USER MOD reduce.3.24.130724 H: found=0, std=0, add=877, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 884 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 45 SER OG : rot -118:sc= 0.296 USER MOD Set 1.2: A 47 SER OG : rot 140:sc= 0.132 USER MOD Set 1.3: A 51 GLN : amide:sc= 0.187 K(o=0.61,f=-6.4!) USER MOD Set 2.1: A 8 THR OG1 : rot 19:sc= 0.565 USER MOD Set 2.2: A 12 SER OG : rot 63:sc= 0.0406 USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.0711 (180deg=0) USER MOD Single : A 2 SER OG : rot -2:sc= 1.17 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 11 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 HIS : no HD1:sc= -0.761 K(o=-0.76,f=-1.5) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot -15:sc= 0.456 USER MOD Single : A 20 HIS : no HD1:sc= 0.41 K(o=0.41,f=-3.4!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -0.207 K(o=-0.21,f=-1.9!) USER MOD Single : A 39 SER OG : rot -100:sc= -0.623 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -2.44! K(o=-2.4!,f=0.093) USER MOD Single : A 65 TYR OH : rot -140:sc= -0.659 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0222 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 157:sc= 0.325! USER MOD Single : A 81 SER OG : rot 33:sc= 0.387 USER MOD Single : A 84 SER OG : rot 180:sc= -0.0741 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 92 HIS : no HD1:sc= -1.75! K(o=-1.7!,f=-0.6) USER MOD Single : A 93 HIS : no HD1:sc= -5.29! K(o=-5.3!,f=-3.1) USER MOD Single : A 94 SER OG : rot 60:sc= 1.34 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.0204 USER MOD Single : A 105 HIS : no HD1:sc= -0.372 X(o=-0.37,f=0.083) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ -143:sc= 0.24 (180deg=0.00621) USER MOD Single : A 111 CYS SG : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -1.35 K(o=-1.3,f=-5.1!) USER MOD Single : A 113 LYS NZ :NH3+ 160:sc= -0.047 (180deg=-0.325) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 33:sc= 0.317 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.819 11.262 -16.537 1.00 0.00 N ATOM 2 CA GLY A 1 18.097 10.173 -17.168 1.00 0.00 C ATOM 3 C GLY A 1 17.036 9.581 -16.262 1.00 0.00 C ATOM 4 O GLY A 1 16.627 10.204 -15.284 1.00 0.00 O ATOM 0 H1 GLY A 1 18.779 12.104 -17.146 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.385 11.479 -15.617 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.811 10.984 -16.395 1.00 0.00 H new ATOM 0 HA2 GLY A 1 17.629 10.534 -18.084 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.801 9.393 -17.456 1.00 0.00 H new ATOM 8 N SER A 2 16.586 8.374 -16.592 1.00 0.00 N ATOM 9 CA SER A 2 15.560 7.699 -15.803 1.00 0.00 C ATOM 10 C SER A 2 15.538 6.204 -16.106 1.00 0.00 C ATOM 11 O SER A 2 16.235 5.731 -17.004 1.00 0.00 O ATOM 12 CB SER A 2 14.186 8.309 -16.088 1.00 0.00 C ATOM 13 OG SER A 2 14.079 9.607 -15.530 1.00 0.00 O ATOM 0 H SER A 2 16.915 7.844 -17.399 1.00 0.00 H new ATOM 0 HA SER A 2 15.799 7.835 -14.748 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.023 8.358 -17.165 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.407 7.667 -15.676 1.00 0.00 H new ATOM 0 HG SER A 2 14.903 9.824 -15.046 1.00 0.00 H new ATOM 19 N SER A 3 14.734 5.465 -15.349 1.00 0.00 N ATOM 20 CA SER A 3 14.622 4.023 -15.532 1.00 0.00 C ATOM 21 C SER A 3 13.177 3.619 -15.805 1.00 0.00 C ATOM 22 O SER A 3 12.258 4.424 -15.658 1.00 0.00 O ATOM 23 CB SER A 3 15.144 3.289 -14.294 1.00 0.00 C ATOM 24 OG SER A 3 14.306 3.519 -13.175 1.00 0.00 O ATOM 0 H SER A 3 14.150 5.842 -14.602 1.00 0.00 H new ATOM 0 HA SER A 3 15.227 3.743 -16.394 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.199 2.220 -14.497 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.157 3.623 -14.069 1.00 0.00 H new ATOM 0 HG SER A 3 14.659 3.038 -12.397 1.00 0.00 H new ATOM 30 N GLY A 4 12.985 2.366 -16.204 1.00 0.00 N ATOM 31 CA GLY A 4 11.650 1.876 -16.493 1.00 0.00 C ATOM 32 C GLY A 4 11.192 0.824 -15.502 1.00 0.00 C ATOM 33 O GLY A 4 11.796 0.653 -14.444 1.00 0.00 O ATOM 0 H GLY A 4 13.730 1.681 -16.332 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.949 2.711 -16.482 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.630 1.457 -17.499 1.00 0.00 H new ATOM 37 N SER A 5 10.118 0.119 -15.844 1.00 0.00 N ATOM 38 CA SER A 5 9.576 -0.918 -14.975 1.00 0.00 C ATOM 39 C SER A 5 8.971 -2.054 -15.794 1.00 0.00 C ATOM 40 O SER A 5 8.899 -1.978 -17.021 1.00 0.00 O ATOM 41 CB SER A 5 8.516 -0.327 -14.041 1.00 0.00 C ATOM 42 OG SER A 5 9.069 0.688 -13.220 1.00 0.00 O ATOM 0 H SER A 5 9.606 0.248 -16.717 1.00 0.00 H new ATOM 0 HA SER A 5 10.394 -1.321 -14.378 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.696 0.084 -14.630 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.096 -1.116 -13.417 1.00 0.00 H new ATOM 0 HG SER A 5 8.372 1.051 -12.634 1.00 0.00 H new ATOM 48 N SER A 6 8.538 -3.106 -15.107 1.00 0.00 N ATOM 49 CA SER A 6 7.943 -4.260 -15.770 1.00 0.00 C ATOM 50 C SER A 6 6.500 -4.462 -15.319 1.00 0.00 C ATOM 51 O SER A 6 5.570 -4.385 -16.122 1.00 0.00 O ATOM 52 CB SER A 6 8.761 -5.520 -15.479 1.00 0.00 C ATOM 53 OG SER A 6 10.056 -5.431 -16.048 1.00 0.00 O ATOM 0 H SER A 6 8.588 -3.183 -14.091 1.00 0.00 H new ATOM 0 HA SER A 6 7.947 -4.072 -16.844 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.843 -5.663 -14.402 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.244 -6.393 -15.878 1.00 0.00 H new ATOM 0 HG SER A 6 10.559 -6.248 -15.846 1.00 0.00 H new ATOM 59 N GLY A 7 6.321 -4.720 -14.028 1.00 0.00 N ATOM 60 CA GLY A 7 4.989 -4.929 -13.491 1.00 0.00 C ATOM 61 C GLY A 7 4.941 -6.062 -12.485 1.00 0.00 C ATOM 62 O GLY A 7 5.975 -6.502 -11.981 1.00 0.00 O ATOM 0 H GLY A 7 7.074 -4.788 -13.344 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.644 -4.011 -13.016 1.00 0.00 H new ATOM 0 HA3 GLY A 7 4.301 -5.143 -14.308 1.00 0.00 H new ATOM 66 N THR A 8 3.735 -6.538 -12.188 1.00 0.00 N ATOM 67 CA THR A 8 3.554 -7.625 -11.235 1.00 0.00 C ATOM 68 C THR A 8 2.811 -8.795 -11.868 1.00 0.00 C ATOM 69 O THR A 8 1.680 -8.662 -12.336 1.00 0.00 O ATOM 70 CB THR A 8 2.783 -7.155 -9.987 1.00 0.00 C ATOM 71 OG1 THR A 8 1.435 -6.826 -10.339 1.00 0.00 O ATOM 72 CG2 THR A 8 3.457 -5.945 -9.357 1.00 0.00 C ATOM 0 H THR A 8 2.868 -6.186 -12.595 1.00 0.00 H new ATOM 0 HA THR A 8 4.550 -7.952 -10.936 1.00 0.00 H new ATOM 0 HB THR A 8 2.781 -7.968 -9.262 1.00 0.00 H new ATOM 0 HG1 THR A 8 1.207 -7.250 -11.193 1.00 0.00 H new ATOM 0 HG21 THR A 8 2.894 -5.632 -8.478 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.473 -6.207 -9.063 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.487 -5.128 -10.078 1.00 0.00 H new ATOM 80 N PRO A 9 3.456 -9.969 -11.883 1.00 0.00 N ATOM 81 CA PRO A 9 2.873 -11.187 -12.455 1.00 0.00 C ATOM 82 C PRO A 9 1.716 -11.723 -11.620 1.00 0.00 C ATOM 83 O PRO A 9 0.713 -12.190 -12.159 1.00 0.00 O ATOM 84 CB PRO A 9 4.041 -12.176 -12.450 1.00 0.00 C ATOM 85 CG PRO A 9 4.936 -11.699 -11.359 1.00 0.00 C ATOM 86 CD PRO A 9 4.807 -10.202 -11.343 1.00 0.00 C ATOM 0 HA PRO A 9 2.451 -11.011 -13.444 1.00 0.00 H new ATOM 0 HB2 PRO A 9 3.697 -13.194 -12.264 1.00 0.00 H new ATOM 0 HB3 PRO A 9 4.557 -12.184 -13.410 1.00 0.00 H new ATOM 0 HG2 PRO A 9 4.644 -12.126 -10.400 1.00 0.00 H new ATOM 0 HG3 PRO A 9 5.968 -12.000 -11.541 1.00 0.00 H new ATOM 0 HD2 PRO A 9 4.911 -9.801 -10.335 1.00 0.00 H new ATOM 0 HD3 PRO A 9 5.572 -9.726 -11.956 1.00 0.00 H new ATOM 94 N VAL A 10 1.862 -11.652 -10.300 1.00 0.00 N ATOM 95 CA VAL A 10 0.827 -12.128 -9.391 1.00 0.00 C ATOM 96 C VAL A 10 -0.496 -11.415 -9.641 1.00 0.00 C ATOM 97 O VAL A 10 -0.552 -10.187 -9.684 1.00 0.00 O ATOM 98 CB VAL A 10 1.238 -11.927 -7.920 1.00 0.00 C ATOM 99 CG1 VAL A 10 2.611 -12.525 -7.661 1.00 0.00 C ATOM 100 CG2 VAL A 10 1.214 -10.448 -7.559 1.00 0.00 C ATOM 0 H VAL A 10 2.687 -11.270 -9.837 1.00 0.00 H new ATOM 0 HA VAL A 10 0.702 -13.194 -9.583 1.00 0.00 H new ATOM 0 HB VAL A 10 0.519 -12.445 -7.286 1.00 0.00 H new ATOM 0 HG11 VAL A 10 2.883 -12.373 -6.617 1.00 0.00 H new ATOM 0 HG12 VAL A 10 2.590 -13.593 -7.878 1.00 0.00 H new ATOM 0 HG13 VAL A 10 3.346 -12.039 -8.302 1.00 0.00 H new ATOM 0 HG21 VAL A 10 1.507 -10.323 -6.517 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.910 -9.906 -8.199 1.00 0.00 H new ATOM 0 HG23 VAL A 10 0.208 -10.055 -7.703 1.00 0.00 H new ATOM 110 N ASN A 11 -1.561 -12.193 -9.805 1.00 0.00 N ATOM 111 CA ASN A 11 -2.886 -11.636 -10.050 1.00 0.00 C ATOM 112 C ASN A 11 -3.082 -10.336 -9.276 1.00 0.00 C ATOM 113 O ASN A 11 -2.648 -10.212 -8.130 1.00 0.00 O ATOM 114 CB ASN A 11 -3.968 -12.644 -9.657 1.00 0.00 C ATOM 115 CG ASN A 11 -4.155 -13.727 -10.701 1.00 0.00 C ATOM 116 OD1 ASN A 11 -3.354 -13.858 -11.627 1.00 0.00 O ATOM 117 ND2 ASN A 11 -5.217 -14.511 -10.557 1.00 0.00 N ATOM 0 H ASN A 11 -1.532 -13.212 -9.773 1.00 0.00 H new ATOM 0 HA ASN A 11 -2.970 -11.420 -11.115 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -3.704 -13.103 -8.704 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -4.912 -12.120 -9.508 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -5.395 -15.257 -11.229 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -5.855 -14.367 -9.774 1.00 0.00 H new ATOM 124 N SER A 12 -3.736 -9.369 -9.910 1.00 0.00 N ATOM 125 CA SER A 12 -3.987 -8.077 -9.282 1.00 0.00 C ATOM 126 C SER A 12 -5.384 -7.567 -9.624 1.00 0.00 C ATOM 127 O SER A 12 -5.747 -7.456 -10.797 1.00 0.00 O ATOM 128 CB SER A 12 -2.936 -7.058 -9.728 1.00 0.00 C ATOM 129 OG SER A 12 -1.731 -7.216 -8.999 1.00 0.00 O ATOM 0 H SER A 12 -4.102 -9.455 -10.858 1.00 0.00 H new ATOM 0 HA SER A 12 -3.922 -8.207 -8.202 1.00 0.00 H new ATOM 0 HB2 SER A 12 -2.739 -7.177 -10.793 1.00 0.00 H new ATOM 0 HB3 SER A 12 -3.321 -6.048 -9.586 1.00 0.00 H new ATOM 0 HG SER A 12 -1.352 -8.101 -9.182 1.00 0.00 H new ATOM 135 N LEU A 13 -6.164 -7.259 -8.594 1.00 0.00 N ATOM 136 CA LEU A 13 -7.521 -6.761 -8.785 1.00 0.00 C ATOM 137 C LEU A 13 -7.633 -5.305 -8.348 1.00 0.00 C ATOM 138 O LEU A 13 -8.445 -4.965 -7.488 1.00 0.00 O ATOM 139 CB LEU A 13 -8.515 -7.618 -7.998 1.00 0.00 C ATOM 140 CG LEU A 13 -8.180 -7.854 -6.525 1.00 0.00 C ATOM 141 CD1 LEU A 13 -9.449 -8.089 -5.721 1.00 0.00 C ATOM 142 CD2 LEU A 13 -7.226 -9.030 -6.376 1.00 0.00 C ATOM 0 H LEU A 13 -5.880 -7.345 -7.618 1.00 0.00 H new ATOM 0 HA LEU A 13 -7.758 -6.822 -9.847 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.496 -7.146 -8.056 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.598 -8.587 -8.491 1.00 0.00 H new ATOM 0 HG LEU A 13 -7.688 -6.962 -6.137 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.191 -8.255 -4.675 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -10.097 -7.216 -5.801 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -9.969 -8.964 -6.110 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -6.999 -9.183 -5.321 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -7.691 -9.929 -6.781 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.304 -8.822 -6.919 1.00 0.00 H new ATOM 154 N GLU A 14 -6.815 -4.446 -8.950 1.00 0.00 N ATOM 155 CA GLU A 14 -6.824 -3.025 -8.623 1.00 0.00 C ATOM 156 C GLU A 14 -7.596 -2.231 -9.671 1.00 0.00 C ATOM 157 O GLU A 14 -7.027 -1.776 -10.665 1.00 0.00 O ATOM 158 CB GLU A 14 -5.391 -2.495 -8.517 1.00 0.00 C ATOM 159 CG GLU A 14 -4.674 -2.927 -7.249 1.00 0.00 C ATOM 160 CD GLU A 14 -3.167 -2.958 -7.413 1.00 0.00 C ATOM 161 OE1 GLU A 14 -2.623 -2.050 -8.077 1.00 0.00 O ATOM 162 OE2 GLU A 14 -2.531 -3.891 -6.879 1.00 0.00 O ATOM 0 H GLU A 14 -6.138 -4.710 -9.666 1.00 0.00 H new ATOM 0 HA GLU A 14 -7.321 -2.902 -7.661 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -4.821 -2.837 -9.381 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -5.411 -1.406 -8.560 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -4.934 -2.245 -6.439 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -5.024 -3.917 -6.957 1.00 0.00 H new ATOM 170 N LYS A 15 -8.895 -2.068 -9.444 1.00 0.00 N ATOM 171 CA LYS A 15 -9.747 -1.329 -10.366 1.00 0.00 C ATOM 172 C LYS A 15 -9.907 0.120 -9.917 1.00 0.00 C ATOM 173 O LYS A 15 -9.919 1.038 -10.738 1.00 0.00 O ATOM 174 CB LYS A 15 -11.120 -1.995 -10.470 1.00 0.00 C ATOM 175 CG LYS A 15 -11.063 -3.431 -10.964 1.00 0.00 C ATOM 176 CD LYS A 15 -12.454 -4.010 -11.158 1.00 0.00 C ATOM 177 CE LYS A 15 -12.399 -5.488 -11.514 1.00 0.00 C ATOM 178 NZ LYS A 15 -11.996 -5.701 -12.932 1.00 0.00 N ATOM 0 H LYS A 15 -9.381 -2.439 -8.627 1.00 0.00 H new ATOM 0 HA LYS A 15 -9.270 -1.337 -11.346 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -11.599 -1.975 -9.491 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -11.747 -1.412 -11.144 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -10.517 -3.471 -11.906 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -10.511 -4.041 -10.249 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -13.035 -3.876 -10.246 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -12.970 -3.464 -11.948 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -11.693 -5.994 -10.856 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -13.376 -5.940 -11.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -11.970 -6.720 -13.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -12.683 -5.239 -13.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -11.053 -5.292 -13.090 1.00 0.00 H new ATOM 192 N HIS A 16 -10.028 0.319 -8.608 1.00 0.00 N ATOM 193 CA HIS A 16 -10.185 1.658 -8.050 1.00 0.00 C ATOM 194 C HIS A 16 -8.904 2.470 -8.217 1.00 0.00 C ATOM 195 O HIS A 16 -7.809 1.913 -8.282 1.00 0.00 O ATOM 196 CB HIS A 16 -10.560 1.575 -6.570 1.00 0.00 C ATOM 197 CG HIS A 16 -11.695 0.638 -6.291 1.00 0.00 C ATOM 198 ND1 HIS A 16 -13.020 1.003 -6.412 1.00 0.00 N ATOM 199 CD2 HIS A 16 -11.698 -0.656 -5.897 1.00 0.00 C ATOM 200 CE1 HIS A 16 -13.788 -0.026 -6.103 1.00 0.00 C ATOM 201 NE2 HIS A 16 -13.010 -1.046 -5.787 1.00 0.00 N ATOM 0 H HIS A 16 -10.020 -0.429 -7.915 1.00 0.00 H new ATOM 0 HA HIS A 16 -10.986 2.160 -8.593 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -9.688 1.256 -6.000 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -10.826 2.571 -6.215 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -10.830 -1.269 -5.705 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -14.868 -0.033 -6.108 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -13.332 -1.973 -5.507 1.00 0.00 H new ATOM 210 N SER A 17 -9.051 3.790 -8.285 1.00 0.00 N ATOM 211 CA SER A 17 -7.906 4.677 -8.451 1.00 0.00 C ATOM 212 C SER A 17 -7.206 4.914 -7.115 1.00 0.00 C ATOM 213 O SER A 17 -5.985 5.066 -7.060 1.00 0.00 O ATOM 214 CB SER A 17 -8.352 6.013 -9.048 1.00 0.00 C ATOM 215 OG SER A 17 -8.645 5.880 -10.429 1.00 0.00 O ATOM 0 H SER A 17 -9.950 4.268 -8.228 1.00 0.00 H new ATOM 0 HA SER A 17 -7.202 4.199 -9.132 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.233 6.376 -8.519 1.00 0.00 H new ATOM 0 HB3 SER A 17 -7.568 6.757 -8.909 1.00 0.00 H new ATOM 0 HG SER A 17 -8.929 6.746 -10.788 1.00 0.00 H new ATOM 221 N TRP A 18 -7.987 4.945 -6.043 1.00 0.00 N ATOM 222 CA TRP A 18 -7.444 5.164 -4.707 1.00 0.00 C ATOM 223 C TRP A 18 -6.809 3.888 -4.163 1.00 0.00 C ATOM 224 O TRP A 18 -5.828 3.941 -3.421 1.00 0.00 O ATOM 225 CB TRP A 18 -8.542 5.646 -3.758 1.00 0.00 C ATOM 226 CG TRP A 18 -9.874 5.010 -4.020 1.00 0.00 C ATOM 227 CD1 TRP A 18 -10.875 5.499 -4.812 1.00 0.00 C ATOM 228 CD2 TRP A 18 -10.351 3.769 -3.489 1.00 0.00 C ATOM 229 NE1 TRP A 18 -11.945 4.638 -4.803 1.00 0.00 N ATOM 230 CE2 TRP A 18 -11.648 3.568 -4.001 1.00 0.00 C ATOM 231 CE3 TRP A 18 -9.809 2.810 -2.631 1.00 0.00 C ATOM 232 CZ2 TRP A 18 -12.409 2.447 -3.682 1.00 0.00 C ATOM 233 CZ3 TRP A 18 -10.565 1.696 -2.315 1.00 0.00 C ATOM 234 CH2 TRP A 18 -11.852 1.522 -2.840 1.00 0.00 C ATOM 0 H TRP A 18 -8.999 4.821 -6.072 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.673 5.932 -4.777 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -8.243 5.436 -2.731 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -8.640 6.728 -3.847 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -10.831 6.426 -5.364 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -12.819 4.773 -5.311 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.818 2.936 -2.222 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -13.402 2.312 -4.084 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.156 0.948 -1.652 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -12.416 0.640 -2.575 1.00 0.00 H new ATOM 245 N TYR A 19 -7.375 2.746 -4.534 1.00 0.00 N ATOM 246 CA TYR A 19 -6.865 1.457 -4.081 1.00 0.00 C ATOM 247 C TYR A 19 -5.497 1.167 -4.690 1.00 0.00 C ATOM 248 O TYR A 19 -5.396 0.553 -5.753 1.00 0.00 O ATOM 249 CB TYR A 19 -7.846 0.340 -4.445 1.00 0.00 C ATOM 250 CG TYR A 19 -7.397 -1.030 -3.991 1.00 0.00 C ATOM 251 CD1 TYR A 19 -6.936 -1.240 -2.698 1.00 0.00 C ATOM 252 CD2 TYR A 19 -7.435 -2.117 -4.858 1.00 0.00 C ATOM 253 CE1 TYR A 19 -6.523 -2.491 -2.282 1.00 0.00 C ATOM 254 CE2 TYR A 19 -7.027 -3.371 -4.449 1.00 0.00 C ATOM 255 CZ TYR A 19 -6.572 -3.554 -3.159 1.00 0.00 C ATOM 256 OH TYR A 19 -6.164 -4.801 -2.747 1.00 0.00 O ATOM 0 H TYR A 19 -8.188 2.686 -5.148 1.00 0.00 H new ATOM 0 HA TYR A 19 -6.758 1.498 -2.997 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -8.817 0.561 -4.001 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -7.985 0.328 -5.526 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.900 -0.412 -2.006 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -7.790 -1.978 -5.869 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.163 -2.636 -1.274 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -7.064 -4.204 -5.135 1.00 0.00 H new ATOM 0 HH TYR A 19 -5.655 -4.720 -1.914 1.00 0.00 H new ATOM 266 N HIS A 20 -4.446 1.613 -4.009 1.00 0.00 N ATOM 267 CA HIS A 20 -3.083 1.401 -4.482 1.00 0.00 C ATOM 268 C HIS A 20 -2.614 -0.018 -4.172 1.00 0.00 C ATOM 269 O HIS A 20 -2.298 -0.789 -5.077 1.00 0.00 O ATOM 270 CB HIS A 20 -2.135 2.415 -3.840 1.00 0.00 C ATOM 271 CG HIS A 20 -2.036 3.704 -4.595 1.00 0.00 C ATOM 272 ND1 HIS A 20 -0.833 4.307 -4.901 1.00 0.00 N ATOM 273 CD2 HIS A 20 -2.998 4.504 -5.109 1.00 0.00 C ATOM 274 CE1 HIS A 20 -1.061 5.424 -5.567 1.00 0.00 C ATOM 275 NE2 HIS A 20 -2.366 5.567 -5.709 1.00 0.00 N ATOM 0 H HIS A 20 -4.512 2.123 -3.128 1.00 0.00 H new ATOM 0 HA HIS A 20 -3.074 1.539 -5.563 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -2.473 2.623 -2.825 1.00 0.00 H new ATOM 0 HB3 HIS A 20 -1.142 1.972 -3.761 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -4.064 4.338 -5.058 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -0.308 6.105 -5.934 1.00 0.00 H new ATOM 0 HE2 HIS A 20 -2.830 6.340 -6.186 1.00 0.00 H new ATOM 284 N GLY A 21 -2.574 -0.356 -2.887 1.00 0.00 N ATOM 285 CA GLY A 21 -2.144 -1.682 -2.482 1.00 0.00 C ATOM 286 C GLY A 21 -0.775 -1.671 -1.829 1.00 0.00 C ATOM 287 O GLY A 21 -0.624 -1.316 -0.660 1.00 0.00 O ATOM 0 H GLY A 21 -2.832 0.264 -2.119 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -2.872 -2.101 -1.787 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -2.123 -2.336 -3.354 1.00 0.00 H new ATOM 291 N PRO A 22 0.252 -2.072 -2.593 1.00 0.00 N ATOM 292 CA PRO A 22 1.632 -2.117 -2.103 1.00 0.00 C ATOM 293 C PRO A 22 2.215 -0.727 -1.878 1.00 0.00 C ATOM 294 O PRO A 22 2.919 -0.192 -2.734 1.00 0.00 O ATOM 295 CB PRO A 22 2.384 -2.837 -3.225 1.00 0.00 C ATOM 296 CG PRO A 22 1.577 -2.576 -4.450 1.00 0.00 C ATOM 297 CD PRO A 22 0.146 -2.510 -3.994 1.00 0.00 C ATOM 0 HA PRO A 22 1.704 -2.614 -1.135 1.00 0.00 H new ATOM 0 HB2 PRO A 22 3.399 -2.454 -3.331 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.466 -3.905 -3.025 1.00 0.00 H new ATOM 0 HG2 PRO A 22 1.879 -1.643 -4.925 1.00 0.00 H new ATOM 0 HG3 PRO A 22 1.716 -3.368 -5.186 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -0.434 -1.807 -4.592 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -0.346 -3.479 -4.075 1.00 0.00 H new ATOM 305 N VAL A 23 1.916 -0.144 -0.721 1.00 0.00 N ATOM 306 CA VAL A 23 2.412 1.185 -0.384 1.00 0.00 C ATOM 307 C VAL A 23 3.252 1.152 0.889 1.00 0.00 C ATOM 308 O VAL A 23 2.839 0.587 1.902 1.00 0.00 O ATOM 309 CB VAL A 23 1.254 2.184 -0.197 1.00 0.00 C ATOM 310 CG1 VAL A 23 1.793 3.588 0.030 1.00 0.00 C ATOM 311 CG2 VAL A 23 0.321 2.148 -1.397 1.00 0.00 C ATOM 0 H VAL A 23 1.333 -0.571 -0.002 1.00 0.00 H new ATOM 0 HA VAL A 23 3.034 1.512 -1.217 1.00 0.00 H new ATOM 0 HB VAL A 23 0.684 1.893 0.685 1.00 0.00 H new ATOM 0 HG11 VAL A 23 0.961 4.280 0.160 1.00 0.00 H new ATOM 0 HG12 VAL A 23 2.417 3.598 0.924 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.388 3.893 -0.831 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -0.491 2.860 -1.248 1.00 0.00 H new ATOM 0 HG22 VAL A 23 0.876 2.413 -2.297 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -0.091 1.145 -1.507 1.00 0.00 H new ATOM 321 N SER A 24 4.430 1.761 0.830 1.00 0.00 N ATOM 322 CA SER A 24 5.331 1.798 1.976 1.00 0.00 C ATOM 323 C SER A 24 4.912 2.888 2.959 1.00 0.00 C ATOM 324 O SER A 24 4.304 3.887 2.574 1.00 0.00 O ATOM 325 CB SER A 24 6.768 2.039 1.514 1.00 0.00 C ATOM 326 OG SER A 24 7.649 2.144 2.620 1.00 0.00 O ATOM 0 H SER A 24 4.784 2.237 0.000 1.00 0.00 H new ATOM 0 HA SER A 24 5.277 0.834 2.482 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.087 1.222 0.867 1.00 0.00 H new ATOM 0 HB3 SER A 24 6.814 2.952 0.920 1.00 0.00 H new ATOM 0 HG SER A 24 8.562 2.296 2.298 1.00 0.00 H new ATOM 332 N ARG A 25 5.242 2.688 4.230 1.00 0.00 N ATOM 333 CA ARG A 25 4.900 3.650 5.270 1.00 0.00 C ATOM 334 C ARG A 25 5.149 5.078 4.793 1.00 0.00 C ATOM 335 O ARG A 25 4.230 5.894 4.736 1.00 0.00 O ATOM 336 CB ARG A 25 5.713 3.375 6.537 1.00 0.00 C ATOM 337 CG ARG A 25 5.193 2.203 7.352 1.00 0.00 C ATOM 338 CD ARG A 25 6.290 1.591 8.210 1.00 0.00 C ATOM 339 NE ARG A 25 7.304 0.917 7.403 1.00 0.00 N ATOM 340 CZ ARG A 25 8.526 0.642 7.841 1.00 0.00 C ATOM 341 NH1 ARG A 25 8.887 0.982 9.070 1.00 0.00 N ATOM 342 NH2 ARG A 25 9.394 0.026 7.047 1.00 0.00 N ATOM 0 H ARG A 25 5.747 1.867 4.565 1.00 0.00 H new ATOM 0 HA ARG A 25 3.839 3.540 5.496 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.749 3.182 6.259 1.00 0.00 H new ATOM 0 HB3 ARG A 25 5.712 4.269 7.160 1.00 0.00 H new ATOM 0 HG2 ARG A 25 4.374 2.537 7.990 1.00 0.00 H new ATOM 0 HG3 ARG A 25 4.787 1.444 6.683 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.762 2.372 8.807 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.850 0.879 8.908 1.00 0.00 H new ATOM 0 HE ARG A 25 7.060 0.643 6.451 1.00 0.00 H new ATOM 0 HH11 ARG A 25 8.225 1.457 9.683 1.00 0.00 H new ATOM 0 HH12 ARG A 25 9.827 0.769 9.403 1.00 0.00 H new ATOM 0 HH21 ARG A 25 9.122 -0.236 6.100 1.00 0.00 H new ATOM 0 HH22 ARG A 25 10.333 -0.185 7.384 1.00 0.00 H new ATOM 356 N SER A 26 6.400 5.372 4.450 1.00 0.00 N ATOM 357 CA SER A 26 6.771 6.701 3.981 1.00 0.00 C ATOM 358 C SER A 26 5.945 7.098 2.761 1.00 0.00 C ATOM 359 O SER A 26 5.300 8.145 2.749 1.00 0.00 O ATOM 360 CB SER A 26 8.262 6.746 3.637 1.00 0.00 C ATOM 361 OG SER A 26 8.621 8.004 3.092 1.00 0.00 O ATOM 0 H SER A 26 7.173 4.707 4.488 1.00 0.00 H new ATOM 0 HA SER A 26 6.568 7.411 4.783 1.00 0.00 H new ATOM 0 HB2 SER A 26 8.851 6.553 4.533 1.00 0.00 H new ATOM 0 HB3 SER A 26 8.498 5.956 2.924 1.00 0.00 H new ATOM 0 HG SER A 26 9.578 8.008 2.882 1.00 0.00 H new ATOM 367 N ALA A 27 5.970 6.252 1.736 1.00 0.00 N ATOM 368 CA ALA A 27 5.222 6.512 0.513 1.00 0.00 C ATOM 369 C ALA A 27 3.820 7.021 0.824 1.00 0.00 C ATOM 370 O ALA A 27 3.393 8.052 0.304 1.00 0.00 O ATOM 371 CB ALA A 27 5.152 5.253 -0.341 1.00 0.00 C ATOM 0 H ALA A 27 6.500 5.381 1.729 1.00 0.00 H new ATOM 0 HA ALA A 27 5.746 7.288 -0.045 1.00 0.00 H new ATOM 0 HB1 ALA A 27 4.590 5.462 -1.252 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.161 4.934 -0.602 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.654 4.461 0.219 1.00 0.00 H new ATOM 377 N ALA A 28 3.105 6.293 1.676 1.00 0.00 N ATOM 378 CA ALA A 28 1.750 6.672 2.056 1.00 0.00 C ATOM 379 C ALA A 28 1.672 8.155 2.401 1.00 0.00 C ATOM 380 O ALA A 28 0.910 8.903 1.790 1.00 0.00 O ATOM 381 CB ALA A 28 1.278 5.830 3.233 1.00 0.00 C ATOM 0 H ALA A 28 3.442 5.437 2.116 1.00 0.00 H new ATOM 0 HA ALA A 28 1.095 6.488 1.205 1.00 0.00 H new ATOM 0 HB1 ALA A 28 0.265 6.123 3.507 1.00 0.00 H new ATOM 0 HB2 ALA A 28 1.288 4.776 2.954 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.943 5.987 4.082 1.00 0.00 H new ATOM 387 N GLU A 29 2.465 8.573 3.381 1.00 0.00 N ATOM 388 CA GLU A 29 2.483 9.968 3.806 1.00 0.00 C ATOM 389 C GLU A 29 2.986 10.872 2.685 1.00 0.00 C ATOM 390 O GLU A 29 2.282 11.780 2.242 1.00 0.00 O ATOM 391 CB GLU A 29 3.366 10.135 5.045 1.00 0.00 C ATOM 392 CG GLU A 29 2.759 9.549 6.309 1.00 0.00 C ATOM 393 CD GLU A 29 3.765 9.429 7.437 1.00 0.00 C ATOM 394 OE1 GLU A 29 4.719 8.635 7.299 1.00 0.00 O ATOM 395 OE2 GLU A 29 3.598 10.127 8.459 1.00 0.00 O ATOM 0 H GLU A 29 3.103 7.967 3.896 1.00 0.00 H new ATOM 0 HA GLU A 29 1.462 10.259 4.053 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.330 9.660 4.861 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.559 11.196 5.203 1.00 0.00 H new ATOM 0 HG2 GLU A 29 1.928 10.176 6.633 1.00 0.00 H new ATOM 0 HG3 GLU A 29 2.348 8.564 6.087 1.00 0.00 H new ATOM 403 N TYR A 30 4.207 10.617 2.230 1.00 0.00 N ATOM 404 CA TYR A 30 4.806 11.410 1.162 1.00 0.00 C ATOM 405 C TYR A 30 3.803 11.657 0.040 1.00 0.00 C ATOM 406 O TYR A 30 3.423 12.799 -0.229 1.00 0.00 O ATOM 407 CB TYR A 30 6.045 10.703 0.608 1.00 0.00 C ATOM 408 CG TYR A 30 6.765 11.495 -0.460 1.00 0.00 C ATOM 409 CD1 TYR A 30 7.470 12.648 -0.143 1.00 0.00 C ATOM 410 CD2 TYR A 30 6.741 11.087 -1.788 1.00 0.00 C ATOM 411 CE1 TYR A 30 8.129 13.374 -1.116 1.00 0.00 C ATOM 412 CE2 TYR A 30 7.398 11.806 -2.769 1.00 0.00 C ATOM 413 CZ TYR A 30 8.090 12.949 -2.427 1.00 0.00 C ATOM 414 OH TYR A 30 8.746 13.667 -3.400 1.00 0.00 O ATOM 0 H TYR A 30 4.802 9.868 2.583 1.00 0.00 H new ATOM 0 HA TYR A 30 5.101 12.373 1.579 1.00 0.00 H new ATOM 0 HB2 TYR A 30 6.735 10.502 1.427 1.00 0.00 H new ATOM 0 HB3 TYR A 30 5.749 9.738 0.196 1.00 0.00 H new ATOM 0 HD1 TYR A 30 7.504 12.984 0.883 1.00 0.00 H new ATOM 0 HD2 TYR A 30 6.200 10.193 -2.059 1.00 0.00 H new ATOM 0 HE1 TYR A 30 8.672 14.269 -0.851 1.00 0.00 H new ATOM 0 HE2 TYR A 30 7.370 11.475 -3.797 1.00 0.00 H new ATOM 0 HH TYR A 30 8.620 13.232 -4.269 1.00 0.00 H new ATOM 424 N LEU A 31 3.377 10.582 -0.612 1.00 0.00 N ATOM 425 CA LEU A 31 2.417 10.680 -1.706 1.00 0.00 C ATOM 426 C LEU A 31 1.336 11.708 -1.391 1.00 0.00 C ATOM 427 O LEU A 31 1.093 12.630 -2.172 1.00 0.00 O ATOM 428 CB LEU A 31 1.777 9.316 -1.973 1.00 0.00 C ATOM 429 CG LEU A 31 1.280 9.076 -3.400 1.00 0.00 C ATOM 430 CD1 LEU A 31 0.476 10.268 -3.891 1.00 0.00 C ATOM 431 CD2 LEU A 31 2.451 8.799 -4.332 1.00 0.00 C ATOM 0 H LEU A 31 3.681 9.631 -0.402 1.00 0.00 H new ATOM 0 HA LEU A 31 2.952 11.004 -2.598 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.504 8.542 -1.728 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.936 9.192 -1.291 1.00 0.00 H new ATOM 0 HG LEU A 31 0.629 8.201 -3.397 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.130 10.080 -4.908 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.383 10.421 -3.238 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.103 11.159 -3.880 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.080 8.631 -5.343 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.127 9.654 -4.332 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.987 7.913 -3.990 1.00 0.00 H new ATOM 443 N LEU A 32 0.691 11.548 -0.240 1.00 0.00 N ATOM 444 CA LEU A 32 -0.363 12.464 0.181 1.00 0.00 C ATOM 445 C LEU A 32 0.112 13.912 0.108 1.00 0.00 C ATOM 446 O LEU A 32 -0.470 14.733 -0.598 1.00 0.00 O ATOM 447 CB LEU A 32 -0.815 12.133 1.603 1.00 0.00 C ATOM 448 CG LEU A 32 -1.699 10.895 1.757 1.00 0.00 C ATOM 449 CD1 LEU A 32 -1.886 10.550 3.226 1.00 0.00 C ATOM 450 CD2 LEU A 32 -3.045 11.114 1.082 1.00 0.00 C ATOM 0 H LEU A 32 0.880 10.792 0.418 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.207 12.345 -0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.072 12.001 2.223 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.356 12.992 2.000 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.203 10.056 1.270 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.518 9.666 3.315 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.915 10.349 3.679 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -2.359 11.387 3.739 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.661 10.223 1.201 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.547 11.966 1.540 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.892 11.310 0.021 1.00 0.00 H new ATOM 462 N SER A 33 1.176 14.217 0.846 1.00 0.00 N ATOM 463 CA SER A 33 1.730 15.565 0.867 1.00 0.00 C ATOM 464 C SER A 33 1.609 16.224 -0.504 1.00 0.00 C ATOM 465 O SER A 33 1.142 17.356 -0.621 1.00 0.00 O ATOM 466 CB SER A 33 3.196 15.531 1.302 1.00 0.00 C ATOM 467 OG SER A 33 3.704 16.839 1.486 1.00 0.00 O ATOM 0 H SER A 33 1.671 13.548 1.437 1.00 0.00 H new ATOM 0 HA SER A 33 1.160 16.154 1.585 1.00 0.00 H new ATOM 0 HB2 SER A 33 3.290 14.967 2.230 1.00 0.00 H new ATOM 0 HB3 SER A 33 3.789 15.010 0.551 1.00 0.00 H new ATOM 0 HG SER A 33 4.642 16.789 1.765 1.00 0.00 H new ATOM 473 N SER A 34 2.036 15.507 -1.538 1.00 0.00 N ATOM 474 CA SER A 34 1.979 16.021 -2.900 1.00 0.00 C ATOM 475 C SER A 34 0.553 16.403 -3.278 1.00 0.00 C ATOM 476 O SER A 34 0.308 17.484 -3.816 1.00 0.00 O ATOM 477 CB SER A 34 2.519 14.981 -3.883 1.00 0.00 C ATOM 478 OG SER A 34 3.937 14.972 -3.890 1.00 0.00 O ATOM 0 H SER A 34 2.425 14.568 -1.458 1.00 0.00 H new ATOM 0 HA SER A 34 2.600 16.915 -2.950 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.147 13.993 -3.612 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.149 15.197 -4.885 1.00 0.00 H new ATOM 0 HG SER A 34 4.257 14.298 -4.525 1.00 0.00 H new ATOM 484 N LEU A 35 -0.388 15.507 -2.996 1.00 0.00 N ATOM 485 CA LEU A 35 -1.793 15.750 -3.305 1.00 0.00 C ATOM 486 C LEU A 35 -2.302 16.994 -2.586 1.00 0.00 C ATOM 487 O LEU A 35 -1.551 17.665 -1.878 1.00 0.00 O ATOM 488 CB LEU A 35 -2.638 14.537 -2.911 1.00 0.00 C ATOM 489 CG LEU A 35 -2.789 13.450 -3.975 1.00 0.00 C ATOM 490 CD1 LEU A 35 -3.252 12.146 -3.343 1.00 0.00 C ATOM 491 CD2 LEU A 35 -3.760 13.893 -5.058 1.00 0.00 C ATOM 0 H LEU A 35 -0.203 14.606 -2.554 1.00 0.00 H new ATOM 0 HA LEU A 35 -1.881 15.914 -4.379 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.199 14.087 -2.021 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.632 14.887 -2.634 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.815 13.282 -4.436 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -3.354 11.384 -4.115 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.520 11.819 -2.605 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -4.215 12.300 -2.855 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.854 13.106 -5.806 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.736 14.090 -4.614 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.387 14.801 -5.532 1.00 0.00 H new ATOM 503 N ILE A 36 -3.584 17.296 -2.773 1.00 0.00 N ATOM 504 CA ILE A 36 -4.193 18.458 -2.140 1.00 0.00 C ATOM 505 C ILE A 36 -4.457 18.202 -0.659 1.00 0.00 C ATOM 506 O ILE A 36 -4.337 17.076 -0.184 1.00 0.00 O ATOM 507 CB ILE A 36 -5.517 18.843 -2.828 1.00 0.00 C ATOM 508 CG1 ILE A 36 -6.569 17.755 -2.600 1.00 0.00 C ATOM 509 CG2 ILE A 36 -5.296 19.071 -4.314 1.00 0.00 C ATOM 510 CD1 ILE A 36 -7.976 18.195 -2.942 1.00 0.00 C ATOM 0 H ILE A 36 -4.219 16.752 -3.357 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.486 19.281 -2.243 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.881 19.772 -2.390 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -6.314 16.882 -3.201 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -6.538 17.444 -1.556 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.241 19.342 -4.785 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.576 19.877 -4.455 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.913 18.158 -4.769 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.669 17.374 -2.756 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -8.251 19.049 -2.323 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.023 18.479 -3.993 1.00 0.00 H new ATOM 522 N ASN A 37 -4.819 19.259 0.062 1.00 0.00 N ATOM 523 CA ASN A 37 -5.100 19.149 1.489 1.00 0.00 C ATOM 524 C ASN A 37 -6.496 18.579 1.725 1.00 0.00 C ATOM 525 O ASN A 37 -7.298 19.156 2.457 1.00 0.00 O ATOM 526 CB ASN A 37 -4.978 20.518 2.160 1.00 0.00 C ATOM 527 CG ASN A 37 -3.563 20.813 2.618 1.00 0.00 C ATOM 528 OD1 ASN A 37 -2.776 19.898 2.867 1.00 0.00 O ATOM 529 ND2 ASN A 37 -3.231 22.094 2.731 1.00 0.00 N ATOM 0 H ASN A 37 -4.924 20.200 -0.318 1.00 0.00 H new ATOM 0 HA ASN A 37 -4.369 18.469 1.927 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -5.300 21.291 1.463 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -5.651 20.561 3.017 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -2.292 22.353 3.034 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -3.915 22.819 2.514 1.00 0.00 H new ATOM 536 N GLY A 38 -6.777 17.439 1.100 1.00 0.00 N ATOM 537 CA GLY A 38 -8.074 16.808 1.254 1.00 0.00 C ATOM 538 C GLY A 38 -8.221 15.567 0.396 1.00 0.00 C ATOM 539 O GLY A 38 -9.282 15.325 -0.180 1.00 0.00 O ATOM 0 H GLY A 38 -6.129 16.942 0.490 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.223 16.542 2.300 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.855 17.522 0.992 1.00 0.00 H new ATOM 543 N SER A 39 -7.155 14.780 0.310 1.00 0.00 N ATOM 544 CA SER A 39 -7.168 13.560 -0.489 1.00 0.00 C ATOM 545 C SER A 39 -7.070 12.325 0.402 1.00 0.00 C ATOM 546 O SER A 39 -6.608 12.403 1.541 1.00 0.00 O ATOM 547 CB SER A 39 -6.013 13.570 -1.493 1.00 0.00 C ATOM 548 OG SER A 39 -6.039 14.743 -2.286 1.00 0.00 O ATOM 0 H SER A 39 -6.271 14.965 0.784 1.00 0.00 H new ATOM 0 HA SER A 39 -8.112 13.521 -1.032 1.00 0.00 H new ATOM 0 HB2 SER A 39 -5.064 13.508 -0.961 1.00 0.00 H new ATOM 0 HB3 SER A 39 -6.077 12.691 -2.135 1.00 0.00 H new ATOM 0 HG SER A 39 -6.439 14.540 -3.157 1.00 0.00 H new ATOM 554 N PHE A 40 -7.507 11.186 -0.124 1.00 0.00 N ATOM 555 CA PHE A 40 -7.472 9.935 0.623 1.00 0.00 C ATOM 556 C PHE A 40 -6.856 8.818 -0.215 1.00 0.00 C ATOM 557 O PHE A 40 -6.874 8.868 -1.445 1.00 0.00 O ATOM 558 CB PHE A 40 -8.882 9.539 1.066 1.00 0.00 C ATOM 559 CG PHE A 40 -9.666 8.830 -0.001 1.00 0.00 C ATOM 560 CD1 PHE A 40 -10.191 9.529 -1.075 1.00 0.00 C ATOM 561 CD2 PHE A 40 -9.878 7.461 0.071 1.00 0.00 C ATOM 562 CE1 PHE A 40 -10.914 8.880 -2.057 1.00 0.00 C ATOM 563 CE2 PHE A 40 -10.601 6.806 -0.909 1.00 0.00 C ATOM 564 CZ PHE A 40 -11.118 7.516 -1.975 1.00 0.00 C ATOM 0 H PHE A 40 -7.890 11.104 -1.066 1.00 0.00 H new ATOM 0 HA PHE A 40 -6.852 10.086 1.507 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -8.812 8.895 1.943 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -9.424 10.434 1.370 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -10.033 10.595 -1.146 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -9.474 6.901 0.901 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -11.319 9.438 -2.888 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -10.761 5.740 -0.841 1.00 0.00 H new ATOM 0 HZ PHE A 40 -11.681 7.006 -2.743 1.00 0.00 H new ATOM 574 N LEU A 41 -6.310 7.811 0.460 1.00 0.00 N ATOM 575 CA LEU A 41 -5.689 6.682 -0.222 1.00 0.00 C ATOM 576 C LEU A 41 -5.906 5.389 0.558 1.00 0.00 C ATOM 577 O LEU A 41 -6.193 5.415 1.754 1.00 0.00 O ATOM 578 CB LEU A 41 -4.191 6.934 -0.406 1.00 0.00 C ATOM 579 CG LEU A 41 -3.289 6.498 0.747 1.00 0.00 C ATOM 580 CD1 LEU A 41 -2.864 5.049 0.574 1.00 0.00 C ATOM 581 CD2 LEU A 41 -2.072 7.406 0.847 1.00 0.00 C ATOM 0 H LEU A 41 -6.285 7.754 1.478 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.157 6.578 -1.201 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -3.865 6.419 -1.310 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -4.041 8.000 -0.575 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.854 6.580 1.675 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -2.222 4.756 1.405 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -3.747 4.410 0.556 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -2.318 4.939 -0.363 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -1.441 7.080 1.674 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.505 7.358 -0.083 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.397 8.432 1.021 1.00 0.00 H new ATOM 593 N VAL A 42 -5.764 4.259 -0.129 1.00 0.00 N ATOM 594 CA VAL A 42 -5.942 2.955 0.500 1.00 0.00 C ATOM 595 C VAL A 42 -4.754 2.043 0.217 1.00 0.00 C ATOM 596 O VAL A 42 -4.485 1.695 -0.933 1.00 0.00 O ATOM 597 CB VAL A 42 -7.230 2.268 0.013 1.00 0.00 C ATOM 598 CG1 VAL A 42 -7.478 0.984 0.790 1.00 0.00 C ATOM 599 CG2 VAL A 42 -8.417 3.212 0.135 1.00 0.00 C ATOM 0 H VAL A 42 -5.526 4.220 -1.120 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.016 3.128 1.574 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.107 2.010 -1.039 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -8.393 0.513 0.431 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -6.639 0.304 0.646 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -7.580 1.214 1.850 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -9.319 2.709 -0.214 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -8.544 3.504 1.178 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.239 4.100 -0.471 1.00 0.00 H new ATOM 609 N ARG A 43 -4.045 1.658 1.274 1.00 0.00 N ATOM 610 CA ARG A 43 -2.885 0.786 1.138 1.00 0.00 C ATOM 611 C ARG A 43 -3.106 -0.531 1.876 1.00 0.00 C ATOM 612 O ARG A 43 -3.960 -0.623 2.758 1.00 0.00 O ATOM 613 CB ARG A 43 -1.632 1.481 1.676 1.00 0.00 C ATOM 614 CG ARG A 43 -1.710 1.819 3.156 1.00 0.00 C ATOM 615 CD ARG A 43 -0.350 2.206 3.713 1.00 0.00 C ATOM 616 NE ARG A 43 0.506 1.042 3.926 1.00 0.00 N ATOM 617 CZ ARG A 43 1.552 1.039 4.746 1.00 0.00 C ATOM 618 NH1 ARG A 43 1.869 2.133 5.424 1.00 0.00 N ATOM 619 NH2 ARG A 43 2.283 -0.058 4.886 1.00 0.00 N ATOM 0 H ARG A 43 -4.254 1.936 2.233 1.00 0.00 H new ATOM 0 HA ARG A 43 -2.746 0.570 0.079 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -0.768 0.839 1.504 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -1.465 2.398 1.111 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -2.412 2.639 3.306 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -2.099 0.962 3.706 1.00 0.00 H new ATOM 0 HD2 ARG A 43 0.140 2.895 3.026 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -0.482 2.736 4.656 1.00 0.00 H new ATOM 0 HE ARG A 43 0.289 0.185 3.418 1.00 0.00 H new ATOM 0 HH11 ARG A 43 1.310 2.979 5.317 1.00 0.00 H new ATOM 0 HH12 ARG A 43 2.672 2.129 6.053 1.00 0.00 H new ATOM 0 HH21 ARG A 43 2.043 -0.901 4.364 1.00 0.00 H new ATOM 0 HH22 ARG A 43 3.086 -0.059 5.516 1.00 0.00 H new ATOM 633 N GLU A 44 -2.328 -1.546 1.511 1.00 0.00 N ATOM 634 CA GLU A 44 -2.442 -2.857 2.138 1.00 0.00 C ATOM 635 C GLU A 44 -1.440 -3.002 3.280 1.00 0.00 C ATOM 636 O GLU A 44 -0.289 -2.580 3.169 1.00 0.00 O ATOM 637 CB GLU A 44 -2.216 -3.962 1.104 1.00 0.00 C ATOM 638 CG GLU A 44 -2.908 -5.271 1.451 1.00 0.00 C ATOM 639 CD GLU A 44 -4.325 -5.340 0.916 1.00 0.00 C ATOM 640 OE1 GLU A 44 -5.202 -5.875 1.627 1.00 0.00 O ATOM 641 OE2 GLU A 44 -4.559 -4.859 -0.212 1.00 0.00 O ATOM 0 H GLU A 44 -1.613 -1.485 0.786 1.00 0.00 H new ATOM 0 HA GLU A 44 -3.448 -2.951 2.546 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.573 -3.618 0.133 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.146 -4.142 1.005 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -2.330 -6.102 1.047 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -2.926 -5.392 2.534 1.00 0.00 H new ATOM 649 N SER A 45 -1.888 -3.601 4.380 1.00 0.00 N ATOM 650 CA SER A 45 -1.033 -3.797 5.545 1.00 0.00 C ATOM 651 C SER A 45 0.183 -4.646 5.189 1.00 0.00 C ATOM 652 O SER A 45 0.117 -5.509 4.315 1.00 0.00 O ATOM 653 CB SER A 45 -1.821 -4.464 6.675 1.00 0.00 C ATOM 654 OG SER A 45 -1.022 -4.611 7.835 1.00 0.00 O ATOM 0 H SER A 45 -2.837 -3.958 4.488 1.00 0.00 H new ATOM 0 HA SER A 45 -0.687 -2.819 5.880 1.00 0.00 H new ATOM 0 HB2 SER A 45 -2.702 -3.867 6.910 1.00 0.00 H new ATOM 0 HB3 SER A 45 -2.176 -5.441 6.348 1.00 0.00 H new ATOM 0 HG SER A 45 -0.931 -5.563 8.051 1.00 0.00 H new ATOM 660 N GLU A 46 1.295 -4.392 5.874 1.00 0.00 N ATOM 661 CA GLU A 46 2.528 -5.131 5.629 1.00 0.00 C ATOM 662 C GLU A 46 2.437 -6.544 6.201 1.00 0.00 C ATOM 663 O GLU A 46 2.809 -7.516 5.545 1.00 0.00 O ATOM 664 CB GLU A 46 3.720 -4.395 6.245 1.00 0.00 C ATOM 665 CG GLU A 46 5.066 -4.945 5.804 1.00 0.00 C ATOM 666 CD GLU A 46 6.213 -4.009 6.131 1.00 0.00 C ATOM 667 OE1 GLU A 46 6.166 -2.839 5.696 1.00 0.00 O ATOM 668 OE2 GLU A 46 7.158 -4.446 6.821 1.00 0.00 O ATOM 0 H GLU A 46 1.367 -3.681 6.602 1.00 0.00 H new ATOM 0 HA GLU A 46 2.672 -5.202 4.551 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.663 -3.340 5.978 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.651 -4.453 7.331 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.237 -5.907 6.287 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.046 -5.127 4.730 1.00 0.00 H new ATOM 676 N SER A 47 1.941 -6.647 7.431 1.00 0.00 N ATOM 677 CA SER A 47 1.806 -7.938 8.093 1.00 0.00 C ATOM 678 C SER A 47 1.163 -8.962 7.163 1.00 0.00 C ATOM 679 O SER A 47 1.794 -9.944 6.772 1.00 0.00 O ATOM 680 CB SER A 47 0.973 -7.796 9.368 1.00 0.00 C ATOM 681 OG SER A 47 -0.320 -7.292 9.079 1.00 0.00 O ATOM 0 H SER A 47 1.627 -5.852 7.988 1.00 0.00 H new ATOM 0 HA SER A 47 2.804 -8.289 8.356 1.00 0.00 H new ATOM 0 HB2 SER A 47 0.887 -8.765 9.860 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.480 -7.128 10.065 1.00 0.00 H new ATOM 0 HG SER A 47 -0.983 -7.758 9.630 1.00 0.00 H new ATOM 687 N SER A 48 -0.098 -8.725 6.814 1.00 0.00 N ATOM 688 CA SER A 48 -0.829 -9.627 5.934 1.00 0.00 C ATOM 689 C SER A 48 -1.474 -8.860 4.783 1.00 0.00 C ATOM 690 O SER A 48 -1.944 -7.734 4.941 1.00 0.00 O ATOM 691 CB SER A 48 -1.901 -10.384 6.720 1.00 0.00 C ATOM 692 OG SER A 48 -1.316 -11.264 7.664 1.00 0.00 O ATOM 0 H SER A 48 -0.634 -7.916 7.128 1.00 0.00 H new ATOM 0 HA SER A 48 -0.119 -10.343 5.519 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.549 -9.674 7.233 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.529 -10.949 6.032 1.00 0.00 H new ATOM 0 HG SER A 48 -2.022 -11.734 8.154 1.00 0.00 H new ATOM 698 N PRO A 49 -1.496 -9.484 3.596 1.00 0.00 N ATOM 699 CA PRO A 49 -2.078 -8.879 2.395 1.00 0.00 C ATOM 700 C PRO A 49 -3.598 -8.775 2.477 1.00 0.00 C ATOM 701 O PRO A 49 -4.262 -8.442 1.497 1.00 0.00 O ATOM 702 CB PRO A 49 -1.670 -9.843 1.278 1.00 0.00 C ATOM 703 CG PRO A 49 -1.471 -11.153 1.961 1.00 0.00 C ATOM 704 CD PRO A 49 -0.953 -10.828 3.336 1.00 0.00 C ATOM 0 HA PRO A 49 -1.729 -7.857 2.244 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -2.442 -9.910 0.511 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -0.757 -9.512 0.783 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -2.406 -11.710 2.018 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -0.763 -11.775 1.414 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -1.297 -11.550 4.076 1.00 0.00 H new ATOM 0 HD3 PRO A 49 0.137 -10.834 3.367 1.00 0.00 H new ATOM 712 N GLY A 50 -4.142 -9.060 3.657 1.00 0.00 N ATOM 713 CA GLY A 50 -5.579 -8.992 3.846 1.00 0.00 C ATOM 714 C GLY A 50 -6.018 -7.694 4.496 1.00 0.00 C ATOM 715 O GLY A 50 -6.973 -7.060 4.047 1.00 0.00 O ATOM 0 H GLY A 50 -3.613 -9.336 4.484 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -6.075 -9.097 2.881 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -5.901 -9.831 4.463 1.00 0.00 H new ATOM 719 N GLN A 51 -5.321 -7.300 5.557 1.00 0.00 N ATOM 720 CA GLN A 51 -5.645 -6.071 6.270 1.00 0.00 C ATOM 721 C GLN A 51 -5.513 -4.859 5.354 1.00 0.00 C ATOM 722 O GLN A 51 -4.808 -4.904 4.345 1.00 0.00 O ATOM 723 CB GLN A 51 -4.733 -5.907 7.487 1.00 0.00 C ATOM 724 CG GLN A 51 -5.214 -6.666 8.714 1.00 0.00 C ATOM 725 CD GLN A 51 -4.426 -6.318 9.961 1.00 0.00 C ATOM 726 OE1 GLN A 51 -5.000 -6.039 11.014 1.00 0.00 O ATOM 727 NE2 GLN A 51 -3.103 -6.333 9.849 1.00 0.00 N ATOM 0 H GLN A 51 -4.528 -7.814 5.941 1.00 0.00 H new ATOM 0 HA GLN A 51 -6.680 -6.138 6.606 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.731 -6.249 7.228 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -4.655 -4.848 7.732 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -6.268 -6.447 8.882 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -5.137 -7.737 8.527 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.669 -6.570 8.957 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -2.520 -6.108 10.655 1.00 0.00 H new ATOM 736 N LEU A 52 -6.195 -3.776 5.712 1.00 0.00 N ATOM 737 CA LEU A 52 -6.153 -2.550 4.921 1.00 0.00 C ATOM 738 C LEU A 52 -6.161 -1.320 5.824 1.00 0.00 C ATOM 739 O LEU A 52 -6.405 -1.421 7.026 1.00 0.00 O ATOM 740 CB LEU A 52 -7.343 -2.499 3.960 1.00 0.00 C ATOM 741 CG LEU A 52 -7.212 -3.335 2.687 1.00 0.00 C ATOM 742 CD1 LEU A 52 -8.577 -3.565 2.058 1.00 0.00 C ATOM 743 CD2 LEU A 52 -6.275 -2.656 1.698 1.00 0.00 C ATOM 0 H LEU A 52 -6.783 -3.722 6.544 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.228 -2.549 4.345 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.233 -2.828 4.497 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -7.509 -1.461 3.674 1.00 0.00 H new ATOM 0 HG LEU A 52 -6.789 -4.304 2.952 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.465 -4.162 1.153 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.218 -4.093 2.764 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -9.028 -2.605 1.806 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.193 -3.265 0.798 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.670 -1.674 1.438 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.290 -2.542 2.150 1.00 0.00 H new ATOM 755 N SER A 53 -5.895 -0.159 5.234 1.00 0.00 N ATOM 756 CA SER A 53 -5.870 1.091 5.986 1.00 0.00 C ATOM 757 C SER A 53 -6.109 2.283 5.063 1.00 0.00 C ATOM 758 O SER A 53 -5.624 2.312 3.930 1.00 0.00 O ATOM 759 CB SER A 53 -4.531 1.250 6.707 1.00 0.00 C ATOM 760 OG SER A 53 -4.462 2.491 7.389 1.00 0.00 O ATOM 0 H SER A 53 -5.694 -0.058 4.239 1.00 0.00 H new ATOM 0 HA SER A 53 -6.670 1.059 6.725 1.00 0.00 H new ATOM 0 HB2 SER A 53 -4.398 0.434 7.417 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.716 1.182 5.986 1.00 0.00 H new ATOM 0 HG SER A 53 -3.597 2.567 7.843 1.00 0.00 H new ATOM 766 N ILE A 54 -6.855 3.265 5.557 1.00 0.00 N ATOM 767 CA ILE A 54 -7.156 4.460 4.780 1.00 0.00 C ATOM 768 C ILE A 54 -6.302 5.639 5.230 1.00 0.00 C ATOM 769 O ILE A 54 -6.616 6.306 6.216 1.00 0.00 O ATOM 770 CB ILE A 54 -8.644 4.844 4.893 1.00 0.00 C ATOM 771 CG1 ILE A 54 -9.523 3.758 4.272 1.00 0.00 C ATOM 772 CG2 ILE A 54 -8.896 6.186 4.220 1.00 0.00 C ATOM 773 CD1 ILE A 54 -10.894 3.656 4.903 1.00 0.00 C ATOM 0 H ILE A 54 -7.262 3.256 6.492 1.00 0.00 H new ATOM 0 HA ILE A 54 -6.927 4.226 3.740 1.00 0.00 H new ATOM 0 HB ILE A 54 -8.902 4.933 5.948 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -9.636 3.959 3.207 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -9.018 2.797 4.363 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -9.951 6.444 4.308 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -8.293 6.954 4.703 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -8.625 6.121 3.166 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -11.462 2.866 4.413 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -10.790 3.424 5.963 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -11.419 4.605 4.789 1.00 0.00 H new ATOM 785 N SER A 55 -5.220 5.892 4.500 1.00 0.00 N ATOM 786 CA SER A 55 -4.318 6.991 4.825 1.00 0.00 C ATOM 787 C SER A 55 -4.691 8.249 4.047 1.00 0.00 C ATOM 788 O SER A 55 -4.320 8.407 2.883 1.00 0.00 O ATOM 789 CB SER A 55 -2.871 6.598 4.520 1.00 0.00 C ATOM 790 OG SER A 55 -2.367 5.707 5.499 1.00 0.00 O ATOM 0 H SER A 55 -4.947 5.351 3.680 1.00 0.00 H new ATOM 0 HA SER A 55 -4.412 7.203 5.890 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.817 6.131 3.537 1.00 0.00 H new ATOM 0 HB3 SER A 55 -2.248 7.492 4.482 1.00 0.00 H new ATOM 0 HG SER A 55 -1.442 5.470 5.280 1.00 0.00 H new ATOM 796 N LEU A 56 -5.428 9.143 4.698 1.00 0.00 N ATOM 797 CA LEU A 56 -5.853 10.388 4.068 1.00 0.00 C ATOM 798 C LEU A 56 -5.233 11.593 4.772 1.00 0.00 C ATOM 799 O LEU A 56 -5.065 11.593 5.991 1.00 0.00 O ATOM 800 CB LEU A 56 -7.378 10.499 4.090 1.00 0.00 C ATOM 801 CG LEU A 56 -7.985 11.175 5.320 1.00 0.00 C ATOM 802 CD1 LEU A 56 -7.939 12.689 5.175 1.00 0.00 C ATOM 803 CD2 LEU A 56 -9.415 10.700 5.538 1.00 0.00 C ATOM 0 H LEU A 56 -5.743 9.029 5.661 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.511 10.379 3.033 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -7.695 11.050 3.204 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -7.796 9.496 4.008 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.394 10.897 6.193 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.375 13.153 6.060 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.904 13.013 5.069 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.505 12.987 4.293 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -9.831 11.191 6.417 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -10.018 10.948 4.664 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -9.421 9.620 5.689 1.00 0.00 H new ATOM 815 N ARG A 57 -4.899 12.617 3.994 1.00 0.00 N ATOM 816 CA ARG A 57 -4.301 13.828 4.544 1.00 0.00 C ATOM 817 C ARG A 57 -5.369 14.875 4.842 1.00 0.00 C ATOM 818 O ARG A 57 -6.339 15.017 4.098 1.00 0.00 O ATOM 819 CB ARG A 57 -3.270 14.400 3.567 1.00 0.00 C ATOM 820 CG ARG A 57 -2.726 15.757 3.981 1.00 0.00 C ATOM 821 CD ARG A 57 -1.563 15.621 4.952 1.00 0.00 C ATOM 822 NE ARG A 57 -0.479 14.817 4.395 1.00 0.00 N ATOM 823 CZ ARG A 57 0.646 14.546 5.048 1.00 0.00 C ATOM 824 NH1 ARG A 57 0.832 15.013 6.275 1.00 0.00 N ATOM 825 NH2 ARG A 57 1.587 13.808 4.475 1.00 0.00 N ATOM 0 H ARG A 57 -5.032 12.633 2.983 1.00 0.00 H new ATOM 0 HA ARG A 57 -3.803 13.566 5.478 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -2.441 13.698 3.475 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.726 14.486 2.581 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -2.400 16.304 3.096 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -3.521 16.343 4.444 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -1.186 16.611 5.208 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.914 15.165 5.878 1.00 0.00 H new ATOM 0 HE ARG A 57 -0.592 14.443 3.453 1.00 0.00 H new ATOM 0 HH11 ARG A 57 0.111 15.581 6.719 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.696 14.804 6.775 1.00 0.00 H new ATOM 0 HH21 ARG A 57 1.448 13.447 3.531 1.00 0.00 H new ATOM 0 HH22 ARG A 57 2.450 13.601 4.978 1.00 0.00 H new ATOM 839 N TYR A 58 -5.183 15.605 5.936 1.00 0.00 N ATOM 840 CA TYR A 58 -6.131 16.638 6.336 1.00 0.00 C ATOM 841 C TYR A 58 -5.544 17.523 7.432 1.00 0.00 C ATOM 842 O TYR A 58 -5.049 17.030 8.444 1.00 0.00 O ATOM 843 CB TYR A 58 -7.435 16.002 6.823 1.00 0.00 C ATOM 844 CG TYR A 58 -8.540 17.003 7.076 1.00 0.00 C ATOM 845 CD1 TYR A 58 -8.597 17.720 8.263 1.00 0.00 C ATOM 846 CD2 TYR A 58 -9.527 17.229 6.124 1.00 0.00 C ATOM 847 CE1 TYR A 58 -9.606 18.634 8.497 1.00 0.00 C ATOM 848 CE2 TYR A 58 -10.540 18.144 6.349 1.00 0.00 C ATOM 849 CZ TYR A 58 -10.574 18.843 7.538 1.00 0.00 C ATOM 850 OH TYR A 58 -11.579 19.754 7.767 1.00 0.00 O ATOM 0 H TYR A 58 -4.384 15.501 6.562 1.00 0.00 H new ATOM 0 HA TYR A 58 -6.340 17.260 5.465 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -7.775 15.278 6.083 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -7.239 15.450 7.742 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -7.840 17.561 9.016 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -9.503 16.681 5.193 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -9.636 19.182 9.427 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -11.299 18.310 5.599 1.00 0.00 H new ATOM 0 HH TYR A 58 -12.178 19.782 6.992 1.00 0.00 H new ATOM 860 N GLU A 59 -5.604 18.835 7.219 1.00 0.00 N ATOM 861 CA GLU A 59 -5.079 19.789 8.188 1.00 0.00 C ATOM 862 C GLU A 59 -3.642 19.444 8.567 1.00 0.00 C ATOM 863 O GLU A 59 -3.269 19.490 9.740 1.00 0.00 O ATOM 864 CB GLU A 59 -5.957 19.814 9.442 1.00 0.00 C ATOM 865 CG GLU A 59 -7.191 20.690 9.302 1.00 0.00 C ATOM 866 CD GLU A 59 -6.850 22.162 9.181 1.00 0.00 C ATOM 867 OE1 GLU A 59 -7.082 22.907 10.157 1.00 0.00 O ATOM 868 OE2 GLU A 59 -6.353 22.570 8.110 1.00 0.00 O ATOM 0 H GLU A 59 -6.010 19.260 6.385 1.00 0.00 H new ATOM 0 HA GLU A 59 -5.088 20.777 7.728 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.269 18.796 9.678 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.363 20.169 10.284 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -7.756 20.378 8.423 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -7.838 20.541 10.166 1.00 0.00 H new ATOM 876 N GLY A 60 -2.838 19.096 7.566 1.00 0.00 N ATOM 877 CA GLY A 60 -1.451 18.748 7.815 1.00 0.00 C ATOM 878 C GLY A 60 -1.311 17.532 8.710 1.00 0.00 C ATOM 879 O GLY A 60 -0.400 17.463 9.536 1.00 0.00 O ATOM 0 H GLY A 60 -3.123 19.049 6.588 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -0.951 18.556 6.865 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.944 19.595 8.276 1.00 0.00 H new ATOM 883 N ARG A 61 -2.216 16.573 8.549 1.00 0.00 N ATOM 884 CA ARG A 61 -2.191 15.357 9.352 1.00 0.00 C ATOM 885 C ARG A 61 -2.531 14.136 8.502 1.00 0.00 C ATOM 886 O ARG A 61 -3.246 14.241 7.504 1.00 0.00 O ATOM 887 CB ARG A 61 -3.174 15.468 10.518 1.00 0.00 C ATOM 888 CG ARG A 61 -2.741 16.462 11.585 1.00 0.00 C ATOM 889 CD ARG A 61 -3.935 17.015 12.348 1.00 0.00 C ATOM 890 NE ARG A 61 -3.531 17.953 13.391 1.00 0.00 N ATOM 891 CZ ARG A 61 -4.375 18.480 14.273 1.00 0.00 C ATOM 892 NH1 ARG A 61 -5.661 18.161 14.237 1.00 0.00 N ATOM 893 NH2 ARG A 61 -3.931 19.328 15.192 1.00 0.00 N ATOM 0 H ARG A 61 -2.976 16.614 7.870 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.182 15.235 9.747 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -4.150 15.763 10.133 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -3.295 14.486 10.975 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -2.057 15.976 12.280 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -2.194 17.282 11.120 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -4.610 17.515 11.653 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -4.491 16.192 12.796 1.00 0.00 H new ATOM 0 HE ARG A 61 -2.548 18.219 13.446 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -6.005 17.510 13.532 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -6.306 18.567 14.915 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -2.942 19.576 15.222 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -4.579 19.732 15.868 1.00 0.00 H new ATOM 907 N VAL A 62 -2.015 12.978 8.902 1.00 0.00 N ATOM 908 CA VAL A 62 -2.266 11.739 8.178 1.00 0.00 C ATOM 909 C VAL A 62 -3.033 10.743 9.042 1.00 0.00 C ATOM 910 O VAL A 62 -2.456 10.080 9.903 1.00 0.00 O ATOM 911 CB VAL A 62 -0.951 11.088 7.709 1.00 0.00 C ATOM 912 CG1 VAL A 62 -1.236 9.890 6.816 1.00 0.00 C ATOM 913 CG2 VAL A 62 -0.081 12.105 6.987 1.00 0.00 C ATOM 0 H VAL A 62 -1.420 12.873 9.724 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.867 11.998 7.306 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.408 10.736 8.586 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.295 9.444 6.495 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -1.817 9.153 7.370 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -1.801 10.214 5.942 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.844 11.628 6.663 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.615 12.489 6.118 1.00 0.00 H new ATOM 0 HG23 VAL A 62 0.153 12.928 7.662 1.00 0.00 H new ATOM 923 N TYR A 63 -4.336 10.643 8.803 1.00 0.00 N ATOM 924 CA TYR A 63 -5.184 9.729 9.560 1.00 0.00 C ATOM 925 C TYR A 63 -5.159 8.331 8.948 1.00 0.00 C ATOM 926 O TYR A 63 -5.108 8.175 7.728 1.00 0.00 O ATOM 927 CB TYR A 63 -6.619 10.252 9.606 1.00 0.00 C ATOM 928 CG TYR A 63 -6.760 11.574 10.327 1.00 0.00 C ATOM 929 CD1 TYR A 63 -6.866 11.623 11.711 1.00 0.00 C ATOM 930 CD2 TYR A 63 -6.786 12.773 9.625 1.00 0.00 C ATOM 931 CE1 TYR A 63 -6.996 12.828 12.376 1.00 0.00 C ATOM 932 CE2 TYR A 63 -6.914 13.982 10.281 1.00 0.00 C ATOM 933 CZ TYR A 63 -7.018 14.003 11.657 1.00 0.00 C ATOM 934 OH TYR A 63 -7.146 15.207 12.314 1.00 0.00 O ATOM 0 H TYR A 63 -4.828 11.183 8.091 1.00 0.00 H new ATOM 0 HA TYR A 63 -4.794 9.669 10.576 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -6.989 10.363 8.587 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.251 9.511 10.096 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -6.847 10.704 12.278 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -6.705 12.759 8.548 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -7.080 12.848 13.453 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.933 14.905 9.721 1.00 0.00 H new ATOM 0 HH TYR A 63 -7.143 15.938 11.661 1.00 0.00 H new ATOM 944 N HIS A 64 -5.195 7.317 9.807 1.00 0.00 N ATOM 945 CA HIS A 64 -5.178 5.931 9.353 1.00 0.00 C ATOM 946 C HIS A 64 -6.352 5.152 9.942 1.00 0.00 C ATOM 947 O HIS A 64 -6.388 4.878 11.142 1.00 0.00 O ATOM 948 CB HIS A 64 -3.861 5.260 9.743 1.00 0.00 C ATOM 949 CG HIS A 64 -3.362 5.662 11.096 1.00 0.00 C ATOM 950 ND1 HIS A 64 -2.031 5.605 11.455 1.00 0.00 N ATOM 951 CD2 HIS A 64 -4.021 6.129 12.181 1.00 0.00 C ATOM 952 CE1 HIS A 64 -1.896 6.019 12.702 1.00 0.00 C ATOM 953 NE2 HIS A 64 -3.089 6.344 13.165 1.00 0.00 N ATOM 0 H HIS A 64 -5.236 7.429 10.820 1.00 0.00 H new ATOM 0 HA HIS A 64 -5.271 5.930 8.267 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.993 4.178 9.720 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -3.104 5.504 8.998 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -5.084 6.301 12.259 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -0.967 6.081 13.250 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -3.286 6.697 14.101 1.00 0.00 H new ATOM 962 N TYR A 65 -7.308 4.800 9.091 1.00 0.00 N ATOM 963 CA TYR A 65 -8.484 4.056 9.527 1.00 0.00 C ATOM 964 C TYR A 65 -8.306 2.562 9.277 1.00 0.00 C ATOM 965 O TYR A 65 -8.296 2.108 8.133 1.00 0.00 O ATOM 966 CB TYR A 65 -9.731 4.561 8.800 1.00 0.00 C ATOM 967 CG TYR A 65 -9.930 6.055 8.905 1.00 0.00 C ATOM 968 CD1 TYR A 65 -9.181 6.931 8.129 1.00 0.00 C ATOM 969 CD2 TYR A 65 -10.867 6.593 9.778 1.00 0.00 C ATOM 970 CE1 TYR A 65 -9.359 8.299 8.222 1.00 0.00 C ATOM 971 CE2 TYR A 65 -11.053 7.957 9.877 1.00 0.00 C ATOM 972 CZ TYR A 65 -10.296 8.806 9.097 1.00 0.00 C ATOM 973 OH TYR A 65 -10.477 10.167 9.192 1.00 0.00 O ATOM 0 H TYR A 65 -7.292 5.018 8.095 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.607 4.215 10.598 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -9.664 4.285 7.748 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.608 4.057 9.207 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -8.447 6.537 7.442 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -11.461 5.931 10.391 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -8.768 8.966 7.613 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -11.787 8.357 10.561 1.00 0.00 H new ATOM 0 HH TYR A 65 -10.610 10.415 10.131 1.00 0.00 H new ATOM 983 N ARG A 66 -8.166 1.800 10.359 1.00 0.00 N ATOM 984 CA ARG A 66 -7.988 0.357 10.259 1.00 0.00 C ATOM 985 C ARG A 66 -9.313 -0.334 9.950 1.00 0.00 C ATOM 986 O ARG A 66 -10.081 -0.661 10.855 1.00 0.00 O ATOM 987 CB ARG A 66 -7.404 -0.197 11.560 1.00 0.00 C ATOM 988 CG ARG A 66 -6.994 -1.657 11.470 1.00 0.00 C ATOM 989 CD ARG A 66 -5.661 -1.817 10.754 1.00 0.00 C ATOM 990 NE ARG A 66 -4.952 -3.022 11.179 1.00 0.00 N ATOM 991 CZ ARG A 66 -4.453 -3.189 12.398 1.00 0.00 C ATOM 992 NH1 ARG A 66 -4.586 -2.234 13.310 1.00 0.00 N ATOM 993 NH2 ARG A 66 -3.821 -4.313 12.710 1.00 0.00 N ATOM 0 H ARG A 66 -8.173 2.159 11.314 1.00 0.00 H new ATOM 0 HA ARG A 66 -7.294 0.157 9.442 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -6.536 0.399 11.841 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -8.140 -0.083 12.356 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -6.923 -2.079 12.473 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -7.763 -2.220 10.941 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -5.830 -1.856 9.678 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -5.039 -0.943 10.947 1.00 0.00 H new ATOM 0 HE ARG A 66 -4.834 -3.776 10.502 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -5.073 -1.369 13.075 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -4.202 -2.365 14.246 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -3.718 -5.050 12.013 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -3.438 -4.440 13.647 1.00 0.00 H new ATOM 1007 N ILE A 67 -9.574 -0.552 8.665 1.00 0.00 N ATOM 1008 CA ILE A 67 -10.805 -1.204 8.237 1.00 0.00 C ATOM 1009 C ILE A 67 -11.066 -2.472 9.044 1.00 0.00 C ATOM 1010 O ILE A 67 -10.341 -3.458 8.919 1.00 0.00 O ATOM 1011 CB ILE A 67 -10.761 -1.563 6.740 1.00 0.00 C ATOM 1012 CG1 ILE A 67 -10.521 -0.308 5.898 1.00 0.00 C ATOM 1013 CG2 ILE A 67 -12.051 -2.248 6.321 1.00 0.00 C ATOM 1014 CD1 ILE A 67 -9.056 0.010 5.689 1.00 0.00 C ATOM 0 H ILE A 67 -8.950 -0.287 7.903 1.00 0.00 H new ATOM 0 HA ILE A 67 -11.614 -0.494 8.409 1.00 0.00 H new ATOM 0 HB ILE A 67 -9.935 -2.254 6.573 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -10.999 -0.435 4.927 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.003 0.542 6.381 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -12.004 -2.495 5.260 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.183 -3.161 6.901 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -12.893 -1.579 6.501 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -8.962 0.912 5.084 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -8.577 0.170 6.655 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -8.572 -0.822 5.178 1.00 0.00 H new ATOM 1026 N ASN A 68 -12.105 -2.437 9.870 1.00 0.00 N ATOM 1027 CA ASN A 68 -12.463 -3.584 10.697 1.00 0.00 C ATOM 1028 C ASN A 68 -13.132 -4.670 9.861 1.00 0.00 C ATOM 1029 O ASN A 68 -13.564 -4.425 8.733 1.00 0.00 O ATOM 1030 CB ASN A 68 -13.396 -3.150 11.830 1.00 0.00 C ATOM 1031 CG ASN A 68 -12.737 -2.161 12.774 1.00 0.00 C ATOM 1032 OD1 ASN A 68 -11.583 -2.334 13.165 1.00 0.00 O ATOM 1033 ND2 ASN A 68 -13.473 -1.120 13.146 1.00 0.00 N ATOM 0 H ASN A 68 -12.714 -1.627 9.985 1.00 0.00 H new ATOM 0 HA ASN A 68 -11.547 -3.992 11.125 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -14.294 -2.701 11.406 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -13.714 -4.028 12.392 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -13.086 -0.423 13.782 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -14.426 -1.018 12.796 1.00 0.00 H new ATOM 1040 N THR A 69 -13.218 -5.873 10.421 1.00 0.00 N ATOM 1041 CA THR A 69 -13.833 -6.997 9.728 1.00 0.00 C ATOM 1042 C THR A 69 -14.718 -7.805 10.670 1.00 0.00 C ATOM 1043 O THR A 69 -14.340 -8.085 11.808 1.00 0.00 O ATOM 1044 CB THR A 69 -12.771 -7.929 9.114 1.00 0.00 C ATOM 1045 OG1 THR A 69 -11.860 -7.170 8.310 1.00 0.00 O ATOM 1046 CG2 THR A 69 -13.423 -9.010 8.265 1.00 0.00 C ATOM 0 H THR A 69 -12.869 -6.093 11.354 1.00 0.00 H new ATOM 0 HA THR A 69 -14.444 -6.579 8.928 1.00 0.00 H new ATOM 0 HB THR A 69 -12.227 -8.408 9.928 1.00 0.00 H new ATOM 0 HG1 THR A 69 -11.187 -7.769 7.924 1.00 0.00 H new ATOM 0 HG21 THR A 69 -12.653 -9.655 7.843 1.00 0.00 H new ATOM 0 HG22 THR A 69 -14.094 -9.604 8.885 1.00 0.00 H new ATOM 0 HG23 THR A 69 -13.990 -8.546 7.458 1.00 0.00 H new ATOM 1054 N THR A 70 -15.899 -8.181 10.187 1.00 0.00 N ATOM 1055 CA THR A 70 -16.838 -8.958 10.988 1.00 0.00 C ATOM 1056 C THR A 70 -16.595 -10.453 10.823 1.00 0.00 C ATOM 1057 O THR A 70 -15.744 -10.870 10.038 1.00 0.00 O ATOM 1058 CB THR A 70 -18.297 -8.642 10.605 1.00 0.00 C ATOM 1059 OG1 THR A 70 -18.602 -9.214 9.328 1.00 0.00 O ATOM 1060 CG2 THR A 70 -18.532 -7.139 10.560 1.00 0.00 C ATOM 0 H THR A 70 -16.227 -7.960 9.247 1.00 0.00 H new ATOM 0 HA THR A 70 -16.673 -8.678 12.029 1.00 0.00 H new ATOM 0 HB THR A 70 -18.950 -9.074 11.363 1.00 0.00 H new ATOM 0 HG1 THR A 70 -19.531 -9.011 9.092 1.00 0.00 H new ATOM 0 HG21 THR A 70 -19.569 -6.941 10.288 1.00 0.00 H new ATOM 0 HG22 THR A 70 -18.326 -6.709 11.540 1.00 0.00 H new ATOM 0 HG23 THR A 70 -17.870 -6.689 9.820 1.00 0.00 H new ATOM 1068 N ALA A 71 -17.346 -11.256 11.569 1.00 0.00 N ATOM 1069 CA ALA A 71 -17.213 -12.707 11.504 1.00 0.00 C ATOM 1070 C ALA A 71 -17.447 -13.215 10.086 1.00 0.00 C ATOM 1071 O ALA A 71 -16.657 -14.000 9.560 1.00 0.00 O ATOM 1072 CB ALA A 71 -18.182 -13.370 12.471 1.00 0.00 C ATOM 0 H ALA A 71 -18.053 -10.927 12.226 1.00 0.00 H new ATOM 0 HA ALA A 71 -16.195 -12.968 11.793 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -18.072 -14.453 12.412 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -17.966 -13.038 13.487 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -19.203 -13.095 12.209 1.00 0.00 H new ATOM 1078 N ASP A 72 -18.537 -12.765 9.472 1.00 0.00 N ATOM 1079 CA ASP A 72 -18.875 -13.176 8.115 1.00 0.00 C ATOM 1080 C ASP A 72 -17.787 -12.753 7.133 1.00 0.00 C ATOM 1081 O ASP A 72 -17.263 -13.572 6.379 1.00 0.00 O ATOM 1082 CB ASP A 72 -20.217 -12.576 7.698 1.00 0.00 C ATOM 1083 CG ASP A 72 -21.370 -13.097 8.534 1.00 0.00 C ATOM 1084 OD1 ASP A 72 -21.999 -12.286 9.246 1.00 0.00 O ATOM 1085 OD2 ASP A 72 -21.642 -14.313 8.477 1.00 0.00 O ATOM 0 H ASP A 72 -19.201 -12.115 9.893 1.00 0.00 H new ATOM 0 HA ASP A 72 -18.951 -14.263 8.099 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -20.169 -11.491 7.786 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -20.402 -12.802 6.648 1.00 0.00 H new ATOM 1091 N GLY A 73 -17.452 -11.466 7.146 1.00 0.00 N ATOM 1092 CA GLY A 73 -16.429 -10.956 6.252 1.00 0.00 C ATOM 1093 C GLY A 73 -16.828 -9.647 5.601 1.00 0.00 C ATOM 1094 O GLY A 73 -16.789 -9.514 4.378 1.00 0.00 O ATOM 0 H GLY A 73 -17.871 -10.768 7.760 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -15.503 -10.814 6.808 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -16.226 -11.696 5.478 1.00 0.00 H new ATOM 1098 N LYS A 74 -17.216 -8.675 6.420 1.00 0.00 N ATOM 1099 CA LYS A 74 -17.626 -7.369 5.919 1.00 0.00 C ATOM 1100 C LYS A 74 -16.684 -6.276 6.415 1.00 0.00 C ATOM 1101 O LYS A 74 -16.094 -6.390 7.488 1.00 0.00 O ATOM 1102 CB LYS A 74 -19.060 -7.057 6.356 1.00 0.00 C ATOM 1103 CG LYS A 74 -20.084 -8.049 5.831 1.00 0.00 C ATOM 1104 CD LYS A 74 -21.471 -7.431 5.758 1.00 0.00 C ATOM 1105 CE LYS A 74 -22.449 -8.344 5.034 1.00 0.00 C ATOM 1106 NZ LYS A 74 -22.281 -8.276 3.555 1.00 0.00 N ATOM 0 H LYS A 74 -17.255 -8.768 7.435 1.00 0.00 H new ATOM 0 HA LYS A 74 -17.583 -7.397 4.830 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -19.104 -7.043 7.445 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -19.326 -6.057 6.014 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -19.785 -8.393 4.841 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -20.109 -8.925 6.479 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -21.835 -7.231 6.766 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -21.417 -6.472 5.243 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -22.303 -9.371 5.369 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -23.469 -8.065 5.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -22.965 -8.912 3.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -22.445 -7.301 3.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -21.315 -8.567 3.302 1.00 0.00 H new ATOM 1120 N VAL A 75 -16.548 -5.215 5.625 1.00 0.00 N ATOM 1121 CA VAL A 75 -15.680 -4.100 5.985 1.00 0.00 C ATOM 1122 C VAL A 75 -16.490 -2.831 6.234 1.00 0.00 C ATOM 1123 O VAL A 75 -17.445 -2.541 5.515 1.00 0.00 O ATOM 1124 CB VAL A 75 -14.638 -3.823 4.886 1.00 0.00 C ATOM 1125 CG1 VAL A 75 -13.573 -4.910 4.873 1.00 0.00 C ATOM 1126 CG2 VAL A 75 -15.315 -3.711 3.527 1.00 0.00 C ATOM 0 H VAL A 75 -17.028 -5.104 4.732 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.163 -4.384 6.902 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.150 -2.873 5.103 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.845 -4.697 4.090 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -13.069 -4.937 5.839 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -14.041 -5.876 4.681 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -14.564 -3.515 2.762 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -15.830 -4.644 3.299 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -16.036 -2.894 3.546 1.00 0.00 H new ATOM 1136 N TYR A 76 -16.100 -2.080 7.258 1.00 0.00 N ATOM 1137 CA TYR A 76 -16.790 -0.844 7.604 1.00 0.00 C ATOM 1138 C TYR A 76 -16.043 -0.093 8.703 1.00 0.00 C ATOM 1139 O TYR A 76 -15.813 -0.626 9.789 1.00 0.00 O ATOM 1140 CB TYR A 76 -18.220 -1.142 8.057 1.00 0.00 C ATOM 1141 CG TYR A 76 -18.318 -1.591 9.497 1.00 0.00 C ATOM 1142 CD1 TYR A 76 -17.826 -2.827 9.895 1.00 0.00 C ATOM 1143 CD2 TYR A 76 -18.907 -0.779 10.460 1.00 0.00 C ATOM 1144 CE1 TYR A 76 -17.914 -3.242 11.210 1.00 0.00 C ATOM 1145 CE2 TYR A 76 -18.997 -1.185 11.777 1.00 0.00 C ATOM 1146 CZ TYR A 76 -18.500 -2.417 12.147 1.00 0.00 C ATOM 1147 OH TYR A 76 -18.590 -2.825 13.459 1.00 0.00 O ATOM 0 H TYR A 76 -15.310 -2.306 7.862 1.00 0.00 H new ATOM 0 HA TYR A 76 -16.822 -0.215 6.715 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -18.829 -0.248 7.922 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -18.642 -1.915 7.415 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -17.366 -3.475 9.164 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -19.301 0.185 10.173 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -17.526 -4.207 11.502 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -19.454 -0.541 12.513 1.00 0.00 H new ATOM 0 HH TYR A 76 -19.028 -2.127 13.989 1.00 0.00 H new ATOM 1157 N VAL A 77 -15.668 1.150 8.412 1.00 0.00 N ATOM 1158 CA VAL A 77 -14.949 1.976 9.375 1.00 0.00 C ATOM 1159 C VAL A 77 -15.860 3.044 9.969 1.00 0.00 C ATOM 1160 O VAL A 77 -15.780 4.218 9.606 1.00 0.00 O ATOM 1161 CB VAL A 77 -13.730 2.658 8.727 1.00 0.00 C ATOM 1162 CG1 VAL A 77 -12.766 1.618 8.177 1.00 0.00 C ATOM 1163 CG2 VAL A 77 -14.174 3.618 7.634 1.00 0.00 C ATOM 0 H VAL A 77 -15.850 1.606 7.518 1.00 0.00 H new ATOM 0 HA VAL A 77 -14.606 1.313 10.169 1.00 0.00 H new ATOM 0 HB VAL A 77 -13.208 3.233 9.492 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -11.911 2.119 7.723 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -12.422 0.976 8.988 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -13.273 1.013 7.425 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -13.299 4.091 7.187 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -14.721 3.069 6.867 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -14.821 4.383 8.063 1.00 0.00 H new ATOM 1173 N THR A 78 -16.728 2.631 10.888 1.00 0.00 N ATOM 1174 CA THR A 78 -17.654 3.551 11.533 1.00 0.00 C ATOM 1175 C THR A 78 -18.457 2.850 12.624 1.00 0.00 C ATOM 1176 O THR A 78 -18.328 1.642 12.822 1.00 0.00 O ATOM 1177 CB THR A 78 -18.628 4.173 10.515 1.00 0.00 C ATOM 1178 OG1 THR A 78 -19.683 4.858 11.201 1.00 0.00 O ATOM 1179 CG2 THR A 78 -19.218 3.106 9.606 1.00 0.00 C ATOM 0 H THR A 78 -16.808 1.664 11.202 1.00 0.00 H new ATOM 0 HA THR A 78 -17.052 4.342 11.980 1.00 0.00 H new ATOM 0 HB THR A 78 -18.072 4.882 9.902 1.00 0.00 H new ATOM 0 HG1 THR A 78 -20.069 5.538 10.611 1.00 0.00 H new ATOM 0 HG21 THR A 78 -19.902 3.571 8.896 1.00 0.00 H new ATOM 0 HG22 THR A 78 -18.416 2.607 9.063 1.00 0.00 H new ATOM 0 HG23 THR A 78 -19.759 2.375 10.207 1.00 0.00 H new ATOM 1187 N ALA A 79 -19.287 3.614 13.326 1.00 0.00 N ATOM 1188 CA ALA A 79 -20.112 3.065 14.394 1.00 0.00 C ATOM 1189 C ALA A 79 -21.576 3.446 14.208 1.00 0.00 C ATOM 1190 O ALA A 79 -22.417 3.146 15.055 1.00 0.00 O ATOM 1191 CB ALA A 79 -19.609 3.543 15.749 1.00 0.00 C ATOM 0 H ALA A 79 -19.406 4.616 13.174 1.00 0.00 H new ATOM 0 HA ALA A 79 -20.038 1.978 14.354 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -20.235 3.125 16.538 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -18.579 3.215 15.891 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -19.652 4.631 15.790 1.00 0.00 H new ATOM 1197 N GLU A 80 -21.873 4.108 13.093 1.00 0.00 N ATOM 1198 CA GLU A 80 -23.237 4.531 12.798 1.00 0.00 C ATOM 1199 C GLU A 80 -23.938 3.517 11.899 1.00 0.00 C ATOM 1200 O GLU A 80 -25.145 3.307 12.005 1.00 0.00 O ATOM 1201 CB GLU A 80 -23.234 5.907 12.129 1.00 0.00 C ATOM 1202 CG GLU A 80 -23.345 7.061 13.111 1.00 0.00 C ATOM 1203 CD GLU A 80 -24.781 7.485 13.353 1.00 0.00 C ATOM 1204 OE1 GLU A 80 -25.143 8.609 12.948 1.00 0.00 O ATOM 1205 OE2 GLU A 80 -25.541 6.693 13.950 1.00 0.00 O ATOM 0 H GLU A 80 -21.188 4.362 12.381 1.00 0.00 H new ATOM 0 HA GLU A 80 -23.783 4.594 13.739 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -22.316 6.019 11.552 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -24.063 5.960 11.423 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -22.891 6.772 14.059 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -22.778 7.911 12.732 1.00 0.00 H new ATOM 1213 N SER A 81 -23.170 2.892 11.011 1.00 0.00 N ATOM 1214 CA SER A 81 -23.717 1.902 10.089 1.00 0.00 C ATOM 1215 C SER A 81 -22.635 0.933 9.628 1.00 0.00 C ATOM 1216 O SER A 81 -21.497 0.984 10.098 1.00 0.00 O ATOM 1217 CB SER A 81 -24.345 2.597 8.878 1.00 0.00 C ATOM 1218 OG SER A 81 -25.706 2.913 9.121 1.00 0.00 O ATOM 0 H SER A 81 -22.168 3.053 10.911 1.00 0.00 H new ATOM 0 HA SER A 81 -24.486 1.336 10.615 1.00 0.00 H new ATOM 0 HB2 SER A 81 -23.792 3.508 8.650 1.00 0.00 H new ATOM 0 HB3 SER A 81 -24.269 1.951 8.004 1.00 0.00 H new ATOM 0 HG SER A 81 -25.829 3.120 10.071 1.00 0.00 H new ATOM 1224 N ARG A 82 -22.996 0.048 8.705 1.00 0.00 N ATOM 1225 CA ARG A 82 -22.056 -0.935 8.180 1.00 0.00 C ATOM 1226 C ARG A 82 -22.106 -0.975 6.654 1.00 0.00 C ATOM 1227 O ARG A 82 -22.980 -0.369 6.035 1.00 0.00 O ATOM 1228 CB ARG A 82 -22.366 -2.322 8.747 1.00 0.00 C ATOM 1229 CG ARG A 82 -21.831 -2.538 10.153 1.00 0.00 C ATOM 1230 CD ARG A 82 -21.555 -4.008 10.425 1.00 0.00 C ATOM 1231 NE ARG A 82 -22.733 -4.698 10.948 1.00 0.00 N ATOM 1232 CZ ARG A 82 -23.254 -4.457 12.145 1.00 0.00 C ATOM 1233 NH1 ARG A 82 -22.705 -3.549 12.940 1.00 0.00 N ATOM 1234 NH2 ARG A 82 -24.326 -5.126 12.550 1.00 0.00 N ATOM 0 H ARG A 82 -23.933 -0.009 8.305 1.00 0.00 H new ATOM 0 HA ARG A 82 -21.052 -0.640 8.486 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -23.446 -2.471 8.751 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -21.943 -3.078 8.086 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -20.914 -1.964 10.287 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -22.551 -2.162 10.879 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -21.230 -4.492 9.504 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -20.736 -4.097 11.138 1.00 0.00 H new ATOM 0 HE ARG A 82 -23.179 -5.403 10.361 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -21.880 -3.034 12.632 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -23.107 -3.366 13.859 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -24.750 -5.826 11.941 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -24.726 -4.940 13.470 1.00 0.00 H new ATOM 1248 N PHE A 83 -21.162 -1.693 6.056 1.00 0.00 N ATOM 1249 CA PHE A 83 -21.098 -1.812 4.604 1.00 0.00 C ATOM 1250 C PHE A 83 -20.781 -3.245 4.188 1.00 0.00 C ATOM 1251 O PHE A 83 -20.268 -4.035 4.981 1.00 0.00 O ATOM 1252 CB PHE A 83 -20.039 -0.861 4.040 1.00 0.00 C ATOM 1253 CG PHE A 83 -20.259 0.575 4.424 1.00 0.00 C ATOM 1254 CD1 PHE A 83 -21.115 1.379 3.688 1.00 0.00 C ATOM 1255 CD2 PHE A 83 -19.609 1.121 5.520 1.00 0.00 C ATOM 1256 CE1 PHE A 83 -21.320 2.701 4.038 1.00 0.00 C ATOM 1257 CE2 PHE A 83 -19.810 2.442 5.876 1.00 0.00 C ATOM 1258 CZ PHE A 83 -20.665 3.233 5.134 1.00 0.00 C ATOM 0 H PHE A 83 -20.431 -2.201 6.554 1.00 0.00 H new ATOM 0 HA PHE A 83 -22.074 -1.542 4.200 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -19.056 -1.176 4.390 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -20.032 -0.941 2.953 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -21.628 0.968 2.831 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -18.938 0.507 6.103 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -21.990 3.317 3.457 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -19.299 2.855 6.733 1.00 0.00 H new ATOM 0 HZ PHE A 83 -20.822 4.266 5.409 1.00 0.00 H new ATOM 1268 N SER A 84 -21.092 -3.576 2.938 1.00 0.00 N ATOM 1269 CA SER A 84 -20.846 -4.915 2.417 1.00 0.00 C ATOM 1270 C SER A 84 -19.382 -5.084 2.023 1.00 0.00 C ATOM 1271 O SER A 84 -18.669 -5.919 2.577 1.00 0.00 O ATOM 1272 CB SER A 84 -21.747 -5.190 1.212 1.00 0.00 C ATOM 1273 OG SER A 84 -21.612 -4.173 0.234 1.00 0.00 O ATOM 0 H SER A 84 -21.515 -2.934 2.268 1.00 0.00 H new ATOM 0 HA SER A 84 -21.077 -5.633 3.204 1.00 0.00 H new ATOM 0 HB2 SER A 84 -21.492 -6.156 0.775 1.00 0.00 H new ATOM 0 HB3 SER A 84 -22.786 -5.252 1.537 1.00 0.00 H new ATOM 0 HG SER A 84 -22.196 -4.372 -0.527 1.00 0.00 H new ATOM 1279 N THR A 85 -18.940 -4.282 1.058 1.00 0.00 N ATOM 1280 CA THR A 85 -17.561 -4.342 0.587 1.00 0.00 C ATOM 1281 C THR A 85 -16.855 -3.005 0.784 1.00 0.00 C ATOM 1282 O THR A 85 -17.469 -2.022 1.199 1.00 0.00 O ATOM 1283 CB THR A 85 -17.495 -4.731 -0.903 1.00 0.00 C ATOM 1284 OG1 THR A 85 -18.074 -3.697 -1.707 1.00 0.00 O ATOM 1285 CG2 THR A 85 -18.224 -6.043 -1.152 1.00 0.00 C ATOM 0 H THR A 85 -19.517 -3.584 0.588 1.00 0.00 H new ATOM 0 HA THR A 85 -17.056 -5.106 1.178 1.00 0.00 H new ATOM 0 HB THR A 85 -16.447 -4.858 -1.176 1.00 0.00 H new ATOM 0 HG1 THR A 85 -18.026 -3.952 -2.652 1.00 0.00 H new ATOM 0 HG21 THR A 85 -18.164 -6.297 -2.210 1.00 0.00 H new ATOM 0 HG22 THR A 85 -17.761 -6.834 -0.562 1.00 0.00 H new ATOM 0 HG23 THR A 85 -19.270 -5.939 -0.862 1.00 0.00 H new ATOM 1293 N LEU A 86 -15.562 -2.976 0.483 1.00 0.00 N ATOM 1294 CA LEU A 86 -14.770 -1.759 0.626 1.00 0.00 C ATOM 1295 C LEU A 86 -15.215 -0.700 -0.377 1.00 0.00 C ATOM 1296 O LEU A 86 -15.454 0.452 -0.013 1.00 0.00 O ATOM 1297 CB LEU A 86 -13.285 -2.068 0.434 1.00 0.00 C ATOM 1298 CG LEU A 86 -12.309 -0.991 0.907 1.00 0.00 C ATOM 1299 CD1 LEU A 86 -12.110 -1.074 2.412 1.00 0.00 C ATOM 1300 CD2 LEU A 86 -10.976 -1.123 0.184 1.00 0.00 C ATOM 0 H LEU A 86 -15.039 -3.781 0.138 1.00 0.00 H new ATOM 0 HA LEU A 86 -14.926 -1.369 1.632 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -13.056 -2.994 0.961 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -13.107 -2.252 -0.626 1.00 0.00 H new ATOM 0 HG LEU A 86 -12.733 -0.015 0.670 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -11.412 -0.300 2.730 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -13.067 -0.929 2.914 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -11.709 -2.053 2.672 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.294 -0.348 0.534 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -10.547 -2.104 0.389 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -11.132 -1.012 -0.889 1.00 0.00 H new ATOM 1312 N ALA A 87 -15.326 -1.097 -1.641 1.00 0.00 N ATOM 1313 CA ALA A 87 -15.746 -0.182 -2.694 1.00 0.00 C ATOM 1314 C ALA A 87 -16.857 0.743 -2.210 1.00 0.00 C ATOM 1315 O ALA A 87 -16.836 1.944 -2.473 1.00 0.00 O ATOM 1316 CB ALA A 87 -16.201 -0.962 -3.919 1.00 0.00 C ATOM 0 H ALA A 87 -15.131 -2.046 -1.960 1.00 0.00 H new ATOM 0 HA ALA A 87 -14.890 0.436 -2.966 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -16.512 -0.266 -4.698 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -15.378 -1.574 -4.287 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -17.039 -1.605 -3.650 1.00 0.00 H new ATOM 1322 N GLU A 88 -17.826 0.173 -1.500 1.00 0.00 N ATOM 1323 CA GLU A 88 -18.947 0.948 -0.979 1.00 0.00 C ATOM 1324 C GLU A 88 -18.521 1.776 0.230 1.00 0.00 C ATOM 1325 O GLU A 88 -19.006 2.890 0.434 1.00 0.00 O ATOM 1326 CB GLU A 88 -20.101 0.019 -0.593 1.00 0.00 C ATOM 1327 CG GLU A 88 -20.551 -0.895 -1.722 1.00 0.00 C ATOM 1328 CD GLU A 88 -21.439 -0.187 -2.726 1.00 0.00 C ATOM 1329 OE1 GLU A 88 -21.346 -0.510 -3.929 1.00 0.00 O ATOM 1330 OE2 GLU A 88 -22.227 0.686 -2.310 1.00 0.00 O ATOM 0 H GLU A 88 -17.858 -0.821 -1.273 1.00 0.00 H new ATOM 0 HA GLU A 88 -19.282 1.627 -1.763 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -19.796 -0.591 0.257 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -20.948 0.622 -0.266 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -19.675 -1.292 -2.234 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -21.089 -1.746 -1.303 1.00 0.00 H new ATOM 1338 N LEU A 89 -17.613 1.225 1.027 1.00 0.00 N ATOM 1339 CA LEU A 89 -17.120 1.912 2.216 1.00 0.00 C ATOM 1340 C LEU A 89 -16.486 3.250 1.848 1.00 0.00 C ATOM 1341 O LEU A 89 -16.755 4.270 2.481 1.00 0.00 O ATOM 1342 CB LEU A 89 -16.104 1.037 2.951 1.00 0.00 C ATOM 1343 CG LEU A 89 -15.273 1.733 4.029 1.00 0.00 C ATOM 1344 CD1 LEU A 89 -14.589 0.709 4.921 1.00 0.00 C ATOM 1345 CD2 LEU A 89 -14.248 2.662 3.396 1.00 0.00 C ATOM 0 H LEU A 89 -17.203 0.304 0.872 1.00 0.00 H new ATOM 0 HA LEU A 89 -17.968 2.102 2.874 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -16.637 0.206 3.412 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -15.423 0.610 2.215 1.00 0.00 H new ATOM 0 HG LEU A 89 -15.943 2.331 4.646 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -14.002 1.224 5.682 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -15.342 0.086 5.403 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -13.932 0.083 4.318 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -13.666 3.149 4.179 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -13.582 2.086 2.754 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.761 3.418 2.802 1.00 0.00 H new ATOM 1357 N VAL A 90 -15.644 3.236 0.821 1.00 0.00 N ATOM 1358 CA VAL A 90 -14.973 4.449 0.367 1.00 0.00 C ATOM 1359 C VAL A 90 -15.915 5.325 -0.452 1.00 0.00 C ATOM 1360 O VAL A 90 -16.007 6.532 -0.230 1.00 0.00 O ATOM 1361 CB VAL A 90 -13.731 4.118 -0.482 1.00 0.00 C ATOM 1362 CG1 VAL A 90 -13.249 5.354 -1.227 1.00 0.00 C ATOM 1363 CG2 VAL A 90 -12.625 3.548 0.392 1.00 0.00 C ATOM 0 H VAL A 90 -15.410 2.399 0.287 1.00 0.00 H new ATOM 0 HA VAL A 90 -14.661 4.991 1.260 1.00 0.00 H new ATOM 0 HB VAL A 90 -14.006 3.363 -1.218 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -12.371 5.101 -1.821 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.040 5.715 -1.884 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -12.990 6.133 -0.510 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -11.755 3.320 -0.224 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -12.349 4.279 1.153 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -12.976 2.636 0.875 1.00 0.00 H new ATOM 1373 N HIS A 91 -16.616 4.708 -1.398 1.00 0.00 N ATOM 1374 CA HIS A 91 -17.554 5.431 -2.249 1.00 0.00 C ATOM 1375 C HIS A 91 -18.590 6.169 -1.409 1.00 0.00 C ATOM 1376 O HIS A 91 -18.610 7.400 -1.366 1.00 0.00 O ATOM 1377 CB HIS A 91 -18.250 4.468 -3.210 1.00 0.00 C ATOM 1378 CG HIS A 91 -19.095 5.154 -4.240 1.00 0.00 C ATOM 1379 ND1 HIS A 91 -18.598 5.601 -5.446 1.00 0.00 N ATOM 1380 CD2 HIS A 91 -20.411 5.469 -4.237 1.00 0.00 C ATOM 1381 CE1 HIS A 91 -19.572 6.163 -6.140 1.00 0.00 C ATOM 1382 NE2 HIS A 91 -20.683 6.095 -5.428 1.00 0.00 N ATOM 0 H HIS A 91 -16.552 3.709 -1.594 1.00 0.00 H new ATOM 0 HA HIS A 91 -16.992 6.164 -2.827 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -17.496 3.864 -3.715 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -18.875 3.784 -2.636 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -21.116 5.266 -3.445 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -19.476 6.603 -7.122 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -21.595 6.450 -5.716 1.00 0.00 H new ATOM 1391 N HIS A 92 -19.455 5.410 -0.741 1.00 0.00 N ATOM 1392 CA HIS A 92 -20.496 5.992 0.098 1.00 0.00 C ATOM 1393 C HIS A 92 -19.986 7.242 0.808 1.00 0.00 C ATOM 1394 O HIS A 92 -20.541 8.329 0.649 1.00 0.00 O ATOM 1395 CB HIS A 92 -20.983 4.969 1.125 1.00 0.00 C ATOM 1396 CG HIS A 92 -21.820 5.568 2.213 1.00 0.00 C ATOM 1397 ND1 HIS A 92 -23.175 5.342 2.332 1.00 0.00 N ATOM 1398 CD2 HIS A 92 -21.487 6.386 3.239 1.00 0.00 C ATOM 1399 CE1 HIS A 92 -23.640 5.997 3.380 1.00 0.00 C ATOM 1400 NE2 HIS A 92 -22.634 6.639 3.949 1.00 0.00 N ATOM 0 H HIS A 92 -19.455 4.390 -0.765 1.00 0.00 H new ATOM 0 HA HIS A 92 -21.330 6.276 -0.544 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -21.562 4.200 0.614 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -20.120 4.475 1.571 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -20.501 6.769 3.458 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -24.667 6.007 3.715 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -22.700 7.227 4.780 1.00 0.00 H new ATOM 1409 N HIS A 93 -18.925 7.079 1.594 1.00 0.00 N ATOM 1410 CA HIS A 93 -18.340 8.193 2.329 1.00 0.00 C ATOM 1411 C HIS A 93 -18.097 9.385 1.407 1.00 0.00 C ATOM 1412 O HIS A 93 -18.275 10.537 1.804 1.00 0.00 O ATOM 1413 CB HIS A 93 -17.027 7.766 2.986 1.00 0.00 C ATOM 1414 CG HIS A 93 -17.214 6.863 4.165 1.00 0.00 C ATOM 1415 ND1 HIS A 93 -18.223 7.031 5.090 1.00 0.00 N ATOM 1416 CD2 HIS A 93 -16.516 5.776 4.567 1.00 0.00 C ATOM 1417 CE1 HIS A 93 -18.136 6.086 6.010 1.00 0.00 C ATOM 1418 NE2 HIS A 93 -17.107 5.312 5.716 1.00 0.00 N ATOM 0 H HIS A 93 -18.454 6.186 1.737 1.00 0.00 H new ATOM 0 HA HIS A 93 -19.044 8.493 3.105 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -16.408 7.260 2.246 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -16.483 8.656 3.303 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -15.653 5.352 4.075 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -18.794 5.967 6.858 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -16.801 4.502 6.255 1.00 0.00 H new ATOM 1427 N SER A 94 -17.688 9.100 0.175 1.00 0.00 N ATOM 1428 CA SER A 94 -17.416 10.147 -0.803 1.00 0.00 C ATOM 1429 C SER A 94 -18.501 11.218 -0.766 1.00 0.00 C ATOM 1430 O SER A 94 -18.251 12.384 -1.072 1.00 0.00 O ATOM 1431 CB SER A 94 -17.318 9.551 -2.207 1.00 0.00 C ATOM 1432 OG SER A 94 -16.807 10.498 -3.129 1.00 0.00 O ATOM 0 H SER A 94 -17.538 8.152 -0.170 1.00 0.00 H new ATOM 0 HA SER A 94 -16.463 10.610 -0.547 1.00 0.00 H new ATOM 0 HB2 SER A 94 -16.673 8.673 -2.188 1.00 0.00 H new ATOM 0 HB3 SER A 94 -18.303 9.216 -2.533 1.00 0.00 H new ATOM 0 HG SER A 94 -15.911 10.779 -2.847 1.00 0.00 H new ATOM 1438 N THR A 95 -19.711 10.814 -0.393 1.00 0.00 N ATOM 1439 CA THR A 95 -20.837 11.737 -0.318 1.00 0.00 C ATOM 1440 C THR A 95 -20.853 12.476 1.015 1.00 0.00 C ATOM 1441 O THR A 95 -20.887 13.707 1.053 1.00 0.00 O ATOM 1442 CB THR A 95 -22.179 11.002 -0.501 1.00 0.00 C ATOM 1443 OG1 THR A 95 -22.180 10.286 -1.741 1.00 0.00 O ATOM 1444 CG2 THR A 95 -23.341 11.984 -0.474 1.00 0.00 C ATOM 0 H THR A 95 -19.937 9.853 -0.138 1.00 0.00 H new ATOM 0 HA THR A 95 -20.712 12.456 -1.128 1.00 0.00 H new ATOM 0 HB THR A 95 -22.299 10.299 0.323 1.00 0.00 H new ATOM 0 HG1 THR A 95 -23.035 9.820 -1.849 1.00 0.00 H new ATOM 0 HG21 THR A 95 -24.278 11.443 -0.605 1.00 0.00 H new ATOM 0 HG22 THR A 95 -23.354 12.506 0.483 1.00 0.00 H new ATOM 0 HG23 THR A 95 -23.224 12.708 -1.281 1.00 0.00 H new ATOM 1452 N VAL A 96 -20.830 11.719 2.107 1.00 0.00 N ATOM 1453 CA VAL A 96 -20.840 12.305 3.443 1.00 0.00 C ATOM 1454 C VAL A 96 -19.775 11.669 4.329 1.00 0.00 C ATOM 1455 O VAL A 96 -19.602 10.450 4.331 1.00 0.00 O ATOM 1456 CB VAL A 96 -22.217 12.142 4.116 1.00 0.00 C ATOM 1457 CG1 VAL A 96 -22.538 10.671 4.324 1.00 0.00 C ATOM 1458 CG2 VAL A 96 -22.255 12.897 5.436 1.00 0.00 C ATOM 0 H VAL A 96 -20.804 10.699 2.094 1.00 0.00 H new ATOM 0 HA VAL A 96 -20.624 13.367 3.326 1.00 0.00 H new ATOM 0 HB VAL A 96 -22.977 12.565 3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -23.514 10.575 4.800 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -22.553 10.162 3.360 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -21.778 10.219 4.961 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -23.234 12.772 5.899 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -21.486 12.505 6.102 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -22.072 13.956 5.255 1.00 0.00 H new ATOM 1468 N ALA A 97 -19.065 12.503 5.081 1.00 0.00 N ATOM 1469 CA ALA A 97 -18.018 12.022 5.975 1.00 0.00 C ATOM 1470 C ALA A 97 -18.565 10.998 6.962 1.00 0.00 C ATOM 1471 O ALA A 97 -17.949 9.959 7.202 1.00 0.00 O ATOM 1472 CB ALA A 97 -17.384 13.188 6.719 1.00 0.00 C ATOM 0 H ALA A 97 -19.195 13.515 5.089 1.00 0.00 H new ATOM 0 HA ALA A 97 -17.255 11.532 5.370 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -16.604 12.815 7.383 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -16.948 13.883 6.002 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -18.145 13.702 7.306 1.00 0.00 H new ATOM 1478 N ASP A 98 -19.727 11.296 7.534 1.00 0.00 N ATOM 1479 CA ASP A 98 -20.360 10.401 8.495 1.00 0.00 C ATOM 1480 C ASP A 98 -19.467 10.196 9.715 1.00 0.00 C ATOM 1481 O ASP A 98 -19.551 9.173 10.394 1.00 0.00 O ATOM 1482 CB ASP A 98 -20.668 9.052 7.841 1.00 0.00 C ATOM 1483 CG ASP A 98 -21.294 8.069 8.811 1.00 0.00 C ATOM 1484 OD1 ASP A 98 -20.715 6.981 9.010 1.00 0.00 O ATOM 1485 OD2 ASP A 98 -22.363 8.388 9.372 1.00 0.00 O ATOM 0 H ASP A 98 -20.250 12.152 7.348 1.00 0.00 H new ATOM 0 HA ASP A 98 -21.293 10.859 8.822 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -21.342 9.205 6.998 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -19.748 8.627 7.440 1.00 0.00 H new ATOM 1491 N GLY A 99 -18.612 11.177 9.987 1.00 0.00 N ATOM 1492 CA GLY A 99 -17.714 11.086 11.125 1.00 0.00 C ATOM 1493 C GLY A 99 -16.265 10.935 10.709 1.00 0.00 C ATOM 1494 O GLY A 99 -15.384 10.768 11.553 1.00 0.00 O ATOM 0 H GLY A 99 -18.525 12.033 9.440 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -17.821 11.979 11.741 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -18.002 10.236 11.744 1.00 0.00 H new ATOM 1498 N LEU A 100 -16.016 10.995 9.406 1.00 0.00 N ATOM 1499 CA LEU A 100 -14.661 10.863 8.879 1.00 0.00 C ATOM 1500 C LEU A 100 -13.980 12.223 8.779 1.00 0.00 C ATOM 1501 O LEU A 100 -14.615 13.223 8.440 1.00 0.00 O ATOM 1502 CB LEU A 100 -14.691 10.191 7.505 1.00 0.00 C ATOM 1503 CG LEU A 100 -14.717 8.663 7.505 1.00 0.00 C ATOM 1504 CD1 LEU A 100 -15.021 8.134 6.111 1.00 0.00 C ATOM 1505 CD2 LEU A 100 -13.396 8.106 8.014 1.00 0.00 C ATOM 0 H LEU A 100 -16.734 11.134 8.695 1.00 0.00 H new ATOM 0 HA LEU A 100 -14.088 10.242 9.568 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -15.569 10.549 6.967 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -13.817 10.519 6.943 1.00 0.00 H new ATOM 0 HG LEU A 100 -15.509 8.332 8.177 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -15.035 7.044 6.131 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -15.993 8.504 5.785 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -14.252 8.474 5.417 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -13.434 7.017 8.007 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -12.585 8.445 7.369 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -13.221 8.456 9.031 1.00 0.00 H new ATOM 1517 N VAL A 101 -12.685 12.256 9.073 1.00 0.00 N ATOM 1518 CA VAL A 101 -11.918 13.493 9.012 1.00 0.00 C ATOM 1519 C VAL A 101 -12.421 14.399 7.894 1.00 0.00 C ATOM 1520 O VAL A 101 -12.449 15.621 8.032 1.00 0.00 O ATOM 1521 CB VAL A 101 -10.418 13.214 8.798 1.00 0.00 C ATOM 1522 CG1 VAL A 101 -10.147 12.843 7.347 1.00 0.00 C ATOM 1523 CG2 VAL A 101 -9.587 14.419 9.212 1.00 0.00 C ATOM 0 H VAL A 101 -12.144 11.439 9.356 1.00 0.00 H new ATOM 0 HA VAL A 101 -12.053 13.996 9.970 1.00 0.00 H new ATOM 0 HB VAL A 101 -10.130 12.370 9.425 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -9.083 12.649 7.214 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -10.714 11.949 7.088 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -10.450 13.665 6.699 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -8.530 14.204 9.054 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -9.875 15.283 8.613 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -9.760 14.635 10.266 1.00 0.00 H new ATOM 1533 N THR A 102 -12.818 13.788 6.781 1.00 0.00 N ATOM 1534 CA THR A 102 -13.319 14.538 5.636 1.00 0.00 C ATOM 1535 C THR A 102 -13.848 13.603 4.555 1.00 0.00 C ATOM 1536 O THR A 102 -13.368 12.478 4.403 1.00 0.00 O ATOM 1537 CB THR A 102 -12.225 15.436 5.031 1.00 0.00 C ATOM 1538 OG1 THR A 102 -12.802 16.333 4.073 1.00 0.00 O ATOM 1539 CG2 THR A 102 -11.144 14.600 4.364 1.00 0.00 C ATOM 0 H THR A 102 -12.802 12.777 6.649 1.00 0.00 H new ATOM 0 HA THR A 102 -14.133 15.165 6.001 1.00 0.00 H new ATOM 0 HB THR A 102 -11.770 16.010 5.838 1.00 0.00 H new ATOM 0 HG1 THR A 102 -12.100 16.902 3.694 1.00 0.00 H new ATOM 0 HG21 THR A 102 -10.383 15.258 3.944 1.00 0.00 H new ATOM 0 HG22 THR A 102 -10.687 13.940 5.102 1.00 0.00 H new ATOM 0 HG23 THR A 102 -11.586 14.002 3.567 1.00 0.00 H new ATOM 1547 N THR A 103 -14.841 14.073 3.805 1.00 0.00 N ATOM 1548 CA THR A 103 -15.435 13.278 2.737 1.00 0.00 C ATOM 1549 C THR A 103 -14.405 12.938 1.666 1.00 0.00 C ATOM 1550 O THR A 103 -13.643 13.801 1.227 1.00 0.00 O ATOM 1551 CB THR A 103 -16.617 14.013 2.081 1.00 0.00 C ATOM 1552 OG1 THR A 103 -16.299 15.399 1.911 1.00 0.00 O ATOM 1553 CG2 THR A 103 -17.874 13.877 2.926 1.00 0.00 C ATOM 0 H THR A 103 -15.250 15.000 3.918 1.00 0.00 H new ATOM 0 HA THR A 103 -15.798 12.357 3.193 1.00 0.00 H new ATOM 0 HB THR A 103 -16.802 13.561 1.107 1.00 0.00 H new ATOM 0 HG1 THR A 103 -17.056 15.859 1.491 1.00 0.00 H new ATOM 0 HG21 THR A 103 -18.696 14.404 2.443 1.00 0.00 H new ATOM 0 HG22 THR A 103 -18.130 12.823 3.030 1.00 0.00 H new ATOM 0 HG23 THR A 103 -17.698 14.306 3.912 1.00 0.00 H new ATOM 1561 N LEU A 104 -14.386 11.678 1.248 1.00 0.00 N ATOM 1562 CA LEU A 104 -13.450 11.223 0.226 1.00 0.00 C ATOM 1563 C LEU A 104 -13.909 11.655 -1.163 1.00 0.00 C ATOM 1564 O LEU A 104 -14.625 10.924 -1.847 1.00 0.00 O ATOM 1565 CB LEU A 104 -13.305 9.701 0.278 1.00 0.00 C ATOM 1566 CG LEU A 104 -13.381 9.067 1.667 1.00 0.00 C ATOM 1567 CD1 LEU A 104 -13.200 7.560 1.577 1.00 0.00 C ATOM 1568 CD2 LEU A 104 -12.334 9.677 2.589 1.00 0.00 C ATOM 0 H LEU A 104 -15.009 10.952 1.601 1.00 0.00 H new ATOM 0 HA LEU A 104 -12.481 11.680 0.427 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -14.084 9.260 -0.344 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -12.349 9.432 -0.171 1.00 0.00 H new ATOM 0 HG LEU A 104 -14.367 9.269 2.084 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -13.257 7.126 2.575 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -13.986 7.136 0.952 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -12.227 7.336 1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -12.402 9.214 3.574 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -11.340 9.505 2.175 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -12.509 10.749 2.679 1.00 0.00 H new ATOM 1580 N HIS A 105 -13.488 12.847 -1.575 1.00 0.00 N ATOM 1581 CA HIS A 105 -13.854 13.376 -2.886 1.00 0.00 C ATOM 1582 C HIS A 105 -12.640 13.429 -3.808 1.00 0.00 C ATOM 1583 O HIS A 105 -12.778 13.549 -5.025 1.00 0.00 O ATOM 1584 CB HIS A 105 -14.463 14.771 -2.744 1.00 0.00 C ATOM 1585 CG HIS A 105 -15.483 15.089 -3.794 1.00 0.00 C ATOM 1586 ND1 HIS A 105 -16.623 15.821 -3.539 1.00 0.00 N ATOM 1587 CD2 HIS A 105 -15.528 14.770 -5.109 1.00 0.00 C ATOM 1588 CE1 HIS A 105 -17.328 15.938 -4.650 1.00 0.00 C ATOM 1589 NE2 HIS A 105 -16.684 15.310 -5.619 1.00 0.00 N ATOM 0 H HIS A 105 -12.894 13.465 -1.022 1.00 0.00 H new ATOM 0 HA HIS A 105 -14.594 12.708 -3.327 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -14.926 14.858 -1.761 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -13.666 15.513 -2.787 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -14.793 14.198 -5.655 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -18.269 16.458 -4.750 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -16.995 15.238 -6.588 1.00 0.00 H new ATOM 1598 N TYR A 106 -11.452 13.339 -3.220 1.00 0.00 N ATOM 1599 CA TYR A 106 -10.215 13.382 -3.988 1.00 0.00 C ATOM 1600 C TYR A 106 -9.326 12.187 -3.655 1.00 0.00 C ATOM 1601 O TYR A 106 -8.425 12.264 -2.819 1.00 0.00 O ATOM 1602 CB TYR A 106 -9.460 14.684 -3.713 1.00 0.00 C ATOM 1603 CG TYR A 106 -10.181 15.916 -4.210 1.00 0.00 C ATOM 1604 CD1 TYR A 106 -10.340 16.150 -5.570 1.00 0.00 C ATOM 1605 CD2 TYR A 106 -10.702 16.848 -3.320 1.00 0.00 C ATOM 1606 CE1 TYR A 106 -10.997 17.276 -6.029 1.00 0.00 C ATOM 1607 CE2 TYR A 106 -11.360 17.975 -3.770 1.00 0.00 C ATOM 1608 CZ TYR A 106 -11.507 18.185 -5.126 1.00 0.00 C ATOM 1609 OH TYR A 106 -12.161 19.307 -5.578 1.00 0.00 O ATOM 0 H TYR A 106 -11.320 13.236 -2.214 1.00 0.00 H new ATOM 0 HA TYR A 106 -10.474 13.338 -5.046 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -9.293 14.778 -2.640 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -8.479 14.632 -4.185 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -9.944 15.440 -6.281 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -10.590 16.688 -2.258 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -11.110 17.443 -7.090 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -11.758 18.689 -3.064 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.459 19.842 -4.813 1.00 0.00 H new ATOM 1619 N PRO A 107 -9.584 11.053 -4.325 1.00 0.00 N ATOM 1620 CA PRO A 107 -8.819 9.820 -4.118 1.00 0.00 C ATOM 1621 C PRO A 107 -7.394 9.925 -4.652 1.00 0.00 C ATOM 1622 O PRO A 107 -6.981 10.976 -5.142 1.00 0.00 O ATOM 1623 CB PRO A 107 -9.610 8.775 -4.910 1.00 0.00 C ATOM 1624 CG PRO A 107 -10.327 9.556 -5.956 1.00 0.00 C ATOM 1625 CD PRO A 107 -10.643 10.890 -5.335 1.00 0.00 C ATOM 0 HA PRO A 107 -8.710 9.581 -3.060 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -8.949 8.031 -5.355 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -10.309 8.238 -4.269 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -9.708 9.677 -6.845 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -11.238 9.045 -6.268 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -10.622 11.692 -6.073 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -11.635 10.898 -4.883 1.00 0.00 H new ATOM 1633 N ALA A 108 -6.647 8.830 -4.552 1.00 0.00 N ATOM 1634 CA ALA A 108 -5.270 8.801 -5.026 1.00 0.00 C ATOM 1635 C ALA A 108 -5.204 8.385 -6.492 1.00 0.00 C ATOM 1636 O ALA A 108 -5.970 7.543 -6.960 1.00 0.00 O ATOM 1637 CB ALA A 108 -4.437 7.857 -4.170 1.00 0.00 C ATOM 0 H ALA A 108 -6.973 7.952 -4.147 1.00 0.00 H new ATOM 0 HA ALA A 108 -4.861 9.808 -4.941 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -3.410 7.845 -4.535 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -4.450 8.198 -3.135 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -4.854 6.851 -4.226 1.00 0.00 H new ATOM 1643 N PRO A 109 -4.265 8.989 -7.238 1.00 0.00 N ATOM 1644 CA PRO A 109 -4.076 8.696 -8.661 1.00 0.00 C ATOM 1645 C PRO A 109 -3.505 7.303 -8.898 1.00 0.00 C ATOM 1646 O PRO A 109 -2.829 6.744 -8.034 1.00 0.00 O ATOM 1647 CB PRO A 109 -3.079 9.767 -9.113 1.00 0.00 C ATOM 1648 CG PRO A 109 -2.334 10.137 -7.876 1.00 0.00 C ATOM 1649 CD PRO A 109 -3.316 10.002 -6.746 1.00 0.00 C ATOM 0 HA PRO A 109 -5.019 8.711 -9.208 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -2.407 9.383 -9.880 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -3.591 10.629 -9.540 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -1.475 9.482 -7.727 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -1.951 11.155 -7.941 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -2.828 9.682 -5.826 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -3.813 10.948 -6.531 1.00 0.00 H new ATOM 1657 N LYS A 110 -3.782 6.746 -10.071 1.00 0.00 N ATOM 1658 CA LYS A 110 -3.295 5.417 -10.422 1.00 0.00 C ATOM 1659 C LYS A 110 -1.816 5.460 -10.789 1.00 0.00 C ATOM 1660 O LYS A 110 -1.432 6.056 -11.796 1.00 0.00 O ATOM 1661 CB LYS A 110 -4.105 4.848 -11.590 1.00 0.00 C ATOM 1662 CG LYS A 110 -5.441 4.256 -11.173 1.00 0.00 C ATOM 1663 CD LYS A 110 -5.267 2.899 -10.510 1.00 0.00 C ATOM 1664 CE LYS A 110 -5.017 1.805 -11.538 1.00 0.00 C ATOM 1665 NZ LYS A 110 -4.948 0.459 -10.909 1.00 0.00 N ATOM 0 H LYS A 110 -4.342 7.194 -10.796 1.00 0.00 H new ATOM 0 HA LYS A 110 -3.417 4.770 -9.553 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -4.279 5.639 -12.320 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -3.516 4.078 -12.089 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -5.943 4.936 -10.485 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.084 4.155 -12.047 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.433 2.939 -9.810 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -6.158 2.659 -9.931 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -5.813 1.818 -12.283 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -4.085 2.008 -12.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -4.226 -0.113 -11.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -4.697 0.558 -9.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -5.873 -0.010 -10.990 1.00 0.00 H new ATOM 1679 N CYS A 111 -0.989 4.823 -9.966 1.00 0.00 N ATOM 1680 CA CYS A 111 0.450 4.788 -10.205 1.00 0.00 C ATOM 1681 C CYS A 111 0.806 3.704 -11.216 1.00 0.00 C ATOM 1682 O CYS A 111 1.422 3.980 -12.245 1.00 0.00 O ATOM 1683 CB CYS A 111 1.199 4.545 -8.893 1.00 0.00 C ATOM 1684 SG CYS A 111 2.942 5.021 -8.941 1.00 0.00 S ATOM 0 H CYS A 111 -1.290 4.324 -9.129 1.00 0.00 H new ATOM 0 HA CYS A 111 0.750 5.753 -10.613 1.00 0.00 H new ATOM 0 HB2 CYS A 111 0.704 5.099 -8.096 1.00 0.00 H new ATOM 0 HB3 CYS A 111 1.129 3.488 -8.637 1.00 0.00 H new ATOM 0 HG CYS A 111 3.490 4.780 -7.787 1.00 0.00 H new ATOM 1690 N ASN A 112 0.416 2.469 -10.916 1.00 0.00 N ATOM 1691 CA ASN A 112 0.698 1.343 -11.799 1.00 0.00 C ATOM 1692 C ASN A 112 -0.535 0.973 -12.619 1.00 0.00 C ATOM 1693 O ASN A 112 -1.309 0.094 -12.237 1.00 0.00 O ATOM 1694 CB ASN A 112 1.163 0.134 -10.985 1.00 0.00 C ATOM 1695 CG ASN A 112 2.099 0.522 -9.856 1.00 0.00 C ATOM 1696 OD1 ASN A 112 1.735 1.299 -8.973 1.00 0.00 O ATOM 1697 ND2 ASN A 112 3.311 -0.018 -9.881 1.00 0.00 N ATOM 0 H ASN A 112 -0.096 2.223 -10.069 1.00 0.00 H new ATOM 0 HA ASN A 112 1.493 1.640 -12.483 1.00 0.00 H new ATOM 0 HB2 ASN A 112 0.294 -0.379 -10.573 1.00 0.00 H new ATOM 0 HB3 ASN A 112 1.667 -0.572 -11.645 1.00 0.00 H new ATOM 0 HD21 ASN A 112 3.984 0.206 -9.148 1.00 0.00 H new ATOM 0 HD22 ASN A 112 3.569 -0.657 -10.633 1.00 0.00 H new ATOM 1704 N LYS A 113 -0.714 1.652 -13.747 1.00 0.00 N ATOM 1705 CA LYS A 113 -1.850 1.396 -14.624 1.00 0.00 C ATOM 1706 C LYS A 113 -1.765 -0.002 -15.231 1.00 0.00 C ATOM 1707 O LYS A 113 -0.674 -0.519 -15.471 1.00 0.00 O ATOM 1708 CB LYS A 113 -1.909 2.444 -15.737 1.00 0.00 C ATOM 1709 CG LYS A 113 -0.775 2.330 -16.740 1.00 0.00 C ATOM 1710 CD LYS A 113 -1.139 1.409 -17.892 1.00 0.00 C ATOM 1711 CE LYS A 113 -1.953 2.136 -18.951 1.00 0.00 C ATOM 1712 NZ LYS A 113 -1.138 3.148 -19.679 1.00 0.00 N ATOM 0 H LYS A 113 -0.085 2.385 -14.076 1.00 0.00 H new ATOM 0 HA LYS A 113 -2.759 1.459 -14.026 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -2.859 2.350 -16.263 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -1.889 3.438 -15.290 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -0.530 3.319 -17.127 1.00 0.00 H new ATOM 0 HG3 LYS A 113 0.117 1.953 -16.240 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -0.230 1.010 -18.341 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -1.708 0.559 -17.514 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -2.353 1.413 -19.661 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -2.805 2.626 -18.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -1.595 3.375 -20.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -1.062 4.011 -19.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -0.187 2.765 -19.857 1.00 0.00 H new ATOM 1726 N SER A 114 -2.922 -0.606 -15.477 1.00 0.00 N ATOM 1727 CA SER A 114 -2.978 -1.944 -16.054 1.00 0.00 C ATOM 1728 C SER A 114 -3.689 -1.924 -17.405 1.00 0.00 C ATOM 1729 O SER A 114 -4.911 -2.045 -17.477 1.00 0.00 O ATOM 1730 CB SER A 114 -3.694 -2.904 -15.103 1.00 0.00 C ATOM 1731 OG SER A 114 -2.823 -3.352 -14.079 1.00 0.00 O ATOM 0 H SER A 114 -3.834 -0.191 -15.286 1.00 0.00 H new ATOM 0 HA SER A 114 -1.956 -2.290 -16.206 1.00 0.00 H new ATOM 0 HB2 SER A 114 -4.556 -2.406 -14.659 1.00 0.00 H new ATOM 0 HB3 SER A 114 -4.073 -3.759 -15.662 1.00 0.00 H new ATOM 0 HG SER A 114 -3.305 -3.963 -13.483 1.00 0.00 H new ATOM 1737 N GLY A 115 -2.912 -1.771 -18.473 1.00 0.00 N ATOM 1738 CA GLY A 115 -3.483 -1.738 -19.807 1.00 0.00 C ATOM 1739 C GLY A 115 -4.589 -2.757 -19.989 1.00 0.00 C ATOM 1740 O GLY A 115 -4.622 -3.794 -19.326 1.00 0.00 O ATOM 0 H GLY A 115 -1.898 -1.669 -18.438 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -3.875 -0.741 -20.006 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -2.698 -1.924 -20.540 1.00 0.00 H new ATOM 1744 N PRO A 116 -5.522 -2.466 -20.908 1.00 0.00 N ATOM 1745 CA PRO A 116 -6.654 -3.353 -21.196 1.00 0.00 C ATOM 1746 C PRO A 116 -6.220 -4.634 -21.900 1.00 0.00 C ATOM 1747 O PRO A 116 -6.801 -5.698 -21.687 1.00 0.00 O ATOM 1748 CB PRO A 116 -7.539 -2.510 -22.116 1.00 0.00 C ATOM 1749 CG PRO A 116 -6.606 -1.543 -22.760 1.00 0.00 C ATOM 1750 CD PRO A 116 -5.545 -1.248 -21.735 1.00 0.00 C ATOM 0 HA PRO A 116 -7.155 -3.684 -20.287 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -8.041 -3.130 -22.859 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -8.317 -1.994 -21.553 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -6.168 -1.966 -23.664 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.129 -0.633 -23.054 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.578 -1.060 -22.201 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -5.791 -0.366 -21.144 1.00 0.00 H new ATOM 1758 N SER A 117 -5.195 -4.526 -22.739 1.00 0.00 N ATOM 1759 CA SER A 117 -4.686 -5.676 -23.478 1.00 0.00 C ATOM 1760 C SER A 117 -4.757 -6.941 -22.629 1.00 0.00 C ATOM 1761 O SER A 117 -4.204 -6.997 -21.531 1.00 0.00 O ATOM 1762 CB SER A 117 -3.243 -5.426 -23.921 1.00 0.00 C ATOM 1763 OG SER A 117 -2.402 -5.188 -22.806 1.00 0.00 O ATOM 0 H SER A 117 -4.700 -3.653 -22.924 1.00 0.00 H new ATOM 0 HA SER A 117 -5.311 -5.816 -24.360 1.00 0.00 H new ATOM 0 HB2 SER A 117 -2.876 -6.287 -24.480 1.00 0.00 H new ATOM 0 HB3 SER A 117 -3.209 -4.570 -24.595 1.00 0.00 H new ATOM 0 HG SER A 117 -2.716 -5.714 -22.041 1.00 0.00 H new ATOM 1769 N SER A 118 -5.444 -7.955 -23.146 1.00 0.00 N ATOM 1770 CA SER A 118 -5.593 -9.219 -22.435 1.00 0.00 C ATOM 1771 C SER A 118 -4.716 -10.301 -23.061 1.00 0.00 C ATOM 1772 O SER A 118 -4.655 -10.436 -24.283 1.00 0.00 O ATOM 1773 CB SER A 118 -7.056 -9.666 -22.443 1.00 0.00 C ATOM 1774 OG SER A 118 -7.460 -10.060 -23.743 1.00 0.00 O ATOM 0 H SER A 118 -5.906 -7.925 -24.055 1.00 0.00 H new ATOM 0 HA SER A 118 -5.274 -9.066 -21.404 1.00 0.00 H new ATOM 0 HB2 SER A 118 -7.190 -10.496 -21.750 1.00 0.00 H new ATOM 0 HB3 SER A 118 -7.691 -8.852 -22.092 1.00 0.00 H new ATOM 0 HG SER A 118 -8.398 -10.343 -23.722 1.00 0.00 H new ATOM 1780 N GLY A 119 -4.037 -11.067 -22.213 1.00 0.00 N ATOM 1781 CA GLY A 119 -3.172 -12.127 -22.701 1.00 0.00 C ATOM 1782 C GLY A 119 -2.316 -11.685 -23.870 1.00 0.00 C ATOM 1783 O GLY A 119 -1.384 -12.385 -24.265 1.00 0.00 O ATOM 0 H GLY A 119 -4.070 -10.973 -21.198 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -2.527 -12.467 -21.891 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -3.781 -12.979 -23.003 1.00 0.00 H new TER 1787 GLY A 119