941 1.00 0.00 C ATOM 124 O GLY A 8 10.218 4.088 2.765 1.00 0.00 O ATOM 0 H GLY A 8 12.800 3.497 3.454 1.00 0.00 H new ATOM 0 HA2 GLY A 8 12.941 4.398 1.007 1.00 0.00 H new ATOM 0 HA3 GLY A 8 11.884 3.037 0.687 1.00 0.00 H new ATOM 128 N LYS A 9 10.899 5.763 1.406 1.00 0.00 N ATOM 129 CA LYS A 9 9.808 6.651 1.770 1.00 0.00 C ATOM 130 C LYS A 9 8.498 5.861 1.792 1.00 0.00 C ATOM 131 O LYS A 9 8.142 5.216 0.808 1.00 0.00 O ATOM 132 CB LYS A 9 9.776 7.869 0.844 1.00 0.00 C ATOM 133 CG LYS A 9 9.652 9.165 1.647 1.00 0.00 C ATOM 134 CD LYS A 9 9.394 10.358 0.725 1.00 0.00 C ATOM 135 CE LYS A 9 7.894 10.569 0.508 1.00 0.00 C ATOM 136 NZ LYS A 9 7.615 11.979 0.153 1.00 0.00 N ATOM 0 H LYS A 9 11.552 6.147 0.723 1.00 0.00 H new ATOM 0 HA LYS A 9 9.959 7.047 2.774 1.00 0.00 H new ATOM 0 HB2 LYS A 9 10.684 7.896 0.241 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.937 7.783 0.153 1.00 0.00 H new ATOM 0 HG2 LYS A 9 8.839 9.075 2.367 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.566 9.332 2.217 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.833 11.258 1.157 1.00 0.00 H new ATOM 0 HD3 LYS A 9 9.884 10.193 -0.234 1.00 0.00 H new ATOM 0 HE2 LYS A 9 7.539 9.911 -0.285 1.00 0.00 H new ATOM 0 HE3 LYS A 9 7.348 10.301 1.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 6.593 12.105 0.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 7.936 12.601 0.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.120 12.223 -0.723 1.00 0.00 H new ATOM 149 N GLY A 10 7.817 5.937 2.926 1.00 0.00 N ATOM 150 CA GLY A 10 6.554 5.237 3.089 1.00 0.00 C ATOM 151 C GLY A 10 6.357 4.793 4.540 1.00 0.00 C ATOM 152 O GLY A 10 5.227 4.714 5.020 1.00 0.00 O ATOM 0 H GLY A 10 8.116 6.473 3.741 1.00 0.00 H new ATOM 0 HA2 GLY A 10 5.732 5.887 2.789 1.00 0.00 H new ATOM 0 HA3 GLY A 10 6.528 4.368 2.432 1.00 0.00 H new ATOM 156 N SER A 11 7.473 4.515 5.197 1.00 0.00 N ATOM 157 CA SER A 11 7.437 4.080 6.583 1.00 0.00 C ATOM 158 C SER A 11 6.713 5.121 7.439 1.00 0.00 C ATOM 159 O SER A 11 5.759 4.796 8.144 1.00 0.00 O ATOM 160 CB SER A 11 8.849 3.839 7.122 1.00 0.00 C ATOM 161 OG SER A 11 8.846 2.984 8.261 1.00 0.00 O ATOM 0 H SER A 11 8.408 4.582 4.795 1.00 0.00 H new ATOM 0 HA SER A 11 6.893 3.137 6.631 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.466 3.398 6.339 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.304 4.794 7.386 1.00 0.00 H new ATOM 0 HG SER A 11 9.765 2.853 8.574 1.00 0.00 H new ATOM 167 N LYS A 12 7.193 6.353 7.348 1.00 0.00 N ATOM 168 CA LYS A 12 6.604 7.444 8.106 1.00 0.00 C ATOM 169 C LYS A 12 5.171 7.678 7.623 1.00 0.00 C ATOM 170 O LYS A 12 4.261 7.859 8.431 1.00 0.00 O ATOM 171 CB LYS A 12 7.489 8.689 8.030 1.00 0.00 C ATOM 172 CG LYS A 12 8.097 8.845 6.635 1.00 0.00 C ATOM 173 CD LYS A 12 8.250 10.322 6.265 1.00 0.00 C ATOM 174 CE LYS A 12 8.803 10.478 4.847 1.00 0.00 C ATOM 175 NZ LYS A 12 10.232 10.860 4.887 1.00 0.00 N ATOM 0 H LYS A 12 7.983 6.620 6.761 1.00 0.00 H new ATOM 0 HA LYS A 12 6.547 7.186 9.164 1.00 0.00 H new ATOM 0 HB2 LYS A 12 6.901 9.573 8.275 1.00 0.00 H new ATOM 0 HB3 LYS A 12 8.285 8.620 8.772 1.00 0.00 H new ATOM 0 HG2 LYS A 12 9.070 8.356 6.602 1.00 0.00 H new ATOM 0 HG3 LYS A 12 7.464 8.346 5.901 1.00 0.00 H new ATOM 0 HD2 LYS A 12 7.284 10.821 6.339 1.00 0.00 H new ATOM 0 HD3 LYS A 12 8.917 10.811 6.975 1.00 0.00 H new ATOM 0 HE2 LYS A 12 8.686 9.543 4.300 1.00 0.00 H new ATOM 0 HE3 LYS A 12 8.233 11.236 4.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 10.591 10.962 3.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 10.336 11.764 5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 10.775 10.123 5.382 1.00 0.00 H new ATOM 188 N LEU A 13 5.014 7.667 6.307 1.00 0.00 N ATOM 189 CA LEU A 13 3.708 7.876 5.707 1.00 0.00 C ATOM 190 C LEU A 13 2.719 6.859 6.281 1.00 0.00 C ATOM 191 O LEU A 13 1.528 7.142 6.396 1.00 0.00 O ATOM 192 CB LEU A 13 3.807 7.843 4.181 1.00 0.00 C ATOM 193 CG LEU A 13 2.767 6.984 3.459 1.00 0.00 C ATOM 194 CD1 LEU A 13 1.353 7.516 3.703 1.00 0.00 C ATOM 195 CD2 LEU A 13 3.087 6.873 1.967 1.00 0.00 C ATOM 0 H LEU A 13 5.771 7.516 5.640 1.00 0.00 H new ATOM 0 HA LEU A 13 3.329 8.867 5.957 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.726 8.865 3.809 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.799 7.482 3.909 1.00 0.00 H new ATOM 0 HG LEU A 13 2.809 5.977 3.873 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.633 6.888 3.179 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.138 7.501 4.771 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.280 8.538 3.333 1.00 0.00 H new ATOM 0 HD21 LEU A 13 2.332 6.257 1.478 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.089 7.867 1.520 1.00 0.00 H new ATOM 0 HD23 LEU A 13 4.068 6.415 1.838 1.00 0.00 H new ATOM 207 N LEU A 14 3.250 5.695 6.627 1.00 0.00 N ATOM 208 CA LEU A 14 2.430 4.634 7.186 1.00 0.00 C ATOM 209 C LEU A 14 2.050 4.993 8.624 1.00 0.00 C ATOM 210 O LEU A 14 0.874 4.974 8.983 1.00 0.00 O ATOM 211 CB LEU A 14 3.137 3.284 7.055 1.00 0.00 C ATOM 212 CG LEU A 14 2.232 2.051 7.043 1.00 0.00 C ATOM 213 CD1 LEU A 14 0.906 2.337 7.751 1.00 0.00 C ATOM 214 CD2 LEU A 14 2.021 1.539 5.617 1.00 0.00 C ATOM 0 H LEU A 14 4.239 5.464 6.531 1.00 0.00 H new ATOM 0 HA LEU A 14 1.500 4.536 6.625 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.721 3.290 6.135 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.842 3.184 7.880 1.00 0.00 H new ATOM 0 HG LEU A 14 2.730 1.257 7.600 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.281 1.444 7.728 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.100 2.618 8.786 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.391 3.153 7.244 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.374 0.662 5.637 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.555 2.320 5.015 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.983 1.270 5.181 1.00 0.00 H new ATOM 226 N GLU A 15 3.069 5.312 9.409 1.00 0.00 N ATOM 227 CA GLU A 15 2.857 5.674 10.800 1.00 0.00 C ATOM 228 C GLU A 15 1.805 6.780 10.906 1.00 0.00 C ATOM 229 O GLU A 15 1.183 6.951 11.953 1.00 0.00 O ATOM 230 CB GLU A 15 4.169 6.100 11.462 1.00 0.00 C ATOM 231 CG GLU A 15 5.126 4.913 11.598 1.00 0.00 C ATOM 232 CD GLU A 15 6.091 5.119 12.767 1.00 0.00 C ATOM 233 OE1 GLU A 15 6.727 6.178 12.867 1.00 0.00 O ATOM 234 OE2 GLU A 15 6.167 4.129 13.591 1.00 0.00 O ATOM 0 H GLU A 15 4.043 5.327 9.108 1.00 0.00 H new ATOM 0 HA GLU A 15 2.488 4.797 11.331 1.00 0.00 H new ATOM 0 HB2 GLU A 15 4.640 6.886 10.871 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.964 6.521 12.446 1.00 0.00 H new ATOM 0 HG2 GLU A 15 4.556 3.997 11.750 1.00 0.00 H new ATOM 0 HG3 GLU A 15 5.690 4.788 10.674 1.00 0.00 H new ATOM 242 N ASN A 16 1.640 7.503 9.808 1.00 0.00 N ATOM 243 CA ASN A 16 0.674 8.588 9.764 1.00 0.00 C ATOM 244 C ASN A 16 -0.739 8.004 9.707 1.00 0.00 C ATOM 245 O ASN A 16 -1.603 8.383 10.497 1.00 0.00 O ATOM 246 CB ASN A 16 0.878 9.456 8.521 1.00 0.00 C ATOM 247 CG ASN A 16 2.191 10.237 8.607 1.00 0.00 C ATOM 248 OD1 ASN A 16 2.791 10.379 9.659 1.00 0.00 O ATOM 249 ND2 ASN A 16 2.602 10.732 7.443 1.00 0.00 N ATOM 0 H ASN A 16 2.159 7.359 8.942 1.00 0.00 H new ATOM 0 HA ASN A 16 0.811 9.199 10.656 1.00 0.00 H new ATOM 0 HB2 ASN A 16 0.882 8.827 7.631 1.00 0.00 H new ATOM 0 HB3 ASN A 16 0.044 10.150 8.417 1.00 0.00 H new ATOM 0 HD21 ASN A 16 3.468 11.268 7.394 1.00 0.00 H new ATOM 0 HD22 ASN A 16 2.051 10.576 6.599 1.00 0.00 H new ATOM 256 N LEU A 17 -0.931 7.093 8.765 1.00 0.00 N ATOM 257 CA LEU A 17 -2.225 6.454 8.595 1.00 0.00 C ATOM 258 C LEU A 17 -2.170 5.039 9.173 1.00 0.00 C ATOM 259 O LEU A 17 -2.832 4.132 8.670 1.00 0.00 O ATOM 260 CB LEU A 17 -2.657 6.502 7.128 1.00 0.00 C ATOM 261 CG LEU A 17 -1.529 6.593 6.099 1.00 0.00 C ATOM 262 CD1 LEU A 17 -0.702 5.306 6.076 1.00 0.00 C ATOM 263 CD2 LEU A 17 -2.077 6.946 4.714 1.00 0.00 C ATOM 0 H LEU A 17 -0.212 6.782 8.111 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.993 6.995 9.148 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.246 5.610 6.914 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.316 7.359 6.992 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.860 7.401 6.397 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.093 5.398 5.336 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.264 5.137 7.060 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.345 4.465 5.816 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.254 7.004 4.001 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -2.780 6.177 4.394 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.587 7.908 4.759 1.00 0.00 H new ATOM 275 N LYS A 18 -1.375 4.893 10.223 1.00 0.00 N ATOM 276 CA LYS A 18 -1.225 3.604 10.876 1.00 0.00 C ATOM 277 C LYS A 18 -2.519 3.257 11.614 1.00 0.00 C ATOM 278 O LYS A 18 -3.058 2.164 11.449 1.00 0.00 O ATOM 279 CB LYS A 18 0.016 3.598 11.772 1.00 0.00 C ATOM 280 CG LYS A 18 0.945 2.436 11.414 1.00 0.00 C ATOM 281 CD LYS A 18 1.656 1.899 12.658 1.00 0.00 C ATOM 282 CE LYS A 18 2.833 1.001 12.272 1.00 0.00 C ATOM 283 NZ LYS A 18 3.470 0.433 13.481 1.00 0.00 N ATOM 0 H LYS A 18 -0.828 5.647 10.638 1.00 0.00 H new ATOM 0 HA LYS A 18 -1.060 2.820 10.137 1.00 0.00 H new ATOM 0 HB2 LYS A 18 0.551 4.542 11.665 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -0.286 3.519 12.816 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.370 1.637 10.946 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.683 2.768 10.684 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.013 2.731 13.265 1.00 0.00 H new ATOM 0 HD3 LYS A 18 0.951 1.337 13.270 1.00 0.00 H new ATOM 0 HE2 LYS A 18 2.487 0.196 11.624 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.565 1.575 11.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.267 -0.174 13.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.818 1.205 14.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 2.773 -0.132 14.008 1.00 0.00 H new ATOM 296 N GLU A 19 -2.979 4.208 12.413 1.00 0.00 N ATOM 297 CA GLU A 19 -4.200 4.018 13.178 1.00 0.00 C ATOM 298 C GLU A 19 -5.388 3.808 12.237 1.00 0.00 C ATOM 299 O GLU A 19 -6.300 3.041 12.545 1.00 0.00 O ATOM 300 CB GLU A 19 -4.448 5.198 14.119 1.00 0.00 C ATOM 301 CG GLU A 19 -4.566 6.508 13.337 1.00 0.00 C ATOM 302 CD GLU A 19 -4.080 7.692 14.175 1.00 0.00 C ATOM 303 OE1 GLU A 19 -3.132 8.386 13.777 1.00 0.00 O ATOM 304 OE2 GLU A 19 -4.726 7.883 15.275 1.00 0.00 O ATOM 0 H GLU A 19 -2.528 5.113 12.548 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.085 3.125 13.792 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -5.361 5.027 14.689 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -3.632 5.272 14.838 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -3.981 6.442 12.420 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -5.603 6.668 13.042 1.00 0.00 H new ATOM 312 N LYS A 20 -5.339 4.502 11.110 1.00 0.00 N ATOM 313 CA LYS A 20 -6.401 4.401 10.122 1.00 0.00 C ATOM 314 C LYS A 20 -6.501 2.954 9.634 1.00 0.00 C ATOM 315 O LYS A 20 -7.600 2.427 9.467 1.00 0.00 O ATOM 316 CB LYS A 20 -6.184 5.416 8.998 1.00 0.00 C ATOM 317 CG LYS A 20 -7.382 6.359 8.872 1.00 0.00 C ATOM 318 CD LYS A 20 -7.520 7.239 10.116 1.00 0.00 C ATOM 319 CE LYS A 20 -8.818 8.049 10.074 1.00 0.00 C ATOM 320 NZ LYS A 20 -8.849 9.036 11.176 1.00 0.00 N ATOM 0 H LYS A 20 -4.581 5.137 10.858 1.00 0.00 H new ATOM 0 HA LYS A 20 -7.363 4.654 10.568 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.281 5.994 9.194 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.028 4.892 8.055 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.264 6.987 7.989 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.293 5.778 8.730 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.505 6.616 11.010 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.668 7.915 10.184 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.903 8.562 9.116 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.674 7.379 10.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.627 9.708 11.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.995 8.543 12.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.947 9.552 11.205 1.00 0.00 H new ATOM 333 N LEU A 21 -5.340 2.354 9.420 1.00 0.00 N ATOM 334 CA LEU A 21 -5.284 0.978 8.954 1.00 0.00 C ATOM 335 C LEU A 21 -5.605 0.037 10.117 1.00 0.00 C ATOM 336 O LEU A 21 -6.110 -1.065 9.907 1.00 0.00 O ATOM 337 CB LEU A 21 -3.937 0.693 8.287 1.00 0.00 C ATOM 338 CG LEU A 21 -3.480 1.709 7.238 1.00 0.00 C ATOM 339 CD1 LEU A 21 -1.968 1.931 7.312 1.00 0.00 C ATOM 340 CD2 LEU A 21 -3.930 1.290 5.836 1.00 0.00 C ATOM 0 H LEU A 21 -4.431 2.794 9.560 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.037 0.805 8.186 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.175 0.634 9.064 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -3.988 -0.288 7.816 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.957 2.664 7.457 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.669 2.657 6.556 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.703 2.306 8.300 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.453 0.988 7.132 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.592 2.029 5.109 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.501 0.318 5.591 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.018 1.224 5.808 1.00 0.00 H new ATOM 352 N GLU A 22 -5.300 0.507 11.318 1.00 0.00 N ATOM 353 CA GLU A 22 -5.550 -0.279 12.514 1.00 0.00 C ATOM 354 C GLU A 22 -7.055 -0.456 12.727 1.00 0.00 C ATOM 355 O GLU A 22 -7.482 -1.362 13.443 1.00 0.00 O ATOM 356 CB GLU A 22 -4.894 0.362 13.738 1.00 0.00 C ATOM 357 CG GLU A 22 -3.375 0.185 13.702 1.00 0.00 C ATOM 358 CD GLU A 22 -2.872 -0.497 14.976 1.00 0.00 C ATOM 359 OE1 GLU A 22 -3.649 -1.175 15.664 1.00 0.00 O ATOM 360 OE2 GLU A 22 -1.624 -0.304 15.241 1.00 0.00 O ATOM 0 H GLU A 22 -4.882 1.422 11.488 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.104 -1.264 12.378 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.139 1.424 13.772 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.295 -0.087 14.647 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.095 -0.409 12.832 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.895 1.157 13.592 1.00 0.00 H new ATOM 368 N GLU A 23 -7.818 0.422 12.094 1.00 0.00 N ATOM 369 CA GLU A 23 -9.266 0.374 12.206 1.00 0.00 C ATOM 370 C GLU A 23 -9.831 -0.727 11.307 1.00 0.00 C ATOM 371 O GLU A 23 -10.578 -1.588 11.769 1.00 0.00 O ATOM 372 CB GLU A 23 -9.887 1.731 11.868 1.00 0.00 C ATOM 373 CG GLU A 23 -8.979 2.877 12.319 1.00 0.00 C ATOM 374 CD GLU A 23 -9.804 4.087 12.764 1.00 0.00 C ATOM 375 OE1 GLU A 23 -10.005 4.291 13.971 1.00 0.00 O ATOM 376 OE2 GLU A 23 -10.242 4.831 11.806 1.00 0.00 O ATOM 0 H GLU A 23 -7.461 1.171 11.501 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.524 0.141 13.239 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -10.058 1.799 10.794 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.859 1.821 12.352 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -8.345 2.542 13.140 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -8.317 3.164 11.502 1.00 0.00 H new ATOM 384 N ILE A 24 -9.454 -0.662 10.038 1.00 0.00 N ATOM 385 CA ILE A 24 -9.915 -1.643 9.070 1.00 0.00 C ATOM 386 C ILE A 24 -9.645 -3.050 9.608 1.00 0.00 C ATOM 387 O ILE A 24 -10.533 -3.901 9.604 1.00 0.00 O ATOM 388 CB ILE A 24 -9.289 -1.378 7.699 1.00 0.00 C ATOM 389 CG1 ILE A 24 -7.772 -1.216 7.812 1.00 0.00 C ATOM 390 CG2 ILE A 24 -9.945 -0.174 7.020 1.00 0.00 C ATOM 391 CD1 ILE A 24 -7.135 -1.044 6.431 1.00 0.00 C ATOM 0 H ILE A 24 -8.835 0.054 9.658 1.00 0.00 H new ATOM 0 HA ILE A 24 -10.992 -1.558 8.925 1.00 0.00 H new ATOM 0 HB ILE A 24 -9.474 -2.245 7.065 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -7.540 -0.351 8.434 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.345 -2.088 8.307 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.482 -0.008 6.048 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -11.009 -0.367 6.886 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.812 0.711 7.642 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -6.056 -0.931 6.539 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.348 -1.921 5.820 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -7.546 -0.157 5.949 1.00 0.00 H new ATOM 403 N VAL A 25 -8.415 -3.251 10.057 1.00 0.00 N ATOM 404 CA VAL A 25 -8.016 -4.540 10.597 1.00 0.00 C ATOM 405 C VAL A 25 -8.869 -4.858 11.827 1.00 0.00 C ATOM 406 O VAL A 25 -9.335 -5.985 11.988 1.00 0.00 O ATOM 407 CB VAL A 25 -6.515 -4.541 10.894 1.00 0.00 C ATOM 408 CG1 VAL A 25 -5.702 -4.704 9.608 1.00 0.00 C ATOM 409 CG2 VAL A 25 -6.104 -3.274 11.647 1.00 0.00 C ATOM 0 H VAL A 25 -7.681 -2.543 10.058 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.190 -5.331 9.867 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.301 -5.396 11.536 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.639 -4.701 9.847 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -5.964 -5.647 9.129 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -5.924 -3.879 8.931 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.033 -3.300 11.846 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -6.340 -2.399 11.042 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -6.647 -3.219 12.591 1.00 0.00 H new ATOM 419 N LYS A 26 -9.048 -3.846 12.662 1.00 0.00 N ATOM 420 CA LYS A 26 -9.837 -4.004 13.872 1.00 0.00 C ATOM 421 C LYS A 26 -11.250 -4.456 13.499 1.00 0.00 C ATOM 422 O LYS A 26 -11.832 -5.306 14.171 1.00 0.00 O ATOM 423 CB LYS A 26 -9.802 -2.722 14.706 1.00 0.00 C ATOM 424 CG LYS A 26 -10.462 -2.936 16.070 1.00 0.00 C ATOM 425 CD LYS A 26 -10.404 -1.661 16.913 1.00 0.00 C ATOM 426 CE LYS A 26 -10.042 -1.981 18.365 1.00 0.00 C ATOM 427 NZ LYS A 26 -11.245 -2.400 19.119 1.00 0.00 N ATOM 0 H LYS A 26 -8.660 -2.913 12.525 1.00 0.00 H new ATOM 0 HA LYS A 26 -9.410 -4.781 14.506 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.769 -2.402 14.844 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -10.315 -1.922 14.172 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.500 -3.238 15.932 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -9.961 -3.748 16.597 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -9.667 -0.976 16.493 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -11.368 -1.153 16.878 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -9.294 -2.773 18.393 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -9.597 -1.105 18.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.982 -2.613 20.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -11.947 -1.633 19.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.653 -3.249 18.678 1.00 0.00 H new ATOM 440 N LYS A 27 -11.762 -3.867 12.428 1.00 0.00 N ATOM 441 CA LYS A 27 -13.096 -4.199 11.957 1.00 0.00 C ATOM 442 C LYS A 27 -13.132 -5.668 11.532 1.00 0.00 C ATOM 443 O LYS A 27 -13.994 -6.425 11.975 1.00 0.00 O ATOM 444 CB LYS A 27 -13.532 -3.230 10.856 1.00 0.00 C ATOM 445 CG LYS A 27 -14.998 -3.452 10.480 1.00 0.00 C ATOM 446 CD LYS A 27 -15.615 -2.176 9.902 1.00 0.00 C ATOM 447 CE LYS A 27 -15.316 -2.052 8.406 1.00 0.00 C ATOM 448 NZ LYS A 27 -14.471 -0.866 8.143 1.00 0.00 N ATOM 0 H LYS A 27 -11.277 -3.162 11.873 1.00 0.00 H new ATOM 0 HA LYS A 27 -13.823 -4.081 12.760 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -13.391 -2.203 11.193 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.903 -3.366 9.977 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -15.072 -4.259 9.751 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -15.559 -3.765 11.360 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -16.693 -2.184 10.062 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -15.222 -1.307 10.429 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -14.810 -2.951 8.054 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -16.249 -1.972 7.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.278 -0.797 7.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.967 -0.009 8.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.573 -0.958 8.660 1.00 0.00 H new ATOM 461 N GLU A 28 -12.184 -6.028 10.679 1.00 0.00 N ATOM 462 CA GLU A 28 -12.096 -7.393 10.189 1.00 0.00 C ATOM 463 C GLU A 28 -11.860 -8.359 11.352 1.00 0.00 C ATOM 464 O GLU A 28 -12.669 -9.254 11.593 1.00 0.00 O ATOM 465 CB GLU A 28 -10.997 -7.527 9.133 1.00 0.00 C ATOM 466 CG GLU A 28 -11.335 -8.631 8.128 1.00 0.00 C ATOM 467 CD GLU A 28 -12.643 -8.325 7.396 1.00 0.00 C ATOM 468 OE1 GLU A 28 -12.666 -7.465 6.503 1.00 0.00 O ATOM 469 OE2 GLU A 28 -13.659 -9.017 7.784 1.00 0.00 O ATOM 0 H GLU A 28 -11.470 -5.397 10.315 1.00 0.00 H new ATOM 0 HA GLU A 28 -13.043 -7.650 9.714 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -10.873 -6.579 8.609 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -10.047 -7.750 9.618 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -10.525 -8.731 7.406 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -11.419 -9.586 8.646 1.00 0.00 H new ATOM 477 N ILE A 29 -10.749 -8.146 12.041 1.00 0.00 N ATOM 478 CA ILE A 29 -10.396 -8.987 13.172 1.00 0.00 C ATOM 479 C ILE A 29 -9.728 -8.131 14.250 1.00 0.00 C ATOM 480 O ILE A 29 -10.211 -8.059 15.378 1.00 0.00 O ATOM 481 CB ILE A 29 -9.546 -10.173 12.713 1.00 0.00 C ATOM 482 CG1 ILE A 29 -9.088 -11.014 13.907 1.00 0.00 C ATOM 483 CG2 ILE A 29 -8.368 -9.704 11.857 1.00 0.00 C ATOM 484 CD1 ILE A 29 -8.574 -12.381 13.450 1.00 0.00 C ATOM 0 H ILE A 29 -10.081 -7.403 11.838 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.291 -9.420 13.619 1.00 0.00 H new ATOM 0 HB ILE A 29 -10.165 -10.815 12.086 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.301 -10.487 14.447 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -9.917 -11.147 14.602 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.780 -10.567 11.544 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -8.743 -9.182 10.977 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -7.741 -9.029 12.440 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.255 -12.958 14.318 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -9.371 -12.915 12.932 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.730 -12.245 12.774 1.00 0.00 H new ATOM 496 N GLY A 30 -8.626 -7.504 13.863 1.00 0.00 N ATOM 497 CA GLY A 30 -7.887 -6.656 14.783 1.00 0.00 C ATOM 498 C GLY A 30 -6.696 -7.406 15.383 1.00 0.00 C ATOM 499 O GLY A 30 -6.340 -7.188 16.540 1.00 0.00 O ATOM 0 H GLY A 30 -8.228 -7.566 12.926 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.535 -5.766 14.261 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -8.547 -6.317 15.581 1.00 0.00 H new ATOM 503 N ASP A 31 -6.114 -8.275 14.570 1.00 0.00 N ATOM 504 CA ASP A 31 -4.971 -9.059 15.007 1.00 0.00 C ATOM 505 C ASP A 31 -4.274 -9.661 13.785 1.00 0.00 C ATOM 506 O ASP A 31 -4.237 -10.880 13.625 1.00 0.00 O ATOM 507 CB ASP A 31 -5.407 -10.209 15.917 1.00 0.00 C ATOM 508 CG ASP A 31 -4.356 -10.666 16.930 1.00 0.00 C ATOM 509 OD1 ASP A 31 -4.131 -10.010 17.958 1.00 0.00 O ATOM 510 OD2 ASP A 31 -3.746 -11.762 16.626 1.00 0.00 O ATOM 0 H ASP A 31 -6.412 -8.454 13.611 1.00 0.00 H new ATOM 0 HA ASP A 31 -4.300 -8.399 15.557 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -6.303 -9.905 16.458 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -5.684 -11.060 15.295 1.00 0.00 H new ATOM 516 N VAL A 32 -3.738 -8.778 12.955 1.00 0.00 N ATOM 517 CA VAL A 32 -3.044 -9.207 11.753 1.00 0.00 C ATOM 518 C VAL A 32 -1.627 -8.631 11.754 1.00 0.00 C ATOM 519 O VAL A 32 -1.290 -7.803 12.599 1.00 0.00 O ATOM 520 CB VAL A 32 -3.850 -8.810 10.514 1.00 0.00 C ATOM 521 CG1 VAL A 32 -3.836 -7.294 10.313 1.00 0.00 C ATOM 522 CG2 VAL A 32 -3.332 -9.533 9.269 1.00 0.00 C ATOM 0 H VAL A 32 -3.770 -7.768 13.091 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.953 -10.293 11.731 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.884 -9.117 10.674 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.416 -7.039 9.426 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -4.273 -6.807 11.185 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.809 -6.953 10.185 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -3.922 -9.233 8.403 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -2.287 -9.271 9.105 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.418 -10.610 9.412 1.00 0.00 H new ATOM 532 N HIS A 33 -0.834 -9.092 10.797 1.00 0.00 N ATOM 533 CA HIS A 33 0.539 -8.632 10.678 1.00 0.00 C ATOM 534 C HIS A 33 0.880 -8.413 9.202 1.00 0.00 C ATOM 535 O HIS A 33 1.014 -9.371 8.443 1.00 0.00 O ATOM 536 CB HIS A 33 1.499 -9.602 11.370 1.00 0.00 C ATOM 537 CG HIS A 33 2.142 -9.044 12.617 1.00 0.00 C ATOM 538 ND1 HIS A 33 3.487 -9.201 12.902 1.00 0.00 N ATOM 539 CD2 HIS A 33 1.610 -8.330 13.651 1.00 0.00 C ATOM 540 CE1 HIS A 33 3.743 -8.604 14.057 1.00 0.00 C ATOM 541 NE2 HIS A 33 2.578 -8.065 14.520 1.00 0.00 N ATOM 0 H HIS A 33 -1.116 -9.779 10.098 1.00 0.00 H new ATOM 0 HA HIS A 33 0.651 -7.675 11.188 1.00 0.00 H new ATOM 0 HB2 HIS A 33 0.957 -10.511 11.629 1.00 0.00 H new ATOM 0 HB3 HIS A 33 2.281 -9.887 10.666 1.00 0.00 H new ATOM 0 HD2 HIS A 33 0.577 -8.031 13.746 1.00 0.00 H new ATOM 0 HE1 HIS A 33 4.705 -8.553 14.546 1.00 0.00 H new ATOM 0 HE2 HIS A 33 2.469 -7.544 15.390 1.00 0.00 H new ATOM 549 N VAL A 34 1.011 -7.145 8.841 1.00 0.00 N ATOM 550 CA VAL A 34 1.334 -6.787 7.470 1.00 0.00 C ATOM 551 C VAL A 34 2.732 -6.167 7.425 1.00 0.00 C ATOM 552 O VAL A 34 2.920 -5.021 7.831 1.00 0.00 O ATOM 553 CB VAL A 34 0.252 -5.867 6.901 1.00 0.00 C ATOM 554 CG1 VAL A 34 0.762 -5.121 5.665 1.00 0.00 C ATOM 555 CG2 VAL A 34 -1.022 -6.650 6.582 1.00 0.00 C ATOM 0 H VAL A 34 0.899 -6.353 9.474 1.00 0.00 H new ATOM 0 HA VAL A 34 1.352 -7.674 6.837 1.00 0.00 H new ATOM 0 HB VAL A 34 0.007 -5.127 7.663 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.026 -4.474 5.280 1.00 0.00 H new ATOM 0 HG12 VAL A 34 1.628 -4.517 5.936 1.00 0.00 H new ATOM 0 HG13 VAL A 34 1.048 -5.841 4.898 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.774 -5.972 6.179 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -0.799 -7.423 5.847 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.402 -7.114 7.492 1.00 0.00 H new ATOM 565 N ASN A 35 3.677 -6.951 6.927 1.00 0.00 N ATOM 566 CA ASN A 35 5.052 -6.492 6.823 1.00 0.00 C ATOM 567 C ASN A 35 5.295 -5.937 5.419 1.00 0.00 C ATOM 568 O ASN A 35 5.436 -6.698 4.462 1.00 0.00 O ATOM 569 CB ASN A 35 6.034 -7.642 7.054 1.00 0.00 C ATOM 570 CG ASN A 35 6.712 -7.518 8.420 1.00 0.00 C ATOM 571 OD1 ASN A 35 7.228 -6.478 8.794 1.00 0.00 O ATOM 572 ND2 ASN A 35 6.682 -8.635 9.142 1.00 0.00 N ATOM 0 H ASN A 35 3.518 -7.901 6.591 1.00 0.00 H new ATOM 0 HA ASN A 35 5.210 -5.725 7.581 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.506 -8.594 6.991 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.789 -7.644 6.268 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.108 -8.655 10.069 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.233 -9.472 8.769 1.00 0.00 H new ATOM 579 N VAL A 36 5.337 -4.615 5.339 1.00 0.00 N ATOM 580 CA VAL A 36 5.561 -3.949 4.067 1.00 0.00 C ATOM 581 C VAL A 36 7.062 -3.721 3.873 1.00 0.00 C ATOM 582 O VAL A 36 7.734 -3.199 4.761 1.00 0.00 O ATOM 583 CB VAL A 36 4.747 -2.655 4.003 1.00 0.00 C ATOM 584 CG1 VAL A 36 3.474 -2.766 4.845 1.00 0.00 C ATOM 585 CG2 VAL A 36 5.590 -1.455 4.439 1.00 0.00 C ATOM 0 H VAL A 36 5.220 -3.987 6.134 1.00 0.00 H new ATOM 0 HA VAL A 36 5.218 -4.574 3.243 1.00 0.00 H new ATOM 0 HB VAL A 36 4.450 -2.497 2.966 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.914 -1.833 4.782 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.860 -3.584 4.469 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.741 -2.960 5.884 1.00 0.00 H new ATOM 0 HG21 VAL A 36 4.988 -0.548 4.384 1.00 0.00 H new ATOM 0 HG22 VAL A 36 5.931 -1.603 5.464 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.453 -1.358 3.780 1.00 0.00 H new ATOM 595 N ILE A 37 7.543 -4.125 2.706 1.00 0.00 N ATOM 596 CA ILE A 37 8.952 -3.971 2.384 1.00 0.00 C ATOM 597 C ILE A 37 9.130 -2.769 1.455 1.00 0.00 C ATOM 598 O ILE A 37 8.747 -2.820 0.288 1.00 0.00 O ATOM 599 CB ILE A 37 9.517 -5.275 1.817 1.00 0.00 C ATOM 600 CG1 ILE A 37 9.036 -6.480 2.629 1.00 0.00 C ATOM 601 CG2 ILE A 37 11.043 -5.218 1.727 1.00 0.00 C ATOM 602 CD1 ILE A 37 7.744 -7.055 2.045 1.00 0.00 C ATOM 0 H ILE A 37 6.982 -4.558 1.972 1.00 0.00 H new ATOM 0 HA ILE A 37 9.529 -3.766 3.286 1.00 0.00 H new ATOM 0 HB ILE A 37 9.139 -5.398 0.802 1.00 0.00 H new ATOM 0 HG12 ILE A 37 9.809 -7.249 2.638 1.00 0.00 H new ATOM 0 HG13 ILE A 37 8.870 -6.182 3.664 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.419 -6.157 1.321 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.339 -4.396 1.074 1.00 0.00 H new ATOM 0 HG23 ILE A 37 11.460 -5.060 2.721 1.00 0.00 H new ATOM 0 HD11 ILE A 37 7.424 -7.910 2.641 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.966 -6.291 2.060 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.920 -7.374 1.018 1.00 0.00 H new ATOM 614 N LEU A 38 9.711 -1.715 2.009 1.00 0.00 N ATOM 615 CA LEU A 38 9.945 -0.501 1.245 1.00 0.00 C ATOM 616 C LEU A 38 11.216 -0.667 0.409 1.00 0.00 C ATOM 617 O LEU A 38 12.291 -0.919 0.950 1.00 0.00 O ATOM 618 CB LEU A 38 9.972 0.717 2.170 1.00 0.00 C ATOM 619 CG LEU A 38 8.746 0.908 3.064 1.00 0.00 C ATOM 620 CD1 LEU A 38 9.043 1.889 4.200 1.00 0.00 C ATOM 621 CD2 LEU A 38 7.528 1.335 2.241 1.00 0.00 C ATOM 0 H LEU A 38 10.027 -1.676 2.978 1.00 0.00 H new ATOM 0 HA LEU A 38 9.125 -0.325 0.548 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.854 0.645 2.807 1.00 0.00 H new ATOM 0 HB3 LEU A 38 10.093 1.611 1.558 1.00 0.00 H new ATOM 0 HG LEU A 38 8.505 -0.051 3.522 1.00 0.00 H new ATOM 0 HD11 LEU A 38 8.155 2.007 4.821 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.862 1.505 4.808 1.00 0.00 H new ATOM 0 HD13 LEU A 38 9.324 2.856 3.782 1.00 0.00 H new ATOM 0 HD21 LEU A 38 6.670 1.464 2.901 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.742 2.277 1.736 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.303 0.569 1.499 1.00 0.00 H new ATOM 633 N VAL A 39 11.049 -0.519 -0.897 1.00 0.00 N ATOM 634 CA VAL A 39 12.170 -0.649 -1.814 1.00 0.00 C ATOM 635 C VAL A 39 11.928 0.238 -3.037 1.00 0.00 C ATOM 636 O VAL A 39 10.797 0.364 -3.503 1.00 0.00 O ATOM 637 CB VAL A 39 12.381 -2.120 -2.175 1.00 0.00 C ATOM 638 CG1 VAL A 39 12.491 -2.984 -0.917 1.00 0.00 C ATOM 639 CG2 VAL A 39 11.266 -2.626 -3.092 1.00 0.00 C ATOM 0 H VAL A 39 10.155 -0.310 -1.342 1.00 0.00 H new ATOM 0 HA VAL A 39 13.092 -0.308 -1.342 1.00 0.00 H new ATOM 0 HB VAL A 39 13.323 -2.199 -2.718 1.00 0.00 H new ATOM 0 HG11 VAL A 39 12.641 -4.025 -1.203 1.00 0.00 H new ATOM 0 HG12 VAL A 39 13.336 -2.647 -0.317 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.574 -2.896 -0.334 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.441 -3.675 -3.333 1.00 0.00 H new ATOM 0 HG22 VAL A 39 10.305 -2.525 -2.587 1.00 0.00 H new ATOM 0 HG23 VAL A 39 11.256 -2.039 -4.011 1.00 0.00 H new ATOM 649 N SER A 40 13.010 0.831 -3.520 1.00 0.00 N ATOM 650 CA SER A 40 12.930 1.703 -4.680 1.00 0.00 C ATOM 651 C SER A 40 12.914 0.869 -5.962 1.00 0.00 C ATOM 652 O SER A 40 12.797 -0.355 -5.909 1.00 0.00 O ATOM 653 CB SER A 40 14.096 2.694 -4.706 1.00 0.00 C ATOM 654 OG SER A 40 14.128 3.510 -3.538 1.00 0.00 O ATOM 0 H SER A 40 13.946 0.725 -3.130 1.00 0.00 H new ATOM 0 HA SER A 40 12.004 2.274 -4.614 1.00 0.00 H new ATOM 0 HB2 SER A 40 15.035 2.147 -4.792 1.00 0.00 H new ATOM 0 HB3 SER A 40 14.014 3.328 -5.589 1.00 0.00 H new ATOM 0 HG SER A 40 14.887 4.128 -3.591 1.00 0.00 H new ATOM 660 N GLU A 41 13.034 1.563 -7.084 1.00 0.00 N ATOM 661 CA GLU A 41 13.035 0.902 -8.378 1.00 0.00 C ATOM 662 C GLU A 41 14.300 0.057 -8.541 1.00 0.00 C ATOM 663 O GLU A 41 14.226 -1.111 -8.919 1.00 0.00 O ATOM 664 CB GLU A 41 12.904 1.918 -9.514 1.00 0.00 C ATOM 665 CG GLU A 41 13.274 1.289 -10.858 1.00 0.00 C ATOM 666 CD GLU A 41 13.163 2.311 -11.991 1.00 0.00 C ATOM 667 OE1 GLU A 41 12.177 3.059 -12.057 1.00 0.00 O ATOM 668 OE2 GLU A 41 14.149 2.312 -12.823 1.00 0.00 O ATOM 0 H GLU A 41 13.131 2.578 -7.124 1.00 0.00 H new ATOM 0 HA GLU A 41 12.170 0.240 -8.426 1.00 0.00 H new ATOM 0 HB2 GLU A 41 11.882 2.294 -9.554 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.551 2.773 -9.318 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.291 0.899 -10.813 1.00 0.00 H new ATOM 0 HG3 GLU A 41 12.617 0.443 -11.061 1.00 0.00 H new ATOM 676 N ASP A 42 15.431 0.680 -8.247 1.00 0.00 N ATOM 677 CA ASP A 42 16.711 0.000 -8.356 1.00 0.00 C ATOM 678 C ASP A 42 16.851 -1.001 -7.208 1.00 0.00 C ATOM 679 O ASP A 42 17.425 -2.075 -7.382 1.00 0.00 O ATOM 680 CB ASP A 42 17.871 0.992 -8.263 1.00 0.00 C ATOM 681 CG ASP A 42 18.828 0.982 -9.457 1.00 0.00 C ATOM 682 OD1 ASP A 42 18.570 1.620 -10.488 1.00 0.00 O ATOM 683 OD2 ASP A 42 19.893 0.271 -9.296 1.00 0.00 O ATOM 0 H ASP A 42 15.488 1.649 -7.933 1.00 0.00 H new ATOM 0 HA ASP A 42 16.744 -0.504 -9.322 1.00 0.00 H new ATOM 0 HB2 ASP A 42 17.462 1.996 -8.153 1.00 0.00 H new ATOM 0 HB3 ASP A 42 18.440 0.778 -7.358 1.00 0.00 H new ATOM 689 N GLU A 43 16.317 -0.614 -6.059 1.00 0.00 N ATOM 690 CA GLU A 43 16.375 -1.464 -4.882 1.00 0.00 C ATOM 691 C GLU A 43 15.508 -2.708 -5.082 1.00 0.00 C ATOM 692 O GLU A 43 15.842 -3.787 -4.595 1.00 0.00 O ATOM 693 CB GLU A 43 15.950 -0.695 -3.629 1.00 0.00 C ATOM 694 CG GLU A 43 17.093 -0.628 -2.613 1.00 0.00 C ATOM 695 CD GLU A 43 17.146 0.744 -1.938 1.00 0.00 C ATOM 696 OE1 GLU A 43 16.448 0.970 -0.938 1.00 0.00 O ATOM 697 OE2 GLU A 43 17.949 1.591 -2.487 1.00 0.00 O ATOM 0 H GLU A 43 15.842 0.277 -5.918 1.00 0.00 H new ATOM 0 HA GLU A 43 17.407 -1.784 -4.740 1.00 0.00 H new ATOM 0 HB2 GLU A 43 15.643 0.314 -3.904 1.00 0.00 H new ATOM 0 HB3 GLU A 43 15.084 -1.179 -3.177 1.00 0.00 H new ATOM 0 HG2 GLU A 43 16.960 -1.404 -1.859 1.00 0.00 H new ATOM 0 HG3 GLU A 43 18.041 -0.828 -3.113 1.00 0.00 H new ATOM 705 N ILE A 44 14.411 -2.517 -5.801 1.00 0.00 N ATOM 706 CA ILE A 44 13.494 -3.610 -6.072 1.00 0.00 C ATOM 707 C ILE A 44 13.980 -4.387 -7.297 1.00 0.00 C ATOM 708 O ILE A 44 13.757 -5.592 -7.401 1.00 0.00 O ATOM 709 CB ILE A 44 12.062 -3.088 -6.204 1.00 0.00 C ATOM 710 CG1 ILE A 44 11.046 -4.190 -5.899 1.00 0.00 C ATOM 711 CG2 ILE A 44 11.831 -2.461 -7.580 1.00 0.00 C ATOM 712 CD1 ILE A 44 9.722 -3.596 -5.411 1.00 0.00 C ATOM 0 H ILE A 44 14.137 -1.621 -6.204 1.00 0.00 H new ATOM 0 HA ILE A 44 13.478 -4.309 -5.236 1.00 0.00 H new ATOM 0 HB ILE A 44 11.916 -2.302 -5.463 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.873 -4.788 -6.794 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.449 -4.861 -5.141 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.805 -2.098 -7.647 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.520 -1.628 -7.721 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.003 -3.209 -8.354 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.017 -4.401 -5.201 1.00 0.00 H new ATOM 0 HD12 ILE A 44 9.895 -3.019 -4.502 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.310 -2.944 -6.181 1.00 0.00 H new ATOM 724 N LYS A 45 14.636 -3.665 -8.194 1.00 0.00 N ATOM 725 CA LYS A 45 15.156 -4.271 -9.408 1.00 0.00 C ATOM 726 C LYS A 45 15.934 -5.538 -9.047 1.00 0.00 C ATOM 727 O LYS A 45 15.746 -6.584 -9.666 1.00 0.00 O ATOM 728 CB LYS A 45 15.973 -3.254 -10.207 1.00 0.00 C ATOM 729 CG LYS A 45 16.631 -3.912 -11.421 1.00 0.00 C ATOM 730 CD LYS A 45 18.063 -4.345 -11.102 1.00 0.00 C ATOM 731 CE LYS A 45 18.996 -4.067 -12.283 1.00 0.00 C ATOM 732 NZ LYS A 45 19.452 -2.660 -12.263 1.00 0.00 N ATOM 0 H LYS A 45 14.819 -2.666 -8.104 1.00 0.00 H new ATOM 0 HA LYS A 45 14.339 -4.574 -10.063 1.00 0.00 H new ATOM 0 HB2 LYS A 45 15.326 -2.440 -10.536 1.00 0.00 H new ATOM 0 HB3 LYS A 45 16.739 -2.814 -9.568 1.00 0.00 H new ATOM 0 HG2 LYS A 45 16.046 -4.778 -11.731 1.00 0.00 H new ATOM 0 HG3 LYS A 45 16.636 -3.215 -12.259 1.00 0.00 H new ATOM 0 HD2 LYS A 45 18.419 -3.814 -10.220 1.00 0.00 H new ATOM 0 HD3 LYS A 45 18.080 -5.408 -10.863 1.00 0.00 H new ATOM 0 HE2 LYS A 45 19.856 -4.735 -12.239 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.478 -4.274 -13.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 20.084 -2.488 -13.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 18.629 -2.027 -12.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 19.964 -2.474 -11.377 1.00 0.00 H new ATOM 745 N GLU A 46 16.792 -5.402 -8.046 1.00 0.00 N ATOM 746 CA GLU A 46 17.599 -6.523 -7.595 1.00 0.00 C ATOM 747 C GLU A 46 16.767 -7.456 -6.714 1.00 0.00 C ATOM 748 O GLU A 46 16.839 -8.676 -6.854 1.00 0.00 O ATOM 749 CB GLU A 46 18.847 -6.037 -6.854 1.00 0.00 C ATOM 750 CG GLU A 46 19.705 -5.143 -7.752 1.00 0.00 C ATOM 751 CD GLU A 46 21.179 -5.547 -7.680 1.00 0.00 C ATOM 752 OE1 GLU A 46 21.916 -5.048 -6.817 1.00 0.00 O ATOM 753 OE2 GLU A 46 21.551 -6.412 -8.561 1.00 0.00 O ATOM 0 H GLU A 46 16.946 -4.533 -7.535 1.00 0.00 H new ATOM 0 HA GLU A 46 17.931 -7.082 -8.470 1.00 0.00 H new ATOM 0 HB2 GLU A 46 18.552 -5.486 -5.961 1.00 0.00 H new ATOM 0 HB3 GLU A 46 19.433 -6.894 -6.521 1.00 0.00 H new ATOM 0 HG2 GLU A 46 19.355 -5.213 -8.782 1.00 0.00 H new ATOM 0 HG3 GLU A 46 19.594 -4.102 -7.448 1.00 0.00 H new ATOM 761 N LEU A 47 15.996 -6.847 -5.825 1.00 0.00 N ATOM 762 CA LEU A 47 15.151 -7.609 -4.921 1.00 0.00 C ATOM 763 C LEU A 47 14.328 -8.617 -5.727 1.00 0.00 C ATOM 764 O LEU A 47 14.314 -9.805 -5.411 1.00 0.00 O ATOM 765 CB LEU A 47 14.302 -6.670 -4.062 1.00 0.00 C ATOM 766 CG LEU A 47 13.733 -7.269 -2.774 1.00 0.00 C ATOM 767 CD1 LEU A 47 12.689 -8.343 -3.084 1.00 0.00 C ATOM 768 CD2 LEU A 47 14.852 -7.800 -1.876 1.00 0.00 C ATOM 0 H LEU A 47 15.939 -5.835 -5.711 1.00 0.00 H new ATOM 0 HA LEU A 47 15.760 -8.181 -4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 47 14.908 -5.803 -3.799 1.00 0.00 H new ATOM 0 HB3 LEU A 47 13.472 -6.307 -4.668 1.00 0.00 H new ATOM 0 HG LEU A 47 13.226 -6.477 -2.223 1.00 0.00 H new ATOM 0 HD11 LEU A 47 12.300 -8.753 -2.152 1.00 0.00 H new ATOM 0 HD12 LEU A 47 11.872 -7.902 -3.655 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.150 -9.141 -3.667 1.00 0.00 H new ATOM 0 HD21 LEU A 47 14.421 -8.220 -0.967 1.00 0.00 H new ATOM 0 HD22 LEU A 47 15.407 -8.574 -2.406 1.00 0.00 H new ATOM 0 HD23 LEU A 47 15.526 -6.985 -1.614 1.00 0.00 H new ATOM 780 N ASN A 48 13.663 -8.105 -6.751 1.00 0.00 N ATOM 781 CA ASN A 48 12.840 -8.945 -7.604 1.00 0.00 C ATOM 782 C ASN A 48 13.712 -10.030 -8.240 1.00 0.00 C ATOM 783 O ASN A 48 13.255 -11.150 -8.458 1.00 0.00 O ATOM 784 CB ASN A 48 12.203 -8.130 -8.732 1.00 0.00 C ATOM 785 CG ASN A 48 10.960 -8.833 -9.282 1.00 0.00 C ATOM 786 OD1 ASN A 48 10.651 -9.962 -8.940 1.00 0.00 O ATOM 787 ND2 ASN A 48 10.268 -8.104 -10.152 1.00 0.00 N ATOM 0 H ASN A 48 13.677 -7.118 -7.010 1.00 0.00 H new ATOM 0 HA ASN A 48 12.055 -9.383 -6.988 1.00 0.00 H new ATOM 0 HB2 ASN A 48 11.932 -7.141 -8.363 1.00 0.00 H new ATOM 0 HB3 ASN A 48 12.927 -7.984 -9.534 1.00 0.00 H new ATOM 0 HD21 ASN A 48 9.422 -8.484 -10.577 1.00 0.00 H new ATOM 0 HD22 ASN A 48 10.583 -7.165 -10.395 1.00 0.00 H new ATOM 794 N GLN A 49 14.953 -9.658 -8.518 1.00 0.00 N ATOM 795 CA GLN A 49 15.894 -10.584 -9.124 1.00 0.00 C ATOM 796 C GLN A 49 16.180 -11.748 -8.173 1.00 0.00 C ATOM 797 O GLN A 49 16.544 -12.838 -8.611 1.00 0.00 O ATOM 798 CB GLN A 49 17.187 -9.871 -9.523 1.00 0.00 C ATOM 799 CG GLN A 49 17.240 -9.634 -11.033 1.00 0.00 C ATOM 800 CD GLN A 49 18.667 -9.330 -11.491 1.00 0.00 C ATOM 801 OE1 GLN A 49 19.384 -8.544 -10.894 1.00 0.00 O ATOM 802 NE2 GLN A 49 19.039 -9.994 -12.582 1.00 0.00 N ATOM 0 H GLN A 49 15.329 -8.728 -8.335 1.00 0.00 H new ATOM 0 HA GLN A 49 15.445 -10.985 -10.033 1.00 0.00 H new ATOM 0 HB2 GLN A 49 17.257 -8.918 -8.999 1.00 0.00 H new ATOM 0 HB3 GLN A 49 18.045 -10.468 -9.215 1.00 0.00 H new ATOM 0 HG2 GLN A 49 16.866 -10.514 -11.556 1.00 0.00 H new ATOM 0 HG3 GLN A 49 16.585 -8.804 -11.298 1.00 0.00 H new ATOM 0 HE21 GLN A 49 18.389 -10.638 -13.034 1.00 0.00 H new ATOM 0 HE22 GLN A 49 19.974 -9.859 -12.967 1.00 0.00 H new ATOM 811 N GLN A 50 16.006 -11.476 -6.888 1.00 0.00 N ATOM 812 CA GLN A 50 16.241 -12.487 -5.870 1.00 0.00 C ATOM 813 C GLN A 50 15.236 -13.631 -6.016 1.00 0.00 C ATOM 814 O GLN A 50 15.491 -14.747 -5.567 1.00 0.00 O ATOM 815 CB GLN A 50 16.179 -11.878 -4.468 1.00 0.00 C ATOM 816 CG GLN A 50 17.250 -10.800 -4.291 1.00 0.00 C ATOM 817 CD GLN A 50 17.241 -10.248 -2.863 1.00 0.00 C ATOM 818 OE1 GLN A 50 16.489 -10.683 -2.007 1.00 0.00 O ATOM 819 NE2 GLN A 50 18.117 -9.269 -2.657 1.00 0.00 N ATOM 0 H GLN A 50 15.705 -10.570 -6.528 1.00 0.00 H new ATOM 0 HA GLN A 50 17.244 -12.890 -6.011 1.00 0.00 H new ATOM 0 HB2 GLN A 50 15.192 -11.447 -4.298 1.00 0.00 H new ATOM 0 HB3 GLN A 50 16.318 -12.660 -3.721 1.00 0.00 H new ATOM 0 HG2 GLN A 50 18.231 -11.217 -4.518 1.00 0.00 H new ATOM 0 HG3 GLN A 50 17.076 -9.990 -4.999 1.00 0.00 H new ATOM 0 HE21 GLN A 50 18.717 -8.953 -3.419 1.00 0.00 H new ATOM 0 HE22 GLN A 50 18.189 -8.834 -1.737 1.00 0.00 H new ATOM 828 N PHE A 51 14.114 -13.314 -6.646 1.00 0.00 N ATOM 829 CA PHE A 51 13.069 -14.302 -6.857 1.00 0.00 C ATOM 830 C PHE A 51 12.852 -14.560 -8.349 1.00 0.00 C ATOM 831 O PHE A 51 12.828 -15.709 -8.787 1.00 0.00 O ATOM 832 CB PHE A 51 11.784 -13.728 -6.258 1.00 0.00 C ATOM 833 CG PHE A 51 11.965 -13.114 -4.868 1.00 0.00 C ATOM 834 CD1 PHE A 51 12.757 -13.731 -3.950 1.00 0.00 C ATOM 835 CD2 PHE A 51 11.333 -11.953 -4.550 1.00 0.00 C ATOM 836 CE1 PHE A 51 12.925 -13.161 -2.661 1.00 0.00 C ATOM 837 CE2 PHE A 51 11.501 -11.383 -3.260 1.00 0.00 C ATOM 838 CZ PHE A 51 12.294 -12.000 -2.343 1.00 0.00 C ATOM 0 H PHE A 51 13.906 -12.387 -7.017 1.00 0.00 H new ATOM 0 HA PHE A 51 13.349 -15.246 -6.390 1.00 0.00 H new ATOM 0 HB2 PHE A 51 11.390 -12.967 -6.931 1.00 0.00 H new ATOM 0 HB3 PHE A 51 11.037 -14.520 -6.200 1.00 0.00 H new ATOM 0 HD1 PHE A 51 13.258 -14.654 -4.202 1.00 0.00 H new ATOM 0 HD2 PHE A 51 10.703 -11.464 -5.278 1.00 0.00 H new ATOM 0 HE1 PHE A 51 13.555 -13.650 -1.932 1.00 0.00 H new ATOM 0 HE2 PHE A 51 11.000 -10.460 -3.007 1.00 0.00 H new ATOM 0 HZ PHE A 51 12.422 -11.567 -1.362 1.00 0.00 H new ATOM 848 N ARG A 52 12.698 -13.471 -9.089 1.00 0.00 N ATOM 849 CA ARG A 52 12.483 -13.565 -10.523 1.00 0.00 C ATOM 850 C ARG A 52 13.756 -14.049 -11.220 1.00 0.00 C ATOM 851 O ARG A 52 13.688 -14.730 -12.242 1.00 0.00 O ATOM 852 CB ARG A 52 12.072 -12.212 -11.108 1.00 0.00 C ATOM 853 CG ARG A 52 10.549 -12.094 -11.198 1.00 0.00 C ATOM 854 CD ARG A 52 10.012 -12.837 -12.422 1.00 0.00 C ATOM 855 NE ARG A 52 8.900 -12.073 -13.030 1.00 0.00 N ATOM 856 CZ ARG A 52 7.659 -11.995 -12.504 1.00 0.00 C ATOM 857 NH1 ARG A 52 7.361 -12.635 -11.353 1.00 0.00 N ATOM 858 NH2 ARG A 52 6.741 -11.284 -13.132 1.00 0.00 N ATOM 0 H ARG A 52 12.718 -12.519 -8.722 1.00 0.00 H new ATOM 0 HA ARG A 52 11.678 -14.280 -10.692 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.467 -11.408 -10.487 1.00 0.00 H new ATOM 0 HB3 ARG A 52 12.509 -12.092 -12.099 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.095 -12.500 -10.294 1.00 0.00 H new ATOM 0 HG3 ARG A 52 10.265 -11.043 -11.253 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.810 -12.977 -13.152 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.667 -13.830 -12.133 1.00 0.00 H new ATOM 0 HE ARG A 52 9.082 -11.574 -13.901 1.00 0.00 H new ATOM 0 HH11 ARG A 52 8.076 -13.183 -10.874 1.00 0.00 H new ATOM 0 HH12 ARG A 52 6.421 -12.571 -10.962 1.00 0.00 H new ATOM 0 HH21 ARG A 52 6.974 -10.804 -14.001 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.799 -11.215 -12.748 1.00 0.00 H new ATOM 871 N GLY A 53 14.888 -13.677 -10.640 1.00 0.00 N ATOM 872 CA GLY A 53 16.175 -14.065 -11.193 1.00 0.00 C ATOM 873 C GLY A 53 16.537 -13.197 -12.399 1.00 0.00 C ATOM 874 O GLY A 53 17.600 -13.366 -12.994 1.00 0.00 O ATOM 0 H GLY A 53 14.941 -13.111 -9.793 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.946 -13.972 -10.429 1.00 0.00 H new ATOM 0 HA3 GLY A 53 16.146 -15.113 -11.490 1.00 0.00 H new ATOM 878 N GLN A 54 15.631 -12.286 -12.726 1.00 0.00 N ATOM 879 CA GLN A 54 15.842 -11.391 -13.851 1.00 0.00 C ATOM 880 C GLN A 54 15.511 -9.951 -13.454 1.00 0.00 C ATOM 881 O GLN A 54 14.921 -9.714 -12.401 1.00 0.00 O ATOM 882 CB GLN A 54 15.016 -11.829 -15.062 1.00 0.00 C ATOM 883 CG GLN A 54 13.553 -12.055 -14.676 1.00 0.00 C ATOM 884 CD GLN A 54 12.684 -12.266 -15.917 1.00 0.00 C ATOM 885 OE1 GLN A 54 12.572 -11.411 -16.781 1.00 0.00 O ATOM 886 NE2 GLN A 54 12.078 -13.448 -15.959 1.00 0.00 N ATOM 0 H GLN A 54 14.750 -12.149 -12.231 1.00 0.00 H new ATOM 0 HA GLN A 54 16.894 -11.436 -14.134 1.00 0.00 H new ATOM 0 HB2 GLN A 54 15.077 -11.070 -15.842 1.00 0.00 H new ATOM 0 HB3 GLN A 54 15.432 -12.747 -15.478 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.476 -12.924 -14.022 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.186 -11.198 -14.112 1.00 0.00 H new ATOM 0 HE21 GLN A 54 12.215 -14.118 -15.202 1.00 0.00 H new ATOM 0 HE22 GLN A 54 11.476 -13.685 -16.748 1.00 0.00 H new ATOM 895 N ASP A 55 15.905 -9.027 -14.318 1.00 0.00 N ATOM 896 CA ASP A 55 15.657 -7.617 -14.070 1.00 0.00 C ATOM 897 C ASP A 55 14.268 -7.248 -14.595 1.00 0.00 C ATOM 898 O ASP A 55 14.087 -7.050 -15.796 1.00 0.00 O ATOM 899 CB ASP A 55 16.684 -6.742 -14.792 1.00 0.00 C ATOM 900 CG ASP A 55 16.344 -5.251 -14.839 1.00 0.00 C ATOM 901 OD1 ASP A 55 15.311 -4.814 -14.309 1.00 0.00 O ATOM 902 OD2 ASP A 55 17.201 -4.516 -15.462 1.00 0.00 O ATOM 0 H ASP A 55 16.394 -9.227 -15.190 1.00 0.00 H new ATOM 0 HA ASP A 55 15.729 -7.445 -12.996 1.00 0.00 H new ATOM 0 HB2 ASP A 55 17.650 -6.864 -14.303 1.00 0.00 H new ATOM 0 HB3 ASP A 55 16.795 -7.106 -15.813 1.00 0.00 H new ATOM 908 N ARG A 56 13.323 -7.166 -13.670 1.00 0.00 N ATOM 909 CA ARG A 56 11.956 -6.824 -14.025 1.00 0.00 C ATOM 910 C ARG A 56 11.331 -5.943 -12.942 1.00 0.00 C ATOM 911 O ARG A 56 10.961 -6.432 -11.876 1.00 0.00 O ATOM 912 CB ARG A 56 11.103 -8.081 -14.206 1.00 0.00 C ATOM 913 CG ARG A 56 11.767 -9.059 -15.177 1.00 0.00 C ATOM 914 CD ARG A 56 11.733 -8.519 -16.608 1.00 0.00 C ATOM 915 NE ARG A 56 10.437 -8.849 -17.243 1.00 0.00 N ATOM 916 CZ ARG A 56 9.347 -8.053 -17.198 1.00 0.00 C ATOM 917 NH1 ARG A 56 9.388 -6.872 -16.545 1.00 0.00 N ATOM 918 NH2 ARG A 56 8.241 -8.448 -17.801 1.00 0.00 N ATOM 0 H ARG A 56 13.477 -7.330 -12.675 1.00 0.00 H new ATOM 0 HA ARG A 56 11.985 -6.280 -14.969 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.954 -8.566 -13.241 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.117 -7.805 -14.580 1.00 0.00 H new ATOM 0 HG2 ARG A 56 12.800 -9.233 -14.874 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.257 -10.021 -15.135 1.00 0.00 H new ATOM 0 HD2 ARG A 56 11.880 -7.439 -16.601 1.00 0.00 H new ATOM 0 HD3 ARG A 56 12.551 -8.948 -17.187 1.00 0.00 H new ATOM 0 HE ARG A 56 10.363 -9.733 -17.746 1.00 0.00 H new ATOM 0 HH11 ARG A 56 10.247 -6.575 -16.081 1.00 0.00 H new ATOM 0 HH12 ARG A 56 8.560 -6.276 -16.516 1.00 0.00 H new ATOM 0 HH21 ARG A 56 8.219 -9.342 -18.291 1.00 0.00 H new ATOM 0 HH22 ARG A 56 7.409 -7.859 -17.777 1.00 0.00 H new ATOM 931 N PRO A 57 11.231 -4.624 -13.260 1.00 0.00 N ATOM 932 CA PRO A 57 10.657 -3.671 -12.326 1.00 0.00 C ATOM 933 C PRO A 57 9.134 -3.808 -12.268 1.00 0.00 C ATOM 934 O PRO A 57 8.538 -4.498 -13.093 1.00 0.00 O ATOM 935 CB PRO A 57 11.111 -2.309 -12.826 1.00 0.00 C ATOM 936 CG PRO A 57 11.530 -2.514 -14.273 1.00 0.00 C ATOM 937 CD PRO A 57 11.659 -4.009 -14.513 1.00 0.00 C ATOM 0 HA PRO A 57 10.988 -3.836 -11.301 1.00 0.00 H new ATOM 0 HB2 PRO A 57 10.306 -1.578 -12.752 1.00 0.00 H new ATOM 0 HB3 PRO A 57 11.941 -1.931 -12.229 1.00 0.00 H new ATOM 0 HG2 PRO A 57 10.793 -2.081 -14.949 1.00 0.00 H new ATOM 0 HG3 PRO A 57 12.477 -2.012 -14.471 1.00 0.00 H new ATOM 0 HD2 PRO A 57 11.034 -4.332 -15.346 1.00 0.00 H new ATOM 0 HD3 PRO A 57 12.685 -4.284 -14.759 1.00 0.00 H new ATOM 945 N THR A 58 8.549 -3.141 -11.284 1.00 0.00 N ATOM 946 CA THR A 58 7.107 -3.180 -11.108 1.00 0.00 C ATOM 947 C THR A 58 6.659 -2.085 -10.138 1.00 0.00 C ATOM 948 O THR A 58 7.476 -1.521 -9.412 1.00 0.00 O ATOM 949 CB THR A 58 6.725 -4.590 -10.652 1.00 0.00 C ATOM 950 OG1 THR A 58 5.304 -4.549 -10.551 1.00 0.00 O ATOM 951 CG2 THR A 58 7.191 -4.890 -9.226 1.00 0.00 C ATOM 0 H THR A 58 9.047 -2.571 -10.601 1.00 0.00 H new ATOM 0 HA THR A 58 6.588 -2.974 -12.044 1.00 0.00 H new ATOM 0 HB THR A 58 7.155 -5.322 -11.336 1.00 0.00 H new ATOM 0 HG1 THR A 58 4.971 -5.424 -10.262 1.00 0.00 H new ATOM 0 HG21 THR A 58 6.895 -5.902 -8.952 1.00 0.00 H new ATOM 0 HG22 THR A 58 8.276 -4.802 -9.172 1.00 0.00 H new ATOM 0 HG23 THR A 58 6.735 -4.179 -8.537 1.00 0.00 H new ATOM 959 N ASP A 59 5.361 -1.818 -10.156 1.00 0.00 N ATOM 960 CA ASP A 59 4.794 -0.801 -9.287 1.00 0.00 C ATOM 961 C ASP A 59 4.958 -1.233 -7.829 1.00 0.00 C ATOM 962 O ASP A 59 5.417 -0.454 -6.995 1.00 0.00 O ATOM 963 CB ASP A 59 3.300 -0.613 -9.561 1.00 0.00 C ATOM 964 CG ASP A 59 2.968 0.308 -10.736 1.00 0.00 C ATOM 965 OD1 ASP A 59 3.808 0.547 -11.617 1.00 0.00 O ATOM 966 OD2 ASP A 59 1.775 0.797 -10.725 1.00 0.00 O ATOM 0 H ASP A 59 4.686 -2.289 -10.759 1.00 0.00 H new ATOM 0 HA ASP A 59 5.316 0.136 -9.479 1.00 0.00 H new ATOM 0 HB2 ASP A 59 2.855 -1.590 -9.748 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.829 -0.215 -8.662 1.00 0.00 H new ATOM 972 N VAL A 60 4.572 -2.473 -7.566 1.00 0.00 N ATOM 973 CA VAL A 60 4.670 -3.018 -6.223 1.00 0.00 C ATOM 974 C VAL A 60 4.745 -4.544 -6.300 1.00 0.00 C ATOM 975 O VAL A 60 4.017 -5.166 -7.073 1.00 0.00 O ATOM 976 CB VAL A 60 3.502 -2.519 -5.369 1.00 0.00 C ATOM 977 CG1 VAL A 60 2.190 -2.566 -6.155 1.00 0.00 C ATOM 978 CG2 VAL A 60 3.392 -3.320 -4.070 1.00 0.00 C ATOM 0 H VAL A 60 4.191 -3.116 -8.260 1.00 0.00 H new ATOM 0 HA VAL A 60 5.582 -2.672 -5.737 1.00 0.00 H new ATOM 0 HB VAL A 60 3.698 -1.480 -5.106 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.376 -2.206 -5.526 1.00 0.00 H new ATOM 0 HG12 VAL A 60 2.272 -1.933 -7.039 1.00 0.00 H new ATOM 0 HG13 VAL A 60 1.986 -3.592 -6.461 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.554 -2.946 -3.481 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.229 -4.372 -4.304 1.00 0.00 H new ATOM 0 HG23 VAL A 60 4.314 -3.214 -3.498 1.00 0.00 H new ATOM 988 N LEU A 61 5.631 -5.103 -5.490 1.00 0.00 N ATOM 989 CA LEU A 61 5.811 -6.545 -5.457 1.00 0.00 C ATOM 990 C LEU A 61 5.003 -7.129 -4.296 1.00 0.00 C ATOM 991 O LEU A 61 5.125 -6.674 -3.160 1.00 0.00 O ATOM 992 CB LEU A 61 7.298 -6.899 -5.411 1.00 0.00 C ATOM 993 CG LEU A 61 7.904 -7.422 -6.715 1.00 0.00 C ATOM 994 CD1 LEU A 61 8.972 -6.464 -7.246 1.00 0.00 C ATOM 995 CD2 LEU A 61 8.446 -8.842 -6.537 1.00 0.00 C ATOM 0 H LEU A 61 6.233 -4.584 -4.851 1.00 0.00 H new ATOM 0 HA LEU A 61 5.428 -6.998 -6.372 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.853 -6.012 -5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 61 7.448 -7.651 -4.636 1.00 0.00 H new ATOM 0 HG LEU A 61 7.113 -7.470 -7.464 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.387 -6.859 -8.173 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.524 -5.489 -7.436 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.767 -6.361 -6.508 1.00 0.00 H new ATOM 0 HD21 LEU A 61 8.871 -9.190 -7.478 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.218 -8.843 -5.768 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.635 -9.506 -6.238 1.00 0.00 H new ATOM 1007 N THR A 62 4.195 -8.127 -4.622 1.00 0.00 N ATOM 1008 CA THR A 62 3.368 -8.778 -3.621 1.00 0.00 C ATOM 1009 C THR A 62 3.753 -10.253 -3.487 1.00 0.00 C ATOM 1010 O THR A 62 4.100 -10.900 -4.474 1.00 0.00 O ATOM 1011 CB THR A 62 1.903 -8.566 -4.008 1.00 0.00 C ATOM 1012 OG1 THR A 62 1.172 -9.195 -2.958 1.00 0.00 O ATOM 1013 CG2 THR A 62 1.508 -9.352 -5.259 1.00 0.00 C ATOM 0 H THR A 62 4.096 -8.501 -5.566 1.00 0.00 H new ATOM 0 HA THR A 62 3.526 -8.343 -2.634 1.00 0.00 H new ATOM 0 HB THR A 62 1.722 -7.504 -4.174 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.211 -9.104 -3.128 1.00 0.00 H new ATOM 0 HG21 THR A 62 0.459 -9.166 -5.489 1.00 0.00 H new ATOM 0 HG22 THR A 62 2.126 -9.034 -6.099 1.00 0.00 H new ATOM 0 HG23 THR A 62 1.657 -10.417 -5.082 1.00 0.00 H new ATOM 1021 N PHE A 63 3.681 -10.740 -2.257 1.00 0.00 N ATOM 1022 CA PHE A 63 4.018 -12.127 -1.981 1.00 0.00 C ATOM 1023 C PHE A 63 2.875 -13.060 -2.387 1.00 0.00 C ATOM 1024 O PHE A 63 1.713 -12.657 -2.398 1.00 0.00 O ATOM 1025 CB PHE A 63 4.241 -12.240 -0.472 1.00 0.00 C ATOM 1026 CG PHE A 63 5.690 -12.006 -0.038 1.00 0.00 C ATOM 1027 CD1 PHE A 63 6.473 -11.133 -0.726 1.00 0.00 C ATOM 1028 CD2 PHE A 63 6.194 -12.670 1.036 1.00 0.00 C ATOM 1029 CE1 PHE A 63 7.817 -10.915 -0.324 1.00 0.00 C ATOM 1030 CE2 PHE A 63 7.538 -12.453 1.439 1.00 0.00 C ATOM 1031 CZ PHE A 63 8.321 -11.580 0.750 1.00 0.00 C ATOM 0 H PHE A 63 3.395 -10.200 -1.441 1.00 0.00 H new ATOM 0 HA PHE A 63 4.904 -12.415 -2.546 1.00 0.00 H new ATOM 0 HB2 PHE A 63 3.600 -11.519 0.035 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.929 -13.231 -0.142 1.00 0.00 H new ATOM 0 HD1 PHE A 63 6.072 -10.605 -1.579 1.00 0.00 H new ATOM 0 HD2 PHE A 63 5.572 -13.363 1.583 1.00 0.00 H new ATOM 0 HE1 PHE A 63 8.439 -10.222 -0.871 1.00 0.00 H new ATOM 0 HE2 PHE A 63 7.938 -12.981 2.292 1.00 0.00 H new ATOM 0 HZ PHE A 63 9.344 -11.415 1.056 1.00 0.00 H new ATOM 1041 N PRO A 64 3.255 -14.323 -2.719 1.00 0.00 N ATOM 1042 CA PRO A 64 2.276 -15.317 -3.124 1.00 0.00 C ATOM 1043 C PRO A 64 1.488 -15.834 -1.919 1.00 0.00 C ATOM 1044 O PRO A 64 2.021 -16.577 -1.096 1.00 0.00 O ATOM 1045 CB PRO A 64 3.083 -16.404 -3.817 1.00 0.00 C ATOM 1046 CG PRO A 64 4.521 -16.206 -3.367 1.00 0.00 C ATOM 1047 CD PRO A 64 4.622 -14.836 -2.717 1.00 0.00 C ATOM 0 HA PRO A 64 1.519 -14.912 -3.795 1.00 0.00 H new ATOM 0 HB2 PRO A 64 2.721 -17.395 -3.542 1.00 0.00 H new ATOM 0 HB3 PRO A 64 2.998 -16.323 -4.901 1.00 0.00 H new ATOM 0 HG2 PRO A 64 4.811 -16.985 -2.662 1.00 0.00 H new ATOM 0 HG3 PRO A 64 5.200 -16.276 -4.217 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.017 -14.907 -1.704 1.00 0.00 H new ATOM 0 HD3 PRO A 64 5.291 -14.181 -3.275 1.00 0.00 H new ATOM 1136 N VAL A 70 -3.159 -12.921 3.790 1.00 0.00 N ATOM 1137 CA VAL A 70 -1.749 -13.058 3.465 1.00 0.00 C ATOM 1138 C VAL A 70 -0.933 -13.097 4.758 1.00 0.00 C ATOM 1139 O VAL A 70 0.011 -13.876 4.878 1.00 0.00 O ATOM 1140 CB VAL A 70 -1.318 -11.935 2.519 1.00 0.00 C ATOM 1141 CG1 VAL A 70 -1.954 -12.107 1.138 1.00 0.00 C ATOM 1142 CG2 VAL A 70 -1.652 -10.563 3.110 1.00 0.00 C ATOM 0 HA VAL A 70 -1.568 -13.995 2.939 1.00 0.00 H new ATOM 0 HB VAL A 70 -0.236 -11.994 2.399 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.631 -11.296 0.485 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -1.645 -13.061 0.711 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -3.040 -12.087 1.232 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -1.336 -9.782 2.418 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -2.727 -10.489 3.273 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -1.131 -10.439 4.060 1.00 0.00 H new ATOM 1152 N TYR A 71 -1.327 -12.246 5.695 1.00 0.00 N ATOM 1153 CA TYR A 71 -0.644 -12.173 6.975 1.00 0.00 C ATOM 1154 C TYR A 71 0.864 -12.364 6.803 1.00 0.00 C ATOM 1155 O TYR A 71 1.534 -12.880 7.697 1.00 0.00 O ATOM 1156 CB TYR A 71 -1.199 -13.325 7.815 1.00 0.00 C ATOM 1157 CG TYR A 71 -0.502 -13.503 9.166 1.00 0.00 C ATOM 1158 CD1 TYR A 71 -0.787 -12.644 10.208 1.00 0.00 C ATOM 1159 CD2 TYR A 71 0.413 -14.521 9.341 1.00 0.00 C ATOM 1160 CE1 TYR A 71 -0.131 -12.811 11.479 1.00 0.00 C ATOM 1161 CE2 TYR A 71 1.069 -14.688 10.612 1.00 0.00 C ATOM 1162 CZ TYR A 71 0.765 -13.825 11.618 1.00 0.00 C ATOM 1163 OH TYR A 71 1.384 -13.983 12.818 1.00 0.00 O ATOM 0 H TYR A 71 -2.111 -11.601 5.593 1.00 0.00 H new ATOM 0 HA TYR A 71 -0.804 -11.201 7.441 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -2.262 -13.157 7.986 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -1.110 -14.251 7.247 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -1.502 -11.846 10.070 1.00 0.00 H new ATOM 0 HD2 TYR A 71 0.637 -15.192 8.525 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -0.345 -12.146 12.303 1.00 0.00 H new ATOM 0 HE2 TYR A 71 1.786 -15.481 10.763 1.00 0.00 H new ATOM 0 HH TYR A 71 1.996 -14.747 12.772 1.00 0.00 H new ATOM 1173 N GLY A 72 1.355 -11.937 5.649 1.00 0.00 N ATOM 1174 CA GLY A 72 2.772 -12.055 5.348 1.00 0.00 C ATOM 1175 C GLY A 72 3.413 -10.675 5.183 1.00 0.00 C ATOM 1176 O GLY A 72 3.332 -9.837 6.080 1.00 0.00 O ATOM 0 H GLY A 72 0.797 -11.509 4.911 1.00 0.00 H new ATOM 0 HA2 GLY A 72 3.273 -12.600 6.148 1.00 0.00 H new ATOM 0 HA3 GLY A 72 2.907 -12.634 4.435 1.00 0.00 H new ATOM 1180 N GLU A 73 4.036 -10.483 4.029 1.00 0.00 N ATOM 1181 CA GLU A 73 4.691 -9.219 3.735 1.00 0.00 C ATOM 1182 C GLU A 73 4.511 -8.860 2.259 1.00 0.00 C ATOM 1183 O GLU A 73 4.345 -9.741 1.417 1.00 0.00 O ATOM 1184 CB GLU A 73 6.174 -9.270 4.109 1.00 0.00 C ATOM 1185 CG GLU A 73 6.855 -10.491 3.489 1.00 0.00 C ATOM 1186 CD GLU A 73 6.823 -11.683 4.448 1.00 0.00 C ATOM 1187 OE1 GLU A 73 5.771 -12.317 4.614 1.00 0.00 O ATOM 1188 OE2 GLU A 73 7.944 -11.943 5.031 1.00 0.00 O ATOM 0 H GLU A 73 4.101 -11.180 3.288 1.00 0.00 H new ATOM 0 HA GLU A 73 4.224 -8.441 4.339 1.00 0.00 H new ATOM 0 HB2 GLU A 73 6.670 -8.361 3.769 1.00 0.00 H new ATOM 0 HB3 GLU A 73 6.278 -9.303 5.194 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.356 -10.756 2.557 1.00 0.00 H new ATOM 0 HG3 GLU A 73 7.888 -10.248 3.239 1.00 0.00 H new ATOM 1196 N ILE A 74 4.548 -7.563 1.990 1.00 0.00 N ATOM 1197 CA ILE A 74 4.391 -7.076 0.630 1.00 0.00 C ATOM 1198 C ILE A 74 5.399 -5.954 0.374 1.00 0.00 C ATOM 1199 O ILE A 74 5.499 -5.013 1.161 1.00 0.00 O ATOM 1200 CB ILE A 74 2.939 -6.668 0.371 1.00 0.00 C ATOM 1201 CG1 ILE A 74 2.509 -5.543 1.315 1.00 0.00 C ATOM 1202 CG2 ILE A 74 2.006 -7.877 0.459 1.00 0.00 C ATOM 1203 CD1 ILE A 74 1.993 -4.336 0.529 1.00 0.00 C ATOM 0 H ILE A 74 4.684 -6.835 2.691 1.00 0.00 H new ATOM 0 HA ILE A 74 4.608 -7.869 -0.085 1.00 0.00 H new ATOM 0 HB ILE A 74 2.869 -6.280 -0.645 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.730 -5.904 1.986 1.00 0.00 H new ATOM 0 HG13 ILE A 74 3.352 -5.243 1.937 1.00 0.00 H new ATOM 0 HG21 ILE A 74 0.980 -7.560 0.271 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.299 -8.618 -0.285 1.00 0.00 H new ATOM 0 HG23 ILE A 74 2.073 -8.317 1.454 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.694 -3.551 1.223 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.782 -3.962 -0.124 1.00 0.00 H new ATOM 0 HD13 ILE A 74 1.135 -4.634 -0.073 1.00 0.00 H new ATOM 1215 N TYR A 75 6.122 -6.091 -0.728 1.00 0.00 N ATOM 1216 CA TYR A 75 7.119 -5.100 -1.096 1.00 0.00 C ATOM 1217 C TYR A 75 6.485 -3.948 -1.878 1.00 0.00 C ATOM 1218 O TYR A 75 5.920 -4.158 -2.951 1.00 0.00 O ATOM 1219 CB TYR A 75 8.119 -5.825 -2.000 1.00 0.00 C ATOM 1220 CG TYR A 75 9.188 -6.612 -1.240 1.00 0.00 C ATOM 1221 CD1 TYR A 75 8.864 -7.809 -0.635 1.00 0.00 C ATOM 1222 CD2 TYR A 75 10.477 -6.124 -1.159 1.00 0.00 C ATOM 1223 CE1 TYR A 75 9.871 -8.550 0.081 1.00 0.00 C ATOM 1224 CE2 TYR A 75 11.483 -6.865 -0.443 1.00 0.00 C ATOM 1225 CZ TYR A 75 11.130 -8.041 0.141 1.00 0.00 C ATOM 1226 OH TYR A 75 12.081 -8.741 0.817 1.00 0.00 O ATOM 0 H TYR A 75 6.037 -6.873 -1.378 1.00 0.00 H new ATOM 0 HA TYR A 75 7.588 -4.678 -0.207 1.00 0.00 H new ATOM 0 HB2 TYR A 75 7.575 -6.508 -2.652 1.00 0.00 H new ATOM 0 HB3 TYR A 75 8.609 -5.093 -2.642 1.00 0.00 H new ATOM 0 HD1 TYR A 75 7.856 -8.190 -0.698 1.00 0.00 H new ATOM 0 HD2 TYR A 75 10.731 -5.187 -1.632 1.00 0.00 H new ATOM 0 HE1 TYR A 75 9.631 -9.488 0.559 1.00 0.00 H new ATOM 0 HE2 TYR A 75 12.495 -6.495 -0.372 1.00 0.00 H new ATOM 0 HH TYR A 75 12.933 -8.259 0.776 1.00 0.00 H new ATOM 1236 N VAL A 76 6.599 -2.757 -1.310 1.00 0.00 N ATOM 1237 CA VAL A 76 6.044 -1.571 -1.941 1.00 0.00 C ATOM 1238 C VAL A 76 7.182 -0.717 -2.502 1.00 0.00 C ATOM 1239 O VAL A 76 8.299 -0.747 -1.987 1.00 0.00 O ATOM 1240 CB VAL A 76 5.163 -0.813 -0.945 1.00 0.00 C ATOM 1241 CG1 VAL A 76 4.676 0.509 -1.541 1.00 0.00 C ATOM 1242 CG2 VAL A 76 3.985 -1.676 -0.488 1.00 0.00 C ATOM 0 H VAL A 76 7.067 -2.587 -0.420 1.00 0.00 H new ATOM 0 HA VAL A 76 5.403 -1.848 -2.778 1.00 0.00 H new ATOM 0 HB VAL A 76 5.769 -0.583 -0.069 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.052 1.028 -0.813 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.534 1.132 -1.794 1.00 0.00 H new ATOM 0 HG13 VAL A 76 4.094 0.310 -2.441 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.375 -1.114 0.219 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.379 -1.951 -1.351 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.361 -2.578 -0.006 1.00 0.00 H new ATOM 1252 N CYS A 77 6.861 0.025 -3.552 1.00 0.00 N ATOM 1253 CA CYS A 77 7.842 0.886 -4.189 1.00 0.00 C ATOM 1254 C CYS A 77 7.113 2.100 -4.768 1.00 0.00 C ATOM 1255 O CYS A 77 6.617 2.053 -5.893 1.00 0.00 O ATOM 1256 CB CYS A 77 8.642 0.138 -5.258 1.00 0.00 C ATOM 1257 SG CYS A 77 9.855 1.265 -6.036 1.00 0.00 S ATOM 0 H CYS A 77 5.934 0.047 -3.978 1.00 0.00 H new ATOM 0 HA CYS A 77 8.570 1.219 -3.450 1.00 0.00 H new ATOM 0 HB2 CYS A 77 9.158 -0.711 -4.810 1.00 0.00 H new ATOM 0 HB3 CYS A 77 7.967 -0.262 -6.015 1.00 0.00 H new ATOM 0 HG CYS A 77 10.544 0.614 -6.925 1.00 0.00 H new ATOM 1263 N PRO A 78 7.069 3.187 -3.952 1.00 0.00 N ATOM 1264 CA PRO A 78 6.409 4.411 -4.371 1.00 0.00 C ATOM 1265 C PRO A 78 7.258 5.170 -5.393 1.00 0.00 C ATOM 1266 O PRO A 78 6.896 6.268 -5.813 1.00 0.00 O ATOM 1267 CB PRO A 78 6.183 5.195 -3.088 1.00 0.00 C ATOM 1268 CG PRO A 78 7.134 4.600 -2.062 1.00 0.00 C ATOM 1269 CD PRO A 78 7.646 3.279 -2.613 1.00 0.00 C ATOM 0 HA PRO A 78 5.464 4.226 -4.881 1.00 0.00 H new ATOM 0 HB2 PRO A 78 6.384 6.256 -3.238 1.00 0.00 H new ATOM 0 HB3 PRO A 78 5.148 5.111 -2.756 1.00 0.00 H new ATOM 0 HG2 PRO A 78 7.963 5.281 -1.870 1.00 0.00 H new ATOM 0 HG3 PRO A 78 6.623 4.445 -1.112 1.00 0.00 H new ATOM 0 HD2 PRO A 78 8.735 3.261 -2.649 1.00 0.00 H new ATOM 0 HD3 PRO A 78 7.334 2.442 -1.989 1.00 0.00 H new ATOM 1277 N LEU A 79 8.371 4.554 -5.764 1.00 0.00 N ATOM 1278 CA LEU A 79 9.274 5.158 -6.729 1.00 0.00 C ATOM 1279 C LEU A 79 8.620 5.142 -8.112 1.00 0.00 C ATOM 1280 O LEU A 79 8.448 6.190 -8.733 1.00 0.00 O ATOM 1281 CB LEU A 79 10.640 4.470 -6.687 1.00 0.00 C ATOM 1282 CG LEU A 79 11.858 5.390 -6.794 1.00 0.00 C ATOM 1283 CD1 LEU A 79 12.626 5.440 -5.472 1.00 0.00 C ATOM 1284 CD2 LEU A 79 12.754 4.979 -7.964 1.00 0.00 C ATOM 0 H LEU A 79 8.668 3.643 -5.414 1.00 0.00 H new ATOM 0 HA LEU A 79 9.460 6.202 -6.476 1.00 0.00 H new ATOM 0 HB2 LEU A 79 10.714 3.909 -5.755 1.00 0.00 H new ATOM 0 HB3 LEU A 79 10.685 3.745 -7.500 1.00 0.00 H new ATOM 0 HG LEU A 79 11.506 6.401 -6.999 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.487 6.101 -5.576 1.00 0.00 H new ATOM 0 HD12 LEU A 79 11.972 5.817 -4.685 1.00 0.00 H new ATOM 0 HD13 LEU A 79 12.967 4.438 -5.211 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.612 5.649 -8.018 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.101 3.956 -7.815 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.188 5.039 -8.894 1.00 0.00 H new ATOM 1296 N ILE A 80 8.272 3.942 -8.554 1.00 0.00 N ATOM 1297 CA ILE A 80 7.640 3.777 -9.852 1.00 0.00 C ATOM 1298 C ILE A 80 6.184 4.239 -9.768 1.00 0.00 C ATOM 1299 O ILE A 80 5.690 4.912 -10.672 1.00 0.00 O ATOM 1300 CB ILE A 80 7.801 2.338 -10.346 1.00 0.00 C ATOM 1301 CG1 ILE A 80 9.279 1.965 -10.478 1.00 0.00 C ATOM 1302 CG2 ILE A 80 7.036 2.118 -11.653 1.00 0.00 C ATOM 1303 CD1 ILE A 80 9.692 0.968 -9.393 1.00 0.00 C ATOM 0 H ILE A 80 8.416 3.075 -8.036 1.00 0.00 H new ATOM 0 HA ILE A 80 8.131 4.403 -10.597 1.00 0.00 H new ATOM 0 HB ILE A 80 7.366 1.671 -9.602 1.00 0.00 H new ATOM 0 HG12 ILE A 80 9.462 1.534 -11.462 1.00 0.00 H new ATOM 0 HG13 ILE A 80 9.892 2.863 -10.404 1.00 0.00 H new ATOM 0 HG21 ILE A 80 7.167 1.087 -11.982 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.976 2.315 -11.492 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.419 2.794 -12.417 1.00 0.00 H new ATOM 0 HD11 ILE A 80 10.747 0.720 -9.510 1.00 0.00 H new ATOM 0 HD12 ILE A 80 9.530 1.412 -8.411 1.00 0.00 H new ATOM 0 HD13 ILE A 80 9.094 0.062 -9.485 1.00 0.00 H new ATOM 1315 N VAL A 81 5.538 3.861 -8.675 1.00 0.00 N ATOM 1316 CA VAL A 81 4.149 4.229 -8.462 1.00 0.00 C ATOM 1317 C VAL A 81 3.993 5.741 -8.636 1.00 0.00 C ATOM 1318 O VAL A 81 3.188 6.196 -9.447 1.00 0.00 O ATOM 1319 CB VAL A 81 3.681 3.733 -7.092 1.00 0.00 C ATOM 1320 CG1 VAL A 81 2.232 4.147 -6.825 1.00 0.00 C ATOM 1321 CG2 VAL A 81 3.849 2.217 -6.971 1.00 0.00 C ATOM 0 H VAL A 81 5.951 3.303 -7.927 1.00 0.00 H new ATOM 0 HA VAL A 81 3.509 3.750 -9.203 1.00 0.00 H new ATOM 0 HB VAL A 81 4.309 4.201 -6.334 1.00 0.00 H new ATOM 0 HG11 VAL A 81 1.924 3.782 -5.845 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.154 5.234 -6.848 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.585 3.720 -7.591 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.509 1.891 -5.988 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.258 1.723 -7.742 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.900 1.956 -7.097 1.00 0.00 H new ATOM 1331 N GLU A 82 4.777 6.477 -7.861 1.00 0.00 N ATOM 1332 CA GLU A 82 4.736 7.928 -7.920 1.00 0.00 C ATOM 1333 C GLU A 82 5.066 8.412 -9.333 1.00 0.00 C ATOM 1334 O GLU A 82 4.486 9.386 -9.811 1.00 0.00 O ATOM 1335 CB GLU A 82 5.688 8.545 -6.893 1.00 0.00 C ATOM 1336 CG GLU A 82 5.382 10.029 -6.683 1.00 0.00 C ATOM 1337 CD GLU A 82 6.606 10.891 -6.996 1.00 0.00 C ATOM 1338 OE1 GLU A 82 6.503 11.860 -7.764 1.00 0.00 O ATOM 1339 OE2 GLU A 82 7.695 10.526 -6.409 1.00 0.00 O ATOM 0 H GLU A 82 5.444 6.096 -7.190 1.00 0.00 H new ATOM 0 HA GLU A 82 3.726 8.254 -7.673 1.00 0.00 H new ATOM 0 HB2 GLU A 82 5.599 8.014 -5.945 1.00 0.00 H new ATOM 0 HB3 GLU A 82 6.718 8.427 -7.230 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.550 10.326 -7.322 1.00 0.00 H new ATOM 0 HG3 GLU A 82 5.068 10.197 -5.653 1.00 0.00 H new ATOM 1347 N GLU A 83 5.996 7.709 -9.963 1.00 0.00 N ATOM 1348 CA GLU A 83 6.409 8.055 -11.313 1.00 0.00 C ATOM 1349 C GLU A 83 5.195 8.107 -12.243 1.00 0.00 C ATOM 1350 O GLU A 83 5.132 8.946 -13.140 1.00 0.00 O ATOM 1351 CB GLU A 83 7.457 7.070 -11.834 1.00 0.00 C ATOM 1352 CG GLU A 83 8.282 7.694 -12.962 1.00 0.00 C ATOM 1353 CD GLU A 83 9.275 8.720 -12.414 1.00 0.00 C ATOM 1354 OE1 GLU A 83 10.375 8.347 -11.980 1.00 0.00 O ATOM 1355 OE2 GLU A 83 8.869 9.944 -12.449 1.00 0.00 O ATOM 0 H GLU A 83 6.475 6.902 -9.564 1.00 0.00 H new ATOM 0 HA GLU A 83 6.867 9.044 -11.290 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.116 6.770 -11.019 1.00 0.00 H new ATOM 0 HB3 GLU A 83 6.965 6.167 -12.195 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.820 6.913 -13.498 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.617 8.174 -13.680 1.00 0.00 H new ATOM 1363 N ASN A 84 4.262 7.200 -11.996 1.00 0.00 N ATOM 1364 CA ASN A 84 3.053 7.133 -12.801 1.00 0.00 C ATOM 1365 C ASN A 84 2.109 8.265 -12.391 1.00 0.00 C ATOM 1366 O ASN A 84 1.470 8.883 -13.240 1.00 0.00 O ATOM 1367 CB ASN A 84 2.322 5.806 -12.586 1.00 0.00 C ATOM 1368 CG ASN A 84 3.056 4.657 -13.280 1.00 0.00 C ATOM 1369 OD1 ASN A 84 2.830 4.352 -14.440 1.00 0.00 O ATOM 1370 ND2 ASN A 84 3.946 4.038 -12.508 1.00 0.00 N ATOM 0 H ASN A 84 4.318 6.506 -11.251 1.00 0.00 H new ATOM 0 HA ASN A 84 3.340 7.221 -13.849 1.00 0.00 H new ATOM 0 HB2 ASN A 84 2.242 5.599 -11.519 1.00 0.00 H new ATOM 0 HB3 ASN A 84 1.306 5.880 -12.973 1.00 0.00 H new ATOM 0 HD21 ASN A 84 4.488 3.258 -12.879 1.00 0.00 H new ATOM 0 HD22 ASN A 84 4.086 4.344 -11.545 1.00 0.00 H new ATOM 1377 N ALA A 85 2.051 8.501 -11.088 1.00 0.00 N ATOM 1378 CA ALA A 85 1.195 9.548 -10.555 1.00 0.00 C ATOM 1379 C ALA A 85 1.707 10.910 -11.030 1.00 0.00 C ATOM 1380 O ALA A 85 0.941 11.868 -11.118 1.00 0.00 O ATOM 1381 CB ALA A 85 1.148 9.442 -9.030 1.00 0.00 C ATOM 0 H ALA A 85 2.582 7.986 -10.386 1.00 0.00 H new ATOM 0 HA ALA A 85 0.175 9.433 -10.921 1.00 0.00 H new ATOM 0 HB1 ALA A 85 0.506 10.227 -8.630 1.00 0.00 H new ATOM 0 HB2 ALA A 85 0.750 8.468 -8.745 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.154 9.555 -8.626 1.00 0.00 H new ATOM 1387 N ARG A 86 2.998 10.952 -11.322 1.00 0.00 N ATOM 1388 CA ARG A 86 3.621 12.180 -11.785 1.00 0.00 C ATOM 1389 C ARG A 86 3.040 12.593 -13.139 1.00 0.00 C ATOM 1390 O ARG A 86 2.561 13.715 -13.298 1.00 0.00 O ATOM 1391 CB ARG A 86 5.136 12.014 -11.918 1.00 0.00 C ATOM 1392 CG ARG A 86 5.804 11.955 -10.543 1.00 0.00 C ATOM 1393 CD ARG A 86 7.123 12.731 -10.540 1.00 0.00 C ATOM 1394 NE ARG A 86 6.874 14.150 -10.201 1.00 0.00 N ATOM 1395 CZ ARG A 86 7.760 15.146 -10.415 1.00 0.00 C ATOM 1396 NH1 ARG A 86 8.963 14.885 -10.970 1.00 0.00 N ATOM 1397 NH2 ARG A 86 7.433 16.378 -10.074 1.00 0.00 N ATOM 0 H ARG A 86 3.630 10.155 -11.247 1.00 0.00 H new ATOM 0 HA ARG A 86 3.415 12.954 -11.046 1.00 0.00 H new ATOM 0 HB2 ARG A 86 5.358 11.103 -12.474 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.548 12.845 -12.491 1.00 0.00 H new ATOM 0 HG2 ARG A 86 5.133 12.369 -9.791 1.00 0.00 H new ATOM 0 HG3 ARG A 86 5.988 10.916 -10.269 1.00 0.00 H new ATOM 0 HD2 ARG A 86 7.812 12.291 -9.818 1.00 0.00 H new ATOM 0 HD3 ARG A 86 7.599 12.660 -11.518 1.00 0.00 H new ATOM 0 HE ARG A 86 5.977 14.391 -9.779 1.00 0.00 H new ATOM 0 HH11 ARG A 86 9.208 13.930 -11.231 1.00 0.00 H new ATOM 0 HH12 ARG A 86 9.627 15.643 -11.128 1.00 0.00 H new ATOM 0 HH21 ARG A 86 6.522 16.567 -9.655 1.00 0.00 H new ATOM 0 HH22 ARG A 86 8.091 17.142 -10.229 1.00 0.00 H new ATOM 1410 N GLU A 87 3.100 11.663 -14.081 1.00 0.00 N ATOM 1411 CA GLU A 87 2.585 11.915 -15.416 1.00 0.00 C ATOM 1412 C GLU A 87 1.056 11.865 -15.414 1.00 0.00 C ATOM 1413 O GLU A 87 0.405 12.651 -16.100 1.00 0.00 O ATOM 1414 CB GLU A 87 3.165 10.922 -16.425 1.00 0.00 C ATOM 1415 CG GLU A 87 2.989 9.482 -15.938 1.00 0.00 C ATOM 1416 CD GLU A 87 4.330 8.744 -15.913 1.00 0.00 C ATOM 1417 OE1 GLU A 87 5.347 9.321 -15.500 1.00 0.00 O ATOM 1418 OE2 GLU A 87 4.291 7.528 -16.342 1.00 0.00 O ATOM 0 H GLU A 87 3.498 10.733 -13.946 1.00 0.00 H new ATOM 0 HA GLU A 87 2.896 12.914 -15.721 1.00 0.00 H new ATOM 0 HB2 GLU A 87 2.672 11.047 -17.389 1.00 0.00 H new ATOM 0 HB3 GLU A 87 4.224 11.131 -16.579 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.552 9.483 -14.940 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.292 8.956 -16.591 1.00 0.00 H new ATOM 1426 N PHE A 88 0.527 10.933 -14.635 1.00 0.00 N ATOM 1427 CA PHE A 88 -0.913 10.770 -14.534 1.00 0.00 C ATOM 1428 C PHE A 88 -1.489 11.654 -13.426 1.00 0.00 C ATOM 1429 O PHE A 88 -2.662 11.532 -13.076 1.00 0.00 O ATOM 1430 CB PHE A 88 -1.174 9.303 -14.187 1.00 0.00 C ATOM 1431 CG PHE A 88 -2.377 8.697 -14.913 1.00 0.00 C ATOM 1432 CD1 PHE A 88 -3.637 9.087 -14.583 1.00 0.00 C ATOM 1433 CD2 PHE A 88 -2.186 7.767 -15.886 1.00 0.00 C ATOM 1434 CE1 PHE A 88 -4.754 8.525 -15.257 1.00 0.00 C ATOM 1435 CE2 PHE A 88 -3.302 7.204 -16.560 1.00 0.00 C ATOM 1436 CZ PHE A 88 -4.562 7.595 -16.231 1.00 0.00 C ATOM 0 H PHE A 88 1.070 10.283 -14.067 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.386 11.057 -15.473 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -0.285 8.720 -14.428 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -1.330 9.217 -13.112 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -3.789 9.824 -13.808 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.185 7.456 -16.147 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -5.755 8.836 -14.996 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -3.150 6.466 -17.333 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.411 7.167 -16.743 1.00 0.00 H new ATOM 1446 N ASN A 89 -0.636 12.524 -12.904 1.00 0.00 N ATOM 1447 CA ASN A 89 -1.046 13.428 -11.843 1.00 0.00 C ATOM 1448 C ASN A 89 -1.982 12.691 -10.883 1.00 0.00 C ATOM 1449 O ASN A 89 -2.872 13.298 -10.290 1.00 0.00 O ATOM 1450 CB ASN A 89 -1.801 14.634 -12.407 1.00 0.00 C ATOM 1451 CG ASN A 89 -1.645 15.854 -11.497 1.00 0.00 C ATOM 1452 OD1 ASN A 89 -1.145 16.894 -11.891 1.00 0.00 O ATOM 1453 ND2 ASN A 89 -2.098 15.668 -10.261 1.00 0.00 N ATOM 0 H ASN A 89 0.336 12.622 -13.196 1.00 0.00 H new ATOM 0 HA ASN A 89 -0.149 13.773 -11.329 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -1.426 14.869 -13.403 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -2.858 14.388 -12.514 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -2.038 16.422 -9.577 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -2.506 14.771 -9.997 1.00 0.00 H new ATOM 1460 N ASN A 90 -1.747 11.393 -10.760 1.00 0.00 N ATOM 1461 CA ASN A 90 -2.558 10.566 -9.882 1.00 0.00 C ATOM 1462 C ASN A 90 -2.162 10.832 -8.428 1.00 0.00 C ATOM 1463 O ASN A 90 -1.048 11.276 -8.156 1.00 0.00 O ATOM 1464 CB ASN A 90 -2.338 9.079 -10.167 1.00 0.00 C ATOM 1465 CG ASN A 90 -3.367 8.221 -9.429 1.00 0.00 C ATOM 1466 OD1 ASN A 90 -4.560 8.290 -9.673 1.00 0.00 O ATOM 1467 ND2 ASN A 90 -2.840 7.410 -8.516 1.00 0.00 N ATOM 0 H ASN A 90 -1.007 10.894 -11.253 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.605 10.816 -10.056 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -2.409 8.896 -11.239 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -1.332 8.791 -9.860 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -3.444 6.796 -7.970 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -1.832 7.402 -8.362 1.00 0.00 H new ATOM 1474 N THR A 91 -3.097 10.551 -7.533 1.00 0.00 N ATOM 1475 CA THR A 91 -2.860 10.755 -6.114 1.00 0.00 C ATOM 1476 C THR A 91 -1.829 9.749 -5.596 1.00 0.00 C ATOM 1477 O THR A 91 -2.172 8.612 -5.277 1.00 0.00 O ATOM 1478 CB THR A 91 -4.206 10.670 -5.393 1.00 0.00 C ATOM 1479 OG1 THR A 91 -3.875 10.190 -4.093 1.00 0.00 O ATOM 1480 CG2 THR A 91 -5.114 9.583 -5.971 1.00 0.00 C ATOM 0 H THR A 91 -4.020 10.184 -7.763 1.00 0.00 H new ATOM 0 HA THR A 91 -2.433 11.739 -5.922 1.00 0.00 H new ATOM 0 HB THR A 91 -4.710 11.634 -5.454 1.00 0.00 H new ATOM 0 HG1 THR A 91 -4.331 10.734 -3.417 1.00 0.00 H new ATOM 0 HG21 THR A 91 -6.056 9.566 -5.423 1.00 0.00 H new ATOM 0 HG22 THR A 91 -5.310 9.794 -7.022 1.00 0.00 H new ATOM 0 HG23 THR A 91 -4.624 8.614 -5.881 1.00 0.00 H new ATOM 1488 N PHE A 92 -0.587 10.206 -5.528 1.00 0.00 N ATOM 1489 CA PHE A 92 0.496 9.361 -5.055 1.00 0.00 C ATOM 1490 C PHE A 92 0.166 8.763 -3.685 1.00 0.00 C ATOM 1491 O PHE A 92 0.511 7.616 -3.405 1.00 0.00 O ATOM 1492 CB PHE A 92 1.734 10.250 -4.925 1.00 0.00 C ATOM 1493 CG PHE A 92 2.898 9.592 -4.182 1.00 0.00 C ATOM 1494 CD1 PHE A 92 3.215 8.293 -4.429 1.00 0.00 C ATOM 1495 CD2 PHE A 92 3.615 10.307 -3.274 1.00 0.00 C ATOM 1496 CE1 PHE A 92 4.296 7.683 -3.739 1.00 0.00 C ATOM 1497 CE2 PHE A 92 4.696 9.696 -2.584 1.00 0.00 C ATOM 1498 CZ PHE A 92 5.013 8.397 -2.831 1.00 0.00 C ATOM 0 H PHE A 92 -0.307 11.150 -5.793 1.00 0.00 H new ATOM 0 HA PHE A 92 0.658 8.539 -5.752 1.00 0.00 H new ATOM 0 HB2 PHE A 92 2.069 10.537 -5.922 1.00 0.00 H new ATOM 0 HB3 PHE A 92 1.457 11.167 -4.405 1.00 0.00 H new ATOM 0 HD1 PHE A 92 2.645 7.725 -5.150 1.00 0.00 H new ATOM 0 HD2 PHE A 92 3.363 11.339 -3.078 1.00 0.00 H new ATOM 0 HE1 PHE A 92 4.549 6.652 -3.936 1.00 0.00 H new ATOM 0 HE2 PHE A 92 5.266 10.263 -1.863 1.00 0.00 H new ATOM 0 HZ PHE A 92 5.834 7.932 -2.306 1.00 0.00 H new ATOM 1508 N GLU A 93 -0.498 9.568 -2.868 1.00 0.00 N ATOM 1509 CA GLU A 93 -0.878 9.134 -1.535 1.00 0.00 C ATOM 1510 C GLU A 93 -1.887 7.987 -1.618 1.00 0.00 C ATOM 1511 O GLU A 93 -1.811 7.031 -0.848 1.00 0.00 O ATOM 1512 CB GLU A 93 -1.438 10.299 -0.717 1.00 0.00 C ATOM 1513 CG GLU A 93 -2.539 11.031 -1.488 1.00 0.00 C ATOM 1514 CD GLU A 93 -2.299 12.542 -1.484 1.00 0.00 C ATOM 1515 OE1 GLU A 93 -1.590 13.055 -0.606 1.00 0.00 O ATOM 1516 OE2 GLU A 93 -2.878 13.188 -2.439 1.00 0.00 O ATOM 0 H GLU A 93 -0.782 10.519 -3.104 1.00 0.00 H new ATOM 0 HA GLU A 93 0.014 8.771 -1.024 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -1.836 9.927 0.227 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -0.636 10.995 -0.473 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -2.572 10.667 -2.515 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.509 10.812 -1.041 1.00 0.00 H new ATOM 1524 N LYS A 94 -2.810 8.121 -2.559 1.00 0.00 N ATOM 1525 CA LYS A 94 -3.834 7.108 -2.753 1.00 0.00 C ATOM 1526 C LYS A 94 -3.200 5.860 -3.370 1.00 0.00 C ATOM 1527 O LYS A 94 -3.605 4.738 -3.067 1.00 0.00 O ATOM 1528 CB LYS A 94 -4.999 7.672 -3.568 1.00 0.00 C ATOM 1529 CG LYS A 94 -6.258 6.821 -3.387 1.00 0.00 C ATOM 1530 CD LYS A 94 -6.284 5.662 -4.386 1.00 0.00 C ATOM 1531 CE LYS A 94 -6.570 6.165 -5.802 1.00 0.00 C ATOM 1532 NZ LYS A 94 -5.525 5.696 -6.740 1.00 0.00 N ATOM 0 H LYS A 94 -2.870 8.916 -3.196 1.00 0.00 H new ATOM 0 HA LYS A 94 -4.260 6.810 -1.795 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -5.201 8.697 -3.258 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -4.727 7.705 -4.623 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -6.294 6.430 -2.370 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -7.144 7.442 -3.522 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -5.327 5.140 -4.368 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -7.046 4.941 -4.092 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -7.547 5.810 -6.130 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.609 7.254 -5.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.735 6.046 -7.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.598 6.055 -6.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.507 4.656 -6.748 1.00 0.00 H new ATOM 1545 N GLU A 95 -2.215 6.096 -4.225 1.00 0.00 N ATOM 1546 CA GLU A 95 -1.521 5.005 -4.888 1.00 0.00 C ATOM 1547 C GLU A 95 -0.821 4.117 -3.857 1.00 0.00 C ATOM 1548 O GLU A 95 -0.929 2.893 -3.910 1.00 0.00 O ATOM 1549 CB GLU A 95 -0.526 5.535 -5.921 1.00 0.00 C ATOM 1550 CG GLU A 95 -0.704 4.829 -7.267 1.00 0.00 C ATOM 1551 CD GLU A 95 -0.015 5.608 -8.390 1.00 0.00 C ATOM 1552 OE1 GLU A 95 0.148 5.080 -9.500 1.00 0.00 O ATOM 1553 OE2 GLU A 95 0.357 6.803 -8.076 1.00 0.00 O ATOM 0 H GLU A 95 -1.881 7.027 -4.474 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.257 4.401 -5.419 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -0.666 6.609 -6.048 1.00 0.00 H new ATOM 0 HB3 GLU A 95 0.492 5.387 -5.560 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.290 3.822 -7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.766 4.725 -7.490 1.00 0.00 H new ATOM 1561 N LEU A 96 -0.118 4.769 -2.942 1.00 0.00 N ATOM 1562 CA LEU A 96 0.600 4.055 -1.900 1.00 0.00 C ATOM 1563 C LEU A 96 -0.401 3.501 -0.885 1.00 0.00 C ATOM 1564 O LEU A 96 -0.162 2.459 -0.277 1.00 0.00 O ATOM 1565 CB LEU A 96 1.674 4.950 -1.279 1.00 0.00 C ATOM 1566 CG LEU A 96 2.834 4.228 -0.590 1.00 0.00 C ATOM 1567 CD1 LEU A 96 3.929 5.215 -0.181 1.00 0.00 C ATOM 1568 CD2 LEU A 96 2.336 3.399 0.596 1.00 0.00 C ATOM 0 H LEU A 96 -0.031 5.784 -2.901 1.00 0.00 H new ATOM 0 HA LEU A 96 1.133 3.202 -2.321 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.083 5.589 -2.062 1.00 0.00 H new ATOM 0 HB3 LEU A 96 1.196 5.605 -0.551 1.00 0.00 H new ATOM 0 HG LEU A 96 3.278 3.534 -1.304 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.741 4.676 0.306 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.311 5.723 -1.067 1.00 0.00 H new ATOM 0 HD13 LEU A 96 3.516 5.951 0.509 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.180 2.896 1.068 1.00 0.00 H new ATOM 0 HD22 LEU A 96 1.852 4.054 1.320 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.620 2.655 0.245 1.00 0.00 H new ATOM 1580 N LEU A 97 -1.502 4.222 -0.733 1.00 0.00 N ATOM 1581 CA LEU A 97 -2.541 3.816 0.198 1.00 0.00 C ATOM 1582 C LEU A 97 -3.078 2.443 -0.212 1.00 0.00 C ATOM 1583 O LEU A 97 -3.555 1.683 0.629 1.00 0.00 O ATOM 1584 CB LEU A 97 -3.621 4.894 0.300 1.00 0.00 C ATOM 1585 CG LEU A 97 -3.649 5.693 1.605 1.00 0.00 C ATOM 1586 CD1 LEU A 97 -3.109 7.109 1.392 1.00 0.00 C ATOM 1587 CD2 LEU A 97 -5.054 5.701 2.212 1.00 0.00 C ATOM 0 H LEU A 97 -1.697 5.086 -1.239 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.133 3.712 1.203 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -3.490 5.591 -0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -4.593 4.420 0.166 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.991 5.201 2.321 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -3.140 7.656 2.334 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -2.080 7.056 1.036 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.722 7.625 0.653 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.047 6.275 3.138 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.752 6.156 1.509 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -5.366 4.678 2.422 1.00 0.00 H new ATOM 1599 N GLU A 98 -2.984 2.168 -1.504 1.00 0.00 N ATOM 1600 CA GLU A 98 -3.455 0.901 -2.036 1.00 0.00 C ATOM 1601 C GLU A 98 -2.539 -0.238 -1.584 1.00 0.00 C ATOM 1602 O GLU A 98 -2.992 -1.189 -0.948 1.00 0.00 O ATOM 1603 CB GLU A 98 -3.556 0.950 -3.562 1.00 0.00 C ATOM 1604 CG GLU A 98 -4.872 1.593 -4.004 1.00 0.00 C ATOM 1605 CD GLU A 98 -5.073 1.450 -5.514 1.00 0.00 C ATOM 1606 OE1 GLU A 98 -6.219 1.422 -5.987 1.00 0.00 O ATOM 1607 OE2 GLU A 98 -3.986 1.367 -6.203 1.00 0.00 O ATOM 0 H GLU A 98 -2.588 2.801 -2.199 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.455 0.715 -1.644 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.717 1.515 -3.968 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.486 -0.059 -3.967 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.704 1.126 -3.477 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.875 2.648 -3.732 1.00 0.00 H new ATOM 1615 N VAL A 99 -1.267 -0.105 -1.930 1.00 0.00 N ATOM 1616 CA VAL A 99 -0.284 -1.111 -1.567 1.00 0.00 C ATOM 1617 C VAL A 99 -0.293 -1.303 -0.049 1.00 0.00 C ATOM 1618 O VAL A 99 0.117 -2.350 0.450 1.00 0.00 O ATOM 1619 CB VAL A 99 1.091 -0.719 -2.112 1.00 0.00 C ATOM 1620 CG1 VAL A 99 1.108 -0.764 -3.641 1.00 0.00 C ATOM 1621 CG2 VAL A 99 1.511 0.660 -1.600 1.00 0.00 C ATOM 0 H VAL A 99 -0.895 0.684 -2.458 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.536 -2.071 -2.017 1.00 0.00 H new ATOM 0 HB VAL A 99 1.816 -1.447 -1.747 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.097 -0.481 -4.002 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.874 -1.774 -3.978 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.366 -0.069 -4.034 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.492 0.914 -2.002 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.783 1.405 -1.921 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.558 0.645 -0.511 1.00 0.00 H new ATOM 1631 N VAL A 100 -0.764 -0.276 0.642 1.00 0.00 N ATOM 1632 CA VAL A 100 -0.832 -0.319 2.093 1.00 0.00 C ATOM 1633 C VAL A 100 -1.974 -1.243 2.519 1.00 0.00 C ATOM 1634 O VAL A 100 -1.754 -2.219 3.234 1.00 0.00 O ATOM 1635 CB VAL A 100 -0.970 1.099 2.652 1.00 0.00 C ATOM 1636 CG1 VAL A 100 -1.195 1.072 4.166 1.00 0.00 C ATOM 1637 CG2 VAL A 100 0.250 1.950 2.295 1.00 0.00 C ATOM 0 H VAL A 100 -1.102 0.591 0.224 1.00 0.00 H new ATOM 0 HA VAL A 100 0.089 -0.729 2.507 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.845 1.557 2.191 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -1.290 2.092 4.538 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.107 0.518 4.388 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -0.348 0.586 4.651 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.126 2.953 2.704 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.147 1.495 2.715 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.347 2.010 1.211 1.00 0.00 H new ATOM 1647 N ILE A 101 -3.171 -0.902 2.062 1.00 0.00 N ATOM 1648 CA ILE A 101 -4.348 -1.689 2.387 1.00 0.00 C ATOM 1649 C ILE A 101 -4.305 -3.007 1.611 1.00 0.00 C ATOM 1650 O ILE A 101 -5.028 -3.947 1.936 1.00 0.00 O ATOM 1651 CB ILE A 101 -5.620 -0.875 2.146 1.00 0.00 C ATOM 1652 CG1 ILE A 101 -5.791 -0.552 0.660 1.00 0.00 C ATOM 1653 CG2 ILE A 101 -5.636 0.386 3.012 1.00 0.00 C ATOM 1654 CD1 ILE A 101 -7.079 0.238 0.416 1.00 0.00 C ATOM 0 H ILE A 101 -3.350 -0.091 1.469 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.356 -1.943 3.447 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.475 -1.481 2.444 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -4.935 0.024 0.308 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -5.812 -1.477 0.083 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -6.551 0.947 2.821 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -5.595 0.105 4.064 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -4.773 1.006 2.768 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -7.177 0.455 -0.648 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -7.935 -0.350 0.747 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -7.044 1.173 0.975 1.00 0.00 H new ATOM 1666 N HIS A 102 -3.451 -3.033 0.598 1.00 0.00 N ATOM 1667 CA HIS A 102 -3.304 -4.220 -0.227 1.00 0.00 C ATOM 1668 C HIS A 102 -3.086 -5.443 0.666 1.00 0.00 C ATOM 1669 O HIS A 102 -3.480 -6.553 0.313 1.00 0.00 O ATOM 1670 CB HIS A 102 -2.189 -4.032 -1.257 1.00 0.00 C ATOM 1671 CG HIS A 102 -2.072 -5.163 -2.250 1.00 0.00 C ATOM 1672 ND1 HIS A 102 -0.857 -5.599 -2.749 1.00 0.00 N ATOM 1673 CD2 HIS A 102 -3.029 -5.944 -2.829 1.00 0.00 C ATOM 1674 CE1 HIS A 102 -1.085 -6.597 -3.591 1.00 0.00 C ATOM 1675 NE2 HIS A 102 -2.431 -6.809 -3.639 1.00 0.00 N ATOM 0 H HIS A 102 -2.854 -2.251 0.330 1.00 0.00 H new ATOM 0 HA HIS A 102 -4.219 -4.387 -0.795 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -2.363 -3.103 -1.799 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -1.239 -3.923 -0.733 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -4.093 -5.871 -2.657 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -0.336 -7.146 -4.142 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -2.901 -7.516 -4.204 1.00 0.00 H new ATOM 1683 N GLY A 103 -2.458 -5.197 1.807 1.00 0.00 N ATOM 1684 CA GLY A 103 -2.182 -6.265 2.754 1.00 0.00 C ATOM 1685 C GLY A 103 -3.417 -6.579 3.601 1.00 0.00 C ATOM 1686 O GLY A 103 -3.815 -7.737 3.719 1.00 0.00 O ATOM 0 H GLY A 103 -2.133 -4.275 2.097 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -1.868 -7.160 2.217 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -1.355 -5.976 3.403 1.00 0.00 H new ATOM 1690 N ILE A 104 -3.990 -5.527 4.168 1.00 0.00 N ATOM 1691 CA ILE A 104 -5.172 -5.676 5.000 1.00 0.00 C ATOM 1692 C ILE A 104 -6.343 -6.146 4.135 1.00 0.00 C ATOM 1693 O ILE A 104 -6.976 -7.157 4.437 1.00 0.00 O ATOM 1694 CB ILE A 104 -5.453 -4.383 5.767 1.00 0.00 C ATOM 1695 CG1 ILE A 104 -4.301 -4.045 6.715 1.00 0.00 C ATOM 1696 CG2 ILE A 104 -6.794 -4.461 6.500 1.00 0.00 C ATOM 1697 CD1 ILE A 104 -4.381 -2.590 7.180 1.00 0.00 C ATOM 0 H ILE A 104 -3.657 -4.568 4.067 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.010 -6.441 5.760 1.00 0.00 H new ATOM 0 HB ILE A 104 -5.526 -3.568 5.047 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -4.330 -4.709 7.579 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -3.349 -4.218 6.212 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.970 -3.529 7.037 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -7.595 -4.620 5.778 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -6.774 -5.290 7.208 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -3.550 -2.377 7.853 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -4.327 -1.928 6.316 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.323 -2.427 7.704 1.00 0.00 H new ATOM 1709 N LEU A 105 -6.597 -5.390 3.077 1.00 0.00 N ATOM 1710 CA LEU A 105 -7.681 -5.717 2.167 1.00 0.00 C ATOM 1711 C LEU A 105 -7.598 -7.198 1.792 1.00 0.00 C ATOM 1712 O LEU A 105 -8.601 -7.909 1.832 1.00 0.00 O ATOM 1713 CB LEU A 105 -7.669 -4.776 0.961 1.00 0.00 C ATOM 1714 CG LEU A 105 -6.939 -5.288 -0.283 1.00 0.00 C ATOM 1715 CD1 LEU A 105 -7.728 -6.411 -0.958 1.00 0.00 C ATOM 1716 CD2 LEU A 105 -6.632 -4.142 -1.249 1.00 0.00 C ATOM 0 H LEU A 105 -6.071 -4.552 2.830 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.645 -5.565 2.652 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -8.701 -4.555 0.687 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.211 -3.834 1.265 1.00 0.00 H new ATOM 0 HG LEU A 105 -5.984 -5.709 0.030 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -7.187 -6.757 -1.839 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.852 -7.239 -0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -8.708 -6.039 -1.257 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.113 -4.533 -2.124 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -7.563 -3.669 -1.560 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -6.000 -3.406 -0.751 1.00 0.00 H new ATOM 1728 N HIS A 106 -6.393 -7.619 1.437 1.00 0.00 N ATOM 1729 CA HIS A 106 -6.166 -9.002 1.055 1.00 0.00 C ATOM 1730 C HIS A 106 -6.698 -9.930 2.149 1.00 0.00 C ATOM 1731 O HIS A 106 -7.094 -11.061 1.871 1.00 0.00 O ATOM 1732 CB HIS A 106 -4.689 -9.244 0.739 1.00 0.00 C ATOM 1733 CG HIS A 106 -4.352 -9.153 -0.730 1.00 0.00 C ATOM 1734 ND1 HIS A 106 -3.426 -9.981 -1.340 1.00 0.00 N ATOM 1735 CD2 HIS A 106 -4.827 -8.324 -1.704 1.00 0.00 C ATOM 1736 CE1 HIS A 106 -3.355 -9.656 -2.622 1.00 0.00 C ATOM 1737 NE2 HIS A 106 -4.224 -8.628 -2.846 1.00 0.00 N ATOM 0 H HIS A 106 -5.563 -7.026 1.406 1.00 0.00 H new ATOM 0 HA HIS A 106 -6.714 -9.224 0.139 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.088 -8.517 1.285 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.407 -10.231 1.106 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -2.889 -10.717 -0.880 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -5.569 -7.551 -1.568 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -2.720 -10.123 -3.361 1.00 0.00 H new ATOM 1745 N LEU A 107 -6.689 -9.418 3.371 1.00 0.00 N ATOM 1746 CA LEU A 107 -7.165 -10.186 4.509 1.00 0.00 C ATOM 1747 C LEU A 107 -8.671 -9.970 4.670 1.00 0.00 C ATOM 1748 O LEU A 107 -9.376 -10.840 5.179 1.00 0.00 O ATOM 1749 CB LEU A 107 -6.357 -9.845 5.762 1.00 0.00 C ATOM 1750 CG LEU A 107 -7.169 -9.556 7.026 1.00 0.00 C ATOM 1751 CD1 LEU A 107 -7.666 -10.854 7.667 1.00 0.00 C ATOM 1752 CD2 LEU A 107 -6.368 -8.701 8.009 1.00 0.00 C ATOM 0 H LEU A 107 -6.359 -8.480 3.598 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.012 -11.252 4.340 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.680 -10.674 5.970 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.738 -8.975 5.545 1.00 0.00 H new ATOM 0 HG LEU A 107 -8.049 -8.979 6.742 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.240 -10.620 8.564 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -8.299 -11.390 6.960 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.813 -11.477 7.935 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -6.968 -8.510 8.899 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.457 -9.229 8.292 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.107 -7.753 7.538 1.00 0.00 H new ATOM 1764 N ALA A 108 -9.120 -8.805 4.227 1.00 0.00 N ATOM 1765 CA ALA A 108 -10.530 -8.463 4.316 1.00 0.00 C ATOM 1766 C ALA A 108 -11.353 -9.513 3.567 1.00 0.00 C ATOM 1767 O ALA A 108 -12.563 -9.613 3.762 1.00 0.00 O ATOM 1768 CB ALA A 108 -10.749 -7.052 3.768 1.00 0.00 C ATOM 0 H ALA A 108 -8.533 -8.086 3.805 1.00 0.00 H new ATOM 0 HA ALA A 108 -10.860 -8.464 5.355 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -11.806 -6.796 3.835 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -10.166 -6.340 4.352 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -10.431 -7.013 2.726 1.00 0.00 H new ATOM 1774 N GLY A 109 -10.663 -10.270 2.726 1.00 0.00 N ATOM 1775 CA GLY A 109 -11.316 -11.309 1.947 1.00 0.00 C ATOM 1776 C GLY A 109 -11.793 -10.765 0.599 1.00 0.00 C ATOM 1777 O GLY A 109 -12.457 -9.731 0.542 1.00 0.00 O ATOM 0 H GLY A 109 -9.659 -10.185 2.567 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -10.625 -12.136 1.785 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.165 -11.707 2.504 1.00 0.00 H new ATOM 1997 N PHE A 123 -10.565 -2.915 -7.124 1.00 0.00 N ATOM 1998 CA PHE A 123 -10.314 -1.521 -6.799 1.00 0.00 C ATOM 1999 C PHE A 123 -11.417 -0.960 -5.900 1.00 0.00 C ATOM 2000 O PHE A 123 -11.154 -0.127 -5.034 1.00 0.00 O ATOM 2001 CB PHE A 123 -10.307 -0.748 -8.120 1.00 0.00 C ATOM 2002 CG PHE A 123 -10.265 0.772 -7.951 1.00 0.00 C ATOM 2003 CD1 PHE A 123 -9.087 1.394 -7.682 1.00 0.00 C ATOM 2004 CD2 PHE A 123 -11.408 1.501 -8.069 1.00 0.00 C ATOM 2005 CE1 PHE A 123 -9.048 2.805 -7.526 1.00 0.00 C ATOM 2006 CE2 PHE A 123 -11.369 2.912 -7.913 1.00 0.00 C ATOM 2007 CZ PHE A 123 -10.190 3.534 -7.644 1.00 0.00 C ATOM 0 HA PHE A 123 -9.367 -1.428 -6.268 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -9.445 -1.062 -8.708 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -11.196 -1.015 -8.690 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -8.180 0.815 -7.587 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -12.344 1.007 -8.281 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -8.111 3.299 -7.314 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -12.276 3.491 -8.008 1.00 0.00 H new ATOM 0 HZ PHE A 123 -10.161 4.607 -7.524 1.00 0.00 H new ATOM 2017 N GLU A 124 -12.629 -1.440 -6.135 1.00 0.00 N ATOM 2018 CA GLU A 124 -13.774 -0.998 -5.357 1.00 0.00 C ATOM 2019 C GLU A 124 -13.551 -1.290 -3.872 1.00 0.00 C ATOM 2020 O GLU A 124 -13.501 -0.371 -3.055 1.00 0.00 O ATOM 2021 CB GLU A 124 -15.063 -1.652 -5.857 1.00 0.00 C ATOM 2022 CG GLU A 124 -15.396 -1.193 -7.277 1.00 0.00 C ATOM 2023 CD GLU A 124 -16.905 -1.003 -7.453 1.00 0.00 C ATOM 2024 OE1 GLU A 124 -17.697 -1.689 -6.790 1.00 0.00 O ATOM 2025 OE2 GLU A 124 -17.245 -0.105 -8.314 1.00 0.00 O ATOM 0 H GLU A 124 -12.843 -2.131 -6.854 1.00 0.00 H new ATOM 0 HA GLU A 124 -13.880 0.079 -5.484 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -14.956 -2.737 -5.837 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -15.886 -1.401 -5.188 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -14.881 -0.257 -7.490 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -15.032 -1.928 -7.995 1.00 0.00 H new ATOM 2033 N LYS A 125 -13.422 -2.573 -3.566 1.00 0.00 N ATOM 2034 CA LYS A 125 -13.205 -2.997 -2.194 1.00 0.00 C ATOM 2035 C LYS A 125 -11.921 -2.356 -1.663 1.00 0.00 C ATOM 2036 O LYS A 125 -11.825 -2.040 -0.478 1.00 0.00 O ATOM 2037 CB LYS A 125 -13.216 -4.524 -2.097 1.00 0.00 C ATOM 2038 CG LYS A 125 -14.644 -5.055 -1.961 1.00 0.00 C ATOM 2039 CD LYS A 125 -15.142 -4.926 -0.520 1.00 0.00 C ATOM 2040 CE LYS A 125 -16.343 -3.981 -0.438 1.00 0.00 C ATOM 2041 NZ LYS A 125 -17.362 -4.518 0.492 1.00 0.00 N ATOM 0 H LYS A 125 -13.464 -3.333 -4.245 1.00 0.00 H new ATOM 0 HA LYS A 125 -14.020 -2.654 -1.556 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -12.748 -4.952 -2.984 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -12.623 -4.842 -1.239 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -15.306 -4.504 -2.629 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -14.678 -6.100 -2.269 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -15.421 -5.908 -0.138 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -14.338 -4.554 0.115 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -16.017 -2.997 -0.101 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -16.779 -3.850 -1.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -18.170 -3.865 0.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -17.685 -5.447 0.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -16.947 -4.620 1.440 1.00 0.00 H new ATOM 2054 N GLN A 126 -10.967 -2.184 -2.565 1.00 0.00 N ATOM 2055 CA GLN A 126 -9.693 -1.586 -2.203 1.00 0.00 C ATOM 2056 C GLN A 126 -9.874 -0.100 -1.888 1.00 0.00 C ATOM 2057 O GLN A 126 -9.241 0.426 -0.974 1.00 0.00 O ATOM 2058 CB GLN A 126 -8.657 -1.790 -3.310 1.00 0.00 C ATOM 2059 CG GLN A 126 -7.493 -0.809 -3.158 1.00 0.00 C ATOM 2060 CD GLN A 126 -6.270 -1.283 -3.946 1.00 0.00 C ATOM 2061 OE1 GLN A 126 -5.204 -1.535 -3.191 1.00 0.00 O flip ATOM 2062 NE2 GLN A 126 -6.292 -1.411 -5.159 1.00 0.00 N flip ATOM 0 H GLN A 126 -11.050 -2.448 -3.547 1.00 0.00 H new ATOM 0 HA GLN A 126 -9.322 -2.084 -1.307 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -8.282 -2.813 -3.278 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -9.128 -1.653 -4.284 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -7.796 0.178 -3.509 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -7.234 -0.707 -2.104 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -7.144 -1.200 -5.679 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -5.458 -1.729 -5.653 1.00 0.00 H new ATOM 2071 N LYS A 127 -10.742 0.535 -2.663 1.00 0.00 N ATOM 2072 CA LYS A 127 -11.014 1.950 -2.478 1.00 0.00 C ATOM 2073 C LYS A 127 -11.826 2.145 -1.196 1.00 0.00 C ATOM 2074 O LYS A 127 -11.832 3.233 -0.621 1.00 0.00 O ATOM 2075 CB LYS A 127 -11.683 2.534 -3.724 1.00 0.00 C ATOM 2076 CG LYS A 127 -10.684 3.342 -4.554 1.00 0.00 C ATOM 2077 CD LYS A 127 -11.309 4.650 -5.044 1.00 0.00 C ATOM 2078 CE LYS A 127 -10.319 5.810 -4.923 1.00 0.00 C ATOM 2079 NZ LYS A 127 -10.811 6.991 -5.668 1.00 0.00 N ATOM 0 H LYS A 127 -11.266 0.095 -3.420 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.084 2.504 -2.354 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -12.097 1.728 -4.330 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -12.516 3.172 -3.429 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.800 3.559 -3.955 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.353 2.751 -5.408 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.622 4.541 -6.082 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -12.205 4.869 -4.463 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -10.178 6.068 -3.873 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -9.346 5.508 -5.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -10.127 7.769 -5.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -10.923 6.746 -6.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -11.729 7.289 -5.280 1.00 0.00 H new ATOM 2092 N LYS A 128 -12.491 1.076 -0.786 1.00 0.00 N ATOM 2093 CA LYS A 128 -13.305 1.116 0.417 1.00 0.00 C ATOM 2094 C LYS A 128 -12.430 1.521 1.606 1.00 0.00 C ATOM 2095 O LYS A 128 -12.712 2.511 2.279 1.00 0.00 O ATOM 2096 CB LYS A 128 -14.034 -0.214 0.616 1.00 0.00 C ATOM 2097 CG LYS A 128 -15.450 0.011 1.150 1.00 0.00 C ATOM 2098 CD LYS A 128 -15.541 -0.354 2.633 1.00 0.00 C ATOM 2099 CE LYS A 128 -16.583 -1.450 2.865 1.00 0.00 C ATOM 2100 NZ LYS A 128 -15.922 -2.736 3.179 1.00 0.00 N ATOM 0 H LYS A 128 -12.483 0.176 -1.266 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.086 1.870 0.323 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -14.080 -0.753 -0.330 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -13.474 -0.839 1.312 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -15.734 1.054 1.010 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -16.158 -0.591 0.580 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -14.567 -0.692 2.988 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -15.803 0.531 3.213 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -17.243 -1.164 3.684 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -17.206 -1.562 1.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -16.644 -3.469 3.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -15.310 -3.015 2.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -15.347 -2.630 4.039 1.00 0.00 H new ATOM 2113 N TYR A 129 -11.386 0.736 1.827 1.00 0.00 N ATOM 2114 CA TYR A 129 -10.469 1.001 2.922 1.00 0.00 C ATOM 2115 C TYR A 129 -9.588 2.214 2.618 1.00 0.00 C ATOM 2116 O TYR A 129 -9.280 3.002 3.511 1.00 0.00 O ATOM 2117 CB TYR A 129 -9.583 -0.241 3.039 1.00 0.00 C ATOM 2118 CG TYR A 129 -10.333 -1.561 2.852 1.00 0.00 C ATOM 2119 CD1 TYR A 129 -11.180 -2.019 3.840 1.00 0.00 C ATOM 2120 CD2 TYR A 129 -10.163 -2.293 1.694 1.00 0.00 C ATOM 2121 CE1 TYR A 129 -11.886 -3.262 3.664 1.00 0.00 C ATOM 2122 CE2 TYR A 129 -10.869 -3.536 1.518 1.00 0.00 C ATOM 2123 CZ TYR A 129 -11.696 -3.959 2.512 1.00 0.00 C ATOM 2124 OH TYR A 129 -12.363 -5.132 2.345 1.00 0.00 O ATOM 0 H TYR A 129 -11.155 -0.084 1.266 1.00 0.00 H new ATOM 0 HA TYR A 129 -11.018 1.212 3.840 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -8.788 -0.179 2.296 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -9.105 -0.242 4.018 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.314 -1.446 4.745 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -9.501 -1.934 0.920 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -12.551 -3.632 4.430 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.745 -4.119 0.617 1.00 0.00 H new ATOM 0 HH TYR A 129 -12.131 -5.519 1.475 1.00 0.00 H new ATOM 2134 N VAL A 130 -9.208 2.327 1.354 1.00 0.00 N ATOM 2135 CA VAL A 130 -8.368 3.432 0.921 1.00 0.00 C ATOM 2136 C VAL A 130 -9.047 4.755 1.282 1.00 0.00 C ATOM 2137 O VAL A 130 -8.387 5.694 1.724 1.00 0.00 O ATOM 2138 CB VAL A 130 -8.065 3.304 -0.574 1.00 0.00 C ATOM 2139 CG1 VAL A 130 -8.481 4.569 -1.327 1.00 0.00 C ATOM 2140 CG2 VAL A 130 -6.587 2.987 -0.808 1.00 0.00 C ATOM 0 H VAL A 130 -9.466 1.672 0.616 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.408 3.408 1.437 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.652 2.473 -0.966 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -8.255 4.452 -2.387 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.551 4.733 -1.200 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.934 5.425 -0.931 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.398 2.901 -1.878 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.973 3.787 -0.394 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.335 2.046 -0.319 1.00 0.00 H new ATOM 2150 N GLU A 131 -10.356 4.785 1.082 1.00 0.00 N ATOM 2151 CA GLU A 131 -11.131 5.977 1.381 1.00 0.00 C ATOM 2152 C GLU A 131 -11.024 6.320 2.869 1.00 0.00 C ATOM 2153 O GLU A 131 -10.700 7.451 3.227 1.00 0.00 O ATOM 2154 CB GLU A 131 -12.593 5.801 0.963 1.00 0.00 C ATOM 2155 CG GLU A 131 -12.787 6.154 -0.513 1.00 0.00 C ATOM 2156 CD GLU A 131 -13.663 7.398 -0.668 1.00 0.00 C ATOM 2157 OE1 GLU A 131 -13.297 8.479 -0.182 1.00 0.00 O ATOM 2158 OE2 GLU A 131 -14.760 7.215 -1.321 1.00 0.00 O ATOM 0 H GLU A 131 -10.900 4.003 0.717 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.721 6.807 0.806 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -12.904 4.771 1.138 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -13.230 6.435 1.579 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -11.817 6.327 -0.980 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -13.246 5.314 -1.034 1.00 0.00 H new ATOM 2166 N GLU A 132 -11.303 5.323 3.695 1.00 0.00 N ATOM 2167 CA GLU A 132 -11.242 5.505 5.135 1.00 0.00 C ATOM 2168 C GLU A 132 -9.846 5.972 5.552 1.00 0.00 C ATOM 2169 O GLU A 132 -9.705 6.987 6.232 1.00 0.00 O ATOM 2170 CB GLU A 132 -11.631 4.219 5.867 1.00 0.00 C ATOM 2171 CG GLU A 132 -12.977 4.378 6.578 1.00 0.00 C ATOM 2172 CD GLU A 132 -13.880 3.171 6.318 1.00 0.00 C ATOM 2173 OE1 GLU A 132 -13.702 2.117 6.946 1.00 0.00 O ATOM 2174 OE2 GLU A 132 -14.795 3.356 5.428 1.00 0.00 O ATOM 0 H GLU A 132 -11.572 4.386 3.395 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.961 6.275 5.415 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -11.686 3.394 5.156 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -10.860 3.962 6.594 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.815 4.491 7.650 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.470 5.287 6.232 1.00 0.00 H new ATOM 2182 N VAL A 133 -8.850 5.209 5.128 1.00 0.00 N ATOM 2183 CA VAL A 133 -7.470 5.532 5.449 1.00 0.00 C ATOM 2184 C VAL A 133 -7.108 6.881 4.823 1.00 0.00 C ATOM 2185 O VAL A 133 -6.472 7.716 5.465 1.00 0.00 O ATOM 2186 CB VAL A 133 -6.548 4.397 4.998 1.00 0.00 C ATOM 2187 CG1 VAL A 133 -5.079 4.768 5.209 1.00 0.00 C ATOM 2188 CG2 VAL A 133 -6.893 3.092 5.718 1.00 0.00 C ATOM 0 H VAL A 133 -8.971 4.367 4.565 1.00 0.00 H new ATOM 0 HA VAL A 133 -7.341 5.628 6.527 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.704 4.242 3.930 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.445 3.944 4.881 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.843 5.661 4.631 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.901 4.963 6.267 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -6.223 2.302 5.379 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -6.779 3.229 6.793 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -7.923 2.815 5.495 1.00 0.00 H new ATOM 2198 N TRP A 134 -7.529 7.052 3.579 1.00 0.00 N ATOM 2199 CA TRP A 134 -7.256 8.284 2.859 1.00 0.00 C ATOM 2200 C TRP A 134 -8.034 9.411 3.542 1.00 0.00 C ATOM 2201 O TRP A 134 -7.793 10.588 3.274 1.00 0.00 O ATOM 2202 CB TRP A 134 -7.595 8.139 1.374 1.00 0.00 C ATOM 2203 CG TRP A 134 -7.224 9.359 0.529 1.00 0.00 C ATOM 2204 CD1 TRP A 134 -6.515 10.435 0.899 1.00 0.00 C ATOM 2205 CD2 TRP A 134 -7.573 9.586 -0.852 1.00 0.00 C ATOM 2206 NE1 TRP A 134 -6.384 11.335 -0.138 1.00 0.00 N ATOM 2207 CE2 TRP A 134 -7.047 10.803 -1.237 1.00 0.00 C ATOM 2208 CE3 TRP A 134 -8.310 8.791 -1.747 1.00 0.00 C ATOM 2209 CZ2 TRP A 134 -7.201 11.332 -2.524 1.00 0.00 C ATOM 2210 CZ3 TRP A 134 -8.455 9.333 -3.030 1.00 0.00 C ATOM 2211 CH2 TRP A 134 -7.931 10.556 -3.433 1.00 0.00 C ATOM 0 H TRP A 134 -8.057 6.358 3.051 1.00 0.00 H new ATOM 0 HA TRP A 134 -6.193 8.523 2.892 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -7.079 7.265 0.978 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -8.664 7.951 1.273 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -6.099 10.579 1.885 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -5.891 12.227 -0.104 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -8.731 7.837 -1.467 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -6.780 12.287 -2.801 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -9.013 8.761 -3.757 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -8.086 10.906 -4.443 1.00 0.00 H new ATOM 2222 N GLY A 135 -8.952 9.013 4.411 1.00 0.00 N ATOM 2223 CA GLY A 135 -9.766 9.974 5.134 1.00 0.00 C ATOM 2224 C GLY A 135 -8.894 11.043 5.796 1.00 0.00 C ATOM 2225 O GLY A 135 -9.310 12.193 5.931 1.00 0.00 O ATOM 0 H GLY A 135 -9.150 8.037 4.630 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -10.471 10.447 4.450 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -10.355 9.459 5.893 1.00 0.00 H new ATOM 2229 N GLU A 136 -7.701 10.626 6.192 1.00 0.00 N ATOM 2230 CA GLU A 136 -6.767 11.533 6.837 1.00 0.00 C ATOM 2231 C GLU A 136 -5.922 12.258 5.788 1.00 0.00 C ATOM 2232 O GLU A 136 -5.939 13.486 5.713 1.00 0.00 O ATOM 2233 CB GLU A 136 -5.880 10.787 7.836 1.00 0.00 C ATOM 2234 CG GLU A 136 -5.812 11.531 9.171 1.00 0.00 C ATOM 2235 CD GLU A 136 -5.635 10.554 10.335 1.00 0.00 C ATOM 2236 OE1 GLU A 136 -4.977 9.515 10.178 1.00 0.00 O ATOM 2237 OE2 GLU A 136 -6.209 10.907 11.435 1.00 0.00 O ATOM 0 H GLU A 136 -7.359 9.672 6.079 1.00 0.00 H new ATOM 0 HA GLU A 136 -7.338 12.277 7.393 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -6.271 9.782 7.995 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -4.876 10.677 7.425 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -4.982 12.238 9.156 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -6.723 12.112 9.314 1.00 0.00 H new ATOM 2245 N TRP A 137 -5.202 11.468 5.005 1.00 0.00 N ATOM 2246 CA TRP A 137 -4.352 12.020 3.964 1.00 0.00 C ATOM 2247 C TRP A 137 -5.212 12.927 3.082 1.00 0.00 C ATOM 2248 O TRP A 137 -4.692 13.801 2.390 1.00 0.00 O ATOM 2249 CB TRP A 137 -3.655 10.908 3.178 1.00 0.00 C ATOM 2250 CG TRP A 137 -2.270 10.541 3.713 1.00 0.00 C ATOM 2251 CD1 TRP A 137 -1.964 9.946 4.874 1.00 0.00 C ATOM 2252 CD2 TRP A 137 -1.005 10.772 3.055 1.00 0.00 C ATOM 2253 NE1 TRP A 137 -0.602 9.777 5.012 1.00 0.00 N ATOM 2254 CE2 TRP A 137 0.000 10.295 3.871 1.00 0.00 C ATOM 2255 CE3 TRP A 137 -0.721 11.364 1.812 1.00 0.00 C ATOM 2256 CZ2 TRP A 137 1.357 10.361 3.534 1.00 0.00 C ATOM 2257 CZ3 TRP A 137 0.640 11.422 1.490 1.00 0.00 C ATOM 2258 CH2 TRP A 137 1.664 10.947 2.300 1.00 0.00 C ATOM 0 H TRP A 137 -5.190 10.450 5.071 1.00 0.00 H new ATOM 0 HA TRP A 137 -3.549 12.616 4.398 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -4.285 10.019 3.190 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -3.561 11.217 2.137 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -2.692 9.637 5.609 1.00 0.00 H new ATOM 0 HE1 TRP A 137 -0.124 9.350 5.806 1.00 0.00 H new ATOM 0 HE3 TRP A 137 -1.492 11.744 1.158 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 2.126 9.980 4.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 0.913 11.868 0.545 1.00 0.00 H new ATOM 0 HH2 TRP A 137 2.692 11.029 1.979 1.00 0.00 H new ATOM 2269 N ARG A 138 -6.514 12.688 3.135 1.00 0.00 N ATOM 2270 CA ARG A 138 -7.452 13.472 2.349 1.00 0.00 C ATOM 2271 C ARG A 138 -7.267 14.963 2.636 1.00 0.00 C ATOM 2272 O ARG A 138 -7.469 15.798 1.755 1.00 0.00 O ATOM 2273 CB ARG A 138 -8.897 13.075 2.659 1.00 0.00 C ATOM 2274 CG ARG A 138 -9.452 12.141 1.582 1.00 0.00 C ATOM 2275 CD ARG A 138 -9.907 12.930 0.353 1.00 0.00 C ATOM 2276 NE ARG A 138 -11.185 12.384 -0.155 1.00 0.00 N ATOM 2277 CZ ARG A 138 -11.778 12.783 -1.300 1.00 0.00 C ATOM 2278 NH1 ARG A 138 -11.211 13.738 -2.068 1.00 0.00 N ATOM 2279 NH2 ARG A 138 -12.920 12.227 -1.658 1.00 0.00 N ATOM 0 H ARG A 138 -6.942 11.962 3.710 1.00 0.00 H new ATOM 0 HA ARG A 138 -7.251 13.273 1.296 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.942 12.583 3.631 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.517 13.969 2.725 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.688 11.419 1.293 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -10.291 11.573 1.985 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -10.029 13.982 0.611 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -9.145 12.878 -0.425 1.00 0.00 H new ATOM 0 HE ARG A 138 -11.647 11.660 0.395 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -10.328 14.163 -1.784 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -11.665 14.034 -2.932 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -13.342 11.507 -1.072 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -13.381 12.518 -2.520 1.00 0.00 H new ATOM 2292 N SER A 139 -6.886 15.253 3.871 1.00 0.00 N ATOM 2293 CA SER A 139 -6.672 16.629 4.285 1.00 0.00 C ATOM 2294 C SER A 139 -5.407 17.183 3.626 1.00 0.00 C ATOM 2295 O SER A 139 -5.132 18.379 3.710 1.00 0.00 O ATOM 2296 CB SER A 139 -6.568 16.737 5.808 1.00 0.00 C ATOM 2297 OG SER A 139 -7.678 16.129 6.463 1.00 0.00 O ATOM 0 H SER A 139 -6.720 14.558 4.599 1.00 0.00 H new ATOM 0 HA SER A 139 -7.530 17.220 3.964 1.00 0.00 H new ATOM 0 HB2 SER A 139 -5.645 16.263 6.143 1.00 0.00 H new ATOM 0 HB3 SER A 139 -6.509 17.787 6.094 1.00 0.00 H new ATOM 0 HG SER A 139 -7.574 16.217 7.433 1.00 0.00 H new ATOM 2303 N ASN A 140 -4.671 16.287 2.986 1.00 0.00 N ATOM 2304 CA ASN A 140 -3.442 16.671 2.313 1.00 0.00 C ATOM 2305 C ASN A 140 -3.293 15.855 1.027 1.00 0.00 C ATOM 2306 O ASN A 140 -2.419 14.995 0.931 1.00 0.00 O ATOM 2307 CB ASN A 140 -2.222 16.394 3.193 1.00 0.00 C ATOM 2308 CG ASN A 140 -2.332 15.024 3.866 1.00 0.00 C ATOM 2309 OD1 ASN A 140 -1.781 14.034 3.411 1.00 0.00 O ATOM 2310 ND2 ASN A 140 -3.071 15.022 4.971 1.00 0.00 N ATOM 0 H ASN A 140 -4.902 15.296 2.919 1.00 0.00 H new ATOM 0 HA ASN A 140 -3.496 17.738 2.097 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -1.316 16.435 2.588 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -2.133 17.170 3.953 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -3.205 14.156 5.493 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -3.504 15.886 5.297 1.00 0.00 H new ATOM 2317 N PRO A 141 -4.183 16.162 0.045 1.00 0.00 N ATOM 2318 CA PRO A 141 -4.158 15.466 -1.230 1.00 0.00 C ATOM 2319 C PRO A 141 -2.989 15.944 -2.093 1.00 0.00 C ATOM 2320 O PRO A 141 -1.891 15.394 -2.018 1.00 0.00 O ATOM 2321 CB PRO A 141 -5.514 15.748 -1.858 1.00 0.00 C ATOM 2322 CG PRO A 141 -6.066 16.963 -1.130 1.00 0.00 C ATOM 2323 CD PRO A 141 -5.231 17.174 0.123 1.00 0.00 C ATOM 0 HA PRO A 141 -3.999 14.393 -1.121 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -5.417 15.943 -2.926 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -6.180 14.892 -1.750 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -6.023 17.844 -1.770 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -7.113 16.809 -0.870 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -4.810 18.179 0.153 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -5.832 17.053 1.024 1.00 0.00 H new ATOM 2331 N SER A 142 -3.264 16.964 -2.894 1.00 0.00 N ATOM 2332 CA SER A 142 -2.248 17.522 -3.770 1.00 0.00 C ATOM 2333 C SER A 142 -0.890 17.522 -3.064 1.00 0.00 C ATOM 2334 O SER A 142 -0.808 17.802 -1.870 1.00 0.00 O ATOM 2335 CB SER A 142 -2.618 18.941 -4.208 1.00 0.00 C ATOM 2336 OG SER A 142 -2.663 19.066 -5.627 1.00 0.00 O ATOM 0 H SER A 142 -4.175 17.418 -2.954 1.00 0.00 H new ATOM 0 HA SER A 142 -2.186 16.899 -4.662 1.00 0.00 H new ATOM 0 HB2 SER A 142 -3.588 19.208 -3.789 1.00 0.00 H new ATOM 0 HB3 SER A 142 -1.891 19.646 -3.805 1.00 0.00 H new ATOM 0 HG SER A 142 -2.904 19.985 -5.867 1.00 0.00 H new