USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 955 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 4 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 103 LYS NZ :NH3+ -96:sc= -0.253 (180deg=-1.15) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 134:sc= 0.21 (180deg=-0.371) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.174 K(o=-0.17,f=-1.1) USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 19 SER OG : rot 180:sc= -0.225 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 23 ASN : amide:sc= -0.0858 X(o=-0.086,f=-0.58) USER MOD Single : A 26 ASN :FLIP amide:sc= -0.253 F(o=-1.1,f=-0.25) USER MOD Single : A 29 SER OG : rot 180:sc= 0.00962 USER MOD Single : A 31 MET CE :methyl 148:sc= -3.26! (180deg=-5.5!) USER MOD Single : A 37 CYS SG : rot 180:sc= -0.309 USER MOD Single : A 41 MET CE :methyl -121:sc= -4.13! (180deg=-5.34!) USER MOD Single : A 42 LYS NZ :NH3+ -108:sc= -1.14 (180deg=-3.5!) USER MOD Single : A 44 GLN : amide:sc= -1.68 K(o=-1.7,f=-3.4) USER MOD Single : A 46 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0232) USER MOD Single : A 48 ASN :FLIP amide:sc= -3.56! C(o=-4.3!,f=-3.6!) USER MOD Single : A 59 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.306) USER MOD Single : A 60 THR OG1 : rot -109:sc= -0.539 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot -150:sc= -1.3 USER MOD Single : A 70 SER OG : rot -109:sc= 0.86 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -89:sc= 0.00822 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= -0.0168 (180deg=-0.0168) USER MOD Single : A 81 SER OG : rot 180:sc= -0.228 USER MOD Single : A 86 GLN : amide:sc= -0.18 X(o=-0.18,f=-0.037) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN :FLIP amide:sc= -1.21 F(o=-1.8,f=-1.2) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 HIS : no HD1:sc= -0.198 X(o=-0.2,f=-0.53) USER MOD Single : A 106 CYS SG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 80:sc= 0.342 USER MOD Single : A 115 LYS NZ :NH3+ -166:sc= -0.685 (180deg=-0.952) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 90:sc= 0.382 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.282 13.453 5.682 1.00 0.00 N ATOM 2 CA MET A 1 -11.691 13.256 6.006 1.00 0.00 C ATOM 3 C MET A 1 -12.569 13.497 4.782 1.00 0.00 C ATOM 4 O MET A 1 -13.714 13.929 4.904 1.00 0.00 O ATOM 5 CB MET A 1 -12.110 14.192 7.141 1.00 0.00 C ATOM 6 CG MET A 1 -11.854 15.661 6.844 1.00 0.00 C ATOM 7 SD MET A 1 -10.247 16.220 7.441 1.00 0.00 S ATOM 8 CE MET A 1 -10.735 17.202 8.858 1.00 0.00 C ATOM 0 H1 MET A 1 -9.833 14.031 6.421 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.806 12.530 5.628 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.201 13.939 4.766 1.00 0.00 H new ATOM 0 HA MET A 1 -11.824 12.223 6.328 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.172 14.051 7.344 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.572 13.914 8.047 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.915 15.826 5.768 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.638 16.263 7.304 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.848 17.617 9.336 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.385 18.014 8.532 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.270 16.573 9.570 1.00 0.00 H new ATOM 18 N ALA A 2 -12.023 13.214 3.604 1.00 0.00 N ATOM 19 CA ALA A 2 -12.758 13.398 2.358 1.00 0.00 C ATOM 20 C ALA A 2 -12.652 12.163 1.470 1.00 0.00 C ATOM 21 O ALA A 2 -12.075 11.150 1.866 1.00 0.00 O ATOM 22 CB ALA A 2 -12.247 14.627 1.621 1.00 0.00 C ATOM 0 H ALA A 2 -11.075 12.857 3.486 1.00 0.00 H new ATOM 0 HA ALA A 2 -13.810 13.546 2.604 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -12.804 14.752 0.693 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -12.382 15.509 2.247 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -11.188 14.501 1.394 1.00 0.00 H new ATOM 28 N TYR A 3 -13.211 12.254 0.269 1.00 0.00 N ATOM 29 CA TYR A 3 -13.182 11.142 -0.674 1.00 0.00 C ATOM 30 C TYR A 3 -11.758 10.867 -1.147 1.00 0.00 C ATOM 31 O TYR A 3 -10.802 11.469 -0.658 1.00 0.00 O ATOM 32 CB TYR A 3 -14.082 11.440 -1.874 1.00 0.00 C ATOM 33 CG TYR A 3 -15.491 11.833 -1.491 1.00 0.00 C ATOM 34 CD1 TYR A 3 -16.278 10.996 -0.710 1.00 0.00 C ATOM 35 CD2 TYR A 3 -16.035 13.040 -1.913 1.00 0.00 C ATOM 36 CE1 TYR A 3 -17.566 11.351 -0.358 1.00 0.00 C ATOM 37 CE2 TYR A 3 -17.322 13.403 -1.565 1.00 0.00 C ATOM 38 CZ TYR A 3 -18.083 12.555 -0.788 1.00 0.00 C ATOM 39 OH TYR A 3 -19.366 12.913 -0.440 1.00 0.00 O ATOM 0 H TYR A 3 -13.690 13.086 -0.075 1.00 0.00 H new ATOM 0 HA TYR A 3 -13.553 10.254 -0.162 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -13.637 12.243 -2.461 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -14.121 10.560 -2.516 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -15.876 10.052 -0.372 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -15.442 13.705 -2.523 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -18.165 10.689 0.250 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -17.730 14.345 -1.900 1.00 0.00 H new ATOM 0 HH TYR A 3 -19.576 13.791 -0.822 1.00 0.00 H new ATOM 49 N SER A 4 -11.625 9.954 -2.104 1.00 0.00 N ATOM 50 CA SER A 4 -10.319 9.595 -2.643 1.00 0.00 C ATOM 51 C SER A 4 -10.427 9.204 -4.114 1.00 0.00 C ATOM 52 O SER A 4 -11.520 8.964 -4.624 1.00 0.00 O ATOM 53 CB SER A 4 -9.711 8.444 -1.840 1.00 0.00 C ATOM 54 OG SER A 4 -8.405 8.766 -1.395 1.00 0.00 O ATOM 0 H SER A 4 -12.407 9.449 -2.522 1.00 0.00 H new ATOM 0 HA SER A 4 -9.669 10.466 -2.564 1.00 0.00 H new ATOM 0 HB2 SER A 4 -10.346 8.220 -0.983 1.00 0.00 H new ATOM 0 HB3 SER A 4 -9.677 7.545 -2.456 1.00 0.00 H new ATOM 0 HG SER A 4 -8.039 8.015 -0.883 1.00 0.00 H new ATOM 60 N GLU A 5 -9.283 9.141 -4.788 1.00 0.00 N ATOM 61 CA GLU A 5 -9.249 8.780 -6.201 1.00 0.00 C ATOM 62 C GLU A 5 -7.950 8.057 -6.546 1.00 0.00 C ATOM 63 O GLU A 5 -6.869 8.456 -6.111 1.00 0.00 O ATOM 64 CB GLU A 5 -9.398 10.028 -7.073 1.00 0.00 C ATOM 65 CG GLU A 5 -10.840 10.355 -7.425 1.00 0.00 C ATOM 66 CD GLU A 5 -11.172 11.820 -7.219 1.00 0.00 C ATOM 67 OE1 GLU A 5 -10.874 12.348 -6.127 1.00 0.00 O ATOM 68 OE2 GLU A 5 -11.730 12.439 -8.149 1.00 0.00 O ATOM 0 H GLU A 5 -8.369 9.335 -4.379 1.00 0.00 H new ATOM 0 HA GLU A 5 -10.083 8.107 -6.398 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.958 10.879 -6.553 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.831 9.888 -7.993 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -11.026 10.087 -8.465 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -11.506 9.746 -6.814 1.00 0.00 H new ATOM 75 N LYS A 6 -8.063 6.991 -7.330 1.00 0.00 N ATOM 76 CA LYS A 6 -6.900 6.211 -7.736 1.00 0.00 C ATOM 77 C LYS A 6 -6.746 6.212 -9.253 1.00 0.00 C ATOM 78 O LYS A 6 -7.723 6.374 -9.986 1.00 0.00 O ATOM 79 CB LYS A 6 -7.021 4.773 -7.226 1.00 0.00 C ATOM 80 CG LYS A 6 -5.682 4.085 -7.023 1.00 0.00 C ATOM 81 CD LYS A 6 -5.114 4.366 -5.642 1.00 0.00 C ATOM 82 CE LYS A 6 -5.757 3.483 -4.584 1.00 0.00 C ATOM 83 NZ LYS A 6 -5.762 4.134 -3.245 1.00 0.00 N ATOM 0 H LYS A 6 -8.950 6.647 -7.698 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.014 6.672 -7.299 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -7.565 4.776 -6.282 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -7.614 4.194 -7.934 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -5.801 3.010 -7.157 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -4.978 4.425 -7.783 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -4.037 4.200 -5.650 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -5.273 5.414 -5.388 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -6.780 3.251 -4.878 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -5.219 2.537 -4.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -6.209 3.500 -2.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -4.784 4.333 -2.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -6.297 5.025 -3.294 1.00 0.00 H new ATOM 97 N VAL A 7 -5.515 6.029 -9.719 1.00 0.00 N ATOM 98 CA VAL A 7 -5.234 6.007 -11.150 1.00 0.00 C ATOM 99 C VAL A 7 -4.257 4.890 -11.500 1.00 0.00 C ATOM 100 O VAL A 7 -3.205 4.754 -10.876 1.00 0.00 O ATOM 101 CB VAL A 7 -4.654 7.351 -11.629 1.00 0.00 C ATOM 102 CG1 VAL A 7 -4.368 7.306 -13.122 1.00 0.00 C ATOM 103 CG2 VAL A 7 -5.604 8.491 -11.294 1.00 0.00 C ATOM 0 H VAL A 7 -4.696 5.894 -9.126 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.182 5.829 -11.657 1.00 0.00 H new ATOM 0 HB VAL A 7 -3.713 7.528 -11.108 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -3.959 8.264 -13.443 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -3.647 6.515 -13.331 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -5.293 7.107 -13.664 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -5.178 9.433 -11.640 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -6.562 8.323 -11.787 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.754 8.535 -10.215 1.00 0.00 H new ATOM 113 N ILE A 8 -4.613 4.094 -12.503 1.00 0.00 N ATOM 114 CA ILE A 8 -3.767 2.990 -12.938 1.00 0.00 C ATOM 115 C ILE A 8 -3.185 3.255 -14.322 1.00 0.00 C ATOM 116 O ILE A 8 -3.838 3.853 -15.177 1.00 0.00 O ATOM 117 CB ILE A 8 -4.545 1.661 -12.967 1.00 0.00 C ATOM 118 CG1 ILE A 8 -3.595 0.494 -13.239 1.00 0.00 C ATOM 119 CG2 ILE A 8 -5.643 1.714 -14.020 1.00 0.00 C ATOM 120 CD1 ILE A 8 -4.039 -0.807 -12.607 1.00 0.00 C ATOM 0 H ILE A 8 -5.481 4.193 -13.029 1.00 0.00 H new ATOM 0 HA ILE A 8 -2.956 2.911 -12.214 1.00 0.00 H new ATOM 0 HB ILE A 8 -5.009 1.507 -11.993 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -3.505 0.353 -14.316 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -2.603 0.749 -12.867 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.184 0.768 -14.029 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -6.333 2.525 -13.786 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -5.199 1.887 -15.000 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -3.318 -1.590 -12.842 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -4.102 -0.683 -11.526 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -5.018 -1.086 -12.998 1.00 0.00 H new ATOM 132 N ASP A 9 -1.953 2.805 -14.536 1.00 0.00 N ATOM 133 CA ASP A 9 -1.283 2.992 -15.818 1.00 0.00 C ATOM 134 C ASP A 9 -1.147 4.475 -16.150 1.00 0.00 C ATOM 135 O ASP A 9 -1.507 5.337 -15.347 1.00 0.00 O ATOM 136 CB ASP A 9 -2.054 2.277 -16.929 1.00 0.00 C ATOM 137 CG ASP A 9 -1.190 1.290 -17.690 1.00 0.00 C ATOM 138 OD1 ASP A 9 -0.120 1.698 -18.189 1.00 0.00 O ATOM 139 OD2 ASP A 9 -1.584 0.109 -17.786 1.00 0.00 O ATOM 0 H ASP A 9 -1.398 2.308 -13.839 1.00 0.00 H new ATOM 0 HA ASP A 9 -0.284 2.562 -15.744 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -2.906 1.752 -16.496 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -2.454 3.016 -17.623 1.00 0.00 H new ATOM 144 N HIS A 10 -0.623 4.765 -17.336 1.00 0.00 N ATOM 145 CA HIS A 10 -0.439 6.144 -17.774 1.00 0.00 C ATOM 146 C HIS A 10 0.451 6.909 -16.799 1.00 0.00 C ATOM 147 O HIS A 10 -0.030 7.726 -16.015 1.00 0.00 O ATOM 148 CB HIS A 10 -1.791 6.845 -17.905 1.00 0.00 C ATOM 149 CG HIS A 10 -2.530 6.492 -19.160 1.00 0.00 C ATOM 150 ND1 HIS A 10 -3.419 7.347 -19.776 1.00 0.00 N ATOM 151 CD2 HIS A 10 -2.505 5.368 -19.915 1.00 0.00 C ATOM 152 CE1 HIS A 10 -3.911 6.764 -20.854 1.00 0.00 C ATOM 153 NE2 HIS A 10 -3.373 5.563 -20.962 1.00 0.00 N ATOM 0 H HIS A 10 -0.318 4.064 -18.011 1.00 0.00 H new ATOM 0 HA HIS A 10 0.049 6.127 -18.749 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -2.409 6.588 -17.045 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -1.636 7.924 -17.875 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -1.913 4.484 -19.729 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -4.632 7.196 -21.532 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -3.570 4.890 -21.702 1.00 0.00 H new ATOM 161 N TYR A 11 1.750 6.637 -16.854 1.00 0.00 N ATOM 162 CA TYR A 11 2.707 7.297 -15.974 1.00 0.00 C ATOM 163 C TYR A 11 4.140 6.974 -16.387 1.00 0.00 C ATOM 164 O TYR A 11 5.027 6.850 -15.543 1.00 0.00 O ATOM 165 CB TYR A 11 2.475 6.872 -14.523 1.00 0.00 C ATOM 166 CG TYR A 11 2.852 5.434 -14.245 1.00 0.00 C ATOM 167 CD1 TYR A 11 2.142 4.386 -14.819 1.00 0.00 C ATOM 168 CD2 TYR A 11 3.917 5.123 -13.409 1.00 0.00 C ATOM 169 CE1 TYR A 11 2.483 3.071 -14.568 1.00 0.00 C ATOM 170 CE2 TYR A 11 4.266 3.811 -13.153 1.00 0.00 C ATOM 171 CZ TYR A 11 3.545 2.789 -13.735 1.00 0.00 C ATOM 172 OH TYR A 11 3.888 1.480 -13.481 1.00 0.00 O ATOM 0 H TYR A 11 2.164 5.964 -17.499 1.00 0.00 H new ATOM 0 HA TYR A 11 2.557 8.373 -16.059 1.00 0.00 H new ATOM 0 HB2 TYR A 11 3.051 7.523 -13.866 1.00 0.00 H new ATOM 0 HB3 TYR A 11 1.424 7.018 -14.274 1.00 0.00 H new ATOM 0 HD1 TYR A 11 1.310 4.603 -15.472 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.482 5.921 -12.951 1.00 0.00 H new ATOM 0 HE1 TYR A 11 1.921 2.268 -15.022 1.00 0.00 H new ATOM 0 HE2 TYR A 11 5.098 3.587 -12.502 1.00 0.00 H new ATOM 0 HH TYR A 11 4.658 1.455 -12.876 1.00 0.00 H new ATOM 182 N GLU A 12 4.357 6.840 -17.691 1.00 0.00 N ATOM 183 CA GLU A 12 5.682 6.532 -18.217 1.00 0.00 C ATOM 184 C GLU A 12 6.024 7.438 -19.397 1.00 0.00 C ATOM 185 O GLU A 12 5.223 8.282 -19.797 1.00 0.00 O ATOM 186 CB GLU A 12 5.755 5.065 -18.648 1.00 0.00 C ATOM 187 CG GLU A 12 5.580 4.084 -17.501 1.00 0.00 C ATOM 188 CD GLU A 12 5.842 2.649 -17.915 1.00 0.00 C ATOM 189 OE1 GLU A 12 5.348 2.243 -18.988 1.00 0.00 O ATOM 190 OE2 GLU A 12 6.540 1.933 -17.168 1.00 0.00 O ATOM 0 H GLU A 12 3.633 6.940 -18.403 1.00 0.00 H new ATOM 0 HA GLU A 12 6.409 6.708 -17.424 1.00 0.00 H new ATOM 0 HB2 GLU A 12 4.986 4.876 -19.397 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.717 4.883 -19.127 1.00 0.00 H new ATOM 0 HG2 GLU A 12 6.257 4.354 -16.691 1.00 0.00 H new ATOM 0 HG3 GLU A 12 4.566 4.166 -17.109 1.00 0.00 H new ATOM 197 N ASN A 13 7.219 7.255 -19.948 1.00 0.00 N ATOM 198 CA ASN A 13 7.668 8.056 -21.081 1.00 0.00 C ATOM 199 C ASN A 13 7.516 9.546 -20.788 1.00 0.00 C ATOM 200 O ASN A 13 6.651 10.227 -21.339 1.00 0.00 O ATOM 201 CB ASN A 13 6.877 7.689 -22.338 1.00 0.00 C ATOM 202 CG ASN A 13 6.697 6.191 -22.490 1.00 0.00 C ATOM 203 OD1 ASN A 13 7.485 5.403 -21.966 1.00 0.00 O ATOM 204 ND2 ASN A 13 5.657 5.790 -23.212 1.00 0.00 N ATOM 0 H ASN A 13 7.894 6.560 -19.629 1.00 0.00 H new ATOM 0 HA ASN A 13 8.724 7.842 -21.249 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.899 8.168 -22.301 1.00 0.00 H new ATOM 0 HB3 ASN A 13 7.391 8.081 -23.215 1.00 0.00 H new ATOM 0 HD21 ASN A 13 5.486 4.794 -23.350 1.00 0.00 H new ATOM 0 HD22 ASN A 13 5.029 6.478 -23.628 1.00 0.00 H new ATOM 211 N PRO A 14 8.377 10.065 -19.900 1.00 0.00 N ATOM 212 CA PRO A 14 8.359 11.480 -19.515 1.00 0.00 C ATOM 213 C PRO A 14 8.821 12.394 -20.644 1.00 0.00 C ATOM 214 O PRO A 14 9.973 12.828 -20.673 1.00 0.00 O ATOM 215 CB PRO A 14 9.342 11.540 -18.342 1.00 0.00 C ATOM 216 CG PRO A 14 10.262 10.389 -18.560 1.00 0.00 C ATOM 217 CD PRO A 14 9.434 9.312 -19.204 1.00 0.00 C ATOM 0 HA PRO A 14 7.355 11.822 -19.266 1.00 0.00 H new ATOM 0 HB2 PRO A 14 9.886 12.485 -18.329 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.824 11.457 -17.387 1.00 0.00 H new ATOM 0 HG2 PRO A 14 11.098 10.673 -19.199 1.00 0.00 H new ATOM 0 HG3 PRO A 14 10.685 10.044 -17.617 1.00 0.00 H new ATOM 0 HD2 PRO A 14 10.024 8.713 -19.898 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.019 8.628 -18.464 1.00 0.00 H new ATOM 225 N ARG A 15 7.915 12.683 -21.573 1.00 0.00 N ATOM 226 CA ARG A 15 8.231 13.546 -22.705 1.00 0.00 C ATOM 227 C ARG A 15 8.816 14.873 -22.231 1.00 0.00 C ATOM 228 O ARG A 15 9.607 15.500 -22.934 1.00 0.00 O ATOM 229 CB ARG A 15 6.977 13.800 -23.545 1.00 0.00 C ATOM 230 CG ARG A 15 5.927 14.638 -22.833 1.00 0.00 C ATOM 231 CD ARG A 15 4.553 14.456 -23.457 1.00 0.00 C ATOM 232 NE ARG A 15 3.863 15.730 -23.642 1.00 0.00 N ATOM 233 CZ ARG A 15 2.778 15.876 -24.396 1.00 0.00 C ATOM 234 NH1 ARG A 15 2.263 14.832 -25.030 1.00 0.00 N ATOM 235 NH2 ARG A 15 2.207 17.067 -24.515 1.00 0.00 N ATOM 0 H ARG A 15 6.957 12.332 -21.564 1.00 0.00 H new ATOM 0 HA ARG A 15 8.976 13.040 -23.319 1.00 0.00 H new ATOM 0 HB2 ARG A 15 7.264 14.301 -24.469 1.00 0.00 H new ATOM 0 HB3 ARG A 15 6.537 12.843 -23.825 1.00 0.00 H new ATOM 0 HG2 ARG A 15 5.890 14.359 -21.780 1.00 0.00 H new ATOM 0 HG3 ARG A 15 6.210 15.690 -22.874 1.00 0.00 H new ATOM 0 HD2 ARG A 15 4.656 13.956 -24.420 1.00 0.00 H new ATOM 0 HD3 ARG A 15 3.950 13.806 -22.823 1.00 0.00 H new ATOM 0 HE ARG A 15 4.234 16.553 -23.167 1.00 0.00 H new ATOM 0 HH11 ARG A 15 2.699 13.914 -24.940 1.00 0.00 H new ATOM 0 HH12 ARG A 15 1.430 14.946 -25.608 1.00 0.00 H new ATOM 0 HH21 ARG A 15 2.600 17.872 -24.028 1.00 0.00 H new ATOM 0 HH22 ARG A 15 1.375 17.178 -25.094 1.00 0.00 H new ATOM 249 N ASN A 16 8.420 15.294 -21.034 1.00 0.00 N ATOM 250 CA ASN A 16 8.905 16.547 -20.467 1.00 0.00 C ATOM 251 C ASN A 16 10.060 16.297 -19.502 1.00 0.00 C ATOM 252 O ASN A 16 9.847 16.021 -18.321 1.00 0.00 O ATOM 253 CB ASN A 16 7.770 17.277 -19.744 1.00 0.00 C ATOM 254 CG ASN A 16 7.205 18.421 -20.562 1.00 0.00 C ATOM 255 OD1 ASN A 16 7.930 19.334 -20.958 1.00 0.00 O ATOM 256 ND2 ASN A 16 5.903 18.377 -20.820 1.00 0.00 N ATOM 0 H ASN A 16 7.765 14.787 -20.439 1.00 0.00 H new ATOM 0 HA ASN A 16 9.267 17.171 -21.284 1.00 0.00 H new ATOM 0 HB2 ASN A 16 6.973 16.569 -19.516 1.00 0.00 H new ATOM 0 HB3 ASN A 16 8.137 17.661 -18.792 1.00 0.00 H new ATOM 0 HD21 ASN A 16 5.466 19.119 -21.366 1.00 0.00 H new ATOM 0 HD22 ASN A 16 5.340 17.601 -20.472 1.00 0.00 H new ATOM 263 N VAL A 17 11.283 16.395 -20.013 1.00 0.00 N ATOM 264 CA VAL A 17 12.472 16.181 -19.196 1.00 0.00 C ATOM 265 C VAL A 17 12.501 17.135 -18.007 1.00 0.00 C ATOM 266 O VAL A 17 11.861 18.185 -18.024 1.00 0.00 O ATOM 267 CB VAL A 17 13.760 16.367 -20.021 1.00 0.00 C ATOM 268 CG1 VAL A 17 13.979 15.177 -20.943 1.00 0.00 C ATOM 269 CG2 VAL A 17 13.701 17.664 -20.814 1.00 0.00 C ATOM 0 H VAL A 17 11.477 16.621 -20.989 1.00 0.00 H new ATOM 0 HA VAL A 17 12.426 15.154 -18.833 1.00 0.00 H new ATOM 0 HB VAL A 17 14.606 16.425 -19.336 1.00 0.00 H new ATOM 0 HG11 VAL A 17 14.893 15.326 -21.518 1.00 0.00 H new ATOM 0 HG12 VAL A 17 14.068 14.268 -20.349 1.00 0.00 H new ATOM 0 HG13 VAL A 17 13.133 15.084 -21.624 1.00 0.00 H new ATOM 0 HG21 VAL A 17 14.618 17.780 -21.391 1.00 0.00 H new ATOM 0 HG22 VAL A 17 12.847 17.638 -21.491 1.00 0.00 H new ATOM 0 HG23 VAL A 17 13.595 18.505 -20.129 1.00 0.00 H new ATOM 279 N GLY A 18 13.249 16.760 -16.973 1.00 0.00 N ATOM 280 CA GLY A 18 13.348 17.594 -15.789 1.00 0.00 C ATOM 281 C GLY A 18 14.243 16.987 -14.727 1.00 0.00 C ATOM 282 O GLY A 18 13.849 16.871 -13.566 1.00 0.00 O ATOM 0 H GLY A 18 13.787 15.895 -16.934 1.00 0.00 H new ATOM 0 HA2 GLY A 18 13.735 18.574 -16.069 1.00 0.00 H new ATOM 0 HA3 GLY A 18 12.352 17.751 -15.374 1.00 0.00 H new ATOM 286 N SER A 19 15.450 16.597 -15.124 1.00 0.00 N ATOM 287 CA SER A 19 16.401 15.993 -14.198 1.00 0.00 C ATOM 288 C SER A 19 17.795 16.582 -14.390 1.00 0.00 C ATOM 289 O SER A 19 17.972 17.566 -15.109 1.00 0.00 O ATOM 290 CB SER A 19 16.445 14.477 -14.395 1.00 0.00 C ATOM 291 OG SER A 19 15.447 14.052 -15.307 1.00 0.00 O ATOM 0 H SER A 19 15.793 16.688 -16.080 1.00 0.00 H new ATOM 0 HA SER A 19 16.070 16.211 -13.183 1.00 0.00 H new ATOM 0 HB2 SER A 19 17.428 14.183 -14.764 1.00 0.00 H new ATOM 0 HB3 SER A 19 16.302 13.978 -13.436 1.00 0.00 H new ATOM 0 HG SER A 19 15.497 13.079 -15.417 1.00 0.00 H new ATOM 297 N PHE A 20 18.783 15.974 -13.741 1.00 0.00 N ATOM 298 CA PHE A 20 20.162 16.438 -13.838 1.00 0.00 C ATOM 299 C PHE A 20 21.043 15.386 -14.505 1.00 0.00 C ATOM 300 O PHE A 20 20.560 14.343 -14.944 1.00 0.00 O ATOM 301 CB PHE A 20 20.709 16.773 -12.449 1.00 0.00 C ATOM 302 CG PHE A 20 20.421 15.717 -11.421 1.00 0.00 C ATOM 303 CD1 PHE A 20 20.978 14.453 -11.531 1.00 0.00 C ATOM 304 CD2 PHE A 20 19.593 15.988 -10.343 1.00 0.00 C ATOM 305 CE1 PHE A 20 20.714 13.479 -10.587 1.00 0.00 C ATOM 306 CE2 PHE A 20 19.325 15.018 -9.395 1.00 0.00 C ATOM 307 CZ PHE A 20 19.887 13.762 -9.517 1.00 0.00 C ATOM 0 H PHE A 20 18.654 15.159 -13.142 1.00 0.00 H new ATOM 0 HA PHE A 20 20.174 17.339 -14.452 1.00 0.00 H new ATOM 0 HB2 PHE A 20 21.787 16.918 -12.517 1.00 0.00 H new ATOM 0 HB3 PHE A 20 20.281 17.719 -12.117 1.00 0.00 H new ATOM 0 HD1 PHE A 20 21.626 14.226 -12.365 1.00 0.00 H new ATOM 0 HD2 PHE A 20 19.152 16.969 -10.242 1.00 0.00 H new ATOM 0 HE1 PHE A 20 21.154 12.497 -10.686 1.00 0.00 H new ATOM 0 HE2 PHE A 20 18.677 15.242 -8.560 1.00 0.00 H new ATOM 0 HZ PHE A 20 19.680 13.003 -8.777 1.00 0.00 H new ATOM 317 N ASP A 21 22.339 15.669 -14.576 1.00 0.00 N ATOM 318 CA ASP A 21 23.290 14.748 -15.188 1.00 0.00 C ATOM 319 C ASP A 21 23.530 13.539 -14.290 1.00 0.00 C ATOM 320 O ASP A 21 23.099 12.429 -14.599 1.00 0.00 O ATOM 321 CB ASP A 21 24.614 15.461 -15.470 1.00 0.00 C ATOM 322 CG ASP A 21 24.724 15.932 -16.907 1.00 0.00 C ATOM 323 OD1 ASP A 21 24.985 15.088 -17.789 1.00 0.00 O ATOM 324 OD2 ASP A 21 24.549 17.144 -17.149 1.00 0.00 O ATOM 0 H ASP A 21 22.755 16.528 -14.218 1.00 0.00 H new ATOM 0 HA ASP A 21 22.866 14.400 -16.130 1.00 0.00 H new ATOM 0 HB2 ASP A 21 24.712 16.317 -14.802 1.00 0.00 H new ATOM 0 HB3 ASP A 21 25.441 14.787 -15.248 1.00 0.00 H new ATOM 329 N ASN A 22 24.223 13.762 -13.178 1.00 0.00 N ATOM 330 CA ASN A 22 24.522 12.690 -12.236 1.00 0.00 C ATOM 331 C ASN A 22 25.106 13.250 -10.942 1.00 0.00 C ATOM 332 O ASN A 22 26.324 13.329 -10.783 1.00 0.00 O ATOM 333 CB ASN A 22 25.500 11.692 -12.860 1.00 0.00 C ATOM 334 CG ASN A 22 25.490 10.352 -12.150 1.00 0.00 C ATOM 335 OD1 ASN A 22 25.908 10.245 -10.996 1.00 0.00 O ATOM 336 ND2 ASN A 22 25.013 9.321 -12.837 1.00 0.00 N ATOM 0 H ASN A 22 24.588 14.675 -12.907 1.00 0.00 H new ATOM 0 HA ASN A 22 23.590 12.176 -12.001 1.00 0.00 H new ATOM 0 HB2 ASN A 22 25.245 11.546 -13.910 1.00 0.00 H new ATOM 0 HB3 ASN A 22 26.507 12.108 -12.831 1.00 0.00 H new ATOM 0 HD21 ASN A 22 24.982 8.395 -12.411 1.00 0.00 H new ATOM 0 HD22 ASN A 22 24.677 9.455 -13.791 1.00 0.00 H new ATOM 343 N ASN A 23 24.229 13.636 -10.022 1.00 0.00 N ATOM 344 CA ASN A 23 24.658 14.189 -8.742 1.00 0.00 C ATOM 345 C ASN A 23 25.418 15.496 -8.941 1.00 0.00 C ATOM 346 O ASN A 23 25.905 15.783 -10.035 1.00 0.00 O ATOM 347 CB ASN A 23 25.538 13.182 -7.997 1.00 0.00 C ATOM 348 CG ASN A 23 24.878 12.661 -6.735 1.00 0.00 C ATOM 349 OD1 ASN A 23 24.219 13.408 -6.011 1.00 0.00 O ATOM 350 ND2 ASN A 23 25.054 11.372 -6.465 1.00 0.00 N ATOM 0 H ASN A 23 23.217 13.576 -10.138 1.00 0.00 H new ATOM 0 HA ASN A 23 23.768 14.394 -8.147 1.00 0.00 H new ATOM 0 HB2 ASN A 23 25.766 12.345 -8.657 1.00 0.00 H new ATOM 0 HB3 ASN A 23 26.487 13.653 -7.740 1.00 0.00 H new ATOM 0 HD21 ASN A 23 24.635 10.964 -5.629 1.00 0.00 H new ATOM 0 HD22 ASN A 23 25.608 10.790 -7.094 1.00 0.00 H new ATOM 357 N ASP A 24 25.516 16.285 -7.877 1.00 0.00 N ATOM 358 CA ASP A 24 26.219 17.562 -7.933 1.00 0.00 C ATOM 359 C ASP A 24 26.359 18.167 -6.540 1.00 0.00 C ATOM 360 O ASP A 24 25.419 18.143 -5.746 1.00 0.00 O ATOM 361 CB ASP A 24 25.480 18.534 -8.854 1.00 0.00 C ATOM 362 CG ASP A 24 26.418 19.274 -9.787 1.00 0.00 C ATOM 363 OD1 ASP A 24 27.592 19.475 -9.412 1.00 0.00 O ATOM 364 OD2 ASP A 24 25.978 19.651 -10.894 1.00 0.00 O ATOM 0 H ASP A 24 25.117 16.063 -6.965 1.00 0.00 H new ATOM 0 HA ASP A 24 27.217 17.383 -8.333 1.00 0.00 H new ATOM 0 HB2 ASP A 24 24.745 17.985 -9.443 1.00 0.00 H new ATOM 0 HB3 ASP A 24 24.930 19.255 -8.250 1.00 0.00 H new ATOM 369 N GLU A 25 27.538 18.709 -6.251 1.00 0.00 N ATOM 370 CA GLU A 25 27.800 19.319 -4.953 1.00 0.00 C ATOM 371 C GLU A 25 26.843 20.479 -4.693 1.00 0.00 C ATOM 372 O GLU A 25 26.622 20.870 -3.548 1.00 0.00 O ATOM 373 CB GLU A 25 29.247 19.811 -4.879 1.00 0.00 C ATOM 374 CG GLU A 25 29.571 20.903 -5.885 1.00 0.00 C ATOM 375 CD GLU A 25 29.811 22.249 -5.229 1.00 0.00 C ATOM 376 OE1 GLU A 25 29.060 22.594 -4.293 1.00 0.00 O ATOM 377 OE2 GLU A 25 30.750 22.956 -5.651 1.00 0.00 O ATOM 0 H GLU A 25 28.326 18.738 -6.898 1.00 0.00 H new ATOM 0 HA GLU A 25 27.641 18.561 -4.186 1.00 0.00 H new ATOM 0 HB2 GLU A 25 29.444 20.184 -3.874 1.00 0.00 H new ATOM 0 HB3 GLU A 25 29.918 18.967 -5.043 1.00 0.00 H new ATOM 0 HG2 GLU A 25 30.456 20.617 -6.453 1.00 0.00 H new ATOM 0 HG3 GLU A 25 28.750 20.991 -6.597 1.00 0.00 H new ATOM 384 N ASN A 26 26.278 21.024 -5.766 1.00 0.00 N ATOM 385 CA ASN A 26 25.345 22.139 -5.655 1.00 0.00 C ATOM 386 C ASN A 26 24.011 21.800 -6.313 1.00 0.00 C ATOM 387 O ASN A 26 23.595 22.453 -7.271 1.00 0.00 O ATOM 388 CB ASN A 26 25.940 23.394 -6.298 1.00 0.00 C ATOM 389 CG ASN A 26 26.798 23.073 -7.507 1.00 0.00 C ATOM 390 OD1 ASN A 26 26.207 22.406 -8.491 1.00 0.00 O flip ATOM 391 ND2 ASN A 26 27.978 23.421 -7.554 1.00 0.00 N flip ATOM 0 H ASN A 26 26.450 20.711 -6.722 1.00 0.00 H new ATOM 0 HA ASN A 26 25.169 22.330 -4.596 1.00 0.00 H new ATOM 0 HB2 ASN A 26 25.133 24.064 -6.596 1.00 0.00 H new ATOM 0 HB3 ASN A 26 26.541 23.927 -5.561 1.00 0.00 H new ATOM 0 HD21 ASN A 26 28.390 23.932 -6.774 1.00 0.00 H new ATOM 0 HD22 ASN A 26 28.543 23.198 -8.373 1.00 0.00 H new ATOM 398 N VAL A 27 23.344 20.776 -5.793 1.00 0.00 N ATOM 399 CA VAL A 27 22.056 20.350 -6.328 1.00 0.00 C ATOM 400 C VAL A 27 21.138 19.851 -5.218 1.00 0.00 C ATOM 401 O VAL A 27 21.586 19.212 -4.267 1.00 0.00 O ATOM 402 CB VAL A 27 22.225 19.238 -7.379 1.00 0.00 C ATOM 403 CG1 VAL A 27 22.699 17.950 -6.723 1.00 0.00 C ATOM 404 CG2 VAL A 27 20.922 19.014 -8.131 1.00 0.00 C ATOM 0 H VAL A 27 23.674 20.225 -5.001 1.00 0.00 H new ATOM 0 HA VAL A 27 21.606 21.222 -6.803 1.00 0.00 H new ATOM 0 HB VAL A 27 22.983 19.552 -8.096 1.00 0.00 H new ATOM 0 HG11 VAL A 27 22.813 17.176 -7.482 1.00 0.00 H new ATOM 0 HG12 VAL A 27 23.658 18.122 -6.234 1.00 0.00 H new ATOM 0 HG13 VAL A 27 21.967 17.628 -5.983 1.00 0.00 H new ATOM 0 HG21 VAL A 27 21.059 18.225 -8.870 1.00 0.00 H new ATOM 0 HG22 VAL A 27 20.142 18.721 -7.428 1.00 0.00 H new ATOM 0 HG23 VAL A 27 20.629 19.935 -8.634 1.00 0.00 H new ATOM 414 N GLY A 28 19.848 20.147 -5.347 1.00 0.00 N ATOM 415 CA GLY A 28 18.886 19.720 -4.348 1.00 0.00 C ATOM 416 C GLY A 28 17.773 18.875 -4.938 1.00 0.00 C ATOM 417 O GLY A 28 16.983 19.357 -5.749 1.00 0.00 O ATOM 0 H GLY A 28 19.452 20.675 -6.125 1.00 0.00 H new ATOM 0 HA2 GLY A 28 19.400 19.150 -3.574 1.00 0.00 H new ATOM 0 HA3 GLY A 28 18.455 20.597 -3.865 1.00 0.00 H new ATOM 421 N SER A 29 17.713 17.611 -4.531 1.00 0.00 N ATOM 422 CA SER A 29 16.693 16.696 -5.029 1.00 0.00 C ATOM 423 C SER A 29 15.674 16.373 -3.940 1.00 0.00 C ATOM 424 O SER A 29 16.030 15.897 -2.863 1.00 0.00 O ATOM 425 CB SER A 29 17.339 15.406 -5.538 1.00 0.00 C ATOM 426 OG SER A 29 18.608 15.202 -4.941 1.00 0.00 O ATOM 0 H SER A 29 18.358 17.198 -3.858 1.00 0.00 H new ATOM 0 HA SER A 29 16.174 17.184 -5.854 1.00 0.00 H new ATOM 0 HB2 SER A 29 16.689 14.559 -5.318 1.00 0.00 H new ATOM 0 HB3 SER A 29 17.446 15.452 -6.622 1.00 0.00 H new ATOM 0 HG SER A 29 19.000 14.371 -5.281 1.00 0.00 H new ATOM 432 N GLY A 30 14.404 16.636 -4.231 1.00 0.00 N ATOM 433 CA GLY A 30 13.352 16.368 -3.267 1.00 0.00 C ATOM 434 C GLY A 30 12.189 15.610 -3.875 1.00 0.00 C ATOM 435 O GLY A 30 11.547 16.089 -4.809 1.00 0.00 O ATOM 0 H GLY A 30 14.085 17.030 -5.116 1.00 0.00 H new ATOM 0 HA2 GLY A 30 13.762 15.793 -2.437 1.00 0.00 H new ATOM 0 HA3 GLY A 30 12.992 17.311 -2.855 1.00 0.00 H new ATOM 439 N MET A 31 11.917 14.421 -3.344 1.00 0.00 N ATOM 440 CA MET A 31 10.823 13.595 -3.841 1.00 0.00 C ATOM 441 C MET A 31 9.906 13.164 -2.701 1.00 0.00 C ATOM 442 O MET A 31 10.367 12.653 -1.680 1.00 0.00 O ATOM 443 CB MET A 31 11.373 12.363 -4.563 1.00 0.00 C ATOM 444 CG MET A 31 10.294 11.403 -5.036 1.00 0.00 C ATOM 445 SD MET A 31 10.324 9.833 -4.150 1.00 0.00 S ATOM 446 CE MET A 31 8.950 10.054 -3.022 1.00 0.00 C ATOM 0 H MET A 31 12.439 14.009 -2.571 1.00 0.00 H new ATOM 0 HA MET A 31 10.242 14.190 -4.545 1.00 0.00 H new ATOM 0 HB2 MET A 31 11.961 12.688 -5.422 1.00 0.00 H new ATOM 0 HB3 MET A 31 12.051 11.833 -3.894 1.00 0.00 H new ATOM 0 HG2 MET A 31 9.317 11.869 -4.908 1.00 0.00 H new ATOM 0 HG3 MET A 31 10.421 11.216 -6.102 1.00 0.00 H new ATOM 0 HE1 MET A 31 8.477 9.091 -2.832 1.00 0.00 H new ATOM 0 HE2 MET A 31 9.314 10.471 -2.083 1.00 0.00 H new ATOM 0 HE3 MET A 31 8.222 10.735 -3.464 1.00 0.00 H new ATOM 456 N VAL A 32 8.606 13.374 -2.882 1.00 0.00 N ATOM 457 CA VAL A 32 7.624 13.006 -1.869 1.00 0.00 C ATOM 458 C VAL A 32 6.554 12.088 -2.448 1.00 0.00 C ATOM 459 O VAL A 32 6.016 12.346 -3.523 1.00 0.00 O ATOM 460 CB VAL A 32 6.946 14.251 -1.266 1.00 0.00 C ATOM 461 CG1 VAL A 32 7.982 15.175 -0.645 1.00 0.00 C ATOM 462 CG2 VAL A 32 6.136 14.981 -2.327 1.00 0.00 C ATOM 0 H VAL A 32 8.208 13.797 -3.721 1.00 0.00 H new ATOM 0 HA VAL A 32 8.164 12.478 -1.082 1.00 0.00 H new ATOM 0 HB VAL A 32 6.265 13.928 -0.479 1.00 0.00 H new ATOM 0 HG11 VAL A 32 7.485 16.049 -0.224 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.515 14.646 0.145 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.690 15.494 -1.410 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.664 15.858 -1.885 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.795 15.294 -3.137 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.368 14.315 -2.721 1.00 0.00 H new ATOM 472 N GLY A 33 6.249 11.013 -1.726 1.00 0.00 N ATOM 473 CA GLY A 33 5.244 10.073 -2.184 1.00 0.00 C ATOM 474 C GLY A 33 4.319 9.625 -1.070 1.00 0.00 C ATOM 475 O GLY A 33 4.733 9.517 0.084 1.00 0.00 O ATOM 0 H GLY A 33 6.681 10.777 -0.832 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.656 10.533 -2.978 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.736 9.202 -2.616 1.00 0.00 H new ATOM 479 N ALA A 34 3.062 9.365 -1.415 1.00 0.00 N ATOM 480 CA ALA A 34 2.076 8.926 -0.435 1.00 0.00 C ATOM 481 C ALA A 34 1.438 7.605 -0.852 1.00 0.00 C ATOM 482 O ALA A 34 1.177 7.359 -2.030 1.00 0.00 O ATOM 483 CB ALA A 34 1.009 9.994 -0.245 1.00 0.00 C ATOM 0 H ALA A 34 2.703 9.451 -2.366 1.00 0.00 H new ATOM 0 HA ALA A 34 2.588 8.768 0.514 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.279 9.653 0.489 1.00 0.00 H new ATOM 0 HB2 ALA A 34 1.474 10.915 0.107 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.508 10.181 -1.195 1.00 0.00 H new ATOM 489 N PRO A 35 1.180 6.734 0.134 1.00 0.00 N ATOM 490 CA PRO A 35 0.569 5.423 -0.107 1.00 0.00 C ATOM 491 C PRO A 35 -0.894 5.534 -0.525 1.00 0.00 C ATOM 492 O PRO A 35 -1.318 4.918 -1.502 1.00 0.00 O ATOM 493 CB PRO A 35 0.686 4.722 1.249 1.00 0.00 C ATOM 494 CG PRO A 35 0.747 5.829 2.244 1.00 0.00 C ATOM 495 CD PRO A 35 1.464 6.961 1.561 1.00 0.00 C ATOM 0 HA PRO A 35 1.058 4.889 -0.922 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -0.169 4.071 1.433 1.00 0.00 H new ATOM 0 HB3 PRO A 35 1.578 4.098 1.296 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -0.254 6.131 2.553 1.00 0.00 H new ATOM 0 HG3 PRO A 35 1.278 5.517 3.143 1.00 0.00 H new ATOM 0 HD2 PRO A 35 1.094 7.930 1.895 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.534 6.940 1.766 1.00 0.00 H new ATOM 503 N ALA A 36 -1.660 6.322 0.222 1.00 0.00 N ATOM 504 CA ALA A 36 -3.074 6.515 -0.072 1.00 0.00 C ATOM 505 C ALA A 36 -3.265 7.461 -1.253 1.00 0.00 C ATOM 506 O ALA A 36 -4.294 7.426 -1.929 1.00 0.00 O ATOM 507 CB ALA A 36 -3.801 7.045 1.154 1.00 0.00 C ATOM 0 H ALA A 36 -1.324 6.837 1.036 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.498 5.548 -0.342 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.856 7.184 0.919 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.702 6.332 1.972 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.366 8.000 1.450 1.00 0.00 H new ATOM 513 N CYS A 37 -2.269 8.305 -1.495 1.00 0.00 N ATOM 514 CA CYS A 37 -2.328 9.263 -2.594 1.00 0.00 C ATOM 515 C CYS A 37 -2.092 8.570 -3.932 1.00 0.00 C ATOM 516 O CYS A 37 -2.764 8.861 -4.921 1.00 0.00 O ATOM 517 CB CYS A 37 -1.293 10.370 -2.390 1.00 0.00 C ATOM 518 SG CYS A 37 -1.601 11.858 -3.371 1.00 0.00 S ATOM 0 H CYS A 37 -1.411 8.346 -0.945 1.00 0.00 H new ATOM 0 HA CYS A 37 -3.324 9.705 -2.605 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.270 10.642 -1.335 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.306 9.981 -2.640 1.00 0.00 H new ATOM 0 HG CYS A 37 -0.674 12.737 -3.129 1.00 0.00 H new ATOM 524 N GLY A 38 -1.131 7.651 -3.956 1.00 0.00 N ATOM 525 CA GLY A 38 -0.822 6.932 -5.178 1.00 0.00 C ATOM 526 C GLY A 38 0.101 7.713 -6.092 1.00 0.00 C ATOM 527 O GLY A 38 0.875 7.129 -6.851 1.00 0.00 O ATOM 0 H GLY A 38 -0.561 7.392 -3.151 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -0.358 5.978 -4.927 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -1.748 6.707 -5.708 1.00 0.00 H new ATOM 531 N ALA A 39 0.019 9.038 -6.022 1.00 0.00 N ATOM 532 CA ALA A 39 0.853 9.900 -6.850 1.00 0.00 C ATOM 533 C ALA A 39 2.175 10.213 -6.158 1.00 0.00 C ATOM 534 O ALA A 39 2.455 9.704 -5.073 1.00 0.00 O ATOM 535 CB ALA A 39 0.113 11.186 -7.186 1.00 0.00 C ATOM 0 H ALA A 39 -0.617 9.537 -5.400 1.00 0.00 H new ATOM 0 HA ALA A 39 1.074 9.369 -7.776 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.748 11.820 -7.805 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.802 10.948 -7.729 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.138 11.712 -6.265 1.00 0.00 H new ATOM 541 N VAL A 40 2.985 11.054 -6.792 1.00 0.00 N ATOM 542 CA VAL A 40 4.278 11.436 -6.237 1.00 0.00 C ATOM 543 C VAL A 40 4.718 12.800 -6.756 1.00 0.00 C ATOM 544 O VAL A 40 4.475 13.143 -7.912 1.00 0.00 O ATOM 545 CB VAL A 40 5.363 10.396 -6.574 1.00 0.00 C ATOM 546 CG1 VAL A 40 5.693 10.431 -8.059 1.00 0.00 C ATOM 547 CG2 VAL A 40 6.610 10.637 -5.737 1.00 0.00 C ATOM 0 H VAL A 40 2.769 11.484 -7.691 1.00 0.00 H new ATOM 0 HA VAL A 40 4.156 11.485 -5.155 1.00 0.00 H new ATOM 0 HB VAL A 40 4.978 9.405 -6.335 1.00 0.00 H new ATOM 0 HG11 VAL A 40 6.461 9.690 -8.279 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.796 10.206 -8.636 1.00 0.00 H new ATOM 0 HG13 VAL A 40 6.058 11.422 -8.327 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.366 9.893 -5.988 1.00 0.00 H new ATOM 0 HG22 VAL A 40 6.999 11.634 -5.943 1.00 0.00 H new ATOM 0 HG23 VAL A 40 6.359 10.557 -4.679 1.00 0.00 H new ATOM 557 N MET A 41 5.368 13.574 -5.893 1.00 0.00 N ATOM 558 CA MET A 41 5.844 14.902 -6.265 1.00 0.00 C ATOM 559 C MET A 41 7.357 15.003 -6.098 1.00 0.00 C ATOM 560 O MET A 41 7.873 14.966 -4.981 1.00 0.00 O ATOM 561 CB MET A 41 5.153 15.971 -5.417 1.00 0.00 C ATOM 562 CG MET A 41 4.164 16.821 -6.198 1.00 0.00 C ATOM 563 SD MET A 41 2.536 16.879 -5.426 1.00 0.00 S ATOM 564 CE MET A 41 2.090 18.592 -5.704 1.00 0.00 C ATOM 0 H MET A 41 5.577 13.305 -4.932 1.00 0.00 H new ATOM 0 HA MET A 41 5.600 15.068 -7.314 1.00 0.00 H new ATOM 0 HB2 MET A 41 4.631 15.487 -4.592 1.00 0.00 H new ATOM 0 HB3 MET A 41 5.910 16.620 -4.978 1.00 0.00 H new ATOM 0 HG2 MET A 41 4.555 17.834 -6.289 1.00 0.00 H new ATOM 0 HG3 MET A 41 4.069 16.424 -7.209 1.00 0.00 H new ATOM 0 HE1 MET A 41 1.910 19.081 -4.747 1.00 0.00 H new ATOM 0 HE2 MET A 41 2.903 19.100 -6.224 1.00 0.00 H new ATOM 0 HE3 MET A 41 1.186 18.639 -6.311 1.00 0.00 H new ATOM 574 N LYS A 42 8.063 15.131 -7.216 1.00 0.00 N ATOM 575 CA LYS A 42 9.517 15.239 -7.195 1.00 0.00 C ATOM 576 C LYS A 42 9.978 16.522 -7.879 1.00 0.00 C ATOM 577 O LYS A 42 9.471 16.888 -8.941 1.00 0.00 O ATOM 578 CB LYS A 42 10.149 14.026 -7.883 1.00 0.00 C ATOM 579 CG LYS A 42 9.475 13.649 -9.191 1.00 0.00 C ATOM 580 CD LYS A 42 10.041 12.358 -9.758 1.00 0.00 C ATOM 581 CE LYS A 42 11.528 12.482 -10.052 1.00 0.00 C ATOM 582 NZ LYS A 42 11.892 11.845 -11.348 1.00 0.00 N ATOM 0 H LYS A 42 7.652 15.163 -8.149 1.00 0.00 H new ATOM 0 HA LYS A 42 9.839 15.268 -6.154 1.00 0.00 H new ATOM 0 HB2 LYS A 42 11.202 14.234 -8.073 1.00 0.00 H new ATOM 0 HB3 LYS A 42 10.110 13.173 -7.205 1.00 0.00 H new ATOM 0 HG2 LYS A 42 8.403 13.537 -9.030 1.00 0.00 H new ATOM 0 HG3 LYS A 42 9.607 14.454 -9.914 1.00 0.00 H new ATOM 0 HD2 LYS A 42 9.876 11.546 -9.050 1.00 0.00 H new ATOM 0 HD3 LYS A 42 9.509 12.097 -10.673 1.00 0.00 H new ATOM 0 HE2 LYS A 42 11.807 13.535 -10.074 1.00 0.00 H new ATOM 0 HE3 LYS A 42 12.097 12.018 -9.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 12.421 10.968 -11.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 11.027 11.624 -11.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 12.483 12.497 -11.902 1.00 0.00 H new ATOM 596 N LEU A 43 10.941 17.201 -7.266 1.00 0.00 N ATOM 597 CA LEU A 43 11.471 18.443 -7.817 1.00 0.00 C ATOM 598 C LEU A 43 12.980 18.528 -7.615 1.00 0.00 C ATOM 599 O LEU A 43 13.537 17.864 -6.741 1.00 0.00 O ATOM 600 CB LEU A 43 10.789 19.646 -7.163 1.00 0.00 C ATOM 601 CG LEU A 43 9.481 20.108 -7.807 1.00 0.00 C ATOM 602 CD1 LEU A 43 8.357 19.133 -7.491 1.00 0.00 C ATOM 603 CD2 LEU A 43 9.121 21.510 -7.336 1.00 0.00 C ATOM 0 H LEU A 43 11.371 16.912 -6.387 1.00 0.00 H new ATOM 0 HA LEU A 43 11.265 18.454 -8.887 1.00 0.00 H new ATOM 0 HB2 LEU A 43 10.591 19.403 -6.119 1.00 0.00 H new ATOM 0 HB3 LEU A 43 11.488 20.482 -7.168 1.00 0.00 H new ATOM 0 HG LEU A 43 9.619 20.133 -8.888 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.434 19.478 -7.957 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.612 18.146 -7.877 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.218 19.075 -6.411 1.00 0.00 H new ATOM 0 HD21 LEU A 43 8.188 21.823 -7.804 1.00 0.00 H new ATOM 0 HD22 LEU A 43 9.001 21.510 -6.253 1.00 0.00 H new ATOM 0 HD23 LEU A 43 9.916 22.202 -7.613 1.00 0.00 H new ATOM 615 N GLN A 44 13.636 19.351 -8.428 1.00 0.00 N ATOM 616 CA GLN A 44 15.081 19.524 -8.336 1.00 0.00 C ATOM 617 C GLN A 44 15.455 21.002 -8.355 1.00 0.00 C ATOM 618 O GLN A 44 14.872 21.790 -9.102 1.00 0.00 O ATOM 619 CB GLN A 44 15.776 18.794 -9.487 1.00 0.00 C ATOM 620 CG GLN A 44 16.686 17.665 -9.030 1.00 0.00 C ATOM 621 CD GLN A 44 16.387 16.355 -9.732 1.00 0.00 C ATOM 622 OE1 GLN A 44 16.736 16.168 -10.898 1.00 0.00 O ATOM 623 NE2 GLN A 44 15.737 15.439 -9.024 1.00 0.00 N ATOM 0 H GLN A 44 13.190 19.908 -9.157 1.00 0.00 H new ATOM 0 HA GLN A 44 15.414 19.097 -7.390 1.00 0.00 H new ATOM 0 HB2 GLN A 44 15.019 18.390 -10.160 1.00 0.00 H new ATOM 0 HB3 GLN A 44 16.362 19.512 -10.061 1.00 0.00 H new ATOM 0 HG2 GLN A 44 17.724 17.943 -9.214 1.00 0.00 H new ATOM 0 HG3 GLN A 44 16.578 17.529 -7.954 1.00 0.00 H new ATOM 0 HE21 GLN A 44 15.467 15.636 -8.060 1.00 0.00 H new ATOM 0 HE22 GLN A 44 15.508 14.538 -9.444 1.00 0.00 H new ATOM 632 N ILE A 45 16.428 21.371 -7.530 1.00 0.00 N ATOM 633 CA ILE A 45 16.880 22.755 -7.454 1.00 0.00 C ATOM 634 C ILE A 45 18.400 22.842 -7.533 1.00 0.00 C ATOM 635 O ILE A 45 19.095 21.827 -7.487 1.00 0.00 O ATOM 636 CB ILE A 45 16.405 23.431 -6.154 1.00 0.00 C ATOM 637 CG1 ILE A 45 16.928 22.667 -4.936 1.00 0.00 C ATOM 638 CG2 ILE A 45 14.886 23.513 -6.123 1.00 0.00 C ATOM 639 CD1 ILE A 45 16.633 23.353 -3.620 1.00 0.00 C ATOM 0 H ILE A 45 16.919 20.732 -6.905 1.00 0.00 H new ATOM 0 HA ILE A 45 16.444 23.277 -8.306 1.00 0.00 H new ATOM 0 HB ILE A 45 16.804 24.445 -6.122 1.00 0.00 H new ATOM 0 HG12 ILE A 45 16.485 21.671 -4.924 1.00 0.00 H new ATOM 0 HG13 ILE A 45 18.006 22.536 -5.035 1.00 0.00 H new ATOM 0 HG21 ILE A 45 14.566 23.993 -5.198 1.00 0.00 H new ATOM 0 HG22 ILE A 45 14.536 24.096 -6.975 1.00 0.00 H new ATOM 0 HG23 ILE A 45 14.466 22.508 -6.174 1.00 0.00 H new ATOM 0 HD11 ILE A 45 17.032 22.755 -2.801 1.00 0.00 H new ATOM 0 HD12 ILE A 45 17.099 24.338 -3.611 1.00 0.00 H new ATOM 0 HD13 ILE A 45 15.555 23.460 -3.499 1.00 0.00 H new ATOM 651 N LYS A 46 18.912 24.063 -7.651 1.00 0.00 N ATOM 652 CA LYS A 46 20.351 24.285 -7.734 1.00 0.00 C ATOM 653 C LYS A 46 20.770 25.465 -6.863 1.00 0.00 C ATOM 654 O LYS A 46 20.560 26.623 -7.225 1.00 0.00 O ATOM 655 CB LYS A 46 20.766 24.536 -9.185 1.00 0.00 C ATOM 656 CG LYS A 46 21.480 23.358 -9.826 1.00 0.00 C ATOM 657 CD LYS A 46 22.965 23.631 -9.995 1.00 0.00 C ATOM 658 CE LYS A 46 23.720 22.374 -10.402 1.00 0.00 C ATOM 659 NZ LYS A 46 23.255 21.849 -11.715 1.00 0.00 N ATOM 0 H LYS A 46 18.351 24.914 -7.691 1.00 0.00 H new ATOM 0 HA LYS A 46 20.854 23.389 -7.369 1.00 0.00 H new ATOM 0 HB2 LYS A 46 19.879 24.775 -9.772 1.00 0.00 H new ATOM 0 HB3 LYS A 46 21.418 25.409 -9.222 1.00 0.00 H new ATOM 0 HG2 LYS A 46 21.340 22.469 -9.212 1.00 0.00 H new ATOM 0 HG3 LYS A 46 21.035 23.147 -10.798 1.00 0.00 H new ATOM 0 HD2 LYS A 46 23.110 24.404 -10.749 1.00 0.00 H new ATOM 0 HD3 LYS A 46 23.374 24.016 -9.061 1.00 0.00 H new ATOM 0 HE2 LYS A 46 24.787 22.592 -10.455 1.00 0.00 H new ATOM 0 HE3 LYS A 46 23.589 21.608 -9.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 23.839 21.033 -11.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 22.261 21.554 -11.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 23.340 22.593 -12.436 1.00 0.00 H new ATOM 673 N VAL A 47 21.365 25.165 -5.713 1.00 0.00 N ATOM 674 CA VAL A 47 21.816 26.201 -4.791 1.00 0.00 C ATOM 675 C VAL A 47 23.283 26.543 -5.025 1.00 0.00 C ATOM 676 O VAL A 47 24.080 25.683 -5.394 1.00 0.00 O ATOM 677 CB VAL A 47 21.628 25.768 -3.325 1.00 0.00 C ATOM 678 CG1 VAL A 47 21.856 26.944 -2.388 1.00 0.00 C ATOM 679 CG2 VAL A 47 20.244 25.172 -3.119 1.00 0.00 C ATOM 0 H VAL A 47 21.546 24.212 -5.397 1.00 0.00 H new ATOM 0 HA VAL A 47 21.205 27.083 -4.982 1.00 0.00 H new ATOM 0 HB VAL A 47 22.367 25.001 -3.093 1.00 0.00 H new ATOM 0 HG11 VAL A 47 21.719 26.619 -1.357 1.00 0.00 H new ATOM 0 HG12 VAL A 47 22.870 27.321 -2.518 1.00 0.00 H new ATOM 0 HG13 VAL A 47 21.142 27.735 -2.617 1.00 0.00 H new ATOM 0 HG21 VAL A 47 20.129 24.872 -2.078 1.00 0.00 H new ATOM 0 HG22 VAL A 47 19.487 25.915 -3.368 1.00 0.00 H new ATOM 0 HG23 VAL A 47 20.123 24.301 -3.763 1.00 0.00 H new ATOM 689 N ASN A 48 23.631 27.807 -4.807 1.00 0.00 N ATOM 690 CA ASN A 48 25.004 28.265 -4.994 1.00 0.00 C ATOM 691 C ASN A 48 25.723 28.388 -3.654 1.00 0.00 C ATOM 692 O ASN A 48 25.145 28.120 -2.601 1.00 0.00 O ATOM 693 CB ASN A 48 25.020 29.611 -5.720 1.00 0.00 C ATOM 694 CG ASN A 48 23.830 30.479 -5.357 1.00 0.00 C ATOM 695 OD1 ASN A 48 23.851 31.036 -4.152 1.00 0.00 O flip ATOM 696 ND2 ASN A 48 22.904 30.645 -6.150 1.00 0.00 N flip ATOM 0 H ASN A 48 22.982 28.532 -4.501 1.00 0.00 H new ATOM 0 HA ASN A 48 25.528 27.527 -5.601 1.00 0.00 H new ATOM 0 HB2 ASN A 48 25.941 30.141 -5.476 1.00 0.00 H new ATOM 0 HB3 ASN A 48 25.026 29.440 -6.796 1.00 0.00 H new ATOM 0 HD21 ASN A 48 22.930 30.197 -7.066 1.00 0.00 H new ATOM 0 HD22 ASN A 48 22.110 31.231 -5.891 1.00 0.00 H new ATOM 703 N ASP A 49 26.986 28.796 -3.703 1.00 0.00 N ATOM 704 CA ASP A 49 27.785 28.957 -2.494 1.00 0.00 C ATOM 705 C ASP A 49 27.097 29.898 -1.509 1.00 0.00 C ATOM 706 O ASP A 49 27.156 29.694 -0.297 1.00 0.00 O ATOM 707 CB ASP A 49 29.175 29.491 -2.842 1.00 0.00 C ATOM 708 CG ASP A 49 30.260 28.448 -2.656 1.00 0.00 C ATOM 709 OD1 ASP A 49 30.047 27.291 -3.074 1.00 0.00 O ATOM 710 OD2 ASP A 49 31.320 28.789 -2.091 1.00 0.00 O ATOM 0 H ASP A 49 27.479 29.021 -4.567 1.00 0.00 H new ATOM 0 HA ASP A 49 27.888 27.979 -2.024 1.00 0.00 H new ATOM 0 HB2 ASP A 49 29.180 29.836 -3.876 1.00 0.00 H new ATOM 0 HB3 ASP A 49 29.396 30.356 -2.217 1.00 0.00 H new ATOM 715 N GLU A 50 26.447 30.929 -2.040 1.00 0.00 N ATOM 716 CA GLU A 50 25.750 31.902 -1.207 1.00 0.00 C ATOM 717 C GLU A 50 24.566 31.257 -0.492 1.00 0.00 C ATOM 718 O GLU A 50 24.056 31.790 0.492 1.00 0.00 O ATOM 719 CB GLU A 50 25.267 33.080 -2.055 1.00 0.00 C ATOM 720 CG GLU A 50 26.091 34.343 -1.869 1.00 0.00 C ATOM 721 CD GLU A 50 26.846 34.737 -3.123 1.00 0.00 C ATOM 722 OE1 GLU A 50 26.222 34.772 -4.204 1.00 0.00 O ATOM 723 OE2 GLU A 50 28.061 35.010 -3.025 1.00 0.00 O ATOM 0 H GLU A 50 26.389 31.112 -3.042 1.00 0.00 H new ATOM 0 HA GLU A 50 26.451 32.267 -0.456 1.00 0.00 H new ATOM 0 HB2 GLU A 50 25.290 32.793 -3.106 1.00 0.00 H new ATOM 0 HB3 GLU A 50 24.228 33.294 -1.805 1.00 0.00 H new ATOM 0 HG2 GLU A 50 25.434 35.161 -1.573 1.00 0.00 H new ATOM 0 HG3 GLU A 50 26.800 34.193 -1.055 1.00 0.00 H new ATOM 730 N GLY A 51 24.133 30.105 -0.996 1.00 0.00 N ATOM 731 CA GLY A 51 23.013 29.406 -0.395 1.00 0.00 C ATOM 732 C GLY A 51 21.676 29.904 -0.907 1.00 0.00 C ATOM 733 O GLY A 51 20.689 29.923 -0.171 1.00 0.00 O ATOM 0 H GLY A 51 24.539 29.644 -1.810 1.00 0.00 H new ATOM 0 HA2 GLY A 51 23.102 28.339 -0.600 1.00 0.00 H new ATOM 0 HA3 GLY A 51 23.052 29.527 0.688 1.00 0.00 H new ATOM 737 N ILE A 52 21.644 30.311 -2.172 1.00 0.00 N ATOM 738 CA ILE A 52 20.418 30.812 -2.781 1.00 0.00 C ATOM 739 C ILE A 52 20.063 30.020 -4.035 1.00 0.00 C ATOM 740 O ILE A 52 20.943 29.616 -4.796 1.00 0.00 O ATOM 741 CB ILE A 52 20.540 32.303 -3.147 1.00 0.00 C ATOM 742 CG1 ILE A 52 20.794 33.140 -1.891 1.00 0.00 C ATOM 743 CG2 ILE A 52 19.283 32.778 -3.861 1.00 0.00 C ATOM 744 CD1 ILE A 52 19.731 32.972 -0.828 1.00 0.00 C ATOM 0 H ILE A 52 22.452 30.304 -2.794 1.00 0.00 H new ATOM 0 HA ILE A 52 19.626 30.691 -2.042 1.00 0.00 H new ATOM 0 HB ILE A 52 21.387 32.428 -3.822 1.00 0.00 H new ATOM 0 HG12 ILE A 52 21.762 32.867 -1.472 1.00 0.00 H new ATOM 0 HG13 ILE A 52 20.853 34.192 -2.171 1.00 0.00 H new ATOM 0 HG21 ILE A 52 19.385 33.834 -4.113 1.00 0.00 H new ATOM 0 HG22 ILE A 52 19.142 32.199 -4.774 1.00 0.00 H new ATOM 0 HG23 ILE A 52 18.421 32.642 -3.208 1.00 0.00 H new ATOM 0 HD11 ILE A 52 19.976 33.594 0.033 1.00 0.00 H new ATOM 0 HD12 ILE A 52 18.764 33.273 -1.230 1.00 0.00 H new ATOM 0 HD13 ILE A 52 19.687 31.927 -0.520 1.00 0.00 H new ATOM 756 N ILE A 53 18.769 29.803 -4.245 1.00 0.00 N ATOM 757 CA ILE A 53 18.299 29.061 -5.408 1.00 0.00 C ATOM 758 C ILE A 53 18.549 29.841 -6.695 1.00 0.00 C ATOM 759 O ILE A 53 17.993 30.919 -6.896 1.00 0.00 O ATOM 760 CB ILE A 53 16.796 28.740 -5.300 1.00 0.00 C ATOM 761 CG1 ILE A 53 16.528 27.854 -4.082 1.00 0.00 C ATOM 762 CG2 ILE A 53 16.307 28.063 -6.572 1.00 0.00 C ATOM 763 CD1 ILE A 53 17.103 26.460 -4.209 1.00 0.00 C ATOM 0 H ILE A 53 18.028 30.130 -3.625 1.00 0.00 H new ATOM 0 HA ILE A 53 18.861 28.128 -5.436 1.00 0.00 H new ATOM 0 HB ILE A 53 16.248 29.674 -5.174 1.00 0.00 H new ATOM 0 HG12 ILE A 53 16.947 28.332 -3.196 1.00 0.00 H new ATOM 0 HG13 ILE A 53 15.452 27.781 -3.926 1.00 0.00 H new ATOM 0 HG21 ILE A 53 15.243 27.842 -6.481 1.00 0.00 H new ATOM 0 HG22 ILE A 53 16.469 28.726 -7.422 1.00 0.00 H new ATOM 0 HG23 ILE A 53 16.858 27.135 -6.725 1.00 0.00 H new ATOM 0 HD11 ILE A 53 16.874 25.889 -3.309 1.00 0.00 H new ATOM 0 HD12 ILE A 53 16.665 25.963 -5.075 1.00 0.00 H new ATOM 0 HD13 ILE A 53 18.184 26.522 -4.334 1.00 0.00 H new ATOM 775 N GLU A 54 19.389 29.285 -7.563 1.00 0.00 N ATOM 776 CA GLU A 54 19.712 29.928 -8.831 1.00 0.00 C ATOM 777 C GLU A 54 18.970 29.259 -9.985 1.00 0.00 C ATOM 778 O GLU A 54 18.645 29.902 -10.983 1.00 0.00 O ATOM 779 CB GLU A 54 21.220 29.880 -9.083 1.00 0.00 C ATOM 780 CG GLU A 54 21.696 28.563 -9.674 1.00 0.00 C ATOM 781 CD GLU A 54 23.208 28.456 -9.717 1.00 0.00 C ATOM 782 OE1 GLU A 54 23.852 28.714 -8.678 1.00 0.00 O ATOM 783 OE2 GLU A 54 23.748 28.113 -10.789 1.00 0.00 O ATOM 0 H GLU A 54 19.857 28.392 -7.411 1.00 0.00 H new ATOM 0 HA GLU A 54 19.394 30.969 -8.773 1.00 0.00 H new ATOM 0 HB2 GLU A 54 21.493 30.691 -9.758 1.00 0.00 H new ATOM 0 HB3 GLU A 54 21.743 30.057 -8.143 1.00 0.00 H new ATOM 0 HG2 GLU A 54 21.294 27.738 -9.086 1.00 0.00 H new ATOM 0 HG3 GLU A 54 21.299 28.457 -10.684 1.00 0.00 H new ATOM 790 N ASP A 55 18.707 27.965 -9.839 1.00 0.00 N ATOM 791 CA ASP A 55 18.003 27.208 -10.868 1.00 0.00 C ATOM 792 C ASP A 55 17.049 26.196 -10.242 1.00 0.00 C ATOM 793 O ASP A 55 17.271 25.728 -9.126 1.00 0.00 O ATOM 794 CB ASP A 55 19.003 26.490 -11.777 1.00 0.00 C ATOM 795 CG ASP A 55 19.054 27.089 -13.169 1.00 0.00 C ATOM 796 OD1 ASP A 55 18.083 26.901 -13.932 1.00 0.00 O ATOM 797 OD2 ASP A 55 20.064 27.747 -13.494 1.00 0.00 O ATOM 0 H ASP A 55 18.970 27.419 -9.019 1.00 0.00 H new ATOM 0 HA ASP A 55 17.419 27.909 -11.464 1.00 0.00 H new ATOM 0 HB2 ASP A 55 19.995 26.536 -11.328 1.00 0.00 H new ATOM 0 HB3 ASP A 55 18.734 25.436 -11.848 1.00 0.00 H new ATOM 802 N ALA A 56 15.986 25.865 -10.967 1.00 0.00 N ATOM 803 CA ALA A 56 14.999 24.909 -10.483 1.00 0.00 C ATOM 804 C ALA A 56 14.390 24.116 -11.635 1.00 0.00 C ATOM 805 O ALA A 56 13.728 24.680 -12.507 1.00 0.00 O ATOM 806 CB ALA A 56 13.909 25.626 -9.700 1.00 0.00 C ATOM 0 H ALA A 56 15.786 26.245 -11.892 1.00 0.00 H new ATOM 0 HA ALA A 56 15.505 24.207 -9.821 1.00 0.00 H new ATOM 0 HB1 ALA A 56 13.178 24.899 -9.344 1.00 0.00 H new ATOM 0 HB2 ALA A 56 14.352 26.142 -8.848 1.00 0.00 H new ATOM 0 HB3 ALA A 56 13.414 26.351 -10.346 1.00 0.00 H new ATOM 812 N ARG A 57 14.620 22.807 -11.633 1.00 0.00 N ATOM 813 CA ARG A 57 14.096 21.938 -12.680 1.00 0.00 C ATOM 814 C ARG A 57 13.394 20.724 -12.078 1.00 0.00 C ATOM 815 O ARG A 57 13.786 20.229 -11.021 1.00 0.00 O ATOM 816 CB ARG A 57 15.225 21.482 -13.606 1.00 0.00 C ATOM 817 CG ARG A 57 14.840 20.321 -14.509 1.00 0.00 C ATOM 818 CD ARG A 57 15.993 19.911 -15.411 1.00 0.00 C ATOM 819 NE ARG A 57 16.439 21.011 -16.263 1.00 0.00 N ATOM 820 CZ ARG A 57 15.735 21.477 -17.289 1.00 0.00 C ATOM 821 NH1 ARG A 57 14.559 20.943 -17.588 1.00 0.00 N ATOM 822 NH2 ARG A 57 16.207 22.481 -18.018 1.00 0.00 N ATOM 0 H ARG A 57 15.165 22.325 -10.918 1.00 0.00 H new ATOM 0 HA ARG A 57 13.368 22.506 -13.259 1.00 0.00 H new ATOM 0 HB2 ARG A 57 15.539 22.323 -14.224 1.00 0.00 H new ATOM 0 HB3 ARG A 57 16.085 21.192 -13.002 1.00 0.00 H new ATOM 0 HG2 ARG A 57 14.533 19.471 -13.900 1.00 0.00 H new ATOM 0 HG3 ARG A 57 13.982 20.602 -15.119 1.00 0.00 H new ATOM 0 HD2 ARG A 57 16.826 19.565 -14.800 1.00 0.00 H new ATOM 0 HD3 ARG A 57 15.685 19.072 -16.034 1.00 0.00 H new ATOM 0 HE ARG A 57 17.339 21.445 -16.059 1.00 0.00 H new ATOM 0 HH11 ARG A 57 14.192 20.172 -17.030 1.00 0.00 H new ATOM 0 HH12 ARG A 57 14.021 21.303 -18.376 1.00 0.00 H new ATOM 0 HH21 ARG A 57 17.111 22.895 -17.791 1.00 0.00 H new ATOM 0 HH22 ARG A 57 15.666 22.838 -18.805 1.00 0.00 H new ATOM 836 N PHE A 58 12.356 20.250 -12.758 1.00 0.00 N ATOM 837 CA PHE A 58 11.599 19.095 -12.290 1.00 0.00 C ATOM 838 C PHE A 58 10.827 18.449 -13.437 1.00 0.00 C ATOM 839 O PHE A 58 10.680 19.035 -14.510 1.00 0.00 O ATOM 840 CB PHE A 58 10.631 19.509 -11.179 1.00 0.00 C ATOM 841 CG PHE A 58 9.429 20.258 -11.680 1.00 0.00 C ATOM 842 CD1 PHE A 58 9.572 21.490 -12.297 1.00 0.00 C ATOM 843 CD2 PHE A 58 8.157 19.730 -11.533 1.00 0.00 C ATOM 844 CE1 PHE A 58 8.468 22.182 -12.757 1.00 0.00 C ATOM 845 CE2 PHE A 58 7.048 20.417 -11.992 1.00 0.00 C ATOM 846 CZ PHE A 58 7.204 21.644 -12.606 1.00 0.00 C ATOM 0 H PHE A 58 12.020 20.648 -13.635 1.00 0.00 H new ATOM 0 HA PHE A 58 12.306 18.365 -11.894 1.00 0.00 H new ATOM 0 HB2 PHE A 58 10.298 18.618 -10.647 1.00 0.00 H new ATOM 0 HB3 PHE A 58 11.162 20.131 -10.458 1.00 0.00 H new ATOM 0 HD1 PHE A 58 10.557 21.914 -12.420 1.00 0.00 H new ATOM 0 HD2 PHE A 58 8.030 18.770 -11.054 1.00 0.00 H new ATOM 0 HE1 PHE A 58 8.593 23.143 -13.234 1.00 0.00 H new ATOM 0 HE2 PHE A 58 6.062 19.995 -11.870 1.00 0.00 H new ATOM 0 HZ PHE A 58 6.340 22.182 -12.967 1.00 0.00 H new ATOM 856 N LYS A 59 10.337 17.237 -13.204 1.00 0.00 N ATOM 857 CA LYS A 59 9.579 16.509 -14.215 1.00 0.00 C ATOM 858 C LYS A 59 8.376 15.807 -13.594 1.00 0.00 C ATOM 859 O LYS A 59 8.442 15.322 -12.464 1.00 0.00 O ATOM 860 CB LYS A 59 10.476 15.485 -14.914 1.00 0.00 C ATOM 861 CG LYS A 59 11.387 14.725 -13.965 1.00 0.00 C ATOM 862 CD LYS A 59 11.413 13.240 -14.286 1.00 0.00 C ATOM 863 CE LYS A 59 12.838 12.727 -14.430 1.00 0.00 C ATOM 864 NZ LYS A 59 12.903 11.242 -14.346 1.00 0.00 N ATOM 0 H LYS A 59 10.451 16.737 -12.322 1.00 0.00 H new ATOM 0 HA LYS A 59 9.217 17.228 -14.950 1.00 0.00 H new ATOM 0 HB2 LYS A 59 9.850 14.773 -15.451 1.00 0.00 H new ATOM 0 HB3 LYS A 59 11.086 15.997 -15.658 1.00 0.00 H new ATOM 0 HG2 LYS A 59 12.397 15.129 -14.027 1.00 0.00 H new ATOM 0 HG3 LYS A 59 11.048 14.871 -12.939 1.00 0.00 H new ATOM 0 HD2 LYS A 59 10.904 12.687 -13.497 1.00 0.00 H new ATOM 0 HD3 LYS A 59 10.864 13.056 -15.209 1.00 0.00 H new ATOM 0 HE2 LYS A 59 13.247 13.055 -15.385 1.00 0.00 H new ATOM 0 HE3 LYS A 59 13.462 13.163 -13.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 13.844 10.954 -14.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 12.179 10.900 -13.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 12.731 10.833 -15.287 1.00 0.00 H new ATOM 878 N THR A 60 7.277 15.755 -14.340 1.00 0.00 N ATOM 879 CA THR A 60 6.059 15.112 -13.863 1.00 0.00 C ATOM 880 C THR A 60 6.189 13.594 -13.899 1.00 0.00 C ATOM 881 O THR A 60 6.853 13.038 -14.774 1.00 0.00 O ATOM 882 CB THR A 60 4.837 15.532 -14.702 1.00 0.00 C ATOM 883 OG1 THR A 60 3.634 15.061 -14.083 1.00 0.00 O ATOM 884 CG2 THR A 60 4.935 14.979 -16.116 1.00 0.00 C ATOM 0 H THR A 60 7.206 16.151 -15.277 1.00 0.00 H new ATOM 0 HA THR A 60 5.912 15.437 -12.833 1.00 0.00 H new ATOM 0 HB THR A 60 4.817 16.621 -14.755 1.00 0.00 H new ATOM 0 HG1 THR A 60 3.253 14.334 -14.619 1.00 0.00 H new ATOM 0 HG21 THR A 60 4.061 15.289 -16.689 1.00 0.00 H new ATOM 0 HG22 THR A 60 5.837 15.361 -16.594 1.00 0.00 H new ATOM 0 HG23 THR A 60 4.977 13.890 -16.079 1.00 0.00 H new ATOM 892 N TYR A 61 5.550 12.928 -12.943 1.00 0.00 N ATOM 893 CA TYR A 61 5.596 11.472 -12.865 1.00 0.00 C ATOM 894 C TYR A 61 4.418 10.933 -12.058 1.00 0.00 C ATOM 895 O TYR A 61 4.522 10.727 -10.850 1.00 0.00 O ATOM 896 CB TYR A 61 6.912 11.016 -12.234 1.00 0.00 C ATOM 897 CG TYR A 61 7.375 9.659 -12.714 1.00 0.00 C ATOM 898 CD1 TYR A 61 8.045 9.519 -13.923 1.00 0.00 C ATOM 899 CD2 TYR A 61 7.141 8.516 -11.959 1.00 0.00 C ATOM 900 CE1 TYR A 61 8.469 8.281 -14.366 1.00 0.00 C ATOM 901 CE2 TYR A 61 7.563 7.274 -12.393 1.00 0.00 C ATOM 902 CZ TYR A 61 8.226 7.162 -13.597 1.00 0.00 C ATOM 903 OH TYR A 61 8.646 5.927 -14.034 1.00 0.00 O ATOM 0 H TYR A 61 4.995 13.373 -12.212 1.00 0.00 H new ATOM 0 HA TYR A 61 5.531 11.076 -13.879 1.00 0.00 H new ATOM 0 HB2 TYR A 61 7.685 11.753 -12.453 1.00 0.00 H new ATOM 0 HB3 TYR A 61 6.796 10.989 -11.151 1.00 0.00 H new ATOM 0 HD1 TYR A 61 8.238 10.393 -14.527 1.00 0.00 H new ATOM 0 HD2 TYR A 61 6.620 8.600 -11.017 1.00 0.00 H new ATOM 0 HE1 TYR A 61 8.988 8.190 -15.309 1.00 0.00 H new ATOM 0 HE2 TYR A 61 7.375 6.396 -11.793 1.00 0.00 H new ATOM 0 HH TYR A 61 8.398 5.245 -13.375 1.00 0.00 H new ATOM 913 N GLY A 62 3.298 10.707 -12.737 1.00 0.00 N ATOM 914 CA GLY A 62 2.116 10.193 -12.069 1.00 0.00 C ATOM 915 C GLY A 62 0.842 10.852 -12.558 1.00 0.00 C ATOM 916 O GLY A 62 0.802 12.066 -12.765 1.00 0.00 O ATOM 0 H GLY A 62 3.188 10.871 -13.738 1.00 0.00 H new ATOM 0 HA2 GLY A 62 2.050 9.117 -12.230 1.00 0.00 H new ATOM 0 HA3 GLY A 62 2.213 10.349 -10.995 1.00 0.00 H new ATOM 920 N CYS A 63 -0.202 10.052 -12.744 1.00 0.00 N ATOM 921 CA CYS A 63 -1.484 10.564 -13.214 1.00 0.00 C ATOM 922 C CYS A 63 -1.312 11.358 -14.505 1.00 0.00 C ATOM 923 O CYS A 63 -2.065 12.292 -14.776 1.00 0.00 O ATOM 924 CB CYS A 63 -2.130 11.444 -12.142 1.00 0.00 C ATOM 925 SG CYS A 63 -2.379 10.612 -10.556 1.00 0.00 S ATOM 0 H CYS A 63 -0.186 9.046 -12.576 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.135 9.713 -13.416 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.506 12.324 -11.985 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -3.093 11.798 -12.510 1.00 0.00 H new ATOM 0 HG CYS A 63 -2.928 11.437 -9.715 1.00 0.00 H new ATOM 931 N GLY A 64 -0.313 10.981 -15.297 1.00 0.00 N ATOM 932 CA GLY A 64 -0.059 11.669 -16.549 1.00 0.00 C ATOM 933 C GLY A 64 0.789 12.912 -16.366 1.00 0.00 C ATOM 934 O GLY A 64 1.921 12.835 -15.888 1.00 0.00 O ATOM 0 H GLY A 64 0.325 10.211 -15.094 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.442 10.989 -17.238 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -1.009 11.945 -17.007 1.00 0.00 H new ATOM 938 N SER A 65 0.242 14.062 -16.747 1.00 0.00 N ATOM 939 CA SER A 65 0.958 15.327 -16.627 1.00 0.00 C ATOM 940 C SER A 65 0.968 15.810 -15.180 1.00 0.00 C ATOM 941 O SER A 65 0.333 15.214 -14.311 1.00 0.00 O ATOM 942 CB SER A 65 0.318 16.386 -17.526 1.00 0.00 C ATOM 943 OG SER A 65 1.295 17.038 -18.320 1.00 0.00 O ATOM 0 H SER A 65 -0.695 14.144 -17.142 1.00 0.00 H new ATOM 0 HA SER A 65 1.988 15.165 -16.945 1.00 0.00 H new ATOM 0 HB2 SER A 65 -0.427 15.919 -18.171 1.00 0.00 H new ATOM 0 HB3 SER A 65 -0.206 17.119 -16.913 1.00 0.00 H new ATOM 0 HG SER A 65 0.861 17.709 -18.887 1.00 0.00 H new ATOM 949 N ALA A 66 1.693 16.895 -14.930 1.00 0.00 N ATOM 950 CA ALA A 66 1.785 17.460 -13.590 1.00 0.00 C ATOM 951 C ALA A 66 0.680 18.483 -13.349 1.00 0.00 C ATOM 952 O ALA A 66 -0.154 18.727 -14.221 1.00 0.00 O ATOM 953 CB ALA A 66 3.151 18.096 -13.378 1.00 0.00 C ATOM 0 H ALA A 66 2.225 17.400 -15.638 1.00 0.00 H new ATOM 0 HA ALA A 66 1.658 16.650 -12.871 1.00 0.00 H new ATOM 0 HB1 ALA A 66 3.206 18.514 -12.373 1.00 0.00 H new ATOM 0 HB2 ALA A 66 3.927 17.340 -13.499 1.00 0.00 H new ATOM 0 HB3 ALA A 66 3.300 18.890 -14.110 1.00 0.00 H new ATOM 959 N ILE A 67 0.680 19.078 -12.160 1.00 0.00 N ATOM 960 CA ILE A 67 -0.323 20.074 -11.806 1.00 0.00 C ATOM 961 C ILE A 67 0.322 21.429 -11.533 1.00 0.00 C ATOM 962 O ILE A 67 1.527 21.520 -11.302 1.00 0.00 O ATOM 963 CB ILE A 67 -1.131 19.644 -10.567 1.00 0.00 C ATOM 964 CG1 ILE A 67 -0.189 19.232 -9.434 1.00 0.00 C ATOM 965 CG2 ILE A 67 -2.074 18.503 -10.921 1.00 0.00 C ATOM 966 CD1 ILE A 67 -0.909 18.811 -8.173 1.00 0.00 C ATOM 0 H ILE A 67 1.363 18.887 -11.427 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.998 20.159 -12.658 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.727 20.491 -10.228 1.00 0.00 H new ATOM 0 HG12 ILE A 67 0.439 18.410 -9.776 1.00 0.00 H new ATOM 0 HG13 ILE A 67 0.475 20.065 -9.203 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -2.638 18.210 -10.036 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -2.764 18.829 -11.700 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -1.496 17.652 -11.281 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.179 18.533 -7.413 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -1.516 19.639 -7.807 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -1.552 17.958 -8.389 1.00 0.00 H new ATOM 978 N ALA A 68 -0.491 22.481 -11.558 1.00 0.00 N ATOM 979 CA ALA A 68 -0.001 23.831 -11.310 1.00 0.00 C ATOM 980 C ALA A 68 0.696 23.921 -9.957 1.00 0.00 C ATOM 981 O ALA A 68 1.555 24.778 -9.746 1.00 0.00 O ATOM 982 CB ALA A 68 -1.147 24.830 -11.383 1.00 0.00 C ATOM 0 H ALA A 68 -1.492 22.424 -11.748 1.00 0.00 H new ATOM 0 HA ALA A 68 0.728 24.074 -12.083 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -0.767 25.834 -11.196 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -1.600 24.792 -12.374 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.896 24.580 -10.632 1.00 0.00 H new ATOM 988 N SER A 69 0.320 23.033 -9.042 1.00 0.00 N ATOM 989 CA SER A 69 0.907 23.016 -7.707 1.00 0.00 C ATOM 990 C SER A 69 2.422 22.855 -7.781 1.00 0.00 C ATOM 991 O SER A 69 3.152 23.337 -6.916 1.00 0.00 O ATOM 992 CB SER A 69 0.302 21.883 -6.875 1.00 0.00 C ATOM 993 OG SER A 69 -1.062 21.682 -7.204 1.00 0.00 O ATOM 0 H SER A 69 -0.388 22.316 -9.201 1.00 0.00 H new ATOM 0 HA SER A 69 0.684 23.969 -7.227 1.00 0.00 H new ATOM 0 HB2 SER A 69 0.860 20.963 -7.047 1.00 0.00 H new ATOM 0 HB3 SER A 69 0.393 22.118 -5.814 1.00 0.00 H new ATOM 0 HG SER A 69 -1.542 21.347 -6.418 1.00 0.00 H new ATOM 999 N SER A 70 2.888 22.172 -8.822 1.00 0.00 N ATOM 1000 CA SER A 70 4.316 21.942 -9.009 1.00 0.00 C ATOM 1001 C SER A 70 4.967 23.123 -9.722 1.00 0.00 C ATOM 1002 O SER A 70 6.009 23.621 -9.296 1.00 0.00 O ATOM 1003 CB SER A 70 4.547 20.659 -9.809 1.00 0.00 C ATOM 1004 OG SER A 70 5.758 20.030 -9.426 1.00 0.00 O ATOM 0 H SER A 70 2.297 21.768 -9.549 1.00 0.00 H new ATOM 0 HA SER A 70 4.774 21.836 -8.026 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.713 19.975 -9.653 1.00 0.00 H new ATOM 0 HB3 SER A 70 4.575 20.891 -10.874 1.00 0.00 H new ATOM 0 HG SER A 70 6.418 20.125 -10.144 1.00 0.00 H new ATOM 1010 N SER A 71 4.345 23.567 -10.809 1.00 0.00 N ATOM 1011 CA SER A 71 4.865 24.687 -11.584 1.00 0.00 C ATOM 1012 C SER A 71 4.858 25.969 -10.758 1.00 0.00 C ATOM 1013 O SER A 71 5.604 26.908 -11.039 1.00 0.00 O ATOM 1014 CB SER A 71 4.038 24.882 -12.857 1.00 0.00 C ATOM 1015 OG SER A 71 3.094 25.926 -12.696 1.00 0.00 O ATOM 0 H SER A 71 3.480 23.168 -11.173 1.00 0.00 H new ATOM 0 HA SER A 71 5.895 24.459 -11.860 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.699 25.111 -13.693 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.521 23.955 -13.104 1.00 0.00 H new ATOM 0 HG SER A 71 2.579 26.032 -13.523 1.00 0.00 H new ATOM 1021 N LEU A 72 4.009 26.002 -9.736 1.00 0.00 N ATOM 1022 CA LEU A 72 3.903 27.169 -8.867 1.00 0.00 C ATOM 1023 C LEU A 72 5.017 27.175 -7.825 1.00 0.00 C ATOM 1024 O LEU A 72 5.698 28.183 -7.635 1.00 0.00 O ATOM 1025 CB LEU A 72 2.539 27.190 -8.173 1.00 0.00 C ATOM 1026 CG LEU A 72 2.365 28.232 -7.068 1.00 0.00 C ATOM 1027 CD1 LEU A 72 2.188 29.620 -7.666 1.00 0.00 C ATOM 1028 CD2 LEU A 72 1.181 27.876 -6.181 1.00 0.00 C ATOM 0 H LEU A 72 3.384 25.234 -9.489 1.00 0.00 H new ATOM 0 HA LEU A 72 4.004 28.062 -9.484 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.772 27.359 -8.929 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.355 26.204 -7.747 1.00 0.00 H new ATOM 0 HG LEU A 72 3.265 28.236 -6.453 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.066 30.349 -6.865 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.067 29.876 -8.258 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.305 29.631 -8.305 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.072 28.629 -5.400 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.273 27.843 -6.783 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.349 26.901 -5.724 1.00 0.00 H new ATOM 1040 N VAL A 73 5.198 26.042 -7.154 1.00 0.00 N ATOM 1041 CA VAL A 73 6.231 25.916 -6.133 1.00 0.00 C ATOM 1042 C VAL A 73 7.622 26.073 -6.737 1.00 0.00 C ATOM 1043 O VAL A 73 8.562 26.494 -6.062 1.00 0.00 O ATOM 1044 CB VAL A 73 6.147 24.556 -5.414 1.00 0.00 C ATOM 1045 CG1 VAL A 73 4.848 24.446 -4.631 1.00 0.00 C ATOM 1046 CG2 VAL A 73 6.274 23.416 -6.414 1.00 0.00 C ATOM 0 H VAL A 73 4.643 25.199 -7.299 1.00 0.00 H new ATOM 0 HA VAL A 73 6.059 26.713 -5.409 1.00 0.00 H new ATOM 0 HB VAL A 73 6.976 24.485 -4.709 1.00 0.00 H new ATOM 0 HG11 VAL A 73 4.806 23.479 -4.130 1.00 0.00 H new ATOM 0 HG12 VAL A 73 4.803 25.242 -3.888 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.003 24.538 -5.313 1.00 0.00 H new ATOM 0 HG21 VAL A 73 6.213 22.463 -5.889 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.467 23.481 -7.144 1.00 0.00 H new ATOM 0 HG23 VAL A 73 7.233 23.487 -6.926 1.00 0.00 H new ATOM 1056 N THR A 74 7.748 25.732 -8.016 1.00 0.00 N ATOM 1057 CA THR A 74 9.024 25.834 -8.712 1.00 0.00 C ATOM 1058 C THR A 74 9.404 27.290 -8.954 1.00 0.00 C ATOM 1059 O THR A 74 10.514 27.713 -8.632 1.00 0.00 O ATOM 1060 CB THR A 74 8.988 25.094 -10.063 1.00 0.00 C ATOM 1061 OG1 THR A 74 7.676 25.174 -10.631 1.00 0.00 O ATOM 1062 CG2 THR A 74 9.384 23.635 -9.891 1.00 0.00 C ATOM 0 H THR A 74 6.981 25.383 -8.591 1.00 0.00 H new ATOM 0 HA THR A 74 9.772 25.368 -8.070 1.00 0.00 H new ATOM 0 HB THR A 74 9.703 25.572 -10.733 1.00 0.00 H new ATOM 0 HG1 THR A 74 7.134 24.423 -10.310 1.00 0.00 H new ATOM 0 HG21 THR A 74 9.351 23.133 -10.858 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.394 23.578 -9.486 1.00 0.00 H new ATOM 0 HG23 THR A 74 8.690 23.148 -9.206 1.00 0.00 H new ATOM 1070 N GLU A 75 8.474 28.053 -9.521 1.00 0.00 N ATOM 1071 CA GLU A 75 8.713 29.463 -9.805 1.00 0.00 C ATOM 1072 C GLU A 75 8.939 30.247 -8.516 1.00 0.00 C ATOM 1073 O GLU A 75 9.510 31.338 -8.532 1.00 0.00 O ATOM 1074 CB GLU A 75 7.533 30.058 -10.577 1.00 0.00 C ATOM 1075 CG GLU A 75 7.350 29.462 -11.962 1.00 0.00 C ATOM 1076 CD GLU A 75 8.542 29.707 -12.866 1.00 0.00 C ATOM 1077 OE1 GLU A 75 9.259 30.706 -12.644 1.00 0.00 O ATOM 1078 OE2 GLU A 75 8.759 28.901 -13.795 1.00 0.00 O ATOM 0 H GLU A 75 7.549 27.718 -9.792 1.00 0.00 H new ATOM 0 HA GLU A 75 9.612 29.537 -10.417 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.620 29.906 -10.002 1.00 0.00 H new ATOM 0 HB3 GLU A 75 7.676 31.135 -10.670 1.00 0.00 H new ATOM 0 HG2 GLU A 75 7.182 28.389 -11.872 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.457 29.887 -12.421 1.00 0.00 H new ATOM 1085 N TRP A 76 8.486 29.684 -7.401 1.00 0.00 N ATOM 1086 CA TRP A 76 8.638 30.330 -6.103 1.00 0.00 C ATOM 1087 C TRP A 76 10.040 30.111 -5.546 1.00 0.00 C ATOM 1088 O TRP A 76 10.676 31.043 -5.052 1.00 0.00 O ATOM 1089 CB TRP A 76 7.596 29.796 -5.119 1.00 0.00 C ATOM 1090 CG TRP A 76 6.490 30.768 -4.839 1.00 0.00 C ATOM 1091 CD1 TRP A 76 5.149 30.507 -4.844 1.00 0.00 C ATOM 1092 CD2 TRP A 76 6.630 32.155 -4.516 1.00 0.00 C ATOM 1093 NE1 TRP A 76 4.447 31.649 -4.542 1.00 0.00 N ATOM 1094 CE2 TRP A 76 5.332 32.674 -4.336 1.00 0.00 C ATOM 1095 CE3 TRP A 76 7.724 33.009 -4.359 1.00 0.00 C ATOM 1096 CZ2 TRP A 76 5.103 34.008 -4.009 1.00 0.00 C ATOM 1097 CZ3 TRP A 76 7.495 34.333 -4.034 1.00 0.00 C ATOM 1098 CH2 TRP A 76 6.193 34.822 -3.861 1.00 0.00 C ATOM 0 H TRP A 76 8.011 28.782 -7.370 1.00 0.00 H new ATOM 0 HA TRP A 76 8.485 31.401 -6.238 1.00 0.00 H new ATOM 0 HB2 TRP A 76 7.169 28.876 -5.517 1.00 0.00 H new ATOM 0 HB3 TRP A 76 8.090 29.539 -4.182 1.00 0.00 H new ATOM 0 HD1 TRP A 76 4.706 29.545 -5.054 1.00 0.00 H new ATOM 0 HE1 TRP A 76 3.431 31.722 -4.481 1.00 0.00 H new ATOM 0 HE3 TRP A 76 8.731 32.641 -4.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 4.100 34.387 -3.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 8.334 35.002 -3.911 1.00 0.00 H new ATOM 0 HH2 TRP A 76 6.047 35.861 -3.606 1.00 0.00 H new ATOM 1109 N VAL A 77 10.518 28.873 -5.629 1.00 0.00 N ATOM 1110 CA VAL A 77 11.847 28.532 -5.134 1.00 0.00 C ATOM 1111 C VAL A 77 12.934 29.126 -6.022 1.00 0.00 C ATOM 1112 O VAL A 77 14.009 29.493 -5.547 1.00 0.00 O ATOM 1113 CB VAL A 77 12.041 27.006 -5.055 1.00 0.00 C ATOM 1114 CG1 VAL A 77 11.131 26.406 -3.994 1.00 0.00 C ATOM 1115 CG2 VAL A 77 11.788 26.366 -6.411 1.00 0.00 C ATOM 0 H VAL A 77 10.005 28.090 -6.034 1.00 0.00 H new ATOM 0 HA VAL A 77 11.930 28.954 -4.133 1.00 0.00 H new ATOM 0 HB VAL A 77 13.073 26.803 -4.770 1.00 0.00 H new ATOM 0 HG11 VAL A 77 11.282 25.327 -3.953 1.00 0.00 H new ATOM 0 HG12 VAL A 77 11.366 26.843 -3.023 1.00 0.00 H new ATOM 0 HG13 VAL A 77 10.091 26.617 -4.244 1.00 0.00 H new ATOM 0 HG21 VAL A 77 11.930 25.288 -6.337 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.767 26.577 -6.728 1.00 0.00 H new ATOM 0 HG23 VAL A 77 12.486 26.774 -7.142 1.00 0.00 H new ATOM 1125 N LYS A 78 12.646 29.220 -7.316 1.00 0.00 N ATOM 1126 CA LYS A 78 13.598 29.772 -8.274 1.00 0.00 C ATOM 1127 C LYS A 78 13.991 31.196 -7.892 1.00 0.00 C ATOM 1128 O LYS A 78 13.271 32.149 -8.187 1.00 0.00 O ATOM 1129 CB LYS A 78 13.001 29.757 -9.683 1.00 0.00 C ATOM 1130 CG LYS A 78 13.580 28.674 -10.577 1.00 0.00 C ATOM 1131 CD LYS A 78 13.939 29.217 -11.950 1.00 0.00 C ATOM 1132 CE LYS A 78 13.873 28.132 -13.013 1.00 0.00 C ATOM 1133 NZ LYS A 78 15.128 28.060 -13.812 1.00 0.00 N ATOM 0 H LYS A 78 11.761 28.921 -7.726 1.00 0.00 H new ATOM 0 HA LYS A 78 14.493 29.150 -8.258 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.922 29.618 -9.610 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.167 30.728 -10.149 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.468 28.251 -10.108 1.00 0.00 H new ATOM 0 HG3 LYS A 78 12.859 27.864 -10.682 1.00 0.00 H new ATOM 0 HD2 LYS A 78 13.257 30.026 -12.212 1.00 0.00 H new ATOM 0 HD3 LYS A 78 14.943 29.641 -11.924 1.00 0.00 H new ATOM 0 HE2 LYS A 78 13.690 27.169 -12.537 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.030 28.325 -13.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 15.043 27.308 -14.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 15.290 28.971 -14.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 15.929 27.850 -13.182 1.00 0.00 H new ATOM 1147 N GLY A 79 15.138 31.332 -7.234 1.00 0.00 N ATOM 1148 CA GLY A 79 15.607 32.643 -6.824 1.00 0.00 C ATOM 1149 C GLY A 79 15.510 32.851 -5.326 1.00 0.00 C ATOM 1150 O GLY A 79 16.111 33.775 -4.779 1.00 0.00 O ATOM 0 H GLY A 79 15.751 30.558 -6.977 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.643 32.770 -7.139 1.00 0.00 H new ATOM 0 HA3 GLY A 79 15.023 33.410 -7.333 1.00 0.00 H new ATOM 1154 N LYS A 80 14.749 31.990 -4.659 1.00 0.00 N ATOM 1155 CA LYS A 80 14.573 32.082 -3.214 1.00 0.00 C ATOM 1156 C LYS A 80 15.701 31.362 -2.482 1.00 0.00 C ATOM 1157 O LYS A 80 16.418 30.553 -3.069 1.00 0.00 O ATOM 1158 CB LYS A 80 13.223 31.488 -2.805 1.00 0.00 C ATOM 1159 CG LYS A 80 12.353 32.446 -2.010 1.00 0.00 C ATOM 1160 CD LYS A 80 11.611 33.411 -2.920 1.00 0.00 C ATOM 1161 CE LYS A 80 10.420 34.039 -2.213 1.00 0.00 C ATOM 1162 NZ LYS A 80 10.324 35.501 -2.481 1.00 0.00 N ATOM 0 H LYS A 80 14.244 31.220 -5.096 1.00 0.00 H new ATOM 0 HA LYS A 80 14.598 33.136 -2.936 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.685 31.180 -3.701 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.395 30.590 -2.212 1.00 0.00 H new ATOM 0 HG2 LYS A 80 11.635 31.880 -1.416 1.00 0.00 H new ATOM 0 HG3 LYS A 80 12.973 33.007 -1.311 1.00 0.00 H new ATOM 0 HD2 LYS A 80 12.292 34.194 -3.254 1.00 0.00 H new ATOM 0 HD3 LYS A 80 11.270 32.884 -3.811 1.00 0.00 H new ATOM 0 HE2 LYS A 80 9.503 33.549 -2.541 1.00 0.00 H new ATOM 0 HE3 LYS A 80 10.505 33.871 -1.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 9.500 35.892 -1.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 11.188 35.973 -2.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 10.217 35.660 -3.503 1.00 0.00 H new ATOM 1176 N SER A 81 15.851 31.662 -1.196 1.00 0.00 N ATOM 1177 CA SER A 81 16.893 31.045 -0.384 1.00 0.00 C ATOM 1178 C SER A 81 16.463 29.660 0.091 1.00 0.00 C ATOM 1179 O SER A 81 15.418 29.149 -0.312 1.00 0.00 O ATOM 1180 CB SER A 81 17.222 31.930 0.820 1.00 0.00 C ATOM 1181 OG SER A 81 18.416 31.505 1.454 1.00 0.00 O ATOM 0 H SER A 81 15.264 32.328 -0.694 1.00 0.00 H new ATOM 0 HA SER A 81 17.785 30.938 -1.002 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.327 32.965 0.496 1.00 0.00 H new ATOM 0 HB3 SER A 81 16.398 31.901 1.533 1.00 0.00 H new ATOM 0 HG SER A 81 18.605 32.087 2.219 1.00 0.00 H new ATOM 1187 N LEU A 82 17.277 29.058 0.951 1.00 0.00 N ATOM 1188 CA LEU A 82 16.983 27.732 1.483 1.00 0.00 C ATOM 1189 C LEU A 82 15.914 27.805 2.568 1.00 0.00 C ATOM 1190 O LEU A 82 14.989 26.994 2.598 1.00 0.00 O ATOM 1191 CB LEU A 82 18.254 27.092 2.044 1.00 0.00 C ATOM 1192 CG LEU A 82 19.492 27.163 1.151 1.00 0.00 C ATOM 1193 CD1 LEU A 82 20.758 27.015 1.980 1.00 0.00 C ATOM 1194 CD2 LEU A 82 19.433 26.094 0.070 1.00 0.00 C ATOM 0 H LEU A 82 18.146 29.467 1.295 1.00 0.00 H new ATOM 0 HA LEU A 82 16.604 27.116 0.667 1.00 0.00 H new ATOM 0 HB2 LEU A 82 18.489 27.571 2.995 1.00 0.00 H new ATOM 0 HB3 LEU A 82 18.045 26.044 2.258 1.00 0.00 H new ATOM 0 HG LEU A 82 19.511 28.140 0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 82 21.629 27.068 1.327 1.00 0.00 H new ATOM 0 HD12 LEU A 82 20.807 27.818 2.716 1.00 0.00 H new ATOM 0 HD13 LEU A 82 20.747 26.053 2.492 1.00 0.00 H new ATOM 0 HD21 LEU A 82 20.323 26.160 -0.556 1.00 0.00 H new ATOM 0 HD22 LEU A 82 19.388 25.109 0.534 1.00 0.00 H new ATOM 0 HD23 LEU A 82 18.545 26.246 -0.544 1.00 0.00 H new ATOM 1206 N ASP A 83 16.047 28.783 3.457 1.00 0.00 N ATOM 1207 CA ASP A 83 15.091 28.965 4.543 1.00 0.00 C ATOM 1208 C ASP A 83 13.755 29.473 4.011 1.00 0.00 C ATOM 1209 O ASP A 83 12.694 29.073 4.489 1.00 0.00 O ATOM 1210 CB ASP A 83 15.646 29.942 5.581 1.00 0.00 C ATOM 1211 CG ASP A 83 16.349 29.235 6.724 1.00 0.00 C ATOM 1212 OD1 ASP A 83 15.652 28.639 7.571 1.00 0.00 O ATOM 1213 OD2 ASP A 83 17.596 29.278 6.770 1.00 0.00 O ATOM 0 H ASP A 83 16.808 29.462 3.447 1.00 0.00 H new ATOM 0 HA ASP A 83 14.928 27.997 5.017 1.00 0.00 H new ATOM 0 HB2 ASP A 83 16.343 30.625 5.096 1.00 0.00 H new ATOM 0 HB3 ASP A 83 14.831 30.547 5.978 1.00 0.00 H new ATOM 1218 N GLU A 84 13.816 30.358 3.021 1.00 0.00 N ATOM 1219 CA GLU A 84 12.610 30.922 2.426 1.00 0.00 C ATOM 1220 C GLU A 84 11.708 29.820 1.876 1.00 0.00 C ATOM 1221 O GLU A 84 10.560 29.676 2.295 1.00 0.00 O ATOM 1222 CB GLU A 84 12.975 31.902 1.309 1.00 0.00 C ATOM 1223 CG GLU A 84 12.961 33.357 1.747 1.00 0.00 C ATOM 1224 CD GLU A 84 11.563 33.944 1.776 1.00 0.00 C ATOM 1225 OE1 GLU A 84 10.609 33.224 1.412 1.00 0.00 O ATOM 1226 OE2 GLU A 84 11.423 35.123 2.162 1.00 0.00 O ATOM 0 H GLU A 84 14.687 30.700 2.614 1.00 0.00 H new ATOM 0 HA GLU A 84 12.068 31.457 3.206 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.967 31.655 0.930 1.00 0.00 H new ATOM 0 HB3 GLU A 84 12.277 31.774 0.482 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.406 33.438 2.739 1.00 0.00 H new ATOM 0 HG3 GLU A 84 13.583 33.942 1.070 1.00 0.00 H new ATOM 1233 N ALA A 85 12.237 29.046 0.934 1.00 0.00 N ATOM 1234 CA ALA A 85 11.482 27.957 0.327 1.00 0.00 C ATOM 1235 C ALA A 85 11.010 26.962 1.381 1.00 0.00 C ATOM 1236 O ALA A 85 9.883 26.472 1.324 1.00 0.00 O ATOM 1237 CB ALA A 85 12.325 27.254 -0.727 1.00 0.00 C ATOM 0 H ALA A 85 13.186 29.153 0.575 1.00 0.00 H new ATOM 0 HA ALA A 85 10.601 28.382 -0.153 1.00 0.00 H new ATOM 0 HB1 ALA A 85 11.749 26.443 -1.172 1.00 0.00 H new ATOM 0 HB2 ALA A 85 12.607 27.967 -1.502 1.00 0.00 H new ATOM 0 HB3 ALA A 85 13.224 26.848 -0.263 1.00 0.00 H new ATOM 1243 N GLN A 86 11.881 26.667 2.341 1.00 0.00 N ATOM 1244 CA GLN A 86 11.552 25.729 3.408 1.00 0.00 C ATOM 1245 C GLN A 86 10.494 26.311 4.339 1.00 0.00 C ATOM 1246 O GLN A 86 9.799 25.577 5.041 1.00 0.00 O ATOM 1247 CB GLN A 86 12.808 25.370 4.205 1.00 0.00 C ATOM 1248 CG GLN A 86 12.716 24.027 4.912 1.00 0.00 C ATOM 1249 CD GLN A 86 12.686 24.164 6.422 1.00 0.00 C ATOM 1250 OE1 GLN A 86 11.818 23.603 7.090 1.00 0.00 O ATOM 1251 NE2 GLN A 86 13.637 24.913 6.967 1.00 0.00 N ATOM 0 H GLN A 86 12.819 27.064 2.402 1.00 0.00 H new ATOM 0 HA GLN A 86 11.149 24.825 2.951 1.00 0.00 H new ATOM 0 HB2 GLN A 86 13.665 25.359 3.531 1.00 0.00 H new ATOM 0 HB3 GLN A 86 12.994 26.149 4.945 1.00 0.00 H new ATOM 0 HG2 GLN A 86 11.818 23.507 4.580 1.00 0.00 H new ATOM 0 HG3 GLN A 86 13.567 23.410 4.624 1.00 0.00 H new ATOM 0 HE21 GLN A 86 14.337 25.360 6.374 1.00 0.00 H new ATOM 0 HE22 GLN A 86 13.668 25.042 7.978 1.00 0.00 H new ATOM 1260 N ALA A 87 10.378 27.635 4.340 1.00 0.00 N ATOM 1261 CA ALA A 87 9.403 28.316 5.183 1.00 0.00 C ATOM 1262 C ALA A 87 8.012 28.272 4.560 1.00 0.00 C ATOM 1263 O ALA A 87 7.008 28.468 5.246 1.00 0.00 O ATOM 1264 CB ALA A 87 9.830 29.756 5.426 1.00 0.00 C ATOM 0 H ALA A 87 10.947 28.257 3.766 1.00 0.00 H new ATOM 0 HA ALA A 87 9.360 27.795 6.140 1.00 0.00 H new ATOM 0 HB1 ALA A 87 9.093 30.253 6.057 1.00 0.00 H new ATOM 0 HB2 ALA A 87 10.800 29.769 5.923 1.00 0.00 H new ATOM 0 HB3 ALA A 87 9.903 30.280 4.473 1.00 0.00 H new ATOM 1270 N ILE A 88 7.960 28.015 3.257 1.00 0.00 N ATOM 1271 CA ILE A 88 6.692 27.946 2.543 1.00 0.00 C ATOM 1272 C ILE A 88 5.712 27.015 3.250 1.00 0.00 C ATOM 1273 O ILE A 88 6.091 25.947 3.732 1.00 0.00 O ATOM 1274 CB ILE A 88 6.888 27.461 1.094 1.00 0.00 C ATOM 1275 CG1 ILE A 88 7.845 28.392 0.347 1.00 0.00 C ATOM 1276 CG2 ILE A 88 5.549 27.382 0.376 1.00 0.00 C ATOM 1277 CD1 ILE A 88 8.165 27.929 -1.057 1.00 0.00 C ATOM 0 H ILE A 88 8.781 27.851 2.675 1.00 0.00 H new ATOM 0 HA ILE A 88 6.283 28.956 2.528 1.00 0.00 H new ATOM 0 HB ILE A 88 7.325 26.463 1.116 1.00 0.00 H new ATOM 0 HG12 ILE A 88 7.407 29.389 0.301 1.00 0.00 H new ATOM 0 HG13 ILE A 88 8.773 28.477 0.913 1.00 0.00 H new ATOM 0 HG21 ILE A 88 5.704 27.038 -0.647 1.00 0.00 H new ATOM 0 HG22 ILE A 88 4.896 26.683 0.899 1.00 0.00 H new ATOM 0 HG23 ILE A 88 5.086 28.369 0.360 1.00 0.00 H new ATOM 0 HD11 ILE A 88 8.848 28.637 -1.527 1.00 0.00 H new ATOM 0 HD12 ILE A 88 8.632 26.945 -1.018 1.00 0.00 H new ATOM 0 HD13 ILE A 88 7.246 27.871 -1.640 1.00 0.00 H new ATOM 1289 N LYS A 89 4.450 27.426 3.307 1.00 0.00 N ATOM 1290 CA LYS A 89 3.414 26.630 3.953 1.00 0.00 C ATOM 1291 C LYS A 89 2.390 26.140 2.933 1.00 0.00 C ATOM 1292 O LYS A 89 1.960 26.893 2.061 1.00 0.00 O ATOM 1293 CB LYS A 89 2.715 27.449 5.040 1.00 0.00 C ATOM 1294 CG LYS A 89 3.660 27.982 6.102 1.00 0.00 C ATOM 1295 CD LYS A 89 4.425 26.859 6.783 1.00 0.00 C ATOM 1296 CE LYS A 89 5.362 27.393 7.855 1.00 0.00 C ATOM 1297 NZ LYS A 89 5.108 26.761 9.179 1.00 0.00 N ATOM 0 H LYS A 89 4.120 28.307 2.913 1.00 0.00 H new ATOM 0 HA LYS A 89 3.890 25.763 4.411 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.196 28.287 4.574 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.956 26.830 5.518 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.364 28.679 5.647 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.094 28.541 6.847 1.00 0.00 H new ATOM 0 HD2 LYS A 89 3.721 26.157 7.230 1.00 0.00 H new ATOM 0 HD3 LYS A 89 4.999 26.305 6.040 1.00 0.00 H new ATOM 0 HE2 LYS A 89 6.395 27.211 7.558 1.00 0.00 H new ATOM 0 HE3 LYS A 89 5.240 28.473 7.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 5.767 27.152 9.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 4.130 26.956 9.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 5.249 25.733 9.106 1.00 0.00 H new ATOM 1311 N ASN A 90 2.004 24.873 3.051 1.00 0.00 N ATOM 1312 CA ASN A 90 1.030 24.284 2.139 1.00 0.00 C ATOM 1313 C ASN A 90 -0.189 25.187 1.988 1.00 0.00 C ATOM 1314 O ASN A 90 -0.753 25.312 0.900 1.00 0.00 O ATOM 1315 CB ASN A 90 0.598 22.905 2.644 1.00 0.00 C ATOM 1316 CG ASN A 90 0.002 22.960 4.037 1.00 0.00 C ATOM 1317 OD1 ASN A 90 -1.307 23.167 4.113 1.00 0.00 O flip ATOM 1318 ND2 ASN A 90 0.711 22.818 5.034 1.00 0.00 N flip ATOM 0 H ASN A 90 2.350 24.236 3.768 1.00 0.00 H new ATOM 0 HA ASN A 90 1.502 24.175 1.163 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -0.133 22.482 1.955 1.00 0.00 H new ATOM 0 HB3 ASN A 90 1.458 22.236 2.646 1.00 0.00 H new ATOM 0 HD21 ASN A 90 1.713 22.661 4.929 1.00 0.00 H new ATOM 0 HD22 ASN A 90 0.296 22.858 5.965 1.00 0.00 H new ATOM 1325 N THR A 91 -0.593 25.817 3.087 1.00 0.00 N ATOM 1326 CA THR A 91 -1.746 26.709 3.077 1.00 0.00 C ATOM 1327 C THR A 91 -1.639 27.733 1.953 1.00 0.00 C ATOM 1328 O THR A 91 -2.640 28.097 1.335 1.00 0.00 O ATOM 1329 CB THR A 91 -1.894 27.450 4.419 1.00 0.00 C ATOM 1330 OG1 THR A 91 -3.033 28.317 4.377 1.00 0.00 O ATOM 1331 CG2 THR A 91 -0.644 28.261 4.730 1.00 0.00 C ATOM 0 H THR A 91 -0.138 25.726 3.996 1.00 0.00 H new ATOM 0 HA THR A 91 -2.626 26.087 2.915 1.00 0.00 H new ATOM 0 HB THR A 91 -2.032 26.708 5.205 1.00 0.00 H new ATOM 0 HG1 THR A 91 -3.121 28.783 5.234 1.00 0.00 H new ATOM 0 HG21 THR A 91 -0.772 28.776 5.682 1.00 0.00 H new ATOM 0 HG22 THR A 91 0.216 27.595 4.790 1.00 0.00 H new ATOM 0 HG23 THR A 91 -0.480 28.994 3.940 1.00 0.00 H new ATOM 1339 N ASP A 92 -0.421 28.193 1.692 1.00 0.00 N ATOM 1340 CA ASP A 92 -0.183 29.175 0.640 1.00 0.00 C ATOM 1341 C ASP A 92 -0.372 28.550 -0.739 1.00 0.00 C ATOM 1342 O ASP A 92 -0.931 29.173 -1.642 1.00 0.00 O ATOM 1343 CB ASP A 92 1.227 29.754 0.762 1.00 0.00 C ATOM 1344 CG ASP A 92 1.245 31.087 1.485 1.00 0.00 C ATOM 1345 OD1 ASP A 92 0.408 31.952 1.154 1.00 0.00 O ATOM 1346 OD2 ASP A 92 2.097 31.265 2.381 1.00 0.00 O ATOM 0 H ASP A 92 0.418 27.902 2.194 1.00 0.00 H new ATOM 0 HA ASP A 92 -0.909 29.980 0.757 1.00 0.00 H new ATOM 0 HB2 ASP A 92 1.862 29.046 1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 92 1.653 29.878 -0.234 1.00 0.00 H new ATOM 1351 N ILE A 93 0.099 27.317 -0.894 1.00 0.00 N ATOM 1352 CA ILE A 93 -0.019 26.609 -2.162 1.00 0.00 C ATOM 1353 C ILE A 93 -1.454 26.157 -2.409 1.00 0.00 C ATOM 1354 O ILE A 93 -1.881 26.011 -3.554 1.00 0.00 O ATOM 1355 CB ILE A 93 0.910 25.381 -2.209 1.00 0.00 C ATOM 1356 CG1 ILE A 93 2.374 25.818 -2.148 1.00 0.00 C ATOM 1357 CG2 ILE A 93 0.646 24.565 -3.466 1.00 0.00 C ATOM 1358 CD1 ILE A 93 2.871 26.073 -0.742 1.00 0.00 C ATOM 0 H ILE A 93 0.566 26.788 -0.157 1.00 0.00 H new ATOM 0 HA ILE A 93 0.277 27.309 -2.943 1.00 0.00 H new ATOM 0 HB ILE A 93 0.702 24.754 -1.342 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.994 25.049 -2.610 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.499 26.725 -2.739 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.310 23.701 -3.485 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.390 24.227 -3.469 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.829 25.182 -4.346 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.917 26.379 -0.776 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.276 26.863 -0.283 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.779 25.161 -0.152 1.00 0.00 H new ATOM 1370 N ALA A 94 -2.194 25.939 -1.327 1.00 0.00 N ATOM 1371 CA ALA A 94 -3.583 25.508 -1.425 1.00 0.00 C ATOM 1372 C ALA A 94 -4.475 26.640 -1.922 1.00 0.00 C ATOM 1373 O ALA A 94 -5.293 26.448 -2.822 1.00 0.00 O ATOM 1374 CB ALA A 94 -4.074 24.998 -0.079 1.00 0.00 C ATOM 0 H ALA A 94 -1.855 26.054 -0.372 1.00 0.00 H new ATOM 0 HA ALA A 94 -3.635 24.695 -2.149 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.113 24.680 -0.167 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.461 24.153 0.236 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.001 25.795 0.661 1.00 0.00 H new ATOM 1380 N GLU A 95 -4.312 27.819 -1.331 1.00 0.00 N ATOM 1381 CA GLU A 95 -5.105 28.981 -1.714 1.00 0.00 C ATOM 1382 C GLU A 95 -4.560 29.615 -2.990 1.00 0.00 C ATOM 1383 O GLU A 95 -5.286 30.294 -3.717 1.00 0.00 O ATOM 1384 CB GLU A 95 -5.118 30.013 -0.584 1.00 0.00 C ATOM 1385 CG GLU A 95 -5.720 29.492 0.710 1.00 0.00 C ATOM 1386 CD GLU A 95 -7.234 29.420 0.662 1.00 0.00 C ATOM 1387 OE1 GLU A 95 -7.871 30.477 0.469 1.00 0.00 O ATOM 1388 OE2 GLU A 95 -7.781 28.309 0.817 1.00 0.00 O ATOM 0 H GLU A 95 -3.638 27.995 -0.586 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.125 28.646 -1.902 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.097 30.343 -0.393 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.680 30.888 -0.909 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.319 28.500 0.919 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -5.417 30.138 1.534 1.00 0.00 H new ATOM 1395 N GLU A 96 -3.277 29.389 -3.255 1.00 0.00 N ATOM 1396 CA GLU A 96 -2.635 29.939 -4.443 1.00 0.00 C ATOM 1397 C GLU A 96 -3.367 29.504 -5.709 1.00 0.00 C ATOM 1398 O GLU A 96 -3.709 30.329 -6.557 1.00 0.00 O ATOM 1399 CB GLU A 96 -1.171 29.497 -4.509 1.00 0.00 C ATOM 1400 CG GLU A 96 -0.191 30.571 -4.069 1.00 0.00 C ATOM 1401 CD GLU A 96 -0.008 31.657 -5.111 1.00 0.00 C ATOM 1402 OE1 GLU A 96 -0.761 31.655 -6.107 1.00 0.00 O ATOM 1403 OE2 GLU A 96 0.887 32.509 -4.930 1.00 0.00 O ATOM 0 H GLU A 96 -2.662 28.829 -2.664 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.677 31.026 -4.377 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -1.038 28.616 -3.881 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.936 29.199 -5.531 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.543 31.020 -3.140 1.00 0.00 H new ATOM 0 HG3 GLU A 96 0.774 30.111 -3.856 1.00 0.00 H new ATOM 1410 N LEU A 97 -3.603 28.202 -5.830 1.00 0.00 N ATOM 1411 CA LEU A 97 -4.295 27.655 -6.992 1.00 0.00 C ATOM 1412 C LEU A 97 -5.706 27.208 -6.626 1.00 0.00 C ATOM 1413 O LEU A 97 -6.495 26.840 -7.495 1.00 0.00 O ATOM 1414 CB LEU A 97 -3.508 26.477 -7.570 1.00 0.00 C ATOM 1415 CG LEU A 97 -2.103 26.795 -8.083 1.00 0.00 C ATOM 1416 CD1 LEU A 97 -1.215 25.563 -8.006 1.00 0.00 C ATOM 1417 CD2 LEU A 97 -2.164 27.323 -9.509 1.00 0.00 C ATOM 0 H LEU A 97 -3.325 27.506 -5.138 1.00 0.00 H new ATOM 0 HA LEU A 97 -4.367 28.441 -7.744 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -3.427 25.708 -6.802 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -4.084 26.049 -8.390 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.671 27.569 -7.448 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.219 25.809 -8.375 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.146 25.228 -6.971 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -1.642 24.768 -8.617 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -1.156 27.544 -9.859 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.616 26.571 -10.156 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -2.765 28.232 -9.535 1.00 0.00 H new ATOM 1429 N GLU A 98 -6.017 27.246 -5.334 1.00 0.00 N ATOM 1430 CA GLU A 98 -7.334 26.846 -4.854 1.00 0.00 C ATOM 1431 C GLU A 98 -7.644 25.406 -5.252 1.00 0.00 C ATOM 1432 O GLU A 98 -8.536 25.152 -6.062 1.00 0.00 O ATOM 1433 CB GLU A 98 -8.410 27.783 -5.409 1.00 0.00 C ATOM 1434 CG GLU A 98 -8.391 29.168 -4.785 1.00 0.00 C ATOM 1435 CD GLU A 98 -9.784 29.713 -4.534 1.00 0.00 C ATOM 1436 OE1 GLU A 98 -10.468 30.066 -5.517 1.00 0.00 O ATOM 1437 OE2 GLU A 98 -10.189 29.788 -3.355 1.00 0.00 O ATOM 0 H GLU A 98 -5.375 27.550 -4.602 1.00 0.00 H new ATOM 0 HA GLU A 98 -7.331 26.911 -3.766 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -8.277 27.877 -6.487 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -9.390 27.334 -5.247 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -7.844 29.131 -3.843 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -7.850 29.851 -5.441 1.00 0.00 H new ATOM 1444 N LEU A 99 -6.902 24.467 -4.676 1.00 0.00 N ATOM 1445 CA LEU A 99 -7.096 23.051 -4.969 1.00 0.00 C ATOM 1446 C LEU A 99 -8.447 22.568 -4.453 1.00 0.00 C ATOM 1447 O LEU A 99 -8.942 23.019 -3.420 1.00 0.00 O ATOM 1448 CB LEU A 99 -5.972 22.222 -4.345 1.00 0.00 C ATOM 1449 CG LEU A 99 -4.703 22.071 -5.184 1.00 0.00 C ATOM 1450 CD1 LEU A 99 -4.985 21.253 -6.435 1.00 0.00 C ATOM 1451 CD2 LEU A 99 -4.141 23.436 -5.552 1.00 0.00 C ATOM 0 H LEU A 99 -6.160 24.660 -4.003 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.075 22.923 -6.051 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.701 22.674 -3.391 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.360 21.227 -4.127 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.958 21.543 -4.589 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.070 21.156 -7.020 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.340 20.263 -6.150 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.747 21.753 -7.033 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.238 23.309 -6.149 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.882 23.991 -6.128 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.900 23.987 -4.643 1.00 0.00 H new ATOM 1463 N PRO A 100 -9.059 21.627 -5.187 1.00 0.00 N ATOM 1464 CA PRO A 100 -10.360 21.060 -4.821 1.00 0.00 C ATOM 1465 C PRO A 100 -10.280 20.178 -3.579 1.00 0.00 C ATOM 1466 O PRO A 100 -9.222 19.657 -3.226 1.00 0.00 O ATOM 1467 CB PRO A 100 -10.740 20.224 -6.046 1.00 0.00 C ATOM 1468 CG PRO A 100 -9.440 19.876 -6.685 1.00 0.00 C ATOM 1469 CD PRO A 100 -8.528 21.043 -6.430 1.00 0.00 C ATOM 0 HA PRO A 100 -11.086 21.834 -4.574 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -11.292 19.329 -5.759 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -11.378 20.787 -6.727 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -9.029 18.960 -6.261 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -9.564 19.704 -7.754 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -7.492 20.725 -6.314 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -8.552 21.758 -7.252 1.00 0.00 H new ATOM 1477 N PRO A 101 -11.424 20.006 -2.900 1.00 0.00 N ATOM 1478 CA PRO A 101 -11.509 19.187 -1.688 1.00 0.00 C ATOM 1479 C PRO A 101 -11.344 17.699 -1.980 1.00 0.00 C ATOM 1480 O PRO A 101 -11.233 16.885 -1.064 1.00 0.00 O ATOM 1481 CB PRO A 101 -12.918 19.475 -1.162 1.00 0.00 C ATOM 1482 CG PRO A 101 -13.695 19.883 -2.366 1.00 0.00 C ATOM 1483 CD PRO A 101 -12.723 20.597 -3.264 1.00 0.00 C ATOM 0 HA PRO A 101 -10.717 19.427 -0.979 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -13.352 18.594 -0.690 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -12.907 20.265 -0.411 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -14.123 19.015 -2.867 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -14.525 20.535 -2.093 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -12.956 20.437 -4.317 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -12.736 21.674 -3.095 1.00 0.00 H new ATOM 1491 N VAL A 102 -11.328 17.351 -3.263 1.00 0.00 N ATOM 1492 CA VAL A 102 -11.175 15.962 -3.677 1.00 0.00 C ATOM 1493 C VAL A 102 -9.865 15.376 -3.162 1.00 0.00 C ATOM 1494 O VAL A 102 -9.801 14.207 -2.781 1.00 0.00 O ATOM 1495 CB VAL A 102 -11.219 15.824 -5.210 1.00 0.00 C ATOM 1496 CG1 VAL A 102 -12.583 16.234 -5.744 1.00 0.00 C ATOM 1497 CG2 VAL A 102 -10.115 16.652 -5.851 1.00 0.00 C ATOM 0 H VAL A 102 -11.419 18.013 -4.034 1.00 0.00 H new ATOM 0 HA VAL A 102 -12.011 15.410 -3.247 1.00 0.00 H new ATOM 0 HB VAL A 102 -11.054 14.778 -5.468 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -12.595 16.130 -6.829 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -13.351 15.594 -5.309 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -12.781 17.272 -5.477 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -10.161 16.543 -6.935 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -10.247 17.701 -5.586 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -9.146 16.306 -5.492 1.00 0.00 H new ATOM 1507 N LYS A 103 -8.820 16.197 -3.153 1.00 0.00 N ATOM 1508 CA LYS A 103 -7.509 15.763 -2.684 1.00 0.00 C ATOM 1509 C LYS A 103 -6.648 16.959 -2.292 1.00 0.00 C ATOM 1510 O LYS A 103 -5.620 17.226 -2.915 1.00 0.00 O ATOM 1511 CB LYS A 103 -6.802 14.945 -3.766 1.00 0.00 C ATOM 1512 CG LYS A 103 -5.790 13.954 -3.217 1.00 0.00 C ATOM 1513 CD LYS A 103 -6.303 12.527 -3.304 1.00 0.00 C ATOM 1514 CE LYS A 103 -5.164 11.521 -3.235 1.00 0.00 C ATOM 1515 NZ LYS A 103 -5.602 10.158 -3.648 1.00 0.00 N ATOM 0 H LYS A 103 -8.856 17.167 -3.465 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.655 15.138 -1.803 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -7.549 14.404 -4.347 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.297 15.625 -4.452 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -4.856 14.040 -3.773 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.566 14.199 -2.179 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -7.004 12.341 -2.491 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -6.853 12.393 -4.236 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -4.348 11.851 -3.879 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -4.773 11.484 -2.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -5.846 9.601 -2.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -6.435 10.233 -4.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.831 9.687 -4.163 1.00 0.00 H new ATOM 1529 N ILE A 104 -7.074 17.675 -1.256 1.00 0.00 N ATOM 1530 CA ILE A 104 -6.339 18.841 -0.781 1.00 0.00 C ATOM 1531 C ILE A 104 -4.872 18.504 -0.536 1.00 0.00 C ATOM 1532 O ILE A 104 -4.004 19.375 -0.606 1.00 0.00 O ATOM 1533 CB ILE A 104 -6.950 19.400 0.518 1.00 0.00 C ATOM 1534 CG1 ILE A 104 -8.407 19.809 0.287 1.00 0.00 C ATOM 1535 CG2 ILE A 104 -6.136 20.583 1.020 1.00 0.00 C ATOM 1536 CD1 ILE A 104 -8.564 20.967 -0.673 1.00 0.00 C ATOM 0 H ILE A 104 -7.923 17.468 -0.730 1.00 0.00 H new ATOM 0 HA ILE A 104 -6.409 19.598 -1.562 1.00 0.00 H new ATOM 0 HB ILE A 104 -6.927 18.619 1.278 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.960 18.952 -0.097 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -8.857 20.077 1.243 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.580 20.967 1.938 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -5.113 20.263 1.218 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -6.131 21.368 0.264 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -9.622 21.202 -0.789 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -8.039 21.838 -0.281 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -8.144 20.696 -1.642 1.00 0.00 H new ATOM 1548 N HIS A 105 -4.602 17.235 -0.249 1.00 0.00 N ATOM 1549 CA HIS A 105 -3.239 16.782 0.005 1.00 0.00 C ATOM 1550 C HIS A 105 -2.331 17.103 -1.178 1.00 0.00 C ATOM 1551 O HIS A 105 -1.110 17.170 -1.035 1.00 0.00 O ATOM 1552 CB HIS A 105 -3.222 15.278 0.282 1.00 0.00 C ATOM 1553 CG HIS A 105 -2.317 14.887 1.409 1.00 0.00 C ATOM 1554 ND1 HIS A 105 -2.238 15.593 2.591 1.00 0.00 N ATOM 1555 CD2 HIS A 105 -1.450 13.855 1.531 1.00 0.00 C ATOM 1556 CE1 HIS A 105 -1.361 15.013 3.390 1.00 0.00 C ATOM 1557 NE2 HIS A 105 -0.869 13.956 2.771 1.00 0.00 N ATOM 0 H HIS A 105 -5.309 16.502 -0.186 1.00 0.00 H new ATOM 0 HA HIS A 105 -2.865 17.310 0.882 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -4.235 14.947 0.509 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.911 14.754 -0.622 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -1.252 13.094 0.791 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -1.092 15.347 4.381 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -0.171 13.318 3.152 1.00 0.00 H new ATOM 1565 N CYS A 106 -2.935 17.300 -2.345 1.00 0.00 N ATOM 1566 CA CYS A 106 -2.180 17.613 -3.553 1.00 0.00 C ATOM 1567 C CYS A 106 -1.375 18.896 -3.375 1.00 0.00 C ATOM 1568 O CYS A 106 -0.388 19.124 -4.075 1.00 0.00 O ATOM 1569 CB CYS A 106 -3.125 17.752 -4.748 1.00 0.00 C ATOM 1570 SG CYS A 106 -3.476 16.195 -5.597 1.00 0.00 S ATOM 0 H CYS A 106 -3.945 17.249 -2.480 1.00 0.00 H new ATOM 0 HA CYS A 106 -1.486 16.793 -3.740 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -4.064 18.187 -4.406 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -2.691 18.452 -5.461 1.00 0.00 H new ATOM 0 HG CYS A 106 -4.285 16.415 -6.591 1.00 0.00 H new ATOM 1576 N SER A 107 -1.803 19.731 -2.434 1.00 0.00 N ATOM 1577 CA SER A 107 -1.125 20.994 -2.166 1.00 0.00 C ATOM 1578 C SER A 107 -0.042 20.815 -1.107 1.00 0.00 C ATOM 1579 O SER A 107 0.961 21.530 -1.102 1.00 0.00 O ATOM 1580 CB SER A 107 -2.132 22.051 -1.709 1.00 0.00 C ATOM 1581 OG SER A 107 -3.427 21.774 -2.214 1.00 0.00 O ATOM 0 H SER A 107 -2.616 19.556 -1.844 1.00 0.00 H new ATOM 0 HA SER A 107 -0.653 21.328 -3.090 1.00 0.00 H new ATOM 0 HB2 SER A 107 -2.162 22.082 -0.620 1.00 0.00 H new ATOM 0 HB3 SER A 107 -1.809 23.036 -2.047 1.00 0.00 H new ATOM 0 HG SER A 107 -3.849 21.078 -1.668 1.00 0.00 H new ATOM 1587 N ILE A 108 -0.252 19.857 -0.211 1.00 0.00 N ATOM 1588 CA ILE A 108 0.706 19.583 0.853 1.00 0.00 C ATOM 1589 C ILE A 108 2.014 19.039 0.288 1.00 0.00 C ATOM 1590 O ILE A 108 3.097 19.517 0.630 1.00 0.00 O ATOM 1591 CB ILE A 108 0.142 18.576 1.873 1.00 0.00 C ATOM 1592 CG1 ILE A 108 -1.275 18.977 2.288 1.00 0.00 C ATOM 1593 CG2 ILE A 108 1.051 18.490 3.090 1.00 0.00 C ATOM 1594 CD1 ILE A 108 -1.363 20.370 2.871 1.00 0.00 C ATOM 0 H ILE A 108 -1.077 19.257 -0.201 1.00 0.00 H new ATOM 0 HA ILE A 108 0.897 20.530 1.358 1.00 0.00 H new ATOM 0 HB ILE A 108 0.099 17.593 1.405 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.931 18.913 1.420 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.646 18.261 3.021 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.639 17.775 3.802 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.044 18.163 2.780 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.122 19.470 3.561 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -2.396 20.586 3.143 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.734 20.433 3.759 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -1.023 21.096 2.132 1.00 0.00 H new ATOM 1606 N LEU A 109 1.907 18.039 -0.579 1.00 0.00 N ATOM 1607 CA LEU A 109 3.081 17.430 -1.194 1.00 0.00 C ATOM 1608 C LEU A 109 3.841 18.446 -2.040 1.00 0.00 C ATOM 1609 O LEU A 109 5.027 18.273 -2.319 1.00 0.00 O ATOM 1610 CB LEU A 109 2.668 16.237 -2.057 1.00 0.00 C ATOM 1611 CG LEU A 109 2.359 14.941 -1.308 1.00 0.00 C ATOM 1612 CD1 LEU A 109 0.890 14.885 -0.921 1.00 0.00 C ATOM 1613 CD2 LEU A 109 2.736 13.733 -2.153 1.00 0.00 C ATOM 0 H LEU A 109 1.019 17.632 -0.872 1.00 0.00 H new ATOM 0 HA LEU A 109 3.739 17.083 -0.398 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.787 16.519 -2.633 1.00 0.00 H new ATOM 0 HB3 LEU A 109 3.466 16.038 -2.772 1.00 0.00 H new ATOM 0 HG LEU A 109 2.955 14.921 -0.396 1.00 0.00 H new ATOM 0 HD11 LEU A 109 0.689 13.955 -0.389 1.00 0.00 H new ATOM 0 HD12 LEU A 109 0.651 15.731 -0.277 1.00 0.00 H new ATOM 0 HD13 LEU A 109 0.275 14.929 -1.820 1.00 0.00 H new ATOM 0 HD21 LEU A 109 2.509 12.819 -1.603 1.00 0.00 H new ATOM 0 HD22 LEU A 109 2.168 13.748 -3.083 1.00 0.00 H new ATOM 0 HD23 LEU A 109 3.802 13.765 -2.379 1.00 0.00 H new ATOM 1625 N ALA A 110 3.150 19.507 -2.444 1.00 0.00 N ATOM 1626 CA ALA A 110 3.761 20.553 -3.255 1.00 0.00 C ATOM 1627 C ALA A 110 4.863 21.272 -2.484 1.00 0.00 C ATOM 1628 O ALA A 110 5.956 21.490 -3.005 1.00 0.00 O ATOM 1629 CB ALA A 110 2.705 21.546 -3.718 1.00 0.00 C ATOM 0 H ALA A 110 2.167 19.665 -2.223 1.00 0.00 H new ATOM 0 HA ALA A 110 4.212 20.084 -4.130 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.175 22.322 -4.323 1.00 0.00 H new ATOM 0 HB2 ALA A 110 1.954 21.027 -4.314 1.00 0.00 H new ATOM 0 HB3 ALA A 110 2.228 22.002 -2.850 1.00 0.00 H new ATOM 1635 N GLU A 111 4.567 21.638 -1.241 1.00 0.00 N ATOM 1636 CA GLU A 111 5.533 22.334 -0.399 1.00 0.00 C ATOM 1637 C GLU A 111 6.484 21.346 0.270 1.00 0.00 C ATOM 1638 O GLU A 111 7.591 21.706 0.670 1.00 0.00 O ATOM 1639 CB GLU A 111 4.812 23.165 0.664 1.00 0.00 C ATOM 1640 CG GLU A 111 3.945 22.338 1.598 1.00 0.00 C ATOM 1641 CD GLU A 111 4.104 22.739 3.051 1.00 0.00 C ATOM 1642 OE1 GLU A 111 4.554 23.876 3.308 1.00 0.00 O ATOM 1643 OE2 GLU A 111 3.779 21.916 3.933 1.00 0.00 O ATOM 0 H GLU A 111 3.666 21.464 -0.795 1.00 0.00 H new ATOM 0 HA GLU A 111 6.117 22.999 -1.035 1.00 0.00 H new ATOM 0 HB2 GLU A 111 5.552 23.707 1.253 1.00 0.00 H new ATOM 0 HB3 GLU A 111 4.190 23.911 0.170 1.00 0.00 H new ATOM 0 HG2 GLU A 111 2.900 22.446 1.308 1.00 0.00 H new ATOM 0 HG3 GLU A 111 4.200 21.284 1.486 1.00 0.00 H new ATOM 1650 N ASP A 112 6.043 20.098 0.388 1.00 0.00 N ATOM 1651 CA ASP A 112 6.854 19.056 1.008 1.00 0.00 C ATOM 1652 C ASP A 112 7.910 18.540 0.036 1.00 0.00 C ATOM 1653 O ASP A 112 8.961 18.051 0.449 1.00 0.00 O ATOM 1654 CB ASP A 112 5.967 17.902 1.478 1.00 0.00 C ATOM 1655 CG ASP A 112 5.001 18.321 2.568 1.00 0.00 C ATOM 1656 OD1 ASP A 112 4.905 19.536 2.840 1.00 0.00 O ATOM 1657 OD2 ASP A 112 4.342 17.434 3.151 1.00 0.00 O ATOM 0 H ASP A 112 5.129 19.783 0.063 1.00 0.00 H new ATOM 0 HA ASP A 112 7.361 19.488 1.871 1.00 0.00 H new ATOM 0 HB2 ASP A 112 5.405 17.511 0.630 1.00 0.00 H new ATOM 0 HB3 ASP A 112 6.596 17.091 1.846 1.00 0.00 H new ATOM 1662 N ALA A 113 7.622 18.650 -1.257 1.00 0.00 N ATOM 1663 CA ALA A 113 8.547 18.195 -2.287 1.00 0.00 C ATOM 1664 C ALA A 113 9.708 19.170 -2.452 1.00 0.00 C ATOM 1665 O ALA A 113 10.865 18.760 -2.560 1.00 0.00 O ATOM 1666 CB ALA A 113 7.817 18.012 -3.609 1.00 0.00 C ATOM 0 H ALA A 113 6.755 19.050 -1.616 1.00 0.00 H new ATOM 0 HA ALA A 113 8.956 17.234 -1.974 1.00 0.00 H new ATOM 0 HB1 ALA A 113 8.520 17.672 -4.369 1.00 0.00 H new ATOM 0 HB2 ALA A 113 7.027 17.271 -3.489 1.00 0.00 H new ATOM 0 HB3 ALA A 113 7.380 18.962 -3.918 1.00 0.00 H new ATOM 1672 N ILE A 114 9.393 20.460 -2.471 1.00 0.00 N ATOM 1673 CA ILE A 114 10.410 21.493 -2.622 1.00 0.00 C ATOM 1674 C ILE A 114 11.382 21.483 -1.447 1.00 0.00 C ATOM 1675 O ILE A 114 12.582 21.699 -1.618 1.00 0.00 O ATOM 1676 CB ILE A 114 9.779 22.893 -2.740 1.00 0.00 C ATOM 1677 CG1 ILE A 114 8.896 23.182 -1.524 1.00 0.00 C ATOM 1678 CG2 ILE A 114 8.972 23.003 -4.025 1.00 0.00 C ATOM 1679 CD1 ILE A 114 8.171 24.507 -1.606 1.00 0.00 C ATOM 0 H ILE A 114 8.441 20.815 -2.384 1.00 0.00 H new ATOM 0 HA ILE A 114 10.952 21.270 -3.541 1.00 0.00 H new ATOM 0 HB ILE A 114 10.577 23.634 -2.770 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.163 22.382 -1.419 1.00 0.00 H new ATOM 0 HG13 ILE A 114 9.513 23.170 -0.626 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.532 23.998 -4.094 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.626 22.835 -4.881 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.179 22.255 -4.022 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.564 24.646 -0.711 1.00 0.00 H new ATOM 0 HD12 ILE A 114 8.898 25.316 -1.680 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.527 24.516 -2.486 1.00 0.00 H new ATOM 1691 N LYS A 115 10.856 21.230 -0.254 1.00 0.00 N ATOM 1692 CA LYS A 115 11.677 21.189 0.951 1.00 0.00 C ATOM 1693 C LYS A 115 12.650 20.015 0.906 1.00 0.00 C ATOM 1694 O LYS A 115 13.817 20.150 1.274 1.00 0.00 O ATOM 1695 CB LYS A 115 10.789 21.082 2.193 1.00 0.00 C ATOM 1696 CG LYS A 115 11.557 21.184 3.500 1.00 0.00 C ATOM 1697 CD LYS A 115 12.065 19.827 3.956 1.00 0.00 C ATOM 1698 CE LYS A 115 13.522 19.892 4.385 1.00 0.00 C ATOM 1699 NZ LYS A 115 13.850 18.850 5.398 1.00 0.00 N ATOM 0 H LYS A 115 9.865 21.050 -0.095 1.00 0.00 H new ATOM 0 HA LYS A 115 12.252 22.113 1.001 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.037 21.870 2.161 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.256 20.132 2.168 1.00 0.00 H new ATOM 0 HG2 LYS A 115 12.399 21.866 3.376 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.913 21.610 4.269 1.00 0.00 H new ATOM 0 HD2 LYS A 115 11.456 19.470 4.786 1.00 0.00 H new ATOM 0 HD3 LYS A 115 11.955 19.105 3.146 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.163 19.765 3.513 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.736 20.878 4.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.767 19.069 5.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 13.111 18.832 6.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.901 17.920 4.935 1.00 0.00 H new ATOM 1713 N ALA A 116 12.163 18.865 0.452 1.00 0.00 N ATOM 1714 CA ALA A 116 12.991 17.669 0.356 1.00 0.00 C ATOM 1715 C ALA A 116 14.262 17.945 -0.440 1.00 0.00 C ATOM 1716 O ALA A 116 15.286 17.293 -0.237 1.00 0.00 O ATOM 1717 CB ALA A 116 12.205 16.532 -0.278 1.00 0.00 C ATOM 0 H ALA A 116 11.199 18.736 0.145 1.00 0.00 H new ATOM 0 HA ALA A 116 13.281 17.376 1.365 1.00 0.00 H new ATOM 0 HB1 ALA A 116 12.836 15.646 -0.343 1.00 0.00 H new ATOM 0 HB2 ALA A 116 11.330 16.310 0.332 1.00 0.00 H new ATOM 0 HB3 ALA A 116 11.885 16.824 -1.278 1.00 0.00 H new ATOM 1723 N ALA A 117 14.189 18.914 -1.346 1.00 0.00 N ATOM 1724 CA ALA A 117 15.334 19.275 -2.172 1.00 0.00 C ATOM 1725 C ALA A 117 16.316 20.148 -1.397 1.00 0.00 C ATOM 1726 O ALA A 117 17.531 19.996 -1.527 1.00 0.00 O ATOM 1727 CB ALA A 117 14.871 19.990 -3.433 1.00 0.00 C ATOM 0 H ALA A 117 13.349 19.463 -1.527 1.00 0.00 H new ATOM 0 HA ALA A 117 15.849 18.358 -2.456 1.00 0.00 H new ATOM 0 HB1 ALA A 117 15.737 20.254 -4.040 1.00 0.00 H new ATOM 0 HB2 ALA A 117 14.214 19.333 -4.003 1.00 0.00 H new ATOM 0 HB3 ALA A 117 14.330 20.896 -3.160 1.00 0.00 H new ATOM 1733 N ILE A 118 15.782 21.061 -0.594 1.00 0.00 N ATOM 1734 CA ILE A 118 16.611 21.957 0.202 1.00 0.00 C ATOM 1735 C ILE A 118 17.427 21.183 1.231 1.00 0.00 C ATOM 1736 O ILE A 118 18.568 21.536 1.528 1.00 0.00 O ATOM 1737 CB ILE A 118 15.761 23.016 0.928 1.00 0.00 C ATOM 1738 CG1 ILE A 118 14.979 23.856 -0.084 1.00 0.00 C ATOM 1739 CG2 ILE A 118 16.644 23.904 1.791 1.00 0.00 C ATOM 1740 CD1 ILE A 118 14.114 24.921 0.554 1.00 0.00 C ATOM 0 H ILE A 118 14.778 21.200 -0.477 1.00 0.00 H new ATOM 0 HA ILE A 118 17.287 22.459 -0.491 1.00 0.00 H new ATOM 0 HB ILE A 118 15.049 22.506 1.576 1.00 0.00 H new ATOM 0 HG12 ILE A 118 15.681 24.332 -0.769 1.00 0.00 H new ATOM 0 HG13 ILE A 118 14.349 23.197 -0.681 1.00 0.00 H new ATOM 0 HG21 ILE A 118 16.028 24.647 2.297 1.00 0.00 H new ATOM 0 HG22 ILE A 118 17.160 23.294 2.533 1.00 0.00 H new ATOM 0 HG23 ILE A 118 17.378 24.408 1.162 1.00 0.00 H new ATOM 0 HD11 ILE A 118 13.589 25.477 -0.223 1.00 0.00 H new ATOM 0 HD12 ILE A 118 13.388 24.451 1.217 1.00 0.00 H new ATOM 0 HD13 ILE A 118 14.741 25.603 1.128 1.00 0.00 H new ATOM 1752 N ALA A 119 16.834 20.123 1.772 1.00 0.00 N ATOM 1753 CA ALA A 119 17.506 19.296 2.766 1.00 0.00 C ATOM 1754 C ALA A 119 18.535 18.380 2.112 1.00 0.00 C ATOM 1755 O ALA A 119 19.496 17.953 2.752 1.00 0.00 O ATOM 1756 CB ALA A 119 16.489 18.477 3.546 1.00 0.00 C ATOM 0 H ALA A 119 15.889 19.817 1.538 1.00 0.00 H new ATOM 0 HA ALA A 119 18.031 19.956 3.456 1.00 0.00 H new ATOM 0 HB1 ALA A 119 17.005 17.864 4.285 1.00 0.00 H new ATOM 0 HB2 ALA A 119 15.794 19.147 4.052 1.00 0.00 H new ATOM 0 HB3 ALA A 119 15.938 17.832 2.861 1.00 0.00 H new ATOM 1762 N ASP A 120 18.328 18.082 0.834 1.00 0.00 N ATOM 1763 CA ASP A 120 19.239 17.217 0.093 1.00 0.00 C ATOM 1764 C ASP A 120 20.594 17.891 -0.098 1.00 0.00 C ATOM 1765 O ASP A 120 21.635 17.234 -0.070 1.00 0.00 O ATOM 1766 CB ASP A 120 18.639 16.855 -1.267 1.00 0.00 C ATOM 1767 CG ASP A 120 19.551 15.958 -2.081 1.00 0.00 C ATOM 1768 OD1 ASP A 120 19.584 14.741 -1.807 1.00 0.00 O ATOM 1769 OD2 ASP A 120 20.232 16.474 -2.992 1.00 0.00 O ATOM 0 H ASP A 120 17.537 18.427 0.289 1.00 0.00 H new ATOM 0 HA ASP A 120 19.386 16.305 0.671 1.00 0.00 H new ATOM 0 HB2 ASP A 120 17.682 16.356 -1.117 1.00 0.00 H new ATOM 0 HB3 ASP A 120 18.438 17.768 -1.827 1.00 0.00 H new ATOM 1774 N TYR A 121 20.573 19.205 -0.292 1.00 0.00 N ATOM 1775 CA TYR A 121 21.800 19.967 -0.491 1.00 0.00 C ATOM 1776 C TYR A 121 22.574 20.105 0.816 1.00 0.00 C ATOM 1777 O TYR A 121 23.796 19.952 0.847 1.00 0.00 O ATOM 1778 CB TYR A 121 21.478 21.353 -1.054 1.00 0.00 C ATOM 1779 CG TYR A 121 22.671 22.282 -1.094 1.00 0.00 C ATOM 1780 CD1 TYR A 121 23.916 21.829 -1.511 1.00 0.00 C ATOM 1781 CD2 TYR A 121 22.551 23.614 -0.716 1.00 0.00 C ATOM 1782 CE1 TYR A 121 25.008 22.674 -1.548 1.00 0.00 C ATOM 1783 CE2 TYR A 121 23.637 24.466 -0.751 1.00 0.00 C ATOM 1784 CZ TYR A 121 24.863 23.992 -1.167 1.00 0.00 C ATOM 1785 OH TYR A 121 25.948 24.838 -1.204 1.00 0.00 O ATOM 0 H TYR A 121 19.720 19.764 -0.316 1.00 0.00 H new ATOM 0 HA TYR A 121 22.422 19.426 -1.205 1.00 0.00 H new ATOM 0 HB2 TYR A 121 21.080 21.243 -2.063 1.00 0.00 H new ATOM 0 HB3 TYR A 121 20.693 21.808 -0.450 1.00 0.00 H new ATOM 0 HD1 TYR A 121 24.032 20.798 -1.812 1.00 0.00 H new ATOM 0 HD2 TYR A 121 21.592 23.989 -0.389 1.00 0.00 H new ATOM 0 HE1 TYR A 121 25.970 22.305 -1.873 1.00 0.00 H new ATOM 0 HE2 TYR A 121 23.527 25.498 -0.454 1.00 0.00 H new ATOM 0 HH TYR A 121 25.677 25.731 -0.906 1.00 0.00 H new ATOM 1795 N LYS A 122 21.854 20.393 1.895 1.00 0.00 N ATOM 1796 CA LYS A 122 22.470 20.550 3.207 1.00 0.00 C ATOM 1797 C LYS A 122 22.922 19.202 3.760 1.00 0.00 C ATOM 1798 O LYS A 122 23.953 19.107 4.425 1.00 0.00 O ATOM 1799 CB LYS A 122 21.489 21.209 4.179 1.00 0.00 C ATOM 1800 CG LYS A 122 20.900 22.509 3.659 1.00 0.00 C ATOM 1801 CD LYS A 122 20.903 23.590 4.727 1.00 0.00 C ATOM 1802 CE LYS A 122 19.738 23.425 5.690 1.00 0.00 C ATOM 1803 NZ LYS A 122 20.200 23.179 7.084 1.00 0.00 N ATOM 0 H LYS A 122 20.842 20.523 1.886 1.00 0.00 H new ATOM 0 HA LYS A 122 23.345 21.190 3.095 1.00 0.00 H new ATOM 0 HB2 LYS A 122 20.678 20.512 4.393 1.00 0.00 H new ATOM 0 HB3 LYS A 122 22.000 21.403 5.122 1.00 0.00 H new ATOM 0 HG2 LYS A 122 21.472 22.848 2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 122 19.879 22.336 3.318 1.00 0.00 H new ATOM 0 HD2 LYS A 122 21.842 23.554 5.280 1.00 0.00 H new ATOM 0 HD3 LYS A 122 20.849 24.571 4.254 1.00 0.00 H new ATOM 0 HE2 LYS A 122 19.118 24.321 5.666 1.00 0.00 H new ATOM 0 HE3 LYS A 122 19.112 22.595 5.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 19.376 23.072 7.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 20.771 22.310 7.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 20.776 23.983 7.406 1.00 0.00 H new ATOM 1817 N SER A 123 22.143 18.162 3.480 1.00 0.00 N ATOM 1818 CA SER A 123 22.462 16.819 3.952 1.00 0.00 C ATOM 1819 C SER A 123 23.654 16.245 3.192 1.00 0.00 C ATOM 1820 O SER A 123 24.485 15.536 3.760 1.00 0.00 O ATOM 1821 CB SER A 123 21.250 15.899 3.794 1.00 0.00 C ATOM 1822 OG SER A 123 20.281 16.155 4.795 1.00 0.00 O ATOM 0 H SER A 123 21.287 18.223 2.929 1.00 0.00 H new ATOM 0 HA SER A 123 22.724 16.884 5.008 1.00 0.00 H new ATOM 0 HB2 SER A 123 20.806 16.043 2.809 1.00 0.00 H new ATOM 0 HB3 SER A 123 21.570 14.858 3.851 1.00 0.00 H new ATOM 0 HG SER A 123 19.655 16.838 4.477 1.00 0.00 H new ATOM 1828 N LYS A 124 23.731 16.556 1.903 1.00 0.00 N ATOM 1829 CA LYS A 124 24.820 16.074 1.062 1.00 0.00 C ATOM 1830 C LYS A 124 26.174 16.444 1.660 1.00 0.00 C ATOM 1831 O LYS A 124 27.173 15.765 1.426 1.00 0.00 O ATOM 1832 CB LYS A 124 24.698 16.653 -0.349 1.00 0.00 C ATOM 1833 CG LYS A 124 26.025 16.758 -1.080 1.00 0.00 C ATOM 1834 CD LYS A 124 26.732 18.066 -0.768 1.00 0.00 C ATOM 1835 CE LYS A 124 28.164 17.831 -0.312 1.00 0.00 C ATOM 1836 NZ LYS A 124 29.151 18.440 -1.246 1.00 0.00 N ATOM 0 H LYS A 124 23.051 17.141 1.417 1.00 0.00 H new ATOM 0 HA LYS A 124 24.751 14.988 1.009 1.00 0.00 H new ATOM 0 HB2 LYS A 124 24.020 16.029 -0.931 1.00 0.00 H new ATOM 0 HB3 LYS A 124 24.247 17.643 -0.289 1.00 0.00 H new ATOM 0 HG2 LYS A 124 26.664 15.922 -0.797 1.00 0.00 H new ATOM 0 HG3 LYS A 124 25.857 16.682 -2.154 1.00 0.00 H new ATOM 0 HD2 LYS A 124 26.731 18.702 -1.653 1.00 0.00 H new ATOM 0 HD3 LYS A 124 26.185 18.600 0.009 1.00 0.00 H new ATOM 0 HE2 LYS A 124 28.301 18.250 0.685 1.00 0.00 H new ATOM 0 HE3 LYS A 124 28.350 16.760 -0.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 30.115 18.258 -0.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 29.038 18.022 -2.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 28.991 19.466 -1.300 1.00 0.00 H new ATOM 1850 N ARG A 125 26.198 17.525 2.433 1.00 0.00 N ATOM 1851 CA ARG A 125 27.429 17.985 3.065 1.00 0.00 C ATOM 1852 C ARG A 125 27.432 17.655 4.554 1.00 0.00 C ATOM 1853 O ARG A 125 28.428 17.868 5.244 1.00 0.00 O ATOM 1854 CB ARG A 125 27.597 19.493 2.865 1.00 0.00 C ATOM 1855 CG ARG A 125 26.528 20.322 3.558 1.00 0.00 C ATOM 1856 CD ARG A 125 27.084 21.650 4.047 1.00 0.00 C ATOM 1857 NE ARG A 125 27.071 22.668 3.000 1.00 0.00 N ATOM 1858 CZ ARG A 125 27.532 23.902 3.169 1.00 0.00 C ATOM 1859 NH1 ARG A 125 28.040 24.269 4.337 1.00 0.00 N ATOM 1860 NH2 ARG A 125 27.485 24.772 2.168 1.00 0.00 N ATOM 0 H ARG A 125 25.379 18.098 2.637 1.00 0.00 H new ATOM 0 HA ARG A 125 28.265 17.467 2.595 1.00 0.00 H new ATOM 0 HB2 ARG A 125 28.576 19.794 3.238 1.00 0.00 H new ATOM 0 HB3 ARG A 125 27.581 19.713 1.798 1.00 0.00 H new ATOM 0 HG2 ARG A 125 25.703 20.503 2.869 1.00 0.00 H new ATOM 0 HG3 ARG A 125 26.122 19.763 4.401 1.00 0.00 H new ATOM 0 HD2 ARG A 125 26.497 21.997 4.898 1.00 0.00 H new ATOM 0 HD3 ARG A 125 28.105 21.507 4.401 1.00 0.00 H new ATOM 0 HE ARG A 125 26.687 22.418 2.089 1.00 0.00 H new ATOM 0 HH11 ARG A 125 28.078 23.603 5.109 1.00 0.00 H new ATOM 0 HH12 ARG A 125 28.393 25.217 4.464 1.00 0.00 H new ATOM 0 HH21 ARG A 125 27.095 24.493 1.268 1.00 0.00 H new ATOM 0 HH22 ARG A 125 27.839 25.720 2.299 1.00 0.00 H new ATOM 1874 N GLU A 126 26.311 17.135 5.043 1.00 0.00 N ATOM 1875 CA GLU A 126 26.185 16.777 6.451 1.00 0.00 C ATOM 1876 C GLU A 126 26.876 15.448 6.738 1.00 0.00 C ATOM 1877 O GLU A 126 27.200 15.140 7.885 1.00 0.00 O ATOM 1878 CB GLU A 126 24.710 16.694 6.849 1.00 0.00 C ATOM 1879 CG GLU A 126 24.100 15.317 6.644 1.00 0.00 C ATOM 1880 CD GLU A 126 24.109 14.482 7.910 1.00 0.00 C ATOM 1881 OE1 GLU A 126 24.792 14.879 8.877 1.00 0.00 O ATOM 1882 OE2 GLU A 126 23.433 13.433 7.933 1.00 0.00 O ATOM 0 H GLU A 126 25.477 16.952 4.485 1.00 0.00 H new ATOM 0 HA GLU A 126 26.670 17.554 7.042 1.00 0.00 H new ATOM 0 HB2 GLU A 126 24.609 16.974 7.898 1.00 0.00 H new ATOM 0 HB3 GLU A 126 24.144 17.423 6.268 1.00 0.00 H new ATOM 0 HG2 GLU A 126 23.074 15.427 6.293 1.00 0.00 H new ATOM 0 HG3 GLU A 126 24.650 14.792 5.863 1.00 0.00 H new ATOM 1889 N ALA A 127 27.098 14.664 5.688 1.00 0.00 N ATOM 1890 CA ALA A 127 27.752 13.368 5.827 1.00 0.00 C ATOM 1891 C ALA A 127 28.489 12.986 4.548 1.00 0.00 C ATOM 1892 O ALA A 127 27.870 12.712 3.520 1.00 0.00 O ATOM 1893 CB ALA A 127 26.732 12.299 6.190 1.00 0.00 C ATOM 0 H ALA A 127 26.835 14.903 4.732 1.00 0.00 H new ATOM 0 HA ALA A 127 28.486 13.442 6.630 1.00 0.00 H new ATOM 0 HB1 ALA A 127 27.234 11.337 6.291 1.00 0.00 H new ATOM 0 HB2 ALA A 127 26.253 12.559 7.134 1.00 0.00 H new ATOM 0 HB3 ALA A 127 25.978 12.235 5.406 1.00 0.00 H new ATOM 1899 N LYS A 128 29.816 12.970 4.618 1.00 0.00 N ATOM 1900 CA LYS A 128 30.639 12.621 3.466 1.00 0.00 C ATOM 1901 C LYS A 128 32.080 12.353 3.889 1.00 0.00 C ATOM 1902 O LYS A 128 32.670 11.376 3.430 1.00 0.00 O ATOM 1903 CB LYS A 128 30.602 13.744 2.427 1.00 0.00 C ATOM 1904 CG LYS A 128 31.325 13.402 1.136 1.00 0.00 C ATOM 1905 CD LYS A 128 32.705 14.036 1.086 1.00 0.00 C ATOM 1906 CE LYS A 128 33.159 14.270 -0.347 1.00 0.00 C ATOM 1907 NZ LYS A 128 34.640 14.190 -0.480 1.00 0.00 N ATOM 0 H LYS A 128 30.345 13.195 5.461 1.00 0.00 H new ATOM 0 HA LYS A 128 30.233 11.712 3.023 1.00 0.00 H new ATOM 0 HB2 LYS A 128 29.563 13.983 2.199 1.00 0.00 H new ATOM 0 HB3 LYS A 128 31.049 14.640 2.857 1.00 0.00 H new ATOM 0 HG2 LYS A 128 31.417 12.320 1.045 1.00 0.00 H new ATOM 0 HG3 LYS A 128 30.735 13.744 0.286 1.00 0.00 H new ATOM 0 HD2 LYS A 128 32.691 14.984 1.624 1.00 0.00 H new ATOM 0 HD3 LYS A 128 33.421 13.391 1.595 1.00 0.00 H new ATOM 0 HE2 LYS A 128 32.695 13.531 -1.000 1.00 0.00 H new ATOM 0 HE3 LYS A 128 32.817 15.250 -0.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 34.909 14.355 -1.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 35.082 14.912 0.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 34.965 13.247 -0.186 1.00 0.00 H new TER 1921 LYS A 128