USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1027 hydrogens (5 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 32 ASN : amide:sc= 0.277 K(o=0.76,f=-6.6!) USER MOD Set 1.2: A 142 LYS NZ :NH3+ -111:sc= 0.479 (180deg=-0.582) USER MOD Set 2.1: A 126 LYS NZ :NH3+ 180:sc= -0.064 (180deg=0) USER MOD Set 2.2: A 128 ASN :FLIP amide:sc= -1.55 F(o=-2.1!,f=-1.6) USER MOD Set 3.1: A 113 SER OG : rot 12:sc= 0.605 USER MOD Set 3.2: A 116 HIS : no HE2:sc= -8.5! C(o=-7.9!,f=-24!) USER MOD Set 4.1: A 72 SER OG : rot -64:sc= -1.9! USER MOD Set 4.2: A 75 THR OG1 : rot 142:sc= -0.0301! USER MOD Set 5.1: A 54 GLN :FLIP amide:sc= -1.33 F(o=-16!,f=-9.6) USER MOD Set 5.2: A 55 HIS :FLIP no HD1:sc= -8.31! C(o=-10!,f=-9.6!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 175:sc= -3.34! (180deg=-3.6!) USER MOD Single : A 29 TYR OH : rot -104:sc= 0.0235 USER MOD Single : A 30 CYS SG : rot 44:sc= -0.764 USER MOD Single : A 31 SER OG : rot 167:sc= -3.38! USER MOD Single : A 35 HIS : no HE2:sc= -7.73! C(o=-7.7!,f=-20!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -60:sc= -2.8 USER MOD Single : A 52 SER OG : rot 67:sc= 1.1 USER MOD Single : A 57 GLN : amide:sc= -1.33 K(o=-1.3,f=-15!) USER MOD Single : A 59 GLN : amide:sc= -0.692! C(o=-0.69!,f=-1.7!) USER MOD Single : A 61 SER OG : rot -59:sc= 1 USER MOD Single : A 64 SER OG : rot 72:sc= 0.974 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -161:sc= -2.8! (180deg=-3.32!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -130:sc= -3.69! (180deg=-8.85!) USER MOD Single : A 83 THR OG1 : rot 104:sc= 0.0528 USER MOD Single : A 88 TYR OH : rot 180:sc= -0.761 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 61:sc= 1.03 USER MOD Single : A 94 ASN :FLIP amide:sc= -4.59! C(o=-7!,f=-4.6!) USER MOD Single : A 97 CYS SG : rot 48:sc= -1.07 USER MOD Single : A 106 ASN : amide:sc= -0.0217 X(o=-0.022,f=-0.028) USER MOD Single : A 107 HIS :FLIP no HD1:sc= -2.98! C(o=-3.6!,f=-3!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN :FLIP amide:sc= -0.256 F(o=-1.9,f=-0.26) USER MOD Single : A 110 THR OG1 : rot 19:sc= -0.261 USER MOD Single : A 111 TYR OH : rot 13:sc= -5.2! USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN :FLIP amide:sc= -0.148 F(o=-0.69,f=-0.15) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 42:sc= 0.991 USER MOD Single : A 131 CYS SG : rot 140:sc= -0.85 USER MOD Single : A 132 LYS NZ :NH3+ 140:sc= -1.32 (180deg=-3.72!) USER MOD Single : A 137 THR OG1 : rot -1:sc= -1.03! USER MOD Single : A 138 HIS : no HD1:sc= -2.87 K(o=-2.9,f=-4.6!) USER MOD Single : A 139 TYR OH : rot 180:sc= -0.556 USER MOD Single : A 141 GLN :FLIP amide:sc= -1.2 F(o=-1.7,f=-1.2) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc=-0.00366 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 24 -7.168 -8.241 15.266 1.00 0.00 N ATOM 2 CA LYS A 24 -6.492 -8.150 13.983 1.00 0.00 C ATOM 3 C LYS A 24 -7.408 -8.701 12.888 1.00 0.00 C ATOM 4 O LYS A 24 -7.094 -9.710 12.259 1.00 0.00 O ATOM 5 CB LYS A 24 -5.128 -8.839 14.046 1.00 0.00 C ATOM 6 CG LYS A 24 -4.190 -8.111 15.011 1.00 0.00 C ATOM 7 CD LYS A 24 -3.541 -9.090 15.990 1.00 0.00 C ATOM 8 CE LYS A 24 -2.880 -8.347 17.153 1.00 0.00 C ATOM 9 NZ LYS A 24 -3.363 -8.876 18.448 1.00 0.00 N ATOM 0 HA LYS A 24 -6.287 -7.109 13.734 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.254 -9.873 14.366 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.683 -8.865 13.051 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -3.417 -7.589 14.447 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.747 -7.355 15.564 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.294 -9.778 16.375 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.797 -9.691 15.468 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.797 -8.453 17.091 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -3.100 -7.282 17.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -2.904 -8.361 19.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -4.394 -8.752 18.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -3.131 -9.887 18.518 1.00 0.00 H new ATOM 23 N PRO A 25 -8.554 -7.995 12.689 1.00 0.00 N ATOM 24 CA PRO A 25 -9.518 -8.403 11.681 1.00 0.00 C ATOM 25 C PRO A 25 -9.020 -8.059 10.275 1.00 0.00 C ATOM 26 O PRO A 25 -9.702 -8.331 9.288 1.00 0.00 O ATOM 27 CB PRO A 25 -10.803 -7.679 12.050 1.00 0.00 C ATOM 28 CG PRO A 25 -10.390 -6.539 12.968 1.00 0.00 C ATOM 29 CD PRO A 25 -8.960 -6.795 13.415 1.00 0.00 C ATOM 0 HA PRO A 25 -9.676 -9.481 11.661 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.308 -7.301 11.161 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -11.500 -8.351 12.551 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.462 -5.584 12.447 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.055 -6.483 13.830 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -8.313 -5.950 13.177 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -8.903 -6.946 14.493 1.00 0.00 H new ATOM 37 N LYS A 26 -7.837 -7.466 10.230 1.00 0.00 N ATOM 38 CA LYS A 26 -7.240 -7.082 8.962 1.00 0.00 C ATOM 39 C LYS A 26 -5.882 -6.426 9.220 1.00 0.00 C ATOM 40 O LYS A 26 -5.728 -5.665 10.174 1.00 0.00 O ATOM 41 CB LYS A 26 -8.204 -6.205 8.160 1.00 0.00 C ATOM 42 CG LYS A 26 -7.440 -5.249 7.241 1.00 0.00 C ATOM 43 CD LYS A 26 -6.718 -6.015 6.131 1.00 0.00 C ATOM 44 CE LYS A 26 -5.336 -5.417 5.862 1.00 0.00 C ATOM 45 NZ LYS A 26 -4.456 -6.416 5.214 1.00 0.00 N ATOM 0 H LYS A 26 -7.275 -7.242 11.051 1.00 0.00 H new ATOM 0 HA LYS A 26 -7.057 -7.962 8.345 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.866 -6.835 7.566 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.834 -5.634 8.842 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -8.132 -4.531 6.801 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.717 -4.679 7.824 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.616 -7.063 6.414 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.314 -5.988 5.219 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.431 -4.539 5.223 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.889 -5.083 6.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.551 -5.970 4.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.282 -7.204 5.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.915 -6.777 4.354 1.00 0.00 H new ATOM 59 N LEU A 27 -4.932 -6.745 8.353 1.00 0.00 N ATOM 60 CA LEU A 27 -3.593 -6.196 8.475 1.00 0.00 C ATOM 61 C LEU A 27 -2.752 -6.643 7.277 1.00 0.00 C ATOM 62 O LEU A 27 -2.846 -7.790 6.842 1.00 0.00 O ATOM 63 CB LEU A 27 -2.983 -6.567 9.828 1.00 0.00 C ATOM 64 CG LEU A 27 -2.217 -7.891 9.877 1.00 0.00 C ATOM 65 CD1 LEU A 27 -0.854 -7.762 9.194 1.00 0.00 C ATOM 66 CD2 LEU A 27 -2.092 -8.398 11.315 1.00 0.00 C ATOM 0 H LEU A 27 -5.064 -7.377 7.563 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.624 -5.107 8.454 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.307 -5.767 10.131 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.783 -6.605 10.567 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.786 -8.636 9.321 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.331 -8.717 9.243 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.995 -7.479 8.151 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.264 -6.998 9.701 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.544 -9.340 11.322 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.557 -7.662 11.915 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -3.086 -8.554 11.734 1.00 0.00 H new ATOM 78 N LEU A 28 -1.949 -5.714 6.778 1.00 0.00 N ATOM 79 CA LEU A 28 -1.093 -5.999 5.640 1.00 0.00 C ATOM 80 C LEU A 28 0.305 -6.369 6.139 1.00 0.00 C ATOM 81 O LEU A 28 0.667 -6.055 7.272 1.00 0.00 O ATOM 82 CB LEU A 28 -1.103 -4.827 4.655 1.00 0.00 C ATOM 83 CG LEU A 28 -0.894 -5.187 3.183 1.00 0.00 C ATOM 84 CD1 LEU A 28 -1.503 -4.124 2.267 1.00 0.00 C ATOM 85 CD2 LEU A 28 0.588 -5.421 2.882 1.00 0.00 C ATOM 0 H LEU A 28 -1.874 -4.764 7.141 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.472 -6.857 5.084 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.056 -4.307 4.750 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.325 -4.123 4.950 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.416 -6.123 2.982 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.340 -4.404 1.226 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.573 -4.048 2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.030 -3.162 2.462 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.710 -5.675 1.829 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.152 -4.515 3.104 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.960 -6.240 3.498 1.00 0.00 H new ATOM 97 N TYR A 29 1.053 -7.032 5.269 1.00 0.00 N ATOM 98 CA TYR A 29 2.403 -7.449 5.607 1.00 0.00 C ATOM 99 C TYR A 29 3.264 -7.590 4.351 1.00 0.00 C ATOM 100 O TYR A 29 2.750 -7.871 3.269 1.00 0.00 O ATOM 101 CB TYR A 29 2.267 -8.820 6.274 1.00 0.00 C ATOM 102 CG TYR A 29 3.594 -9.559 6.455 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.516 -9.106 7.377 1.00 0.00 C ATOM 104 CD2 TYR A 29 3.870 -10.678 5.696 1.00 0.00 C ATOM 105 CE1 TYR A 29 5.765 -9.801 7.547 1.00 0.00 C ATOM 106 CE2 TYR A 29 5.119 -11.373 5.866 1.00 0.00 C ATOM 107 CZ TYR A 29 6.005 -10.901 6.784 1.00 0.00 C ATOM 108 OH TYR A 29 7.185 -11.557 6.945 1.00 0.00 O ATOM 0 H TYR A 29 0.749 -7.291 4.330 1.00 0.00 H new ATOM 0 HA TYR A 29 2.880 -6.714 6.255 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.798 -8.693 7.250 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.597 -9.438 5.676 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.300 -8.230 7.971 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.149 -11.032 4.974 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.495 -9.457 8.264 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.348 -12.250 5.278 1.00 0.00 H new ATOM 0 HH TYR A 29 7.784 -11.341 6.200 1.00 0.00 H new ATOM 118 N CYS A 30 4.561 -7.389 4.535 1.00 0.00 N ATOM 119 CA CYS A 30 5.499 -7.490 3.430 1.00 0.00 C ATOM 120 C CYS A 30 6.244 -8.821 3.552 1.00 0.00 C ATOM 121 O CYS A 30 6.447 -9.323 4.656 1.00 0.00 O ATOM 122 CB CYS A 30 6.459 -6.300 3.392 1.00 0.00 C ATOM 123 SG CYS A 30 5.589 -4.777 3.918 1.00 0.00 S ATOM 0 H CYS A 30 4.984 -7.157 5.433 1.00 0.00 H new ATOM 0 HA CYS A 30 4.956 -7.464 2.485 1.00 0.00 H new ATOM 0 HB2 CYS A 30 7.310 -6.487 4.047 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.855 -6.173 2.384 1.00 0.00 H new ATOM 0 HG CYS A 30 4.863 -5.032 4.966 1.00 0.00 H new ATOM 129 N SER A 31 6.632 -9.353 2.403 1.00 0.00 N ATOM 130 CA SER A 31 7.351 -10.616 2.367 1.00 0.00 C ATOM 131 C SER A 31 8.708 -10.464 3.056 1.00 0.00 C ATOM 132 O SER A 31 8.799 -10.538 4.281 1.00 0.00 O ATOM 133 CB SER A 31 7.536 -11.103 0.929 1.00 0.00 C ATOM 134 OG SER A 31 7.687 -10.022 0.014 1.00 0.00 O ATOM 0 H SER A 31 6.462 -8.933 1.489 1.00 0.00 H new ATOM 0 HA SER A 31 6.762 -11.362 2.901 1.00 0.00 H new ATOM 0 HB2 SER A 31 8.413 -11.749 0.875 1.00 0.00 H new ATOM 0 HB3 SER A 31 6.677 -11.707 0.638 1.00 0.00 H new ATOM 0 HG SER A 31 8.008 -10.364 -0.846 1.00 0.00 H new ATOM 140 N ASN A 32 9.730 -10.255 2.239 1.00 0.00 N ATOM 141 CA ASN A 32 11.079 -10.093 2.755 1.00 0.00 C ATOM 142 C ASN A 32 11.092 -8.968 3.792 1.00 0.00 C ATOM 143 O ASN A 32 11.417 -9.196 4.956 1.00 0.00 O ATOM 144 CB ASN A 32 12.054 -9.717 1.637 1.00 0.00 C ATOM 145 CG ASN A 32 13.446 -10.290 1.908 1.00 0.00 C ATOM 146 OD1 ASN A 32 13.766 -11.411 1.547 1.00 0.00 O ATOM 147 ND2 ASN A 32 14.255 -9.462 2.564 1.00 0.00 N ATOM 0 H ASN A 32 9.651 -10.194 1.224 1.00 0.00 H new ATOM 0 HA ASN A 32 11.387 -11.040 3.199 1.00 0.00 H new ATOM 0 HB2 ASN A 32 11.682 -10.092 0.684 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.114 -8.632 1.551 1.00 0.00 H new ATOM 0 HD21 ASN A 32 15.205 -9.753 2.793 1.00 0.00 H new ATOM 0 HD22 ASN A 32 13.925 -8.536 2.837 1.00 0.00 H new ATOM 154 N GLY A 33 10.736 -7.778 3.331 1.00 0.00 N ATOM 155 CA GLY A 33 10.702 -6.617 4.205 1.00 0.00 C ATOM 156 C GLY A 33 10.139 -6.981 5.580 1.00 0.00 C ATOM 157 O GLY A 33 10.588 -6.457 6.598 1.00 0.00 O ATOM 0 H GLY A 33 10.469 -7.592 2.364 1.00 0.00 H new ATOM 0 HA2 GLY A 33 11.708 -6.211 4.316 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.091 -5.835 3.753 1.00 0.00 H new ATOM 161 N GLY A 34 9.163 -7.877 5.566 1.00 0.00 N ATOM 162 CA GLY A 34 8.534 -8.318 6.799 1.00 0.00 C ATOM 163 C GLY A 34 7.835 -7.154 7.504 1.00 0.00 C ATOM 164 O GLY A 34 7.406 -7.284 8.650 1.00 0.00 O ATOM 0 H GLY A 34 8.792 -8.310 4.720 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.810 -9.104 6.582 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.285 -8.750 7.460 1.00 0.00 H new ATOM 168 N HIS A 35 7.740 -6.042 6.790 1.00 0.00 N ATOM 169 CA HIS A 35 7.100 -4.856 7.333 1.00 0.00 C ATOM 170 C HIS A 35 5.582 -4.987 7.203 1.00 0.00 C ATOM 171 O HIS A 35 5.090 -5.816 6.439 1.00 0.00 O ATOM 172 CB HIS A 35 7.645 -3.591 6.666 1.00 0.00 C ATOM 173 CG HIS A 35 9.029 -3.201 7.127 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.085 -4.095 7.168 1.00 0.00 N ATOM 175 CD2 HIS A 35 9.519 -2.006 7.564 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.157 -3.455 7.613 1.00 0.00 C ATOM 177 NE2 HIS A 35 10.804 -2.161 7.859 1.00 0.00 N ATOM 0 H HIS A 35 8.096 -5.937 5.840 1.00 0.00 H new ATOM 0 HA HIS A 35 7.333 -4.767 8.394 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.661 -3.740 5.586 1.00 0.00 H new ATOM 0 HB3 HIS A 35 6.961 -2.765 6.863 1.00 0.00 H new ATOM 0 HD1 HIS A 35 10.045 -5.079 6.901 1.00 0.00 H new ATOM 0 HD2 HIS A 35 8.957 -1.088 7.655 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.138 -3.883 7.756 1.00 0.00 H new ATOM 185 N PHE A 36 4.881 -4.157 7.961 1.00 0.00 N ATOM 186 CA PHE A 36 3.428 -4.170 7.941 1.00 0.00 C ATOM 187 C PHE A 36 2.871 -2.768 7.683 1.00 0.00 C ATOM 188 O PHE A 36 2.651 -2.002 8.620 1.00 0.00 O ATOM 189 CB PHE A 36 2.966 -4.644 9.320 1.00 0.00 C ATOM 190 CG PHE A 36 3.359 -6.086 9.646 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.666 -6.405 9.849 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.403 -7.049 9.733 1.00 0.00 C ATOM 193 CE1 PHE A 36 5.031 -7.743 10.152 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.768 -8.387 10.036 1.00 0.00 C ATOM 195 CZ PHE A 36 4.074 -8.706 10.239 1.00 0.00 C ATOM 0 H PHE A 36 5.292 -3.471 8.593 1.00 0.00 H new ATOM 0 HA PHE A 36 3.072 -4.825 7.146 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.385 -3.984 10.079 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.882 -4.551 9.380 1.00 0.00 H new ATOM 0 HD1 PHE A 36 5.426 -5.640 9.780 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.366 -6.796 9.572 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.068 -7.996 10.313 1.00 0.00 H new ATOM 0 HE2 PHE A 36 2.008 -9.152 10.105 1.00 0.00 H new ATOM 0 HZ PHE A 36 4.352 -9.724 10.469 1.00 0.00 H new ATOM 205 N LEU A 37 2.659 -2.475 6.409 1.00 0.00 N ATOM 206 CA LEU A 37 2.132 -1.179 6.016 1.00 0.00 C ATOM 207 C LEU A 37 1.168 -0.678 7.094 1.00 0.00 C ATOM 208 O LEU A 37 0.480 -1.471 7.734 1.00 0.00 O ATOM 209 CB LEU A 37 1.508 -1.255 4.621 1.00 0.00 C ATOM 210 CG LEU A 37 2.174 -0.399 3.541 1.00 0.00 C ATOM 211 CD1 LEU A 37 2.000 -1.028 2.158 1.00 0.00 C ATOM 212 CD2 LEU A 37 1.655 1.040 3.586 1.00 0.00 C ATOM 0 H LEU A 37 2.843 -3.113 5.635 1.00 0.00 H new ATOM 0 HA LEU A 37 2.936 -0.447 5.941 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.524 -2.295 4.294 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.461 -0.960 4.696 1.00 0.00 H new ATOM 0 HG LEU A 37 3.244 -0.362 3.745 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.482 -0.400 1.409 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.455 -2.018 2.149 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.938 -1.115 1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.144 1.628 2.809 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.578 1.044 3.420 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.873 1.475 4.561 1.00 0.00 H new ATOM 224 N ARG A 38 1.150 0.636 7.261 1.00 0.00 N ATOM 225 CA ARG A 38 0.282 1.253 8.250 1.00 0.00 C ATOM 226 C ARG A 38 -0.351 2.525 7.681 1.00 0.00 C ATOM 227 O ARG A 38 0.219 3.165 6.799 1.00 0.00 O ATOM 228 CB ARG A 38 1.058 1.602 9.521 1.00 0.00 C ATOM 229 CG ARG A 38 2.115 2.672 9.243 1.00 0.00 C ATOM 230 CD ARG A 38 2.652 3.265 10.547 1.00 0.00 C ATOM 231 NE ARG A 38 3.197 2.189 11.405 1.00 0.00 N ATOM 232 CZ ARG A 38 3.765 2.397 12.601 1.00 0.00 C ATOM 233 NH1 ARG A 38 3.865 3.641 13.087 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.232 1.360 13.310 1.00 0.00 N ATOM 0 H ARG A 38 1.723 1.291 6.728 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.499 0.535 8.500 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.368 1.958 10.286 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.538 0.706 9.916 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.936 2.238 8.672 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.684 3.463 8.630 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.429 3.998 10.330 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.855 3.792 11.072 1.00 0.00 H new ATOM 0 HE ARG A 38 3.137 1.229 11.065 1.00 0.00 H new ATOM 0 HH11 ARG A 38 3.509 4.430 12.547 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.297 3.800 13.997 1.00 0.00 H new ATOM 0 HH21 ARG A 38 4.155 0.413 12.939 1.00 0.00 H new ATOM 0 HH22 ARG A 38 4.664 1.518 14.220 1.00 0.00 H new ATOM 248 N ILE A 39 -1.520 2.853 8.211 1.00 0.00 N ATOM 249 CA ILE A 39 -2.237 4.036 7.767 1.00 0.00 C ATOM 250 C ILE A 39 -2.656 4.860 8.986 1.00 0.00 C ATOM 251 O ILE A 39 -3.471 4.413 9.792 1.00 0.00 O ATOM 252 CB ILE A 39 -3.404 3.647 6.857 1.00 0.00 C ATOM 253 CG1 ILE A 39 -3.506 4.594 5.660 1.00 0.00 C ATOM 254 CG2 ILE A 39 -4.714 3.577 7.645 1.00 0.00 C ATOM 255 CD1 ILE A 39 -4.134 3.890 4.456 1.00 0.00 C ATOM 0 H ILE A 39 -1.989 2.320 8.944 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.589 4.669 7.161 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.211 2.649 6.463 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -4.105 5.464 5.930 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.514 4.959 5.395 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.527 3.299 6.975 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.624 2.832 8.435 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.925 4.551 8.087 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.195 4.585 3.619 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.520 3.035 4.173 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -5.135 3.547 4.716 1.00 0.00 H new ATOM 267 N LEU A 40 -2.080 6.049 9.083 1.00 0.00 N ATOM 268 CA LEU A 40 -2.383 6.940 10.191 1.00 0.00 C ATOM 269 C LEU A 40 -3.554 7.846 9.805 1.00 0.00 C ATOM 270 O LEU A 40 -3.622 8.332 8.677 1.00 0.00 O ATOM 271 CB LEU A 40 -1.130 7.704 10.622 1.00 0.00 C ATOM 272 CG LEU A 40 0.202 6.981 10.414 1.00 0.00 C ATOM 273 CD1 LEU A 40 1.350 7.980 10.262 1.00 0.00 C ATOM 274 CD2 LEU A 40 0.462 5.976 11.538 1.00 0.00 C ATOM 0 H LEU A 40 -1.405 6.417 8.413 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.696 6.369 11.065 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.098 8.647 10.076 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.225 7.951 11.679 1.00 0.00 H new ATOM 0 HG LEU A 40 0.142 6.416 9.484 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.285 7.440 10.115 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.163 8.621 9.401 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.421 8.592 11.161 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.415 5.476 11.366 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.494 6.499 12.494 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.338 5.236 11.556 1.00 0.00 H new ATOM 286 N PRO A 41 -4.470 8.051 10.788 1.00 0.00 N ATOM 287 CA PRO A 41 -5.635 8.891 10.563 1.00 0.00 C ATOM 288 C PRO A 41 -5.252 10.372 10.563 1.00 0.00 C ATOM 289 O PRO A 41 -6.121 11.242 10.559 1.00 0.00 O ATOM 290 CB PRO A 41 -6.603 8.528 11.677 1.00 0.00 C ATOM 291 CG PRO A 41 -5.769 7.844 12.748 1.00 0.00 C ATOM 292 CD PRO A 41 -4.422 7.493 12.136 1.00 0.00 C ATOM 0 HA PRO A 41 -6.091 8.724 9.587 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.094 9.417 12.073 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.388 7.866 11.312 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -5.638 8.501 13.608 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -6.271 6.946 13.107 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.602 7.921 12.713 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -4.267 6.414 12.113 1.00 0.00 H new ATOM 300 N ASP A 42 -3.949 10.613 10.567 1.00 0.00 N ATOM 301 CA ASP A 42 -3.440 11.974 10.568 1.00 0.00 C ATOM 302 C ASP A 42 -3.222 12.433 9.125 1.00 0.00 C ATOM 303 O ASP A 42 -3.326 13.621 8.825 1.00 0.00 O ATOM 304 CB ASP A 42 -2.098 12.060 11.299 1.00 0.00 C ATOM 305 CG ASP A 42 -1.881 13.344 12.101 1.00 0.00 C ATOM 306 OD1 ASP A 42 -1.518 14.357 11.465 1.00 0.00 O ATOM 307 OD2 ASP A 42 -2.082 13.285 13.334 1.00 0.00 O ATOM 0 H ASP A 42 -3.231 9.889 10.570 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.169 12.606 11.076 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -2.014 11.209 11.975 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -1.296 11.966 10.567 1.00 0.00 H new ATOM 312 N GLY A 43 -2.923 11.467 8.269 1.00 0.00 N ATOM 313 CA GLY A 43 -2.689 11.757 6.864 1.00 0.00 C ATOM 314 C GLY A 43 -1.275 11.349 6.448 1.00 0.00 C ATOM 315 O GLY A 43 -0.789 11.764 5.397 1.00 0.00 O ATOM 0 H GLY A 43 -2.837 10.482 8.521 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.419 11.226 6.253 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.833 12.822 6.680 1.00 0.00 H new ATOM 319 N THR A 44 -0.654 10.540 7.294 1.00 0.00 N ATOM 320 CA THR A 44 0.696 10.071 7.027 1.00 0.00 C ATOM 321 C THR A 44 0.715 8.546 6.900 1.00 0.00 C ATOM 322 O THR A 44 0.173 7.842 7.751 1.00 0.00 O ATOM 323 CB THR A 44 1.608 10.600 8.135 1.00 0.00 C ATOM 324 OG1 THR A 44 2.068 11.853 7.637 1.00 0.00 O ATOM 325 CG2 THR A 44 2.884 9.770 8.290 1.00 0.00 C ATOM 0 H THR A 44 -1.060 10.197 8.165 1.00 0.00 H new ATOM 0 HA THR A 44 1.065 10.450 6.074 1.00 0.00 H new ATOM 0 HB THR A 44 1.064 10.609 9.079 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.665 12.267 8.294 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.495 10.188 9.089 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.621 8.741 8.535 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.446 9.788 7.356 1.00 0.00 H new ATOM 333 N VAL A 45 1.346 8.081 5.832 1.00 0.00 N ATOM 334 CA VAL A 45 1.443 6.653 5.583 1.00 0.00 C ATOM 335 C VAL A 45 2.903 6.215 5.714 1.00 0.00 C ATOM 336 O VAL A 45 3.806 7.050 5.731 1.00 0.00 O ATOM 337 CB VAL A 45 0.838 6.317 4.219 1.00 0.00 C ATOM 338 CG1 VAL A 45 0.346 4.868 4.178 1.00 0.00 C ATOM 339 CG2 VAL A 45 -0.289 7.289 3.864 1.00 0.00 C ATOM 0 H VAL A 45 1.795 8.668 5.129 1.00 0.00 H new ATOM 0 HA VAL A 45 0.869 6.096 6.324 1.00 0.00 H new ATOM 0 HB VAL A 45 1.622 6.425 3.470 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -0.079 4.656 3.197 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.182 4.194 4.364 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -0.416 4.721 4.943 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.702 7.028 2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.073 7.228 4.618 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.104 8.305 3.831 1.00 0.00 H new ATOM 349 N ASP A 46 3.089 4.906 5.803 1.00 0.00 N ATOM 350 CA ASP A 46 4.425 4.347 5.932 1.00 0.00 C ATOM 351 C ASP A 46 4.319 2.857 6.260 1.00 0.00 C ATOM 352 O ASP A 46 3.232 2.283 6.217 1.00 0.00 O ATOM 353 CB ASP A 46 5.199 5.027 7.063 1.00 0.00 C ATOM 354 CG ASP A 46 4.350 5.878 8.009 1.00 0.00 C ATOM 355 OD1 ASP A 46 3.212 5.445 8.294 1.00 0.00 O ATOM 356 OD2 ASP A 46 4.856 6.942 8.425 1.00 0.00 O ATOM 0 H ASP A 46 2.338 4.216 5.788 1.00 0.00 H new ATOM 0 HA ASP A 46 4.950 4.505 4.990 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.708 4.260 7.647 1.00 0.00 H new ATOM 0 HB3 ASP A 46 5.972 5.659 6.625 1.00 0.00 H new ATOM 361 N GLY A 47 5.464 2.272 6.580 1.00 0.00 N ATOM 362 CA GLY A 47 5.515 0.859 6.916 1.00 0.00 C ATOM 363 C GLY A 47 6.182 0.641 8.275 1.00 0.00 C ATOM 364 O GLY A 47 6.766 1.565 8.839 1.00 0.00 O ATOM 0 H GLY A 47 6.364 2.751 6.614 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.505 0.449 6.933 1.00 0.00 H new ATOM 0 HA3 GLY A 47 6.066 0.318 6.146 1.00 0.00 H new ATOM 368 N THR A 48 6.073 -0.586 8.762 1.00 0.00 N ATOM 369 CA THR A 48 6.659 -0.937 10.045 1.00 0.00 C ATOM 370 C THR A 48 7.163 -2.381 10.024 1.00 0.00 C ATOM 371 O THR A 48 6.405 -3.303 9.727 1.00 0.00 O ATOM 372 CB THR A 48 5.613 -0.674 11.130 1.00 0.00 C ATOM 373 OG1 THR A 48 5.158 0.649 10.861 1.00 0.00 O ATOM 374 CG2 THR A 48 6.229 -0.579 12.527 1.00 0.00 C ATOM 0 H THR A 48 5.588 -1.350 8.292 1.00 0.00 H new ATOM 0 HA THR A 48 7.534 -0.324 10.261 1.00 0.00 H new ATOM 0 HB THR A 48 4.868 -1.469 11.115 1.00 0.00 H new ATOM 0 HG1 THR A 48 5.912 1.272 10.920 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.443 -0.392 13.259 1.00 0.00 H new ATOM 0 HG22 THR A 48 6.733 -1.515 12.767 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.950 0.238 12.552 1.00 0.00 H new ATOM 382 N ARG A 49 8.440 -2.533 10.343 1.00 0.00 N ATOM 383 CA ARG A 49 9.054 -3.849 10.364 1.00 0.00 C ATOM 384 C ARG A 49 8.085 -4.878 10.951 1.00 0.00 C ATOM 385 O ARG A 49 8.103 -6.045 10.562 1.00 0.00 O ATOM 386 CB ARG A 49 10.342 -3.843 11.191 1.00 0.00 C ATOM 387 CG ARG A 49 11.225 -5.042 10.839 1.00 0.00 C ATOM 388 CD ARG A 49 11.293 -6.033 12.003 1.00 0.00 C ATOM 389 NE ARG A 49 12.616 -5.950 12.661 1.00 0.00 N ATOM 390 CZ ARG A 49 13.158 -6.940 13.384 1.00 0.00 C ATOM 391 NH1 ARG A 49 12.495 -8.093 13.546 1.00 0.00 N ATOM 392 NH2 ARG A 49 14.364 -6.776 13.946 1.00 0.00 N ATOM 0 H ARG A 49 9.066 -1.766 10.589 1.00 0.00 H new ATOM 0 HA ARG A 49 9.296 -4.118 9.336 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.890 -2.918 11.011 1.00 0.00 H new ATOM 0 HB3 ARG A 49 10.097 -3.867 12.253 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.831 -5.541 9.954 1.00 0.00 H new ATOM 0 HG3 ARG A 49 12.229 -4.698 10.590 1.00 0.00 H new ATOM 0 HD2 ARG A 49 10.505 -5.815 12.724 1.00 0.00 H new ATOM 0 HD3 ARG A 49 11.121 -7.046 11.640 1.00 0.00 H new ATOM 0 HE ARG A 49 13.148 -5.086 12.558 1.00 0.00 H new ATOM 0 HH11 ARG A 49 11.577 -8.218 13.119 1.00 0.00 H new ATOM 0 HH12 ARG A 49 12.908 -8.846 14.096 1.00 0.00 H new ATOM 0 HH21 ARG A 49 14.869 -5.898 13.823 1.00 0.00 H new ATOM 0 HH22 ARG A 49 14.777 -7.529 14.496 1.00 0.00 H new ATOM 406 N ASP A 50 7.263 -4.408 11.877 1.00 0.00 N ATOM 407 CA ASP A 50 6.288 -5.272 12.521 1.00 0.00 C ATOM 408 C ASP A 50 5.185 -4.415 13.143 1.00 0.00 C ATOM 409 O ASP A 50 5.451 -3.596 14.022 1.00 0.00 O ATOM 410 CB ASP A 50 6.935 -6.095 13.637 1.00 0.00 C ATOM 411 CG ASP A 50 7.407 -7.489 13.223 1.00 0.00 C ATOM 412 OD1 ASP A 50 6.584 -8.212 12.621 1.00 0.00 O ATOM 413 OD2 ASP A 50 8.581 -7.801 13.517 1.00 0.00 O ATOM 0 H ASP A 50 7.252 -3.440 12.197 1.00 0.00 H new ATOM 0 HA ASP A 50 5.882 -5.945 11.766 1.00 0.00 H new ATOM 0 HB2 ASP A 50 7.788 -5.541 14.029 1.00 0.00 H new ATOM 0 HB3 ASP A 50 6.220 -6.198 14.453 1.00 0.00 H new ATOM 418 N ARG A 51 3.969 -4.632 12.664 1.00 0.00 N ATOM 419 CA ARG A 51 2.824 -3.889 13.162 1.00 0.00 C ATOM 420 C ARG A 51 3.029 -3.522 14.633 1.00 0.00 C ATOM 421 O ARG A 51 2.711 -4.308 15.523 1.00 0.00 O ATOM 422 CB ARG A 51 1.536 -4.703 13.022 1.00 0.00 C ATOM 423 CG ARG A 51 1.640 -6.029 13.778 1.00 0.00 C ATOM 424 CD ARG A 51 1.471 -7.216 12.829 1.00 0.00 C ATOM 425 NE ARG A 51 0.341 -8.063 13.272 1.00 0.00 N ATOM 426 CZ ARG A 51 0.246 -9.377 13.029 1.00 0.00 C ATOM 427 NH1 ARG A 51 1.212 -10.003 12.344 1.00 0.00 N ATOM 428 NH2 ARG A 51 -0.816 -10.065 13.470 1.00 0.00 N ATOM 0 H ARG A 51 3.752 -5.312 11.936 1.00 0.00 H new ATOM 0 HA ARG A 51 2.733 -2.981 12.566 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.694 -4.127 13.406 1.00 0.00 H new ATOM 0 HB3 ARG A 51 1.336 -4.896 11.968 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.607 -6.092 14.277 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.877 -6.069 14.556 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.292 -6.859 11.815 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.388 -7.804 12.803 1.00 0.00 H new ATOM 0 HE ARG A 51 -0.413 -7.618 13.795 1.00 0.00 H new ATOM 0 HH11 ARG A 51 2.020 -9.479 12.007 1.00 0.00 H new ATOM 0 HH12 ARG A 51 1.140 -11.003 12.159 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.552 -9.588 13.991 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.888 -11.065 13.285 1.00 0.00 H new ATOM 442 N SER A 52 3.560 -2.326 14.843 1.00 0.00 N ATOM 443 CA SER A 52 3.812 -1.845 16.190 1.00 0.00 C ATOM 444 C SER A 52 3.067 -0.529 16.423 1.00 0.00 C ATOM 445 O SER A 52 3.550 0.342 17.146 1.00 0.00 O ATOM 446 CB SER A 52 5.310 -1.658 16.438 1.00 0.00 C ATOM 447 OG SER A 52 5.704 -0.293 16.327 1.00 0.00 O ATOM 0 H SER A 52 3.823 -1.676 14.102 1.00 0.00 H new ATOM 0 HA SER A 52 3.446 -2.593 16.894 1.00 0.00 H new ATOM 0 HB2 SER A 52 5.562 -2.028 17.432 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.873 -2.257 15.723 1.00 0.00 H new ATOM 0 HG SER A 52 5.300 0.224 17.055 1.00 0.00 H new ATOM 453 N ASP A 53 1.904 -0.425 15.798 1.00 0.00 N ATOM 454 CA ASP A 53 1.088 0.770 15.928 1.00 0.00 C ATOM 455 C ASP A 53 -0.370 0.365 16.154 1.00 0.00 C ATOM 456 O ASP A 53 -0.704 -0.818 16.106 1.00 0.00 O ATOM 457 CB ASP A 53 1.151 1.621 14.659 1.00 0.00 C ATOM 458 CG ASP A 53 1.767 3.010 14.841 1.00 0.00 C ATOM 459 OD1 ASP A 53 2.516 3.174 15.828 1.00 0.00 O ATOM 460 OD2 ASP A 53 1.474 3.877 13.989 1.00 0.00 O ATOM 0 H ASP A 53 1.507 -1.149 15.200 1.00 0.00 H new ATOM 0 HA ASP A 53 1.470 1.349 16.769 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.725 1.081 13.906 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.141 1.737 14.267 1.00 0.00 H new ATOM 465 N GLN A 54 -1.199 1.370 16.395 1.00 0.00 N ATOM 466 CA GLN A 54 -2.614 1.133 16.628 1.00 0.00 C ATOM 467 C GLN A 54 -3.389 1.211 15.311 1.00 0.00 C ATOM 468 O GLN A 54 -4.409 0.544 15.147 1.00 0.00 O ATOM 469 CB GLN A 54 -3.174 2.121 17.653 1.00 0.00 C ATOM 470 CG GLN A 54 -4.704 2.113 17.644 1.00 0.00 C ATOM 471 CD GLN A 54 -5.253 3.344 16.920 1.00 0.00 C ATOM 472 OE1 GLN A 54 -4.464 3.799 15.950 1.00 0.00 O flip ATOM 473 NE2 GLN A 54 -6.323 3.847 17.221 1.00 0.00 N flip ATOM 0 H GLN A 54 -0.918 2.350 16.434 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.732 0.130 17.038 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.811 1.863 18.648 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -2.811 3.125 17.432 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -5.064 1.208 17.155 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -5.077 2.092 18.668 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -6.880 3.447 17.977 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -6.661 4.667 16.717 1.00 0.00 H new ATOM 482 N HIS A 55 -2.876 2.033 14.407 1.00 0.00 N ATOM 483 CA HIS A 55 -3.507 2.207 13.110 1.00 0.00 C ATOM 484 C HIS A 55 -2.538 1.779 12.006 1.00 0.00 C ATOM 485 O HIS A 55 -1.867 2.616 11.405 1.00 0.00 O ATOM 486 CB HIS A 55 -4.006 3.643 12.937 1.00 0.00 C ATOM 487 CG HIS A 55 -3.102 4.685 13.551 1.00 0.00 C ATOM 488 ND1 HIS A 55 -3.392 5.874 14.153 1.00 0.00 N flip ATOM 489 CD2 HIS A 55 -1.724 4.557 13.584 1.00 0.00 C flip ATOM 490 CE1 HIS A 55 -2.254 6.440 14.535 1.00 0.00 C flip ATOM 491 NE2 HIS A 55 -1.219 5.625 14.182 1.00 0.00 N flip ATOM 0 H HIS A 55 -2.030 2.586 14.547 1.00 0.00 H new ATOM 0 HA HIS A 55 -4.387 1.567 13.041 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -4.115 3.853 11.873 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -4.997 3.729 13.382 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -1.157 3.727 13.189 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -2.163 7.389 15.042 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -0.229 5.806 14.349 1.00 0.00 H new ATOM 499 N ILE A 56 -2.497 0.475 11.772 1.00 0.00 N ATOM 500 CA ILE A 56 -1.621 -0.074 10.751 1.00 0.00 C ATOM 501 C ILE A 56 -2.423 -1.018 9.852 1.00 0.00 C ATOM 502 O ILE A 56 -1.849 -1.850 9.151 1.00 0.00 O ATOM 503 CB ILE A 56 -0.396 -0.729 11.391 1.00 0.00 C ATOM 504 CG1 ILE A 56 -0.633 -2.221 11.631 1.00 0.00 C ATOM 505 CG2 ILE A 56 0.008 0.001 12.674 1.00 0.00 C ATOM 506 CD1 ILE A 56 -1.934 -2.452 12.402 1.00 0.00 C ATOM 0 H ILE A 56 -3.056 -0.217 12.272 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.232 0.721 10.115 1.00 0.00 H new ATOM 0 HB ILE A 56 0.439 -0.644 10.695 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.674 -2.745 10.676 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.204 -2.641 12.189 1.00 0.00 H new ATOM 0 HG21 ILE A 56 0.881 -0.485 13.109 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.248 1.039 12.442 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.817 -0.030 13.386 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.079 -3.521 12.559 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.880 -1.947 13.367 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.772 -2.053 11.830 1.00 0.00 H new ATOM 518 N GLN A 57 -3.737 -0.857 9.902 1.00 0.00 N ATOM 519 CA GLN A 57 -4.624 -1.684 9.101 1.00 0.00 C ATOM 520 C GLN A 57 -4.657 -1.181 7.656 1.00 0.00 C ATOM 521 O GLN A 57 -4.256 -0.052 7.378 1.00 0.00 O ATOM 522 CB GLN A 57 -6.030 -1.721 9.701 1.00 0.00 C ATOM 523 CG GLN A 57 -5.997 -2.219 11.147 1.00 0.00 C ATOM 524 CD GLN A 57 -5.611 -1.092 12.106 1.00 0.00 C ATOM 525 OE1 GLN A 57 -5.356 0.034 11.712 1.00 0.00 O ATOM 526 NE2 GLN A 57 -5.582 -1.456 13.385 1.00 0.00 N ATOM 0 H GLN A 57 -4.209 -0.166 10.485 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.238 -2.703 9.102 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.470 -0.725 9.666 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -6.667 -2.372 9.103 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -6.975 -2.616 11.421 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -5.284 -3.038 11.237 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -5.806 -2.416 13.647 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -5.335 -0.775 14.103 1.00 0.00 H new ATOM 535 N LEU A 58 -5.138 -2.045 6.773 1.00 0.00 N ATOM 536 CA LEU A 58 -5.229 -1.703 5.364 1.00 0.00 C ATOM 537 C LEU A 58 -6.435 -2.414 4.748 1.00 0.00 C ATOM 538 O LEU A 58 -7.119 -3.182 5.423 1.00 0.00 O ATOM 539 CB LEU A 58 -3.908 -2.004 4.654 1.00 0.00 C ATOM 540 CG LEU A 58 -2.778 -0.999 4.883 1.00 0.00 C ATOM 541 CD1 LEU A 58 -1.643 -1.626 5.695 1.00 0.00 C ATOM 542 CD2 LEU A 58 -2.282 -0.419 3.557 1.00 0.00 C ATOM 0 H LEU A 58 -5.469 -2.981 7.007 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.393 -0.632 5.241 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.563 -2.987 4.973 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.100 -2.066 3.583 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.173 -0.169 5.469 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.852 -0.890 5.844 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.024 -1.950 6.664 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.242 -2.485 5.157 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.479 0.293 3.749 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.910 -1.225 2.924 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -3.104 0.089 3.052 1.00 0.00 H new ATOM 554 N GLN A 59 -6.659 -2.133 3.473 1.00 0.00 N ATOM 555 CA GLN A 59 -7.771 -2.736 2.758 1.00 0.00 C ATOM 556 C GLN A 59 -7.667 -2.434 1.262 1.00 0.00 C ATOM 557 O GLN A 59 -7.172 -1.378 0.871 1.00 0.00 O ATOM 558 CB GLN A 59 -9.110 -2.257 3.322 1.00 0.00 C ATOM 559 CG GLN A 59 -10.237 -3.226 2.958 1.00 0.00 C ATOM 560 CD GLN A 59 -9.876 -4.660 3.352 1.00 0.00 C ATOM 561 OE1 GLN A 59 -9.626 -5.516 2.519 1.00 0.00 O ATOM 562 NE2 GLN A 59 -9.862 -4.872 4.665 1.00 0.00 N ATOM 0 H GLN A 59 -6.089 -1.496 2.916 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.722 -3.816 2.895 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.040 -2.166 4.406 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -9.339 -1.265 2.933 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.156 -2.927 3.462 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -10.431 -3.177 1.887 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -10.081 -4.110 5.307 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -9.632 -5.796 5.030 1.00 0.00 H new ATOM 571 N LEU A 60 -8.140 -3.381 0.465 1.00 0.00 N ATOM 572 CA LEU A 60 -8.106 -3.229 -0.980 1.00 0.00 C ATOM 573 C LEU A 60 -9.534 -3.274 -1.527 1.00 0.00 C ATOM 574 O LEU A 60 -10.438 -3.793 -0.873 1.00 0.00 O ATOM 575 CB LEU A 60 -7.175 -4.270 -1.606 1.00 0.00 C ATOM 576 CG LEU A 60 -6.199 -4.958 -0.650 1.00 0.00 C ATOM 577 CD1 LEU A 60 -6.938 -5.892 0.310 1.00 0.00 C ATOM 578 CD2 LEU A 60 -5.096 -5.685 -1.422 1.00 0.00 C ATOM 0 H LEU A 60 -8.549 -4.256 0.792 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.691 -2.258 -1.251 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.787 -5.036 -2.082 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.599 -3.786 -2.395 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.716 -4.191 -0.045 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.221 -6.368 0.979 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.655 -5.318 0.897 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -7.466 -6.657 -0.260 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.416 -6.165 -0.719 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.542 -6.440 -2.069 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.543 -4.968 -2.029 1.00 0.00 H new ATOM 590 N SER A 61 -9.694 -2.722 -2.721 1.00 0.00 N ATOM 591 CA SER A 61 -10.997 -2.693 -3.363 1.00 0.00 C ATOM 592 C SER A 61 -10.840 -2.878 -4.874 1.00 0.00 C ATOM 593 O SER A 61 -11.330 -2.065 -5.657 1.00 0.00 O ATOM 594 CB SER A 61 -11.730 -1.384 -3.062 1.00 0.00 C ATOM 595 OG SER A 61 -12.773 -1.128 -3.999 1.00 0.00 O ATOM 0 H SER A 61 -8.943 -2.291 -3.260 1.00 0.00 H new ATOM 0 HA SER A 61 -11.594 -3.513 -2.963 1.00 0.00 H new ATOM 0 HB2 SER A 61 -12.148 -1.426 -2.056 1.00 0.00 H new ATOM 0 HB3 SER A 61 -11.018 -0.558 -3.077 1.00 0.00 H new ATOM 0 HG SER A 61 -12.397 -1.082 -4.903 1.00 0.00 H new ATOM 601 N ALA A 62 -10.156 -3.952 -5.238 1.00 0.00 N ATOM 602 CA ALA A 62 -9.928 -4.254 -6.641 1.00 0.00 C ATOM 603 C ALA A 62 -11.196 -3.940 -7.438 1.00 0.00 C ATOM 604 O ALA A 62 -12.276 -4.432 -7.112 1.00 0.00 O ATOM 605 CB ALA A 62 -9.496 -5.715 -6.785 1.00 0.00 C ATOM 0 H ALA A 62 -9.752 -4.624 -4.586 1.00 0.00 H new ATOM 0 HA ALA A 62 -9.125 -3.635 -7.041 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.325 -5.942 -7.837 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.576 -5.879 -6.224 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.279 -6.366 -6.396 1.00 0.00 H new ATOM 611 N GLU A 63 -11.023 -3.124 -8.467 1.00 0.00 N ATOM 612 CA GLU A 63 -12.140 -2.739 -9.313 1.00 0.00 C ATOM 613 C GLU A 63 -11.903 -3.207 -10.750 1.00 0.00 C ATOM 614 O GLU A 63 -12.734 -2.975 -11.627 1.00 0.00 O ATOM 615 CB GLU A 63 -12.373 -1.227 -9.259 1.00 0.00 C ATOM 616 CG GLU A 63 -11.234 -0.473 -9.948 1.00 0.00 C ATOM 617 CD GLU A 63 -11.779 0.556 -10.941 1.00 0.00 C ATOM 618 OE1 GLU A 63 -12.890 1.065 -10.678 1.00 0.00 O ATOM 619 OE2 GLU A 63 -11.073 0.810 -11.940 1.00 0.00 O ATOM 0 H GLU A 63 -10.126 -2.719 -8.734 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.040 -3.225 -8.937 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.320 -0.984 -9.742 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.452 -0.904 -8.221 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.620 0.028 -9.200 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.588 -1.180 -10.469 1.00 0.00 H new ATOM 626 N SER A 64 -10.766 -3.857 -10.947 1.00 0.00 N ATOM 627 CA SER A 64 -10.409 -4.359 -12.263 1.00 0.00 C ATOM 628 C SER A 64 -8.900 -4.600 -12.340 1.00 0.00 C ATOM 629 O SER A 64 -8.109 -3.706 -12.044 1.00 0.00 O ATOM 630 CB SER A 64 -10.848 -3.388 -13.361 1.00 0.00 C ATOM 631 OG SER A 64 -12.079 -3.783 -13.961 1.00 0.00 O ATOM 0 H SER A 64 -10.079 -4.048 -10.217 1.00 0.00 H new ATOM 0 HA SER A 64 -10.930 -5.303 -12.421 1.00 0.00 H new ATOM 0 HB2 SER A 64 -10.954 -2.388 -12.940 1.00 0.00 H new ATOM 0 HB3 SER A 64 -10.073 -3.331 -14.126 1.00 0.00 H new ATOM 0 HG SER A 64 -12.815 -3.625 -13.333 1.00 0.00 H new ATOM 637 N VAL A 65 -8.547 -5.813 -12.740 1.00 0.00 N ATOM 638 CA VAL A 65 -7.147 -6.183 -12.860 1.00 0.00 C ATOM 639 C VAL A 65 -6.361 -5.005 -13.440 1.00 0.00 C ATOM 640 O VAL A 65 -6.859 -4.289 -14.307 1.00 0.00 O ATOM 641 CB VAL A 65 -7.012 -7.460 -13.692 1.00 0.00 C ATOM 642 CG1 VAL A 65 -7.080 -8.703 -12.802 1.00 0.00 C ATOM 643 CG2 VAL A 65 -8.075 -7.513 -14.791 1.00 0.00 C ATOM 0 H VAL A 65 -9.206 -6.552 -12.985 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.725 -6.404 -11.880 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.034 -7.445 -14.173 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.982 -9.597 -13.418 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -6.270 -8.673 -12.073 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.037 -8.725 -12.280 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.957 -8.430 -15.368 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.067 -7.494 -14.339 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.960 -6.653 -15.450 1.00 0.00 H new ATOM 653 N GLY A 66 -5.145 -4.842 -12.940 1.00 0.00 N ATOM 654 CA GLY A 66 -4.285 -3.764 -13.398 1.00 0.00 C ATOM 655 C GLY A 66 -4.713 -2.426 -12.792 1.00 0.00 C ATOM 656 O GLY A 66 -4.155 -1.382 -13.126 1.00 0.00 O ATOM 0 H GLY A 66 -4.735 -5.439 -12.222 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.252 -3.977 -13.124 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.321 -3.703 -14.486 1.00 0.00 H new ATOM 660 N GLU A 67 -5.700 -2.501 -11.911 1.00 0.00 N ATOM 661 CA GLU A 67 -6.210 -1.308 -11.256 1.00 0.00 C ATOM 662 C GLU A 67 -7.128 -1.693 -10.094 1.00 0.00 C ATOM 663 O GLU A 67 -8.259 -2.127 -10.309 1.00 0.00 O ATOM 664 CB GLU A 67 -6.936 -0.402 -12.252 1.00 0.00 C ATOM 665 CG GLU A 67 -6.489 1.052 -12.098 1.00 0.00 C ATOM 666 CD GLU A 67 -7.245 1.964 -13.066 1.00 0.00 C ATOM 667 OE1 GLU A 67 -7.420 1.538 -14.228 1.00 0.00 O ATOM 668 OE2 GLU A 67 -7.631 3.067 -12.623 1.00 0.00 O ATOM 0 H GLU A 67 -6.160 -3.369 -11.636 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.365 -0.747 -10.856 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.738 -0.741 -13.269 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.012 -0.474 -12.096 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.660 1.382 -11.073 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.417 1.128 -12.283 1.00 0.00 H new ATOM 675 N VAL A 68 -6.608 -1.518 -8.888 1.00 0.00 N ATOM 676 CA VAL A 68 -7.367 -1.842 -7.692 1.00 0.00 C ATOM 677 C VAL A 68 -7.385 -0.628 -6.760 1.00 0.00 C ATOM 678 O VAL A 68 -6.590 0.296 -6.925 1.00 0.00 O ATOM 679 CB VAL A 68 -6.792 -3.095 -7.030 1.00 0.00 C ATOM 680 CG1 VAL A 68 -6.923 -4.311 -7.950 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.336 -2.877 -6.614 1.00 0.00 C ATOM 0 H VAL A 68 -5.670 -1.156 -8.713 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.402 -2.072 -7.947 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.372 -3.293 -6.128 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -6.507 -5.188 -7.455 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -7.975 -4.486 -8.174 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.381 -4.126 -8.877 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.952 -3.783 -6.146 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.738 -2.641 -7.494 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.280 -2.051 -5.905 1.00 0.00 H new ATOM 691 N TYR A 69 -8.299 -0.670 -5.803 1.00 0.00 N ATOM 692 CA TYR A 69 -8.430 0.415 -4.845 1.00 0.00 C ATOM 693 C TYR A 69 -7.964 -0.022 -3.454 1.00 0.00 C ATOM 694 O TYR A 69 -7.743 -1.208 -3.214 1.00 0.00 O ATOM 695 CB TYR A 69 -9.922 0.749 -4.788 1.00 0.00 C ATOM 696 CG TYR A 69 -10.363 1.801 -5.808 1.00 0.00 C ATOM 697 CD1 TYR A 69 -10.239 3.143 -5.512 1.00 0.00 C ATOM 698 CD2 TYR A 69 -10.886 1.407 -7.023 1.00 0.00 C ATOM 699 CE1 TYR A 69 -10.655 4.133 -6.472 1.00 0.00 C ATOM 700 CE2 TYR A 69 -11.301 2.397 -7.983 1.00 0.00 C ATOM 701 CZ TYR A 69 -11.165 3.711 -7.660 1.00 0.00 C ATOM 702 OH TYR A 69 -11.557 4.646 -8.566 1.00 0.00 O ATOM 0 H TYR A 69 -8.957 -1.438 -5.670 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.821 1.268 -5.146 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.495 -0.164 -4.952 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.167 1.103 -3.787 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.830 3.451 -4.561 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -10.984 0.356 -7.254 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -10.564 5.187 -6.253 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -11.711 2.103 -8.938 1.00 0.00 H new ATOM 0 HH TYR A 69 -11.900 4.200 -9.369 1.00 0.00 H new ATOM 712 N ILE A 70 -7.829 0.960 -2.575 1.00 0.00 N ATOM 713 CA ILE A 70 -7.394 0.691 -1.215 1.00 0.00 C ATOM 714 C ILE A 70 -8.059 1.690 -0.265 1.00 0.00 C ATOM 715 O ILE A 70 -7.966 2.900 -0.466 1.00 0.00 O ATOM 716 CB ILE A 70 -5.866 0.688 -1.132 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.269 -0.368 -2.065 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.395 0.508 0.312 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.771 -0.543 -1.807 1.00 0.00 C ATOM 0 H ILE A 70 -8.013 1.943 -2.778 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.709 -0.305 -0.904 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.504 1.659 -1.470 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.781 -1.319 -1.918 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.431 -0.076 -3.102 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.305 0.509 0.342 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.776 1.326 0.924 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.767 -0.440 0.701 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.371 -1.299 -2.483 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.259 0.404 -1.978 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.614 -0.859 -0.776 1.00 0.00 H new ATOM 731 N LYS A 71 -8.714 1.146 0.750 1.00 0.00 N ATOM 732 CA LYS A 71 -9.394 1.973 1.732 1.00 0.00 C ATOM 733 C LYS A 71 -8.678 1.851 3.079 1.00 0.00 C ATOM 734 O LYS A 71 -8.351 0.748 3.514 1.00 0.00 O ATOM 735 CB LYS A 71 -10.881 1.621 1.791 1.00 0.00 C ATOM 736 CG LYS A 71 -11.709 2.814 2.275 1.00 0.00 C ATOM 737 CD LYS A 71 -12.204 2.594 3.705 1.00 0.00 C ATOM 738 CE LYS A 71 -11.391 3.425 4.701 1.00 0.00 C ATOM 739 NZ LYS A 71 -12.221 4.509 5.271 1.00 0.00 N ATOM 0 H LYS A 71 -8.788 0.142 0.914 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.350 3.023 1.442 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.225 1.312 0.804 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.031 0.774 2.460 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -11.106 3.721 2.231 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -12.560 2.964 1.611 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -13.258 2.865 3.775 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -12.129 1.537 3.961 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -11.020 2.784 5.501 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.519 3.850 4.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -11.604 5.241 5.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -12.807 4.928 4.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -12.836 4.121 6.015 1.00 0.00 H new ATOM 753 N SER A 72 -8.457 3.000 3.701 1.00 0.00 N ATOM 754 CA SER A 72 -7.786 3.035 4.990 1.00 0.00 C ATOM 755 C SER A 72 -8.716 2.494 6.078 1.00 0.00 C ATOM 756 O SER A 72 -9.198 3.251 6.919 1.00 0.00 O ATOM 757 CB SER A 72 -7.333 4.455 5.336 1.00 0.00 C ATOM 758 OG SER A 72 -7.069 4.606 6.728 1.00 0.00 O ATOM 0 H SER A 72 -8.730 3.913 3.337 1.00 0.00 H new ATOM 0 HA SER A 72 -6.899 2.404 4.932 1.00 0.00 H new ATOM 0 HB2 SER A 72 -6.435 4.698 4.768 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.103 5.165 5.034 1.00 0.00 H new ATOM 0 HG SER A 72 -7.896 4.468 7.235 1.00 0.00 H new ATOM 764 N THR A 73 -8.939 1.189 6.027 1.00 0.00 N ATOM 765 CA THR A 73 -9.802 0.539 6.998 1.00 0.00 C ATOM 766 C THR A 73 -9.481 1.031 8.411 1.00 0.00 C ATOM 767 O THR A 73 -8.537 0.553 9.039 1.00 0.00 O ATOM 768 CB THR A 73 -9.645 -0.974 6.831 1.00 0.00 C ATOM 769 OG1 THR A 73 -10.937 -1.414 6.423 1.00 0.00 O ATOM 770 CG2 THR A 73 -9.412 -1.689 8.164 1.00 0.00 C ATOM 0 H THR A 73 -8.537 0.564 5.328 1.00 0.00 H new ATOM 0 HA THR A 73 -10.849 0.793 6.830 1.00 0.00 H new ATOM 0 HB THR A 73 -8.813 -1.180 6.158 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.925 -2.385 6.290 1.00 0.00 H new ATOM 0 HG21 THR A 73 -9.307 -2.760 7.989 1.00 0.00 H new ATOM 0 HG22 THR A 73 -8.503 -1.306 8.628 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.260 -1.511 8.826 1.00 0.00 H new ATOM 778 N GLU A 74 -10.284 1.980 8.869 1.00 0.00 N ATOM 779 CA GLU A 74 -10.097 2.542 10.196 1.00 0.00 C ATOM 780 C GLU A 74 -10.782 3.907 10.295 1.00 0.00 C ATOM 781 O GLU A 74 -11.364 4.239 11.327 1.00 0.00 O ATOM 782 CB GLU A 74 -8.610 2.649 10.542 1.00 0.00 C ATOM 783 CG GLU A 74 -8.171 1.489 11.437 1.00 0.00 C ATOM 784 CD GLU A 74 -8.210 1.890 12.913 1.00 0.00 C ATOM 785 OE1 GLU A 74 -9.097 2.700 13.258 1.00 0.00 O ATOM 786 OE2 GLU A 74 -7.352 1.377 13.664 1.00 0.00 O ATOM 0 H GLU A 74 -11.065 2.374 8.345 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.558 1.872 10.922 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.019 2.650 9.626 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.418 3.596 11.047 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.823 0.631 11.272 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.161 1.179 11.167 1.00 0.00 H new ATOM 793 N THR A 75 -10.691 4.660 9.209 1.00 0.00 N ATOM 794 CA THR A 75 -11.295 5.981 9.161 1.00 0.00 C ATOM 795 C THR A 75 -12.345 6.047 8.051 1.00 0.00 C ATOM 796 O THR A 75 -13.274 5.241 8.021 1.00 0.00 O ATOM 797 CB THR A 75 -10.173 7.008 8.999 1.00 0.00 C ATOM 798 OG1 THR A 75 -9.729 6.828 7.657 1.00 0.00 O ATOM 799 CG2 THR A 75 -8.944 6.672 9.846 1.00 0.00 C ATOM 0 H THR A 75 -10.208 4.381 8.355 1.00 0.00 H new ATOM 0 HA THR A 75 -11.830 6.206 10.084 1.00 0.00 H new ATOM 0 HB THR A 75 -10.543 7.996 9.273 1.00 0.00 H new ATOM 0 HG1 THR A 75 -9.514 7.700 7.264 1.00 0.00 H new ATOM 0 HG21 THR A 75 -8.178 7.433 9.694 1.00 0.00 H new ATOM 0 HG22 THR A 75 -9.224 6.645 10.899 1.00 0.00 H new ATOM 0 HG23 THR A 75 -8.553 5.699 9.550 1.00 0.00 H new ATOM 807 N GLY A 76 -12.163 7.015 7.165 1.00 0.00 N ATOM 808 CA GLY A 76 -13.083 7.197 6.055 1.00 0.00 C ATOM 809 C GLY A 76 -12.346 7.680 4.805 1.00 0.00 C ATOM 810 O GLY A 76 -12.967 8.171 3.864 1.00 0.00 O ATOM 0 H GLY A 76 -11.392 7.682 7.193 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -13.591 6.257 5.841 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -13.852 7.919 6.330 1.00 0.00 H new ATOM 814 N GLN A 77 -11.030 7.525 4.835 1.00 0.00 N ATOM 815 CA GLN A 77 -10.201 7.939 3.716 1.00 0.00 C ATOM 816 C GLN A 77 -9.801 6.726 2.874 1.00 0.00 C ATOM 817 O GLN A 77 -10.422 5.669 2.968 1.00 0.00 O ATOM 818 CB GLN A 77 -8.967 8.702 4.201 1.00 0.00 C ATOM 819 CG GLN A 77 -8.930 10.115 3.615 1.00 0.00 C ATOM 820 CD GLN A 77 -8.458 11.129 4.660 1.00 0.00 C ATOM 821 OE1 GLN A 77 -7.305 11.525 4.701 1.00 0.00 O ATOM 822 NE2 GLN A 77 -9.412 11.525 5.498 1.00 0.00 N ATOM 0 H GLN A 77 -10.517 7.118 5.617 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.782 8.615 3.089 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.973 8.756 5.290 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -8.065 8.162 3.914 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -8.263 10.138 2.753 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -9.922 10.391 3.258 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -10.357 11.153 5.407 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -9.198 12.201 6.231 1.00 0.00 H new ATOM 831 N TYR A 78 -8.765 6.919 2.071 1.00 0.00 N ATOM 832 CA TYR A 78 -8.275 5.854 1.213 1.00 0.00 C ATOM 833 C TYR A 78 -6.775 6.010 0.949 1.00 0.00 C ATOM 834 O TYR A 78 -6.169 6.999 1.357 1.00 0.00 O ATOM 835 CB TYR A 78 -9.031 5.996 -0.110 1.00 0.00 C ATOM 836 CG TYR A 78 -10.494 5.554 -0.040 1.00 0.00 C ATOM 837 CD1 TYR A 78 -11.433 6.371 0.556 1.00 0.00 C ATOM 838 CD2 TYR A 78 -10.874 4.340 -0.574 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.811 5.955 0.621 1.00 0.00 C ATOM 840 CE2 TYR A 78 -12.251 3.924 -0.509 1.00 0.00 C ATOM 841 CZ TYR A 78 -13.151 4.752 0.086 1.00 0.00 C ATOM 842 OH TYR A 78 -14.452 4.359 0.147 1.00 0.00 O ATOM 0 H TYR A 78 -8.251 7.797 1.997 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.431 4.882 1.681 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -8.991 7.037 -0.430 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.521 5.409 -0.873 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -11.135 7.322 0.973 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -10.139 3.702 -1.041 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.557 6.584 1.084 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -12.562 2.976 -0.923 1.00 0.00 H new ATOM 0 HH TYR A 78 -14.548 3.480 -0.275 1.00 0.00 H new ATOM 852 N LEU A 79 -6.221 5.018 0.267 1.00 0.00 N ATOM 853 CA LEU A 79 -4.805 5.032 -0.056 1.00 0.00 C ATOM 854 C LEU A 79 -4.607 5.669 -1.433 1.00 0.00 C ATOM 855 O LEU A 79 -5.550 5.769 -2.216 1.00 0.00 O ATOM 856 CB LEU A 79 -4.214 3.625 0.061 1.00 0.00 C ATOM 857 CG LEU A 79 -2.761 3.545 0.533 1.00 0.00 C ATOM 858 CD1 LEU A 79 -2.541 4.403 1.780 1.00 0.00 C ATOM 859 CD2 LEU A 79 -2.336 2.092 0.754 1.00 0.00 C ATOM 0 H LEU A 79 -6.728 4.200 -0.071 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.257 5.643 0.661 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.831 3.049 0.751 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.286 3.140 -0.912 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.124 3.951 -0.253 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.500 4.328 2.094 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.777 5.443 1.553 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.189 4.051 2.583 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.299 2.063 1.089 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.975 1.637 1.511 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.431 1.539 -0.181 1.00 0.00 H new ATOM 871 N ALA A 80 -3.374 6.085 -1.685 1.00 0.00 N ATOM 872 CA ALA A 80 -3.040 6.710 -2.954 1.00 0.00 C ATOM 873 C ALA A 80 -1.542 7.020 -2.986 1.00 0.00 C ATOM 874 O ALA A 80 -0.811 6.664 -2.063 1.00 0.00 O ATOM 875 CB ALA A 80 -3.899 7.961 -3.148 1.00 0.00 C ATOM 0 H ALA A 80 -2.595 6.001 -1.032 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.255 6.035 -3.783 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.649 8.430 -4.100 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.953 7.683 -3.147 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.708 8.663 -2.336 1.00 0.00 H new ATOM 881 N MET A 81 -1.130 7.679 -4.059 1.00 0.00 N ATOM 882 CA MET A 81 0.268 8.041 -4.223 1.00 0.00 C ATOM 883 C MET A 81 0.406 9.357 -4.992 1.00 0.00 C ATOM 884 O MET A 81 0.413 9.363 -6.222 1.00 0.00 O ATOM 885 CB MET A 81 0.998 6.929 -4.979 1.00 0.00 C ATOM 886 CG MET A 81 2.451 6.814 -4.516 1.00 0.00 C ATOM 887 SD MET A 81 3.005 5.123 -4.654 1.00 0.00 S ATOM 888 CE MET A 81 4.772 5.373 -4.638 1.00 0.00 C ATOM 0 H MET A 81 -1.739 7.972 -4.823 1.00 0.00 H new ATOM 0 HA MET A 81 0.709 8.171 -3.235 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.486 5.980 -4.821 1.00 0.00 H new ATOM 0 HB3 MET A 81 0.969 7.132 -6.049 1.00 0.00 H new ATOM 0 HG2 MET A 81 3.086 7.463 -5.119 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.540 7.151 -3.483 1.00 0.00 H new ATOM 0 HE1 MET A 81 5.223 4.836 -5.472 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.990 6.437 -4.731 1.00 0.00 H new ATOM 0 HE3 MET A 81 5.184 4.999 -3.701 1.00 0.00 H new ATOM 898 N ASP A 82 0.513 10.439 -4.236 1.00 0.00 N ATOM 899 CA ASP A 82 0.652 11.757 -4.830 1.00 0.00 C ATOM 900 C ASP A 82 1.810 11.742 -5.830 1.00 0.00 C ATOM 901 O ASP A 82 2.588 10.790 -5.869 1.00 0.00 O ATOM 902 CB ASP A 82 0.960 12.812 -3.766 1.00 0.00 C ATOM 903 CG ASP A 82 -0.003 12.831 -2.577 1.00 0.00 C ATOM 904 OD1 ASP A 82 -1.223 12.902 -2.836 1.00 0.00 O ATOM 905 OD2 ASP A 82 0.504 12.774 -1.436 1.00 0.00 O ATOM 0 H ASP A 82 0.506 10.430 -3.216 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.289 12.005 -5.322 1.00 0.00 H new ATOM 0 HB2 ASP A 82 1.971 12.646 -3.393 1.00 0.00 H new ATOM 0 HB3 ASP A 82 0.951 13.795 -4.237 1.00 0.00 H new ATOM 910 N THR A 83 1.887 12.808 -6.614 1.00 0.00 N ATOM 911 CA THR A 83 2.937 12.929 -7.611 1.00 0.00 C ATOM 912 C THR A 83 4.314 12.872 -6.945 1.00 0.00 C ATOM 913 O THR A 83 5.322 12.654 -7.614 1.00 0.00 O ATOM 914 CB THR A 83 2.695 14.218 -8.398 1.00 0.00 C ATOM 915 OG1 THR A 83 1.280 14.266 -8.560 1.00 0.00 O ATOM 916 CG2 THR A 83 3.231 14.140 -9.829 1.00 0.00 C ATOM 0 H THR A 83 1.239 13.595 -6.579 1.00 0.00 H new ATOM 0 HA THR A 83 2.915 12.095 -8.312 1.00 0.00 H new ATOM 0 HB THR A 83 3.165 15.053 -7.879 1.00 0.00 H new ATOM 0 HG1 THR A 83 0.902 14.924 -7.940 1.00 0.00 H new ATOM 0 HG21 THR A 83 3.033 15.080 -10.343 1.00 0.00 H new ATOM 0 HG22 THR A 83 4.305 13.958 -9.806 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.737 13.326 -10.359 1.00 0.00 H new ATOM 924 N ASP A 84 4.311 13.074 -5.636 1.00 0.00 N ATOM 925 CA ASP A 84 5.547 13.049 -4.872 1.00 0.00 C ATOM 926 C ASP A 84 5.930 11.597 -4.578 1.00 0.00 C ATOM 927 O ASP A 84 6.917 11.339 -3.891 1.00 0.00 O ATOM 928 CB ASP A 84 5.384 13.775 -3.536 1.00 0.00 C ATOM 929 CG ASP A 84 5.561 15.293 -3.599 1.00 0.00 C ATOM 930 OD1 ASP A 84 6.444 15.730 -4.368 1.00 0.00 O ATOM 931 OD2 ASP A 84 4.809 15.983 -2.877 1.00 0.00 O ATOM 0 H ASP A 84 3.472 13.256 -5.085 1.00 0.00 H new ATOM 0 HA ASP A 84 6.317 13.547 -5.461 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.393 13.556 -3.139 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.107 13.369 -2.829 1.00 0.00 H new ATOM 936 N GLY A 85 5.129 10.687 -5.112 1.00 0.00 N ATOM 937 CA GLY A 85 5.372 9.268 -4.915 1.00 0.00 C ATOM 938 C GLY A 85 5.339 8.907 -3.428 1.00 0.00 C ATOM 939 O GLY A 85 5.812 7.843 -3.034 1.00 0.00 O ATOM 0 H GLY A 85 4.311 10.905 -5.681 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.620 8.689 -5.450 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.341 8.999 -5.337 1.00 0.00 H new ATOM 943 N LEU A 86 4.775 9.815 -2.645 1.00 0.00 N ATOM 944 CA LEU A 86 4.674 9.606 -1.210 1.00 0.00 C ATOM 945 C LEU A 86 3.280 9.073 -0.874 1.00 0.00 C ATOM 946 O LEU A 86 2.295 9.804 -0.959 1.00 0.00 O ATOM 947 CB LEU A 86 5.043 10.884 -0.455 1.00 0.00 C ATOM 948 CG LEU A 86 5.588 10.693 0.962 1.00 0.00 C ATOM 949 CD1 LEU A 86 5.820 12.041 1.646 1.00 0.00 C ATOM 950 CD2 LEU A 86 4.673 9.783 1.783 1.00 0.00 C ATOM 0 H LEU A 86 4.383 10.697 -2.977 1.00 0.00 H new ATOM 0 HA LEU A 86 5.391 8.853 -0.883 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.787 11.425 -1.039 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.158 11.518 -0.400 1.00 0.00 H new ATOM 0 HG LEU A 86 6.556 10.197 0.892 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.207 11.877 2.652 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.540 12.622 1.070 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.878 12.586 1.705 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.083 9.664 2.786 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.680 10.228 1.848 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.603 8.808 1.301 1.00 0.00 H new ATOM 962 N LEU A 87 3.241 7.802 -0.499 1.00 0.00 N ATOM 963 CA LEU A 87 1.984 7.163 -0.150 1.00 0.00 C ATOM 964 C LEU A 87 1.112 8.153 0.626 1.00 0.00 C ATOM 965 O LEU A 87 1.499 8.621 1.696 1.00 0.00 O ATOM 966 CB LEU A 87 2.239 5.852 0.596 1.00 0.00 C ATOM 967 CG LEU A 87 2.599 4.645 -0.272 1.00 0.00 C ATOM 968 CD1 LEU A 87 4.115 4.529 -0.447 1.00 0.00 C ATOM 969 CD2 LEU A 87 1.987 3.361 0.292 1.00 0.00 C ATOM 0 H LEU A 87 4.060 7.198 -0.429 1.00 0.00 H new ATOM 0 HA LEU A 87 1.433 6.889 -1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.046 6.015 1.310 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.348 5.606 1.173 1.00 0.00 H new ATOM 0 HG LEU A 87 2.171 4.797 -1.263 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.344 3.663 -1.068 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.496 5.431 -0.927 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.586 4.411 0.529 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.259 2.519 -0.344 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.364 3.191 1.300 1.00 0.00 H new ATOM 0 HD23 LEU A 87 0.902 3.458 0.322 1.00 0.00 H new ATOM 981 N TYR A 88 -0.049 8.442 0.056 1.00 0.00 N ATOM 982 CA TYR A 88 -0.979 9.367 0.681 1.00 0.00 C ATOM 983 C TYR A 88 -2.426 8.931 0.448 1.00 0.00 C ATOM 984 O TYR A 88 -2.694 8.087 -0.406 1.00 0.00 O ATOM 985 CB TYR A 88 -0.750 10.718 0.000 1.00 0.00 C ATOM 986 CG TYR A 88 -1.802 11.070 -1.054 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.821 10.400 -2.260 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.733 12.056 -0.798 1.00 0.00 C ATOM 989 CE1 TYR A 88 -2.811 10.730 -3.252 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.723 12.387 -1.790 1.00 0.00 C ATOM 991 CZ TYR A 88 -3.713 11.708 -2.968 1.00 0.00 C ATOM 992 OH TYR A 88 -4.648 12.020 -3.905 1.00 0.00 O ATOM 0 H TYR A 88 -0.367 8.052 -0.831 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.815 9.408 1.758 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.737 11.499 0.760 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.233 10.714 -0.470 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -1.093 9.628 -2.460 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.719 12.580 0.147 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -2.837 10.213 -4.200 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.457 13.157 -1.603 1.00 0.00 H new ATOM 0 HH TYR A 88 -5.226 12.735 -3.565 1.00 0.00 H new ATOM 1002 N GLY A 89 -3.322 9.525 1.223 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.735 9.207 1.112 1.00 0.00 C ATOM 1004 C GLY A 89 -5.550 10.451 0.748 1.00 0.00 C ATOM 1005 O GLY A 89 -5.119 11.575 1.001 1.00 0.00 O ATOM 0 H GLY A 89 -3.096 10.225 1.930 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.880 8.438 0.353 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.094 8.796 2.055 1.00 0.00 H new ATOM 1009 N SER A 90 -6.712 10.207 0.160 1.00 0.00 N ATOM 1010 CA SER A 90 -7.590 11.293 -0.241 1.00 0.00 C ATOM 1011 C SER A 90 -9.045 10.820 -0.230 1.00 0.00 C ATOM 1012 O SER A 90 -9.314 9.625 -0.340 1.00 0.00 O ATOM 1013 CB SER A 90 -7.214 11.822 -1.626 1.00 0.00 C ATOM 1014 OG SER A 90 -7.377 13.235 -1.720 1.00 0.00 O ATOM 0 H SER A 90 -7.066 9.273 -0.048 1.00 0.00 H new ATOM 0 HA SER A 90 -7.474 12.108 0.473 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.179 11.561 -1.845 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.832 11.335 -2.380 1.00 0.00 H new ATOM 0 HG SER A 90 -7.125 13.534 -2.619 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.945 11.783 -0.098 1.00 0.00 N ATOM 1021 CA GLN A 91 -11.366 11.480 -0.072 1.00 0.00 C ATOM 1022 C GLN A 91 -11.944 11.521 -1.488 1.00 0.00 C ATOM 1023 O GLN A 91 -13.120 11.828 -1.674 1.00 0.00 O ATOM 1024 CB GLN A 91 -12.115 12.441 0.854 1.00 0.00 C ATOM 1025 CG GLN A 91 -13.400 11.803 1.383 1.00 0.00 C ATOM 1026 CD GLN A 91 -14.225 12.813 2.184 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -14.376 12.712 3.391 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -14.747 13.789 1.448 1.00 0.00 N ATOM 0 H GLN A 91 -9.718 12.773 -0.008 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.495 10.472 0.323 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -11.473 12.721 1.689 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -12.355 13.358 0.315 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.992 11.424 0.550 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -13.153 10.949 2.013 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -14.581 13.814 0.442 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -15.313 14.513 1.889 1.00 0.00 H new ATOM 1037 N THR A 92 -11.089 11.208 -2.451 1.00 0.00 N ATOM 1038 CA THR A 92 -11.500 11.205 -3.844 1.00 0.00 C ATOM 1039 C THR A 92 -11.000 9.940 -4.545 1.00 0.00 C ATOM 1040 O THR A 92 -9.912 9.932 -5.118 1.00 0.00 O ATOM 1041 CB THR A 92 -10.994 12.497 -4.489 1.00 0.00 C ATOM 1042 OG1 THR A 92 -9.600 12.268 -4.678 1.00 0.00 O ATOM 1043 CG2 THR A 92 -11.049 13.689 -3.532 1.00 0.00 C ATOM 0 H THR A 92 -10.114 10.955 -2.293 1.00 0.00 H new ATOM 0 HA THR A 92 -12.586 11.182 -3.936 1.00 0.00 H new ATOM 0 HB THR A 92 -11.587 12.716 -5.377 1.00 0.00 H new ATOM 0 HG1 THR A 92 -9.472 11.501 -5.275 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.679 14.580 -4.039 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.079 13.853 -3.214 1.00 0.00 H new ATOM 0 HG23 THR A 92 -10.429 13.484 -2.660 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.842 8.874 -4.475 1.00 0.00 N ATOM 1052 CA PRO A 93 -11.497 7.606 -5.096 1.00 0.00 C ATOM 1053 C PRO A 93 -11.658 7.678 -6.616 1.00 0.00 C ATOM 1054 O PRO A 93 -12.769 7.563 -7.132 1.00 0.00 O ATOM 1055 CB PRO A 93 -12.419 6.587 -4.448 1.00 0.00 C ATOM 1056 CG PRO A 93 -13.557 7.386 -3.834 1.00 0.00 C ATOM 1057 CD PRO A 93 -13.139 8.847 -3.806 1.00 0.00 C ATOM 0 HA PRO A 93 -10.453 7.332 -4.943 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.794 5.876 -5.184 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.892 6.011 -3.688 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -14.469 7.261 -4.417 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.772 7.031 -2.826 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.864 9.476 -4.322 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -13.065 9.218 -2.784 1.00 0.00 H new ATOM 1065 N ASN A 94 -10.534 7.868 -7.290 1.00 0.00 N ATOM 1066 CA ASN A 94 -10.536 7.957 -8.741 1.00 0.00 C ATOM 1067 C ASN A 94 -9.150 7.587 -9.273 1.00 0.00 C ATOM 1068 O ASN A 94 -8.422 6.823 -8.641 1.00 0.00 O ATOM 1069 CB ASN A 94 -10.858 9.379 -9.205 1.00 0.00 C ATOM 1070 CG ASN A 94 -11.983 9.988 -8.367 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.610 10.351 -7.143 1.00 0.00 O flip ATOM 1072 ND2 ASN A 94 -13.115 10.120 -8.802 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.615 7.963 -6.858 1.00 0.00 H new ATOM 0 HA ASN A 94 -11.296 7.274 -9.120 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.966 10.001 -9.129 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.149 9.365 -10.255 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.335 9.820 -9.752 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -13.842 10.530 -8.216 1.00 0.00 H new ATOM 1079 N GLU A 95 -8.827 8.147 -10.429 1.00 0.00 N ATOM 1080 CA GLU A 95 -7.541 7.886 -11.053 1.00 0.00 C ATOM 1081 C GLU A 95 -6.410 8.469 -10.202 1.00 0.00 C ATOM 1082 O GLU A 95 -5.768 9.440 -10.598 1.00 0.00 O ATOM 1083 CB GLU A 95 -7.499 8.445 -12.477 1.00 0.00 C ATOM 1084 CG GLU A 95 -8.373 7.614 -13.418 1.00 0.00 C ATOM 1085 CD GLU A 95 -9.778 8.209 -13.529 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -9.870 9.363 -14.000 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -10.729 7.496 -13.141 1.00 0.00 O ATOM 0 H GLU A 95 -9.433 8.780 -10.950 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.403 6.807 -11.117 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.842 9.480 -12.476 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.471 8.450 -12.839 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.913 7.572 -14.405 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.436 6.589 -13.052 1.00 0.00 H new ATOM 1094 N GLU A 96 -6.201 7.850 -9.049 1.00 0.00 N ATOM 1095 CA GLU A 96 -5.159 8.294 -8.139 1.00 0.00 C ATOM 1096 C GLU A 96 -5.099 7.380 -6.914 1.00 0.00 C ATOM 1097 O GLU A 96 -4.016 6.997 -6.474 1.00 0.00 O ATOM 1098 CB GLU A 96 -5.377 9.751 -7.726 1.00 0.00 C ATOM 1099 CG GLU A 96 -4.366 10.175 -6.659 1.00 0.00 C ATOM 1100 CD GLU A 96 -4.106 11.682 -6.718 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -4.874 12.363 -7.430 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -3.144 12.118 -6.050 1.00 0.00 O ATOM 0 H GLU A 96 -6.736 7.044 -8.724 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.202 8.237 -8.658 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.284 10.398 -8.598 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -6.390 9.877 -7.343 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.740 9.905 -5.671 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -3.430 9.635 -6.804 1.00 0.00 H new ATOM 1109 N CYS A 97 -6.276 7.057 -6.398 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.371 6.195 -5.232 1.00 0.00 C ATOM 1111 C CYS A 97 -6.128 4.753 -5.680 1.00 0.00 C ATOM 1112 O CYS A 97 -5.678 3.922 -4.893 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.716 6.353 -4.520 1.00 0.00 C ATOM 1114 SG CYS A 97 -7.978 4.960 -3.363 1.00 0.00 S ATOM 0 H CYS A 97 -7.172 7.377 -6.766 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.613 6.480 -4.503 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -7.741 7.298 -3.977 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -8.523 6.385 -5.252 1.00 0.00 H new ATOM 0 HG CYS A 97 -6.908 4.784 -2.647 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.438 4.499 -6.943 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.259 3.171 -7.505 1.00 0.00 C ATOM 1122 C LEU A 98 -4.786 2.772 -7.402 1.00 0.00 C ATOM 1123 O LEU A 98 -3.943 3.588 -7.031 1.00 0.00 O ATOM 1124 CB LEU A 98 -6.814 3.114 -8.930 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.220 2.530 -9.080 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -8.978 3.210 -10.222 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.167 1.010 -9.252 1.00 0.00 C ATOM 0 H LEU A 98 -6.812 5.190 -7.593 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.828 2.436 -6.936 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.817 4.125 -9.338 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.130 2.525 -9.541 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.773 2.731 -8.162 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.974 2.776 -10.307 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.063 4.277 -10.017 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.437 3.062 -11.157 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.180 0.620 -9.356 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.590 0.765 -10.144 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.694 0.561 -8.379 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.521 1.518 -7.737 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.164 1.001 -7.687 1.00 0.00 C ATOM 1141 C PHE A 99 -2.964 -0.117 -8.712 1.00 0.00 C ATOM 1142 O PHE A 99 -3.434 -1.236 -8.514 1.00 0.00 O ATOM 1143 CB PHE A 99 -2.953 0.433 -6.282 1.00 0.00 C ATOM 1144 CG PHE A 99 -1.936 1.208 -5.443 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -0.787 1.659 -6.013 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.181 1.446 -4.126 1.00 0.00 C ATOM 1147 CE1 PHE A 99 0.158 2.378 -5.234 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.236 2.166 -3.347 1.00 0.00 C ATOM 1149 CZ PHE A 99 -0.087 2.617 -3.918 1.00 0.00 C ATOM 0 H PHE A 99 -5.223 0.845 -8.044 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.455 1.797 -7.915 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -3.909 0.423 -5.758 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.625 -0.603 -6.366 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.593 1.470 -7.059 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.094 1.088 -3.673 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.071 2.735 -5.687 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.430 2.355 -2.302 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.631 3.165 -3.326 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.267 0.225 -9.785 1.00 0.00 N ATOM 1160 CA LEU A 100 -2.000 -0.736 -10.842 1.00 0.00 C ATOM 1161 C LEU A 100 -1.528 -2.052 -10.221 1.00 0.00 C ATOM 1162 O LEU A 100 -0.355 -2.196 -9.879 1.00 0.00 O ATOM 1163 CB LEU A 100 -1.022 -0.152 -11.863 1.00 0.00 C ATOM 1164 CG LEU A 100 -1.579 0.083 -13.268 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -0.894 1.276 -13.938 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -1.480 -1.186 -14.117 1.00 0.00 C ATOM 0 H LEU A 100 -1.879 1.154 -9.946 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.912 -0.954 -11.398 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.650 0.797 -11.478 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.166 -0.822 -11.941 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.637 0.329 -13.178 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.309 1.421 -14.936 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.061 2.173 -13.342 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.176 1.085 -14.014 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.883 -0.991 -15.111 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.436 -1.487 -14.201 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.051 -1.985 -13.644 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.466 -2.979 -10.094 1.00 0.00 N ATOM 1179 CA GLU A 101 -2.160 -4.279 -9.520 1.00 0.00 C ATOM 1180 C GLU A 101 -1.484 -5.173 -10.561 1.00 0.00 C ATOM 1181 O GLU A 101 -1.570 -4.910 -11.760 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.421 -4.942 -8.963 1.00 0.00 C ATOM 1183 CG GLU A 101 -3.100 -5.772 -7.718 1.00 0.00 C ATOM 1184 CD GLU A 101 -4.355 -6.463 -7.181 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -4.638 -7.581 -7.664 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -5.003 -5.859 -6.300 1.00 0.00 O ATOM 0 H GLU A 101 -3.438 -2.856 -10.378 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.468 -4.135 -8.690 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -4.158 -4.179 -8.715 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.867 -5.581 -9.725 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.344 -6.519 -7.960 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.677 -5.129 -6.947 1.00 0.00 H new ATOM 1193 N ARG A 102 -0.828 -6.212 -10.065 1.00 0.00 N ATOM 1194 CA ARG A 102 -0.138 -7.147 -10.938 1.00 0.00 C ATOM 1195 C ARG A 102 0.539 -8.243 -10.112 1.00 0.00 C ATOM 1196 O ARG A 102 1.750 -8.206 -9.898 1.00 0.00 O ATOM 1197 CB ARG A 102 0.917 -6.433 -11.786 1.00 0.00 C ATOM 1198 CG ARG A 102 1.554 -5.278 -11.011 1.00 0.00 C ATOM 1199 CD ARG A 102 3.081 -5.353 -11.071 1.00 0.00 C ATOM 1200 NE ARG A 102 3.616 -4.198 -11.826 1.00 0.00 N ATOM 1201 CZ ARG A 102 4.825 -4.172 -12.402 1.00 0.00 C ATOM 1202 NH1 ARG A 102 5.633 -5.238 -12.313 1.00 0.00 N ATOM 1203 NH2 ARG A 102 5.227 -3.081 -13.068 1.00 0.00 N ATOM 0 H ARG A 102 -0.760 -6.427 -9.070 1.00 0.00 H new ATOM 0 HA ARG A 102 -0.880 -7.592 -11.601 1.00 0.00 H new ATOM 0 HB2 ARG A 102 1.688 -7.142 -12.087 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.459 -6.054 -12.699 1.00 0.00 H new ATOM 0 HG2 ARG A 102 1.217 -4.328 -11.425 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.226 -5.308 -9.972 1.00 0.00 H new ATOM 0 HD2 ARG A 102 3.493 -5.360 -10.062 1.00 0.00 H new ATOM 0 HD3 ARG A 102 3.389 -6.284 -11.548 1.00 0.00 H new ATOM 0 HE ARG A 102 3.027 -3.370 -11.913 1.00 0.00 H new ATOM 0 HH11 ARG A 102 5.327 -6.069 -11.807 1.00 0.00 H new ATOM 0 HH12 ARG A 102 6.554 -5.218 -12.752 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.612 -2.270 -13.136 1.00 0.00 H new ATOM 0 HH22 ARG A 102 6.148 -3.062 -13.506 1.00 0.00 H new ATOM 1217 N LEU A 103 -0.273 -9.192 -9.670 1.00 0.00 N ATOM 1218 CA LEU A 103 0.232 -10.297 -8.873 1.00 0.00 C ATOM 1219 C LEU A 103 1.668 -10.612 -9.297 1.00 0.00 C ATOM 1220 O LEU A 103 1.888 -11.354 -10.253 1.00 0.00 O ATOM 1221 CB LEU A 103 -0.712 -11.498 -8.962 1.00 0.00 C ATOM 1222 CG LEU A 103 -0.419 -12.654 -8.004 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -0.829 -12.299 -6.573 1.00 0.00 C ATOM 1224 CD2 LEU A 103 -1.081 -13.947 -8.486 1.00 0.00 C ATOM 0 H LEU A 103 -1.277 -9.219 -9.849 1.00 0.00 H new ATOM 0 HA LEU A 103 0.263 -10.022 -7.819 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.729 -11.150 -8.780 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.685 -11.882 -9.982 1.00 0.00 H new ATOM 0 HG LEU A 103 0.657 -12.826 -7.997 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.610 -13.138 -5.913 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.273 -11.422 -6.242 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.897 -12.084 -6.543 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.857 -14.753 -7.787 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.160 -13.804 -8.542 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.698 -14.206 -9.473 1.00 0.00 H new ATOM 1236 N GLU A 104 2.608 -10.033 -8.565 1.00 0.00 N ATOM 1237 CA GLU A 104 4.017 -10.242 -8.853 1.00 0.00 C ATOM 1238 C GLU A 104 4.323 -11.738 -8.944 1.00 0.00 C ATOM 1239 O GLU A 104 5.087 -12.168 -9.807 1.00 0.00 O ATOM 1240 CB GLU A 104 4.898 -9.565 -7.802 1.00 0.00 C ATOM 1241 CG GLU A 104 6.328 -10.107 -7.853 1.00 0.00 C ATOM 1242 CD GLU A 104 6.477 -11.347 -6.970 1.00 0.00 C ATOM 1243 OE1 GLU A 104 5.444 -11.772 -6.410 1.00 0.00 O ATOM 1244 OE2 GLU A 104 7.621 -11.842 -6.876 1.00 0.00 O ATOM 0 H GLU A 104 2.422 -9.419 -7.772 1.00 0.00 H new ATOM 0 HA GLU A 104 4.243 -9.785 -9.817 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.907 -8.488 -7.969 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.478 -9.730 -6.810 1.00 0.00 H new ATOM 0 HG2 GLU A 104 6.590 -10.355 -8.882 1.00 0.00 H new ATOM 0 HG3 GLU A 104 7.025 -9.336 -7.524 1.00 0.00 H new ATOM 1251 N GLU A 105 3.712 -12.491 -8.041 1.00 0.00 N ATOM 1252 CA GLU A 105 3.909 -13.930 -8.009 1.00 0.00 C ATOM 1253 C GLU A 105 2.560 -14.650 -7.958 1.00 0.00 C ATOM 1254 O GLU A 105 1.839 -14.697 -8.953 1.00 0.00 O ATOM 1255 CB GLU A 105 4.792 -14.336 -6.827 1.00 0.00 C ATOM 1256 CG GLU A 105 4.940 -15.857 -6.749 1.00 0.00 C ATOM 1257 CD GLU A 105 4.782 -16.350 -5.309 1.00 0.00 C ATOM 1258 OE1 GLU A 105 3.619 -16.572 -4.909 1.00 0.00 O ATOM 1259 OE2 GLU A 105 5.829 -16.492 -4.641 1.00 0.00 O ATOM 0 H GLU A 105 3.080 -12.131 -7.326 1.00 0.00 H new ATOM 0 HA GLU A 105 4.423 -14.227 -8.923 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.775 -13.876 -6.928 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.359 -13.961 -5.900 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.192 -16.332 -7.384 1.00 0.00 H new ATOM 0 HG3 GLU A 105 5.917 -16.151 -7.133 1.00 0.00 H new ATOM 1266 N ASN A 106 2.260 -15.195 -6.787 1.00 0.00 N ATOM 1267 CA ASN A 106 1.010 -15.910 -6.594 1.00 0.00 C ATOM 1268 C ASN A 106 0.443 -15.572 -5.214 1.00 0.00 C ATOM 1269 O ASN A 106 -0.075 -16.446 -4.520 1.00 0.00 O ATOM 1270 CB ASN A 106 1.227 -17.424 -6.657 1.00 0.00 C ATOM 1271 CG ASN A 106 0.005 -18.128 -7.251 1.00 0.00 C ATOM 1272 OD1 ASN A 106 -0.343 -17.953 -8.407 1.00 0.00 O ATOM 1273 ND2 ASN A 106 -0.624 -18.930 -6.398 1.00 0.00 N ATOM 0 H ASN A 106 2.861 -15.156 -5.964 1.00 0.00 H new ATOM 0 HA ASN A 106 0.323 -15.610 -7.386 1.00 0.00 H new ATOM 0 HB2 ASN A 106 2.107 -17.644 -7.261 1.00 0.00 H new ATOM 0 HB3 ASN A 106 1.422 -17.809 -5.656 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -1.452 -19.445 -6.698 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -0.279 -19.031 -5.443 1.00 0.00 H new ATOM 1280 N HIS A 107 0.558 -14.301 -4.857 1.00 0.00 N ATOM 1281 CA HIS A 107 0.063 -13.836 -3.573 1.00 0.00 C ATOM 1282 C HIS A 107 0.291 -12.328 -3.450 1.00 0.00 C ATOM 1283 O HIS A 107 -0.659 -11.547 -3.489 1.00 0.00 O ATOM 1284 CB HIS A 107 0.697 -14.627 -2.427 1.00 0.00 C ATOM 1285 CG HIS A 107 -0.093 -15.845 -2.011 1.00 0.00 C ATOM 1286 ND1 HIS A 107 -1.418 -16.139 -2.151 1.00 0.00 N flip ATOM 1287 CD2 HIS A 107 0.481 -16.927 -1.367 1.00 0.00 C flip ATOM 1288 CE1 HIS A 107 -1.640 -17.336 -1.624 1.00 0.00 C flip ATOM 1289 NE2 HIS A 107 -0.464 -17.826 -1.137 1.00 0.00 N flip ATOM 0 H HIS A 107 0.987 -13.579 -5.435 1.00 0.00 H new ATOM 0 HA HIS A 107 -1.011 -14.012 -3.508 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.698 -14.940 -2.725 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.812 -13.969 -1.565 1.00 0.00 H new ATOM 0 HD2 HIS A 107 1.523 -17.022 -1.098 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.595 -17.840 -1.587 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -0.335 -18.727 -0.676 1.00 0.00 H new ATOM 1297 N TYR A 108 1.557 -11.964 -3.304 1.00 0.00 N ATOM 1298 CA TYR A 108 1.922 -10.563 -3.175 1.00 0.00 C ATOM 1299 C TYR A 108 1.365 -9.742 -4.339 1.00 0.00 C ATOM 1300 O TYR A 108 1.550 -10.100 -5.501 1.00 0.00 O ATOM 1301 CB TYR A 108 3.451 -10.520 -3.222 1.00 0.00 C ATOM 1302 CG TYR A 108 4.131 -11.525 -2.290 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.777 -11.578 -0.957 1.00 0.00 C ATOM 1304 CD2 TYR A 108 5.097 -12.379 -2.782 1.00 0.00 C ATOM 1305 CE1 TYR A 108 4.417 -12.523 -0.079 1.00 0.00 C ATOM 1306 CE2 TYR A 108 5.737 -13.324 -1.904 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.365 -13.350 -0.596 1.00 0.00 C ATOM 1308 OH TYR A 108 5.969 -14.243 0.233 1.00 0.00 O ATOM 0 H TYR A 108 2.342 -12.614 -3.272 1.00 0.00 H new ATOM 0 HA TYR A 108 1.520 -10.145 -2.252 1.00 0.00 H new ATOM 0 HB2 TYR A 108 3.778 -10.709 -4.244 1.00 0.00 H new ATOM 0 HB3 TYR A 108 3.784 -9.515 -2.961 1.00 0.00 H new ATOM 0 HD1 TYR A 108 3.020 -10.911 -0.572 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.373 -12.339 -3.825 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.150 -12.574 0.966 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.495 -13.997 -2.276 1.00 0.00 H new ATOM 0 HH TYR A 108 6.623 -14.768 -0.273 1.00 0.00 H new ATOM 1318 N ASN A 109 0.693 -8.655 -3.987 1.00 0.00 N ATOM 1319 CA ASN A 109 0.108 -7.780 -4.988 1.00 0.00 C ATOM 1320 C ASN A 109 0.949 -6.507 -5.101 1.00 0.00 C ATOM 1321 O ASN A 109 0.644 -5.498 -4.467 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.315 -7.373 -4.599 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.343 -8.335 -5.197 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -2.209 -8.525 -6.507 1.00 0.00 O flip ATOM 1325 ND2 ASN A 109 -3.202 -8.870 -4.515 1.00 0.00 N flip ATOM 0 H ASN A 109 0.541 -8.361 -3.022 1.00 0.00 H new ATOM 0 HA ASN A 109 0.083 -8.320 -5.935 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -1.410 -7.362 -3.513 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -1.515 -6.359 -4.946 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -3.250 -8.681 -3.514 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -3.872 -9.506 -4.946 1.00 0.00 H new ATOM 1332 N THR A 110 1.992 -6.596 -5.914 1.00 0.00 N ATOM 1333 CA THR A 110 2.879 -5.464 -6.118 1.00 0.00 C ATOM 1334 C THR A 110 2.215 -4.421 -7.019 1.00 0.00 C ATOM 1335 O THR A 110 2.280 -4.521 -8.244 1.00 0.00 O ATOM 1336 CB THR A 110 4.202 -5.994 -6.676 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.849 -6.542 -7.944 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.731 -7.193 -5.887 1.00 0.00 C ATOM 0 H THR A 110 2.242 -7.434 -6.439 1.00 0.00 H new ATOM 0 HA THR A 110 3.087 -4.951 -5.179 1.00 0.00 H new ATOM 0 HB THR A 110 4.945 -5.197 -6.667 1.00 0.00 H new ATOM 0 HG1 THR A 110 2.985 -6.177 -8.229 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.671 -7.530 -6.324 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.897 -6.902 -4.850 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.003 -8.003 -5.924 1.00 0.00 H new ATOM 1346 N TYR A 111 1.591 -3.444 -6.379 1.00 0.00 N ATOM 1347 CA TYR A 111 0.915 -2.383 -7.107 1.00 0.00 C ATOM 1348 C TYR A 111 1.916 -1.349 -7.624 1.00 0.00 C ATOM 1349 O TYR A 111 3.126 -1.545 -7.520 1.00 0.00 O ATOM 1350 CB TYR A 111 -0.021 -1.711 -6.100 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.836 -2.692 -5.256 1.00 0.00 C ATOM 1352 CD1 TYR A 111 -0.321 -3.173 -4.068 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -2.084 -3.097 -5.681 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -1.088 -4.097 -3.274 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -2.851 -4.021 -4.886 1.00 0.00 C ATOM 1356 CZ TYR A 111 -2.315 -4.475 -3.722 1.00 0.00 C ATOM 1357 OH TYR A 111 -3.040 -5.348 -2.971 1.00 0.00 O ATOM 0 H TYR A 111 1.539 -3.364 -5.363 1.00 0.00 H new ATOM 0 HA TYR A 111 0.382 -2.787 -7.968 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.570 -1.080 -5.436 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.705 -1.055 -6.638 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.656 -2.856 -3.735 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.486 -2.721 -6.610 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -0.698 -4.481 -2.343 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.830 -4.346 -5.207 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.636 -5.428 -2.082 1.00 0.00 H new ATOM 1367 N ILE A 112 1.375 -0.270 -8.171 1.00 0.00 N ATOM 1368 CA ILE A 112 2.206 0.795 -8.705 1.00 0.00 C ATOM 1369 C ILE A 112 1.346 2.039 -8.937 1.00 0.00 C ATOM 1370 O ILE A 112 0.355 1.986 -9.663 1.00 0.00 O ATOM 1371 CB ILE A 112 2.950 0.320 -9.954 1.00 0.00 C ATOM 1372 CG1 ILE A 112 4.435 0.098 -9.657 1.00 0.00 C ATOM 1373 CG2 ILE A 112 2.737 1.287 -11.121 1.00 0.00 C ATOM 1374 CD1 ILE A 112 5.094 -0.740 -10.755 1.00 0.00 C ATOM 0 H ILE A 112 0.371 -0.111 -8.256 1.00 0.00 H new ATOM 0 HA ILE A 112 2.979 1.070 -7.988 1.00 0.00 H new ATOM 0 HB ILE A 112 2.534 -0.642 -10.253 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.941 1.060 -9.575 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.546 -0.403 -8.696 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.277 0.926 -11.996 1.00 0.00 H new ATOM 0 HG22 ILE A 112 1.674 1.351 -11.351 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.109 2.275 -10.848 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.149 -0.883 -10.520 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.601 -1.710 -10.817 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.002 -0.224 -11.711 1.00 0.00 H new ATOM 1386 N SER A 113 1.757 3.130 -8.307 1.00 0.00 N ATOM 1387 CA SER A 113 1.037 4.385 -8.436 1.00 0.00 C ATOM 1388 C SER A 113 0.457 4.513 -9.846 1.00 0.00 C ATOM 1389 O SER A 113 1.165 4.886 -10.781 1.00 0.00 O ATOM 1390 CB SER A 113 1.945 5.576 -8.126 1.00 0.00 C ATOM 1391 OG SER A 113 2.909 5.795 -9.152 1.00 0.00 O ATOM 0 H SER A 113 2.580 3.170 -7.706 1.00 0.00 H new ATOM 0 HA SER A 113 0.222 4.387 -7.713 1.00 0.00 H new ATOM 0 HB2 SER A 113 1.337 6.472 -8.003 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.457 5.405 -7.179 1.00 0.00 H new ATOM 0 HG SER A 113 2.674 5.262 -9.940 1.00 0.00 H new ATOM 1397 N LYS A 114 -0.825 4.197 -9.956 1.00 0.00 N ATOM 1398 CA LYS A 114 -1.508 4.272 -11.236 1.00 0.00 C ATOM 1399 C LYS A 114 -1.543 5.728 -11.706 1.00 0.00 C ATOM 1400 O LYS A 114 -1.682 5.996 -12.898 1.00 0.00 O ATOM 1401 CB LYS A 114 -2.889 3.622 -11.146 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.261 2.938 -12.463 1.00 0.00 C ATOM 1403 CD LYS A 114 -4.459 3.627 -13.120 1.00 0.00 C ATOM 1404 CE LYS A 114 -4.925 2.855 -14.356 1.00 0.00 C ATOM 1405 NZ LYS A 114 -3.984 3.059 -15.480 1.00 0.00 N ATOM 0 H LYS A 114 -1.409 3.888 -9.179 1.00 0.00 H new ATOM 0 HA LYS A 114 -0.964 3.705 -11.991 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.899 2.891 -10.337 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.635 4.378 -10.901 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.408 2.959 -13.141 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.496 1.890 -12.279 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.277 3.703 -12.404 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.188 4.644 -13.403 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.997 1.793 -14.123 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -5.923 3.186 -14.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.315 2.528 -16.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.936 4.071 -15.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.039 2.721 -15.207 1.00 0.00 H new ATOM 1419 N LYS A 115 -1.415 6.630 -10.744 1.00 0.00 N ATOM 1420 CA LYS A 115 -1.430 8.052 -11.044 1.00 0.00 C ATOM 1421 C LYS A 115 -0.133 8.432 -11.760 1.00 0.00 C ATOM 1422 O LYS A 115 0.019 9.563 -12.219 1.00 0.00 O ATOM 1423 CB LYS A 115 -1.693 8.864 -9.775 1.00 0.00 C ATOM 1424 CG LYS A 115 -2.445 10.157 -10.097 1.00 0.00 C ATOM 1425 CD LYS A 115 -1.745 11.368 -9.477 1.00 0.00 C ATOM 1426 CE LYS A 115 -0.963 12.150 -10.534 1.00 0.00 C ATOM 1427 NZ LYS A 115 -1.834 13.154 -11.185 1.00 0.00 N ATOM 0 H LYS A 115 -1.300 6.404 -9.756 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.250 8.290 -11.722 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.273 8.267 -9.071 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.747 9.101 -9.288 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.510 10.284 -11.178 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.466 10.091 -9.721 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.483 12.020 -9.010 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -1.068 11.037 -8.689 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -0.110 12.646 -10.071 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.566 11.464 -11.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.288 13.676 -11.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.635 12.674 -11.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.192 13.819 -10.470 1.00 0.00 H new ATOM 1441 N HIS A 116 0.770 7.465 -11.833 1.00 0.00 N ATOM 1442 CA HIS A 116 2.050 7.684 -12.486 1.00 0.00 C ATOM 1443 C HIS A 116 2.887 6.405 -12.417 1.00 0.00 C ATOM 1444 O HIS A 116 3.910 6.364 -11.736 1.00 0.00 O ATOM 1445 CB HIS A 116 2.766 8.894 -11.884 1.00 0.00 C ATOM 1446 CG HIS A 116 2.385 9.184 -10.452 1.00 0.00 C ATOM 1447 ND1 HIS A 116 2.392 8.216 -9.464 1.00 0.00 N ATOM 1448 CD2 HIS A 116 1.987 10.343 -9.853 1.00 0.00 C ATOM 1449 CE1 HIS A 116 2.013 8.777 -8.325 1.00 0.00 C ATOM 1450 NE2 HIS A 116 1.762 10.096 -8.569 1.00 0.00 N ATOM 0 H HIS A 116 0.641 6.528 -11.451 1.00 0.00 H new ATOM 0 HA HIS A 116 1.890 7.916 -13.539 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.842 8.729 -11.937 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.548 9.772 -12.492 1.00 0.00 H new ATOM 0 HD1 HIS A 116 2.646 7.236 -9.591 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.874 11.300 -10.341 1.00 0.00 H new ATOM 0 HE1 HIS A 116 1.919 8.278 -7.372 1.00 0.00 H new ATOM 1458 N ALA A 117 2.420 5.391 -13.131 1.00 0.00 N ATOM 1459 CA ALA A 117 3.112 4.114 -13.159 1.00 0.00 C ATOM 1460 C ALA A 117 4.207 4.156 -14.227 1.00 0.00 C ATOM 1461 O ALA A 117 4.952 3.191 -14.396 1.00 0.00 O ATOM 1462 CB ALA A 117 2.103 2.991 -13.403 1.00 0.00 C ATOM 0 H ALA A 117 1.571 5.428 -13.695 1.00 0.00 H new ATOM 0 HA ALA A 117 3.593 3.917 -12.201 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.623 2.033 -13.424 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.364 2.985 -12.602 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.602 3.153 -14.357 1.00 0.00 H new ATOM 1468 N GLU A 118 4.271 5.283 -14.920 1.00 0.00 N ATOM 1469 CA GLU A 118 5.262 5.464 -15.967 1.00 0.00 C ATOM 1470 C GLU A 118 6.665 5.541 -15.361 1.00 0.00 C ATOM 1471 O GLU A 118 7.659 5.370 -16.066 1.00 0.00 O ATOM 1472 CB GLU A 118 4.956 6.708 -16.803 1.00 0.00 C ATOM 1473 CG GLU A 118 6.190 7.157 -17.588 1.00 0.00 C ATOM 1474 CD GLU A 118 5.789 7.967 -18.823 1.00 0.00 C ATOM 1475 OE1 GLU A 118 5.409 7.323 -19.825 1.00 0.00 O ATOM 1476 OE2 GLU A 118 5.871 9.211 -18.737 1.00 0.00 O ATOM 0 H GLU A 118 3.652 6.081 -14.777 1.00 0.00 H new ATOM 0 HA GLU A 118 5.221 4.602 -16.632 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.139 6.495 -17.493 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.621 7.515 -16.152 1.00 0.00 H new ATOM 0 HG2 GLU A 118 6.834 7.759 -16.947 1.00 0.00 H new ATOM 0 HG3 GLU A 118 6.769 6.285 -17.893 1.00 0.00 H new ATOM 1483 N LYS A 119 6.701 5.800 -14.062 1.00 0.00 N ATOM 1484 CA LYS A 119 7.966 5.903 -13.355 1.00 0.00 C ATOM 1485 C LYS A 119 8.218 4.608 -12.579 1.00 0.00 C ATOM 1486 O LYS A 119 9.252 4.460 -11.930 1.00 0.00 O ATOM 1487 CB LYS A 119 7.990 7.158 -12.480 1.00 0.00 C ATOM 1488 CG LYS A 119 9.097 8.115 -12.927 1.00 0.00 C ATOM 1489 CD LYS A 119 9.004 9.448 -12.180 1.00 0.00 C ATOM 1490 CE LYS A 119 9.583 10.588 -13.019 1.00 0.00 C ATOM 1491 NZ LYS A 119 9.083 11.894 -12.534 1.00 0.00 N ATOM 0 H LYS A 119 5.875 5.942 -13.481 1.00 0.00 H new ATOM 0 HA LYS A 119 8.789 6.018 -14.061 1.00 0.00 H new ATOM 0 HB2 LYS A 119 7.025 7.662 -12.533 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.146 6.877 -11.438 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.071 7.660 -12.746 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.021 8.289 -14.000 1.00 0.00 H new ATOM 0 HD2 LYS A 119 7.963 9.662 -11.939 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.542 9.378 -11.235 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.672 10.567 -12.969 1.00 0.00 H new ATOM 0 HE3 LYS A 119 9.309 10.453 -14.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 9.486 12.657 -13.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 8.046 11.916 -12.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 9.366 12.027 -11.542 1.00 0.00 H new ATOM 1505 N ASN A 120 7.254 3.703 -12.672 1.00 0.00 N ATOM 1506 CA ASN A 120 7.359 2.426 -11.987 1.00 0.00 C ATOM 1507 C ASN A 120 7.252 2.651 -10.478 1.00 0.00 C ATOM 1508 O ASN A 120 7.678 1.809 -9.689 1.00 0.00 O ATOM 1509 CB ASN A 120 8.705 1.757 -12.271 1.00 0.00 C ATOM 1510 CG ASN A 120 8.520 0.479 -13.091 1.00 0.00 C ATOM 1511 OD1 ASN A 120 7.606 0.580 -14.051 1.00 0.00 O flip ATOM 1512 ND2 ASN A 120 9.165 -0.533 -12.866 1.00 0.00 N flip ATOM 0 H ASN A 120 6.397 3.829 -13.211 1.00 0.00 H new ATOM 0 HA ASN A 120 6.555 1.784 -12.346 1.00 0.00 H new ATOM 0 HB2 ASN A 120 9.352 2.449 -12.810 1.00 0.00 H new ATOM 0 HB3 ASN A 120 9.203 1.521 -11.331 1.00 0.00 H new ATOM 0 HD21 ASN A 120 9.852 -0.543 -12.112 1.00 0.00 H new ATOM 0 HD22 ASN A 120 9.017 -1.369 -13.432 1.00 0.00 H new ATOM 1519 N TRP A 121 6.680 3.792 -10.121 1.00 0.00 N ATOM 1520 CA TRP A 121 6.512 4.139 -8.720 1.00 0.00 C ATOM 1521 C TRP A 121 5.643 3.062 -8.068 1.00 0.00 C ATOM 1522 O TRP A 121 4.437 3.005 -8.304 1.00 0.00 O ATOM 1523 CB TRP A 121 5.933 5.547 -8.570 1.00 0.00 C ATOM 1524 CG TRP A 121 6.944 6.667 -8.824 1.00 0.00 C ATOM 1525 CD1 TRP A 121 8.269 6.559 -8.994 1.00 0.00 C ATOM 1526 CD2 TRP A 121 6.657 8.077 -8.930 1.00 0.00 C ATOM 1527 NE1 TRP A 121 8.854 7.791 -9.201 1.00 0.00 N ATOM 1528 CE2 TRP A 121 7.843 8.744 -9.161 1.00 0.00 C ATOM 1529 CE3 TRP A 121 5.435 8.767 -8.834 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 7.924 10.133 -9.316 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 5.533 10.154 -8.991 1.00 0.00 C ATOM 1532 CH2 TRP A 121 6.719 10.841 -9.224 1.00 0.00 C ATOM 0 H TRP A 121 6.327 4.488 -10.778 1.00 0.00 H new ATOM 0 HA TRP A 121 7.475 4.165 -8.210 1.00 0.00 H new ATOM 0 HB2 TRP A 121 5.099 5.661 -9.262 1.00 0.00 H new ATOM 0 HB3 TRP A 121 5.530 5.657 -7.563 1.00 0.00 H new ATOM 0 HD1 TRP A 121 8.811 5.625 -8.972 1.00 0.00 H new ATOM 0 HE1 TRP A 121 9.846 7.970 -9.355 1.00 0.00 H new ATOM 0 HE3 TRP A 121 4.495 8.266 -8.653 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 8.865 10.632 -9.497 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.623 10.732 -8.927 1.00 0.00 H new ATOM 0 HH2 TRP A 121 6.711 11.915 -9.334 1.00 0.00 H new ATOM 1543 N PHE A 122 6.289 2.235 -7.259 1.00 0.00 N ATOM 1544 CA PHE A 122 5.590 1.163 -6.570 1.00 0.00 C ATOM 1545 C PHE A 122 5.048 1.640 -5.221 1.00 0.00 C ATOM 1546 O PHE A 122 5.169 2.816 -4.880 1.00 0.00 O ATOM 1547 CB PHE A 122 6.608 0.047 -6.332 1.00 0.00 C ATOM 1548 CG PHE A 122 6.722 -0.949 -7.488 1.00 0.00 C ATOM 1549 CD1 PHE A 122 5.926 -2.052 -7.516 1.00 0.00 C ATOM 1550 CD2 PHE A 122 7.619 -0.732 -8.487 1.00 0.00 C ATOM 1551 CE1 PHE A 122 6.031 -2.976 -8.589 1.00 0.00 C ATOM 1552 CE2 PHE A 122 7.724 -1.656 -9.559 1.00 0.00 C ATOM 1553 CZ PHE A 122 6.928 -2.759 -9.588 1.00 0.00 C ATOM 0 H PHE A 122 7.289 2.286 -7.065 1.00 0.00 H new ATOM 0 HA PHE A 122 4.746 0.823 -7.170 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.586 0.494 -6.153 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.334 -0.494 -5.426 1.00 0.00 H new ATOM 0 HD1 PHE A 122 5.214 -2.225 -6.722 1.00 0.00 H new ATOM 0 HD2 PHE A 122 8.251 0.143 -8.464 1.00 0.00 H new ATOM 0 HE1 PHE A 122 5.399 -3.851 -8.612 1.00 0.00 H new ATOM 0 HE2 PHE A 122 8.436 -1.484 -10.352 1.00 0.00 H new ATOM 0 HZ PHE A 122 7.008 -3.462 -10.404 1.00 0.00 H new ATOM 1563 N VAL A 123 4.462 0.703 -4.490 1.00 0.00 N ATOM 1564 CA VAL A 123 3.901 1.012 -3.186 1.00 0.00 C ATOM 1565 C VAL A 123 4.635 0.203 -2.115 1.00 0.00 C ATOM 1566 O VAL A 123 4.184 0.126 -0.973 1.00 0.00 O ATOM 1567 CB VAL A 123 2.391 0.764 -3.194 1.00 0.00 C ATOM 1568 CG1 VAL A 123 2.074 -0.667 -3.634 1.00 0.00 C ATOM 1569 CG2 VAL A 123 1.780 1.065 -1.824 1.00 0.00 C ATOM 0 H VAL A 123 4.364 -0.271 -4.776 1.00 0.00 H new ATOM 0 HA VAL A 123 4.042 2.067 -2.949 1.00 0.00 H new ATOM 0 HB VAL A 123 1.942 1.444 -3.918 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.994 -0.818 -3.631 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.461 -0.833 -4.639 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.540 -1.371 -2.945 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.706 0.881 -1.856 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.236 0.421 -1.073 1.00 0.00 H new ATOM 0 HG23 VAL A 123 1.962 2.108 -1.566 1.00 0.00 H new ATOM 1579 N GLY A 124 5.754 -0.379 -2.522 1.00 0.00 N ATOM 1580 CA GLY A 124 6.554 -1.180 -1.611 1.00 0.00 C ATOM 1581 C GLY A 124 7.472 -0.295 -0.765 1.00 0.00 C ATOM 1582 O GLY A 124 8.457 0.244 -1.268 1.00 0.00 O ATOM 0 H GLY A 124 6.125 -0.312 -3.470 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.899 -1.759 -0.959 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.152 -1.894 -2.178 1.00 0.00 H new ATOM 1586 N LEU A 125 7.116 -0.172 0.505 1.00 0.00 N ATOM 1587 CA LEU A 125 7.895 0.638 1.426 1.00 0.00 C ATOM 1588 C LEU A 125 9.304 0.054 1.546 1.00 0.00 C ATOM 1589 O LEU A 125 9.471 -1.092 1.961 1.00 0.00 O ATOM 1590 CB LEU A 125 7.169 0.774 2.766 1.00 0.00 C ATOM 1591 CG LEU A 125 5.664 0.499 2.745 1.00 0.00 C ATOM 1592 CD1 LEU A 125 5.374 -0.984 2.978 1.00 0.00 C ATOM 1593 CD2 LEU A 125 4.930 1.392 3.748 1.00 0.00 C ATOM 0 H LEU A 125 6.298 -0.620 0.918 1.00 0.00 H new ATOM 0 HA LEU A 125 8.002 1.653 1.044 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.633 0.092 3.479 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.328 1.785 3.142 1.00 0.00 H new ATOM 0 HG LEU A 125 5.285 0.748 1.754 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.297 -1.152 2.958 1.00 0.00 H new ATOM 0 HD12 LEU A 125 5.848 -1.575 2.194 1.00 0.00 H new ATOM 0 HD13 LEU A 125 5.770 -1.284 3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.862 1.177 3.713 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.307 1.198 4.752 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.098 2.439 3.494 1.00 0.00 H new ATOM 1605 N LYS A 126 10.281 0.868 1.175 1.00 0.00 N ATOM 1606 CA LYS A 126 11.670 0.446 1.236 1.00 0.00 C ATOM 1607 C LYS A 126 11.817 -0.664 2.279 1.00 0.00 C ATOM 1608 O LYS A 126 11.543 -0.451 3.460 1.00 0.00 O ATOM 1609 CB LYS A 126 12.585 1.647 1.484 1.00 0.00 C ATOM 1610 CG LYS A 126 14.051 1.279 1.245 1.00 0.00 C ATOM 1611 CD LYS A 126 14.977 2.113 2.132 1.00 0.00 C ATOM 1612 CE LYS A 126 16.344 1.442 2.282 1.00 0.00 C ATOM 1613 NZ LYS A 126 17.178 2.179 3.258 1.00 0.00 N ATOM 0 H LYS A 126 10.138 1.818 0.831 1.00 0.00 H new ATOM 0 HA LYS A 126 11.983 0.028 0.279 1.00 0.00 H new ATOM 0 HB2 LYS A 126 12.300 2.467 0.825 1.00 0.00 H new ATOM 0 HB3 LYS A 126 12.457 2.001 2.507 1.00 0.00 H new ATOM 0 HG2 LYS A 126 14.202 0.219 1.451 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.304 1.439 0.197 1.00 0.00 H new ATOM 0 HD2 LYS A 126 15.101 3.107 1.701 1.00 0.00 H new ATOM 0 HD3 LYS A 126 14.523 2.246 3.114 1.00 0.00 H new ATOM 0 HE2 LYS A 126 16.216 0.410 2.610 1.00 0.00 H new ATOM 0 HE3 LYS A 126 16.848 1.409 1.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.102 1.711 3.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.315 3.156 2.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 16.703 2.189 4.183 1.00 0.00 H new ATOM 1627 N LYS A 127 12.248 -1.824 1.806 1.00 0.00 N ATOM 1628 CA LYS A 127 12.433 -2.967 2.683 1.00 0.00 C ATOM 1629 C LYS A 127 13.519 -2.644 3.712 1.00 0.00 C ATOM 1630 O LYS A 127 14.552 -3.310 3.760 1.00 0.00 O ATOM 1631 CB LYS A 127 12.717 -4.229 1.866 1.00 0.00 C ATOM 1632 CG LYS A 127 13.609 -3.914 0.663 1.00 0.00 C ATOM 1633 CD LYS A 127 14.795 -3.040 1.074 1.00 0.00 C ATOM 1634 CE LYS A 127 15.631 -2.643 -0.145 1.00 0.00 C ATOM 1635 NZ LYS A 127 16.885 -1.981 0.281 1.00 0.00 N ATOM 0 H LYS A 127 12.474 -1.997 0.827 1.00 0.00 H new ATOM 0 HA LYS A 127 11.518 -3.173 3.238 1.00 0.00 H new ATOM 0 HB2 LYS A 127 13.201 -4.974 2.497 1.00 0.00 H new ATOM 0 HB3 LYS A 127 11.778 -4.664 1.523 1.00 0.00 H new ATOM 0 HG2 LYS A 127 13.972 -4.842 0.222 1.00 0.00 H new ATOM 0 HG3 LYS A 127 13.025 -3.404 -0.103 1.00 0.00 H new ATOM 0 HD2 LYS A 127 14.434 -2.144 1.579 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.419 -3.579 1.787 1.00 0.00 H new ATOM 0 HE2 LYS A 127 15.863 -3.528 -0.738 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.057 -1.972 -0.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 17.441 -1.718 -0.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 16.658 -1.126 0.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.438 -2.633 0.872 1.00 0.00 H new ATOM 1649 N ASN A 128 13.247 -1.622 4.511 1.00 0.00 N ATOM 1650 CA ASN A 128 14.188 -1.203 5.536 1.00 0.00 C ATOM 1651 C ASN A 128 13.415 -0.760 6.780 1.00 0.00 C ATOM 1652 O ASN A 128 13.767 -1.131 7.898 1.00 0.00 O ATOM 1653 CB ASN A 128 15.032 -0.020 5.058 1.00 0.00 C ATOM 1654 CG ASN A 128 16.515 -0.392 5.001 1.00 0.00 C ATOM 1655 OD1 ASN A 128 16.814 -1.280 4.057 1.00 0.00 O flip ATOM 1656 ND2 ASN A 128 17.333 0.094 5.764 1.00 0.00 N flip ATOM 0 H ASN A 128 12.389 -1.072 4.469 1.00 0.00 H new ATOM 0 HA ASN A 128 14.842 -2.046 5.759 1.00 0.00 H new ATOM 0 HB2 ASN A 128 14.695 0.297 4.071 1.00 0.00 H new ATOM 0 HB3 ASN A 128 14.891 0.827 5.730 1.00 0.00 H new ATOM 0 HD21 ASN A 128 17.036 0.771 6.466 1.00 0.00 H new ATOM 0 HD22 ASN A 128 18.314 -0.177 5.700 1.00 0.00 H new ATOM 1663 N GLY A 129 12.377 0.028 6.543 1.00 0.00 N ATOM 1664 CA GLY A 129 11.552 0.526 7.631 1.00 0.00 C ATOM 1665 C GLY A 129 11.447 2.052 7.586 1.00 0.00 C ATOM 1666 O GLY A 129 11.971 2.739 8.462 1.00 0.00 O ATOM 0 H GLY A 129 12.088 0.334 5.614 1.00 0.00 H new ATOM 0 HA2 GLY A 129 10.556 0.087 7.567 1.00 0.00 H new ATOM 0 HA3 GLY A 129 11.976 0.215 8.586 1.00 0.00 H new ATOM 1670 N SER A 130 10.767 2.536 6.558 1.00 0.00 N ATOM 1671 CA SER A 130 10.588 3.968 6.387 1.00 0.00 C ATOM 1672 C SER A 130 10.020 4.263 4.998 1.00 0.00 C ATOM 1673 O SER A 130 10.554 3.795 3.993 1.00 0.00 O ATOM 1674 CB SER A 130 11.906 4.717 6.592 1.00 0.00 C ATOM 1675 OG SER A 130 12.109 5.077 7.956 1.00 0.00 O ATOM 0 H SER A 130 10.333 1.962 5.835 1.00 0.00 H new ATOM 0 HA SER A 130 9.883 4.316 7.142 1.00 0.00 H new ATOM 0 HB2 SER A 130 12.734 4.093 6.255 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.912 5.616 5.975 1.00 0.00 H new ATOM 0 HG SER A 130 11.843 4.332 8.534 1.00 0.00 H new ATOM 1681 N CYS A 131 8.944 5.036 4.984 1.00 0.00 N ATOM 1682 CA CYS A 131 8.299 5.399 3.734 1.00 0.00 C ATOM 1683 C CYS A 131 9.386 5.722 2.708 1.00 0.00 C ATOM 1684 O CYS A 131 10.518 6.033 3.074 1.00 0.00 O ATOM 1685 CB CYS A 131 7.323 6.563 3.918 1.00 0.00 C ATOM 1686 SG CYS A 131 6.401 6.859 2.365 1.00 0.00 S ATOM 0 H CYS A 131 8.503 5.421 5.819 1.00 0.00 H new ATOM 0 HA CYS A 131 7.700 4.562 3.375 1.00 0.00 H new ATOM 0 HB2 CYS A 131 6.627 6.340 4.727 1.00 0.00 H new ATOM 0 HB3 CYS A 131 7.867 7.463 4.204 1.00 0.00 H new ATOM 0 HG CYS A 131 5.159 7.127 2.642 1.00 0.00 H new ATOM 1692 N LYS A 132 9.004 5.637 1.442 1.00 0.00 N ATOM 1693 CA LYS A 132 9.933 5.916 0.360 1.00 0.00 C ATOM 1694 C LYS A 132 9.297 6.919 -0.605 1.00 0.00 C ATOM 1695 O LYS A 132 8.079 7.084 -0.621 1.00 0.00 O ATOM 1696 CB LYS A 132 10.380 4.616 -0.311 1.00 0.00 C ATOM 1697 CG LYS A 132 11.752 4.781 -0.968 1.00 0.00 C ATOM 1698 CD LYS A 132 12.832 5.058 0.080 1.00 0.00 C ATOM 1699 CE LYS A 132 14.228 4.809 -0.493 1.00 0.00 C ATOM 1700 NZ LYS A 132 15.265 5.117 0.517 1.00 0.00 N ATOM 0 H LYS A 132 8.064 5.379 1.141 1.00 0.00 H new ATOM 0 HA LYS A 132 10.842 6.377 0.747 1.00 0.00 H new ATOM 0 HB2 LYS A 132 10.421 3.816 0.429 1.00 0.00 H new ATOM 0 HB3 LYS A 132 9.647 4.319 -1.061 1.00 0.00 H new ATOM 0 HG2 LYS A 132 12.003 3.878 -1.525 1.00 0.00 H new ATOM 0 HG3 LYS A 132 11.719 5.600 -1.687 1.00 0.00 H new ATOM 0 HD2 LYS A 132 12.755 6.090 0.423 1.00 0.00 H new ATOM 0 HD3 LYS A 132 12.673 4.420 0.949 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.318 3.770 -0.810 1.00 0.00 H new ATOM 0 HE3 LYS A 132 14.380 5.426 -1.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 16.021 4.405 0.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 15.664 6.059 0.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 14.840 5.104 1.466 1.00 0.00 H new ATOM 1714 N ARG A 133 10.152 7.563 -1.387 1.00 0.00 N ATOM 1715 CA ARG A 133 9.690 8.545 -2.352 1.00 0.00 C ATOM 1716 C ARG A 133 9.524 7.899 -3.729 1.00 0.00 C ATOM 1717 O ARG A 133 10.153 6.883 -4.022 1.00 0.00 O ATOM 1718 CB ARG A 133 10.670 9.715 -2.460 1.00 0.00 C ATOM 1719 CG ARG A 133 12.036 9.241 -2.963 1.00 0.00 C ATOM 1720 CD ARG A 133 13.020 10.409 -3.058 1.00 0.00 C ATOM 1721 NE ARG A 133 12.345 11.595 -3.632 1.00 0.00 N ATOM 1722 CZ ARG A 133 12.737 12.858 -3.419 1.00 0.00 C ATOM 1723 NH1 ARG A 133 13.803 13.108 -2.646 1.00 0.00 N ATOM 1724 NH2 ARG A 133 12.065 13.872 -3.981 1.00 0.00 N ATOM 0 H ARG A 133 11.162 7.423 -1.371 1.00 0.00 H new ATOM 0 HA ARG A 133 8.728 8.923 -2.006 1.00 0.00 H new ATOM 0 HB2 ARG A 133 10.270 10.468 -3.139 1.00 0.00 H new ATOM 0 HB3 ARG A 133 10.782 10.191 -1.486 1.00 0.00 H new ATOM 0 HG2 ARG A 133 12.432 8.481 -2.289 1.00 0.00 H new ATOM 0 HG3 ARG A 133 11.925 8.773 -3.941 1.00 0.00 H new ATOM 0 HD2 ARG A 133 13.412 10.647 -2.069 1.00 0.00 H new ATOM 0 HD3 ARG A 133 13.871 10.129 -3.679 1.00 0.00 H new ATOM 0 HE ARG A 133 11.531 11.441 -4.227 1.00 0.00 H new ATOM 0 HH11 ARG A 133 14.316 12.336 -2.220 1.00 0.00 H new ATOM 0 HH12 ARG A 133 14.101 14.070 -2.484 1.00 0.00 H new ATOM 0 HH21 ARG A 133 11.255 13.682 -4.571 1.00 0.00 H new ATOM 0 HH22 ARG A 133 12.364 14.834 -3.819 1.00 0.00 H new ATOM 1738 N GLY A 134 8.674 8.514 -4.538 1.00 0.00 N ATOM 1739 CA GLY A 134 8.417 8.012 -5.877 1.00 0.00 C ATOM 1740 C GLY A 134 9.706 7.510 -6.531 1.00 0.00 C ATOM 1741 O GLY A 134 9.781 6.362 -6.963 1.00 0.00 O ATOM 0 H GLY A 134 8.154 9.356 -4.292 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.689 7.202 -5.832 1.00 0.00 H new ATOM 0 HA3 GLY A 134 7.979 8.802 -6.487 1.00 0.00 H new ATOM 1745 N PRO A 135 10.716 8.421 -6.583 1.00 0.00 N ATOM 1746 CA PRO A 135 11.998 8.083 -7.177 1.00 0.00 C ATOM 1747 C PRO A 135 12.813 7.182 -6.247 1.00 0.00 C ATOM 1748 O PRO A 135 13.886 7.568 -5.787 1.00 0.00 O ATOM 1749 CB PRO A 135 12.670 9.419 -7.449 1.00 0.00 C ATOM 1750 CG PRO A 135 11.947 10.434 -6.578 1.00 0.00 C ATOM 1751 CD PRO A 135 10.663 9.790 -6.081 1.00 0.00 C ATOM 0 HA PRO A 135 11.897 7.509 -8.098 1.00 0.00 H new ATOM 0 HB2 PRO A 135 13.731 9.379 -7.204 1.00 0.00 H new ATOM 0 HB3 PRO A 135 12.596 9.686 -8.503 1.00 0.00 H new ATOM 0 HG2 PRO A 135 12.575 10.732 -5.738 1.00 0.00 H new ATOM 0 HG3 PRO A 135 11.726 11.337 -7.147 1.00 0.00 H new ATOM 0 HD2 PRO A 135 10.605 9.811 -4.993 1.00 0.00 H new ATOM 0 HD3 PRO A 135 9.785 10.316 -6.457 1.00 0.00 H new ATOM 1759 N ARG A 136 12.271 5.999 -5.997 1.00 0.00 N ATOM 1760 CA ARG A 136 12.934 5.040 -5.130 1.00 0.00 C ATOM 1761 C ARG A 136 11.993 3.879 -4.805 1.00 0.00 C ATOM 1762 O ARG A 136 11.967 3.394 -3.675 1.00 0.00 O ATOM 1763 CB ARG A 136 13.389 5.699 -3.826 1.00 0.00 C ATOM 1764 CG ARG A 136 14.903 5.921 -3.823 1.00 0.00 C ATOM 1765 CD ARG A 136 15.637 4.686 -3.297 1.00 0.00 C ATOM 1766 NE ARG A 136 16.783 5.097 -2.456 1.00 0.00 N ATOM 1767 CZ ARG A 136 17.856 4.331 -2.221 1.00 0.00 C ATOM 1768 NH1 ARG A 136 17.938 3.108 -2.763 1.00 0.00 N ATOM 1769 NH2 ARG A 136 18.849 4.787 -1.445 1.00 0.00 N ATOM 0 H ARG A 136 11.380 5.683 -6.380 1.00 0.00 H new ATOM 0 HA ARG A 136 13.810 4.665 -5.659 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.878 6.653 -3.699 1.00 0.00 H new ATOM 0 HB3 ARG A 136 13.108 5.072 -2.980 1.00 0.00 H new ATOM 0 HG2 ARG A 136 15.243 6.148 -4.834 1.00 0.00 H new ATOM 0 HG3 ARG A 136 15.146 6.784 -3.204 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.953 4.067 -2.717 1.00 0.00 H new ATOM 0 HD3 ARG A 136 15.987 4.078 -4.131 1.00 0.00 H new ATOM 0 HE ARG A 136 16.754 6.022 -2.028 1.00 0.00 H new ATOM 0 HH11 ARG A 136 17.183 2.761 -3.355 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.755 2.525 -2.584 1.00 0.00 H new ATOM 0 HH21 ARG A 136 18.788 5.718 -1.033 1.00 0.00 H new ATOM 0 HH22 ARG A 136 19.666 4.203 -1.266 1.00 0.00 H new ATOM 1783 N THR A 137 11.243 3.465 -5.816 1.00 0.00 N ATOM 1784 CA THR A 137 10.303 2.370 -5.652 1.00 0.00 C ATOM 1785 C THR A 137 10.221 1.541 -6.935 1.00 0.00 C ATOM 1786 O THR A 137 9.437 1.851 -7.830 1.00 0.00 O ATOM 1787 CB THR A 137 8.958 2.961 -5.224 1.00 0.00 C ATOM 1788 OG1 THR A 137 8.370 3.404 -6.444 1.00 0.00 O ATOM 1789 CG2 THR A 137 9.117 4.241 -4.401 1.00 0.00 C ATOM 0 H THR A 137 11.268 3.869 -6.752 1.00 0.00 H new ATOM 0 HA THR A 137 10.633 1.679 -4.876 1.00 0.00 H new ATOM 0 HB THR A 137 8.405 2.222 -4.644 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.984 3.225 -7.187 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.133 4.619 -4.123 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.691 4.025 -3.500 1.00 0.00 H new ATOM 0 HG23 THR A 137 9.640 4.992 -4.993 1.00 0.00 H new ATOM 1797 N HIS A 138 11.042 0.501 -6.983 1.00 0.00 N ATOM 1798 CA HIS A 138 11.072 -0.375 -8.141 1.00 0.00 C ATOM 1799 C HIS A 138 11.209 -1.828 -7.682 1.00 0.00 C ATOM 1800 O HIS A 138 11.419 -2.092 -6.499 1.00 0.00 O ATOM 1801 CB HIS A 138 12.177 0.046 -9.113 1.00 0.00 C ATOM 1802 CG HIS A 138 12.357 1.541 -9.227 1.00 0.00 C ATOM 1803 ND1 HIS A 138 12.743 2.333 -8.160 1.00 0.00 N ATOM 1804 CD2 HIS A 138 12.200 2.379 -10.292 1.00 0.00 C ATOM 1805 CE1 HIS A 138 12.812 3.590 -8.575 1.00 0.00 C ATOM 1806 NE2 HIS A 138 12.475 3.616 -9.896 1.00 0.00 N ATOM 0 H HIS A 138 11.691 0.246 -6.238 1.00 0.00 H new ATOM 0 HA HIS A 138 10.134 -0.290 -8.689 1.00 0.00 H new ATOM 0 HB2 HIS A 138 13.118 -0.400 -8.792 1.00 0.00 H new ATOM 0 HB3 HIS A 138 11.953 -0.359 -10.100 1.00 0.00 H new ATOM 0 HD2 HIS A 138 11.903 2.086 -11.288 1.00 0.00 H new ATOM 0 HE1 HIS A 138 13.087 4.443 -7.973 1.00 0.00 H new ATOM 0 HE2 HIS A 138 12.440 4.449 -10.483 1.00 0.00 H new ATOM 1814 N TYR A 139 11.086 -2.733 -8.642 1.00 0.00 N ATOM 1815 CA TYR A 139 11.193 -4.152 -8.351 1.00 0.00 C ATOM 1816 C TYR A 139 12.477 -4.458 -7.577 1.00 0.00 C ATOM 1817 O TYR A 139 13.165 -3.544 -7.124 1.00 0.00 O ATOM 1818 CB TYR A 139 11.250 -4.858 -9.708 1.00 0.00 C ATOM 1819 CG TYR A 139 10.159 -5.911 -9.908 1.00 0.00 C ATOM 1820 CD1 TYR A 139 8.905 -5.716 -9.366 1.00 0.00 C ATOM 1821 CD2 TYR A 139 10.429 -7.056 -10.630 1.00 0.00 C ATOM 1822 CE1 TYR A 139 7.877 -6.707 -9.555 1.00 0.00 C ATOM 1823 CE2 TYR A 139 9.401 -8.047 -10.819 1.00 0.00 C ATOM 1824 CZ TYR A 139 8.176 -7.824 -10.272 1.00 0.00 C ATOM 1825 OH TYR A 139 7.206 -8.760 -10.450 1.00 0.00 O ATOM 0 H TYR A 139 10.913 -2.511 -9.622 1.00 0.00 H new ATOM 0 HA TYR A 139 10.352 -4.483 -7.742 1.00 0.00 H new ATOM 0 HB2 TYR A 139 11.169 -4.111 -10.498 1.00 0.00 H new ATOM 0 HB3 TYR A 139 12.224 -5.334 -9.818 1.00 0.00 H new ATOM 0 HD1 TYR A 139 8.694 -4.820 -8.800 1.00 0.00 H new ATOM 0 HD2 TYR A 139 11.411 -7.209 -11.053 1.00 0.00 H new ATOM 0 HE1 TYR A 139 6.891 -6.567 -9.137 1.00 0.00 H new ATOM 0 HE2 TYR A 139 9.599 -8.947 -11.382 1.00 0.00 H new ATOM 0 HH TYR A 139 7.561 -9.502 -10.982 1.00 0.00 H new ATOM 1835 N GLY A 140 12.760 -5.745 -7.448 1.00 0.00 N ATOM 1836 CA GLY A 140 13.949 -6.183 -6.736 1.00 0.00 C ATOM 1837 C GLY A 140 13.825 -5.901 -5.237 1.00 0.00 C ATOM 1838 O GLY A 140 14.743 -6.189 -4.470 1.00 0.00 O ATOM 0 H GLY A 140 12.186 -6.500 -7.825 1.00 0.00 H new ATOM 0 HA2 GLY A 140 14.102 -7.250 -6.898 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.825 -5.672 -7.135 1.00 0.00 H new ATOM 1842 N GLN A 141 12.684 -5.341 -4.865 1.00 0.00 N ATOM 1843 CA GLN A 141 12.428 -5.017 -3.472 1.00 0.00 C ATOM 1844 C GLN A 141 11.101 -5.629 -3.020 1.00 0.00 C ATOM 1845 O GLN A 141 10.032 -5.137 -3.379 1.00 0.00 O ATOM 1846 CB GLN A 141 12.438 -3.503 -3.250 1.00 0.00 C ATOM 1847 CG GLN A 141 13.863 -2.950 -3.308 1.00 0.00 C ATOM 1848 CD GLN A 141 14.159 -2.338 -4.679 1.00 0.00 C ATOM 1849 OE1 GLN A 141 15.038 -3.027 -5.400 1.00 0.00 O flip ATOM 1850 NE2 GLN A 141 13.624 -1.308 -5.056 1.00 0.00 N flip ATOM 0 H GLN A 141 11.926 -5.103 -5.504 1.00 0.00 H new ATOM 0 HA GLN A 141 13.227 -5.445 -2.867 1.00 0.00 H new ATOM 0 HB2 GLN A 141 11.824 -3.017 -4.008 1.00 0.00 H new ATOM 0 HB3 GLN A 141 11.993 -3.271 -2.282 1.00 0.00 H new ATOM 0 HG2 GLN A 141 13.996 -2.195 -2.533 1.00 0.00 H new ATOM 0 HG3 GLN A 141 14.575 -3.749 -3.101 1.00 0.00 H new ATOM 0 HE21 GLN A 141 12.957 -0.829 -4.451 1.00 0.00 H new ATOM 0 HE22 GLN A 141 13.844 -0.926 -5.976 1.00 0.00 H new ATOM 1859 N LYS A 142 11.212 -6.693 -2.238 1.00 0.00 N ATOM 1860 CA LYS A 142 10.034 -7.377 -1.733 1.00 0.00 C ATOM 1861 C LYS A 142 9.095 -6.357 -1.087 1.00 0.00 C ATOM 1862 O LYS A 142 7.932 -6.659 -0.822 1.00 0.00 O ATOM 1863 CB LYS A 142 10.437 -8.520 -0.800 1.00 0.00 C ATOM 1864 CG LYS A 142 11.253 -9.577 -1.547 1.00 0.00 C ATOM 1865 CD LYS A 142 10.670 -10.975 -1.329 1.00 0.00 C ATOM 1866 CE LYS A 142 11.776 -11.990 -1.033 1.00 0.00 C ATOM 1867 NZ LYS A 142 11.487 -12.719 0.221 1.00 0.00 N ATOM 0 H LYS A 142 12.100 -7.098 -1.942 1.00 0.00 H new ATOM 0 HA LYS A 142 9.484 -7.843 -2.551 1.00 0.00 H new ATOM 0 HB2 LYS A 142 11.021 -8.126 0.032 1.00 0.00 H new ATOM 0 HB3 LYS A 142 9.544 -8.979 -0.374 1.00 0.00 H new ATOM 0 HG2 LYS A 142 11.265 -9.346 -2.612 1.00 0.00 H new ATOM 0 HG3 LYS A 142 12.287 -9.553 -1.204 1.00 0.00 H new ATOM 0 HD2 LYS A 142 9.961 -10.952 -0.501 1.00 0.00 H new ATOM 0 HD3 LYS A 142 10.116 -11.284 -2.215 1.00 0.00 H new ATOM 0 HE2 LYS A 142 11.861 -12.696 -1.860 1.00 0.00 H new ATOM 0 HE3 LYS A 142 12.735 -11.478 -0.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 12.172 -12.439 0.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 10.525 -12.489 0.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 11.560 -13.743 0.052 1.00 0.00 H new ATOM 1881 N ALA A 143 9.634 -5.170 -0.851 1.00 0.00 N ATOM 1882 CA ALA A 143 8.859 -4.104 -0.240 1.00 0.00 C ATOM 1883 C ALA A 143 7.513 -3.983 -0.957 1.00 0.00 C ATOM 1884 O ALA A 143 6.486 -3.754 -0.320 1.00 0.00 O ATOM 1885 CB ALA A 143 9.661 -2.801 -0.282 1.00 0.00 C ATOM 0 H ALA A 143 10.599 -4.923 -1.072 1.00 0.00 H new ATOM 0 HA ALA A 143 8.656 -4.329 0.807 1.00 0.00 H new ATOM 0 HB1 ALA A 143 9.080 -2.001 0.176 1.00 0.00 H new ATOM 0 HB2 ALA A 143 10.595 -2.931 0.265 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.881 -2.542 -1.318 1.00 0.00 H new ATOM 1891 N ILE A 144 7.562 -4.142 -2.271 1.00 0.00 N ATOM 1892 CA ILE A 144 6.359 -4.054 -3.081 1.00 0.00 C ATOM 1893 C ILE A 144 5.492 -5.290 -2.836 1.00 0.00 C ATOM 1894 O ILE A 144 4.268 -5.225 -2.936 1.00 0.00 O ATOM 1895 CB ILE A 144 6.718 -3.836 -4.552 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.360 -5.090 -5.151 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.604 -2.601 -4.724 1.00 0.00 C ATOM 1898 CD1 ILE A 144 8.072 -4.766 -6.466 1.00 0.00 C ATOM 0 H ILE A 144 8.416 -4.331 -2.795 1.00 0.00 H new ATOM 0 HA ILE A 144 5.767 -3.187 -2.790 1.00 0.00 H new ATOM 0 HB ILE A 144 5.797 -3.650 -5.104 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.072 -5.512 -4.442 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.595 -5.847 -5.324 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.844 -2.470 -5.779 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.075 -1.720 -4.360 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.525 -2.732 -4.156 1.00 0.00 H new ATOM 0 HD11 ILE A 144 8.520 -5.674 -6.871 1.00 0.00 H new ATOM 0 HD12 ILE A 144 7.352 -4.366 -7.181 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.852 -4.027 -6.285 1.00 0.00 H new ATOM 1910 N LEU A 145 6.161 -6.389 -2.519 1.00 0.00 N ATOM 1911 CA LEU A 145 5.467 -7.639 -2.259 1.00 0.00 C ATOM 1912 C LEU A 145 4.678 -7.517 -0.954 1.00 0.00 C ATOM 1913 O LEU A 145 5.256 -7.551 0.131 1.00 0.00 O ATOM 1914 CB LEU A 145 6.451 -8.811 -2.275 1.00 0.00 C ATOM 1915 CG LEU A 145 7.140 -9.090 -3.612 1.00 0.00 C ATOM 1916 CD1 LEU A 145 8.321 -10.046 -3.432 1.00 0.00 C ATOM 1917 CD2 LEU A 145 6.139 -9.605 -4.648 1.00 0.00 C ATOM 0 H LEU A 145 7.176 -6.440 -2.436 1.00 0.00 H new ATOM 0 HA LEU A 145 4.746 -7.846 -3.050 1.00 0.00 H new ATOM 0 HB2 LEU A 145 7.219 -8.625 -1.525 1.00 0.00 H new ATOM 0 HB3 LEU A 145 5.918 -9.711 -1.969 1.00 0.00 H new ATOM 0 HG LEU A 145 7.541 -8.150 -3.991 1.00 0.00 H new ATOM 0 HD11 LEU A 145 8.793 -10.227 -4.398 1.00 0.00 H new ATOM 0 HD12 LEU A 145 9.047 -9.603 -2.751 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.965 -10.990 -3.019 1.00 0.00 H new ATOM 0 HD21 LEU A 145 6.655 -9.795 -5.589 1.00 0.00 H new ATOM 0 HD22 LEU A 145 5.687 -10.529 -4.289 1.00 0.00 H new ATOM 0 HD23 LEU A 145 5.361 -8.858 -4.805 1.00 0.00 H new ATOM 1929 N PHE A 146 3.369 -7.377 -1.103 1.00 0.00 N ATOM 1930 CA PHE A 146 2.494 -7.250 0.051 1.00 0.00 C ATOM 1931 C PHE A 146 1.526 -8.431 0.137 1.00 0.00 C ATOM 1932 O PHE A 146 0.793 -8.709 -0.811 1.00 0.00 O ATOM 1933 CB PHE A 146 1.691 -5.961 -0.137 1.00 0.00 C ATOM 1934 CG PHE A 146 2.515 -4.684 0.039 1.00 0.00 C ATOM 1935 CD1 PHE A 146 3.572 -4.669 0.895 1.00 0.00 C ATOM 1936 CD2 PHE A 146 2.190 -3.563 -0.660 1.00 0.00 C ATOM 1937 CE1 PHE A 146 4.337 -3.483 1.059 1.00 0.00 C ATOM 1938 CE2 PHE A 146 2.955 -2.378 -0.496 1.00 0.00 C ATOM 1939 CZ PHE A 146 4.012 -2.363 0.360 1.00 0.00 C ATOM 0 H PHE A 146 2.893 -7.349 -2.005 1.00 0.00 H new ATOM 0 HA PHE A 146 3.085 -7.232 0.966 1.00 0.00 H new ATOM 0 HB2 PHE A 146 1.250 -5.962 -1.134 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.867 -5.951 0.577 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.830 -5.559 1.450 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.351 -3.574 -1.339 1.00 0.00 H new ATOM 0 HE1 PHE A 146 5.176 -3.471 1.739 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.697 -1.488 -1.051 1.00 0.00 H new ATOM 0 HZ PHE A 146 4.593 -1.461 0.484 1.00 0.00 H new ATOM 1949 N LEU A 147 1.554 -9.095 1.283 1.00 0.00 N ATOM 1950 CA LEU A 147 0.688 -10.241 1.507 1.00 0.00 C ATOM 1951 C LEU A 147 -0.431 -9.848 2.472 1.00 0.00 C ATOM 1952 O LEU A 147 -0.214 -9.767 3.680 1.00 0.00 O ATOM 1953 CB LEU A 147 1.506 -11.448 1.971 1.00 0.00 C ATOM 1954 CG LEU A 147 0.851 -12.817 1.773 1.00 0.00 C ATOM 1955 CD1 LEU A 147 0.039 -13.219 3.006 1.00 0.00 C ATOM 1956 CD2 LEU A 147 0.008 -12.842 0.497 1.00 0.00 C ATOM 0 H LEU A 147 2.163 -8.861 2.067 1.00 0.00 H new ATOM 0 HA LEU A 147 0.212 -10.547 0.575 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.458 -11.442 1.440 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.731 -11.324 3.030 1.00 0.00 H new ATOM 0 HG LEU A 147 1.640 -13.559 1.651 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -0.416 -14.195 2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.696 -13.268 3.874 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -0.742 -12.480 3.184 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.446 -13.826 0.380 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -0.775 -12.087 0.563 1.00 0.00 H new ATOM 0 HD23 LEU A 147 0.644 -12.631 -0.363 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.636 -9.607 1.889 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.790 -9.224 2.684 1.00 0.00 C ATOM 1970 C PRO A 148 -3.358 -10.427 3.440 1.00 0.00 C ATOM 1971 O PRO A 148 -3.571 -11.488 2.856 1.00 0.00 O ATOM 1972 CB PRO A 148 -3.773 -8.629 1.690 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.332 -9.122 0.321 1.00 0.00 C ATOM 1974 CD PRO A 148 -1.930 -9.692 0.461 1.00 0.00 C ATOM 0 HA PRO A 148 -2.544 -8.501 3.461 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.792 -8.947 1.910 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.763 -7.540 1.735 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.018 -9.883 -0.050 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.342 -8.305 -0.400 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.884 -10.722 0.108 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.210 -9.122 -0.126 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.587 -10.221 4.729 1.00 0.00 N ATOM 1983 CA LEU A 149 -4.126 -11.275 5.571 1.00 0.00 C ATOM 1984 C LEU A 149 -5.325 -10.734 6.353 1.00 0.00 C ATOM 1985 O LEU A 149 -5.256 -10.577 7.571 1.00 0.00 O ATOM 1986 CB LEU A 149 -3.029 -11.866 6.458 1.00 0.00 C ATOM 1987 CG LEU A 149 -2.019 -10.869 7.030 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -1.511 -11.327 8.399 1.00 0.00 C ATOM 1989 CD2 LEU A 149 -0.874 -10.623 6.047 1.00 0.00 C ATOM 0 H LEU A 149 -3.409 -9.340 5.210 1.00 0.00 H new ATOM 0 HA LEU A 149 -4.490 -12.102 4.961 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -3.503 -12.389 7.288 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -2.485 -12.613 5.880 1.00 0.00 H new ATOM 0 HG LEU A 149 -2.527 -9.916 7.177 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -0.795 -10.601 8.783 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -2.350 -11.409 9.090 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.026 -12.298 8.301 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -0.171 -9.911 6.478 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -0.360 -11.563 5.844 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -1.274 -10.220 5.116 1.00 0.00 H new ATOM 2001 N PRO A 150 -6.424 -10.457 5.602 1.00 0.00 N ATOM 2002 CA PRO A 150 -7.636 -9.937 6.212 1.00 0.00 C ATOM 2003 C PRO A 150 -8.386 -11.037 6.966 1.00 0.00 C ATOM 2004 O PRO A 150 -8.111 -12.221 6.779 1.00 0.00 O ATOM 2005 CB PRO A 150 -8.437 -9.354 5.060 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.867 -9.978 3.797 1.00 0.00 C ATOM 2007 CD PRO A 150 -6.542 -10.630 4.157 1.00 0.00 C ATOM 0 HA PRO A 150 -7.435 -9.175 6.965 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -9.497 -9.585 5.165 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -8.348 -8.268 5.033 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.558 -10.717 3.391 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.723 -9.219 3.028 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -6.532 -11.685 3.882 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.712 -10.156 3.632 1.00 0.00 H new ATOM 2015 N VAL A 151 -9.319 -10.606 7.802 1.00 0.00 N ATOM 2016 CA VAL A 151 -10.110 -11.540 8.585 1.00 0.00 C ATOM 2017 C VAL A 151 -11.250 -10.785 9.273 1.00 0.00 C ATOM 2018 O VAL A 151 -11.609 -11.094 10.408 1.00 0.00 O ATOM 2019 CB VAL A 151 -9.212 -12.291 9.570 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -8.681 -13.585 8.950 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -8.063 -11.402 10.051 1.00 0.00 C ATOM 0 H VAL A 151 -9.545 -9.623 7.954 1.00 0.00 H new ATOM 0 HA VAL A 151 -10.561 -12.293 7.938 1.00 0.00 H new ATOM 0 HB VAL A 151 -9.815 -12.558 10.438 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -8.046 -14.100 9.671 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -9.518 -14.229 8.679 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -8.101 -13.350 8.058 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -7.440 -11.960 10.750 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -7.461 -11.091 9.197 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -8.468 -10.521 10.549 1.00 0.00 H new ATOM 2031 N SER A 152 -11.787 -9.808 8.556 1.00 0.00 N ATOM 2032 CA SER A 152 -12.878 -9.006 9.083 1.00 0.00 C ATOM 2033 C SER A 152 -13.852 -9.894 9.859 1.00 0.00 C ATOM 2034 O SER A 152 -14.703 -10.555 9.266 1.00 0.00 O ATOM 2035 CB SER A 152 -13.611 -8.268 7.960 1.00 0.00 C ATOM 2036 OG SER A 152 -14.640 -7.421 8.462 1.00 0.00 O ATOM 0 H SER A 152 -11.487 -9.554 7.615 1.00 0.00 H new ATOM 0 HA SER A 152 -12.460 -8.260 9.759 1.00 0.00 H new ATOM 0 HB2 SER A 152 -12.897 -7.673 7.391 1.00 0.00 H new ATOM 0 HB3 SER A 152 -14.043 -8.994 7.271 1.00 0.00 H new ATOM 0 HG SER A 152 -15.083 -6.967 7.715 1.00 0.00 H new ATOM 2042 N SER A 153 -13.696 -9.880 11.175 1.00 0.00 N ATOM 2043 CA SER A 153 -14.551 -10.676 12.039 1.00 0.00 C ATOM 2044 C SER A 153 -14.288 -10.324 13.504 1.00 0.00 C ATOM 2045 O SER A 153 -13.687 -11.108 14.236 1.00 0.00 O ATOM 2046 CB SER A 153 -14.331 -12.172 11.805 1.00 0.00 C ATOM 2047 OG SER A 153 -15.075 -12.970 12.721 1.00 0.00 O ATOM 0 H SER A 153 -12.990 -9.330 11.664 1.00 0.00 H new ATOM 0 HA SER A 153 -15.589 -10.447 11.798 1.00 0.00 H new ATOM 0 HB2 SER A 153 -14.620 -12.426 10.785 1.00 0.00 H new ATOM 0 HB3 SER A 153 -13.270 -12.402 11.902 1.00 0.00 H new ATOM 0 HG SER A 153 -14.909 -13.918 12.538 1.00 0.00 H new ATOM 2053 N ASP A 154 -14.751 -9.143 13.888 1.00 0.00 N ATOM 2054 CA ASP A 154 -14.574 -8.677 15.253 1.00 0.00 C ATOM 2055 C ASP A 154 -15.437 -7.435 15.479 1.00 0.00 C ATOM 2056 O ASP A 154 -16.069 -6.936 14.550 1.00 0.00 O ATOM 2057 CB ASP A 154 -13.116 -8.295 15.519 1.00 0.00 C ATOM 2058 CG ASP A 154 -12.771 -8.046 16.988 1.00 0.00 C ATOM 2059 OD1 ASP A 154 -13.152 -6.964 17.485 1.00 0.00 O ATOM 2060 OD2 ASP A 154 -12.134 -8.943 17.581 1.00 0.00 O ATOM 0 H ASP A 154 -15.249 -8.495 13.277 1.00 0.00 H new ATOM 0 HA ASP A 154 -14.864 -9.484 15.926 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -12.473 -9.089 15.140 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -12.882 -7.396 14.949 1.00 0.00 H new TER 2065 ASP A 154 HETATM 2066 C1 NTS A 178 14.089 -11.203 -3.760 1.00 0.00 C HETATM 2067 C2 NTS A 178 14.844 -10.521 -2.807 1.00 0.00 C HETATM 2068 C3 NTS A 178 14.634 -9.161 -2.585 1.00 0.00 C HETATM 2069 C4 NTS A 178 13.665 -8.481 -3.320 1.00 0.00 C HETATM 2070 C5 NTS A 178 11.939 -8.466 -5.004 1.00 0.00 C HETATM 2071 C6 NTS A 178 11.175 -9.130 -5.961 1.00 0.00 C HETATM 2072 C7 NTS A 178 11.379 -10.490 -6.189 1.00 0.00 C HETATM 2073 C8 NTS A 178 12.345 -11.182 -5.460 1.00 0.00 C HETATM 2074 C9 NTS A 178 13.116 -10.524 -4.498 1.00 0.00 C HETATM 2075 C10 NTS A 178 12.907 -9.160 -4.275 1.00 0.00 C HETATM 2076 O11 NTS A 178 16.028 -13.387 -3.333 1.00 0.00 O HETATM 2077 O12 NTS A 178 14.373 -13.380 -5.760 1.00 0.00 O HETATM 2078 O13 NTS A 178 13.147 -13.933 -3.147 1.00 0.00 O HETATM 2079 O31 NTS A 178 14.844 -6.694 -0.983 1.00 0.00 O HETATM 2080 O32 NTS A 178 17.281 -7.998 -1.981 1.00 0.00 O HETATM 2081 O33 NTS A 178 15.707 -9.259 0.166 1.00 0.00 O HETATM 2082 O61 NTS A 178 9.700 -9.024 -8.511 1.00 0.00 O HETATM 2083 O62 NTS A 178 10.456 -6.528 -7.158 1.00 0.00 O HETATM 2084 O63 NTS A 178 8.355 -8.247 -6.016 1.00 0.00 O HETATM 2085 S1 NTS A 178 14.410 -12.979 -4.005 1.00 0.00 S HETATM 2086 S3 NTS A 178 15.623 -8.277 -1.341 1.00 0.00 S HETATM 2087 S6 NTS A 178 9.916 -8.226 -6.913 1.00 0.00 S HETATM 0 H8 NTS A 178 12.500 -12.245 -5.642 1.00 0.00 H new HETATM 0 H7 NTS A 178 10.783 -11.012 -6.937 1.00 0.00 H new HETATM 0 H5 NTS A 178 11.781 -7.403 -4.824 1.00 0.00 H new HETATM 0 H4 NTS A 178 13.499 -7.417 -3.149 1.00 0.00 H new HETATM 0 H2 NTS A 178 15.602 -11.054 -2.233 1.00 0.00 H new