USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1080 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 NoAdj-H: A 46 HIS HD1 : A 46 HIS ND1 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 48 HIS HE2 : A 48 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 63 HIS HD1 : A 63 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 71 HIS HD1 : A 71 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 80 HIS HD1 : A 80 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 120 HIS HE2 : A 120 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD Set 1.1: A 133 GLN :FLIP amide:sc= 0.726 F(o=-1.5,f=2) USER MOD Set 1.2: A 137 THR OG1 : rot -121:sc= 1.27 USER MOD Set 2.1: A 22 GLN : amide:sc= 2.13 K(o=3.3,f=-5.1!) USER MOD Set 2.2: A 105 SER OG : rot 60:sc= 1.21 USER MOD Set 3.1: A 9 LYS NZ :NH3+ -130:sc= 1.19 (180deg=-0.0342) USER MOD Set 3.2: A 15 GLN : amide:sc= 1.07 K(o=2.3,f=-5.8) USER MOD Single : A 1 ALA N :NH3+ -179:sc= 0 (180deg=-0.00367) USER MOD Single : A 2 THR OG1 : rot -128:sc= 1.08 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.362 X(o=-0.36,f=-0.33) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=0.049) USER MOD Single : A 30 LYS NZ :NH3+ -177:sc= 0.661 (180deg=0.1!) USER MOD Single : A 34 SER OG : rot 32:sc= 0.0882 USER MOD Single : A 36 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0134) USER MOD Single : A 39 THR OG1 : rot 27:sc= 1.22 USER MOD Single : A 43 HIS : no HE2:sc= -1.78 K(o=-1.8,f=-5.5!) USER MOD Single : A 53 ASN : amide:sc= 1.58 K(o=1.6,f=-12!) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.00542 USER MOD Single : A 58 THR OG1 : rot 7:sc= 0.823 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0.626 K(o=0.63,f=-2.3!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0816) USER MOD Single : A 86 ASN : amide:sc= -0.824 K(o=-0.82,f=-1.3) USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.107 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 12:sc= 0.761 USER MOD Single : A 110 HIS : no HE2:sc= -0.592 K(o=-0.59,f=-2.5!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -160:sc= -0.508 USER MOD Single : A 122 LYS NZ :NH3+ -160:sc= 1.2 (180deg=0.886) USER MOD Single : A 128 LYS NZ :NH3+ 152:sc= -0.553 (180deg=-1.4) USER MOD Single : A 131 ASN :FLIP amide:sc= -0.705 F(o=-4.5!,f=-0.7) USER MOD Single : A 134 SER OG : rot -124:sc= 0.822 USER MOD Single : A 135 THR OG1 : rot 180:sc= -0.162 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= -0.0624 K(o=-0.062,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 17.592 10.083 9.256 1.00 0.00 N ATOM 2 CA ALA A 1 16.188 10.367 9.600 1.00 0.00 C ATOM 3 C ALA A 1 15.368 9.155 9.178 1.00 0.00 C ATOM 4 O ALA A 1 15.229 8.956 7.986 1.00 0.00 O ATOM 5 CB ALA A 1 15.745 11.596 8.809 1.00 0.00 C ATOM 0 H1 ALA A 1 18.189 10.884 9.545 1.00 0.00 H new ATOM 0 H2 ALA A 1 17.903 9.223 9.750 1.00 0.00 H new ATOM 0 H3 ALA A 1 17.676 9.942 8.229 1.00 0.00 H new ATOM 0 HA ALA A 1 16.059 10.557 10.665 1.00 0.00 H new ATOM 0 HB1 ALA A 1 14.707 11.827 9.047 1.00 0.00 H new ATOM 0 HB2 ALA A 1 16.375 12.445 9.073 1.00 0.00 H new ATOM 0 HB3 ALA A 1 15.836 11.394 7.742 1.00 0.00 H new ATOM 13 N THR A 2 14.969 8.258 10.081 1.00 0.00 N ATOM 14 CA THR A 2 14.641 6.904 9.636 1.00 0.00 C ATOM 15 C THR A 2 13.869 6.146 10.718 1.00 0.00 C ATOM 16 O THR A 2 14.430 5.339 11.448 1.00 0.00 O ATOM 17 CB THR A 2 15.945 6.231 9.154 1.00 0.00 C ATOM 18 OG1 THR A 2 15.701 5.072 8.409 1.00 0.00 O ATOM 19 CG2 THR A 2 17.030 6.019 10.220 1.00 0.00 C ATOM 0 H THR A 2 14.868 8.432 11.081 1.00 0.00 H new ATOM 0 HA THR A 2 13.957 6.910 8.788 1.00 0.00 H new ATOM 0 HB THR A 2 16.383 6.976 8.489 1.00 0.00 H new ATOM 0 HG1 THR A 2 16.221 4.329 8.780 1.00 0.00 H new ATOM 0 HG21 THR A 2 17.897 5.540 9.766 1.00 0.00 H new ATOM 0 HG22 THR A 2 17.324 6.982 10.636 1.00 0.00 H new ATOM 0 HG23 THR A 2 16.640 5.384 11.015 1.00 0.00 H new ATOM 27 N LYS A 3 12.589 6.484 10.884 1.00 0.00 N ATOM 28 CA LYS A 3 11.724 5.919 11.913 1.00 0.00 C ATOM 29 C LYS A 3 10.314 6.473 11.724 1.00 0.00 C ATOM 30 O LYS A 3 9.884 7.367 12.448 1.00 0.00 O ATOM 31 CB LYS A 3 12.256 6.201 13.331 1.00 0.00 C ATOM 32 CG LYS A 3 12.613 7.680 13.555 1.00 0.00 C ATOM 33 CD LYS A 3 14.123 7.880 13.692 1.00 0.00 C ATOM 34 CE LYS A 3 14.645 7.395 15.054 1.00 0.00 C ATOM 35 NZ LYS A 3 16.098 7.611 15.203 1.00 0.00 N ATOM 0 H LYS A 3 12.119 7.171 10.295 1.00 0.00 H new ATOM 0 HA LYS A 3 11.707 4.834 11.807 1.00 0.00 H new ATOM 0 HB2 LYS A 3 11.505 5.899 14.062 1.00 0.00 H new ATOM 0 HB3 LYS A 3 13.140 5.588 13.510 1.00 0.00 H new ATOM 0 HG2 LYS A 3 12.241 8.275 12.721 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.114 8.043 14.454 1.00 0.00 H new ATOM 0 HD2 LYS A 3 14.634 7.341 12.895 1.00 0.00 H new ATOM 0 HD3 LYS A 3 14.362 8.936 13.567 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.118 7.919 15.851 1.00 0.00 H new ATOM 0 HE3 LYS A 3 14.423 6.334 15.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 16.406 7.269 16.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 16.605 7.090 14.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 16.308 8.626 15.119 1.00 0.00 H new ATOM 49 N ALA A 4 9.606 5.958 10.728 1.00 0.00 N ATOM 50 CA ALA A 4 8.199 6.254 10.478 1.00 0.00 C ATOM 51 C ALA A 4 7.397 4.955 10.556 1.00 0.00 C ATOM 52 O ALA A 4 7.951 3.892 10.293 1.00 0.00 O ATOM 53 CB ALA A 4 8.099 6.980 9.137 1.00 0.00 C ATOM 0 H ALA A 4 10.004 5.305 10.053 1.00 0.00 H new ATOM 0 HA ALA A 4 7.770 6.917 11.230 1.00 0.00 H new ATOM 0 HB1 ALA A 4 7.055 7.213 8.926 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.676 7.904 9.180 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.495 6.342 8.347 1.00 0.00 H new ATOM 59 N VAL A 5 6.128 5.032 10.969 1.00 0.00 N ATOM 60 CA VAL A 5 5.217 3.915 11.190 1.00 0.00 C ATOM 61 C VAL A 5 3.868 4.274 10.565 1.00 0.00 C ATOM 62 O VAL A 5 3.493 5.446 10.550 1.00 0.00 O ATOM 63 CB VAL A 5 5.101 3.600 12.699 1.00 0.00 C ATOM 64 CG1 VAL A 5 4.441 4.736 13.494 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.366 2.287 12.996 1.00 0.00 C ATOM 0 H VAL A 5 5.688 5.930 11.168 1.00 0.00 H new ATOM 0 HA VAL A 5 5.595 3.009 10.717 1.00 0.00 H new ATOM 0 HB VAL A 5 6.135 3.492 13.027 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.386 4.459 14.547 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.032 5.645 13.388 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.435 4.911 13.112 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.322 2.130 14.074 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.354 2.338 12.595 1.00 0.00 H new ATOM 0 HG23 VAL A 5 4.899 1.458 12.530 1.00 0.00 H new ATOM 75 N ALA A 6 3.133 3.285 10.053 1.00 0.00 N ATOM 76 CA ALA A 6 1.743 3.472 9.663 1.00 0.00 C ATOM 77 C ALA A 6 0.952 2.283 10.184 1.00 0.00 C ATOM 78 O ALA A 6 0.983 1.207 9.590 1.00 0.00 O ATOM 79 CB ALA A 6 1.622 3.641 8.144 1.00 0.00 C ATOM 0 H ALA A 6 3.485 2.340 9.900 1.00 0.00 H new ATOM 0 HA ALA A 6 1.337 4.386 10.097 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.575 3.779 7.876 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.196 4.512 7.828 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.010 2.752 7.647 1.00 0.00 H new ATOM 85 N VAL A 7 0.274 2.436 11.321 1.00 0.00 N ATOM 86 CA VAL A 7 -0.606 1.393 11.785 1.00 0.00 C ATOM 87 C VAL A 7 -1.841 1.383 10.887 1.00 0.00 C ATOM 88 O VAL A 7 -2.389 2.440 10.591 1.00 0.00 O ATOM 89 CB VAL A 7 -0.933 1.571 13.271 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.348 1.672 14.109 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.848 2.767 13.570 1.00 0.00 C ATOM 0 H VAL A 7 0.323 3.260 11.920 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.124 0.418 11.715 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.489 0.676 13.552 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.086 1.798 15.160 1.00 0.00 H new ATOM 0 HG12 VAL A 7 0.935 0.762 13.988 1.00 0.00 H new ATOM 0 HG13 VAL A 7 0.934 2.529 13.776 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -2.032 2.825 14.643 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.367 3.686 13.234 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.795 2.641 13.045 1.00 0.00 H new ATOM 101 N LEU A 8 -2.239 0.195 10.437 1.00 0.00 N ATOM 102 CA LEU A 8 -3.488 -0.080 9.760 1.00 0.00 C ATOM 103 C LEU A 8 -4.601 -0.132 10.828 1.00 0.00 C ATOM 104 O LEU A 8 -4.667 0.787 11.639 1.00 0.00 O ATOM 105 CB LEU A 8 -3.258 -1.290 8.823 1.00 0.00 C ATOM 106 CG LEU A 8 -2.942 -0.821 7.399 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.688 0.055 7.353 1.00 0.00 C ATOM 108 CD2 LEU A 8 -2.744 -2.056 6.517 1.00 0.00 C ATOM 0 H LEU A 8 -1.663 -0.640 10.544 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.846 0.691 9.077 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.436 -1.898 9.201 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -4.145 -1.923 8.814 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.773 -0.216 7.037 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.499 0.366 6.326 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.836 0.936 7.978 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.834 -0.512 7.723 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.518 -1.743 5.498 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.918 -2.652 6.905 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.655 -2.654 6.519 1.00 0.00 H new ATOM 120 N LYS A 9 -5.431 -1.183 10.876 1.00 0.00 N ATOM 121 CA LYS A 9 -6.602 -1.351 11.735 1.00 0.00 C ATOM 122 C LYS A 9 -7.855 -0.973 10.946 1.00 0.00 C ATOM 123 O LYS A 9 -8.058 0.186 10.599 1.00 0.00 O ATOM 124 CB LYS A 9 -6.491 -0.656 13.100 1.00 0.00 C ATOM 125 CG LYS A 9 -7.516 -1.213 14.097 1.00 0.00 C ATOM 126 CD LYS A 9 -7.266 -0.629 15.496 1.00 0.00 C ATOM 127 CE LYS A 9 -6.144 -1.352 16.259 1.00 0.00 C ATOM 128 NZ LYS A 9 -6.547 -2.705 16.700 1.00 0.00 N ATOM 0 H LYS A 9 -5.288 -1.992 10.272 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.671 -2.403 12.013 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.485 -0.790 13.497 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.645 0.416 12.978 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.526 -0.967 13.767 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.447 -2.300 14.131 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.012 0.427 15.402 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.187 -0.685 16.077 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -5.264 -1.427 15.621 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.858 -0.759 17.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.329 -2.820 17.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -7.569 -2.829 16.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.027 -3.419 16.150 1.00 0.00 H new ATOM 142 N GLY A 10 -8.669 -1.971 10.614 1.00 0.00 N ATOM 143 CA GLY A 10 -9.911 -1.788 9.896 1.00 0.00 C ATOM 144 C GLY A 10 -11.092 -1.802 10.851 1.00 0.00 C ATOM 145 O GLY A 10 -10.946 -1.560 12.048 1.00 0.00 O ATOM 0 H GLY A 10 -8.473 -2.945 10.844 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.887 -0.843 9.354 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.028 -2.578 9.154 1.00 0.00 H new ATOM 149 N ASP A 11 -12.259 -2.120 10.293 1.00 0.00 N ATOM 150 CA ASP A 11 -13.493 -2.265 11.042 1.00 0.00 C ATOM 151 C ASP A 11 -13.414 -3.476 11.974 1.00 0.00 C ATOM 152 O ASP A 11 -13.842 -3.414 13.124 1.00 0.00 O ATOM 153 CB ASP A 11 -14.648 -2.400 10.048 1.00 0.00 C ATOM 154 CG ASP A 11 -15.983 -2.376 10.775 1.00 0.00 C ATOM 155 OD1 ASP A 11 -16.433 -1.252 11.083 1.00 0.00 O ATOM 156 OD2 ASP A 11 -16.526 -3.480 10.992 1.00 0.00 O ATOM 0 H ASP A 11 -12.369 -2.285 9.293 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.659 -1.388 11.668 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -14.608 -1.587 9.323 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -14.548 -3.331 9.490 1.00 0.00 H new ATOM 161 N GLY A 12 -12.842 -4.582 11.478 1.00 0.00 N ATOM 162 CA GLY A 12 -12.715 -5.806 12.235 1.00 0.00 C ATOM 163 C GLY A 12 -11.338 -5.862 12.887 1.00 0.00 C ATOM 164 O GLY A 12 -10.663 -4.844 13.030 1.00 0.00 O ATOM 0 H GLY A 12 -12.457 -4.639 10.535 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.492 -5.856 12.998 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.854 -6.667 11.581 1.00 0.00 H new ATOM 168 N PRO A 13 -10.882 -7.064 13.257 1.00 0.00 N ATOM 169 CA PRO A 13 -9.606 -7.243 13.917 1.00 0.00 C ATOM 170 C PRO A 13 -8.441 -7.097 12.935 1.00 0.00 C ATOM 171 O PRO A 13 -7.298 -6.980 13.373 1.00 0.00 O ATOM 172 CB PRO A 13 -9.676 -8.633 14.552 1.00 0.00 C ATOM 173 CG PRO A 13 -10.634 -9.402 13.639 1.00 0.00 C ATOM 174 CD PRO A 13 -11.568 -8.328 13.069 1.00 0.00 C ATOM 0 HA PRO A 13 -9.422 -6.479 14.673 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.694 -9.105 14.591 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -10.048 -8.587 15.575 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.096 -9.921 12.846 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -11.190 -10.158 14.194 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.772 -8.508 12.014 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.528 -8.332 13.585 1.00 0.00 H new ATOM 182 N VAL A 14 -8.725 -7.088 11.624 1.00 0.00 N ATOM 183 CA VAL A 14 -7.746 -6.817 10.585 1.00 0.00 C ATOM 184 C VAL A 14 -6.968 -5.563 10.936 1.00 0.00 C ATOM 185 O VAL A 14 -7.534 -4.472 10.965 1.00 0.00 O ATOM 186 CB VAL A 14 -8.403 -6.679 9.200 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.307 -6.701 8.124 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.433 -7.785 8.935 1.00 0.00 C ATOM 0 H VAL A 14 -9.660 -7.273 11.260 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.063 -7.665 10.531 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.942 -5.732 9.169 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.763 -6.604 7.139 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.619 -5.872 8.289 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.761 -7.643 8.180 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.870 -7.646 7.946 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.943 -8.757 8.982 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.219 -7.738 9.689 1.00 0.00 H new ATOM 198 N GLN A 15 -5.671 -5.716 11.191 1.00 0.00 N ATOM 199 CA GLN A 15 -4.817 -4.580 11.478 1.00 0.00 C ATOM 200 C GLN A 15 -3.450 -4.816 10.881 1.00 0.00 C ATOM 201 O GLN A 15 -3.168 -5.924 10.445 1.00 0.00 O ATOM 202 CB GLN A 15 -4.774 -4.315 12.991 1.00 0.00 C ATOM 203 CG GLN A 15 -3.908 -5.334 13.749 1.00 0.00 C ATOM 204 CD GLN A 15 -4.452 -5.608 15.150 1.00 0.00 C ATOM 205 OE1 GLN A 15 -4.980 -4.709 15.807 1.00 0.00 O ATOM 206 NE2 GLN A 15 -4.328 -6.840 15.631 1.00 0.00 N ATOM 0 H GLN A 15 -5.194 -6.618 11.203 1.00 0.00 H new ATOM 0 HA GLN A 15 -5.221 -3.678 11.018 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.386 -3.312 13.169 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -5.789 -4.340 13.389 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -3.867 -6.266 13.186 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.887 -4.960 13.822 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.887 -7.566 15.066 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -4.674 -7.060 16.565 1.00 0.00 H new ATOM 215 N GLY A 16 -2.600 -3.795 10.861 1.00 0.00 N ATOM 216 CA GLY A 16 -1.206 -4.001 10.535 1.00 0.00 C ATOM 217 C GLY A 16 -0.352 -2.891 11.110 1.00 0.00 C ATOM 218 O GLY A 16 -0.884 -1.895 11.592 1.00 0.00 O ATOM 0 H GLY A 16 -2.854 -2.829 11.065 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.874 -4.962 10.927 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.082 -4.038 9.453 1.00 0.00 H new ATOM 222 N ILE A 17 0.961 -3.086 11.074 1.00 0.00 N ATOM 223 CA ILE A 17 1.973 -2.141 11.520 1.00 0.00 C ATOM 224 C ILE A 17 2.988 -1.953 10.380 1.00 0.00 C ATOM 225 O ILE A 17 3.895 -2.770 10.226 1.00 0.00 O ATOM 226 CB ILE A 17 2.596 -2.689 12.820 1.00 0.00 C ATOM 227 CG1 ILE A 17 1.569 -2.691 13.972 1.00 0.00 C ATOM 228 CG2 ILE A 17 3.813 -1.857 13.245 1.00 0.00 C ATOM 229 CD1 ILE A 17 1.858 -3.798 14.990 1.00 0.00 C ATOM 0 H ILE A 17 1.367 -3.950 10.715 1.00 0.00 H new ATOM 0 HA ILE A 17 1.563 -1.157 11.748 1.00 0.00 H new ATOM 0 HB ILE A 17 2.911 -3.712 12.614 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.584 -1.723 14.473 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.567 -2.824 13.565 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.231 -2.267 14.164 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.567 -1.887 12.458 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.507 -0.825 13.415 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.113 -3.765 15.785 1.00 0.00 H new ATOM 0 HD12 ILE A 17 1.817 -4.768 14.494 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.850 -3.650 15.417 1.00 0.00 H new ATOM 241 N ILE A 18 2.826 -0.904 9.560 1.00 0.00 N ATOM 242 CA ILE A 18 3.793 -0.529 8.525 1.00 0.00 C ATOM 243 C ILE A 18 4.878 0.321 9.161 1.00 0.00 C ATOM 244 O ILE A 18 4.649 0.923 10.204 1.00 0.00 O ATOM 245 CB ILE A 18 3.134 0.236 7.361 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.876 -0.469 6.848 1.00 0.00 C ATOM 247 CG2 ILE A 18 4.096 0.479 6.184 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.145 -1.929 6.504 1.00 0.00 C ATOM 0 H ILE A 18 2.013 -0.289 9.599 1.00 0.00 H new ATOM 0 HA ILE A 18 4.217 -1.440 8.104 1.00 0.00 H new ATOM 0 HB ILE A 18 2.855 1.204 7.778 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.094 -0.412 7.605 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.503 0.050 5.965 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.576 1.022 5.395 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.949 1.065 6.526 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.446 -0.478 5.796 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.227 -2.393 6.144 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.909 -1.985 5.728 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.492 -2.454 7.394 1.00 0.00 H new ATOM 260 N ASN A 19 6.044 0.367 8.524 1.00 0.00 N ATOM 261 CA ASN A 19 7.263 0.976 9.003 1.00 0.00 C ATOM 262 C ASN A 19 7.990 1.490 7.768 1.00 0.00 C ATOM 263 O ASN A 19 7.954 0.837 6.724 1.00 0.00 O ATOM 264 CB ASN A 19 8.147 -0.032 9.751 1.00 0.00 C ATOM 265 CG ASN A 19 7.362 -1.014 10.622 1.00 0.00 C ATOM 266 OD1 ASN A 19 7.303 -0.878 11.840 1.00 0.00 O ATOM 267 ND2 ASN A 19 6.730 -2.000 9.990 1.00 0.00 N ATOM 0 H ASN A 19 6.161 -0.049 7.600 1.00 0.00 H new ATOM 0 HA ASN A 19 7.037 1.774 9.710 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.735 -0.594 9.025 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.852 0.513 10.379 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.175 -2.672 10.520 1.00 0.00 H new ATOM 0 HD22 ASN A 19 6.801 -2.084 8.976 1.00 0.00 H new ATOM 274 N PHE A 20 8.606 2.662 7.888 1.00 0.00 N ATOM 275 CA PHE A 20 9.371 3.340 6.866 1.00 0.00 C ATOM 276 C PHE A 20 10.694 3.794 7.473 1.00 0.00 C ATOM 277 O PHE A 20 10.698 4.492 8.492 1.00 0.00 O ATOM 278 CB PHE A 20 8.587 4.562 6.393 1.00 0.00 C ATOM 279 CG PHE A 20 7.440 4.258 5.467 1.00 0.00 C ATOM 280 CD1 PHE A 20 6.181 3.910 5.987 1.00 0.00 C ATOM 281 CD2 PHE A 20 7.610 4.435 4.088 1.00 0.00 C ATOM 282 CE1 PHE A 20 5.095 3.723 5.113 1.00 0.00 C ATOM 283 CE2 PHE A 20 6.520 4.282 3.217 1.00 0.00 C ATOM 284 CZ PHE A 20 5.266 3.908 3.730 1.00 0.00 C ATOM 0 H PHE A 20 8.578 3.191 8.760 1.00 0.00 H new ATOM 0 HA PHE A 20 9.556 2.674 6.023 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.201 5.088 7.266 1.00 0.00 H new ATOM 0 HB3 PHE A 20 9.272 5.243 5.888 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.048 3.787 7.052 1.00 0.00 H new ATOM 0 HD2 PHE A 20 8.583 4.690 3.694 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.130 3.437 5.504 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.644 4.451 2.158 1.00 0.00 H new ATOM 0 HZ PHE A 20 4.432 3.762 3.060 1.00 0.00 H new ATOM 294 N GLU A 21 11.792 3.433 6.808 1.00 0.00 N ATOM 295 CA GLU A 21 13.138 3.899 7.101 1.00 0.00 C ATOM 296 C GLU A 21 13.743 4.503 5.830 1.00 0.00 C ATOM 297 O GLU A 21 13.784 3.838 4.795 1.00 0.00 O ATOM 298 CB GLU A 21 13.995 2.740 7.639 1.00 0.00 C ATOM 299 CG GLU A 21 13.880 2.607 9.169 1.00 0.00 C ATOM 300 CD GLU A 21 15.167 2.069 9.779 1.00 0.00 C ATOM 301 OE1 GLU A 21 16.149 2.847 9.754 1.00 0.00 O ATOM 302 OE2 GLU A 21 15.151 0.911 10.242 1.00 0.00 O ATOM 0 H GLU A 21 11.762 2.784 6.022 1.00 0.00 H new ATOM 0 HA GLU A 21 13.108 4.668 7.873 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.682 1.808 7.168 1.00 0.00 H new ATOM 0 HB3 GLU A 21 15.038 2.901 7.365 1.00 0.00 H new ATOM 0 HG2 GLU A 21 13.648 3.579 9.604 1.00 0.00 H new ATOM 0 HG3 GLU A 21 13.053 1.942 9.417 1.00 0.00 H new ATOM 309 N GLN A 22 14.197 5.762 5.905 1.00 0.00 N ATOM 310 CA GLN A 22 14.850 6.471 4.807 1.00 0.00 C ATOM 311 C GLN A 22 16.004 7.308 5.365 1.00 0.00 C ATOM 312 O GLN A 22 15.933 8.528 5.429 1.00 0.00 O ATOM 313 CB GLN A 22 13.853 7.376 4.060 1.00 0.00 C ATOM 314 CG GLN A 22 14.350 7.689 2.635 1.00 0.00 C ATOM 315 CD GLN A 22 14.264 9.161 2.246 1.00 0.00 C ATOM 316 OE1 GLN A 22 13.686 9.988 2.947 1.00 0.00 O ATOM 317 NE2 GLN A 22 14.803 9.504 1.087 1.00 0.00 N ATOM 0 H GLN A 22 14.116 6.324 6.752 1.00 0.00 H new ATOM 0 HA GLN A 22 15.234 5.739 4.096 1.00 0.00 H new ATOM 0 HB2 GLN A 22 12.880 6.887 4.010 1.00 0.00 H new ATOM 0 HB3 GLN A 22 13.715 8.305 4.613 1.00 0.00 H new ATOM 0 HG2 GLN A 22 15.386 7.362 2.545 1.00 0.00 H new ATOM 0 HG3 GLN A 22 13.768 7.103 1.924 1.00 0.00 H new ATOM 0 HE21 GLN A 22 15.279 8.803 0.519 1.00 0.00 H new ATOM 0 HE22 GLN A 22 14.742 10.469 0.762 1.00 0.00 H new ATOM 326 N LYS A 23 17.093 6.670 5.790 1.00 0.00 N ATOM 327 CA LYS A 23 18.195 7.393 6.416 1.00 0.00 C ATOM 328 C LYS A 23 18.895 8.368 5.459 1.00 0.00 C ATOM 329 O LYS A 23 19.576 9.280 5.933 1.00 0.00 O ATOM 330 CB LYS A 23 19.152 6.363 7.040 1.00 0.00 C ATOM 331 CG LYS A 23 20.171 6.976 8.013 1.00 0.00 C ATOM 332 CD LYS A 23 21.545 7.121 7.349 1.00 0.00 C ATOM 333 CE LYS A 23 22.502 7.957 8.214 1.00 0.00 C ATOM 334 NZ LYS A 23 23.354 8.838 7.387 1.00 0.00 N ATOM 0 H LYS A 23 17.234 5.663 5.713 1.00 0.00 H new ATOM 0 HA LYS A 23 17.802 8.037 7.203 1.00 0.00 H new ATOM 0 HB2 LYS A 23 18.567 5.610 7.568 1.00 0.00 H new ATOM 0 HB3 LYS A 23 19.688 5.849 6.242 1.00 0.00 H new ATOM 0 HG2 LYS A 23 19.819 7.952 8.346 1.00 0.00 H new ATOM 0 HG3 LYS A 23 20.256 6.348 8.900 1.00 0.00 H new ATOM 0 HD2 LYS A 23 21.974 6.134 7.179 1.00 0.00 H new ATOM 0 HD3 LYS A 23 21.431 7.591 6.372 1.00 0.00 H new ATOM 0 HE2 LYS A 23 21.926 8.561 8.915 1.00 0.00 H new ATOM 0 HE3 LYS A 23 23.131 7.293 8.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 23.987 9.387 8.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 23.922 8.260 6.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 22.754 9.488 6.840 1.00 0.00 H new ATOM 348 N GLU A 24 18.725 8.190 4.147 1.00 0.00 N ATOM 349 CA GLU A 24 19.134 9.139 3.127 1.00 0.00 C ATOM 350 C GLU A 24 18.050 10.219 3.056 1.00 0.00 C ATOM 351 O GLU A 24 16.884 9.931 3.286 1.00 0.00 O ATOM 352 CB GLU A 24 19.285 8.357 1.813 1.00 0.00 C ATOM 353 CG GLU A 24 20.518 8.749 0.984 1.00 0.00 C ATOM 354 CD GLU A 24 20.326 9.998 0.134 1.00 0.00 C ATOM 355 OE1 GLU A 24 19.926 11.037 0.707 1.00 0.00 O ATOM 356 OE2 GLU A 24 20.557 9.885 -1.084 1.00 0.00 O ATOM 0 H GLU A 24 18.285 7.355 3.761 1.00 0.00 H new ATOM 0 HA GLU A 24 20.085 9.627 3.339 1.00 0.00 H new ATOM 0 HB2 GLU A 24 19.338 7.292 2.041 1.00 0.00 H new ATOM 0 HB3 GLU A 24 18.391 8.509 1.208 1.00 0.00 H new ATOM 0 HG2 GLU A 24 21.360 8.907 1.658 1.00 0.00 H new ATOM 0 HG3 GLU A 24 20.784 7.917 0.332 1.00 0.00 H new ATOM 363 N SER A 25 18.415 11.457 2.739 1.00 0.00 N ATOM 364 CA SER A 25 17.439 12.502 2.485 1.00 0.00 C ATOM 365 C SER A 25 16.667 12.192 1.206 1.00 0.00 C ATOM 366 O SER A 25 15.437 12.233 1.197 1.00 0.00 O ATOM 367 CB SER A 25 18.154 13.853 2.377 1.00 0.00 C ATOM 368 OG SER A 25 18.531 14.287 3.668 1.00 0.00 O ATOM 0 H SER A 25 19.386 11.759 2.652 1.00 0.00 H new ATOM 0 HA SER A 25 16.728 12.548 3.310 1.00 0.00 H new ATOM 0 HB2 SER A 25 19.034 13.762 1.740 1.00 0.00 H new ATOM 0 HB3 SER A 25 17.498 14.588 1.911 1.00 0.00 H new ATOM 0 HG SER A 25 18.990 15.150 3.602 1.00 0.00 H new ATOM 374 N ASN A 26 17.393 11.896 0.126 1.00 0.00 N ATOM 375 CA ASN A 26 16.828 11.757 -1.215 1.00 0.00 C ATOM 376 C ASN A 26 17.264 10.444 -1.861 1.00 0.00 C ATOM 377 O ASN A 26 17.386 10.358 -3.081 1.00 0.00 O ATOM 378 CB ASN A 26 17.139 12.998 -2.071 1.00 0.00 C ATOM 379 CG ASN A 26 18.626 13.337 -2.162 1.00 0.00 C ATOM 380 OD1 ASN A 26 19.384 12.701 -2.882 1.00 0.00 O ATOM 381 ND2 ASN A 26 19.054 14.388 -1.465 1.00 0.00 N ATOM 0 H ASN A 26 18.401 11.745 0.160 1.00 0.00 H new ATOM 0 HA ASN A 26 15.742 11.706 -1.138 1.00 0.00 H new ATOM 0 HB2 ASN A 26 16.752 12.838 -3.077 1.00 0.00 H new ATOM 0 HB3 ASN A 26 16.607 13.854 -1.657 1.00 0.00 H new ATOM 0 HD21 ASN A 26 20.030 14.677 -1.525 1.00 0.00 H new ATOM 0 HD22 ASN A 26 18.405 14.904 -0.871 1.00 0.00 H new ATOM 388 N GLY A 27 17.416 9.401 -1.038 1.00 0.00 N ATOM 389 CA GLY A 27 17.756 8.057 -1.489 1.00 0.00 C ATOM 390 C GLY A 27 16.579 7.105 -1.284 1.00 0.00 C ATOM 391 O GLY A 27 15.545 7.511 -0.753 1.00 0.00 O ATOM 0 H GLY A 27 17.304 9.473 -0.027 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.032 8.081 -2.543 1.00 0.00 H new ATOM 0 HA3 GLY A 27 18.625 7.693 -0.940 1.00 0.00 H new ATOM 395 N PRO A 28 16.718 5.837 -1.702 1.00 0.00 N ATOM 396 CA PRO A 28 15.619 4.886 -1.753 1.00 0.00 C ATOM 397 C PRO A 28 15.132 4.519 -0.348 1.00 0.00 C ATOM 398 O PRO A 28 15.898 3.963 0.443 1.00 0.00 O ATOM 399 CB PRO A 28 16.169 3.673 -2.510 1.00 0.00 C ATOM 400 CG PRO A 28 17.677 3.747 -2.260 1.00 0.00 C ATOM 401 CD PRO A 28 17.943 5.250 -2.215 1.00 0.00 C ATOM 0 HA PRO A 28 14.745 5.300 -2.256 1.00 0.00 H new ATOM 0 HB2 PRO A 28 15.746 2.741 -2.136 1.00 0.00 H new ATOM 0 HB3 PRO A 28 15.936 3.724 -3.574 1.00 0.00 H new ATOM 0 HG2 PRO A 28 17.956 3.259 -1.326 1.00 0.00 H new ATOM 0 HG3 PRO A 28 18.242 3.260 -3.055 1.00 0.00 H new ATOM 0 HD2 PRO A 28 18.791 5.481 -1.570 1.00 0.00 H new ATOM 0 HD3 PRO A 28 18.181 5.638 -3.205 1.00 0.00 H new ATOM 409 N VAL A 29 13.861 4.804 -0.041 1.00 0.00 N ATOM 410 CA VAL A 29 13.245 4.425 1.214 1.00 0.00 C ATOM 411 C VAL A 29 13.142 2.910 1.278 1.00 0.00 C ATOM 412 O VAL A 29 13.035 2.273 0.238 1.00 0.00 O ATOM 413 CB VAL A 29 11.853 5.076 1.307 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.767 4.392 0.477 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.349 5.058 2.741 1.00 0.00 C ATOM 0 H VAL A 29 13.235 5.308 -0.669 1.00 0.00 H new ATOM 0 HA VAL A 29 13.847 4.769 2.055 1.00 0.00 H new ATOM 0 HB VAL A 29 12.010 6.082 0.919 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.823 4.921 0.606 1.00 0.00 H new ATOM 0 HG12 VAL A 29 11.050 4.407 -0.576 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.653 3.360 0.807 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.364 5.522 2.786 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.281 4.028 3.090 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.040 5.611 3.377 1.00 0.00 H new ATOM 425 N LYS A 30 13.122 2.340 2.480 1.00 0.00 N ATOM 426 CA LYS A 30 12.749 0.968 2.746 1.00 0.00 C ATOM 427 C LYS A 30 11.455 1.035 3.561 1.00 0.00 C ATOM 428 O LYS A 30 11.484 1.480 4.710 1.00 0.00 O ATOM 429 CB LYS A 30 13.870 0.315 3.567 1.00 0.00 C ATOM 430 CG LYS A 30 14.958 -0.375 2.731 1.00 0.00 C ATOM 431 CD LYS A 30 15.615 0.548 1.696 1.00 0.00 C ATOM 432 CE LYS A 30 16.895 -0.094 1.140 1.00 0.00 C ATOM 433 NZ LYS A 30 17.314 0.524 -0.134 1.00 0.00 N ATOM 0 H LYS A 30 13.377 2.850 3.326 1.00 0.00 H new ATOM 0 HA LYS A 30 12.602 0.385 1.837 1.00 0.00 H new ATOM 0 HB2 LYS A 30 14.338 1.078 4.189 1.00 0.00 H new ATOM 0 HB3 LYS A 30 13.428 -0.419 4.241 1.00 0.00 H new ATOM 0 HG2 LYS A 30 15.727 -0.763 3.399 1.00 0.00 H new ATOM 0 HG3 LYS A 30 14.521 -1.231 2.217 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.918 0.747 0.882 1.00 0.00 H new ATOM 0 HD3 LYS A 30 15.852 1.508 2.154 1.00 0.00 H new ATOM 0 HE2 LYS A 30 17.697 0.004 1.872 1.00 0.00 H new ATOM 0 HE3 LYS A 30 16.730 -1.161 0.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 18.152 0.029 -0.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 16.540 0.454 -0.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 17.546 1.525 0.026 1.00 0.00 H new ATOM 447 N VAL A 31 10.328 0.624 2.974 1.00 0.00 N ATOM 448 CA VAL A 31 9.086 0.393 3.664 1.00 0.00 C ATOM 449 C VAL A 31 8.991 -1.093 3.977 1.00 0.00 C ATOM 450 O VAL A 31 9.525 -1.928 3.244 1.00 0.00 O ATOM 451 CB VAL A 31 7.901 0.873 2.811 1.00 0.00 C ATOM 452 CG1 VAL A 31 8.295 1.871 1.728 1.00 0.00 C ATOM 453 CG2 VAL A 31 7.011 -0.228 2.218 1.00 0.00 C ATOM 0 H VAL A 31 10.268 0.441 1.972 1.00 0.00 H new ATOM 0 HA VAL A 31 9.053 0.959 4.595 1.00 0.00 H new ATOM 0 HB VAL A 31 7.287 1.385 3.551 1.00 0.00 H new ATOM 0 HG11 VAL A 31 7.409 2.166 1.166 1.00 0.00 H new ATOM 0 HG12 VAL A 31 8.742 2.752 2.190 1.00 0.00 H new ATOM 0 HG13 VAL A 31 9.016 1.410 1.053 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.209 0.226 1.636 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.609 -0.870 1.572 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.582 -0.823 3.024 1.00 0.00 H new ATOM 463 N TRP A 32 8.258 -1.425 5.031 1.00 0.00 N ATOM 464 CA TRP A 32 7.962 -2.804 5.378 1.00 0.00 C ATOM 465 C TRP A 32 6.861 -2.810 6.422 1.00 0.00 C ATOM 466 O TRP A 32 6.645 -1.809 7.100 1.00 0.00 O ATOM 467 CB TRP A 32 9.215 -3.556 5.871 1.00 0.00 C ATOM 468 CG TRP A 32 9.466 -3.517 7.345 1.00 0.00 C ATOM 469 CD1 TRP A 32 8.962 -4.386 8.251 1.00 0.00 C ATOM 470 CD2 TRP A 32 10.242 -2.551 8.105 1.00 0.00 C ATOM 471 NE1 TRP A 32 9.355 -4.012 9.518 1.00 0.00 N ATOM 472 CE2 TRP A 32 10.151 -2.886 9.489 1.00 0.00 C ATOM 473 CE3 TRP A 32 10.990 -1.405 7.767 1.00 0.00 C ATOM 474 CZ2 TRP A 32 10.774 -2.123 10.487 1.00 0.00 C ATOM 475 CZ3 TRP A 32 11.629 -0.641 8.758 1.00 0.00 C ATOM 476 CH2 TRP A 32 11.523 -0.994 10.115 1.00 0.00 C ATOM 0 H TRP A 32 7.852 -0.742 5.670 1.00 0.00 H new ATOM 0 HA TRP A 32 7.625 -3.334 4.487 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.133 -4.599 5.564 1.00 0.00 H new ATOM 0 HB3 TRP A 32 10.086 -3.142 5.363 1.00 0.00 H new ATOM 0 HD1 TRP A 32 8.346 -5.242 8.017 1.00 0.00 H new ATOM 0 HE1 TRP A 32 9.090 -4.506 10.370 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.073 -1.110 6.731 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 10.679 -2.399 11.527 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 12.207 0.226 8.475 1.00 0.00 H new ATOM 0 HH2 TRP A 32 12.016 -0.399 10.869 1.00 0.00 H new ATOM 487 N GLY A 33 6.161 -3.924 6.582 1.00 0.00 N ATOM 488 CA GLY A 33 5.079 -3.976 7.537 1.00 0.00 C ATOM 489 C GLY A 33 4.585 -5.383 7.720 1.00 0.00 C ATOM 490 O GLY A 33 5.177 -6.301 7.162 1.00 0.00 O ATOM 0 H GLY A 33 6.324 -4.790 6.068 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.416 -3.578 8.494 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.260 -3.341 7.198 1.00 0.00 H new ATOM 494 N SER A 34 3.496 -5.540 8.469 1.00 0.00 N ATOM 495 CA SER A 34 2.934 -6.831 8.780 1.00 0.00 C ATOM 496 C SER A 34 1.474 -6.571 9.097 1.00 0.00 C ATOM 497 O SER A 34 1.158 -5.822 10.025 1.00 0.00 O ATOM 498 CB SER A 34 3.714 -7.495 9.918 1.00 0.00 C ATOM 499 OG SER A 34 3.897 -6.611 11.011 1.00 0.00 O ATOM 0 H SER A 34 2.981 -4.759 8.876 1.00 0.00 H new ATOM 0 HA SER A 34 3.005 -7.540 7.955 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.181 -8.385 10.254 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.685 -7.825 9.550 1.00 0.00 H new ATOM 0 HG SER A 34 3.129 -6.006 11.074 1.00 0.00 H new ATOM 505 N ILE A 35 0.591 -7.104 8.258 1.00 0.00 N ATOM 506 CA ILE A 35 -0.834 -7.111 8.495 1.00 0.00 C ATOM 507 C ILE A 35 -1.162 -8.324 9.371 1.00 0.00 C ATOM 508 O ILE A 35 -0.325 -9.195 9.589 1.00 0.00 O ATOM 509 CB ILE A 35 -1.541 -7.062 7.126 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.091 -5.653 6.845 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.626 -8.123 6.967 1.00 0.00 C ATOM 512 CD1 ILE A 35 -2.268 -5.391 5.346 1.00 0.00 C ATOM 0 H ILE A 35 0.859 -7.549 7.380 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.195 -6.243 9.047 1.00 0.00 H new ATOM 0 HB ILE A 35 -0.783 -7.297 6.379 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.050 -5.531 7.349 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.413 -4.910 7.265 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.082 -8.032 5.981 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.184 -9.114 7.072 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.388 -7.982 7.734 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.658 -4.384 5.196 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.305 -5.485 4.844 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.967 -6.117 4.930 1.00 0.00 H new ATOM 524 N LYS A 36 -2.386 -8.380 9.882 1.00 0.00 N ATOM 525 CA LYS A 36 -2.898 -9.450 10.700 1.00 0.00 C ATOM 526 C LYS A 36 -4.416 -9.363 10.574 1.00 0.00 C ATOM 527 O LYS A 36 -5.060 -8.625 11.315 1.00 0.00 O ATOM 528 CB LYS A 36 -2.389 -9.262 12.139 1.00 0.00 C ATOM 529 CG LYS A 36 -2.206 -10.577 12.915 1.00 0.00 C ATOM 530 CD LYS A 36 -0.711 -10.875 13.121 1.00 0.00 C ATOM 531 CE LYS A 36 -0.512 -12.170 13.926 1.00 0.00 C ATOM 532 NZ LYS A 36 0.773 -12.834 13.621 1.00 0.00 N ATOM 0 H LYS A 36 -3.073 -7.642 9.725 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.566 -10.442 10.393 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.436 -8.734 12.110 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -3.089 -8.627 12.681 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.706 -10.509 13.881 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.675 -11.396 12.370 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.218 -10.965 12.153 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -0.239 -10.042 13.643 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.556 -11.942 14.991 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.332 -12.856 13.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.946 -13.591 14.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.735 -13.242 12.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.544 -12.138 13.670 1.00 0.00 H new ATOM 546 N GLY A 37 -4.960 -10.064 9.580 1.00 0.00 N ATOM 547 CA GLY A 37 -6.388 -10.257 9.370 1.00 0.00 C ATOM 548 C GLY A 37 -6.814 -10.354 7.899 1.00 0.00 C ATOM 549 O GLY A 37 -8.007 -10.359 7.608 1.00 0.00 O ATOM 0 H GLY A 37 -4.392 -10.530 8.872 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.697 -11.167 9.884 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.925 -9.430 9.835 1.00 0.00 H new ATOM 553 N LEU A 38 -5.862 -10.381 6.961 1.00 0.00 N ATOM 554 CA LEU A 38 -6.126 -10.615 5.551 1.00 0.00 C ATOM 555 C LEU A 38 -6.503 -12.092 5.326 1.00 0.00 C ATOM 556 O LEU A 38 -6.843 -12.801 6.267 1.00 0.00 O ATOM 557 CB LEU A 38 -4.884 -10.140 4.765 1.00 0.00 C ATOM 558 CG LEU A 38 -5.122 -8.801 4.059 1.00 0.00 C ATOM 559 CD1 LEU A 38 -5.638 -7.653 4.942 1.00 0.00 C ATOM 560 CD2 LEU A 38 -3.893 -8.382 3.240 1.00 0.00 C ATOM 0 H LEU A 38 -4.874 -10.238 7.170 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.983 -10.048 5.187 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.039 -10.044 5.447 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.613 -10.895 4.027 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.956 -8.997 3.385 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.769 -6.757 4.335 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.594 -7.935 5.383 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.918 -7.452 5.735 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.090 -7.429 2.750 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.033 -8.279 3.901 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.682 -9.141 2.486 1.00 0.00 H new ATOM 572 N THR A 39 -6.453 -12.565 4.079 1.00 0.00 N ATOM 573 CA THR A 39 -6.587 -13.971 3.732 1.00 0.00 C ATOM 574 C THR A 39 -5.552 -14.238 2.648 1.00 0.00 C ATOM 575 O THR A 39 -5.153 -13.300 1.945 1.00 0.00 O ATOM 576 CB THR A 39 -8.021 -14.294 3.278 1.00 0.00 C ATOM 577 OG1 THR A 39 -8.180 -15.639 2.875 1.00 0.00 O ATOM 578 CG2 THR A 39 -8.440 -13.442 2.078 1.00 0.00 C ATOM 0 H THR A 39 -6.315 -11.963 3.268 1.00 0.00 H new ATOM 0 HA THR A 39 -6.408 -14.620 4.590 1.00 0.00 H new ATOM 0 HB THR A 39 -8.637 -14.085 4.152 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.521 -16.199 3.337 1.00 0.00 H new ATOM 0 HG21 THR A 39 -9.458 -13.699 1.787 1.00 0.00 H new ATOM 0 HG22 THR A 39 -8.395 -12.387 2.348 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.765 -13.632 1.243 1.00 0.00 H new ATOM 586 N GLU A 40 -5.129 -15.494 2.564 1.00 0.00 N ATOM 587 CA GLU A 40 -4.122 -16.025 1.676 1.00 0.00 C ATOM 588 C GLU A 40 -4.358 -15.558 0.246 1.00 0.00 C ATOM 589 O GLU A 40 -5.475 -15.624 -0.265 1.00 0.00 O ATOM 590 CB GLU A 40 -4.089 -17.559 1.766 1.00 0.00 C ATOM 591 CG GLU A 40 -5.466 -18.242 1.851 1.00 0.00 C ATOM 592 CD GLU A 40 -5.954 -18.419 3.285 1.00 0.00 C ATOM 593 OE1 GLU A 40 -6.506 -17.428 3.819 1.00 0.00 O ATOM 594 OE2 GLU A 40 -5.746 -19.527 3.819 1.00 0.00 O ATOM 0 H GLU A 40 -5.518 -16.219 3.167 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.149 -15.646 1.987 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.563 -17.947 0.894 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.506 -17.843 2.642 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.194 -17.651 1.295 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -5.412 -19.218 1.368 1.00 0.00 H new ATOM 601 N GLY A 41 -3.298 -15.073 -0.401 1.00 0.00 N ATOM 602 CA GLY A 41 -3.390 -14.530 -1.738 1.00 0.00 C ATOM 603 C GLY A 41 -2.852 -13.121 -1.642 1.00 0.00 C ATOM 604 O GLY A 41 -1.900 -12.898 -0.902 1.00 0.00 O ATOM 0 H GLY A 41 -2.358 -15.050 -0.006 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.809 -15.124 -2.443 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -4.421 -14.533 -2.092 1.00 0.00 H new ATOM 608 N LEU A 42 -3.457 -12.173 -2.353 1.00 0.00 N ATOM 609 CA LEU A 42 -2.908 -10.844 -2.540 1.00 0.00 C ATOM 610 C LEU A 42 -4.007 -9.798 -2.384 1.00 0.00 C ATOM 611 O LEU A 42 -5.181 -10.090 -2.603 1.00 0.00 O ATOM 612 CB LEU A 42 -2.166 -10.790 -3.885 1.00 0.00 C ATOM 613 CG LEU A 42 -3.049 -10.652 -5.121 1.00 0.00 C ATOM 614 CD1 LEU A 42 -2.166 -10.681 -6.373 1.00 0.00 C ATOM 615 CD2 LEU A 42 -4.101 -11.762 -5.272 1.00 0.00 C ATOM 0 H LEU A 42 -4.353 -12.314 -2.819 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.172 -10.610 -1.771 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.470 -9.951 -3.862 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.569 -11.696 -3.987 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.583 -9.709 -5.002 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.790 -10.583 -7.261 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.455 -9.855 -6.336 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -1.623 -11.625 -6.414 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -4.686 -11.589 -6.175 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -3.602 -12.729 -5.342 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.762 -11.757 -4.405 1.00 0.00 H new ATOM 627 N HIS A 43 -3.634 -8.607 -1.914 1.00 0.00 N ATOM 628 CA HIS A 43 -4.564 -7.544 -1.563 1.00 0.00 C ATOM 629 C HIS A 43 -4.008 -6.217 -2.064 1.00 0.00 C ATOM 630 O HIS A 43 -2.821 -5.977 -1.855 1.00 0.00 O ATOM 631 CB HIS A 43 -4.678 -7.514 -0.041 1.00 0.00 C ATOM 632 CG HIS A 43 -5.625 -8.544 0.514 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.895 -8.265 0.960 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.430 -9.894 0.612 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.481 -9.417 1.319 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.607 -10.416 1.113 1.00 0.00 N ATOM 0 H HIS A 43 -2.657 -8.354 -1.765 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.543 -7.713 -2.013 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.690 -7.671 0.392 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -5.009 -6.523 0.271 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.320 -7.339 1.010 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.537 -10.441 0.351 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.483 -9.523 1.707 1.00 0.00 H new ATOM 645 N GLY A 44 -4.830 -5.374 -2.704 1.00 0.00 N ATOM 646 CA GLY A 44 -4.373 -4.111 -3.262 1.00 0.00 C ATOM 647 C GLY A 44 -3.904 -3.187 -2.148 1.00 0.00 C ATOM 648 O GLY A 44 -4.450 -3.256 -1.043 1.00 0.00 O ATOM 0 H GLY A 44 -5.824 -5.555 -2.845 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.559 -4.288 -3.965 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.180 -3.638 -3.822 1.00 0.00 H new ATOM 652 N PHE A 45 -2.903 -2.344 -2.425 1.00 0.00 N ATOM 653 CA PHE A 45 -2.223 -1.581 -1.381 1.00 0.00 C ATOM 654 C PHE A 45 -1.663 -0.272 -1.929 1.00 0.00 C ATOM 655 O PHE A 45 -0.822 -0.289 -2.827 1.00 0.00 O ATOM 656 CB PHE A 45 -1.108 -2.449 -0.773 1.00 0.00 C ATOM 657 CG PHE A 45 -0.624 -2.020 0.599 1.00 0.00 C ATOM 658 CD1 PHE A 45 -1.554 -1.847 1.640 1.00 0.00 C ATOM 659 CD2 PHE A 45 0.752 -1.918 0.879 1.00 0.00 C ATOM 660 CE1 PHE A 45 -1.121 -1.575 2.944 1.00 0.00 C ATOM 661 CE2 PHE A 45 1.186 -1.679 2.195 1.00 0.00 C ATOM 662 CZ PHE A 45 0.250 -1.535 3.232 1.00 0.00 C ATOM 0 H PHE A 45 -2.548 -2.175 -3.366 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.941 -1.319 -0.604 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -1.465 -3.477 -0.708 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -0.258 -2.449 -1.456 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -2.611 -1.925 1.432 1.00 0.00 H new ATOM 0 HD2 PHE A 45 1.474 -2.023 0.083 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.843 -1.396 3.727 1.00 0.00 H new ATOM 0 HE2 PHE A 45 2.242 -1.606 2.409 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.586 -1.394 4.249 1.00 0.00 H new ATOM 672 N HIS A 46 -2.151 0.871 -1.431 1.00 0.00 N ATOM 673 CA HIS A 46 -1.831 2.162 -2.041 1.00 0.00 C ATOM 674 C HIS A 46 -1.785 3.284 -1.026 1.00 0.00 C ATOM 675 O HIS A 46 -2.417 3.196 0.029 1.00 0.00 O ATOM 676 CB HIS A 46 -2.880 2.559 -3.086 1.00 0.00 C ATOM 677 CG HIS A 46 -3.544 1.401 -3.743 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.767 0.845 -3.371 1.00 0.00 N ATOM 679 CD2 HIS A 46 -3.014 0.633 -4.729 1.00 0.00 C ATOM 680 CE1 HIS A 46 -4.960 -0.239 -4.152 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.919 -0.342 -4.980 1.00 0.00 N ATOM 0 H HIS A 46 -2.762 0.926 -0.616 1.00 0.00 H new ATOM 0 HA HIS A 46 -0.850 2.029 -2.497 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.639 3.177 -2.608 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.403 3.173 -3.850 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -2.060 0.772 -5.216 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.809 -0.906 -4.113 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.819 -1.056 -5.702 1.00 0.00 H new ATOM 689 N VAL A 47 -1.127 4.375 -1.427 1.00 0.00 N ATOM 690 CA VAL A 47 -1.211 5.653 -0.748 1.00 0.00 C ATOM 691 C VAL A 47 -2.404 6.431 -1.312 1.00 0.00 C ATOM 692 O VAL A 47 -2.390 6.867 -2.467 1.00 0.00 O ATOM 693 CB VAL A 47 0.099 6.437 -0.897 1.00 0.00 C ATOM 694 CG1 VAL A 47 -0.004 7.754 -0.127 1.00 0.00 C ATOM 695 CG2 VAL A 47 1.281 5.630 -0.343 1.00 0.00 C ATOM 0 H VAL A 47 -0.516 4.387 -2.243 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.363 5.496 0.320 1.00 0.00 H new ATOM 0 HB VAL A 47 0.266 6.631 -1.957 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.927 8.311 -0.233 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -0.828 8.345 -0.526 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.184 7.546 0.928 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.200 6.205 -0.459 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.115 5.420 0.714 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.369 4.691 -0.890 1.00 0.00 H new ATOM 705 N HIS A 48 -3.452 6.595 -0.505 1.00 0.00 N ATOM 706 CA HIS A 48 -4.549 7.488 -0.834 1.00 0.00 C ATOM 707 C HIS A 48 -4.103 8.912 -0.521 1.00 0.00 C ATOM 708 O HIS A 48 -3.268 9.113 0.361 1.00 0.00 O ATOM 709 CB HIS A 48 -5.810 7.104 -0.056 1.00 0.00 C ATOM 710 CG HIS A 48 -6.376 5.766 -0.472 1.00 0.00 C ATOM 711 ND1 HIS A 48 -7.684 5.537 -0.777 1.00 0.00 N ATOM 712 CD2 HIS A 48 -5.658 4.621 -0.666 1.00 0.00 C ATOM 713 CE1 HIS A 48 -7.791 4.259 -1.171 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.563 3.704 -1.190 1.00 0.00 N ATOM 0 H HIS A 48 -3.559 6.114 0.388 1.00 0.00 H new ATOM 0 HA HIS A 48 -4.801 7.411 -1.892 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -5.580 7.080 1.009 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -6.568 7.874 -0.201 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -8.444 6.214 -0.717 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.610 4.461 -0.457 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -8.711 3.757 -1.431 1.00 0.00 H new ATOM 722 N GLU A 49 -4.631 9.870 -1.282 1.00 0.00 N ATOM 723 CA GLU A 49 -4.225 11.270 -1.255 1.00 0.00 C ATOM 724 C GLU A 49 -4.153 11.836 0.171 1.00 0.00 C ATOM 725 O GLU A 49 -3.057 12.015 0.706 1.00 0.00 O ATOM 726 CB GLU A 49 -5.185 12.021 -2.181 1.00 0.00 C ATOM 727 CG GLU A 49 -4.946 13.529 -2.299 1.00 0.00 C ATOM 728 CD GLU A 49 -5.898 14.147 -3.316 1.00 0.00 C ATOM 729 OE1 GLU A 49 -6.904 13.474 -3.642 1.00 0.00 O ATOM 730 OE2 GLU A 49 -5.579 15.262 -3.779 1.00 0.00 O ATOM 0 H GLU A 49 -5.376 9.685 -1.954 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.204 11.390 -1.618 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.119 11.582 -3.176 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.203 11.859 -1.828 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.087 14.002 -1.327 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.915 13.717 -2.598 1.00 0.00 H new ATOM 737 N GLU A 50 -5.308 12.122 0.780 1.00 0.00 N ATOM 738 CA GLU A 50 -5.385 12.627 2.143 1.00 0.00 C ATOM 739 C GLU A 50 -5.639 11.479 3.117 1.00 0.00 C ATOM 740 O GLU A 50 -6.098 10.404 2.723 1.00 0.00 O ATOM 741 CB GLU A 50 -6.507 13.662 2.288 1.00 0.00 C ATOM 742 CG GLU A 50 -6.662 14.586 1.075 1.00 0.00 C ATOM 743 CD GLU A 50 -7.675 15.680 1.378 1.00 0.00 C ATOM 744 OE1 GLU A 50 -8.881 15.376 1.259 1.00 0.00 O ATOM 745 OE2 GLU A 50 -7.221 16.780 1.759 1.00 0.00 O ATOM 0 H GLU A 50 -6.218 12.007 0.333 1.00 0.00 H new ATOM 0 HA GLU A 50 -4.433 13.105 2.373 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -7.449 13.140 2.457 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.315 14.269 3.173 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.700 15.031 0.821 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -6.985 14.010 0.208 1.00 0.00 H new ATOM 752 N GLU A 51 -5.380 11.739 4.400 1.00 0.00 N ATOM 753 CA GLU A 51 -5.625 10.817 5.493 1.00 0.00 C ATOM 754 C GLU A 51 -6.917 11.090 6.260 1.00 0.00 C ATOM 755 O GLU A 51 -7.470 10.162 6.851 1.00 0.00 O ATOM 756 CB GLU A 51 -4.419 10.798 6.435 1.00 0.00 C ATOM 757 CG GLU A 51 -4.058 12.164 7.030 1.00 0.00 C ATOM 758 CD GLU A 51 -3.106 11.973 8.201 1.00 0.00 C ATOM 759 OE1 GLU A 51 -1.999 11.459 7.943 1.00 0.00 O ATOM 760 OE2 GLU A 51 -3.515 12.302 9.335 1.00 0.00 O ATOM 0 H GLU A 51 -4.982 12.626 4.709 1.00 0.00 H new ATOM 0 HA GLU A 51 -5.761 9.832 5.046 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.621 10.102 7.250 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -3.556 10.412 5.893 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.594 12.792 6.270 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.960 12.678 7.361 1.00 0.00 H new ATOM 767 N ASP A 52 -7.374 12.346 6.287 1.00 0.00 N ATOM 768 CA ASP A 52 -8.430 12.796 7.186 1.00 0.00 C ATOM 769 C ASP A 52 -9.796 12.268 6.734 1.00 0.00 C ATOM 770 O ASP A 52 -10.599 12.973 6.127 1.00 0.00 O ATOM 771 CB ASP A 52 -8.403 14.325 7.295 1.00 0.00 C ATOM 772 CG ASP A 52 -9.351 14.830 8.376 1.00 0.00 C ATOM 773 OD1 ASP A 52 -9.936 13.975 9.077 1.00 0.00 O ATOM 774 OD2 ASP A 52 -9.449 16.068 8.506 1.00 0.00 O ATOM 0 H ASP A 52 -7.015 13.082 5.678 1.00 0.00 H new ATOM 0 HA ASP A 52 -8.253 12.388 8.181 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -7.389 14.656 7.517 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -8.679 14.763 6.336 1.00 0.00 H new ATOM 779 N ASN A 53 -10.029 10.978 6.979 1.00 0.00 N ATOM 780 CA ASN A 53 -11.132 10.229 6.405 1.00 0.00 C ATOM 781 C ASN A 53 -12.184 9.914 7.467 1.00 0.00 C ATOM 782 O ASN A 53 -12.618 8.771 7.606 1.00 0.00 O ATOM 783 CB ASN A 53 -10.566 8.975 5.724 1.00 0.00 C ATOM 784 CG ASN A 53 -11.528 8.461 4.667 1.00 0.00 C ATOM 785 OD1 ASN A 53 -11.311 8.662 3.477 1.00 0.00 O ATOM 786 ND2 ASN A 53 -12.617 7.825 5.080 1.00 0.00 N ATOM 0 H ASN A 53 -9.440 10.419 7.596 1.00 0.00 H new ATOM 0 HA ASN A 53 -11.646 10.822 5.649 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -9.604 9.206 5.267 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -10.387 8.199 6.469 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -13.300 7.489 4.401 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -12.771 7.672 6.077 1.00 0.00 H new ATOM 793 N THR A 54 -12.640 10.934 8.196 1.00 0.00 N ATOM 794 CA THR A 54 -13.603 10.794 9.286 1.00 0.00 C ATOM 795 C THR A 54 -14.881 10.063 8.861 1.00 0.00 C ATOM 796 O THR A 54 -15.538 9.431 9.683 1.00 0.00 O ATOM 797 CB THR A 54 -13.920 12.189 9.838 1.00 0.00 C ATOM 798 OG1 THR A 54 -14.180 13.075 8.766 1.00 0.00 O ATOM 799 CG2 THR A 54 -12.726 12.724 10.633 1.00 0.00 C ATOM 0 H THR A 54 -12.344 11.898 8.041 1.00 0.00 H new ATOM 0 HA THR A 54 -13.156 10.175 10.063 1.00 0.00 H new ATOM 0 HB THR A 54 -14.792 12.117 10.488 1.00 0.00 H new ATOM 0 HG1 THR A 54 -14.384 13.966 9.120 1.00 0.00 H new ATOM 0 HG21 THR A 54 -12.962 13.715 11.021 1.00 0.00 H new ATOM 0 HG22 THR A 54 -12.511 12.051 11.463 1.00 0.00 H new ATOM 0 HG23 THR A 54 -11.854 12.787 9.982 1.00 0.00 H new ATOM 807 N ALA A 55 -15.232 10.140 7.574 1.00 0.00 N ATOM 808 CA ALA A 55 -16.368 9.434 6.999 1.00 0.00 C ATOM 809 C ALA A 55 -16.290 7.910 7.178 1.00 0.00 C ATOM 810 O ALA A 55 -17.317 7.243 7.094 1.00 0.00 O ATOM 811 CB ALA A 55 -16.457 9.780 5.512 1.00 0.00 C ATOM 0 H ALA A 55 -14.722 10.706 6.895 1.00 0.00 H new ATOM 0 HA ALA A 55 -17.262 9.759 7.532 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -17.304 9.258 5.067 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -16.592 10.855 5.396 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -15.538 9.474 5.012 1.00 0.00 H new ATOM 817 N GLY A 56 -15.093 7.346 7.376 1.00 0.00 N ATOM 818 CA GLY A 56 -14.921 5.913 7.571 1.00 0.00 C ATOM 819 C GLY A 56 -13.464 5.520 7.340 1.00 0.00 C ATOM 820 O GLY A 56 -12.598 5.915 8.113 1.00 0.00 O ATOM 0 H GLY A 56 -14.221 7.875 7.405 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -15.224 5.637 8.581 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -15.566 5.365 6.884 1.00 0.00 H new ATOM 824 N CYS A 57 -13.191 4.765 6.269 1.00 0.00 N ATOM 825 CA CYS A 57 -11.841 4.306 5.923 1.00 0.00 C ATOM 826 C CYS A 57 -11.379 4.806 4.552 1.00 0.00 C ATOM 827 O CYS A 57 -10.180 4.898 4.299 1.00 0.00 O ATOM 828 CB CYS A 57 -11.750 2.773 5.982 1.00 0.00 C ATOM 829 SG CYS A 57 -11.021 2.052 7.480 1.00 0.00 S ATOM 0 H CYS A 57 -13.907 4.453 5.613 1.00 0.00 H new ATOM 0 HA CYS A 57 -11.171 4.735 6.668 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -12.755 2.369 5.865 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -11.169 2.434 5.125 1.00 0.00 H new ATOM 834 N THR A 58 -12.301 5.088 3.628 1.00 0.00 N ATOM 835 CA THR A 58 -11.981 5.678 2.335 1.00 0.00 C ATOM 836 C THR A 58 -13.197 6.465 1.862 1.00 0.00 C ATOM 837 O THR A 58 -14.280 5.898 1.738 1.00 0.00 O ATOM 838 CB THR A 58 -11.607 4.588 1.324 1.00 0.00 C ATOM 839 OG1 THR A 58 -10.370 3.998 1.665 1.00 0.00 O ATOM 840 CG2 THR A 58 -11.484 5.140 -0.102 1.00 0.00 C ATOM 0 H THR A 58 -13.296 4.910 3.762 1.00 0.00 H new ATOM 0 HA THR A 58 -11.122 6.343 2.426 1.00 0.00 H new ATOM 0 HB THR A 58 -12.410 3.852 1.356 1.00 0.00 H new ATOM 0 HG1 THR A 58 -10.074 4.338 2.535 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.218 4.332 -0.783 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.436 5.573 -0.408 1.00 0.00 H new ATOM 0 HG23 THR A 58 -10.711 5.907 -0.130 1.00 0.00 H new ATOM 848 N SER A 59 -13.007 7.760 1.623 1.00 0.00 N ATOM 849 CA SER A 59 -14.002 8.702 1.134 1.00 0.00 C ATOM 850 C SER A 59 -13.294 10.003 0.729 1.00 0.00 C ATOM 851 O SER A 59 -13.580 10.550 -0.330 1.00 0.00 O ATOM 852 CB SER A 59 -15.073 8.961 2.207 1.00 0.00 C ATOM 853 OG SER A 59 -16.286 9.352 1.599 1.00 0.00 O ATOM 0 H SER A 59 -12.101 8.203 1.775 1.00 0.00 H new ATOM 0 HA SER A 59 -14.509 8.286 0.264 1.00 0.00 H new ATOM 0 HB2 SER A 59 -15.229 8.060 2.801 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.733 9.739 2.891 1.00 0.00 H new ATOM 0 HG SER A 59 -16.962 9.513 2.290 1.00 0.00 H new ATOM 859 N ALA A 60 -12.361 10.466 1.575 1.00 0.00 N ATOM 860 CA ALA A 60 -11.634 11.724 1.438 1.00 0.00 C ATOM 861 C ALA A 60 -11.047 11.913 0.038 1.00 0.00 C ATOM 862 O ALA A 60 -11.558 12.706 -0.750 1.00 0.00 O ATOM 863 CB ALA A 60 -10.531 11.776 2.504 1.00 0.00 C ATOM 0 H ALA A 60 -12.085 9.946 2.408 1.00 0.00 H new ATOM 0 HA ALA A 60 -12.337 12.544 1.585 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -9.980 12.712 2.412 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.980 11.715 3.495 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -9.849 10.938 2.363 1.00 0.00 H new ATOM 869 N GLY A 61 -9.967 11.186 -0.262 1.00 0.00 N ATOM 870 CA GLY A 61 -9.230 11.301 -1.506 1.00 0.00 C ATOM 871 C GLY A 61 -8.947 9.898 -2.048 1.00 0.00 C ATOM 872 O GLY A 61 -8.670 8.987 -1.260 1.00 0.00 O ATOM 0 H GLY A 61 -9.579 10.488 0.373 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -9.804 11.877 -2.232 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -8.295 11.837 -1.342 1.00 0.00 H new ATOM 876 N PRO A 62 -9.058 9.681 -3.368 1.00 0.00 N ATOM 877 CA PRO A 62 -8.829 8.380 -3.978 1.00 0.00 C ATOM 878 C PRO A 62 -7.324 8.062 -4.053 1.00 0.00 C ATOM 879 O PRO A 62 -6.506 8.670 -3.358 1.00 0.00 O ATOM 880 CB PRO A 62 -9.535 8.469 -5.341 1.00 0.00 C ATOM 881 CG PRO A 62 -9.454 9.952 -5.705 1.00 0.00 C ATOM 882 CD PRO A 62 -9.523 10.652 -4.348 1.00 0.00 C ATOM 0 HA PRO A 62 -9.232 7.547 -3.402 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -9.041 7.847 -6.088 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.569 8.130 -5.278 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -8.529 10.187 -6.232 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.276 10.252 -6.355 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -8.898 11.545 -4.338 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -10.541 10.972 -4.126 1.00 0.00 H new ATOM 890 N HIS A 63 -6.957 7.077 -4.887 1.00 0.00 N ATOM 891 CA HIS A 63 -5.565 6.756 -5.189 1.00 0.00 C ATOM 892 C HIS A 63 -4.812 8.025 -5.589 1.00 0.00 C ATOM 893 O HIS A 63 -5.191 8.680 -6.558 1.00 0.00 O ATOM 894 CB HIS A 63 -5.475 5.782 -6.372 1.00 0.00 C ATOM 895 CG HIS A 63 -5.641 4.317 -6.062 1.00 0.00 C ATOM 896 ND1 HIS A 63 -5.009 3.259 -6.723 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.479 3.761 -5.142 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.496 2.102 -6.225 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.370 2.407 -5.255 1.00 0.00 N ATOM 0 H HIS A 63 -7.627 6.480 -5.371 1.00 0.00 H new ATOM 0 HA HIS A 63 -5.130 6.307 -4.296 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -6.235 6.063 -7.101 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -4.506 5.920 -6.852 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.113 4.295 -4.450 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -5.229 1.107 -6.550 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -6.877 1.728 -4.687 1.00 0.00 H new ATOM 907 N PHE A 64 -3.730 8.346 -4.879 1.00 0.00 N ATOM 908 CA PHE A 64 -2.967 9.554 -5.141 1.00 0.00 C ATOM 909 C PHE A 64 -2.240 9.435 -6.488 1.00 0.00 C ATOM 910 O PHE A 64 -1.345 8.601 -6.620 1.00 0.00 O ATOM 911 CB PHE A 64 -1.988 9.751 -3.976 1.00 0.00 C ATOM 912 CG PHE A 64 -1.278 11.091 -3.901 1.00 0.00 C ATOM 913 CD1 PHE A 64 -1.980 12.296 -4.106 1.00 0.00 C ATOM 914 CD2 PHE A 64 0.065 11.137 -3.482 1.00 0.00 C ATOM 915 CE1 PHE A 64 -1.322 13.529 -3.971 1.00 0.00 C ATOM 916 CE2 PHE A 64 0.730 12.370 -3.367 1.00 0.00 C ATOM 917 CZ PHE A 64 0.037 13.568 -3.614 1.00 0.00 C ATOM 0 H PHE A 64 -3.365 7.778 -4.114 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.620 10.424 -5.210 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.534 9.602 -3.044 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.232 8.968 -4.031 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.027 12.271 -4.368 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.587 10.221 -3.248 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.861 14.449 -4.142 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.773 12.397 -3.089 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.548 14.516 -3.530 1.00 0.00 H new ATOM 927 N ASN A 65 -2.619 10.239 -7.491 1.00 0.00 N ATOM 928 CA ASN A 65 -2.048 10.203 -8.842 1.00 0.00 C ATOM 929 C ASN A 65 -1.588 11.572 -9.369 1.00 0.00 C ATOM 930 O ASN A 65 -1.896 11.929 -10.506 1.00 0.00 O ATOM 931 CB ASN A 65 -3.035 9.528 -9.805 1.00 0.00 C ATOM 932 CG ASN A 65 -4.235 10.383 -10.201 1.00 0.00 C ATOM 933 OD1 ASN A 65 -4.687 11.223 -9.431 1.00 0.00 O ATOM 934 ND2 ASN A 65 -4.763 10.168 -11.406 1.00 0.00 N ATOM 0 H ASN A 65 -3.346 10.946 -7.382 1.00 0.00 H new ATOM 0 HA ASN A 65 -1.135 9.611 -8.781 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -2.498 9.241 -10.709 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.398 8.609 -9.344 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.570 10.711 -11.714 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.360 9.460 -12.020 1.00 0.00 H new ATOM 941 N PRO A 66 -0.756 12.313 -8.620 1.00 0.00 N ATOM 942 CA PRO A 66 -0.287 13.636 -9.013 1.00 0.00 C ATOM 943 C PRO A 66 0.556 13.626 -10.297 1.00 0.00 C ATOM 944 O PRO A 66 0.714 14.666 -10.927 1.00 0.00 O ATOM 945 CB PRO A 66 0.509 14.155 -7.811 1.00 0.00 C ATOM 946 CG PRO A 66 1.023 12.874 -7.157 1.00 0.00 C ATOM 947 CD PRO A 66 -0.148 11.916 -7.363 1.00 0.00 C ATOM 0 HA PRO A 66 -1.128 14.284 -9.259 1.00 0.00 H new ATOM 0 HB2 PRO A 66 1.327 14.806 -8.120 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -0.118 14.731 -7.131 1.00 0.00 H new ATOM 0 HG2 PRO A 66 1.934 12.511 -7.632 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.250 13.019 -6.101 1.00 0.00 H new ATOM 0 HD2 PRO A 66 0.193 10.881 -7.401 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.862 11.986 -6.542 1.00 0.00 H new ATOM 955 N LEU A 67 1.071 12.464 -10.722 1.00 0.00 N ATOM 956 CA LEU A 67 1.785 12.340 -11.991 1.00 0.00 C ATOM 957 C LEU A 67 0.826 12.380 -13.185 1.00 0.00 C ATOM 958 O LEU A 67 1.286 12.400 -14.323 1.00 0.00 O ATOM 959 CB LEU A 67 2.630 11.054 -12.030 1.00 0.00 C ATOM 960 CG LEU A 67 3.993 11.204 -11.333 1.00 0.00 C ATOM 961 CD1 LEU A 67 3.925 10.748 -9.875 1.00 0.00 C ATOM 962 CD2 LEU A 67 5.056 10.378 -12.068 1.00 0.00 C ATOM 0 H LEU A 67 1.003 11.592 -10.197 1.00 0.00 H new ATOM 0 HA LEU A 67 2.454 13.197 -12.066 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.073 10.246 -11.555 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.790 10.763 -13.068 1.00 0.00 H new ATOM 0 HG LEU A 67 4.261 12.260 -11.357 1.00 0.00 H new ATOM 0 HD11 LEU A 67 4.904 10.867 -9.411 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.193 11.352 -9.339 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.629 9.700 -9.835 1.00 0.00 H new ATOM 0 HD21 LEU A 67 6.017 10.492 -11.566 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.767 9.327 -12.064 1.00 0.00 H new ATOM 0 HD23 LEU A 67 5.141 10.727 -13.097 1.00 0.00 H new ATOM 974 N SER A 68 -0.489 12.368 -12.946 1.00 0.00 N ATOM 975 CA SER A 68 -1.507 12.408 -13.979 1.00 0.00 C ATOM 976 C SER A 68 -1.429 11.149 -14.846 1.00 0.00 C ATOM 977 O SER A 68 -0.896 11.151 -15.954 1.00 0.00 O ATOM 978 CB SER A 68 -1.418 13.708 -14.792 1.00 0.00 C ATOM 979 OG SER A 68 -2.631 13.922 -15.488 1.00 0.00 O ATOM 0 H SER A 68 -0.876 12.329 -12.003 1.00 0.00 H new ATOM 0 HA SER A 68 -2.492 12.412 -13.513 1.00 0.00 H new ATOM 0 HB2 SER A 68 -1.215 14.549 -14.129 1.00 0.00 H new ATOM 0 HB3 SER A 68 -0.589 13.651 -15.497 1.00 0.00 H new ATOM 0 HG SER A 68 -2.570 14.753 -16.004 1.00 0.00 H new ATOM 985 N ARG A 69 -1.944 10.044 -14.311 1.00 0.00 N ATOM 986 CA ARG A 69 -2.009 8.761 -14.988 1.00 0.00 C ATOM 987 C ARG A 69 -3.153 7.975 -14.362 1.00 0.00 C ATOM 988 O ARG A 69 -3.624 8.320 -13.273 1.00 0.00 O ATOM 989 CB ARG A 69 -0.668 7.998 -14.930 1.00 0.00 C ATOM 990 CG ARG A 69 0.222 8.349 -13.725 1.00 0.00 C ATOM 991 CD ARG A 69 1.635 7.794 -13.909 1.00 0.00 C ATOM 992 NE ARG A 69 2.352 8.517 -14.973 1.00 0.00 N ATOM 993 CZ ARG A 69 3.675 8.456 -15.185 1.00 0.00 C ATOM 994 NH1 ARG A 69 4.439 7.706 -14.384 1.00 0.00 N ATOM 995 NH2 ARG A 69 4.226 9.146 -16.189 1.00 0.00 N ATOM 0 H ARG A 69 -2.337 10.021 -13.370 1.00 0.00 H new ATOM 0 HA ARG A 69 -2.197 8.908 -16.051 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.875 6.928 -14.911 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.112 8.199 -15.846 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.265 9.431 -13.603 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.217 7.943 -12.814 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.187 7.877 -12.973 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.584 6.734 -14.156 1.00 0.00 H new ATOM 0 HE ARG A 69 1.801 9.108 -15.595 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.015 7.184 -13.617 1.00 0.00 H new ATOM 0 HH12 ARG A 69 5.446 7.656 -14.540 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.640 9.720 -16.795 1.00 0.00 H new ATOM 0 HH22 ARG A 69 5.232 9.098 -16.349 1.00 0.00 H new ATOM 1009 N LYS A 70 -3.602 6.937 -15.065 1.00 0.00 N ATOM 1010 CA LYS A 70 -4.536 5.969 -14.547 1.00 0.00 C ATOM 1011 C LYS A 70 -3.775 4.929 -13.716 1.00 0.00 C ATOM 1012 O LYS A 70 -2.547 4.953 -13.599 1.00 0.00 O ATOM 1013 CB LYS A 70 -5.317 5.363 -15.718 1.00 0.00 C ATOM 1014 CG LYS A 70 -6.654 6.082 -15.941 1.00 0.00 C ATOM 1015 CD LYS A 70 -7.394 5.493 -17.153 1.00 0.00 C ATOM 1016 CE LYS A 70 -7.195 6.358 -18.405 1.00 0.00 C ATOM 1017 NZ LYS A 70 -7.857 5.771 -19.588 1.00 0.00 N ATOM 0 H LYS A 70 -3.315 6.752 -16.026 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.264 6.430 -13.880 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.716 5.422 -16.626 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.500 4.306 -15.525 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.275 5.990 -15.050 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -6.478 7.146 -16.098 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -7.033 4.483 -17.346 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -8.458 5.414 -16.929 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -7.593 7.357 -18.224 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -6.129 6.471 -18.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.700 6.384 -20.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.460 4.828 -19.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.878 5.687 -19.408 1.00 0.00 H new ATOM 1031 N HIS A 71 -4.554 4.092 -13.039 1.00 0.00 N ATOM 1032 CA HIS A 71 -4.098 3.113 -12.076 1.00 0.00 C ATOM 1033 C HIS A 71 -3.355 1.989 -12.781 1.00 0.00 C ATOM 1034 O HIS A 71 -3.755 1.578 -13.863 1.00 0.00 O ATOM 1035 CB HIS A 71 -5.326 2.544 -11.366 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.977 1.557 -10.299 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -4.149 1.746 -9.195 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -5.413 0.273 -10.235 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.923 0.546 -8.638 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.809 -0.295 -9.159 1.00 0.00 N ATOM 0 H HIS A 71 -5.567 4.083 -13.157 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.421 3.581 -11.361 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.896 3.362 -10.925 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.974 2.064 -12.100 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -6.107 -0.205 -10.910 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -3.165 0.309 -7.906 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -5.007 -1.230 -8.803 1.00 0.00 H new ATOM 1048 N GLY A 72 -2.327 1.440 -12.140 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.659 0.263 -12.653 1.00 0.00 C ATOM 1050 C GLY A 72 -0.624 -0.209 -11.644 1.00 0.00 C ATOM 1051 O GLY A 72 -0.551 0.335 -10.541 1.00 0.00 O ATOM 0 H GLY A 72 -1.943 1.796 -11.265 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -2.385 -0.527 -12.843 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -1.179 0.490 -13.605 1.00 0.00 H new ATOM 1055 N GLY A 73 0.149 -1.231 -11.997 1.00 0.00 N ATOM 1056 CA GLY A 73 1.111 -1.863 -11.113 1.00 0.00 C ATOM 1057 C GLY A 73 2.520 -1.365 -11.413 1.00 0.00 C ATOM 1058 O GLY A 73 2.783 -0.850 -12.496 1.00 0.00 O ATOM 0 H GLY A 73 0.120 -1.649 -12.927 1.00 0.00 H new ATOM 0 HA2 GLY A 73 0.856 -1.648 -10.075 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.068 -2.945 -11.234 1.00 0.00 H new ATOM 1062 N PRO A 74 3.471 -1.556 -10.489 1.00 0.00 N ATOM 1063 CA PRO A 74 4.856 -1.169 -10.703 1.00 0.00 C ATOM 1064 C PRO A 74 5.463 -1.878 -11.917 1.00 0.00 C ATOM 1065 O PRO A 74 6.373 -1.348 -12.552 1.00 0.00 O ATOM 1066 CB PRO A 74 5.582 -1.498 -9.396 1.00 0.00 C ATOM 1067 CG PRO A 74 4.720 -2.591 -8.762 1.00 0.00 C ATOM 1068 CD PRO A 74 3.306 -2.226 -9.212 1.00 0.00 C ATOM 0 HA PRO A 74 4.948 -0.108 -10.937 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.598 -1.847 -9.580 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.658 -0.623 -8.750 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.009 -3.583 -9.108 1.00 0.00 H new ATOM 0 HG3 PRO A 74 4.809 -2.594 -7.676 1.00 0.00 H new ATOM 0 HD2 PRO A 74 2.683 -3.115 -9.312 1.00 0.00 H new ATOM 0 HD3 PRO A 74 2.818 -1.575 -8.486 1.00 0.00 H new ATOM 1076 N LYS A 75 4.948 -3.064 -12.253 1.00 0.00 N ATOM 1077 CA LYS A 75 5.344 -3.827 -13.416 1.00 0.00 C ATOM 1078 C LYS A 75 4.827 -3.186 -14.715 1.00 0.00 C ATOM 1079 O LYS A 75 5.386 -3.450 -15.781 1.00 0.00 O ATOM 1080 CB LYS A 75 4.824 -5.258 -13.197 1.00 0.00 C ATOM 1081 CG LYS A 75 4.897 -6.074 -14.480 1.00 0.00 C ATOM 1082 CD LYS A 75 4.785 -7.582 -14.210 1.00 0.00 C ATOM 1083 CE LYS A 75 4.786 -8.401 -15.510 1.00 0.00 C ATOM 1084 NZ LYS A 75 6.002 -8.179 -16.321 1.00 0.00 N ATOM 0 H LYS A 75 4.224 -3.524 -11.701 1.00 0.00 H new ATOM 0 HA LYS A 75 6.428 -3.843 -13.533 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.411 -5.746 -12.419 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.793 -5.223 -12.844 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.096 -5.766 -15.152 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.838 -5.866 -14.989 1.00 0.00 H new ATOM 0 HD2 LYS A 75 5.616 -7.900 -13.580 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.869 -7.784 -13.655 1.00 0.00 H new ATOM 0 HE2 LYS A 75 4.704 -9.461 -15.268 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.908 -8.140 -16.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.009 -8.840 -17.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 6.009 -7.202 -16.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 6.845 -8.339 -15.734 1.00 0.00 H new ATOM 1098 N ASP A 76 3.755 -2.397 -14.643 1.00 0.00 N ATOM 1099 CA ASP A 76 3.044 -1.881 -15.800 1.00 0.00 C ATOM 1100 C ASP A 76 3.545 -0.485 -16.137 1.00 0.00 C ATOM 1101 O ASP A 76 4.242 0.169 -15.355 1.00 0.00 O ATOM 1102 CB ASP A 76 1.538 -1.870 -15.526 1.00 0.00 C ATOM 1103 CG ASP A 76 1.020 -3.195 -15.000 1.00 0.00 C ATOM 1104 OD1 ASP A 76 1.352 -4.238 -15.605 1.00 0.00 O ATOM 1105 OD2 ASP A 76 0.318 -3.123 -13.969 1.00 0.00 O ATOM 0 H ASP A 76 3.352 -2.095 -13.756 1.00 0.00 H new ATOM 0 HA ASP A 76 3.231 -2.528 -16.657 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.312 -1.086 -14.804 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.009 -1.619 -16.445 1.00 0.00 H new ATOM 1110 N GLU A 77 3.164 -0.028 -17.329 1.00 0.00 N ATOM 1111 CA GLU A 77 3.442 1.326 -17.763 1.00 0.00 C ATOM 1112 C GLU A 77 2.639 2.294 -16.886 1.00 0.00 C ATOM 1113 O GLU A 77 3.168 3.293 -16.396 1.00 0.00 O ATOM 1114 CB GLU A 77 3.096 1.483 -19.253 1.00 0.00 C ATOM 1115 CG GLU A 77 4.046 2.490 -19.911 1.00 0.00 C ATOM 1116 CD GLU A 77 3.481 3.036 -21.215 1.00 0.00 C ATOM 1117 OE1 GLU A 77 2.984 2.209 -22.007 1.00 0.00 O ATOM 1118 OE2 GLU A 77 3.557 4.272 -21.385 1.00 0.00 O ATOM 0 H GLU A 77 2.656 -0.589 -18.013 1.00 0.00 H new ATOM 0 HA GLU A 77 4.502 1.553 -17.653 1.00 0.00 H new ATOM 0 HB2 GLU A 77 3.171 0.519 -19.755 1.00 0.00 H new ATOM 0 HB3 GLU A 77 2.065 1.819 -19.361 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.234 3.315 -19.223 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.006 2.011 -20.104 1.00 0.00 H new ATOM 1125 N GLU A 78 1.362 1.959 -16.672 1.00 0.00 N ATOM 1126 CA GLU A 78 0.469 2.736 -15.819 1.00 0.00 C ATOM 1127 C GLU A 78 0.731 2.347 -14.366 1.00 0.00 C ATOM 1128 O GLU A 78 1.099 1.213 -14.081 1.00 0.00 O ATOM 1129 CB GLU A 78 -1.002 2.504 -16.196 1.00 0.00 C ATOM 1130 CG GLU A 78 -1.359 3.180 -17.530 1.00 0.00 C ATOM 1131 CD GLU A 78 -2.853 3.120 -17.840 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -3.641 3.199 -16.875 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -3.193 3.037 -19.040 1.00 0.00 O ATOM 0 H GLU A 78 0.922 1.139 -17.089 1.00 0.00 H new ATOM 0 HA GLU A 78 0.666 3.799 -15.957 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -1.195 1.434 -16.267 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.646 2.893 -15.407 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.040 4.222 -17.502 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.805 2.699 -18.336 1.00 0.00 H new ATOM 1140 N ARG A 79 0.558 3.304 -13.457 1.00 0.00 N ATOM 1141 CA ARG A 79 0.828 3.211 -12.030 1.00 0.00 C ATOM 1142 C ARG A 79 0.811 4.644 -11.497 1.00 0.00 C ATOM 1143 O ARG A 79 1.535 5.506 -11.994 1.00 0.00 O ATOM 1144 CB ARG A 79 2.163 2.531 -11.692 1.00 0.00 C ATOM 1145 CG ARG A 79 3.320 2.961 -12.601 1.00 0.00 C ATOM 1146 CD ARG A 79 4.645 2.971 -11.831 1.00 0.00 C ATOM 1147 NE ARG A 79 5.699 3.672 -12.573 1.00 0.00 N ATOM 1148 CZ ARG A 79 6.224 3.293 -13.750 1.00 0.00 C ATOM 1149 NH1 ARG A 79 5.861 2.147 -14.335 1.00 0.00 N ATOM 1150 NH2 ARG A 79 7.122 4.089 -14.342 1.00 0.00 N ATOM 0 H ARG A 79 0.202 4.224 -13.718 1.00 0.00 H new ATOM 0 HA ARG A 79 0.069 2.581 -11.565 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.423 2.754 -10.657 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.039 1.450 -11.763 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.393 2.281 -13.450 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.121 3.954 -13.004 1.00 0.00 H new ATOM 0 HD2 ARG A 79 4.500 3.452 -10.864 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.959 1.946 -11.634 1.00 0.00 H new ATOM 0 HE ARG A 79 6.067 4.527 -12.156 1.00 0.00 H new ATOM 0 HH11 ARG A 79 5.173 1.542 -13.887 1.00 0.00 H new ATOM 0 HH12 ARG A 79 6.272 1.878 -15.229 1.00 0.00 H new ATOM 0 HH21 ARG A 79 7.396 4.966 -13.899 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.532 3.819 -15.236 1.00 0.00 H new ATOM 1164 N HIS A 80 -0.033 4.917 -10.510 1.00 0.00 N ATOM 1165 CA HIS A 80 -0.046 6.187 -9.802 1.00 0.00 C ATOM 1166 C HIS A 80 1.240 6.361 -8.973 1.00 0.00 C ATOM 1167 O HIS A 80 2.112 5.493 -9.000 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.296 6.227 -8.925 1.00 0.00 C ATOM 1169 CG HIS A 80 -2.599 5.941 -9.634 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.671 5.182 -9.163 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -3.023 6.520 -10.794 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -4.751 5.525 -9.883 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -4.355 6.261 -10.921 1.00 0.00 N ATOM 0 H HIS A 80 -0.734 4.255 -10.177 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.075 7.016 -10.509 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.176 5.504 -8.118 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.363 7.212 -8.463 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.414 7.082 -11.486 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.771 5.250 -9.658 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -4.951 6.578 -11.685 1.00 0.00 H new ATOM 1181 N VAL A 81 1.382 7.462 -8.220 1.00 0.00 N ATOM 1182 CA VAL A 81 2.623 7.693 -7.478 1.00 0.00 C ATOM 1183 C VAL A 81 2.798 6.631 -6.391 1.00 0.00 C ATOM 1184 O VAL A 81 3.848 6.003 -6.300 1.00 0.00 O ATOM 1185 CB VAL A 81 2.727 9.137 -6.945 1.00 0.00 C ATOM 1186 CG1 VAL A 81 1.891 9.435 -5.696 1.00 0.00 C ATOM 1187 CG2 VAL A 81 4.185 9.474 -6.609 1.00 0.00 C ATOM 0 H VAL A 81 0.672 8.187 -8.112 1.00 0.00 H new ATOM 0 HA VAL A 81 3.460 7.587 -8.168 1.00 0.00 H new ATOM 0 HB VAL A 81 2.330 9.750 -7.754 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.034 10.475 -5.402 1.00 0.00 H new ATOM 0 HG12 VAL A 81 0.837 9.261 -5.913 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.207 8.782 -4.883 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.245 10.496 -6.234 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.551 8.786 -5.847 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.796 9.381 -7.507 1.00 0.00 H new ATOM 1197 N GLY A 82 1.757 6.417 -5.581 1.00 0.00 N ATOM 1198 CA GLY A 82 1.798 5.462 -4.484 1.00 0.00 C ATOM 1199 C GLY A 82 0.976 4.224 -4.816 1.00 0.00 C ATOM 1200 O GLY A 82 0.130 3.821 -4.016 1.00 0.00 O ATOM 0 H GLY A 82 0.865 6.904 -5.672 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.830 5.176 -4.283 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.414 5.927 -3.576 1.00 0.00 H new ATOM 1204 N ASP A 83 1.211 3.651 -6.001 1.00 0.00 N ATOM 1205 CA ASP A 83 0.506 2.492 -6.535 1.00 0.00 C ATOM 1206 C ASP A 83 1.387 1.259 -6.376 1.00 0.00 C ATOM 1207 O ASP A 83 1.927 0.711 -7.337 1.00 0.00 O ATOM 1208 CB ASP A 83 0.147 2.789 -8.004 1.00 0.00 C ATOM 1209 CG ASP A 83 -1.337 2.783 -8.293 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -2.136 2.736 -7.335 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.675 2.912 -9.487 1.00 0.00 O ATOM 0 H ASP A 83 1.928 4.000 -6.637 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.420 2.293 -5.996 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.555 3.763 -8.276 1.00 0.00 H new ATOM 0 HB3 ASP A 83 0.633 2.050 -8.641 1.00 0.00 H new ATOM 1216 N LEU A 84 1.533 0.806 -5.135 1.00 0.00 N ATOM 1217 CA LEU A 84 2.460 -0.258 -4.790 1.00 0.00 C ATOM 1218 C LEU A 84 1.773 -1.610 -4.999 1.00 0.00 C ATOM 1219 O LEU A 84 1.785 -2.459 -4.110 1.00 0.00 O ATOM 1220 CB LEU A 84 2.950 -0.030 -3.352 1.00 0.00 C ATOM 1221 CG LEU A 84 3.489 1.396 -3.125 1.00 0.00 C ATOM 1222 CD1 LEU A 84 3.991 1.534 -1.685 1.00 0.00 C ATOM 1223 CD2 LEU A 84 4.616 1.749 -4.104 1.00 0.00 C ATOM 0 H LEU A 84 1.008 1.170 -4.340 1.00 0.00 H new ATOM 0 HA LEU A 84 3.340 -0.255 -5.434 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.130 -0.218 -2.659 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.734 -0.751 -3.121 1.00 0.00 H new ATOM 0 HG LEU A 84 2.669 2.092 -3.303 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.372 2.543 -1.527 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.170 1.344 -0.994 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.789 0.813 -1.507 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.965 2.763 -3.907 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.442 1.050 -3.975 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.243 1.686 -5.126 1.00 0.00 H new ATOM 1235 N GLY A 85 1.179 -1.779 -6.190 1.00 0.00 N ATOM 1236 CA GLY A 85 0.211 -2.811 -6.541 1.00 0.00 C ATOM 1237 C GLY A 85 -0.481 -3.448 -5.330 1.00 0.00 C ATOM 1238 O GLY A 85 -1.161 -2.779 -4.551 1.00 0.00 O ATOM 0 H GLY A 85 1.378 -1.159 -6.975 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.546 -2.378 -7.195 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.716 -3.591 -7.111 1.00 0.00 H new ATOM 1242 N ASN A 86 -0.260 -4.755 -5.172 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.849 -5.593 -4.140 1.00 0.00 C ATOM 1244 C ASN A 86 0.242 -6.290 -3.344 1.00 0.00 C ATOM 1245 O ASN A 86 1.320 -6.554 -3.878 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.786 -6.657 -4.742 1.00 0.00 C ATOM 1247 CG ASN A 86 -1.292 -7.257 -6.058 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -2.078 -7.492 -6.968 1.00 0.00 O ATOM 1249 ND2 ASN A 86 0.005 -7.539 -6.186 1.00 0.00 N ATOM 0 H ASN A 86 0.363 -5.275 -5.790 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.432 -4.944 -3.487 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -1.918 -7.460 -4.017 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.767 -6.210 -4.905 1.00 0.00 H new ATOM 0 HD21 ASN A 86 0.354 -7.955 -7.049 1.00 0.00 H new ATOM 0 HD22 ASN A 86 0.649 -7.338 -5.421 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.078 -6.638 -2.095 1.00 0.00 N ATOM 1257 CA VAL A 87 0.819 -7.358 -1.198 1.00 0.00 C ATOM 1258 C VAL A 87 0.573 -8.860 -1.346 1.00 0.00 C ATOM 1259 O VAL A 87 0.023 -9.287 -2.355 1.00 0.00 O ATOM 1260 CB VAL A 87 0.695 -6.824 0.243 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.132 -5.356 0.297 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.722 -6.959 0.815 1.00 0.00 C ATOM 0 H VAL A 87 -0.982 -6.422 -1.676 1.00 0.00 H new ATOM 0 HA VAL A 87 1.860 -7.185 -1.469 1.00 0.00 H new ATOM 0 HB VAL A 87 1.350 -7.438 0.861 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.041 -4.987 1.319 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.169 -5.273 -0.028 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.497 -4.763 -0.361 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.743 -6.566 1.831 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.420 -6.398 0.194 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.011 -8.010 0.827 1.00 0.00 H new ATOM 1272 N THR A 88 0.962 -9.692 -0.382 1.00 0.00 N ATOM 1273 CA THR A 88 0.688 -11.122 -0.431 1.00 0.00 C ATOM 1274 C THR A 88 0.523 -11.595 1.007 1.00 0.00 C ATOM 1275 O THR A 88 1.484 -11.553 1.769 1.00 0.00 O ATOM 1276 CB THR A 88 1.818 -11.855 -1.172 1.00 0.00 C ATOM 1277 OG1 THR A 88 2.087 -11.201 -2.398 1.00 0.00 O ATOM 1278 CG2 THR A 88 1.423 -13.303 -1.484 1.00 0.00 C ATOM 0 H THR A 88 1.473 -9.394 0.449 1.00 0.00 H new ATOM 0 HA THR A 88 -0.224 -11.339 -0.986 1.00 0.00 H new ATOM 0 HB THR A 88 2.697 -11.849 -0.528 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.809 -11.670 -2.867 1.00 0.00 H new ATOM 0 HG21 THR A 88 2.240 -13.798 -2.008 1.00 0.00 H new ATOM 0 HG22 THR A 88 1.215 -13.832 -0.554 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.532 -13.310 -2.112 1.00 0.00 H new ATOM 1286 N ALA A 89 -0.698 -11.972 1.392 1.00 0.00 N ATOM 1287 CA ALA A 89 -0.975 -12.490 2.719 1.00 0.00 C ATOM 1288 C ALA A 89 -0.688 -13.986 2.788 1.00 0.00 C ATOM 1289 O ALA A 89 -0.931 -14.715 1.824 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.404 -12.159 3.139 1.00 0.00 C ATOM 0 H ALA A 89 -1.518 -11.924 0.787 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.308 -12.003 3.430 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -2.591 -12.556 4.137 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.539 -11.077 3.148 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.104 -12.607 2.433 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.175 -14.410 3.944 1.00 0.00 N ATOM 1297 CA ASP A 90 0.119 -15.795 4.276 1.00 0.00 C ATOM 1298 C ASP A 90 -1.172 -16.546 4.595 1.00 0.00 C ATOM 1299 O ASP A 90 -2.249 -15.952 4.665 1.00 0.00 O ATOM 1300 CB ASP A 90 1.124 -15.837 5.442 1.00 0.00 C ATOM 1301 CG ASP A 90 2.030 -17.063 5.375 1.00 0.00 C ATOM 1302 OD1 ASP A 90 1.488 -18.182 5.512 1.00 0.00 O ATOM 1303 OD2 ASP A 90 3.244 -16.875 5.162 1.00 0.00 O ATOM 0 H ASP A 90 0.055 -13.767 4.702 1.00 0.00 H new ATOM 0 HA ASP A 90 0.576 -16.296 3.423 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.735 -14.934 5.426 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.582 -15.839 6.388 1.00 0.00 H new ATOM 1308 N LYS A 91 -1.055 -17.842 4.878 1.00 0.00 N ATOM 1309 CA LYS A 91 -2.131 -18.707 5.309 1.00 0.00 C ATOM 1310 C LYS A 91 -2.742 -18.230 6.631 1.00 0.00 C ATOM 1311 O LYS A 91 -3.839 -18.638 6.998 1.00 0.00 O ATOM 1312 CB LYS A 91 -1.587 -20.140 5.418 1.00 0.00 C ATOM 1313 CG LYS A 91 -0.693 -20.418 6.645 1.00 0.00 C ATOM 1314 CD LYS A 91 -0.383 -21.916 6.779 1.00 0.00 C ATOM 1315 CE LYS A 91 0.766 -22.377 5.867 1.00 0.00 C ATOM 1316 NZ LYS A 91 2.073 -22.327 6.554 1.00 0.00 N ATOM 0 H LYS A 91 -0.163 -18.332 4.807 1.00 0.00 H new ATOM 0 HA LYS A 91 -2.937 -18.680 4.576 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -2.431 -20.830 5.441 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -1.017 -20.363 4.516 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.238 -19.858 6.554 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.191 -20.065 7.548 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.128 -22.137 7.815 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.279 -22.489 6.542 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.573 -23.395 5.528 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.799 -21.746 4.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.819 -22.646 5.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.270 -21.351 6.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 2.051 -22.949 7.387 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.001 -17.387 7.358 1.00 0.00 N ATOM 1331 CA ASP A 92 -2.416 -16.828 8.639 1.00 0.00 C ATOM 1332 C ASP A 92 -3.134 -15.492 8.415 1.00 0.00 C ATOM 1333 O ASP A 92 -3.556 -14.836 9.366 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.178 -16.661 9.539 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.343 -17.356 10.884 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -1.413 -18.604 10.868 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.353 -16.629 11.903 1.00 0.00 O ATOM 0 H ASP A 92 -1.078 -17.071 7.062 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.116 -17.501 9.135 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.304 -17.065 9.029 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -0.990 -15.600 9.702 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.240 -15.053 7.156 1.00 0.00 N ATOM 1343 CA GLY A 93 -3.845 -13.781 6.819 1.00 0.00 C ATOM 1344 C GLY A 93 -2.961 -12.612 7.251 1.00 0.00 C ATOM 1345 O GLY A 93 -3.453 -11.559 7.670 1.00 0.00 O ATOM 0 H GLY A 93 -2.905 -15.578 6.348 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.017 -13.731 5.744 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.819 -13.700 7.301 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.645 -12.802 7.130 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.618 -11.832 7.469 1.00 0.00 C ATOM 1351 C VAL A 94 0.107 -11.478 6.180 1.00 0.00 C ATOM 1352 O VAL A 94 0.763 -12.341 5.607 1.00 0.00 O ATOM 1353 CB VAL A 94 0.346 -12.438 8.502 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.575 -11.536 8.728 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.404 -12.681 9.816 1.00 0.00 C ATOM 0 H VAL A 94 -1.256 -13.676 6.777 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.048 -10.934 7.912 1.00 0.00 H new ATOM 0 HB VAL A 94 0.715 -13.389 8.117 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.234 -11.996 9.464 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.112 -11.411 7.788 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.249 -10.562 9.092 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.278 -13.111 10.550 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.794 -11.735 10.193 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.230 -13.370 9.641 1.00 0.00 H new ATOM 1365 N ALA A 95 -0.034 -10.238 5.703 1.00 0.00 N ATOM 1366 CA ALA A 95 0.762 -9.738 4.595 1.00 0.00 C ATOM 1367 C ALA A 95 1.932 -8.970 5.180 1.00 0.00 C ATOM 1368 O ALA A 95 1.738 -7.884 5.730 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.076 -8.879 3.644 1.00 0.00 C ATOM 0 H ALA A 95 -0.700 -9.562 6.076 1.00 0.00 H new ATOM 0 HA ALA A 95 1.133 -10.566 3.991 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.552 -8.522 2.827 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -0.893 -9.476 3.239 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.484 -8.027 4.187 1.00 0.00 H new ATOM 1375 N ASP A 96 3.126 -9.555 5.080 1.00 0.00 N ATOM 1376 CA ASP A 96 4.362 -8.909 5.461 1.00 0.00 C ATOM 1377 C ASP A 96 4.829 -8.073 4.273 1.00 0.00 C ATOM 1378 O ASP A 96 5.174 -8.614 3.224 1.00 0.00 O ATOM 1379 CB ASP A 96 5.393 -9.941 5.926 1.00 0.00 C ATOM 1380 CG ASP A 96 4.968 -10.613 7.228 1.00 0.00 C ATOM 1381 OD1 ASP A 96 4.671 -9.873 8.192 1.00 0.00 O ATOM 1382 OD2 ASP A 96 4.936 -11.862 7.236 1.00 0.00 O ATOM 0 H ASP A 96 3.253 -10.503 4.726 1.00 0.00 H new ATOM 0 HA ASP A 96 4.218 -8.247 6.315 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.526 -10.697 5.152 1.00 0.00 H new ATOM 0 HB3 ASP A 96 6.358 -9.454 6.065 1.00 0.00 H new ATOM 1387 N VAL A 97 4.785 -6.750 4.415 1.00 0.00 N ATOM 1388 CA VAL A 97 5.220 -5.827 3.380 1.00 0.00 C ATOM 1389 C VAL A 97 6.723 -5.680 3.542 1.00 0.00 C ATOM 1390 O VAL A 97 7.212 -5.718 4.667 1.00 0.00 O ATOM 1391 CB VAL A 97 4.507 -4.468 3.513 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.624 -3.672 2.207 1.00 0.00 C ATOM 1393 CG2 VAL A 97 3.032 -4.640 3.884 1.00 0.00 C ATOM 0 H VAL A 97 4.444 -6.290 5.259 1.00 0.00 H new ATOM 0 HA VAL A 97 4.971 -6.204 2.388 1.00 0.00 H new ATOM 0 HB VAL A 97 4.997 -3.918 4.316 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.115 -2.714 2.318 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.676 -3.500 1.979 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.164 -4.235 1.395 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.562 -3.660 3.969 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.527 -5.219 3.110 1.00 0.00 H new ATOM 0 HG23 VAL A 97 2.955 -5.163 4.837 1.00 0.00 H new ATOM 1403 N SER A 98 7.440 -5.485 2.437 1.00 0.00 N ATOM 1404 CA SER A 98 8.857 -5.162 2.429 1.00 0.00 C ATOM 1405 C SER A 98 9.195 -4.734 1.004 1.00 0.00 C ATOM 1406 O SER A 98 9.308 -5.585 0.126 1.00 0.00 O ATOM 1407 CB SER A 98 9.711 -6.352 2.912 1.00 0.00 C ATOM 1408 OG SER A 98 10.795 -5.896 3.701 1.00 0.00 O ATOM 0 H SER A 98 7.038 -5.550 1.502 1.00 0.00 H new ATOM 0 HA SER A 98 9.083 -4.355 3.125 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.094 -7.038 3.492 1.00 0.00 H new ATOM 0 HB3 SER A 98 10.087 -6.909 2.054 1.00 0.00 H new ATOM 0 HG SER A 98 11.326 -6.663 4.001 1.00 0.00 H new ATOM 1414 N ILE A 99 9.292 -3.427 0.753 1.00 0.00 N ATOM 1415 CA ILE A 99 9.629 -2.907 -0.564 1.00 0.00 C ATOM 1416 C ILE A 99 10.381 -1.591 -0.394 1.00 0.00 C ATOM 1417 O ILE A 99 10.288 -0.965 0.662 1.00 0.00 O ATOM 1418 CB ILE A 99 8.361 -2.788 -1.442 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.703 -3.246 -2.866 1.00 0.00 C ATOM 1420 CG2 ILE A 99 7.753 -1.376 -1.454 1.00 0.00 C ATOM 1421 CD1 ILE A 99 7.532 -3.114 -3.844 1.00 0.00 C ATOM 0 H ILE A 99 9.139 -2.705 1.457 1.00 0.00 H new ATOM 0 HA ILE A 99 10.288 -3.595 -1.094 1.00 0.00 H new ATOM 0 HB ILE A 99 7.596 -3.430 -1.006 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.544 -2.660 -3.236 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.028 -4.286 -2.837 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.867 -1.367 -2.089 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.475 -1.091 -0.439 1.00 0.00 H new ATOM 0 HG23 ILE A 99 8.485 -0.668 -1.842 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.843 -3.455 -4.832 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.697 -3.722 -3.496 1.00 0.00 H new ATOM 0 HD13 ILE A 99 7.222 -2.071 -3.901 1.00 0.00 H new ATOM 1433 N GLU A 100 11.124 -1.172 -1.419 1.00 0.00 N ATOM 1434 CA GLU A 100 11.843 0.082 -1.407 1.00 0.00 C ATOM 1435 C GLU A 100 11.432 0.910 -2.616 1.00 0.00 C ATOM 1436 O GLU A 100 11.274 0.363 -3.708 1.00 0.00 O ATOM 1437 CB GLU A 100 13.350 -0.174 -1.329 1.00 0.00 C ATOM 1438 CG GLU A 100 13.971 -1.129 -2.352 1.00 0.00 C ATOM 1439 CD GLU A 100 15.455 -1.206 -2.040 1.00 0.00 C ATOM 1440 OE1 GLU A 100 16.164 -0.232 -2.379 1.00 0.00 O ATOM 1441 OE2 GLU A 100 15.858 -2.105 -1.275 1.00 0.00 O ATOM 0 H GLU A 100 11.238 -1.704 -2.282 1.00 0.00 H new ATOM 0 HA GLU A 100 11.587 0.661 -0.520 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.857 0.787 -1.419 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.572 -0.560 -0.334 1.00 0.00 H new ATOM 0 HG2 GLU A 100 13.511 -2.115 -2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.808 -0.767 -3.367 1.00 0.00 H new ATOM 1448 N ASP A 101 11.229 2.212 -2.397 1.00 0.00 N ATOM 1449 CA ASP A 101 10.795 3.156 -3.413 1.00 0.00 C ATOM 1450 C ASP A 101 11.808 4.292 -3.500 1.00 0.00 C ATOM 1451 O ASP A 101 12.453 4.644 -2.513 1.00 0.00 O ATOM 1452 CB ASP A 101 9.410 3.709 -3.058 1.00 0.00 C ATOM 1453 CG ASP A 101 8.283 2.908 -3.684 1.00 0.00 C ATOM 1454 OD1 ASP A 101 8.068 3.116 -4.898 1.00 0.00 O ATOM 1455 OD2 ASP A 101 7.647 2.135 -2.936 1.00 0.00 O ATOM 0 H ASP A 101 11.367 2.643 -1.483 1.00 0.00 H new ATOM 0 HA ASP A 101 10.729 2.652 -4.377 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.291 3.711 -1.975 1.00 0.00 H new ATOM 0 HB3 ASP A 101 9.341 4.745 -3.388 1.00 0.00 H new ATOM 1460 N SER A 102 11.913 4.880 -4.693 1.00 0.00 N ATOM 1461 CA SER A 102 12.826 5.969 -5.004 1.00 0.00 C ATOM 1462 C SER A 102 12.091 7.301 -5.151 1.00 0.00 C ATOM 1463 O SER A 102 12.732 8.322 -5.380 1.00 0.00 O ATOM 1464 CB SER A 102 13.588 5.640 -6.292 1.00 0.00 C ATOM 1465 OG SER A 102 14.149 4.343 -6.205 1.00 0.00 O ATOM 0 H SER A 102 11.344 4.598 -5.492 1.00 0.00 H new ATOM 0 HA SER A 102 13.526 6.074 -4.175 1.00 0.00 H new ATOM 0 HB2 SER A 102 12.915 5.697 -7.147 1.00 0.00 H new ATOM 0 HB3 SER A 102 14.375 6.376 -6.456 1.00 0.00 H new ATOM 0 HG SER A 102 14.633 4.140 -7.033 1.00 0.00 H new ATOM 1471 N VAL A 103 10.754 7.286 -5.080 1.00 0.00 N ATOM 1472 CA VAL A 103 9.919 8.459 -5.290 1.00 0.00 C ATOM 1473 C VAL A 103 9.420 8.952 -3.938 1.00 0.00 C ATOM 1474 O VAL A 103 9.804 10.030 -3.491 1.00 0.00 O ATOM 1475 CB VAL A 103 8.778 8.134 -6.270 1.00 0.00 C ATOM 1476 CG1 VAL A 103 7.795 9.308 -6.379 1.00 0.00 C ATOM 1477 CG2 VAL A 103 9.345 7.844 -7.668 1.00 0.00 C ATOM 0 H VAL A 103 10.221 6.442 -4.871 1.00 0.00 H new ATOM 0 HA VAL A 103 10.494 9.264 -5.748 1.00 0.00 H new ATOM 0 HB VAL A 103 8.255 7.258 -5.887 1.00 0.00 H new ATOM 0 HG11 VAL A 103 6.999 9.052 -7.078 1.00 0.00 H new ATOM 0 HG12 VAL A 103 7.365 9.515 -5.399 1.00 0.00 H new ATOM 0 HG13 VAL A 103 8.322 10.192 -6.738 1.00 0.00 H new ATOM 0 HG21 VAL A 103 8.528 7.615 -8.352 1.00 0.00 H new ATOM 0 HG22 VAL A 103 9.887 8.718 -8.029 1.00 0.00 H new ATOM 0 HG23 VAL A 103 10.023 6.992 -7.616 1.00 0.00 H new ATOM 1487 N ILE A 104 8.543 8.195 -3.277 1.00 0.00 N ATOM 1488 CA ILE A 104 8.085 8.551 -1.953 1.00 0.00 C ATOM 1489 C ILE A 104 9.233 8.342 -0.959 1.00 0.00 C ATOM 1490 O ILE A 104 10.152 7.574 -1.242 1.00 0.00 O ATOM 1491 CB ILE A 104 6.783 7.798 -1.646 1.00 0.00 C ATOM 1492 CG1 ILE A 104 6.799 6.261 -1.732 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.671 8.314 -2.574 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.730 5.593 -0.722 1.00 0.00 C ATOM 0 H ILE A 104 8.141 7.333 -3.646 1.00 0.00 H new ATOM 0 HA ILE A 104 7.822 9.606 -1.871 1.00 0.00 H new ATOM 0 HB ILE A 104 6.617 8.010 -0.590 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.786 5.888 -1.579 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.099 5.966 -2.738 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.743 7.783 -2.361 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.524 9.381 -2.408 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.956 8.144 -3.612 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.685 4.511 -0.846 1.00 0.00 H new ATOM 0 HD12 ILE A 104 8.752 5.935 -0.887 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.418 5.855 0.289 1.00 0.00 H new ATOM 1506 N SER A 105 9.251 9.082 0.155 1.00 0.00 N ATOM 1507 CA SER A 105 10.409 9.223 1.025 1.00 0.00 C ATOM 1508 C SER A 105 9.986 10.128 2.183 1.00 0.00 C ATOM 1509 O SER A 105 8.797 10.399 2.326 1.00 0.00 O ATOM 1510 CB SER A 105 11.599 9.769 0.208 1.00 0.00 C ATOM 1511 OG SER A 105 12.368 8.694 -0.289 1.00 0.00 O ATOM 0 H SER A 105 8.440 9.609 0.478 1.00 0.00 H new ATOM 0 HA SER A 105 10.746 8.273 1.439 1.00 0.00 H new ATOM 0 HB2 SER A 105 11.236 10.381 -0.618 1.00 0.00 H new ATOM 0 HB3 SER A 105 12.217 10.413 0.834 1.00 0.00 H new ATOM 0 HG SER A 105 11.811 8.134 -0.870 1.00 0.00 H new ATOM 1517 N LEU A 106 10.949 10.590 2.983 1.00 0.00 N ATOM 1518 CA LEU A 106 10.856 11.650 3.977 1.00 0.00 C ATOM 1519 C LEU A 106 11.274 12.991 3.346 1.00 0.00 C ATOM 1520 O LEU A 106 11.365 13.994 4.049 1.00 0.00 O ATOM 1521 CB LEU A 106 11.745 11.304 5.187 1.00 0.00 C ATOM 1522 CG LEU A 106 11.531 9.877 5.730 1.00 0.00 C ATOM 1523 CD1 LEU A 106 12.608 9.527 6.756 1.00 0.00 C ATOM 1524 CD2 LEU A 106 10.169 9.697 6.396 1.00 0.00 C ATOM 0 H LEU A 106 11.889 10.197 2.946 1.00 0.00 H new ATOM 0 HA LEU A 106 9.827 11.742 4.324 1.00 0.00 H new ATOM 0 HB2 LEU A 106 12.791 11.421 4.903 1.00 0.00 H new ATOM 0 HB3 LEU A 106 11.550 12.020 5.986 1.00 0.00 H new ATOM 0 HG LEU A 106 11.586 9.215 4.866 1.00 0.00 H new ATOM 0 HD11 LEU A 106 12.441 8.516 7.128 1.00 0.00 H new ATOM 0 HD12 LEU A 106 13.590 9.583 6.286 1.00 0.00 H new ATOM 0 HD13 LEU A 106 12.562 10.232 7.586 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.074 8.674 6.759 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.079 10.389 7.233 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.380 9.900 5.672 1.00 0.00 H new ATOM 1536 N SER A 107 11.530 13.012 2.027 1.00 0.00 N ATOM 1537 CA SER A 107 11.829 14.228 1.269 1.00 0.00 C ATOM 1538 C SER A 107 10.659 15.216 1.319 1.00 0.00 C ATOM 1539 O SER A 107 9.593 14.866 1.809 1.00 0.00 O ATOM 1540 CB SER A 107 12.193 13.857 -0.179 1.00 0.00 C ATOM 1541 OG SER A 107 13.469 13.263 -0.263 1.00 0.00 O ATOM 0 H SER A 107 11.534 12.169 1.453 1.00 0.00 H new ATOM 0 HA SER A 107 12.684 14.727 1.726 1.00 0.00 H new ATOM 0 HB2 SER A 107 11.446 13.171 -0.577 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.167 14.752 -0.801 1.00 0.00 H new ATOM 0 HG SER A 107 13.783 13.035 0.637 1.00 0.00 H new ATOM 1547 N GLY A 108 10.852 16.441 0.812 1.00 0.00 N ATOM 1548 CA GLY A 108 9.888 17.536 0.918 1.00 0.00 C ATOM 1549 C GLY A 108 8.473 17.156 0.469 1.00 0.00 C ATOM 1550 O GLY A 108 7.663 16.703 1.279 1.00 0.00 O ATOM 0 H GLY A 108 11.700 16.700 0.308 1.00 0.00 H new ATOM 0 HA2 GLY A 108 9.852 17.878 1.952 1.00 0.00 H new ATOM 0 HA3 GLY A 108 10.237 18.375 0.317 1.00 0.00 H new ATOM 1554 N ASP A 109 8.152 17.329 -0.818 1.00 0.00 N ATOM 1555 CA ASP A 109 6.824 16.991 -1.337 1.00 0.00 C ATOM 1556 C ASP A 109 6.758 15.494 -1.646 1.00 0.00 C ATOM 1557 O ASP A 109 6.545 15.062 -2.776 1.00 0.00 O ATOM 1558 CB ASP A 109 6.483 17.855 -2.557 1.00 0.00 C ATOM 1559 CG ASP A 109 5.043 17.622 -3.012 1.00 0.00 C ATOM 1560 OD1 ASP A 109 4.211 17.283 -2.140 1.00 0.00 O ATOM 1561 OD2 ASP A 109 4.795 17.816 -4.219 1.00 0.00 O ATOM 0 H ASP A 109 8.794 17.701 -1.518 1.00 0.00 H new ATOM 0 HA ASP A 109 6.070 17.208 -0.580 1.00 0.00 H new ATOM 0 HB2 ASP A 109 6.624 18.908 -2.312 1.00 0.00 H new ATOM 0 HB3 ASP A 109 7.167 17.623 -3.373 1.00 0.00 H new ATOM 1566 N HIS A 110 7.039 14.699 -0.616 1.00 0.00 N ATOM 1567 CA HIS A 110 7.246 13.261 -0.704 1.00 0.00 C ATOM 1568 C HIS A 110 6.924 12.620 0.637 1.00 0.00 C ATOM 1569 O HIS A 110 6.281 11.573 0.648 1.00 0.00 O ATOM 1570 CB HIS A 110 8.694 12.946 -1.085 1.00 0.00 C ATOM 1571 CG HIS A 110 9.052 13.321 -2.499 1.00 0.00 C ATOM 1572 ND1 HIS A 110 8.864 12.530 -3.607 1.00 0.00 N ATOM 1573 CD2 HIS A 110 9.601 14.501 -2.924 1.00 0.00 C ATOM 1574 CE1 HIS A 110 9.283 13.223 -4.678 1.00 0.00 C ATOM 1575 NE2 HIS A 110 9.752 14.427 -4.312 1.00 0.00 N ATOM 0 H HIS A 110 7.131 15.054 0.336 1.00 0.00 H new ATOM 0 HA HIS A 110 6.587 12.860 -1.475 1.00 0.00 H new ATOM 0 HB2 HIS A 110 9.361 13.471 -0.401 1.00 0.00 H new ATOM 0 HB3 HIS A 110 8.871 11.879 -0.947 1.00 0.00 H new ATOM 0 HD1 HIS A 110 8.476 11.587 -3.614 1.00 0.00 H new ATOM 0 HD2 HIS A 110 9.870 15.340 -2.299 1.00 0.00 H new ATOM 0 HE1 HIS A 110 9.248 12.861 -5.695 1.00 0.00 H new ATOM 1583 N SER A 111 7.400 13.245 1.727 1.00 0.00 N ATOM 1584 CA SER A 111 7.210 12.846 3.113 1.00 0.00 C ATOM 1585 C SER A 111 5.939 12.025 3.284 1.00 0.00 C ATOM 1586 O SER A 111 4.838 12.573 3.308 1.00 0.00 O ATOM 1587 CB SER A 111 7.193 14.063 4.047 1.00 0.00 C ATOM 1588 OG SER A 111 7.332 13.631 5.390 1.00 0.00 O ATOM 0 H SER A 111 7.961 14.093 1.648 1.00 0.00 H new ATOM 0 HA SER A 111 8.058 12.219 3.388 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.003 14.745 3.788 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.261 14.615 3.926 1.00 0.00 H new ATOM 0 HG SER A 111 7.323 14.409 5.986 1.00 0.00 H new ATOM 1594 N ILE A 112 6.087 10.704 3.390 1.00 0.00 N ATOM 1595 CA ILE A 112 4.942 9.823 3.576 1.00 0.00 C ATOM 1596 C ILE A 112 4.182 10.153 4.863 1.00 0.00 C ATOM 1597 O ILE A 112 3.005 9.821 4.986 1.00 0.00 O ATOM 1598 CB ILE A 112 5.339 8.337 3.511 1.00 0.00 C ATOM 1599 CG1 ILE A 112 6.064 7.798 4.757 1.00 0.00 C ATOM 1600 CG2 ILE A 112 6.100 8.033 2.219 1.00 0.00 C ATOM 1601 CD1 ILE A 112 7.491 8.286 4.966 1.00 0.00 C ATOM 0 H ILE A 112 6.987 10.225 3.350 1.00 0.00 H new ATOM 0 HA ILE A 112 4.262 10.003 2.743 1.00 0.00 H new ATOM 0 HB ILE A 112 4.399 7.786 3.501 1.00 0.00 H new ATOM 0 HG12 ILE A 112 5.478 8.064 5.637 1.00 0.00 H new ATOM 0 HG13 ILE A 112 6.078 6.710 4.701 1.00 0.00 H new ATOM 0 HG21 ILE A 112 6.370 6.977 2.196 1.00 0.00 H new ATOM 0 HG22 ILE A 112 5.468 8.265 1.362 1.00 0.00 H new ATOM 0 HG23 ILE A 112 7.005 8.640 2.178 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.899 7.840 5.873 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.103 7.996 4.112 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.494 9.372 5.062 1.00 0.00 H new ATOM 1613 N ILE A 113 4.845 10.801 5.824 1.00 0.00 N ATOM 1614 CA ILE A 113 4.220 11.224 7.059 1.00 0.00 C ATOM 1615 C ILE A 113 3.054 12.125 6.679 1.00 0.00 C ATOM 1616 O ILE A 113 3.218 13.079 5.921 1.00 0.00 O ATOM 1617 CB ILE A 113 5.227 11.959 7.960 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.439 11.087 8.327 1.00 0.00 C ATOM 1619 CG2 ILE A 113 4.536 12.472 9.235 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.051 9.745 8.951 1.00 0.00 C ATOM 0 H ILE A 113 5.834 11.043 5.758 1.00 0.00 H new ATOM 0 HA ILE A 113 3.866 10.366 7.630 1.00 0.00 H new ATOM 0 HB ILE A 113 5.603 12.806 7.386 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.032 10.905 7.431 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.074 11.634 9.024 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.264 12.989 9.860 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.736 13.161 8.963 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.118 11.630 9.786 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.952 9.179 9.186 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.483 9.919 9.865 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.441 9.179 8.247 1.00 0.00 H new ATOM 1632 N GLY A 114 1.870 11.795 7.175 1.00 0.00 N ATOM 1633 CA GLY A 114 0.691 12.578 6.876 1.00 0.00 C ATOM 1634 C GLY A 114 -0.083 12.101 5.639 1.00 0.00 C ATOM 1635 O GLY A 114 -1.026 12.767 5.216 1.00 0.00 O ATOM 0 H GLY A 114 1.706 10.993 7.783 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.025 12.556 7.739 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.986 13.617 6.728 1.00 0.00 H new ATOM 1639 N ARG A 115 0.338 11.004 4.996 1.00 0.00 N ATOM 1640 CA ARG A 115 -0.462 10.299 4.012 1.00 0.00 C ATOM 1641 C ARG A 115 -1.242 9.170 4.700 1.00 0.00 C ATOM 1642 O ARG A 115 -1.022 8.885 5.880 1.00 0.00 O ATOM 1643 CB ARG A 115 0.468 9.733 2.932 1.00 0.00 C ATOM 1644 CG ARG A 115 0.932 10.777 1.916 1.00 0.00 C ATOM 1645 CD ARG A 115 1.887 11.876 2.409 1.00 0.00 C ATOM 1646 NE ARG A 115 1.297 13.218 2.262 1.00 0.00 N ATOM 1647 CZ ARG A 115 1.117 13.850 1.090 1.00 0.00 C ATOM 1648 NH1 ARG A 115 1.445 13.235 -0.052 1.00 0.00 N ATOM 1649 NH2 ARG A 115 0.608 15.085 1.058 1.00 0.00 N ATOM 0 H ARG A 115 1.254 10.585 5.153 1.00 0.00 H new ATOM 0 HA ARG A 115 -1.176 10.979 3.548 1.00 0.00 H new ATOM 0 HB2 ARG A 115 1.342 9.291 3.412 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -0.047 8.929 2.405 1.00 0.00 H new ATOM 0 HG2 ARG A 115 1.420 10.252 1.094 1.00 0.00 H new ATOM 0 HG3 ARG A 115 0.047 11.261 1.504 1.00 0.00 H new ATOM 0 HD2 ARG A 115 2.134 11.700 3.456 1.00 0.00 H new ATOM 0 HD3 ARG A 115 2.820 11.825 1.848 1.00 0.00 H new ATOM 0 HE ARG A 115 1.004 13.702 3.111 1.00 0.00 H new ATOM 0 HH11 ARG A 115 1.830 12.291 -0.030 1.00 0.00 H new ATOM 0 HH12 ARG A 115 1.310 13.711 -0.944 1.00 0.00 H new ATOM 0 HH21 ARG A 115 0.353 15.554 1.927 1.00 0.00 H new ATOM 0 HH22 ARG A 115 0.474 15.558 0.165 1.00 0.00 H new ATOM 1663 N THR A 116 -2.114 8.496 3.936 1.00 0.00 N ATOM 1664 CA THR A 116 -2.863 7.328 4.364 1.00 0.00 C ATOM 1665 C THR A 116 -2.576 6.139 3.451 1.00 0.00 C ATOM 1666 O THR A 116 -2.680 6.262 2.228 1.00 0.00 O ATOM 1667 CB THR A 116 -4.355 7.655 4.507 1.00 0.00 C ATOM 1668 OG1 THR A 116 -4.606 7.895 5.874 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.309 6.541 4.097 1.00 0.00 C ATOM 0 H THR A 116 -2.317 8.766 2.973 1.00 0.00 H new ATOM 0 HA THR A 116 -2.529 7.031 5.358 1.00 0.00 H new ATOM 0 HB THR A 116 -4.539 8.501 3.844 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.564 7.793 6.054 1.00 0.00 H new ATOM 0 HG21 THR A 116 -6.338 6.873 4.236 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.147 6.291 3.049 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.126 5.660 4.713 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.237 4.990 4.049 1.00 0.00 N ATOM 1678 CA LEU A 117 -1.976 3.741 3.344 1.00 0.00 C ATOM 1679 C LEU A 117 -3.123 2.784 3.661 1.00 0.00 C ATOM 1680 O LEU A 117 -3.344 2.454 4.825 1.00 0.00 O ATOM 1681 CB LEU A 117 -0.598 3.168 3.742 1.00 0.00 C ATOM 1682 CG LEU A 117 0.347 2.950 2.537 1.00 0.00 C ATOM 1683 CD1 LEU A 117 1.730 3.565 2.763 1.00 0.00 C ATOM 1684 CD2 LEU A 117 0.554 1.459 2.292 1.00 0.00 C ATOM 0 H LEU A 117 -2.136 4.907 5.061 1.00 0.00 H new ATOM 0 HA LEU A 117 -1.933 3.901 2.267 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.122 3.846 4.450 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.743 2.219 4.258 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.130 3.434 1.685 1.00 0.00 H new ATOM 0 HD11 LEU A 117 2.356 3.385 1.889 1.00 0.00 H new ATOM 0 HD12 LEU A 117 1.629 4.639 2.922 1.00 0.00 H new ATOM 0 HD13 LEU A 117 2.192 3.110 3.639 1.00 0.00 H new ATOM 0 HD21 LEU A 117 1.221 1.319 1.441 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.995 1.003 3.178 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.406 0.988 2.081 1.00 0.00 H new ATOM 1696 N VAL A 118 -3.884 2.378 2.639 1.00 0.00 N ATOM 1697 CA VAL A 118 -5.084 1.566 2.814 1.00 0.00 C ATOM 1698 C VAL A 118 -4.923 0.252 2.055 1.00 0.00 C ATOM 1699 O VAL A 118 -4.348 0.248 0.963 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.329 2.347 2.355 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.601 1.615 2.767 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.377 3.742 2.974 1.00 0.00 C ATOM 0 H VAL A 118 -3.681 2.606 1.666 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.221 1.332 3.870 1.00 0.00 H new ATOM 0 HB VAL A 118 -6.265 2.429 1.270 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.471 2.182 2.434 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.616 0.626 2.310 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.627 1.514 3.852 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.269 4.263 2.627 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.405 3.657 4.060 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.491 4.303 2.677 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.422 -0.852 2.632 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.400 -2.168 2.016 1.00 0.00 C ATOM 1714 C VAL A 119 -6.809 -2.567 1.582 1.00 0.00 C ATOM 1715 O VAL A 119 -7.790 -2.278 2.269 1.00 0.00 O ATOM 1716 CB VAL A 119 -4.753 -3.194 2.962 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -5.708 -3.683 4.051 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.273 -4.409 2.173 1.00 0.00 C ATOM 0 H VAL A 119 -5.857 -0.845 3.555 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.784 -2.141 1.117 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.919 -2.681 3.441 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.195 -4.405 4.687 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.036 -2.836 4.654 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.574 -4.157 3.589 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -3.817 -5.128 2.854 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.121 -4.874 1.669 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.538 -4.094 1.432 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.899 -3.236 0.434 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.147 -3.588 -0.228 1.00 0.00 C ATOM 1730 C HIS A 120 -8.412 -5.077 -0.134 1.00 0.00 C ATOM 1731 O HIS A 120 -7.463 -5.851 -0.040 1.00 0.00 O ATOM 1732 CB HIS A 120 -8.062 -3.154 -1.687 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.043 -1.668 -1.825 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.124 -0.853 -1.991 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -6.901 -0.938 -1.775 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.671 0.403 -2.066 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.326 0.375 -1.936 1.00 0.00 N ATOM 0 H HIS A 120 -6.076 -3.557 -0.075 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.974 -3.077 0.265 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.162 -3.572 -2.138 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.912 -3.559 -2.236 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.099 -1.147 -2.048 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -5.891 -1.296 -1.641 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.275 1.287 -2.206 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.684 -5.492 -0.136 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.013 -6.905 -0.045 1.00 0.00 C ATOM 1747 C GLU A 121 -9.443 -7.671 -1.237 1.00 0.00 C ATOM 1748 O GLU A 121 -8.749 -8.668 -1.063 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.525 -7.152 0.031 1.00 0.00 C ATOM 1750 CG GLU A 121 -11.770 -8.602 0.497 1.00 0.00 C ATOM 1751 CD GLU A 121 -13.162 -9.107 0.161 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.092 -8.278 0.165 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -13.240 -10.308 -0.192 1.00 0.00 O ATOM 0 H GLU A 121 -10.490 -4.870 -0.199 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.563 -7.266 0.880 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -11.988 -6.450 0.724 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.984 -6.986 -0.944 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.031 -9.256 0.034 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -11.618 -8.662 1.575 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.786 -7.251 -2.450 1.00 0.00 N ATOM 1761 CA LYS A 122 -9.305 -7.932 -3.638 1.00 0.00 C ATOM 1762 C LYS A 122 -7.902 -7.422 -3.963 1.00 0.00 C ATOM 1763 O LYS A 122 -7.427 -6.423 -3.410 1.00 0.00 O ATOM 1764 CB LYS A 122 -10.281 -7.740 -4.812 1.00 0.00 C ATOM 1765 CG LYS A 122 -11.743 -8.132 -4.549 1.00 0.00 C ATOM 1766 CD LYS A 122 -11.967 -9.639 -4.327 1.00 0.00 C ATOM 1767 CE LYS A 122 -12.059 -9.911 -2.822 1.00 0.00 C ATOM 1768 NZ LYS A 122 -12.443 -11.288 -2.455 1.00 0.00 N ATOM 0 H LYS A 122 -10.390 -6.449 -2.632 1.00 0.00 H new ATOM 0 HA LYS A 122 -9.250 -9.005 -3.456 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.256 -6.692 -5.111 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.917 -8.322 -5.659 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -12.099 -7.591 -3.672 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.351 -7.807 -5.393 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.881 -9.961 -4.825 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -11.148 -10.210 -4.764 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -11.093 -9.687 -2.369 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.783 -9.221 -2.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.805 -11.299 -1.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.183 -11.627 -3.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -11.612 -11.910 -2.523 1.00 0.00 H new ATOM 1782 N ALA A 123 -7.251 -8.114 -4.891 1.00 0.00 N ATOM 1783 CA ALA A 123 -6.085 -7.597 -5.565 1.00 0.00 C ATOM 1784 C ALA A 123 -6.525 -6.364 -6.349 1.00 0.00 C ATOM 1785 O ALA A 123 -7.664 -6.317 -6.818 1.00 0.00 O ATOM 1786 CB ALA A 123 -5.574 -8.655 -6.543 1.00 0.00 C ATOM 0 H ALA A 123 -7.524 -9.050 -5.192 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.297 -7.346 -4.855 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.692 -8.277 -7.060 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -5.313 -9.561 -5.996 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.352 -8.883 -7.272 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.643 -5.386 -6.525 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.867 -4.399 -7.552 1.00 0.00 C ATOM 1794 C ASP A 124 -5.711 -5.042 -8.930 1.00 0.00 C ATOM 1795 O ASP A 124 -4.783 -5.796 -9.204 1.00 0.00 O ATOM 1796 CB ASP A 124 -4.974 -3.165 -7.424 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.629 -3.271 -6.743 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -3.223 -4.384 -6.352 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.051 -2.167 -6.635 1.00 0.00 O ATOM 0 H ASP A 124 -4.789 -5.264 -5.980 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.887 -4.038 -7.424 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.798 -2.787 -8.431 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.547 -2.404 -6.893 1.00 0.00 H new ATOM 1804 N ASP A 125 -6.615 -4.650 -9.824 1.00 0.00 N ATOM 1805 CA ASP A 125 -6.726 -5.018 -11.232 1.00 0.00 C ATOM 1806 C ASP A 125 -5.703 -4.300 -12.119 1.00 0.00 C ATOM 1807 O ASP A 125 -5.699 -4.445 -13.339 1.00 0.00 O ATOM 1808 CB ASP A 125 -8.166 -4.647 -11.615 1.00 0.00 C ATOM 1809 CG ASP A 125 -8.447 -4.711 -13.094 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -8.641 -5.822 -13.617 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -8.509 -3.595 -13.660 1.00 0.00 O ATOM 0 H ASP A 125 -7.358 -4.006 -9.555 1.00 0.00 H new ATOM 0 HA ASP A 125 -6.512 -6.076 -11.382 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -8.852 -5.317 -11.097 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -8.376 -3.638 -11.260 1.00 0.00 H new ATOM 1816 N LEU A 126 -4.835 -3.497 -11.508 1.00 0.00 N ATOM 1817 CA LEU A 126 -3.814 -2.724 -12.185 1.00 0.00 C ATOM 1818 C LEU A 126 -4.387 -1.962 -13.393 1.00 0.00 C ATOM 1819 O LEU A 126 -3.754 -1.827 -14.438 1.00 0.00 O ATOM 1820 CB LEU A 126 -2.641 -3.639 -12.544 1.00 0.00 C ATOM 1821 CG LEU A 126 -2.291 -4.640 -11.428 1.00 0.00 C ATOM 1822 CD1 LEU A 126 -1.070 -5.444 -11.847 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -2.002 -3.976 -10.078 1.00 0.00 C ATOM 0 H LEU A 126 -4.828 -3.367 -10.496 1.00 0.00 H new ATOM 0 HA LEU A 126 -3.437 -1.952 -11.515 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.882 -4.189 -13.454 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.765 -3.028 -12.763 1.00 0.00 H new ATOM 0 HG LEU A 126 -3.166 -5.275 -11.291 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -0.816 -6.156 -11.061 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -1.288 -5.984 -12.769 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.229 -4.770 -12.012 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.763 -4.742 -9.340 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.157 -3.295 -10.181 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -2.880 -3.418 -9.751 1.00 0.00 H new ATOM 1835 N GLY A 127 -5.608 -1.457 -13.213 1.00 0.00 N ATOM 1836 CA GLY A 127 -6.357 -0.697 -14.196 1.00 0.00 C ATOM 1837 C GLY A 127 -6.497 -1.409 -15.534 1.00 0.00 C ATOM 1838 O GLY A 127 -6.521 -0.758 -16.578 1.00 0.00 O ATOM 0 H GLY A 127 -6.118 -1.576 -12.338 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -7.350 -0.485 -13.800 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -5.865 0.263 -14.354 1.00 0.00 H new ATOM 1842 N LYS A 128 -6.639 -2.735 -15.526 1.00 0.00 N ATOM 1843 CA LYS A 128 -6.842 -3.492 -16.752 1.00 0.00 C ATOM 1844 C LYS A 128 -8.323 -3.694 -17.099 1.00 0.00 C ATOM 1845 O LYS A 128 -8.614 -4.048 -18.240 1.00 0.00 O ATOM 1846 CB LYS A 128 -6.015 -4.787 -16.743 1.00 0.00 C ATOM 1847 CG LYS A 128 -4.502 -4.549 -16.560 1.00 0.00 C ATOM 1848 CD LYS A 128 -3.672 -4.205 -17.814 1.00 0.00 C ATOM 1849 CE LYS A 128 -4.019 -2.876 -18.505 1.00 0.00 C ATOM 1850 NZ LYS A 128 -5.029 -3.038 -19.575 1.00 0.00 N ATOM 0 H LYS A 128 -6.616 -3.304 -14.680 1.00 0.00 H new ATOM 0 HA LYS A 128 -6.461 -2.890 -17.577 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -6.373 -5.432 -15.941 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -6.180 -5.321 -17.679 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -4.375 -3.739 -15.841 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -4.074 -5.445 -16.110 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -2.619 -4.183 -17.534 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -3.792 -5.011 -18.538 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -4.392 -2.171 -17.762 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -3.113 -2.443 -18.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -5.568 -2.155 -19.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -4.552 -3.262 -20.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -5.678 -3.811 -19.326 1.00 0.00 H new ATOM 1864 N GLY A 129 -9.254 -3.398 -16.187 1.00 0.00 N ATOM 1865 CA GLY A 129 -10.678 -3.633 -16.372 1.00 0.00 C ATOM 1866 C GLY A 129 -11.363 -2.639 -17.315 1.00 0.00 C ATOM 1867 O GLY A 129 -12.545 -2.796 -17.604 1.00 0.00 O ATOM 0 H GLY A 129 -9.028 -2.981 -15.284 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -10.821 -4.642 -16.760 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -11.170 -3.593 -15.400 1.00 0.00 H new ATOM 1871 N GLY A 130 -10.654 -1.605 -17.786 1.00 0.00 N ATOM 1872 CA GLY A 130 -11.186 -0.666 -18.771 1.00 0.00 C ATOM 1873 C GLY A 130 -12.432 0.064 -18.262 1.00 0.00 C ATOM 1874 O GLY A 130 -13.410 0.225 -18.985 1.00 0.00 O ATOM 0 H GLY A 130 -9.699 -1.400 -17.493 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -10.418 0.064 -19.026 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -11.431 -1.203 -19.687 1.00 0.00 H new ATOM 1878 N ASN A 131 -12.382 0.513 -17.008 1.00 0.00 N ATOM 1879 CA ASN A 131 -13.485 1.138 -16.297 1.00 0.00 C ATOM 1880 C ASN A 131 -12.873 1.998 -15.213 1.00 0.00 C ATOM 1881 O ASN A 131 -12.094 1.448 -14.440 1.00 0.00 O ATOM 1882 CB ASN A 131 -14.403 0.033 -15.733 1.00 0.00 C ATOM 1883 CG ASN A 131 -15.252 0.466 -14.538 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -14.586 0.765 -13.427 1.00 0.00 O flip ATOM 1885 ND2 ASN A 131 -16.473 0.515 -14.596 1.00 0.00 N flip ATOM 0 H ASN A 131 -11.536 0.446 -16.442 1.00 0.00 H new ATOM 0 HA ASN A 131 -14.102 1.765 -16.940 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -15.065 -0.313 -16.527 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -13.788 -0.817 -15.437 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -16.952 0.279 -15.465 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -17.012 0.792 -13.775 1.00 0.00 H new ATOM 1892 N GLU A 132 -13.307 3.255 -15.075 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.946 4.195 -14.016 1.00 0.00 C ATOM 1894 C GLU A 132 -12.544 3.521 -12.700 1.00 0.00 C ATOM 1895 O GLU A 132 -11.369 3.515 -12.369 1.00 0.00 O ATOM 1896 CB GLU A 132 -14.096 5.181 -13.822 1.00 0.00 C ATOM 1897 CG GLU A 132 -14.151 6.169 -14.995 1.00 0.00 C ATOM 1898 CD GLU A 132 -15.474 6.918 -15.020 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -16.014 7.136 -13.913 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -15.913 7.241 -16.142 1.00 0.00 O ATOM 0 H GLU A 132 -13.960 3.666 -15.742 1.00 0.00 H new ATOM 0 HA GLU A 132 -12.049 4.727 -14.334 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -15.040 4.640 -13.748 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.965 5.724 -12.886 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.329 6.880 -14.914 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.016 5.631 -15.934 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.489 2.952 -11.947 1.00 0.00 N ATOM 1908 CA GLN A 133 -13.246 2.263 -10.675 1.00 0.00 C ATOM 1909 C GLN A 133 -12.038 1.300 -10.731 1.00 0.00 C ATOM 1910 O GLN A 133 -11.184 1.311 -9.863 1.00 0.00 O ATOM 1911 CB GLN A 133 -14.548 1.578 -10.204 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.974 1.935 -8.769 1.00 0.00 C ATOM 1913 CD GLN A 133 -14.110 1.369 -7.647 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.162 0.511 -7.984 1.00 0.00 O flip ATOM 1915 NE2 GLN A 133 -14.264 1.735 -6.484 1.00 0.00 N flip ATOM 0 H GLN A 133 -14.474 2.958 -12.213 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.963 3.006 -9.930 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -15.353 1.849 -10.887 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -14.421 0.498 -10.274 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -14.987 3.021 -8.676 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.997 1.590 -8.620 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -15.003 2.398 -6.252 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -13.652 1.376 -5.751 1.00 0.00 H new ATOM 1924 N SER A 134 -11.957 0.398 -11.693 1.00 0.00 N ATOM 1925 CA SER A 134 -10.764 -0.365 -12.025 1.00 0.00 C ATOM 1926 C SER A 134 -9.551 0.541 -12.292 1.00 0.00 C ATOM 1927 O SER A 134 -8.512 0.391 -11.660 1.00 0.00 O ATOM 1928 CB SER A 134 -11.060 -1.296 -13.217 1.00 0.00 C ATOM 1929 OG SER A 134 -10.845 -2.640 -12.857 1.00 0.00 O ATOM 0 H SER A 134 -12.752 0.167 -12.289 1.00 0.00 H new ATOM 0 HA SER A 134 -10.496 -0.976 -11.163 1.00 0.00 H new ATOM 0 HB2 SER A 134 -12.091 -1.161 -13.544 1.00 0.00 H new ATOM 0 HB3 SER A 134 -10.421 -1.032 -14.060 1.00 0.00 H new ATOM 0 HG SER A 134 -10.196 -3.043 -13.471 1.00 0.00 H new ATOM 1935 N THR A 135 -9.666 1.503 -13.205 1.00 0.00 N ATOM 1936 CA THR A 135 -8.549 2.317 -13.672 1.00 0.00 C ATOM 1937 C THR A 135 -8.199 3.454 -12.703 1.00 0.00 C ATOM 1938 O THR A 135 -7.311 4.254 -12.982 1.00 0.00 O ATOM 1939 CB THR A 135 -8.848 2.832 -15.084 1.00 0.00 C ATOM 1940 OG1 THR A 135 -10.053 3.561 -15.107 1.00 0.00 O ATOM 1941 CG2 THR A 135 -8.983 1.683 -16.084 1.00 0.00 C ATOM 0 H THR A 135 -10.553 1.742 -13.648 1.00 0.00 H new ATOM 0 HA THR A 135 -7.660 1.687 -13.709 1.00 0.00 H new ATOM 0 HB THR A 135 -8.010 3.470 -15.365 1.00 0.00 H new ATOM 0 HG1 THR A 135 -10.224 3.882 -16.017 1.00 0.00 H new ATOM 0 HG21 THR A 135 -9.195 2.086 -17.074 1.00 0.00 H new ATOM 0 HG22 THR A 135 -8.053 1.116 -16.114 1.00 0.00 H new ATOM 0 HG23 THR A 135 -9.798 1.027 -15.777 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.892 3.527 -11.569 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.712 4.490 -10.507 1.00 0.00 C ATOM 1951 C LYS A 136 -8.381 3.732 -9.226 1.00 0.00 C ATOM 1952 O LYS A 136 -7.471 4.148 -8.517 1.00 0.00 O ATOM 1953 CB LYS A 136 -10.017 5.280 -10.346 1.00 0.00 C ATOM 1954 CG LYS A 136 -9.931 6.332 -9.237 1.00 0.00 C ATOM 1955 CD LYS A 136 -11.225 7.154 -9.140 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.445 6.312 -8.716 1.00 0.00 C ATOM 1957 NZ LYS A 136 -13.647 7.157 -8.541 1.00 0.00 N ATOM 0 H LYS A 136 -9.642 2.867 -11.363 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.901 5.183 -10.732 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.261 5.770 -11.289 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.831 4.590 -10.126 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -9.738 5.842 -8.283 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -9.089 6.997 -9.430 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.082 7.963 -8.423 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.428 7.617 -10.106 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.641 5.548 -9.468 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.224 5.792 -7.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.451 6.562 -8.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.466 7.870 -7.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -13.870 7.633 -9.438 1.00 0.00 H new ATOM 1971 N THR A 137 -9.123 2.661 -8.904 1.00 0.00 N ATOM 1972 CA THR A 137 -8.887 1.948 -7.632 1.00 0.00 C ATOM 1973 C THR A 137 -8.222 0.585 -7.809 1.00 0.00 C ATOM 1974 O THR A 137 -7.589 0.080 -6.881 1.00 0.00 O ATOM 1975 CB THR A 137 -10.125 1.832 -6.725 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.739 0.560 -6.791 1.00 0.00 O ATOM 1977 CG2 THR A 137 -11.140 2.964 -6.902 1.00 0.00 C ATOM 0 H THR A 137 -9.869 2.276 -9.483 1.00 0.00 H new ATOM 0 HA THR A 137 -8.181 2.597 -7.114 1.00 0.00 H new ATOM 0 HB THR A 137 -9.731 1.946 -5.715 1.00 0.00 H new ATOM 0 HG1 THR A 137 -11.668 0.660 -7.088 1.00 0.00 H new ATOM 0 HG21 THR A 137 -11.981 2.807 -6.227 1.00 0.00 H new ATOM 0 HG22 THR A 137 -10.665 3.918 -6.674 1.00 0.00 H new ATOM 0 HG23 THR A 137 -11.498 2.974 -7.932 1.00 0.00 H new ATOM 1985 N GLY A 138 -8.458 -0.051 -8.951 1.00 0.00 N ATOM 1986 CA GLY A 138 -8.063 -1.415 -9.234 1.00 0.00 C ATOM 1987 C GLY A 138 -9.215 -2.368 -8.974 1.00 0.00 C ATOM 1988 O GLY A 138 -8.978 -3.562 -8.851 1.00 0.00 O ATOM 0 H GLY A 138 -8.948 0.390 -9.730 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.742 -1.499 -10.272 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -7.210 -1.689 -8.613 1.00 0.00 H new ATOM 1992 N ASN A 139 -10.450 -1.865 -8.835 1.00 0.00 N ATOM 1993 CA ASN A 139 -11.599 -2.710 -8.523 1.00 0.00 C ATOM 1994 C ASN A 139 -11.301 -3.579 -7.299 1.00 0.00 C ATOM 1995 O ASN A 139 -11.807 -4.685 -7.140 1.00 0.00 O ATOM 1996 CB ASN A 139 -11.987 -3.550 -9.746 1.00 0.00 C ATOM 1997 CG ASN A 139 -13.472 -3.895 -9.772 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -14.108 -4.089 -8.742 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -14.060 -3.909 -10.964 1.00 0.00 N ATOM 0 H ASN A 139 -10.673 -0.875 -8.935 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.454 -2.080 -8.275 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -11.728 -3.005 -10.654 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -11.404 -4.471 -9.750 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -15.062 -4.084 -11.036 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -13.509 -3.745 -11.806 1.00 0.00 H new ATOM 2006 N ALA A 140 -10.438 -3.056 -6.423 1.00 0.00 N ATOM 2007 CA ALA A 140 -9.862 -3.829 -5.346 1.00 0.00 C ATOM 2008 C ALA A 140 -10.893 -4.027 -4.226 1.00 0.00 C ATOM 2009 O ALA A 140 -10.651 -4.743 -3.259 1.00 0.00 O ATOM 2010 CB ALA A 140 -8.569 -3.149 -4.898 1.00 0.00 C ATOM 0 H ALA A 140 -10.127 -2.085 -6.450 1.00 0.00 H new ATOM 0 HA ALA A 140 -9.597 -4.834 -5.674 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -8.121 -3.720 -4.085 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -7.873 -3.103 -5.736 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.790 -2.139 -4.553 1.00 0.00 H new ATOM 2016 N GLY A 141 -12.064 -3.397 -4.354 1.00 0.00 N ATOM 2017 CA GLY A 141 -13.186 -3.638 -3.475 1.00 0.00 C ATOM 2018 C GLY A 141 -13.042 -2.838 -2.189 1.00 0.00 C ATOM 2019 O GLY A 141 -12.232 -1.899 -2.098 1.00 0.00 O ATOM 0 H GLY A 141 -12.250 -2.703 -5.078 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.114 -3.364 -3.978 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.251 -4.701 -3.243 1.00 0.00 H new ATOM 2023 N SER A 142 -13.885 -3.171 -1.213 1.00 0.00 N ATOM 2024 CA SER A 142 -13.870 -2.546 0.093 1.00 0.00 C ATOM 2025 C SER A 142 -12.497 -2.687 0.742 1.00 0.00 C ATOM 2026 O SER A 142 -11.746 -3.631 0.493 1.00 0.00 O ATOM 2027 CB SER A 142 -14.977 -3.131 0.972 1.00 0.00 C ATOM 2028 OG SER A 142 -16.224 -2.670 0.491 1.00 0.00 O ATOM 0 H SER A 142 -14.601 -3.890 -1.315 1.00 0.00 H new ATOM 0 HA SER A 142 -14.066 -1.480 -0.022 1.00 0.00 H new ATOM 0 HB2 SER A 142 -14.942 -4.220 0.950 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.836 -2.828 2.010 1.00 0.00 H new ATOM 0 HG SER A 142 -16.944 -3.038 1.044 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.165 -1.674 1.533 1.00 0.00 N ATOM 2035 CA ARG A 143 -10.905 -1.561 2.220 1.00 0.00 C ATOM 2036 C ARG A 143 -10.962 -2.314 3.547 1.00 0.00 C ATOM 2037 O ARG A 143 -11.671 -1.896 4.458 1.00 0.00 O ATOM 2038 CB ARG A 143 -10.575 -0.079 2.375 1.00 0.00 C ATOM 2039 CG ARG A 143 -10.404 0.564 0.984 1.00 0.00 C ATOM 2040 CD ARG A 143 -11.666 1.221 0.399 1.00 0.00 C ATOM 2041 NE ARG A 143 -12.235 0.517 -0.766 1.00 0.00 N ATOM 2042 CZ ARG A 143 -13.073 1.082 -1.654 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -13.602 2.286 -1.412 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -13.364 0.433 -2.783 1.00 0.00 N ATOM 0 H ARG A 143 -12.792 -0.889 1.713 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.099 -2.023 1.649 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.370 0.425 2.924 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -9.661 0.041 2.957 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -9.618 1.317 1.045 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -10.058 -0.201 0.289 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -12.425 1.280 1.179 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -11.427 2.244 0.109 1.00 0.00 H new ATOM 0 HE ARG A 143 -11.977 -0.460 -0.907 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -13.371 2.781 -0.551 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -14.237 2.710 -2.089 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -12.952 -0.482 -2.966 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -13.998 0.852 -3.463 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.239 -3.435 3.644 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.255 -4.283 4.832 1.00 0.00 C ATOM 2060 C LEU A 144 -9.571 -3.592 6.011 1.00 0.00 C ATOM 2061 O LEU A 144 -9.944 -3.851 7.151 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.586 -5.647 4.568 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.437 -6.783 3.949 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -10.711 -7.866 4.999 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.796 -6.301 3.418 1.00 0.00 C ATOM 0 H LEU A 144 -9.629 -3.776 2.901 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.301 -4.457 5.082 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.734 -5.476 3.910 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.189 -6.010 5.516 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.855 -7.169 3.112 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.310 -8.661 4.554 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.766 -8.278 5.352 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -11.252 -7.430 5.839 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -12.343 -7.145 2.998 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.372 -5.866 4.235 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -11.639 -5.549 2.645 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.562 -2.751 5.760 1.00 0.00 N ATOM 2078 CA ALA A 145 -7.883 -2.005 6.810 1.00 0.00 C ATOM 2079 C ALA A 145 -7.367 -0.693 6.235 1.00 0.00 C ATOM 2080 O ALA A 145 -7.032 -0.634 5.050 1.00 0.00 O ATOM 2081 CB ALA A 145 -6.756 -2.839 7.428 1.00 0.00 C ATOM 0 H ALA A 145 -8.198 -2.573 4.824 1.00 0.00 H new ATOM 0 HA ALA A 145 -8.585 -1.780 7.613 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.263 -2.262 8.210 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.171 -3.751 7.857 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.031 -3.099 6.657 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.325 0.355 7.058 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.950 1.696 6.655 1.00 0.00 C ATOM 2089 C CYS A 146 -6.155 2.317 7.790 1.00 0.00 C ATOM 2090 O CYS A 146 -6.245 1.849 8.922 1.00 0.00 O ATOM 2091 CB CYS A 146 -8.201 2.519 6.327 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.204 3.058 7.734 1.00 0.00 S ATOM 0 H CYS A 146 -7.558 0.285 8.048 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.338 1.673 5.754 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.891 3.403 5.770 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.833 1.929 5.663 1.00 0.00 H new ATOM 2097 N GLY A 147 -5.335 3.324 7.491 1.00 0.00 N ATOM 2098 CA GLY A 147 -4.511 3.942 8.510 1.00 0.00 C ATOM 2099 C GLY A 147 -3.604 5.033 7.950 1.00 0.00 C ATOM 2100 O GLY A 147 -3.291 5.038 6.756 1.00 0.00 O ATOM 0 H GLY A 147 -5.229 3.721 6.558 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -5.152 4.369 9.281 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.900 3.178 8.990 1.00 0.00 H new ATOM 2104 N VAL A 148 -3.206 5.951 8.838 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.422 7.138 8.528 1.00 0.00 C ATOM 2106 C VAL A 148 -0.956 6.909 8.900 1.00 0.00 C ATOM 2107 O VAL A 148 -0.655 5.993 9.666 1.00 0.00 O ATOM 2108 CB VAL A 148 -3.015 8.381 9.217 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -4.547 8.340 9.304 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -2.456 8.649 10.620 1.00 0.00 C ATOM 0 H VAL A 148 -3.433 5.879 9.830 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.463 7.325 7.455 1.00 0.00 H new ATOM 0 HB VAL A 148 -2.706 9.199 8.566 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -4.908 9.242 9.799 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -4.967 8.285 8.300 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -4.856 7.464 9.875 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -2.925 9.541 11.034 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -2.666 7.796 11.265 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.378 8.801 10.559 1.00 0.00 H new ATOM 2120 N ILE A 149 -0.044 7.730 8.366 1.00 0.00 N ATOM 2121 CA ILE A 149 1.392 7.548 8.564 1.00 0.00 C ATOM 2122 C ILE A 149 1.938 8.612 9.520 1.00 0.00 C ATOM 2123 O ILE A 149 1.680 9.801 9.321 1.00 0.00 O ATOM 2124 CB ILE A 149 2.144 7.607 7.226 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.367 7.007 6.034 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.535 6.992 7.437 1.00 0.00 C ATOM 2127 CD1 ILE A 149 2.065 5.906 5.256 1.00 0.00 C ATOM 0 H ILE A 149 -0.283 8.535 7.787 1.00 0.00 H new ATOM 0 HA ILE A 149 1.549 6.563 9.003 1.00 0.00 H new ATOM 0 HB ILE A 149 2.253 8.650 6.928 1.00 0.00 H new ATOM 0 HG12 ILE A 149 0.421 6.614 6.406 1.00 0.00 H new ATOM 0 HG13 ILE A 149 1.127 7.814 5.342 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.092 7.021 6.500 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.073 7.560 8.196 1.00 0.00 H new ATOM 0 HG23 ILE A 149 3.430 5.958 7.764 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.419 5.567 4.446 1.00 0.00 H new ATOM 0 HD12 ILE A 149 2.997 6.289 4.841 1.00 0.00 H new ATOM 0 HD13 ILE A 149 2.280 5.070 5.922 1.00 0.00 H new ATOM 2139 N GLY A 150 2.725 8.201 10.521 1.00 0.00 N ATOM 2140 CA GLY A 150 3.254 9.059 11.564 1.00 0.00 C ATOM 2141 C GLY A 150 4.690 8.649 11.862 1.00 0.00 C ATOM 2142 O GLY A 150 5.155 7.606 11.411 1.00 0.00 O ATOM 0 H GLY A 150 3.015 7.228 10.622 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.218 10.102 11.248 1.00 0.00 H new ATOM 0 HA3 GLY A 150 2.645 8.977 12.464 1.00 0.00 H new ATOM 2146 N ILE A 151 5.419 9.482 12.597 1.00 0.00 N ATOM 2147 CA ILE A 151 6.758 9.168 13.053 1.00 0.00 C ATOM 2148 C ILE A 151 6.673 8.029 14.076 1.00 0.00 C ATOM 2149 O ILE A 151 5.798 8.019 14.937 1.00 0.00 O ATOM 2150 CB ILE A 151 7.432 10.430 13.616 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.271 11.613 12.638 1.00 0.00 C ATOM 2152 CG2 ILE A 151 8.927 10.163 13.845 1.00 0.00 C ATOM 2153 CD1 ILE A 151 6.259 12.652 13.131 1.00 0.00 C ATOM 0 H ILE A 151 5.089 10.401 12.893 1.00 0.00 H new ATOM 0 HA ILE A 151 7.381 8.829 12.226 1.00 0.00 H new ATOM 0 HB ILE A 151 6.953 10.684 14.562 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.238 12.094 12.493 1.00 0.00 H new ATOM 0 HG13 ILE A 151 6.954 11.235 11.666 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.400 11.060 14.244 1.00 0.00 H new ATOM 0 HG22 ILE A 151 9.046 9.344 14.555 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.398 9.895 12.899 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.186 13.462 12.405 1.00 0.00 H new ATOM 0 HD12 ILE A 151 5.283 12.181 13.250 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.587 13.053 14.090 1.00 0.00 H new ATOM 2165 N ALA A 152 7.576 7.059 13.963 1.00 0.00 N ATOM 2166 CA ALA A 152 7.678 5.917 14.861 1.00 0.00 C ATOM 2167 C ALA A 152 8.431 6.324 16.120 1.00 0.00 C ATOM 2168 O ALA A 152 9.508 5.796 16.394 1.00 0.00 O ATOM 2169 CB ALA A 152 8.386 4.758 14.146 1.00 0.00 C ATOM 0 H ALA A 152 8.277 7.047 13.222 1.00 0.00 H new ATOM 0 HA ALA A 152 6.681 5.583 15.149 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.461 3.905 14.821 1.00 0.00 H new ATOM 0 HB2 ALA A 152 7.815 4.473 13.262 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.386 5.072 13.846 1.00 0.00 H new ATOM 2175 N GLN A 153 7.877 7.267 16.879 1.00 0.00 N ATOM 2176 CA GLN A 153 8.450 7.705 18.133 1.00 0.00 C ATOM 2177 C GLN A 153 7.364 8.445 18.908 1.00 0.00 C ATOM 2178 O GLN A 153 7.634 8.801 20.074 1.00 0.00 O ATOM 2179 CB GLN A 153 9.675 8.595 17.863 1.00 0.00 C ATOM 2180 CG GLN A 153 10.597 8.674 19.091 1.00 0.00 C ATOM 2181 CD GLN A 153 12.071 8.428 18.758 1.00 0.00 C ATOM 2182 OE1 GLN A 153 12.424 7.594 17.928 1.00 0.00 O ATOM 2183 NE2 GLN A 153 12.974 9.151 19.412 1.00 0.00 N ATOM 2184 OXT GLN A 153 6.286 8.643 18.303 1.00 0.00 O ATOM 0 H GLN A 153 7.012 7.747 16.632 1.00 0.00 H new ATOM 0 HA GLN A 153 8.796 6.859 18.727 1.00 0.00 H new ATOM 0 HB2 GLN A 153 10.232 8.200 17.013 1.00 0.00 H new ATOM 0 HB3 GLN A 153 9.345 9.597 17.590 1.00 0.00 H new ATOM 0 HG2 GLN A 153 10.495 9.657 19.551 1.00 0.00 H new ATOM 0 HG3 GLN A 153 10.271 7.941 19.829 1.00 0.00 H new ATOM 0 HE21 GLN A 153 12.673 9.842 20.100 1.00 0.00 H new ATOM 0 HE22 GLN A 153 13.968 9.015 19.226 1.00 0.00 H new TER 2193 GLN A 153 HETATM 2194 ZN ZN A 154 -3.584 3.389 -8.184 1.00 0.00 ZN HETATM 2195 CU CU1 A 155 -5.924 1.816 -1.855 1.00 0.00 CU