USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1139 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 149 SER OG : rot 179:sc= -0.177 USER MOD Set 1.2: A 155 THR OG1 : rot -44:sc= -0.65 USER MOD Set 2.1: A 25 GLN : amide:sc= -10.1! C(o=-10!,f=-18!) USER MOD Set 2.2: A 153 ASN :FLIP amide:sc= -0.0626 F(o=-13,f=-10) USER MOD Set 3.1: A 124 HIS : no HE2:sc= -0.0236 K(o=-0.024,f=-7.2!) USER MOD Set 3.2: A 125 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 111 GLN : amide:sc= -1.04 X(o=-1.5,f=-1.4) USER MOD Set 4.2: A 142 ASN : amide:sc= -0.437 X(o=-1.5,f=-1.4) USER MOD Set 5.1: A 86 SER OG : rot -31:sc= -3.14! USER MOD Set 5.2: A 92 SER OG : rot -40:sc= 0.652 USER MOD Set 6.1: A 89 SER OG : rot 180:sc= 0.313 USER MOD Set 6.2: A 91 LYS NZ :NH3+ 141:sc= -0.171 (180deg=-1.07) USER MOD Set 7.1: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 57 GLN : amide:sc= -1.17 K(o=-1.2,f=-2.2) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -177:sc= -0.0265! USER MOD Single : A 19 LYS NZ :NH3+ -167:sc= 0.266 (180deg=0.212) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -24:sc= 0.181 USER MOD Single : A 23 THR OG1 : rot 80:sc= 1.13 USER MOD Single : A 30 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.012) USER MOD Single : A 41 ASN : amide:sc= -2.4! C(o=-2.4!,f=-2.9!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc=-0.00474 USER MOD Single : A 45 LYS NZ :NH3+ -162:sc= 1.09 (180deg=0.329) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 ASN :FLIP amide:sc= -3.82! C(o=-4.6!,f=-3.8!) USER MOD Single : A 52 GLN :FLIP amide:sc= -1.62 F(o=-2.6!,f=-1.6) USER MOD Single : A 54 TYR OH : rot 122:sc= 0.868 USER MOD Single : A 55 HIS : no HD1:sc= -5.54! C(o=-5.5!,f=-11!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0.0413 K(o=0.041,f=-1.1) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 71:sc= 1.4 USER MOD Single : A 88 THR OG1 : rot -18:sc= -1.64! USER MOD Single : A 97 LYS NZ :NH3+ 151:sc= -0.0496 (180deg=-0.471) USER MOD Single : A 100 HIS :FLIP no HD1:sc= -3.3! F(o=-4.1,f=-3.3!) USER MOD Single : A 102 LYS NZ :NH3+ -144:sc= -0.166 (180deg=-1.08) USER MOD Single : A 115 MET CE :methyl -175:sc= -1.78! (180deg=-1.91!) USER MOD Single : A 119 ASN : amide:sc= -2.58! C(o=-2.6!,f=-8!) USER MOD Single : A 120 LYS NZ :NH3+ -138:sc= -2.07! (180deg=-7.84!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot -55:sc= -4.22! USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot -82:sc= -0.015 USER MOD Single : A 148 SER OG : rot 140:sc= -1.07 USER MOD Single : A 151 LYS NZ :NH3+ -145:sc= -0.192 (180deg=-1.03) USER MOD Single : A 154 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 6 -13.790 -4.023 -6.148 1.00 0.00 N ATOM 2 CA SER A 6 -12.685 -3.727 -7.044 1.00 0.00 C ATOM 3 C SER A 6 -11.980 -2.446 -6.612 1.00 0.00 C ATOM 4 O SER A 6 -12.545 -1.354 -6.679 1.00 0.00 O ATOM 5 CB SER A 6 -13.196 -3.562 -8.464 1.00 0.00 C ATOM 6 OG SER A 6 -12.435 -4.384 -9.339 1.00 0.00 O ATOM 0 HA SER A 6 -11.979 -4.556 -7.005 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.250 -3.834 -8.517 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.121 -2.519 -8.770 1.00 0.00 H new ATOM 0 HG SER A 6 -12.765 -4.280 -10.256 1.00 0.00 H new ATOM 12 N ARG A 7 -10.746 -2.601 -6.169 1.00 0.00 N ATOM 13 CA ARG A 7 -9.940 -1.471 -5.715 1.00 0.00 C ATOM 14 C ARG A 7 -8.504 -1.642 -6.196 1.00 0.00 C ATOM 15 O ARG A 7 -7.947 -2.732 -6.095 1.00 0.00 O ATOM 16 CB ARG A 7 -9.962 -1.383 -4.185 1.00 0.00 C ATOM 17 CG ARG A 7 -11.067 -2.284 -3.625 1.00 0.00 C ATOM 18 CD ARG A 7 -11.106 -2.151 -2.101 1.00 0.00 C ATOM 19 NE ARG A 7 -12.439 -1.752 -1.660 1.00 0.00 N ATOM 20 CZ ARG A 7 -12.883 -2.061 -0.444 1.00 0.00 C ATOM 21 NH1 ARG A 7 -12.126 -2.733 0.381 1.00 0.00 N ATOM 22 NH2 ARG A 7 -14.077 -1.690 -0.074 1.00 0.00 N ATOM 0 H ARG A 7 -10.273 -3.503 -6.112 1.00 0.00 H new ATOM 0 HA ARG A 7 -10.357 -0.552 -6.127 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -8.996 -1.685 -3.781 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -10.130 -0.352 -3.874 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -12.031 -2.004 -4.051 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -10.884 -3.321 -3.906 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -10.832 -3.100 -1.639 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -10.372 -1.414 -1.775 1.00 0.00 H new ATOM 0 HE ARG A 7 -13.041 -1.227 -2.295 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -11.191 -3.023 0.094 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -12.470 -2.968 1.312 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -14.669 -1.164 -0.716 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -14.419 -1.926 0.858 1.00 0.00 H new ATOM 36 N LYS A 8 -7.891 -0.578 -6.709 1.00 0.00 N ATOM 37 CA LYS A 8 -6.526 -0.683 -7.171 1.00 0.00 C ATOM 38 C LYS A 8 -5.631 0.042 -6.193 1.00 0.00 C ATOM 39 O LYS A 8 -5.901 1.175 -5.839 1.00 0.00 O ATOM 40 CB LYS A 8 -6.397 -0.082 -8.570 1.00 0.00 C ATOM 41 CG LYS A 8 -7.523 -0.613 -9.460 1.00 0.00 C ATOM 42 CD LYS A 8 -7.070 -0.594 -10.922 1.00 0.00 C ATOM 43 CE LYS A 8 -8.289 -0.429 -11.831 1.00 0.00 C ATOM 44 NZ LYS A 8 -7.986 -0.994 -13.176 1.00 0.00 N ATOM 0 H LYS A 8 -8.314 0.345 -6.811 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.229 -1.730 -7.228 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.444 1.006 -8.516 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.428 -0.338 -8.999 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.788 -1.628 -9.163 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.417 -0.002 -9.337 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -6.368 0.223 -11.086 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -6.545 -1.518 -11.163 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -9.151 -0.937 -11.397 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.551 0.625 -11.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.815 -0.882 -13.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -7.175 -0.491 -13.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -7.756 -2.004 -13.084 1.00 0.00 H new ATOM 58 N ILE A 9 -4.592 -0.620 -5.726 1.00 0.00 N ATOM 59 CA ILE A 9 -3.712 -0.009 -4.766 1.00 0.00 C ATOM 60 C ILE A 9 -2.423 0.476 -5.454 1.00 0.00 C ATOM 61 O ILE A 9 -1.715 -0.283 -6.083 1.00 0.00 O ATOM 62 CB ILE A 9 -3.428 -1.003 -3.624 1.00 0.00 C ATOM 63 CG1 ILE A 9 -4.582 -2.052 -3.456 1.00 0.00 C ATOM 64 CG2 ILE A 9 -3.268 -0.224 -2.336 1.00 0.00 C ATOM 65 CD1 ILE A 9 -5.882 -1.440 -2.942 1.00 0.00 C ATOM 0 H ILE A 9 -4.342 -1.572 -5.996 1.00 0.00 H new ATOM 0 HA ILE A 9 -4.189 0.870 -4.332 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.518 -1.552 -3.866 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.769 -2.533 -4.416 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.258 -2.832 -2.767 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -3.066 -0.914 -1.516 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.438 0.475 -2.435 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.185 0.328 -2.128 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.639 -2.219 -2.848 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.709 -0.983 -1.968 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -6.228 -0.680 -3.642 1.00 0.00 H new ATOM 77 N ALA A 10 -2.136 1.765 -5.354 1.00 0.00 N ATOM 78 CA ALA A 10 -0.951 2.320 -6.015 1.00 0.00 C ATOM 79 C ALA A 10 0.290 2.132 -5.159 1.00 0.00 C ATOM 80 O ALA A 10 0.261 2.370 -3.959 1.00 0.00 O ATOM 81 CB ALA A 10 -1.129 3.807 -6.223 1.00 0.00 C ATOM 0 H ALA A 10 -2.693 2.442 -4.832 1.00 0.00 H new ATOM 0 HA ALA A 10 -0.833 1.799 -6.965 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.245 4.214 -6.715 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -2.005 3.985 -6.846 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -1.265 4.296 -5.258 1.00 0.00 H new ATOM 87 N ILE A 11 1.375 1.709 -5.794 1.00 0.00 N ATOM 88 CA ILE A 11 2.632 1.457 -5.087 1.00 0.00 C ATOM 89 C ILE A 11 3.574 2.649 -5.146 1.00 0.00 C ATOM 90 O ILE A 11 3.833 3.211 -6.210 1.00 0.00 O ATOM 91 CB ILE A 11 3.345 0.243 -5.691 1.00 0.00 C ATOM 92 CG1 ILE A 11 2.354 -0.916 -5.892 1.00 0.00 C ATOM 93 CG2 ILE A 11 4.462 -0.205 -4.747 1.00 0.00 C ATOM 94 CD1 ILE A 11 3.015 -2.021 -6.721 1.00 0.00 C ATOM 0 H ILE A 11 1.414 1.532 -6.798 1.00 0.00 H new ATOM 0 HA ILE A 11 2.374 1.271 -4.044 1.00 0.00 H new ATOM 0 HB ILE A 11 3.762 0.522 -6.659 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.040 -1.311 -4.926 1.00 0.00 H new ATOM 0 HG13 ILE A 11 1.457 -0.557 -6.396 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.973 -1.069 -5.172 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.175 0.609 -4.614 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.036 -0.475 -3.781 1.00 0.00 H new ATOM 0 HD11 ILE A 11 2.311 -2.841 -6.862 1.00 0.00 H new ATOM 0 HD12 ILE A 11 3.306 -1.622 -7.693 1.00 0.00 H new ATOM 0 HD13 ILE A 11 3.899 -2.388 -6.199 1.00 0.00 H new ATOM 106 N LEU A 12 4.093 3.006 -3.975 1.00 0.00 N ATOM 107 CA LEU A 12 5.030 4.115 -3.856 1.00 0.00 C ATOM 108 C LEU A 12 6.242 3.663 -3.053 1.00 0.00 C ATOM 109 O LEU A 12 6.173 3.525 -1.833 1.00 0.00 O ATOM 110 CB LEU A 12 4.347 5.293 -3.163 1.00 0.00 C ATOM 111 CG LEU A 12 5.211 6.555 -3.279 1.00 0.00 C ATOM 112 CD1 LEU A 12 4.383 7.770 -2.862 1.00 0.00 C ATOM 113 CD2 LEU A 12 6.452 6.460 -2.378 1.00 0.00 C ATOM 0 H LEU A 12 3.879 2.541 -3.093 1.00 0.00 H new ATOM 0 HA LEU A 12 5.354 4.432 -4.847 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.370 5.471 -3.612 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.177 5.056 -2.113 1.00 0.00 H new ATOM 0 HG LEU A 12 5.540 6.654 -4.313 1.00 0.00 H new ATOM 0 HD11 LEU A 12 4.992 8.670 -2.942 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.515 7.860 -3.515 1.00 0.00 H new ATOM 0 HD13 LEU A 12 4.051 7.648 -1.831 1.00 0.00 H new ATOM 0 HD21 LEU A 12 7.046 7.368 -2.480 1.00 0.00 H new ATOM 0 HD22 LEU A 12 6.140 6.345 -1.340 1.00 0.00 H new ATOM 0 HD23 LEU A 12 7.051 5.599 -2.674 1.00 0.00 H new ATOM 125 N GLY A 13 7.346 3.408 -3.745 1.00 0.00 N ATOM 126 CA GLY A 13 8.554 2.947 -3.083 1.00 0.00 C ATOM 127 C GLY A 13 9.802 3.573 -3.688 1.00 0.00 C ATOM 128 O GLY A 13 9.943 3.642 -4.909 1.00 0.00 O ATOM 0 H GLY A 13 7.427 3.512 -4.756 1.00 0.00 H new ATOM 0 HA2 GLY A 13 8.503 3.190 -2.022 1.00 0.00 H new ATOM 0 HA3 GLY A 13 8.618 1.862 -3.158 1.00 0.00 H new ATOM 132 N TYR A 14 10.703 4.018 -2.822 1.00 0.00 N ATOM 133 CA TYR A 14 11.953 4.624 -3.262 1.00 0.00 C ATOM 134 C TYR A 14 12.686 3.699 -4.218 1.00 0.00 C ATOM 135 O TYR A 14 12.100 2.794 -4.808 1.00 0.00 O ATOM 136 CB TYR A 14 12.838 4.908 -2.045 1.00 0.00 C ATOM 137 CG TYR A 14 13.439 6.287 -2.160 1.00 0.00 C ATOM 138 CD1 TYR A 14 12.603 7.408 -2.185 1.00 0.00 C ATOM 139 CD2 TYR A 14 14.829 6.445 -2.235 1.00 0.00 C ATOM 140 CE1 TYR A 14 13.157 8.691 -2.285 1.00 0.00 C ATOM 141 CE2 TYR A 14 15.381 7.727 -2.336 1.00 0.00 C ATOM 142 CZ TYR A 14 14.547 8.850 -2.361 1.00 0.00 C ATOM 143 OH TYR A 14 15.092 10.113 -2.460 1.00 0.00 O ATOM 0 H TYR A 14 10.591 3.971 -1.809 1.00 0.00 H new ATOM 0 HA TYR A 14 11.728 5.556 -3.781 1.00 0.00 H new ATOM 0 HB2 TYR A 14 12.249 4.833 -1.131 1.00 0.00 H new ATOM 0 HB3 TYR A 14 13.629 4.161 -1.977 1.00 0.00 H new ATOM 0 HD1 TYR A 14 11.532 7.285 -2.127 1.00 0.00 H new ATOM 0 HD2 TYR A 14 15.474 5.579 -2.215 1.00 0.00 H new ATOM 0 HE1 TYR A 14 12.513 9.557 -2.304 1.00 0.00 H new ATOM 0 HE2 TYR A 14 16.452 7.850 -2.395 1.00 0.00 H new ATOM 0 HH TYR A 14 16.069 10.045 -2.502 1.00 0.00 H new ATOM 153 N ARG A 15 13.971 3.941 -4.373 1.00 0.00 N ATOM 154 CA ARG A 15 14.783 3.123 -5.263 1.00 0.00 C ATOM 155 C ARG A 15 15.504 2.024 -4.485 1.00 0.00 C ATOM 156 O ARG A 15 16.065 2.269 -3.417 1.00 0.00 O ATOM 157 CB ARG A 15 15.809 3.990 -5.991 1.00 0.00 C ATOM 158 CG ARG A 15 16.346 3.234 -7.209 1.00 0.00 C ATOM 159 CD ARG A 15 17.856 3.448 -7.316 1.00 0.00 C ATOM 160 NE ARG A 15 18.522 2.934 -6.125 1.00 0.00 N ATOM 161 CZ ARG A 15 19.745 3.335 -5.795 1.00 0.00 C ATOM 162 NH1 ARG A 15 20.369 4.204 -6.542 1.00 0.00 N ATOM 163 NH2 ARG A 15 20.320 2.860 -4.724 1.00 0.00 N ATOM 0 H ARG A 15 14.477 4.690 -3.900 1.00 0.00 H new ATOM 0 HA ARG A 15 14.119 2.659 -5.993 1.00 0.00 H new ATOM 0 HB2 ARG A 15 15.351 4.928 -6.305 1.00 0.00 H new ATOM 0 HB3 ARG A 15 16.628 4.245 -5.318 1.00 0.00 H new ATOM 0 HG2 ARG A 15 16.124 2.171 -7.117 1.00 0.00 H new ATOM 0 HG3 ARG A 15 15.853 3.586 -8.115 1.00 0.00 H new ATOM 0 HD2 ARG A 15 18.240 2.944 -8.203 1.00 0.00 H new ATOM 0 HD3 ARG A 15 18.073 4.510 -7.434 1.00 0.00 H new ATOM 0 HE ARG A 15 18.041 2.255 -5.535 1.00 0.00 H new ATOM 0 HH11 ARG A 15 19.918 4.575 -7.378 1.00 0.00 H new ATOM 0 HH12 ARG A 15 21.308 4.513 -6.290 1.00 0.00 H new ATOM 0 HH21 ARG A 15 19.831 2.181 -4.141 1.00 0.00 H new ATOM 0 HH22 ARG A 15 21.259 3.167 -4.470 1.00 0.00 H new ATOM 177 N SER A 16 15.491 0.816 -5.038 1.00 0.00 N ATOM 178 CA SER A 16 16.149 -0.319 -4.414 1.00 0.00 C ATOM 179 C SER A 16 15.574 -0.610 -3.030 1.00 0.00 C ATOM 180 O SER A 16 16.207 -1.283 -2.217 1.00 0.00 O ATOM 181 CB SER A 16 17.634 -0.037 -4.305 1.00 0.00 C ATOM 182 OG SER A 16 18.104 0.498 -5.536 1.00 0.00 O ATOM 0 H SER A 16 15.029 0.600 -5.921 1.00 0.00 H new ATOM 0 HA SER A 16 15.979 -1.198 -5.035 1.00 0.00 H new ATOM 0 HB2 SER A 16 17.823 0.666 -3.494 1.00 0.00 H new ATOM 0 HB3 SER A 16 18.173 -0.953 -4.065 1.00 0.00 H new ATOM 0 HG SER A 16 19.073 0.638 -5.483 1.00 0.00 H new ATOM 188 N VAL A 17 14.373 -0.107 -2.772 1.00 0.00 N ATOM 189 CA VAL A 17 13.726 -0.329 -1.483 1.00 0.00 C ATOM 190 C VAL A 17 13.155 -1.743 -1.401 1.00 0.00 C ATOM 191 O VAL A 17 12.904 -2.255 -0.310 1.00 0.00 O ATOM 192 CB VAL A 17 12.606 0.687 -1.278 1.00 0.00 C ATOM 193 CG1 VAL A 17 11.679 0.665 -2.490 1.00 0.00 C ATOM 194 CG2 VAL A 17 11.818 0.320 -0.021 1.00 0.00 C ATOM 0 H VAL A 17 13.831 0.452 -3.431 1.00 0.00 H new ATOM 0 HA VAL A 17 14.474 -0.207 -0.700 1.00 0.00 H new ATOM 0 HB VAL A 17 13.028 1.685 -1.163 1.00 0.00 H new ATOM 0 HG11 VAL A 17 10.877 1.389 -2.348 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.245 0.921 -3.386 1.00 0.00 H new ATOM 0 HG13 VAL A 17 11.252 -0.331 -2.603 1.00 0.00 H new ATOM 0 HG21 VAL A 17 11.016 1.043 0.130 1.00 0.00 H new ATOM 0 HG22 VAL A 17 11.391 -0.676 -0.137 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.484 0.331 0.842 1.00 0.00 H new ATOM 204 N GLY A 18 12.957 -2.372 -2.555 1.00 0.00 N ATOM 205 CA GLY A 18 12.423 -3.728 -2.587 1.00 0.00 C ATOM 206 C GLY A 18 10.908 -3.729 -2.764 1.00 0.00 C ATOM 207 O GLY A 18 10.239 -4.709 -2.434 1.00 0.00 O ATOM 0 H GLY A 18 13.156 -1.970 -3.471 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.886 -4.283 -3.403 1.00 0.00 H new ATOM 0 HA3 GLY A 18 12.683 -4.244 -1.663 1.00 0.00 H new ATOM 211 N LYS A 19 10.371 -2.638 -3.291 1.00 0.00 N ATOM 212 CA LYS A 19 8.933 -2.544 -3.507 1.00 0.00 C ATOM 213 C LYS A 19 8.506 -3.513 -4.600 1.00 0.00 C ATOM 214 O LYS A 19 7.412 -4.077 -4.554 1.00 0.00 O ATOM 215 CB LYS A 19 8.552 -1.118 -3.904 1.00 0.00 C ATOM 216 CG LYS A 19 8.973 -0.860 -5.351 1.00 0.00 C ATOM 217 CD LYS A 19 9.143 0.645 -5.577 1.00 0.00 C ATOM 218 CE LYS A 19 9.554 0.904 -7.027 1.00 0.00 C ATOM 219 NZ LYS A 19 11.041 0.928 -7.121 1.00 0.00 N ATOM 0 H LYS A 19 10.901 -1.814 -3.574 1.00 0.00 H new ATOM 0 HA LYS A 19 8.422 -2.803 -2.580 1.00 0.00 H new ATOM 0 HB2 LYS A 19 7.477 -0.974 -3.796 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.037 -0.403 -3.240 1.00 0.00 H new ATOM 0 HG2 LYS A 19 9.908 -1.378 -5.566 1.00 0.00 H new ATOM 0 HG3 LYS A 19 8.223 -1.258 -6.035 1.00 0.00 H new ATOM 0 HD2 LYS A 19 8.210 1.164 -5.355 1.00 0.00 H new ATOM 0 HD3 LYS A 19 9.898 1.042 -4.898 1.00 0.00 H new ATOM 0 HE2 LYS A 19 9.150 0.127 -7.676 1.00 0.00 H new ATOM 0 HE3 LYS A 19 9.141 1.853 -7.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 11.324 1.317 -8.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 11.427 1.523 -6.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 11.411 -0.039 -7.025 1.00 0.00 H new ATOM 233 N SER A 20 9.380 -3.707 -5.578 1.00 0.00 N ATOM 234 CA SER A 20 9.087 -4.613 -6.676 1.00 0.00 C ATOM 235 C SER A 20 9.168 -6.064 -6.209 1.00 0.00 C ATOM 236 O SER A 20 8.359 -6.898 -6.612 1.00 0.00 O ATOM 237 CB SER A 20 10.076 -4.382 -7.819 1.00 0.00 C ATOM 238 OG SER A 20 9.954 -3.041 -8.283 1.00 0.00 O ATOM 0 H SER A 20 10.291 -3.252 -5.632 1.00 0.00 H new ATOM 0 HA SER A 20 8.075 -4.415 -7.028 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.094 -4.570 -7.478 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.879 -5.080 -8.633 1.00 0.00 H new ATOM 0 HG SER A 20 10.588 -2.889 -9.015 1.00 0.00 H new ATOM 244 N SER A 21 10.140 -6.364 -5.350 1.00 0.00 N ATOM 245 CA SER A 21 10.293 -7.718 -4.851 1.00 0.00 C ATOM 246 C SER A 21 9.057 -8.138 -4.069 1.00 0.00 C ATOM 247 O SER A 21 8.602 -9.278 -4.179 1.00 0.00 O ATOM 248 CB SER A 21 11.530 -7.808 -3.957 1.00 0.00 C ATOM 249 OG SER A 21 11.411 -6.872 -2.895 1.00 0.00 O ATOM 0 H SER A 21 10.822 -5.695 -4.992 1.00 0.00 H new ATOM 0 HA SER A 21 10.415 -8.391 -5.700 1.00 0.00 H new ATOM 0 HB2 SER A 21 11.632 -8.817 -3.558 1.00 0.00 H new ATOM 0 HB3 SER A 21 12.429 -7.603 -4.539 1.00 0.00 H new ATOM 0 HG SER A 21 10.809 -6.147 -3.164 1.00 0.00 H new ATOM 255 N LEU A 22 8.513 -7.219 -3.274 1.00 0.00 N ATOM 256 CA LEU A 22 7.333 -7.544 -2.488 1.00 0.00 C ATOM 257 C LEU A 22 6.074 -7.524 -3.347 1.00 0.00 C ATOM 258 O LEU A 22 5.105 -8.197 -3.023 1.00 0.00 O ATOM 259 CB LEU A 22 7.172 -6.601 -1.288 1.00 0.00 C ATOM 260 CG LEU A 22 5.905 -6.961 -0.494 1.00 0.00 C ATOM 261 CD1 LEU A 22 5.950 -8.433 -0.055 1.00 0.00 C ATOM 262 CD2 LEU A 22 5.823 -6.074 0.750 1.00 0.00 C ATOM 0 H LEU A 22 8.862 -6.267 -3.160 1.00 0.00 H new ATOM 0 HA LEU A 22 7.475 -8.555 -2.106 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.047 -6.671 -0.642 1.00 0.00 H new ATOM 0 HB3 LEU A 22 7.112 -5.569 -1.633 1.00 0.00 H new ATOM 0 HG LEU A 22 5.033 -6.804 -1.129 1.00 0.00 H new ATOM 0 HD11 LEU A 22 5.047 -8.673 0.506 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.012 -9.073 -0.935 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.823 -8.598 0.576 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.927 -6.325 1.317 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.703 -6.237 1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.781 -5.027 0.448 1.00 0.00 H new ATOM 274 N THR A 23 6.073 -6.767 -4.443 1.00 0.00 N ATOM 275 CA THR A 23 4.902 -6.736 -5.292 1.00 0.00 C ATOM 276 C THR A 23 4.681 -8.123 -5.871 1.00 0.00 C ATOM 277 O THR A 23 3.548 -8.574 -5.995 1.00 0.00 O ATOM 278 CB THR A 23 5.083 -5.719 -6.419 1.00 0.00 C ATOM 279 OG1 THR A 23 5.190 -4.414 -5.867 1.00 0.00 O ATOM 280 CG2 THR A 23 3.880 -5.782 -7.355 1.00 0.00 C ATOM 0 H THR A 23 6.851 -6.184 -4.751 1.00 0.00 H new ATOM 0 HA THR A 23 4.035 -6.438 -4.703 1.00 0.00 H new ATOM 0 HB THR A 23 5.990 -5.950 -6.978 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.101 -4.273 -5.536 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.007 -5.058 -8.160 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.800 -6.784 -7.778 1.00 0.00 H new ATOM 0 HG23 THR A 23 2.973 -5.550 -6.797 1.00 0.00 H new ATOM 288 N ILE A 24 5.783 -8.793 -6.213 1.00 0.00 N ATOM 289 CA ILE A 24 5.711 -10.141 -6.770 1.00 0.00 C ATOM 290 C ILE A 24 5.386 -11.150 -5.670 1.00 0.00 C ATOM 291 O ILE A 24 4.627 -12.086 -5.889 1.00 0.00 O ATOM 292 CB ILE A 24 7.038 -10.501 -7.447 1.00 0.00 C ATOM 293 CG1 ILE A 24 7.024 -10.013 -8.902 1.00 0.00 C ATOM 294 CG2 ILE A 24 7.232 -12.019 -7.435 1.00 0.00 C ATOM 295 CD1 ILE A 24 6.603 -8.540 -8.966 1.00 0.00 C ATOM 0 H ILE A 24 6.729 -8.425 -6.114 1.00 0.00 H new ATOM 0 HA ILE A 24 4.917 -10.172 -7.516 1.00 0.00 H new ATOM 0 HB ILE A 24 7.853 -10.023 -6.904 1.00 0.00 H new ATOM 0 HG12 ILE A 24 8.013 -10.135 -9.343 1.00 0.00 H new ATOM 0 HG13 ILE A 24 6.336 -10.621 -9.490 1.00 0.00 H new ATOM 0 HG21 ILE A 24 8.177 -12.269 -7.918 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.245 -12.376 -6.405 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.413 -12.495 -7.974 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.598 -8.208 -10.004 1.00 0.00 H new ATOM 0 HD12 ILE A 24 5.604 -8.428 -8.544 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.308 -7.935 -8.395 1.00 0.00 H new ATOM 307 N GLN A 25 5.951 -10.961 -4.481 1.00 0.00 N ATOM 308 CA GLN A 25 5.665 -11.882 -3.386 1.00 0.00 C ATOM 309 C GLN A 25 4.274 -11.621 -2.832 1.00 0.00 C ATOM 310 O GLN A 25 3.664 -12.497 -2.247 1.00 0.00 O ATOM 311 CB GLN A 25 6.667 -11.749 -2.243 1.00 0.00 C ATOM 312 CG GLN A 25 6.150 -12.581 -1.062 1.00 0.00 C ATOM 313 CD GLN A 25 7.293 -13.078 -0.191 1.00 0.00 C ATOM 314 OE1 GLN A 25 7.345 -14.261 0.138 1.00 0.00 O ATOM 315 NE2 GLN A 25 8.213 -12.252 0.209 1.00 0.00 N ATOM 0 H GLN A 25 6.592 -10.201 -4.254 1.00 0.00 H new ATOM 0 HA GLN A 25 5.736 -12.889 -3.797 1.00 0.00 H new ATOM 0 HB2 GLN A 25 7.651 -12.100 -2.555 1.00 0.00 H new ATOM 0 HB3 GLN A 25 6.779 -10.704 -1.953 1.00 0.00 H new ATOM 0 HG2 GLN A 25 5.468 -11.979 -0.461 1.00 0.00 H new ATOM 0 HG3 GLN A 25 5.579 -13.431 -1.436 1.00 0.00 H new ATOM 0 HE21 GLN A 25 8.170 -11.270 -0.064 1.00 0.00 H new ATOM 0 HE22 GLN A 25 8.978 -12.586 0.796 1.00 0.00 H new ATOM 324 N PHE A 26 3.799 -10.401 -2.999 1.00 0.00 N ATOM 325 CA PHE A 26 2.486 -10.015 -2.496 1.00 0.00 C ATOM 326 C PHE A 26 1.385 -10.563 -3.388 1.00 0.00 C ATOM 327 O PHE A 26 0.456 -11.225 -2.924 1.00 0.00 O ATOM 328 CB PHE A 26 2.402 -8.491 -2.461 1.00 0.00 C ATOM 329 CG PHE A 26 1.008 -8.052 -2.085 1.00 0.00 C ATOM 330 CD1 PHE A 26 -0.003 -8.024 -3.053 1.00 0.00 C ATOM 331 CD2 PHE A 26 0.729 -7.658 -0.771 1.00 0.00 C ATOM 332 CE1 PHE A 26 -1.292 -7.605 -2.708 1.00 0.00 C ATOM 333 CE2 PHE A 26 -0.562 -7.241 -0.425 1.00 0.00 C ATOM 334 CZ PHE A 26 -1.572 -7.212 -1.394 1.00 0.00 C ATOM 0 H PHE A 26 4.302 -9.655 -3.480 1.00 0.00 H new ATOM 0 HA PHE A 26 2.353 -10.425 -1.495 1.00 0.00 H new ATOM 0 HB2 PHE A 26 3.121 -8.097 -1.743 1.00 0.00 H new ATOM 0 HB3 PHE A 26 2.669 -8.083 -3.436 1.00 0.00 H new ATOM 0 HD1 PHE A 26 0.213 -8.326 -4.067 1.00 0.00 H new ATOM 0 HD2 PHE A 26 1.509 -7.676 -0.024 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -2.071 -7.585 -3.455 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -0.779 -6.942 0.590 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.567 -6.887 -1.128 1.00 0.00 H new ATOM 344 N VAL A 27 1.506 -10.276 -4.672 1.00 0.00 N ATOM 345 CA VAL A 27 0.533 -10.726 -5.653 1.00 0.00 C ATOM 346 C VAL A 27 0.486 -12.252 -5.714 1.00 0.00 C ATOM 347 O VAL A 27 -0.588 -12.850 -5.703 1.00 0.00 O ATOM 348 CB VAL A 27 0.908 -10.161 -7.011 1.00 0.00 C ATOM 349 CG1 VAL A 27 2.283 -10.689 -7.411 1.00 0.00 C ATOM 350 CG2 VAL A 27 -0.126 -10.588 -8.036 1.00 0.00 C ATOM 0 H VAL A 27 2.274 -9.730 -5.062 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.456 -10.372 -5.363 1.00 0.00 H new ATOM 0 HB VAL A 27 0.938 -9.072 -6.964 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.558 -10.286 -8.386 1.00 0.00 H new ATOM 0 HG12 VAL A 27 3.021 -10.381 -6.670 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.254 -11.777 -7.463 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.141 -10.184 -9.012 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.157 -11.676 -8.090 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.106 -10.211 -7.743 1.00 0.00 H new ATOM 360 N GLU A 28 1.653 -12.881 -5.756 1.00 0.00 N ATOM 361 CA GLU A 28 1.718 -14.336 -5.793 1.00 0.00 C ATOM 362 C GLU A 28 1.579 -14.869 -4.386 1.00 0.00 C ATOM 363 O GLU A 28 1.171 -16.010 -4.169 1.00 0.00 O ATOM 364 CB GLU A 28 3.046 -14.812 -6.379 1.00 0.00 C ATOM 365 CG GLU A 28 2.778 -15.778 -7.535 1.00 0.00 C ATOM 366 CD GLU A 28 2.034 -17.007 -7.025 1.00 0.00 C ATOM 367 OE1 GLU A 28 2.640 -17.787 -6.307 1.00 0.00 O ATOM 368 OE2 GLU A 28 0.870 -17.152 -7.358 1.00 0.00 O ATOM 0 H GLU A 28 2.559 -12.412 -5.765 1.00 0.00 H new ATOM 0 HA GLU A 28 0.910 -14.705 -6.425 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.627 -13.959 -6.731 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.639 -15.305 -5.609 1.00 0.00 H new ATOM 0 HG2 GLU A 28 2.190 -15.281 -8.306 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.720 -16.078 -7.995 1.00 0.00 H new ATOM 375 N GLY A 29 1.936 -14.026 -3.430 1.00 0.00 N ATOM 376 CA GLY A 29 1.869 -14.403 -2.037 1.00 0.00 C ATOM 377 C GLY A 29 3.038 -15.304 -1.664 1.00 0.00 C ATOM 378 O GLY A 29 2.989 -16.007 -0.656 1.00 0.00 O ATOM 0 H GLY A 29 2.274 -13.078 -3.598 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.879 -13.509 -1.413 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.929 -14.919 -1.840 1.00 0.00 H new ATOM 382 N GLN A 30 4.082 -15.297 -2.494 1.00 0.00 N ATOM 383 CA GLN A 30 5.245 -16.152 -2.239 1.00 0.00 C ATOM 384 C GLN A 30 6.563 -15.517 -2.695 1.00 0.00 C ATOM 385 O GLN A 30 6.672 -15.009 -3.809 1.00 0.00 O ATOM 386 CB GLN A 30 5.064 -17.480 -2.979 1.00 0.00 C ATOM 387 CG GLN A 30 4.475 -18.537 -2.041 1.00 0.00 C ATOM 388 CD GLN A 30 3.748 -19.597 -2.858 1.00 0.00 C ATOM 389 OE1 GLN A 30 4.085 -20.779 -2.787 1.00 0.00 O ATOM 390 NE2 GLN A 30 2.762 -19.241 -3.635 1.00 0.00 N ATOM 0 H GLN A 30 4.148 -14.721 -3.333 1.00 0.00 H new ATOM 0 HA GLN A 30 5.303 -16.299 -1.161 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.407 -17.339 -3.837 1.00 0.00 H new ATOM 0 HB3 GLN A 30 6.024 -17.822 -3.366 1.00 0.00 H new ATOM 0 HG2 GLN A 30 5.268 -18.998 -1.452 1.00 0.00 H new ATOM 0 HG3 GLN A 30 3.786 -18.070 -1.337 1.00 0.00 H new ATOM 0 HE21 GLN A 30 2.485 -18.261 -3.691 1.00 0.00 H new ATOM 0 HE22 GLN A 30 2.268 -19.943 -4.186 1.00 0.00 H new ATOM 399 N PHE A 31 7.571 -15.595 -1.825 1.00 0.00 N ATOM 400 CA PHE A 31 8.899 -15.075 -2.126 1.00 0.00 C ATOM 401 C PHE A 31 9.544 -15.927 -3.216 1.00 0.00 C ATOM 402 O PHE A 31 10.162 -16.952 -2.925 1.00 0.00 O ATOM 403 CB PHE A 31 9.767 -15.122 -0.861 1.00 0.00 C ATOM 404 CG PHE A 31 11.219 -15.255 -1.242 1.00 0.00 C ATOM 405 CD1 PHE A 31 11.751 -14.424 -2.228 1.00 0.00 C ATOM 406 CD2 PHE A 31 12.031 -16.203 -0.609 1.00 0.00 C ATOM 407 CE1 PHE A 31 13.099 -14.536 -2.588 1.00 0.00 C ATOM 408 CE2 PHE A 31 13.379 -16.318 -0.967 1.00 0.00 C ATOM 409 CZ PHE A 31 13.914 -15.484 -1.957 1.00 0.00 C ATOM 0 H PHE A 31 7.488 -16.017 -0.900 1.00 0.00 H new ATOM 0 HA PHE A 31 8.815 -14.044 -2.471 1.00 0.00 H new ATOM 0 HB2 PHE A 31 9.618 -14.217 -0.273 1.00 0.00 H new ATOM 0 HB3 PHE A 31 9.468 -15.962 -0.235 1.00 0.00 H new ATOM 0 HD1 PHE A 31 11.122 -13.693 -2.714 1.00 0.00 H new ATOM 0 HD2 PHE A 31 11.618 -16.845 0.155 1.00 0.00 H new ATOM 0 HE1 PHE A 31 13.510 -13.892 -3.351 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.007 -17.050 -0.480 1.00 0.00 H new ATOM 0 HZ PHE A 31 14.954 -15.572 -2.234 1.00 0.00 H new ATOM 538 N GLU A 40 8.480 -1.257 -13.774 1.00 0.00 N ATOM 539 CA GLU A 40 7.168 -0.712 -13.472 1.00 0.00 C ATOM 540 C GLU A 40 6.090 -1.470 -14.236 1.00 0.00 C ATOM 541 O GLU A 40 6.306 -1.896 -15.370 1.00 0.00 O ATOM 542 CB GLU A 40 7.116 0.770 -13.842 1.00 0.00 C ATOM 543 CG GLU A 40 7.923 1.004 -15.120 1.00 0.00 C ATOM 544 CD GLU A 40 9.400 1.174 -14.779 1.00 0.00 C ATOM 545 OE1 GLU A 40 9.754 2.224 -14.269 1.00 0.00 O ATOM 546 OE2 GLU A 40 10.157 0.251 -15.033 1.00 0.00 O ATOM 0 HA GLU A 40 6.986 -0.821 -12.403 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.082 1.083 -13.989 1.00 0.00 H new ATOM 0 HB3 GLU A 40 7.519 1.373 -13.029 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.793 0.163 -15.801 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.555 1.892 -15.635 1.00 0.00 H new ATOM 553 N ASN A 41 4.932 -1.649 -13.607 1.00 0.00 N ATOM 554 CA ASN A 41 3.844 -2.375 -14.249 1.00 0.00 C ATOM 555 C ASN A 41 2.646 -2.539 -13.325 1.00 0.00 C ATOM 556 O ASN A 41 2.661 -2.103 -12.174 1.00 0.00 O ATOM 557 CB ASN A 41 4.342 -3.753 -14.630 1.00 0.00 C ATOM 558 CG ASN A 41 4.565 -3.844 -16.137 1.00 0.00 C ATOM 559 OD1 ASN A 41 5.707 -3.828 -16.599 1.00 0.00 O ATOM 560 ND2 ASN A 41 3.538 -3.943 -16.936 1.00 0.00 N ATOM 0 H ASN A 41 4.725 -1.307 -12.668 1.00 0.00 H new ATOM 0 HA ASN A 41 3.528 -1.805 -15.122 1.00 0.00 H new ATOM 0 HB2 ASN A 41 5.273 -3.967 -14.105 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.619 -4.507 -14.317 1.00 0.00 H new ATOM 0 HD21 ASN A 41 3.680 -4.007 -17.944 1.00 0.00 H new ATOM 0 HD22 ASN A 41 2.593 -3.956 -16.553 1.00 0.00 H new ATOM 567 N THR A 42 1.615 -3.191 -13.854 1.00 0.00 N ATOM 568 CA THR A 42 0.393 -3.444 -13.102 1.00 0.00 C ATOM 569 C THR A 42 0.289 -4.918 -12.724 1.00 0.00 C ATOM 570 O THR A 42 0.629 -5.800 -13.513 1.00 0.00 O ATOM 571 CB THR A 42 -0.822 -3.051 -13.946 1.00 0.00 C ATOM 572 OG1 THR A 42 -0.383 -2.368 -15.111 1.00 0.00 O ATOM 573 CG2 THR A 42 -1.737 -2.141 -13.132 1.00 0.00 C ATOM 0 H THR A 42 1.603 -3.555 -14.807 1.00 0.00 H new ATOM 0 HA THR A 42 0.419 -2.848 -12.190 1.00 0.00 H new ATOM 0 HB THR A 42 -1.371 -3.947 -14.235 1.00 0.00 H new ATOM 0 HG1 THR A 42 -1.159 -2.116 -15.655 1.00 0.00 H new ATOM 0 HG21 THR A 42 -2.602 -1.862 -13.734 1.00 0.00 H new ATOM 0 HG22 THR A 42 -2.072 -2.667 -12.238 1.00 0.00 H new ATOM 0 HG23 THR A 42 -1.192 -1.243 -12.841 1.00 0.00 H new ATOM 581 N PHE A 43 -0.183 -5.170 -11.509 1.00 0.00 N ATOM 582 CA PHE A 43 -0.337 -6.535 -11.015 1.00 0.00 C ATOM 583 C PHE A 43 -1.748 -6.733 -10.496 1.00 0.00 C ATOM 584 O PHE A 43 -2.472 -5.765 -10.277 1.00 0.00 O ATOM 585 CB PHE A 43 0.684 -6.810 -9.902 1.00 0.00 C ATOM 586 CG PHE A 43 2.092 -6.724 -10.453 1.00 0.00 C ATOM 587 CD1 PHE A 43 2.609 -5.493 -10.881 1.00 0.00 C ATOM 588 CD2 PHE A 43 2.876 -7.879 -10.544 1.00 0.00 C ATOM 589 CE1 PHE A 43 3.909 -5.421 -11.397 1.00 0.00 C ATOM 590 CE2 PHE A 43 4.174 -7.807 -11.065 1.00 0.00 C ATOM 591 CZ PHE A 43 4.690 -6.579 -11.491 1.00 0.00 C ATOM 0 H PHE A 43 -0.466 -4.448 -10.847 1.00 0.00 H new ATOM 0 HA PHE A 43 -0.158 -7.235 -11.831 1.00 0.00 H new ATOM 0 HB2 PHE A 43 0.557 -6.089 -9.095 1.00 0.00 H new ATOM 0 HB3 PHE A 43 0.512 -7.798 -9.476 1.00 0.00 H new ATOM 0 HD1 PHE A 43 2.005 -4.600 -10.813 1.00 0.00 H new ATOM 0 HD2 PHE A 43 2.480 -8.827 -10.212 1.00 0.00 H new ATOM 0 HE1 PHE A 43 4.309 -4.472 -11.722 1.00 0.00 H new ATOM 0 HE2 PHE A 43 4.777 -8.700 -11.138 1.00 0.00 H new ATOM 0 HZ PHE A 43 5.691 -6.524 -11.893 1.00 0.00 H new ATOM 601 N THR A 44 -2.148 -7.987 -10.329 1.00 0.00 N ATOM 602 CA THR A 44 -3.487 -8.277 -9.869 1.00 0.00 C ATOM 603 C THR A 44 -3.532 -9.479 -8.944 1.00 0.00 C ATOM 604 O THR A 44 -2.670 -10.353 -8.991 1.00 0.00 O ATOM 605 CB THR A 44 -4.388 -8.553 -11.075 1.00 0.00 C ATOM 606 OG1 THR A 44 -3.674 -8.293 -12.274 1.00 0.00 O ATOM 607 CG2 THR A 44 -5.629 -7.683 -11.023 1.00 0.00 C ATOM 0 H THR A 44 -1.567 -8.807 -10.505 1.00 0.00 H new ATOM 0 HA THR A 44 -3.834 -7.408 -9.310 1.00 0.00 H new ATOM 0 HB THR A 44 -4.693 -9.599 -11.050 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.252 -8.472 -13.045 1.00 0.00 H new ATOM 0 HG21 THR A 44 -6.257 -7.893 -11.889 1.00 0.00 H new ATOM 0 HG22 THR A 44 -6.185 -7.897 -10.110 1.00 0.00 H new ATOM 0 HG23 THR A 44 -5.338 -6.633 -11.033 1.00 0.00 H new ATOM 615 N LYS A 45 -4.566 -9.513 -8.107 1.00 0.00 N ATOM 616 CA LYS A 45 -4.740 -10.612 -7.170 1.00 0.00 C ATOM 617 C LYS A 45 -6.183 -10.679 -6.670 1.00 0.00 C ATOM 618 O LYS A 45 -6.649 -9.793 -5.953 1.00 0.00 O ATOM 619 CB LYS A 45 -3.784 -10.431 -5.987 1.00 0.00 C ATOM 620 CG LYS A 45 -3.139 -11.771 -5.617 1.00 0.00 C ATOM 621 CD LYS A 45 -4.206 -12.713 -5.070 1.00 0.00 C ATOM 622 CE LYS A 45 -3.537 -13.956 -4.480 1.00 0.00 C ATOM 623 NZ LYS A 45 -2.539 -14.489 -5.449 1.00 0.00 N ATOM 0 H LYS A 45 -5.290 -8.796 -8.061 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.514 -11.547 -7.683 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -3.011 -9.706 -6.242 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.326 -10.031 -5.130 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -2.663 -12.212 -6.493 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -2.357 -11.618 -4.873 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -4.795 -12.207 -4.305 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -4.894 -13.000 -5.865 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -3.048 -13.707 -3.538 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.287 -14.716 -4.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -2.309 -15.473 -5.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -2.936 -14.455 -6.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -1.675 -13.911 -5.410 1.00 0.00 H new ATOM 637 N LEU A 46 -6.886 -11.736 -7.077 1.00 0.00 N ATOM 638 CA LEU A 46 -8.279 -11.929 -6.700 1.00 0.00 C ATOM 639 C LEU A 46 -8.407 -13.018 -5.631 1.00 0.00 C ATOM 640 O LEU A 46 -7.920 -14.133 -5.811 1.00 0.00 O ATOM 641 CB LEU A 46 -9.080 -12.377 -7.928 1.00 0.00 C ATOM 642 CG LEU A 46 -9.301 -11.202 -8.883 1.00 0.00 C ATOM 643 CD1 LEU A 46 -7.987 -10.821 -9.556 1.00 0.00 C ATOM 644 CD2 LEU A 46 -10.320 -11.590 -9.959 1.00 0.00 C ATOM 0 H LEU A 46 -6.507 -12.474 -7.671 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.659 -10.986 -6.308 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.549 -13.177 -8.444 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -10.041 -12.783 -7.614 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.676 -10.353 -8.311 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.155 -9.984 -10.234 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.259 -10.533 -8.797 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.606 -11.673 -10.119 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -10.473 -10.749 -10.636 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -9.947 -12.446 -10.522 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -11.267 -11.852 -9.486 1.00 0.00 H new ATOM 656 N ILE A 47 -9.077 -12.691 -4.526 1.00 0.00 N ATOM 657 CA ILE A 47 -9.275 -13.657 -3.442 1.00 0.00 C ATOM 658 C ILE A 47 -10.595 -13.393 -2.726 1.00 0.00 C ATOM 659 O ILE A 47 -11.197 -12.332 -2.888 1.00 0.00 O ATOM 660 CB ILE A 47 -8.138 -13.585 -2.416 1.00 0.00 C ATOM 661 CG1 ILE A 47 -6.879 -13.003 -3.058 1.00 0.00 C ATOM 662 CG2 ILE A 47 -7.829 -14.991 -1.898 1.00 0.00 C ATOM 663 CD1 ILE A 47 -5.752 -12.968 -2.023 1.00 0.00 C ATOM 0 H ILE A 47 -9.489 -11.773 -4.357 1.00 0.00 H new ATOM 0 HA ILE A 47 -9.287 -14.649 -3.892 1.00 0.00 H new ATOM 0 HB ILE A 47 -8.450 -12.943 -1.592 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.582 -13.607 -3.915 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -7.078 -11.998 -3.430 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.021 -14.941 -1.169 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -8.718 -15.408 -1.426 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -7.528 -15.627 -2.730 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.853 -12.553 -2.478 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -6.052 -12.346 -1.180 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -5.548 -13.980 -1.673 1.00 0.00 H new ATOM 675 N THR A 48 -11.031 -14.364 -1.930 1.00 0.00 N ATOM 676 CA THR A 48 -12.276 -14.235 -1.179 1.00 0.00 C ATOM 677 C THR A 48 -11.997 -14.210 0.320 1.00 0.00 C ATOM 678 O THR A 48 -11.340 -15.105 0.851 1.00 0.00 O ATOM 679 CB THR A 48 -13.207 -15.400 -1.506 1.00 0.00 C ATOM 680 OG1 THR A 48 -13.248 -15.593 -2.913 1.00 0.00 O ATOM 681 CG2 THR A 48 -14.613 -15.094 -0.986 1.00 0.00 C ATOM 0 H THR A 48 -10.542 -15.248 -1.788 1.00 0.00 H new ATOM 0 HA THR A 48 -12.754 -13.298 -1.464 1.00 0.00 H new ATOM 0 HB THR A 48 -12.836 -16.307 -1.028 1.00 0.00 H new ATOM 0 HG1 THR A 48 -13.844 -16.342 -3.123 1.00 0.00 H new ATOM 0 HG21 THR A 48 -15.277 -15.926 -1.220 1.00 0.00 H new ATOM 0 HG22 THR A 48 -14.578 -14.950 0.094 1.00 0.00 H new ATOM 0 HG23 THR A 48 -14.987 -14.187 -1.461 1.00 0.00 H new ATOM 689 N VAL A 49 -12.506 -13.181 0.993 1.00 0.00 N ATOM 690 CA VAL A 49 -12.315 -13.043 2.432 1.00 0.00 C ATOM 691 C VAL A 49 -13.667 -12.947 3.126 1.00 0.00 C ATOM 692 O VAL A 49 -14.556 -12.232 2.667 1.00 0.00 O ATOM 693 CB VAL A 49 -11.487 -11.792 2.733 1.00 0.00 C ATOM 694 CG1 VAL A 49 -12.202 -10.559 2.177 1.00 0.00 C ATOM 695 CG2 VAL A 49 -11.317 -11.643 4.247 1.00 0.00 C ATOM 0 H VAL A 49 -13.052 -12.433 0.565 1.00 0.00 H new ATOM 0 HA VAL A 49 -11.783 -13.918 2.804 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.507 -11.886 2.265 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -11.612 -9.668 2.392 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -12.322 -10.663 1.099 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -13.183 -10.466 2.644 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -10.727 -10.752 4.461 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -12.297 -11.551 4.716 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -10.806 -12.520 4.644 1.00 0.00 H new ATOM 705 N ASN A 50 -13.822 -13.680 4.222 1.00 0.00 N ATOM 706 CA ASN A 50 -15.082 -13.675 4.953 1.00 0.00 C ATOM 707 C ASN A 50 -16.197 -14.220 4.066 1.00 0.00 C ATOM 708 O ASN A 50 -17.366 -14.235 4.453 1.00 0.00 O ATOM 709 CB ASN A 50 -15.431 -12.253 5.401 1.00 0.00 C ATOM 710 CG ASN A 50 -14.185 -11.552 5.930 1.00 0.00 C ATOM 711 OD1 ASN A 50 -13.289 -12.241 6.583 1.00 0.00 O flip ATOM 712 ND2 ASN A 50 -14.024 -10.346 5.745 1.00 0.00 N flip ATOM 0 H ASN A 50 -13.099 -14.279 4.620 1.00 0.00 H new ATOM 0 HA ASN A 50 -14.977 -14.308 5.834 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -15.847 -11.691 4.565 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -16.197 -12.285 6.176 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -14.726 -9.810 5.234 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -13.189 -9.882 6.102 1.00 0.00 H new ATOM 719 N GLY A 51 -15.820 -14.662 2.868 1.00 0.00 N ATOM 720 CA GLY A 51 -16.785 -15.203 1.917 1.00 0.00 C ATOM 721 C GLY A 51 -17.099 -14.181 0.834 1.00 0.00 C ATOM 722 O GLY A 51 -17.683 -14.512 -0.198 1.00 0.00 O ATOM 0 H GLY A 51 -14.856 -14.656 2.535 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -16.387 -16.111 1.464 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.701 -15.482 2.438 1.00 0.00 H new ATOM 726 N GLN A 52 -16.692 -12.941 1.073 1.00 0.00 N ATOM 727 CA GLN A 52 -16.917 -11.874 0.108 1.00 0.00 C ATOM 728 C GLN A 52 -15.730 -11.794 -0.842 1.00 0.00 C ATOM 729 O GLN A 52 -14.582 -11.955 -0.426 1.00 0.00 O ATOM 730 CB GLN A 52 -17.103 -10.544 0.840 1.00 0.00 C ATOM 731 CG GLN A 52 -17.104 -9.380 -0.158 1.00 0.00 C ATOM 732 CD GLN A 52 -18.085 -9.658 -1.293 1.00 0.00 C ATOM 733 OE1 GLN A 52 -17.706 -9.479 -2.529 1.00 0.00 O flip ATOM 734 NE2 GLN A 52 -19.225 -10.049 -1.048 1.00 0.00 N flip ATOM 0 H GLN A 52 -16.207 -12.651 1.922 1.00 0.00 H new ATOM 0 HA GLN A 52 -17.819 -12.084 -0.466 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -18.041 -10.556 1.396 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -16.303 -10.407 1.567 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -17.378 -8.456 0.351 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -16.102 -9.237 -0.561 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -19.520 -10.188 -0.081 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -19.876 -10.234 -1.811 1.00 0.00 H new ATOM 743 N GLU A 53 -16.004 -11.562 -2.118 1.00 0.00 N ATOM 744 CA GLU A 53 -14.947 -11.486 -3.104 1.00 0.00 C ATOM 745 C GLU A 53 -14.218 -10.153 -3.031 1.00 0.00 C ATOM 746 O GLU A 53 -14.803 -9.115 -2.716 1.00 0.00 O ATOM 747 CB GLU A 53 -15.535 -11.675 -4.487 1.00 0.00 C ATOM 748 CG GLU A 53 -15.077 -13.014 -5.057 1.00 0.00 C ATOM 749 CD GLU A 53 -15.698 -13.238 -6.432 1.00 0.00 C ATOM 750 OE1 GLU A 53 -15.486 -12.405 -7.299 1.00 0.00 O ATOM 751 OE2 GLU A 53 -16.378 -14.238 -6.597 1.00 0.00 O ATOM 0 H GLU A 53 -16.944 -11.425 -2.488 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.225 -12.276 -2.896 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -16.623 -11.642 -4.438 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -15.220 -10.862 -5.142 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.990 -13.033 -5.133 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -15.364 -13.822 -4.384 1.00 0.00 H new ATOM 758 N TYR A 54 -12.934 -10.207 -3.332 1.00 0.00 N ATOM 759 CA TYR A 54 -12.087 -9.021 -3.312 1.00 0.00 C ATOM 760 C TYR A 54 -11.129 -9.047 -4.498 1.00 0.00 C ATOM 761 O TYR A 54 -10.365 -9.998 -4.664 1.00 0.00 O ATOM 762 CB TYR A 54 -11.274 -8.971 -2.017 1.00 0.00 C ATOM 763 CG TYR A 54 -12.059 -8.262 -0.941 1.00 0.00 C ATOM 764 CD1 TYR A 54 -13.105 -8.924 -0.304 1.00 0.00 C ATOM 765 CD2 TYR A 54 -11.734 -6.948 -0.577 1.00 0.00 C ATOM 766 CE1 TYR A 54 -13.837 -8.279 0.701 1.00 0.00 C ATOM 767 CE2 TYR A 54 -12.464 -6.301 0.427 1.00 0.00 C ATOM 768 CZ TYR A 54 -13.517 -6.966 1.066 1.00 0.00 C ATOM 769 OH TYR A 54 -14.237 -6.329 2.057 1.00 0.00 O ATOM 0 H TYR A 54 -12.449 -11.065 -3.596 1.00 0.00 H new ATOM 0 HA TYR A 54 -12.726 -8.140 -3.373 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -11.029 -9.982 -1.693 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -10.330 -8.454 -2.190 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -13.353 -9.937 -0.585 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -10.921 -6.435 -1.070 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -14.648 -8.794 1.194 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -12.215 -5.289 0.709 1.00 0.00 H new ATOM 0 HH TYR A 54 -13.629 -6.045 2.771 1.00 0.00 H new ATOM 779 N HIS A 55 -11.176 -8.005 -5.316 1.00 0.00 N ATOM 780 CA HIS A 55 -10.315 -7.915 -6.485 1.00 0.00 C ATOM 781 C HIS A 55 -9.394 -6.712 -6.353 1.00 0.00 C ATOM 782 O HIS A 55 -9.862 -5.572 -6.361 1.00 0.00 O ATOM 783 CB HIS A 55 -11.183 -7.746 -7.730 1.00 0.00 C ATOM 784 CG HIS A 55 -11.901 -9.033 -8.033 1.00 0.00 C ATOM 785 ND1 HIS A 55 -12.002 -10.061 -7.108 1.00 0.00 N ATOM 786 CD2 HIS A 55 -12.575 -9.467 -9.148 1.00 0.00 C ATOM 787 CE1 HIS A 55 -12.714 -11.051 -7.675 1.00 0.00 C ATOM 788 NE2 HIS A 55 -13.089 -10.740 -8.919 1.00 0.00 N ATOM 0 H HIS A 55 -11.802 -7.210 -5.191 1.00 0.00 H new ATOM 0 HA HIS A 55 -9.716 -8.822 -6.566 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -11.905 -6.945 -7.574 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -10.564 -7.456 -8.579 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -12.689 -8.906 -10.064 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -12.953 -11.983 -7.185 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -13.635 -11.313 -9.563 1.00 0.00 H new ATOM 797 N LEU A 56 -8.088 -6.963 -6.227 1.00 0.00 N ATOM 798 CA LEU A 56 -7.129 -5.870 -6.083 1.00 0.00 C ATOM 799 C LEU A 56 -6.118 -5.842 -7.217 1.00 0.00 C ATOM 800 O LEU A 56 -5.698 -6.877 -7.733 1.00 0.00 O ATOM 801 CB LEU A 56 -6.374 -5.977 -4.762 1.00 0.00 C ATOM 802 CG LEU A 56 -7.153 -5.272 -3.649 1.00 0.00 C ATOM 803 CD1 LEU A 56 -8.532 -5.905 -3.510 1.00 0.00 C ATOM 804 CD2 LEU A 56 -6.394 -5.412 -2.327 1.00 0.00 C ATOM 0 H LEU A 56 -7.678 -7.897 -6.222 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.710 -4.948 -6.107 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.225 -7.025 -4.504 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -5.385 -5.530 -4.863 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.262 -4.216 -3.897 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.085 -5.402 -2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -9.074 -5.806 -4.450 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.424 -6.961 -3.263 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.949 -4.910 -1.534 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.284 -6.468 -2.080 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.408 -4.958 -2.424 1.00 0.00 H new ATOM 816 N GLN A 57 -5.726 -4.629 -7.570 1.00 0.00 N ATOM 817 CA GLN A 57 -4.742 -4.399 -8.628 1.00 0.00 C ATOM 818 C GLN A 57 -3.784 -3.286 -8.218 1.00 0.00 C ATOM 819 O GLN A 57 -4.218 -2.193 -7.888 1.00 0.00 O ATOM 820 CB GLN A 57 -5.451 -4.026 -9.930 1.00 0.00 C ATOM 821 CG GLN A 57 -4.484 -3.277 -10.844 1.00 0.00 C ATOM 822 CD GLN A 57 -4.968 -3.350 -12.288 1.00 0.00 C ATOM 823 OE1 GLN A 57 -5.376 -4.414 -12.753 1.00 0.00 O ATOM 824 NE2 GLN A 57 -4.945 -2.277 -13.030 1.00 0.00 N ATOM 0 H GLN A 57 -6.076 -3.775 -7.136 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.172 -5.315 -8.785 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -5.815 -4.925 -10.428 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -6.321 -3.405 -9.717 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -4.407 -2.236 -10.530 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -3.487 -3.709 -10.764 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -4.606 -1.396 -12.643 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -5.266 -2.319 -13.997 1.00 0.00 H new ATOM 833 N LEU A 58 -2.480 -3.565 -8.219 1.00 0.00 N ATOM 834 CA LEU A 58 -1.516 -2.563 -7.803 1.00 0.00 C ATOM 835 C LEU A 58 -0.579 -2.170 -8.914 1.00 0.00 C ATOM 836 O LEU A 58 -0.347 -2.931 -9.854 1.00 0.00 O ATOM 837 CB LEU A 58 -0.694 -3.044 -6.602 1.00 0.00 C ATOM 838 CG LEU A 58 -1.419 -4.151 -5.843 1.00 0.00 C ATOM 839 CD1 LEU A 58 -2.807 -3.676 -5.418 1.00 0.00 C ATOM 840 CD2 LEU A 58 -1.519 -5.433 -6.682 1.00 0.00 C ATOM 0 H LEU A 58 -2.079 -4.460 -8.498 1.00 0.00 H new ATOM 0 HA LEU A 58 -2.099 -1.687 -7.519 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.275 -3.409 -6.944 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.501 -2.206 -5.932 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.838 -4.386 -4.951 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.315 -4.474 -4.877 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.711 -2.804 -4.771 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -3.387 -3.410 -6.302 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.041 -6.201 -6.112 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.070 -5.225 -7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.518 -5.784 -6.931 1.00 0.00 H new ATOM 852 N VAL A 59 -0.048 -0.955 -8.796 1.00 0.00 N ATOM 853 CA VAL A 59 0.868 -0.449 -9.812 1.00 0.00 C ATOM 854 C VAL A 59 2.102 0.193 -9.220 1.00 0.00 C ATOM 855 O VAL A 59 2.056 0.869 -8.198 1.00 0.00 O ATOM 856 CB VAL A 59 0.164 0.581 -10.717 1.00 0.00 C ATOM 857 CG1 VAL A 59 0.454 2.015 -10.240 1.00 0.00 C ATOM 858 CG2 VAL A 59 0.670 0.448 -12.167 1.00 0.00 C ATOM 0 H VAL A 59 -0.232 -0.315 -8.023 1.00 0.00 H new ATOM 0 HA VAL A 59 1.180 -1.316 -10.394 1.00 0.00 H new ATOM 0 HB VAL A 59 -0.907 0.386 -10.669 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.053 2.725 -10.893 1.00 0.00 H new ATOM 0 HG12 VAL A 59 0.092 2.139 -9.219 1.00 0.00 H new ATOM 0 HG13 VAL A 59 1.528 2.198 -10.269 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.166 1.181 -12.797 1.00 0.00 H new ATOM 0 HG22 VAL A 59 1.745 0.625 -12.195 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.457 -0.555 -12.536 1.00 0.00 H new ATOM 868 N ASP A 60 3.200 -0.003 -9.921 1.00 0.00 N ATOM 869 CA ASP A 60 4.468 0.581 -9.532 1.00 0.00 C ATOM 870 C ASP A 60 5.031 1.353 -10.706 1.00 0.00 C ATOM 871 O ASP A 60 5.520 0.752 -11.662 1.00 0.00 O ATOM 872 CB ASP A 60 5.448 -0.513 -9.101 1.00 0.00 C ATOM 873 CG ASP A 60 6.859 -0.164 -9.562 1.00 0.00 C ATOM 874 OD1 ASP A 60 7.271 0.963 -9.342 1.00 0.00 O ATOM 875 OD2 ASP A 60 7.507 -1.028 -10.126 1.00 0.00 O ATOM 0 H ASP A 60 3.240 -0.567 -10.770 1.00 0.00 H new ATOM 0 HA ASP A 60 4.316 1.254 -8.688 1.00 0.00 H new ATOM 0 HB2 ASP A 60 5.428 -0.623 -8.017 1.00 0.00 H new ATOM 0 HB3 ASP A 60 5.145 -1.471 -9.524 1.00 0.00 H new ATOM 880 N THR A 61 4.943 2.681 -10.650 1.00 0.00 N ATOM 881 CA THR A 61 5.442 3.500 -11.737 1.00 0.00 C ATOM 882 C THR A 61 6.620 4.336 -11.275 1.00 0.00 C ATOM 883 O THR A 61 6.883 4.459 -10.078 1.00 0.00 O ATOM 884 CB THR A 61 4.335 4.408 -12.238 1.00 0.00 C ATOM 885 OG1 THR A 61 3.152 4.123 -11.507 1.00 0.00 O ATOM 886 CG2 THR A 61 4.096 4.158 -13.728 1.00 0.00 C ATOM 0 H THR A 61 4.536 3.201 -9.872 1.00 0.00 H new ATOM 0 HA THR A 61 5.774 2.848 -12.545 1.00 0.00 H new ATOM 0 HB THR A 61 4.617 5.452 -12.098 1.00 0.00 H new ATOM 0 HG1 THR A 61 2.427 4.704 -11.819 1.00 0.00 H new ATOM 0 HG21 THR A 61 3.300 4.812 -14.084 1.00 0.00 H new ATOM 0 HG22 THR A 61 5.011 4.365 -14.283 1.00 0.00 H new ATOM 0 HG23 THR A 61 3.806 3.118 -13.881 1.00 0.00 H new ATOM 1134 N ILE A 78 -7.762 4.666 -9.380 1.00 0.00 N ATOM 1135 CA ILE A 78 -7.663 3.654 -8.362 1.00 0.00 C ATOM 1136 C ILE A 78 -8.553 3.932 -7.169 1.00 0.00 C ATOM 1137 O ILE A 78 -9.360 4.861 -7.175 1.00 0.00 O ATOM 1138 CB ILE A 78 -6.236 3.618 -7.923 1.00 0.00 C ATOM 1139 CG1 ILE A 78 -5.828 4.955 -7.314 1.00 0.00 C ATOM 1140 CG2 ILE A 78 -5.349 3.323 -9.133 1.00 0.00 C ATOM 1141 CD1 ILE A 78 -4.415 4.803 -6.817 1.00 0.00 C ATOM 0 HA ILE A 78 -7.993 2.701 -8.775 1.00 0.00 H new ATOM 0 HB ILE A 78 -6.117 2.840 -7.169 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.892 5.751 -8.056 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.497 5.226 -6.497 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -4.305 3.295 -8.821 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.626 2.359 -9.561 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.483 4.104 -9.881 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -4.083 5.741 -6.372 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.376 4.012 -6.068 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -3.762 4.546 -7.651 1.00 0.00 H new ATOM 1153 N ASN A 79 -8.384 3.116 -6.136 1.00 0.00 N ATOM 1154 CA ASN A 79 -9.165 3.278 -4.921 1.00 0.00 C ATOM 1155 C ASN A 79 -8.340 2.817 -3.734 1.00 0.00 C ATOM 1156 O ASN A 79 -8.869 2.559 -2.655 1.00 0.00 O ATOM 1157 CB ASN A 79 -10.459 2.464 -5.011 1.00 0.00 C ATOM 1158 CG ASN A 79 -11.645 3.392 -5.251 1.00 0.00 C ATOM 1159 OD1 ASN A 79 -12.713 3.198 -4.670 1.00 0.00 O ATOM 1160 ND2 ASN A 79 -11.523 4.392 -6.080 1.00 0.00 N ATOM 0 H ASN A 79 -7.719 2.343 -6.116 1.00 0.00 H new ATOM 0 HA ASN A 79 -9.427 4.329 -4.796 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -10.386 1.738 -5.821 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -10.608 1.901 -4.090 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -12.313 5.015 -6.248 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -10.637 4.551 -6.560 1.00 0.00 H new ATOM 1167 N GLY A 80 -7.038 2.698 -3.953 1.00 0.00 N ATOM 1168 CA GLY A 80 -6.140 2.240 -2.903 1.00 0.00 C ATOM 1169 C GLY A 80 -4.758 2.856 -3.004 1.00 0.00 C ATOM 1170 O GLY A 80 -4.379 3.425 -4.027 1.00 0.00 O ATOM 0 H GLY A 80 -6.583 2.910 -4.841 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -6.571 2.482 -1.931 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.054 1.155 -2.952 1.00 0.00 H new ATOM 1174 N TYR A 81 -4.001 2.696 -1.930 1.00 0.00 N ATOM 1175 CA TYR A 81 -2.636 3.192 -1.878 1.00 0.00 C ATOM 1176 C TYR A 81 -1.774 2.359 -0.932 1.00 0.00 C ATOM 1177 O TYR A 81 -2.088 2.238 0.253 1.00 0.00 O ATOM 1178 CB TYR A 81 -2.613 4.651 -1.432 1.00 0.00 C ATOM 1179 CG TYR A 81 -1.847 5.487 -2.434 1.00 0.00 C ATOM 1180 CD1 TYR A 81 -0.578 5.082 -2.868 1.00 0.00 C ATOM 1181 CD2 TYR A 81 -2.399 6.678 -2.915 1.00 0.00 C ATOM 1182 CE1 TYR A 81 0.134 5.862 -3.773 1.00 0.00 C ATOM 1183 CE2 TYR A 81 -1.686 7.457 -3.831 1.00 0.00 C ATOM 1184 CZ TYR A 81 -0.417 7.050 -4.261 1.00 0.00 C ATOM 1185 OH TYR A 81 0.288 7.824 -5.159 1.00 0.00 O ATOM 0 H TYR A 81 -4.311 2.225 -1.080 1.00 0.00 H new ATOM 0 HA TYR A 81 -2.223 3.112 -2.884 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -3.632 5.027 -1.336 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.150 4.732 -0.449 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.151 4.161 -2.499 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -3.375 6.996 -2.579 1.00 0.00 H new ATOM 0 HE1 TYR A 81 1.115 5.549 -4.099 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -2.115 8.374 -4.208 1.00 0.00 H new ATOM 0 HH TYR A 81 -0.241 8.614 -5.396 1.00 0.00 H new ATOM 1195 N ILE A 82 -0.684 1.814 -1.447 1.00 0.00 N ATOM 1196 CA ILE A 82 0.232 1.024 -0.631 1.00 0.00 C ATOM 1197 C ILE A 82 1.645 1.574 -0.794 1.00 0.00 C ATOM 1198 O ILE A 82 2.298 1.378 -1.814 1.00 0.00 O ATOM 1199 CB ILE A 82 0.181 -0.436 -1.059 1.00 0.00 C ATOM 1200 CG1 ILE A 82 1.230 -1.244 -0.297 1.00 0.00 C ATOM 1201 CG2 ILE A 82 0.468 -0.512 -2.548 1.00 0.00 C ATOM 1202 CD1 ILE A 82 1.024 -2.724 -0.600 1.00 0.00 C ATOM 0 H ILE A 82 -0.409 1.902 -2.425 1.00 0.00 H new ATOM 0 HA ILE A 82 -0.061 1.087 0.417 1.00 0.00 H new ATOM 0 HB ILE A 82 -0.804 -0.848 -0.841 1.00 0.00 H new ATOM 0 HG12 ILE A 82 2.233 -0.934 -0.592 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.142 -1.062 0.774 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.435 -1.552 -2.872 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.282 0.061 -3.093 1.00 0.00 H new ATOM 0 HG23 ILE A 82 1.457 -0.100 -2.749 1.00 0.00 H new ATOM 0 HD11 ILE A 82 1.767 -3.312 -0.062 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.025 -3.024 -0.284 1.00 0.00 H new ATOM 0 HD13 ILE A 82 1.132 -2.895 -1.671 1.00 0.00 H new ATOM 1214 N LEU A 83 2.111 2.288 0.203 1.00 0.00 N ATOM 1215 CA LEU A 83 3.430 2.879 0.117 1.00 0.00 C ATOM 1216 C LEU A 83 4.477 2.026 0.815 1.00 0.00 C ATOM 1217 O LEU A 83 4.367 1.728 2.005 1.00 0.00 O ATOM 1218 CB LEU A 83 3.398 4.276 0.723 1.00 0.00 C ATOM 1219 CG LEU A 83 1.981 4.861 0.596 1.00 0.00 C ATOM 1220 CD1 LEU A 83 1.073 4.344 1.721 1.00 0.00 C ATOM 1221 CD2 LEU A 83 2.043 6.389 0.678 1.00 0.00 C ATOM 0 H LEU A 83 1.608 2.473 1.071 1.00 0.00 H new ATOM 0 HA LEU A 83 3.709 2.939 -0.935 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.693 4.235 1.772 1.00 0.00 H new ATOM 0 HB3 LEU A 83 4.115 4.920 0.215 1.00 0.00 H new ATOM 0 HG LEU A 83 1.571 4.550 -0.365 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.077 4.772 1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.010 3.257 1.667 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.487 4.636 2.686 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.037 6.799 0.588 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.471 6.685 1.636 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.665 6.772 -0.131 1.00 0.00 H new ATOM 1233 N VAL A 84 5.503 1.647 0.055 1.00 0.00 N ATOM 1234 CA VAL A 84 6.585 0.838 0.596 1.00 0.00 C ATOM 1235 C VAL A 84 7.744 1.743 0.998 1.00 0.00 C ATOM 1236 O VAL A 84 8.324 2.432 0.160 1.00 0.00 O ATOM 1237 CB VAL A 84 7.056 -0.197 -0.442 1.00 0.00 C ATOM 1238 CG1 VAL A 84 8.569 -0.427 -0.325 1.00 0.00 C ATOM 1239 CG2 VAL A 84 6.337 -1.527 -0.198 1.00 0.00 C ATOM 0 H VAL A 84 5.605 1.887 -0.931 1.00 0.00 H new ATOM 0 HA VAL A 84 6.223 0.302 1.474 1.00 0.00 H new ATOM 0 HB VAL A 84 6.826 0.182 -1.438 1.00 0.00 H new ATOM 0 HG11 VAL A 84 8.884 -1.161 -1.066 1.00 0.00 H new ATOM 0 HG12 VAL A 84 9.094 0.512 -0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.805 -0.795 0.673 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.670 -2.261 -0.932 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.568 -1.887 0.805 1.00 0.00 H new ATOM 0 HG23 VAL A 84 5.261 -1.382 -0.292 1.00 0.00 H new ATOM 1249 N TYR A 85 8.069 1.735 2.287 1.00 0.00 N ATOM 1250 CA TYR A 85 9.157 2.557 2.801 1.00 0.00 C ATOM 1251 C TYR A 85 10.225 1.688 3.445 1.00 0.00 C ATOM 1252 O TYR A 85 9.923 0.665 4.058 1.00 0.00 O ATOM 1253 CB TYR A 85 8.624 3.573 3.814 1.00 0.00 C ATOM 1254 CG TYR A 85 8.058 2.866 5.021 1.00 0.00 C ATOM 1255 CD1 TYR A 85 8.915 2.369 6.010 1.00 0.00 C ATOM 1256 CD2 TYR A 85 6.672 2.721 5.158 1.00 0.00 C ATOM 1257 CE1 TYR A 85 8.385 1.727 7.135 1.00 0.00 C ATOM 1258 CE2 TYR A 85 6.144 2.081 6.284 1.00 0.00 C ATOM 1259 CZ TYR A 85 7.001 1.584 7.273 1.00 0.00 C ATOM 1260 OH TYR A 85 6.480 0.953 8.383 1.00 0.00 O ATOM 0 H TYR A 85 7.596 1.170 2.992 1.00 0.00 H new ATOM 0 HA TYR A 85 9.604 3.095 1.965 1.00 0.00 H new ATOM 0 HB2 TYR A 85 9.426 4.245 4.121 1.00 0.00 H new ATOM 0 HB3 TYR A 85 7.853 4.188 3.350 1.00 0.00 H new ATOM 0 HD1 TYR A 85 9.984 2.481 5.905 1.00 0.00 H new ATOM 0 HD2 TYR A 85 6.011 3.103 4.394 1.00 0.00 H new ATOM 0 HE1 TYR A 85 9.046 1.342 7.897 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.075 1.970 6.390 1.00 0.00 H new ATOM 0 HH TYR A 85 6.593 1.527 9.169 1.00 0.00 H new ATOM 1270 N SER A 86 11.476 2.100 3.293 1.00 0.00 N ATOM 1271 CA SER A 86 12.590 1.349 3.855 1.00 0.00 C ATOM 1272 C SER A 86 12.863 1.791 5.286 1.00 0.00 C ATOM 1273 O SER A 86 12.768 2.975 5.607 1.00 0.00 O ATOM 1274 CB SER A 86 13.841 1.588 3.018 1.00 0.00 C ATOM 1275 OG SER A 86 14.509 2.735 3.517 1.00 0.00 O ATOM 0 H SER A 86 11.744 2.945 2.788 1.00 0.00 H new ATOM 0 HA SER A 86 12.331 0.290 3.850 1.00 0.00 H new ATOM 0 HB2 SER A 86 14.497 0.719 3.063 1.00 0.00 H new ATOM 0 HB3 SER A 86 13.574 1.732 1.971 1.00 0.00 H new ATOM 0 HG SER A 86 13.852 3.361 3.887 1.00 0.00 H new ATOM 1281 N VAL A 87 13.208 0.837 6.143 1.00 0.00 N ATOM 1282 CA VAL A 87 13.495 1.151 7.530 1.00 0.00 C ATOM 1283 C VAL A 87 14.877 1.793 7.652 1.00 0.00 C ATOM 1284 O VAL A 87 15.471 1.800 8.729 1.00 0.00 O ATOM 1285 CB VAL A 87 13.462 -0.124 8.359 1.00 0.00 C ATOM 1286 CG1 VAL A 87 12.132 -0.840 8.163 1.00 0.00 C ATOM 1287 CG2 VAL A 87 14.594 -1.040 7.906 1.00 0.00 C ATOM 0 H VAL A 87 13.294 -0.150 5.901 1.00 0.00 H new ATOM 0 HA VAL A 87 12.742 1.849 7.895 1.00 0.00 H new ATOM 0 HB VAL A 87 13.581 0.128 9.413 1.00 0.00 H new ATOM 0 HG11 VAL A 87 12.118 -1.752 8.760 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.318 -0.187 8.478 1.00 0.00 H new ATOM 0 HG13 VAL A 87 12.007 -1.094 7.110 1.00 0.00 H new ATOM 0 HG21 VAL A 87 14.578 -1.957 8.495 1.00 0.00 H new ATOM 0 HG22 VAL A 87 14.465 -1.284 6.852 1.00 0.00 H new ATOM 0 HG23 VAL A 87 15.549 -0.535 8.047 1.00 0.00 H new ATOM 1297 N THR A 88 15.394 2.302 6.534 1.00 0.00 N ATOM 1298 CA THR A 88 16.723 2.907 6.527 1.00 0.00 C ATOM 1299 C THR A 88 16.729 4.245 5.806 1.00 0.00 C ATOM 1300 O THR A 88 17.626 5.066 5.998 1.00 0.00 O ATOM 1301 CB THR A 88 17.693 1.967 5.807 1.00 0.00 C ATOM 1302 OG1 THR A 88 18.993 2.120 6.359 1.00 0.00 O ATOM 1303 CG2 THR A 88 17.734 2.299 4.305 1.00 0.00 C ATOM 0 H THR A 88 14.918 2.307 5.632 1.00 0.00 H new ATOM 0 HA THR A 88 17.023 3.070 7.562 1.00 0.00 H new ATOM 0 HB THR A 88 17.355 0.939 5.935 1.00 0.00 H new ATOM 0 HG1 THR A 88 19.043 2.968 6.847 1.00 0.00 H new ATOM 0 HG21 THR A 88 18.427 1.625 3.802 1.00 0.00 H new ATOM 0 HG22 THR A 88 16.738 2.180 3.879 1.00 0.00 H new ATOM 0 HG23 THR A 88 18.066 3.328 4.169 1.00 0.00 H new ATOM 1311 N SER A 89 15.758 4.424 4.926 1.00 0.00 N ATOM 1312 CA SER A 89 15.695 5.618 4.124 1.00 0.00 C ATOM 1313 C SER A 89 14.819 6.674 4.752 1.00 0.00 C ATOM 1314 O SER A 89 13.615 6.729 4.495 1.00 0.00 O ATOM 1315 CB SER A 89 15.150 5.267 2.741 1.00 0.00 C ATOM 1316 OG SER A 89 15.231 6.408 1.898 1.00 0.00 O ATOM 0 H SER A 89 15.007 3.755 4.755 1.00 0.00 H new ATOM 0 HA SER A 89 16.704 6.024 4.047 1.00 0.00 H new ATOM 0 HB2 SER A 89 15.720 4.443 2.312 1.00 0.00 H new ATOM 0 HB3 SER A 89 14.116 4.932 2.820 1.00 0.00 H new ATOM 0 HG SER A 89 14.883 6.184 1.010 1.00 0.00 H new ATOM 1322 N ILE A 90 15.436 7.564 5.517 1.00 0.00 N ATOM 1323 CA ILE A 90 14.686 8.658 6.089 1.00 0.00 C ATOM 1324 C ILE A 90 14.106 9.423 4.913 1.00 0.00 C ATOM 1325 O ILE A 90 13.224 10.268 5.056 1.00 0.00 O ATOM 1326 CB ILE A 90 15.605 9.558 6.925 1.00 0.00 C ATOM 1327 CG1 ILE A 90 14.855 10.817 7.376 1.00 0.00 C ATOM 1328 CG2 ILE A 90 16.813 9.971 6.083 1.00 0.00 C ATOM 1329 CD1 ILE A 90 13.562 10.425 8.097 1.00 0.00 C ATOM 0 H ILE A 90 16.429 7.548 5.748 1.00 0.00 H new ATOM 0 HA ILE A 90 13.901 8.303 6.756 1.00 0.00 H new ATOM 0 HB ILE A 90 15.932 9.004 7.805 1.00 0.00 H new ATOM 0 HG12 ILE A 90 15.486 11.409 8.039 1.00 0.00 H new ATOM 0 HG13 ILE A 90 14.625 11.442 6.513 1.00 0.00 H new ATOM 0 HG21 ILE A 90 17.468 10.611 6.675 1.00 0.00 H new ATOM 0 HG22 ILE A 90 17.360 9.081 5.771 1.00 0.00 H new ATOM 0 HG23 ILE A 90 16.473 10.516 5.202 1.00 0.00 H new ATOM 0 HD11 ILE A 90 13.035 11.325 8.414 1.00 0.00 H new ATOM 0 HD12 ILE A 90 12.927 9.852 7.421 1.00 0.00 H new ATOM 0 HD13 ILE A 90 13.802 9.818 8.970 1.00 0.00 H new ATOM 1341 N LYS A 91 14.620 9.067 3.731 1.00 0.00 N ATOM 1342 CA LYS A 91 14.175 9.666 2.486 1.00 0.00 C ATOM 1343 C LYS A 91 12.842 9.064 2.051 1.00 0.00 C ATOM 1344 O LYS A 91 11.895 9.795 1.764 1.00 0.00 O ATOM 1345 CB LYS A 91 15.215 9.453 1.394 1.00 0.00 C ATOM 1346 CG LYS A 91 16.588 9.189 2.021 1.00 0.00 C ATOM 1347 CD LYS A 91 17.663 9.232 0.933 1.00 0.00 C ATOM 1348 CE LYS A 91 19.005 8.794 1.523 1.00 0.00 C ATOM 1349 NZ LYS A 91 18.881 7.412 2.067 1.00 0.00 N ATOM 0 H LYS A 91 15.349 8.362 3.619 1.00 0.00 H new ATOM 0 HA LYS A 91 14.044 10.736 2.649 1.00 0.00 H new ATOM 0 HB2 LYS A 91 14.926 8.611 0.764 1.00 0.00 H new ATOM 0 HB3 LYS A 91 15.263 10.331 0.750 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.800 9.936 2.786 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.593 8.217 2.514 1.00 0.00 H new ATOM 0 HD2 LYS A 91 17.386 8.577 0.107 1.00 0.00 H new ATOM 0 HD3 LYS A 91 17.744 10.240 0.527 1.00 0.00 H new ATOM 0 HE2 LYS A 91 19.779 8.827 0.757 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.309 9.481 2.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 19.749 6.878 1.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 18.739 7.456 3.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 18.068 6.937 1.625 1.00 0.00 H new ATOM 1363 N SER A 92 12.764 7.729 2.004 1.00 0.00 N ATOM 1364 CA SER A 92 11.518 7.084 1.598 1.00 0.00 C ATOM 1365 C SER A 92 10.366 7.540 2.494 1.00 0.00 C ATOM 1366 O SER A 92 9.227 7.676 2.044 1.00 0.00 O ATOM 1367 CB SER A 92 11.660 5.562 1.677 1.00 0.00 C ATOM 1368 OG SER A 92 11.754 5.164 3.038 1.00 0.00 O ATOM 0 H SER A 92 13.527 7.093 2.235 1.00 0.00 H new ATOM 0 HA SER A 92 11.302 7.370 0.569 1.00 0.00 H new ATOM 0 HB2 SER A 92 10.803 5.081 1.205 1.00 0.00 H new ATOM 0 HB3 SER A 92 12.547 5.240 1.131 1.00 0.00 H new ATOM 0 HG SER A 92 12.321 5.797 3.526 1.00 0.00 H new ATOM 1374 N PHE A 93 10.676 7.765 3.764 1.00 0.00 N ATOM 1375 CA PHE A 93 9.673 8.190 4.737 1.00 0.00 C ATOM 1376 C PHE A 93 9.207 9.628 4.504 1.00 0.00 C ATOM 1377 O PHE A 93 8.007 9.893 4.391 1.00 0.00 O ATOM 1378 CB PHE A 93 10.257 8.072 6.141 1.00 0.00 C ATOM 1379 CG PHE A 93 9.568 6.940 6.848 1.00 0.00 C ATOM 1380 CD1 PHE A 93 8.252 7.100 7.283 1.00 0.00 C ATOM 1381 CD2 PHE A 93 10.237 5.729 7.056 1.00 0.00 C ATOM 1382 CE1 PHE A 93 7.595 6.046 7.929 1.00 0.00 C ATOM 1383 CE2 PHE A 93 9.585 4.676 7.702 1.00 0.00 C ATOM 1384 CZ PHE A 93 8.263 4.833 8.139 1.00 0.00 C ATOM 0 H PHE A 93 11.616 7.661 4.147 1.00 0.00 H new ATOM 0 HA PHE A 93 8.805 7.541 4.621 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.331 7.890 6.091 1.00 0.00 H new ATOM 0 HB3 PHE A 93 10.116 9.003 6.690 1.00 0.00 H new ATOM 0 HD1 PHE A 93 7.740 8.037 7.121 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.256 5.609 6.718 1.00 0.00 H new ATOM 0 HE1 PHE A 93 6.576 6.168 8.265 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.100 3.741 7.865 1.00 0.00 H new ATOM 0 HZ PHE A 93 7.759 4.018 8.638 1.00 0.00 H new ATOM 1394 N GLU A 94 10.155 10.553 4.464 1.00 0.00 N ATOM 1395 CA GLU A 94 9.834 11.968 4.285 1.00 0.00 C ATOM 1396 C GLU A 94 9.165 12.241 2.938 1.00 0.00 C ATOM 1397 O GLU A 94 8.183 12.984 2.867 1.00 0.00 O ATOM 1398 CB GLU A 94 11.112 12.801 4.393 1.00 0.00 C ATOM 1399 CG GLU A 94 11.278 13.302 5.829 1.00 0.00 C ATOM 1400 CD GLU A 94 12.708 13.778 6.054 1.00 0.00 C ATOM 1401 OE1 GLU A 94 13.452 13.829 5.088 1.00 0.00 O ATOM 1402 OE2 GLU A 94 13.039 14.087 7.187 1.00 0.00 O ATOM 0 H GLU A 94 11.151 10.353 4.553 1.00 0.00 H new ATOM 0 HA GLU A 94 9.130 12.247 5.069 1.00 0.00 H new ATOM 0 HB2 GLU A 94 11.975 12.201 4.104 1.00 0.00 H new ATOM 0 HB3 GLU A 94 11.067 13.646 3.705 1.00 0.00 H new ATOM 0 HG2 GLU A 94 10.580 14.117 6.021 1.00 0.00 H new ATOM 0 HG3 GLU A 94 11.037 12.504 6.531 1.00 0.00 H new ATOM 1409 N VAL A 95 9.691 11.654 1.871 1.00 0.00 N ATOM 1410 CA VAL A 95 9.110 11.880 0.553 1.00 0.00 C ATOM 1411 C VAL A 95 7.698 11.313 0.497 1.00 0.00 C ATOM 1412 O VAL A 95 6.822 11.876 -0.157 1.00 0.00 O ATOM 1413 CB VAL A 95 9.971 11.242 -0.534 1.00 0.00 C ATOM 1414 CG1 VAL A 95 11.403 11.766 -0.427 1.00 0.00 C ATOM 1415 CG2 VAL A 95 9.970 9.734 -0.342 1.00 0.00 C ATOM 0 H VAL A 95 10.499 11.032 1.888 1.00 0.00 H new ATOM 0 HA VAL A 95 9.070 12.955 0.377 1.00 0.00 H new ATOM 0 HB VAL A 95 9.569 11.492 -1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 95 12.016 11.310 -1.204 1.00 0.00 H new ATOM 0 HG12 VAL A 95 11.405 12.849 -0.553 1.00 0.00 H new ATOM 0 HG13 VAL A 95 11.810 11.514 0.552 1.00 0.00 H new ATOM 0 HG21 VAL A 95 10.583 9.269 -1.114 1.00 0.00 H new ATOM 0 HG22 VAL A 95 10.377 9.492 0.640 1.00 0.00 H new ATOM 0 HG23 VAL A 95 8.949 9.359 -0.414 1.00 0.00 H new ATOM 1425 N ILE A 96 7.474 10.207 1.197 1.00 0.00 N ATOM 1426 CA ILE A 96 6.152 9.599 1.219 1.00 0.00 C ATOM 1427 C ILE A 96 5.157 10.533 1.901 1.00 0.00 C ATOM 1428 O ILE A 96 3.991 10.602 1.512 1.00 0.00 O ATOM 1429 CB ILE A 96 6.215 8.254 1.953 1.00 0.00 C ATOM 1430 CG1 ILE A 96 6.429 7.142 0.926 1.00 0.00 C ATOM 1431 CG2 ILE A 96 4.909 7.992 2.714 1.00 0.00 C ATOM 1432 CD1 ILE A 96 6.817 5.851 1.643 1.00 0.00 C ATOM 0 H ILE A 96 8.180 9.720 1.749 1.00 0.00 H new ATOM 0 HA ILE A 96 5.818 9.427 0.196 1.00 0.00 H new ATOM 0 HB ILE A 96 7.037 8.277 2.668 1.00 0.00 H new ATOM 0 HG12 ILE A 96 5.519 6.989 0.346 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.211 7.428 0.222 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.974 7.033 3.228 1.00 0.00 H new ATOM 0 HG22 ILE A 96 4.748 8.785 3.444 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.076 7.971 2.011 1.00 0.00 H new ATOM 0 HD11 ILE A 96 6.969 5.059 0.910 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.739 6.009 2.203 1.00 0.00 H new ATOM 0 HD13 ILE A 96 6.021 5.562 2.329 1.00 0.00 H new ATOM 1444 N LYS A 97 5.622 11.250 2.920 1.00 0.00 N ATOM 1445 CA LYS A 97 4.753 12.173 3.642 1.00 0.00 C ATOM 1446 C LYS A 97 4.402 13.372 2.768 1.00 0.00 C ATOM 1447 O LYS A 97 3.344 13.981 2.928 1.00 0.00 O ATOM 1448 CB LYS A 97 5.438 12.653 4.923 1.00 0.00 C ATOM 1449 CG LYS A 97 4.379 13.102 5.933 1.00 0.00 C ATOM 1450 CD LYS A 97 5.064 13.571 7.218 1.00 0.00 C ATOM 1451 CE LYS A 97 4.609 14.992 7.552 1.00 0.00 C ATOM 1452 NZ LYS A 97 3.130 15.010 7.736 1.00 0.00 N ATOM 0 H LYS A 97 6.583 11.211 3.261 1.00 0.00 H new ATOM 0 HA LYS A 97 3.835 11.646 3.902 1.00 0.00 H new ATOM 0 HB2 LYS A 97 6.043 11.851 5.347 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.114 13.478 4.699 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.780 13.910 5.512 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.698 12.280 6.151 1.00 0.00 H new ATOM 0 HD2 LYS A 97 4.819 12.897 8.039 1.00 0.00 H new ATOM 0 HD3 LYS A 97 6.147 13.544 7.096 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.103 15.340 8.459 1.00 0.00 H new ATOM 0 HE3 LYS A 97 4.895 15.674 6.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 2.872 15.765 8.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 2.668 15.184 6.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 2.816 14.093 8.113 1.00 0.00 H new ATOM 1466 N VAL A 98 5.290 13.700 1.836 1.00 0.00 N ATOM 1467 CA VAL A 98 5.055 14.822 0.939 1.00 0.00 C ATOM 1468 C VAL A 98 4.054 14.432 -0.145 1.00 0.00 C ATOM 1469 O VAL A 98 2.932 14.940 -0.182 1.00 0.00 O ATOM 1470 CB VAL A 98 6.372 15.246 0.306 1.00 0.00 C ATOM 1471 CG1 VAL A 98 6.109 16.293 -0.770 1.00 0.00 C ATOM 1472 CG2 VAL A 98 7.291 15.838 1.378 1.00 0.00 C ATOM 0 H VAL A 98 6.171 13.209 1.684 1.00 0.00 H new ATOM 0 HA VAL A 98 4.641 15.655 1.507 1.00 0.00 H new ATOM 0 HB VAL A 98 6.851 14.376 -0.143 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.054 16.595 -1.222 1.00 0.00 H new ATOM 0 HG12 VAL A 98 5.458 15.872 -1.536 1.00 0.00 H new ATOM 0 HG13 VAL A 98 5.627 17.162 -0.322 1.00 0.00 H new ATOM 0 HG21 VAL A 98 8.234 16.141 0.922 1.00 0.00 H new ATOM 0 HG22 VAL A 98 6.811 16.706 1.830 1.00 0.00 H new ATOM 0 HG23 VAL A 98 7.484 15.089 2.146 1.00 0.00 H new ATOM 1482 N ILE A 99 4.467 13.523 -1.016 1.00 0.00 N ATOM 1483 CA ILE A 99 3.601 13.056 -2.094 1.00 0.00 C ATOM 1484 C ILE A 99 2.189 12.804 -1.571 1.00 0.00 C ATOM 1485 O ILE A 99 1.208 13.206 -2.196 1.00 0.00 O ATOM 1486 CB ILE A 99 4.186 11.768 -2.689 1.00 0.00 C ATOM 1487 CG1 ILE A 99 5.160 12.120 -3.818 1.00 0.00 C ATOM 1488 CG2 ILE A 99 3.067 10.894 -3.251 1.00 0.00 C ATOM 1489 CD1 ILE A 99 6.285 13.004 -3.274 1.00 0.00 C ATOM 0 H ILE A 99 5.392 13.094 -1.000 1.00 0.00 H new ATOM 0 HA ILE A 99 3.546 13.821 -2.869 1.00 0.00 H new ATOM 0 HB ILE A 99 4.710 11.224 -1.903 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.576 11.209 -4.249 1.00 0.00 H new ATOM 0 HG13 ILE A 99 4.632 12.639 -4.618 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.493 9.983 -3.671 1.00 0.00 H new ATOM 0 HG22 ILE A 99 2.372 10.635 -2.453 1.00 0.00 H new ATOM 0 HG23 ILE A 99 2.536 11.439 -4.031 1.00 0.00 H new ATOM 0 HD11 ILE A 99 6.975 13.252 -4.080 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.861 13.921 -2.864 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.821 12.470 -2.489 1.00 0.00 H new ATOM 1501 N HIS A 100 2.091 12.141 -0.424 1.00 0.00 N ATOM 1502 CA HIS A 100 0.788 11.852 0.161 1.00 0.00 C ATOM 1503 C HIS A 100 0.034 13.146 0.452 1.00 0.00 C ATOM 1504 O HIS A 100 -1.072 13.359 -0.047 1.00 0.00 O ATOM 1505 CB HIS A 100 0.962 11.060 1.460 1.00 0.00 C ATOM 1506 CG HIS A 100 -0.300 11.152 2.272 1.00 0.00 C ATOM 1507 ND1 HIS A 100 -1.407 10.343 2.343 1.00 0.00 N flip ATOM 1508 CD2 HIS A 100 -0.540 12.198 3.149 1.00 0.00 C flip ATOM 1509 CE1 HIS A 100 -2.320 10.878 3.245 1.00 0.00 C flip ATOM 1510 NE2 HIS A 100 -1.748 11.996 3.700 1.00 0.00 N flip ATOM 0 H HIS A 100 2.887 11.798 0.113 1.00 0.00 H new ATOM 0 HA HIS A 100 0.214 11.260 -0.552 1.00 0.00 H new ATOM 0 HB2 HIS A 100 1.189 10.018 1.236 1.00 0.00 H new ATOM 0 HB3 HIS A 100 1.804 11.454 2.029 1.00 0.00 H new ATOM 0 HD2 HIS A 100 0.124 13.025 3.352 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -3.284 10.476 3.519 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -2.177 12.621 4.383 1.00 0.00 H new ATOM 1519 N GLY A 101 0.640 14.001 1.269 1.00 0.00 N ATOM 1520 CA GLY A 101 0.035 15.267 1.640 1.00 0.00 C ATOM 1521 C GLY A 101 -0.711 15.898 0.480 1.00 0.00 C ATOM 1522 O GLY A 101 -1.905 16.181 0.570 1.00 0.00 O ATOM 0 H GLY A 101 1.555 13.835 1.687 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -0.652 15.111 2.472 1.00 0.00 H new ATOM 0 HA3 GLY A 101 0.809 15.951 1.989 1.00 0.00 H new ATOM 1526 N LYS A 102 0.011 16.122 -0.597 1.00 0.00 N ATOM 1527 CA LYS A 102 -0.566 16.737 -1.793 1.00 0.00 C ATOM 1528 C LYS A 102 -1.728 15.902 -2.317 1.00 0.00 C ATOM 1529 O LYS A 102 -2.871 16.347 -2.280 1.00 0.00 O ATOM 1530 CB LYS A 102 0.509 16.875 -2.874 1.00 0.00 C ATOM 1531 CG LYS A 102 -0.033 17.710 -4.038 1.00 0.00 C ATOM 1532 CD LYS A 102 -0.266 19.160 -3.593 1.00 0.00 C ATOM 1533 CE LYS A 102 0.215 20.113 -4.689 1.00 0.00 C ATOM 1534 NZ LYS A 102 1.682 19.937 -4.891 1.00 0.00 N ATOM 0 H LYS A 102 1.001 15.890 -0.678 1.00 0.00 H new ATOM 0 HA LYS A 102 -0.942 17.726 -1.531 1.00 0.00 H new ATOM 0 HB2 LYS A 102 1.398 17.348 -2.458 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.809 15.889 -3.230 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.671 17.687 -4.870 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.967 17.279 -4.399 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -1.325 19.324 -3.392 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.269 19.357 -2.664 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -0.318 19.914 -5.619 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.004 21.144 -4.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 2.116 20.858 -5.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 2.107 19.547 -4.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.847 19.284 -5.683 1.00 0.00 H new ATOM 1548 N LEU A 103 -1.437 14.694 -2.800 1.00 0.00 N ATOM 1549 CA LEU A 103 -2.493 13.817 -3.308 1.00 0.00 C ATOM 1550 C LEU A 103 -3.745 13.972 -2.447 1.00 0.00 C ATOM 1551 O LEU A 103 -4.791 14.412 -2.923 1.00 0.00 O ATOM 1552 CB LEU A 103 -2.022 12.367 -3.259 1.00 0.00 C ATOM 1553 CG LEU A 103 -3.092 11.447 -3.867 1.00 0.00 C ATOM 1554 CD1 LEU A 103 -2.586 10.837 -5.177 1.00 0.00 C ATOM 1555 CD2 LEU A 103 -3.429 10.332 -2.871 1.00 0.00 C ATOM 0 H LEU A 103 -0.496 14.305 -2.850 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.723 14.090 -4.338 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.086 12.261 -3.807 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.823 12.075 -2.228 1.00 0.00 H new ATOM 0 HG LEU A 103 -3.987 12.032 -4.078 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -3.354 10.188 -5.597 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -2.358 11.634 -5.885 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.685 10.255 -4.983 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -4.188 9.678 -3.300 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.531 9.753 -2.655 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.808 10.771 -1.948 1.00 0.00 H new ATOM 1567 N LEU A 104 -3.612 13.628 -1.172 1.00 0.00 N ATOM 1568 CA LEU A 104 -4.716 13.752 -0.234 1.00 0.00 C ATOM 1569 C LEU A 104 -5.429 15.084 -0.464 1.00 0.00 C ATOM 1570 O LEU A 104 -6.654 15.151 -0.544 1.00 0.00 O ATOM 1571 CB LEU A 104 -4.155 13.626 1.203 1.00 0.00 C ATOM 1572 CG LEU A 104 -4.573 14.795 2.097 1.00 0.00 C ATOM 1573 CD1 LEU A 104 -6.084 14.789 2.250 1.00 0.00 C ATOM 1574 CD2 LEU A 104 -3.933 14.629 3.475 1.00 0.00 C ATOM 0 H LEU A 104 -2.751 13.262 -0.766 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.451 12.961 -0.383 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.502 12.692 1.645 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -3.067 13.574 1.162 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.248 15.734 1.649 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.389 15.620 2.886 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.549 14.893 1.270 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.400 13.850 2.704 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.228 15.460 4.116 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.266 13.691 3.920 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.848 14.617 3.373 1.00 0.00 H new ATOM 1586 N ASP A 105 -4.635 16.132 -0.553 1.00 0.00 N ATOM 1587 CA ASP A 105 -5.139 17.480 -0.757 1.00 0.00 C ATOM 1588 C ASP A 105 -5.870 17.601 -2.089 1.00 0.00 C ATOM 1589 O ASP A 105 -6.786 18.410 -2.239 1.00 0.00 O ATOM 1590 CB ASP A 105 -3.952 18.434 -0.746 1.00 0.00 C ATOM 1591 CG ASP A 105 -3.838 19.150 -2.087 1.00 0.00 C ATOM 1592 OD1 ASP A 105 -3.589 18.479 -3.075 1.00 0.00 O ATOM 1593 OD2 ASP A 105 -4.003 20.358 -2.107 1.00 0.00 O ATOM 0 H ASP A 105 -3.619 16.075 -0.486 1.00 0.00 H new ATOM 0 HA ASP A 105 -5.846 17.722 0.037 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.070 19.164 0.055 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -3.035 17.882 -0.541 1.00 0.00 H new ATOM 1676 N GLN A 111 -12.052 8.847 3.751 1.00 0.00 N ATOM 1677 CA GLN A 111 -11.054 7.841 4.085 1.00 0.00 C ATOM 1678 C GLN A 111 -10.975 6.774 3.002 1.00 0.00 C ATOM 1679 O GLN A 111 -11.934 6.041 2.768 1.00 0.00 O ATOM 1680 CB GLN A 111 -11.396 7.183 5.416 1.00 0.00 C ATOM 1681 CG GLN A 111 -11.657 8.258 6.472 1.00 0.00 C ATOM 1682 CD GLN A 111 -11.842 7.611 7.840 1.00 0.00 C ATOM 1683 OE1 GLN A 111 -12.778 7.949 8.566 1.00 0.00 O ATOM 1684 NE2 GLN A 111 -11.002 6.695 8.239 1.00 0.00 N ATOM 0 HA GLN A 111 -10.087 8.339 4.161 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -12.276 6.549 5.304 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -10.577 6.538 5.735 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.823 8.960 6.502 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.546 8.830 6.208 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -10.227 6.416 7.637 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -11.120 6.258 9.153 1.00 0.00 H new ATOM 1693 N ILE A 112 -9.817 6.691 2.357 1.00 0.00 N ATOM 1694 CA ILE A 112 -9.599 5.707 1.302 1.00 0.00 C ATOM 1695 C ILE A 112 -8.560 4.683 1.768 1.00 0.00 C ATOM 1696 O ILE A 112 -7.696 5.018 2.569 1.00 0.00 O ATOM 1697 CB ILE A 112 -9.102 6.402 0.035 1.00 0.00 C ATOM 1698 CG1 ILE A 112 -8.528 7.773 0.400 1.00 0.00 C ATOM 1699 CG2 ILE A 112 -10.267 6.579 -0.941 1.00 0.00 C ATOM 1700 CD1 ILE A 112 -7.708 8.314 -0.772 1.00 0.00 C ATOM 0 H ILE A 112 -9.015 7.292 2.545 1.00 0.00 H new ATOM 0 HA ILE A 112 -10.539 5.200 1.084 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.327 5.795 -0.433 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -9.336 8.464 0.642 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -7.902 7.692 1.288 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -9.912 7.075 -1.845 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -10.677 5.603 -1.200 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -11.043 7.186 -0.475 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -7.300 9.290 -0.511 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -6.891 7.627 -0.993 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -8.347 8.411 -1.649 1.00 0.00 H new ATOM 1712 N PRO A 113 -8.617 3.454 1.309 1.00 0.00 N ATOM 1713 CA PRO A 113 -7.635 2.413 1.731 1.00 0.00 C ATOM 1714 C PRO A 113 -6.186 2.893 1.643 1.00 0.00 C ATOM 1715 O PRO A 113 -5.627 3.005 0.548 1.00 0.00 O ATOM 1716 CB PRO A 113 -7.869 1.255 0.760 1.00 0.00 C ATOM 1717 CG PRO A 113 -9.247 1.437 0.215 1.00 0.00 C ATOM 1718 CD PRO A 113 -9.611 2.916 0.360 1.00 0.00 C ATOM 0 HA PRO A 113 -7.781 2.140 2.776 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -7.130 1.264 -0.041 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -7.776 0.296 1.269 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -9.288 1.133 -0.831 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -9.958 0.813 0.756 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -9.563 3.432 -0.599 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -10.626 3.039 0.737 1.00 0.00 H new ATOM 1726 N ILE A 114 -5.574 3.136 2.803 1.00 0.00 N ATOM 1727 CA ILE A 114 -4.183 3.561 2.856 1.00 0.00 C ATOM 1728 C ILE A 114 -3.406 2.536 3.666 1.00 0.00 C ATOM 1729 O ILE A 114 -3.787 2.193 4.790 1.00 0.00 O ATOM 1730 CB ILE A 114 -4.053 4.955 3.486 1.00 0.00 C ATOM 1731 CG1 ILE A 114 -4.953 5.947 2.747 1.00 0.00 C ATOM 1732 CG2 ILE A 114 -2.609 5.439 3.379 1.00 0.00 C ATOM 1733 CD1 ILE A 114 -5.914 6.618 3.734 1.00 0.00 C ATOM 0 H ILE A 114 -6.023 3.045 3.715 1.00 0.00 H new ATOM 0 HA ILE A 114 -3.782 3.626 1.845 1.00 0.00 H new ATOM 0 HB ILE A 114 -4.349 4.893 4.533 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -4.344 6.702 2.249 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -5.518 5.430 1.971 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -2.523 6.429 3.828 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -1.953 4.744 3.903 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.319 5.490 2.329 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -6.551 7.323 3.200 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -6.534 5.859 4.212 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -5.342 7.150 4.494 1.00 0.00 H new ATOM 1745 N MET A 115 -2.337 2.029 3.075 1.00 0.00 N ATOM 1746 CA MET A 115 -1.527 1.018 3.729 1.00 0.00 C ATOM 1747 C MET A 115 -0.065 1.428 3.773 1.00 0.00 C ATOM 1748 O MET A 115 0.592 1.531 2.736 1.00 0.00 O ATOM 1749 CB MET A 115 -1.657 -0.301 2.970 1.00 0.00 C ATOM 1750 CG MET A 115 -1.093 -1.438 3.818 1.00 0.00 C ATOM 1751 SD MET A 115 -2.350 -1.992 4.990 1.00 0.00 S ATOM 1752 CE MET A 115 -1.210 -2.752 6.163 1.00 0.00 C ATOM 0 H MET A 115 -2.012 2.300 2.147 1.00 0.00 H new ATOM 0 HA MET A 115 -1.883 0.903 4.753 1.00 0.00 H new ATOM 0 HB2 MET A 115 -2.703 -0.495 2.734 1.00 0.00 H new ATOM 0 HB3 MET A 115 -1.122 -0.241 2.022 1.00 0.00 H new ATOM 0 HG2 MET A 115 -0.786 -2.266 3.179 1.00 0.00 H new ATOM 0 HG3 MET A 115 -0.205 -1.102 4.352 1.00 0.00 H new ATOM 0 HE1 MET A 115 -1.776 -3.251 6.950 1.00 0.00 H new ATOM 0 HE2 MET A 115 -0.588 -3.482 5.645 1.00 0.00 H new ATOM 0 HE3 MET A 115 -0.576 -1.983 6.604 1.00 0.00 H new ATOM 1762 N LEU A 116 0.449 1.635 4.978 1.00 0.00 N ATOM 1763 CA LEU A 116 1.830 1.999 5.145 1.00 0.00 C ATOM 1764 C LEU A 116 2.638 0.762 5.436 1.00 0.00 C ATOM 1765 O LEU A 116 2.694 0.299 6.574 1.00 0.00 O ATOM 1766 CB LEU A 116 1.960 2.931 6.316 1.00 0.00 C ATOM 1767 CG LEU A 116 1.799 4.371 5.838 1.00 0.00 C ATOM 1768 CD1 LEU A 116 1.292 5.209 6.993 1.00 0.00 C ATOM 1769 CD2 LEU A 116 3.148 4.920 5.381 1.00 0.00 C ATOM 0 H LEU A 116 -0.078 1.555 5.848 1.00 0.00 H new ATOM 0 HA LEU A 116 2.188 2.481 4.235 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.204 2.698 7.066 1.00 0.00 H new ATOM 0 HB3 LEU A 116 2.932 2.801 6.792 1.00 0.00 H new ATOM 0 HG LEU A 116 1.097 4.404 5.005 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.171 6.242 6.667 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.331 4.820 7.330 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.008 5.168 7.814 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.026 5.948 5.041 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.852 4.894 6.213 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.531 4.310 4.563 1.00 0.00 H new ATOM 1781 N VAL A 117 3.256 0.232 4.404 1.00 0.00 N ATOM 1782 CA VAL A 117 4.057 -0.958 4.552 1.00 0.00 C ATOM 1783 C VAL A 117 5.529 -0.612 4.545 1.00 0.00 C ATOM 1784 O VAL A 117 6.019 0.134 3.706 1.00 0.00 O ATOM 1785 CB VAL A 117 3.720 -1.966 3.454 1.00 0.00 C ATOM 1786 CG1 VAL A 117 4.415 -3.301 3.720 1.00 0.00 C ATOM 1787 CG2 VAL A 117 2.222 -2.196 3.480 1.00 0.00 C ATOM 0 H VAL A 117 3.218 0.607 3.456 1.00 0.00 H new ATOM 0 HA VAL A 117 3.827 -1.417 5.513 1.00 0.00 H new ATOM 0 HB VAL A 117 4.052 -1.579 2.491 1.00 0.00 H new ATOM 0 HG11 VAL A 117 4.163 -4.006 2.928 1.00 0.00 H new ATOM 0 HG12 VAL A 117 5.494 -3.151 3.743 1.00 0.00 H new ATOM 0 HG13 VAL A 117 4.084 -3.699 4.679 1.00 0.00 H new ATOM 0 HG21 VAL A 117 1.950 -2.913 2.705 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.931 -2.587 4.455 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.706 -1.253 3.299 1.00 0.00 H new ATOM 1797 N GLY A 118 6.208 -1.175 5.505 1.00 0.00 N ATOM 1798 CA GLY A 118 7.637 -0.975 5.666 1.00 0.00 C ATOM 1799 C GLY A 118 8.367 -2.225 5.223 1.00 0.00 C ATOM 1800 O GLY A 118 8.287 -3.258 5.884 1.00 0.00 O ATOM 0 H GLY A 118 5.792 -1.789 6.205 1.00 0.00 H new ATOM 0 HA2 GLY A 118 7.965 -0.119 5.076 1.00 0.00 H new ATOM 0 HA3 GLY A 118 7.870 -0.753 6.707 1.00 0.00 H new ATOM 1804 N ASN A 119 9.059 -2.143 4.098 1.00 0.00 N ATOM 1805 CA ASN A 119 9.762 -3.307 3.593 1.00 0.00 C ATOM 1806 C ASN A 119 11.231 -3.279 3.993 1.00 0.00 C ATOM 1807 O ASN A 119 11.705 -2.319 4.600 1.00 0.00 O ATOM 1808 CB ASN A 119 9.652 -3.369 2.069 1.00 0.00 C ATOM 1809 CG ASN A 119 10.262 -4.670 1.556 1.00 0.00 C ATOM 1810 OD1 ASN A 119 9.821 -5.755 1.938 1.00 0.00 O ATOM 1811 ND2 ASN A 119 11.254 -4.628 0.710 1.00 0.00 N ATOM 0 H ASN A 119 9.148 -1.301 3.529 1.00 0.00 H new ATOM 0 HA ASN A 119 9.299 -4.192 4.030 1.00 0.00 H new ATOM 0 HB2 ASN A 119 8.606 -3.304 1.768 1.00 0.00 H new ATOM 0 HB3 ASN A 119 10.165 -2.516 1.624 1.00 0.00 H new ATOM 0 HD21 ASN A 119 11.666 -5.494 0.364 1.00 0.00 H new ATOM 0 HD22 ASN A 119 11.618 -3.729 0.395 1.00 0.00 H new ATOM 1818 N LYS A 120 11.942 -4.350 3.654 1.00 0.00 N ATOM 1819 CA LYS A 120 13.366 -4.458 3.987 1.00 0.00 C ATOM 1820 C LYS A 120 13.525 -4.544 5.509 1.00 0.00 C ATOM 1821 O LYS A 120 14.148 -3.699 6.148 1.00 0.00 O ATOM 1822 CB LYS A 120 14.147 -3.260 3.403 1.00 0.00 C ATOM 1823 CG LYS A 120 15.084 -3.747 2.295 1.00 0.00 C ATOM 1824 CD LYS A 120 15.648 -2.546 1.531 1.00 0.00 C ATOM 1825 CE LYS A 120 16.383 -3.038 0.284 1.00 0.00 C ATOM 1826 NZ LYS A 120 15.423 -3.136 -0.851 1.00 0.00 N ATOM 0 H LYS A 120 11.562 -5.153 3.152 1.00 0.00 H new ATOM 0 HA LYS A 120 13.779 -5.364 3.544 1.00 0.00 H new ATOM 0 HB2 LYS A 120 13.453 -2.519 3.006 1.00 0.00 H new ATOM 0 HB3 LYS A 120 14.721 -2.770 4.189 1.00 0.00 H new ATOM 0 HG2 LYS A 120 15.898 -4.332 2.724 1.00 0.00 H new ATOM 0 HG3 LYS A 120 14.545 -4.404 1.612 1.00 0.00 H new ATOM 0 HD2 LYS A 120 14.842 -1.869 1.248 1.00 0.00 H new ATOM 0 HD3 LYS A 120 16.328 -1.982 2.169 1.00 0.00 H new ATOM 0 HE2 LYS A 120 17.192 -2.353 0.032 1.00 0.00 H new ATOM 0 HE3 LYS A 120 16.837 -4.010 0.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 15.603 -4.011 -1.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.450 -3.149 -0.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 15.544 -2.317 -1.480 1.00 0.00 H new ATOM 1840 N LYS A 121 12.911 -5.574 6.078 1.00 0.00 N ATOM 1841 CA LYS A 121 12.928 -5.786 7.523 1.00 0.00 C ATOM 1842 C LYS A 121 14.335 -6.050 8.075 1.00 0.00 C ATOM 1843 O LYS A 121 14.655 -5.604 9.175 1.00 0.00 O ATOM 1844 CB LYS A 121 12.013 -6.965 7.866 1.00 0.00 C ATOM 1845 CG LYS A 121 11.727 -6.987 9.369 1.00 0.00 C ATOM 1846 CD LYS A 121 10.665 -8.051 9.668 1.00 0.00 C ATOM 1847 CE LYS A 121 10.743 -8.464 11.139 1.00 0.00 C ATOM 1848 NZ LYS A 121 11.524 -9.728 11.262 1.00 0.00 N ATOM 0 H LYS A 121 12.391 -6.281 5.558 1.00 0.00 H new ATOM 0 HA LYS A 121 12.573 -4.868 7.990 1.00 0.00 H new ATOM 0 HB2 LYS A 121 11.078 -6.884 7.311 1.00 0.00 H new ATOM 0 HB3 LYS A 121 12.483 -7.901 7.563 1.00 0.00 H new ATOM 0 HG2 LYS A 121 12.641 -7.204 9.921 1.00 0.00 H new ATOM 0 HG3 LYS A 121 11.380 -6.008 9.699 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.673 -7.660 9.443 1.00 0.00 H new ATOM 0 HD3 LYS A 121 10.818 -8.920 9.028 1.00 0.00 H new ATOM 0 HE2 LYS A 121 11.215 -7.675 11.724 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.740 -8.604 11.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.576 -10.008 12.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.056 -10.480 10.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.485 -9.580 10.893 1.00 0.00 H new ATOM 1862 N ASP A 122 15.169 -6.789 7.341 1.00 0.00 N ATOM 1863 CA ASP A 122 16.513 -7.096 7.840 1.00 0.00 C ATOM 1864 C ASP A 122 17.331 -5.831 8.078 1.00 0.00 C ATOM 1865 O ASP A 122 18.435 -5.896 8.620 1.00 0.00 O ATOM 1866 CB ASP A 122 17.265 -8.027 6.885 1.00 0.00 C ATOM 1867 CG ASP A 122 17.177 -7.529 5.449 1.00 0.00 C ATOM 1868 OD1 ASP A 122 16.090 -7.574 4.897 1.00 0.00 O ATOM 1869 OD2 ASP A 122 18.211 -7.160 4.902 1.00 0.00 O ATOM 0 H ASP A 122 14.948 -7.177 6.424 1.00 0.00 H new ATOM 0 HA ASP A 122 16.382 -7.605 8.795 1.00 0.00 H new ATOM 0 HB2 ASP A 122 18.310 -8.094 7.186 1.00 0.00 H new ATOM 0 HB3 ASP A 122 16.849 -9.032 6.950 1.00 0.00 H new ATOM 1874 N LEU A 123 16.785 -4.681 7.706 1.00 0.00 N ATOM 1875 CA LEU A 123 17.485 -3.428 7.931 1.00 0.00 C ATOM 1876 C LEU A 123 17.056 -2.865 9.273 1.00 0.00 C ATOM 1877 O LEU A 123 17.816 -2.146 9.921 1.00 0.00 O ATOM 1878 CB LEU A 123 17.199 -2.424 6.805 1.00 0.00 C ATOM 1879 CG LEU A 123 18.299 -2.508 5.740 1.00 0.00 C ATOM 1880 CD1 LEU A 123 18.286 -3.897 5.120 1.00 0.00 C ATOM 1881 CD2 LEU A 123 18.042 -1.465 4.649 1.00 0.00 C ATOM 0 H LEU A 123 15.875 -4.591 7.255 1.00 0.00 H new ATOM 0 HA LEU A 123 18.559 -3.612 7.935 1.00 0.00 H new ATOM 0 HB2 LEU A 123 16.229 -2.635 6.356 1.00 0.00 H new ATOM 0 HB3 LEU A 123 17.150 -1.413 7.211 1.00 0.00 H new ATOM 0 HG LEU A 123 19.268 -2.316 6.201 1.00 0.00 H new ATOM 0 HD11 LEU A 123 19.066 -3.964 4.361 1.00 0.00 H new ATOM 0 HD12 LEU A 123 18.467 -4.643 5.894 1.00 0.00 H new ATOM 0 HD13 LEU A 123 17.315 -4.081 4.660 1.00 0.00 H new ATOM 0 HD21 LEU A 123 18.826 -1.528 3.894 1.00 0.00 H new ATOM 0 HD22 LEU A 123 17.074 -1.655 4.184 1.00 0.00 H new ATOM 0 HD23 LEU A 123 18.043 -0.469 5.091 1.00 0.00 H new ATOM 1893 N HIS A 124 15.836 -3.220 9.695 1.00 0.00 N ATOM 1894 CA HIS A 124 15.324 -2.769 10.983 1.00 0.00 C ATOM 1895 C HIS A 124 16.443 -2.788 12.016 1.00 0.00 C ATOM 1896 O HIS A 124 16.420 -2.042 12.990 1.00 0.00 O ATOM 1897 CB HIS A 124 14.182 -3.673 11.446 1.00 0.00 C ATOM 1898 CG HIS A 124 14.744 -4.867 12.168 1.00 0.00 C ATOM 1899 ND1 HIS A 124 15.140 -6.016 11.503 1.00 0.00 N ATOM 1900 CD2 HIS A 124 14.981 -5.106 13.500 1.00 0.00 C ATOM 1901 CE1 HIS A 124 15.589 -6.887 12.426 1.00 0.00 C ATOM 1902 NE2 HIS A 124 15.514 -6.382 13.660 1.00 0.00 N ATOM 0 H HIS A 124 15.196 -3.812 9.166 1.00 0.00 H new ATOM 0 HA HIS A 124 14.947 -1.752 10.874 1.00 0.00 H new ATOM 0 HB2 HIS A 124 13.511 -3.120 12.104 1.00 0.00 H new ATOM 0 HB3 HIS A 124 13.592 -3.998 10.589 1.00 0.00 H new ATOM 0 HD1 HIS A 124 15.099 -6.174 10.496 1.00 0.00 H new ATOM 0 HD2 HIS A 124 14.784 -4.410 14.301 1.00 0.00 H new ATOM 0 HE1 HIS A 124 15.964 -7.873 12.197 1.00 0.00 H new ATOM 1911 N MET A 125 17.445 -3.626 11.788 1.00 0.00 N ATOM 1912 CA MET A 125 18.569 -3.680 12.703 1.00 0.00 C ATOM 1913 C MET A 125 19.015 -2.256 13.012 1.00 0.00 C ATOM 1914 O MET A 125 19.636 -1.992 14.042 1.00 0.00 O ATOM 1915 CB MET A 125 19.720 -4.470 12.083 1.00 0.00 C ATOM 1916 CG MET A 125 19.306 -5.933 11.925 1.00 0.00 C ATOM 1917 SD MET A 125 20.365 -6.974 12.960 1.00 0.00 S ATOM 1918 CE MET A 125 19.069 -7.602 14.055 1.00 0.00 C ATOM 0 H MET A 125 17.501 -4.264 10.994 1.00 0.00 H new ATOM 0 HA MET A 125 18.270 -4.182 13.623 1.00 0.00 H new ATOM 0 HB2 MET A 125 19.984 -4.049 11.113 1.00 0.00 H new ATOM 0 HB3 MET A 125 20.606 -4.398 12.713 1.00 0.00 H new ATOM 0 HG2 MET A 125 18.262 -6.060 12.211 1.00 0.00 H new ATOM 0 HG3 MET A 125 19.389 -6.235 10.881 1.00 0.00 H new ATOM 0 HE1 MET A 125 19.508 -8.278 14.788 1.00 0.00 H new ATOM 0 HE2 MET A 125 18.593 -6.768 14.570 1.00 0.00 H new ATOM 0 HE3 MET A 125 18.324 -8.138 13.467 1.00 0.00 H new ATOM 1928 N GLU A 126 18.680 -1.338 12.101 1.00 0.00 N ATOM 1929 CA GLU A 126 19.028 0.058 12.258 1.00 0.00 C ATOM 1930 C GLU A 126 17.762 0.878 12.525 1.00 0.00 C ATOM 1931 O GLU A 126 17.771 1.824 13.313 1.00 0.00 O ATOM 1932 CB GLU A 126 19.733 0.505 10.976 1.00 0.00 C ATOM 1933 CG GLU A 126 18.887 1.501 10.183 1.00 0.00 C ATOM 1934 CD GLU A 126 19.606 1.867 8.890 1.00 0.00 C ATOM 1935 OE1 GLU A 126 20.141 0.971 8.258 1.00 0.00 O ATOM 1936 OE2 GLU A 126 19.610 3.039 8.548 1.00 0.00 O ATOM 0 H GLU A 126 18.165 -1.548 11.246 1.00 0.00 H new ATOM 0 HA GLU A 126 19.695 0.209 13.107 1.00 0.00 H new ATOM 0 HB2 GLU A 126 20.691 0.960 11.227 1.00 0.00 H new ATOM 0 HB3 GLU A 126 19.947 -0.366 10.356 1.00 0.00 H new ATOM 0 HG2 GLU A 126 17.912 1.068 9.959 1.00 0.00 H new ATOM 0 HG3 GLU A 126 18.709 2.397 10.778 1.00 0.00 H new ATOM 1943 N ARG A 127 16.684 0.486 11.850 1.00 0.00 N ATOM 1944 CA ARG A 127 15.382 1.140 11.972 1.00 0.00 C ATOM 1945 C ARG A 127 15.519 2.620 12.309 1.00 0.00 C ATOM 1946 O ARG A 127 15.581 3.001 13.477 1.00 0.00 O ATOM 1947 CB ARG A 127 14.547 0.433 13.043 1.00 0.00 C ATOM 1948 CG ARG A 127 13.049 0.725 12.864 1.00 0.00 C ATOM 1949 CD ARG A 127 12.335 -0.575 12.467 1.00 0.00 C ATOM 1950 NE ARG A 127 10.902 -0.346 12.294 1.00 0.00 N ATOM 1951 CZ ARG A 127 9.990 -1.203 12.766 1.00 0.00 C ATOM 1952 NH1 ARG A 127 10.348 -2.364 13.233 1.00 0.00 N ATOM 1953 NH2 ARG A 127 8.729 -0.931 12.626 1.00 0.00 N ATOM 0 H ARG A 127 16.689 -0.299 11.199 1.00 0.00 H new ATOM 0 HA ARG A 127 14.881 1.068 11.007 1.00 0.00 H new ATOM 0 HB2 ARG A 127 14.719 -0.642 12.991 1.00 0.00 H new ATOM 0 HB3 ARG A 127 14.868 0.760 14.032 1.00 0.00 H new ATOM 0 HG2 ARG A 127 12.628 1.119 13.789 1.00 0.00 H new ATOM 0 HG3 ARG A 127 12.902 1.486 12.097 1.00 0.00 H new ATOM 0 HD2 ARG A 127 12.761 -0.961 11.541 1.00 0.00 H new ATOM 0 HD3 ARG A 127 12.497 -1.333 13.233 1.00 0.00 H new ATOM 0 HE ARG A 127 10.589 0.490 11.800 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.333 -2.629 13.242 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.643 -3.009 13.590 1.00 0.00 H new ATOM 0 HH21 ARG A 127 8.442 -0.071 12.160 1.00 0.00 H new ATOM 0 HH22 ARG A 127 8.025 -1.578 12.982 1.00 0.00 H new ATOM 1967 N VAL A 128 15.553 3.446 11.270 1.00 0.00 N ATOM 1968 CA VAL A 128 15.670 4.888 11.452 1.00 0.00 C ATOM 1969 C VAL A 128 14.361 5.459 11.987 1.00 0.00 C ATOM 1970 O VAL A 128 14.360 6.380 12.804 1.00 0.00 O ATOM 1971 CB VAL A 128 16.004 5.562 10.125 1.00 0.00 C ATOM 1972 CG1 VAL A 128 16.208 7.061 10.353 1.00 0.00 C ATOM 1973 CG2 VAL A 128 17.284 4.961 9.540 1.00 0.00 C ATOM 0 H VAL A 128 15.502 3.144 10.297 1.00 0.00 H new ATOM 0 HA VAL A 128 16.470 5.080 12.168 1.00 0.00 H new ATOM 0 HB VAL A 128 15.182 5.403 9.428 1.00 0.00 H new ATOM 0 HG11 VAL A 128 16.447 7.544 9.405 1.00 0.00 H new ATOM 0 HG12 VAL A 128 15.295 7.494 10.761 1.00 0.00 H new ATOM 0 HG13 VAL A 128 17.028 7.214 11.055 1.00 0.00 H new ATOM 0 HG21 VAL A 128 17.515 5.448 8.593 1.00 0.00 H new ATOM 0 HG22 VAL A 128 18.109 5.113 10.236 1.00 0.00 H new ATOM 0 HG23 VAL A 128 17.142 3.893 9.374 1.00 0.00 H new ATOM 1983 N ILE A 129 13.249 4.902 11.517 1.00 0.00 N ATOM 1984 CA ILE A 129 11.932 5.358 11.945 1.00 0.00 C ATOM 1985 C ILE A 129 11.473 4.591 13.176 1.00 0.00 C ATOM 1986 O ILE A 129 11.898 3.459 13.413 1.00 0.00 O ATOM 1987 CB ILE A 129 10.909 5.193 10.812 1.00 0.00 C ATOM 1988 CG1 ILE A 129 9.972 6.407 10.799 1.00 0.00 C ATOM 1989 CG2 ILE A 129 10.081 3.914 11.013 1.00 0.00 C ATOM 1990 CD1 ILE A 129 10.686 7.618 10.189 1.00 0.00 C ATOM 0 H ILE A 129 13.234 4.137 10.842 1.00 0.00 H new ATOM 0 HA ILE A 129 12.006 6.415 12.199 1.00 0.00 H new ATOM 0 HB ILE A 129 11.442 5.119 9.864 1.00 0.00 H new ATOM 0 HG12 ILE A 129 9.075 6.177 10.225 1.00 0.00 H new ATOM 0 HG13 ILE A 129 9.650 6.638 11.814 1.00 0.00 H new ATOM 0 HG21 ILE A 129 9.362 3.815 10.200 1.00 0.00 H new ATOM 0 HG22 ILE A 129 10.744 3.049 11.019 1.00 0.00 H new ATOM 0 HG23 ILE A 129 9.549 3.970 11.963 1.00 0.00 H new ATOM 0 HD11 ILE A 129 10.011 8.474 10.185 1.00 0.00 H new ATOM 0 HD12 ILE A 129 11.570 7.855 10.781 1.00 0.00 H new ATOM 0 HD13 ILE A 129 10.985 7.387 9.167 1.00 0.00 H new ATOM 2002 N SER A 130 10.600 5.215 13.949 1.00 0.00 N ATOM 2003 CA SER A 130 10.079 4.583 15.156 1.00 0.00 C ATOM 2004 C SER A 130 8.680 4.031 14.915 1.00 0.00 C ATOM 2005 O SER A 130 7.787 4.746 14.461 1.00 0.00 O ATOM 2006 CB SER A 130 10.041 5.590 16.302 1.00 0.00 C ATOM 2007 OG SER A 130 9.122 6.627 15.987 1.00 0.00 O ATOM 0 H SER A 130 10.238 6.151 13.767 1.00 0.00 H new ATOM 0 HA SER A 130 10.741 3.758 15.421 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.745 5.095 17.227 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.034 6.007 16.468 1.00 0.00 H new ATOM 0 HG SER A 130 9.365 7.029 15.127 1.00 0.00 H new ATOM 2013 N TYR A 131 8.503 2.754 15.235 1.00 0.00 N ATOM 2014 CA TYR A 131 7.209 2.099 15.065 1.00 0.00 C ATOM 2015 C TYR A 131 6.091 3.040 15.485 1.00 0.00 C ATOM 2016 O TYR A 131 5.001 3.030 14.917 1.00 0.00 O ATOM 2017 CB TYR A 131 7.161 0.835 15.934 1.00 0.00 C ATOM 2018 CG TYR A 131 6.055 -0.084 15.463 1.00 0.00 C ATOM 2019 CD1 TYR A 131 4.713 0.246 15.698 1.00 0.00 C ATOM 2020 CD2 TYR A 131 6.373 -1.272 14.796 1.00 0.00 C ATOM 2021 CE1 TYR A 131 3.694 -0.610 15.262 1.00 0.00 C ATOM 2022 CE2 TYR A 131 5.356 -2.128 14.360 1.00 0.00 C ATOM 2023 CZ TYR A 131 4.016 -1.797 14.592 1.00 0.00 C ATOM 2024 OH TYR A 131 3.012 -2.640 14.162 1.00 0.00 O ATOM 0 H TYR A 131 9.235 2.153 15.612 1.00 0.00 H new ATOM 0 HA TYR A 131 7.078 1.832 14.016 1.00 0.00 H new ATOM 0 HB2 TYR A 131 8.119 0.317 15.887 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.997 1.108 16.976 1.00 0.00 H new ATOM 0 HD1 TYR A 131 4.465 1.161 16.216 1.00 0.00 H new ATOM 0 HD2 TYR A 131 7.407 -1.529 14.617 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.660 -0.355 15.442 1.00 0.00 H new ATOM 0 HE2 TYR A 131 5.605 -3.044 13.845 1.00 0.00 H new ATOM 0 HH TYR A 131 3.407 -3.418 13.715 1.00 0.00 H new ATOM 2034 N GLU A 132 6.385 3.851 16.490 1.00 0.00 N ATOM 2035 CA GLU A 132 5.422 4.807 17.017 1.00 0.00 C ATOM 2036 C GLU A 132 5.142 5.908 16.010 1.00 0.00 C ATOM 2037 O GLU A 132 4.027 6.030 15.504 1.00 0.00 O ATOM 2038 CB GLU A 132 5.969 5.414 18.295 1.00 0.00 C ATOM 2039 CG GLU A 132 6.216 4.300 19.299 1.00 0.00 C ATOM 2040 CD GLU A 132 7.686 4.269 19.689 1.00 0.00 C ATOM 2041 OE1 GLU A 132 8.492 3.935 18.836 1.00 0.00 O ATOM 2042 OE2 GLU A 132 7.986 4.580 20.830 1.00 0.00 O ATOM 0 H GLU A 132 7.290 3.866 16.960 1.00 0.00 H new ATOM 0 HA GLU A 132 4.488 4.284 17.221 1.00 0.00 H new ATOM 0 HB2 GLU A 132 6.895 5.951 18.091 1.00 0.00 H new ATOM 0 HB3 GLU A 132 5.263 6.139 18.701 1.00 0.00 H new ATOM 0 HG2 GLU A 132 5.599 4.454 20.185 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.925 3.341 18.870 1.00 0.00 H new ATOM 2049 N GLU A 133 6.164 6.706 15.723 1.00 0.00 N ATOM 2050 CA GLU A 133 6.019 7.793 14.771 1.00 0.00 C ATOM 2051 C GLU A 133 5.197 7.332 13.580 1.00 0.00 C ATOM 2052 O GLU A 133 4.339 8.061 13.095 1.00 0.00 O ATOM 2053 CB GLU A 133 7.392 8.254 14.295 1.00 0.00 C ATOM 2054 CG GLU A 133 8.078 9.062 15.400 1.00 0.00 C ATOM 2055 CD GLU A 133 9.585 9.123 15.153 1.00 0.00 C ATOM 2056 OE1 GLU A 133 10.107 8.208 14.535 1.00 0.00 O ATOM 2057 OE2 GLU A 133 10.195 10.085 15.588 1.00 0.00 O ATOM 0 H GLU A 133 7.094 6.620 16.134 1.00 0.00 H new ATOM 0 HA GLU A 133 5.510 8.624 15.260 1.00 0.00 H new ATOM 0 HB2 GLU A 133 8.003 7.392 14.029 1.00 0.00 H new ATOM 0 HB3 GLU A 133 7.290 8.862 13.396 1.00 0.00 H new ATOM 0 HG2 GLU A 133 7.666 10.071 15.431 1.00 0.00 H new ATOM 0 HG3 GLU A 133 7.880 8.606 16.370 1.00 0.00 H new ATOM 2064 N GLY A 134 5.465 6.112 13.125 1.00 0.00 N ATOM 2065 CA GLY A 134 4.756 5.547 12.002 1.00 0.00 C ATOM 2066 C GLY A 134 3.330 5.209 12.380 1.00 0.00 C ATOM 2067 O GLY A 134 2.408 5.335 11.574 1.00 0.00 O ATOM 0 H GLY A 134 6.175 5.499 13.526 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.759 6.253 11.172 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.268 4.649 11.658 1.00 0.00 H new ATOM 2071 N LYS A 135 3.160 4.789 13.618 1.00 0.00 N ATOM 2072 CA LYS A 135 1.840 4.442 14.116 1.00 0.00 C ATOM 2073 C LYS A 135 0.961 5.678 14.118 1.00 0.00 C ATOM 2074 O LYS A 135 -0.110 5.686 13.520 1.00 0.00 O ATOM 2075 CB LYS A 135 1.930 3.876 15.536 1.00 0.00 C ATOM 2076 CG LYS A 135 0.655 3.093 15.852 1.00 0.00 C ATOM 2077 CD LYS A 135 0.317 3.238 17.336 1.00 0.00 C ATOM 2078 CE LYS A 135 -0.915 2.393 17.666 1.00 0.00 C ATOM 2079 NZ LYS A 135 -2.013 3.279 18.142 1.00 0.00 N ATOM 0 H LYS A 135 3.914 4.679 14.296 1.00 0.00 H new ATOM 0 HA LYS A 135 1.409 3.682 13.465 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.801 3.226 15.626 1.00 0.00 H new ATOM 0 HB3 LYS A 135 2.061 4.685 16.254 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -0.170 3.462 15.243 1.00 0.00 H new ATOM 0 HG3 LYS A 135 0.791 2.041 15.601 1.00 0.00 H new ATOM 0 HD2 LYS A 135 1.163 2.919 17.945 1.00 0.00 H new ATOM 0 HD3 LYS A 135 0.128 4.284 17.576 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -1.237 1.840 16.784 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.670 1.657 18.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -2.850 2.704 18.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -1.704 3.788 18.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -2.253 3.965 17.398 1.00 0.00 H new ATOM 2093 N ALA A 136 1.432 6.726 14.787 1.00 0.00 N ATOM 2094 CA ALA A 136 0.687 7.977 14.862 1.00 0.00 C ATOM 2095 C ALA A 136 0.380 8.505 13.466 1.00 0.00 C ATOM 2096 O ALA A 136 -0.683 9.081 13.231 1.00 0.00 O ATOM 2097 CB ALA A 136 1.501 9.017 15.633 1.00 0.00 C ATOM 0 H ALA A 136 2.323 6.734 15.283 1.00 0.00 H new ATOM 0 HA ALA A 136 -0.254 7.789 15.380 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.941 9.951 15.687 1.00 0.00 H new ATOM 0 HB2 ALA A 136 1.696 8.652 16.641 1.00 0.00 H new ATOM 0 HB3 ALA A 136 2.447 9.191 15.121 1.00 0.00 H new ATOM 2103 N LEU A 137 1.309 8.298 12.540 1.00 0.00 N ATOM 2104 CA LEU A 137 1.130 8.743 11.179 1.00 0.00 C ATOM 2105 C LEU A 137 -0.020 7.979 10.538 1.00 0.00 C ATOM 2106 O LEU A 137 -1.030 8.565 10.142 1.00 0.00 O ATOM 2107 CB LEU A 137 2.432 8.469 10.440 1.00 0.00 C ATOM 2108 CG LEU A 137 2.801 9.639 9.525 1.00 0.00 C ATOM 2109 CD1 LEU A 137 4.150 9.364 8.860 1.00 0.00 C ATOM 2110 CD2 LEU A 137 1.734 9.795 8.460 1.00 0.00 C ATOM 0 H LEU A 137 2.194 7.822 12.716 1.00 0.00 H new ATOM 0 HA LEU A 137 0.890 9.805 11.140 1.00 0.00 H new ATOM 0 HB2 LEU A 137 3.233 8.298 11.159 1.00 0.00 H new ATOM 0 HB3 LEU A 137 2.334 7.558 9.850 1.00 0.00 H new ATOM 0 HG LEU A 137 2.869 10.555 10.112 1.00 0.00 H new ATOM 0 HD11 LEU A 137 4.411 10.198 8.209 1.00 0.00 H new ATOM 0 HD12 LEU A 137 4.916 9.248 9.626 1.00 0.00 H new ATOM 0 HD13 LEU A 137 4.085 8.450 8.270 1.00 0.00 H new ATOM 0 HD21 LEU A 137 1.992 10.627 7.805 1.00 0.00 H new ATOM 0 HD22 LEU A 137 1.669 8.879 7.873 1.00 0.00 H new ATOM 0 HD23 LEU A 137 0.772 9.991 8.934 1.00 0.00 H new ATOM 2122 N ALA A 138 0.144 6.670 10.441 1.00 0.00 N ATOM 2123 CA ALA A 138 -0.883 5.830 9.847 1.00 0.00 C ATOM 2124 C ALA A 138 -2.232 6.083 10.526 1.00 0.00 C ATOM 2125 O ALA A 138 -3.273 6.116 9.868 1.00 0.00 O ATOM 2126 CB ALA A 138 -0.483 4.351 9.967 1.00 0.00 C ATOM 0 H ALA A 138 0.972 6.169 10.763 1.00 0.00 H new ATOM 0 HA ALA A 138 -0.980 6.079 8.790 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.257 3.727 9.520 1.00 0.00 H new ATOM 0 HB2 ALA A 138 0.461 4.186 9.447 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -0.369 4.089 11.019 1.00 0.00 H new ATOM 2132 N GLU A 139 -2.209 6.282 11.842 1.00 0.00 N ATOM 2133 CA GLU A 139 -3.434 6.545 12.583 1.00 0.00 C ATOM 2134 C GLU A 139 -4.033 7.884 12.156 1.00 0.00 C ATOM 2135 O GLU A 139 -5.253 8.054 12.148 1.00 0.00 O ATOM 2136 CB GLU A 139 -3.137 6.529 14.095 1.00 0.00 C ATOM 2137 CG GLU A 139 -3.825 7.697 14.801 1.00 0.00 C ATOM 2138 CD GLU A 139 -3.664 7.552 16.311 1.00 0.00 C ATOM 2139 OE1 GLU A 139 -4.470 6.855 16.907 1.00 0.00 O ATOM 2140 OE2 GLU A 139 -2.739 8.136 16.848 1.00 0.00 O ATOM 0 H GLU A 139 -1.362 6.266 12.410 1.00 0.00 H new ATOM 0 HA GLU A 139 -4.164 5.766 12.364 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -3.477 5.588 14.526 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -2.061 6.584 14.258 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.393 8.641 14.469 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -4.883 7.721 14.539 1.00 0.00 H new ATOM 2147 N SER A 140 -3.169 8.833 11.813 1.00 0.00 N ATOM 2148 CA SER A 140 -3.625 10.155 11.401 1.00 0.00 C ATOM 2149 C SER A 140 -4.440 10.071 10.115 1.00 0.00 C ATOM 2150 O SER A 140 -5.510 10.669 10.008 1.00 0.00 O ATOM 2151 CB SER A 140 -2.427 11.078 11.188 1.00 0.00 C ATOM 2152 OG SER A 140 -2.222 11.267 9.795 1.00 0.00 O ATOM 0 H SER A 140 -2.156 8.713 11.812 1.00 0.00 H new ATOM 0 HA SER A 140 -4.259 10.558 12.190 1.00 0.00 H new ATOM 0 HB2 SER A 140 -2.601 12.037 11.675 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.535 10.647 11.643 1.00 0.00 H new ATOM 0 HG SER A 140 -1.717 10.509 9.433 1.00 0.00 H new ATOM 2158 N TRP A 141 -3.931 9.324 9.141 1.00 0.00 N ATOM 2159 CA TRP A 141 -4.631 9.173 7.870 1.00 0.00 C ATOM 2160 C TRP A 141 -5.592 7.994 7.922 1.00 0.00 C ATOM 2161 O TRP A 141 -6.248 7.679 6.931 1.00 0.00 O ATOM 2162 CB TRP A 141 -3.633 8.948 6.736 1.00 0.00 C ATOM 2163 CG TRP A 141 -2.548 9.978 6.785 1.00 0.00 C ATOM 2164 CD1 TRP A 141 -1.233 9.703 6.941 1.00 0.00 C ATOM 2165 CD2 TRP A 141 -2.650 11.432 6.670 1.00 0.00 C ATOM 2166 NE1 TRP A 141 -0.521 10.889 6.931 1.00 0.00 N ATOM 2167 CE2 TRP A 141 -1.348 11.982 6.769 1.00 0.00 C ATOM 2168 CE3 TRP A 141 -3.730 12.320 6.493 1.00 0.00 C ATOM 2169 CZ2 TRP A 141 -1.126 13.358 6.697 1.00 0.00 C ATOM 2170 CZ3 TRP A 141 -3.508 13.705 6.420 1.00 0.00 C ATOM 2171 CH2 TRP A 141 -2.210 14.222 6.523 1.00 0.00 C ATOM 0 H TRP A 141 -3.047 8.819 9.205 1.00 0.00 H new ATOM 0 HA TRP A 141 -5.193 10.089 7.688 1.00 0.00 H new ATOM 0 HB2 TRP A 141 -3.201 7.951 6.816 1.00 0.00 H new ATOM 0 HB3 TRP A 141 -4.147 8.997 5.776 1.00 0.00 H new ATOM 0 HD1 TRP A 141 -0.808 8.717 7.055 1.00 0.00 H new ATOM 0 HE1 TRP A 141 0.492 10.948 7.031 1.00 0.00 H new ATOM 0 HE3 TRP A 141 -4.735 11.933 6.413 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 -0.123 13.752 6.775 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 -4.343 14.376 6.284 1.00 0.00 H new ATOM 0 HH2 TRP A 141 -2.047 15.288 6.468 1.00 0.00 H new ATOM 2182 N ASN A 142 -5.647 7.339 9.078 1.00 0.00 N ATOM 2183 CA ASN A 142 -6.508 6.181 9.270 1.00 0.00 C ATOM 2184 C ASN A 142 -5.995 5.021 8.434 1.00 0.00 C ATOM 2185 O ASN A 142 -6.760 4.192 7.941 1.00 0.00 O ATOM 2186 CB ASN A 142 -7.944 6.515 8.884 1.00 0.00 C ATOM 2187 CG ASN A 142 -8.341 7.866 9.469 1.00 0.00 C ATOM 2188 OD1 ASN A 142 -8.939 8.691 8.778 1.00 0.00 O ATOM 2189 ND2 ASN A 142 -8.044 8.142 10.709 1.00 0.00 N ATOM 0 H ASN A 142 -5.100 7.595 9.900 1.00 0.00 H new ATOM 0 HA ASN A 142 -6.493 5.899 10.323 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -8.042 6.537 7.799 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -8.617 5.739 9.249 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -8.307 9.043 11.108 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -7.549 7.457 11.279 1.00 0.00 H new ATOM 2196 N ALA A 143 -4.680 4.983 8.291 1.00 0.00 N ATOM 2197 CA ALA A 143 -4.014 3.944 7.529 1.00 0.00 C ATOM 2198 C ALA A 143 -3.438 2.907 8.468 1.00 0.00 C ATOM 2199 O ALA A 143 -3.394 3.114 9.681 1.00 0.00 O ATOM 2200 CB ALA A 143 -2.881 4.557 6.711 1.00 0.00 C ATOM 0 H ALA A 143 -4.047 5.671 8.700 1.00 0.00 H new ATOM 0 HA ALA A 143 -4.738 3.472 6.864 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -2.381 3.775 6.139 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -3.288 5.303 6.028 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -2.164 5.031 7.381 1.00 0.00 H new ATOM 2206 N ALA A 144 -3.003 1.796 7.902 1.00 0.00 N ATOM 2207 CA ALA A 144 -2.429 0.726 8.707 1.00 0.00 C ATOM 2208 C ALA A 144 -0.912 0.646 8.525 1.00 0.00 C ATOM 2209 O ALA A 144 -0.404 0.698 7.406 1.00 0.00 O ATOM 2210 CB ALA A 144 -3.082 -0.592 8.325 1.00 0.00 C ATOM 0 H ALA A 144 -3.034 1.609 6.900 1.00 0.00 H new ATOM 0 HA ALA A 144 -2.620 0.937 9.759 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -2.656 -1.396 8.925 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.155 -0.533 8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -2.904 -0.794 7.269 1.00 0.00 H new ATOM 2216 N PHE A 145 -0.199 0.531 9.643 1.00 0.00 N ATOM 2217 CA PHE A 145 1.258 0.459 9.634 1.00 0.00 C ATOM 2218 C PHE A 145 1.705 -1.001 9.702 1.00 0.00 C ATOM 2219 O PHE A 145 1.296 -1.748 10.590 1.00 0.00 O ATOM 2220 CB PHE A 145 1.777 1.249 10.844 1.00 0.00 C ATOM 2221 CG PHE A 145 3.271 1.089 11.010 1.00 0.00 C ATOM 2222 CD1 PHE A 145 3.826 -0.115 11.469 1.00 0.00 C ATOM 2223 CD2 PHE A 145 4.103 2.170 10.715 1.00 0.00 C ATOM 2224 CE1 PHE A 145 5.209 -0.231 11.619 1.00 0.00 C ATOM 2225 CE2 PHE A 145 5.490 2.053 10.870 1.00 0.00 C ATOM 2226 CZ PHE A 145 6.042 0.850 11.316 1.00 0.00 C ATOM 0 H PHE A 145 -0.613 0.485 10.574 1.00 0.00 H new ATOM 0 HA PHE A 145 1.661 0.887 8.716 1.00 0.00 H new ATOM 0 HB2 PHE A 145 1.534 2.305 10.722 1.00 0.00 H new ATOM 0 HB3 PHE A 145 1.271 0.908 11.747 1.00 0.00 H new ATOM 0 HD1 PHE A 145 3.184 -0.951 11.706 1.00 0.00 H new ATOM 0 HD2 PHE A 145 3.676 3.099 10.366 1.00 0.00 H new ATOM 0 HE1 PHE A 145 5.637 -1.158 11.970 1.00 0.00 H new ATOM 0 HE2 PHE A 145 6.132 2.892 10.645 1.00 0.00 H new ATOM 0 HZ PHE A 145 7.112 0.755 11.427 1.00 0.00 H new ATOM 2236 N LEU A 146 2.499 -1.412 8.710 1.00 0.00 N ATOM 2237 CA LEU A 146 2.963 -2.788 8.582 1.00 0.00 C ATOM 2238 C LEU A 146 4.454 -2.831 8.262 1.00 0.00 C ATOM 2239 O LEU A 146 4.915 -2.069 7.439 1.00 0.00 O ATOM 2240 CB LEU A 146 2.207 -3.441 7.428 1.00 0.00 C ATOM 2241 CG LEU A 146 1.172 -4.435 7.944 1.00 0.00 C ATOM 2242 CD1 LEU A 146 1.854 -5.607 8.628 1.00 0.00 C ATOM 2243 CD2 LEU A 146 0.254 -3.738 8.917 1.00 0.00 C ATOM 0 H LEU A 146 2.837 -0.794 7.972 1.00 0.00 H new ATOM 0 HA LEU A 146 2.788 -3.311 9.522 1.00 0.00 H new ATOM 0 HB2 LEU A 146 1.713 -2.674 6.832 1.00 0.00 H new ATOM 0 HB3 LEU A 146 2.911 -3.952 6.771 1.00 0.00 H new ATOM 0 HG LEU A 146 0.594 -4.816 7.102 1.00 0.00 H new ATOM 0 HD11 LEU A 146 1.100 -6.306 8.990 1.00 0.00 H new ATOM 0 HD12 LEU A 146 2.507 -6.113 7.917 1.00 0.00 H new ATOM 0 HD13 LEU A 146 2.445 -5.244 9.469 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -0.488 -4.445 9.288 1.00 0.00 H new ATOM 0 HD22 LEU A 146 0.836 -3.351 9.753 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.251 -2.914 8.414 1.00 0.00 H new ATOM 2255 N GLU A 147 5.198 -3.728 8.904 1.00 0.00 N ATOM 2256 CA GLU A 147 6.638 -3.853 8.632 1.00 0.00 C ATOM 2257 C GLU A 147 6.964 -5.302 8.286 1.00 0.00 C ATOM 2258 O GLU A 147 6.874 -6.190 9.134 1.00 0.00 O ATOM 2259 CB GLU A 147 7.465 -3.401 9.844 1.00 0.00 C ATOM 2260 CG GLU A 147 8.963 -3.521 9.522 1.00 0.00 C ATOM 2261 CD GLU A 147 9.746 -2.384 10.182 1.00 0.00 C ATOM 2262 OE1 GLU A 147 9.281 -1.250 10.120 1.00 0.00 O ATOM 2263 OE2 GLU A 147 10.803 -2.661 10.741 1.00 0.00 O ATOM 0 H GLU A 147 4.840 -4.373 9.608 1.00 0.00 H new ATOM 0 HA GLU A 147 6.893 -3.210 7.790 1.00 0.00 H new ATOM 0 HB2 GLU A 147 7.220 -2.370 10.100 1.00 0.00 H new ATOM 0 HB3 GLU A 147 7.220 -4.012 10.712 1.00 0.00 H new ATOM 0 HG2 GLU A 147 9.340 -4.482 9.872 1.00 0.00 H new ATOM 0 HG3 GLU A 147 9.112 -3.494 8.443 1.00 0.00 H new ATOM 2270 N SER A 148 7.319 -5.532 7.025 1.00 0.00 N ATOM 2271 CA SER A 148 7.632 -6.880 6.563 1.00 0.00 C ATOM 2272 C SER A 148 8.867 -6.882 5.671 1.00 0.00 C ATOM 2273 O SER A 148 9.532 -5.862 5.520 1.00 0.00 O ATOM 2274 CB SER A 148 6.442 -7.432 5.778 1.00 0.00 C ATOM 2275 OG SER A 148 6.084 -6.505 4.760 1.00 0.00 O ATOM 0 H SER A 148 7.397 -4.809 6.310 1.00 0.00 H new ATOM 0 HA SER A 148 7.835 -7.505 7.433 1.00 0.00 H new ATOM 0 HB2 SER A 148 6.697 -8.395 5.336 1.00 0.00 H new ATOM 0 HB3 SER A 148 5.597 -7.602 6.446 1.00 0.00 H new ATOM 0 HG SER A 148 5.855 -6.991 3.941 1.00 0.00 H new ATOM 2281 N SER A 149 9.174 -8.038 5.088 1.00 0.00 N ATOM 2282 CA SER A 149 10.337 -8.150 4.210 1.00 0.00 C ATOM 2283 C SER A 149 10.015 -9.004 2.984 1.00 0.00 C ATOM 2284 O SER A 149 9.404 -10.065 3.106 1.00 0.00 O ATOM 2285 CB SER A 149 11.505 -8.775 4.973 1.00 0.00 C ATOM 2286 OG SER A 149 11.031 -9.311 6.200 1.00 0.00 O ATOM 0 H SER A 149 8.642 -8.900 5.205 1.00 0.00 H new ATOM 0 HA SER A 149 10.609 -7.149 3.875 1.00 0.00 H new ATOM 0 HB2 SER A 149 11.967 -9.560 4.374 1.00 0.00 H new ATOM 0 HB3 SER A 149 12.273 -8.025 5.163 1.00 0.00 H new ATOM 0 HG SER A 149 11.774 -9.728 6.684 1.00 0.00 H new ATOM 2292 N ALA A 150 10.445 -8.553 1.803 1.00 0.00 N ATOM 2293 CA ALA A 150 10.210 -9.307 0.587 1.00 0.00 C ATOM 2294 C ALA A 150 10.942 -10.634 0.667 1.00 0.00 C ATOM 2295 O ALA A 150 10.547 -11.618 0.049 1.00 0.00 O ATOM 2296 CB ALA A 150 10.716 -8.522 -0.613 1.00 0.00 C ATOM 0 H ALA A 150 10.952 -7.678 1.672 1.00 0.00 H new ATOM 0 HA ALA A 150 9.140 -9.484 0.475 1.00 0.00 H new ATOM 0 HB1 ALA A 150 10.537 -9.094 -1.524 1.00 0.00 H new ATOM 0 HB2 ALA A 150 10.190 -7.569 -0.673 1.00 0.00 H new ATOM 0 HB3 ALA A 150 11.785 -8.339 -0.504 1.00 0.00 H new ATOM 2302 N LYS A 151 12.014 -10.645 1.442 1.00 0.00 N ATOM 2303 CA LYS A 151 12.806 -11.854 1.624 1.00 0.00 C ATOM 2304 C LYS A 151 12.105 -12.786 2.612 1.00 0.00 C ATOM 2305 O LYS A 151 12.632 -13.835 2.978 1.00 0.00 O ATOM 2306 CB LYS A 151 14.198 -11.494 2.151 1.00 0.00 C ATOM 2307 CG LYS A 151 15.248 -11.771 1.072 1.00 0.00 C ATOM 2308 CD LYS A 151 15.421 -13.281 0.901 1.00 0.00 C ATOM 2309 CE LYS A 151 16.759 -13.712 1.504 1.00 0.00 C ATOM 2310 NZ LYS A 151 17.871 -13.037 0.776 1.00 0.00 N ATOM 0 H LYS A 151 12.357 -9.833 1.955 1.00 0.00 H new ATOM 0 HA LYS A 151 12.910 -12.359 0.664 1.00 0.00 H new ATOM 0 HB2 LYS A 151 14.227 -10.443 2.439 1.00 0.00 H new ATOM 0 HB3 LYS A 151 14.420 -12.076 3.046 1.00 0.00 H new ATOM 0 HG2 LYS A 151 14.942 -11.321 0.128 1.00 0.00 H new ATOM 0 HG3 LYS A 151 16.198 -11.315 1.349 1.00 0.00 H new ATOM 0 HD2 LYS A 151 14.603 -13.809 1.390 1.00 0.00 H new ATOM 0 HD3 LYS A 151 15.384 -13.545 -0.156 1.00 0.00 H new ATOM 0 HE2 LYS A 151 16.793 -13.454 2.562 1.00 0.00 H new ATOM 0 HE3 LYS A 151 16.869 -14.794 1.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 18.688 -13.678 0.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 17.557 -12.789 -0.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 18.144 -12.172 1.285 1.00 0.00 H new ATOM 2324 N GLU A 152 10.908 -12.384 3.034 1.00 0.00 N ATOM 2325 CA GLU A 152 10.121 -13.172 3.979 1.00 0.00 C ATOM 2326 C GLU A 152 8.648 -13.167 3.569 1.00 0.00 C ATOM 2327 O GLU A 152 8.037 -12.106 3.436 1.00 0.00 O ATOM 2328 CB GLU A 152 10.263 -12.591 5.388 1.00 0.00 C ATOM 2329 CG GLU A 152 10.340 -13.729 6.408 1.00 0.00 C ATOM 2330 CD GLU A 152 10.382 -13.159 7.823 1.00 0.00 C ATOM 2331 OE1 GLU A 152 11.102 -12.197 8.033 1.00 0.00 O ATOM 2332 OE2 GLU A 152 9.695 -13.696 8.677 1.00 0.00 O ATOM 0 H GLU A 152 10.462 -11.516 2.736 1.00 0.00 H new ATOM 0 HA GLU A 152 10.490 -14.198 3.973 1.00 0.00 H new ATOM 0 HB2 GLU A 152 11.159 -11.974 5.449 1.00 0.00 H new ATOM 0 HB3 GLU A 152 9.415 -11.945 5.613 1.00 0.00 H new ATOM 0 HG2 GLU A 152 9.478 -14.387 6.297 1.00 0.00 H new ATOM 0 HG3 GLU A 152 11.228 -14.334 6.224 1.00 0.00 H new ATOM 2339 N ASN A 153 8.088 -14.355 3.358 1.00 0.00 N ATOM 2340 CA ASN A 153 6.690 -14.470 2.950 1.00 0.00 C ATOM 2341 C ASN A 153 5.743 -14.262 4.126 1.00 0.00 C ATOM 2342 O ASN A 153 4.856 -13.412 4.070 1.00 0.00 O ATOM 2343 CB ASN A 153 6.439 -15.847 2.333 1.00 0.00 C ATOM 2344 CG ASN A 153 5.096 -15.858 1.608 1.00 0.00 C ATOM 2345 OD1 ASN A 153 4.725 -14.811 0.922 1.00 0.00 O flip ATOM 2346 ND2 ASN A 153 4.365 -16.847 1.669 1.00 0.00 N flip ATOM 0 H ASN A 153 8.575 -15.245 3.461 1.00 0.00 H new ATOM 0 HA ASN A 153 6.495 -13.691 2.213 1.00 0.00 H new ATOM 0 HB2 ASN A 153 7.240 -16.094 1.636 1.00 0.00 H new ATOM 0 HB3 ASN A 153 6.448 -16.610 3.111 1.00 0.00 H new ATOM 0 HD21 ASN A 153 4.656 -17.664 2.205 1.00 0.00 H new ATOM 0 HD22 ASN A 153 3.468 -16.849 1.183 1.00 0.00 H new ATOM 2353 N GLN A 154 5.929 -15.050 5.179 1.00 0.00 N ATOM 2354 CA GLN A 154 5.077 -14.950 6.362 1.00 0.00 C ATOM 2355 C GLN A 154 4.704 -13.500 6.644 1.00 0.00 C ATOM 2356 O GLN A 154 3.524 -13.159 6.734 1.00 0.00 O ATOM 2357 CB GLN A 154 5.803 -15.540 7.575 1.00 0.00 C ATOM 2358 CG GLN A 154 5.259 -14.911 8.861 1.00 0.00 C ATOM 2359 CD GLN A 154 5.621 -15.782 10.060 1.00 0.00 C ATOM 2360 OE1 GLN A 154 6.719 -16.335 10.117 1.00 0.00 O ATOM 2361 NE2 GLN A 154 4.757 -15.935 11.027 1.00 0.00 N ATOM 0 H GLN A 154 6.657 -15.762 5.240 1.00 0.00 H new ATOM 0 HA GLN A 154 4.162 -15.511 6.173 1.00 0.00 H new ATOM 0 HB2 GLN A 154 5.666 -16.621 7.602 1.00 0.00 H new ATOM 0 HB3 GLN A 154 6.874 -15.356 7.494 1.00 0.00 H new ATOM 0 HG2 GLN A 154 5.672 -13.911 8.990 1.00 0.00 H new ATOM 0 HG3 GLN A 154 4.177 -14.803 8.793 1.00 0.00 H new ATOM 0 HE21 GLN A 154 3.848 -15.475 10.976 1.00 0.00 H new ATOM 0 HE22 GLN A 154 4.991 -16.514 11.833 1.00 0.00 H new ATOM 2370 N THR A 155 5.713 -12.653 6.792 1.00 0.00 N ATOM 2371 CA THR A 155 5.473 -11.245 7.073 1.00 0.00 C ATOM 2372 C THR A 155 4.567 -10.639 6.005 1.00 0.00 C ATOM 2373 O THR A 155 3.604 -9.935 6.314 1.00 0.00 O ATOM 2374 CB THR A 155 6.795 -10.483 7.117 1.00 0.00 C ATOM 2375 OG1 THR A 155 7.420 -10.538 5.844 1.00 0.00 O ATOM 2376 CG2 THR A 155 7.712 -11.101 8.164 1.00 0.00 C ATOM 0 H THR A 155 6.697 -12.913 6.723 1.00 0.00 H new ATOM 0 HA THR A 155 4.982 -11.165 8.043 1.00 0.00 H new ATOM 0 HB THR A 155 6.600 -9.443 7.380 1.00 0.00 H new ATOM 0 HG1 THR A 155 7.363 -11.450 5.491 1.00 0.00 H new ATOM 0 HG21 THR A 155 8.654 -10.553 8.191 1.00 0.00 H new ATOM 0 HG22 THR A 155 7.234 -11.050 9.142 1.00 0.00 H new ATOM 0 HG23 THR A 155 7.905 -12.143 7.909 1.00 0.00 H new ATOM 2384 N ALA A 156 4.880 -10.931 4.750 1.00 0.00 N ATOM 2385 CA ALA A 156 4.091 -10.427 3.634 1.00 0.00 C ATOM 2386 C ALA A 156 2.634 -10.803 3.819 1.00 0.00 C ATOM 2387 O ALA A 156 1.759 -9.945 3.936 1.00 0.00 O ATOM 2388 CB ALA A 156 4.593 -11.045 2.335 1.00 0.00 C ATOM 0 H ALA A 156 5.673 -11.513 4.479 1.00 0.00 H new ATOM 0 HA ALA A 156 4.189 -9.342 3.595 1.00 0.00 H new ATOM 0 HB1 ALA A 156 4.002 -10.668 1.500 1.00 0.00 H new ATOM 0 HB2 ALA A 156 5.640 -10.781 2.187 1.00 0.00 H new ATOM 0 HB3 ALA A 156 4.496 -12.129 2.387 1.00 0.00 H new ATOM 2394 N VAL A 157 2.395 -12.101 3.843 1.00 0.00 N ATOM 2395 CA VAL A 157 1.049 -12.625 4.015 1.00 0.00 C ATOM 2396 C VAL A 157 0.310 -11.848 5.097 1.00 0.00 C ATOM 2397 O VAL A 157 -0.880 -11.558 4.967 1.00 0.00 O ATOM 2398 CB VAL A 157 1.121 -14.100 4.398 1.00 0.00 C ATOM 2399 CG1 VAL A 157 -0.292 -14.664 4.542 1.00 0.00 C ATOM 2400 CG2 VAL A 157 1.867 -14.867 3.309 1.00 0.00 C ATOM 0 H VAL A 157 3.117 -12.815 3.745 1.00 0.00 H new ATOM 0 HA VAL A 157 0.506 -12.517 3.076 1.00 0.00 H new ATOM 0 HB VAL A 157 1.648 -14.204 5.347 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -0.237 -15.718 4.816 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -0.826 -14.115 5.318 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -0.823 -14.562 3.595 1.00 0.00 H new ATOM 0 HG21 VAL A 157 1.921 -15.922 3.579 1.00 0.00 H new ATOM 0 HG22 VAL A 157 1.338 -14.761 2.362 1.00 0.00 H new ATOM 0 HG23 VAL A 157 2.876 -14.466 3.208 1.00 0.00 H new ATOM 2410 N ASP A 158 1.026 -11.518 6.163 1.00 0.00 N ATOM 2411 CA ASP A 158 0.433 -10.777 7.269 1.00 0.00 C ATOM 2412 C ASP A 158 0.036 -9.375 6.823 1.00 0.00 C ATOM 2413 O ASP A 158 -0.946 -8.813 7.308 1.00 0.00 O ATOM 2414 CB ASP A 158 1.426 -10.685 8.429 1.00 0.00 C ATOM 2415 CG ASP A 158 0.675 -10.613 9.754 1.00 0.00 C ATOM 2416 OD1 ASP A 158 0.113 -9.567 10.038 1.00 0.00 O ATOM 2417 OD2 ASP A 158 0.673 -11.603 10.466 1.00 0.00 O ATOM 0 H ASP A 158 2.012 -11.749 6.286 1.00 0.00 H new ATOM 0 HA ASP A 158 -0.461 -11.307 7.598 1.00 0.00 H new ATOM 0 HB2 ASP A 158 2.087 -11.552 8.423 1.00 0.00 H new ATOM 0 HB3 ASP A 158 2.056 -9.803 8.310 1.00 0.00 H new ATOM 2422 N VAL A 159 0.809 -8.812 5.900 1.00 0.00 N ATOM 2423 CA VAL A 159 0.541 -7.484 5.400 1.00 0.00 C ATOM 2424 C VAL A 159 -0.712 -7.498 4.532 1.00 0.00 C ATOM 2425 O VAL A 159 -1.496 -6.548 4.535 1.00 0.00 O ATOM 2426 CB VAL A 159 1.768 -6.989 4.616 1.00 0.00 C ATOM 2427 CG1 VAL A 159 1.582 -5.538 4.199 1.00 0.00 C ATOM 2428 CG2 VAL A 159 3.018 -7.077 5.496 1.00 0.00 C ATOM 0 H VAL A 159 1.626 -9.262 5.487 1.00 0.00 H new ATOM 0 HA VAL A 159 0.359 -6.799 6.228 1.00 0.00 H new ATOM 0 HB VAL A 159 1.881 -7.616 3.732 1.00 0.00 H new ATOM 0 HG11 VAL A 159 2.459 -5.203 3.645 1.00 0.00 H new ATOM 0 HG12 VAL A 159 0.699 -5.452 3.566 1.00 0.00 H new ATOM 0 HG13 VAL A 159 1.455 -4.918 5.086 1.00 0.00 H new ATOM 0 HG21 VAL A 159 3.884 -6.725 4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 159 2.883 -6.457 6.382 1.00 0.00 H new ATOM 0 HG23 VAL A 159 3.178 -8.112 5.798 1.00 0.00 H new ATOM 2438 N PHE A 160 -0.898 -8.587 3.805 1.00 0.00 N ATOM 2439 CA PHE A 160 -2.067 -8.722 2.948 1.00 0.00 C ATOM 2440 C PHE A 160 -3.346 -8.750 3.785 1.00 0.00 C ATOM 2441 O PHE A 160 -4.167 -7.842 3.707 1.00 0.00 O ATOM 2442 CB PHE A 160 -1.962 -10.010 2.128 1.00 0.00 C ATOM 2443 CG PHE A 160 -3.298 -10.317 1.489 1.00 0.00 C ATOM 2444 CD1 PHE A 160 -3.878 -9.395 0.612 1.00 0.00 C ATOM 2445 CD2 PHE A 160 -3.954 -11.523 1.773 1.00 0.00 C ATOM 2446 CE1 PHE A 160 -5.115 -9.676 0.017 1.00 0.00 C ATOM 2447 CE2 PHE A 160 -5.190 -11.802 1.178 1.00 0.00 C ATOM 2448 CZ PHE A 160 -5.770 -10.879 0.300 1.00 0.00 C ATOM 0 H PHE A 160 -0.262 -9.384 3.789 1.00 0.00 H new ATOM 0 HA PHE A 160 -2.106 -7.864 2.277 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -1.197 -9.902 1.360 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -1.656 -10.837 2.769 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -3.372 -8.466 0.393 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -3.506 -12.236 2.450 1.00 0.00 H new ATOM 0 HE1 PHE A 160 -5.563 -8.964 -0.660 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -5.697 -12.730 1.397 1.00 0.00 H new ATOM 0 HZ PHE A 160 -6.723 -11.096 -0.159 1.00 0.00 H new ATOM 2458 N ARG A 161 -3.515 -9.788 4.593 1.00 0.00 N ATOM 2459 CA ARG A 161 -4.710 -9.886 5.423 1.00 0.00 C ATOM 2460 C ARG A 161 -4.966 -8.576 6.158 1.00 0.00 C ATOM 2461 O ARG A 161 -6.104 -8.099 6.231 1.00 0.00 O ATOM 2462 CB ARG A 161 -4.568 -11.027 6.426 1.00 0.00 C ATOM 2463 CG ARG A 161 -5.816 -11.087 7.311 1.00 0.00 C ATOM 2464 CD ARG A 161 -6.234 -12.546 7.507 1.00 0.00 C ATOM 2465 NE ARG A 161 -6.808 -13.080 6.276 1.00 0.00 N ATOM 2466 CZ ARG A 161 -8.119 -13.045 6.042 1.00 0.00 C ATOM 2467 NH1 ARG A 161 -8.934 -12.513 6.914 1.00 0.00 N ATOM 2468 NH2 ARG A 161 -8.593 -13.540 4.932 1.00 0.00 N ATOM 0 H ARG A 161 -2.855 -10.560 4.692 1.00 0.00 H new ATOM 0 HA ARG A 161 -5.560 -10.090 4.772 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -4.436 -11.973 5.901 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -3.680 -10.877 7.040 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -5.613 -10.623 8.276 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -6.628 -10.524 6.851 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -5.370 -13.142 7.802 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -6.961 -12.617 8.316 1.00 0.00 H new ATOM 0 HE ARG A 161 -6.189 -13.491 5.577 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -8.568 -12.121 7.781 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -9.937 -12.490 6.727 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -7.960 -13.952 4.246 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -9.596 -13.515 4.750 1.00 0.00 H new ATOM 2482 N ARG A 162 -3.904 -7.990 6.697 1.00 0.00 N ATOM 2483 CA ARG A 162 -4.031 -6.733 7.416 1.00 0.00 C ATOM 2484 C ARG A 162 -4.624 -5.658 6.510 1.00 0.00 C ATOM 2485 O ARG A 162 -5.357 -4.785 6.969 1.00 0.00 O ATOM 2486 CB ARG A 162 -2.662 -6.274 7.920 1.00 0.00 C ATOM 2487 CG ARG A 162 -2.257 -7.107 9.138 1.00 0.00 C ATOM 2488 CD ARG A 162 -2.702 -6.396 10.417 1.00 0.00 C ATOM 2489 NE ARG A 162 -1.723 -5.383 10.799 1.00 0.00 N ATOM 2490 CZ ARG A 162 -2.065 -4.352 11.566 1.00 0.00 C ATOM 2491 NH1 ARG A 162 -3.294 -4.231 11.989 1.00 0.00 N ATOM 2492 NH2 ARG A 162 -1.172 -3.459 11.896 1.00 0.00 N ATOM 0 H ARG A 162 -2.955 -8.362 6.650 1.00 0.00 H new ATOM 0 HA ARG A 162 -4.696 -6.890 8.265 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -1.918 -6.381 7.130 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -2.696 -5.217 8.185 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -2.712 -8.096 9.082 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -1.177 -7.253 9.148 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -3.676 -5.931 10.263 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -2.819 -7.121 11.223 1.00 0.00 H new ATOM 0 HE ARG A 162 -0.760 -5.467 10.472 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -3.993 -4.928 11.731 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -3.555 -3.440 12.577 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -0.212 -3.552 11.565 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -1.435 -2.668 12.484 1.00 0.00 H new ATOM 2506 N ILE A 163 -4.307 -5.721 5.221 1.00 0.00 N ATOM 2507 CA ILE A 163 -4.832 -4.728 4.292 1.00 0.00 C ATOM 2508 C ILE A 163 -6.350 -4.876 4.174 1.00 0.00 C ATOM 2509 O ILE A 163 -7.069 -3.889 4.018 1.00 0.00 O ATOM 2510 CB ILE A 163 -4.141 -4.861 2.914 1.00 0.00 C ATOM 2511 CG1 ILE A 163 -3.886 -3.453 2.324 1.00 0.00 C ATOM 2512 CG2 ILE A 163 -5.022 -5.662 1.934 1.00 0.00 C ATOM 2513 CD1 ILE A 163 -3.888 -3.493 0.788 1.00 0.00 C ATOM 0 H ILE A 163 -3.704 -6.430 4.804 1.00 0.00 H new ATOM 0 HA ILE A 163 -4.618 -3.730 4.674 1.00 0.00 H new ATOM 0 HB ILE A 163 -3.197 -5.388 3.053 1.00 0.00 H new ATOM 0 HG12 ILE A 163 -4.653 -2.763 2.675 1.00 0.00 H new ATOM 0 HG13 ILE A 163 -2.929 -3.073 2.681 1.00 0.00 H new ATOM 0 HG21 ILE A 163 -4.516 -5.742 0.972 1.00 0.00 H new ATOM 0 HG22 ILE A 163 -5.199 -6.660 2.336 1.00 0.00 H new ATOM 0 HG23 ILE A 163 -5.975 -5.151 1.801 1.00 0.00 H new ATOM 0 HD11 ILE A 163 -3.707 -2.492 0.398 1.00 0.00 H new ATOM 0 HD12 ILE A 163 -3.104 -4.165 0.441 1.00 0.00 H new ATOM 0 HD13 ILE A 163 -4.855 -3.851 0.435 1.00 0.00 H new ATOM 2525 N ILE A 164 -6.824 -6.118 4.262 1.00 0.00 N ATOM 2526 CA ILE A 164 -8.256 -6.391 4.164 1.00 0.00 C ATOM 2527 C ILE A 164 -9.019 -5.746 5.307 1.00 0.00 C ATOM 2528 O ILE A 164 -10.032 -5.075 5.100 1.00 0.00 O ATOM 2529 CB ILE A 164 -8.502 -7.893 4.168 1.00 0.00 C ATOM 2530 CG1 ILE A 164 -7.567 -8.541 3.151 1.00 0.00 C ATOM 2531 CG2 ILE A 164 -9.958 -8.177 3.791 1.00 0.00 C ATOM 2532 CD1 ILE A 164 -7.937 -10.010 2.997 1.00 0.00 C ATOM 0 H ILE A 164 -6.242 -6.945 4.400 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.616 -5.964 3.228 1.00 0.00 H new ATOM 0 HB ILE A 164 -8.310 -8.301 5.160 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.645 -8.031 2.191 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -6.532 -8.447 3.479 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -10.132 -9.253 3.795 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -10.621 -7.700 4.513 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -10.160 -7.780 2.796 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -7.272 -10.479 2.271 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -7.837 -10.513 3.959 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -8.967 -10.091 2.651 1.00 0.00 H new ATOM 2544 N LEU A 165 -8.524 -5.945 6.509 1.00 0.00 N ATOM 2545 CA LEU A 165 -9.160 -5.373 7.675 1.00 0.00 C ATOM 2546 C LEU A 165 -9.288 -3.867 7.498 1.00 0.00 C ATOM 2547 O LEU A 165 -10.390 -3.315 7.519 1.00 0.00 O ATOM 2548 CB LEU A 165 -8.313 -5.741 8.889 1.00 0.00 C ATOM 2549 CG LEU A 165 -8.191 -4.591 9.894 1.00 0.00 C ATOM 2550 CD1 LEU A 165 -8.545 -5.137 11.248 1.00 0.00 C ATOM 2551 CD2 LEU A 165 -6.762 -4.068 9.856 1.00 0.00 C ATOM 0 H LEU A 165 -7.688 -6.495 6.704 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.168 -5.763 7.815 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -8.752 -6.607 9.385 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.317 -6.035 8.557 1.00 0.00 H new ATOM 0 HG LEU A 165 -8.860 -3.764 9.657 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -8.469 -4.344 11.992 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -9.565 -5.521 11.230 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -7.858 -5.943 11.506 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -6.656 -3.248 10.566 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -6.074 -4.870 10.123 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -6.532 -3.711 8.852 1.00 0.00 H new ATOM 2563 N GLU A 166 -8.161 -3.199 7.335 1.00 0.00 N ATOM 2564 CA GLU A 166 -8.184 -1.762 7.169 1.00 0.00 C ATOM 2565 C GLU A 166 -9.163 -1.410 6.079 1.00 0.00 C ATOM 2566 O GLU A 166 -9.705 -0.308 6.036 1.00 0.00 O ATOM 2567 CB GLU A 166 -6.790 -1.234 6.827 1.00 0.00 C ATOM 2568 CG GLU A 166 -6.758 0.284 7.010 1.00 0.00 C ATOM 2569 CD GLU A 166 -5.905 0.921 5.919 1.00 0.00 C ATOM 2570 OE1 GLU A 166 -5.001 0.258 5.439 1.00 0.00 O ATOM 2571 OE2 GLU A 166 -6.169 2.063 5.578 1.00 0.00 O ATOM 0 H GLU A 166 -7.233 -3.622 7.314 1.00 0.00 H new ATOM 0 HA GLU A 166 -8.496 -1.296 8.104 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -6.045 -1.704 7.469 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -6.534 -1.492 5.799 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -7.771 0.685 6.972 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -6.353 0.532 7.991 1.00 0.00 H new ATOM 2578 N ALA A 167 -9.396 -2.367 5.207 1.00 0.00 N ATOM 2579 CA ALA A 167 -10.331 -2.160 4.118 1.00 0.00 C ATOM 2580 C ALA A 167 -11.752 -2.124 4.655 1.00 0.00 C ATOM 2581 O ALA A 167 -12.619 -1.435 4.115 1.00 0.00 O ATOM 2582 CB ALA A 167 -10.196 -3.281 3.095 1.00 0.00 C ATOM 0 H ALA A 167 -8.957 -3.287 5.228 1.00 0.00 H new ATOM 0 HA ALA A 167 -10.106 -1.208 3.636 1.00 0.00 H new ATOM 0 HB1 ALA A 167 -10.902 -3.117 2.281 1.00 0.00 H new ATOM 0 HB2 ALA A 167 -9.181 -3.291 2.698 1.00 0.00 H new ATOM 0 HB3 ALA A 167 -10.409 -4.237 3.573 1.00 0.00 H new ATOM 2588 N GLU A 168 -11.979 -2.869 5.729 1.00 0.00 N ATOM 2589 CA GLU A 168 -13.306 -2.918 6.338 1.00 0.00 C ATOM 2590 C GLU A 168 -13.636 -1.601 7.027 1.00 0.00 C ATOM 2591 O GLU A 168 -14.665 -0.985 6.748 1.00 0.00 O ATOM 2592 CB GLU A 168 -13.400 -4.073 7.340 1.00 0.00 C ATOM 2593 CG GLU A 168 -14.208 -5.217 6.724 1.00 0.00 C ATOM 2594 CD GLU A 168 -13.542 -5.692 5.435 1.00 0.00 C ATOM 2595 OE1 GLU A 168 -13.825 -5.116 4.396 1.00 0.00 O ATOM 2596 OE2 GLU A 168 -12.760 -6.625 5.505 1.00 0.00 O ATOM 0 H GLU A 168 -11.274 -3.441 6.193 1.00 0.00 H new ATOM 0 HA GLU A 168 -14.033 -3.085 5.543 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -12.402 -4.420 7.606 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -13.874 -3.733 8.260 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -14.281 -6.043 7.431 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -15.225 -4.884 6.516 1.00 0.00 H new ATOM 2603 N LYS A 169 -12.762 -1.173 7.930 1.00 0.00 N ATOM 2604 CA LYS A 169 -12.984 0.077 8.653 1.00 0.00 C ATOM 2605 C LYS A 169 -13.068 1.251 7.681 1.00 0.00 C ATOM 2606 O LYS A 169 -14.001 2.054 7.733 1.00 0.00 O ATOM 2607 CB LYS A 169 -11.843 0.316 9.645 1.00 0.00 C ATOM 2608 CG LYS A 169 -12.382 1.038 10.882 1.00 0.00 C ATOM 2609 CD LYS A 169 -13.026 2.360 10.462 1.00 0.00 C ATOM 2610 CE LYS A 169 -13.105 3.295 11.672 1.00 0.00 C ATOM 2611 NZ LYS A 169 -14.181 4.302 11.454 1.00 0.00 N ATOM 0 H LYS A 169 -11.903 -1.664 8.178 1.00 0.00 H new ATOM 0 HA LYS A 169 -13.927 -0.001 9.194 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -11.393 -0.634 9.933 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -11.059 0.911 9.177 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -13.113 0.411 11.392 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -11.573 1.224 11.589 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -12.443 2.825 9.667 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -14.024 2.180 10.062 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -13.308 2.721 12.576 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -12.148 3.796 11.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -14.234 4.937 12.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -13.969 4.858 10.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -15.092 3.816 11.333 1.00 0.00 H new ATOM 2625 N ILE A 170 -12.084 1.339 6.795 1.00 0.00 N ATOM 2626 CA ILE A 170 -12.039 2.411 5.806 1.00 0.00 C ATOM 2627 C ILE A 170 -13.377 2.543 5.082 1.00 0.00 C ATOM 2628 O ILE A 170 -13.863 3.656 4.856 1.00 0.00 O ATOM 2629 CB ILE A 170 -10.941 2.113 4.789 1.00 0.00 C ATOM 2630 CG1 ILE A 170 -9.565 2.257 5.458 1.00 0.00 C ATOM 2631 CG2 ILE A 170 -11.060 3.081 3.615 1.00 0.00 C ATOM 2632 CD1 ILE A 170 -9.067 3.698 5.346 1.00 0.00 C ATOM 0 H ILE A 170 -11.306 0.682 6.740 1.00 0.00 H new ATOM 0 HA ILE A 170 -11.830 3.349 6.321 1.00 0.00 H new ATOM 0 HB ILE A 170 -11.049 1.093 4.421 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -9.632 1.969 6.507 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -8.852 1.581 4.986 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -10.276 2.869 2.888 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -12.035 2.962 3.143 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -10.954 4.104 3.975 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -8.091 3.784 5.824 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -8.981 3.973 4.295 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -9.773 4.366 5.839 1.00 0.00 H new ATOM 2644 N ASP A 171 -13.966 1.408 4.713 1.00 0.00 N ATOM 2645 CA ASP A 171 -15.243 1.427 4.007 1.00 0.00 C ATOM 2646 C ASP A 171 -16.341 1.964 4.914 1.00 0.00 C ATOM 2647 O ASP A 171 -17.200 2.730 4.476 1.00 0.00 O ATOM 2648 CB ASP A 171 -15.611 0.022 3.529 1.00 0.00 C ATOM 2649 CG ASP A 171 -16.685 -0.578 4.431 1.00 0.00 C ATOM 2650 OD1 ASP A 171 -17.816 -0.126 4.353 1.00 0.00 O ATOM 2651 OD2 ASP A 171 -16.363 -1.483 5.181 1.00 0.00 O ATOM 0 H ASP A 171 -13.586 0.478 4.888 1.00 0.00 H new ATOM 0 HA ASP A 171 -15.145 2.081 3.141 1.00 0.00 H new ATOM 0 HB2 ASP A 171 -15.971 0.063 2.501 1.00 0.00 H new ATOM 0 HB3 ASP A 171 -14.726 -0.614 3.532 1.00 0.00 H new ATOM 2656 N GLY A 172 -16.303 1.573 6.183 1.00 0.00 N ATOM 2657 CA GLY A 172 -17.299 2.044 7.135 1.00 0.00 C ATOM 2658 C GLY A 172 -17.378 3.564 7.097 1.00 0.00 C ATOM 2659 O GLY A 172 -18.463 4.143 7.125 1.00 0.00 O ATOM 0 H GLY A 172 -15.604 0.940 6.571 1.00 0.00 H new ATOM 0 HA2 GLY A 172 -18.272 1.615 6.897 1.00 0.00 H new ATOM 0 HA3 GLY A 172 -17.040 1.710 8.140 1.00 0.00 H new ATOM 2663 N ALA A 173 -16.213 4.202 7.022 1.00 0.00 N ATOM 2664 CA ALA A 173 -16.151 5.659 6.967 1.00 0.00 C ATOM 2665 C ALA A 173 -16.673 6.165 5.626 1.00 0.00 C ATOM 2666 O ALA A 173 -17.817 6.606 5.522 1.00 0.00 O ATOM 2667 CB ALA A 173 -14.709 6.129 7.167 1.00 0.00 C ATOM 0 H ALA A 173 -15.306 3.737 6.998 1.00 0.00 H new ATOM 0 HA ALA A 173 -16.776 6.062 7.764 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -14.672 7.218 7.124 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -14.348 5.791 8.138 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -14.079 5.714 6.381 1.00 0.00 H new ATOM 2673 N ALA A 174 -15.823 6.099 4.601 1.00 0.00 N ATOM 2674 CA ALA A 174 -16.206 6.555 3.268 1.00 0.00 C ATOM 2675 C ALA A 174 -17.649 6.172 2.952 1.00 0.00 C ATOM 2676 O ALA A 174 -18.524 7.034 2.860 1.00 0.00 O ATOM 2677 CB ALA A 174 -15.276 5.938 2.222 1.00 0.00 C ATOM 0 H ALA A 174 -14.872 5.737 4.669 1.00 0.00 H new ATOM 0 HA ALA A 174 -16.121 7.641 3.243 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -15.566 6.282 1.229 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -14.249 6.241 2.425 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -15.349 4.851 2.266 1.00 0.00 H new