USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 891 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 1 ASP N :NH3+ 168:sc= 0.435 (180deg=0.319) USER MOD Set 1.2: A 100 THR OG1 : rot 161:sc= 1.21 USER MOD Set 2.1: A 90 SER OG : rot 180:sc= 0.0212 USER MOD Set 2.2: A 93 THR OG1 : rot 133:sc= 0.0241 USER MOD Set 3.1: A 34 GLN : amide:sc= 0.65 K(o=1.2,f=-0.17) USER MOD Set 3.2: A 68 THR OG1 : rot -150:sc= 0.591 USER MOD Set 4.1: A 55 GLN : amide:sc= 0.417 X(o=0.79,f=0.39) USER MOD Set 4.2: A 58 TYR OH : rot 150:sc= 0.376 USER MOD Set 5.1: A 50 GLN : amide:sc= 0.397 X(o=1.4,f=0.98) USER MOD Set 5.2: A 54 SER OG : rot 55:sc= 1.02 USER MOD Set 6.1: A 36 GLN : amide:sc= 0.276 K(o=2.1,f=-0.99) USER MOD Set 6.2: A 39 LYS NZ :NH3+ 155:sc= 1.78 (180deg=1.13) USER MOD Set 7.1: A 28 THR OG1 : rot 180:sc= 0.552 USER MOD Set 7.2: A 71 LYS NZ :NH3+ -156:sc= 0.593 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 156:sc= 2.23 (180deg=1.37) USER MOD Single : A 7 GLN : amide:sc= 0.671 K(o=0.67,f=-0.0035) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= 0.357 K(o=0.36,f=-3.8!) USER MOD Single : A 15 LYS NZ :NH3+ 175:sc= 0.919 (180deg=0.856) USER MOD Single : A 18 LYS NZ :NH3+ -126:sc= 0.735 (180deg=0.105) USER MOD Single : A 22 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0122) USER MOD Single : A 24 LYS NZ :NH3+ -164:sc= -0.045 (180deg=-0.258) USER MOD Single : A 25 LYS NZ :NH3+ -103:sc= 1.3 (180deg=-0.0318) USER MOD Single : A 27 GLN : amide:sc= -0.299 K(o=-0.3,f=-4.6!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0.00459 USER MOD Single : A 56 LYS NZ :NH3+ 175:sc= 1.02 (180deg=0.86) USER MOD Single : A 60 SER OG : rot -50:sc= 0.346 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.0532 USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= 0.183 X(o=0.18,f=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot -130:sc= 0.392 USER MOD Single : A 101 ASN : amide:sc= 0.62 K(o=0.62,f=-3.5!) USER MOD Single : A 103 ASN : amide:sc= -0.0208 X(o=-0.021,f=-0.021) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -168:sc= 0.472 USER MOD Single : A 111 HIS : no HD1:sc= -0.0367 K(o=-0.037,f=-0.56) USER MOD Single : A 112 HIS : no HD1:sc= -0.0708 K(o=-0.071,f=-2.5!) USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 114 HIS : no HD1:sc= -0.0241 K(o=-0.024,f=-1.5) USER MOD Single : A 115 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=-0.015) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 -0.760 -2.572 0.551 1.00 0.00 N ATOM 2 CA ASP A 1 -0.586 -3.252 -0.762 1.00 0.00 C ATOM 3 C ASP A 1 0.863 -3.693 -0.940 1.00 0.00 C ATOM 4 O ASP A 1 1.771 -2.901 -0.698 1.00 0.00 O ATOM 5 CB ASP A 1 -1.027 -2.348 -1.926 1.00 0.00 C ATOM 6 CG ASP A 1 -2.547 -2.095 -1.947 1.00 0.00 C ATOM 7 OD1 ASP A 1 -3.132 -1.961 -0.846 1.00 0.00 O ATOM 8 OD2 ASP A 1 -3.148 -2.050 -3.046 1.00 0.00 O ATOM 0 H1 ASP A 1 -1.687 -2.100 0.578 1.00 0.00 H new ATOM 0 H2 ASP A 1 -0.707 -3.275 1.316 1.00 0.00 H new ATOM 0 H3 ASP A 1 -0.008 -1.865 0.678 1.00 0.00 H new ATOM 0 HA ASP A 1 -1.225 -4.135 -0.772 1.00 0.00 H new ATOM 0 HB2 ASP A 1 -0.506 -1.393 -1.855 1.00 0.00 H new ATOM 0 HB3 ASP A 1 -0.727 -2.806 -2.869 1.00 0.00 H new ATOM 15 N VAL A 2 1.091 -4.956 -1.336 1.00 0.00 N ATOM 16 CA VAL A 2 2.422 -5.578 -1.331 1.00 0.00 C ATOM 17 C VAL A 2 2.713 -6.515 -2.485 1.00 0.00 C ATOM 18 O VAL A 2 2.186 -7.617 -2.591 1.00 0.00 O ATOM 19 CB VAL A 2 2.688 -6.264 0.001 1.00 0.00 C ATOM 20 CG1 VAL A 2 1.785 -7.402 0.481 1.00 0.00 C ATOM 21 CG2 VAL A 2 4.136 -6.747 0.085 1.00 0.00 C ATOM 0 H VAL A 2 0.353 -5.576 -1.670 1.00 0.00 H new ATOM 0 HA VAL A 2 3.114 -4.748 -1.472 1.00 0.00 H new ATOM 0 HB VAL A 2 2.444 -5.447 0.680 1.00 0.00 H new ATOM 0 HG11 VAL A 2 2.135 -7.761 1.449 1.00 0.00 H new ATOM 0 HG12 VAL A 2 0.762 -7.039 0.577 1.00 0.00 H new ATOM 0 HG13 VAL A 2 1.814 -8.218 -0.241 1.00 0.00 H new ATOM 0 HG21 VAL A 2 4.302 -7.234 1.046 1.00 0.00 H new ATOM 0 HG22 VAL A 2 4.330 -7.456 -0.720 1.00 0.00 H new ATOM 0 HG23 VAL A 2 4.810 -5.896 -0.011 1.00 0.00 H new ATOM 31 N ILE A 3 3.604 -6.035 -3.332 1.00 0.00 N ATOM 32 CA ILE A 3 4.030 -6.661 -4.585 1.00 0.00 C ATOM 33 C ILE A 3 4.798 -7.962 -4.285 1.00 0.00 C ATOM 34 O ILE A 3 5.982 -7.937 -3.945 1.00 0.00 O ATOM 35 CB ILE A 3 4.820 -5.653 -5.451 1.00 0.00 C ATOM 36 CG1 ILE A 3 3.973 -4.467 -5.982 1.00 0.00 C ATOM 37 CG2 ILE A 3 5.371 -6.358 -6.705 1.00 0.00 C ATOM 38 CD1 ILE A 3 3.458 -3.456 -4.950 1.00 0.00 C ATOM 0 H ILE A 3 4.080 -5.149 -3.161 1.00 0.00 H new ATOM 0 HA ILE A 3 3.161 -6.945 -5.178 1.00 0.00 H new ATOM 0 HB ILE A 3 5.597 -5.270 -4.789 1.00 0.00 H new ATOM 0 HG12 ILE A 3 4.571 -3.926 -6.715 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.113 -4.877 -6.512 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.926 -5.642 -7.311 1.00 0.00 H new ATOM 0 HG22 ILE A 3 6.033 -7.170 -6.405 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.544 -6.762 -7.289 1.00 0.00 H new ATOM 0 HD11 ILE A 3 2.882 -2.681 -5.456 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.822 -3.966 -4.227 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.303 -3.001 -4.433 1.00 0.00 H new ATOM 50 N ILE A 4 4.115 -9.104 -4.377 1.00 0.00 N ATOM 51 CA ILE A 4 4.649 -10.458 -4.284 1.00 0.00 C ATOM 52 C ILE A 4 5.589 -10.762 -5.472 1.00 0.00 C ATOM 53 O ILE A 4 5.389 -10.278 -6.597 1.00 0.00 O ATOM 54 CB ILE A 4 3.436 -11.417 -4.215 1.00 0.00 C ATOM 55 CG1 ILE A 4 3.534 -12.546 -3.189 1.00 0.00 C ATOM 56 CG2 ILE A 4 3.109 -12.037 -5.561 1.00 0.00 C ATOM 57 CD1 ILE A 4 4.834 -13.363 -3.175 1.00 0.00 C ATOM 0 H ILE A 4 3.106 -9.104 -4.529 1.00 0.00 H new ATOM 0 HA ILE A 4 5.262 -10.585 -3.392 1.00 0.00 H new ATOM 0 HB ILE A 4 2.638 -10.751 -3.886 1.00 0.00 H new ATOM 0 HG12 ILE A 4 3.393 -12.116 -2.197 1.00 0.00 H new ATOM 0 HG13 ILE A 4 2.704 -13.232 -3.360 1.00 0.00 H new ATOM 0 HG21 ILE A 4 2.251 -12.701 -5.457 1.00 0.00 H new ATOM 0 HG22 ILE A 4 2.874 -11.249 -6.277 1.00 0.00 H new ATOM 0 HG23 ILE A 4 3.967 -12.607 -5.917 1.00 0.00 H new ATOM 0 HD11 ILE A 4 4.773 -14.130 -2.403 1.00 0.00 H new ATOM 0 HD12 ILE A 4 4.977 -13.837 -4.146 1.00 0.00 H new ATOM 0 HD13 ILE A 4 5.676 -12.703 -2.966 1.00 0.00 H new ATOM 69 N LYS A 5 6.607 -11.592 -5.230 1.00 0.00 N ATOM 70 CA LYS A 5 7.669 -11.949 -6.182 1.00 0.00 C ATOM 71 C LYS A 5 8.137 -13.400 -6.056 1.00 0.00 C ATOM 72 O LYS A 5 8.031 -13.982 -4.973 1.00 0.00 O ATOM 73 CB LYS A 5 8.825 -10.983 -5.954 1.00 0.00 C ATOM 74 CG LYS A 5 8.410 -9.596 -6.439 1.00 0.00 C ATOM 75 CD LYS A 5 9.606 -8.737 -6.798 1.00 0.00 C ATOM 76 CE LYS A 5 9.038 -7.337 -7.005 1.00 0.00 C ATOM 77 NZ LYS A 5 10.087 -6.312 -7.233 1.00 0.00 N ATOM 0 H LYS A 5 6.721 -12.055 -4.328 1.00 0.00 H new ATOM 0 HA LYS A 5 7.275 -11.866 -7.195 1.00 0.00 H new ATOM 0 HB2 LYS A 5 9.087 -10.950 -4.896 1.00 0.00 H new ATOM 0 HB3 LYS A 5 9.711 -11.321 -6.491 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.761 -9.696 -7.309 1.00 0.00 H new ATOM 0 HG3 LYS A 5 7.828 -9.100 -5.663 1.00 0.00 H new ATOM 0 HD2 LYS A 5 10.352 -8.747 -6.003 1.00 0.00 H new ATOM 0 HD3 LYS A 5 10.097 -9.101 -7.700 1.00 0.00 H new ATOM 0 HE2 LYS A 5 8.359 -7.349 -7.857 1.00 0.00 H new ATOM 0 HE3 LYS A 5 8.449 -7.057 -6.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 9.680 -5.508 -7.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 10.455 -5.982 -6.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 10.862 -6.726 -7.789 1.00 0.00 H new ATOM 91 N PRO A 6 8.665 -13.978 -7.148 1.00 0.00 N ATOM 92 CA PRO A 6 9.172 -15.343 -7.158 1.00 0.00 C ATOM 93 C PRO A 6 10.536 -15.481 -6.466 1.00 0.00 C ATOM 94 O PRO A 6 11.314 -14.529 -6.368 1.00 0.00 O ATOM 95 CB PRO A 6 9.214 -15.710 -8.635 1.00 0.00 C ATOM 96 CG PRO A 6 9.429 -14.392 -9.377 1.00 0.00 C ATOM 97 CD PRO A 6 8.743 -13.386 -8.478 1.00 0.00 C ATOM 0 HA PRO A 6 8.538 -16.020 -6.586 1.00 0.00 H new ATOM 0 HB2 PRO A 6 10.021 -16.413 -8.842 1.00 0.00 H new ATOM 0 HB3 PRO A 6 8.286 -16.189 -8.947 1.00 0.00 H new ATOM 0 HG2 PRO A 6 10.488 -14.166 -9.502 1.00 0.00 H new ATOM 0 HG3 PRO A 6 8.987 -14.412 -10.373 1.00 0.00 H new ATOM 0 HD2 PRO A 6 9.302 -12.451 -8.450 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.747 -13.151 -8.853 1.00 0.00 H new ATOM 105 N GLN A 7 10.835 -16.700 -6.014 1.00 0.00 N ATOM 106 CA GLN A 7 12.076 -17.061 -5.308 1.00 0.00 C ATOM 107 C GLN A 7 13.172 -17.644 -6.233 1.00 0.00 C ATOM 108 O GLN A 7 14.268 -17.970 -5.775 1.00 0.00 O ATOM 109 CB GLN A 7 11.744 -17.970 -4.104 1.00 0.00 C ATOM 110 CG GLN A 7 11.108 -19.320 -4.485 1.00 0.00 C ATOM 111 CD GLN A 7 10.771 -20.173 -3.257 1.00 0.00 C ATOM 112 OE1 GLN A 7 11.588 -20.397 -2.374 1.00 0.00 O ATOM 113 NE2 GLN A 7 9.568 -20.699 -3.141 1.00 0.00 N ATOM 0 H GLN A 7 10.203 -17.492 -6.131 1.00 0.00 H new ATOM 0 HA GLN A 7 12.522 -16.142 -4.928 1.00 0.00 H new ATOM 0 HB2 GLN A 7 12.659 -18.158 -3.543 1.00 0.00 H new ATOM 0 HB3 GLN A 7 11.066 -17.437 -3.438 1.00 0.00 H new ATOM 0 HG2 GLN A 7 10.200 -19.141 -5.061 1.00 0.00 H new ATOM 0 HG3 GLN A 7 11.791 -19.871 -5.131 1.00 0.00 H new ATOM 0 HE21 GLN A 7 8.866 -20.530 -3.861 1.00 0.00 H new ATOM 0 HE22 GLN A 7 9.339 -21.275 -2.331 1.00 0.00 H new ATOM 122 N VAL A 8 12.888 -17.746 -7.537 1.00 0.00 N ATOM 123 CA VAL A 8 13.798 -18.144 -8.634 1.00 0.00 C ATOM 124 C VAL A 8 13.471 -17.342 -9.908 1.00 0.00 C ATOM 125 O VAL A 8 12.564 -16.509 -9.901 1.00 0.00 O ATOM 126 CB VAL A 8 13.724 -19.666 -8.942 1.00 0.00 C ATOM 127 CG1 VAL A 8 14.050 -20.535 -7.721 1.00 0.00 C ATOM 128 CG2 VAL A 8 12.372 -20.101 -9.523 1.00 0.00 C ATOM 0 H VAL A 8 11.952 -17.539 -7.885 1.00 0.00 H new ATOM 0 HA VAL A 8 14.813 -17.924 -8.305 1.00 0.00 H new ATOM 0 HB VAL A 8 14.490 -19.825 -9.701 1.00 0.00 H new ATOM 0 HG11 VAL A 8 13.983 -21.588 -7.995 1.00 0.00 H new ATOM 0 HG12 VAL A 8 15.060 -20.314 -7.376 1.00 0.00 H new ATOM 0 HG13 VAL A 8 13.339 -20.322 -6.923 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.387 -21.174 -9.715 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.579 -19.871 -8.811 1.00 0.00 H new ATOM 0 HG23 VAL A 8 12.188 -19.568 -10.456 1.00 0.00 H new ATOM 138 N SER A 9 14.176 -17.604 -11.011 1.00 0.00 N ATOM 139 CA SER A 9 13.834 -17.107 -12.354 1.00 0.00 C ATOM 140 C SER A 9 13.403 -18.257 -13.287 1.00 0.00 C ATOM 141 O SER A 9 13.671 -19.435 -13.019 1.00 0.00 O ATOM 142 CB SER A 9 14.999 -16.318 -12.962 1.00 0.00 C ATOM 143 OG SER A 9 16.166 -17.125 -13.071 1.00 0.00 O ATOM 0 H SER A 9 15.018 -18.179 -11.000 1.00 0.00 H new ATOM 0 HA SER A 9 12.986 -16.431 -12.248 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.716 -15.948 -13.948 1.00 0.00 H new ATOM 0 HB3 SER A 9 15.213 -15.446 -12.344 1.00 0.00 H new ATOM 0 HG SER A 9 16.893 -16.598 -13.463 1.00 0.00 H new ATOM 149 N GLY A 10 12.699 -17.923 -14.368 1.00 0.00 N ATOM 150 CA GLY A 10 12.002 -18.842 -15.261 1.00 0.00 C ATOM 151 C GLY A 10 10.820 -18.138 -15.828 1.00 0.00 C ATOM 152 O GLY A 10 10.907 -17.048 -16.384 1.00 0.00 O ATOM 0 H GLY A 10 12.595 -16.951 -14.658 1.00 0.00 H new ATOM 0 HA2 GLY A 10 12.666 -19.172 -16.060 1.00 0.00 H new ATOM 0 HA3 GLY A 10 11.688 -19.734 -14.718 1.00 0.00 H new ATOM 156 N VAL A 11 9.704 -18.821 -15.694 1.00 0.00 N ATOM 157 CA VAL A 11 8.493 -18.460 -16.375 1.00 0.00 C ATOM 158 C VAL A 11 7.317 -19.020 -15.584 1.00 0.00 C ATOM 159 O VAL A 11 7.433 -20.100 -15.002 1.00 0.00 O ATOM 160 CB VAL A 11 8.617 -19.104 -17.766 1.00 0.00 C ATOM 161 CG1 VAL A 11 7.277 -19.379 -18.314 1.00 0.00 C ATOM 162 CG2 VAL A 11 9.176 -18.211 -18.866 1.00 0.00 C ATOM 0 H VAL A 11 9.617 -19.648 -15.103 1.00 0.00 H new ATOM 0 HA VAL A 11 8.335 -17.385 -16.467 1.00 0.00 H new ATOM 0 HB VAL A 11 9.266 -19.957 -17.568 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.373 -19.835 -19.299 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.745 -20.060 -17.650 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.720 -18.446 -18.399 1.00 0.00 H new ATOM 0 HG21 VAL A 11 9.218 -18.769 -19.801 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.531 -17.341 -18.991 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.179 -17.883 -18.594 1.00 0.00 H new ATOM 172 N ILE A 12 6.174 -18.335 -15.620 1.00 0.00 N ATOM 173 CA ILE A 12 4.932 -18.791 -14.976 1.00 0.00 C ATOM 174 C ILE A 12 4.340 -20.057 -15.647 1.00 0.00 C ATOM 175 O ILE A 12 4.349 -20.176 -16.872 1.00 0.00 O ATOM 176 CB ILE A 12 3.898 -17.649 -15.022 1.00 0.00 C ATOM 177 CG1 ILE A 12 4.412 -16.283 -14.518 1.00 0.00 C ATOM 178 CG2 ILE A 12 2.555 -17.973 -14.348 1.00 0.00 C ATOM 179 CD1 ILE A 12 4.722 -16.252 -13.018 1.00 0.00 C ATOM 0 H ILE A 12 6.078 -17.440 -16.100 1.00 0.00 H new ATOM 0 HA ILE A 12 5.171 -19.059 -13.947 1.00 0.00 H new ATOM 0 HB ILE A 12 3.723 -17.559 -16.094 1.00 0.00 H new ATOM 0 HG12 ILE A 12 5.313 -16.018 -15.071 1.00 0.00 H new ATOM 0 HG13 ILE A 12 3.666 -15.520 -14.741 1.00 0.00 H new ATOM 0 HG21 ILE A 12 1.890 -17.113 -14.429 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.099 -18.832 -14.840 1.00 0.00 H new ATOM 0 HG23 ILE A 12 2.722 -18.205 -13.296 1.00 0.00 H new ATOM 0 HD11 ILE A 12 5.078 -15.260 -12.740 1.00 0.00 H new ATOM 0 HD12 ILE A 12 3.818 -16.484 -12.455 1.00 0.00 H new ATOM 0 HD13 ILE A 12 5.491 -16.990 -12.790 1.00 0.00 H new ATOM 191 N VAL A 13 3.743 -20.950 -14.844 1.00 0.00 N ATOM 192 CA VAL A 13 3.139 -22.241 -15.244 1.00 0.00 C ATOM 193 C VAL A 13 1.663 -22.341 -14.843 1.00 0.00 C ATOM 194 O VAL A 13 0.862 -22.911 -15.583 1.00 0.00 O ATOM 195 CB VAL A 13 3.901 -23.421 -14.603 1.00 0.00 C ATOM 196 CG1 VAL A 13 3.353 -24.801 -14.994 1.00 0.00 C ATOM 197 CG2 VAL A 13 5.367 -23.415 -15.004 1.00 0.00 C ATOM 0 H VAL A 13 3.661 -20.787 -13.840 1.00 0.00 H new ATOM 0 HA VAL A 13 3.209 -22.290 -16.331 1.00 0.00 H new ATOM 0 HB VAL A 13 3.770 -23.271 -13.531 1.00 0.00 H new ATOM 0 HG11 VAL A 13 3.940 -25.578 -14.504 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.312 -24.881 -14.681 1.00 0.00 H new ATOM 0 HG13 VAL A 13 3.417 -24.925 -16.075 1.00 0.00 H new ATOM 0 HG21 VAL A 13 5.876 -24.258 -14.536 1.00 0.00 H new ATOM 0 HG22 VAL A 13 5.448 -23.498 -16.088 1.00 0.00 H new ATOM 0 HG23 VAL A 13 5.830 -22.484 -14.676 1.00 0.00 H new ATOM 207 N ASN A 14 1.279 -21.768 -13.696 1.00 0.00 N ATOM 208 CA ASN A 14 -0.109 -21.733 -13.223 1.00 0.00 C ATOM 209 C ASN A 14 -0.366 -20.491 -12.359 1.00 0.00 C ATOM 210 O ASN A 14 0.571 -19.916 -11.789 1.00 0.00 O ATOM 211 CB ASN A 14 -0.421 -23.030 -12.434 1.00 0.00 C ATOM 212 CG ASN A 14 -1.899 -23.394 -12.381 1.00 0.00 C ATOM 213 OD1 ASN A 14 -2.769 -22.693 -12.877 1.00 0.00 O ATOM 214 ND2 ASN A 14 -2.225 -24.508 -11.766 1.00 0.00 N ATOM 0 H ASN A 14 1.933 -21.309 -13.062 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.773 -21.674 -14.085 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.128 -23.856 -12.885 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -0.050 -22.919 -11.415 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -3.204 -24.788 -11.702 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.499 -25.093 -11.352 1.00 0.00 H new ATOM 221 N LYS A 15 -1.650 -20.146 -12.215 1.00 0.00 N ATOM 222 CA LYS A 15 -2.197 -19.029 -11.449 1.00 0.00 C ATOM 223 C LYS A 15 -3.264 -19.588 -10.514 1.00 0.00 C ATOM 224 O LYS A 15 -4.423 -19.776 -10.893 1.00 0.00 O ATOM 225 CB LYS A 15 -2.782 -17.974 -12.408 1.00 0.00 C ATOM 226 CG LYS A 15 -1.762 -17.357 -13.375 1.00 0.00 C ATOM 227 CD LYS A 15 -1.141 -16.045 -12.892 1.00 0.00 C ATOM 228 CE LYS A 15 -2.125 -14.871 -12.984 1.00 0.00 C ATOM 229 NZ LYS A 15 -2.563 -14.535 -14.362 1.00 0.00 N ATOM 0 H LYS A 15 -2.388 -20.685 -12.668 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.421 -18.537 -10.862 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.582 -18.433 -12.988 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.233 -17.176 -11.818 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -0.964 -18.079 -13.550 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.250 -17.182 -14.334 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -0.810 -16.160 -11.860 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.256 -15.823 -13.488 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -3.005 -15.104 -12.384 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -1.661 -13.990 -12.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -3.288 -13.790 -14.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -1.748 -14.197 -14.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -2.961 -15.382 -14.816 1.00 0.00 H new ATOM 243 N LEU A 16 -2.847 -19.896 -9.289 1.00 0.00 N ATOM 244 CA LEU A 16 -3.704 -20.492 -8.267 1.00 0.00 C ATOM 245 C LEU A 16 -4.758 -19.494 -7.773 1.00 0.00 C ATOM 246 O LEU A 16 -5.956 -19.783 -7.732 1.00 0.00 O ATOM 247 CB LEU A 16 -2.845 -20.972 -7.109 1.00 0.00 C ATOM 248 CG LEU A 16 -2.029 -22.247 -7.380 1.00 0.00 C ATOM 249 CD1 LEU A 16 -2.719 -23.316 -8.219 1.00 0.00 C ATOM 250 CD2 LEU A 16 -0.684 -21.960 -8.029 1.00 0.00 C ATOM 0 H LEU A 16 -1.890 -19.736 -8.973 1.00 0.00 H new ATOM 0 HA LEU A 16 -4.233 -21.338 -8.705 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -2.158 -20.173 -6.832 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -3.490 -21.149 -6.249 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.905 -22.645 -6.373 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.050 -24.168 -8.345 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.630 -23.641 -7.716 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -2.971 -22.905 -9.197 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.153 -22.897 -8.196 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.840 -21.456 -8.983 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -0.093 -21.320 -7.374 1.00 0.00 H new ATOM 262 N PHE A 17 -4.282 -18.290 -7.465 1.00 0.00 N ATOM 263 CA PHE A 17 -5.106 -17.131 -7.138 1.00 0.00 C ATOM 264 C PHE A 17 -5.855 -16.594 -8.371 1.00 0.00 C ATOM 265 O PHE A 17 -5.700 -17.098 -9.488 1.00 0.00 O ATOM 266 CB PHE A 17 -4.218 -16.056 -6.497 1.00 0.00 C ATOM 267 CG PHE A 17 -3.632 -15.034 -7.461 1.00 0.00 C ATOM 268 CD1 PHE A 17 -2.578 -15.372 -8.321 1.00 0.00 C ATOM 269 CD2 PHE A 17 -4.211 -13.755 -7.569 1.00 0.00 C ATOM 270 CE1 PHE A 17 -2.174 -14.471 -9.314 1.00 0.00 C ATOM 271 CE2 PHE A 17 -3.712 -12.802 -8.467 1.00 0.00 C ATOM 272 CZ PHE A 17 -2.687 -13.167 -9.348 1.00 0.00 C ATOM 0 H PHE A 17 -3.282 -18.089 -7.435 1.00 0.00 H new ATOM 0 HA PHE A 17 -5.876 -17.430 -6.426 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -4.803 -15.527 -5.744 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -3.398 -16.550 -5.975 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -2.079 -16.324 -8.218 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -5.057 -13.503 -6.947 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -1.460 -14.784 -10.061 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -4.113 -11.799 -8.479 1.00 0.00 H new ATOM 0 HZ PHE A 17 -2.293 -12.447 -10.050 1.00 0.00 H new ATOM 282 N LYS A 18 -6.649 -15.545 -8.157 1.00 0.00 N ATOM 283 CA LYS A 18 -7.383 -14.816 -9.205 1.00 0.00 C ATOM 284 C LYS A 18 -7.345 -13.314 -8.935 1.00 0.00 C ATOM 285 O LYS A 18 -7.457 -12.893 -7.784 1.00 0.00 O ATOM 286 CB LYS A 18 -8.836 -15.288 -9.268 1.00 0.00 C ATOM 287 CG LYS A 18 -8.997 -16.791 -9.475 1.00 0.00 C ATOM 288 CD LYS A 18 -8.647 -17.237 -10.897 1.00 0.00 C ATOM 289 CE LYS A 18 -8.591 -18.766 -11.053 1.00 0.00 C ATOM 290 NZ LYS A 18 -7.392 -19.360 -10.399 1.00 0.00 N ATOM 0 H LYS A 18 -6.807 -15.164 -7.224 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.901 -15.019 -10.161 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -9.339 -15.004 -8.344 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -9.341 -14.765 -10.080 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -8.360 -17.321 -8.766 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.026 -17.075 -9.253 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -9.386 -16.834 -11.590 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -7.682 -16.814 -11.177 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -9.491 -19.206 -10.623 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.587 -19.020 -12.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -6.872 -19.940 -11.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -6.774 -18.600 -10.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -7.691 -19.956 -9.601 1.00 0.00 H new ATOM 304 N ALA A 19 -7.217 -12.510 -9.992 1.00 0.00 N ATOM 305 CA ALA A 19 -7.250 -11.047 -9.926 1.00 0.00 C ATOM 306 C ALA A 19 -8.548 -10.516 -9.279 1.00 0.00 C ATOM 307 O ALA A 19 -9.607 -10.477 -9.913 1.00 0.00 O ATOM 308 CB ALA A 19 -7.025 -10.518 -11.350 1.00 0.00 C ATOM 0 H ALA A 19 -7.085 -12.865 -10.939 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.458 -10.681 -9.273 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -7.043 -9.428 -11.340 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -6.058 -10.862 -11.717 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -7.814 -10.888 -12.005 1.00 0.00 H new ATOM 314 N GLY A 20 -8.456 -10.134 -8.004 1.00 0.00 N ATOM 315 CA GLY A 20 -9.553 -9.599 -7.188 1.00 0.00 C ATOM 316 C GLY A 20 -10.066 -10.534 -6.075 1.00 0.00 C ATOM 317 O GLY A 20 -10.852 -10.098 -5.228 1.00 0.00 O ATOM 0 H GLY A 20 -7.578 -10.191 -7.488 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -9.222 -8.666 -6.732 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -10.387 -9.354 -7.846 1.00 0.00 H new ATOM 321 N ASP A 21 -9.666 -11.810 -6.067 1.00 0.00 N ATOM 322 CA ASP A 21 -10.068 -12.807 -5.056 1.00 0.00 C ATOM 323 C ASP A 21 -9.443 -12.562 -3.657 1.00 0.00 C ATOM 324 O ASP A 21 -8.669 -11.626 -3.436 1.00 0.00 O ATOM 325 CB ASP A 21 -9.719 -14.190 -5.632 1.00 0.00 C ATOM 326 CG ASP A 21 -10.366 -15.398 -4.929 1.00 0.00 C ATOM 327 OD1 ASP A 21 -11.356 -15.224 -4.182 1.00 0.00 O ATOM 328 OD2 ASP A 21 -9.887 -16.536 -5.148 1.00 0.00 O ATOM 0 H ASP A 21 -9.040 -12.192 -6.776 1.00 0.00 H new ATOM 0 HA ASP A 21 -11.139 -12.729 -4.868 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.010 -14.208 -6.682 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.636 -14.313 -5.599 1.00 0.00 H new ATOM 333 N LYS A 22 -9.782 -13.419 -2.689 1.00 0.00 N ATOM 334 CA LYS A 22 -9.142 -13.479 -1.366 1.00 0.00 C ATOM 335 C LYS A 22 -7.919 -14.398 -1.370 1.00 0.00 C ATOM 336 O LYS A 22 -7.756 -15.247 -2.247 1.00 0.00 O ATOM 337 CB LYS A 22 -10.152 -13.945 -0.304 1.00 0.00 C ATOM 338 CG LYS A 22 -11.422 -13.079 -0.231 1.00 0.00 C ATOM 339 CD LYS A 22 -11.132 -11.594 0.050 1.00 0.00 C ATOM 340 CE LYS A 22 -12.406 -10.735 0.135 1.00 0.00 C ATOM 341 NZ LYS A 22 -13.307 -11.121 1.259 1.00 0.00 N ATOM 0 H LYS A 22 -10.526 -14.107 -2.804 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.801 -12.473 -1.120 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -10.438 -14.975 -0.516 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -9.666 -13.943 0.672 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.966 -13.164 -1.172 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -12.074 -13.469 0.550 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.580 -11.509 0.986 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -10.488 -11.201 -0.736 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -12.123 -9.689 0.249 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -12.953 -10.816 -0.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -14.111 -10.462 1.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -13.659 -12.087 1.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.780 -11.083 2.155 1.00 0.00 H new ATOM 355 N VAL A 23 -7.105 -14.260 -0.330 1.00 0.00 N ATOM 356 CA VAL A 23 -5.989 -15.162 0.001 1.00 0.00 C ATOM 357 C VAL A 23 -5.938 -15.441 1.503 1.00 0.00 C ATOM 358 O VAL A 23 -6.039 -14.521 2.314 1.00 0.00 O ATOM 359 CB VAL A 23 -4.617 -14.648 -0.480 1.00 0.00 C ATOM 360 CG1 VAL A 23 -4.531 -14.642 -2.006 1.00 0.00 C ATOM 361 CG2 VAL A 23 -4.216 -13.259 0.022 1.00 0.00 C ATOM 0 H VAL A 23 -7.201 -13.492 0.335 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.189 -16.087 -0.539 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.916 -15.357 -0.040 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.552 -14.275 -2.314 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.673 -15.655 -2.382 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.306 -13.992 -2.412 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.236 -12.997 -0.376 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.951 -12.526 -0.311 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.176 -13.263 1.111 1.00 0.00 H new ATOM 371 N LYS A 24 -5.773 -16.708 1.894 1.00 0.00 N ATOM 372 CA LYS A 24 -5.439 -17.127 3.249 1.00 0.00 C ATOM 373 C LYS A 24 -3.954 -16.811 3.510 1.00 0.00 C ATOM 374 O LYS A 24 -3.167 -16.804 2.562 1.00 0.00 O ATOM 375 CB LYS A 24 -5.811 -18.608 3.346 1.00 0.00 C ATOM 376 CG LYS A 24 -5.436 -19.217 4.686 1.00 0.00 C ATOM 377 CD LYS A 24 -6.127 -18.616 5.904 1.00 0.00 C ATOM 378 CE LYS A 24 -5.737 -19.387 7.163 1.00 0.00 C ATOM 379 NZ LYS A 24 -6.195 -20.804 7.168 1.00 0.00 N ATOM 0 H LYS A 24 -5.873 -17.493 1.251 1.00 0.00 H new ATOM 0 HA LYS A 24 -5.988 -16.597 4.027 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.883 -18.721 3.187 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.311 -19.158 2.548 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.659 -20.283 4.654 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.358 -19.121 4.819 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.848 -17.568 6.009 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.208 -18.646 5.770 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.652 -19.365 7.269 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -6.153 -18.878 8.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.142 -21.183 8.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.178 -20.852 6.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.586 -21.368 6.541 1.00 0.00 H new ATOM 393 N LYS A 25 -3.548 -16.587 4.770 1.00 0.00 N ATOM 394 CA LYS A 25 -2.145 -16.463 5.240 1.00 0.00 C ATOM 395 C LYS A 25 -1.250 -17.617 4.740 1.00 0.00 C ATOM 396 O LYS A 25 -1.040 -18.625 5.409 1.00 0.00 O ATOM 397 CB LYS A 25 -2.098 -16.031 6.731 1.00 0.00 C ATOM 398 CG LYS A 25 -1.140 -16.670 7.737 1.00 0.00 C ATOM 399 CD LYS A 25 0.281 -16.088 7.724 1.00 0.00 C ATOM 400 CE LYS A 25 0.995 -16.328 6.395 1.00 0.00 C ATOM 401 NZ LYS A 25 2.443 -16.007 6.477 1.00 0.00 N ATOM 0 H LYS A 25 -4.217 -16.481 5.532 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.639 -15.627 4.757 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.893 -14.961 6.740 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -3.104 -16.166 7.128 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.556 -16.556 8.738 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -1.082 -17.740 7.535 1.00 0.00 H new ATOM 0 HD2 LYS A 25 0.234 -15.017 7.920 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.861 -16.535 8.531 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.870 -17.370 6.099 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.532 -15.719 5.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 2.621 -15.089 6.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 2.733 -15.962 7.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 2.990 -16.746 5.991 1.00 0.00 H new ATOM 415 N GLY A 26 -0.728 -17.441 3.527 1.00 0.00 N ATOM 416 CA GLY A 26 0.275 -18.289 2.891 1.00 0.00 C ATOM 417 C GLY A 26 -0.280 -19.251 1.861 1.00 0.00 C ATOM 418 O GLY A 26 0.397 -20.219 1.511 1.00 0.00 O ATOM 0 H GLY A 26 -1.009 -16.662 2.932 1.00 0.00 H new ATOM 0 HA2 GLY A 26 1.020 -17.653 2.412 1.00 0.00 H new ATOM 0 HA3 GLY A 26 0.792 -18.860 3.662 1.00 0.00 H new ATOM 422 N GLN A 27 -1.509 -19.021 1.391 1.00 0.00 N ATOM 423 CA GLN A 27 -2.006 -19.756 0.240 1.00 0.00 C ATOM 424 C GLN A 27 -1.065 -19.610 -0.971 1.00 0.00 C ATOM 425 O GLN A 27 -0.459 -18.559 -1.202 1.00 0.00 O ATOM 426 CB GLN A 27 -3.488 -19.496 -0.008 1.00 0.00 C ATOM 427 CG GLN A 27 -3.754 -18.639 -1.216 1.00 0.00 C ATOM 428 CD GLN A 27 -5.239 -18.411 -1.441 1.00 0.00 C ATOM 429 OE1 GLN A 27 -6.059 -18.431 -0.536 1.00 0.00 O ATOM 430 NE2 GLN A 27 -5.651 -18.219 -2.671 1.00 0.00 N ATOM 0 H GLN A 27 -2.162 -18.344 1.785 1.00 0.00 H new ATOM 0 HA GLN A 27 -1.980 -20.824 0.457 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -4.001 -20.450 -0.130 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -3.916 -19.014 0.871 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -3.255 -17.678 -1.095 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -3.323 -19.113 -2.098 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -4.978 -18.200 -3.437 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -6.645 -18.089 -2.862 1.00 0.00 H new ATOM 439 N THR A 28 -0.946 -20.688 -1.737 1.00 0.00 N ATOM 440 CA THR A 28 -0.186 -20.749 -2.986 1.00 0.00 C ATOM 441 C THR A 28 -0.869 -19.922 -4.071 1.00 0.00 C ATOM 442 O THR A 28 -2.087 -19.963 -4.225 1.00 0.00 O ATOM 443 CB THR A 28 -0.058 -22.216 -3.395 1.00 0.00 C ATOM 444 OG1 THR A 28 0.523 -22.939 -2.329 1.00 0.00 O ATOM 445 CG2 THR A 28 0.857 -22.430 -4.601 1.00 0.00 C ATOM 0 H THR A 28 -1.390 -21.575 -1.500 1.00 0.00 H new ATOM 0 HA THR A 28 0.808 -20.326 -2.845 1.00 0.00 H new ATOM 0 HB THR A 28 -1.064 -22.551 -3.648 1.00 0.00 H new ATOM 0 HG1 THR A 28 0.608 -23.882 -2.581 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.904 -23.493 -4.838 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.463 -21.884 -5.458 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.858 -22.066 -4.368 1.00 0.00 H new ATOM 453 N LEU A 29 -0.059 -19.163 -4.812 1.00 0.00 N ATOM 454 CA LEU A 29 -0.464 -18.120 -5.753 1.00 0.00 C ATOM 455 C LEU A 29 0.006 -18.416 -7.189 1.00 0.00 C ATOM 456 O LEU A 29 -0.791 -18.324 -8.120 1.00 0.00 O ATOM 457 CB LEU A 29 0.133 -16.795 -5.284 1.00 0.00 C ATOM 458 CG LEU A 29 -0.182 -16.368 -3.840 1.00 0.00 C ATOM 459 CD1 LEU A 29 0.157 -14.893 -3.734 1.00 0.00 C ATOM 460 CD2 LEU A 29 -1.611 -16.527 -3.334 1.00 0.00 C ATOM 0 H LEU A 29 0.955 -19.267 -4.768 1.00 0.00 H new ATOM 0 HA LEU A 29 -1.553 -18.077 -5.773 1.00 0.00 H new ATOM 0 HB2 LEU A 29 1.216 -16.852 -5.393 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.214 -16.009 -5.955 1.00 0.00 H new ATOM 0 HG LEU A 29 0.404 -17.048 -3.222 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.051 -14.544 -2.723 1.00 0.00 H new ATOM 0 HD12 LEU A 29 1.213 -14.745 -3.959 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.447 -14.329 -4.444 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.672 -16.183 -2.301 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.284 -15.935 -3.954 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.900 -17.577 -3.384 1.00 0.00 H new ATOM 472 N PHE A 30 1.261 -18.848 -7.369 1.00 0.00 N ATOM 473 CA PHE A 30 1.835 -19.162 -8.695 1.00 0.00 C ATOM 474 C PHE A 30 2.699 -20.415 -8.669 1.00 0.00 C ATOM 475 O PHE A 30 3.178 -20.855 -7.618 1.00 0.00 O ATOM 476 CB PHE A 30 2.669 -17.991 -9.281 1.00 0.00 C ATOM 477 CG PHE A 30 2.082 -16.598 -9.194 1.00 0.00 C ATOM 478 CD1 PHE A 30 2.067 -15.885 -7.974 1.00 0.00 C ATOM 479 CD2 PHE A 30 1.579 -15.995 -10.358 1.00 0.00 C ATOM 480 CE1 PHE A 30 1.443 -14.628 -7.879 1.00 0.00 C ATOM 481 CE2 PHE A 30 0.999 -14.722 -10.281 1.00 0.00 C ATOM 482 CZ PHE A 30 0.864 -14.075 -9.041 1.00 0.00 C ATOM 0 H PHE A 30 1.914 -18.992 -6.599 1.00 0.00 H new ATOM 0 HA PHE A 30 0.973 -19.335 -9.340 1.00 0.00 H new ATOM 0 HB2 PHE A 30 3.634 -17.981 -8.775 1.00 0.00 H new ATOM 0 HB3 PHE A 30 2.862 -18.209 -10.331 1.00 0.00 H new ATOM 0 HD1 PHE A 30 2.541 -16.311 -7.102 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.639 -16.509 -11.306 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.408 -14.098 -6.938 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.653 -14.235 -11.181 1.00 0.00 H new ATOM 0 HZ PHE A 30 0.313 -13.148 -8.977 1.00 0.00 H new ATOM 492 N ILE A 31 2.945 -20.933 -9.871 1.00 0.00 N ATOM 493 CA ILE A 31 3.877 -22.029 -10.161 1.00 0.00 C ATOM 494 C ILE A 31 4.812 -21.522 -11.258 1.00 0.00 C ATOM 495 O ILE A 31 4.371 -20.783 -12.140 1.00 0.00 O ATOM 496 CB ILE A 31 3.144 -23.307 -10.600 1.00 0.00 C ATOM 497 CG1 ILE A 31 2.105 -23.669 -9.530 1.00 0.00 C ATOM 498 CG2 ILE A 31 4.125 -24.479 -10.858 1.00 0.00 C ATOM 499 CD1 ILE A 31 1.296 -24.923 -9.828 1.00 0.00 C ATOM 0 H ILE A 31 2.480 -20.586 -10.710 1.00 0.00 H new ATOM 0 HA ILE A 31 4.433 -22.304 -9.265 1.00 0.00 H new ATOM 0 HB ILE A 31 2.641 -23.120 -11.549 1.00 0.00 H new ATOM 0 HG12 ILE A 31 2.616 -23.801 -8.576 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.419 -22.830 -9.411 1.00 0.00 H new ATOM 0 HG21 ILE A 31 3.564 -25.362 -11.166 1.00 0.00 H new ATOM 0 HG22 ILE A 31 4.825 -24.201 -11.646 1.00 0.00 H new ATOM 0 HG23 ILE A 31 4.676 -24.700 -9.944 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.588 -25.100 -9.018 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.752 -24.791 -10.763 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.968 -25.777 -9.916 1.00 0.00 H new ATOM 511 N ILE A 32 6.073 -21.930 -11.236 1.00 0.00 N ATOM 512 CA ILE A 32 7.124 -21.543 -12.179 1.00 0.00 C ATOM 513 C ILE A 32 7.848 -22.760 -12.698 1.00 0.00 C ATOM 514 O ILE A 32 7.900 -23.789 -12.031 1.00 0.00 O ATOM 515 CB ILE A 32 8.074 -20.536 -11.484 1.00 0.00 C ATOM 516 CG1 ILE A 32 7.346 -19.182 -11.469 1.00 0.00 C ATOM 517 CG2 ILE A 32 9.485 -20.412 -12.101 1.00 0.00 C ATOM 518 CD1 ILE A 32 8.171 -18.052 -10.862 1.00 0.00 C ATOM 0 H ILE A 32 6.413 -22.575 -10.523 1.00 0.00 H new ATOM 0 HA ILE A 32 6.687 -21.053 -13.049 1.00 0.00 H new ATOM 0 HB ILE A 32 8.282 -20.908 -10.481 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.074 -18.914 -12.490 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.417 -19.284 -10.908 1.00 0.00 H new ATOM 0 HG21 ILE A 32 10.065 -19.681 -11.538 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.985 -21.380 -12.063 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.401 -20.087 -13.138 1.00 0.00 H new ATOM 0 HD11 ILE A 32 7.594 -17.127 -10.885 1.00 0.00 H new ATOM 0 HD12 ILE A 32 8.421 -18.298 -9.830 1.00 0.00 H new ATOM 0 HD13 ILE A 32 9.088 -17.922 -11.437 1.00 0.00 H new ATOM 530 N GLU A 33 8.444 -22.603 -13.873 1.00 0.00 N ATOM 531 CA GLU A 33 9.371 -23.539 -14.488 1.00 0.00 C ATOM 532 C GLU A 33 10.726 -22.848 -14.663 1.00 0.00 C ATOM 533 O GLU A 33 10.797 -21.796 -15.300 1.00 0.00 O ATOM 534 CB GLU A 33 8.810 -23.922 -15.865 1.00 0.00 C ATOM 535 CG GLU A 33 9.553 -25.123 -16.416 1.00 0.00 C ATOM 536 CD GLU A 33 9.206 -25.363 -17.897 1.00 0.00 C ATOM 537 OE1 GLU A 33 8.166 -26.002 -18.181 1.00 0.00 O ATOM 538 OE2 GLU A 33 9.985 -24.932 -18.778 1.00 0.00 O ATOM 0 H GLU A 33 8.285 -21.777 -14.450 1.00 0.00 H new ATOM 0 HA GLU A 33 9.495 -24.428 -13.870 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.747 -24.149 -15.783 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.904 -23.080 -16.551 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.627 -24.968 -16.312 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.301 -26.009 -15.833 1.00 0.00 H new ATOM 545 N GLN A 34 11.797 -23.446 -14.142 1.00 0.00 N ATOM 546 CA GLN A 34 13.184 -22.987 -14.314 1.00 0.00 C ATOM 547 C GLN A 34 13.742 -23.290 -15.732 1.00 0.00 C ATOM 548 O GLN A 34 14.918 -23.631 -15.885 1.00 0.00 O ATOM 549 CB GLN A 34 14.039 -23.593 -13.182 1.00 0.00 C ATOM 550 CG GLN A 34 13.646 -23.066 -11.789 1.00 0.00 C ATOM 551 CD GLN A 34 14.413 -23.779 -10.675 1.00 0.00 C ATOM 552 OE1 GLN A 34 15.575 -24.152 -10.804 1.00 0.00 O ATOM 553 NE2 GLN A 34 13.812 -23.992 -9.526 1.00 0.00 N ATOM 0 H GLN A 34 11.726 -24.288 -13.571 1.00 0.00 H new ATOM 0 HA GLN A 34 13.220 -21.900 -14.239 1.00 0.00 H new ATOM 0 HB2 GLN A 34 13.937 -24.678 -13.197 1.00 0.00 H new ATOM 0 HB3 GLN A 34 15.090 -23.369 -13.367 1.00 0.00 H new ATOM 0 HG2 GLN A 34 13.842 -21.995 -11.737 1.00 0.00 H new ATOM 0 HG3 GLN A 34 12.575 -23.202 -11.638 1.00 0.00 H new ATOM 0 HE21 GLN A 34 12.846 -23.692 -9.392 1.00 0.00 H new ATOM 0 HE22 GLN A 34 14.311 -24.457 -8.768 1.00 0.00 H new ATOM 562 N ASP A 35 12.896 -23.135 -16.760 1.00 0.00 N ATOM 563 CA ASP A 35 13.101 -23.426 -18.187 1.00 0.00 C ATOM 564 C ASP A 35 13.643 -24.835 -18.517 1.00 0.00 C ATOM 565 O ASP A 35 14.829 -25.144 -18.376 1.00 0.00 O ATOM 566 CB ASP A 35 13.944 -22.324 -18.832 1.00 0.00 C ATOM 567 CG ASP A 35 14.186 -22.539 -20.335 1.00 0.00 C ATOM 568 OD1 ASP A 35 13.330 -23.147 -21.021 1.00 0.00 O ATOM 569 OD2 ASP A 35 15.250 -22.097 -20.836 1.00 0.00 O ATOM 0 H ASP A 35 11.959 -22.767 -16.598 1.00 0.00 H new ATOM 0 HA ASP A 35 12.103 -23.434 -18.626 1.00 0.00 H new ATOM 0 HB2 ASP A 35 13.448 -21.365 -18.685 1.00 0.00 H new ATOM 0 HB3 ASP A 35 14.905 -22.267 -18.322 1.00 0.00 H new ATOM 574 N GLN A 36 12.754 -25.664 -19.054 1.00 0.00 N ATOM 575 CA GLN A 36 12.992 -27.055 -19.451 1.00 0.00 C ATOM 576 C GLN A 36 12.538 -27.375 -20.891 1.00 0.00 C ATOM 577 O GLN A 36 12.361 -28.547 -21.232 1.00 0.00 O ATOM 578 CB GLN A 36 12.412 -27.993 -18.387 1.00 0.00 C ATOM 579 CG GLN A 36 10.897 -28.248 -18.411 1.00 0.00 C ATOM 580 CD GLN A 36 10.580 -29.741 -18.504 1.00 0.00 C ATOM 581 OE1 GLN A 36 10.371 -30.431 -17.514 1.00 0.00 O ATOM 582 NE2 GLN A 36 10.635 -30.318 -19.688 1.00 0.00 N ATOM 0 H GLN A 36 11.794 -25.371 -19.236 1.00 0.00 H new ATOM 0 HA GLN A 36 14.068 -27.222 -19.492 1.00 0.00 H new ATOM 0 HB2 GLN A 36 12.916 -28.955 -18.477 1.00 0.00 H new ATOM 0 HB3 GLN A 36 12.669 -27.589 -17.408 1.00 0.00 H new ATOM 0 HG2 GLN A 36 10.443 -27.834 -17.510 1.00 0.00 H new ATOM 0 HG3 GLN A 36 10.453 -27.727 -19.260 1.00 0.00 H new ATOM 0 HE21 GLN A 36 10.808 -29.756 -20.522 1.00 0.00 H new ATOM 0 HE22 GLN A 36 10.504 -31.326 -19.771 1.00 0.00 H new ATOM 591 N ALA A 37 12.328 -26.361 -21.741 1.00 0.00 N ATOM 592 CA ALA A 37 11.863 -26.535 -23.121 1.00 0.00 C ATOM 593 C ALA A 37 12.782 -27.437 -23.970 1.00 0.00 C ATOM 594 O ALA A 37 12.307 -28.375 -24.618 1.00 0.00 O ATOM 595 CB ALA A 37 11.699 -25.140 -23.742 1.00 0.00 C ATOM 0 H ALA A 37 12.479 -25.385 -21.485 1.00 0.00 H new ATOM 0 HA ALA A 37 10.907 -27.059 -23.105 1.00 0.00 H new ATOM 0 HB1 ALA A 37 11.353 -25.238 -24.771 1.00 0.00 H new ATOM 0 HB2 ALA A 37 10.970 -24.569 -23.167 1.00 0.00 H new ATOM 0 HB3 ALA A 37 12.657 -24.621 -23.729 1.00 0.00 H new ATOM 601 N SER A 38 14.102 -27.207 -23.928 1.00 0.00 N ATOM 602 CA SER A 38 15.107 -28.028 -24.638 1.00 0.00 C ATOM 603 C SER A 38 15.421 -29.350 -23.941 1.00 0.00 C ATOM 604 O SER A 38 16.046 -30.219 -24.547 1.00 0.00 O ATOM 605 CB SER A 38 16.436 -27.276 -24.808 1.00 0.00 C ATOM 606 OG SER A 38 16.223 -25.935 -25.221 1.00 0.00 O ATOM 0 H SER A 38 14.511 -26.439 -23.396 1.00 0.00 H new ATOM 0 HA SER A 38 14.649 -28.237 -25.605 1.00 0.00 H new ATOM 0 HB2 SER A 38 16.984 -27.285 -23.866 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.056 -27.790 -25.543 1.00 0.00 H new ATOM 0 HG SER A 38 17.086 -25.482 -25.319 1.00 0.00 H new ATOM 612 N LYS A 39 15.024 -29.519 -22.674 1.00 0.00 N ATOM 613 CA LYS A 39 15.411 -30.659 -21.839 1.00 0.00 C ATOM 614 C LYS A 39 14.881 -31.984 -22.385 1.00 0.00 C ATOM 615 O LYS A 39 15.626 -32.954 -22.484 1.00 0.00 O ATOM 616 CB LYS A 39 14.945 -30.393 -20.403 1.00 0.00 C ATOM 617 CG LYS A 39 15.563 -31.344 -19.373 1.00 0.00 C ATOM 618 CD LYS A 39 15.038 -31.063 -17.956 1.00 0.00 C ATOM 619 CE LYS A 39 13.548 -31.405 -17.850 1.00 0.00 C ATOM 620 NZ LYS A 39 13.012 -31.181 -16.481 1.00 0.00 N ATOM 0 H LYS A 39 14.415 -28.856 -22.194 1.00 0.00 H new ATOM 0 HA LYS A 39 16.496 -30.759 -21.850 1.00 0.00 H new ATOM 0 HB2 LYS A 39 15.194 -29.367 -20.133 1.00 0.00 H new ATOM 0 HB3 LYS A 39 13.859 -30.480 -20.360 1.00 0.00 H new ATOM 0 HG2 LYS A 39 15.337 -32.375 -19.647 1.00 0.00 H new ATOM 0 HG3 LYS A 39 16.648 -31.241 -19.387 1.00 0.00 H new ATOM 0 HD2 LYS A 39 15.603 -31.649 -17.231 1.00 0.00 H new ATOM 0 HD3 LYS A 39 15.193 -30.013 -17.707 1.00 0.00 H new ATOM 0 HE2 LYS A 39 12.987 -30.798 -18.561 1.00 0.00 H new ATOM 0 HE3 LYS A 39 13.396 -32.447 -18.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 11.988 -31.008 -16.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 13.192 -32.022 -15.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.481 -30.356 -16.055 1.00 0.00 H new ATOM 634 N ASP A 40 13.613 -32.008 -22.800 1.00 0.00 N ATOM 635 CA ASP A 40 13.026 -33.141 -23.526 1.00 0.00 C ATOM 636 C ASP A 40 13.570 -33.226 -24.965 1.00 0.00 C ATOM 637 O ASP A 40 13.970 -34.296 -25.430 1.00 0.00 O ATOM 638 CB ASP A 40 11.497 -32.993 -23.558 1.00 0.00 C ATOM 639 CG ASP A 40 10.829 -34.224 -24.201 1.00 0.00 C ATOM 640 OD1 ASP A 40 10.751 -35.283 -23.539 1.00 0.00 O ATOM 641 OD2 ASP A 40 10.366 -34.122 -25.363 1.00 0.00 O ATOM 0 H ASP A 40 12.960 -31.240 -22.642 1.00 0.00 H new ATOM 0 HA ASP A 40 13.300 -34.059 -23.006 1.00 0.00 H new ATOM 0 HB2 ASP A 40 11.121 -32.861 -22.544 1.00 0.00 H new ATOM 0 HB3 ASP A 40 11.228 -32.097 -24.117 1.00 0.00 H new ATOM 646 N PHE A 41 13.595 -32.085 -25.662 1.00 0.00 N ATOM 647 CA PHE A 41 13.864 -31.999 -27.098 1.00 0.00 C ATOM 648 C PHE A 41 15.291 -32.405 -27.504 1.00 0.00 C ATOM 649 O PHE A 41 15.502 -32.970 -28.580 1.00 0.00 O ATOM 650 CB PHE A 41 13.537 -30.573 -27.563 1.00 0.00 C ATOM 651 CG PHE A 41 13.096 -30.509 -29.007 1.00 0.00 C ATOM 652 CD1 PHE A 41 11.786 -30.898 -29.337 1.00 0.00 C ATOM 653 CD2 PHE A 41 13.980 -30.078 -30.016 1.00 0.00 C ATOM 654 CE1 PHE A 41 11.358 -30.855 -30.676 1.00 0.00 C ATOM 655 CE2 PHE A 41 13.556 -30.046 -31.357 1.00 0.00 C ATOM 656 CZ PHE A 41 12.243 -30.429 -31.686 1.00 0.00 C ATOM 0 H PHE A 41 13.425 -31.176 -25.232 1.00 0.00 H new ATOM 0 HA PHE A 41 13.225 -32.728 -27.596 1.00 0.00 H new ATOM 0 HB2 PHE A 41 12.750 -30.162 -26.930 1.00 0.00 H new ATOM 0 HB3 PHE A 41 14.416 -29.943 -27.429 1.00 0.00 H new ATOM 0 HD1 PHE A 41 11.109 -31.229 -28.563 1.00 0.00 H new ATOM 0 HD2 PHE A 41 14.984 -29.772 -29.760 1.00 0.00 H new ATOM 0 HE1 PHE A 41 10.350 -31.149 -30.930 1.00 0.00 H new ATOM 0 HE2 PHE A 41 14.237 -29.728 -32.132 1.00 0.00 H new ATOM 0 HZ PHE A 41 11.913 -30.396 -32.714 1.00 0.00 H new ATOM 666 N ASN A 42 16.278 -32.144 -26.643 1.00 0.00 N ATOM 667 CA ASN A 42 17.633 -32.666 -26.784 1.00 0.00 C ATOM 668 C ASN A 42 17.685 -34.160 -26.480 1.00 0.00 C ATOM 669 O ASN A 42 18.145 -34.953 -27.303 1.00 0.00 O ATOM 670 CB ASN A 42 18.565 -31.921 -25.809 1.00 0.00 C ATOM 671 CG ASN A 42 19.989 -32.474 -25.802 1.00 0.00 C ATOM 672 OD1 ASN A 42 20.592 -32.706 -26.840 1.00 0.00 O ATOM 673 ND2 ASN A 42 20.557 -32.710 -24.642 1.00 0.00 N ATOM 0 H ASN A 42 16.153 -31.556 -25.819 1.00 0.00 H new ATOM 0 HA ASN A 42 17.955 -32.513 -27.814 1.00 0.00 H new ATOM 0 HB2 ASN A 42 18.593 -30.865 -26.078 1.00 0.00 H new ATOM 0 HB3 ASN A 42 18.152 -31.983 -24.802 1.00 0.00 H new ATOM 0 HD21 ASN A 42 21.504 -33.088 -24.605 1.00 0.00 H new ATOM 0 HD22 ASN A 42 20.052 -32.515 -23.778 1.00 0.00 H new ATOM 680 N ARG A 43 17.214 -34.533 -25.282 1.00 0.00 N ATOM 681 CA ARG A 43 17.445 -35.868 -24.741 1.00 0.00 C ATOM 682 C ARG A 43 16.724 -36.984 -25.497 1.00 0.00 C ATOM 683 O ARG A 43 17.246 -38.093 -25.556 1.00 0.00 O ATOM 684 CB ARG A 43 17.091 -35.937 -23.249 1.00 0.00 C ATOM 685 CG ARG A 43 18.061 -35.132 -22.370 1.00 0.00 C ATOM 686 CD ARG A 43 17.687 -35.325 -20.894 1.00 0.00 C ATOM 687 NE ARG A 43 18.523 -34.502 -20.005 1.00 0.00 N ATOM 688 CZ ARG A 43 19.736 -34.761 -19.562 1.00 0.00 C ATOM 689 NH1 ARG A 43 20.424 -35.808 -19.906 1.00 0.00 N ATOM 690 NH2 ARG A 43 20.290 -33.955 -18.712 1.00 0.00 N ATOM 0 H ARG A 43 16.670 -33.923 -24.672 1.00 0.00 H new ATOM 0 HA ARG A 43 18.513 -36.042 -24.873 1.00 0.00 H new ATOM 0 HB2 ARG A 43 16.078 -35.562 -23.103 1.00 0.00 H new ATOM 0 HB3 ARG A 43 17.095 -36.978 -22.927 1.00 0.00 H new ATOM 0 HG2 ARG A 43 19.086 -35.461 -22.543 1.00 0.00 H new ATOM 0 HG3 ARG A 43 18.017 -34.075 -22.633 1.00 0.00 H new ATOM 0 HD2 ARG A 43 16.638 -35.067 -20.748 1.00 0.00 H new ATOM 0 HD3 ARG A 43 17.797 -36.376 -20.626 1.00 0.00 H new ATOM 0 HE ARG A 43 18.112 -33.622 -19.693 1.00 0.00 H new ATOM 0 HH11 ARG A 43 20.028 -36.487 -20.556 1.00 0.00 H new ATOM 0 HH12 ARG A 43 21.360 -35.951 -19.526 1.00 0.00 H new ATOM 0 HH21 ARG A 43 19.787 -33.128 -18.391 1.00 0.00 H new ATOM 0 HH22 ARG A 43 21.229 -34.148 -18.364 1.00 0.00 H new ATOM 704 N SER A 44 15.569 -36.703 -26.103 1.00 0.00 N ATOM 705 CA SER A 44 14.756 -37.669 -26.870 1.00 0.00 C ATOM 706 C SER A 44 15.550 -38.445 -27.932 1.00 0.00 C ATOM 707 O SER A 44 15.312 -39.637 -28.148 1.00 0.00 O ATOM 708 CB SER A 44 13.561 -36.960 -27.524 1.00 0.00 C ATOM 709 OG SER A 44 14.018 -35.995 -28.459 1.00 0.00 O ATOM 0 H SER A 44 15.155 -35.771 -26.077 1.00 0.00 H new ATOM 0 HA SER A 44 14.407 -38.407 -26.148 1.00 0.00 H new ATOM 0 HB2 SER A 44 12.925 -37.690 -28.025 1.00 0.00 H new ATOM 0 HB3 SER A 44 12.952 -36.477 -26.760 1.00 0.00 H new ATOM 0 HG SER A 44 13.249 -35.550 -28.872 1.00 0.00 H new ATOM 715 N LYS A 45 16.544 -37.794 -28.545 1.00 0.00 N ATOM 716 CA LYS A 45 17.450 -38.350 -29.565 1.00 0.00 C ATOM 717 C LYS A 45 18.511 -39.327 -29.025 1.00 0.00 C ATOM 718 O LYS A 45 19.208 -39.961 -29.824 1.00 0.00 O ATOM 719 CB LYS A 45 18.137 -37.175 -30.289 1.00 0.00 C ATOM 720 CG LYS A 45 17.130 -36.291 -31.052 1.00 0.00 C ATOM 721 CD LYS A 45 17.795 -35.075 -31.710 1.00 0.00 C ATOM 722 CE LYS A 45 18.243 -34.040 -30.669 1.00 0.00 C ATOM 723 NZ LYS A 45 18.820 -32.831 -31.314 1.00 0.00 N ATOM 0 H LYS A 45 16.752 -36.818 -28.336 1.00 0.00 H new ATOM 0 HA LYS A 45 16.837 -38.946 -30.241 1.00 0.00 H new ATOM 0 HB2 LYS A 45 18.674 -36.566 -29.561 1.00 0.00 H new ATOM 0 HB3 LYS A 45 18.878 -37.564 -30.987 1.00 0.00 H new ATOM 0 HG2 LYS A 45 16.634 -36.888 -31.817 1.00 0.00 H new ATOM 0 HG3 LYS A 45 16.357 -35.950 -30.364 1.00 0.00 H new ATOM 0 HD2 LYS A 45 18.657 -35.402 -32.292 1.00 0.00 H new ATOM 0 HD3 LYS A 45 17.097 -34.611 -32.407 1.00 0.00 H new ATOM 0 HE2 LYS A 45 17.392 -33.753 -30.051 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.983 -34.487 -30.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 19.112 -32.153 -30.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 19.646 -33.103 -31.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 18.106 -32.391 -31.928 1.00 0.00 H new ATOM 737 N ALA A 46 18.653 -39.450 -27.700 1.00 0.00 N ATOM 738 CA ALA A 46 19.751 -40.163 -27.035 1.00 0.00 C ATOM 739 C ALA A 46 19.345 -40.902 -25.734 1.00 0.00 C ATOM 740 O ALA A 46 20.222 -41.281 -24.953 1.00 0.00 O ATOM 741 CB ALA A 46 20.870 -39.138 -26.782 1.00 0.00 C ATOM 0 H ALA A 46 17.988 -39.045 -27.041 1.00 0.00 H new ATOM 0 HA ALA A 46 20.087 -40.967 -27.690 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.708 -39.629 -26.287 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.203 -38.721 -27.732 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.493 -38.337 -26.147 1.00 0.00 H new ATOM 747 N LEU A 47 18.045 -41.108 -25.479 1.00 0.00 N ATOM 748 CA LEU A 47 17.538 -41.775 -24.269 1.00 0.00 C ATOM 749 C LEU A 47 18.148 -43.168 -24.040 1.00 0.00 C ATOM 750 O LEU A 47 18.505 -43.873 -24.986 1.00 0.00 O ATOM 751 CB LEU A 47 15.996 -41.904 -24.305 1.00 0.00 C ATOM 752 CG LEU A 47 15.219 -40.580 -24.383 1.00 0.00 C ATOM 753 CD1 LEU A 47 13.718 -40.862 -24.403 1.00 0.00 C ATOM 754 CD2 LEU A 47 15.513 -39.651 -23.198 1.00 0.00 C ATOM 0 H LEU A 47 17.305 -40.812 -26.116 1.00 0.00 H new ATOM 0 HA LEU A 47 17.842 -41.137 -23.439 1.00 0.00 H new ATOM 0 HB2 LEU A 47 15.721 -42.517 -25.163 1.00 0.00 H new ATOM 0 HB3 LEU A 47 15.674 -42.441 -23.413 1.00 0.00 H new ATOM 0 HG LEU A 47 15.542 -40.083 -25.298 1.00 0.00 H new ATOM 0 HD11 LEU A 47 13.172 -39.920 -24.458 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.474 -41.474 -25.271 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.435 -41.393 -23.494 1.00 0.00 H new ATOM 0 HD21 LEU A 47 14.938 -38.731 -23.305 1.00 0.00 H new ATOM 0 HD22 LEU A 47 15.234 -40.147 -22.269 1.00 0.00 H new ATOM 0 HD23 LEU A 47 16.577 -39.413 -23.177 1.00 0.00 H new ATOM 766 N PHE A 48 18.201 -43.580 -22.769 1.00 0.00 N ATOM 767 CA PHE A 48 18.702 -44.869 -22.262 1.00 0.00 C ATOM 768 C PHE A 48 20.186 -45.202 -22.506 1.00 0.00 C ATOM 769 O PHE A 48 20.748 -46.000 -21.747 1.00 0.00 O ATOM 770 CB PHE A 48 17.790 -46.019 -22.731 1.00 0.00 C ATOM 771 CG PHE A 48 16.683 -46.303 -21.750 1.00 0.00 C ATOM 772 CD1 PHE A 48 16.931 -47.185 -20.685 1.00 0.00 C ATOM 773 CD2 PHE A 48 15.437 -45.666 -21.867 1.00 0.00 C ATOM 774 CE1 PHE A 48 15.924 -47.445 -19.739 1.00 0.00 C ATOM 775 CE2 PHE A 48 14.427 -45.928 -20.926 1.00 0.00 C ATOM 776 CZ PHE A 48 14.669 -46.821 -19.863 1.00 0.00 C ATOM 0 H PHE A 48 17.872 -42.982 -22.011 1.00 0.00 H new ATOM 0 HA PHE A 48 18.660 -44.752 -21.179 1.00 0.00 H new ATOM 0 HB2 PHE A 48 17.359 -45.767 -23.700 1.00 0.00 H new ATOM 0 HB3 PHE A 48 18.387 -46.920 -22.873 1.00 0.00 H new ATOM 0 HD1 PHE A 48 17.895 -47.663 -20.593 1.00 0.00 H new ATOM 0 HD2 PHE A 48 15.256 -44.976 -22.678 1.00 0.00 H new ATOM 0 HE1 PHE A 48 16.113 -48.122 -18.919 1.00 0.00 H new ATOM 0 HE2 PHE A 48 13.465 -45.445 -21.017 1.00 0.00 H new ATOM 0 HZ PHE A 48 13.891 -47.027 -19.143 1.00 0.00 H new ATOM 786 N SER A 49 20.836 -44.622 -23.516 1.00 0.00 N ATOM 787 CA SER A 49 22.239 -44.903 -23.819 1.00 0.00 C ATOM 788 C SER A 49 23.182 -44.410 -22.712 1.00 0.00 C ATOM 789 O SER A 49 22.920 -43.395 -22.064 1.00 0.00 O ATOM 790 CB SER A 49 22.635 -44.257 -25.150 1.00 0.00 C ATOM 791 OG SER A 49 21.881 -44.819 -26.216 1.00 0.00 O ATOM 0 H SER A 49 20.405 -43.945 -24.146 1.00 0.00 H new ATOM 0 HA SER A 49 22.339 -45.986 -23.887 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.466 -43.181 -25.104 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.700 -44.405 -25.331 1.00 0.00 H new ATOM 0 HG SER A 49 22.143 -44.396 -27.060 1.00 0.00 H new ATOM 797 N GLN A 50 24.312 -45.101 -22.524 1.00 0.00 N ATOM 798 CA GLN A 50 25.294 -44.801 -21.474 1.00 0.00 C ATOM 799 C GLN A 50 25.846 -43.360 -21.542 1.00 0.00 C ATOM 800 O GLN A 50 26.201 -42.797 -20.509 1.00 0.00 O ATOM 801 CB GLN A 50 26.410 -45.861 -21.531 1.00 0.00 C ATOM 802 CG GLN A 50 27.480 -45.737 -20.429 1.00 0.00 C ATOM 803 CD GLN A 50 26.920 -45.853 -19.009 1.00 0.00 C ATOM 804 OE1 GLN A 50 26.780 -46.932 -18.446 1.00 0.00 O ATOM 805 NE2 GLN A 50 26.573 -44.752 -18.374 1.00 0.00 N ATOM 0 H GLN A 50 24.575 -45.897 -23.106 1.00 0.00 H new ATOM 0 HA GLN A 50 24.792 -44.850 -20.508 1.00 0.00 H new ATOM 0 HB2 GLN A 50 25.956 -46.850 -21.466 1.00 0.00 H new ATOM 0 HB3 GLN A 50 26.901 -45.799 -22.502 1.00 0.00 H new ATOM 0 HG2 GLN A 50 28.232 -46.512 -20.577 1.00 0.00 H new ATOM 0 HG3 GLN A 50 27.986 -44.777 -20.533 1.00 0.00 H new ATOM 0 HE21 GLN A 50 26.683 -43.845 -18.828 1.00 0.00 H new ATOM 0 HE22 GLN A 50 26.194 -44.806 -17.428 1.00 0.00 H new ATOM 814 N SER A 51 25.859 -42.737 -22.727 1.00 0.00 N ATOM 815 CA SER A 51 26.212 -41.323 -22.925 1.00 0.00 C ATOM 816 C SER A 51 25.295 -40.375 -22.143 1.00 0.00 C ATOM 817 O SER A 51 25.772 -39.618 -21.297 1.00 0.00 O ATOM 818 CB SER A 51 26.174 -41.001 -24.428 1.00 0.00 C ATOM 819 OG SER A 51 24.958 -41.446 -25.014 1.00 0.00 O ATOM 0 H SER A 51 25.619 -43.213 -23.597 1.00 0.00 H new ATOM 0 HA SER A 51 27.218 -41.167 -22.537 1.00 0.00 H new ATOM 0 HB2 SER A 51 26.281 -39.926 -24.576 1.00 0.00 H new ATOM 0 HB3 SER A 51 27.018 -41.477 -24.927 1.00 0.00 H new ATOM 0 HG SER A 51 24.957 -41.229 -25.970 1.00 0.00 H new ATOM 825 N ALA A 52 23.979 -40.453 -22.351 1.00 0.00 N ATOM 826 CA ALA A 52 22.977 -39.622 -21.661 1.00 0.00 C ATOM 827 C ALA A 52 22.799 -39.950 -20.167 1.00 0.00 C ATOM 828 O ALA A 52 22.214 -39.163 -19.419 1.00 0.00 O ATOM 829 CB ALA A 52 21.650 -39.744 -22.418 1.00 0.00 C ATOM 0 H ALA A 52 23.567 -41.107 -23.016 1.00 0.00 H new ATOM 0 HA ALA A 52 23.339 -38.594 -21.671 1.00 0.00 H new ATOM 0 HB1 ALA A 52 20.892 -39.136 -21.924 1.00 0.00 H new ATOM 0 HB2 ALA A 52 21.782 -39.397 -23.443 1.00 0.00 H new ATOM 0 HB3 ALA A 52 21.330 -40.786 -22.426 1.00 0.00 H new ATOM 835 N ILE A 53 23.306 -41.107 -19.739 1.00 0.00 N ATOM 836 CA ILE A 53 23.161 -41.679 -18.394 1.00 0.00 C ATOM 837 C ILE A 53 24.470 -41.565 -17.573 1.00 0.00 C ATOM 838 O ILE A 53 24.484 -41.822 -16.366 1.00 0.00 O ATOM 839 CB ILE A 53 22.645 -43.130 -18.582 1.00 0.00 C ATOM 840 CG1 ILE A 53 21.214 -43.179 -19.187 1.00 0.00 C ATOM 841 CG2 ILE A 53 22.685 -44.005 -17.317 1.00 0.00 C ATOM 842 CD1 ILE A 53 20.097 -42.564 -18.329 1.00 0.00 C ATOM 0 H ILE A 53 23.859 -41.705 -20.353 1.00 0.00 H new ATOM 0 HA ILE A 53 22.440 -41.122 -17.796 1.00 0.00 H new ATOM 0 HB ILE A 53 23.359 -43.556 -19.286 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.230 -42.666 -20.149 1.00 0.00 H new ATOM 0 HG13 ILE A 53 20.961 -44.220 -19.385 1.00 0.00 H new ATOM 0 HG21 ILE A 53 22.305 -45.000 -17.550 1.00 0.00 H new ATOM 0 HG22 ILE A 53 23.712 -44.084 -16.961 1.00 0.00 H new ATOM 0 HG23 ILE A 53 22.066 -43.553 -16.542 1.00 0.00 H new ATOM 0 HD11 ILE A 53 19.145 -42.655 -18.851 1.00 0.00 H new ATOM 0 HD12 ILE A 53 20.040 -43.089 -17.376 1.00 0.00 H new ATOM 0 HD13 ILE A 53 20.313 -41.511 -18.151 1.00 0.00 H new ATOM 854 N SER A 54 25.573 -41.116 -18.190 1.00 0.00 N ATOM 855 CA SER A 54 26.823 -40.773 -17.498 1.00 0.00 C ATOM 856 C SER A 54 26.625 -39.649 -16.476 1.00 0.00 C ATOM 857 O SER A 54 25.851 -38.718 -16.696 1.00 0.00 O ATOM 858 CB SER A 54 27.901 -40.353 -18.489 1.00 0.00 C ATOM 859 OG SER A 54 28.344 -41.463 -19.250 1.00 0.00 O ATOM 0 H SER A 54 25.622 -40.979 -19.200 1.00 0.00 H new ATOM 0 HA SER A 54 27.139 -41.673 -16.971 1.00 0.00 H new ATOM 0 HB2 SER A 54 27.510 -39.583 -19.154 1.00 0.00 H new ATOM 0 HB3 SER A 54 28.743 -39.914 -17.953 1.00 0.00 H new ATOM 0 HG SER A 54 27.576 -41.891 -19.682 1.00 0.00 H new ATOM 865 N GLN A 55 27.368 -39.698 -15.368 1.00 0.00 N ATOM 866 CA GLN A 55 27.191 -38.835 -14.189 1.00 0.00 C ATOM 867 C GLN A 55 27.387 -37.311 -14.388 1.00 0.00 C ATOM 868 O GLN A 55 27.129 -36.498 -13.497 1.00 0.00 O ATOM 869 CB GLN A 55 27.892 -39.484 -12.973 1.00 0.00 C ATOM 870 CG GLN A 55 28.524 -38.537 -11.949 1.00 0.00 C ATOM 871 CD GLN A 55 29.092 -39.297 -10.754 1.00 0.00 C ATOM 872 OE1 GLN A 55 30.261 -39.662 -10.702 1.00 0.00 O ATOM 873 NE2 GLN A 55 28.289 -39.569 -9.744 1.00 0.00 N ATOM 0 H GLN A 55 28.136 -40.360 -15.259 1.00 0.00 H new ATOM 0 HA GLN A 55 26.124 -38.801 -13.971 1.00 0.00 H new ATOM 0 HB2 GLN A 55 27.163 -40.107 -12.454 1.00 0.00 H new ATOM 0 HB3 GLN A 55 28.671 -40.149 -13.346 1.00 0.00 H new ATOM 0 HG2 GLN A 55 29.318 -37.963 -12.426 1.00 0.00 H new ATOM 0 HG3 GLN A 55 27.777 -37.822 -11.604 1.00 0.00 H new ATOM 0 HE21 GLN A 55 27.314 -39.271 -9.773 1.00 0.00 H new ATOM 0 HE22 GLN A 55 28.643 -40.077 -8.933 1.00 0.00 H new ATOM 882 N LYS A 56 27.818 -36.881 -15.570 1.00 0.00 N ATOM 883 CA LYS A 56 27.890 -35.455 -15.938 1.00 0.00 C ATOM 884 C LYS A 56 26.780 -35.012 -16.913 1.00 0.00 C ATOM 885 O LYS A 56 26.532 -33.818 -17.055 1.00 0.00 O ATOM 886 CB LYS A 56 29.314 -35.118 -16.425 1.00 0.00 C ATOM 887 CG LYS A 56 30.062 -36.301 -17.081 1.00 0.00 C ATOM 888 CD LYS A 56 31.375 -35.899 -17.763 1.00 0.00 C ATOM 889 CE LYS A 56 31.184 -35.037 -19.023 1.00 0.00 C ATOM 890 NZ LYS A 56 30.526 -35.786 -20.134 1.00 0.00 N ATOM 0 H LYS A 56 28.131 -37.509 -16.310 1.00 0.00 H new ATOM 0 HA LYS A 56 27.692 -34.864 -15.044 1.00 0.00 H new ATOM 0 HB2 LYS A 56 29.255 -34.299 -17.142 1.00 0.00 H new ATOM 0 HB3 LYS A 56 29.899 -34.759 -15.578 1.00 0.00 H new ATOM 0 HG2 LYS A 56 30.273 -37.052 -16.320 1.00 0.00 H new ATOM 0 HG3 LYS A 56 29.409 -36.769 -17.818 1.00 0.00 H new ATOM 0 HD2 LYS A 56 31.991 -35.351 -17.050 1.00 0.00 H new ATOM 0 HD3 LYS A 56 31.925 -36.801 -18.032 1.00 0.00 H new ATOM 0 HE2 LYS A 56 30.583 -34.162 -18.773 1.00 0.00 H new ATOM 0 HE3 LYS A 56 32.154 -34.672 -19.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 30.344 -35.140 -20.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 31.149 -36.556 -20.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 29.626 -36.185 -19.799 1.00 0.00 H new ATOM 904 N GLU A 57 26.077 -35.958 -17.532 1.00 0.00 N ATOM 905 CA GLU A 57 24.884 -35.745 -18.369 1.00 0.00 C ATOM 906 C GLU A 57 23.554 -35.989 -17.638 1.00 0.00 C ATOM 907 O GLU A 57 22.554 -35.348 -17.951 1.00 0.00 O ATOM 908 CB GLU A 57 24.923 -36.739 -19.537 1.00 0.00 C ATOM 909 CG GLU A 57 25.739 -36.245 -20.740 1.00 0.00 C ATOM 910 CD GLU A 57 27.220 -35.962 -20.413 1.00 0.00 C ATOM 911 OE1 GLU A 57 27.958 -36.876 -19.974 1.00 0.00 O ATOM 912 OE2 GLU A 57 27.683 -34.819 -20.632 1.00 0.00 O ATOM 0 H GLU A 57 26.331 -36.944 -17.464 1.00 0.00 H new ATOM 0 HA GLU A 57 24.917 -34.701 -18.679 1.00 0.00 H new ATOM 0 HB2 GLU A 57 25.343 -37.682 -19.187 1.00 0.00 H new ATOM 0 HB3 GLU A 57 23.903 -36.946 -19.861 1.00 0.00 H new ATOM 0 HG2 GLU A 57 25.688 -36.991 -21.533 1.00 0.00 H new ATOM 0 HG3 GLU A 57 25.282 -35.335 -21.128 1.00 0.00 H new ATOM 919 N TYR A 58 23.519 -36.930 -16.697 1.00 0.00 N ATOM 920 CA TYR A 58 22.322 -37.505 -16.066 1.00 0.00 C ATOM 921 C TYR A 58 21.446 -36.590 -15.180 1.00 0.00 C ATOM 922 O TYR A 58 20.459 -37.048 -14.607 1.00 0.00 O ATOM 923 CB TYR A 58 22.790 -38.755 -15.298 1.00 0.00 C ATOM 924 CG TYR A 58 23.554 -38.590 -13.980 1.00 0.00 C ATOM 925 CD1 TYR A 58 24.017 -37.339 -13.519 1.00 0.00 C ATOM 926 CD2 TYR A 58 23.927 -39.748 -13.269 1.00 0.00 C ATOM 927 CE1 TYR A 58 24.661 -37.218 -12.282 1.00 0.00 C ATOM 928 CE2 TYR A 58 24.678 -39.643 -12.078 1.00 0.00 C ATOM 929 CZ TYR A 58 24.960 -38.374 -11.530 1.00 0.00 C ATOM 930 OH TYR A 58 25.617 -38.274 -10.342 1.00 0.00 O ATOM 0 H TYR A 58 24.377 -37.340 -16.328 1.00 0.00 H new ATOM 0 HA TYR A 58 21.626 -37.721 -16.877 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.907 -39.360 -15.090 1.00 0.00 H new ATOM 0 HB3 TYR A 58 23.422 -39.334 -15.971 1.00 0.00 H new ATOM 0 HD1 TYR A 58 23.872 -36.461 -14.131 1.00 0.00 H new ATOM 0 HD2 TYR A 58 23.637 -40.721 -13.637 1.00 0.00 H new ATOM 0 HE1 TYR A 58 24.928 -36.242 -11.904 1.00 0.00 H new ATOM 0 HE2 TYR A 58 25.037 -40.535 -11.586 1.00 0.00 H new ATOM 0 HH TYR A 58 25.340 -39.006 -9.752 1.00 0.00 H new ATOM 940 N ASP A 59 21.788 -35.305 -15.045 1.00 0.00 N ATOM 941 CA ASP A 59 21.206 -34.372 -14.065 1.00 0.00 C ATOM 942 C ASP A 59 19.671 -34.215 -14.129 1.00 0.00 C ATOM 943 O ASP A 59 19.018 -34.084 -13.091 1.00 0.00 O ATOM 944 CB ASP A 59 21.926 -33.024 -14.191 1.00 0.00 C ATOM 945 CG ASP A 59 21.384 -31.971 -13.206 1.00 0.00 C ATOM 946 OD1 ASP A 59 21.711 -32.059 -12.001 1.00 0.00 O ATOM 947 OD2 ASP A 59 20.664 -31.037 -13.640 1.00 0.00 O ATOM 0 H ASP A 59 22.499 -34.868 -15.631 1.00 0.00 H new ATOM 0 HA ASP A 59 21.368 -34.806 -13.078 1.00 0.00 H new ATOM 0 HB2 ASP A 59 22.992 -33.167 -14.014 1.00 0.00 H new ATOM 0 HB3 ASP A 59 21.819 -32.652 -15.210 1.00 0.00 H new ATOM 952 N SER A 60 19.069 -34.305 -15.318 1.00 0.00 N ATOM 953 CA SER A 60 17.601 -34.267 -15.486 1.00 0.00 C ATOM 954 C SER A 60 16.867 -35.486 -14.893 1.00 0.00 C ATOM 955 O SER A 60 15.645 -35.443 -14.734 1.00 0.00 O ATOM 956 CB SER A 60 17.236 -34.122 -16.967 1.00 0.00 C ATOM 957 OG SER A 60 17.898 -32.995 -17.533 1.00 0.00 O ATOM 0 H SER A 60 19.579 -34.406 -16.195 1.00 0.00 H new ATOM 0 HA SER A 60 17.265 -33.397 -14.922 1.00 0.00 H new ATOM 0 HB2 SER A 60 17.517 -35.026 -17.508 1.00 0.00 H new ATOM 0 HB3 SER A 60 16.157 -34.009 -17.073 1.00 0.00 H new ATOM 0 HG SER A 60 17.753 -32.211 -16.964 1.00 0.00 H new ATOM 963 N SER A 61 17.592 -36.556 -14.537 1.00 0.00 N ATOM 964 CA SER A 61 17.077 -37.742 -13.825 1.00 0.00 C ATOM 965 C SER A 61 17.436 -37.761 -12.327 1.00 0.00 C ATOM 966 O SER A 61 16.974 -38.631 -11.588 1.00 0.00 O ATOM 967 CB SER A 61 17.593 -39.014 -14.494 1.00 0.00 C ATOM 968 OG SER A 61 17.271 -39.052 -15.878 1.00 0.00 O ATOM 0 H SER A 61 18.589 -36.625 -14.743 1.00 0.00 H new ATOM 0 HA SER A 61 15.990 -37.693 -13.886 1.00 0.00 H new ATOM 0 HB2 SER A 61 18.674 -39.076 -14.371 1.00 0.00 H new ATOM 0 HB3 SER A 61 17.165 -39.885 -13.997 1.00 0.00 H new ATOM 0 HG SER A 61 17.619 -39.879 -16.272 1.00 0.00 H new ATOM 974 N LEU A 62 18.247 -36.800 -11.864 1.00 0.00 N ATOM 975 CA LEU A 62 18.667 -36.627 -10.461 1.00 0.00 C ATOM 976 C LEU A 62 17.708 -35.741 -9.638 1.00 0.00 C ATOM 977 O LEU A 62 17.887 -35.603 -8.426 1.00 0.00 O ATOM 978 CB LEU A 62 20.101 -36.044 -10.450 1.00 0.00 C ATOM 979 CG LEU A 62 21.242 -37.048 -10.203 1.00 0.00 C ATOM 980 CD1 LEU A 62 21.236 -37.572 -8.767 1.00 0.00 C ATOM 981 CD2 LEU A 62 21.210 -38.240 -11.168 1.00 0.00 C ATOM 0 H LEU A 62 18.646 -36.091 -12.480 1.00 0.00 H new ATOM 0 HA LEU A 62 18.643 -37.604 -9.979 1.00 0.00 H new ATOM 0 HB2 LEU A 62 20.278 -35.553 -11.407 1.00 0.00 H new ATOM 0 HB3 LEU A 62 20.151 -35.273 -9.681 1.00 0.00 H new ATOM 0 HG LEU A 62 22.159 -36.488 -10.383 1.00 0.00 H new ATOM 0 HD11 LEU A 62 22.056 -38.277 -8.634 1.00 0.00 H new ATOM 0 HD12 LEU A 62 21.358 -36.739 -8.075 1.00 0.00 H new ATOM 0 HD13 LEU A 62 20.289 -38.074 -8.567 1.00 0.00 H new ATOM 0 HD21 LEU A 62 22.038 -38.912 -10.944 1.00 0.00 H new ATOM 0 HD22 LEU A 62 20.267 -38.775 -11.054 1.00 0.00 H new ATOM 0 HD23 LEU A 62 21.301 -37.881 -12.193 1.00 0.00 H new ATOM 993 N ALA A 63 16.705 -35.133 -10.279 1.00 0.00 N ATOM 994 CA ALA A 63 15.799 -34.151 -9.688 1.00 0.00 C ATOM 995 C ALA A 63 14.400 -34.160 -10.348 1.00 0.00 C ATOM 996 O ALA A 63 14.180 -34.820 -11.368 1.00 0.00 O ATOM 997 CB ALA A 63 16.482 -32.781 -9.830 1.00 0.00 C ATOM 0 H ALA A 63 16.497 -35.320 -11.260 1.00 0.00 H new ATOM 0 HA ALA A 63 15.618 -34.393 -8.641 1.00 0.00 H new ATOM 0 HB1 ALA A 63 15.842 -32.009 -9.402 1.00 0.00 H new ATOM 0 HB2 ALA A 63 17.437 -32.794 -9.304 1.00 0.00 H new ATOM 0 HB3 ALA A 63 16.652 -32.567 -10.885 1.00 0.00 H new ATOM 1003 N THR A 64 13.450 -33.426 -9.759 1.00 0.00 N ATOM 1004 CA THR A 64 12.076 -33.203 -10.265 1.00 0.00 C ATOM 1005 C THR A 64 12.060 -32.400 -11.584 1.00 0.00 C ATOM 1006 O THR A 64 13.101 -31.996 -12.106 1.00 0.00 O ATOM 1007 CB THR A 64 11.211 -32.484 -9.195 1.00 0.00 C ATOM 1008 OG1 THR A 64 11.706 -32.687 -7.884 1.00 0.00 O ATOM 1009 CG2 THR A 64 9.755 -32.970 -9.178 1.00 0.00 C ATOM 0 H THR A 64 13.618 -32.946 -8.875 1.00 0.00 H new ATOM 0 HA THR A 64 11.651 -34.185 -10.473 1.00 0.00 H new ATOM 0 HB THR A 64 11.259 -31.432 -9.477 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.134 -32.217 -7.242 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.200 -32.431 -8.410 1.00 0.00 H new ATOM 0 HG22 THR A 64 9.299 -32.787 -10.151 1.00 0.00 H new ATOM 0 HG23 THR A 64 9.730 -34.038 -8.961 1.00 0.00 H new ATOM 1017 N LEU A 65 10.868 -32.093 -12.100 1.00 0.00 N ATOM 1018 CA LEU A 65 10.572 -31.270 -13.290 1.00 0.00 C ATOM 1019 C LEU A 65 10.972 -29.768 -13.181 1.00 0.00 C ATOM 1020 O LEU A 65 10.424 -28.923 -13.888 1.00 0.00 O ATOM 1021 CB LEU A 65 9.067 -31.410 -13.609 1.00 0.00 C ATOM 1022 CG LEU A 65 8.539 -32.852 -13.747 1.00 0.00 C ATOM 1023 CD1 LEU A 65 7.037 -32.818 -14.025 1.00 0.00 C ATOM 1024 CD2 LEU A 65 9.238 -33.621 -14.875 1.00 0.00 C ATOM 0 H LEU A 65 10.011 -32.438 -11.667 1.00 0.00 H new ATOM 0 HA LEU A 65 11.196 -31.652 -14.098 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.501 -30.910 -12.823 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.861 -30.878 -14.538 1.00 0.00 H new ATOM 0 HG LEU A 65 8.748 -33.368 -12.810 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.662 -33.837 -14.123 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.526 -32.321 -13.201 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.850 -32.272 -14.950 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.832 -34.631 -14.933 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.072 -33.108 -15.822 1.00 0.00 H new ATOM 0 HD23 LEU A 65 10.308 -33.671 -14.673 1.00 0.00 H new ATOM 1036 N ASP A 66 11.905 -29.425 -12.284 1.00 0.00 N ATOM 1037 CA ASP A 66 12.462 -28.084 -12.034 1.00 0.00 C ATOM 1038 C ASP A 66 11.438 -26.941 -11.867 1.00 0.00 C ATOM 1039 O ASP A 66 11.719 -25.779 -12.170 1.00 0.00 O ATOM 1040 CB ASP A 66 13.640 -27.808 -12.987 1.00 0.00 C ATOM 1041 CG ASP A 66 13.266 -27.760 -14.472 1.00 0.00 C ATOM 1042 OD1 ASP A 66 12.888 -26.676 -14.972 1.00 0.00 O ATOM 1043 OD2 ASP A 66 13.419 -28.809 -15.149 1.00 0.00 O ATOM 0 H ASP A 66 12.322 -30.124 -11.669 1.00 0.00 H new ATOM 0 HA ASP A 66 12.872 -28.098 -11.024 1.00 0.00 H new ATOM 0 HB2 ASP A 66 14.098 -26.858 -12.711 1.00 0.00 H new ATOM 0 HB3 ASP A 66 14.396 -28.580 -12.842 1.00 0.00 H new ATOM 1048 N HIS A 67 10.251 -27.252 -11.331 1.00 0.00 N ATOM 1049 CA HIS A 67 9.288 -26.234 -10.925 1.00 0.00 C ATOM 1050 C HIS A 67 9.628 -25.560 -9.592 1.00 0.00 C ATOM 1051 O HIS A 67 10.341 -26.116 -8.754 1.00 0.00 O ATOM 1052 CB HIS A 67 7.869 -26.823 -10.830 1.00 0.00 C ATOM 1053 CG HIS A 67 7.318 -27.435 -12.089 1.00 0.00 C ATOM 1054 ND1 HIS A 67 6.678 -28.673 -12.154 1.00 0.00 N ATOM 1055 CD2 HIS A 67 7.266 -26.847 -13.317 1.00 0.00 C ATOM 1056 CE1 HIS A 67 6.269 -28.806 -13.424 1.00 0.00 C ATOM 1057 NE2 HIS A 67 6.612 -27.729 -14.147 1.00 0.00 N ATOM 0 H HIS A 67 9.938 -28.209 -11.170 1.00 0.00 H new ATOM 0 HA HIS A 67 9.335 -25.472 -11.703 1.00 0.00 H new ATOM 0 HB2 HIS A 67 7.865 -27.584 -10.049 1.00 0.00 H new ATOM 0 HB3 HIS A 67 7.191 -26.033 -10.508 1.00 0.00 H new ATOM 0 HD2 HIS A 67 7.661 -25.878 -13.586 1.00 0.00 H new ATOM 0 HE1 HIS A 67 5.737 -29.662 -13.812 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.421 -27.588 -15.139 1.00 0.00 H new ATOM 1065 N THR A 68 9.017 -24.391 -9.365 1.00 0.00 N ATOM 1066 CA THR A 68 9.004 -23.667 -8.082 1.00 0.00 C ATOM 1067 C THR A 68 7.599 -23.119 -7.806 1.00 0.00 C ATOM 1068 O THR A 68 6.812 -22.946 -8.734 1.00 0.00 O ATOM 1069 CB THR A 68 10.052 -22.542 -8.125 1.00 0.00 C ATOM 1070 OG1 THR A 68 11.335 -23.096 -8.307 1.00 0.00 O ATOM 1071 CG2 THR A 68 10.153 -21.696 -6.849 1.00 0.00 C ATOM 0 H THR A 68 8.498 -23.903 -10.095 1.00 0.00 H new ATOM 0 HA THR A 68 9.260 -24.344 -7.267 1.00 0.00 H new ATOM 0 HB THR A 68 9.722 -21.901 -8.942 1.00 0.00 H new ATOM 0 HG1 THR A 68 12.003 -22.521 -7.880 1.00 0.00 H new ATOM 0 HG21 THR A 68 10.919 -20.931 -6.979 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.193 -21.219 -6.652 1.00 0.00 H new ATOM 0 HG23 THR A 68 10.419 -22.336 -6.008 1.00 0.00 H new ATOM 1079 N GLU A 69 7.269 -22.827 -6.547 1.00 0.00 N ATOM 1080 CA GLU A 69 5.957 -22.306 -6.130 1.00 0.00 C ATOM 1081 C GLU A 69 6.099 -20.989 -5.350 1.00 0.00 C ATOM 1082 O GLU A 69 7.128 -20.725 -4.724 1.00 0.00 O ATOM 1083 CB GLU A 69 5.207 -23.352 -5.281 1.00 0.00 C ATOM 1084 CG GLU A 69 4.892 -24.637 -6.059 1.00 0.00 C ATOM 1085 CD GLU A 69 4.172 -25.663 -5.162 1.00 0.00 C ATOM 1086 OE1 GLU A 69 4.841 -26.316 -4.326 1.00 0.00 O ATOM 1087 OE2 GLU A 69 2.939 -25.853 -5.310 1.00 0.00 O ATOM 0 H GLU A 69 7.917 -22.947 -5.769 1.00 0.00 H new ATOM 0 HA GLU A 69 5.379 -22.102 -7.031 1.00 0.00 H new ATOM 0 HB2 GLU A 69 5.808 -23.601 -4.406 1.00 0.00 H new ATOM 0 HB3 GLU A 69 4.277 -22.917 -4.916 1.00 0.00 H new ATOM 0 HG2 GLU A 69 4.268 -24.401 -6.921 1.00 0.00 H new ATOM 0 HG3 GLU A 69 5.816 -25.069 -6.443 1.00 0.00 H new ATOM 1094 N ILE A 70 5.061 -20.150 -5.420 1.00 0.00 N ATOM 1095 CA ILE A 70 5.003 -18.802 -4.847 1.00 0.00 C ATOM 1096 C ILE A 70 3.741 -18.696 -3.995 1.00 0.00 C ATOM 1097 O ILE A 70 2.673 -19.106 -4.454 1.00 0.00 O ATOM 1098 CB ILE A 70 5.021 -17.716 -5.948 1.00 0.00 C ATOM 1099 CG1 ILE A 70 6.342 -17.735 -6.742 1.00 0.00 C ATOM 1100 CG2 ILE A 70 4.878 -16.315 -5.317 1.00 0.00 C ATOM 1101 CD1 ILE A 70 6.416 -18.732 -7.899 1.00 0.00 C ATOM 0 H ILE A 70 4.198 -20.404 -5.900 1.00 0.00 H new ATOM 0 HA ILE A 70 5.884 -18.634 -4.228 1.00 0.00 H new ATOM 0 HB ILE A 70 4.188 -17.930 -6.618 1.00 0.00 H new ATOM 0 HG12 ILE A 70 6.519 -16.735 -7.139 1.00 0.00 H new ATOM 0 HG13 ILE A 70 7.156 -17.952 -6.050 1.00 0.00 H new ATOM 0 HG21 ILE A 70 4.892 -15.559 -6.102 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.935 -16.256 -4.773 1.00 0.00 H new ATOM 0 HG23 ILE A 70 5.705 -16.139 -4.630 1.00 0.00 H new ATOM 0 HD11 ILE A 70 7.390 -18.656 -8.383 1.00 0.00 H new ATOM 0 HD12 ILE A 70 6.279 -19.744 -7.517 1.00 0.00 H new ATOM 0 HD13 ILE A 70 5.632 -18.508 -8.623 1.00 0.00 H new ATOM 1113 N LYS A 71 3.855 -18.127 -2.788 1.00 0.00 N ATOM 1114 CA LYS A 71 2.821 -18.136 -1.734 1.00 0.00 C ATOM 1115 C LYS A 71 2.674 -16.753 -1.063 1.00 0.00 C ATOM 1116 O LYS A 71 3.660 -16.023 -0.952 1.00 0.00 O ATOM 1117 CB LYS A 71 3.199 -19.210 -0.691 1.00 0.00 C ATOM 1118 CG LYS A 71 3.475 -20.614 -1.276 1.00 0.00 C ATOM 1119 CD LYS A 71 3.934 -21.637 -0.224 1.00 0.00 C ATOM 1120 CE LYS A 71 2.866 -21.992 0.821 1.00 0.00 C ATOM 1121 NZ LYS A 71 1.789 -22.849 0.259 1.00 0.00 N ATOM 0 H LYS A 71 4.698 -17.629 -2.504 1.00 0.00 H new ATOM 0 HA LYS A 71 1.856 -18.370 -2.184 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.085 -18.876 -0.151 1.00 0.00 H new ATOM 0 HB3 LYS A 71 2.392 -19.288 0.038 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.570 -20.982 -1.759 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.238 -20.533 -2.050 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.245 -22.549 -0.733 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.811 -21.244 0.290 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.337 -22.507 1.658 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.429 -21.075 1.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.924 -22.735 0.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.599 -22.568 -0.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.090 -23.844 0.283 1.00 0.00 H new ATOM 1135 N ALA A 72 1.466 -16.383 -0.624 1.00 0.00 N ATOM 1136 CA ALA A 72 1.173 -15.084 0.009 1.00 0.00 C ATOM 1137 C ALA A 72 2.001 -14.805 1.284 1.00 0.00 C ATOM 1138 O ALA A 72 2.326 -15.743 2.021 1.00 0.00 O ATOM 1139 CB ALA A 72 -0.329 -15.026 0.334 1.00 0.00 C ATOM 0 H ALA A 72 0.647 -16.986 -0.698 1.00 0.00 H new ATOM 0 HA ALA A 72 1.457 -14.308 -0.702 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.563 -14.070 0.803 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -0.905 -15.129 -0.586 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.585 -15.837 1.015 1.00 0.00 H new ATOM 1145 N PRO A 73 2.261 -13.527 1.628 1.00 0.00 N ATOM 1146 CA PRO A 73 2.885 -13.170 2.909 1.00 0.00 C ATOM 1147 C PRO A 73 1.906 -13.269 4.088 1.00 0.00 C ATOM 1148 O PRO A 73 2.308 -13.583 5.207 1.00 0.00 O ATOM 1149 CB PRO A 73 3.313 -11.721 2.717 1.00 0.00 C ATOM 1150 CG PRO A 73 2.236 -11.147 1.804 1.00 0.00 C ATOM 1151 CD PRO A 73 1.998 -12.321 0.843 1.00 0.00 C ATOM 0 HA PRO A 73 3.705 -13.846 3.151 1.00 0.00 H new ATOM 0 HB2 PRO A 73 3.360 -11.188 3.666 1.00 0.00 H new ATOM 0 HB3 PRO A 73 4.302 -11.652 2.263 1.00 0.00 H new ATOM 0 HG2 PRO A 73 1.334 -10.876 2.353 1.00 0.00 H new ATOM 0 HG3 PRO A 73 2.574 -10.251 1.283 1.00 0.00 H new ATOM 0 HD2 PRO A 73 0.977 -12.316 0.462 1.00 0.00 H new ATOM 0 HD3 PRO A 73 2.661 -12.262 -0.020 1.00 0.00 H new ATOM 1159 N PHE A 74 0.630 -12.976 3.833 1.00 0.00 N ATOM 1160 CA PHE A 74 -0.448 -12.919 4.827 1.00 0.00 C ATOM 1161 C PHE A 74 -1.862 -12.910 4.226 1.00 0.00 C ATOM 1162 O PHE A 74 -2.085 -12.661 3.043 1.00 0.00 O ATOM 1163 CB PHE A 74 -0.272 -11.692 5.736 1.00 0.00 C ATOM 1164 CG PHE A 74 -0.021 -10.362 5.025 1.00 0.00 C ATOM 1165 CD1 PHE A 74 -1.102 -9.587 4.559 1.00 0.00 C ATOM 1166 CD2 PHE A 74 1.288 -9.902 4.794 1.00 0.00 C ATOM 1167 CE1 PHE A 74 -0.870 -8.367 3.903 1.00 0.00 C ATOM 1168 CE2 PHE A 74 1.524 -8.670 4.166 1.00 0.00 C ATOM 1169 CZ PHE A 74 0.438 -7.891 3.735 1.00 0.00 C ATOM 0 H PHE A 74 0.304 -12.763 2.890 1.00 0.00 H new ATOM 0 HA PHE A 74 -0.362 -13.841 5.402 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.166 -11.589 6.351 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.561 -11.882 6.413 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -2.114 -9.933 4.707 1.00 0.00 H new ATOM 0 HD2 PHE A 74 2.126 -10.508 5.106 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -1.703 -7.793 3.526 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.535 -8.323 4.015 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.610 -6.929 3.276 1.00 0.00 H new ATOM 1179 N ASP A 75 -2.821 -13.193 5.112 1.00 0.00 N ATOM 1180 CA ASP A 75 -4.274 -13.164 4.888 1.00 0.00 C ATOM 1181 C ASP A 75 -4.810 -11.795 4.427 1.00 0.00 C ATOM 1182 O ASP A 75 -4.479 -10.749 5.007 1.00 0.00 O ATOM 1183 CB ASP A 75 -4.981 -13.565 6.194 1.00 0.00 C ATOM 1184 CG ASP A 75 -6.478 -13.838 5.994 1.00 0.00 C ATOM 1185 OD1 ASP A 75 -7.284 -12.881 6.032 1.00 0.00 O ATOM 1186 OD2 ASP A 75 -6.836 -15.028 5.832 1.00 0.00 O ATOM 0 H ASP A 75 -2.591 -13.466 6.067 1.00 0.00 H new ATOM 0 HA ASP A 75 -4.482 -13.864 4.079 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.504 -14.456 6.602 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.855 -12.771 6.930 1.00 0.00 H new ATOM 1191 N GLY A 76 -5.681 -11.808 3.416 1.00 0.00 N ATOM 1192 CA GLY A 76 -6.330 -10.613 2.896 1.00 0.00 C ATOM 1193 C GLY A 76 -7.011 -10.814 1.545 1.00 0.00 C ATOM 1194 O GLY A 76 -7.627 -11.843 1.260 1.00 0.00 O ATOM 0 H GLY A 76 -5.956 -12.663 2.932 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -7.072 -10.272 3.618 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -5.588 -9.820 2.803 1.00 0.00 H new ATOM 1198 N THR A 77 -6.858 -9.798 0.702 1.00 0.00 N ATOM 1199 CA THR A 77 -7.390 -9.687 -0.662 1.00 0.00 C ATOM 1200 C THR A 77 -6.215 -9.461 -1.610 1.00 0.00 C ATOM 1201 O THR A 77 -5.109 -9.139 -1.175 1.00 0.00 O ATOM 1202 CB THR A 77 -8.418 -8.542 -0.738 1.00 0.00 C ATOM 1203 OG1 THR A 77 -9.428 -8.744 0.226 1.00 0.00 O ATOM 1204 CG2 THR A 77 -9.152 -8.413 -2.074 1.00 0.00 C ATOM 0 H THR A 77 -6.323 -8.971 0.967 1.00 0.00 H new ATOM 0 HA THR A 77 -7.910 -10.600 -0.952 1.00 0.00 H new ATOM 0 HB THR A 77 -7.825 -7.641 -0.580 1.00 0.00 H new ATOM 0 HG1 THR A 77 -10.079 -8.013 0.176 1.00 0.00 H new ATOM 0 HG21 THR A 77 -9.852 -7.579 -2.025 1.00 0.00 H new ATOM 0 HG22 THR A 77 -8.429 -8.234 -2.870 1.00 0.00 H new ATOM 0 HG23 THR A 77 -9.698 -9.334 -2.280 1.00 0.00 H new ATOM 1212 N ILE A 78 -6.406 -9.665 -2.913 1.00 0.00 N ATOM 1213 CA ILE A 78 -5.317 -9.588 -3.888 1.00 0.00 C ATOM 1214 C ILE A 78 -5.718 -8.755 -5.115 1.00 0.00 C ATOM 1215 O ILE A 78 -6.872 -8.775 -5.549 1.00 0.00 O ATOM 1216 CB ILE A 78 -4.843 -11.023 -4.187 1.00 0.00 C ATOM 1217 CG1 ILE A 78 -3.391 -11.045 -4.685 1.00 0.00 C ATOM 1218 CG2 ILE A 78 -5.786 -11.754 -5.149 1.00 0.00 C ATOM 1219 CD1 ILE A 78 -2.749 -12.430 -4.611 1.00 0.00 C ATOM 0 H ILE A 78 -7.314 -9.887 -3.321 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.461 -9.045 -3.487 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.871 -11.570 -3.245 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -3.362 -10.693 -5.716 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.800 -10.346 -4.093 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -5.411 -12.761 -5.330 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.782 -11.811 -4.709 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.836 -11.210 -6.092 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -1.724 -12.376 -4.978 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -2.747 -12.775 -3.577 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -3.318 -13.128 -5.226 1.00 0.00 H new ATOM 1231 N GLY A 79 -4.770 -7.967 -5.625 1.00 0.00 N ATOM 1232 CA GLY A 79 -5.012 -7.024 -6.719 1.00 0.00 C ATOM 1233 C GLY A 79 -5.064 -7.686 -8.094 1.00 0.00 C ATOM 1234 O GLY A 79 -5.006 -8.911 -8.222 1.00 0.00 O ATOM 0 H GLY A 79 -3.807 -7.965 -5.289 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.953 -6.505 -6.539 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.226 -6.269 -6.718 1.00 0.00 H new ATOM 1238 N ASP A 80 -5.169 -6.878 -9.149 1.00 0.00 N ATOM 1239 CA ASP A 80 -4.979 -7.355 -10.517 1.00 0.00 C ATOM 1240 C ASP A 80 -3.563 -7.888 -10.738 1.00 0.00 C ATOM 1241 O ASP A 80 -2.563 -7.224 -10.447 1.00 0.00 O ATOM 1242 CB ASP A 80 -5.326 -6.313 -11.577 1.00 0.00 C ATOM 1243 CG ASP A 80 -4.704 -4.917 -11.357 1.00 0.00 C ATOM 1244 OD1 ASP A 80 -4.930 -4.312 -10.281 1.00 0.00 O ATOM 1245 OD2 ASP A 80 -3.985 -4.420 -12.250 1.00 0.00 O ATOM 0 H ASP A 80 -5.386 -5.884 -9.080 1.00 0.00 H new ATOM 0 HA ASP A 80 -5.686 -8.176 -10.638 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -5.005 -6.687 -12.549 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -6.410 -6.207 -11.618 1.00 0.00 H new ATOM 1250 N ALA A 81 -3.513 -9.110 -11.262 1.00 0.00 N ATOM 1251 CA ALA A 81 -2.304 -9.821 -11.630 1.00 0.00 C ATOM 1252 C ALA A 81 -1.443 -9.004 -12.621 1.00 0.00 C ATOM 1253 O ALA A 81 -1.957 -8.276 -13.472 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.766 -11.120 -12.283 1.00 0.00 C ATOM 0 H ALA A 81 -4.357 -9.652 -11.448 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.681 -10.001 -10.754 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -1.897 -11.705 -12.585 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.360 -11.694 -11.572 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.372 -10.891 -13.160 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.126 -9.200 -12.571 1.00 0.00 N ATOM 1261 CA LEU A 82 0.863 -8.563 -13.446 1.00 0.00 C ATOM 1262 C LEU A 82 1.449 -9.528 -14.501 1.00 0.00 C ATOM 1263 O LEU A 82 2.237 -9.105 -15.349 1.00 0.00 O ATOM 1264 CB LEU A 82 1.972 -7.952 -12.577 1.00 0.00 C ATOM 1265 CG LEU A 82 1.632 -6.861 -11.563 1.00 0.00 C ATOM 1266 CD1 LEU A 82 2.864 -6.566 -10.695 1.00 0.00 C ATOM 1267 CD2 LEU A 82 1.262 -5.634 -12.344 1.00 0.00 C ATOM 0 H LEU A 82 0.300 -9.832 -11.893 1.00 0.00 H new ATOM 0 HA LEU A 82 0.358 -7.781 -14.014 1.00 0.00 H new ATOM 0 HB2 LEU A 82 2.442 -8.769 -12.029 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.725 -7.545 -13.251 1.00 0.00 H new ATOM 0 HG LEU A 82 0.814 -7.172 -10.913 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.621 -5.788 -9.972 1.00 0.00 H new ATOM 0 HD12 LEU A 82 3.162 -7.472 -10.167 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.684 -6.229 -11.329 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.011 -4.827 -11.656 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.104 -5.331 -12.967 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.402 -5.852 -12.978 1.00 0.00 H new ATOM 1279 N VAL A 83 1.063 -10.812 -14.469 1.00 0.00 N ATOM 1280 CA VAL A 83 1.685 -11.912 -15.235 1.00 0.00 C ATOM 1281 C VAL A 83 0.679 -12.945 -15.739 1.00 0.00 C ATOM 1282 O VAL A 83 -0.481 -12.976 -15.327 1.00 0.00 O ATOM 1283 CB VAL A 83 2.782 -12.614 -14.404 1.00 0.00 C ATOM 1284 CG1 VAL A 83 3.848 -11.638 -13.912 1.00 0.00 C ATOM 1285 CG2 VAL A 83 2.223 -13.359 -13.189 1.00 0.00 C ATOM 0 H VAL A 83 0.284 -11.128 -13.891 1.00 0.00 H new ATOM 0 HA VAL A 83 2.132 -11.445 -16.113 1.00 0.00 H new ATOM 0 HB VAL A 83 3.229 -13.334 -15.089 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.597 -12.179 -13.333 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.326 -11.160 -14.767 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.383 -10.878 -13.284 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.040 -13.832 -12.644 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.711 -12.654 -12.534 1.00 0.00 H new ATOM 0 HG23 VAL A 83 1.520 -14.122 -13.522 1.00 0.00 H new ATOM 1295 N ASN A 84 1.148 -13.813 -16.629 1.00 0.00 N ATOM 1296 CA ASN A 84 0.412 -14.864 -17.333 1.00 0.00 C ATOM 1297 C ASN A 84 1.270 -16.125 -17.481 1.00 0.00 C ATOM 1298 O ASN A 84 2.487 -16.046 -17.403 1.00 0.00 O ATOM 1299 CB ASN A 84 0.014 -14.351 -18.738 1.00 0.00 C ATOM 1300 CG ASN A 84 1.140 -13.628 -19.467 1.00 0.00 C ATOM 1301 OD1 ASN A 84 1.937 -14.231 -20.172 1.00 0.00 O ATOM 1302 ND2 ASN A 84 1.264 -12.331 -19.289 1.00 0.00 N ATOM 0 H ASN A 84 2.131 -13.801 -16.900 1.00 0.00 H new ATOM 0 HA ASN A 84 -0.478 -15.114 -16.755 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -0.316 -15.195 -19.343 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -0.837 -13.676 -18.641 1.00 0.00 H new ATOM 0 HD21 ASN A 84 2.026 -11.825 -19.740 1.00 0.00 H new ATOM 0 HD22 ASN A 84 0.598 -11.831 -18.700 1.00 0.00 H new ATOM 1309 N ILE A 85 0.661 -17.281 -17.760 1.00 0.00 N ATOM 1310 CA ILE A 85 1.341 -18.543 -18.066 1.00 0.00 C ATOM 1311 C ILE A 85 2.117 -18.377 -19.379 1.00 0.00 C ATOM 1312 O ILE A 85 1.523 -18.365 -20.459 1.00 0.00 O ATOM 1313 CB ILE A 85 0.332 -19.706 -18.133 1.00 0.00 C ATOM 1314 CG1 ILE A 85 -0.411 -19.977 -16.808 1.00 0.00 C ATOM 1315 CG2 ILE A 85 1.043 -21.015 -18.531 1.00 0.00 C ATOM 1316 CD1 ILE A 85 -1.296 -18.858 -16.252 1.00 0.00 C ATOM 0 H ILE A 85 -0.355 -17.367 -17.780 1.00 0.00 H new ATOM 0 HA ILE A 85 2.046 -18.790 -17.272 1.00 0.00 H new ATOM 0 HB ILE A 85 -0.401 -19.394 -18.877 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.034 -20.861 -16.946 1.00 0.00 H new ATOM 0 HG13 ILE A 85 0.332 -20.226 -16.050 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.316 -21.826 -18.573 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.508 -20.893 -19.509 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.808 -21.253 -17.792 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -1.755 -19.186 -15.319 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -0.689 -17.972 -16.065 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -2.075 -18.617 -16.975 1.00 0.00 H new ATOM 1328 N GLY A 86 3.437 -18.194 -19.278 1.00 0.00 N ATOM 1329 CA GLY A 86 4.296 -17.868 -20.419 1.00 0.00 C ATOM 1330 C GLY A 86 4.991 -16.520 -20.246 1.00 0.00 C ATOM 1331 O GLY A 86 5.961 -16.263 -20.962 1.00 0.00 O ATOM 0 H GLY A 86 3.943 -18.269 -18.395 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.046 -18.649 -20.543 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.698 -17.853 -21.330 1.00 0.00 H new ATOM 1335 N ASP A 87 4.553 -15.662 -19.305 1.00 0.00 N ATOM 1336 CA ASP A 87 5.336 -14.472 -18.947 1.00 0.00 C ATOM 1337 C ASP A 87 6.699 -14.910 -18.408 1.00 0.00 C ATOM 1338 O ASP A 87 6.783 -15.753 -17.498 1.00 0.00 O ATOM 1339 CB ASP A 87 4.627 -13.586 -17.912 1.00 0.00 C ATOM 1340 CG ASP A 87 4.854 -12.104 -18.249 1.00 0.00 C ATOM 1341 OD1 ASP A 87 5.936 -11.570 -17.910 1.00 0.00 O ATOM 1342 OD2 ASP A 87 3.963 -11.493 -18.884 1.00 0.00 O ATOM 0 H ASP A 87 3.679 -15.769 -18.790 1.00 0.00 H new ATOM 0 HA ASP A 87 5.456 -13.873 -19.850 1.00 0.00 H new ATOM 0 HB2 ASP A 87 3.560 -13.806 -17.902 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.007 -13.803 -16.914 1.00 0.00 H new ATOM 1347 N TYR A 88 7.762 -14.358 -18.991 1.00 0.00 N ATOM 1348 CA TYR A 88 9.115 -14.673 -18.558 1.00 0.00 C ATOM 1349 C TYR A 88 9.408 -13.902 -17.281 1.00 0.00 C ATOM 1350 O TYR A 88 9.668 -12.694 -17.335 1.00 0.00 O ATOM 1351 CB TYR A 88 10.145 -14.386 -19.664 1.00 0.00 C ATOM 1352 CG TYR A 88 11.441 -15.116 -19.373 1.00 0.00 C ATOM 1353 CD1 TYR A 88 12.330 -14.632 -18.397 1.00 0.00 C ATOM 1354 CD2 TYR A 88 11.610 -16.400 -19.916 1.00 0.00 C ATOM 1355 CE1 TYR A 88 13.354 -15.468 -17.896 1.00 0.00 C ATOM 1356 CE2 TYR A 88 12.572 -17.266 -19.371 1.00 0.00 C ATOM 1357 CZ TYR A 88 13.462 -16.798 -18.374 1.00 0.00 C ATOM 1358 OH TYR A 88 14.392 -17.653 -17.866 1.00 0.00 O ATOM 0 H TYR A 88 7.709 -13.693 -19.762 1.00 0.00 H new ATOM 0 HA TYR A 88 9.194 -15.740 -18.351 1.00 0.00 H new ATOM 0 HB2 TYR A 88 9.750 -14.701 -20.630 1.00 0.00 H new ATOM 0 HB3 TYR A 88 10.330 -13.314 -19.730 1.00 0.00 H new ATOM 0 HD1 TYR A 88 12.230 -13.621 -18.030 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.003 -16.720 -20.750 1.00 0.00 H new ATOM 0 HE1 TYR A 88 14.048 -15.097 -17.156 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.633 -18.289 -19.712 1.00 0.00 H new ATOM 0 HH TYR A 88 14.317 -18.521 -18.314 1.00 0.00 H new ATOM 1368 N VAL A 89 9.409 -14.605 -16.146 1.00 0.00 N ATOM 1369 CA VAL A 89 9.666 -13.955 -14.836 1.00 0.00 C ATOM 1370 C VAL A 89 11.024 -14.243 -14.192 1.00 0.00 C ATOM 1371 O VAL A 89 11.589 -15.329 -14.281 1.00 0.00 O ATOM 1372 CB VAL A 89 8.537 -14.126 -13.813 1.00 0.00 C ATOM 1373 CG1 VAL A 89 7.201 -13.655 -14.381 1.00 0.00 C ATOM 1374 CG2 VAL A 89 8.383 -15.564 -13.319 1.00 0.00 C ATOM 0 H VAL A 89 9.239 -15.609 -16.095 1.00 0.00 H new ATOM 0 HA VAL A 89 9.697 -12.906 -15.129 1.00 0.00 H new ATOM 0 HB VAL A 89 8.822 -13.507 -12.962 1.00 0.00 H new ATOM 0 HG11 VAL A 89 6.420 -13.789 -13.633 1.00 0.00 H new ATOM 0 HG12 VAL A 89 7.271 -12.601 -14.648 1.00 0.00 H new ATOM 0 HG13 VAL A 89 6.957 -14.239 -15.268 1.00 0.00 H new ATOM 0 HG21 VAL A 89 7.567 -15.616 -12.598 1.00 0.00 H new ATOM 0 HG22 VAL A 89 8.163 -16.217 -14.163 1.00 0.00 H new ATOM 0 HG23 VAL A 89 9.309 -15.886 -12.843 1.00 0.00 H new ATOM 1384 N SER A 90 11.536 -13.254 -13.471 1.00 0.00 N ATOM 1385 CA SER A 90 12.837 -13.273 -12.811 1.00 0.00 C ATOM 1386 C SER A 90 12.693 -12.691 -11.400 1.00 0.00 C ATOM 1387 O SER A 90 11.969 -11.714 -11.203 1.00 0.00 O ATOM 1388 CB SER A 90 13.811 -12.531 -13.720 1.00 0.00 C ATOM 1389 OG SER A 90 15.024 -12.230 -13.052 1.00 0.00 O ATOM 0 H SER A 90 11.035 -12.378 -13.323 1.00 0.00 H new ATOM 0 HA SER A 90 13.233 -14.278 -12.665 1.00 0.00 H new ATOM 0 HB2 SER A 90 14.021 -13.138 -14.601 1.00 0.00 H new ATOM 0 HB3 SER A 90 13.350 -11.608 -14.071 1.00 0.00 H new ATOM 0 HG SER A 90 15.625 -11.756 -13.664 1.00 0.00 H new ATOM 1395 N ALA A 91 13.353 -13.331 -10.424 1.00 0.00 N ATOM 1396 CA ALA A 91 13.157 -13.182 -8.970 1.00 0.00 C ATOM 1397 C ALA A 91 12.633 -11.862 -8.468 1.00 0.00 C ATOM 1398 O ALA A 91 11.434 -11.735 -8.235 1.00 0.00 O ATOM 1399 CB ALA A 91 14.393 -13.708 -8.230 1.00 0.00 C ATOM 0 H ALA A 91 14.084 -14.009 -10.640 1.00 0.00 H new ATOM 0 HA ALA A 91 12.300 -13.809 -8.723 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.248 -13.598 -7.155 1.00 0.00 H new ATOM 0 HB2 ALA A 91 14.540 -14.761 -8.470 1.00 0.00 H new ATOM 0 HB3 ALA A 91 15.271 -13.140 -8.538 1.00 0.00 H new ATOM 1405 N SER A 92 13.478 -10.861 -8.362 1.00 0.00 N ATOM 1406 CA SER A 92 13.012 -9.570 -7.867 1.00 0.00 C ATOM 1407 C SER A 92 12.638 -8.595 -9.005 1.00 0.00 C ATOM 1408 O SER A 92 12.237 -7.459 -8.755 1.00 0.00 O ATOM 1409 CB SER A 92 14.054 -8.930 -6.944 1.00 0.00 C ATOM 1410 OG SER A 92 14.355 -9.792 -5.852 1.00 0.00 O ATOM 0 H SER A 92 14.468 -10.904 -8.603 1.00 0.00 H new ATOM 0 HA SER A 92 12.103 -9.767 -7.299 1.00 0.00 H new ATOM 0 HB2 SER A 92 14.963 -8.716 -7.506 1.00 0.00 H new ATOM 0 HB3 SER A 92 13.679 -7.977 -6.569 1.00 0.00 H new ATOM 0 HG SER A 92 15.023 -9.367 -5.275 1.00 0.00 H new ATOM 1416 N THR A 93 12.781 -9.046 -10.253 1.00 0.00 N ATOM 1417 CA THR A 93 12.834 -8.231 -11.488 1.00 0.00 C ATOM 1418 C THR A 93 11.530 -8.058 -12.290 1.00 0.00 C ATOM 1419 O THR A 93 11.479 -7.160 -13.134 1.00 0.00 O ATOM 1420 CB THR A 93 13.895 -8.868 -12.423 1.00 0.00 C ATOM 1421 OG1 THR A 93 15.030 -9.291 -11.687 1.00 0.00 O ATOM 1422 CG2 THR A 93 14.435 -7.942 -13.513 1.00 0.00 C ATOM 0 H THR A 93 12.869 -10.043 -10.450 1.00 0.00 H new ATOM 0 HA THR A 93 13.069 -7.224 -11.145 1.00 0.00 H new ATOM 0 HB THR A 93 13.356 -9.691 -12.892 1.00 0.00 H new ATOM 0 HG1 THR A 93 15.271 -10.203 -11.953 1.00 0.00 H new ATOM 0 HG21 THR A 93 15.170 -8.477 -14.114 1.00 0.00 H new ATOM 0 HG22 THR A 93 13.614 -7.613 -14.151 1.00 0.00 H new ATOM 0 HG23 THR A 93 14.906 -7.074 -13.052 1.00 0.00 H new ATOM 1430 N THR A 94 10.467 -8.843 -12.055 1.00 0.00 N ATOM 1431 CA THR A 94 9.326 -8.911 -13.006 1.00 0.00 C ATOM 1432 C THR A 94 7.962 -8.598 -12.410 1.00 0.00 C ATOM 1433 O THR A 94 7.125 -7.999 -13.088 1.00 0.00 O ATOM 1434 CB THR A 94 9.290 -10.249 -13.742 1.00 0.00 C ATOM 1435 OG1 THR A 94 10.566 -10.606 -14.226 1.00 0.00 O ATOM 1436 CG2 THR A 94 8.351 -10.191 -14.938 1.00 0.00 C ATOM 0 H THR A 94 10.366 -9.434 -11.230 1.00 0.00 H new ATOM 0 HA THR A 94 9.523 -8.106 -13.714 1.00 0.00 H new ATOM 0 HB THR A 94 8.943 -10.987 -13.019 1.00 0.00 H new ATOM 0 HG1 THR A 94 10.500 -10.853 -15.172 1.00 0.00 H new ATOM 0 HG21 THR A 94 8.345 -11.157 -15.443 1.00 0.00 H new ATOM 0 HG22 THR A 94 7.343 -9.953 -14.598 1.00 0.00 H new ATOM 0 HG23 THR A 94 8.691 -9.421 -15.631 1.00 0.00 H new ATOM 1444 N GLU A 95 7.806 -8.866 -11.114 1.00 0.00 N ATOM 1445 CA GLU A 95 6.647 -8.559 -10.272 1.00 0.00 C ATOM 1446 C GLU A 95 5.346 -9.258 -10.716 1.00 0.00 C ATOM 1447 O GLU A 95 4.927 -9.226 -11.869 1.00 0.00 O ATOM 1448 CB GLU A 95 6.491 -7.035 -10.141 1.00 0.00 C ATOM 1449 CG GLU A 95 7.803 -6.241 -10.182 1.00 0.00 C ATOM 1450 CD GLU A 95 7.687 -4.836 -9.572 1.00 0.00 C ATOM 1451 OE1 GLU A 95 6.919 -3.998 -10.107 1.00 0.00 O ATOM 1452 OE2 GLU A 95 8.395 -4.564 -8.571 1.00 0.00 O ATOM 0 H GLU A 95 8.539 -9.338 -10.585 1.00 0.00 H new ATOM 0 HA GLU A 95 6.843 -8.976 -9.284 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.845 -6.681 -10.944 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.981 -6.817 -9.202 1.00 0.00 H new ATOM 0 HG2 GLU A 95 8.573 -6.798 -9.648 1.00 0.00 H new ATOM 0 HG3 GLU A 95 8.133 -6.153 -11.217 1.00 0.00 H new ATOM 1459 N LEU A 96 4.721 -9.952 -9.760 1.00 0.00 N ATOM 1460 CA LEU A 96 3.624 -10.896 -10.036 1.00 0.00 C ATOM 1461 C LEU A 96 2.218 -10.347 -9.794 1.00 0.00 C ATOM 1462 O LEU A 96 1.329 -10.575 -10.608 1.00 0.00 O ATOM 1463 CB LEU A 96 3.793 -12.141 -9.171 1.00 0.00 C ATOM 1464 CG LEU A 96 5.170 -12.812 -9.270 1.00 0.00 C ATOM 1465 CD1 LEU A 96 5.308 -13.894 -8.208 1.00 0.00 C ATOM 1466 CD2 LEU A 96 5.394 -13.439 -10.643 1.00 0.00 C ATOM 0 H LEU A 96 4.959 -9.878 -8.771 1.00 0.00 H new ATOM 0 HA LEU A 96 3.699 -11.111 -11.102 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.610 -11.871 -8.131 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.030 -12.867 -9.451 1.00 0.00 H new ATOM 0 HG LEU A 96 5.919 -12.035 -9.114 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.289 -14.361 -8.290 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.200 -13.449 -7.219 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.534 -14.648 -8.354 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.379 -13.904 -10.674 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.630 -14.195 -10.827 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.333 -12.667 -11.410 1.00 0.00 H new ATOM 1478 N VAL A 97 2.022 -9.683 -8.657 1.00 0.00 N ATOM 1479 CA VAL A 97 0.781 -9.064 -8.185 1.00 0.00 C ATOM 1480 C VAL A 97 1.019 -8.446 -6.798 1.00 0.00 C ATOM 1481 O VAL A 97 1.967 -8.821 -6.116 1.00 0.00 O ATOM 1482 CB VAL A 97 -0.387 -10.066 -8.109 1.00 0.00 C ATOM 1483 CG1 VAL A 97 -0.236 -11.120 -7.037 1.00 0.00 C ATOM 1484 CG2 VAL A 97 -1.700 -9.366 -7.794 1.00 0.00 C ATOM 0 H VAL A 97 2.783 -9.553 -7.990 1.00 0.00 H new ATOM 0 HA VAL A 97 0.502 -8.296 -8.906 1.00 0.00 H new ATOM 0 HB VAL A 97 -0.381 -10.535 -9.093 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.101 -11.783 -7.054 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.668 -11.700 -7.222 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.166 -10.639 -6.061 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.503 -10.102 -7.748 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.619 -8.856 -6.834 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.920 -8.637 -8.574 1.00 0.00 H new ATOM 1494 N ARG A 98 0.137 -7.557 -6.338 1.00 0.00 N ATOM 1495 CA ARG A 98 0.083 -7.087 -4.948 1.00 0.00 C ATOM 1496 C ARG A 98 -0.936 -7.865 -4.101 1.00 0.00 C ATOM 1497 O ARG A 98 -2.078 -8.052 -4.512 1.00 0.00 O ATOM 1498 CB ARG A 98 -0.174 -5.576 -4.944 1.00 0.00 C ATOM 1499 CG ARG A 98 -1.593 -5.251 -5.428 1.00 0.00 C ATOM 1500 CD ARG A 98 -1.738 -3.753 -5.707 1.00 0.00 C ATOM 1501 NE ARG A 98 -3.091 -3.408 -6.183 1.00 0.00 N ATOM 1502 CZ ARG A 98 -3.579 -3.574 -7.403 1.00 0.00 C ATOM 1503 NH1 ARG A 98 -2.884 -4.058 -8.388 1.00 0.00 N ATOM 1504 NH2 ARG A 98 -4.809 -3.276 -7.687 1.00 0.00 N ATOM 0 H ARG A 98 -0.576 -7.133 -6.932 1.00 0.00 H new ATOM 0 HA ARG A 98 1.045 -7.280 -4.472 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -0.032 -5.183 -3.937 1.00 0.00 H new ATOM 0 HB3 ARG A 98 0.554 -5.079 -5.585 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -1.813 -5.818 -6.333 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -2.319 -5.558 -4.675 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -1.519 -3.192 -4.798 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -1.003 -3.450 -6.453 1.00 0.00 H new ATOM 0 HE ARG A 98 -3.721 -2.995 -5.495 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -1.912 -4.331 -8.241 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -3.310 -4.165 -9.309 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -5.424 -2.905 -6.963 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -5.161 -3.413 -8.634 1.00 0.00 H new ATOM 1518 N VAL A 99 -0.533 -8.279 -2.902 1.00 0.00 N ATOM 1519 CA VAL A 99 -1.448 -8.794 -1.865 1.00 0.00 C ATOM 1520 C VAL A 99 -1.805 -7.621 -0.953 1.00 0.00 C ATOM 1521 O VAL A 99 -1.020 -6.678 -0.852 1.00 0.00 O ATOM 1522 CB VAL A 99 -0.809 -9.963 -1.092 1.00 0.00 C ATOM 1523 CG1 VAL A 99 -1.864 -10.656 -0.234 1.00 0.00 C ATOM 1524 CG2 VAL A 99 -0.205 -11.010 -2.041 1.00 0.00 C ATOM 0 H VAL A 99 0.445 -8.270 -2.612 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.355 -9.199 -2.313 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.016 -9.544 -0.472 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.405 -11.482 0.310 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.282 -9.942 0.475 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -2.659 -11.040 -0.874 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.236 -11.818 -1.458 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.987 -11.412 -2.685 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.566 -10.543 -2.655 1.00 0.00 H new ATOM 1534 N THR A 100 -2.981 -7.580 -0.325 1.00 0.00 N ATOM 1535 CA THR A 100 -3.294 -6.523 0.645 1.00 0.00 C ATOM 1536 C THR A 100 -4.295 -6.929 1.727 1.00 0.00 C ATOM 1537 O THR A 100 -5.271 -7.619 1.452 1.00 0.00 O ATOM 1538 CB THR A 100 -3.623 -5.227 -0.108 1.00 0.00 C ATOM 1539 OG1 THR A 100 -3.521 -4.148 0.790 1.00 0.00 O ATOM 1540 CG2 THR A 100 -5.008 -5.214 -0.753 1.00 0.00 C ATOM 0 H THR A 100 -3.729 -8.259 -0.467 1.00 0.00 H new ATOM 0 HA THR A 100 -2.405 -6.332 1.246 1.00 0.00 H new ATOM 0 HB THR A 100 -2.906 -5.147 -0.925 1.00 0.00 H new ATOM 0 HG1 THR A 100 -3.426 -3.312 0.287 1.00 0.00 H new ATOM 0 HG21 THR A 100 -5.162 -4.264 -1.265 1.00 0.00 H new ATOM 0 HG22 THR A 100 -5.082 -6.030 -1.472 1.00 0.00 H new ATOM 0 HG23 THR A 100 -5.769 -5.339 0.017 1.00 0.00 H new ATOM 1548 N ASN A 101 -4.029 -6.573 2.985 1.00 0.00 N ATOM 1549 CA ASN A 101 -4.778 -7.075 4.140 1.00 0.00 C ATOM 1550 C ASN A 101 -6.229 -6.546 4.206 1.00 0.00 C ATOM 1551 O ASN A 101 -6.500 -5.383 3.895 1.00 0.00 O ATOM 1552 CB ASN A 101 -3.981 -6.765 5.420 1.00 0.00 C ATOM 1553 CG ASN A 101 -4.779 -7.031 6.683 1.00 0.00 C ATOM 1554 OD1 ASN A 101 -5.203 -6.111 7.363 1.00 0.00 O ATOM 1555 ND2 ASN A 101 -5.077 -8.272 6.992 1.00 0.00 N ATOM 0 H ASN A 101 -3.283 -5.924 3.233 1.00 0.00 H new ATOM 0 HA ASN A 101 -4.888 -8.154 4.035 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -3.074 -7.369 5.434 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -3.669 -5.721 5.405 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -5.664 -8.469 7.802 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -4.721 -9.039 6.422 1.00 0.00 H new ATOM 1562 N LEU A 102 -7.144 -7.404 4.678 1.00 0.00 N ATOM 1563 CA LEU A 102 -8.523 -7.057 5.023 1.00 0.00 C ATOM 1564 C LEU A 102 -8.600 -6.250 6.336 1.00 0.00 C ATOM 1565 O LEU A 102 -8.876 -5.050 6.311 1.00 0.00 O ATOM 1566 CB LEU A 102 -9.341 -8.362 5.137 1.00 0.00 C ATOM 1567 CG LEU A 102 -9.824 -8.940 3.797 1.00 0.00 C ATOM 1568 CD1 LEU A 102 -10.347 -10.361 4.036 1.00 0.00 C ATOM 1569 CD2 LEU A 102 -10.951 -8.102 3.191 1.00 0.00 C ATOM 0 H LEU A 102 -6.934 -8.390 4.834 1.00 0.00 H new ATOM 0 HA LEU A 102 -8.936 -6.421 4.240 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -8.733 -9.112 5.642 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.209 -8.176 5.770 1.00 0.00 H new ATOM 0 HG LEU A 102 -8.984 -8.937 3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -10.694 -10.785 3.093 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -9.546 -10.980 4.439 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -11.174 -10.330 4.745 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -11.264 -8.543 2.245 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -11.797 -8.078 3.878 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -10.596 -7.086 3.017 1.00 0.00 H new ATOM 1581 N ASN A 103 -8.372 -6.910 7.481 1.00 0.00 N ATOM 1582 CA ASN A 103 -8.363 -6.306 8.819 1.00 0.00 C ATOM 1583 C ASN A 103 -7.162 -6.814 9.652 1.00 0.00 C ATOM 1584 O ASN A 103 -6.670 -7.927 9.413 1.00 0.00 O ATOM 1585 CB ASN A 103 -9.712 -6.591 9.510 1.00 0.00 C ATOM 1586 CG ASN A 103 -10.927 -6.122 8.715 1.00 0.00 C ATOM 1587 OD1 ASN A 103 -11.526 -6.862 7.948 1.00 0.00 O ATOM 1588 ND2 ASN A 103 -11.338 -4.882 8.886 1.00 0.00 N ATOM 0 H ASN A 103 -8.183 -7.912 7.500 1.00 0.00 H new ATOM 0 HA ASN A 103 -8.241 -5.226 8.731 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -9.798 -7.663 9.688 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -9.719 -6.105 10.485 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -12.155 -4.541 8.379 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -10.840 -4.263 9.525 1.00 0.00 H new ATOM 1595 N PRO A 104 -6.726 -6.066 10.687 1.00 0.00 N ATOM 1596 CA PRO A 104 -5.480 -6.332 11.404 1.00 0.00 C ATOM 1597 C PRO A 104 -5.586 -7.422 12.480 1.00 0.00 C ATOM 1598 O PRO A 104 -4.590 -7.779 13.112 1.00 0.00 O ATOM 1599 CB PRO A 104 -5.055 -4.964 11.954 1.00 0.00 C ATOM 1600 CG PRO A 104 -6.390 -4.286 12.259 1.00 0.00 C ATOM 1601 CD PRO A 104 -7.349 -4.859 11.209 1.00 0.00 C ATOM 0 HA PRO A 104 -4.727 -6.757 10.740 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -4.439 -5.062 12.848 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -4.473 -4.399 11.226 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -6.728 -4.508 13.271 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -6.314 -3.202 12.180 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -8.318 -5.085 11.653 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -7.524 -4.138 10.411 1.00 0.00 H new ATOM 1609 N ILE A 105 -6.776 -7.993 12.627 1.00 0.00 N ATOM 1610 CA ILE A 105 -7.082 -9.178 13.457 1.00 0.00 C ATOM 1611 C ILE A 105 -6.561 -10.503 12.880 1.00 0.00 C ATOM 1612 O ILE A 105 -6.685 -11.552 13.511 1.00 0.00 O ATOM 1613 CB ILE A 105 -8.598 -9.253 13.765 1.00 0.00 C ATOM 1614 CG1 ILE A 105 -9.438 -9.289 12.472 1.00 0.00 C ATOM 1615 CG2 ILE A 105 -9.006 -8.064 14.660 1.00 0.00 C ATOM 1616 CD1 ILE A 105 -10.900 -9.686 12.705 1.00 0.00 C ATOM 0 H ILE A 105 -7.603 -7.632 12.151 1.00 0.00 H new ATOM 0 HA ILE A 105 -6.535 -9.040 14.390 1.00 0.00 H new ATOM 0 HB ILE A 105 -8.796 -10.182 14.299 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -9.407 -8.307 12.000 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -8.985 -9.993 11.773 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -10.073 -8.120 14.875 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -8.445 -8.102 15.594 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -8.788 -7.129 14.144 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -11.432 -9.691 11.754 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -10.941 -10.681 13.149 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -11.369 -8.969 13.379 1.00 0.00 H new ATOM 1628 N TYR A 106 -5.952 -10.443 11.696 1.00 0.00 N ATOM 1629 CA TYR A 106 -5.402 -11.573 10.947 1.00 0.00 C ATOM 1630 C TYR A 106 -3.895 -11.387 10.688 1.00 0.00 C ATOM 1631 O TYR A 106 -3.100 -12.288 10.965 1.00 0.00 O ATOM 1632 CB TYR A 106 -6.181 -11.649 9.627 1.00 0.00 C ATOM 1633 CG TYR A 106 -7.690 -11.815 9.742 1.00 0.00 C ATOM 1634 CD1 TYR A 106 -8.242 -12.899 10.450 1.00 0.00 C ATOM 1635 CD2 TYR A 106 -8.548 -10.881 9.119 1.00 0.00 C ATOM 1636 CE1 TYR A 106 -9.641 -13.040 10.552 1.00 0.00 C ATOM 1637 CE2 TYR A 106 -9.949 -11.020 9.218 1.00 0.00 C ATOM 1638 CZ TYR A 106 -10.498 -12.105 9.933 1.00 0.00 C ATOM 1639 OH TYR A 106 -11.853 -12.235 10.033 1.00 0.00 O ATOM 0 H TYR A 106 -5.822 -9.557 11.207 1.00 0.00 H new ATOM 0 HA TYR A 106 -5.506 -12.498 11.513 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.979 -10.741 9.058 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -5.788 -12.483 9.046 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.592 -13.625 10.916 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.129 -10.055 8.563 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -10.059 -13.867 11.106 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.599 -10.297 8.747 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.289 -11.503 9.548 1.00 0.00 H new ATOM 1649 N ALA A 107 -3.500 -10.193 10.226 1.00 0.00 N ATOM 1650 CA ALA A 107 -2.125 -9.714 10.080 1.00 0.00 C ATOM 1651 C ALA A 107 -2.148 -8.186 9.907 1.00 0.00 C ATOM 1652 O ALA A 107 -3.041 -7.662 9.244 1.00 0.00 O ATOM 1653 CB ALA A 107 -1.517 -10.364 8.832 1.00 0.00 C ATOM 0 H ALA A 107 -4.179 -9.493 9.926 1.00 0.00 H new ATOM 0 HA ALA A 107 -1.533 -9.971 10.958 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -0.491 -10.019 8.706 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -1.524 -11.448 8.946 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -2.103 -10.088 7.956 1.00 0.00 H new ATOM 1659 N ASP A 108 -1.180 -7.445 10.454 1.00 0.00 N ATOM 1660 CA ASP A 108 -1.175 -5.971 10.429 1.00 0.00 C ATOM 1661 C ASP A 108 -0.588 -5.405 9.115 1.00 0.00 C ATOM 1662 O ASP A 108 0.341 -4.597 9.123 1.00 0.00 O ATOM 1663 CB ASP A 108 -0.480 -5.444 11.697 1.00 0.00 C ATOM 1664 CG ASP A 108 -0.670 -3.929 11.923 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -1.591 -3.311 11.337 1.00 0.00 O ATOM 1666 OD2 ASP A 108 0.090 -3.358 12.735 1.00 0.00 O ATOM 0 H ASP A 108 -0.373 -7.848 10.930 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.203 -5.609 10.440 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -0.865 -5.983 12.563 1.00 0.00 H new ATOM 0 HB3 ASP A 108 0.586 -5.662 11.634 1.00 0.00 H new ATOM 1671 N GLY A 109 -1.078 -5.903 7.968 1.00 0.00 N ATOM 1672 CA GLY A 109 -0.520 -5.620 6.632 1.00 0.00 C ATOM 1673 C GLY A 109 0.978 -5.949 6.518 1.00 0.00 C ATOM 1674 O GLY A 109 1.719 -5.245 5.830 1.00 0.00 O ATOM 0 H GLY A 109 -1.887 -6.524 7.941 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.069 -6.195 5.887 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.673 -4.567 6.397 1.00 0.00 H new ATOM 1678 N SER A 110 1.416 -6.982 7.243 1.00 0.00 N ATOM 1679 CA SER A 110 2.816 -7.338 7.497 1.00 0.00 C ATOM 1680 C SER A 110 2.937 -8.831 7.853 1.00 0.00 C ATOM 1681 O SER A 110 1.942 -9.495 8.148 1.00 0.00 O ATOM 1682 CB SER A 110 3.280 -6.470 8.678 1.00 0.00 C ATOM 1683 OG SER A 110 4.600 -6.755 9.088 1.00 0.00 O ATOM 0 H SER A 110 0.768 -7.628 7.694 1.00 0.00 H new ATOM 0 HA SER A 110 3.430 -7.164 6.613 1.00 0.00 H new ATOM 0 HB2 SER A 110 3.212 -5.419 8.398 1.00 0.00 H new ATOM 0 HB3 SER A 110 2.604 -6.620 9.520 1.00 0.00 H new ATOM 0 HG SER A 110 4.778 -6.316 9.946 1.00 0.00 H new ATOM 1689 N HIS A 111 4.160 -9.368 7.882 1.00 0.00 N ATOM 1690 CA HIS A 111 4.474 -10.704 8.422 1.00 0.00 C ATOM 1691 C HIS A 111 4.288 -10.811 9.955 1.00 0.00 C ATOM 1692 O HIS A 111 4.445 -11.891 10.526 1.00 0.00 O ATOM 1693 CB HIS A 111 5.918 -11.064 8.029 1.00 0.00 C ATOM 1694 CG HIS A 111 6.950 -10.131 8.620 1.00 0.00 C ATOM 1695 ND1 HIS A 111 7.360 -8.917 8.062 1.00 0.00 N ATOM 1696 CD2 HIS A 111 7.576 -10.293 9.823 1.00 0.00 C ATOM 1697 CE1 HIS A 111 8.220 -8.377 8.942 1.00 0.00 C ATOM 1698 NE2 HIS A 111 8.372 -9.182 10.008 1.00 0.00 N ATOM 0 H HIS A 111 4.981 -8.879 7.524 1.00 0.00 H new ATOM 0 HA HIS A 111 3.765 -11.410 7.990 1.00 0.00 H new ATOM 0 HB2 HIS A 111 6.132 -12.083 8.353 1.00 0.00 H new ATOM 0 HB3 HIS A 111 6.006 -11.050 6.943 1.00 0.00 H new ATOM 0 HD2 HIS A 111 7.469 -11.129 10.498 1.00 0.00 H new ATOM 0 HE1 HIS A 111 8.720 -7.428 8.811 1.00 0.00 H new ATOM 0 HE2 HIS A 111 8.972 -9.002 10.813 1.00 0.00 H new ATOM 1706 N HIS A 112 3.965 -9.698 10.623 1.00 0.00 N ATOM 1707 CA HIS A 112 3.847 -9.539 12.078 1.00 0.00 C ATOM 1708 C HIS A 112 2.640 -8.650 12.451 1.00 0.00 C ATOM 1709 O HIS A 112 2.002 -8.039 11.593 1.00 0.00 O ATOM 1710 CB HIS A 112 5.183 -8.949 12.574 1.00 0.00 C ATOM 1711 CG HIS A 112 5.301 -8.766 14.067 1.00 0.00 C ATOM 1712 ND1 HIS A 112 4.824 -9.642 15.045 1.00 0.00 N ATOM 1713 CD2 HIS A 112 5.877 -7.694 14.683 1.00 0.00 C ATOM 1714 CE1 HIS A 112 5.125 -9.077 16.226 1.00 0.00 C ATOM 1715 NE2 HIS A 112 5.753 -7.903 16.038 1.00 0.00 N ATOM 0 H HIS A 112 3.766 -8.827 10.130 1.00 0.00 H new ATOM 0 HA HIS A 112 3.661 -10.498 12.561 1.00 0.00 H new ATOM 0 HB2 HIS A 112 5.992 -9.599 12.241 1.00 0.00 H new ATOM 0 HB3 HIS A 112 5.333 -7.982 12.095 1.00 0.00 H new ATOM 0 HD2 HIS A 112 6.340 -6.846 14.201 1.00 0.00 H new ATOM 0 HE1 HIS A 112 4.895 -9.505 17.190 1.00 0.00 H new ATOM 0 HE2 HIS A 112 6.081 -7.276 16.772 1.00 0.00 H new ATOM 1723 N HIS A 113 2.329 -8.545 13.746 1.00 0.00 N ATOM 1724 CA HIS A 113 1.321 -7.644 14.330 1.00 0.00 C ATOM 1725 C HIS A 113 1.800 -6.178 14.471 1.00 0.00 C ATOM 1726 O HIS A 113 1.225 -5.404 15.240 1.00 0.00 O ATOM 1727 CB HIS A 113 0.855 -8.230 15.676 1.00 0.00 C ATOM 1728 CG HIS A 113 0.221 -9.599 15.525 1.00 0.00 C ATOM 1729 ND1 HIS A 113 0.819 -10.817 15.867 1.00 0.00 N ATOM 1730 CD2 HIS A 113 -1.013 -9.846 14.996 1.00 0.00 C ATOM 1731 CE1 HIS A 113 -0.071 -11.769 15.536 1.00 0.00 C ATOM 1732 NE2 HIS A 113 -1.176 -11.213 15.012 1.00 0.00 N ATOM 0 H HIS A 113 2.794 -9.113 14.454 1.00 0.00 H new ATOM 0 HA HIS A 113 0.480 -7.588 13.639 1.00 0.00 H new ATOM 0 HB2 HIS A 113 1.707 -8.300 16.352 1.00 0.00 H new ATOM 0 HB3 HIS A 113 0.138 -7.550 16.136 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -1.721 -9.114 14.636 1.00 0.00 H new ATOM 0 HE1 HIS A 113 0.081 -12.830 15.672 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -1.998 -11.719 14.681 1.00 0.00 H new ATOM 1740 N HIS A 114 2.858 -5.793 13.745 1.00 0.00 N ATOM 1741 CA HIS A 114 3.360 -4.418 13.602 1.00 0.00 C ATOM 1742 C HIS A 114 3.960 -4.196 12.205 1.00 0.00 C ATOM 1743 O HIS A 114 4.354 -5.150 11.528 1.00 0.00 O ATOM 1744 CB HIS A 114 4.396 -4.124 14.704 1.00 0.00 C ATOM 1745 CG HIS A 114 4.874 -2.689 14.724 1.00 0.00 C ATOM 1746 ND1 HIS A 114 4.057 -1.558 14.596 1.00 0.00 N ATOM 1747 CD2 HIS A 114 6.176 -2.287 14.807 1.00 0.00 C ATOM 1748 CE1 HIS A 114 4.886 -0.501 14.610 1.00 0.00 C ATOM 1749 NE2 HIS A 114 6.160 -0.910 14.740 1.00 0.00 N ATOM 0 H HIS A 114 3.415 -6.464 13.215 1.00 0.00 H new ATOM 0 HA HIS A 114 2.526 -3.725 13.714 1.00 0.00 H new ATOM 0 HB2 HIS A 114 3.960 -4.366 15.673 1.00 0.00 H new ATOM 0 HB3 HIS A 114 5.255 -4.782 14.568 1.00 0.00 H new ATOM 0 HD2 HIS A 114 7.045 -2.921 14.905 1.00 0.00 H new ATOM 0 HE1 HIS A 114 4.574 0.530 14.528 1.00 0.00 H new ATOM 0 HE2 HIS A 114 6.978 -0.303 14.782 1.00 0.00 H new ATOM 1757 N HIS A 115 4.063 -2.934 11.784 1.00 0.00 N ATOM 1758 CA HIS A 115 4.544 -2.509 10.458 1.00 0.00 C ATOM 1759 C HIS A 115 6.068 -2.647 10.248 1.00 0.00 C ATOM 1760 O HIS A 115 6.552 -2.388 9.142 1.00 0.00 O ATOM 1761 CB HIS A 115 4.116 -1.050 10.214 1.00 0.00 C ATOM 1762 CG HIS A 115 2.649 -0.790 10.457 1.00 0.00 C ATOM 1763 ND1 HIS A 115 2.126 0.173 11.324 1.00 0.00 N ATOM 1764 CD2 HIS A 115 1.620 -1.533 9.954 1.00 0.00 C ATOM 1765 CE1 HIS A 115 0.792 -0.016 11.326 1.00 0.00 C ATOM 1766 NE2 HIS A 115 0.464 -1.034 10.515 1.00 0.00 N ATOM 0 H HIS A 115 3.805 -2.145 12.377 1.00 0.00 H new ATOM 0 HA HIS A 115 4.089 -3.187 9.737 1.00 0.00 H new ATOM 0 HB2 HIS A 115 4.702 -0.398 10.861 1.00 0.00 H new ATOM 0 HB3 HIS A 115 4.357 -0.779 9.186 1.00 0.00 H new ATOM 0 HD2 HIS A 115 1.697 -2.352 9.254 1.00 0.00 H new ATOM 0 HE1 HIS A 115 0.087 0.568 11.899 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -0.480 -1.380 10.343 1.00 0.00 H new ATOM 1774 N HIS A 116 6.828 -3.033 11.285 1.00 0.00 N ATOM 1775 CA HIS A 116 8.298 -3.131 11.286 1.00 0.00 C ATOM 1776 C HIS A 116 8.812 -4.338 12.088 1.00 0.00 C ATOM 1777 O HIS A 116 8.397 -4.514 13.254 1.00 0.00 O ATOM 1778 CB HIS A 116 8.884 -1.810 11.815 1.00 0.00 C ATOM 1779 CG HIS A 116 10.388 -1.714 11.706 1.00 0.00 C ATOM 1780 ND1 HIS A 116 11.278 -1.647 12.785 1.00 0.00 N ATOM 1781 CD2 HIS A 116 11.102 -1.641 10.547 1.00 0.00 C ATOM 1782 CE1 HIS A 116 12.504 -1.543 12.245 1.00 0.00 C ATOM 1783 NE2 HIS A 116 12.430 -1.537 10.902 1.00 0.00 N ATOM 1784 OXT HIS A 116 9.607 -5.120 11.518 1.00 0.00 O ATOM 0 H HIS A 116 6.420 -3.296 12.182 1.00 0.00 H new ATOM 0 HA HIS A 116 8.633 -3.297 10.262 1.00 0.00 H new ATOM 0 HB2 HIS A 116 8.437 -0.981 11.266 1.00 0.00 H new ATOM 0 HB3 HIS A 116 8.598 -1.691 12.860 1.00 0.00 H new ATOM 0 HD2 HIS A 116 10.704 -1.661 9.543 1.00 0.00 H new ATOM 0 HE1 HIS A 116 13.421 -1.474 12.811 1.00 0.00 H new ATOM 0 HE2 HIS A 116 13.219 -1.468 10.259 1.00 0.00 H new TER 1792 HIS A 116