USER MOD reduce.3.24.130724 H: found=0, std=0, add=874, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 869 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 85 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 107 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 54 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 63 HIS : no HD1:sc= -3.4 K(o=-3.4,f=-4.6!) USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0.0586 USER MOD Set 3.2: A 39 GLN : amide:sc= 0 X(o=0.059,f=-0.15) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 40:sc= 0.323 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -1.31 K(o=-1.3,f=-4.1!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 29:sc= 0.244 USER MOD Single : A 20 THR OG1 : rot 150:sc= -1.29 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= -0.459 USER MOD Single : A 37 SER OG : rot 180:sc= -1.09 USER MOD Single : A 43 CYS SG : rot -101:sc= -0.0473 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 TYR OH : rot 180:sc= -1.02 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -0.314 X(o=-0.31,f=0) USER MOD Single : A 58 ASN : amide:sc= -2.09 K(o=-2.1,f=-5.9!) USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 69 ASN : amide:sc= -1.34 K(o=-1.3,f=-2.8!) USER MOD Single : A 72 GLN : amide:sc= -4.31! K(o=-4.3!,f=-3.6) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 37:sc= 0.0904 USER MOD Single : A 83 ASN : amide:sc= -2.32! K(o=-2.3!,f=-0.19) USER MOD Single : A 84 HIS : no HE2:sc= 0.859 K(o=0.86,f=-7.7!) USER MOD Single : A 86 TYR OH : rot 30:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -11! C(o=-11!,f=-11!) USER MOD Single : A 94 SER OG : rot 149:sc= -0.217 USER MOD Single : A 95 GLN : amide:sc= -0.0856 X(o=-0.086,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN : amide:sc= -0.0138 K(o=-0.014,f=-1.3) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 31.513 -4.332 -7.917 1.00 0.00 N ATOM 2 CA GLY A 1 30.779 -5.375 -7.225 1.00 0.00 C ATOM 3 C GLY A 1 29.848 -4.823 -6.164 1.00 0.00 C ATOM 4 O GLY A 1 30.135 -4.911 -4.970 1.00 0.00 O ATOM 0 H1 GLY A 1 32.135 -4.761 -8.632 1.00 0.00 H new ATOM 0 H2 GLY A 1 30.843 -3.687 -8.383 1.00 0.00 H new ATOM 0 H3 GLY A 1 32.088 -3.799 -7.233 1.00 0.00 H new ATOM 0 HA2 GLY A 1 30.200 -5.949 -7.949 1.00 0.00 H new ATOM 0 HA3 GLY A 1 31.484 -6.065 -6.762 1.00 0.00 H new ATOM 8 N SER A 2 28.731 -4.250 -6.599 1.00 0.00 N ATOM 9 CA SER A 2 27.757 -3.677 -5.678 1.00 0.00 C ATOM 10 C SER A 2 27.035 -4.772 -4.899 1.00 0.00 C ATOM 11 O SER A 2 26.364 -5.624 -5.481 1.00 0.00 O ATOM 12 CB SER A 2 26.742 -2.824 -6.441 1.00 0.00 C ATOM 13 OG SER A 2 26.111 -3.576 -7.464 1.00 0.00 O ATOM 0 H SER A 2 28.478 -4.170 -7.584 1.00 0.00 H new ATOM 0 HA SER A 2 28.293 -3.045 -4.970 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.991 -2.442 -5.750 1.00 0.00 H new ATOM 0 HB3 SER A 2 27.243 -1.960 -6.877 1.00 0.00 H new ATOM 0 HG SER A 2 25.925 -4.481 -7.138 1.00 0.00 H new ATOM 19 N SER A 3 27.178 -4.742 -3.578 1.00 0.00 N ATOM 20 CA SER A 3 26.543 -5.734 -2.717 1.00 0.00 C ATOM 21 C SER A 3 26.411 -5.211 -1.291 1.00 0.00 C ATOM 22 O SER A 3 27.058 -4.235 -0.913 1.00 0.00 O ATOM 23 CB SER A 3 27.349 -7.035 -2.723 1.00 0.00 C ATOM 24 OG SER A 3 28.618 -6.852 -2.119 1.00 0.00 O ATOM 0 H SER A 3 27.728 -4.042 -3.080 1.00 0.00 H new ATOM 0 HA SER A 3 25.544 -5.931 -3.106 1.00 0.00 H new ATOM 0 HB2 SER A 3 26.798 -7.810 -2.191 1.00 0.00 H new ATOM 0 HB3 SER A 3 27.477 -7.382 -3.748 1.00 0.00 H new ATOM 0 HG SER A 3 29.112 -7.698 -2.134 1.00 0.00 H new ATOM 30 N GLY A 4 25.567 -5.868 -0.502 1.00 0.00 N ATOM 31 CA GLY A 4 25.363 -5.455 0.875 1.00 0.00 C ATOM 32 C GLY A 4 23.922 -5.085 1.162 1.00 0.00 C ATOM 33 O GLY A 4 23.027 -5.389 0.374 1.00 0.00 O ATOM 0 H GLY A 4 25.020 -6.679 -0.791 1.00 0.00 H new ATOM 0 HA2 GLY A 4 25.667 -6.262 1.542 1.00 0.00 H new ATOM 0 HA3 GLY A 4 26.005 -4.601 1.094 1.00 0.00 H new ATOM 37 N SER A 5 23.696 -4.427 2.295 1.00 0.00 N ATOM 38 CA SER A 5 22.352 -4.020 2.687 1.00 0.00 C ATOM 39 C SER A 5 22.249 -2.500 2.775 1.00 0.00 C ATOM 40 O SER A 5 23.236 -1.788 2.589 1.00 0.00 O ATOM 41 CB SER A 5 21.979 -4.646 4.033 1.00 0.00 C ATOM 42 OG SER A 5 22.686 -4.030 5.095 1.00 0.00 O ATOM 0 H SER A 5 24.426 -4.165 2.957 1.00 0.00 H new ATOM 0 HA SER A 5 21.656 -4.371 1.925 1.00 0.00 H new ATOM 0 HB2 SER A 5 20.906 -4.546 4.200 1.00 0.00 H new ATOM 0 HB3 SER A 5 22.200 -5.713 4.015 1.00 0.00 H new ATOM 0 HG SER A 5 22.429 -4.446 5.944 1.00 0.00 H new ATOM 48 N SER A 6 21.046 -2.010 3.058 1.00 0.00 N ATOM 49 CA SER A 6 20.811 -0.575 3.166 1.00 0.00 C ATOM 50 C SER A 6 21.751 0.053 4.191 1.00 0.00 C ATOM 51 O SER A 6 21.551 -0.081 5.398 1.00 0.00 O ATOM 52 CB SER A 6 19.357 -0.303 3.556 1.00 0.00 C ATOM 53 OG SER A 6 18.971 1.013 3.200 1.00 0.00 O ATOM 0 H SER A 6 20.219 -2.586 3.217 1.00 0.00 H new ATOM 0 HA SER A 6 21.009 -0.125 2.193 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.704 -1.023 3.062 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.233 -0.444 4.630 1.00 0.00 H new ATOM 0 HG SER A 6 18.037 1.161 3.458 1.00 0.00 H new ATOM 59 N GLY A 7 22.778 0.740 3.700 1.00 0.00 N ATOM 60 CA GLY A 7 23.734 1.379 4.585 1.00 0.00 C ATOM 61 C GLY A 7 23.086 2.403 5.496 1.00 0.00 C ATOM 62 O GLY A 7 22.065 2.996 5.148 1.00 0.00 O ATOM 0 H GLY A 7 22.965 0.865 2.705 1.00 0.00 H new ATOM 0 HA2 GLY A 7 24.228 0.619 5.191 1.00 0.00 H new ATOM 0 HA3 GLY A 7 24.507 1.865 3.990 1.00 0.00 H new ATOM 66 N SER A 8 23.680 2.610 6.667 1.00 0.00 N ATOM 67 CA SER A 8 23.151 3.566 7.634 1.00 0.00 C ATOM 68 C SER A 8 23.415 4.999 7.181 1.00 0.00 C ATOM 69 O SER A 8 24.366 5.639 7.630 1.00 0.00 O ATOM 70 CB SER A 8 23.776 3.331 9.010 1.00 0.00 C ATOM 71 OG SER A 8 23.661 1.972 9.396 1.00 0.00 O ATOM 0 H SER A 8 24.527 2.129 6.969 1.00 0.00 H new ATOM 0 HA SER A 8 22.073 3.417 7.702 1.00 0.00 H new ATOM 0 HB2 SER A 8 24.827 3.619 8.990 1.00 0.00 H new ATOM 0 HB3 SER A 8 23.286 3.965 9.749 1.00 0.00 H new ATOM 0 HG SER A 8 24.069 1.847 10.278 1.00 0.00 H new ATOM 77 N HIS A 9 22.565 5.497 6.288 1.00 0.00 N ATOM 78 CA HIS A 9 22.705 6.854 5.774 1.00 0.00 C ATOM 79 C HIS A 9 21.527 7.220 4.876 1.00 0.00 C ATOM 80 O HIS A 9 20.647 6.396 4.624 1.00 0.00 O ATOM 81 CB HIS A 9 24.015 6.996 4.998 1.00 0.00 C ATOM 82 CG HIS A 9 24.209 5.941 3.953 1.00 0.00 C ATOM 83 ND1 HIS A 9 23.257 4.989 3.658 1.00 0.00 N ATOM 84 CD2 HIS A 9 25.254 5.693 3.129 1.00 0.00 C ATOM 85 CE1 HIS A 9 23.708 4.199 2.700 1.00 0.00 C ATOM 86 NE2 HIS A 9 24.918 4.606 2.361 1.00 0.00 N ATOM 0 H HIS A 9 21.773 4.981 5.906 1.00 0.00 H new ATOM 0 HA HIS A 9 22.718 7.537 6.623 1.00 0.00 H new ATOM 0 HB2 HIS A 9 24.042 7.976 4.522 1.00 0.00 H new ATOM 0 HB3 HIS A 9 24.849 6.959 5.699 1.00 0.00 H new ATOM 0 HD2 HIS A 9 26.180 6.247 3.084 1.00 0.00 H new ATOM 0 HE1 HIS A 9 23.178 3.363 2.268 1.00 0.00 H new ATOM 0 HE2 HIS A 9 25.507 4.181 1.645 1.00 0.00 H new ATOM 94 N ASP A 10 21.515 8.459 4.398 1.00 0.00 N ATOM 95 CA ASP A 10 20.445 8.933 3.528 1.00 0.00 C ATOM 96 C ASP A 10 20.980 9.263 2.138 1.00 0.00 C ATOM 97 O ASP A 10 21.662 10.269 1.947 1.00 0.00 O ATOM 98 CB ASP A 10 19.774 10.166 4.135 1.00 0.00 C ATOM 99 CG ASP A 10 19.053 9.853 5.432 1.00 0.00 C ATOM 100 OD1 ASP A 10 18.044 9.119 5.387 1.00 0.00 O ATOM 101 OD2 ASP A 10 19.497 10.343 6.491 1.00 0.00 O ATOM 0 H ASP A 10 22.234 9.154 4.598 1.00 0.00 H new ATOM 0 HA ASP A 10 19.707 8.136 3.434 1.00 0.00 H new ATOM 0 HB2 ASP A 10 20.527 10.933 4.317 1.00 0.00 H new ATOM 0 HB3 ASP A 10 19.064 10.580 3.419 1.00 0.00 H new ATOM 106 N SER A 11 20.667 8.407 1.170 1.00 0.00 N ATOM 107 CA SER A 11 21.121 8.604 -0.201 1.00 0.00 C ATOM 108 C SER A 11 20.852 10.034 -0.662 1.00 0.00 C ATOM 109 O SER A 11 21.736 10.702 -1.197 1.00 0.00 O ATOM 110 CB SER A 11 20.425 7.615 -1.138 1.00 0.00 C ATOM 111 OG SER A 11 21.016 6.330 -1.053 1.00 0.00 O ATOM 0 H SER A 11 20.101 7.570 1.310 1.00 0.00 H new ATOM 0 HA SER A 11 22.196 8.427 -0.231 1.00 0.00 H new ATOM 0 HB2 SER A 11 19.367 7.550 -0.883 1.00 0.00 H new ATOM 0 HB3 SER A 11 20.483 7.978 -2.164 1.00 0.00 H new ATOM 0 HG SER A 11 20.552 5.716 -1.660 1.00 0.00 H new ATOM 117 N ARG A 12 19.624 10.496 -0.449 1.00 0.00 N ATOM 118 CA ARG A 12 19.237 11.845 -0.843 1.00 0.00 C ATOM 119 C ARG A 12 18.130 12.379 0.061 1.00 0.00 C ATOM 120 O ARG A 12 17.271 11.625 0.521 1.00 0.00 O ATOM 121 CB ARG A 12 18.770 11.860 -2.300 1.00 0.00 C ATOM 122 CG ARG A 12 17.272 11.666 -2.462 1.00 0.00 C ATOM 123 CD ARG A 12 16.854 10.243 -2.127 1.00 0.00 C ATOM 124 NE ARG A 12 15.414 10.047 -2.270 1.00 0.00 N ATOM 125 CZ ARG A 12 14.784 10.056 -3.439 1.00 0.00 C ATOM 126 NH1 ARG A 12 15.464 10.250 -4.561 1.00 0.00 N ATOM 127 NH2 ARG A 12 13.471 9.870 -3.488 1.00 0.00 N ATOM 0 H ARG A 12 18.881 9.956 -0.006 1.00 0.00 H new ATOM 0 HA ARG A 12 20.110 12.490 -0.741 1.00 0.00 H new ATOM 0 HB2 ARG A 12 19.056 12.809 -2.754 1.00 0.00 H new ATOM 0 HB3 ARG A 12 19.291 11.074 -2.848 1.00 0.00 H new ATOM 0 HG2 ARG A 12 16.742 12.364 -1.814 1.00 0.00 H new ATOM 0 HG3 ARG A 12 16.983 11.899 -3.487 1.00 0.00 H new ATOM 0 HD2 ARG A 12 17.381 9.547 -2.780 1.00 0.00 H new ATOM 0 HD3 ARG A 12 17.152 10.009 -1.105 1.00 0.00 H new ATOM 0 HE ARG A 12 14.862 9.895 -1.426 1.00 0.00 H new ATOM 0 HH11 ARG A 12 16.473 10.393 -4.527 1.00 0.00 H new ATOM 0 HH12 ARG A 12 14.978 10.256 -5.458 1.00 0.00 H new ATOM 0 HH21 ARG A 12 12.945 9.720 -2.627 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.988 9.877 -4.386 1.00 0.00 H new ATOM 141 N LEU A 13 18.156 13.683 0.313 1.00 0.00 N ATOM 142 CA LEU A 13 17.156 14.319 1.163 1.00 0.00 C ATOM 143 C LEU A 13 15.804 14.381 0.460 1.00 0.00 C ATOM 144 O LEU A 13 15.639 15.094 -0.531 1.00 0.00 O ATOM 145 CB LEU A 13 17.608 15.728 1.551 1.00 0.00 C ATOM 146 CG LEU A 13 18.745 15.812 2.570 1.00 0.00 C ATOM 147 CD1 LEU A 13 20.093 15.689 1.877 1.00 0.00 C ATOM 148 CD2 LEU A 13 18.662 17.113 3.355 1.00 0.00 C ATOM 0 H LEU A 13 18.859 14.321 -0.060 1.00 0.00 H new ATOM 0 HA LEU A 13 17.048 13.718 2.066 1.00 0.00 H new ATOM 0 HB2 LEU A 13 17.919 16.250 0.646 1.00 0.00 H new ATOM 0 HB3 LEU A 13 16.749 16.266 1.950 1.00 0.00 H new ATOM 0 HG LEU A 13 18.643 14.982 3.269 1.00 0.00 H new ATOM 0 HD11 LEU A 13 20.890 15.751 2.618 1.00 0.00 H new ATOM 0 HD12 LEU A 13 20.151 14.731 1.361 1.00 0.00 H new ATOM 0 HD13 LEU A 13 20.206 16.497 1.154 1.00 0.00 H new ATOM 0 HD21 LEU A 13 19.479 17.156 4.076 1.00 0.00 H new ATOM 0 HD22 LEU A 13 18.738 17.957 2.670 1.00 0.00 H new ATOM 0 HD23 LEU A 13 17.710 17.159 3.883 1.00 0.00 H new ATOM 160 N THR A 14 14.836 13.632 0.980 1.00 0.00 N ATOM 161 CA THR A 14 13.498 13.603 0.403 1.00 0.00 C ATOM 162 C THR A 14 12.632 14.723 0.967 1.00 0.00 C ATOM 163 O THR A 14 12.509 14.874 2.182 1.00 0.00 O ATOM 164 CB THR A 14 12.804 12.253 0.661 1.00 0.00 C ATOM 165 OG1 THR A 14 12.704 12.015 2.070 1.00 0.00 O ATOM 166 CG2 THR A 14 13.571 11.115 0.003 1.00 0.00 C ATOM 0 H THR A 14 14.954 13.037 1.800 1.00 0.00 H new ATOM 0 HA THR A 14 13.614 13.743 -0.672 1.00 0.00 H new ATOM 0 HB THR A 14 11.805 12.295 0.228 1.00 0.00 H new ATOM 0 HG1 THR A 14 12.660 12.872 2.544 1.00 0.00 H new ATOM 0 HG21 THR A 14 13.062 10.172 0.199 1.00 0.00 H new ATOM 0 HG22 THR A 14 13.621 11.284 -1.073 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.581 11.073 0.411 1.00 0.00 H new ATOM 174 N ALA A 15 12.032 15.507 0.077 1.00 0.00 N ATOM 175 CA ALA A 15 11.175 16.612 0.486 1.00 0.00 C ATOM 176 C ALA A 15 9.804 16.517 -0.175 1.00 0.00 C ATOM 177 O ALA A 15 8.779 16.466 0.503 1.00 0.00 O ATOM 178 CB ALA A 15 11.833 17.942 0.153 1.00 0.00 C ATOM 0 H ALA A 15 12.124 15.397 -0.933 1.00 0.00 H new ATOM 0 HA ALA A 15 11.034 16.550 1.565 1.00 0.00 H new ATOM 0 HB1 ALA A 15 11.181 18.758 0.464 1.00 0.00 H new ATOM 0 HB2 ALA A 15 12.786 18.018 0.677 1.00 0.00 H new ATOM 0 HB3 ALA A 15 12.004 18.004 -0.922 1.00 0.00 H new ATOM 184 N GLY A 16 9.793 16.495 -1.505 1.00 0.00 N ATOM 185 CA GLY A 16 8.543 16.408 -2.235 1.00 0.00 C ATOM 186 C GLY A 16 8.047 14.982 -2.368 1.00 0.00 C ATOM 187 O GLY A 16 7.592 14.572 -3.436 1.00 0.00 O ATOM 0 H GLY A 16 10.628 16.536 -2.089 1.00 0.00 H new ATOM 0 HA2 GLY A 16 7.787 17.006 -1.727 1.00 0.00 H new ATOM 0 HA3 GLY A 16 8.675 16.837 -3.228 1.00 0.00 H new ATOM 191 N VAL A 17 8.137 14.222 -1.281 1.00 0.00 N ATOM 192 CA VAL A 17 7.695 12.832 -1.281 1.00 0.00 C ATOM 193 C VAL A 17 6.390 12.671 -0.510 1.00 0.00 C ATOM 194 O VAL A 17 6.132 13.364 0.475 1.00 0.00 O ATOM 195 CB VAL A 17 8.760 11.904 -0.667 1.00 0.00 C ATOM 196 CG1 VAL A 17 9.928 11.724 -1.624 1.00 0.00 C ATOM 197 CG2 VAL A 17 9.235 12.452 0.670 1.00 0.00 C ATOM 0 H VAL A 17 8.512 14.545 -0.389 1.00 0.00 H new ATOM 0 HA VAL A 17 7.536 12.550 -2.322 1.00 0.00 H new ATOM 0 HB VAL A 17 8.310 10.926 -0.495 1.00 0.00 H new ATOM 0 HG11 VAL A 17 10.670 11.065 -1.173 1.00 0.00 H new ATOM 0 HG12 VAL A 17 9.571 11.284 -2.555 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.381 12.693 -1.831 1.00 0.00 H new ATOM 0 HG21 VAL A 17 9.987 11.784 1.090 1.00 0.00 H new ATOM 0 HG22 VAL A 17 9.669 13.441 0.524 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.390 12.523 1.355 1.00 0.00 H new ATOM 207 N PRO A 18 5.545 11.734 -0.966 1.00 0.00 N ATOM 208 CA PRO A 18 4.252 11.458 -0.333 1.00 0.00 C ATOM 209 C PRO A 18 4.405 10.796 1.032 1.00 0.00 C ATOM 210 O PRO A 18 4.997 9.723 1.150 1.00 0.00 O ATOM 211 CB PRO A 18 3.571 10.504 -1.317 1.00 0.00 C ATOM 212 CG PRO A 18 4.693 9.844 -2.042 1.00 0.00 C ATOM 213 CD PRO A 18 5.787 10.871 -2.134 1.00 0.00 C ATOM 0 HA PRO A 18 3.687 12.371 -0.144 1.00 0.00 H new ATOM 0 HB2 PRO A 18 2.952 9.773 -0.796 1.00 0.00 H new ATOM 0 HB3 PRO A 18 2.918 11.043 -2.004 1.00 0.00 H new ATOM 0 HG2 PRO A 18 5.034 8.957 -1.508 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.379 9.518 -3.034 1.00 0.00 H new ATOM 0 HD2 PRO A 18 6.774 10.411 -2.096 1.00 0.00 H new ATOM 0 HD3 PRO A 18 5.733 11.433 -3.067 1.00 0.00 H new ATOM 221 N ASP A 19 3.867 11.442 2.061 1.00 0.00 N ATOM 222 CA ASP A 19 3.942 10.915 3.419 1.00 0.00 C ATOM 223 C ASP A 19 3.272 9.547 3.508 1.00 0.00 C ATOM 224 O ASP A 19 2.403 9.215 2.701 1.00 0.00 O ATOM 225 CB ASP A 19 3.285 11.884 4.403 1.00 0.00 C ATOM 226 CG ASP A 19 3.904 11.815 5.784 1.00 0.00 C ATOM 227 OD1 ASP A 19 5.086 11.425 5.886 1.00 0.00 O ATOM 228 OD2 ASP A 19 3.208 12.153 6.764 1.00 0.00 O ATOM 0 H ASP A 19 3.374 12.331 1.981 1.00 0.00 H new ATOM 0 HA ASP A 19 4.994 10.803 3.681 1.00 0.00 H new ATOM 0 HB2 ASP A 19 3.372 12.901 4.020 1.00 0.00 H new ATOM 0 HB3 ASP A 19 2.221 11.660 4.474 1.00 0.00 H new ATOM 233 N THR A 20 3.682 8.756 4.495 1.00 0.00 N ATOM 234 CA THR A 20 3.123 7.424 4.689 1.00 0.00 C ATOM 235 C THR A 20 1.605 7.439 4.552 1.00 0.00 C ATOM 236 O THR A 20 0.912 8.270 5.141 1.00 0.00 O ATOM 237 CB THR A 20 3.497 6.854 6.071 1.00 0.00 C ATOM 238 OG1 THR A 20 4.885 7.082 6.335 1.00 0.00 O ATOM 239 CG2 THR A 20 3.201 5.363 6.139 1.00 0.00 C ATOM 0 H THR A 20 4.399 9.015 5.172 1.00 0.00 H new ATOM 0 HA THR A 20 3.548 6.787 3.914 1.00 0.00 H new ATOM 0 HB THR A 20 2.896 7.363 6.825 1.00 0.00 H new ATOM 0 HG1 THR A 20 5.023 7.180 7.300 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.473 4.983 7.124 1.00 0.00 H new ATOM 0 HG22 THR A 20 2.138 5.195 5.966 1.00 0.00 H new ATOM 0 HG23 THR A 20 3.780 4.842 5.376 1.00 0.00 H new ATOM 247 N PRO A 21 1.072 6.499 3.758 1.00 0.00 N ATOM 248 CA PRO A 21 -0.371 6.383 3.526 1.00 0.00 C ATOM 249 C PRO A 21 -1.119 5.900 4.764 1.00 0.00 C ATOM 250 O PRO A 21 -0.706 4.944 5.420 1.00 0.00 O ATOM 251 CB PRO A 21 -0.468 5.346 2.405 1.00 0.00 C ATOM 252 CG PRO A 21 0.775 4.534 2.531 1.00 0.00 C ATOM 253 CD PRO A 21 1.837 5.477 3.025 1.00 0.00 C ATOM 0 HA PRO A 21 -0.822 7.343 3.277 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -1.358 4.727 2.515 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -0.531 5.824 1.428 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.632 3.708 3.227 1.00 0.00 H new ATOM 0 HG3 PRO A 21 1.055 4.098 1.572 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.554 4.971 3.672 1.00 0.00 H new ATOM 0 HD3 PRO A 21 2.402 5.912 2.201 1.00 0.00 H new ATOM 261 N THR A 22 -2.225 6.568 5.079 1.00 0.00 N ATOM 262 CA THR A 22 -3.031 6.208 6.239 1.00 0.00 C ATOM 263 C THR A 22 -3.366 4.721 6.235 1.00 0.00 C ATOM 264 O THR A 22 -3.102 4.018 5.259 1.00 0.00 O ATOM 265 CB THR A 22 -4.341 7.017 6.285 1.00 0.00 C ATOM 266 OG1 THR A 22 -4.141 8.308 5.699 1.00 0.00 O ATOM 267 CG2 THR A 22 -4.828 7.176 7.718 1.00 0.00 C ATOM 0 H THR A 22 -2.583 7.361 4.547 1.00 0.00 H new ATOM 0 HA THR A 22 -2.437 6.442 7.122 1.00 0.00 H new ATOM 0 HB THR A 22 -5.097 6.474 5.718 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.979 8.815 5.731 1.00 0.00 H new ATOM 0 HG21 THR A 22 -5.754 7.751 7.726 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.007 6.193 8.153 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.072 7.699 8.303 1.00 0.00 H new ATOM 275 N ARG A 23 -3.948 4.247 7.332 1.00 0.00 N ATOM 276 CA ARG A 23 -4.318 2.842 7.455 1.00 0.00 C ATOM 277 C ARG A 23 -4.990 2.344 6.179 1.00 0.00 C ATOM 278 O ARG A 23 -5.583 3.123 5.431 1.00 0.00 O ATOM 279 CB ARG A 23 -5.254 2.642 8.648 1.00 0.00 C ATOM 280 CG ARG A 23 -6.607 3.314 8.481 1.00 0.00 C ATOM 281 CD ARG A 23 -7.698 2.562 9.227 1.00 0.00 C ATOM 282 NE ARG A 23 -8.890 3.382 9.427 1.00 0.00 N ATOM 283 CZ ARG A 23 -8.988 4.320 10.362 1.00 0.00 C ATOM 284 NH1 ARG A 23 -7.970 4.556 11.179 1.00 0.00 N ATOM 285 NH2 ARG A 23 -10.105 5.026 10.481 1.00 0.00 N ATOM 0 H ARG A 23 -4.173 4.815 8.148 1.00 0.00 H new ATOM 0 HA ARG A 23 -3.407 2.265 7.615 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -5.405 1.574 8.805 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -4.773 3.031 9.545 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -6.553 4.339 8.848 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -6.860 3.368 7.422 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -7.965 1.664 8.670 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -7.316 2.235 10.194 1.00 0.00 H new ATOM 0 HE ARG A 23 -9.691 3.226 8.815 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -7.109 4.016 11.090 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -8.048 5.277 11.896 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -10.890 4.849 9.854 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -10.179 5.746 11.200 1.00 0.00 H new ATOM 299 N LEU A 24 -4.892 1.041 5.936 1.00 0.00 N ATOM 300 CA LEU A 24 -5.490 0.438 4.750 1.00 0.00 C ATOM 301 C LEU A 24 -6.854 -0.163 5.073 1.00 0.00 C ATOM 302 O LEU A 24 -7.280 -0.178 6.228 1.00 0.00 O ATOM 303 CB LEU A 24 -4.566 -0.642 4.182 1.00 0.00 C ATOM 304 CG LEU A 24 -3.069 -0.430 4.408 1.00 0.00 C ATOM 305 CD1 LEU A 24 -2.277 -1.617 3.880 1.00 0.00 C ATOM 306 CD2 LEU A 24 -2.606 0.859 3.745 1.00 0.00 C ATOM 0 H LEU A 24 -4.405 0.383 6.544 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.626 1.221 4.004 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.847 -1.600 4.620 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.744 -0.717 3.109 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.891 -0.347 5.480 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.213 -1.449 4.049 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -2.589 -2.523 4.400 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -2.461 -1.731 2.812 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.538 0.993 3.917 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.798 0.806 2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.150 1.702 4.170 1.00 0.00 H new ATOM 318 N VAL A 25 -7.535 -0.659 4.045 1.00 0.00 N ATOM 319 CA VAL A 25 -8.850 -1.264 4.220 1.00 0.00 C ATOM 320 C VAL A 25 -9.005 -2.503 3.345 1.00 0.00 C ATOM 321 O VAL A 25 -8.996 -2.414 2.117 1.00 0.00 O ATOM 322 CB VAL A 25 -9.975 -0.268 3.884 1.00 0.00 C ATOM 323 CG1 VAL A 25 -11.280 -1.004 3.622 1.00 0.00 C ATOM 324 CG2 VAL A 25 -10.142 0.745 5.007 1.00 0.00 C ATOM 0 H VAL A 25 -7.198 -0.654 3.082 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.930 -1.551 5.269 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.701 0.270 2.977 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.063 -0.283 3.386 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.150 -1.687 2.782 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -11.563 -1.570 4.509 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.941 1.441 4.753 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.394 0.225 5.931 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.211 1.295 5.142 1.00 0.00 H new ATOM 334 N PHE A 26 -9.149 -3.659 3.985 1.00 0.00 N ATOM 335 CA PHE A 26 -9.306 -4.917 3.265 1.00 0.00 C ATOM 336 C PHE A 26 -10.779 -5.302 3.157 1.00 0.00 C ATOM 337 O PHE A 26 -11.531 -5.199 4.127 1.00 0.00 O ATOM 338 CB PHE A 26 -8.527 -6.031 3.967 1.00 0.00 C ATOM 339 CG PHE A 26 -7.123 -5.642 4.334 1.00 0.00 C ATOM 340 CD1 PHE A 26 -6.852 -5.045 5.554 1.00 0.00 C ATOM 341 CD2 PHE A 26 -6.075 -5.873 3.458 1.00 0.00 C ATOM 342 CE1 PHE A 26 -5.562 -4.685 5.895 1.00 0.00 C ATOM 343 CE2 PHE A 26 -4.782 -5.517 3.793 1.00 0.00 C ATOM 344 CZ PHE A 26 -4.526 -4.921 5.012 1.00 0.00 C ATOM 0 H PHE A 26 -9.160 -3.750 5.001 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.909 -4.783 2.259 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.062 -6.324 4.870 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.495 -6.906 3.318 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.659 -4.858 6.247 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.270 -6.337 2.502 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.364 -4.220 6.850 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.973 -5.705 3.102 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.517 -4.640 5.275 1.00 0.00 H new ATOM 354 N SER A 27 -11.183 -5.743 1.971 1.00 0.00 N ATOM 355 CA SER A 27 -12.567 -6.139 1.734 1.00 0.00 C ATOM 356 C SER A 27 -12.730 -7.650 1.865 1.00 0.00 C ATOM 357 O SER A 27 -13.724 -8.134 2.406 1.00 0.00 O ATOM 358 CB SER A 27 -13.018 -5.685 0.344 1.00 0.00 C ATOM 359 OG SER A 27 -14.422 -5.811 0.198 1.00 0.00 O ATOM 0 H SER A 27 -10.573 -5.835 1.159 1.00 0.00 H new ATOM 0 HA SER A 27 -13.191 -5.657 2.487 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.724 -4.648 0.183 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.515 -6.281 -0.418 1.00 0.00 H new ATOM 0 HG SER A 27 -14.686 -5.513 -0.698 1.00 0.00 H new ATOM 365 N ALA A 28 -11.745 -8.391 1.366 1.00 0.00 N ATOM 366 CA ALA A 28 -11.777 -9.847 1.428 1.00 0.00 C ATOM 367 C ALA A 28 -12.964 -10.404 0.650 1.00 0.00 C ATOM 368 O ALA A 28 -13.760 -11.179 1.182 1.00 0.00 O ATOM 369 CB ALA A 28 -11.828 -10.312 2.876 1.00 0.00 C ATOM 0 H ALA A 28 -10.915 -8.006 0.914 1.00 0.00 H new ATOM 0 HA ALA A 28 -10.865 -10.226 0.967 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.852 -11.401 2.908 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -10.945 -9.953 3.405 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -12.724 -9.916 3.354 1.00 0.00 H new ATOM 375 N LEU A 29 -13.079 -10.004 -0.612 1.00 0.00 N ATOM 376 CA LEU A 29 -14.170 -10.463 -1.464 1.00 0.00 C ATOM 377 C LEU A 29 -14.375 -11.968 -1.323 1.00 0.00 C ATOM 378 O LEU A 29 -15.469 -12.480 -1.557 1.00 0.00 O ATOM 379 CB LEU A 29 -13.886 -10.110 -2.925 1.00 0.00 C ATOM 380 CG LEU A 29 -13.710 -8.622 -3.234 1.00 0.00 C ATOM 381 CD1 LEU A 29 -14.531 -7.777 -2.273 1.00 0.00 C ATOM 382 CD2 LEU A 29 -12.240 -8.234 -3.167 1.00 0.00 C ATOM 0 H LEU A 29 -12.430 -9.363 -1.068 1.00 0.00 H new ATOM 0 HA LEU A 29 -15.083 -9.959 -1.146 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -12.982 -10.634 -3.236 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -14.703 -10.493 -3.536 1.00 0.00 H new ATOM 0 HG LEU A 29 -14.068 -8.435 -4.246 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -14.393 -6.722 -2.508 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -15.585 -8.036 -2.370 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -14.204 -7.967 -1.251 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -12.133 -7.172 -3.389 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -11.856 -8.436 -2.167 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.677 -8.816 -3.896 1.00 0.00 H new ATOM 394 N GLY A 30 -13.314 -12.671 -0.938 1.00 0.00 N ATOM 395 CA GLY A 30 -13.399 -14.110 -0.770 1.00 0.00 C ATOM 396 C GLY A 30 -12.152 -14.694 -0.138 1.00 0.00 C ATOM 397 O GLY A 30 -11.296 -13.975 0.378 1.00 0.00 O ATOM 0 H GLY A 30 -12.397 -12.270 -0.740 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -14.263 -14.350 -0.150 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -13.563 -14.577 -1.741 1.00 0.00 H new ATOM 401 N PRO A 31 -12.037 -16.030 -0.172 1.00 0.00 N ATOM 402 CA PRO A 31 -10.889 -16.741 0.399 1.00 0.00 C ATOM 403 C PRO A 31 -9.610 -16.513 -0.400 1.00 0.00 C ATOM 404 O PRO A 31 -8.507 -16.567 0.144 1.00 0.00 O ATOM 405 CB PRO A 31 -11.309 -18.211 0.326 1.00 0.00 C ATOM 406 CG PRO A 31 -12.295 -18.268 -0.790 1.00 0.00 C ATOM 407 CD PRO A 31 -13.019 -16.950 -0.771 1.00 0.00 C ATOM 0 HA PRO A 31 -10.659 -16.399 1.408 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.454 -18.858 0.132 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -11.753 -18.543 1.264 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -11.794 -18.424 -1.745 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -12.990 -19.097 -0.655 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -13.305 -16.634 -1.774 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -13.933 -17.002 -0.180 1.00 0.00 H new ATOM 415 N THR A 32 -9.765 -16.256 -1.695 1.00 0.00 N ATOM 416 CA THR A 32 -8.623 -16.020 -2.570 1.00 0.00 C ATOM 417 C THR A 32 -8.719 -14.657 -3.244 1.00 0.00 C ATOM 418 O THR A 32 -8.096 -14.420 -4.279 1.00 0.00 O ATOM 419 CB THR A 32 -8.510 -17.110 -3.653 1.00 0.00 C ATOM 420 OG1 THR A 32 -9.776 -17.294 -4.296 1.00 0.00 O ATOM 421 CG2 THR A 32 -8.045 -18.427 -3.049 1.00 0.00 C ATOM 0 H THR A 32 -10.671 -16.206 -2.161 1.00 0.00 H new ATOM 0 HA THR A 32 -7.733 -16.049 -1.942 1.00 0.00 H new ATOM 0 HB THR A 32 -7.773 -16.786 -4.388 1.00 0.00 H new ATOM 0 HG1 THR A 32 -9.696 -17.987 -4.984 1.00 0.00 H new ATOM 0 HG21 THR A 32 -7.973 -19.181 -3.833 1.00 0.00 H new ATOM 0 HG22 THR A 32 -7.068 -18.290 -2.586 1.00 0.00 H new ATOM 0 HG23 THR A 32 -8.761 -18.754 -2.295 1.00 0.00 H new ATOM 429 N SER A 33 -9.504 -13.763 -2.652 1.00 0.00 N ATOM 430 CA SER A 33 -9.684 -12.423 -3.198 1.00 0.00 C ATOM 431 C SER A 33 -9.667 -11.376 -2.087 1.00 0.00 C ATOM 432 O SER A 33 -10.094 -11.641 -0.963 1.00 0.00 O ATOM 433 CB SER A 33 -11.000 -12.338 -3.973 1.00 0.00 C ATOM 434 OG SER A 33 -12.024 -13.070 -3.322 1.00 0.00 O ATOM 0 H SER A 33 -10.026 -13.942 -1.794 1.00 0.00 H new ATOM 0 HA SER A 33 -8.856 -12.220 -3.877 1.00 0.00 H new ATOM 0 HB2 SER A 33 -11.301 -11.295 -4.072 1.00 0.00 H new ATOM 0 HB3 SER A 33 -10.857 -12.725 -4.982 1.00 0.00 H new ATOM 0 HG SER A 33 -12.855 -12.998 -3.836 1.00 0.00 H new ATOM 440 N LEU A 34 -9.171 -10.188 -2.411 1.00 0.00 N ATOM 441 CA LEU A 34 -9.097 -9.100 -1.442 1.00 0.00 C ATOM 442 C LEU A 34 -9.094 -7.745 -2.144 1.00 0.00 C ATOM 443 O LEU A 34 -8.901 -7.664 -3.357 1.00 0.00 O ATOM 444 CB LEU A 34 -7.842 -9.243 -0.580 1.00 0.00 C ATOM 445 CG LEU A 34 -8.003 -10.045 0.712 1.00 0.00 C ATOM 446 CD1 LEU A 34 -6.702 -10.745 1.071 1.00 0.00 C ATOM 447 CD2 LEU A 34 -8.455 -9.139 1.849 1.00 0.00 C ATOM 0 H LEU A 34 -8.814 -9.953 -3.337 1.00 0.00 H new ATOM 0 HA LEU A 34 -9.978 -9.155 -0.802 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -7.064 -9.713 -1.181 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -7.487 -8.245 -0.323 1.00 0.00 H new ATOM 0 HG LEU A 34 -8.768 -10.805 0.553 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -6.836 -11.311 1.993 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.420 -11.424 0.266 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.916 -10.003 1.211 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.565 -9.726 2.761 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.713 -8.357 2.008 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -9.412 -8.684 1.593 1.00 0.00 H new ATOM 459 N ARG A 35 -9.308 -6.684 -1.372 1.00 0.00 N ATOM 460 CA ARG A 35 -9.329 -5.333 -1.919 1.00 0.00 C ATOM 461 C ARG A 35 -8.795 -4.327 -0.904 1.00 0.00 C ATOM 462 O ARG A 35 -9.466 -4.002 0.076 1.00 0.00 O ATOM 463 CB ARG A 35 -10.751 -4.950 -2.333 1.00 0.00 C ATOM 464 CG ARG A 35 -10.868 -3.534 -2.874 1.00 0.00 C ATOM 465 CD ARG A 35 -12.290 -3.009 -2.758 1.00 0.00 C ATOM 466 NE ARG A 35 -12.442 -1.698 -3.383 1.00 0.00 N ATOM 467 CZ ARG A 35 -13.447 -0.870 -3.120 1.00 0.00 C ATOM 468 NH1 ARG A 35 -14.384 -1.216 -2.248 1.00 0.00 N ATOM 469 NH2 ARG A 35 -13.516 0.307 -3.729 1.00 0.00 N ATOM 0 H ARG A 35 -9.469 -6.734 -0.366 1.00 0.00 H new ATOM 0 HA ARG A 35 -8.684 -5.314 -2.798 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -11.100 -5.650 -3.092 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.412 -5.057 -1.473 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -10.191 -2.877 -2.327 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -10.556 -3.515 -3.918 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -12.976 -3.715 -3.225 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -12.568 -2.943 -1.706 1.00 0.00 H new ATOM 0 HE ARG A 35 -11.738 -1.402 -4.059 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -14.334 -2.120 -1.777 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -15.155 -0.579 -2.048 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -12.797 0.577 -4.400 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -14.288 0.942 -3.526 1.00 0.00 H new ATOM 483 N VAL A 36 -7.583 -3.837 -1.145 1.00 0.00 N ATOM 484 CA VAL A 36 -6.959 -2.868 -0.252 1.00 0.00 C ATOM 485 C VAL A 36 -7.209 -1.442 -0.729 1.00 0.00 C ATOM 486 O VAL A 36 -7.026 -1.128 -1.905 1.00 0.00 O ATOM 487 CB VAL A 36 -5.441 -3.102 -0.142 1.00 0.00 C ATOM 488 CG1 VAL A 36 -4.749 -1.870 0.419 1.00 0.00 C ATOM 489 CG2 VAL A 36 -5.152 -4.324 0.717 1.00 0.00 C ATOM 0 H VAL A 36 -7.014 -4.095 -1.951 1.00 0.00 H new ATOM 0 HA VAL A 36 -7.412 -3.005 0.730 1.00 0.00 H new ATOM 0 HB VAL A 36 -5.046 -3.286 -1.141 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.677 -2.055 0.489 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -4.928 -1.020 -0.240 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -5.145 -1.650 1.410 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.075 -4.475 0.784 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -5.560 -4.171 1.716 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -5.614 -5.203 0.267 1.00 0.00 H new ATOM 499 N SER A 37 -7.628 -0.580 0.193 1.00 0.00 N ATOM 500 CA SER A 37 -7.906 0.813 -0.134 1.00 0.00 C ATOM 501 C SER A 37 -7.246 1.750 0.873 1.00 0.00 C ATOM 502 O SER A 37 -7.470 1.639 2.079 1.00 0.00 O ATOM 503 CB SER A 37 -9.416 1.060 -0.164 1.00 0.00 C ATOM 504 OG SER A 37 -9.891 1.472 1.106 1.00 0.00 O ATOM 0 H SER A 37 -7.782 -0.822 1.172 1.00 0.00 H new ATOM 0 HA SER A 37 -7.491 1.019 -1.121 1.00 0.00 H new ATOM 0 HB2 SER A 37 -9.648 1.823 -0.907 1.00 0.00 H new ATOM 0 HB3 SER A 37 -9.931 0.149 -0.470 1.00 0.00 H new ATOM 0 HG SER A 37 -10.858 1.625 1.060 1.00 0.00 H new ATOM 510 N TRP A 38 -6.433 2.671 0.370 1.00 0.00 N ATOM 511 CA TRP A 38 -5.739 3.628 1.225 1.00 0.00 C ATOM 512 C TRP A 38 -6.326 5.026 1.066 1.00 0.00 C ATOM 513 O TRP A 38 -7.322 5.214 0.367 1.00 0.00 O ATOM 514 CB TRP A 38 -4.246 3.648 0.896 1.00 0.00 C ATOM 515 CG TRP A 38 -3.962 3.726 -0.573 1.00 0.00 C ATOM 516 CD1 TRP A 38 -3.462 4.798 -1.255 1.00 0.00 C ATOM 517 CD2 TRP A 38 -4.164 2.690 -1.541 1.00 0.00 C ATOM 518 NE1 TRP A 38 -3.341 4.491 -2.589 1.00 0.00 N ATOM 519 CE2 TRP A 38 -3.764 3.204 -2.790 1.00 0.00 C ATOM 520 CE3 TRP A 38 -4.642 1.379 -1.474 1.00 0.00 C ATOM 521 CZ2 TRP A 38 -3.830 2.451 -3.960 1.00 0.00 C ATOM 522 CZ3 TRP A 38 -4.707 0.633 -2.635 1.00 0.00 C ATOM 523 CH2 TRP A 38 -4.302 1.170 -3.865 1.00 0.00 C ATOM 0 H TRP A 38 -6.238 2.776 -0.626 1.00 0.00 H new ATOM 0 HA TRP A 38 -5.871 3.315 2.261 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -3.783 4.500 1.394 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -3.780 2.750 1.302 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -3.200 5.747 -0.811 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -2.993 5.120 -3.312 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -4.955 0.956 -0.531 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -3.520 2.864 -4.909 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -5.076 -0.381 -2.594 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -4.364 0.561 -4.755 1.00 0.00 H new ATOM 534 N GLN A 39 -5.704 6.002 1.718 1.00 0.00 N ATOM 535 CA GLN A 39 -6.166 7.383 1.648 1.00 0.00 C ATOM 536 C GLN A 39 -5.091 8.288 1.057 1.00 0.00 C ATOM 537 O GLN A 39 -3.985 8.383 1.590 1.00 0.00 O ATOM 538 CB GLN A 39 -6.562 7.882 3.039 1.00 0.00 C ATOM 539 CG GLN A 39 -6.968 9.346 3.067 1.00 0.00 C ATOM 540 CD GLN A 39 -7.985 9.649 4.150 1.00 0.00 C ATOM 541 OE1 GLN A 39 -7.643 9.753 5.328 1.00 0.00 O ATOM 542 NE2 GLN A 39 -9.245 9.792 3.756 1.00 0.00 N ATOM 0 H GLN A 39 -4.879 5.862 2.301 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.039 7.414 0.996 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -7.389 7.277 3.411 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -5.725 7.732 3.721 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.082 9.962 3.223 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -7.382 9.623 2.097 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -9.485 9.698 2.769 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -9.973 9.996 4.440 1.00 0.00 H new ATOM 551 N GLU A 40 -5.422 8.951 -0.046 1.00 0.00 N ATOM 552 CA GLU A 40 -4.483 9.848 -0.710 1.00 0.00 C ATOM 553 C GLU A 40 -3.723 10.691 0.311 1.00 0.00 C ATOM 554 O GLU A 40 -4.240 11.667 0.856 1.00 0.00 O ATOM 555 CB GLU A 40 -5.221 10.759 -1.693 1.00 0.00 C ATOM 556 CG GLU A 40 -4.314 11.753 -2.399 1.00 0.00 C ATOM 557 CD GLU A 40 -5.080 12.913 -3.005 1.00 0.00 C ATOM 558 OE1 GLU A 40 -6.315 12.798 -3.149 1.00 0.00 O ATOM 559 OE2 GLU A 40 -4.444 13.935 -3.336 1.00 0.00 O ATOM 0 H GLU A 40 -6.333 8.884 -0.499 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.765 9.240 -1.260 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -5.722 10.143 -2.440 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.997 11.305 -1.157 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -3.581 12.137 -1.690 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.759 11.239 -3.184 1.00 0.00 H new ATOM 566 N PRO A 41 -2.466 10.307 0.576 1.00 0.00 N ATOM 567 CA PRO A 41 -1.607 11.013 1.532 1.00 0.00 C ATOM 568 C PRO A 41 -1.184 12.388 1.025 1.00 0.00 C ATOM 569 O PRO A 41 -1.494 12.766 -0.105 1.00 0.00 O ATOM 570 CB PRO A 41 -0.391 10.093 1.662 1.00 0.00 C ATOM 571 CG PRO A 41 -0.352 9.332 0.383 1.00 0.00 C ATOM 572 CD PRO A 41 -1.785 9.154 -0.036 1.00 0.00 C ATOM 0 HA PRO A 41 -2.117 11.203 2.476 1.00 0.00 H new ATOM 0 HB2 PRO A 41 0.525 10.666 1.810 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -0.490 9.425 2.517 1.00 0.00 H new ATOM 0 HG2 PRO A 41 0.212 9.873 -0.376 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.138 8.368 0.517 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -1.889 9.155 -1.121 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -2.194 8.209 0.322 1.00 0.00 H new ATOM 580 N ARG A 42 -0.474 13.131 1.868 1.00 0.00 N ATOM 581 CA ARG A 42 -0.009 14.464 1.505 1.00 0.00 C ATOM 582 C ARG A 42 1.263 14.387 0.666 1.00 0.00 C ATOM 583 O ARG A 42 2.104 13.512 0.875 1.00 0.00 O ATOM 584 CB ARG A 42 0.246 15.298 2.762 1.00 0.00 C ATOM 585 CG ARG A 42 1.411 14.797 3.599 1.00 0.00 C ATOM 586 CD ARG A 42 1.753 15.770 4.716 1.00 0.00 C ATOM 587 NE ARG A 42 0.756 15.752 5.783 1.00 0.00 N ATOM 588 CZ ARG A 42 0.931 16.337 6.962 1.00 0.00 C ATOM 589 NH1 ARG A 42 2.059 16.983 7.225 1.00 0.00 N ATOM 590 NH2 ARG A 42 -0.024 16.277 7.882 1.00 0.00 N ATOM 0 H ARG A 42 -0.208 12.832 2.806 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.787 14.943 0.911 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.437 16.331 2.470 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -0.656 15.301 3.375 1.00 0.00 H new ATOM 0 HG2 ARG A 42 1.163 13.825 4.025 1.00 0.00 H new ATOM 0 HG3 ARG A 42 2.283 14.652 2.961 1.00 0.00 H new ATOM 0 HD2 ARG A 42 2.730 15.519 5.129 1.00 0.00 H new ATOM 0 HD3 ARG A 42 1.829 16.778 4.308 1.00 0.00 H new ATOM 0 HE ARG A 42 -0.123 15.263 5.613 1.00 0.00 H new ATOM 0 HH11 ARG A 42 2.795 17.031 6.521 1.00 0.00 H new ATOM 0 HH12 ARG A 42 2.190 17.431 8.132 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -0.893 15.781 7.683 1.00 0.00 H new ATOM 0 HH22 ARG A 42 0.111 16.727 8.788 1.00 0.00 H new ATOM 604 N CYS A 43 1.395 15.306 -0.284 1.00 0.00 N ATOM 605 CA CYS A 43 2.564 15.341 -1.156 1.00 0.00 C ATOM 606 C CYS A 43 2.639 16.664 -1.911 1.00 0.00 C ATOM 607 O CYS A 43 1.742 17.000 -2.683 1.00 0.00 O ATOM 608 CB CYS A 43 2.523 14.176 -2.146 1.00 0.00 C ATOM 609 SG CYS A 43 4.036 13.978 -3.116 1.00 0.00 S ATOM 0 H CYS A 43 0.708 16.036 -0.470 1.00 0.00 H new ATOM 0 HA CYS A 43 3.454 15.248 -0.534 1.00 0.00 H new ATOM 0 HB2 CYS A 43 2.333 13.254 -1.597 1.00 0.00 H new ATOM 0 HB3 CYS A 43 1.684 14.321 -2.827 1.00 0.00 H new ATOM 0 HG CYS A 43 3.860 14.479 -4.302 1.00 0.00 H new ATOM 615 N GLU A 44 3.715 17.411 -1.682 1.00 0.00 N ATOM 616 CA GLU A 44 3.905 18.698 -2.339 1.00 0.00 C ATOM 617 C GLU A 44 3.745 18.566 -3.851 1.00 0.00 C ATOM 618 O GLU A 44 3.334 19.509 -4.527 1.00 0.00 O ATOM 619 CB GLU A 44 5.288 19.265 -2.009 1.00 0.00 C ATOM 620 CG GLU A 44 5.364 19.926 -0.643 1.00 0.00 C ATOM 621 CD GLU A 44 4.841 21.348 -0.653 1.00 0.00 C ATOM 622 OE1 GLU A 44 5.377 22.173 -1.423 1.00 0.00 O ATOM 623 OE2 GLU A 44 3.895 21.638 0.110 1.00 0.00 O ATOM 0 H GLU A 44 4.468 17.147 -1.047 1.00 0.00 H new ATOM 0 HA GLU A 44 3.142 19.382 -1.969 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.022 18.460 -2.055 1.00 0.00 H new ATOM 0 HB3 GLU A 44 5.564 19.993 -2.772 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.791 19.337 0.074 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.399 19.926 -0.301 1.00 0.00 H new ATOM 630 N ARG A 45 4.074 17.389 -4.374 1.00 0.00 N ATOM 631 CA ARG A 45 3.968 17.133 -5.806 1.00 0.00 C ATOM 632 C ARG A 45 2.807 16.190 -6.105 1.00 0.00 C ATOM 633 O ARG A 45 2.405 15.376 -5.273 1.00 0.00 O ATOM 634 CB ARG A 45 5.274 16.537 -6.336 1.00 0.00 C ATOM 635 CG ARG A 45 6.482 17.436 -6.132 1.00 0.00 C ATOM 636 CD ARG A 45 6.406 18.677 -7.009 1.00 0.00 C ATOM 637 NE ARG A 45 7.508 19.599 -6.747 1.00 0.00 N ATOM 638 CZ ARG A 45 7.529 20.448 -5.726 1.00 0.00 C ATOM 639 NH1 ARG A 45 6.514 20.491 -4.874 1.00 0.00 N ATOM 640 NH2 ARG A 45 8.568 21.256 -5.555 1.00 0.00 N ATOM 0 H ARG A 45 4.416 16.598 -3.828 1.00 0.00 H new ATOM 0 HA ARG A 45 3.780 18.082 -6.307 1.00 0.00 H new ATOM 0 HB2 ARG A 45 5.455 15.583 -5.841 1.00 0.00 H new ATOM 0 HB3 ARG A 45 5.163 16.329 -7.400 1.00 0.00 H new ATOM 0 HG2 ARG A 45 6.544 17.732 -5.085 1.00 0.00 H new ATOM 0 HG3 ARG A 45 7.392 16.882 -6.361 1.00 0.00 H new ATOM 0 HD2 ARG A 45 6.422 18.381 -8.058 1.00 0.00 H new ATOM 0 HD3 ARG A 45 5.458 19.186 -6.836 1.00 0.00 H new ATOM 0 HE ARG A 45 8.305 19.590 -7.383 1.00 0.00 H new ATOM 0 HH11 ARG A 45 5.714 19.871 -5.002 1.00 0.00 H new ATOM 0 HH12 ARG A 45 6.533 21.144 -4.091 1.00 0.00 H new ATOM 0 HH21 ARG A 45 9.351 21.225 -6.208 1.00 0.00 H new ATOM 0 HH22 ARG A 45 8.583 21.908 -4.771 1.00 0.00 H new ATOM 654 N PRO A 46 2.253 16.301 -7.322 1.00 0.00 N ATOM 655 CA PRO A 46 1.130 15.466 -7.759 1.00 0.00 C ATOM 656 C PRO A 46 1.536 14.012 -7.969 1.00 0.00 C ATOM 657 O PRO A 46 2.501 13.722 -8.678 1.00 0.00 O ATOM 658 CB PRO A 46 0.713 16.102 -9.088 1.00 0.00 C ATOM 659 CG PRO A 46 1.942 16.780 -9.586 1.00 0.00 C ATOM 660 CD PRO A 46 2.681 17.249 -8.364 1.00 0.00 C ATOM 0 HA PRO A 46 0.333 15.434 -7.017 1.00 0.00 H new ATOM 0 HB2 PRO A 46 0.362 15.349 -9.794 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -0.102 16.812 -8.948 1.00 0.00 H new ATOM 0 HG2 PRO A 46 2.554 16.096 -10.173 1.00 0.00 H new ATOM 0 HG3 PRO A 46 1.689 17.619 -10.235 1.00 0.00 H new ATOM 0 HD2 PRO A 46 3.761 17.223 -8.512 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.420 18.275 -8.106 1.00 0.00 H new ATOM 668 N LEU A 47 0.795 13.100 -7.349 1.00 0.00 N ATOM 669 CA LEU A 47 1.078 11.674 -7.469 1.00 0.00 C ATOM 670 C LEU A 47 0.861 11.194 -8.900 1.00 0.00 C ATOM 671 O LEU A 47 0.053 11.757 -9.638 1.00 0.00 O ATOM 672 CB LEU A 47 0.191 10.876 -6.512 1.00 0.00 C ATOM 673 CG LEU A 47 0.160 11.362 -5.062 1.00 0.00 C ATOM 674 CD1 LEU A 47 -1.090 10.859 -4.357 1.00 0.00 C ATOM 675 CD2 LEU A 47 1.410 10.911 -4.322 1.00 0.00 C ATOM 0 H LEU A 47 -0.006 13.323 -6.758 1.00 0.00 H new ATOM 0 HA LEU A 47 2.123 11.513 -7.206 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.828 10.886 -6.899 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.525 9.838 -6.519 1.00 0.00 H new ATOM 0 HG LEU A 47 0.137 12.452 -5.064 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.095 11.215 -3.327 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.974 11.232 -4.874 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -1.098 9.769 -4.365 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.371 11.266 -3.292 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.464 9.822 -4.329 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.292 11.321 -4.814 1.00 0.00 H new ATOM 687 N GLN A 48 1.588 10.150 -9.285 1.00 0.00 N ATOM 688 CA GLN A 48 1.474 9.593 -10.628 1.00 0.00 C ATOM 689 C GLN A 48 0.762 8.244 -10.600 1.00 0.00 C ATOM 690 O GLN A 48 0.311 7.748 -11.631 1.00 0.00 O ATOM 691 CB GLN A 48 2.859 9.440 -11.259 1.00 0.00 C ATOM 692 CG GLN A 48 3.571 10.762 -11.492 1.00 0.00 C ATOM 693 CD GLN A 48 5.051 10.587 -11.768 1.00 0.00 C ATOM 694 OE1 GLN A 48 5.441 9.984 -12.768 1.00 0.00 O ATOM 695 NE2 GLN A 48 5.886 11.115 -10.880 1.00 0.00 N ATOM 0 H GLN A 48 2.262 9.673 -8.686 1.00 0.00 H new ATOM 0 HA GLN A 48 0.883 10.282 -11.231 1.00 0.00 H new ATOM 0 HB2 GLN A 48 3.476 8.814 -10.614 1.00 0.00 H new ATOM 0 HB3 GLN A 48 2.760 8.918 -12.211 1.00 0.00 H new ATOM 0 HG2 GLN A 48 3.107 11.277 -12.333 1.00 0.00 H new ATOM 0 HG3 GLN A 48 3.441 11.399 -10.617 1.00 0.00 H new ATOM 0 HE21 GLN A 48 5.520 11.607 -10.065 1.00 0.00 H new ATOM 0 HE22 GLN A 48 6.894 11.029 -11.013 1.00 0.00 H new ATOM 704 N GLY A 49 0.667 7.656 -9.411 1.00 0.00 N ATOM 705 CA GLY A 49 0.010 6.369 -9.271 1.00 0.00 C ATOM 706 C GLY A 49 0.095 5.826 -7.859 1.00 0.00 C ATOM 707 O GLY A 49 0.120 6.590 -6.893 1.00 0.00 O ATOM 0 H GLY A 49 1.033 8.047 -8.543 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -1.037 6.466 -9.557 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.464 5.656 -9.959 1.00 0.00 H new ATOM 711 N TYR A 50 0.136 4.504 -7.737 1.00 0.00 N ATOM 712 CA TYR A 50 0.214 3.859 -6.431 1.00 0.00 C ATOM 713 C TYR A 50 0.822 2.465 -6.548 1.00 0.00 C ATOM 714 O TYR A 50 0.892 1.895 -7.636 1.00 0.00 O ATOM 715 CB TYR A 50 -1.177 3.770 -5.800 1.00 0.00 C ATOM 716 CG TYR A 50 -1.620 5.050 -5.129 1.00 0.00 C ATOM 717 CD1 TYR A 50 -0.935 5.556 -4.031 1.00 0.00 C ATOM 718 CD2 TYR A 50 -2.725 5.754 -5.593 1.00 0.00 C ATOM 719 CE1 TYR A 50 -1.338 6.725 -3.415 1.00 0.00 C ATOM 720 CE2 TYR A 50 -3.134 6.924 -4.984 1.00 0.00 C ATOM 721 CZ TYR A 50 -2.437 7.406 -3.895 1.00 0.00 C ATOM 722 OH TYR A 50 -2.842 8.571 -3.285 1.00 0.00 O ATOM 0 H TYR A 50 0.117 3.858 -8.526 1.00 0.00 H new ATOM 0 HA TYR A 50 0.858 4.464 -5.792 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -1.900 3.505 -6.571 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -1.183 2.964 -5.066 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -0.073 5.026 -3.653 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -3.273 5.379 -6.445 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -0.795 7.104 -2.562 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -3.995 7.459 -5.358 1.00 0.00 H new ATOM 0 HH TYR A 50 -3.630 8.925 -3.747 1.00 0.00 H new ATOM 732 N SER A 51 1.261 1.922 -5.417 1.00 0.00 N ATOM 733 CA SER A 51 1.867 0.596 -5.390 1.00 0.00 C ATOM 734 C SER A 51 1.429 -0.177 -4.150 1.00 0.00 C ATOM 735 O SER A 51 1.437 0.353 -3.039 1.00 0.00 O ATOM 736 CB SER A 51 3.393 0.708 -5.423 1.00 0.00 C ATOM 737 OG SER A 51 3.999 -0.572 -5.380 1.00 0.00 O ATOM 0 H SER A 51 1.208 2.380 -4.507 1.00 0.00 H new ATOM 0 HA SER A 51 1.531 0.052 -6.273 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.703 1.230 -6.328 1.00 0.00 H new ATOM 0 HB3 SER A 51 3.735 1.305 -4.577 1.00 0.00 H new ATOM 0 HG SER A 51 4.974 -0.473 -5.404 1.00 0.00 H new ATOM 743 N VAL A 52 1.048 -1.435 -4.348 1.00 0.00 N ATOM 744 CA VAL A 52 0.608 -2.283 -3.247 1.00 0.00 C ATOM 745 C VAL A 52 1.377 -3.599 -3.225 1.00 0.00 C ATOM 746 O VAL A 52 1.045 -4.534 -3.952 1.00 0.00 O ATOM 747 CB VAL A 52 -0.900 -2.583 -3.338 1.00 0.00 C ATOM 748 CG1 VAL A 52 -1.385 -3.273 -2.071 1.00 0.00 C ATOM 749 CG2 VAL A 52 -1.683 -1.304 -3.591 1.00 0.00 C ATOM 0 H VAL A 52 1.035 -1.889 -5.261 1.00 0.00 H new ATOM 0 HA VAL A 52 0.807 -1.735 -2.326 1.00 0.00 H new ATOM 0 HB VAL A 52 -1.069 -3.257 -4.178 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -2.453 -3.477 -2.154 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -0.846 -4.211 -1.938 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.205 -2.626 -1.213 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.747 -1.535 -3.652 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.510 -0.604 -2.774 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -1.354 -0.856 -4.528 1.00 0.00 H new ATOM 759 N GLU A 53 2.405 -3.664 -2.385 1.00 0.00 N ATOM 760 CA GLU A 53 3.221 -4.867 -2.269 1.00 0.00 C ATOM 761 C GLU A 53 2.770 -5.719 -1.086 1.00 0.00 C ATOM 762 O GLU A 53 2.783 -5.267 0.059 1.00 0.00 O ATOM 763 CB GLU A 53 4.697 -4.495 -2.111 1.00 0.00 C ATOM 764 CG GLU A 53 5.381 -4.145 -3.422 1.00 0.00 C ATOM 765 CD GLU A 53 6.572 -3.226 -3.232 1.00 0.00 C ATOM 766 OE1 GLU A 53 6.565 -2.441 -2.261 1.00 0.00 O ATOM 767 OE2 GLU A 53 7.510 -3.292 -4.053 1.00 0.00 O ATOM 0 H GLU A 53 2.692 -2.898 -1.775 1.00 0.00 H new ATOM 0 HA GLU A 53 3.096 -5.449 -3.182 1.00 0.00 H new ATOM 0 HB2 GLU A 53 4.778 -3.647 -1.431 1.00 0.00 H new ATOM 0 HB3 GLU A 53 5.225 -5.328 -1.647 1.00 0.00 H new ATOM 0 HG2 GLU A 53 5.709 -5.062 -3.912 1.00 0.00 H new ATOM 0 HG3 GLU A 53 4.661 -3.668 -4.087 1.00 0.00 H new ATOM 774 N TYR A 54 2.372 -6.953 -1.372 1.00 0.00 N ATOM 775 CA TYR A 54 1.914 -7.868 -0.333 1.00 0.00 C ATOM 776 C TYR A 54 2.612 -9.219 -0.451 1.00 0.00 C ATOM 777 O TYR A 54 2.864 -9.706 -1.553 1.00 0.00 O ATOM 778 CB TYR A 54 0.398 -8.055 -0.421 1.00 0.00 C ATOM 779 CG TYR A 54 -0.037 -8.948 -1.561 1.00 0.00 C ATOM 780 CD1 TYR A 54 -0.074 -10.330 -1.412 1.00 0.00 C ATOM 781 CD2 TYR A 54 -0.409 -8.412 -2.788 1.00 0.00 C ATOM 782 CE1 TYR A 54 -0.469 -11.150 -2.451 1.00 0.00 C ATOM 783 CE2 TYR A 54 -0.807 -9.224 -3.832 1.00 0.00 C ATOM 784 CZ TYR A 54 -0.836 -10.592 -3.659 1.00 0.00 C ATOM 785 OH TYR A 54 -1.231 -11.405 -4.696 1.00 0.00 O ATOM 0 H TYR A 54 2.357 -7.343 -2.314 1.00 0.00 H new ATOM 0 HA TYR A 54 2.164 -7.433 0.635 1.00 0.00 H new ATOM 0 HB2 TYR A 54 0.037 -8.476 0.517 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.074 -7.079 -0.535 1.00 0.00 H new ATOM 0 HD1 TYR A 54 0.211 -10.770 -0.468 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.386 -7.341 -2.928 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -0.491 -12.222 -2.319 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -1.094 -8.790 -4.778 1.00 0.00 H new ATOM 0 HH TYR A 54 -1.457 -10.855 -5.475 1.00 0.00 H new ATOM 795 N GLN A 55 2.921 -9.820 0.694 1.00 0.00 N ATOM 796 CA GLN A 55 3.590 -11.115 0.720 1.00 0.00 C ATOM 797 C GLN A 55 3.184 -11.913 1.955 1.00 0.00 C ATOM 798 O GLN A 55 2.653 -11.358 2.918 1.00 0.00 O ATOM 799 CB GLN A 55 5.108 -10.929 0.695 1.00 0.00 C ATOM 800 CG GLN A 55 5.699 -10.560 2.046 1.00 0.00 C ATOM 801 CD GLN A 55 7.172 -10.212 1.964 1.00 0.00 C ATOM 802 OE1 GLN A 55 7.632 -9.258 2.592 1.00 0.00 O ATOM 803 NE2 GLN A 55 7.921 -10.986 1.187 1.00 0.00 N ATOM 0 H GLN A 55 2.719 -9.431 1.615 1.00 0.00 H new ATOM 0 HA GLN A 55 3.284 -11.671 -0.166 1.00 0.00 H new ATOM 0 HB2 GLN A 55 5.573 -11.850 0.344 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.358 -10.151 -0.026 1.00 0.00 H new ATOM 0 HG2 GLN A 55 5.152 -9.712 2.458 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.564 -11.392 2.737 1.00 0.00 H new ATOM 0 HE21 GLN A 55 7.498 -11.766 0.685 1.00 0.00 H new ATOM 0 HE22 GLN A 55 8.919 -10.800 1.093 1.00 0.00 H new ATOM 812 N LEU A 56 3.438 -13.216 1.921 1.00 0.00 N ATOM 813 CA LEU A 56 3.098 -14.091 3.038 1.00 0.00 C ATOM 814 C LEU A 56 3.660 -13.545 4.347 1.00 0.00 C ATOM 815 O LEU A 56 4.874 -13.418 4.509 1.00 0.00 O ATOM 816 CB LEU A 56 3.635 -15.501 2.788 1.00 0.00 C ATOM 817 CG LEU A 56 2.730 -16.431 1.979 1.00 0.00 C ATOM 818 CD1 LEU A 56 3.491 -17.676 1.549 1.00 0.00 C ATOM 819 CD2 LEU A 56 1.496 -16.809 2.786 1.00 0.00 C ATOM 0 H LEU A 56 3.878 -13.690 1.133 1.00 0.00 H new ATOM 0 HA LEU A 56 2.012 -14.132 3.119 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.591 -15.418 2.271 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.834 -15.969 3.752 1.00 0.00 H new ATOM 0 HG LEU A 56 2.405 -15.902 1.083 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.831 -18.326 0.975 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.342 -17.387 0.933 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.846 -18.208 2.431 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.863 -17.471 2.195 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.801 -17.319 3.700 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.939 -15.908 3.042 1.00 0.00 H new ATOM 831 N LEU A 57 2.769 -13.226 5.279 1.00 0.00 N ATOM 832 CA LEU A 57 3.175 -12.696 6.576 1.00 0.00 C ATOM 833 C LEU A 57 4.306 -13.527 7.174 1.00 0.00 C ATOM 834 O LEU A 57 5.275 -12.984 7.704 1.00 0.00 O ATOM 835 CB LEU A 57 1.983 -12.671 7.535 1.00 0.00 C ATOM 836 CG LEU A 57 2.026 -11.605 8.631 1.00 0.00 C ATOM 837 CD1 LEU A 57 3.048 -11.974 9.695 1.00 0.00 C ATOM 838 CD2 LEU A 57 2.341 -10.241 8.036 1.00 0.00 C ATOM 0 H LEU A 57 1.761 -13.325 5.161 1.00 0.00 H new ATOM 0 HA LEU A 57 3.536 -11.678 6.428 1.00 0.00 H new ATOM 0 HB2 LEU A 57 1.075 -12.526 6.950 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.904 -13.649 8.010 1.00 0.00 H new ATOM 0 HG LEU A 57 1.044 -11.556 9.102 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.064 -11.204 10.466 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.778 -12.930 10.143 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.035 -12.052 9.240 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.368 -9.495 8.830 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.310 -10.276 7.539 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.571 -9.973 7.312 1.00 0.00 H new ATOM 850 N ASN A 58 4.176 -14.846 7.083 1.00 0.00 N ATOM 851 CA ASN A 58 5.188 -15.753 7.614 1.00 0.00 C ATOM 852 C ASN A 58 6.491 -15.633 6.829 1.00 0.00 C ATOM 853 O ASN A 58 7.572 -15.551 7.409 1.00 0.00 O ATOM 854 CB ASN A 58 4.683 -17.196 7.569 1.00 0.00 C ATOM 855 CG ASN A 58 4.047 -17.546 6.237 1.00 0.00 C ATOM 856 OD1 ASN A 58 4.730 -17.644 5.218 1.00 0.00 O ATOM 857 ND2 ASN A 58 2.733 -17.735 6.241 1.00 0.00 N ATOM 0 H ASN A 58 3.380 -15.311 6.647 1.00 0.00 H new ATOM 0 HA ASN A 58 5.382 -15.475 8.650 1.00 0.00 H new ATOM 0 HB2 ASN A 58 5.514 -17.875 7.761 1.00 0.00 H new ATOM 0 HB3 ASN A 58 3.956 -17.348 8.367 1.00 0.00 H new ATOM 0 HD21 ASN A 58 2.249 -17.972 5.375 1.00 0.00 H new ATOM 0 HD22 ASN A 58 2.207 -17.643 7.110 1.00 0.00 H new ATOM 864 N GLY A 59 6.378 -15.623 5.504 1.00 0.00 N ATOM 865 CA GLY A 59 7.554 -15.513 4.661 1.00 0.00 C ATOM 866 C GLY A 59 7.399 -16.256 3.349 1.00 0.00 C ATOM 867 O GLY A 59 7.559 -17.475 3.295 1.00 0.00 O ATOM 0 H GLY A 59 5.494 -15.689 5.000 1.00 0.00 H new ATOM 0 HA2 GLY A 59 7.754 -14.461 4.458 1.00 0.00 H new ATOM 0 HA3 GLY A 59 8.419 -15.904 5.197 1.00 0.00 H new ATOM 871 N GLY A 60 7.083 -15.521 2.287 1.00 0.00 N ATOM 872 CA GLY A 60 6.909 -16.136 0.984 1.00 0.00 C ATOM 873 C GLY A 60 7.049 -15.140 -0.150 1.00 0.00 C ATOM 874 O GLY A 60 7.422 -13.988 0.070 1.00 0.00 O ATOM 0 H GLY A 60 6.944 -14.511 2.306 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.645 -16.930 0.859 1.00 0.00 H new ATOM 0 HA3 GLY A 60 5.925 -16.603 0.934 1.00 0.00 H new ATOM 878 N GLU A 61 6.749 -15.585 -1.367 1.00 0.00 N ATOM 879 CA GLU A 61 6.846 -14.724 -2.540 1.00 0.00 C ATOM 880 C GLU A 61 6.226 -13.357 -2.264 1.00 0.00 C ATOM 881 O GLU A 61 5.413 -13.204 -1.351 1.00 0.00 O ATOM 882 CB GLU A 61 6.155 -15.377 -3.738 1.00 0.00 C ATOM 883 CG GLU A 61 4.708 -14.951 -3.913 1.00 0.00 C ATOM 884 CD GLU A 61 3.846 -16.043 -4.516 1.00 0.00 C ATOM 885 OE1 GLU A 61 4.160 -16.495 -5.637 1.00 0.00 O ATOM 886 OE2 GLU A 61 2.859 -16.447 -3.867 1.00 0.00 O ATOM 0 H GLU A 61 6.437 -16.536 -1.566 1.00 0.00 H new ATOM 0 HA GLU A 61 7.902 -14.585 -2.771 1.00 0.00 H new ATOM 0 HB2 GLU A 61 6.709 -15.132 -4.644 1.00 0.00 H new ATOM 0 HB3 GLU A 61 6.195 -16.460 -3.623 1.00 0.00 H new ATOM 0 HG2 GLU A 61 4.298 -14.663 -2.945 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.668 -14.068 -4.551 1.00 0.00 H new ATOM 893 N LEU A 62 6.614 -12.366 -3.059 1.00 0.00 N ATOM 894 CA LEU A 62 6.098 -11.011 -2.901 1.00 0.00 C ATOM 895 C LEU A 62 5.401 -10.543 -4.175 1.00 0.00 C ATOM 896 O LEU A 62 6.014 -10.472 -5.241 1.00 0.00 O ATOM 897 CB LEU A 62 7.232 -10.049 -2.544 1.00 0.00 C ATOM 898 CG LEU A 62 6.895 -8.560 -2.609 1.00 0.00 C ATOM 899 CD1 LEU A 62 6.870 -8.080 -4.052 1.00 0.00 C ATOM 900 CD2 LEU A 62 5.560 -8.285 -1.931 1.00 0.00 C ATOM 0 H LEU A 62 7.284 -12.476 -3.820 1.00 0.00 H new ATOM 0 HA LEU A 62 5.369 -11.019 -2.091 1.00 0.00 H new ATOM 0 HB2 LEU A 62 7.573 -10.280 -1.535 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.069 -10.241 -3.215 1.00 0.00 H new ATOM 0 HG LEU A 62 7.671 -8.009 -2.078 1.00 0.00 H new ATOM 0 HD11 LEU A 62 6.628 -7.017 -4.078 1.00 0.00 H new ATOM 0 HD12 LEU A 62 7.848 -8.241 -4.506 1.00 0.00 H new ATOM 0 HD13 LEU A 62 6.116 -8.637 -4.608 1.00 0.00 H new ATOM 0 HD21 LEU A 62 5.336 -7.220 -1.987 1.00 0.00 H new ATOM 0 HD22 LEU A 62 4.774 -8.848 -2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 62 5.613 -8.590 -0.886 1.00 0.00 H new ATOM 912 N HIS A 63 4.116 -10.222 -4.057 1.00 0.00 N ATOM 913 CA HIS A 63 3.336 -9.757 -5.198 1.00 0.00 C ATOM 914 C HIS A 63 3.299 -8.233 -5.246 1.00 0.00 C ATOM 915 O HIS A 63 2.831 -7.584 -4.310 1.00 0.00 O ATOM 916 CB HIS A 63 1.913 -10.312 -5.130 1.00 0.00 C ATOM 917 CG HIS A 63 1.857 -11.804 -5.013 1.00 0.00 C ATOM 918 ND1 HIS A 63 1.860 -12.646 -6.106 1.00 0.00 N ATOM 919 CD2 HIS A 63 1.797 -12.605 -3.923 1.00 0.00 C ATOM 920 CE1 HIS A 63 1.803 -13.899 -5.693 1.00 0.00 C ATOM 921 NE2 HIS A 63 1.765 -13.902 -4.373 1.00 0.00 N ATOM 0 H HIS A 63 3.593 -10.276 -3.183 1.00 0.00 H new ATOM 0 HA HIS A 63 3.816 -10.120 -6.107 1.00 0.00 H new ATOM 0 HB2 HIS A 63 1.400 -9.869 -4.276 1.00 0.00 H new ATOM 0 HB3 HIS A 63 1.369 -10.005 -6.023 1.00 0.00 H new ATOM 0 HD2 HIS A 63 1.778 -12.284 -2.892 1.00 0.00 H new ATOM 0 HE1 HIS A 63 1.790 -14.773 -6.327 1.00 0.00 H new ATOM 0 HE2 HIS A 63 1.719 -14.733 -3.783 1.00 0.00 H new ATOM 929 N ARG A 64 3.794 -7.668 -6.342 1.00 0.00 N ATOM 930 CA ARG A 64 3.819 -6.220 -6.510 1.00 0.00 C ATOM 931 C ARG A 64 2.684 -5.759 -7.420 1.00 0.00 C ATOM 932 O ARG A 64 2.562 -6.214 -8.558 1.00 0.00 O ATOM 933 CB ARG A 64 5.163 -5.775 -7.089 1.00 0.00 C ATOM 934 CG ARG A 64 5.325 -4.266 -7.165 1.00 0.00 C ATOM 935 CD ARG A 64 6.536 -3.876 -7.998 1.00 0.00 C ATOM 936 NE ARG A 64 6.416 -4.325 -9.382 1.00 0.00 N ATOM 937 CZ ARG A 64 6.982 -3.701 -10.409 1.00 0.00 C ATOM 938 NH1 ARG A 64 7.704 -2.607 -10.208 1.00 0.00 N ATOM 939 NH2 ARG A 64 6.827 -4.171 -11.640 1.00 0.00 N ATOM 0 H ARG A 64 4.183 -8.191 -7.127 1.00 0.00 H new ATOM 0 HA ARG A 64 3.685 -5.763 -5.529 1.00 0.00 H new ATOM 0 HB2 ARG A 64 5.966 -6.188 -6.479 1.00 0.00 H new ATOM 0 HB3 ARG A 64 5.275 -6.195 -8.089 1.00 0.00 H new ATOM 0 HG2 ARG A 64 4.427 -3.824 -7.597 1.00 0.00 H new ATOM 0 HG3 ARG A 64 5.428 -3.859 -6.159 1.00 0.00 H new ATOM 0 HD2 ARG A 64 6.656 -2.793 -7.978 1.00 0.00 H new ATOM 0 HD3 ARG A 64 7.434 -4.305 -7.554 1.00 0.00 H new ATOM 0 HE ARG A 64 5.867 -5.164 -9.571 1.00 0.00 H new ATOM 0 HH11 ARG A 64 7.826 -2.243 -9.263 1.00 0.00 H new ATOM 0 HH12 ARG A 64 8.138 -2.130 -10.998 1.00 0.00 H new ATOM 0 HH21 ARG A 64 6.273 -5.012 -11.799 1.00 0.00 H new ATOM 0 HH22 ARG A 64 7.262 -3.691 -12.428 1.00 0.00 H new ATOM 953 N LEU A 65 1.856 -4.853 -6.912 1.00 0.00 N ATOM 954 CA LEU A 65 0.730 -4.330 -7.678 1.00 0.00 C ATOM 955 C LEU A 65 0.909 -2.843 -7.963 1.00 0.00 C ATOM 956 O LEU A 65 0.988 -2.030 -7.043 1.00 0.00 O ATOM 957 CB LEU A 65 -0.579 -4.562 -6.921 1.00 0.00 C ATOM 958 CG LEU A 65 -0.827 -5.989 -6.430 1.00 0.00 C ATOM 959 CD1 LEU A 65 -1.995 -6.023 -5.457 1.00 0.00 C ATOM 960 CD2 LEU A 65 -1.083 -6.921 -7.606 1.00 0.00 C ATOM 0 H LEU A 65 1.943 -4.465 -5.973 1.00 0.00 H new ATOM 0 HA LEU A 65 0.692 -4.861 -8.629 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.601 -3.894 -6.060 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.406 -4.273 -7.569 1.00 0.00 H new ATOM 0 HG LEU A 65 0.065 -6.333 -5.907 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -2.157 -7.046 -5.118 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.773 -5.388 -4.600 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.894 -5.659 -5.955 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.257 -7.932 -7.238 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.959 -6.579 -8.157 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.216 -6.920 -8.267 1.00 0.00 H new ATOM 972 N ASN A 66 0.971 -2.494 -9.244 1.00 0.00 N ATOM 973 CA ASN A 66 1.139 -1.104 -9.651 1.00 0.00 C ATOM 974 C ASN A 66 -0.193 -0.498 -10.083 1.00 0.00 C ATOM 975 O ASN A 66 -1.045 -1.186 -10.646 1.00 0.00 O ATOM 976 CB ASN A 66 2.152 -1.003 -10.793 1.00 0.00 C ATOM 977 CG ASN A 66 3.583 -1.128 -10.308 1.00 0.00 C ATOM 978 OD1 ASN A 66 4.154 -2.219 -10.297 1.00 0.00 O ATOM 979 ND2 ASN A 66 4.171 -0.008 -9.904 1.00 0.00 N ATOM 0 H ASN A 66 0.907 -3.155 -10.018 1.00 0.00 H new ATOM 0 HA ASN A 66 1.512 -0.544 -8.793 1.00 0.00 H new ATOM 0 HB2 ASN A 66 1.950 -1.785 -11.525 1.00 0.00 H new ATOM 0 HB3 ASN A 66 2.026 -0.048 -11.303 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.134 -0.030 -9.567 1.00 0.00 H new ATOM 0 HD22 ASN A 66 3.660 0.874 -9.930 1.00 0.00 H new ATOM 986 N ILE A 67 -0.365 0.792 -9.816 1.00 0.00 N ATOM 987 CA ILE A 67 -1.592 1.490 -10.179 1.00 0.00 C ATOM 988 C ILE A 67 -1.317 2.591 -11.198 1.00 0.00 C ATOM 989 O ILE A 67 -0.725 3.625 -10.888 1.00 0.00 O ATOM 990 CB ILE A 67 -2.275 2.108 -8.945 1.00 0.00 C ATOM 991 CG1 ILE A 67 -2.204 1.142 -7.760 1.00 0.00 C ATOM 992 CG2 ILE A 67 -3.720 2.463 -9.261 1.00 0.00 C ATOM 993 CD1 ILE A 67 -3.074 -0.084 -7.927 1.00 0.00 C ATOM 0 H ILE A 67 0.330 1.375 -9.350 1.00 0.00 H new ATOM 0 HA ILE A 67 -2.258 0.748 -10.619 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.748 3.023 -8.676 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -1.170 0.827 -7.620 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -2.503 1.669 -6.854 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -4.189 2.899 -8.379 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -3.747 3.183 -10.079 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.261 1.562 -9.552 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.974 -0.723 -7.050 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -4.115 0.221 -8.037 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -2.761 -0.634 -8.815 1.00 0.00 H new ATOM 1005 N PRO A 68 -1.759 2.366 -12.445 1.00 0.00 N ATOM 1006 CA PRO A 68 -1.575 3.329 -13.535 1.00 0.00 C ATOM 1007 C PRO A 68 -2.426 4.581 -13.354 1.00 0.00 C ATOM 1008 O PRO A 68 -2.430 5.468 -14.205 1.00 0.00 O ATOM 1009 CB PRO A 68 -2.024 2.551 -14.775 1.00 0.00 C ATOM 1010 CG PRO A 68 -2.972 1.526 -14.255 1.00 0.00 C ATOM 1011 CD PRO A 68 -2.473 1.156 -12.886 1.00 0.00 C ATOM 0 HA PRO A 68 -0.548 3.690 -13.590 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -2.507 3.206 -15.500 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -1.177 2.087 -15.280 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -3.986 1.922 -14.207 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -3.001 0.654 -14.909 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -3.293 0.906 -12.213 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -1.813 0.289 -12.920 1.00 0.00 H new ATOM 1019 N ASN A 69 -3.146 4.644 -12.238 1.00 0.00 N ATOM 1020 CA ASN A 69 -4.002 5.788 -11.945 1.00 0.00 C ATOM 1021 C ASN A 69 -3.768 6.294 -10.525 1.00 0.00 C ATOM 1022 O ASN A 69 -3.992 5.586 -9.543 1.00 0.00 O ATOM 1023 CB ASN A 69 -5.474 5.410 -12.128 1.00 0.00 C ATOM 1024 CG ASN A 69 -6.378 6.625 -12.198 1.00 0.00 C ATOM 1025 OD1 ASN A 69 -6.012 7.653 -12.769 1.00 0.00 O ATOM 1026 ND2 ASN A 69 -7.566 6.513 -11.616 1.00 0.00 N ATOM 0 H ASN A 69 -3.154 3.917 -11.523 1.00 0.00 H new ATOM 0 HA ASN A 69 -3.749 6.587 -12.642 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -5.585 4.825 -13.041 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -5.788 4.774 -11.301 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -8.217 7.298 -11.631 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -7.828 5.642 -11.154 1.00 0.00 H new ATOM 1033 N PRO A 70 -3.305 7.548 -10.412 1.00 0.00 N ATOM 1034 CA PRO A 70 -3.031 8.177 -9.117 1.00 0.00 C ATOM 1035 C PRO A 70 -4.306 8.472 -8.335 1.00 0.00 C ATOM 1036 O PRO A 70 -4.256 8.799 -7.149 1.00 0.00 O ATOM 1037 CB PRO A 70 -2.324 9.480 -9.498 1.00 0.00 C ATOM 1038 CG PRO A 70 -2.801 9.780 -10.877 1.00 0.00 C ATOM 1039 CD PRO A 70 -3.015 8.448 -11.541 1.00 0.00 C ATOM 0 HA PRO A 70 -2.442 7.531 -8.467 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -2.577 10.284 -8.808 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -1.240 9.365 -9.470 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.725 10.357 -10.853 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -2.068 10.375 -11.423 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -3.841 8.481 -12.251 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -2.132 8.128 -12.094 1.00 0.00 H new ATOM 1047 N ALA A 71 -5.447 8.354 -9.005 1.00 0.00 N ATOM 1048 CA ALA A 71 -6.736 8.606 -8.372 1.00 0.00 C ATOM 1049 C ALA A 71 -7.296 7.335 -7.743 1.00 0.00 C ATOM 1050 O ALA A 71 -8.062 7.393 -6.782 1.00 0.00 O ATOM 1051 CB ALA A 71 -7.719 9.175 -9.383 1.00 0.00 C ATOM 0 H ALA A 71 -5.505 8.085 -9.987 1.00 0.00 H new ATOM 0 HA ALA A 71 -6.586 9.337 -7.578 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.677 9.358 -8.896 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -7.330 10.112 -9.782 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -7.856 8.464 -10.197 1.00 0.00 H new ATOM 1057 N GLN A 72 -6.910 6.188 -8.294 1.00 0.00 N ATOM 1058 CA GLN A 72 -7.376 4.903 -7.787 1.00 0.00 C ATOM 1059 C GLN A 72 -6.699 4.561 -6.464 1.00 0.00 C ATOM 1060 O GLN A 72 -5.562 4.087 -6.440 1.00 0.00 O ATOM 1061 CB GLN A 72 -7.108 3.799 -8.812 1.00 0.00 C ATOM 1062 CG GLN A 72 -7.297 2.396 -8.258 1.00 0.00 C ATOM 1063 CD GLN A 72 -6.686 1.331 -9.147 1.00 0.00 C ATOM 1064 OE1 GLN A 72 -6.631 1.481 -10.367 1.00 0.00 O ATOM 1065 NE2 GLN A 72 -6.223 0.245 -8.538 1.00 0.00 N ATOM 0 H GLN A 72 -6.276 6.123 -9.091 1.00 0.00 H new ATOM 0 HA GLN A 72 -8.450 4.977 -7.615 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -7.773 3.937 -9.664 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -6.088 3.900 -9.184 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -6.848 2.337 -7.266 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -8.362 2.197 -8.138 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -6.289 0.162 -7.524 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -5.802 -0.506 -9.085 1.00 0.00 H new ATOM 1074 N THR A 73 -7.403 4.804 -5.363 1.00 0.00 N ATOM 1075 CA THR A 73 -6.870 4.524 -4.037 1.00 0.00 C ATOM 1076 C THR A 73 -7.394 3.196 -3.502 1.00 0.00 C ATOM 1077 O THR A 73 -7.576 3.030 -2.296 1.00 0.00 O ATOM 1078 CB THR A 73 -7.227 5.642 -3.040 1.00 0.00 C ATOM 1079 OG1 THR A 73 -8.648 5.804 -2.973 1.00 0.00 O ATOM 1080 CG2 THR A 73 -6.580 6.958 -3.448 1.00 0.00 C ATOM 0 H THR A 73 -8.345 5.195 -5.364 1.00 0.00 H new ATOM 0 HA THR A 73 -5.786 4.470 -4.138 1.00 0.00 H new ATOM 0 HB THR A 73 -6.848 5.358 -2.058 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.866 6.516 -2.336 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.846 7.733 -2.729 1.00 0.00 H new ATOM 0 HG22 THR A 73 -5.497 6.840 -3.469 1.00 0.00 H new ATOM 0 HG23 THR A 73 -6.933 7.245 -4.438 1.00 0.00 H new ATOM 1088 N SER A 74 -7.635 2.253 -4.408 1.00 0.00 N ATOM 1089 CA SER A 74 -8.142 0.940 -4.027 1.00 0.00 C ATOM 1090 C SER A 74 -7.843 -0.093 -5.109 1.00 0.00 C ATOM 1091 O SER A 74 -8.200 0.090 -6.273 1.00 0.00 O ATOM 1092 CB SER A 74 -9.649 1.006 -3.771 1.00 0.00 C ATOM 1093 OG SER A 74 -10.321 1.645 -4.843 1.00 0.00 O ATOM 0 H SER A 74 -7.487 2.374 -5.410 1.00 0.00 H new ATOM 0 HA SER A 74 -7.638 0.636 -3.110 1.00 0.00 H new ATOM 0 HB2 SER A 74 -10.043 -0.002 -3.640 1.00 0.00 H new ATOM 0 HB3 SER A 74 -9.840 1.546 -2.844 1.00 0.00 H new ATOM 0 HG SER A 74 -9.899 1.392 -5.691 1.00 0.00 H new ATOM 1099 N VAL A 75 -7.185 -1.179 -4.717 1.00 0.00 N ATOM 1100 CA VAL A 75 -6.838 -2.242 -5.652 1.00 0.00 C ATOM 1101 C VAL A 75 -7.339 -3.595 -5.157 1.00 0.00 C ATOM 1102 O VAL A 75 -7.484 -3.813 -3.954 1.00 0.00 O ATOM 1103 CB VAL A 75 -5.316 -2.321 -5.873 1.00 0.00 C ATOM 1104 CG1 VAL A 75 -4.619 -2.822 -4.618 1.00 0.00 C ATOM 1105 CG2 VAL A 75 -4.996 -3.212 -7.064 1.00 0.00 C ATOM 0 H VAL A 75 -6.881 -1.346 -3.758 1.00 0.00 H new ATOM 0 HA VAL A 75 -7.323 -2.002 -6.598 1.00 0.00 H new ATOM 0 HB VAL A 75 -4.945 -1.319 -6.089 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.544 -2.871 -4.794 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.821 -2.139 -3.793 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.991 -3.815 -4.367 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -3.916 -3.256 -7.205 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.379 -4.216 -6.881 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.463 -2.803 -7.960 1.00 0.00 H new ATOM 1115 N VAL A 76 -7.601 -4.501 -6.093 1.00 0.00 N ATOM 1116 CA VAL A 76 -8.084 -5.834 -5.753 1.00 0.00 C ATOM 1117 C VAL A 76 -6.971 -6.869 -5.871 1.00 0.00 C ATOM 1118 O VAL A 76 -6.363 -7.024 -6.931 1.00 0.00 O ATOM 1119 CB VAL A 76 -9.259 -6.253 -6.656 1.00 0.00 C ATOM 1120 CG1 VAL A 76 -9.584 -7.726 -6.461 1.00 0.00 C ATOM 1121 CG2 VAL A 76 -10.479 -5.388 -6.379 1.00 0.00 C ATOM 0 H VAL A 76 -7.487 -4.336 -7.093 1.00 0.00 H new ATOM 0 HA VAL A 76 -8.428 -5.792 -4.720 1.00 0.00 H new ATOM 0 HB VAL A 76 -8.966 -6.105 -7.695 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -10.417 -8.004 -7.107 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -8.711 -8.328 -6.715 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -9.857 -7.904 -5.421 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -11.299 -5.698 -7.026 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -10.776 -5.501 -5.336 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.237 -4.344 -6.576 1.00 0.00 H new ATOM 1131 N VAL A 77 -6.710 -7.577 -4.777 1.00 0.00 N ATOM 1132 CA VAL A 77 -5.671 -8.600 -4.759 1.00 0.00 C ATOM 1133 C VAL A 77 -6.276 -9.999 -4.772 1.00 0.00 C ATOM 1134 O VAL A 77 -7.055 -10.357 -3.889 1.00 0.00 O ATOM 1135 CB VAL A 77 -4.764 -8.456 -3.522 1.00 0.00 C ATOM 1136 CG1 VAL A 77 -3.733 -9.573 -3.483 1.00 0.00 C ATOM 1137 CG2 VAL A 77 -4.087 -7.094 -3.513 1.00 0.00 C ATOM 0 H VAL A 77 -7.203 -7.461 -3.892 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.072 -8.459 -5.659 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.383 -8.534 -2.628 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.101 -9.455 -2.602 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.241 -10.536 -3.438 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -3.116 -9.530 -4.380 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.450 -7.010 -2.632 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -3.480 -6.984 -4.411 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -4.845 -6.311 -3.489 1.00 0.00 H new ATOM 1147 N GLU A 78 -5.912 -10.786 -5.779 1.00 0.00 N ATOM 1148 CA GLU A 78 -6.420 -12.147 -5.907 1.00 0.00 C ATOM 1149 C GLU A 78 -5.274 -13.147 -6.021 1.00 0.00 C ATOM 1150 O GLU A 78 -4.102 -12.775 -5.951 1.00 0.00 O ATOM 1151 CB GLU A 78 -7.335 -12.260 -7.128 1.00 0.00 C ATOM 1152 CG GLU A 78 -8.582 -11.397 -7.037 1.00 0.00 C ATOM 1153 CD GLU A 78 -9.618 -11.756 -8.085 1.00 0.00 C ATOM 1154 OE1 GLU A 78 -9.223 -12.057 -9.231 1.00 0.00 O ATOM 1155 OE2 GLU A 78 -10.823 -11.736 -7.759 1.00 0.00 O ATOM 0 H GLU A 78 -5.268 -10.505 -6.518 1.00 0.00 H new ATOM 0 HA GLU A 78 -6.993 -12.380 -5.010 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.774 -11.979 -8.019 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.632 -13.301 -7.253 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -9.022 -11.504 -6.045 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.303 -10.349 -7.151 1.00 0.00 H new ATOM 1162 N ASP A 79 -5.621 -14.417 -6.197 1.00 0.00 N ATOM 1163 CA ASP A 79 -4.622 -15.472 -6.322 1.00 0.00 C ATOM 1164 C ASP A 79 -3.846 -15.643 -5.019 1.00 0.00 C ATOM 1165 O ASP A 79 -2.620 -15.763 -5.025 1.00 0.00 O ATOM 1166 CB ASP A 79 -3.657 -15.158 -7.467 1.00 0.00 C ATOM 1167 CG ASP A 79 -4.378 -14.874 -8.770 1.00 0.00 C ATOM 1168 OD1 ASP A 79 -5.230 -13.961 -8.789 1.00 0.00 O ATOM 1169 OD2 ASP A 79 -4.091 -15.565 -9.770 1.00 0.00 O ATOM 0 H ASP A 79 -6.586 -14.741 -6.256 1.00 0.00 H new ATOM 0 HA ASP A 79 -5.141 -16.405 -6.540 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -3.046 -14.296 -7.198 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -2.978 -15.999 -7.607 1.00 0.00 H new ATOM 1174 N LEU A 80 -4.568 -15.653 -3.904 1.00 0.00 N ATOM 1175 CA LEU A 80 -3.948 -15.808 -2.593 1.00 0.00 C ATOM 1176 C LEU A 80 -4.242 -17.187 -2.011 1.00 0.00 C ATOM 1177 O LEU A 80 -4.996 -17.970 -2.592 1.00 0.00 O ATOM 1178 CB LEU A 80 -4.449 -14.722 -1.639 1.00 0.00 C ATOM 1179 CG LEU A 80 -4.366 -13.285 -2.154 1.00 0.00 C ATOM 1180 CD1 LEU A 80 -5.389 -12.406 -1.451 1.00 0.00 C ATOM 1181 CD2 LEU A 80 -2.962 -12.730 -1.963 1.00 0.00 C ATOM 0 H LEU A 80 -5.583 -15.556 -3.882 1.00 0.00 H new ATOM 0 HA LEU A 80 -2.869 -15.708 -2.714 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -5.488 -14.937 -1.389 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -3.878 -14.788 -0.713 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.592 -13.288 -3.220 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.315 -11.387 -1.830 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.391 -12.792 -1.640 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.195 -12.409 -0.378 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.922 -11.706 -2.335 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -2.707 -12.741 -0.903 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -2.250 -13.345 -2.514 1.00 0.00 H new ATOM 1193 N LEU A 81 -3.645 -17.478 -0.861 1.00 0.00 N ATOM 1194 CA LEU A 81 -3.844 -18.762 -0.199 1.00 0.00 C ATOM 1195 C LEU A 81 -4.753 -18.613 1.017 1.00 0.00 C ATOM 1196 O LEU A 81 -4.673 -17.639 1.767 1.00 0.00 O ATOM 1197 CB LEU A 81 -2.499 -19.354 0.225 1.00 0.00 C ATOM 1198 CG LEU A 81 -1.651 -19.963 -0.892 1.00 0.00 C ATOM 1199 CD1 LEU A 81 -0.214 -20.149 -0.431 1.00 0.00 C ATOM 1200 CD2 LEU A 81 -2.243 -21.290 -1.347 1.00 0.00 C ATOM 0 H LEU A 81 -3.019 -16.842 -0.367 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.324 -19.437 -0.908 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.917 -18.570 0.710 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -2.684 -20.124 0.974 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.653 -19.277 -1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.374 -20.583 -1.239 1.00 0.00 H new ATOM 0 HD12 LEU A 81 0.207 -19.183 -0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.192 -20.815 0.432 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -1.627 -21.710 -2.142 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.272 -21.983 -0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -3.255 -21.129 -1.719 1.00 0.00 H new ATOM 1212 N PRO A 82 -5.637 -19.601 1.220 1.00 0.00 N ATOM 1213 CA PRO A 82 -6.576 -19.603 2.346 1.00 0.00 C ATOM 1214 C PRO A 82 -5.878 -19.821 3.683 1.00 0.00 C ATOM 1215 O PRO A 82 -4.810 -20.429 3.744 1.00 0.00 O ATOM 1216 CB PRO A 82 -7.505 -20.778 2.030 1.00 0.00 C ATOM 1217 CG PRO A 82 -6.692 -21.684 1.172 1.00 0.00 C ATOM 1218 CD PRO A 82 -5.788 -20.791 0.367 1.00 0.00 C ATOM 0 HA PRO A 82 -7.092 -18.648 2.448 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -7.830 -21.281 2.940 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -8.404 -20.444 1.512 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -6.113 -22.381 1.779 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -7.330 -22.282 0.521 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -4.828 -21.266 0.167 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -6.227 -20.540 -0.599 1.00 0.00 H new ATOM 1226 N ASN A 83 -6.487 -19.321 4.753 1.00 0.00 N ATOM 1227 CA ASN A 83 -5.923 -19.462 6.090 1.00 0.00 C ATOM 1228 C ASN A 83 -4.431 -19.142 6.087 1.00 0.00 C ATOM 1229 O ASN A 83 -3.621 -19.900 6.622 1.00 0.00 O ATOM 1230 CB ASN A 83 -6.151 -20.881 6.616 1.00 0.00 C ATOM 1231 CG ASN A 83 -7.604 -21.144 6.960 1.00 0.00 C ATOM 1232 OD1 ASN A 83 -7.914 -21.693 8.017 1.00 0.00 O ATOM 1233 ND2 ASN A 83 -8.504 -20.752 6.065 1.00 0.00 N ATOM 0 H ASN A 83 -7.372 -18.814 4.720 1.00 0.00 H new ATOM 0 HA ASN A 83 -6.428 -18.753 6.747 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.822 -21.601 5.866 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -5.536 -21.040 7.502 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -9.497 -20.902 6.241 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -8.202 -20.301 5.202 1.00 0.00 H new ATOM 1240 N HIS A 84 -4.075 -18.014 5.482 1.00 0.00 N ATOM 1241 CA HIS A 84 -2.680 -17.592 5.410 1.00 0.00 C ATOM 1242 C HIS A 84 -2.560 -16.081 5.581 1.00 0.00 C ATOM 1243 O HIS A 84 -3.286 -15.315 4.946 1.00 0.00 O ATOM 1244 CB HIS A 84 -2.065 -18.017 4.077 1.00 0.00 C ATOM 1245 CG HIS A 84 -1.520 -19.413 4.086 1.00 0.00 C ATOM 1246 ND1 HIS A 84 -2.323 -20.533 4.129 1.00 0.00 N ATOM 1247 CD2 HIS A 84 -0.245 -19.866 4.055 1.00 0.00 C ATOM 1248 CE1 HIS A 84 -1.565 -21.615 4.126 1.00 0.00 C ATOM 1249 NE2 HIS A 84 -0.300 -21.238 4.082 1.00 0.00 N ATOM 0 H HIS A 84 -4.732 -17.375 5.034 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.137 -18.076 6.222 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -2.820 -17.936 3.295 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -1.264 -17.325 3.819 1.00 0.00 H new ATOM 0 HD1 HIS A 84 -3.343 -20.527 4.159 1.00 0.00 H new ATOM 0 HD2 HIS A 84 0.649 -19.261 4.016 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -1.920 -22.635 4.155 1.00 0.00 H new ATOM 1257 N SER A 85 -1.640 -15.659 6.442 1.00 0.00 N ATOM 1258 CA SER A 85 -1.428 -14.239 6.699 1.00 0.00 C ATOM 1259 C SER A 85 -0.631 -13.595 5.569 1.00 0.00 C ATOM 1260 O SER A 85 0.185 -14.249 4.919 1.00 0.00 O ATOM 1261 CB SER A 85 -0.697 -14.044 8.029 1.00 0.00 C ATOM 1262 OG SER A 85 -1.515 -14.427 9.121 1.00 0.00 O ATOM 0 H SER A 85 -1.029 -16.280 6.973 1.00 0.00 H new ATOM 0 HA SER A 85 -2.403 -13.755 6.754 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.220 -14.633 8.033 1.00 0.00 H new ATOM 0 HB3 SER A 85 -0.405 -12.999 8.138 1.00 0.00 H new ATOM 0 HG SER A 85 -1.025 -14.295 9.959 1.00 0.00 H new ATOM 1268 N TYR A 86 -0.873 -12.309 5.341 1.00 0.00 N ATOM 1269 CA TYR A 86 -0.181 -11.576 4.288 1.00 0.00 C ATOM 1270 C TYR A 86 0.053 -10.125 4.698 1.00 0.00 C ATOM 1271 O TYR A 86 -0.873 -9.427 5.110 1.00 0.00 O ATOM 1272 CB TYR A 86 -0.986 -11.627 2.988 1.00 0.00 C ATOM 1273 CG TYR A 86 -0.812 -12.916 2.218 1.00 0.00 C ATOM 1274 CD1 TYR A 86 0.230 -13.072 1.312 1.00 0.00 C ATOM 1275 CD2 TYR A 86 -1.689 -13.979 2.398 1.00 0.00 C ATOM 1276 CE1 TYR A 86 0.392 -14.249 0.606 1.00 0.00 C ATOM 1277 CE2 TYR A 86 -1.534 -15.159 1.697 1.00 0.00 C ATOM 1278 CZ TYR A 86 -0.492 -15.289 0.802 1.00 0.00 C ATOM 1279 OH TYR A 86 -0.333 -16.463 0.101 1.00 0.00 O ATOM 0 H TYR A 86 -1.543 -11.753 5.871 1.00 0.00 H new ATOM 0 HA TYR A 86 0.787 -12.050 4.127 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -2.043 -11.492 3.219 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -0.689 -10.792 2.354 1.00 0.00 H new ATOM 0 HD1 TYR A 86 0.925 -12.260 1.157 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -2.506 -13.881 3.098 1.00 0.00 H new ATOM 0 HE1 TYR A 86 1.207 -14.354 -0.095 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -2.225 -15.975 1.849 1.00 0.00 H new ATOM 0 HH TYR A 86 0.617 -16.602 -0.093 1.00 0.00 H new ATOM 1289 N VAL A 87 1.300 -9.678 4.580 1.00 0.00 N ATOM 1290 CA VAL A 87 1.658 -8.310 4.937 1.00 0.00 C ATOM 1291 C VAL A 87 1.471 -7.367 3.753 1.00 0.00 C ATOM 1292 O VAL A 87 2.286 -7.344 2.830 1.00 0.00 O ATOM 1293 CB VAL A 87 3.115 -8.221 5.426 1.00 0.00 C ATOM 1294 CG1 VAL A 87 4.072 -8.691 4.341 1.00 0.00 C ATOM 1295 CG2 VAL A 87 3.445 -6.801 5.860 1.00 0.00 C ATOM 0 H VAL A 87 2.078 -10.243 4.240 1.00 0.00 H new ATOM 0 HA VAL A 87 0.993 -8.009 5.746 1.00 0.00 H new ATOM 0 HB VAL A 87 3.231 -8.877 6.289 1.00 0.00 H new ATOM 0 HG11 VAL A 87 5.097 -8.621 4.705 1.00 0.00 H new ATOM 0 HG12 VAL A 87 3.849 -9.726 4.082 1.00 0.00 H new ATOM 0 HG13 VAL A 87 3.957 -8.063 3.457 1.00 0.00 H new ATOM 0 HG21 VAL A 87 4.479 -6.756 6.203 1.00 0.00 H new ATOM 0 HG22 VAL A 87 3.312 -6.123 5.017 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.781 -6.505 6.672 1.00 0.00 H new ATOM 1305 N PHE A 88 0.394 -6.590 3.787 1.00 0.00 N ATOM 1306 CA PHE A 88 0.100 -5.644 2.716 1.00 0.00 C ATOM 1307 C PHE A 88 0.736 -4.287 2.999 1.00 0.00 C ATOM 1308 O PHE A 88 0.426 -3.641 4.000 1.00 0.00 O ATOM 1309 CB PHE A 88 -1.413 -5.486 2.548 1.00 0.00 C ATOM 1310 CG PHE A 88 -2.055 -6.620 1.801 1.00 0.00 C ATOM 1311 CD1 PHE A 88 -2.227 -7.855 2.405 1.00 0.00 C ATOM 1312 CD2 PHE A 88 -2.487 -6.451 0.496 1.00 0.00 C ATOM 1313 CE1 PHE A 88 -2.817 -8.901 1.720 1.00 0.00 C ATOM 1314 CE2 PHE A 88 -3.078 -7.493 -0.195 1.00 0.00 C ATOM 1315 CZ PHE A 88 -3.244 -8.719 0.419 1.00 0.00 C ATOM 0 H PHE A 88 -0.290 -6.596 4.544 1.00 0.00 H new ATOM 0 HA PHE A 88 0.522 -6.037 1.791 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -1.873 -5.403 3.533 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -1.617 -4.553 2.022 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.896 -8.002 3.423 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -2.361 -5.494 0.012 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -2.944 -9.859 2.202 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -3.409 -7.348 -1.213 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.707 -9.534 -0.117 1.00 0.00 H new ATOM 1325 N ARG A 89 1.628 -3.861 2.110 1.00 0.00 N ATOM 1326 CA ARG A 89 2.310 -2.582 2.265 1.00 0.00 C ATOM 1327 C ARG A 89 1.973 -1.643 1.110 1.00 0.00 C ATOM 1328 O ARG A 89 2.420 -1.846 -0.019 1.00 0.00 O ATOM 1329 CB ARG A 89 3.823 -2.792 2.340 1.00 0.00 C ATOM 1330 CG ARG A 89 4.269 -3.581 3.561 1.00 0.00 C ATOM 1331 CD ARG A 89 5.782 -3.724 3.610 1.00 0.00 C ATOM 1332 NE ARG A 89 6.202 -4.774 4.534 1.00 0.00 N ATOM 1333 CZ ARG A 89 7.450 -5.222 4.618 1.00 0.00 C ATOM 1334 NH1 ARG A 89 8.394 -4.715 3.838 1.00 0.00 N ATOM 1335 NH2 ARG A 89 7.755 -6.180 5.485 1.00 0.00 N ATOM 0 H ARG A 89 1.895 -4.383 1.275 1.00 0.00 H new ATOM 0 HA ARG A 89 1.967 -2.126 3.194 1.00 0.00 H new ATOM 0 HB2 ARG A 89 4.154 -3.312 1.441 1.00 0.00 H new ATOM 0 HB3 ARG A 89 4.316 -1.820 2.346 1.00 0.00 H new ATOM 0 HG2 ARG A 89 3.920 -3.082 4.465 1.00 0.00 H new ATOM 0 HG3 ARG A 89 3.809 -4.569 3.545 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.158 -3.948 2.612 1.00 0.00 H new ATOM 0 HD3 ARG A 89 6.226 -2.776 3.912 1.00 0.00 H new ATOM 0 HE ARG A 89 5.499 -5.186 5.148 1.00 0.00 H new ATOM 0 HH11 ARG A 89 8.163 -3.979 3.171 1.00 0.00 H new ATOM 0 HH12 ARG A 89 9.351 -5.061 3.905 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.031 -6.572 6.087 1.00 0.00 H new ATOM 0 HH22 ARG A 89 8.713 -6.524 5.549 1.00 0.00 H new ATOM 1349 N VAL A 90 1.182 -0.616 1.401 1.00 0.00 N ATOM 1350 CA VAL A 90 0.785 0.355 0.388 1.00 0.00 C ATOM 1351 C VAL A 90 1.666 1.598 0.442 1.00 0.00 C ATOM 1352 O VAL A 90 2.179 1.962 1.501 1.00 0.00 O ATOM 1353 CB VAL A 90 -0.687 0.775 0.558 1.00 0.00 C ATOM 1354 CG1 VAL A 90 -1.083 1.781 -0.511 1.00 0.00 C ATOM 1355 CG2 VAL A 90 -1.596 -0.444 0.517 1.00 0.00 C ATOM 0 H VAL A 90 0.803 -0.434 2.330 1.00 0.00 H new ATOM 0 HA VAL A 90 0.907 -0.131 -0.580 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.800 1.253 1.531 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -2.126 2.066 -0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.452 2.666 -0.430 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.955 1.334 -1.497 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.632 -0.129 0.639 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.481 -0.952 -0.441 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -1.327 -1.126 1.324 1.00 0.00 H new ATOM 1365 N ARG A 91 1.838 2.245 -0.706 1.00 0.00 N ATOM 1366 CA ARG A 91 2.658 3.448 -0.789 1.00 0.00 C ATOM 1367 C ARG A 91 2.292 4.271 -2.020 1.00 0.00 C ATOM 1368 O ARG A 91 1.650 3.773 -2.944 1.00 0.00 O ATOM 1369 CB ARG A 91 4.142 3.077 -0.833 1.00 0.00 C ATOM 1370 CG ARG A 91 4.489 2.083 -1.929 1.00 0.00 C ATOM 1371 CD ARG A 91 5.985 1.819 -1.989 1.00 0.00 C ATOM 1372 NE ARG A 91 6.406 0.829 -1.001 1.00 0.00 N ATOM 1373 CZ ARG A 91 7.657 0.705 -0.572 1.00 0.00 C ATOM 1374 NH1 ARG A 91 8.605 1.505 -1.042 1.00 0.00 N ATOM 1375 NH2 ARG A 91 7.963 -0.220 0.329 1.00 0.00 N ATOM 0 H ARG A 91 1.421 1.957 -1.591 1.00 0.00 H new ATOM 0 HA ARG A 91 2.467 4.050 0.099 1.00 0.00 H new ATOM 0 HB2 ARG A 91 4.730 3.983 -0.977 1.00 0.00 H new ATOM 0 HB3 ARG A 91 4.432 2.658 0.131 1.00 0.00 H new ATOM 0 HG2 ARG A 91 3.960 1.146 -1.753 1.00 0.00 H new ATOM 0 HG3 ARG A 91 4.147 2.466 -2.891 1.00 0.00 H new ATOM 0 HD2 ARG A 91 6.252 1.471 -2.987 1.00 0.00 H new ATOM 0 HD3 ARG A 91 6.525 2.751 -1.821 1.00 0.00 H new ATOM 0 HE ARG A 91 5.701 0.198 -0.620 1.00 0.00 H new ATOM 0 HH11 ARG A 91 8.374 2.217 -1.734 1.00 0.00 H new ATOM 0 HH12 ARG A 91 9.565 1.408 -0.711 1.00 0.00 H new ATOM 0 HH21 ARG A 91 7.237 -0.837 0.693 1.00 0.00 H new ATOM 0 HH22 ARG A 91 8.924 -0.314 0.657 1.00 0.00 H new ATOM 1389 N ALA A 92 2.704 5.535 -2.025 1.00 0.00 N ATOM 1390 CA ALA A 92 2.421 6.427 -3.142 1.00 0.00 C ATOM 1391 C ALA A 92 3.710 6.916 -3.794 1.00 0.00 C ATOM 1392 O ALA A 92 4.761 6.960 -3.156 1.00 0.00 O ATOM 1393 CB ALA A 92 1.582 7.607 -2.675 1.00 0.00 C ATOM 0 H ALA A 92 3.235 5.964 -1.267 1.00 0.00 H new ATOM 0 HA ALA A 92 1.857 5.868 -3.888 1.00 0.00 H new ATOM 0 HB1 ALA A 92 1.378 8.265 -3.519 1.00 0.00 H new ATOM 0 HB2 ALA A 92 0.641 7.244 -2.263 1.00 0.00 H new ATOM 0 HB3 ALA A 92 2.125 8.159 -1.908 1.00 0.00 H new ATOM 1399 N GLN A 93 3.621 7.281 -5.069 1.00 0.00 N ATOM 1400 CA GLN A 93 4.781 7.765 -5.807 1.00 0.00 C ATOM 1401 C GLN A 93 4.551 9.186 -6.312 1.00 0.00 C ATOM 1402 O GLN A 93 3.427 9.563 -6.645 1.00 0.00 O ATOM 1403 CB GLN A 93 5.087 6.837 -6.984 1.00 0.00 C ATOM 1404 CG GLN A 93 6.252 7.306 -7.842 1.00 0.00 C ATOM 1405 CD GLN A 93 6.830 6.196 -8.697 1.00 0.00 C ATOM 1406 OE1 GLN A 93 8.048 6.044 -8.796 1.00 0.00 O ATOM 1407 NE2 GLN A 93 5.958 5.413 -9.321 1.00 0.00 N ATOM 0 H GLN A 93 2.758 7.251 -5.612 1.00 0.00 H new ATOM 0 HA GLN A 93 5.634 7.773 -5.128 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.306 5.840 -6.602 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.198 6.751 -7.609 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.919 8.120 -8.486 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.034 7.708 -7.198 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.957 5.575 -9.211 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.289 4.649 -9.911 1.00 0.00 H new ATOM 1416 N SER A 94 5.623 9.971 -6.366 1.00 0.00 N ATOM 1417 CA SER A 94 5.537 11.352 -6.826 1.00 0.00 C ATOM 1418 C SER A 94 6.773 11.732 -7.636 1.00 0.00 C ATOM 1419 O SER A 94 7.701 10.937 -7.781 1.00 0.00 O ATOM 1420 CB SER A 94 5.382 12.299 -5.635 1.00 0.00 C ATOM 1421 OG SER A 94 6.584 12.384 -4.890 1.00 0.00 O ATOM 0 H SER A 94 6.561 9.674 -6.097 1.00 0.00 H new ATOM 0 HA SER A 94 4.661 11.442 -7.469 1.00 0.00 H new ATOM 0 HB2 SER A 94 5.099 13.290 -5.989 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.575 11.949 -4.991 1.00 0.00 H new ATOM 0 HG SER A 94 6.662 13.278 -4.496 1.00 0.00 H new ATOM 1427 N GLN A 95 6.776 12.954 -8.160 1.00 0.00 N ATOM 1428 CA GLN A 95 7.896 13.440 -8.956 1.00 0.00 C ATOM 1429 C GLN A 95 9.226 13.071 -8.306 1.00 0.00 C ATOM 1430 O GLN A 95 10.162 12.648 -8.984 1.00 0.00 O ATOM 1431 CB GLN A 95 7.804 14.957 -9.131 1.00 0.00 C ATOM 1432 CG GLN A 95 8.944 15.545 -9.947 1.00 0.00 C ATOM 1433 CD GLN A 95 8.549 16.819 -10.667 1.00 0.00 C ATOM 1434 OE1 GLN A 95 9.105 17.888 -10.412 1.00 0.00 O ATOM 1435 NE2 GLN A 95 7.585 16.713 -11.574 1.00 0.00 N ATOM 0 H GLN A 95 6.016 13.625 -8.047 1.00 0.00 H new ATOM 0 HA GLN A 95 7.847 12.965 -9.936 1.00 0.00 H new ATOM 0 HB2 GLN A 95 6.858 15.202 -9.614 1.00 0.00 H new ATOM 0 HB3 GLN A 95 7.791 15.428 -8.148 1.00 0.00 H new ATOM 0 HG2 GLN A 95 9.788 15.751 -9.289 1.00 0.00 H new ATOM 0 HG3 GLN A 95 9.281 14.809 -10.677 1.00 0.00 H new ATOM 0 HE21 GLN A 95 7.151 15.807 -11.754 1.00 0.00 H new ATOM 0 HE22 GLN A 95 7.278 17.537 -12.091 1.00 0.00 H new ATOM 1444 N GLU A 96 9.301 13.236 -6.989 1.00 0.00 N ATOM 1445 CA GLU A 96 10.517 12.921 -6.249 1.00 0.00 C ATOM 1446 C GLU A 96 10.808 11.423 -6.291 1.00 0.00 C ATOM 1447 O GLU A 96 11.872 10.998 -6.739 1.00 0.00 O ATOM 1448 CB GLU A 96 10.392 13.386 -4.797 1.00 0.00 C ATOM 1449 CG GLU A 96 10.660 14.870 -4.608 1.00 0.00 C ATOM 1450 CD GLU A 96 12.095 15.249 -4.919 1.00 0.00 C ATOM 1451 OE1 GLU A 96 12.966 15.038 -4.050 1.00 0.00 O ATOM 1452 OE2 GLU A 96 12.346 15.755 -6.033 1.00 0.00 O ATOM 0 H GLU A 96 8.535 13.586 -6.413 1.00 0.00 H new ATOM 0 HA GLU A 96 11.346 13.448 -6.722 1.00 0.00 H new ATOM 0 HB2 GLU A 96 9.389 13.158 -4.436 1.00 0.00 H new ATOM 0 HB3 GLU A 96 11.089 12.818 -4.181 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.990 15.441 -5.251 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.429 15.149 -3.580 1.00 0.00 H new ATOM 1459 N GLY A 97 9.852 10.627 -5.821 1.00 0.00 N ATOM 1460 CA GLY A 97 10.024 9.186 -5.813 1.00 0.00 C ATOM 1461 C GLY A 97 9.036 8.490 -4.898 1.00 0.00 C ATOM 1462 O GLY A 97 8.023 9.072 -4.509 1.00 0.00 O ATOM 0 H GLY A 97 8.962 10.954 -5.446 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.907 8.803 -6.827 1.00 0.00 H new ATOM 0 HA3 GLY A 97 11.039 8.946 -5.497 1.00 0.00 H new ATOM 1466 N TRP A 98 9.329 7.241 -4.555 1.00 0.00 N ATOM 1467 CA TRP A 98 8.457 6.464 -3.681 1.00 0.00 C ATOM 1468 C TRP A 98 8.740 6.773 -2.215 1.00 0.00 C ATOM 1469 O TRP A 98 9.841 6.534 -1.722 1.00 0.00 O ATOM 1470 CB TRP A 98 8.640 4.968 -3.944 1.00 0.00 C ATOM 1471 CG TRP A 98 8.115 4.531 -5.279 1.00 0.00 C ATOM 1472 CD1 TRP A 98 8.835 4.363 -6.427 1.00 0.00 C ATOM 1473 CD2 TRP A 98 6.759 4.209 -5.603 1.00 0.00 C ATOM 1474 NE1 TRP A 98 8.008 3.956 -7.445 1.00 0.00 N ATOM 1475 CE2 TRP A 98 6.729 3.853 -6.965 1.00 0.00 C ATOM 1476 CE3 TRP A 98 5.566 4.184 -4.874 1.00 0.00 C ATOM 1477 CZ2 TRP A 98 5.554 3.478 -7.611 1.00 0.00 C ATOM 1478 CZ3 TRP A 98 4.401 3.812 -5.517 1.00 0.00 C ATOM 1479 CH2 TRP A 98 4.401 3.463 -6.874 1.00 0.00 C ATOM 0 H TRP A 98 10.163 6.745 -4.868 1.00 0.00 H new ATOM 0 HA TRP A 98 7.425 6.741 -3.899 1.00 0.00 H new ATOM 0 HB2 TRP A 98 9.700 4.722 -3.880 1.00 0.00 H new ATOM 0 HB3 TRP A 98 8.134 4.404 -3.160 1.00 0.00 H new ATOM 0 HD1 TRP A 98 9.898 4.526 -6.521 1.00 0.00 H new ATOM 0 HE1 TRP A 98 8.299 3.762 -8.403 1.00 0.00 H new ATOM 0 HE3 TRP A 98 5.555 4.451 -3.827 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 5.553 3.208 -8.657 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 3.474 3.790 -4.964 1.00 0.00 H new ATOM 0 HH2 TRP A 98 3.473 3.177 -7.347 1.00 0.00 H new ATOM 1490 N GLY A 99 7.737 7.306 -1.523 1.00 0.00 N ATOM 1491 CA GLY A 99 7.899 7.639 -0.120 1.00 0.00 C ATOM 1492 C GLY A 99 7.832 6.419 0.777 1.00 0.00 C ATOM 1493 O GLY A 99 8.371 5.364 0.442 1.00 0.00 O ATOM 0 H GLY A 99 6.816 7.513 -1.909 1.00 0.00 H new ATOM 0 HA2 GLY A 99 8.857 8.139 0.023 1.00 0.00 H new ATOM 0 HA3 GLY A 99 7.123 8.346 0.174 1.00 0.00 H new ATOM 1497 N ARG A 100 7.170 6.562 1.920 1.00 0.00 N ATOM 1498 CA ARG A 100 7.038 5.464 2.870 1.00 0.00 C ATOM 1499 C ARG A 100 5.900 4.530 2.466 1.00 0.00 C ATOM 1500 O ARG A 100 5.295 4.697 1.407 1.00 0.00 O ATOM 1501 CB ARG A 100 6.791 6.006 4.279 1.00 0.00 C ATOM 1502 CG ARG A 100 8.005 6.684 4.892 1.00 0.00 C ATOM 1503 CD ARG A 100 8.013 6.549 6.406 1.00 0.00 C ATOM 1504 NE ARG A 100 9.123 7.277 7.015 1.00 0.00 N ATOM 1505 CZ ARG A 100 10.390 6.887 6.934 1.00 0.00 C ATOM 1506 NH1 ARG A 100 10.706 5.782 6.273 1.00 0.00 N ATOM 1507 NH2 ARG A 100 11.345 7.603 7.514 1.00 0.00 N ATOM 0 H ARG A 100 6.716 7.428 2.211 1.00 0.00 H new ATOM 0 HA ARG A 100 7.970 4.898 2.864 1.00 0.00 H new ATOM 0 HB2 ARG A 100 5.966 6.718 4.246 1.00 0.00 H new ATOM 0 HB3 ARG A 100 6.479 5.186 4.925 1.00 0.00 H new ATOM 0 HG2 ARG A 100 8.914 6.245 4.482 1.00 0.00 H new ATOM 0 HG3 ARG A 100 8.010 7.739 4.620 1.00 0.00 H new ATOM 0 HD2 ARG A 100 7.071 6.922 6.808 1.00 0.00 H new ATOM 0 HD3 ARG A 100 8.080 5.495 6.676 1.00 0.00 H new ATOM 0 HE ARG A 100 8.914 8.132 7.531 1.00 0.00 H new ATOM 0 HH11 ARG A 100 9.975 5.229 5.825 1.00 0.00 H new ATOM 0 HH12 ARG A 100 11.680 5.485 6.212 1.00 0.00 H new ATOM 0 HH21 ARG A 100 11.106 8.454 8.023 1.00 0.00 H new ATOM 0 HH22 ARG A 100 12.318 7.302 7.451 1.00 0.00 H new ATOM 1521 N GLU A 101 5.616 3.549 3.316 1.00 0.00 N ATOM 1522 CA GLU A 101 4.553 2.589 3.046 1.00 0.00 C ATOM 1523 C GLU A 101 3.951 2.063 4.346 1.00 0.00 C ATOM 1524 O GLU A 101 4.673 1.651 5.254 1.00 0.00 O ATOM 1525 CB GLU A 101 5.087 1.423 2.211 1.00 0.00 C ATOM 1526 CG GLU A 101 5.879 0.408 3.019 1.00 0.00 C ATOM 1527 CD GLU A 101 6.902 1.058 3.930 1.00 0.00 C ATOM 1528 OE1 GLU A 101 7.683 1.900 3.439 1.00 0.00 O ATOM 1529 OE2 GLU A 101 6.921 0.726 5.133 1.00 0.00 O ATOM 0 H GLU A 101 6.107 3.398 4.197 1.00 0.00 H new ATOM 0 HA GLU A 101 3.772 3.101 2.484 1.00 0.00 H new ATOM 0 HB2 GLU A 101 4.249 0.918 1.730 1.00 0.00 H new ATOM 0 HB3 GLU A 101 5.721 1.817 1.416 1.00 0.00 H new ATOM 0 HG2 GLU A 101 5.192 -0.189 3.618 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.386 -0.276 2.339 1.00 0.00 H new ATOM 1536 N ARG A 102 2.625 2.082 4.427 1.00 0.00 N ATOM 1537 CA ARG A 102 1.925 1.610 5.616 1.00 0.00 C ATOM 1538 C ARG A 102 1.765 0.093 5.586 1.00 0.00 C ATOM 1539 O ARG A 102 1.382 -0.479 4.566 1.00 0.00 O ATOM 1540 CB ARG A 102 0.553 2.277 5.725 1.00 0.00 C ATOM 1541 CG ARG A 102 -0.334 1.672 6.802 1.00 0.00 C ATOM 1542 CD ARG A 102 -0.079 2.311 8.158 1.00 0.00 C ATOM 1543 NE ARG A 102 -0.495 1.445 9.258 1.00 0.00 N ATOM 1544 CZ ARG A 102 -0.129 1.634 10.520 1.00 0.00 C ATOM 1545 NH1 ARG A 102 0.656 2.654 10.841 1.00 0.00 N ATOM 1546 NH2 ARG A 102 -0.548 0.803 11.466 1.00 0.00 N ATOM 0 H ARG A 102 2.013 2.419 3.684 1.00 0.00 H new ATOM 0 HA ARG A 102 2.521 1.878 6.488 1.00 0.00 H new ATOM 0 HB2 ARG A 102 0.690 3.338 5.932 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.045 2.203 4.764 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -1.381 1.803 6.528 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -0.152 0.599 6.864 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.982 2.539 8.258 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -0.615 3.258 8.219 1.00 0.00 H new ATOM 0 HE ARG A 102 -1.100 0.652 9.045 1.00 0.00 H new ATOM 0 HH11 ARG A 102 0.980 3.296 10.117 1.00 0.00 H new ATOM 0 HH12 ARG A 102 0.936 2.797 11.812 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -1.152 0.018 11.224 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -0.266 0.950 12.435 1.00 0.00 H new ATOM 1560 N GLU A 103 2.061 -0.551 6.710 1.00 0.00 N ATOM 1561 CA GLU A 103 1.950 -2.002 6.811 1.00 0.00 C ATOM 1562 C GLU A 103 0.546 -2.412 7.244 1.00 0.00 C ATOM 1563 O GLU A 103 -0.068 -1.764 8.091 1.00 0.00 O ATOM 1564 CB GLU A 103 2.981 -2.547 7.802 1.00 0.00 C ATOM 1565 CG GLU A 103 3.450 -3.956 7.480 1.00 0.00 C ATOM 1566 CD GLU A 103 4.326 -4.542 8.570 1.00 0.00 C ATOM 1567 OE1 GLU A 103 4.244 -4.061 9.719 1.00 0.00 O ATOM 1568 OE2 GLU A 103 5.093 -5.482 8.273 1.00 0.00 O ATOM 0 H GLU A 103 2.379 -0.092 7.563 1.00 0.00 H new ATOM 0 HA GLU A 103 2.145 -2.425 5.825 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.844 -1.881 7.819 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.551 -2.536 8.803 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.582 -4.599 7.331 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.003 -3.945 6.541 1.00 0.00 H new ATOM 1575 N GLY A 104 0.043 -3.493 6.655 1.00 0.00 N ATOM 1576 CA GLY A 104 -1.285 -3.971 6.992 1.00 0.00 C ATOM 1577 C GLY A 104 -1.438 -5.462 6.769 1.00 0.00 C ATOM 1578 O GLY A 104 -1.759 -5.903 5.665 1.00 0.00 O ATOM 0 H GLY A 104 0.532 -4.046 5.951 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -1.497 -3.739 8.036 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -2.023 -3.439 6.391 1.00 0.00 H new ATOM 1582 N VAL A 105 -1.207 -6.243 7.820 1.00 0.00 N ATOM 1583 CA VAL A 105 -1.320 -7.694 7.734 1.00 0.00 C ATOM 1584 C VAL A 105 -2.780 -8.132 7.727 1.00 0.00 C ATOM 1585 O VAL A 105 -3.613 -7.562 8.433 1.00 0.00 O ATOM 1586 CB VAL A 105 -0.595 -8.384 8.905 1.00 0.00 C ATOM 1587 CG1 VAL A 105 -1.068 -7.817 10.235 1.00 0.00 C ATOM 1588 CG2 VAL A 105 -0.809 -9.889 8.851 1.00 0.00 C ATOM 0 H VAL A 105 -0.940 -5.895 8.741 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.849 -7.993 6.798 1.00 0.00 H new ATOM 0 HB VAL A 105 0.473 -8.188 8.814 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.545 -8.317 11.050 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -0.858 -6.748 10.270 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.141 -7.979 10.339 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -0.290 -10.360 9.685 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.875 -10.108 8.917 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -0.416 -10.279 7.912 1.00 0.00 H new ATOM 1598 N ILE A 106 -3.084 -9.146 6.925 1.00 0.00 N ATOM 1599 CA ILE A 106 -4.444 -9.661 6.827 1.00 0.00 C ATOM 1600 C ILE A 106 -4.479 -11.168 7.057 1.00 0.00 C ATOM 1601 O ILE A 106 -3.524 -11.879 6.740 1.00 0.00 O ATOM 1602 CB ILE A 106 -5.067 -9.348 5.454 1.00 0.00 C ATOM 1603 CG1 ILE A 106 -6.536 -9.775 5.427 1.00 0.00 C ATOM 1604 CG2 ILE A 106 -4.288 -10.044 4.347 1.00 0.00 C ATOM 1605 CD1 ILE A 106 -7.440 -8.883 6.250 1.00 0.00 C ATOM 0 H ILE A 106 -2.407 -9.628 6.333 1.00 0.00 H new ATOM 0 HA ILE A 106 -5.026 -9.164 7.603 1.00 0.00 H new ATOM 0 HB ILE A 106 -5.017 -8.272 5.286 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -6.886 -9.780 4.395 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.615 -10.798 5.795 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.741 -9.813 3.383 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.255 -9.697 4.355 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.310 -11.122 4.509 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -8.466 -9.245 6.185 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -7.116 -8.897 7.291 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -7.390 -7.863 5.868 1.00 0.00 H new ATOM 1617 N THR A 107 -5.587 -11.652 7.608 1.00 0.00 N ATOM 1618 CA THR A 107 -5.748 -13.075 7.880 1.00 0.00 C ATOM 1619 C THR A 107 -6.949 -13.645 7.134 1.00 0.00 C ATOM 1620 O THR A 107 -8.096 -13.330 7.453 1.00 0.00 O ATOM 1621 CB THR A 107 -5.920 -13.343 9.387 1.00 0.00 C ATOM 1622 OG1 THR A 107 -4.711 -13.019 10.083 1.00 0.00 O ATOM 1623 CG2 THR A 107 -6.282 -14.799 9.640 1.00 0.00 C ATOM 0 H THR A 107 -6.387 -11.079 7.875 1.00 0.00 H new ATOM 0 HA THR A 107 -4.840 -13.568 7.532 1.00 0.00 H new ATOM 0 HB THR A 107 -6.731 -12.714 9.755 1.00 0.00 H new ATOM 0 HG1 THR A 107 -4.829 -13.190 11.041 1.00 0.00 H new ATOM 0 HG21 THR A 107 -6.398 -14.964 10.711 1.00 0.00 H new ATOM 0 HG22 THR A 107 -7.218 -15.035 9.133 1.00 0.00 H new ATOM 0 HG23 THR A 107 -5.490 -15.443 9.258 1.00 0.00 H new ATOM 1631 N ILE A 108 -6.678 -14.485 6.141 1.00 0.00 N ATOM 1632 CA ILE A 108 -7.738 -15.100 5.351 1.00 0.00 C ATOM 1633 C ILE A 108 -8.598 -16.022 6.209 1.00 0.00 C ATOM 1634 O ILE A 108 -8.132 -17.057 6.685 1.00 0.00 O ATOM 1635 CB ILE A 108 -7.164 -15.904 4.169 1.00 0.00 C ATOM 1636 CG1 ILE A 108 -6.280 -15.011 3.297 1.00 0.00 C ATOM 1637 CG2 ILE A 108 -8.290 -16.511 3.345 1.00 0.00 C ATOM 1638 CD1 ILE A 108 -7.054 -13.971 2.518 1.00 0.00 C ATOM 0 H ILE A 108 -5.734 -14.755 5.864 1.00 0.00 H new ATOM 0 HA ILE A 108 -8.354 -14.289 4.963 1.00 0.00 H new ATOM 0 HB ILE A 108 -6.551 -16.714 4.564 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -5.548 -14.509 3.930 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -5.723 -15.636 2.599 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -7.869 -17.076 2.514 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -8.882 -17.177 3.973 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -8.927 -15.716 2.957 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -6.363 -13.374 1.922 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -7.767 -14.466 1.859 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -7.590 -13.322 3.211 1.00 0.00 H new ATOM 1650 N GLU A 109 -9.857 -15.639 6.400 1.00 0.00 N ATOM 1651 CA GLU A 109 -10.783 -16.433 7.200 1.00 0.00 C ATOM 1652 C GLU A 109 -11.943 -16.939 6.347 1.00 0.00 C ATOM 1653 O GLU A 109 -12.785 -16.160 5.900 1.00 0.00 O ATOM 1654 CB GLU A 109 -11.318 -15.606 8.370 1.00 0.00 C ATOM 1655 CG GLU A 109 -10.369 -15.540 9.555 1.00 0.00 C ATOM 1656 CD GLU A 109 -11.013 -14.933 10.786 1.00 0.00 C ATOM 1657 OE1 GLU A 109 -11.272 -13.711 10.777 1.00 0.00 O ATOM 1658 OE2 GLU A 109 -11.256 -15.678 11.757 1.00 0.00 O ATOM 0 H GLU A 109 -10.259 -14.785 6.012 1.00 0.00 H new ATOM 0 HA GLU A 109 -10.240 -17.294 7.591 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -11.524 -14.593 8.024 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -12.267 -16.029 8.699 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -10.018 -16.545 9.791 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -9.492 -14.953 9.281 1.00 0.00 H new ATOM 1665 N SER A 110 -11.979 -18.249 6.125 1.00 0.00 N ATOM 1666 CA SER A 110 -13.032 -18.859 5.322 1.00 0.00 C ATOM 1667 C SER A 110 -13.898 -19.783 6.174 1.00 0.00 C ATOM 1668 O SER A 110 -13.502 -20.905 6.488 1.00 0.00 O ATOM 1669 CB SER A 110 -12.425 -19.641 4.156 1.00 0.00 C ATOM 1670 OG SER A 110 -13.436 -20.158 3.308 1.00 0.00 O ATOM 0 H SER A 110 -11.291 -18.908 6.490 1.00 0.00 H new ATOM 0 HA SER A 110 -13.662 -18.062 4.926 1.00 0.00 H new ATOM 0 HB2 SER A 110 -11.763 -18.991 3.584 1.00 0.00 H new ATOM 0 HB3 SER A 110 -11.815 -20.459 4.540 1.00 0.00 H new ATOM 0 HG SER A 110 -13.023 -20.652 2.570 1.00 0.00 H new ATOM 1676 N GLN A 111 -15.080 -19.302 6.543 1.00 0.00 N ATOM 1677 CA GLN A 111 -16.002 -20.084 7.358 1.00 0.00 C ATOM 1678 C GLN A 111 -17.366 -20.193 6.685 1.00 0.00 C ATOM 1679 O GLN A 111 -18.403 -20.097 7.341 1.00 0.00 O ATOM 1680 CB GLN A 111 -16.152 -19.452 8.743 1.00 0.00 C ATOM 1681 CG GLN A 111 -16.765 -18.061 8.714 1.00 0.00 C ATOM 1682 CD GLN A 111 -17.289 -17.626 10.068 1.00 0.00 C ATOM 1683 OE1 GLN A 111 -17.203 -18.367 11.048 1.00 0.00 O ATOM 1684 NE2 GLN A 111 -17.836 -16.417 10.131 1.00 0.00 N ATOM 0 H GLN A 111 -15.422 -18.375 6.291 1.00 0.00 H new ATOM 0 HA GLN A 111 -15.590 -21.087 7.467 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -16.771 -20.100 9.364 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -15.172 -19.398 9.217 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -16.017 -17.346 8.371 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -17.580 -18.042 7.990 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -17.887 -15.836 9.294 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -18.205 -16.070 11.016 1.00 0.00 H new ATOM 1693 N VAL A 112 -17.358 -20.395 5.371 1.00 0.00 N ATOM 1694 CA VAL A 112 -18.595 -20.518 4.609 1.00 0.00 C ATOM 1695 C VAL A 112 -19.668 -21.239 5.416 1.00 0.00 C ATOM 1696 O VAL A 112 -20.758 -20.709 5.631 1.00 0.00 O ATOM 1697 CB VAL A 112 -18.366 -21.275 3.287 1.00 0.00 C ATOM 1698 CG1 VAL A 112 -19.678 -21.445 2.536 1.00 0.00 C ATOM 1699 CG2 VAL A 112 -17.340 -20.551 2.429 1.00 0.00 C ATOM 0 H VAL A 112 -16.509 -20.477 4.812 1.00 0.00 H new ATOM 0 HA VAL A 112 -18.932 -19.506 4.386 1.00 0.00 H new ATOM 0 HB VAL A 112 -17.976 -22.266 3.518 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -19.497 -21.982 1.605 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -20.378 -22.010 3.151 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -20.100 -20.465 2.314 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -17.191 -21.100 1.499 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -17.698 -19.546 2.204 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -16.395 -20.487 2.968 1.00 0.00 H new ATOM 1709 N SER A 113 -19.352 -22.451 5.861 1.00 0.00 N ATOM 1710 CA SER A 113 -20.291 -23.247 6.643 1.00 0.00 C ATOM 1711 C SER A 113 -20.154 -22.942 8.131 1.00 0.00 C ATOM 1712 O SER A 113 -19.166 -22.354 8.568 1.00 0.00 O ATOM 1713 CB SER A 113 -20.059 -24.738 6.393 1.00 0.00 C ATOM 1714 OG SER A 113 -21.223 -25.492 6.686 1.00 0.00 O ATOM 0 H SER A 113 -18.453 -22.903 5.693 1.00 0.00 H new ATOM 0 HA SER A 113 -21.301 -22.986 6.328 1.00 0.00 H new ATOM 0 HB2 SER A 113 -19.772 -24.895 5.353 1.00 0.00 H new ATOM 0 HB3 SER A 113 -19.230 -25.088 7.008 1.00 0.00 H new ATOM 0 HG SER A 113 -21.049 -26.441 6.516 1.00 0.00 H new ATOM 1720 N GLY A 114 -21.155 -23.348 8.907 1.00 0.00 N ATOM 1721 CA GLY A 114 -21.129 -23.110 10.338 1.00 0.00 C ATOM 1722 C GLY A 114 -21.616 -24.305 11.134 1.00 0.00 C ATOM 1723 O GLY A 114 -22.515 -25.033 10.713 1.00 0.00 O ATOM 0 H GLY A 114 -21.984 -23.838 8.569 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -20.112 -22.864 10.644 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -21.750 -22.245 10.571 1.00 0.00 H new ATOM 1727 N PRO A 115 -21.015 -24.521 12.313 1.00 0.00 N ATOM 1728 CA PRO A 115 -21.376 -25.635 13.193 1.00 0.00 C ATOM 1729 C PRO A 115 -22.755 -25.457 13.819 1.00 0.00 C ATOM 1730 O PRO A 115 -23.248 -26.340 14.521 1.00 0.00 O ATOM 1731 CB PRO A 115 -20.291 -25.601 14.273 1.00 0.00 C ATOM 1732 CG PRO A 115 -19.821 -24.187 14.293 1.00 0.00 C ATOM 1733 CD PRO A 115 -19.936 -23.693 12.878 1.00 0.00 C ATOM 0 HA PRO A 115 -21.429 -26.580 12.652 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -20.688 -25.900 15.243 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -19.476 -26.286 14.038 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -20.428 -23.583 14.968 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -18.792 -24.123 14.646 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -20.183 -22.632 12.842 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -19.002 -23.822 12.331 1.00 0.00 H new ATOM 1741 N SER A 116 -23.373 -24.309 13.560 1.00 0.00 N ATOM 1742 CA SER A 116 -24.695 -24.013 14.100 1.00 0.00 C ATOM 1743 C SER A 116 -25.787 -24.406 13.110 1.00 0.00 C ATOM 1744 O SER A 116 -26.709 -25.148 13.448 1.00 0.00 O ATOM 1745 CB SER A 116 -24.809 -22.526 14.440 1.00 0.00 C ATOM 1746 OG SER A 116 -26.008 -22.255 15.145 1.00 0.00 O ATOM 0 H SER A 116 -22.979 -23.568 12.979 1.00 0.00 H new ATOM 0 HA SER A 116 -24.828 -24.597 15.010 1.00 0.00 H new ATOM 0 HB2 SER A 116 -23.953 -22.220 15.041 1.00 0.00 H new ATOM 0 HB3 SER A 116 -24.781 -21.937 13.523 1.00 0.00 H new ATOM 0 HG SER A 116 -26.057 -21.298 15.352 1.00 0.00 H new ATOM 1752 N SER A 117 -25.675 -23.902 11.885 1.00 0.00 N ATOM 1753 CA SER A 117 -26.655 -24.196 10.845 1.00 0.00 C ATOM 1754 C SER A 117 -26.349 -25.531 10.174 1.00 0.00 C ATOM 1755 O SER A 117 -27.257 -26.289 9.831 1.00 0.00 O ATOM 1756 CB SER A 117 -26.672 -23.079 9.800 1.00 0.00 C ATOM 1757 OG SER A 117 -25.376 -22.854 9.273 1.00 0.00 O ATOM 0 H SER A 117 -24.916 -23.289 11.588 1.00 0.00 H new ATOM 0 HA SER A 117 -27.637 -24.260 11.313 1.00 0.00 H new ATOM 0 HB2 SER A 117 -27.356 -23.342 8.993 1.00 0.00 H new ATOM 0 HB3 SER A 117 -27.049 -22.161 10.251 1.00 0.00 H new ATOM 0 HG SER A 117 -25.414 -22.137 8.606 1.00 0.00 H new ATOM 1763 N GLY A 118 -25.063 -25.813 9.988 1.00 0.00 N ATOM 1764 CA GLY A 118 -24.660 -27.057 9.358 1.00 0.00 C ATOM 1765 C GLY A 118 -23.721 -27.869 10.227 1.00 0.00 C ATOM 1766 O GLY A 118 -22.512 -27.887 9.999 1.00 0.00 O ATOM 0 H GLY A 118 -24.293 -25.202 10.262 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -25.546 -27.650 9.133 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -24.173 -26.838 8.408 1.00 0.00 H new TER 1770 GLY A 118