USER MOD reduce.3.24.130724 H: found=0, std=0, add=1171, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1169 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 151 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 152 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 93 TYR OH : rot 180:sc= -0.501 USER MOD Set 2.2: A 97 TYR OH : rot -103:sc= -0.54 USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.108 (180deg=0) USER MOD Single : A 2 SER OG : rot 34:sc= 0.52 USER MOD Single : A 3 SER OG : rot -25:sc= 0.449 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ -114:sc= -0.0033 (180deg=-0.574) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -4:sc= 0.0112! USER MOD Single : A 26 MET CE :methyl -170:sc= -0.465 (180deg=-0.634) USER MOD Single : A 27 HIS : no HD1:sc= -0.541 X(o=-0.54,f=-0.83) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.246 USER MOD Single : A 35 LYS NZ :NH3+ -130:sc= -0.243 (180deg=-1.87!) USER MOD Single : A 37 CYS SG : rot 180:sc= -3.21! USER MOD Single : A 39 GLN : amide:sc= -0.0218 X(o=-0.022,f=0) USER MOD Single : A 40 MET CE :methyl -129:sc= -0.889 (180deg=-2.28!) USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 42 ASN : amide:sc= -6.66! C(o=-6.7!,f=-7.2!) USER MOD Single : A 43 LYS NZ :NH3+ -161:sc= -0.661 (180deg=-0.698) USER MOD Single : A 46 MET CE :methyl -151:sc= -4.8! (180deg=-6.76!) USER MOD Single : A 48 ASN : amide:sc= -0.424 X(o=-0.42,f=-0.28) USER MOD Single : A 50 GLN : amide:sc= -1.62 K(o=-1.6,f=-9.1!) USER MOD Single : A 51 ASN : amide:sc= -0.965 X(o=-0.97,f=-0.96) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 57 CYS SG : rot 160:sc= -1.61 USER MOD Single : A 58 GLN :FLIP amide:sc= -1.41 F(o=-2.8,f=-1.4) USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -1.05 K(o=-1.1,f=-2.8!) USER MOD Single : A 66 SER OG : rot 170:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.0453 K(o=-0.045,f=-3!) USER MOD Single : A 71 LYS NZ :NH3+ 178:sc= -0.384 (180deg=-0.392) USER MOD Single : A 72 ASN : amide:sc= -4.88! C(o=-4.9!,f=-6.7!) USER MOD Single : A 77 HIS :FLIP no HD1:sc= -0.47 F(o=-1.6,f=-0.47) USER MOD Single : A 82 GLN : amide:sc= -2.62 K(o=-2.6,f=-4.9!) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HE2:sc= -2.08 K(o=-2.1,f=-3.6!) USER MOD Single : A 87 SER OG : rot -87:sc= 1.32 USER MOD Single : A 91 GLN : amide:sc= -0.0449 K(o=-0.045,f=-1.1) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 TYR OH : rot -70:sc= 0.0753 USER MOD Single : A 106 SER OG : rot -110:sc= 0.128 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.239 USER MOD Single : A 114 GLN : amide:sc= -0.0712 K(o=-0.071,f=-1.7!) USER MOD Single : A 115 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.346) USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 121 GLN : amide:sc= -0.179 K(o=-0.18,f=-1.9!) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -0.251 K(o=-0.25,f=-3.7!) USER MOD Single : A 132 THR OG1 : rot -60:sc= 1.2 USER MOD Single : A 138 HIS : no HD1:sc= -3.33! C(o=-3.3!,f=-4.2!) USER MOD Single : A 140 GLN :FLIP amide:sc= -0.533 F(o=-1.1,f=-0.53) USER MOD Single : A 145 SER OG : rot 41:sc= 0.395 USER MOD Single : A 146 SER OG : rot 180:sc= -0.0617 USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.512 41.540 -37.141 1.00 0.00 N ATOM 2 CA GLY A 1 22.540 41.392 -36.073 1.00 0.00 C ATOM 3 C GLY A 1 22.400 39.954 -35.612 1.00 0.00 C ATOM 4 O GLY A 1 23.131 39.075 -36.068 1.00 0.00 O ATOM 0 H1 GLY A 1 24.296 42.141 -36.816 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.881 40.605 -37.407 1.00 0.00 H new ATOM 0 H3 GLY A 1 23.057 41.980 -37.966 1.00 0.00 H new ATOM 0 HA2 GLY A 1 22.835 42.014 -35.228 1.00 0.00 H new ATOM 0 HA3 GLY A 1 21.571 41.757 -36.414 1.00 0.00 H new ATOM 8 N SER A 2 21.459 39.715 -34.705 1.00 0.00 N ATOM 9 CA SER A 2 21.229 38.375 -34.177 1.00 0.00 C ATOM 10 C SER A 2 19.817 38.248 -33.612 1.00 0.00 C ATOM 11 O SER A 2 19.144 39.249 -33.365 1.00 0.00 O ATOM 12 CB SER A 2 22.256 38.048 -33.092 1.00 0.00 C ATOM 13 OG SER A 2 23.427 37.480 -33.653 1.00 0.00 O ATOM 0 H SER A 2 20.843 40.431 -34.320 1.00 0.00 H new ATOM 0 HA SER A 2 21.339 37.665 -34.997 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.514 38.955 -32.546 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.821 37.355 -32.372 1.00 0.00 H new ATOM 0 HG SER A 2 23.592 37.875 -34.534 1.00 0.00 H new ATOM 19 N SER A 3 19.375 37.011 -33.412 1.00 0.00 N ATOM 20 CA SER A 3 18.043 36.752 -32.880 1.00 0.00 C ATOM 21 C SER A 3 17.964 35.356 -32.268 1.00 0.00 C ATOM 22 O SER A 3 18.759 34.476 -32.597 1.00 0.00 O ATOM 23 CB SER A 3 16.993 36.897 -33.983 1.00 0.00 C ATOM 24 OG SER A 3 17.136 38.133 -34.663 1.00 0.00 O ATOM 0 H SER A 3 19.920 36.172 -33.610 1.00 0.00 H new ATOM 0 HA SER A 3 17.842 37.485 -32.098 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.090 36.075 -34.692 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.995 36.829 -33.551 1.00 0.00 H new ATOM 0 HG SER A 3 17.578 38.781 -34.075 1.00 0.00 H new ATOM 30 N GLY A 4 16.998 35.162 -31.375 1.00 0.00 N ATOM 31 CA GLY A 4 16.832 33.872 -30.731 1.00 0.00 C ATOM 32 C GLY A 4 15.374 33.511 -30.523 1.00 0.00 C ATOM 33 O GLY A 4 14.504 34.381 -30.542 1.00 0.00 O ATOM 0 H GLY A 4 16.328 35.875 -31.086 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.311 33.103 -31.337 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.342 33.882 -29.768 1.00 0.00 H new ATOM 37 N SER A 5 15.107 32.224 -30.325 1.00 0.00 N ATOM 38 CA SER A 5 13.744 31.750 -30.118 1.00 0.00 C ATOM 39 C SER A 5 13.711 30.624 -29.088 1.00 0.00 C ATOM 40 O SER A 5 14.719 29.961 -28.845 1.00 0.00 O ATOM 41 CB SER A 5 13.144 31.265 -31.439 1.00 0.00 C ATOM 42 OG SER A 5 11.730 31.362 -31.423 1.00 0.00 O ATOM 0 H SER A 5 15.816 31.491 -30.304 1.00 0.00 H new ATOM 0 HA SER A 5 13.150 32.582 -29.741 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.543 31.857 -32.262 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.439 30.231 -31.618 1.00 0.00 H new ATOM 0 HG SER A 5 11.371 31.048 -32.279 1.00 0.00 H new ATOM 48 N SER A 6 12.544 30.415 -28.487 1.00 0.00 N ATOM 49 CA SER A 6 12.380 29.373 -27.480 1.00 0.00 C ATOM 50 C SER A 6 10.921 28.934 -27.386 1.00 0.00 C ATOM 51 O SER A 6 10.009 29.703 -27.686 1.00 0.00 O ATOM 52 CB SER A 6 12.863 29.870 -26.117 1.00 0.00 C ATOM 53 OG SER A 6 12.031 30.907 -25.627 1.00 0.00 O ATOM 0 H SER A 6 11.699 30.953 -28.680 1.00 0.00 H new ATOM 0 HA SER A 6 12.982 28.515 -27.779 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.873 29.042 -25.408 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.888 30.231 -26.201 1.00 0.00 H new ATOM 0 HG SER A 6 12.361 31.206 -24.754 1.00 0.00 H new ATOM 59 N GLY A 7 10.710 27.690 -26.967 1.00 0.00 N ATOM 60 CA GLY A 7 9.361 27.169 -26.841 1.00 0.00 C ATOM 61 C GLY A 7 9.299 25.668 -27.041 1.00 0.00 C ATOM 62 O GLY A 7 9.789 25.148 -28.044 1.00 0.00 O ATOM 0 H GLY A 7 11.448 27.034 -26.713 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.969 27.418 -25.855 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.716 27.657 -27.572 1.00 0.00 H new ATOM 66 N ILE A 8 8.696 24.970 -26.085 1.00 0.00 N ATOM 67 CA ILE A 8 8.572 23.519 -26.161 1.00 0.00 C ATOM 68 C ILE A 8 7.219 23.055 -25.633 1.00 0.00 C ATOM 69 O ILE A 8 6.836 23.378 -24.509 1.00 0.00 O ATOM 70 CB ILE A 8 9.689 22.816 -25.368 1.00 0.00 C ATOM 71 CG1 ILE A 8 11.062 23.229 -25.903 1.00 0.00 C ATOM 72 CG2 ILE A 8 9.519 21.306 -25.440 1.00 0.00 C ATOM 73 CD1 ILE A 8 12.169 23.116 -24.878 1.00 0.00 C ATOM 0 H ILE A 8 8.286 25.385 -25.249 1.00 0.00 H new ATOM 0 HA ILE A 8 8.661 23.249 -27.213 1.00 0.00 H new ATOM 0 HB ILE A 8 9.620 23.121 -24.324 1.00 0.00 H new ATOM 0 HG12 ILE A 8 11.310 22.607 -26.763 1.00 0.00 H new ATOM 0 HG13 ILE A 8 11.010 24.258 -26.258 1.00 0.00 H new ATOM 0 HG21 ILE A 8 10.316 20.823 -24.875 1.00 0.00 H new ATOM 0 HG22 ILE A 8 8.554 21.028 -25.017 1.00 0.00 H new ATOM 0 HG23 ILE A 8 9.565 20.984 -26.480 1.00 0.00 H new ATOM 0 HD11 ILE A 8 13.113 23.425 -25.327 1.00 0.00 H new ATOM 0 HD12 ILE A 8 11.944 23.759 -24.027 1.00 0.00 H new ATOM 0 HD13 ILE A 8 12.248 22.083 -24.541 1.00 0.00 H new ATOM 85 N ASP A 9 6.500 22.293 -26.451 1.00 0.00 N ATOM 86 CA ASP A 9 5.191 21.781 -26.066 1.00 0.00 C ATOM 87 C ASP A 9 4.935 20.415 -26.696 1.00 0.00 C ATOM 88 O ASP A 9 5.133 20.226 -27.896 1.00 0.00 O ATOM 89 CB ASP A 9 4.093 22.762 -26.481 1.00 0.00 C ATOM 90 CG ASP A 9 3.965 22.885 -27.986 1.00 0.00 C ATOM 91 OD1 ASP A 9 3.418 21.953 -28.612 1.00 0.00 O ATOM 92 OD2 ASP A 9 4.413 23.911 -28.539 1.00 0.00 O ATOM 0 H ASP A 9 6.803 22.017 -27.385 1.00 0.00 H new ATOM 0 HA ASP A 9 5.176 21.670 -24.982 1.00 0.00 H new ATOM 0 HB2 ASP A 9 3.141 22.434 -26.064 1.00 0.00 H new ATOM 0 HB3 ASP A 9 4.307 23.743 -26.056 1.00 0.00 H new ATOM 97 N LYS A 10 4.493 19.466 -25.878 1.00 0.00 N ATOM 98 CA LYS A 10 4.209 18.117 -26.354 1.00 0.00 C ATOM 99 C LYS A 10 2.778 17.712 -26.018 1.00 0.00 C ATOM 100 O LYS A 10 2.389 17.676 -24.850 1.00 0.00 O ATOM 101 CB LYS A 10 5.191 17.119 -25.737 1.00 0.00 C ATOM 102 CG LYS A 10 6.640 17.383 -26.108 1.00 0.00 C ATOM 103 CD LYS A 10 7.592 16.547 -25.269 1.00 0.00 C ATOM 104 CE LYS A 10 7.965 17.255 -23.976 1.00 0.00 C ATOM 105 NZ LYS A 10 8.917 18.375 -24.211 1.00 0.00 N ATOM 0 H LYS A 10 4.324 19.606 -24.882 1.00 0.00 H new ATOM 0 HA LYS A 10 4.325 18.109 -27.438 1.00 0.00 H new ATOM 0 HB2 LYS A 10 5.092 17.148 -24.652 1.00 0.00 H new ATOM 0 HB3 LYS A 10 4.921 16.112 -26.055 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.793 17.160 -27.164 1.00 0.00 H new ATOM 0 HG3 LYS A 10 6.865 18.441 -25.970 1.00 0.00 H new ATOM 0 HD2 LYS A 10 7.129 15.588 -25.039 1.00 0.00 H new ATOM 0 HD3 LYS A 10 8.494 16.336 -25.843 1.00 0.00 H new ATOM 0 HE2 LYS A 10 7.063 17.639 -23.499 1.00 0.00 H new ATOM 0 HE3 LYS A 10 8.410 16.539 -23.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 9.830 18.153 -23.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 9.053 18.506 -25.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 8.534 19.249 -23.798 1.00 0.00 H new ATOM 119 N LYS A 11 1.997 17.405 -27.049 1.00 0.00 N ATOM 120 CA LYS A 11 0.609 16.998 -26.863 1.00 0.00 C ATOM 121 C LYS A 11 0.146 16.105 -28.009 1.00 0.00 C ATOM 122 O LYS A 11 0.033 16.551 -29.151 1.00 0.00 O ATOM 123 CB LYS A 11 -0.295 18.229 -26.765 1.00 0.00 C ATOM 124 CG LYS A 11 -1.636 17.948 -26.109 1.00 0.00 C ATOM 125 CD LYS A 11 -1.508 17.850 -24.598 1.00 0.00 C ATOM 126 CE LYS A 11 -1.639 19.214 -23.938 1.00 0.00 C ATOM 127 NZ LYS A 11 -2.078 19.103 -22.519 1.00 0.00 N ATOM 0 H LYS A 11 2.302 17.430 -28.022 1.00 0.00 H new ATOM 0 HA LYS A 11 0.544 16.431 -25.934 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.221 19.005 -26.199 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.466 18.625 -27.766 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.340 18.740 -26.365 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.046 17.017 -26.501 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -2.276 17.181 -24.209 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.544 17.411 -24.341 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.681 19.733 -23.982 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -2.355 19.819 -24.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -2.156 20.054 -22.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -3.004 18.631 -22.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.382 18.547 -21.983 1.00 0.00 H new ATOM 141 N LEU A 12 -0.122 14.841 -27.697 1.00 0.00 N ATOM 142 CA LEU A 12 -0.575 13.885 -28.701 1.00 0.00 C ATOM 143 C LEU A 12 -1.566 12.893 -28.100 1.00 0.00 C ATOM 144 O LEU A 12 -1.395 12.434 -26.970 1.00 0.00 O ATOM 145 CB LEU A 12 0.619 13.134 -29.293 1.00 0.00 C ATOM 146 CG LEU A 12 1.602 12.534 -28.287 1.00 0.00 C ATOM 147 CD1 LEU A 12 1.219 11.100 -27.957 1.00 0.00 C ATOM 148 CD2 LEU A 12 3.023 12.598 -28.826 1.00 0.00 C ATOM 0 H LEU A 12 -0.033 14.455 -26.757 1.00 0.00 H new ATOM 0 HA LEU A 12 -1.078 14.439 -29.494 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.240 12.330 -29.924 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.167 13.817 -29.942 1.00 0.00 H new ATOM 0 HG LEU A 12 1.556 13.121 -27.370 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.930 10.689 -27.240 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.218 11.081 -27.527 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.235 10.501 -28.867 1.00 0.00 H new ATOM 0 HD21 LEU A 12 3.709 12.167 -28.097 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.084 12.036 -29.758 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.296 13.637 -29.010 1.00 0.00 H new ATOM 160 N THR A 13 -2.603 12.564 -28.864 1.00 0.00 N ATOM 161 CA THR A 13 -3.621 11.626 -28.408 1.00 0.00 C ATOM 162 C THR A 13 -4.007 10.652 -29.516 1.00 0.00 C ATOM 163 O THR A 13 -4.398 11.062 -30.609 1.00 0.00 O ATOM 164 CB THR A 13 -4.885 12.361 -27.924 1.00 0.00 C ATOM 165 OG1 THR A 13 -4.543 13.301 -26.898 1.00 0.00 O ATOM 166 CG2 THR A 13 -5.914 11.375 -27.392 1.00 0.00 C ATOM 0 H THR A 13 -2.760 12.934 -29.802 1.00 0.00 H new ATOM 0 HA THR A 13 -3.190 11.072 -27.574 1.00 0.00 H new ATOM 0 HB THR A 13 -5.317 12.891 -28.773 1.00 0.00 H new ATOM 0 HG1 THR A 13 -5.352 13.765 -26.597 1.00 0.00 H new ATOM 0 HG21 THR A 13 -6.798 11.917 -27.056 1.00 0.00 H new ATOM 0 HG22 THR A 13 -6.194 10.679 -28.183 1.00 0.00 H new ATOM 0 HG23 THR A 13 -5.488 10.821 -26.555 1.00 0.00 H new ATOM 174 N THR A 14 -3.894 9.360 -29.226 1.00 0.00 N ATOM 175 CA THR A 14 -4.231 8.327 -30.197 1.00 0.00 C ATOM 176 C THR A 14 -4.568 7.011 -29.506 1.00 0.00 C ATOM 177 O THR A 14 -3.806 6.524 -28.669 1.00 0.00 O ATOM 178 CB THR A 14 -3.076 8.091 -31.190 1.00 0.00 C ATOM 179 OG1 THR A 14 -2.743 9.316 -31.853 1.00 0.00 O ATOM 180 CG2 THR A 14 -3.455 7.038 -32.220 1.00 0.00 C ATOM 0 H THR A 14 -3.572 9.004 -28.326 1.00 0.00 H new ATOM 0 HA THR A 14 -5.105 8.681 -30.744 1.00 0.00 H new ATOM 0 HB THR A 14 -2.211 7.734 -30.630 1.00 0.00 H new ATOM 0 HG1 THR A 14 -3.371 10.017 -31.580 1.00 0.00 H new ATOM 0 HG21 THR A 14 -2.625 6.888 -32.910 1.00 0.00 H new ATOM 0 HG22 THR A 14 -3.680 6.099 -31.714 1.00 0.00 H new ATOM 0 HG23 THR A 14 -4.332 7.371 -32.775 1.00 0.00 H new ATOM 188 N LEU A 15 -5.712 6.438 -29.861 1.00 0.00 N ATOM 189 CA LEU A 15 -6.150 5.175 -29.275 1.00 0.00 C ATOM 190 C LEU A 15 -5.184 4.048 -29.624 1.00 0.00 C ATOM 191 O LEU A 15 -4.599 4.032 -30.707 1.00 0.00 O ATOM 192 CB LEU A 15 -7.557 4.825 -29.762 1.00 0.00 C ATOM 193 CG LEU A 15 -7.636 3.958 -31.019 1.00 0.00 C ATOM 194 CD1 LEU A 15 -6.720 4.504 -32.103 1.00 0.00 C ATOM 195 CD2 LEU A 15 -7.280 2.514 -30.694 1.00 0.00 C ATOM 0 H LEU A 15 -6.354 6.827 -30.552 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.166 5.292 -28.191 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -8.081 4.310 -28.957 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -8.096 5.753 -29.951 1.00 0.00 H new ATOM 0 HG LEU A 15 -8.660 3.984 -31.391 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -6.790 3.874 -32.990 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -7.021 5.521 -32.356 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -5.692 4.509 -31.742 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -7.341 1.911 -31.600 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -6.266 2.470 -30.297 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -7.977 2.125 -29.952 1.00 0.00 H new ATOM 207 N ALA A 16 -5.022 3.107 -28.701 1.00 0.00 N ATOM 208 CA ALA A 16 -4.131 1.973 -28.913 1.00 0.00 C ATOM 209 C ALA A 16 -4.347 0.898 -27.853 1.00 0.00 C ATOM 210 O ALA A 16 -4.878 1.172 -26.777 1.00 0.00 O ATOM 211 CB ALA A 16 -2.681 2.435 -28.910 1.00 0.00 C ATOM 0 H ALA A 16 -5.496 3.107 -27.798 1.00 0.00 H new ATOM 0 HA ALA A 16 -4.362 1.538 -29.886 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.026 1.579 -29.069 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.529 3.162 -29.708 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -2.448 2.896 -27.950 1.00 0.00 H new ATOM 217 N ASP A 17 -3.934 -0.325 -28.166 1.00 0.00 N ATOM 218 CA ASP A 17 -4.083 -1.442 -27.240 1.00 0.00 C ATOM 219 C ASP A 17 -3.118 -1.307 -26.066 1.00 0.00 C ATOM 220 O ASP A 17 -1.960 -0.927 -26.241 1.00 0.00 O ATOM 221 CB ASP A 17 -3.843 -2.768 -27.964 1.00 0.00 C ATOM 222 CG ASP A 17 -2.523 -2.790 -28.708 1.00 0.00 C ATOM 223 OD1 ASP A 17 -1.476 -2.978 -28.054 1.00 0.00 O ATOM 224 OD2 ASP A 17 -2.536 -2.621 -29.945 1.00 0.00 O ATOM 0 H ASP A 17 -3.494 -0.568 -29.053 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.102 -1.428 -26.853 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -3.862 -3.583 -27.240 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -4.656 -2.947 -28.667 1.00 0.00 H new ATOM 229 N LEU A 18 -3.603 -1.620 -24.870 1.00 0.00 N ATOM 230 CA LEU A 18 -2.784 -1.533 -23.666 1.00 0.00 C ATOM 231 C LEU A 18 -1.801 -2.697 -23.591 1.00 0.00 C ATOM 232 O LEU A 18 -2.201 -3.861 -23.570 1.00 0.00 O ATOM 233 CB LEU A 18 -3.673 -1.520 -22.420 1.00 0.00 C ATOM 234 CG LEU A 18 -4.313 -0.177 -22.067 1.00 0.00 C ATOM 235 CD1 LEU A 18 -3.244 0.848 -21.718 1.00 0.00 C ATOM 236 CD2 LEU A 18 -5.178 0.321 -23.215 1.00 0.00 C ATOM 0 H LEU A 18 -4.559 -1.936 -24.708 1.00 0.00 H new ATOM 0 HA LEU A 18 -2.216 -0.604 -23.709 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -4.467 -2.254 -22.557 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.077 -1.851 -21.569 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.951 -0.319 -21.194 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.718 1.798 -21.470 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.667 0.495 -20.863 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.580 0.986 -22.571 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.625 1.278 -22.945 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.563 0.446 -24.106 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -5.967 -0.404 -23.417 1.00 0.00 H new ATOM 248 N PHE A 19 -0.513 -2.374 -23.548 1.00 0.00 N ATOM 249 CA PHE A 19 0.528 -3.393 -23.474 1.00 0.00 C ATOM 250 C PHE A 19 1.225 -3.360 -22.117 1.00 0.00 C ATOM 251 O PHE A 19 1.697 -4.385 -21.624 1.00 0.00 O ATOM 252 CB PHE A 19 1.553 -3.187 -24.591 1.00 0.00 C ATOM 253 CG PHE A 19 2.036 -1.770 -24.709 1.00 0.00 C ATOM 254 CD1 PHE A 19 1.220 -0.789 -25.248 1.00 0.00 C ATOM 255 CD2 PHE A 19 3.306 -1.419 -24.281 1.00 0.00 C ATOM 256 CE1 PHE A 19 1.661 0.517 -25.357 1.00 0.00 C ATOM 257 CE2 PHE A 19 3.752 -0.115 -24.387 1.00 0.00 C ATOM 258 CZ PHE A 19 2.929 0.854 -24.927 1.00 0.00 C ATOM 0 H PHE A 19 -0.165 -1.415 -23.563 1.00 0.00 H new ATOM 0 HA PHE A 19 0.057 -4.368 -23.598 1.00 0.00 H new ATOM 0 HB2 PHE A 19 2.408 -3.840 -24.414 1.00 0.00 H new ATOM 0 HB3 PHE A 19 1.111 -3.492 -25.540 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.228 -1.047 -25.587 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.955 -2.173 -23.860 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.014 1.273 -25.778 1.00 0.00 H new ATOM 0 HE2 PHE A 19 4.744 0.146 -24.048 1.00 0.00 H new ATOM 0 HZ PHE A 19 3.277 1.873 -25.013 1.00 0.00 H new ATOM 268 N ARG A 20 1.286 -2.175 -21.518 1.00 0.00 N ATOM 269 CA ARG A 20 1.927 -2.008 -20.219 1.00 0.00 C ATOM 270 C ARG A 20 1.312 -2.946 -19.184 1.00 0.00 C ATOM 271 O ARG A 20 0.171 -3.390 -19.314 1.00 0.00 O ATOM 272 CB ARG A 20 1.801 -0.558 -19.747 1.00 0.00 C ATOM 273 CG ARG A 20 2.819 0.378 -20.378 1.00 0.00 C ATOM 274 CD ARG A 20 2.279 1.013 -21.650 1.00 0.00 C ATOM 275 NE ARG A 20 1.314 2.072 -21.367 1.00 0.00 N ATOM 276 CZ ARG A 20 1.605 3.366 -21.430 1.00 0.00 C ATOM 277 NH1 ARG A 20 2.826 3.760 -21.764 1.00 0.00 N ATOM 278 NH2 ARG A 20 0.673 4.271 -21.158 1.00 0.00 N ATOM 0 H ARG A 20 0.900 -1.317 -21.911 1.00 0.00 H new ATOM 0 HA ARG A 20 2.982 -2.257 -20.328 1.00 0.00 H new ATOM 0 HB2 ARG A 20 0.798 -0.197 -19.974 1.00 0.00 H new ATOM 0 HB3 ARG A 20 1.914 -0.526 -18.663 1.00 0.00 H new ATOM 0 HG2 ARG A 20 3.087 1.159 -19.666 1.00 0.00 H new ATOM 0 HG3 ARG A 20 3.731 -0.174 -20.605 1.00 0.00 H new ATOM 0 HD2 ARG A 20 3.106 1.422 -22.230 1.00 0.00 H new ATOM 0 HD3 ARG A 20 1.806 0.247 -22.265 1.00 0.00 H new ATOM 0 HE ARG A 20 0.365 1.803 -21.107 1.00 0.00 H new ATOM 0 HH11 ARG A 20 3.546 3.068 -21.974 1.00 0.00 H new ATOM 0 HH12 ARG A 20 3.046 4.755 -21.811 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -0.268 3.973 -20.900 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.898 5.265 -21.207 1.00 0.00 H new ATOM 292 N PRO A 21 2.084 -3.255 -18.132 1.00 0.00 N ATOM 293 CA PRO A 21 1.636 -4.143 -17.055 1.00 0.00 C ATOM 294 C PRO A 21 0.550 -3.508 -16.195 1.00 0.00 C ATOM 295 O PRO A 21 0.266 -2.314 -16.292 1.00 0.00 O ATOM 296 CB PRO A 21 2.906 -4.370 -16.232 1.00 0.00 C ATOM 297 CG PRO A 21 3.749 -3.170 -16.496 1.00 0.00 C ATOM 298 CD PRO A 21 3.454 -2.762 -17.913 1.00 0.00 C ATOM 0 HA PRO A 21 1.192 -5.061 -17.441 1.00 0.00 H new ATOM 0 HB2 PRO A 21 2.678 -4.467 -15.171 1.00 0.00 H new ATOM 0 HB3 PRO A 21 3.415 -5.285 -16.534 1.00 0.00 H new ATOM 0 HG2 PRO A 21 3.511 -2.365 -15.800 1.00 0.00 H new ATOM 0 HG3 PRO A 21 4.807 -3.400 -16.368 1.00 0.00 H new ATOM 0 HD2 PRO A 21 3.518 -1.681 -18.041 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.159 -3.208 -18.615 1.00 0.00 H new ATOM 306 N PRO A 22 -0.075 -4.323 -15.331 1.00 0.00 N ATOM 307 CA PRO A 22 -1.140 -3.861 -14.436 1.00 0.00 C ATOM 308 C PRO A 22 -0.616 -2.940 -13.340 1.00 0.00 C ATOM 309 O PRO A 22 -0.114 -3.402 -12.315 1.00 0.00 O ATOM 310 CB PRO A 22 -1.681 -5.159 -13.831 1.00 0.00 C ATOM 311 CG PRO A 22 -0.545 -6.119 -13.915 1.00 0.00 C ATOM 312 CD PRO A 22 0.212 -5.757 -15.163 1.00 0.00 C ATOM 0 HA PRO A 22 -1.892 -3.275 -14.964 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -1.999 -5.012 -12.799 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -2.548 -5.522 -14.383 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.094 -6.045 -13.035 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -0.905 -7.147 -13.961 1.00 0.00 H new ATOM 0 HD2 PRO A 22 1.280 -5.943 -15.053 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -0.126 -6.338 -16.021 1.00 0.00 H new ATOM 320 N ILE A 23 -0.738 -1.636 -13.561 1.00 0.00 N ATOM 321 CA ILE A 23 -0.278 -0.650 -12.591 1.00 0.00 C ATOM 322 C ILE A 23 -1.249 -0.538 -11.420 1.00 0.00 C ATOM 323 O ILE A 23 -1.106 0.335 -10.564 1.00 0.00 O ATOM 324 CB ILE A 23 -0.107 0.738 -13.236 1.00 0.00 C ATOM 325 CG1 ILE A 23 -1.428 1.207 -13.848 1.00 0.00 C ATOM 326 CG2 ILE A 23 0.988 0.700 -14.291 1.00 0.00 C ATOM 327 CD1 ILE A 23 -1.409 2.653 -14.291 1.00 0.00 C ATOM 0 H ILE A 23 -1.152 -1.237 -14.404 1.00 0.00 H new ATOM 0 HA ILE A 23 0.690 -0.993 -12.227 1.00 0.00 H new ATOM 0 HB ILE A 23 0.185 1.448 -12.462 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -1.667 0.576 -14.704 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -2.226 1.069 -13.119 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.097 1.688 -14.738 1.00 0.00 H new ATOM 0 HG22 ILE A 23 1.930 0.405 -13.828 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.723 -0.021 -15.065 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -2.378 2.916 -14.715 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -1.202 3.293 -13.434 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.634 2.793 -15.044 1.00 0.00 H new ATOM 339 N ASP A 24 -2.235 -1.428 -11.388 1.00 0.00 N ATOM 340 CA ASP A 24 -3.228 -1.431 -10.321 1.00 0.00 C ATOM 341 C ASP A 24 -2.566 -1.639 -8.963 1.00 0.00 C ATOM 342 O ASP A 24 -2.924 -0.990 -7.979 1.00 0.00 O ATOM 343 CB ASP A 24 -4.270 -2.524 -10.567 1.00 0.00 C ATOM 344 CG ASP A 24 -5.114 -2.252 -11.797 1.00 0.00 C ATOM 345 OD1 ASP A 24 -4.544 -1.837 -12.828 1.00 0.00 O ATOM 346 OD2 ASP A 24 -6.345 -2.453 -11.729 1.00 0.00 O ATOM 0 H ASP A 24 -2.368 -2.157 -12.089 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.725 -0.461 -10.318 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.766 -3.484 -10.681 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.919 -2.606 -9.695 1.00 0.00 H new ATOM 351 N LEU A 25 -1.599 -2.549 -8.915 1.00 0.00 N ATOM 352 CA LEU A 25 -0.886 -2.845 -7.677 1.00 0.00 C ATOM 353 C LEU A 25 0.064 -1.709 -7.312 1.00 0.00 C ATOM 354 O LEU A 25 -0.051 -1.111 -6.242 1.00 0.00 O ATOM 355 CB LEU A 25 -0.107 -4.154 -7.814 1.00 0.00 C ATOM 356 CG LEU A 25 1.026 -4.369 -6.809 1.00 0.00 C ATOM 357 CD1 LEU A 25 0.482 -4.394 -5.390 1.00 0.00 C ATOM 358 CD2 LEU A 25 1.775 -5.656 -7.118 1.00 0.00 C ATOM 0 H LEU A 25 -1.291 -3.095 -9.720 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.621 -2.950 -6.879 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.809 -4.983 -7.722 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.312 -4.201 -8.819 1.00 0.00 H new ATOM 0 HG LEU A 25 1.725 -3.537 -6.894 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.302 -4.548 -4.689 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.009 -3.446 -5.172 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.238 -5.206 -5.291 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.577 -5.793 -6.393 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.087 -6.500 -7.062 1.00 0.00 H new ATOM 0 HD23 LEU A 25 2.198 -5.599 -8.121 1.00 0.00 H new ATOM 370 N MET A 26 1.001 -1.417 -8.208 1.00 0.00 N ATOM 371 CA MET A 26 1.969 -0.350 -7.980 1.00 0.00 C ATOM 372 C MET A 26 1.265 0.964 -7.658 1.00 0.00 C ATOM 373 O MET A 26 1.887 1.911 -7.177 1.00 0.00 O ATOM 374 CB MET A 26 2.864 -0.175 -9.209 1.00 0.00 C ATOM 375 CG MET A 26 3.820 -1.335 -9.435 1.00 0.00 C ATOM 376 SD MET A 26 4.825 -1.127 -10.917 1.00 0.00 S ATOM 377 CE MET A 26 3.607 -1.421 -12.197 1.00 0.00 C ATOM 0 H MET A 26 1.111 -1.904 -9.098 1.00 0.00 H new ATOM 0 HA MET A 26 2.586 -0.629 -7.126 1.00 0.00 H new ATOM 0 HB2 MET A 26 2.236 -0.055 -10.092 1.00 0.00 H new ATOM 0 HB3 MET A 26 3.440 0.744 -9.101 1.00 0.00 H new ATOM 0 HG2 MET A 26 4.474 -1.436 -8.569 1.00 0.00 H new ATOM 0 HG3 MET A 26 3.250 -2.261 -9.514 1.00 0.00 H new ATOM 0 HE1 MET A 26 4.106 -1.504 -13.162 1.00 0.00 H new ATOM 0 HE2 MET A 26 3.072 -2.347 -11.985 1.00 0.00 H new ATOM 0 HE3 MET A 26 2.900 -0.592 -12.224 1.00 0.00 H new ATOM 387 N HIS A 27 -0.036 1.014 -7.925 1.00 0.00 N ATOM 388 CA HIS A 27 -0.825 2.212 -7.663 1.00 0.00 C ATOM 389 C HIS A 27 -0.177 3.439 -8.298 1.00 0.00 C ATOM 390 O HIS A 27 -0.161 4.520 -7.709 1.00 0.00 O ATOM 391 CB HIS A 27 -0.982 2.425 -6.157 1.00 0.00 C ATOM 392 CG HIS A 27 -2.157 3.280 -5.792 1.00 0.00 C ATOM 393 ND1 HIS A 27 -3.396 2.761 -5.480 1.00 0.00 N ATOM 394 CD2 HIS A 27 -2.276 4.624 -5.690 1.00 0.00 C ATOM 395 CE1 HIS A 27 -4.227 3.750 -5.202 1.00 0.00 C ATOM 396 NE2 HIS A 27 -3.572 4.891 -5.322 1.00 0.00 N ATOM 0 H HIS A 27 -0.566 0.239 -8.323 1.00 0.00 H new ATOM 0 HA HIS A 27 -1.811 2.073 -8.107 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -1.084 1.455 -5.670 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -0.074 2.884 -5.767 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -1.497 5.351 -5.865 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -5.265 3.644 -4.924 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -3.965 5.819 -5.167 1.00 0.00 H new ATOM 405 N LYS A 28 0.357 3.264 -9.501 1.00 0.00 N ATOM 406 CA LYS A 28 1.007 4.355 -10.217 1.00 0.00 C ATOM 407 C LYS A 28 0.057 5.537 -10.384 1.00 0.00 C ATOM 408 O LYS A 28 -1.117 5.362 -10.707 1.00 0.00 O ATOM 409 CB LYS A 28 1.490 3.878 -11.589 1.00 0.00 C ATOM 410 CG LYS A 28 2.719 4.614 -12.091 1.00 0.00 C ATOM 411 CD LYS A 28 2.751 4.676 -13.609 1.00 0.00 C ATOM 412 CE LYS A 28 1.910 5.828 -14.138 1.00 0.00 C ATOM 413 NZ LYS A 28 1.836 5.824 -15.625 1.00 0.00 N ATOM 0 H LYS A 28 0.353 2.375 -10.002 1.00 0.00 H new ATOM 0 HA LYS A 28 1.866 4.680 -9.630 1.00 0.00 H new ATOM 0 HB2 LYS A 28 1.712 2.812 -11.536 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.683 4.001 -12.312 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.730 5.625 -11.684 1.00 0.00 H new ATOM 0 HG3 LYS A 28 3.617 4.115 -11.727 1.00 0.00 H new ATOM 0 HD2 LYS A 28 3.781 4.790 -13.948 1.00 0.00 H new ATOM 0 HD3 LYS A 28 2.383 3.736 -14.020 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.904 5.763 -13.724 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.334 6.773 -13.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 1.254 6.624 -15.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.794 5.912 -16.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.408 4.933 -15.949 1.00 0.00 H new ATOM 427 N GLY A 29 0.574 6.742 -10.165 1.00 0.00 N ATOM 428 CA GLY A 29 -0.241 7.935 -10.297 1.00 0.00 C ATOM 429 C GLY A 29 0.310 9.106 -9.508 1.00 0.00 C ATOM 430 O GLY A 29 1.158 9.850 -9.999 1.00 0.00 O ATOM 0 H GLY A 29 1.544 6.913 -9.898 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -0.308 8.210 -11.350 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.254 7.718 -9.959 1.00 0.00 H new ATOM 434 N SER A 30 -0.173 9.270 -8.280 1.00 0.00 N ATOM 435 CA SER A 30 0.273 10.362 -7.423 1.00 0.00 C ATOM 436 C SER A 30 0.478 9.879 -5.990 1.00 0.00 C ATOM 437 O SER A 30 0.006 8.807 -5.611 1.00 0.00 O ATOM 438 CB SER A 30 -0.742 11.506 -7.448 1.00 0.00 C ATOM 439 OG SER A 30 -0.751 12.153 -8.709 1.00 0.00 O ATOM 0 H SER A 30 -0.873 8.661 -7.857 1.00 0.00 H new ATOM 0 HA SER A 30 1.227 10.725 -7.806 1.00 0.00 H new ATOM 0 HB2 SER A 30 -1.737 11.119 -7.228 1.00 0.00 H new ATOM 0 HB3 SER A 30 -0.501 12.227 -6.667 1.00 0.00 H new ATOM 0 HG SER A 30 -1.409 12.879 -8.699 1.00 0.00 H new ATOM 445 N PHE A 31 1.185 10.678 -5.199 1.00 0.00 N ATOM 446 CA PHE A 31 1.454 10.333 -3.807 1.00 0.00 C ATOM 447 C PHE A 31 0.313 10.791 -2.903 1.00 0.00 C ATOM 448 O PHE A 31 -0.217 10.012 -2.112 1.00 0.00 O ATOM 449 CB PHE A 31 2.769 10.966 -3.348 1.00 0.00 C ATOM 450 CG PHE A 31 2.964 10.928 -1.859 1.00 0.00 C ATOM 451 CD1 PHE A 31 2.891 9.730 -1.168 1.00 0.00 C ATOM 452 CD2 PHE A 31 3.221 12.091 -1.151 1.00 0.00 C ATOM 453 CE1 PHE A 31 3.071 9.691 0.202 1.00 0.00 C ATOM 454 CE2 PHE A 31 3.402 12.059 0.219 1.00 0.00 C ATOM 455 CZ PHE A 31 3.325 10.858 0.896 1.00 0.00 C ATOM 0 H PHE A 31 1.582 11.569 -5.497 1.00 0.00 H new ATOM 0 HA PHE A 31 1.537 9.248 -3.737 1.00 0.00 H new ATOM 0 HB2 PHE A 31 3.599 10.449 -3.829 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.801 12.002 -3.684 1.00 0.00 H new ATOM 0 HD1 PHE A 31 2.691 8.815 -1.706 1.00 0.00 H new ATOM 0 HD2 PHE A 31 3.281 13.033 -1.676 1.00 0.00 H new ATOM 0 HE1 PHE A 31 3.013 8.750 0.729 1.00 0.00 H new ATOM 0 HE2 PHE A 31 3.603 12.972 0.759 1.00 0.00 H new ATOM 0 HZ PHE A 31 3.463 10.831 1.967 1.00 0.00 H new ATOM 465 N GLU A 32 -0.059 12.062 -3.027 1.00 0.00 N ATOM 466 CA GLU A 32 -1.136 12.624 -2.221 1.00 0.00 C ATOM 467 C GLU A 32 -2.416 11.809 -2.379 1.00 0.00 C ATOM 468 O GLU A 32 -3.167 11.618 -1.421 1.00 0.00 O ATOM 469 CB GLU A 32 -1.392 14.080 -2.616 1.00 0.00 C ATOM 470 CG GLU A 32 -1.668 14.269 -4.098 1.00 0.00 C ATOM 471 CD GLU A 32 -2.364 15.581 -4.399 1.00 0.00 C ATOM 472 OE1 GLU A 32 -3.597 15.656 -4.214 1.00 0.00 O ATOM 473 OE2 GLU A 32 -1.676 16.535 -4.820 1.00 0.00 O ATOM 0 H GLU A 32 0.369 12.721 -3.677 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.830 12.588 -1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -2.240 14.459 -2.046 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -0.527 14.681 -2.337 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.727 14.227 -4.647 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -2.284 13.445 -4.457 1.00 0.00 H new ATOM 480 N THR A 33 -2.660 11.331 -3.595 1.00 0.00 N ATOM 481 CA THR A 33 -3.850 10.538 -3.880 1.00 0.00 C ATOM 482 C THR A 33 -3.876 9.265 -3.042 1.00 0.00 C ATOM 483 O THR A 33 -4.863 8.978 -2.364 1.00 0.00 O ATOM 484 CB THR A 33 -3.928 10.159 -5.371 1.00 0.00 C ATOM 485 OG1 THR A 33 -3.892 11.341 -6.179 1.00 0.00 O ATOM 486 CG2 THR A 33 -5.199 9.377 -5.664 1.00 0.00 C ATOM 0 H THR A 33 -2.049 11.479 -4.399 1.00 0.00 H new ATOM 0 HA THR A 33 -4.711 11.156 -3.624 1.00 0.00 H new ATOM 0 HB THR A 33 -3.070 9.530 -5.609 1.00 0.00 H new ATOM 0 HG1 THR A 33 -3.940 11.092 -7.126 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.232 9.120 -6.723 1.00 0.00 H new ATOM 0 HG22 THR A 33 -5.210 8.464 -5.069 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.067 9.986 -5.411 1.00 0.00 H new ATOM 494 N ALA A 34 -2.787 8.506 -3.092 1.00 0.00 N ATOM 495 CA ALA A 34 -2.685 7.265 -2.335 1.00 0.00 C ATOM 496 C ALA A 34 -3.408 7.377 -0.997 1.00 0.00 C ATOM 497 O ALA A 34 -3.944 6.394 -0.485 1.00 0.00 O ATOM 498 CB ALA A 34 -1.224 6.897 -2.118 1.00 0.00 C ATOM 0 H ALA A 34 -1.962 8.729 -3.649 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.165 6.476 -2.913 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.163 5.968 -1.551 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.735 6.766 -3.083 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.727 7.693 -1.564 1.00 0.00 H new ATOM 504 N LYS A 35 -3.419 8.581 -0.435 1.00 0.00 N ATOM 505 CA LYS A 35 -4.077 8.823 0.844 1.00 0.00 C ATOM 506 C LYS A 35 -5.593 8.857 0.678 1.00 0.00 C ATOM 507 O LYS A 35 -6.318 8.144 1.371 1.00 0.00 O ATOM 508 CB LYS A 35 -3.590 10.141 1.450 1.00 0.00 C ATOM 509 CG LYS A 35 -2.372 9.986 2.344 1.00 0.00 C ATOM 510 CD LYS A 35 -1.590 11.284 2.452 1.00 0.00 C ATOM 511 CE LYS A 35 -0.808 11.571 1.179 1.00 0.00 C ATOM 512 NZ LYS A 35 0.452 10.780 1.112 1.00 0.00 N ATOM 0 H LYS A 35 -2.979 9.405 -0.845 1.00 0.00 H new ATOM 0 HA LYS A 35 -3.821 8.004 1.517 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -3.353 10.836 0.644 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.400 10.587 2.028 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -2.687 9.666 3.337 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.726 9.203 1.947 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.275 12.107 2.653 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -0.904 11.227 3.297 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.428 11.341 0.312 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -0.573 12.634 1.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 1.247 11.412 0.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 0.622 10.319 2.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 0.368 10.056 0.371 1.00 0.00 H new ATOM 526 N GLU A 36 -6.064 9.689 -0.245 1.00 0.00 N ATOM 527 CA GLU A 36 -7.494 9.814 -0.502 1.00 0.00 C ATOM 528 C GLU A 36 -8.063 8.512 -1.058 1.00 0.00 C ATOM 529 O GLU A 36 -9.105 8.035 -0.607 1.00 0.00 O ATOM 530 CB GLU A 36 -7.761 10.960 -1.480 1.00 0.00 C ATOM 531 CG GLU A 36 -7.507 10.592 -2.932 1.00 0.00 C ATOM 532 CD GLU A 36 -7.782 11.741 -3.883 1.00 0.00 C ATOM 533 OE1 GLU A 36 -6.877 12.579 -4.077 1.00 0.00 O ATOM 534 OE2 GLU A 36 -8.903 11.803 -4.431 1.00 0.00 O ATOM 0 H GLU A 36 -5.477 10.286 -0.827 1.00 0.00 H new ATOM 0 HA GLU A 36 -7.989 10.031 0.444 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -8.796 11.285 -1.372 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -7.131 11.808 -1.213 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -6.471 10.271 -3.046 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -8.135 9.743 -3.203 1.00 0.00 H new ATOM 541 N CYS A 37 -7.372 7.944 -2.040 1.00 0.00 N ATOM 542 CA CYS A 37 -7.809 6.698 -2.659 1.00 0.00 C ATOM 543 C CYS A 37 -8.068 5.627 -1.604 1.00 0.00 C ATOM 544 O CYS A 37 -9.058 4.900 -1.673 1.00 0.00 O ATOM 545 CB CYS A 37 -6.759 6.205 -3.656 1.00 0.00 C ATOM 546 SG CYS A 37 -6.995 6.818 -5.341 1.00 0.00 S ATOM 0 H CYS A 37 -6.508 8.326 -2.424 1.00 0.00 H new ATOM 0 HA CYS A 37 -8.741 6.892 -3.189 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -5.772 6.507 -3.306 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -6.772 5.115 -3.672 1.00 0.00 H new ATOM 0 HG CYS A 37 -6.057 6.348 -6.109 1.00 0.00 H new ATOM 552 N GLY A 38 -7.170 5.535 -0.628 1.00 0.00 N ATOM 553 CA GLY A 38 -7.318 4.550 0.426 1.00 0.00 C ATOM 554 C GLY A 38 -8.569 4.770 1.254 1.00 0.00 C ATOM 555 O GLY A 38 -9.334 3.836 1.493 1.00 0.00 O ATOM 0 H GLY A 38 -6.342 6.126 -0.549 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -7.348 3.553 -0.014 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.444 4.585 1.077 1.00 0.00 H new ATOM 559 N GLN A 39 -8.776 6.007 1.693 1.00 0.00 N ATOM 560 CA GLN A 39 -9.942 6.346 2.501 1.00 0.00 C ATOM 561 C GLN A 39 -11.225 5.859 1.835 1.00 0.00 C ATOM 562 O GLN A 39 -12.113 5.323 2.496 1.00 0.00 O ATOM 563 CB GLN A 39 -10.011 7.857 2.725 1.00 0.00 C ATOM 564 CG GLN A 39 -9.178 8.336 3.903 1.00 0.00 C ATOM 565 CD GLN A 39 -9.442 9.787 4.253 1.00 0.00 C ATOM 566 OE1 GLN A 39 -10.357 10.097 5.018 1.00 0.00 O ATOM 567 NE2 GLN A 39 -8.641 10.687 3.695 1.00 0.00 N ATOM 0 H GLN A 39 -8.152 6.791 1.503 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.843 5.847 3.465 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.674 8.366 1.822 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.050 8.145 2.884 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -9.391 7.712 4.771 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -8.121 8.209 3.671 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -7.895 10.387 3.067 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -8.771 11.679 3.894 1.00 0.00 H new ATOM 576 N MET A 40 -11.314 6.051 0.523 1.00 0.00 N ATOM 577 CA MET A 40 -12.489 5.630 -0.232 1.00 0.00 C ATOM 578 C MET A 40 -12.978 4.264 0.240 1.00 0.00 C ATOM 579 O MET A 40 -14.130 4.115 0.647 1.00 0.00 O ATOM 580 CB MET A 40 -12.171 5.582 -1.727 1.00 0.00 C ATOM 581 CG MET A 40 -12.143 6.951 -2.387 1.00 0.00 C ATOM 582 SD MET A 40 -13.680 7.864 -2.156 1.00 0.00 S ATOM 583 CE MET A 40 -13.288 8.824 -0.696 1.00 0.00 C ATOM 0 H MET A 40 -10.588 6.495 -0.039 1.00 0.00 H new ATOM 0 HA MET A 40 -13.281 6.359 -0.060 1.00 0.00 H new ATOM 0 HB2 MET A 40 -11.204 5.100 -1.869 1.00 0.00 H new ATOM 0 HB3 MET A 40 -12.914 4.961 -2.228 1.00 0.00 H new ATOM 0 HG2 MET A 40 -11.316 7.531 -1.978 1.00 0.00 H new ATOM 0 HG3 MET A 40 -11.952 6.832 -3.454 1.00 0.00 H new ATOM 0 HE1 MET A 40 -14.077 8.698 0.045 1.00 0.00 H new ATOM 0 HE2 MET A 40 -12.341 8.482 -0.279 1.00 0.00 H new ATOM 0 HE3 MET A 40 -13.207 9.877 -0.964 1.00 0.00 H new ATOM 593 N GLN A 41 -12.096 3.272 0.183 1.00 0.00 N ATOM 594 CA GLN A 41 -12.440 1.919 0.604 1.00 0.00 C ATOM 595 C GLN A 41 -11.916 1.637 2.008 1.00 0.00 C ATOM 596 O GLN A 41 -11.826 0.483 2.426 1.00 0.00 O ATOM 597 CB GLN A 41 -11.871 0.896 -0.381 1.00 0.00 C ATOM 598 CG GLN A 41 -12.383 1.070 -1.802 1.00 0.00 C ATOM 599 CD GLN A 41 -13.652 0.283 -2.065 1.00 0.00 C ATOM 600 OE1 GLN A 41 -14.496 0.131 -1.182 1.00 0.00 O ATOM 601 NE2 GLN A 41 -13.794 -0.221 -3.285 1.00 0.00 N ATOM 0 H GLN A 41 -11.138 3.379 -0.150 1.00 0.00 H new ATOM 0 HA GLN A 41 -13.527 1.834 0.618 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.784 0.972 -0.384 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -12.119 -0.107 -0.034 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -12.570 2.127 -1.990 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.611 0.753 -2.504 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -13.069 -0.071 -3.987 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -14.628 -0.759 -3.521 1.00 0.00 H new ATOM 610 N ASN A 42 -11.572 2.698 2.731 1.00 0.00 N ATOM 611 CA ASN A 42 -11.056 2.563 4.088 1.00 0.00 C ATOM 612 C ASN A 42 -9.895 1.574 4.133 1.00 0.00 C ATOM 613 O ASN A 42 -9.855 0.685 4.984 1.00 0.00 O ATOM 614 CB ASN A 42 -12.167 2.105 5.035 1.00 0.00 C ATOM 615 CG ASN A 42 -13.244 1.310 4.322 1.00 0.00 C ATOM 616 OD1 ASN A 42 -14.028 1.861 3.549 1.00 0.00 O ATOM 617 ND2 ASN A 42 -13.286 0.008 4.579 1.00 0.00 N ATOM 0 H ASN A 42 -11.641 3.660 2.400 1.00 0.00 H new ATOM 0 HA ASN A 42 -10.692 3.539 4.410 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.735 1.496 5.829 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.617 2.976 5.511 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -13.989 -0.578 4.128 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -12.616 -0.406 5.227 1.00 0.00 H new ATOM 624 N LYS A 43 -8.951 1.736 3.212 1.00 0.00 N ATOM 625 CA LYS A 43 -7.787 0.860 3.147 1.00 0.00 C ATOM 626 C LYS A 43 -6.564 1.534 3.760 1.00 0.00 C ATOM 627 O LYS A 43 -6.375 2.742 3.621 1.00 0.00 O ATOM 628 CB LYS A 43 -7.495 0.474 1.695 1.00 0.00 C ATOM 629 CG LYS A 43 -8.663 -0.204 1.000 1.00 0.00 C ATOM 630 CD LYS A 43 -8.329 -0.551 -0.441 1.00 0.00 C ATOM 631 CE LYS A 43 -8.132 0.700 -1.284 1.00 0.00 C ATOM 632 NZ LYS A 43 -7.747 0.371 -2.684 1.00 0.00 N ATOM 0 H LYS A 43 -8.969 2.466 2.500 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.009 -0.041 3.719 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -7.222 1.370 1.138 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.632 -0.192 1.671 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -8.932 -1.111 1.541 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.533 0.452 1.025 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -7.423 -1.157 -0.470 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.131 -1.155 -0.866 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.053 1.284 -1.288 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -7.361 1.324 -0.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -7.316 1.205 -3.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -7.063 -0.412 -2.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -8.593 0.090 -3.220 1.00 0.00 H new ATOM 646 N TRP A 44 -5.737 0.745 4.437 1.00 0.00 N ATOM 647 CA TRP A 44 -4.531 1.266 5.070 1.00 0.00 C ATOM 648 C TRP A 44 -3.499 1.674 4.024 1.00 0.00 C ATOM 649 O TRP A 44 -3.515 1.179 2.896 1.00 0.00 O ATOM 650 CB TRP A 44 -3.934 0.221 6.014 1.00 0.00 C ATOM 651 CG TRP A 44 -4.838 -0.135 7.155 1.00 0.00 C ATOM 652 CD1 TRP A 44 -5.662 -1.221 7.239 1.00 0.00 C ATOM 653 CD2 TRP A 44 -5.011 0.598 8.372 1.00 0.00 C ATOM 654 NE1 TRP A 44 -6.337 -1.207 8.436 1.00 0.00 N ATOM 655 CE2 TRP A 44 -5.955 -0.102 9.150 1.00 0.00 C ATOM 656 CE3 TRP A 44 -4.460 1.776 8.883 1.00 0.00 C ATOM 657 CZ2 TRP A 44 -6.357 0.339 10.407 1.00 0.00 C ATOM 658 CZ3 TRP A 44 -4.861 2.214 10.131 1.00 0.00 C ATOM 659 CH2 TRP A 44 -5.802 1.496 10.882 1.00 0.00 C ATOM 0 H TRP A 44 -5.880 -0.257 4.562 1.00 0.00 H new ATOM 0 HA TRP A 44 -4.806 2.150 5.645 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -3.704 -0.681 5.447 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -2.991 0.597 6.411 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -5.768 -1.979 6.477 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -7.013 -1.906 8.743 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -3.733 2.335 8.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -7.082 -0.213 10.987 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -4.443 3.124 10.534 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -6.095 1.863 11.855 1.00 0.00 H new ATOM 670 N LEU A 45 -2.603 2.577 4.404 1.00 0.00 N ATOM 671 CA LEU A 45 -1.563 3.051 3.498 1.00 0.00 C ATOM 672 C LEU A 45 -0.208 2.453 3.864 1.00 0.00 C ATOM 673 O LEU A 45 0.231 2.542 5.010 1.00 0.00 O ATOM 674 CB LEU A 45 -1.485 4.578 3.532 1.00 0.00 C ATOM 675 CG LEU A 45 -0.286 5.206 2.820 1.00 0.00 C ATOM 676 CD1 LEU A 45 -0.391 5.002 1.317 1.00 0.00 C ATOM 677 CD2 LEU A 45 -0.183 6.687 3.154 1.00 0.00 C ATOM 0 H LEU A 45 -2.575 2.996 5.334 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.821 2.729 2.489 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.396 4.978 3.087 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.472 4.898 4.574 1.00 0.00 H new ATOM 0 HG LEU A 45 0.620 4.712 3.170 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.471 5.455 0.827 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.414 3.935 1.095 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -1.305 5.469 0.949 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.676 7.117 2.639 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.092 7.196 2.833 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.059 6.810 4.230 1.00 0.00 H new ATOM 689 N MET A 46 0.450 1.846 2.882 1.00 0.00 N ATOM 690 CA MET A 46 1.757 1.236 3.100 1.00 0.00 C ATOM 691 C MET A 46 2.796 1.824 2.151 1.00 0.00 C ATOM 692 O MET A 46 2.737 1.607 0.940 1.00 0.00 O ATOM 693 CB MET A 46 1.674 -0.280 2.910 1.00 0.00 C ATOM 694 CG MET A 46 2.754 -1.045 3.657 1.00 0.00 C ATOM 695 SD MET A 46 2.333 -2.782 3.900 1.00 0.00 S ATOM 696 CE MET A 46 2.329 -2.882 5.688 1.00 0.00 C ATOM 0 H MET A 46 0.100 1.763 1.928 1.00 0.00 H new ATOM 0 HA MET A 46 2.064 1.450 4.124 1.00 0.00 H new ATOM 0 HB2 MET A 46 0.697 -0.627 3.245 1.00 0.00 H new ATOM 0 HB3 MET A 46 1.747 -0.509 1.847 1.00 0.00 H new ATOM 0 HG2 MET A 46 3.691 -0.976 3.104 1.00 0.00 H new ATOM 0 HG3 MET A 46 2.921 -0.576 4.627 1.00 0.00 H new ATOM 0 HE1 MET A 46 2.599 -3.892 5.997 1.00 0.00 H new ATOM 0 HE2 MET A 46 3.051 -2.173 6.094 1.00 0.00 H new ATOM 0 HE3 MET A 46 1.334 -2.642 6.064 1.00 0.00 H new ATOM 706 N ILE A 47 3.746 2.567 2.708 1.00 0.00 N ATOM 707 CA ILE A 47 4.798 3.185 1.910 1.00 0.00 C ATOM 708 C ILE A 47 6.099 2.394 2.010 1.00 0.00 C ATOM 709 O ILE A 47 6.354 1.723 3.008 1.00 0.00 O ATOM 710 CB ILE A 47 5.059 4.638 2.349 1.00 0.00 C ATOM 711 CG1 ILE A 47 3.776 5.464 2.240 1.00 0.00 C ATOM 712 CG2 ILE A 47 6.166 5.255 1.508 1.00 0.00 C ATOM 713 CD1 ILE A 47 3.268 5.608 0.823 1.00 0.00 C ATOM 0 H ILE A 47 3.809 2.756 3.708 1.00 0.00 H new ATOM 0 HA ILE A 47 4.452 3.184 0.876 1.00 0.00 H new ATOM 0 HB ILE A 47 5.380 4.635 3.391 1.00 0.00 H new ATOM 0 HG12 ILE A 47 3.001 4.999 2.849 1.00 0.00 H new ATOM 0 HG13 ILE A 47 3.956 6.456 2.655 1.00 0.00 H new ATOM 0 HG21 ILE A 47 6.339 6.282 1.830 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.082 4.677 1.632 1.00 0.00 H new ATOM 0 HG23 ILE A 47 5.872 5.249 0.458 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.356 6.205 0.822 1.00 0.00 H new ATOM 0 HD12 ILE A 47 4.025 6.101 0.213 1.00 0.00 H new ATOM 0 HD13 ILE A 47 3.056 4.622 0.411 1.00 0.00 H new ATOM 725 N ASN A 48 6.919 2.481 0.967 1.00 0.00 N ATOM 726 CA ASN A 48 8.194 1.775 0.937 1.00 0.00 C ATOM 727 C ASN A 48 9.265 2.615 0.248 1.00 0.00 C ATOM 728 O ASN A 48 9.058 3.116 -0.858 1.00 0.00 O ATOM 729 CB ASN A 48 8.042 0.433 0.219 1.00 0.00 C ATOM 730 CG ASN A 48 6.967 -0.437 0.841 1.00 0.00 C ATOM 731 OD1 ASN A 48 5.811 -0.412 0.420 1.00 0.00 O ATOM 732 ND2 ASN A 48 7.346 -1.213 1.850 1.00 0.00 N ATOM 0 H ASN A 48 6.723 3.033 0.132 1.00 0.00 H new ATOM 0 HA ASN A 48 8.505 1.595 1.966 1.00 0.00 H new ATOM 0 HB2 ASN A 48 7.801 0.610 -0.829 1.00 0.00 H new ATOM 0 HB3 ASN A 48 8.994 -0.098 0.242 1.00 0.00 H new ATOM 0 HD21 ASN A 48 6.667 -1.821 2.309 1.00 0.00 H new ATOM 0 HD22 ASN A 48 8.316 -1.201 2.166 1.00 0.00 H new ATOM 739 N ILE A 49 10.409 2.764 0.907 1.00 0.00 N ATOM 740 CA ILE A 49 11.512 3.541 0.357 1.00 0.00 C ATOM 741 C ILE A 49 12.710 2.651 0.044 1.00 0.00 C ATOM 742 O ILE A 49 13.359 2.127 0.949 1.00 0.00 O ATOM 743 CB ILE A 49 11.954 4.655 1.325 1.00 0.00 C ATOM 744 CG1 ILE A 49 10.788 5.604 1.611 1.00 0.00 C ATOM 745 CG2 ILE A 49 13.136 5.419 0.748 1.00 0.00 C ATOM 746 CD1 ILE A 49 10.194 6.225 0.365 1.00 0.00 C ATOM 0 H ILE A 49 10.596 2.356 1.823 1.00 0.00 H new ATOM 0 HA ILE A 49 11.149 3.995 -0.565 1.00 0.00 H new ATOM 0 HB ILE A 49 12.265 4.198 2.264 1.00 0.00 H new ATOM 0 HG12 ILE A 49 10.008 5.059 2.142 1.00 0.00 H new ATOM 0 HG13 ILE A 49 11.131 6.398 2.275 1.00 0.00 H new ATOM 0 HG21 ILE A 49 13.437 6.203 1.443 1.00 0.00 H new ATOM 0 HG22 ILE A 49 13.969 4.735 0.590 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.850 5.868 -0.203 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.373 6.886 0.644 1.00 0.00 H new ATOM 0 HD12 ILE A 49 10.960 6.799 -0.156 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.820 5.439 -0.291 1.00 0.00 H new ATOM 758 N GLN A 50 12.998 2.486 -1.243 1.00 0.00 N ATOM 759 CA GLN A 50 14.119 1.659 -1.674 1.00 0.00 C ATOM 760 C GLN A 50 15.379 2.500 -1.849 1.00 0.00 C ATOM 761 O GLN A 50 15.350 3.557 -2.478 1.00 0.00 O ATOM 762 CB GLN A 50 13.780 0.948 -2.985 1.00 0.00 C ATOM 763 CG GLN A 50 13.385 1.895 -4.107 1.00 0.00 C ATOM 764 CD GLN A 50 11.894 2.165 -4.145 1.00 0.00 C ATOM 765 OE1 GLN A 50 11.377 2.966 -3.365 1.00 0.00 O ATOM 766 NE2 GLN A 50 11.194 1.498 -5.054 1.00 0.00 N ATOM 0 H GLN A 50 12.471 2.914 -2.005 1.00 0.00 H new ATOM 0 HA GLN A 50 14.306 0.913 -0.902 1.00 0.00 H new ATOM 0 HB2 GLN A 50 14.641 0.360 -3.303 1.00 0.00 H new ATOM 0 HB3 GLN A 50 12.964 0.247 -2.808 1.00 0.00 H new ATOM 0 HG2 GLN A 50 13.918 2.838 -3.986 1.00 0.00 H new ATOM 0 HG3 GLN A 50 13.698 1.472 -5.061 1.00 0.00 H new ATOM 0 HE21 GLN A 50 11.664 0.844 -5.680 1.00 0.00 H new ATOM 0 HE22 GLN A 50 10.186 1.640 -5.127 1.00 0.00 H new ATOM 775 N ASN A 51 16.485 2.023 -1.288 1.00 0.00 N ATOM 776 CA ASN A 51 17.757 2.731 -1.381 1.00 0.00 C ATOM 777 C ASN A 51 18.662 2.089 -2.428 1.00 0.00 C ATOM 778 O ASN A 51 19.201 1.003 -2.216 1.00 0.00 O ATOM 779 CB ASN A 51 18.459 2.743 -0.022 1.00 0.00 C ATOM 780 CG ASN A 51 19.321 3.975 0.173 1.00 0.00 C ATOM 781 OD1 ASN A 51 18.911 5.091 -0.147 1.00 0.00 O ATOM 782 ND2 ASN A 51 20.524 3.778 0.700 1.00 0.00 N ATOM 0 H ASN A 51 16.526 1.149 -0.764 1.00 0.00 H new ATOM 0 HA ASN A 51 17.551 3.757 -1.685 1.00 0.00 H new ATOM 0 HB2 ASN A 51 17.712 2.697 0.770 1.00 0.00 H new ATOM 0 HB3 ASN A 51 19.078 1.851 0.072 1.00 0.00 H new ATOM 0 HD21 ASN A 51 21.149 4.569 0.854 1.00 0.00 H new ATOM 0 HD22 ASN A 51 20.823 2.836 0.951 1.00 0.00 H new ATOM 789 N VAL A 52 18.824 2.768 -3.559 1.00 0.00 N ATOM 790 CA VAL A 52 19.666 2.266 -4.638 1.00 0.00 C ATOM 791 C VAL A 52 21.058 1.909 -4.130 1.00 0.00 C ATOM 792 O VAL A 52 21.704 0.999 -4.649 1.00 0.00 O ATOM 793 CB VAL A 52 19.795 3.297 -5.775 1.00 0.00 C ATOM 794 CG1 VAL A 52 18.426 3.648 -6.336 1.00 0.00 C ATOM 795 CG2 VAL A 52 20.515 4.544 -5.284 1.00 0.00 C ATOM 0 H VAL A 52 18.383 3.667 -3.752 1.00 0.00 H new ATOM 0 HA VAL A 52 19.183 1.368 -5.024 1.00 0.00 H new ATOM 0 HB VAL A 52 20.387 2.855 -6.577 1.00 0.00 H new ATOM 0 HG11 VAL A 52 18.538 4.378 -7.138 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.952 2.748 -6.727 1.00 0.00 H new ATOM 0 HG13 VAL A 52 17.806 4.070 -5.545 1.00 0.00 H new ATOM 0 HG21 VAL A 52 20.597 5.262 -6.100 1.00 0.00 H new ATOM 0 HG22 VAL A 52 19.952 4.990 -4.464 1.00 0.00 H new ATOM 0 HG23 VAL A 52 21.512 4.275 -4.935 1.00 0.00 H new ATOM 805 N GLN A 53 21.513 2.631 -3.111 1.00 0.00 N ATOM 806 CA GLN A 53 22.829 2.390 -2.532 1.00 0.00 C ATOM 807 C GLN A 53 22.846 1.085 -1.743 1.00 0.00 C ATOM 808 O GLN A 53 23.543 0.138 -2.106 1.00 0.00 O ATOM 809 CB GLN A 53 23.232 3.554 -1.625 1.00 0.00 C ATOM 810 CG GLN A 53 23.289 4.893 -2.343 1.00 0.00 C ATOM 811 CD GLN A 53 23.819 6.006 -1.461 1.00 0.00 C ATOM 812 OE1 GLN A 53 24.823 5.840 -0.768 1.00 0.00 O ATOM 813 NE2 GLN A 53 23.144 7.150 -1.481 1.00 0.00 N ATOM 0 H GLN A 53 20.990 3.387 -2.670 1.00 0.00 H new ATOM 0 HA GLN A 53 23.547 2.309 -3.348 1.00 0.00 H new ATOM 0 HB2 GLN A 53 22.523 3.623 -0.800 1.00 0.00 H new ATOM 0 HB3 GLN A 53 24.208 3.343 -1.189 1.00 0.00 H new ATOM 0 HG2 GLN A 53 23.922 4.801 -3.225 1.00 0.00 H new ATOM 0 HG3 GLN A 53 22.291 5.156 -2.693 1.00 0.00 H new ATOM 0 HE21 GLN A 53 22.317 7.244 -2.070 1.00 0.00 H new ATOM 0 HE22 GLN A 53 23.453 7.935 -0.907 1.00 0.00 H new ATOM 822 N ASP A 54 22.076 1.044 -0.662 1.00 0.00 N ATOM 823 CA ASP A 54 22.001 -0.145 0.179 1.00 0.00 C ATOM 824 C ASP A 54 21.398 -1.317 -0.588 1.00 0.00 C ATOM 825 O ASP A 54 20.507 -1.136 -1.419 1.00 0.00 O ATOM 826 CB ASP A 54 21.172 0.141 1.432 1.00 0.00 C ATOM 827 CG ASP A 54 21.906 1.024 2.423 1.00 0.00 C ATOM 828 OD1 ASP A 54 23.096 0.755 2.687 1.00 0.00 O ATOM 829 OD2 ASP A 54 21.289 1.982 2.935 1.00 0.00 O ATOM 0 H ASP A 54 21.495 1.821 -0.347 1.00 0.00 H new ATOM 0 HA ASP A 54 23.015 -0.412 0.477 1.00 0.00 H new ATOM 0 HB2 ASP A 54 20.237 0.622 1.144 1.00 0.00 H new ATOM 0 HB3 ASP A 54 20.910 -0.801 1.914 1.00 0.00 H new ATOM 834 N PHE A 55 21.889 -2.519 -0.306 1.00 0.00 N ATOM 835 CA PHE A 55 21.400 -3.721 -0.971 1.00 0.00 C ATOM 836 C PHE A 55 20.262 -4.357 -0.178 1.00 0.00 C ATOM 837 O PHE A 55 19.171 -4.575 -0.703 1.00 0.00 O ATOM 838 CB PHE A 55 22.537 -4.728 -1.152 1.00 0.00 C ATOM 839 CG PHE A 55 23.541 -4.706 -0.034 1.00 0.00 C ATOM 840 CD1 PHE A 55 24.515 -3.722 0.020 1.00 0.00 C ATOM 841 CD2 PHE A 55 23.510 -5.669 0.962 1.00 0.00 C ATOM 842 CE1 PHE A 55 25.440 -3.698 1.047 1.00 0.00 C ATOM 843 CE2 PHE A 55 24.432 -5.649 1.991 1.00 0.00 C ATOM 844 CZ PHE A 55 25.399 -4.664 2.033 1.00 0.00 C ATOM 0 H PHE A 55 22.626 -2.687 0.379 1.00 0.00 H new ATOM 0 HA PHE A 55 21.019 -3.434 -1.951 1.00 0.00 H new ATOM 0 HB2 PHE A 55 22.115 -5.730 -1.231 1.00 0.00 H new ATOM 0 HB3 PHE A 55 23.048 -4.522 -2.093 1.00 0.00 H new ATOM 0 HD1 PHE A 55 24.552 -2.965 -0.749 1.00 0.00 H new ATOM 0 HD2 PHE A 55 22.757 -6.443 0.934 1.00 0.00 H new ATOM 0 HE1 PHE A 55 26.194 -2.925 1.078 1.00 0.00 H new ATOM 0 HE2 PHE A 55 24.396 -6.404 2.763 1.00 0.00 H new ATOM 0 HZ PHE A 55 26.122 -4.649 2.835 1.00 0.00 H new ATOM 854 N ALA A 56 20.527 -4.652 1.091 1.00 0.00 N ATOM 855 CA ALA A 56 19.526 -5.262 1.958 1.00 0.00 C ATOM 856 C ALA A 56 18.126 -4.769 1.610 1.00 0.00 C ATOM 857 O ALA A 56 17.174 -5.551 1.573 1.00 0.00 O ATOM 858 CB ALA A 56 19.844 -4.970 3.417 1.00 0.00 C ATOM 0 H ALA A 56 21.426 -4.479 1.541 1.00 0.00 H new ATOM 0 HA ALA A 56 19.552 -6.340 1.801 1.00 0.00 H new ATOM 0 HB1 ALA A 56 19.089 -5.431 4.053 1.00 0.00 H new ATOM 0 HB2 ALA A 56 20.825 -5.377 3.664 1.00 0.00 H new ATOM 0 HB3 ALA A 56 19.847 -3.892 3.580 1.00 0.00 H new ATOM 864 N CYS A 57 18.006 -3.471 1.357 1.00 0.00 N ATOM 865 CA CYS A 57 16.720 -2.874 1.014 1.00 0.00 C ATOM 866 C CYS A 57 16.096 -3.580 -0.185 1.00 0.00 C ATOM 867 O CYS A 57 15.041 -4.204 -0.070 1.00 0.00 O ATOM 868 CB CYS A 57 16.890 -1.384 0.713 1.00 0.00 C ATOM 869 SG CYS A 57 15.420 -0.389 1.057 1.00 0.00 S ATOM 0 H CYS A 57 18.784 -2.811 1.383 1.00 0.00 H new ATOM 0 HA CYS A 57 16.053 -2.990 1.868 1.00 0.00 H new ATOM 0 HB2 CYS A 57 17.723 -0.998 1.301 1.00 0.00 H new ATOM 0 HB3 CYS A 57 17.159 -1.265 -0.337 1.00 0.00 H new ATOM 0 HG CYS A 57 15.761 0.859 1.187 1.00 0.00 H new ATOM 875 N GLN A 58 16.754 -3.474 -1.335 1.00 0.00 N ATOM 876 CA GLN A 58 16.262 -4.101 -2.557 1.00 0.00 C ATOM 877 C GLN A 58 16.028 -5.593 -2.347 1.00 0.00 C ATOM 878 O GLN A 58 15.122 -6.179 -2.940 1.00 0.00 O ATOM 879 CB GLN A 58 17.252 -3.883 -3.702 1.00 0.00 C ATOM 880 CG GLN A 58 18.382 -4.899 -3.730 1.00 0.00 C ATOM 881 CD GLN A 58 18.053 -6.115 -4.573 1.00 0.00 C ATOM 882 OE1 GLN A 58 18.150 -7.296 -3.974 1.00 0.00 O flip ATOM 883 NE2 GLN A 58 17.715 -5.995 -5.751 1.00 0.00 N flip ATOM 0 H GLN A 58 17.628 -2.961 -1.446 1.00 0.00 H new ATOM 0 HA GLN A 58 15.311 -3.636 -2.816 1.00 0.00 H new ATOM 0 HB2 GLN A 58 16.714 -3.924 -4.649 1.00 0.00 H new ATOM 0 HB3 GLN A 58 17.676 -2.882 -3.619 1.00 0.00 H new ATOM 0 HG2 GLN A 58 19.283 -4.424 -4.120 1.00 0.00 H new ATOM 0 HG3 GLN A 58 18.605 -5.217 -2.712 1.00 0.00 H new ATOM 0 HE21 GLN A 58 17.653 -5.068 -6.172 1.00 0.00 H new ATOM 0 HE22 GLN A 58 17.497 -6.823 -6.306 1.00 0.00 H new ATOM 892 N CYS A 59 16.852 -6.202 -1.501 1.00 0.00 N ATOM 893 CA CYS A 59 16.736 -7.628 -1.214 1.00 0.00 C ATOM 894 C CYS A 59 15.303 -7.992 -0.840 1.00 0.00 C ATOM 895 O CYS A 59 14.796 -9.045 -1.231 1.00 0.00 O ATOM 896 CB CYS A 59 17.687 -8.020 -0.083 1.00 0.00 C ATOM 897 SG CYS A 59 17.892 -9.805 0.123 1.00 0.00 S ATOM 0 H CYS A 59 17.607 -5.731 -1.002 1.00 0.00 H new ATOM 0 HA CYS A 59 17.008 -8.179 -2.114 1.00 0.00 H new ATOM 0 HB2 CYS A 59 18.663 -7.572 -0.271 1.00 0.00 H new ATOM 0 HB3 CYS A 59 17.317 -7.597 0.851 1.00 0.00 H new ATOM 0 HG CYS A 59 18.716 -10.037 1.102 1.00 0.00 H new ATOM 903 N LEU A 60 14.655 -7.117 -0.079 1.00 0.00 N ATOM 904 CA LEU A 60 13.280 -7.347 0.350 1.00 0.00 C ATOM 905 C LEU A 60 12.356 -7.519 -0.851 1.00 0.00 C ATOM 906 O LEU A 60 11.728 -8.563 -1.019 1.00 0.00 O ATOM 907 CB LEU A 60 12.795 -6.185 1.219 1.00 0.00 C ATOM 908 CG LEU A 60 13.654 -5.856 2.441 1.00 0.00 C ATOM 909 CD1 LEU A 60 13.578 -4.372 2.763 1.00 0.00 C ATOM 910 CD2 LEU A 60 13.219 -6.687 3.639 1.00 0.00 C ATOM 0 H LEU A 60 15.060 -6.242 0.254 1.00 0.00 H new ATOM 0 HA LEU A 60 13.257 -8.266 0.936 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.730 -5.294 0.595 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.784 -6.410 1.560 1.00 0.00 H new ATOM 0 HG LEU A 60 14.690 -6.104 2.210 1.00 0.00 H new ATOM 0 HD11 LEU A 60 14.195 -4.157 3.635 1.00 0.00 H new ATOM 0 HD12 LEU A 60 13.940 -3.796 1.911 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.544 -4.098 2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 60 13.841 -6.439 4.499 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.176 -6.472 3.872 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.327 -7.746 3.406 1.00 0.00 H new ATOM 922 N ASN A 61 12.279 -6.486 -1.684 1.00 0.00 N ATOM 923 CA ASN A 61 11.433 -6.524 -2.872 1.00 0.00 C ATOM 924 C ASN A 61 11.613 -7.837 -3.627 1.00 0.00 C ATOM 925 O ASN A 61 10.760 -8.228 -4.424 1.00 0.00 O ATOM 926 CB ASN A 61 11.757 -5.344 -3.791 1.00 0.00 C ATOM 927 CG ASN A 61 11.473 -4.006 -3.138 1.00 0.00 C ATOM 928 OD1 ASN A 61 12.177 -3.590 -2.218 1.00 0.00 O ATOM 929 ND2 ASN A 61 10.435 -3.325 -3.611 1.00 0.00 N ATOM 0 H ASN A 61 12.792 -5.613 -1.559 1.00 0.00 H new ATOM 0 HA ASN A 61 10.394 -6.451 -2.551 1.00 0.00 H new ATOM 0 HB2 ASN A 61 12.807 -5.389 -4.078 1.00 0.00 H new ATOM 0 HB3 ASN A 61 11.172 -5.429 -4.707 1.00 0.00 H new ATOM 0 HD21 ASN A 61 10.194 -2.419 -3.210 1.00 0.00 H new ATOM 0 HD22 ASN A 61 9.879 -3.709 -4.375 1.00 0.00 H new ATOM 936 N ARG A 62 12.729 -8.512 -3.371 1.00 0.00 N ATOM 937 CA ARG A 62 13.021 -9.781 -4.027 1.00 0.00 C ATOM 938 C ARG A 62 11.890 -10.781 -3.807 1.00 0.00 C ATOM 939 O ARG A 62 11.230 -11.206 -4.755 1.00 0.00 O ATOM 940 CB ARG A 62 14.337 -10.359 -3.502 1.00 0.00 C ATOM 941 CG ARG A 62 14.932 -11.432 -4.400 1.00 0.00 C ATOM 942 CD ARG A 62 16.207 -12.011 -3.806 1.00 0.00 C ATOM 943 NE ARG A 62 16.476 -13.359 -4.298 1.00 0.00 N ATOM 944 CZ ARG A 62 17.691 -13.893 -4.350 1.00 0.00 C ATOM 945 NH1 ARG A 62 18.743 -13.197 -3.942 1.00 0.00 N ATOM 946 NH2 ARG A 62 17.856 -15.127 -4.810 1.00 0.00 N ATOM 0 H ARG A 62 13.445 -8.202 -2.715 1.00 0.00 H new ATOM 0 HA ARG A 62 13.114 -9.595 -5.097 1.00 0.00 H new ATOM 0 HB2 ARG A 62 15.059 -9.551 -3.388 1.00 0.00 H new ATOM 0 HB3 ARG A 62 14.170 -10.779 -2.510 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.204 -12.229 -4.548 1.00 0.00 H new ATOM 0 HG3 ARG A 62 15.146 -11.009 -5.382 1.00 0.00 H new ATOM 0 HD2 ARG A 62 17.048 -11.362 -4.049 1.00 0.00 H new ATOM 0 HD3 ARG A 62 16.124 -12.031 -2.719 1.00 0.00 H new ATOM 0 HE ARG A 62 15.688 -13.921 -4.619 1.00 0.00 H new ATOM 0 HH11 ARG A 62 18.621 -12.249 -3.587 1.00 0.00 H new ATOM 0 HH12 ARG A 62 19.675 -13.610 -3.983 1.00 0.00 H new ATOM 0 HH21 ARG A 62 17.049 -15.666 -5.124 1.00 0.00 H new ATOM 0 HH22 ARG A 62 18.790 -15.536 -4.849 1.00 0.00 H new ATOM 960 N ASP A 63 11.672 -11.152 -2.550 1.00 0.00 N ATOM 961 CA ASP A 63 10.620 -12.101 -2.205 1.00 0.00 C ATOM 962 C ASP A 63 9.584 -11.455 -1.290 1.00 0.00 C ATOM 963 O ASP A 63 8.391 -11.745 -1.383 1.00 0.00 O ATOM 964 CB ASP A 63 11.219 -13.334 -1.526 1.00 0.00 C ATOM 965 CG ASP A 63 11.940 -14.240 -2.504 1.00 0.00 C ATOM 966 OD1 ASP A 63 11.390 -14.493 -3.596 1.00 0.00 O ATOM 967 OD2 ASP A 63 13.056 -14.695 -2.178 1.00 0.00 O ATOM 0 H ASP A 63 12.210 -10.810 -1.753 1.00 0.00 H new ATOM 0 HA ASP A 63 10.125 -12.407 -3.126 1.00 0.00 H new ATOM 0 HB2 ASP A 63 11.915 -13.016 -0.749 1.00 0.00 H new ATOM 0 HB3 ASP A 63 10.425 -13.895 -1.033 1.00 0.00 H new ATOM 972 N VAL A 64 10.047 -10.577 -0.406 1.00 0.00 N ATOM 973 CA VAL A 64 9.161 -9.889 0.525 1.00 0.00 C ATOM 974 C VAL A 64 8.016 -9.202 -0.211 1.00 0.00 C ATOM 975 O VAL A 64 6.868 -9.641 -0.141 1.00 0.00 O ATOM 976 CB VAL A 64 9.924 -8.841 1.357 1.00 0.00 C ATOM 977 CG1 VAL A 64 8.967 -8.068 2.250 1.00 0.00 C ATOM 978 CG2 VAL A 64 11.015 -9.508 2.181 1.00 0.00 C ATOM 0 H VAL A 64 11.031 -10.325 -0.315 1.00 0.00 H new ATOM 0 HA VAL A 64 8.756 -10.648 1.194 1.00 0.00 H new ATOM 0 HB VAL A 64 10.396 -8.134 0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 64 9.524 -7.332 2.830 1.00 0.00 H new ATOM 0 HG12 VAL A 64 8.226 -7.559 1.634 1.00 0.00 H new ATOM 0 HG13 VAL A 64 8.464 -8.758 2.927 1.00 0.00 H new ATOM 0 HG21 VAL A 64 11.544 -8.753 2.763 1.00 0.00 H new ATOM 0 HG22 VAL A 64 10.567 -10.238 2.855 1.00 0.00 H new ATOM 0 HG23 VAL A 64 11.717 -10.012 1.516 1.00 0.00 H new ATOM 988 N TRP A 65 8.337 -8.123 -0.915 1.00 0.00 N ATOM 989 CA TRP A 65 7.335 -7.375 -1.666 1.00 0.00 C ATOM 990 C TRP A 65 7.101 -8.001 -3.036 1.00 0.00 C ATOM 991 O TRP A 65 6.558 -7.361 -3.937 1.00 0.00 O ATOM 992 CB TRP A 65 7.770 -5.917 -1.825 1.00 0.00 C ATOM 993 CG TRP A 65 8.338 -5.327 -0.570 1.00 0.00 C ATOM 994 CD1 TRP A 65 9.541 -4.696 -0.432 1.00 0.00 C ATOM 995 CD2 TRP A 65 7.726 -5.314 0.725 1.00 0.00 C ATOM 996 NE1 TRP A 65 9.714 -4.292 0.869 1.00 0.00 N ATOM 997 CE2 TRP A 65 8.615 -4.659 1.599 1.00 0.00 C ATOM 998 CE3 TRP A 65 6.514 -5.791 1.230 1.00 0.00 C ATOM 999 CZ2 TRP A 65 8.328 -4.471 2.949 1.00 0.00 C ATOM 1000 CZ3 TRP A 65 6.230 -5.604 2.569 1.00 0.00 C ATOM 1001 CH2 TRP A 65 7.133 -4.948 3.416 1.00 0.00 C ATOM 0 H TRP A 65 9.283 -7.746 -0.982 1.00 0.00 H new ATOM 0 HA TRP A 65 6.399 -7.409 -1.108 1.00 0.00 H new ATOM 0 HB2 TRP A 65 8.515 -5.852 -2.618 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.914 -5.322 -2.142 1.00 0.00 H new ATOM 0 HD1 TRP A 65 10.252 -4.538 -1.229 1.00 0.00 H new ATOM 0 HE1 TRP A 65 10.529 -3.798 1.233 1.00 0.00 H new ATOM 0 HE3 TRP A 65 5.811 -6.297 0.585 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 9.023 -3.967 3.604 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 5.296 -5.970 2.970 1.00 0.00 H new ATOM 0 HH2 TRP A 65 6.881 -4.816 4.458 1.00 0.00 H new ATOM 1012 N SER A 66 7.514 -9.255 -3.188 1.00 0.00 N ATOM 1013 CA SER A 66 7.353 -9.966 -4.450 1.00 0.00 C ATOM 1014 C SER A 66 6.356 -11.112 -4.305 1.00 0.00 C ATOM 1015 O SER A 66 5.636 -11.446 -5.245 1.00 0.00 O ATOM 1016 CB SER A 66 8.701 -10.506 -4.932 1.00 0.00 C ATOM 1017 OG SER A 66 8.537 -11.365 -6.048 1.00 0.00 O ATOM 0 H SER A 66 7.963 -9.800 -2.452 1.00 0.00 H new ATOM 0 HA SER A 66 6.967 -9.262 -5.188 1.00 0.00 H new ATOM 0 HB2 SER A 66 9.354 -9.676 -5.201 1.00 0.00 H new ATOM 0 HB3 SER A 66 9.190 -11.047 -4.122 1.00 0.00 H new ATOM 0 HG SER A 66 9.414 -11.568 -6.436 1.00 0.00 H new ATOM 1023 N ASN A 67 6.320 -11.710 -3.119 1.00 0.00 N ATOM 1024 CA ASN A 67 5.412 -12.819 -2.849 1.00 0.00 C ATOM 1025 C ASN A 67 3.964 -12.410 -3.100 1.00 0.00 C ATOM 1026 O ASN A 67 3.418 -11.563 -2.394 1.00 0.00 O ATOM 1027 CB ASN A 67 5.576 -13.300 -1.405 1.00 0.00 C ATOM 1028 CG ASN A 67 5.097 -14.726 -1.213 1.00 0.00 C ATOM 1029 OD1 ASN A 67 4.132 -15.159 -1.843 1.00 0.00 O ATOM 1030 ND2 ASN A 67 5.771 -15.463 -0.339 1.00 0.00 N ATOM 0 H ASN A 67 6.909 -11.445 -2.329 1.00 0.00 H new ATOM 0 HA ASN A 67 5.663 -13.635 -3.527 1.00 0.00 H new ATOM 0 HB2 ASN A 67 6.625 -13.230 -1.119 1.00 0.00 H new ATOM 0 HB3 ASN A 67 5.020 -12.640 -0.740 1.00 0.00 H new ATOM 0 HD21 ASN A 67 5.495 -16.430 -0.167 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.565 -15.063 0.161 1.00 0.00 H new ATOM 1037 N GLU A 68 3.349 -13.019 -4.108 1.00 0.00 N ATOM 1038 CA GLU A 68 1.964 -12.717 -4.452 1.00 0.00 C ATOM 1039 C GLU A 68 1.102 -12.615 -3.197 1.00 0.00 C ATOM 1040 O GLU A 68 0.272 -11.715 -3.072 1.00 0.00 O ATOM 1041 CB GLU A 68 1.401 -13.792 -5.384 1.00 0.00 C ATOM 1042 CG GLU A 68 -0.096 -13.672 -5.617 1.00 0.00 C ATOM 1043 CD GLU A 68 -0.515 -14.172 -6.986 1.00 0.00 C ATOM 1044 OE1 GLU A 68 0.110 -15.133 -7.483 1.00 0.00 O ATOM 1045 OE2 GLU A 68 -1.466 -13.604 -7.561 1.00 0.00 O ATOM 0 H GLU A 68 3.787 -13.724 -4.701 1.00 0.00 H new ATOM 0 HA GLU A 68 1.945 -11.755 -4.965 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.915 -13.735 -6.343 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.617 -14.774 -4.964 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.626 -14.237 -4.850 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.395 -12.629 -5.508 1.00 0.00 H new ATOM 1052 N ALA A 69 1.305 -13.545 -2.269 1.00 0.00 N ATOM 1053 CA ALA A 69 0.549 -13.559 -1.023 1.00 0.00 C ATOM 1054 C ALA A 69 0.635 -12.213 -0.313 1.00 0.00 C ATOM 1055 O ALA A 69 -0.350 -11.731 0.247 1.00 0.00 O ATOM 1056 CB ALA A 69 1.051 -14.671 -0.114 1.00 0.00 C ATOM 0 H ALA A 69 1.987 -14.298 -2.357 1.00 0.00 H new ATOM 0 HA ALA A 69 -0.497 -13.746 -1.264 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.478 -14.670 0.813 1.00 0.00 H new ATOM 0 HB2 ALA A 69 0.931 -15.632 -0.614 1.00 0.00 H new ATOM 0 HB3 ALA A 69 2.105 -14.509 0.111 1.00 0.00 H new ATOM 1062 N VAL A 70 1.819 -11.610 -0.339 1.00 0.00 N ATOM 1063 CA VAL A 70 2.034 -10.318 0.302 1.00 0.00 C ATOM 1064 C VAL A 70 1.506 -9.180 -0.565 1.00 0.00 C ATOM 1065 O VAL A 70 0.826 -8.277 -0.077 1.00 0.00 O ATOM 1066 CB VAL A 70 3.527 -10.077 0.593 1.00 0.00 C ATOM 1067 CG1 VAL A 70 3.725 -8.743 1.296 1.00 0.00 C ATOM 1068 CG2 VAL A 70 4.098 -11.216 1.423 1.00 0.00 C ATOM 0 H VAL A 70 2.645 -11.996 -0.797 1.00 0.00 H new ATOM 0 HA VAL A 70 1.487 -10.337 1.244 1.00 0.00 H new ATOM 0 HB VAL A 70 4.064 -10.044 -0.355 1.00 0.00 H new ATOM 0 HG11 VAL A 70 4.786 -8.590 1.494 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.354 -7.938 0.661 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.177 -8.743 2.238 1.00 0.00 H new ATOM 0 HG21 VAL A 70 5.154 -11.029 1.619 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.559 -11.283 2.368 1.00 0.00 H new ATOM 0 HG23 VAL A 70 3.991 -12.153 0.877 1.00 0.00 H new ATOM 1078 N LYS A 71 1.823 -9.229 -1.854 1.00 0.00 N ATOM 1079 CA LYS A 71 1.380 -8.204 -2.791 1.00 0.00 C ATOM 1080 C LYS A 71 -0.139 -8.066 -2.768 1.00 0.00 C ATOM 1081 O LYS A 71 -0.669 -6.965 -2.625 1.00 0.00 O ATOM 1082 CB LYS A 71 1.850 -8.542 -4.208 1.00 0.00 C ATOM 1083 CG LYS A 71 3.289 -8.141 -4.483 1.00 0.00 C ATOM 1084 CD LYS A 71 3.940 -9.061 -5.502 1.00 0.00 C ATOM 1085 CE LYS A 71 3.745 -8.549 -6.921 1.00 0.00 C ATOM 1086 NZ LYS A 71 2.388 -8.868 -7.445 1.00 0.00 N ATOM 0 H LYS A 71 2.386 -9.969 -2.274 1.00 0.00 H new ATOM 0 HA LYS A 71 1.819 -7.254 -2.486 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.743 -9.614 -4.371 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.199 -8.044 -4.926 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.318 -7.114 -4.848 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.858 -8.165 -3.554 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.005 -9.146 -5.288 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.516 -10.061 -5.414 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.898 -7.470 -6.942 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.499 -8.990 -7.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.283 -8.473 -8.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.264 -9.900 -7.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.668 -8.454 -6.819 1.00 0.00 H new ATOM 1100 N ASN A 72 -0.834 -9.190 -2.908 1.00 0.00 N ATOM 1101 CA ASN A 72 -2.292 -9.193 -2.902 1.00 0.00 C ATOM 1102 C ASN A 72 -2.832 -8.548 -1.630 1.00 0.00 C ATOM 1103 O ASN A 72 -3.923 -7.977 -1.626 1.00 0.00 O ATOM 1104 CB ASN A 72 -2.820 -10.624 -3.026 1.00 0.00 C ATOM 1105 CG ASN A 72 -3.035 -11.279 -1.676 1.00 0.00 C ATOM 1106 OD1 ASN A 72 -3.781 -10.771 -0.838 1.00 0.00 O ATOM 1107 ND2 ASN A 72 -2.382 -12.415 -1.458 1.00 0.00 N ATOM 0 H ASN A 72 -0.411 -10.110 -3.027 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.635 -8.611 -3.757 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -3.761 -10.615 -3.576 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.116 -11.219 -3.608 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -2.489 -12.902 -0.568 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -1.774 -12.800 -2.181 1.00 0.00 H new ATOM 1114 N ILE A 73 -2.061 -8.643 -0.552 1.00 0.00 N ATOM 1115 CA ILE A 73 -2.461 -8.068 0.726 1.00 0.00 C ATOM 1116 C ILE A 73 -2.120 -6.583 0.792 1.00 0.00 C ATOM 1117 O ILE A 73 -2.913 -5.774 1.272 1.00 0.00 O ATOM 1118 CB ILE A 73 -1.785 -8.791 1.906 1.00 0.00 C ATOM 1119 CG1 ILE A 73 -2.232 -10.253 1.960 1.00 0.00 C ATOM 1120 CG2 ILE A 73 -2.107 -8.085 3.214 1.00 0.00 C ATOM 1121 CD1 ILE A 73 -1.370 -11.117 2.853 1.00 0.00 C ATOM 0 H ILE A 73 -1.156 -9.113 -0.538 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.541 -8.194 0.804 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.705 -8.766 1.758 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.263 -10.296 2.312 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -2.222 -10.665 0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.622 -8.608 4.039 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.744 -7.058 3.172 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.186 -8.083 3.370 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.746 -12.140 2.842 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.342 -11.104 2.490 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -1.399 -10.730 3.872 1.00 0.00 H new ATOM 1133 N ILE A 74 -0.934 -6.232 0.304 1.00 0.00 N ATOM 1134 CA ILE A 74 -0.489 -4.845 0.304 1.00 0.00 C ATOM 1135 C ILE A 74 -1.255 -4.021 -0.725 1.00 0.00 C ATOM 1136 O ILE A 74 -1.201 -2.791 -0.716 1.00 0.00 O ATOM 1137 CB ILE A 74 1.019 -4.737 0.011 1.00 0.00 C ATOM 1138 CG1 ILE A 74 1.820 -5.529 1.047 1.00 0.00 C ATOM 1139 CG2 ILE A 74 1.454 -3.279 -0.001 1.00 0.00 C ATOM 1140 CD1 ILE A 74 3.281 -5.687 0.689 1.00 0.00 C ATOM 0 H ILE A 74 -0.265 -6.890 -0.096 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.686 -4.451 1.301 1.00 0.00 H new ATOM 0 HB ILE A 74 1.214 -5.162 -0.974 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.743 -5.030 2.013 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.374 -6.517 1.162 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.522 -3.220 -0.209 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.903 -2.741 -0.773 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.248 -2.830 0.971 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.787 -6.258 1.468 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.368 -6.213 -0.262 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.743 -4.703 0.603 1.00 0.00 H new ATOM 1152 N ARG A 75 -1.970 -4.707 -1.611 1.00 0.00 N ATOM 1153 CA ARG A 75 -2.749 -4.039 -2.647 1.00 0.00 C ATOM 1154 C ARG A 75 -4.213 -3.920 -2.234 1.00 0.00 C ATOM 1155 O ARG A 75 -4.830 -2.868 -2.399 1.00 0.00 O ATOM 1156 CB ARG A 75 -2.641 -4.803 -3.968 1.00 0.00 C ATOM 1157 CG ARG A 75 -3.501 -6.056 -4.019 1.00 0.00 C ATOM 1158 CD ARG A 75 -3.443 -6.715 -5.388 1.00 0.00 C ATOM 1159 NE ARG A 75 -4.125 -8.006 -5.403 1.00 0.00 N ATOM 1160 CZ ARG A 75 -5.446 -8.139 -5.427 1.00 0.00 C ATOM 1161 NH1 ARG A 75 -6.224 -7.065 -5.439 1.00 0.00 N ATOM 1162 NH2 ARG A 75 -5.993 -9.348 -5.439 1.00 0.00 N ATOM 0 H ARG A 75 -2.026 -5.725 -1.632 1.00 0.00 H new ATOM 0 HA ARG A 75 -2.344 -3.036 -2.781 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -2.929 -4.142 -4.785 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -1.600 -5.080 -4.134 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -3.164 -6.761 -3.260 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -4.533 -5.800 -3.780 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -3.898 -6.056 -6.127 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -2.402 -6.851 -5.681 1.00 0.00 H new ATOM 0 HE ARG A 75 -3.555 -8.852 -5.395 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -5.808 -6.134 -5.430 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -7.238 -7.170 -5.457 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -5.399 -10.177 -5.430 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -7.008 -9.448 -5.457 1.00 0.00 H new ATOM 1176 N GLU A 76 -4.762 -5.005 -1.698 1.00 0.00 N ATOM 1177 CA GLU A 76 -6.154 -5.021 -1.263 1.00 0.00 C ATOM 1178 C GLU A 76 -6.312 -4.321 0.083 1.00 0.00 C ATOM 1179 O GLU A 76 -6.918 -3.253 0.173 1.00 0.00 O ATOM 1180 CB GLU A 76 -6.664 -6.460 -1.165 1.00 0.00 C ATOM 1181 CG GLU A 76 -8.064 -6.571 -0.584 1.00 0.00 C ATOM 1182 CD GLU A 76 -9.144 -6.507 -1.646 1.00 0.00 C ATOM 1183 OE1 GLU A 76 -8.852 -6.855 -2.810 1.00 0.00 O ATOM 1184 OE2 GLU A 76 -10.280 -6.109 -1.315 1.00 0.00 O ATOM 0 H GLU A 76 -4.265 -5.884 -1.554 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.745 -4.483 -2.004 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -6.655 -6.908 -2.159 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -5.977 -7.039 -0.548 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -8.153 -7.510 -0.037 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -8.219 -5.767 0.136 1.00 0.00 H new ATOM 1191 N HIS A 77 -5.762 -4.930 1.129 1.00 0.00 N ATOM 1192 CA HIS A 77 -5.841 -4.366 2.471 1.00 0.00 C ATOM 1193 C HIS A 77 -5.134 -3.016 2.536 1.00 0.00 C ATOM 1194 O HIS A 77 -5.656 -2.056 3.103 1.00 0.00 O ATOM 1195 CB HIS A 77 -5.225 -5.327 3.488 1.00 0.00 C ATOM 1196 CG HIS A 77 -5.946 -6.636 3.590 1.00 0.00 C ATOM 1197 ND1 HIS A 77 -5.654 -7.850 3.068 1.00 0.00 N flip ATOM 1198 CD2 HIS A 77 -7.120 -6.795 4.295 1.00 0.00 C flip ATOM 1199 CE1 HIS A 77 -6.646 -8.713 3.465 1.00 0.00 C flip ATOM 1200 NE2 HIS A 77 -7.518 -8.052 4.204 1.00 0.00 N flip ATOM 0 H HIS A 77 -5.257 -5.814 1.072 1.00 0.00 H new ATOM 0 HA HIS A 77 -6.893 -4.217 2.714 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -4.186 -5.514 3.215 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -5.216 -4.849 4.468 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -7.634 -6.015 4.837 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -6.703 -9.762 3.214 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -8.356 -8.445 4.632 1.00 0.00 H new ATOM 1209 N PHE A 78 -3.942 -2.949 1.952 1.00 0.00 N ATOM 1210 CA PHE A 78 -3.162 -1.717 1.945 1.00 0.00 C ATOM 1211 C PHE A 78 -2.949 -1.216 0.519 1.00 0.00 C ATOM 1212 O PHE A 78 -3.390 -1.846 -0.443 1.00 0.00 O ATOM 1213 CB PHE A 78 -1.809 -1.941 2.625 1.00 0.00 C ATOM 1214 CG PHE A 78 -1.917 -2.608 3.966 1.00 0.00 C ATOM 1215 CD1 PHE A 78 -2.282 -3.941 4.064 1.00 0.00 C ATOM 1216 CD2 PHE A 78 -1.652 -1.903 5.129 1.00 0.00 C ATOM 1217 CE1 PHE A 78 -2.381 -4.559 5.297 1.00 0.00 C ATOM 1218 CE2 PHE A 78 -1.749 -2.515 6.365 1.00 0.00 C ATOM 1219 CZ PHE A 78 -2.115 -3.845 6.449 1.00 0.00 C ATOM 0 H PHE A 78 -3.495 -3.734 1.477 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.719 -0.961 2.498 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.181 -2.550 1.975 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.308 -0.980 2.745 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.492 -4.504 3.167 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -1.366 -0.863 5.069 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -2.666 -5.599 5.359 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.539 -1.954 7.264 1.00 0.00 H new ATOM 0 HZ PHE A 78 -2.193 -4.325 7.413 1.00 0.00 H new ATOM 1229 N ILE A 79 -2.272 -0.080 0.392 1.00 0.00 N ATOM 1230 CA ILE A 79 -2.001 0.505 -0.915 1.00 0.00 C ATOM 1231 C ILE A 79 -0.509 0.483 -1.228 1.00 0.00 C ATOM 1232 O ILE A 79 0.266 1.258 -0.667 1.00 0.00 O ATOM 1233 CB ILE A 79 -2.510 1.956 -0.998 1.00 0.00 C ATOM 1234 CG1 ILE A 79 -4.021 2.004 -0.760 1.00 0.00 C ATOM 1235 CG2 ILE A 79 -2.163 2.563 -2.350 1.00 0.00 C ATOM 1236 CD1 ILE A 79 -4.827 1.336 -1.852 1.00 0.00 C ATOM 0 H ILE A 79 -1.901 0.454 1.178 1.00 0.00 H new ATOM 0 HA ILE A 79 -2.533 -0.101 -1.649 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.019 2.542 -0.221 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.246 1.523 0.192 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -4.334 3.045 -0.674 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -2.529 3.589 -2.393 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.081 2.558 -2.484 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -2.629 1.977 -3.142 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.889 1.408 -1.617 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.632 1.831 -2.803 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.542 0.286 -1.924 1.00 0.00 H new ATOM 1248 N PHE A 80 -0.112 -0.409 -2.129 1.00 0.00 N ATOM 1249 CA PHE A 80 1.288 -0.532 -2.519 1.00 0.00 C ATOM 1250 C PHE A 80 1.766 0.729 -3.232 1.00 0.00 C ATOM 1251 O PHE A 80 1.420 0.970 -4.388 1.00 0.00 O ATOM 1252 CB PHE A 80 1.482 -1.749 -3.426 1.00 0.00 C ATOM 1253 CG PHE A 80 2.923 -2.065 -3.705 1.00 0.00 C ATOM 1254 CD1 PHE A 80 3.833 -2.187 -2.667 1.00 0.00 C ATOM 1255 CD2 PHE A 80 3.369 -2.241 -5.005 1.00 0.00 C ATOM 1256 CE1 PHE A 80 5.160 -2.477 -2.921 1.00 0.00 C ATOM 1257 CE2 PHE A 80 4.695 -2.531 -5.265 1.00 0.00 C ATOM 1258 CZ PHE A 80 5.591 -2.650 -4.221 1.00 0.00 C ATOM 0 H PHE A 80 -0.740 -1.058 -2.603 1.00 0.00 H new ATOM 0 HA PHE A 80 1.881 -0.664 -1.614 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.011 -2.616 -2.963 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.967 -1.574 -4.371 1.00 0.00 H new ATOM 0 HD1 PHE A 80 3.501 -2.054 -1.648 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.672 -2.150 -5.825 1.00 0.00 H new ATOM 0 HE1 PHE A 80 5.859 -2.568 -2.103 1.00 0.00 H new ATOM 0 HE2 PHE A 80 5.030 -2.664 -6.283 1.00 0.00 H new ATOM 0 HZ PHE A 80 6.627 -2.878 -4.421 1.00 0.00 H new ATOM 1268 N TRP A 81 2.564 1.529 -2.534 1.00 0.00 N ATOM 1269 CA TRP A 81 3.090 2.766 -3.099 1.00 0.00 C ATOM 1270 C TRP A 81 4.525 3.006 -2.643 1.00 0.00 C ATOM 1271 O TRP A 81 4.768 3.359 -1.489 1.00 0.00 O ATOM 1272 CB TRP A 81 2.210 3.950 -2.697 1.00 0.00 C ATOM 1273 CG TRP A 81 2.472 5.186 -3.503 1.00 0.00 C ATOM 1274 CD1 TRP A 81 1.779 5.611 -4.601 1.00 0.00 C ATOM 1275 CD2 TRP A 81 3.501 6.155 -3.275 1.00 0.00 C ATOM 1276 NE1 TRP A 81 2.316 6.786 -5.069 1.00 0.00 N ATOM 1277 CE2 TRP A 81 3.372 7.142 -4.273 1.00 0.00 C ATOM 1278 CE3 TRP A 81 4.517 6.288 -2.325 1.00 0.00 C ATOM 1279 CZ2 TRP A 81 4.222 8.242 -4.346 1.00 0.00 C ATOM 1280 CZ3 TRP A 81 5.360 7.380 -2.399 1.00 0.00 C ATOM 1281 CH2 TRP A 81 5.208 8.346 -3.402 1.00 0.00 C ATOM 0 H TRP A 81 2.861 1.343 -1.576 1.00 0.00 H new ATOM 0 HA TRP A 81 3.084 2.671 -4.185 1.00 0.00 H new ATOM 0 HB2 TRP A 81 1.163 3.669 -2.807 1.00 0.00 H new ATOM 0 HB3 TRP A 81 2.372 4.172 -1.642 1.00 0.00 H new ATOM 0 HD1 TRP A 81 0.934 5.099 -5.037 1.00 0.00 H new ATOM 0 HE1 TRP A 81 1.982 7.309 -5.879 1.00 0.00 H new ATOM 0 HE3 TRP A 81 4.641 5.550 -1.546 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 4.108 8.987 -5.120 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 6.150 7.491 -1.671 1.00 0.00 H new ATOM 0 HH2 TRP A 81 5.882 9.189 -3.431 1.00 0.00 H new ATOM 1292 N GLN A 82 5.472 2.812 -3.556 1.00 0.00 N ATOM 1293 CA GLN A 82 6.883 3.007 -3.245 1.00 0.00 C ATOM 1294 C GLN A 82 7.558 3.878 -4.300 1.00 0.00 C ATOM 1295 O GLN A 82 7.097 3.959 -5.439 1.00 0.00 O ATOM 1296 CB GLN A 82 7.597 1.658 -3.147 1.00 0.00 C ATOM 1297 CG GLN A 82 7.906 1.034 -4.499 1.00 0.00 C ATOM 1298 CD GLN A 82 6.749 0.217 -5.042 1.00 0.00 C ATOM 1299 OE1 GLN A 82 5.704 0.097 -4.402 1.00 0.00 O ATOM 1300 NE2 GLN A 82 6.931 -0.351 -6.228 1.00 0.00 N ATOM 0 H GLN A 82 5.288 2.520 -4.516 1.00 0.00 H new ATOM 0 HA GLN A 82 6.950 3.516 -2.283 1.00 0.00 H new ATOM 0 HB2 GLN A 82 8.528 1.788 -2.595 1.00 0.00 H new ATOM 0 HB3 GLN A 82 6.978 0.970 -2.571 1.00 0.00 H new ATOM 0 HG2 GLN A 82 8.155 1.822 -5.210 1.00 0.00 H new ATOM 0 HG3 GLN A 82 8.785 0.396 -4.408 1.00 0.00 H new ATOM 0 HE21 GLN A 82 7.814 -0.225 -6.724 1.00 0.00 H new ATOM 0 HE22 GLN A 82 6.188 -0.913 -6.644 1.00 0.00 H new ATOM 1309 N VAL A 83 8.651 4.527 -3.914 1.00 0.00 N ATOM 1310 CA VAL A 83 9.390 5.391 -4.827 1.00 0.00 C ATOM 1311 C VAL A 83 10.864 5.461 -4.446 1.00 0.00 C ATOM 1312 O VAL A 83 11.208 5.543 -3.266 1.00 0.00 O ATOM 1313 CB VAL A 83 8.807 6.817 -4.845 1.00 0.00 C ATOM 1314 CG1 VAL A 83 7.429 6.822 -5.488 1.00 0.00 C ATOM 1315 CG2 VAL A 83 8.750 7.386 -3.436 1.00 0.00 C ATOM 0 H VAL A 83 9.045 4.471 -2.975 1.00 0.00 H new ATOM 0 HA VAL A 83 9.296 4.955 -5.822 1.00 0.00 H new ATOM 0 HB VAL A 83 9.462 7.452 -5.442 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.033 7.838 -5.492 1.00 0.00 H new ATOM 0 HG12 VAL A 83 7.504 6.458 -6.513 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.761 6.174 -4.921 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.336 8.394 -3.467 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.118 6.753 -2.813 1.00 0.00 H new ATOM 0 HG23 VAL A 83 9.755 7.420 -3.016 1.00 0.00 H new ATOM 1325 N TYR A 84 11.732 5.429 -5.451 1.00 0.00 N ATOM 1326 CA TYR A 84 13.171 5.487 -5.221 1.00 0.00 C ATOM 1327 C TYR A 84 13.569 6.819 -4.595 1.00 0.00 C ATOM 1328 O TYR A 84 13.199 7.886 -5.087 1.00 0.00 O ATOM 1329 CB TYR A 84 13.927 5.282 -6.535 1.00 0.00 C ATOM 1330 CG TYR A 84 14.196 3.829 -6.858 1.00 0.00 C ATOM 1331 CD1 TYR A 84 15.290 3.168 -6.314 1.00 0.00 C ATOM 1332 CD2 TYR A 84 13.357 3.119 -7.708 1.00 0.00 C ATOM 1333 CE1 TYR A 84 15.541 1.841 -6.607 1.00 0.00 C ATOM 1334 CE2 TYR A 84 13.599 1.792 -8.006 1.00 0.00 C ATOM 1335 CZ TYR A 84 14.692 1.157 -7.453 1.00 0.00 C ATOM 1336 OH TYR A 84 14.937 -0.164 -7.748 1.00 0.00 O ATOM 0 H TYR A 84 11.464 5.363 -6.433 1.00 0.00 H new ATOM 0 HA TYR A 84 13.435 4.688 -4.529 1.00 0.00 H new ATOM 0 HB2 TYR A 84 13.353 5.726 -7.348 1.00 0.00 H new ATOM 0 HB3 TYR A 84 14.876 5.816 -6.486 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.956 3.700 -5.651 1.00 0.00 H new ATOM 0 HD2 TYR A 84 12.501 3.613 -8.143 1.00 0.00 H new ATOM 0 HE1 TYR A 84 16.397 1.342 -6.176 1.00 0.00 H new ATOM 0 HE2 TYR A 84 12.936 1.255 -8.668 1.00 0.00 H new ATOM 0 HH TYR A 84 14.245 -0.497 -8.357 1.00 0.00 H new ATOM 1346 N HIS A 85 14.327 6.750 -3.505 1.00 0.00 N ATOM 1347 CA HIS A 85 14.778 7.951 -2.810 1.00 0.00 C ATOM 1348 C HIS A 85 15.267 9.002 -3.803 1.00 0.00 C ATOM 1349 O HIS A 85 14.930 10.181 -3.690 1.00 0.00 O ATOM 1350 CB HIS A 85 15.894 7.606 -1.824 1.00 0.00 C ATOM 1351 CG HIS A 85 17.255 7.569 -2.448 1.00 0.00 C ATOM 1352 ND1 HIS A 85 18.175 8.587 -2.309 1.00 0.00 N ATOM 1353 CD2 HIS A 85 17.851 6.629 -3.218 1.00 0.00 C ATOM 1354 CE1 HIS A 85 19.277 8.274 -2.967 1.00 0.00 C ATOM 1355 NE2 HIS A 85 19.107 7.091 -3.527 1.00 0.00 N ATOM 0 H HIS A 85 14.642 5.876 -3.084 1.00 0.00 H new ATOM 0 HA HIS A 85 13.932 8.362 -2.260 1.00 0.00 H new ATOM 0 HB2 HIS A 85 15.893 8.338 -1.017 1.00 0.00 H new ATOM 0 HB3 HIS A 85 15.683 6.636 -1.374 1.00 0.00 H new ATOM 0 HD1 HIS A 85 18.028 9.447 -1.781 1.00 0.00 H new ATOM 0 HD2 HIS A 85 17.419 5.690 -3.531 1.00 0.00 H new ATOM 0 HE1 HIS A 85 20.166 8.883 -3.035 1.00 0.00 H new ATOM 1364 N ASP A 86 16.062 8.567 -4.773 1.00 0.00 N ATOM 1365 CA ASP A 86 16.597 9.470 -5.786 1.00 0.00 C ATOM 1366 C ASP A 86 15.477 10.255 -6.461 1.00 0.00 C ATOM 1367 O ASP A 86 15.563 11.473 -6.613 1.00 0.00 O ATOM 1368 CB ASP A 86 17.389 8.685 -6.833 1.00 0.00 C ATOM 1369 CG ASP A 86 18.235 9.583 -7.713 1.00 0.00 C ATOM 1370 OD1 ASP A 86 18.893 10.496 -7.172 1.00 0.00 O ATOM 1371 OD2 ASP A 86 18.239 9.373 -8.944 1.00 0.00 O ATOM 0 H ASP A 86 16.351 7.595 -4.880 1.00 0.00 H new ATOM 0 HA ASP A 86 17.264 10.176 -5.291 1.00 0.00 H new ATOM 0 HB2 ASP A 86 18.033 7.963 -6.331 1.00 0.00 H new ATOM 0 HB3 ASP A 86 16.698 8.117 -7.456 1.00 0.00 H new ATOM 1376 N SER A 87 14.426 9.548 -6.864 1.00 0.00 N ATOM 1377 CA SER A 87 13.290 10.177 -7.527 1.00 0.00 C ATOM 1378 C SER A 87 12.755 11.342 -6.699 1.00 0.00 C ATOM 1379 O SER A 87 12.917 11.376 -5.480 1.00 0.00 O ATOM 1380 CB SER A 87 12.179 9.153 -7.765 1.00 0.00 C ATOM 1381 OG SER A 87 11.438 8.919 -6.580 1.00 0.00 O ATOM 0 H SER A 87 14.338 8.539 -6.743 1.00 0.00 H new ATOM 0 HA SER A 87 13.630 10.562 -8.488 1.00 0.00 H new ATOM 0 HB2 SER A 87 11.512 9.511 -8.550 1.00 0.00 H new ATOM 0 HB3 SER A 87 12.612 8.217 -8.117 1.00 0.00 H new ATOM 0 HG SER A 87 11.870 8.210 -6.059 1.00 0.00 H new ATOM 1387 N GLU A 88 12.116 12.294 -7.372 1.00 0.00 N ATOM 1388 CA GLU A 88 11.557 13.460 -6.699 1.00 0.00 C ATOM 1389 C GLU A 88 10.603 13.040 -5.585 1.00 0.00 C ATOM 1390 O GLU A 88 10.639 13.589 -4.484 1.00 0.00 O ATOM 1391 CB GLU A 88 10.825 14.354 -7.702 1.00 0.00 C ATOM 1392 CG GLU A 88 9.704 13.645 -8.443 1.00 0.00 C ATOM 1393 CD GLU A 88 8.867 14.594 -9.280 1.00 0.00 C ATOM 1394 OE1 GLU A 88 8.519 15.681 -8.773 1.00 0.00 O ATOM 1395 OE2 GLU A 88 8.559 14.249 -10.440 1.00 0.00 O ATOM 0 H GLU A 88 11.973 12.280 -8.382 1.00 0.00 H new ATOM 0 HA GLU A 88 12.380 14.021 -6.257 1.00 0.00 H new ATOM 0 HB2 GLU A 88 10.414 15.215 -7.176 1.00 0.00 H new ATOM 0 HB3 GLU A 88 11.543 14.737 -8.427 1.00 0.00 H new ATOM 0 HG2 GLU A 88 10.129 12.876 -9.088 1.00 0.00 H new ATOM 0 HG3 GLU A 88 9.061 13.138 -7.723 1.00 0.00 H new ATOM 1402 N GLU A 89 9.751 12.064 -5.880 1.00 0.00 N ATOM 1403 CA GLU A 89 8.786 11.571 -4.904 1.00 0.00 C ATOM 1404 C GLU A 89 9.489 11.103 -3.633 1.00 0.00 C ATOM 1405 O GLU A 89 9.120 11.494 -2.526 1.00 0.00 O ATOM 1406 CB GLU A 89 7.965 10.425 -5.498 1.00 0.00 C ATOM 1407 CG GLU A 89 7.104 10.841 -6.678 1.00 0.00 C ATOM 1408 CD GLU A 89 6.184 12.001 -6.349 1.00 0.00 C ATOM 1409 OE1 GLU A 89 5.153 11.771 -5.682 1.00 0.00 O ATOM 1410 OE2 GLU A 89 6.495 13.139 -6.758 1.00 0.00 O ATOM 0 H GLU A 89 9.709 11.599 -6.787 1.00 0.00 H new ATOM 0 HA GLU A 89 8.116 12.392 -4.647 1.00 0.00 H new ATOM 0 HB2 GLU A 89 8.641 9.631 -5.815 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.325 10.007 -4.721 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.748 11.118 -7.513 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.507 9.990 -7.005 1.00 0.00 H new ATOM 1417 N GLY A 90 10.504 10.261 -3.801 1.00 0.00 N ATOM 1418 CA GLY A 90 11.242 9.752 -2.660 1.00 0.00 C ATOM 1419 C GLY A 90 11.839 10.859 -1.814 1.00 0.00 C ATOM 1420 O GLY A 90 11.670 10.876 -0.595 1.00 0.00 O ATOM 0 H GLY A 90 10.828 9.922 -4.707 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.579 9.146 -2.043 1.00 0.00 H new ATOM 0 HA3 GLY A 90 12.039 9.097 -3.010 1.00 0.00 H new ATOM 1424 N GLN A 91 12.538 11.785 -2.462 1.00 0.00 N ATOM 1425 CA GLN A 91 13.164 12.899 -1.760 1.00 0.00 C ATOM 1426 C GLN A 91 12.186 13.546 -0.785 1.00 0.00 C ATOM 1427 O GLN A 91 12.516 13.779 0.378 1.00 0.00 O ATOM 1428 CB GLN A 91 13.669 13.941 -2.761 1.00 0.00 C ATOM 1429 CG GLN A 91 14.790 13.433 -3.653 1.00 0.00 C ATOM 1430 CD GLN A 91 16.140 13.458 -2.965 1.00 0.00 C ATOM 1431 OE1 GLN A 91 16.413 14.330 -2.139 1.00 0.00 O ATOM 1432 NE2 GLN A 91 16.994 12.499 -3.302 1.00 0.00 N ATOM 0 H GLN A 91 12.685 11.786 -3.471 1.00 0.00 H new ATOM 0 HA GLN A 91 14.010 12.510 -1.193 1.00 0.00 H new ATOM 0 HB2 GLN A 91 12.837 14.266 -3.386 1.00 0.00 H new ATOM 0 HB3 GLN A 91 14.019 14.817 -2.215 1.00 0.00 H new ATOM 0 HG2 GLN A 91 14.565 12.414 -3.967 1.00 0.00 H new ATOM 0 HG3 GLN A 91 14.835 14.042 -4.556 1.00 0.00 H new ATOM 0 HE21 GLN A 91 16.726 11.796 -3.991 1.00 0.00 H new ATOM 0 HE22 GLN A 91 17.918 12.465 -2.872 1.00 0.00 H new ATOM 1441 N ARG A 92 10.981 13.834 -1.267 1.00 0.00 N ATOM 1442 CA ARG A 92 9.955 14.456 -0.438 1.00 0.00 C ATOM 1443 C ARG A 92 9.655 13.599 0.789 1.00 0.00 C ATOM 1444 O ARG A 92 9.835 14.039 1.925 1.00 0.00 O ATOM 1445 CB ARG A 92 8.676 14.672 -1.248 1.00 0.00 C ATOM 1446 CG ARG A 92 8.804 15.749 -2.313 1.00 0.00 C ATOM 1447 CD ARG A 92 7.442 16.278 -2.737 1.00 0.00 C ATOM 1448 NE ARG A 92 7.544 17.561 -3.426 1.00 0.00 N ATOM 1449 CZ ARG A 92 6.576 18.470 -3.434 1.00 0.00 C ATOM 1450 NH1 ARG A 92 5.439 18.237 -2.793 1.00 0.00 N ATOM 1451 NH2 ARG A 92 6.743 19.615 -4.084 1.00 0.00 N ATOM 0 H ARG A 92 10.691 13.647 -2.227 1.00 0.00 H new ATOM 0 HA ARG A 92 10.331 15.422 -0.102 1.00 0.00 H new ATOM 0 HB2 ARG A 92 8.395 13.733 -1.725 1.00 0.00 H new ATOM 0 HB3 ARG A 92 7.867 14.939 -0.569 1.00 0.00 H new ATOM 0 HG2 ARG A 92 9.411 16.570 -1.931 1.00 0.00 H new ATOM 0 HG3 ARG A 92 9.325 15.344 -3.181 1.00 0.00 H new ATOM 0 HD2 ARG A 92 6.959 15.552 -3.391 1.00 0.00 H new ATOM 0 HD3 ARG A 92 6.806 16.388 -1.859 1.00 0.00 H new ATOM 0 HE ARG A 92 8.406 17.771 -3.929 1.00 0.00 H new ATOM 0 HH11 ARG A 92 5.307 17.358 -2.292 1.00 0.00 H new ATOM 0 HH12 ARG A 92 4.697 18.937 -2.800 1.00 0.00 H new ATOM 0 HH21 ARG A 92 7.616 19.798 -4.579 1.00 0.00 H new ATOM 0 HH22 ARG A 92 5.998 20.312 -4.089 1.00 0.00 H new ATOM 1465 N TYR A 93 9.196 12.376 0.551 1.00 0.00 N ATOM 1466 CA TYR A 93 8.867 11.459 1.636 1.00 0.00 C ATOM 1467 C TYR A 93 9.907 11.538 2.750 1.00 0.00 C ATOM 1468 O TYR A 93 9.564 11.594 3.931 1.00 0.00 O ATOM 1469 CB TYR A 93 8.775 10.025 1.110 1.00 0.00 C ATOM 1470 CG TYR A 93 8.060 9.080 2.049 1.00 0.00 C ATOM 1471 CD1 TYR A 93 6.676 9.108 2.173 1.00 0.00 C ATOM 1472 CD2 TYR A 93 8.768 8.160 2.812 1.00 0.00 C ATOM 1473 CE1 TYR A 93 6.019 8.247 3.031 1.00 0.00 C ATOM 1474 CE2 TYR A 93 8.119 7.294 3.671 1.00 0.00 C ATOM 1475 CZ TYR A 93 6.745 7.342 3.777 1.00 0.00 C ATOM 1476 OH TYR A 93 6.094 6.481 4.631 1.00 0.00 O ATOM 0 H TYR A 93 9.043 11.996 -0.383 1.00 0.00 H new ATOM 0 HA TYR A 93 7.900 11.752 2.045 1.00 0.00 H new ATOM 0 HB2 TYR A 93 8.257 10.031 0.151 1.00 0.00 H new ATOM 0 HB3 TYR A 93 9.782 9.649 0.927 1.00 0.00 H new ATOM 0 HD1 TYR A 93 6.105 9.814 1.589 1.00 0.00 H new ATOM 0 HD2 TYR A 93 9.844 8.121 2.732 1.00 0.00 H new ATOM 0 HE1 TYR A 93 4.943 8.282 3.117 1.00 0.00 H new ATOM 0 HE2 TYR A 93 8.684 6.584 4.256 1.00 0.00 H new ATOM 0 HH TYR A 93 6.750 5.908 5.081 1.00 0.00 H new ATOM 1486 N ILE A 94 11.178 11.541 2.364 1.00 0.00 N ATOM 1487 CA ILE A 94 12.269 11.615 3.328 1.00 0.00 C ATOM 1488 C ILE A 94 12.012 12.702 4.366 1.00 0.00 C ATOM 1489 O ILE A 94 11.882 12.418 5.557 1.00 0.00 O ATOM 1490 CB ILE A 94 13.616 11.891 2.635 1.00 0.00 C ATOM 1491 CG1 ILE A 94 13.964 10.751 1.675 1.00 0.00 C ATOM 1492 CG2 ILE A 94 14.716 12.074 3.669 1.00 0.00 C ATOM 1493 CD1 ILE A 94 15.166 11.040 0.804 1.00 0.00 C ATOM 0 H ILE A 94 11.478 11.493 1.390 1.00 0.00 H new ATOM 0 HA ILE A 94 12.318 10.646 3.824 1.00 0.00 H new ATOM 0 HB ILE A 94 13.529 12.812 2.059 1.00 0.00 H new ATOM 0 HG12 ILE A 94 14.153 9.846 2.252 1.00 0.00 H new ATOM 0 HG13 ILE A 94 13.104 10.549 1.037 1.00 0.00 H new ATOM 0 HG21 ILE A 94 15.662 12.268 3.163 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.471 12.916 4.316 1.00 0.00 H new ATOM 0 HG23 ILE A 94 14.805 11.169 4.270 1.00 0.00 H new ATOM 0 HD11 ILE A 94 15.354 10.189 0.149 1.00 0.00 H new ATOM 0 HD12 ILE A 94 14.973 11.927 0.200 1.00 0.00 H new ATOM 0 HD13 ILE A 94 16.039 11.213 1.434 1.00 0.00 H new ATOM 1505 N GLN A 95 11.938 13.947 3.906 1.00 0.00 N ATOM 1506 CA GLN A 95 11.696 15.076 4.795 1.00 0.00 C ATOM 1507 C GLN A 95 10.513 14.799 5.717 1.00 0.00 C ATOM 1508 O GLN A 95 10.558 15.102 6.910 1.00 0.00 O ATOM 1509 CB GLN A 95 11.437 16.346 3.982 1.00 0.00 C ATOM 1510 CG GLN A 95 12.659 16.846 3.229 1.00 0.00 C ATOM 1511 CD GLN A 95 12.511 18.280 2.761 1.00 0.00 C ATOM 1512 OE1 GLN A 95 12.236 19.179 3.556 1.00 0.00 O ATOM 1513 NE2 GLN A 95 12.691 18.501 1.464 1.00 0.00 N ATOM 0 H GLN A 95 12.042 14.199 2.923 1.00 0.00 H new ATOM 0 HA GLN A 95 12.586 15.220 5.408 1.00 0.00 H new ATOM 0 HB2 GLN A 95 10.635 16.154 3.269 1.00 0.00 H new ATOM 0 HB3 GLN A 95 11.087 17.131 4.652 1.00 0.00 H new ATOM 0 HG2 GLN A 95 13.535 16.767 3.873 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.838 16.203 2.367 1.00 0.00 H new ATOM 0 HE21 GLN A 95 12.918 17.726 0.841 1.00 0.00 H new ATOM 0 HE22 GLN A 95 12.603 19.446 1.091 1.00 0.00 H new ATOM 1522 N PHE A 96 9.455 14.222 5.157 1.00 0.00 N ATOM 1523 CA PHE A 96 8.259 13.905 5.929 1.00 0.00 C ATOM 1524 C PHE A 96 8.628 13.387 7.316 1.00 0.00 C ATOM 1525 O PHE A 96 8.268 13.985 8.330 1.00 0.00 O ATOM 1526 CB PHE A 96 7.412 12.865 5.192 1.00 0.00 C ATOM 1527 CG PHE A 96 5.998 12.782 5.691 1.00 0.00 C ATOM 1528 CD1 PHE A 96 5.734 12.503 7.022 1.00 0.00 C ATOM 1529 CD2 PHE A 96 4.932 12.982 4.828 1.00 0.00 C ATOM 1530 CE1 PHE A 96 4.433 12.426 7.485 1.00 0.00 C ATOM 1531 CE2 PHE A 96 3.630 12.907 5.285 1.00 0.00 C ATOM 1532 CZ PHE A 96 3.380 12.627 6.614 1.00 0.00 C ATOM 0 H PHE A 96 9.401 13.964 4.172 1.00 0.00 H new ATOM 0 HA PHE A 96 7.679 14.820 6.045 1.00 0.00 H new ATOM 0 HB2 PHE A 96 7.400 13.105 4.129 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.883 11.887 5.293 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.554 12.344 7.706 1.00 0.00 H new ATOM 0 HD2 PHE A 96 5.121 13.199 3.787 1.00 0.00 H new ATOM 0 HE1 PHE A 96 4.241 12.209 8.525 1.00 0.00 H new ATOM 0 HE2 PHE A 96 2.808 13.067 4.603 1.00 0.00 H new ATOM 0 HZ PHE A 96 2.363 12.565 6.972 1.00 0.00 H new ATOM 1542 N TYR A 97 9.347 12.271 7.351 1.00 0.00 N ATOM 1543 CA TYR A 97 9.763 11.670 8.613 1.00 0.00 C ATOM 1544 C TYR A 97 11.273 11.784 8.800 1.00 0.00 C ATOM 1545 O TYR A 97 11.858 11.118 9.654 1.00 0.00 O ATOM 1546 CB TYR A 97 9.341 10.200 8.665 1.00 0.00 C ATOM 1547 CG TYR A 97 8.004 9.931 8.014 1.00 0.00 C ATOM 1548 CD1 TYR A 97 7.894 9.798 6.636 1.00 0.00 C ATOM 1549 CD2 TYR A 97 6.849 9.810 8.778 1.00 0.00 C ATOM 1550 CE1 TYR A 97 6.674 9.552 6.036 1.00 0.00 C ATOM 1551 CE2 TYR A 97 5.625 9.563 8.187 1.00 0.00 C ATOM 1552 CZ TYR A 97 5.543 9.435 6.816 1.00 0.00 C ATOM 1553 OH TYR A 97 4.325 9.190 6.224 1.00 0.00 O ATOM 0 H TYR A 97 9.654 11.764 6.521 1.00 0.00 H new ATOM 0 HA TYR A 97 9.273 12.211 9.423 1.00 0.00 H new ATOM 0 HB2 TYR A 97 10.103 9.594 8.174 1.00 0.00 H new ATOM 0 HB3 TYR A 97 9.300 9.879 9.706 1.00 0.00 H new ATOM 0 HD1 TYR A 97 8.778 9.888 6.022 1.00 0.00 H new ATOM 0 HD2 TYR A 97 6.910 9.911 9.852 1.00 0.00 H new ATOM 0 HE1 TYR A 97 6.607 9.452 4.963 1.00 0.00 H new ATOM 0 HE2 TYR A 97 4.737 9.471 8.795 1.00 0.00 H new ATOM 0 HH TYR A 97 3.805 10.020 6.191 1.00 0.00 H new ATOM 1563 N LYS A 98 11.899 12.635 7.994 1.00 0.00 N ATOM 1564 CA LYS A 98 13.341 12.840 8.069 1.00 0.00 C ATOM 1565 C LYS A 98 14.087 11.516 7.942 1.00 0.00 C ATOM 1566 O LYS A 98 15.036 11.253 8.682 1.00 0.00 O ATOM 1567 CB LYS A 98 13.712 13.523 9.387 1.00 0.00 C ATOM 1568 CG LYS A 98 13.162 14.933 9.518 1.00 0.00 C ATOM 1569 CD LYS A 98 13.832 15.885 8.541 1.00 0.00 C ATOM 1570 CE LYS A 98 13.636 17.336 8.954 1.00 0.00 C ATOM 1571 NZ LYS A 98 14.655 17.773 9.947 1.00 0.00 N ATOM 0 H LYS A 98 11.430 13.194 7.281 1.00 0.00 H new ATOM 0 HA LYS A 98 13.635 13.482 7.239 1.00 0.00 H new ATOM 0 HB2 LYS A 98 13.342 12.919 10.216 1.00 0.00 H new ATOM 0 HB3 LYS A 98 14.798 13.556 9.476 1.00 0.00 H new ATOM 0 HG2 LYS A 98 12.087 14.923 9.339 1.00 0.00 H new ATOM 0 HG3 LYS A 98 13.312 15.290 10.537 1.00 0.00 H new ATOM 0 HD2 LYS A 98 14.898 15.662 8.486 1.00 0.00 H new ATOM 0 HD3 LYS A 98 13.423 15.731 7.543 1.00 0.00 H new ATOM 0 HE2 LYS A 98 13.691 17.975 8.073 1.00 0.00 H new ATOM 0 HE3 LYS A 98 12.639 17.462 9.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 14.487 18.767 10.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 14.586 17.180 10.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 15.605 17.678 9.535 1.00 0.00 H new ATOM 1585 N LEU A 99 13.653 10.685 7.001 1.00 0.00 N ATOM 1586 CA LEU A 99 14.281 9.388 6.776 1.00 0.00 C ATOM 1587 C LEU A 99 15.789 9.536 6.599 1.00 0.00 C ATOM 1588 O LEU A 99 16.278 10.598 6.216 1.00 0.00 O ATOM 1589 CB LEU A 99 13.675 8.712 5.544 1.00 0.00 C ATOM 1590 CG LEU A 99 14.429 7.495 5.008 1.00 0.00 C ATOM 1591 CD1 LEU A 99 13.462 6.502 4.381 1.00 0.00 C ATOM 1592 CD2 LEU A 99 15.486 7.922 4.001 1.00 0.00 C ATOM 0 H LEU A 99 12.868 10.886 6.381 1.00 0.00 H new ATOM 0 HA LEU A 99 14.096 8.766 7.652 1.00 0.00 H new ATOM 0 HB2 LEU A 99 12.657 8.406 5.786 1.00 0.00 H new ATOM 0 HB3 LEU A 99 13.605 9.451 4.746 1.00 0.00 H new ATOM 0 HG LEU A 99 14.930 7.005 5.843 1.00 0.00 H new ATOM 0 HD11 LEU A 99 14.016 5.642 4.005 1.00 0.00 H new ATOM 0 HD12 LEU A 99 12.744 6.171 5.131 1.00 0.00 H new ATOM 0 HD13 LEU A 99 12.932 6.981 3.557 1.00 0.00 H new ATOM 0 HD21 LEU A 99 16.012 7.042 3.631 1.00 0.00 H new ATOM 0 HD22 LEU A 99 15.008 8.436 3.167 1.00 0.00 H new ATOM 0 HD23 LEU A 99 16.197 8.594 4.482 1.00 0.00 H new ATOM 1604 N GLY A 100 16.521 8.462 6.880 1.00 0.00 N ATOM 1605 CA GLY A 100 17.965 8.493 6.744 1.00 0.00 C ATOM 1606 C GLY A 100 18.572 7.105 6.690 1.00 0.00 C ATOM 1607 O GLY A 100 19.607 6.897 6.056 1.00 0.00 O ATOM 0 H GLY A 100 16.140 7.572 7.199 1.00 0.00 H new ATOM 0 HA2 GLY A 100 18.230 9.038 5.838 1.00 0.00 H new ATOM 0 HA3 GLY A 100 18.394 9.042 7.582 1.00 0.00 H new ATOM 1611 N ASP A 101 17.928 6.153 7.357 1.00 0.00 N ATOM 1612 CA ASP A 101 18.411 4.777 7.383 1.00 0.00 C ATOM 1613 C ASP A 101 17.589 3.895 6.448 1.00 0.00 C ATOM 1614 O ASP A 101 16.519 4.291 5.985 1.00 0.00 O ATOM 1615 CB ASP A 101 18.358 4.222 8.807 1.00 0.00 C ATOM 1616 CG ASP A 101 19.353 4.899 9.730 1.00 0.00 C ATOM 1617 OD1 ASP A 101 19.110 6.062 10.111 1.00 0.00 O ATOM 1618 OD2 ASP A 101 20.374 4.265 10.069 1.00 0.00 O ATOM 0 H ASP A 101 17.070 6.309 7.887 1.00 0.00 H new ATOM 0 HA ASP A 101 19.445 4.774 7.039 1.00 0.00 H new ATOM 0 HB2 ASP A 101 17.352 4.349 9.206 1.00 0.00 H new ATOM 0 HB3 ASP A 101 18.559 3.151 8.784 1.00 0.00 H new ATOM 1623 N PHE A 102 18.096 2.698 6.175 1.00 0.00 N ATOM 1624 CA PHE A 102 17.410 1.760 5.294 1.00 0.00 C ATOM 1625 C PHE A 102 17.713 0.318 5.693 1.00 0.00 C ATOM 1626 O PHE A 102 18.760 0.012 6.263 1.00 0.00 O ATOM 1627 CB PHE A 102 17.825 1.996 3.840 1.00 0.00 C ATOM 1628 CG PHE A 102 18.013 3.447 3.499 1.00 0.00 C ATOM 1629 CD1 PHE A 102 19.156 4.122 3.895 1.00 0.00 C ATOM 1630 CD2 PHE A 102 17.048 4.134 2.781 1.00 0.00 C ATOM 1631 CE1 PHE A 102 19.331 5.457 3.583 1.00 0.00 C ATOM 1632 CE2 PHE A 102 17.217 5.469 2.466 1.00 0.00 C ATOM 1633 CZ PHE A 102 18.361 6.131 2.866 1.00 0.00 C ATOM 0 H PHE A 102 18.980 2.354 6.551 1.00 0.00 H new ATOM 0 HA PHE A 102 16.337 1.928 5.391 1.00 0.00 H new ATOM 0 HB2 PHE A 102 18.755 1.461 3.644 1.00 0.00 H new ATOM 0 HB3 PHE A 102 17.068 1.571 3.181 1.00 0.00 H new ATOM 0 HD1 PHE A 102 19.919 3.599 4.454 1.00 0.00 H new ATOM 0 HD2 PHE A 102 16.153 3.620 2.464 1.00 0.00 H new ATOM 0 HE1 PHE A 102 20.225 5.973 3.899 1.00 0.00 H new ATOM 0 HE2 PHE A 102 16.456 5.994 1.908 1.00 0.00 H new ATOM 0 HZ PHE A 102 18.497 7.173 2.619 1.00 0.00 H new ATOM 1643 N PRO A 103 16.773 -0.589 5.388 1.00 0.00 N ATOM 1644 CA PRO A 103 15.522 -0.236 4.710 1.00 0.00 C ATOM 1645 C PRO A 103 14.588 0.575 5.602 1.00 0.00 C ATOM 1646 O PRO A 103 14.808 0.685 6.809 1.00 0.00 O ATOM 1647 CB PRO A 103 14.901 -1.596 4.381 1.00 0.00 C ATOM 1648 CG PRO A 103 15.470 -2.527 5.395 1.00 0.00 C ATOM 1649 CD PRO A 103 16.860 -2.030 5.681 1.00 0.00 C ATOM 0 HA PRO A 103 15.695 0.391 3.836 1.00 0.00 H new ATOM 0 HB2 PRO A 103 13.813 -1.560 4.443 1.00 0.00 H new ATOM 0 HB3 PRO A 103 15.152 -1.912 3.368 1.00 0.00 H new ATOM 0 HG2 PRO A 103 14.864 -2.534 6.301 1.00 0.00 H new ATOM 0 HG3 PRO A 103 15.491 -3.549 5.017 1.00 0.00 H new ATOM 0 HD2 PRO A 103 17.147 -2.213 6.716 1.00 0.00 H new ATOM 0 HD3 PRO A 103 17.601 -2.524 5.052 1.00 0.00 H new ATOM 1657 N TYR A 104 13.547 1.139 5.002 1.00 0.00 N ATOM 1658 CA TYR A 104 12.581 1.942 5.743 1.00 0.00 C ATOM 1659 C TYR A 104 11.153 1.591 5.334 1.00 0.00 C ATOM 1660 O TYR A 104 10.768 1.758 4.177 1.00 0.00 O ATOM 1661 CB TYR A 104 12.838 3.432 5.510 1.00 0.00 C ATOM 1662 CG TYR A 104 11.929 4.336 6.311 1.00 0.00 C ATOM 1663 CD1 TYR A 104 10.588 4.479 5.975 1.00 0.00 C ATOM 1664 CD2 TYR A 104 12.410 5.048 7.402 1.00 0.00 C ATOM 1665 CE1 TYR A 104 9.753 5.304 6.703 1.00 0.00 C ATOM 1666 CE2 TYR A 104 11.582 5.874 8.137 1.00 0.00 C ATOM 1667 CZ TYR A 104 10.255 5.999 7.784 1.00 0.00 C ATOM 1668 OH TYR A 104 9.427 6.823 8.512 1.00 0.00 O ATOM 0 H TYR A 104 13.350 1.056 4.005 1.00 0.00 H new ATOM 0 HA TYR A 104 12.701 1.721 6.804 1.00 0.00 H new ATOM 0 HB2 TYR A 104 13.874 3.657 5.762 1.00 0.00 H new ATOM 0 HB3 TYR A 104 12.713 3.652 4.450 1.00 0.00 H new ATOM 0 HD1 TYR A 104 10.192 3.936 5.130 1.00 0.00 H new ATOM 0 HD2 TYR A 104 13.449 4.954 7.681 1.00 0.00 H new ATOM 0 HE1 TYR A 104 8.714 5.404 6.428 1.00 0.00 H new ATOM 0 HE2 TYR A 104 11.972 6.419 8.984 1.00 0.00 H new ATOM 0 HH TYR A 104 9.186 7.605 7.972 1.00 0.00 H new ATOM 1678 N VAL A 105 10.373 1.103 6.293 1.00 0.00 N ATOM 1679 CA VAL A 105 8.987 0.730 6.034 1.00 0.00 C ATOM 1680 C VAL A 105 8.097 1.061 7.227 1.00 0.00 C ATOM 1681 O VAL A 105 8.477 0.845 8.377 1.00 0.00 O ATOM 1682 CB VAL A 105 8.861 -0.772 5.716 1.00 0.00 C ATOM 1683 CG1 VAL A 105 7.418 -1.130 5.394 1.00 0.00 C ATOM 1684 CG2 VAL A 105 9.782 -1.152 4.566 1.00 0.00 C ATOM 0 H VAL A 105 10.677 0.957 7.256 1.00 0.00 H new ATOM 0 HA VAL A 105 8.660 1.307 5.169 1.00 0.00 H new ATOM 0 HB VAL A 105 9.164 -1.339 6.596 1.00 0.00 H new ATOM 0 HG11 VAL A 105 7.348 -2.195 5.172 1.00 0.00 H new ATOM 0 HG12 VAL A 105 6.785 -0.896 6.250 1.00 0.00 H new ATOM 0 HG13 VAL A 105 7.085 -0.556 4.529 1.00 0.00 H new ATOM 0 HG21 VAL A 105 9.680 -2.216 4.355 1.00 0.00 H new ATOM 0 HG22 VAL A 105 9.512 -0.579 3.679 1.00 0.00 H new ATOM 0 HG23 VAL A 105 10.814 -0.933 4.839 1.00 0.00 H new ATOM 1694 N SER A 106 6.910 1.588 6.944 1.00 0.00 N ATOM 1695 CA SER A 106 5.966 1.953 7.994 1.00 0.00 C ATOM 1696 C SER A 106 4.548 2.049 7.439 1.00 0.00 C ATOM 1697 O SER A 106 4.350 2.241 6.239 1.00 0.00 O ATOM 1698 CB SER A 106 6.368 3.285 8.630 1.00 0.00 C ATOM 1699 OG SER A 106 6.550 4.286 7.644 1.00 0.00 O ATOM 0 H SER A 106 6.579 1.772 5.997 1.00 0.00 H new ATOM 0 HA SER A 106 5.988 1.174 8.756 1.00 0.00 H new ATOM 0 HB2 SER A 106 5.600 3.601 9.336 1.00 0.00 H new ATOM 0 HB3 SER A 106 7.290 3.157 9.198 1.00 0.00 H new ATOM 0 HG SER A 106 7.501 4.511 7.578 1.00 0.00 H new ATOM 1705 N ILE A 107 3.564 1.914 8.322 1.00 0.00 N ATOM 1706 CA ILE A 107 2.164 1.986 7.922 1.00 0.00 C ATOM 1707 C ILE A 107 1.509 3.260 8.445 1.00 0.00 C ATOM 1708 O ILE A 107 1.276 3.405 9.646 1.00 0.00 O ATOM 1709 CB ILE A 107 1.370 0.768 8.430 1.00 0.00 C ATOM 1710 CG1 ILE A 107 1.927 -0.520 7.822 1.00 0.00 C ATOM 1711 CG2 ILE A 107 -0.107 0.923 8.097 1.00 0.00 C ATOM 1712 CD1 ILE A 107 1.399 -1.776 8.480 1.00 0.00 C ATOM 0 H ILE A 107 3.710 1.754 9.319 1.00 0.00 H new ATOM 0 HA ILE A 107 2.146 1.992 6.832 1.00 0.00 H new ATOM 0 HB ILE A 107 1.474 0.710 9.514 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.683 -0.546 6.760 1.00 0.00 H new ATOM 0 HG13 ILE A 107 3.014 -0.508 7.899 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.655 0.055 8.462 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.495 1.824 8.573 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -0.230 1.002 7.017 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.836 -2.651 7.998 1.00 0.00 H new ATOM 0 HD12 ILE A 107 1.666 -1.773 9.537 1.00 0.00 H new ATOM 0 HD13 ILE A 107 0.314 -1.811 8.380 1.00 0.00 H new ATOM 1724 N LEU A 108 1.211 4.181 7.535 1.00 0.00 N ATOM 1725 CA LEU A 108 0.579 5.444 7.903 1.00 0.00 C ATOM 1726 C LEU A 108 -0.934 5.368 7.726 1.00 0.00 C ATOM 1727 O LEU A 108 -1.442 4.508 7.006 1.00 0.00 O ATOM 1728 CB LEU A 108 1.147 6.586 7.059 1.00 0.00 C ATOM 1729 CG LEU A 108 1.095 7.978 7.690 1.00 0.00 C ATOM 1730 CD1 LEU A 108 2.298 8.199 8.593 1.00 0.00 C ATOM 1731 CD2 LEU A 108 1.030 9.050 6.612 1.00 0.00 C ATOM 0 H LEU A 108 1.397 4.077 6.537 1.00 0.00 H new ATOM 0 HA LEU A 108 0.793 5.637 8.954 1.00 0.00 H new ATOM 0 HB2 LEU A 108 2.186 6.355 6.823 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.605 6.617 6.114 1.00 0.00 H new ATOM 0 HG LEU A 108 0.193 8.048 8.298 1.00 0.00 H new ATOM 0 HD11 LEU A 108 2.244 9.195 9.033 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.300 7.451 9.386 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.213 8.110 8.008 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.994 10.034 7.079 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.914 8.982 5.978 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.136 8.903 6.006 1.00 0.00 H new ATOM 1743 N ASP A 109 -1.648 6.274 8.384 1.00 0.00 N ATOM 1744 CA ASP A 109 -3.103 6.312 8.297 1.00 0.00 C ATOM 1745 C ASP A 109 -3.559 7.346 7.271 1.00 0.00 C ATOM 1746 O ASP A 109 -3.210 8.524 7.344 1.00 0.00 O ATOM 1747 CB ASP A 109 -3.709 6.631 9.665 1.00 0.00 C ATOM 1748 CG ASP A 109 -5.202 6.373 9.710 1.00 0.00 C ATOM 1749 OD1 ASP A 109 -5.632 5.295 9.249 1.00 0.00 O ATOM 1750 OD2 ASP A 109 -5.942 7.249 10.207 1.00 0.00 O ATOM 0 H ASP A 109 -1.243 6.992 8.984 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.449 5.330 7.975 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.216 6.028 10.427 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.516 7.675 9.910 1.00 0.00 H new ATOM 1755 N PRO A 110 -4.356 6.895 6.291 1.00 0.00 N ATOM 1756 CA PRO A 110 -4.876 7.764 5.232 1.00 0.00 C ATOM 1757 C PRO A 110 -5.911 8.756 5.751 1.00 0.00 C ATOM 1758 O PRO A 110 -6.272 9.710 5.061 1.00 0.00 O ATOM 1759 CB PRO A 110 -5.522 6.781 4.252 1.00 0.00 C ATOM 1760 CG PRO A 110 -5.874 5.595 5.082 1.00 0.00 C ATOM 1761 CD PRO A 110 -4.812 5.503 6.143 1.00 0.00 C ATOM 0 HA PRO A 110 -4.093 8.378 4.788 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.406 7.213 3.783 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -4.835 6.513 3.450 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -6.862 5.710 5.528 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -5.901 4.689 4.477 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -5.211 5.109 7.078 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.998 4.844 5.841 1.00 0.00 H new ATOM 1769 N ARG A 111 -6.385 8.526 6.971 1.00 0.00 N ATOM 1770 CA ARG A 111 -7.379 9.399 7.583 1.00 0.00 C ATOM 1771 C ARG A 111 -6.707 10.519 8.372 1.00 0.00 C ATOM 1772 O ARG A 111 -7.016 11.697 8.187 1.00 0.00 O ATOM 1773 CB ARG A 111 -8.299 8.595 8.502 1.00 0.00 C ATOM 1774 CG ARG A 111 -9.379 7.824 7.760 1.00 0.00 C ATOM 1775 CD ARG A 111 -10.111 6.862 8.683 1.00 0.00 C ATOM 1776 NE ARG A 111 -11.083 7.549 9.529 1.00 0.00 N ATOM 1777 CZ ARG A 111 -12.328 7.814 9.150 1.00 0.00 C ATOM 1778 NH1 ARG A 111 -12.751 7.452 7.947 1.00 0.00 N ATOM 1779 NH2 ARG A 111 -13.155 8.443 9.977 1.00 0.00 N ATOM 0 H ARG A 111 -6.096 7.742 7.556 1.00 0.00 H new ATOM 0 HA ARG A 111 -7.973 9.845 6.786 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.698 7.895 9.082 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -8.772 9.273 9.212 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -10.091 8.523 7.323 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -8.930 7.269 6.936 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -10.620 6.105 8.087 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -9.388 6.341 9.311 1.00 0.00 H new ATOM 0 HE ARG A 111 -10.790 7.841 10.461 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -12.120 6.968 7.309 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -13.708 7.657 7.660 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -12.834 8.723 10.904 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -14.111 8.646 9.685 1.00 0.00 H new ATOM 1793 N THR A 112 -5.785 10.144 9.253 1.00 0.00 N ATOM 1794 CA THR A 112 -5.070 11.116 10.072 1.00 0.00 C ATOM 1795 C THR A 112 -3.706 11.442 9.473 1.00 0.00 C ATOM 1796 O THR A 112 -3.312 12.605 9.399 1.00 0.00 O ATOM 1797 CB THR A 112 -4.877 10.603 11.511 1.00 0.00 C ATOM 1798 OG1 THR A 112 -4.055 9.431 11.508 1.00 0.00 O ATOM 1799 CG2 THR A 112 -6.217 10.288 12.158 1.00 0.00 C ATOM 0 H THR A 112 -5.516 9.174 9.418 1.00 0.00 H new ATOM 0 HA THR A 112 -5.679 12.020 10.095 1.00 0.00 H new ATOM 0 HB THR A 112 -4.388 11.387 12.089 1.00 0.00 H new ATOM 0 HG1 THR A 112 -3.936 9.112 12.427 1.00 0.00 H new ATOM 0 HG21 THR A 112 -6.055 9.927 13.174 1.00 0.00 H new ATOM 0 HG22 THR A 112 -6.828 11.190 12.186 1.00 0.00 H new ATOM 0 HG23 THR A 112 -6.730 9.521 11.578 1.00 0.00 H new ATOM 1807 N GLY A 113 -2.990 10.406 9.046 1.00 0.00 N ATOM 1808 CA GLY A 113 -1.677 10.604 8.459 1.00 0.00 C ATOM 1809 C GLY A 113 -0.580 10.677 9.502 1.00 0.00 C ATOM 1810 O GLY A 113 0.370 11.447 9.360 1.00 0.00 O ATOM 0 H GLY A 113 -3.295 9.434 9.096 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -1.464 9.787 7.769 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -1.679 11.523 7.874 1.00 0.00 H new ATOM 1814 N GLN A 114 -0.711 9.874 10.553 1.00 0.00 N ATOM 1815 CA GLN A 114 0.277 9.853 11.625 1.00 0.00 C ATOM 1816 C GLN A 114 0.916 8.474 11.749 1.00 0.00 C ATOM 1817 O GLN A 114 0.222 7.459 11.808 1.00 0.00 O ATOM 1818 CB GLN A 114 -0.372 10.248 12.953 1.00 0.00 C ATOM 1819 CG GLN A 114 0.502 9.968 14.165 1.00 0.00 C ATOM 1820 CD GLN A 114 0.116 10.804 15.369 1.00 0.00 C ATOM 1821 OE1 GLN A 114 -0.795 11.630 15.299 1.00 0.00 O ATOM 1822 NE2 GLN A 114 0.807 10.593 16.483 1.00 0.00 N ATOM 0 H GLN A 114 -1.491 9.230 10.685 1.00 0.00 H new ATOM 0 HA GLN A 114 1.057 10.574 11.381 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -0.614 11.311 12.928 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -1.313 9.709 13.062 1.00 0.00 H new ATOM 0 HG2 GLN A 114 0.431 8.911 14.423 1.00 0.00 H new ATOM 0 HG3 GLN A 114 1.543 10.164 13.910 1.00 0.00 H new ATOM 0 HE21 GLN A 114 1.554 9.898 16.496 1.00 0.00 H new ATOM 0 HE22 GLN A 114 0.591 11.125 17.326 1.00 0.00 H new ATOM 1831 N LYS A 115 2.244 8.444 11.787 1.00 0.00 N ATOM 1832 CA LYS A 115 2.979 7.190 11.905 1.00 0.00 C ATOM 1833 C LYS A 115 2.511 6.398 13.121 1.00 0.00 C ATOM 1834 O LYS A 115 2.740 6.800 14.263 1.00 0.00 O ATOM 1835 CB LYS A 115 4.481 7.464 12.008 1.00 0.00 C ATOM 1836 CG LYS A 115 5.341 6.238 11.750 1.00 0.00 C ATOM 1837 CD LYS A 115 6.690 6.349 12.439 1.00 0.00 C ATOM 1838 CE LYS A 115 6.652 5.757 13.840 1.00 0.00 C ATOM 1839 NZ LYS A 115 6.402 6.798 14.876 1.00 0.00 N ATOM 0 H LYS A 115 2.834 9.275 11.738 1.00 0.00 H new ATOM 0 HA LYS A 115 2.784 6.598 11.011 1.00 0.00 H new ATOM 0 HB2 LYS A 115 4.750 8.243 11.294 1.00 0.00 H new ATOM 0 HB3 LYS A 115 4.704 7.852 13.002 1.00 0.00 H new ATOM 0 HG2 LYS A 115 4.822 5.347 12.105 1.00 0.00 H new ATOM 0 HG3 LYS A 115 5.488 6.115 10.677 1.00 0.00 H new ATOM 0 HD2 LYS A 115 7.446 5.834 11.846 1.00 0.00 H new ATOM 0 HD3 LYS A 115 6.987 7.396 12.494 1.00 0.00 H new ATOM 0 HE2 LYS A 115 5.872 4.998 13.892 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.598 5.257 14.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.680 6.433 15.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 6.960 7.648 14.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 5.391 7.041 14.887 1.00 0.00 H new ATOM 1853 N LEU A 116 1.857 5.269 12.870 1.00 0.00 N ATOM 1854 CA LEU A 116 1.358 4.419 13.946 1.00 0.00 C ATOM 1855 C LEU A 116 2.373 3.336 14.299 1.00 0.00 C ATOM 1856 O LEU A 116 2.643 3.082 15.473 1.00 0.00 O ATOM 1857 CB LEU A 116 0.030 3.776 13.540 1.00 0.00 C ATOM 1858 CG LEU A 116 -1.019 4.719 12.949 1.00 0.00 C ATOM 1859 CD1 LEU A 116 -2.242 3.939 12.496 1.00 0.00 C ATOM 1860 CD2 LEU A 116 -1.409 5.785 13.963 1.00 0.00 C ATOM 0 H LEU A 116 1.660 4.921 11.932 1.00 0.00 H new ATOM 0 HA LEU A 116 1.199 5.043 14.825 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.237 2.992 12.811 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.399 3.291 14.417 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.587 5.214 12.079 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -2.978 4.626 12.078 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.950 3.214 11.736 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -2.677 3.416 13.348 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -2.156 6.447 13.526 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -1.823 5.308 14.852 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -0.528 6.364 14.239 1.00 0.00 H new ATOM 1872 N VAL A 117 2.935 2.702 13.274 1.00 0.00 N ATOM 1873 CA VAL A 117 3.923 1.649 13.476 1.00 0.00 C ATOM 1874 C VAL A 117 5.210 1.950 12.716 1.00 0.00 C ATOM 1875 O VAL A 117 5.220 2.760 11.790 1.00 0.00 O ATOM 1876 CB VAL A 117 3.383 0.279 13.025 1.00 0.00 C ATOM 1877 CG1 VAL A 117 2.103 -0.063 13.773 1.00 0.00 C ATOM 1878 CG2 VAL A 117 3.151 0.266 11.522 1.00 0.00 C ATOM 0 H VAL A 117 2.723 2.899 12.296 1.00 0.00 H new ATOM 0 HA VAL A 117 4.135 1.614 14.545 1.00 0.00 H new ATOM 0 HB VAL A 117 4.128 -0.481 13.261 1.00 0.00 H new ATOM 0 HG11 VAL A 117 1.736 -1.034 13.441 1.00 0.00 H new ATOM 0 HG12 VAL A 117 2.305 -0.098 14.843 1.00 0.00 H new ATOM 0 HG13 VAL A 117 1.349 0.698 13.571 1.00 0.00 H new ATOM 0 HG21 VAL A 117 2.770 -0.710 11.221 1.00 0.00 H new ATOM 0 HG22 VAL A 117 2.426 1.036 11.259 1.00 0.00 H new ATOM 0 HG23 VAL A 117 4.091 0.462 11.007 1.00 0.00 H new ATOM 1888 N GLU A 118 6.294 1.292 13.114 1.00 0.00 N ATOM 1889 CA GLU A 118 7.587 1.490 12.470 1.00 0.00 C ATOM 1890 C GLU A 118 8.422 0.214 12.521 1.00 0.00 C ATOM 1891 O GLU A 118 8.719 -0.303 13.598 1.00 0.00 O ATOM 1892 CB GLU A 118 8.346 2.636 13.142 1.00 0.00 C ATOM 1893 CG GLU A 118 8.695 2.365 14.596 1.00 0.00 C ATOM 1894 CD GLU A 118 10.025 1.653 14.754 1.00 0.00 C ATOM 1895 OE1 GLU A 118 10.949 1.940 13.965 1.00 0.00 O ATOM 1896 OE2 GLU A 118 10.140 0.809 15.667 1.00 0.00 O ATOM 0 H GLU A 118 6.303 0.617 13.879 1.00 0.00 H new ATOM 0 HA GLU A 118 7.408 1.745 11.425 1.00 0.00 H new ATOM 0 HB2 GLU A 118 9.264 2.828 12.586 1.00 0.00 H new ATOM 0 HB3 GLU A 118 7.744 3.543 13.085 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.725 3.309 15.140 1.00 0.00 H new ATOM 0 HG3 GLU A 118 7.908 1.761 15.048 1.00 0.00 H new ATOM 1903 N TRP A 119 8.795 -0.289 11.350 1.00 0.00 N ATOM 1904 CA TRP A 119 9.595 -1.505 11.261 1.00 0.00 C ATOM 1905 C TRP A 119 10.893 -1.249 10.503 1.00 0.00 C ATOM 1906 O TRP A 119 10.879 -0.737 9.383 1.00 0.00 O ATOM 1907 CB TRP A 119 8.798 -2.614 10.571 1.00 0.00 C ATOM 1908 CG TRP A 119 7.450 -2.846 11.184 1.00 0.00 C ATOM 1909 CD1 TRP A 119 7.140 -2.829 12.514 1.00 0.00 C ATOM 1910 CD2 TRP A 119 6.231 -3.131 10.490 1.00 0.00 C ATOM 1911 NE1 TRP A 119 5.802 -3.087 12.688 1.00 0.00 N ATOM 1912 CE2 TRP A 119 5.221 -3.274 11.462 1.00 0.00 C ATOM 1913 CE3 TRP A 119 5.893 -3.277 9.142 1.00 0.00 C ATOM 1914 CZ2 TRP A 119 3.900 -3.557 11.126 1.00 0.00 C ATOM 1915 CZ3 TRP A 119 4.581 -3.558 8.810 1.00 0.00 C ATOM 1916 CH2 TRP A 119 3.597 -3.695 9.799 1.00 0.00 C ATOM 0 H TRP A 119 8.556 0.126 10.449 1.00 0.00 H new ATOM 0 HA TRP A 119 9.844 -1.821 12.274 1.00 0.00 H new ATOM 0 HB2 TRP A 119 8.672 -2.360 9.519 1.00 0.00 H new ATOM 0 HB3 TRP A 119 9.371 -3.541 10.609 1.00 0.00 H new ATOM 0 HD1 TRP A 119 7.843 -2.640 13.312 1.00 0.00 H new ATOM 0 HE1 TRP A 119 5.319 -3.132 13.585 1.00 0.00 H new ATOM 0 HE3 TRP A 119 6.644 -3.172 8.373 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 3.141 -3.664 11.887 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 4.309 -3.674 7.771 1.00 0.00 H new ATOM 0 HH2 TRP A 119 2.580 -3.914 9.508 1.00 0.00 H new ATOM 1927 N HIS A 120 12.014 -1.607 11.121 1.00 0.00 N ATOM 1928 CA HIS A 120 13.321 -1.416 10.503 1.00 0.00 C ATOM 1929 C HIS A 120 13.593 -2.497 9.461 1.00 0.00 C ATOM 1930 O HIS A 120 13.768 -2.202 8.279 1.00 0.00 O ATOM 1931 CB HIS A 120 14.419 -1.430 11.567 1.00 0.00 C ATOM 1932 CG HIS A 120 15.654 -0.684 11.164 1.00 0.00 C ATOM 1933 ND1 HIS A 120 15.650 0.654 10.833 1.00 0.00 N ATOM 1934 CD2 HIS A 120 16.937 -1.097 11.042 1.00 0.00 C ATOM 1935 CE1 HIS A 120 16.877 1.032 10.522 1.00 0.00 C ATOM 1936 NE2 HIS A 120 17.677 -0.012 10.642 1.00 0.00 N ATOM 0 H HIS A 120 12.043 -2.031 12.048 1.00 0.00 H new ATOM 0 HA HIS A 120 13.321 -0.447 10.004 1.00 0.00 H new ATOM 0 HB2 HIS A 120 14.027 -0.997 12.487 1.00 0.00 H new ATOM 0 HB3 HIS A 120 14.685 -2.463 11.789 1.00 0.00 H new ATOM 0 HD2 HIS A 120 17.309 -2.094 11.225 1.00 0.00 H new ATOM 0 HE1 HIS A 120 17.175 2.025 10.221 1.00 0.00 H new ATOM 0 HE2 HIS A 120 18.682 -0.012 10.466 1.00 0.00 H new ATOM 1945 N GLN A 121 13.628 -3.748 9.908 1.00 0.00 N ATOM 1946 CA GLN A 121 13.880 -4.872 9.014 1.00 0.00 C ATOM 1947 C GLN A 121 12.677 -5.807 8.962 1.00 0.00 C ATOM 1948 O GLN A 121 12.150 -6.216 9.997 1.00 0.00 O ATOM 1949 CB GLN A 121 15.121 -5.644 9.468 1.00 0.00 C ATOM 1950 CG GLN A 121 15.728 -6.514 8.379 1.00 0.00 C ATOM 1951 CD GLN A 121 16.443 -7.730 8.935 1.00 0.00 C ATOM 1952 OE1 GLN A 121 16.116 -8.215 10.018 1.00 0.00 O ATOM 1953 NE2 GLN A 121 17.425 -8.229 8.194 1.00 0.00 N ATOM 0 H GLN A 121 13.485 -4.009 10.884 1.00 0.00 H new ATOM 0 HA GLN A 121 14.053 -4.476 8.013 1.00 0.00 H new ATOM 0 HB2 GLN A 121 15.872 -4.935 9.816 1.00 0.00 H new ATOM 0 HB3 GLN A 121 14.857 -6.272 10.319 1.00 0.00 H new ATOM 0 HG2 GLN A 121 14.941 -6.839 7.698 1.00 0.00 H new ATOM 0 HG3 GLN A 121 16.430 -5.920 7.794 1.00 0.00 H new ATOM 0 HE21 GLN A 121 17.662 -7.795 7.302 1.00 0.00 H new ATOM 0 HE22 GLN A 121 17.942 -9.047 8.516 1.00 0.00 H new ATOM 1962 N LEU A 122 12.245 -6.140 7.751 1.00 0.00 N ATOM 1963 CA LEU A 122 11.103 -7.027 7.563 1.00 0.00 C ATOM 1964 C LEU A 122 11.517 -8.303 6.836 1.00 0.00 C ATOM 1965 O LEU A 122 12.654 -8.429 6.382 1.00 0.00 O ATOM 1966 CB LEU A 122 10.002 -6.313 6.777 1.00 0.00 C ATOM 1967 CG LEU A 122 9.234 -5.228 7.532 1.00 0.00 C ATOM 1968 CD1 LEU A 122 8.725 -5.761 8.862 1.00 0.00 C ATOM 1969 CD2 LEU A 122 10.113 -4.004 7.747 1.00 0.00 C ATOM 0 H LEU A 122 12.669 -5.809 6.884 1.00 0.00 H new ATOM 0 HA LEU A 122 10.721 -7.300 8.547 1.00 0.00 H new ATOM 0 HB2 LEU A 122 10.449 -5.863 5.891 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.288 -7.060 6.430 1.00 0.00 H new ATOM 0 HG LEU A 122 8.375 -4.933 6.930 1.00 0.00 H new ATOM 0 HD11 LEU A 122 8.181 -4.974 9.385 1.00 0.00 H new ATOM 0 HD12 LEU A 122 8.060 -6.606 8.685 1.00 0.00 H new ATOM 0 HD13 LEU A 122 9.569 -6.085 9.471 1.00 0.00 H new ATOM 0 HD21 LEU A 122 9.550 -3.242 8.286 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.992 -4.285 8.328 1.00 0.00 H new ATOM 0 HD23 LEU A 122 10.428 -3.608 6.781 1.00 0.00 H new ATOM 1981 N ASP A 123 10.586 -9.245 6.727 1.00 0.00 N ATOM 1982 CA ASP A 123 10.853 -10.509 6.052 1.00 0.00 C ATOM 1983 C ASP A 123 9.578 -11.077 5.438 1.00 0.00 C ATOM 1984 O ASP A 123 8.489 -10.537 5.632 1.00 0.00 O ATOM 1985 CB ASP A 123 11.454 -11.518 7.032 1.00 0.00 C ATOM 1986 CG ASP A 123 12.956 -11.364 7.173 1.00 0.00 C ATOM 1987 OD1 ASP A 123 13.692 -11.958 6.358 1.00 0.00 O ATOM 1988 OD2 ASP A 123 13.395 -10.650 8.099 1.00 0.00 O ATOM 0 H ASP A 123 9.640 -9.157 7.098 1.00 0.00 H new ATOM 0 HA ASP A 123 11.568 -10.321 5.251 1.00 0.00 H new ATOM 0 HB2 ASP A 123 10.986 -11.395 8.009 1.00 0.00 H new ATOM 0 HB3 ASP A 123 11.225 -12.529 6.694 1.00 0.00 H new ATOM 1993 N VAL A 124 9.720 -12.170 4.694 1.00 0.00 N ATOM 1994 CA VAL A 124 8.580 -12.811 4.051 1.00 0.00 C ATOM 1995 C VAL A 124 7.584 -13.326 5.084 1.00 0.00 C ATOM 1996 O VAL A 124 6.404 -12.979 5.050 1.00 0.00 O ATOM 1997 CB VAL A 124 9.026 -13.982 3.156 1.00 0.00 C ATOM 1998 CG1 VAL A 124 7.818 -14.719 2.598 1.00 0.00 C ATOM 1999 CG2 VAL A 124 9.922 -13.483 2.032 1.00 0.00 C ATOM 0 H VAL A 124 10.614 -12.630 4.522 1.00 0.00 H new ATOM 0 HA VAL A 124 8.098 -12.054 3.433 1.00 0.00 H new ATOM 0 HB VAL A 124 9.600 -14.682 3.764 1.00 0.00 H new ATOM 0 HG11 VAL A 124 8.153 -15.543 1.968 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.219 -15.111 3.420 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.214 -14.032 2.005 1.00 0.00 H new ATOM 0 HG21 VAL A 124 10.228 -14.324 1.410 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.376 -12.762 1.424 1.00 0.00 H new ATOM 0 HG23 VAL A 124 10.805 -13.005 2.456 1.00 0.00 H new ATOM 2009 N SER A 125 8.068 -14.156 6.002 1.00 0.00 N ATOM 2010 CA SER A 125 7.220 -14.722 7.045 1.00 0.00 C ATOM 2011 C SER A 125 6.952 -13.698 8.143 1.00 0.00 C ATOM 2012 O SER A 125 5.815 -13.521 8.578 1.00 0.00 O ATOM 2013 CB SER A 125 7.874 -15.969 7.642 1.00 0.00 C ATOM 2014 OG SER A 125 7.533 -17.129 6.902 1.00 0.00 O ATOM 0 H SER A 125 9.043 -14.452 6.045 1.00 0.00 H new ATOM 0 HA SER A 125 6.268 -15.001 6.593 1.00 0.00 H new ATOM 0 HB2 SER A 125 8.957 -15.846 7.652 1.00 0.00 H new ATOM 0 HB3 SER A 125 7.557 -16.089 8.678 1.00 0.00 H new ATOM 0 HG SER A 125 7.965 -17.912 7.303 1.00 0.00 H new ATOM 2020 N SER A 126 8.010 -13.027 8.588 1.00 0.00 N ATOM 2021 CA SER A 126 7.891 -12.022 9.639 1.00 0.00 C ATOM 2022 C SER A 126 6.833 -10.983 9.280 1.00 0.00 C ATOM 2023 O SER A 126 5.846 -10.813 9.996 1.00 0.00 O ATOM 2024 CB SER A 126 9.239 -11.336 9.871 1.00 0.00 C ATOM 2025 OG SER A 126 9.227 -10.583 11.072 1.00 0.00 O ATOM 0 H SER A 126 8.959 -13.161 8.238 1.00 0.00 H new ATOM 0 HA SER A 126 7.584 -12.525 10.556 1.00 0.00 H new ATOM 0 HB2 SER A 126 10.029 -12.085 9.916 1.00 0.00 H new ATOM 0 HB3 SER A 126 9.467 -10.682 9.030 1.00 0.00 H new ATOM 0 HG SER A 126 10.100 -10.156 11.199 1.00 0.00 H new ATOM 2031 N PHE A 127 7.047 -10.291 8.167 1.00 0.00 N ATOM 2032 CA PHE A 127 6.113 -9.267 7.712 1.00 0.00 C ATOM 2033 C PHE A 127 4.670 -9.736 7.876 1.00 0.00 C ATOM 2034 O PHE A 127 3.895 -9.145 8.628 1.00 0.00 O ATOM 2035 CB PHE A 127 6.384 -8.913 6.248 1.00 0.00 C ATOM 2036 CG PHE A 127 5.427 -7.899 5.690 1.00 0.00 C ATOM 2037 CD1 PHE A 127 5.585 -6.551 5.968 1.00 0.00 C ATOM 2038 CD2 PHE A 127 4.368 -8.294 4.887 1.00 0.00 C ATOM 2039 CE1 PHE A 127 4.706 -5.615 5.456 1.00 0.00 C ATOM 2040 CE2 PHE A 127 3.487 -7.363 4.372 1.00 0.00 C ATOM 2041 CZ PHE A 127 3.655 -6.022 4.657 1.00 0.00 C ATOM 0 H PHE A 127 7.859 -10.420 7.563 1.00 0.00 H new ATOM 0 HA PHE A 127 6.259 -8.378 8.326 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.400 -8.530 6.157 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.330 -9.821 5.647 1.00 0.00 H new ATOM 0 HD1 PHE A 127 6.405 -6.228 6.592 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.230 -9.341 4.662 1.00 0.00 H new ATOM 0 HE1 PHE A 127 4.841 -4.567 5.680 1.00 0.00 H new ATOM 0 HE2 PHE A 127 2.667 -7.684 3.747 1.00 0.00 H new ATOM 0 HZ PHE A 127 2.966 -5.293 4.256 1.00 0.00 H new ATOM 2051 N LEU A 128 4.317 -10.801 7.165 1.00 0.00 N ATOM 2052 CA LEU A 128 2.967 -11.350 7.229 1.00 0.00 C ATOM 2053 C LEU A 128 2.469 -11.404 8.670 1.00 0.00 C ATOM 2054 O LEU A 128 1.411 -10.864 8.992 1.00 0.00 O ATOM 2055 CB LEU A 128 2.935 -12.751 6.614 1.00 0.00 C ATOM 2056 CG LEU A 128 3.144 -12.824 5.101 1.00 0.00 C ATOM 2057 CD1 LEU A 128 3.751 -14.163 4.711 1.00 0.00 C ATOM 2058 CD2 LEU A 128 1.829 -12.599 4.370 1.00 0.00 C ATOM 0 H LEU A 128 4.947 -11.302 6.538 1.00 0.00 H new ATOM 0 HA LEU A 128 2.308 -10.695 6.660 1.00 0.00 H new ATOM 0 HB2 LEU A 128 3.703 -13.356 7.096 1.00 0.00 H new ATOM 0 HB3 LEU A 128 1.974 -13.208 6.851 1.00 0.00 H new ATOM 0 HG LEU A 128 3.838 -12.035 4.810 1.00 0.00 H new ATOM 0 HD11 LEU A 128 3.893 -14.197 3.631 1.00 0.00 H new ATOM 0 HD12 LEU A 128 4.714 -14.284 5.207 1.00 0.00 H new ATOM 0 HD13 LEU A 128 3.082 -14.968 5.015 1.00 0.00 H new ATOM 0 HD21 LEU A 128 1.997 -12.654 3.294 1.00 0.00 H new ATOM 0 HD22 LEU A 128 1.113 -13.366 4.666 1.00 0.00 H new ATOM 0 HD23 LEU A 128 1.434 -11.616 4.626 1.00 0.00 H new ATOM 2070 N ASP A 129 3.240 -12.056 9.533 1.00 0.00 N ATOM 2071 CA ASP A 129 2.880 -12.178 10.941 1.00 0.00 C ATOM 2072 C ASP A 129 2.455 -10.828 11.511 1.00 0.00 C ATOM 2073 O ASP A 129 1.432 -10.724 12.187 1.00 0.00 O ATOM 2074 CB ASP A 129 4.055 -12.738 11.744 1.00 0.00 C ATOM 2075 CG ASP A 129 3.706 -12.960 13.202 1.00 0.00 C ATOM 2076 OD1 ASP A 129 2.753 -13.720 13.476 1.00 0.00 O ATOM 2077 OD2 ASP A 129 4.386 -12.374 14.070 1.00 0.00 O ATOM 0 H ASP A 129 4.119 -12.509 9.282 1.00 0.00 H new ATOM 0 HA ASP A 129 2.038 -12.866 11.017 1.00 0.00 H new ATOM 0 HB2 ASP A 129 4.376 -13.681 11.303 1.00 0.00 H new ATOM 0 HB3 ASP A 129 4.898 -12.051 11.676 1.00 0.00 H new ATOM 2082 N GLN A 130 3.249 -9.799 11.235 1.00 0.00 N ATOM 2083 CA GLN A 130 2.956 -8.456 11.723 1.00 0.00 C ATOM 2084 C GLN A 130 1.664 -7.925 11.112 1.00 0.00 C ATOM 2085 O GLN A 130 0.724 -7.576 11.826 1.00 0.00 O ATOM 2086 CB GLN A 130 4.114 -7.510 11.401 1.00 0.00 C ATOM 2087 CG GLN A 130 5.446 -7.959 11.979 1.00 0.00 C ATOM 2088 CD GLN A 130 5.580 -7.637 13.454 1.00 0.00 C ATOM 2089 OE1 GLN A 130 4.629 -7.782 14.222 1.00 0.00 O ATOM 2090 NE2 GLN A 130 6.766 -7.197 13.859 1.00 0.00 N ATOM 0 H GLN A 130 4.100 -9.869 10.677 1.00 0.00 H new ATOM 0 HA GLN A 130 2.830 -8.509 12.804 1.00 0.00 H new ATOM 0 HB2 GLN A 130 4.209 -7.421 10.319 1.00 0.00 H new ATOM 0 HB3 GLN A 130 3.878 -6.517 11.783 1.00 0.00 H new ATOM 0 HG2 GLN A 130 5.557 -9.034 11.834 1.00 0.00 H new ATOM 0 HG3 GLN A 130 6.256 -7.478 11.431 1.00 0.00 H new ATOM 0 HE21 GLN A 130 7.527 -7.092 13.188 1.00 0.00 H new ATOM 0 HE22 GLN A 130 6.916 -6.965 14.841 1.00 0.00 H new ATOM 2099 N VAL A 131 1.624 -7.866 9.784 1.00 0.00 N ATOM 2100 CA VAL A 131 0.447 -7.378 9.076 1.00 0.00 C ATOM 2101 C VAL A 131 -0.807 -8.129 9.511 1.00 0.00 C ATOM 2102 O VAL A 131 -1.732 -7.543 10.074 1.00 0.00 O ATOM 2103 CB VAL A 131 0.612 -7.516 7.551 1.00 0.00 C ATOM 2104 CG1 VAL A 131 -0.639 -7.032 6.832 1.00 0.00 C ATOM 2105 CG2 VAL A 131 1.838 -6.751 7.077 1.00 0.00 C ATOM 0 H VAL A 131 2.393 -8.150 9.178 1.00 0.00 H new ATOM 0 HA VAL A 131 0.341 -6.323 9.328 1.00 0.00 H new ATOM 0 HB VAL A 131 0.754 -8.570 7.312 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -0.504 -7.137 5.756 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -1.495 -7.627 7.150 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -0.816 -5.984 7.075 1.00 0.00 H new ATOM 0 HG21 VAL A 131 1.939 -6.859 5.997 1.00 0.00 H new ATOM 0 HG22 VAL A 131 1.728 -5.696 7.327 1.00 0.00 H new ATOM 0 HG23 VAL A 131 2.727 -7.149 7.567 1.00 0.00 H new ATOM 2115 N THR A 132 -0.831 -9.431 9.246 1.00 0.00 N ATOM 2116 CA THR A 132 -1.971 -10.264 9.609 1.00 0.00 C ATOM 2117 C THR A 132 -2.496 -9.904 10.994 1.00 0.00 C ATOM 2118 O THR A 132 -3.702 -9.778 11.198 1.00 0.00 O ATOM 2119 CB THR A 132 -1.605 -11.760 9.584 1.00 0.00 C ATOM 2120 OG1 THR A 132 -0.491 -12.006 10.449 1.00 0.00 O ATOM 2121 CG2 THR A 132 -1.266 -12.210 8.171 1.00 0.00 C ATOM 0 H THR A 132 -0.074 -9.932 8.781 1.00 0.00 H new ATOM 0 HA THR A 132 -2.748 -10.076 8.868 1.00 0.00 H new ATOM 0 HB THR A 132 -2.467 -12.329 9.932 1.00 0.00 H new ATOM 0 HG1 THR A 132 0.279 -11.479 10.149 1.00 0.00 H new ATOM 0 HG21 THR A 132 -1.011 -13.270 8.178 1.00 0.00 H new ATOM 0 HG22 THR A 132 -2.126 -12.048 7.521 1.00 0.00 H new ATOM 0 HG23 THR A 132 -0.418 -11.635 7.800 1.00 0.00 H new ATOM 2129 N GLY A 133 -1.580 -9.739 11.945 1.00 0.00 N ATOM 2130 CA GLY A 133 -1.971 -9.395 13.299 1.00 0.00 C ATOM 2131 C GLY A 133 -2.416 -7.951 13.425 1.00 0.00 C ATOM 2132 O GLY A 133 -3.322 -7.638 14.198 1.00 0.00 O ATOM 0 H GLY A 133 -0.575 -9.838 11.801 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -2.781 -10.051 13.618 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -1.133 -9.574 13.972 1.00 0.00 H new ATOM 2136 N PHE A 134 -1.777 -7.068 12.664 1.00 0.00 N ATOM 2137 CA PHE A 134 -2.111 -5.649 12.696 1.00 0.00 C ATOM 2138 C PHE A 134 -3.533 -5.413 12.195 1.00 0.00 C ATOM 2139 O PHE A 134 -4.262 -4.578 12.733 1.00 0.00 O ATOM 2140 CB PHE A 134 -1.120 -4.851 11.845 1.00 0.00 C ATOM 2141 CG PHE A 134 -1.619 -3.487 11.465 1.00 0.00 C ATOM 2142 CD1 PHE A 134 -2.451 -3.320 10.369 1.00 0.00 C ATOM 2143 CD2 PHE A 134 -1.258 -2.372 12.203 1.00 0.00 C ATOM 2144 CE1 PHE A 134 -2.911 -2.065 10.016 1.00 0.00 C ATOM 2145 CE2 PHE A 134 -1.715 -1.115 11.855 1.00 0.00 C ATOM 2146 CZ PHE A 134 -2.544 -0.961 10.761 1.00 0.00 C ATOM 0 H PHE A 134 -1.026 -7.310 12.018 1.00 0.00 H new ATOM 0 HA PHE A 134 -2.048 -5.310 13.730 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -0.184 -4.747 12.394 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -0.897 -5.413 10.938 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -2.743 -4.180 9.784 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -0.612 -2.486 13.061 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -3.557 -1.948 9.158 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -1.424 -0.254 12.438 1.00 0.00 H new ATOM 0 HZ PHE A 134 -2.904 0.020 10.489 1.00 0.00 H new ATOM 2156 N LEU A 135 -3.921 -6.154 11.163 1.00 0.00 N ATOM 2157 CA LEU A 135 -5.255 -6.026 10.588 1.00 0.00 C ATOM 2158 C LEU A 135 -6.329 -6.223 11.654 1.00 0.00 C ATOM 2159 O LEU A 135 -7.286 -5.456 11.735 1.00 0.00 O ATOM 2160 CB LEU A 135 -5.447 -7.044 9.462 1.00 0.00 C ATOM 2161 CG LEU A 135 -4.855 -6.661 8.104 1.00 0.00 C ATOM 2162 CD1 LEU A 135 -4.673 -7.895 7.235 1.00 0.00 C ATOM 2163 CD2 LEU A 135 -5.741 -5.640 7.405 1.00 0.00 C ATOM 0 H LEU A 135 -3.331 -6.850 10.707 1.00 0.00 H new ATOM 0 HA LEU A 135 -5.353 -5.020 10.181 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -5.005 -7.990 9.775 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.515 -7.218 9.334 1.00 0.00 H new ATOM 0 HG LEU A 135 -3.876 -6.210 8.269 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -4.251 -7.604 6.273 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -3.998 -8.593 7.731 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.639 -8.375 7.077 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -5.305 -5.379 6.441 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -6.733 -6.064 7.251 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.820 -4.745 8.021 1.00 0.00 H new ATOM 2175 N GLY A 136 -6.160 -7.257 12.473 1.00 0.00 N ATOM 2176 CA GLY A 136 -7.120 -7.535 13.525 1.00 0.00 C ATOM 2177 C GLY A 136 -6.913 -6.661 14.745 1.00 0.00 C ATOM 2178 O GLY A 136 -7.873 -6.147 15.318 1.00 0.00 O ATOM 0 H GLY A 136 -5.375 -7.907 12.426 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -8.129 -7.384 13.141 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -7.043 -8.583 13.815 1.00 0.00 H new ATOM 2182 N GLU A 137 -5.656 -6.492 15.144 1.00 0.00 N ATOM 2183 CA GLU A 137 -5.327 -5.675 16.306 1.00 0.00 C ATOM 2184 C GLU A 137 -5.925 -4.277 16.175 1.00 0.00 C ATOM 2185 O GLU A 137 -6.562 -3.773 17.101 1.00 0.00 O ATOM 2186 CB GLU A 137 -3.810 -5.579 16.477 1.00 0.00 C ATOM 2187 CG GLU A 137 -3.374 -5.318 17.909 1.00 0.00 C ATOM 2188 CD GLU A 137 -3.910 -6.352 18.880 1.00 0.00 C ATOM 2189 OE1 GLU A 137 -3.253 -7.400 19.052 1.00 0.00 O ATOM 2190 OE2 GLU A 137 -4.986 -6.114 19.467 1.00 0.00 O ATOM 0 H GLU A 137 -4.850 -6.910 14.680 1.00 0.00 H new ATOM 0 HA GLU A 137 -5.755 -6.153 17.187 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -3.354 -6.507 16.131 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -3.431 -4.780 15.839 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -2.285 -5.310 17.957 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -3.714 -4.328 18.214 1.00 0.00 H new ATOM 2197 N HIS A 138 -5.714 -3.655 15.019 1.00 0.00 N ATOM 2198 CA HIS A 138 -6.232 -2.315 14.766 1.00 0.00 C ATOM 2199 C HIS A 138 -7.645 -2.378 14.194 1.00 0.00 C ATOM 2200 O HIS A 138 -8.541 -1.667 14.647 1.00 0.00 O ATOM 2201 CB HIS A 138 -5.312 -1.564 13.804 1.00 0.00 C ATOM 2202 CG HIS A 138 -3.995 -1.185 14.407 1.00 0.00 C ATOM 2203 ND1 HIS A 138 -3.284 -0.067 14.023 1.00 0.00 N ATOM 2204 CD2 HIS A 138 -3.259 -1.782 15.374 1.00 0.00 C ATOM 2205 CE1 HIS A 138 -2.169 0.006 14.727 1.00 0.00 C ATOM 2206 NE2 HIS A 138 -2.129 -1.023 15.554 1.00 0.00 N ATOM 0 H HIS A 138 -5.188 -4.057 14.243 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.267 -1.780 15.715 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -5.135 -2.184 12.925 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -5.818 -0.662 13.460 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -3.513 -2.687 15.905 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -1.417 0.777 14.641 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -1.381 -1.221 16.218 1.00 0.00 H new ATOM 2215 N GLY A 139 -7.836 -3.234 13.195 1.00 0.00 N ATOM 2216 CA GLY A 139 -9.142 -3.373 12.576 1.00 0.00 C ATOM 2217 C GLY A 139 -9.247 -2.616 11.267 1.00 0.00 C ATOM 2218 O GLY A 139 -8.258 -2.068 10.780 1.00 0.00 O ATOM 0 H GLY A 139 -7.110 -3.834 12.803 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -9.346 -4.429 12.399 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -9.907 -3.012 13.263 1.00 0.00 H new ATOM 2222 N GLN A 140 -10.446 -2.588 10.696 1.00 0.00 N ATOM 2223 CA GLN A 140 -10.675 -1.895 9.434 1.00 0.00 C ATOM 2224 C GLN A 140 -11.096 -0.449 9.675 1.00 0.00 C ATOM 2225 O GLN A 140 -12.015 -0.180 10.450 1.00 0.00 O ATOM 2226 CB GLN A 140 -11.745 -2.620 8.616 1.00 0.00 C ATOM 2227 CG GLN A 140 -12.132 -1.892 7.339 1.00 0.00 C ATOM 2228 CD GLN A 140 -11.263 -2.281 6.159 1.00 0.00 C ATOM 2229 OE1 GLN A 140 -10.051 -1.740 6.113 1.00 0.00 O flip ATOM 2230 NE2 GLN A 140 -11.677 -3.058 5.299 1.00 0.00 N flip ATOM 0 H GLN A 140 -11.274 -3.037 11.087 1.00 0.00 H new ATOM 0 HA GLN A 140 -9.739 -1.894 8.875 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -11.383 -3.616 8.361 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -12.634 -2.752 9.233 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -13.174 -2.107 7.104 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -12.057 -0.817 7.501 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -12.616 -3.450 5.375 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -11.081 -3.310 4.510 1.00 0.00 H new ATOM 2239 N LEU A 141 -10.418 0.479 9.008 1.00 0.00 N ATOM 2240 CA LEU A 141 -10.721 1.899 9.150 1.00 0.00 C ATOM 2241 C LEU A 141 -12.225 2.125 9.263 1.00 0.00 C ATOM 2242 O LEU A 141 -12.692 2.816 10.169 1.00 0.00 O ATOM 2243 CB LEU A 141 -10.164 2.681 7.959 1.00 0.00 C ATOM 2244 CG LEU A 141 -8.700 3.109 8.063 1.00 0.00 C ATOM 2245 CD1 LEU A 141 -7.783 1.897 7.999 1.00 0.00 C ATOM 2246 CD2 LEU A 141 -8.355 4.101 6.962 1.00 0.00 C ATOM 0 H LEU A 141 -9.655 0.273 8.363 1.00 0.00 H new ATOM 0 HA LEU A 141 -10.248 2.257 10.065 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -10.281 2.071 7.063 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -10.774 3.574 7.819 1.00 0.00 H new ATOM 0 HG LEU A 141 -8.552 3.599 9.025 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -6.745 2.222 8.075 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -8.013 1.223 8.824 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -7.933 1.377 7.053 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -7.309 4.395 7.052 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -8.520 3.637 5.990 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -8.989 4.983 7.055 1.00 0.00 H new ATOM 2258 N ASP A 142 -12.978 1.538 8.340 1.00 0.00 N ATOM 2259 CA ASP A 142 -14.430 1.673 8.338 1.00 0.00 C ATOM 2260 C ASP A 142 -14.982 1.633 9.760 1.00 0.00 C ATOM 2261 O ASP A 142 -15.772 2.489 10.154 1.00 0.00 O ATOM 2262 CB ASP A 142 -15.066 0.562 7.500 1.00 0.00 C ATOM 2263 CG ASP A 142 -16.575 0.525 7.638 1.00 0.00 C ATOM 2264 OD1 ASP A 142 -17.062 0.222 8.747 1.00 0.00 O ATOM 2265 OD2 ASP A 142 -17.270 0.798 6.636 1.00 0.00 O ATOM 0 H ASP A 142 -12.607 0.964 7.583 1.00 0.00 H new ATOM 0 HA ASP A 142 -14.679 2.638 7.897 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -14.803 0.706 6.452 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -14.653 -0.400 7.803 1.00 0.00 H new ATOM 2270 N GLY A 143 -14.559 0.632 10.526 1.00 0.00 N ATOM 2271 CA GLY A 143 -15.022 0.498 11.895 1.00 0.00 C ATOM 2272 C GLY A 143 -14.360 -0.657 12.620 1.00 0.00 C ATOM 2273 O GLY A 143 -13.521 -1.357 12.053 1.00 0.00 O ATOM 0 H GLY A 143 -13.904 -0.089 10.223 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -14.823 1.424 12.435 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -16.102 0.353 11.897 1.00 0.00 H new ATOM 2277 N LEU A 144 -14.737 -0.856 13.879 1.00 0.00 N ATOM 2278 CA LEU A 144 -14.173 -1.933 14.684 1.00 0.00 C ATOM 2279 C LEU A 144 -14.540 -3.296 14.106 1.00 0.00 C ATOM 2280 O LEU A 144 -15.338 -3.390 13.173 1.00 0.00 O ATOM 2281 CB LEU A 144 -14.667 -1.829 16.128 1.00 0.00 C ATOM 2282 CG LEU A 144 -14.241 -0.577 16.895 1.00 0.00 C ATOM 2283 CD1 LEU A 144 -15.100 0.612 16.494 1.00 0.00 C ATOM 2284 CD2 LEU A 144 -14.326 -0.816 18.396 1.00 0.00 C ATOM 0 H LEU A 144 -15.430 -0.286 14.363 1.00 0.00 H new ATOM 0 HA LEU A 144 -13.088 -1.834 14.669 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -15.756 -1.874 16.122 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -14.315 -2.703 16.675 1.00 0.00 H new ATOM 0 HG LEU A 144 -13.205 -0.353 16.641 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -14.783 1.494 17.050 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -14.989 0.797 15.426 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -16.145 0.398 16.719 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -14.019 0.086 18.926 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -15.352 -1.065 18.667 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -13.668 -1.640 18.671 1.00 0.00 H new ATOM 2296 N SER A 145 -13.955 -4.349 14.667 1.00 0.00 N ATOM 2297 CA SER A 145 -14.219 -5.707 14.206 1.00 0.00 C ATOM 2298 C SER A 145 -15.488 -6.260 14.846 1.00 0.00 C ATOM 2299 O SER A 145 -15.520 -6.544 16.044 1.00 0.00 O ATOM 2300 CB SER A 145 -13.033 -6.617 14.527 1.00 0.00 C ATOM 2301 OG SER A 145 -12.688 -6.540 15.899 1.00 0.00 O ATOM 0 H SER A 145 -13.295 -4.288 15.442 1.00 0.00 H new ATOM 0 HA SER A 145 -14.361 -5.677 13.126 1.00 0.00 H new ATOM 0 HB2 SER A 145 -13.280 -7.647 14.268 1.00 0.00 H new ATOM 0 HB3 SER A 145 -12.176 -6.332 13.917 1.00 0.00 H new ATOM 0 HG SER A 145 -13.504 -6.512 16.441 1.00 0.00 H new ATOM 2307 N SER A 146 -16.534 -6.412 14.039 1.00 0.00 N ATOM 2308 CA SER A 146 -17.807 -6.928 14.527 1.00 0.00 C ATOM 2309 C SER A 146 -17.637 -8.323 15.121 1.00 0.00 C ATOM 2310 O SER A 146 -18.093 -8.596 16.231 1.00 0.00 O ATOM 2311 CB SER A 146 -18.834 -6.966 13.393 1.00 0.00 C ATOM 2312 OG SER A 146 -18.378 -7.769 12.319 1.00 0.00 O ATOM 0 H SER A 146 -16.524 -6.185 13.045 1.00 0.00 H new ATOM 0 HA SER A 146 -18.165 -6.260 15.310 1.00 0.00 H new ATOM 0 HB2 SER A 146 -19.780 -7.357 13.768 1.00 0.00 H new ATOM 0 HB3 SER A 146 -19.026 -5.953 13.038 1.00 0.00 H new ATOM 0 HG SER A 146 -19.053 -7.778 11.608 1.00 0.00 H new ATOM 2318 N SER A 147 -16.977 -9.201 14.373 1.00 0.00 N ATOM 2319 CA SER A 147 -16.748 -10.569 14.822 1.00 0.00 C ATOM 2320 C SER A 147 -15.795 -10.598 16.013 1.00 0.00 C ATOM 2321 O SER A 147 -15.125 -9.609 16.310 1.00 0.00 O ATOM 2322 CB SER A 147 -16.182 -11.416 13.681 1.00 0.00 C ATOM 2323 OG SER A 147 -17.111 -11.524 12.616 1.00 0.00 O ATOM 0 H SER A 147 -16.591 -8.989 13.453 1.00 0.00 H new ATOM 0 HA SER A 147 -17.705 -10.987 15.134 1.00 0.00 H new ATOM 0 HB2 SER A 147 -15.257 -10.969 13.317 1.00 0.00 H new ATOM 0 HB3 SER A 147 -15.932 -12.410 14.051 1.00 0.00 H new ATOM 0 HG SER A 147 -16.725 -12.069 11.899 1.00 0.00 H new ATOM 2329 N SER A 148 -15.741 -11.739 16.692 1.00 0.00 N ATOM 2330 CA SER A 148 -14.873 -11.897 17.854 1.00 0.00 C ATOM 2331 C SER A 148 -14.318 -13.316 17.928 1.00 0.00 C ATOM 2332 O SER A 148 -14.775 -14.211 17.218 1.00 0.00 O ATOM 2333 CB SER A 148 -15.639 -11.569 19.137 1.00 0.00 C ATOM 2334 OG SER A 148 -14.751 -11.229 20.188 1.00 0.00 O ATOM 0 H SER A 148 -16.288 -12.568 16.458 1.00 0.00 H new ATOM 0 HA SER A 148 -14.038 -11.204 17.751 1.00 0.00 H new ATOM 0 HB2 SER A 148 -16.324 -10.741 18.954 1.00 0.00 H new ATOM 0 HB3 SER A 148 -16.245 -12.426 19.432 1.00 0.00 H new ATOM 0 HG SER A 148 -15.265 -11.022 20.996 1.00 0.00 H new ATOM 2340 N GLY A 149 -13.327 -13.513 18.793 1.00 0.00 N ATOM 2341 CA GLY A 149 -12.724 -14.824 18.944 1.00 0.00 C ATOM 2342 C GLY A 149 -11.223 -14.752 19.144 1.00 0.00 C ATOM 2343 O GLY A 149 -10.560 -13.816 18.698 1.00 0.00 O ATOM 0 H GLY A 149 -12.931 -12.788 19.391 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -13.177 -15.333 19.795 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -12.941 -15.424 18.061 1.00 0.00 H new ATOM 2347 N PRO A 150 -10.665 -15.760 19.832 1.00 0.00 N ATOM 2348 CA PRO A 150 -9.227 -15.829 20.107 1.00 0.00 C ATOM 2349 C PRO A 150 -8.409 -16.105 18.850 1.00 0.00 C ATOM 2350 O PRO A 150 -7.202 -16.335 18.921 1.00 0.00 O ATOM 2351 CB PRO A 150 -9.110 -16.999 21.088 1.00 0.00 C ATOM 2352 CG PRO A 150 -10.298 -17.851 20.805 1.00 0.00 C ATOM 2353 CD PRO A 150 -11.395 -16.909 20.394 1.00 0.00 C ATOM 0 HA PRO A 150 -8.841 -14.887 20.496 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -8.182 -17.551 20.937 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -9.109 -16.651 22.121 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -10.083 -18.569 20.014 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -10.586 -18.424 21.686 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -12.059 -17.362 19.658 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -12.013 -16.616 21.243 1.00 0.00 H new ATOM 2361 N SER A 151 -9.075 -16.079 17.699 1.00 0.00 N ATOM 2362 CA SER A 151 -8.409 -16.330 16.426 1.00 0.00 C ATOM 2363 C SER A 151 -8.039 -15.019 15.739 1.00 0.00 C ATOM 2364 O SER A 151 -8.722 -14.007 15.900 1.00 0.00 O ATOM 2365 CB SER A 151 -9.310 -17.161 15.511 1.00 0.00 C ATOM 2366 OG SER A 151 -8.672 -17.430 14.274 1.00 0.00 O ATOM 0 H SER A 151 -10.074 -15.887 17.622 1.00 0.00 H new ATOM 0 HA SER A 151 -7.493 -16.886 16.626 1.00 0.00 H new ATOM 0 HB2 SER A 151 -9.567 -18.099 16.003 1.00 0.00 H new ATOM 0 HB3 SER A 151 -10.244 -16.628 15.334 1.00 0.00 H new ATOM 0 HG SER A 151 -9.268 -17.964 13.708 1.00 0.00 H new ATOM 2372 N SER A 152 -6.954 -15.045 14.973 1.00 0.00 N ATOM 2373 CA SER A 152 -6.489 -13.858 14.264 1.00 0.00 C ATOM 2374 C SER A 152 -6.000 -12.797 15.244 1.00 0.00 C ATOM 2375 O SER A 152 -6.294 -11.612 15.092 1.00 0.00 O ATOM 2376 CB SER A 152 -7.610 -13.287 13.394 1.00 0.00 C ATOM 2377 OG SER A 152 -8.160 -14.284 12.550 1.00 0.00 O ATOM 0 H SER A 152 -6.380 -15.875 14.827 1.00 0.00 H new ATOM 0 HA SER A 152 -5.655 -14.149 13.625 1.00 0.00 H new ATOM 0 HB2 SER A 152 -8.392 -12.872 14.030 1.00 0.00 H new ATOM 0 HB3 SER A 152 -7.223 -12.467 12.789 1.00 0.00 H new ATOM 0 HG SER A 152 -8.875 -13.894 12.006 1.00 0.00 H new ATOM 2383 N GLY A 153 -5.249 -13.232 16.252 1.00 0.00 N ATOM 2384 CA GLY A 153 -4.730 -12.308 17.243 1.00 0.00 C ATOM 2385 C GLY A 153 -4.438 -12.983 18.569 1.00 0.00 C ATOM 2386 O GLY A 153 -4.490 -14.208 18.673 1.00 0.00 O ATOM 0 H GLY A 153 -4.991 -14.208 16.399 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -3.817 -11.849 16.864 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -5.450 -11.505 17.399 1.00 0.00 H new TER 2390 GLY A 153