USER MOD reduce.3.24.130724 H: found=0, std=0, add=1211, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1212 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 31 SER OG : rot -33:sc= 0.425 USER MOD Set 1.2: A 62 THR OG1 : rot 54:sc= 1.39 USER MOD Set 2.1: A 53 TYR OH : rot 165:sc= 0 USER MOD Set 2.2: A 55 ASN : amide:sc= -2.74 K(o=-2.7,f=-5.6!) USER MOD Set 3.1: A 10 ASN : amide:sc= -4.92! C(o=-19!,f=-22!) USER MOD Set 3.2: A 48 GLN : amide:sc= -6! C(o=-19!,f=-31!) USER MOD Set 3.3: A 50 GLN : amide:sc= -7.87! C(o=-19!,f=-24!) USER MOD Set 4.1: A 17 GLN : amide:sc= -1.08 K(o=-1.3,f=-4.1) USER MOD Set 4.2: A 93 THR OG1 : rot -147:sc= -0.257 USER MOD Single : A 1 THR N :NH3+ 135:sc= 0.0655 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.00801 USER MOD Single : A 4 TYR OH : rot -140:sc= -1.94 USER MOD Single : A 9 SER OG : rot 30:sc= -1.51! USER MOD Single : A 13 SER OG : rot 175:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -2.52! K(o=-2.5!,f=-0.53) USER MOD Single : A 23 LYS NZ :NH3+ -166:sc= -0.0436 (180deg=-0.268) USER MOD Single : A 32 HIS : no HD1:sc= -1.07 K(o=-1.1,f=0.19) USER MOD Single : A 35 THR OG1 : rot 174:sc= -0.621! USER MOD Single : A 37 SER OG : rot -74:sc= 1.31 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 27:sc= 0.742 USER MOD Single : A 42 THR OG1 : rot 180:sc= -3.33! USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.38 K(o=-0.38,f=-2.1) USER MOD Single : A 72 HIS : no HD1:sc= -5.18! C(o=-5.2!,f=-7.6!) USER MOD Single : A 73 THR OG1 : rot -11:sc= 1.07 USER MOD Single : A 74 GLN : amide:sc= -5.19! C(o=-5.2!,f=-8.4!) USER MOD Single : A 79 GLN : amide:sc= -1.07! K(o=-1.1!,f=-0.37) USER MOD Single : A 80 GLN : amide:sc= -6.32! C(o=-6.3!,f=-5.2!) USER MOD Single : A 99 MET CE :methyl -165:sc= -2.28! (180deg=-2.49!) USER MOD Single : A 103 ASN : amide:sc= -5.67! K(o=-5.7!,f=-0.18) USER MOD Single : A 107 ASN : amide:sc= -2.65! K(o=-2.7!,f=-0.33) USER MOD Single : A 108 THR OG1 : rot 180:sc= -2.99! USER MOD Single : A 112 THR OG1 : rot 48:sc= 0.0929 USER MOD Single : A 115 HIS : no HD1:sc= -0.131 X(o=-0.13,f=-0.11) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl -120:sc= -1.7 (180deg=-4.57!) USER MOD Single : A 119 LYS NZ :NH3+ -120:sc= 0.714 (180deg=0.0919) USER MOD Single : A 120 ASN : amide:sc= -1.78 K(o=-1.8,f=-10!) USER MOD Single : A 124 MET CE :methyl 156:sc= -0.0169 (180deg=-1.26) USER MOD Single : A 142 MET CE :methyl 151:sc= -0.135 (180deg=-1.31!) USER MOD Single : A 145 GLN : amide:sc= -11.7! C(o=-12!,f=-4.7!) USER MOD Single : A 148 HIS : no HE2:sc= -1.17 K(o=-1.2,f=-3.5!) USER MOD Single : A 149 THR OG1 : rot 92:sc= 1.25 USER MOD Single : A 154 LYS NZ :NH3+ -108:sc= 0.539 (180deg=0) USER MOD Single : A 156 ASN : amide:sc= -1.11 K(o=-1.1,f=0.071) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 1.081 -13.621 -9.764 1.00 0.73 N ATOM 2 CA THR A 1 0.553 -12.895 -8.581 1.00 0.53 C ATOM 3 C THR A 1 0.802 -11.394 -8.704 1.00 0.47 C ATOM 4 O THR A 1 1.708 -10.961 -9.417 1.00 0.70 O ATOM 5 CB THR A 1 1.236 -13.447 -7.328 1.00 0.54 C ATOM 6 OG1 THR A 1 1.034 -14.846 -7.224 1.00 0.58 O ATOM 7 CG2 THR A 1 0.737 -12.820 -6.045 1.00 0.81 C ATOM 0 H1 THR A 1 1.600 -14.466 -9.450 1.00 0.73 H new ATOM 0 H2 THR A 1 0.291 -13.908 -10.377 1.00 0.73 H new ATOM 0 H3 THR A 1 1.723 -12.999 -10.295 1.00 0.73 H new ATOM 0 HA THR A 1 -0.525 -13.044 -8.516 1.00 0.53 H new ATOM 0 HB THR A 1 2.292 -13.204 -7.446 1.00 0.54 H new ATOM 0 HG1 THR A 1 1.479 -15.182 -6.418 1.00 0.58 H new ATOM 0 HG21 THR A 1 1.264 -13.258 -5.197 1.00 0.81 H new ATOM 0 HG22 THR A 1 0.919 -11.746 -6.070 1.00 0.81 H new ATOM 0 HG23 THR A 1 -0.332 -13.004 -5.942 1.00 0.81 H new ATOM 17 N VAL A 2 -0.011 -10.605 -8.008 1.00 0.44 N ATOM 18 CA VAL A 2 0.117 -9.154 -8.041 1.00 0.42 C ATOM 19 C VAL A 2 0.386 -8.584 -6.653 1.00 0.38 C ATOM 20 O VAL A 2 -0.137 -9.080 -5.653 1.00 0.43 O ATOM 21 CB VAL A 2 -1.147 -8.489 -8.614 1.00 0.51 C ATOM 22 CG1 VAL A 2 -1.042 -6.976 -8.533 1.00 1.29 C ATOM 23 CG2 VAL A 2 -1.380 -8.926 -10.047 1.00 0.85 C ATOM 0 H VAL A 2 -0.766 -10.948 -7.414 1.00 0.44 H new ATOM 0 HA VAL A 2 0.965 -8.934 -8.690 1.00 0.42 H new ATOM 0 HB VAL A 2 -1.999 -8.808 -8.013 1.00 0.51 H new ATOM 0 HG11 VAL A 2 -1.946 -6.526 -8.943 1.00 1.29 H new ATOM 0 HG12 VAL A 2 -0.927 -6.674 -7.492 1.00 1.29 H new ATOM 0 HG13 VAL A 2 -0.177 -6.640 -9.106 1.00 1.29 H new ATOM 0 HG21 VAL A 2 -2.278 -8.444 -10.433 1.00 0.85 H new ATOM 0 HG22 VAL A 2 -0.524 -8.640 -10.658 1.00 0.85 H new ATOM 0 HG23 VAL A 2 -1.505 -10.008 -10.082 1.00 0.85 H new ATOM 33 N ALA A 3 1.194 -7.531 -6.601 1.00 0.38 N ATOM 34 CA ALA A 3 1.526 -6.881 -5.344 1.00 0.40 C ATOM 35 C ALA A 3 0.643 -5.660 -5.114 1.00 0.40 C ATOM 36 O ALA A 3 0.895 -4.585 -5.658 1.00 0.65 O ATOM 37 CB ALA A 3 2.996 -6.489 -5.322 1.00 0.43 C ATOM 0 H ALA A 3 1.632 -7.110 -7.420 1.00 0.38 H new ATOM 0 HA ALA A 3 1.343 -7.588 -4.535 1.00 0.40 H new ATOM 0 HB1 ALA A 3 3.229 -6.003 -4.374 1.00 0.43 H new ATOM 0 HB2 ALA A 3 3.612 -7.381 -5.434 1.00 0.43 H new ATOM 0 HB3 ALA A 3 3.201 -5.801 -6.142 1.00 0.43 H new ATOM 43 N TYR A 4 -0.386 -5.839 -4.298 1.00 0.25 N ATOM 44 CA TYR A 4 -1.318 -4.766 -3.971 1.00 0.24 C ATOM 45 C TYR A 4 -0.670 -3.833 -2.951 1.00 0.27 C ATOM 46 O TYR A 4 -0.964 -3.890 -1.758 1.00 0.35 O ATOM 47 CB TYR A 4 -2.612 -5.362 -3.418 1.00 0.25 C ATOM 48 CG TYR A 4 -3.386 -6.196 -4.426 1.00 0.27 C ATOM 49 CD1 TYR A 4 -2.735 -6.995 -5.361 1.00 0.55 C ATOM 50 CD2 TYR A 4 -4.771 -6.186 -4.436 1.00 0.62 C ATOM 51 CE1 TYR A 4 -3.445 -7.753 -6.270 1.00 0.61 C ATOM 52 CE2 TYR A 4 -5.485 -6.940 -5.340 1.00 0.66 C ATOM 53 CZ TYR A 4 -4.817 -7.723 -6.258 1.00 0.45 C ATOM 54 OH TYR A 4 -5.528 -8.476 -7.163 1.00 0.55 O ATOM 0 H TYR A 4 -0.599 -6.728 -3.845 1.00 0.25 H new ATOM 0 HA TYR A 4 -1.559 -4.194 -4.867 1.00 0.24 H new ATOM 0 HB2 TYR A 4 -2.374 -5.982 -2.554 1.00 0.25 H new ATOM 0 HB3 TYR A 4 -3.251 -4.553 -3.064 1.00 0.25 H new ATOM 0 HD1 TYR A 4 -1.655 -7.022 -5.376 1.00 0.55 H new ATOM 0 HD2 TYR A 4 -5.301 -5.575 -3.721 1.00 0.62 H new ATOM 0 HE1 TYR A 4 -2.923 -8.368 -6.988 1.00 0.61 H new ATOM 0 HE2 TYR A 4 -6.565 -6.918 -5.330 1.00 0.66 H new ATOM 0 HH TYR A 4 -6.297 -7.961 -7.485 1.00 0.55 H new ATOM 64 N ILE A 5 0.250 -3.004 -3.437 1.00 0.28 N ATOM 65 CA ILE A 5 0.992 -2.081 -2.586 1.00 0.34 C ATOM 66 C ILE A 5 0.241 -0.776 -2.358 1.00 0.34 C ATOM 67 O ILE A 5 -0.551 -0.346 -3.195 1.00 0.39 O ATOM 68 CB ILE A 5 2.365 -1.752 -3.211 1.00 0.41 C ATOM 69 CG1 ILE A 5 3.099 -3.038 -3.597 1.00 0.44 C ATOM 70 CG2 ILE A 5 3.206 -0.921 -2.252 1.00 0.53 C ATOM 71 CD1 ILE A 5 3.393 -3.952 -2.425 1.00 0.95 C ATOM 0 H ILE A 5 0.500 -2.954 -4.425 1.00 0.28 H new ATOM 0 HA ILE A 5 1.121 -2.581 -1.626 1.00 0.34 H new ATOM 0 HB ILE A 5 2.200 -1.166 -4.115 1.00 0.41 H new ATOM 0 HG12 ILE A 5 2.500 -3.581 -4.328 1.00 0.44 H new ATOM 0 HG13 ILE A 5 4.038 -2.776 -4.086 1.00 0.44 H new ATOM 0 HG21 ILE A 5 4.170 -0.700 -2.711 1.00 0.53 H new ATOM 0 HG22 ILE A 5 2.688 0.012 -2.028 1.00 0.53 H new ATOM 0 HG23 ILE A 5 3.363 -1.479 -1.329 1.00 0.53 H new ATOM 0 HD11 ILE A 5 3.914 -4.841 -2.779 1.00 0.95 H new ATOM 0 HD12 ILE A 5 4.019 -3.428 -1.703 1.00 0.95 H new ATOM 0 HD13 ILE A 5 2.457 -4.245 -1.949 1.00 0.95 H new ATOM 83 N ALA A 6 0.518 -0.146 -1.220 1.00 0.40 N ATOM 84 CA ALA A 6 -0.104 1.125 -0.870 1.00 0.44 C ATOM 85 C ALA A 6 0.954 2.108 -0.382 1.00 0.42 C ATOM 86 O ALA A 6 1.612 1.868 0.632 1.00 0.58 O ATOM 87 CB ALA A 6 -1.171 0.918 0.191 1.00 0.53 C ATOM 0 H ALA A 6 1.173 -0.498 -0.522 1.00 0.40 H new ATOM 0 HA ALA A 6 -0.581 1.539 -1.758 1.00 0.44 H new ATOM 0 HB1 ALA A 6 -1.626 1.876 0.441 1.00 0.53 H new ATOM 0 HB2 ALA A 6 -1.936 0.242 -0.190 1.00 0.53 H new ATOM 0 HB3 ALA A 6 -0.718 0.487 1.084 1.00 0.53 H new ATOM 93 N ILE A 7 1.128 3.204 -1.114 1.00 0.41 N ATOM 94 CA ILE A 7 2.126 4.203 -0.750 1.00 0.40 C ATOM 95 C ILE A 7 1.498 5.382 -0.022 1.00 0.44 C ATOM 96 O ILE A 7 0.406 5.833 -0.369 1.00 0.52 O ATOM 97 CB ILE A 7 2.893 4.736 -1.983 1.00 0.50 C ATOM 98 CG1 ILE A 7 3.552 3.589 -2.759 1.00 0.65 C ATOM 99 CG2 ILE A 7 3.944 5.750 -1.551 1.00 0.53 C ATOM 100 CD1 ILE A 7 2.575 2.717 -3.519 1.00 0.99 C ATOM 0 H ILE A 7 0.595 3.422 -1.956 1.00 0.41 H new ATOM 0 HA ILE A 7 2.827 3.696 -0.087 1.00 0.40 H new ATOM 0 HB ILE A 7 2.177 5.226 -2.643 1.00 0.50 H new ATOM 0 HG12 ILE A 7 4.273 4.007 -3.462 1.00 0.65 H new ATOM 0 HG13 ILE A 7 4.112 2.966 -2.061 1.00 0.65 H new ATOM 0 HG21 ILE A 7 4.477 6.118 -2.428 1.00 0.53 H new ATOM 0 HG22 ILE A 7 3.458 6.585 -1.045 1.00 0.53 H new ATOM 0 HG23 ILE A 7 4.650 5.275 -0.870 1.00 0.53 H new ATOM 0 HD11 ILE A 7 3.119 1.930 -4.041 1.00 0.99 H new ATOM 0 HD12 ILE A 7 1.869 2.268 -2.821 1.00 0.99 H new ATOM 0 HD13 ILE A 7 2.032 3.324 -4.243 1.00 0.99 H new ATOM 112 N GLY A 8 2.208 5.886 0.981 1.00 0.50 N ATOM 113 CA GLY A 8 1.723 7.020 1.740 1.00 0.61 C ATOM 114 C GLY A 8 2.689 8.182 1.694 1.00 0.62 C ATOM 115 O GLY A 8 3.870 7.997 1.401 1.00 0.90 O ATOM 0 H GLY A 8 3.114 5.527 1.282 1.00 0.50 H new ATOM 0 HA2 GLY A 8 0.757 7.335 1.345 1.00 0.61 H new ATOM 0 HA3 GLY A 8 1.562 6.722 2.776 1.00 0.61 H new ATOM 119 N SER A 9 2.193 9.382 1.977 1.00 0.56 N ATOM 120 CA SER A 9 3.031 10.577 1.956 1.00 0.63 C ATOM 121 C SER A 9 2.241 11.811 2.363 1.00 0.66 C ATOM 122 O SER A 9 1.169 12.076 1.821 1.00 0.77 O ATOM 123 CB SER A 9 3.623 10.772 0.563 1.00 0.77 C ATOM 124 OG SER A 9 2.602 10.817 -0.420 1.00 1.58 O ATOM 0 H SER A 9 1.218 9.553 2.223 1.00 0.56 H new ATOM 0 HA SER A 9 3.837 10.439 2.677 1.00 0.63 H new ATOM 0 HB2 SER A 9 4.201 11.696 0.535 1.00 0.77 H new ATOM 0 HB3 SER A 9 4.313 9.958 0.340 1.00 0.77 H new ATOM 0 HG SER A 9 1.785 11.187 -0.026 1.00 1.58 H new ATOM 130 N ASN A 10 2.770 12.564 3.324 1.00 0.69 N ATOM 131 CA ASN A 10 2.091 13.763 3.791 1.00 0.79 C ATOM 132 C ASN A 10 3.053 14.824 4.321 1.00 0.83 C ATOM 133 O ASN A 10 2.818 16.021 4.140 1.00 0.98 O ATOM 134 CB ASN A 10 1.078 13.396 4.874 1.00 0.99 C ATOM 135 CG ASN A 10 1.652 12.473 5.932 1.00 1.05 C ATOM 136 OD1 ASN A 10 2.699 12.750 6.516 1.00 2.01 O ATOM 137 ND2 ASN A 10 0.950 11.377 6.197 1.00 1.01 N ATOM 0 H ASN A 10 3.656 12.366 3.788 1.00 0.69 H new ATOM 0 HA ASN A 10 1.583 14.196 2.929 1.00 0.79 H new ATOM 0 HB2 ASN A 10 0.718 14.307 5.351 1.00 0.99 H new ATOM 0 HB3 ASN A 10 0.216 12.917 4.410 1.00 0.99 H new ATOM 0 HD21 ASN A 10 1.274 10.724 6.911 1.00 1.01 H new ATOM 0 HD22 ASN A 10 0.087 11.188 5.687 1.00 1.01 H new ATOM 144 N LEU A 11 4.119 14.402 4.993 1.00 0.83 N ATOM 145 CA LEU A 11 5.074 15.352 5.559 1.00 0.95 C ATOM 146 C LEU A 11 6.357 15.446 4.732 1.00 0.93 C ATOM 147 O LEU A 11 7.324 16.083 5.151 1.00 1.38 O ATOM 148 CB LEU A 11 5.396 14.977 7.015 1.00 1.12 C ATOM 149 CG LEU A 11 6.003 13.588 7.240 1.00 0.90 C ATOM 150 CD1 LEU A 11 7.451 13.534 6.772 1.00 1.77 C ATOM 151 CD2 LEU A 11 5.906 13.214 8.710 1.00 1.54 C ATOM 0 H LEU A 11 4.343 13.421 5.159 1.00 0.83 H new ATOM 0 HA LEU A 11 4.607 16.337 5.537 1.00 0.95 H new ATOM 0 HB2 LEU A 11 6.085 15.720 7.415 1.00 1.12 H new ATOM 0 HB3 LEU A 11 4.477 15.047 7.598 1.00 1.12 H new ATOM 0 HG LEU A 11 5.437 12.868 6.649 1.00 0.90 H new ATOM 0 HD11 LEU A 11 7.852 12.536 6.945 1.00 1.77 H new ATOM 0 HD12 LEU A 11 7.498 13.764 5.708 1.00 1.77 H new ATOM 0 HD13 LEU A 11 8.040 14.264 7.327 1.00 1.77 H new ATOM 0 HD21 LEU A 11 6.339 12.226 8.863 1.00 1.54 H new ATOM 0 HD22 LEU A 11 6.450 13.945 9.308 1.00 1.54 H new ATOM 0 HD23 LEU A 11 4.859 13.203 9.014 1.00 1.54 H new ATOM 163 N ALA A 12 6.366 14.819 3.561 1.00 0.84 N ATOM 164 CA ALA A 12 7.544 14.849 2.698 1.00 0.91 C ATOM 165 C ALA A 12 7.157 14.876 1.222 1.00 0.95 C ATOM 166 O ALA A 12 7.538 13.992 0.457 1.00 1.72 O ATOM 167 CB ALA A 12 8.440 13.655 2.989 1.00 0.97 C ATOM 0 H ALA A 12 5.579 14.288 3.189 1.00 0.84 H new ATOM 0 HA ALA A 12 8.092 15.766 2.913 1.00 0.91 H new ATOM 0 HB1 ALA A 12 9.314 13.689 2.339 1.00 0.97 H new ATOM 0 HB2 ALA A 12 8.760 13.686 4.030 1.00 0.97 H new ATOM 0 HB3 ALA A 12 7.888 12.733 2.806 1.00 0.97 H new ATOM 173 N SER A 13 6.403 15.898 0.827 1.00 0.81 N ATOM 174 CA SER A 13 5.967 16.038 -0.562 1.00 0.79 C ATOM 175 C SER A 13 5.149 14.819 -0.990 1.00 0.71 C ATOM 176 O SER A 13 5.673 13.894 -1.609 1.00 0.71 O ATOM 177 CB SER A 13 7.173 16.217 -1.485 1.00 0.89 C ATOM 178 OG SER A 13 7.901 17.386 -1.153 1.00 1.47 O ATOM 0 H SER A 13 6.081 16.641 1.447 1.00 0.81 H new ATOM 0 HA SER A 13 5.337 16.924 -0.638 1.00 0.79 H new ATOM 0 HB2 SER A 13 7.824 15.346 -1.410 1.00 0.89 H new ATOM 0 HB3 SER A 13 6.837 16.276 -2.520 1.00 0.89 H new ATOM 0 HG SER A 13 8.710 17.435 -1.704 1.00 1.47 H new ATOM 184 N PRO A 14 3.848 14.803 -0.648 1.00 0.69 N ATOM 185 CA PRO A 14 2.945 13.692 -0.979 1.00 0.66 C ATOM 186 C PRO A 14 2.979 13.297 -2.454 1.00 0.67 C ATOM 187 O PRO A 14 2.738 12.140 -2.798 1.00 0.66 O ATOM 188 CB PRO A 14 1.565 14.237 -0.607 1.00 0.68 C ATOM 189 CG PRO A 14 1.837 15.236 0.462 1.00 0.80 C ATOM 190 CD PRO A 14 3.154 15.864 0.108 1.00 0.78 C ATOM 0 HA PRO A 14 3.228 12.782 -0.449 1.00 0.66 H new ATOM 0 HB2 PRO A 14 1.075 14.697 -1.465 1.00 0.68 H new ATOM 0 HB3 PRO A 14 0.907 13.444 -0.252 1.00 0.68 H new ATOM 0 HG2 PRO A 14 1.046 15.985 0.508 1.00 0.80 H new ATOM 0 HG3 PRO A 14 1.882 14.759 1.441 1.00 0.80 H new ATOM 0 HD2 PRO A 14 3.021 16.764 -0.493 1.00 0.78 H new ATOM 0 HD3 PRO A 14 3.713 16.154 0.998 1.00 0.78 H new ATOM 198 N LEU A 15 3.266 14.260 -3.323 1.00 0.73 N ATOM 199 CA LEU A 15 3.309 14.001 -4.760 1.00 0.78 C ATOM 200 C LEU A 15 4.671 13.469 -5.206 1.00 0.73 C ATOM 201 O LEU A 15 4.771 12.777 -6.220 1.00 0.79 O ATOM 202 CB LEU A 15 2.969 15.281 -5.532 1.00 0.92 C ATOM 203 CG LEU A 15 3.043 15.164 -7.058 1.00 0.98 C ATOM 204 CD1 LEU A 15 2.084 14.100 -7.567 1.00 1.00 C ATOM 205 CD2 LEU A 15 2.743 16.507 -7.707 1.00 1.15 C ATOM 0 H LEU A 15 3.472 15.224 -3.060 1.00 0.73 H new ATOM 0 HA LEU A 15 2.568 13.232 -4.978 1.00 0.78 H new ATOM 0 HB2 LEU A 15 1.962 15.595 -5.257 1.00 0.92 H new ATOM 0 HB3 LEU A 15 3.648 16.071 -5.211 1.00 0.92 H new ATOM 0 HG LEU A 15 4.055 14.865 -7.329 1.00 0.98 H new ATOM 0 HD11 LEU A 15 2.155 14.036 -8.653 1.00 1.00 H new ATOM 0 HD12 LEU A 15 2.344 13.136 -7.129 1.00 1.00 H new ATOM 0 HD13 LEU A 15 1.065 14.364 -7.285 1.00 1.00 H new ATOM 0 HD21 LEU A 15 2.799 16.408 -8.791 1.00 1.15 H new ATOM 0 HD22 LEU A 15 1.742 16.832 -7.424 1.00 1.15 H new ATOM 0 HD23 LEU A 15 3.472 17.244 -7.372 1.00 1.15 H new ATOM 217 N GLU A 16 5.720 13.807 -4.465 1.00 0.71 N ATOM 218 CA GLU A 16 7.070 13.379 -4.807 1.00 0.71 C ATOM 219 C GLU A 16 7.378 11.968 -4.310 1.00 0.63 C ATOM 220 O GLU A 16 8.227 11.276 -4.872 1.00 0.65 O ATOM 221 CB GLU A 16 8.075 14.358 -4.215 1.00 0.81 C ATOM 222 CG GLU A 16 8.042 15.727 -4.870 1.00 0.95 C ATOM 223 CD GLU A 16 9.114 16.657 -4.338 1.00 1.57 C ATOM 224 OE1 GLU A 16 9.891 16.231 -3.458 1.00 2.35 O ATOM 225 OE2 GLU A 16 9.180 17.814 -4.805 1.00 2.01 O ATOM 0 H GLU A 16 5.661 14.378 -3.622 1.00 0.71 H new ATOM 0 HA GLU A 16 7.144 13.364 -5.894 1.00 0.71 H new ATOM 0 HB2 GLU A 16 7.878 14.469 -3.149 1.00 0.81 H new ATOM 0 HB3 GLU A 16 9.077 13.941 -4.312 1.00 0.81 H new ATOM 0 HG2 GLU A 16 8.168 15.613 -5.947 1.00 0.95 H new ATOM 0 HG3 GLU A 16 7.063 16.178 -4.709 1.00 0.95 H new ATOM 232 N GLN A 17 6.704 11.556 -3.245 1.00 0.59 N ATOM 233 CA GLN A 17 6.932 10.237 -2.662 1.00 0.56 C ATOM 234 C GLN A 17 6.308 9.123 -3.497 1.00 0.55 C ATOM 235 O GLN A 17 6.694 7.961 -3.376 1.00 0.61 O ATOM 236 CB GLN A 17 6.366 10.193 -1.245 1.00 0.62 C ATOM 237 CG GLN A 17 6.895 11.301 -0.348 1.00 0.71 C ATOM 238 CD GLN A 17 8.384 11.186 -0.082 1.00 1.20 C ATOM 239 OE1 GLN A 17 9.200 11.305 -0.995 1.00 1.99 O ATOM 240 NE2 GLN A 17 8.743 10.952 1.174 1.00 1.63 N ATOM 0 H GLN A 17 5.996 12.113 -2.767 1.00 0.59 H new ATOM 0 HA GLN A 17 8.009 10.071 -2.641 1.00 0.56 H new ATOM 0 HB2 GLN A 17 5.279 10.263 -1.294 1.00 0.62 H new ATOM 0 HB3 GLN A 17 6.604 9.228 -0.797 1.00 0.62 H new ATOM 0 HG2 GLN A 17 6.687 12.266 -0.810 1.00 0.71 H new ATOM 0 HG3 GLN A 17 6.359 11.280 0.601 1.00 0.71 H new ATOM 0 HE21 GLN A 17 8.032 10.861 1.899 1.00 1.63 H new ATOM 0 HE22 GLN A 17 9.730 10.864 1.414 1.00 1.63 H new ATOM 249 N VAL A 18 5.336 9.474 -4.334 1.00 0.56 N ATOM 250 CA VAL A 18 4.661 8.486 -5.167 1.00 0.62 C ATOM 251 C VAL A 18 5.405 8.242 -6.479 1.00 0.60 C ATOM 252 O VAL A 18 5.400 7.128 -7.001 1.00 0.64 O ATOM 253 CB VAL A 18 3.215 8.909 -5.479 1.00 0.76 C ATOM 254 CG1 VAL A 18 2.503 7.834 -6.286 1.00 0.82 C ATOM 255 CG2 VAL A 18 2.458 9.206 -4.191 1.00 0.83 C ATOM 0 H VAL A 18 5.000 10.430 -4.453 1.00 0.56 H new ATOM 0 HA VAL A 18 4.649 7.559 -4.594 1.00 0.62 H new ATOM 0 HB VAL A 18 3.244 9.819 -6.078 1.00 0.76 H new ATOM 0 HG11 VAL A 18 1.482 8.153 -6.496 1.00 0.82 H new ATOM 0 HG12 VAL A 18 3.033 7.673 -7.225 1.00 0.82 H new ATOM 0 HG13 VAL A 18 2.483 6.905 -5.716 1.00 0.82 H new ATOM 0 HG21 VAL A 18 1.437 9.504 -4.429 1.00 0.83 H new ATOM 0 HG22 VAL A 18 2.439 8.313 -3.566 1.00 0.83 H new ATOM 0 HG23 VAL A 18 2.956 10.014 -3.655 1.00 0.83 H new ATOM 265 N ASN A 19 6.032 9.287 -7.016 1.00 0.60 N ATOM 266 CA ASN A 19 6.765 9.172 -8.274 1.00 0.64 C ATOM 267 C ASN A 19 7.785 8.036 -8.228 1.00 0.56 C ATOM 268 O ASN A 19 7.766 7.140 -9.070 1.00 0.63 O ATOM 269 CB ASN A 19 7.474 10.485 -8.610 1.00 0.72 C ATOM 270 CG ASN A 19 6.506 11.634 -8.817 1.00 0.82 C ATOM 271 OD1 ASN A 19 5.572 11.539 -9.611 1.00 0.92 O ATOM 272 ND2 ASN A 19 6.738 12.734 -8.112 1.00 0.84 N ATOM 0 H ASN A 19 6.047 10.219 -6.601 1.00 0.60 H new ATOM 0 HA ASN A 19 6.036 8.948 -9.052 1.00 0.64 H new ATOM 0 HB2 ASN A 19 8.165 10.737 -7.805 1.00 0.72 H new ATOM 0 HB3 ASN A 19 8.071 10.351 -9.512 1.00 0.72 H new ATOM 0 HD21 ASN A 19 6.129 13.545 -8.218 1.00 0.84 H new ATOM 0 HD22 ASN A 19 7.525 12.768 -7.464 1.00 0.84 H new ATOM 279 N ALA A 20 8.679 8.088 -7.247 1.00 0.47 N ATOM 280 CA ALA A 20 9.714 7.069 -7.098 1.00 0.42 C ATOM 281 C ALA A 20 9.156 5.779 -6.508 1.00 0.35 C ATOM 282 O ALA A 20 9.766 4.718 -6.632 1.00 0.36 O ATOM 283 CB ALA A 20 10.852 7.597 -6.237 1.00 0.43 C ATOM 0 H ALA A 20 8.709 8.825 -6.542 1.00 0.47 H new ATOM 0 HA ALA A 20 10.096 6.837 -8.092 1.00 0.42 H new ATOM 0 HB1 ALA A 20 11.617 6.828 -6.134 1.00 0.43 H new ATOM 0 HB2 ALA A 20 11.286 8.479 -6.708 1.00 0.43 H new ATOM 0 HB3 ALA A 20 10.469 7.863 -5.252 1.00 0.43 H new ATOM 289 N ALA A 21 8.002 5.874 -5.857 1.00 0.36 N ATOM 290 CA ALA A 21 7.374 4.709 -5.242 1.00 0.39 C ATOM 291 C ALA A 21 6.873 3.718 -6.291 1.00 0.41 C ATOM 292 O ALA A 21 7.125 2.517 -6.192 1.00 0.44 O ATOM 293 CB ALA A 21 6.231 5.145 -4.339 1.00 0.46 C ATOM 0 H ALA A 21 7.482 6.744 -5.741 1.00 0.36 H new ATOM 0 HA ALA A 21 8.130 4.201 -4.643 1.00 0.39 H new ATOM 0 HB1 ALA A 21 5.770 4.267 -3.886 1.00 0.46 H new ATOM 0 HB2 ALA A 21 6.615 5.798 -3.556 1.00 0.46 H new ATOM 0 HB3 ALA A 21 5.487 5.682 -4.927 1.00 0.46 H new ATOM 299 N LEU A 22 6.153 4.227 -7.286 1.00 0.47 N ATOM 300 CA LEU A 22 5.607 3.381 -8.344 1.00 0.53 C ATOM 301 C LEU A 22 6.635 3.118 -9.441 1.00 0.50 C ATOM 302 O LEU A 22 6.463 2.217 -10.263 1.00 0.64 O ATOM 303 CB LEU A 22 4.341 4.019 -8.935 1.00 0.70 C ATOM 304 CG LEU A 22 4.487 5.467 -9.425 1.00 0.81 C ATOM 305 CD1 LEU A 22 5.305 5.535 -10.707 1.00 1.28 C ATOM 306 CD2 LEU A 22 3.117 6.095 -9.635 1.00 1.35 C ATOM 0 H LEU A 22 5.934 5.219 -7.383 1.00 0.47 H new ATOM 0 HA LEU A 22 5.346 2.420 -7.901 1.00 0.53 H new ATOM 0 HB2 LEU A 22 4.004 3.405 -9.770 1.00 0.70 H new ATOM 0 HB3 LEU A 22 3.556 3.989 -8.180 1.00 0.70 H new ATOM 0 HG LEU A 22 5.018 6.030 -8.658 1.00 0.81 H new ATOM 0 HD11 LEU A 22 5.391 6.573 -11.029 1.00 1.28 H new ATOM 0 HD12 LEU A 22 6.300 5.128 -10.526 1.00 1.28 H new ATOM 0 HD13 LEU A 22 4.811 4.953 -11.485 1.00 1.28 H new ATOM 0 HD21 LEU A 22 3.237 7.121 -9.982 1.00 1.35 H new ATOM 0 HD22 LEU A 22 2.564 5.522 -10.380 1.00 1.35 H new ATOM 0 HD23 LEU A 22 2.567 6.092 -8.694 1.00 1.35 H new ATOM 318 N LYS A 23 7.694 3.918 -9.459 1.00 0.45 N ATOM 319 CA LYS A 23 8.741 3.783 -10.466 1.00 0.49 C ATOM 320 C LYS A 23 9.787 2.752 -10.041 1.00 0.43 C ATOM 321 O LYS A 23 10.136 1.854 -10.808 1.00 0.51 O ATOM 322 CB LYS A 23 9.401 5.146 -10.701 1.00 0.56 C ATOM 323 CG LYS A 23 10.237 5.238 -11.971 1.00 0.93 C ATOM 324 CD LYS A 23 11.517 4.424 -11.883 1.00 1.62 C ATOM 325 CE LYS A 23 12.324 4.510 -13.167 1.00 2.52 C ATOM 326 NZ LYS A 23 11.566 3.982 -14.334 1.00 3.23 N ATOM 0 H LYS A 23 7.851 4.669 -8.787 1.00 0.45 H new ATOM 0 HA LYS A 23 8.289 3.433 -11.394 1.00 0.49 H new ATOM 0 HB2 LYS A 23 8.624 5.909 -10.738 1.00 0.56 H new ATOM 0 HB3 LYS A 23 10.036 5.379 -9.846 1.00 0.56 H new ATOM 0 HG2 LYS A 23 9.646 4.890 -12.818 1.00 0.93 H new ATOM 0 HG3 LYS A 23 10.486 6.282 -12.164 1.00 0.93 H new ATOM 0 HD2 LYS A 23 12.120 4.782 -11.049 1.00 1.62 H new ATOM 0 HD3 LYS A 23 11.273 3.382 -11.675 1.00 1.62 H new ATOM 0 HE2 LYS A 23 12.601 5.548 -13.353 1.00 2.52 H new ATOM 0 HE3 LYS A 23 13.251 3.948 -13.052 1.00 2.52 H new ATOM 0 HZ1 LYS A 23 12.216 3.836 -15.133 1.00 3.23 H new ATOM 0 HZ2 LYS A 23 11.122 3.077 -14.079 1.00 3.23 H new ATOM 0 HZ3 LYS A 23 10.830 4.664 -14.607 1.00 3.23 H new ATOM 340 N ALA A 24 10.295 2.902 -8.823 1.00 0.37 N ATOM 341 CA ALA A 24 11.319 2.003 -8.296 1.00 0.41 C ATOM 342 C ALA A 24 10.872 0.542 -8.299 1.00 0.41 C ATOM 343 O ALA A 24 11.705 -0.364 -8.332 1.00 0.43 O ATOM 344 CB ALA A 24 11.713 2.428 -6.890 1.00 0.46 C ATOM 0 H ALA A 24 10.014 3.641 -8.178 1.00 0.37 H new ATOM 0 HA ALA A 24 12.183 2.075 -8.957 1.00 0.41 H new ATOM 0 HB1 ALA A 24 12.477 1.752 -6.506 1.00 0.46 H new ATOM 0 HB2 ALA A 24 12.107 3.444 -6.914 1.00 0.46 H new ATOM 0 HB3 ALA A 24 10.838 2.393 -6.241 1.00 0.46 H new ATOM 350 N LEU A 25 9.562 0.311 -8.262 1.00 0.43 N ATOM 351 CA LEU A 25 9.039 -1.052 -8.258 1.00 0.48 C ATOM 352 C LEU A 25 9.268 -1.704 -9.609 1.00 0.49 C ATOM 353 O LEU A 25 9.605 -2.884 -9.697 1.00 0.57 O ATOM 354 CB LEU A 25 7.550 -1.045 -7.895 1.00 0.53 C ATOM 355 CG LEU A 25 6.589 -0.485 -8.949 1.00 0.70 C ATOM 356 CD1 LEU A 25 6.283 -1.522 -10.017 1.00 0.95 C ATOM 357 CD2 LEU A 25 5.303 -0.010 -8.289 1.00 1.00 C ATOM 0 H LEU A 25 8.850 1.041 -8.235 1.00 0.43 H new ATOM 0 HA LEU A 25 9.569 -1.635 -7.505 1.00 0.48 H new ATOM 0 HB2 LEU A 25 7.250 -2.068 -7.670 1.00 0.53 H new ATOM 0 HB3 LEU A 25 7.425 -0.467 -6.979 1.00 0.53 H new ATOM 0 HG LEU A 25 7.073 0.364 -9.432 1.00 0.70 H new ATOM 0 HD11 LEU A 25 5.599 -1.097 -10.751 1.00 0.95 H new ATOM 0 HD12 LEU A 25 7.208 -1.819 -10.512 1.00 0.95 H new ATOM 0 HD13 LEU A 25 5.822 -2.395 -9.555 1.00 0.95 H new ATOM 0 HD21 LEU A 25 4.629 0.386 -9.049 1.00 1.00 H new ATOM 0 HD22 LEU A 25 4.825 -0.847 -7.780 1.00 1.00 H new ATOM 0 HD23 LEU A 25 5.533 0.772 -7.565 1.00 1.00 H new ATOM 369 N GLY A 26 9.085 -0.915 -10.654 1.00 0.47 N ATOM 370 CA GLY A 26 9.279 -1.410 -12.006 1.00 0.53 C ATOM 371 C GLY A 26 10.686 -1.931 -12.224 1.00 0.50 C ATOM 372 O GLY A 26 10.948 -2.650 -13.188 1.00 0.64 O ATOM 0 H GLY A 26 8.804 0.064 -10.594 1.00 0.47 H new ATOM 0 HA2 GLY A 26 8.562 -2.206 -12.207 1.00 0.53 H new ATOM 0 HA3 GLY A 26 9.074 -0.610 -12.718 1.00 0.53 H new ATOM 376 N ASP A 27 11.592 -1.569 -11.319 1.00 0.43 N ATOM 377 CA ASP A 27 12.981 -2.001 -11.402 1.00 0.46 C ATOM 378 C ASP A 27 13.228 -3.181 -10.468 1.00 0.41 C ATOM 379 O ASP A 27 14.175 -3.945 -10.652 1.00 0.56 O ATOM 380 CB ASP A 27 13.917 -0.841 -11.045 1.00 0.59 C ATOM 381 CG ASP A 27 15.378 -1.165 -11.291 1.00 1.05 C ATOM 382 OD1 ASP A 27 15.668 -2.256 -11.824 1.00 1.50 O ATOM 383 OD2 ASP A 27 16.235 -0.320 -10.958 1.00 1.48 O ATOM 0 H ASP A 27 11.386 -0.974 -10.516 1.00 0.43 H new ATOM 0 HA ASP A 27 13.186 -2.318 -12.425 1.00 0.46 H new ATOM 0 HB2 ASP A 27 13.641 0.036 -11.631 1.00 0.59 H new ATOM 0 HB3 ASP A 27 13.780 -0.579 -9.996 1.00 0.59 H new ATOM 388 N ILE A 28 12.366 -3.320 -9.461 1.00 0.37 N ATOM 389 CA ILE A 28 12.481 -4.406 -8.493 1.00 0.36 C ATOM 390 C ILE A 28 12.640 -5.756 -9.190 1.00 0.42 C ATOM 391 O ILE A 28 11.944 -6.044 -10.165 1.00 0.47 O ATOM 392 CB ILE A 28 11.251 -4.457 -7.558 1.00 0.41 C ATOM 393 CG1 ILE A 28 11.195 -3.197 -6.689 1.00 0.45 C ATOM 394 CG2 ILE A 28 11.283 -5.708 -6.686 1.00 0.47 C ATOM 395 CD1 ILE A 28 10.023 -3.165 -5.730 1.00 1.27 C ATOM 0 H ILE A 28 11.580 -2.692 -9.296 1.00 0.37 H new ATOM 0 HA ILE A 28 13.372 -4.206 -7.898 1.00 0.36 H new ATOM 0 HB ILE A 28 10.352 -4.498 -8.173 1.00 0.41 H new ATOM 0 HG12 ILE A 28 12.121 -3.119 -6.119 1.00 0.45 H new ATOM 0 HG13 ILE A 28 11.145 -2.322 -7.337 1.00 0.45 H new ATOM 0 HG21 ILE A 28 10.408 -5.721 -6.037 1.00 0.47 H new ATOM 0 HG22 ILE A 28 11.278 -6.594 -7.321 1.00 0.47 H new ATOM 0 HG23 ILE A 28 12.187 -5.704 -6.076 1.00 0.47 H new ATOM 0 HD11 ILE A 28 10.052 -2.243 -5.150 1.00 1.27 H new ATOM 0 HD12 ILE A 28 9.091 -3.210 -6.293 1.00 1.27 H new ATOM 0 HD13 ILE A 28 10.081 -4.019 -5.056 1.00 1.27 H new ATOM 407 N PRO A 29 13.555 -6.607 -8.691 1.00 0.49 N ATOM 408 CA PRO A 29 13.795 -7.934 -9.264 1.00 0.65 C ATOM 409 C PRO A 29 12.525 -8.773 -9.292 1.00 0.73 C ATOM 410 O PRO A 29 11.866 -8.947 -8.265 1.00 0.77 O ATOM 411 CB PRO A 29 14.833 -8.563 -8.323 1.00 0.75 C ATOM 412 CG PRO A 29 14.793 -7.733 -7.086 1.00 0.74 C ATOM 413 CD PRO A 29 14.417 -6.351 -7.529 1.00 0.51 C ATOM 0 HA PRO A 29 14.133 -7.876 -10.299 1.00 0.65 H new ATOM 0 HB2 PRO A 29 14.589 -9.603 -8.107 1.00 0.75 H new ATOM 0 HB3 PRO A 29 15.827 -8.555 -8.771 1.00 0.75 H new ATOM 0 HG2 PRO A 29 14.066 -8.126 -6.375 1.00 0.74 H new ATOM 0 HG3 PRO A 29 15.761 -7.732 -6.585 1.00 0.74 H new ATOM 0 HD2 PRO A 29 13.890 -5.804 -6.747 1.00 0.51 H new ATOM 0 HD3 PRO A 29 15.292 -5.760 -7.797 1.00 0.51 H new ATOM 421 N GLU A 30 12.181 -9.277 -10.471 1.00 0.83 N ATOM 422 CA GLU A 30 10.978 -10.086 -10.631 1.00 0.95 C ATOM 423 C GLU A 30 9.755 -9.298 -10.195 1.00 0.84 C ATOM 424 O GLU A 30 9.002 -9.727 -9.323 1.00 1.18 O ATOM 425 CB GLU A 30 11.092 -11.380 -9.830 1.00 1.17 C ATOM 426 CG GLU A 30 12.300 -12.207 -10.214 1.00 1.47 C ATOM 427 CD GLU A 30 12.285 -13.591 -9.590 1.00 2.16 C ATOM 428 OE1 GLU A 30 11.324 -14.346 -9.843 1.00 2.84 O ATOM 429 OE2 GLU A 30 13.236 -13.916 -8.847 1.00 2.65 O ATOM 0 H GLU A 30 12.716 -9.141 -11.329 1.00 0.83 H new ATOM 0 HA GLU A 30 10.870 -10.344 -11.685 1.00 0.95 H new ATOM 0 HB2 GLU A 30 11.145 -11.140 -8.768 1.00 1.17 H new ATOM 0 HB3 GLU A 30 10.190 -11.974 -9.978 1.00 1.17 H new ATOM 0 HG2 GLU A 30 12.340 -12.303 -11.299 1.00 1.47 H new ATOM 0 HG3 GLU A 30 13.206 -11.684 -9.907 1.00 1.47 H new ATOM 436 N SER A 31 9.572 -8.139 -10.809 1.00 0.60 N ATOM 437 CA SER A 31 8.448 -7.265 -10.499 1.00 0.54 C ATOM 438 C SER A 31 8.188 -6.311 -11.656 1.00 0.47 C ATOM 439 O SER A 31 9.059 -5.531 -12.035 1.00 0.59 O ATOM 440 CB SER A 31 8.724 -6.468 -9.222 1.00 0.57 C ATOM 441 OG SER A 31 8.926 -7.329 -8.115 1.00 1.37 O ATOM 0 H SER A 31 10.194 -7.778 -11.532 1.00 0.60 H new ATOM 0 HA SER A 31 7.565 -7.884 -10.342 1.00 0.54 H new ATOM 0 HB2 SER A 31 9.604 -5.841 -9.364 1.00 0.57 H new ATOM 0 HB3 SER A 31 7.887 -5.800 -9.019 1.00 0.57 H new ATOM 0 HG SER A 31 8.367 -8.128 -8.215 1.00 1.37 H new ATOM 447 N HIS A 32 6.984 -6.382 -12.210 1.00 0.38 N ATOM 448 CA HIS A 32 6.609 -5.526 -13.336 1.00 0.42 C ATOM 449 C HIS A 32 5.203 -4.966 -13.171 1.00 0.39 C ATOM 450 O HIS A 32 4.219 -5.684 -13.337 1.00 0.39 O ATOM 451 CB HIS A 32 6.692 -6.306 -14.651 1.00 0.52 C ATOM 452 CG HIS A 32 8.056 -6.332 -15.275 1.00 1.10 C ATOM 453 ND1 HIS A 32 8.341 -7.050 -16.417 1.00 1.90 N ATOM 454 CD2 HIS A 32 9.210 -5.712 -14.926 1.00 1.90 C ATOM 455 CE1 HIS A 32 9.609 -6.872 -16.744 1.00 2.46 C ATOM 456 NE2 HIS A 32 10.158 -6.065 -15.856 1.00 2.42 N ATOM 0 H HIS A 32 6.251 -7.020 -11.902 1.00 0.38 H new ATOM 0 HA HIS A 32 7.312 -4.693 -13.358 1.00 0.42 H new ATOM 0 HB2 HIS A 32 6.369 -7.331 -14.471 1.00 0.52 H new ATOM 0 HB3 HIS A 32 5.990 -5.871 -15.362 1.00 0.52 H new ATOM 0 HD2 HIS A 32 9.357 -5.062 -14.076 1.00 1.90 H new ATOM 0 HE1 HIS A 32 10.110 -7.312 -17.593 1.00 2.46 H new ATOM 0 HE2 HIS A 32 11.129 -5.754 -15.859 1.00 2.42 H new ATOM 465 N ILE A 33 5.115 -3.679 -12.843 1.00 0.42 N ATOM 466 CA ILE A 33 3.835 -3.025 -12.662 1.00 0.42 C ATOM 467 C ILE A 33 2.910 -3.291 -13.849 1.00 0.41 C ATOM 468 O ILE A 33 3.363 -3.425 -14.985 1.00 0.48 O ATOM 469 CB ILE A 33 4.022 -1.506 -12.470 1.00 0.51 C ATOM 470 CG1 ILE A 33 3.065 -1.012 -11.397 1.00 0.61 C ATOM 471 CG2 ILE A 33 3.811 -0.751 -13.778 1.00 0.79 C ATOM 472 CD1 ILE A 33 3.167 0.473 -11.115 1.00 0.70 C ATOM 0 H ILE A 33 5.922 -3.072 -12.698 1.00 0.42 H new ATOM 0 HA ILE A 33 3.374 -3.440 -11.765 1.00 0.42 H new ATOM 0 HB ILE A 33 5.047 -1.316 -12.151 1.00 0.51 H new ATOM 0 HG12 ILE A 33 2.044 -1.244 -11.701 1.00 0.61 H new ATOM 0 HG13 ILE A 33 3.256 -1.560 -10.474 1.00 0.61 H new ATOM 0 HG21 ILE A 33 3.950 0.317 -13.608 1.00 0.79 H new ATOM 0 HG22 ILE A 33 4.532 -1.098 -14.519 1.00 0.79 H new ATOM 0 HG23 ILE A 33 2.800 -0.932 -14.143 1.00 0.79 H new ATOM 0 HD11 ILE A 33 2.452 0.746 -10.339 1.00 0.70 H new ATOM 0 HD12 ILE A 33 4.176 0.711 -10.779 1.00 0.70 H new ATOM 0 HD13 ILE A 33 2.946 1.032 -12.024 1.00 0.70 H new ATOM 484 N LEU A 34 1.614 -3.371 -13.573 1.00 0.39 N ATOM 485 CA LEU A 34 0.627 -3.624 -14.614 1.00 0.40 C ATOM 486 C LEU A 34 -0.378 -2.475 -14.683 1.00 0.37 C ATOM 487 O LEU A 34 -0.709 -1.991 -15.764 1.00 0.50 O ATOM 488 CB LEU A 34 -0.082 -4.956 -14.344 1.00 0.43 C ATOM 489 CG LEU A 34 -0.809 -5.577 -15.542 1.00 0.66 C ATOM 490 CD1 LEU A 34 -1.144 -7.034 -15.259 1.00 1.42 C ATOM 491 CD2 LEU A 34 -2.075 -4.805 -15.871 1.00 1.39 C ATOM 0 H LEU A 34 1.223 -3.264 -12.637 1.00 0.39 H new ATOM 0 HA LEU A 34 1.132 -3.689 -15.578 1.00 0.40 H new ATOM 0 HB2 LEU A 34 0.655 -5.671 -13.979 1.00 0.43 H new ATOM 0 HB3 LEU A 34 -0.805 -4.806 -13.542 1.00 0.43 H new ATOM 0 HG LEU A 34 -0.144 -5.526 -16.404 1.00 0.66 H new ATOM 0 HD11 LEU A 34 -1.660 -7.462 -16.118 1.00 1.42 H new ATOM 0 HD12 LEU A 34 -0.225 -7.589 -15.074 1.00 1.42 H new ATOM 0 HD13 LEU A 34 -1.788 -7.096 -14.382 1.00 1.42 H new ATOM 0 HD21 LEU A 34 -2.571 -5.267 -16.725 1.00 1.39 H new ATOM 0 HD22 LEU A 34 -2.744 -4.820 -15.011 1.00 1.39 H new ATOM 0 HD23 LEU A 34 -1.819 -3.774 -16.114 1.00 1.39 H new ATOM 503 N THR A 35 -0.848 -2.038 -13.516 1.00 0.30 N ATOM 504 CA THR A 35 -1.804 -0.938 -13.437 1.00 0.33 C ATOM 505 C THR A 35 -1.457 0.002 -12.285 1.00 0.34 C ATOM 506 O THR A 35 -0.825 -0.404 -11.309 1.00 0.44 O ATOM 507 CB THR A 35 -3.227 -1.469 -13.259 1.00 0.39 C ATOM 508 OG1 THR A 35 -3.302 -2.340 -12.144 1.00 0.97 O ATOM 509 CG2 THR A 35 -3.742 -2.220 -14.467 1.00 0.93 C ATOM 0 H THR A 35 -0.582 -2.430 -12.613 1.00 0.30 H new ATOM 0 HA THR A 35 -1.749 -0.382 -14.373 1.00 0.33 H new ATOM 0 HB THR A 35 -3.848 -0.586 -13.111 1.00 0.39 H new ATOM 0 HG1 THR A 35 -4.236 -2.594 -11.990 1.00 0.97 H new ATOM 0 HG21 THR A 35 -4.756 -2.569 -14.273 1.00 0.93 H new ATOM 0 HG22 THR A 35 -3.745 -1.558 -15.333 1.00 0.93 H new ATOM 0 HG23 THR A 35 -3.096 -3.075 -14.667 1.00 0.93 H new ATOM 517 N VAL A 36 -1.871 1.259 -12.408 1.00 0.33 N ATOM 518 CA VAL A 36 -1.603 2.259 -11.380 1.00 0.39 C ATOM 519 C VAL A 36 -2.845 3.098 -11.088 1.00 0.36 C ATOM 520 O VAL A 36 -3.586 3.464 -12.001 1.00 0.38 O ATOM 521 CB VAL A 36 -0.445 3.190 -11.797 1.00 0.51 C ATOM 522 CG1 VAL A 36 -0.764 3.892 -13.107 1.00 1.05 C ATOM 523 CG2 VAL A 36 -0.149 4.204 -10.700 1.00 1.21 C ATOM 0 H VAL A 36 -2.394 1.610 -13.210 1.00 0.33 H new ATOM 0 HA VAL A 36 -1.319 1.720 -10.476 1.00 0.39 H new ATOM 0 HB VAL A 36 0.446 2.580 -11.947 1.00 0.51 H new ATOM 0 HG11 VAL A 36 0.066 4.543 -13.382 1.00 1.05 H new ATOM 0 HG12 VAL A 36 -0.917 3.149 -13.890 1.00 1.05 H new ATOM 0 HG13 VAL A 36 -1.669 4.488 -12.990 1.00 1.05 H new ATOM 0 HG21 VAL A 36 0.670 4.851 -11.014 1.00 1.21 H new ATOM 0 HG22 VAL A 36 -1.037 4.808 -10.514 1.00 1.21 H new ATOM 0 HG23 VAL A 36 0.132 3.680 -9.786 1.00 1.21 H new ATOM 533 N SER A 37 -3.067 3.399 -9.812 1.00 0.35 N ATOM 534 CA SER A 37 -4.218 4.196 -9.402 1.00 0.35 C ATOM 535 C SER A 37 -3.886 5.685 -9.438 1.00 0.40 C ATOM 536 O SER A 37 -2.841 6.081 -9.959 1.00 0.72 O ATOM 537 CB SER A 37 -4.666 3.795 -7.992 1.00 0.36 C ATOM 538 OG SER A 37 -3.693 4.152 -7.027 1.00 1.35 O ATOM 0 H SER A 37 -2.465 3.103 -9.044 1.00 0.35 H new ATOM 0 HA SER A 37 -5.031 4.005 -10.102 1.00 0.35 H new ATOM 0 HB2 SER A 37 -5.612 4.281 -7.756 1.00 0.36 H new ATOM 0 HB3 SER A 37 -4.842 2.720 -7.955 1.00 0.36 H new ATOM 0 HG SER A 37 -2.931 3.538 -7.088 1.00 1.35 H new ATOM 544 N SER A 38 -4.771 6.505 -8.880 1.00 0.43 N ATOM 545 CA SER A 38 -4.563 7.947 -8.845 1.00 0.45 C ATOM 546 C SER A 38 -4.079 8.381 -7.467 1.00 0.47 C ATOM 547 O SER A 38 -3.879 7.549 -6.586 1.00 0.70 O ATOM 548 CB SER A 38 -5.857 8.681 -9.202 1.00 0.50 C ATOM 549 OG SER A 38 -6.307 8.323 -10.497 1.00 1.19 O ATOM 0 H SER A 38 -5.640 6.194 -8.446 1.00 0.43 H new ATOM 0 HA SER A 38 -3.800 8.203 -9.581 1.00 0.45 H new ATOM 0 HB2 SER A 38 -6.627 8.444 -8.468 1.00 0.50 H new ATOM 0 HB3 SER A 38 -5.693 9.758 -9.156 1.00 0.50 H new ATOM 0 HG SER A 38 -7.136 8.804 -10.700 1.00 1.19 H new ATOM 555 N PHE A 39 -3.899 9.685 -7.282 1.00 0.38 N ATOM 556 CA PHE A 39 -3.443 10.208 -5.999 1.00 0.43 C ATOM 557 C PHE A 39 -4.627 10.761 -5.219 1.00 0.40 C ATOM 558 O PHE A 39 -5.256 11.733 -5.637 1.00 0.65 O ATOM 559 CB PHE A 39 -2.385 11.304 -6.186 1.00 0.59 C ATOM 560 CG PHE A 39 -1.344 10.992 -7.229 1.00 1.42 C ATOM 561 CD1 PHE A 39 -1.677 10.950 -8.575 1.00 1.93 C ATOM 562 CD2 PHE A 39 -0.030 10.755 -6.862 1.00 2.21 C ATOM 563 CE1 PHE A 39 -0.721 10.674 -9.533 1.00 2.75 C ATOM 564 CE2 PHE A 39 0.932 10.480 -7.816 1.00 3.01 C ATOM 565 CZ PHE A 39 0.585 10.439 -9.153 1.00 3.17 C ATOM 0 H PHE A 39 -4.060 10.394 -7.998 1.00 0.38 H new ATOM 0 HA PHE A 39 -2.986 9.390 -5.442 1.00 0.43 H new ATOM 0 HB2 PHE A 39 -2.886 12.233 -6.457 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -1.886 11.477 -5.232 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -2.697 11.136 -8.878 1.00 1.93 H new ATOM 0 HD2 PHE A 39 0.247 10.785 -5.818 1.00 2.21 H new ATOM 0 HE1 PHE A 39 -0.995 10.642 -10.577 1.00 2.75 H new ATOM 0 HE2 PHE A 39 1.954 10.297 -7.517 1.00 3.01 H new ATOM 0 HZ PHE A 39 1.335 10.223 -9.900 1.00 3.17 H new ATOM 575 N TYR A 40 -4.945 10.124 -4.098 1.00 0.38 N ATOM 576 CA TYR A 40 -6.076 10.549 -3.284 1.00 0.37 C ATOM 577 C TYR A 40 -5.625 11.144 -1.954 1.00 0.40 C ATOM 578 O TYR A 40 -4.858 10.531 -1.213 1.00 0.53 O ATOM 579 CB TYR A 40 -7.019 9.374 -3.029 1.00 0.44 C ATOM 580 CG TYR A 40 -7.536 8.713 -4.291 1.00 0.49 C ATOM 581 CD1 TYR A 40 -6.697 7.951 -5.099 1.00 0.49 C ATOM 582 CD2 TYR A 40 -8.863 8.855 -4.678 1.00 0.59 C ATOM 583 CE1 TYR A 40 -7.167 7.351 -6.251 1.00 0.57 C ATOM 584 CE2 TYR A 40 -9.339 8.258 -5.828 1.00 0.67 C ATOM 585 CZ TYR A 40 -8.488 7.508 -6.610 1.00 0.66 C ATOM 586 OH TYR A 40 -8.959 6.913 -7.758 1.00 0.76 O ATOM 0 H TYR A 40 -4.439 9.317 -3.734 1.00 0.38 H new ATOM 0 HA TYR A 40 -6.602 11.325 -3.840 1.00 0.37 H new ATOM 0 HB2 TYR A 40 -6.499 8.628 -2.427 1.00 0.44 H new ATOM 0 HB3 TYR A 40 -7.867 9.723 -2.440 1.00 0.44 H new ATOM 0 HD1 TYR A 40 -5.661 7.827 -4.820 1.00 0.49 H new ATOM 0 HD2 TYR A 40 -9.534 9.443 -4.069 1.00 0.59 H new ATOM 0 HE1 TYR A 40 -6.503 6.762 -6.867 1.00 0.57 H new ATOM 0 HE2 TYR A 40 -10.374 8.378 -6.113 1.00 0.67 H new ATOM 0 HH TYR A 40 -8.423 6.117 -7.958 1.00 0.76 H new ATOM 596 N ARG A 41 -6.127 12.339 -1.659 1.00 0.43 N ATOM 597 CA ARG A 41 -5.806 13.025 -0.415 1.00 0.50 C ATOM 598 C ARG A 41 -6.729 12.532 0.695 1.00 0.54 C ATOM 599 O ARG A 41 -7.920 12.313 0.468 1.00 0.67 O ATOM 600 CB ARG A 41 -5.959 14.538 -0.596 1.00 0.66 C ATOM 601 CG ARG A 41 -5.433 15.356 0.571 1.00 0.69 C ATOM 602 CD ARG A 41 -5.726 16.838 0.386 1.00 0.94 C ATOM 603 NE ARG A 41 -7.158 17.107 0.287 1.00 1.56 N ATOM 604 CZ ARG A 41 -7.670 18.322 0.110 1.00 2.07 C ATOM 605 NH1 ARG A 41 -6.869 19.375 -0.001 1.00 2.32 N ATOM 606 NH2 ARG A 41 -8.985 18.485 0.042 1.00 2.95 N ATOM 0 H ARG A 41 -6.761 12.854 -2.270 1.00 0.43 H new ATOM 0 HA ARG A 41 -4.773 12.809 -0.142 1.00 0.50 H new ATOM 0 HB2 ARG A 41 -5.436 14.840 -1.503 1.00 0.66 H new ATOM 0 HB3 ARG A 41 -7.013 14.771 -0.744 1.00 0.66 H new ATOM 0 HG2 ARG A 41 -5.889 15.006 1.497 1.00 0.69 H new ATOM 0 HG3 ARG A 41 -4.358 15.205 0.668 1.00 0.69 H new ATOM 0 HD2 ARG A 41 -5.310 17.397 1.224 1.00 0.94 H new ATOM 0 HD3 ARG A 41 -5.227 17.196 -0.515 1.00 0.94 H new ATOM 0 HE ARG A 41 -7.802 16.319 0.358 1.00 1.56 H new ATOM 0 HH11 ARG A 41 -5.857 19.254 0.049 1.00 2.32 H new ATOM 0 HH12 ARG A 41 -7.265 20.305 -0.137 1.00 2.32 H new ATOM 0 HH21 ARG A 41 -9.604 17.678 0.125 1.00 2.95 H new ATOM 0 HH22 ARG A 41 -9.377 19.417 -0.094 1.00 2.95 H new ATOM 620 N THR A 42 -6.179 12.339 1.889 1.00 0.61 N ATOM 621 CA THR A 42 -6.966 11.848 3.018 1.00 0.73 C ATOM 622 C THR A 42 -6.211 12.042 4.332 1.00 0.84 C ATOM 623 O THR A 42 -4.988 12.114 4.338 1.00 1.10 O ATOM 624 CB THR A 42 -7.266 10.359 2.811 1.00 0.81 C ATOM 625 OG1 THR A 42 -8.148 9.868 3.805 1.00 1.30 O ATOM 626 CG2 THR A 42 -6.026 9.493 2.842 1.00 1.28 C ATOM 0 H THR A 42 -5.197 12.514 2.101 1.00 0.61 H new ATOM 0 HA THR A 42 -7.897 12.413 3.071 1.00 0.73 H new ATOM 0 HB THR A 42 -7.719 10.299 1.822 1.00 0.81 H new ATOM 0 HG1 THR A 42 -8.323 8.917 3.647 1.00 1.30 H new ATOM 0 HG21 THR A 42 -6.306 8.451 2.690 1.00 1.28 H new ATOM 0 HG22 THR A 42 -5.344 9.805 2.051 1.00 1.28 H new ATOM 0 HG23 THR A 42 -5.533 9.598 3.808 1.00 1.28 H new ATOM 634 N PRO A 43 -6.927 12.124 5.469 1.00 0.74 N ATOM 635 CA PRO A 43 -6.292 12.294 6.778 1.00 0.86 C ATOM 636 C PRO A 43 -5.626 11.000 7.251 1.00 0.90 C ATOM 637 O PRO A 43 -6.262 9.947 7.276 1.00 0.94 O ATOM 638 CB PRO A 43 -7.462 12.657 7.691 1.00 0.98 C ATOM 639 CG PRO A 43 -8.639 11.995 7.063 1.00 0.87 C ATOM 640 CD PRO A 43 -8.401 12.048 5.579 1.00 0.71 C ATOM 0 HA PRO A 43 -5.501 13.044 6.765 1.00 0.86 H new ATOM 0 HB2 PRO A 43 -7.299 12.298 8.707 1.00 0.98 H new ATOM 0 HB3 PRO A 43 -7.599 13.737 7.752 1.00 0.98 H new ATOM 0 HG2 PRO A 43 -8.736 10.965 7.406 1.00 0.87 H new ATOM 0 HG3 PRO A 43 -9.563 12.508 7.329 1.00 0.87 H new ATOM 0 HD2 PRO A 43 -8.796 11.165 5.077 1.00 0.71 H new ATOM 0 HD3 PRO A 43 -8.883 12.914 5.126 1.00 0.71 H new ATOM 648 N PRO A 44 -4.335 11.056 7.635 1.00 0.98 N ATOM 649 CA PRO A 44 -3.605 9.873 8.104 1.00 1.12 C ATOM 650 C PRO A 44 -4.195 9.327 9.398 1.00 1.19 C ATOM 651 O PRO A 44 -5.298 9.701 9.794 1.00 2.06 O ATOM 652 CB PRO A 44 -2.174 10.380 8.332 1.00 1.28 C ATOM 653 CG PRO A 44 -2.101 11.695 7.627 1.00 1.18 C ATOM 654 CD PRO A 44 -3.493 12.258 7.645 1.00 1.03 C ATOM 0 HA PRO A 44 -3.655 9.052 7.389 1.00 1.12 H new ATOM 0 HB2 PRO A 44 -1.962 10.492 9.395 1.00 1.28 H new ATOM 0 HB3 PRO A 44 -1.441 9.679 7.933 1.00 1.28 H new ATOM 0 HG2 PRO A 44 -1.403 12.367 8.127 1.00 1.18 H new ATOM 0 HG3 PRO A 44 -1.745 11.569 6.604 1.00 1.18 H new ATOM 0 HD2 PRO A 44 -3.670 12.868 8.531 1.00 1.03 H new ATOM 0 HD3 PRO A 44 -3.683 12.891 6.779 1.00 1.03 H new ATOM 662 N LEU A 45 -3.461 8.438 10.057 1.00 0.99 N ATOM 663 CA LEU A 45 -3.930 7.849 11.304 1.00 1.03 C ATOM 664 C LEU A 45 -2.765 7.502 12.221 1.00 1.08 C ATOM 665 O LEU A 45 -2.190 6.420 12.126 1.00 1.32 O ATOM 666 CB LEU A 45 -4.764 6.600 11.019 1.00 1.15 C ATOM 667 CG LEU A 45 -5.318 5.887 12.255 1.00 1.53 C ATOM 668 CD1 LEU A 45 -6.279 6.790 13.013 1.00 1.83 C ATOM 669 CD2 LEU A 45 -6.005 4.590 11.853 1.00 2.21 C ATOM 0 H LEU A 45 -2.545 8.111 9.751 1.00 0.99 H new ATOM 0 HA LEU A 45 -4.553 8.586 11.811 1.00 1.03 H new ATOM 0 HB2 LEU A 45 -5.599 6.880 10.377 1.00 1.15 H new ATOM 0 HB3 LEU A 45 -4.152 5.895 10.457 1.00 1.15 H new ATOM 0 HG LEU A 45 -4.485 5.648 12.917 1.00 1.53 H new ATOM 0 HD11 LEU A 45 -6.660 6.263 13.887 1.00 1.83 H new ATOM 0 HD12 LEU A 45 -5.756 7.691 13.332 1.00 1.83 H new ATOM 0 HD13 LEU A 45 -7.110 7.064 12.363 1.00 1.83 H new ATOM 0 HD21 LEU A 45 -6.394 4.094 12.742 1.00 2.21 H new ATOM 0 HD22 LEU A 45 -6.827 4.810 11.171 1.00 2.21 H new ATOM 0 HD23 LEU A 45 -5.287 3.936 11.357 1.00 2.21 H new ATOM 681 N GLY A 46 -2.430 8.427 13.111 1.00 1.09 N ATOM 682 CA GLY A 46 -1.336 8.204 14.037 1.00 1.18 C ATOM 683 C GLY A 46 -0.578 9.478 14.359 1.00 1.11 C ATOM 684 O GLY A 46 -1.185 10.516 14.621 1.00 1.19 O ATOM 0 H GLY A 46 -2.897 9.329 13.208 1.00 1.09 H new ATOM 0 HA2 GLY A 46 -1.727 7.775 14.959 1.00 1.18 H new ATOM 0 HA3 GLY A 46 -0.648 7.473 13.612 1.00 1.18 H new ATOM 688 N PRO A 47 0.766 9.428 14.363 1.00 1.12 N ATOM 689 CA PRO A 47 1.608 10.574 14.671 1.00 1.16 C ATOM 690 C PRO A 47 2.106 11.319 13.429 1.00 1.14 C ATOM 691 O PRO A 47 1.381 11.467 12.456 1.00 1.99 O ATOM 692 CB PRO A 47 2.770 9.905 15.389 1.00 1.36 C ATOM 693 CG PRO A 47 2.920 8.573 14.723 1.00 1.39 C ATOM 694 CD PRO A 47 1.585 8.237 14.092 1.00 1.26 C ATOM 0 HA PRO A 47 1.081 11.340 15.240 1.00 1.16 H new ATOM 0 HB2 PRO A 47 3.682 10.496 15.300 1.00 1.36 H new ATOM 0 HB3 PRO A 47 2.565 9.793 16.454 1.00 1.36 H new ATOM 0 HG2 PRO A 47 3.705 8.606 13.968 1.00 1.39 H new ATOM 0 HG3 PRO A 47 3.206 7.810 15.447 1.00 1.39 H new ATOM 0 HD2 PRO A 47 1.682 8.052 13.022 1.00 1.26 H new ATOM 0 HD3 PRO A 47 1.148 7.341 14.532 1.00 1.26 H new ATOM 702 N GLN A 48 3.353 11.784 13.495 1.00 0.95 N ATOM 703 CA GLN A 48 4.003 12.527 12.410 1.00 0.84 C ATOM 704 C GLN A 48 3.456 13.953 12.296 1.00 0.90 C ATOM 705 O GLN A 48 4.232 14.901 12.170 1.00 1.04 O ATOM 706 CB GLN A 48 3.888 11.781 11.072 1.00 0.83 C ATOM 707 CG GLN A 48 2.873 12.371 10.108 1.00 1.00 C ATOM 708 CD GLN A 48 2.071 11.306 9.413 1.00 1.29 C ATOM 709 OE1 GLN A 48 2.502 10.739 8.411 1.00 2.23 O ATOM 710 NE2 GLN A 48 0.899 11.013 9.958 1.00 1.15 N ATOM 0 H GLN A 48 3.950 11.655 14.312 1.00 0.95 H new ATOM 0 HA GLN A 48 5.062 12.601 12.659 1.00 0.84 H new ATOM 0 HB2 GLN A 48 4.866 11.772 10.590 1.00 0.83 H new ATOM 0 HB3 GLN A 48 3.621 10.743 11.271 1.00 0.83 H new ATOM 0 HG2 GLN A 48 2.200 13.035 10.651 1.00 1.00 H new ATOM 0 HG3 GLN A 48 3.389 12.979 9.365 1.00 1.00 H new ATOM 0 HE21 GLN A 48 0.585 11.512 10.790 1.00 1.15 H new ATOM 0 HE22 GLN A 48 0.311 10.289 9.545 1.00 1.15 H new ATOM 719 N ASP A 49 2.121 14.085 12.349 1.00 0.99 N ATOM 720 CA ASP A 49 1.422 15.377 12.253 1.00 1.16 C ATOM 721 C ASP A 49 0.046 15.172 11.626 1.00 1.20 C ATOM 722 O ASP A 49 -0.870 15.970 11.828 1.00 1.33 O ATOM 723 CB ASP A 49 2.202 16.396 11.416 1.00 1.28 C ATOM 724 CG ASP A 49 1.492 17.733 11.322 1.00 1.51 C ATOM 725 OD1 ASP A 49 1.264 18.360 12.377 1.00 1.81 O ATOM 726 OD2 ASP A 49 1.163 18.152 10.191 1.00 1.70 O ATOM 0 H ASP A 49 1.491 13.291 12.461 1.00 0.99 H new ATOM 0 HA ASP A 49 1.329 15.771 13.265 1.00 1.16 H new ATOM 0 HB2 ASP A 49 3.189 16.542 11.854 1.00 1.28 H new ATOM 0 HB3 ASP A 49 2.354 15.997 10.413 1.00 1.28 H new ATOM 731 N GLN A 50 -0.078 14.090 10.861 1.00 1.19 N ATOM 732 CA GLN A 50 -1.324 13.743 10.181 1.00 1.31 C ATOM 733 C GLN A 50 -1.705 14.785 9.124 1.00 1.33 C ATOM 734 O GLN A 50 -2.833 15.281 9.113 1.00 1.40 O ATOM 735 CB GLN A 50 -2.457 13.603 11.190 1.00 1.42 C ATOM 736 CG GLN A 50 -2.144 12.654 12.334 1.00 1.67 C ATOM 737 CD GLN A 50 -2.236 11.198 11.928 1.00 1.43 C ATOM 738 OE1 GLN A 50 -3.324 10.683 11.680 1.00 2.03 O ATOM 739 NE2 GLN A 50 -1.091 10.535 11.839 1.00 1.24 N ATOM 0 H GLN A 50 0.681 13.430 10.695 1.00 1.19 H new ATOM 0 HA GLN A 50 -1.163 12.791 9.676 1.00 1.31 H new ATOM 0 HB2 GLN A 50 -2.691 14.586 11.599 1.00 1.42 H new ATOM 0 HB3 GLN A 50 -3.350 13.252 10.673 1.00 1.42 H new ATOM 0 HG2 GLN A 50 -1.141 12.860 12.707 1.00 1.67 H new ATOM 0 HG3 GLN A 50 -2.835 12.842 13.156 1.00 1.67 H new ATOM 0 HE21 GLN A 50 -0.212 11.005 12.055 1.00 1.24 H new ATOM 0 HE22 GLN A 50 -1.090 9.555 11.555 1.00 1.24 H new ATOM 748 N PRO A 51 -0.775 15.126 8.213 1.00 1.35 N ATOM 749 CA PRO A 51 -1.026 16.103 7.146 1.00 1.46 C ATOM 750 C PRO A 51 -1.974 15.552 6.080 1.00 1.54 C ATOM 751 O PRO A 51 -2.879 14.781 6.388 1.00 2.26 O ATOM 752 CB PRO A 51 0.372 16.361 6.553 1.00 1.52 C ATOM 753 CG PRO A 51 1.331 15.721 7.502 1.00 1.53 C ATOM 754 CD PRO A 51 0.585 14.593 8.138 1.00 1.37 C ATOM 0 HA PRO A 51 -1.509 17.006 7.520 1.00 1.46 H new ATOM 0 HB2 PRO A 51 0.461 15.931 5.555 1.00 1.52 H new ATOM 0 HB3 PRO A 51 0.567 17.429 6.458 1.00 1.52 H new ATOM 0 HG2 PRO A 51 2.216 15.358 6.978 1.00 1.53 H new ATOM 0 HG3 PRO A 51 1.674 16.434 8.251 1.00 1.53 H new ATOM 0 HD2 PRO A 51 0.634 13.684 7.539 1.00 1.37 H new ATOM 0 HD3 PRO A 51 0.981 14.347 9.123 1.00 1.37 H new ATOM 762 N ASP A 52 -1.765 15.947 4.827 1.00 1.24 N ATOM 763 CA ASP A 52 -2.609 15.479 3.732 1.00 1.23 C ATOM 764 C ASP A 52 -2.076 14.169 3.152 1.00 0.91 C ATOM 765 O ASP A 52 -1.379 14.160 2.137 1.00 1.55 O ATOM 766 CB ASP A 52 -2.697 16.544 2.637 1.00 1.67 C ATOM 767 CG ASP A 52 -3.306 17.838 3.136 1.00 2.16 C ATOM 768 OD1 ASP A 52 -4.462 17.807 3.607 1.00 2.69 O ATOM 769 OD2 ASP A 52 -2.626 18.884 3.060 1.00 2.56 O ATOM 0 H ASP A 52 -1.022 16.587 4.546 1.00 1.24 H new ATOM 0 HA ASP A 52 -3.608 15.296 4.128 1.00 1.23 H new ATOM 0 HB2 ASP A 52 -1.699 16.743 2.246 1.00 1.67 H new ATOM 0 HB3 ASP A 52 -3.293 16.161 1.809 1.00 1.67 H new ATOM 774 N TYR A 53 -2.407 13.067 3.817 1.00 0.76 N ATOM 775 CA TYR A 53 -1.975 11.740 3.403 1.00 1.08 C ATOM 776 C TYR A 53 -2.429 11.422 1.980 1.00 0.87 C ATOM 777 O TYR A 53 -3.624 11.302 1.713 1.00 0.98 O ATOM 778 CB TYR A 53 -2.555 10.711 4.370 1.00 1.83 C ATOM 779 CG TYR A 53 -2.030 9.315 4.176 1.00 2.62 C ATOM 780 CD1 TYR A 53 -0.684 9.045 4.321 1.00 3.32 C ATOM 781 CD2 TYR A 53 -2.886 8.271 3.866 1.00 3.26 C ATOM 782 CE1 TYR A 53 -0.194 7.765 4.158 1.00 4.46 C ATOM 783 CE2 TYR A 53 -2.409 6.985 3.702 1.00 4.34 C ATOM 784 CZ TYR A 53 -1.061 6.738 3.848 1.00 4.90 C ATOM 785 OH TYR A 53 -0.576 5.460 3.686 1.00 6.13 O ATOM 0 H TYR A 53 -2.983 13.071 4.659 1.00 0.76 H new ATOM 0 HA TYR A 53 -0.886 11.707 3.419 1.00 1.08 H new ATOM 0 HB2 TYR A 53 -2.342 11.028 5.391 1.00 1.83 H new ATOM 0 HB3 TYR A 53 -3.639 10.697 4.260 1.00 1.83 H new ATOM 0 HD1 TYR A 53 -0.004 9.848 4.566 1.00 3.32 H new ATOM 0 HD2 TYR A 53 -3.942 8.465 3.751 1.00 3.26 H new ATOM 0 HE1 TYR A 53 0.862 7.569 4.272 1.00 4.46 H new ATOM 0 HE2 TYR A 53 -3.087 6.180 3.461 1.00 4.34 H new ATOM 0 HH TYR A 53 -1.320 4.822 3.710 1.00 6.13 H new ATOM 795 N LEU A 54 -1.467 11.260 1.075 1.00 0.72 N ATOM 796 CA LEU A 54 -1.772 10.932 -0.313 1.00 0.59 C ATOM 797 C LEU A 54 -1.488 9.456 -0.567 1.00 0.61 C ATOM 798 O LEU A 54 -0.332 9.048 -0.676 1.00 0.88 O ATOM 799 CB LEU A 54 -0.945 11.788 -1.274 1.00 0.60 C ATOM 800 CG LEU A 54 -1.344 11.675 -2.745 1.00 0.54 C ATOM 801 CD1 LEU A 54 -2.650 12.409 -3.001 1.00 0.92 C ATOM 802 CD2 LEU A 54 -0.234 12.209 -3.637 1.00 1.10 C ATOM 0 H LEU A 54 -0.472 11.351 1.278 1.00 0.72 H new ATOM 0 HA LEU A 54 -2.827 11.139 -0.490 1.00 0.59 H new ATOM 0 HB2 LEU A 54 -1.027 12.831 -0.970 1.00 0.60 H new ATOM 0 HB3 LEU A 54 0.104 11.509 -1.175 1.00 0.60 H new ATOM 0 HG LEU A 54 -1.497 10.623 -2.985 1.00 0.54 H new ATOM 0 HD11 LEU A 54 -2.918 12.318 -4.053 1.00 0.92 H new ATOM 0 HD12 LEU A 54 -3.438 11.974 -2.386 1.00 0.92 H new ATOM 0 HD13 LEU A 54 -2.531 13.462 -2.747 1.00 0.92 H new ATOM 0 HD21 LEU A 54 -0.533 12.122 -4.682 1.00 1.10 H new ATOM 0 HD22 LEU A 54 -0.048 13.256 -3.399 1.00 1.10 H new ATOM 0 HD23 LEU A 54 0.676 11.632 -3.471 1.00 1.10 H new ATOM 814 N ASN A 55 -2.543 8.655 -0.642 1.00 0.50 N ATOM 815 CA ASN A 55 -2.392 7.220 -0.862 1.00 0.58 C ATOM 816 C ASN A 55 -2.755 6.834 -2.291 1.00 0.57 C ATOM 817 O ASN A 55 -3.640 7.430 -2.903 1.00 0.70 O ATOM 818 CB ASN A 55 -3.260 6.440 0.130 1.00 0.82 C ATOM 819 CG ASN A 55 -3.023 4.943 0.057 1.00 1.80 C ATOM 820 OD1 ASN A 55 -3.245 4.314 -0.978 1.00 2.63 O ATOM 821 ND2 ASN A 55 -2.570 4.364 1.162 1.00 2.49 N ATOM 0 H ASN A 55 -3.509 8.971 -0.554 1.00 0.50 H new ATOM 0 HA ASN A 55 -1.344 6.966 -0.701 1.00 0.58 H new ATOM 0 HB2 ASN A 55 -3.053 6.789 1.142 1.00 0.82 H new ATOM 0 HB3 ASN A 55 -4.311 6.648 -0.070 1.00 0.82 H new ATOM 0 HD21 ASN A 55 -2.392 3.360 1.175 1.00 2.49 H new ATOM 0 HD22 ASN A 55 -2.400 4.923 1.998 1.00 2.49 H new ATOM 828 N ALA A 56 -2.059 5.828 -2.818 1.00 0.51 N ATOM 829 CA ALA A 56 -2.297 5.351 -4.175 1.00 0.57 C ATOM 830 C ALA A 56 -1.772 3.931 -4.354 1.00 0.54 C ATOM 831 O ALA A 56 -0.560 3.708 -4.378 1.00 0.75 O ATOM 832 CB ALA A 56 -1.641 6.283 -5.180 1.00 0.61 C ATOM 0 H ALA A 56 -1.323 5.327 -2.321 1.00 0.51 H new ATOM 0 HA ALA A 56 -3.373 5.341 -4.349 1.00 0.57 H new ATOM 0 HB1 ALA A 56 -1.825 5.917 -6.190 1.00 0.61 H new ATOM 0 HB2 ALA A 56 -2.059 7.284 -5.075 1.00 0.61 H new ATOM 0 HB3 ALA A 56 -0.567 6.318 -4.997 1.00 0.61 H new ATOM 838 N ALA A 57 -2.683 2.969 -4.480 1.00 0.31 N ATOM 839 CA ALA A 57 -2.297 1.576 -4.655 1.00 0.29 C ATOM 840 C ALA A 57 -1.873 1.297 -6.092 1.00 0.29 C ATOM 841 O ALA A 57 -2.216 2.049 -7.003 1.00 0.39 O ATOM 842 CB ALA A 57 -3.444 0.665 -4.260 1.00 0.33 C ATOM 0 H ALA A 57 -3.690 3.130 -4.464 1.00 0.31 H new ATOM 0 HA ALA A 57 -1.443 1.377 -4.008 1.00 0.29 H new ATOM 0 HB1 ALA A 57 -3.146 -0.375 -4.394 1.00 0.33 H new ATOM 0 HB2 ALA A 57 -3.702 0.836 -3.215 1.00 0.33 H new ATOM 0 HB3 ALA A 57 -4.310 0.878 -4.887 1.00 0.33 H new ATOM 848 N VAL A 58 -1.133 0.205 -6.296 1.00 0.26 N ATOM 849 CA VAL A 58 -0.675 -0.167 -7.633 1.00 0.27 C ATOM 850 C VAL A 58 -0.507 -1.677 -7.775 1.00 0.27 C ATOM 851 O VAL A 58 0.225 -2.305 -7.009 1.00 0.28 O ATOM 852 CB VAL A 58 0.664 0.508 -7.988 1.00 0.31 C ATOM 853 CG1 VAL A 58 0.492 2.013 -8.139 1.00 1.20 C ATOM 854 CG2 VAL A 58 1.723 0.195 -6.940 1.00 0.98 C ATOM 0 H VAL A 58 -0.840 -0.433 -5.556 1.00 0.26 H new ATOM 0 HA VAL A 58 -1.448 0.178 -8.320 1.00 0.27 H new ATOM 0 HB VAL A 58 0.998 0.105 -8.944 1.00 0.31 H new ATOM 0 HG11 VAL A 58 1.451 2.466 -8.390 1.00 1.20 H new ATOM 0 HG12 VAL A 58 -0.225 2.219 -8.934 1.00 1.20 H new ATOM 0 HG13 VAL A 58 0.126 2.433 -7.202 1.00 1.20 H new ATOM 0 HG21 VAL A 58 2.659 0.682 -7.212 1.00 0.98 H new ATOM 0 HG22 VAL A 58 1.392 0.561 -5.968 1.00 0.98 H new ATOM 0 HG23 VAL A 58 1.876 -0.883 -6.888 1.00 0.98 H new ATOM 864 N ALA A 59 -1.187 -2.263 -8.763 1.00 0.28 N ATOM 865 CA ALA A 59 -1.100 -3.698 -8.995 1.00 0.29 C ATOM 866 C ALA A 59 0.199 -4.056 -9.712 1.00 0.31 C ATOM 867 O ALA A 59 0.332 -3.863 -10.920 1.00 0.50 O ATOM 868 CB ALA A 59 -2.292 -4.175 -9.804 1.00 0.31 C ATOM 0 H ALA A 59 -1.799 -1.765 -9.409 1.00 0.28 H new ATOM 0 HA ALA A 59 -1.107 -4.199 -8.027 1.00 0.29 H new ATOM 0 HB1 ALA A 59 -2.213 -5.249 -9.969 1.00 0.31 H new ATOM 0 HB2 ALA A 59 -3.211 -3.958 -9.260 1.00 0.31 H new ATOM 0 HB3 ALA A 59 -2.309 -3.660 -10.765 1.00 0.31 H new ATOM 874 N LEU A 60 1.153 -4.575 -8.947 1.00 0.28 N ATOM 875 CA LEU A 60 2.453 -4.964 -9.481 1.00 0.28 C ATOM 876 C LEU A 60 2.453 -6.421 -9.934 1.00 0.30 C ATOM 877 O LEU A 60 2.298 -7.328 -9.121 1.00 0.33 O ATOM 878 CB LEU A 60 3.531 -4.758 -8.410 1.00 0.29 C ATOM 879 CG LEU A 60 4.898 -5.387 -8.709 1.00 0.29 C ATOM 880 CD1 LEU A 60 5.496 -4.800 -9.975 1.00 0.35 C ATOM 881 CD2 LEU A 60 5.840 -5.183 -7.532 1.00 0.31 C ATOM 0 H LEU A 60 1.048 -4.737 -7.945 1.00 0.28 H new ATOM 0 HA LEU A 60 2.666 -4.339 -10.348 1.00 0.28 H new ATOM 0 HB2 LEU A 60 3.669 -3.687 -8.262 1.00 0.29 H new ATOM 0 HB3 LEU A 60 3.163 -5.165 -7.468 1.00 0.29 H new ATOM 0 HG LEU A 60 4.758 -6.457 -8.864 1.00 0.29 H new ATOM 0 HD11 LEU A 60 6.465 -5.261 -10.167 1.00 0.35 H new ATOM 0 HD12 LEU A 60 4.829 -4.993 -10.816 1.00 0.35 H new ATOM 0 HD13 LEU A 60 5.624 -3.724 -9.852 1.00 0.35 H new ATOM 0 HD21 LEU A 60 6.806 -5.634 -7.757 1.00 0.31 H new ATOM 0 HD22 LEU A 60 5.971 -4.116 -7.351 1.00 0.31 H new ATOM 0 HD23 LEU A 60 5.419 -5.653 -6.643 1.00 0.31 H new ATOM 893 N GLU A 61 2.660 -6.649 -11.226 1.00 0.32 N ATOM 894 CA GLU A 61 2.709 -8.010 -11.736 1.00 0.36 C ATOM 895 C GLU A 61 4.067 -8.591 -11.397 1.00 0.34 C ATOM 896 O GLU A 61 5.031 -8.435 -12.147 1.00 0.36 O ATOM 897 CB GLU A 61 2.472 -8.036 -13.249 1.00 0.43 C ATOM 898 CG GLU A 61 2.438 -9.439 -13.835 1.00 0.52 C ATOM 899 CD GLU A 61 2.199 -9.442 -15.332 1.00 1.37 C ATOM 900 OE1 GLU A 61 2.052 -8.347 -15.914 1.00 1.88 O ATOM 901 OE2 GLU A 61 2.157 -10.542 -15.924 1.00 2.11 O ATOM 0 H GLU A 61 2.794 -5.921 -11.928 1.00 0.32 H new ATOM 0 HA GLU A 61 1.921 -8.606 -11.276 1.00 0.36 H new ATOM 0 HB2 GLU A 61 1.529 -7.536 -13.469 1.00 0.43 H new ATOM 0 HB3 GLU A 61 3.259 -7.464 -13.742 1.00 0.43 H new ATOM 0 HG2 GLU A 61 3.382 -9.941 -13.621 1.00 0.52 H new ATOM 0 HG3 GLU A 61 1.653 -10.014 -13.345 1.00 0.52 H new ATOM 908 N THR A 62 4.146 -9.227 -10.238 1.00 0.34 N ATOM 909 CA THR A 62 5.399 -9.789 -9.766 1.00 0.35 C ATOM 910 C THR A 62 5.282 -11.264 -9.420 1.00 0.39 C ATOM 911 O THR A 62 4.233 -11.741 -8.988 1.00 0.61 O ATOM 912 CB THR A 62 5.870 -9.014 -8.534 1.00 0.40 C ATOM 913 OG1 THR A 62 6.978 -9.653 -7.927 1.00 0.43 O ATOM 914 CG2 THR A 62 4.796 -8.860 -7.479 1.00 0.52 C ATOM 0 H THR A 62 3.356 -9.366 -9.608 1.00 0.34 H new ATOM 0 HA THR A 62 6.122 -9.701 -10.576 1.00 0.35 H new ATOM 0 HB THR A 62 6.141 -8.025 -8.904 1.00 0.40 H new ATOM 0 HG1 THR A 62 7.684 -9.786 -8.593 1.00 0.43 H new ATOM 0 HG21 THR A 62 5.195 -8.301 -6.632 1.00 0.52 H new ATOM 0 HG22 THR A 62 3.946 -8.323 -7.900 1.00 0.52 H new ATOM 0 HG23 THR A 62 4.472 -9.845 -7.143 1.00 0.52 H new ATOM 922 N SER A 63 6.394 -11.964 -9.581 1.00 0.37 N ATOM 923 CA SER A 63 6.474 -13.377 -9.262 1.00 0.48 C ATOM 924 C SER A 63 7.501 -13.564 -8.161 1.00 0.42 C ATOM 925 O SER A 63 7.756 -14.681 -7.706 1.00 0.45 O ATOM 926 CB SER A 63 6.858 -14.192 -10.499 1.00 0.69 C ATOM 927 OG SER A 63 5.902 -14.037 -11.531 1.00 1.22 O ATOM 0 H SER A 63 7.264 -11.567 -9.936 1.00 0.37 H new ATOM 0 HA SER A 63 5.500 -13.732 -8.924 1.00 0.48 H new ATOM 0 HB2 SER A 63 7.838 -13.875 -10.857 1.00 0.69 H new ATOM 0 HB3 SER A 63 6.941 -15.246 -10.232 1.00 0.69 H new ATOM 0 HG SER A 63 6.173 -14.567 -12.310 1.00 1.22 H new ATOM 933 N LEU A 64 8.085 -12.446 -7.738 1.00 0.37 N ATOM 934 CA LEU A 64 9.090 -12.455 -6.683 1.00 0.35 C ATOM 935 C LEU A 64 8.475 -12.983 -5.388 1.00 0.50 C ATOM 936 O LEU A 64 7.279 -12.812 -5.151 1.00 0.82 O ATOM 937 CB LEU A 64 9.646 -11.034 -6.490 1.00 0.49 C ATOM 938 CG LEU A 64 10.986 -10.924 -5.750 1.00 0.48 C ATOM 939 CD1 LEU A 64 10.813 -11.191 -4.266 1.00 0.90 C ATOM 940 CD2 LEU A 64 12.011 -11.877 -6.349 1.00 0.84 C ATOM 0 H LEU A 64 7.877 -11.520 -8.112 1.00 0.37 H new ATOM 0 HA LEU A 64 9.913 -13.113 -6.963 1.00 0.35 H new ATOM 0 HB2 LEU A 64 9.758 -10.574 -7.472 1.00 0.49 H new ATOM 0 HB3 LEU A 64 8.905 -10.448 -5.946 1.00 0.49 H new ATOM 0 HG LEU A 64 11.352 -9.904 -5.869 1.00 0.48 H new ATOM 0 HD11 LEU A 64 11.778 -11.107 -3.766 1.00 0.90 H new ATOM 0 HD12 LEU A 64 10.121 -10.463 -3.844 1.00 0.90 H new ATOM 0 HD13 LEU A 64 10.416 -12.196 -4.121 1.00 0.90 H new ATOM 0 HD21 LEU A 64 12.954 -11.783 -5.810 1.00 0.84 H new ATOM 0 HD22 LEU A 64 11.647 -12.901 -6.268 1.00 0.84 H new ATOM 0 HD23 LEU A 64 12.167 -11.630 -7.399 1.00 0.84 H new ATOM 952 N ALA A 65 9.291 -13.632 -4.560 1.00 0.58 N ATOM 953 CA ALA A 65 8.823 -14.189 -3.297 1.00 0.89 C ATOM 954 C ALA A 65 7.987 -13.173 -2.531 1.00 0.60 C ATOM 955 O ALA A 65 8.371 -12.015 -2.403 1.00 0.59 O ATOM 956 CB ALA A 65 10.002 -14.649 -2.456 1.00 1.41 C ATOM 0 H ALA A 65 10.283 -13.784 -4.744 1.00 0.58 H new ATOM 0 HA ALA A 65 8.191 -15.050 -3.516 1.00 0.89 H new ATOM 0 HB1 ALA A 65 9.639 -15.063 -1.515 1.00 1.41 H new ATOM 0 HB2 ALA A 65 10.559 -15.413 -2.998 1.00 1.41 H new ATOM 0 HB3 ALA A 65 10.655 -13.801 -2.251 1.00 1.41 H new ATOM 962 N PRO A 66 6.822 -13.595 -2.010 1.00 0.50 N ATOM 963 CA PRO A 66 5.925 -12.714 -1.253 1.00 0.40 C ATOM 964 C PRO A 66 6.602 -12.080 -0.048 1.00 0.41 C ATOM 965 O PRO A 66 6.159 -11.049 0.455 1.00 0.62 O ATOM 966 CB PRO A 66 4.811 -13.650 -0.774 1.00 0.47 C ATOM 967 CG PRO A 66 5.350 -15.031 -0.945 1.00 0.75 C ATOM 968 CD PRO A 66 6.281 -14.958 -2.118 1.00 0.64 C ATOM 0 HA PRO A 66 5.581 -11.883 -1.869 1.00 0.40 H new ATOM 0 HB2 PRO A 66 4.555 -13.455 0.267 1.00 0.47 H new ATOM 0 HB3 PRO A 66 3.901 -13.509 -1.358 1.00 0.47 H new ATOM 0 HG2 PRO A 66 5.874 -15.361 -0.048 1.00 0.75 H new ATOM 0 HG3 PRO A 66 4.547 -15.746 -1.126 1.00 0.75 H new ATOM 0 HD2 PRO A 66 7.066 -15.712 -2.061 1.00 0.64 H new ATOM 0 HD3 PRO A 66 5.758 -15.114 -3.062 1.00 0.64 H new ATOM 976 N GLU A 67 7.669 -12.713 0.412 1.00 0.40 N ATOM 977 CA GLU A 67 8.407 -12.231 1.570 1.00 0.44 C ATOM 978 C GLU A 67 9.458 -11.217 1.175 1.00 0.37 C ATOM 979 O GLU A 67 9.710 -10.254 1.901 1.00 0.40 O ATOM 980 CB GLU A 67 9.064 -13.408 2.299 1.00 0.57 C ATOM 981 CG GLU A 67 9.510 -14.519 1.365 1.00 0.65 C ATOM 982 CD GLU A 67 10.308 -15.600 2.069 1.00 0.80 C ATOM 983 OE1 GLU A 67 10.523 -15.477 3.294 1.00 1.28 O ATOM 984 OE2 GLU A 67 10.718 -16.569 1.397 1.00 1.19 O ATOM 0 H GLU A 67 8.046 -13.566 -0.001 1.00 0.40 H new ATOM 0 HA GLU A 67 7.699 -11.739 2.237 1.00 0.44 H new ATOM 0 HB2 GLU A 67 9.926 -13.045 2.858 1.00 0.57 H new ATOM 0 HB3 GLU A 67 8.361 -13.814 3.026 1.00 0.57 H new ATOM 0 HG2 GLU A 67 8.633 -14.968 0.898 1.00 0.65 H new ATOM 0 HG3 GLU A 67 10.114 -14.092 0.564 1.00 0.65 H new ATOM 991 N GLU A 68 10.078 -11.437 0.028 1.00 0.34 N ATOM 992 CA GLU A 68 11.109 -10.533 -0.441 1.00 0.31 C ATOM 993 C GLU A 68 10.521 -9.384 -1.251 1.00 0.29 C ATOM 994 O GLU A 68 11.131 -8.325 -1.353 1.00 0.30 O ATOM 995 CB GLU A 68 12.163 -11.278 -1.250 1.00 0.37 C ATOM 996 CG GLU A 68 13.347 -10.405 -1.608 1.00 0.34 C ATOM 997 CD GLU A 68 14.439 -11.165 -2.340 1.00 0.53 C ATOM 998 OE1 GLU A 68 14.250 -12.372 -2.600 1.00 1.21 O ATOM 999 OE2 GLU A 68 15.481 -10.553 -2.654 1.00 1.02 O ATOM 0 H GLU A 68 9.887 -12.226 -0.589 1.00 0.34 H new ATOM 0 HA GLU A 68 11.591 -10.106 0.438 1.00 0.31 H new ATOM 0 HB2 GLU A 68 12.511 -12.140 -0.680 1.00 0.37 H new ATOM 0 HB3 GLU A 68 11.710 -11.662 -2.164 1.00 0.37 H new ATOM 0 HG2 GLU A 68 13.007 -9.577 -2.230 1.00 0.34 H new ATOM 0 HG3 GLU A 68 13.761 -9.971 -0.698 1.00 0.34 H new ATOM 1006 N LEU A 69 9.331 -9.589 -1.816 1.00 0.32 N ATOM 1007 CA LEU A 69 8.682 -8.545 -2.601 1.00 0.36 C ATOM 1008 C LEU A 69 8.443 -7.339 -1.714 1.00 0.35 C ATOM 1009 O LEU A 69 8.993 -6.267 -1.960 1.00 0.41 O ATOM 1010 CB LEU A 69 7.377 -9.064 -3.218 1.00 0.42 C ATOM 1011 CG LEU A 69 6.592 -8.073 -4.094 1.00 0.54 C ATOM 1012 CD1 LEU A 69 5.922 -6.996 -3.254 1.00 1.08 C ATOM 1013 CD2 LEU A 69 7.504 -7.443 -5.138 1.00 1.51 C ATOM 0 H LEU A 69 8.804 -10.459 -1.745 1.00 0.32 H new ATOM 0 HA LEU A 69 9.328 -8.249 -3.428 1.00 0.36 H new ATOM 0 HB2 LEU A 69 7.610 -9.942 -3.820 1.00 0.42 H new ATOM 0 HB3 LEU A 69 6.725 -9.396 -2.410 1.00 0.42 H new ATOM 0 HG LEU A 69 5.808 -8.632 -4.605 1.00 0.54 H new ATOM 0 HD11 LEU A 69 5.376 -6.313 -3.905 1.00 1.08 H new ATOM 0 HD12 LEU A 69 5.229 -7.460 -2.553 1.00 1.08 H new ATOM 0 HD13 LEU A 69 6.680 -6.442 -2.701 1.00 1.08 H new ATOM 0 HD21 LEU A 69 6.931 -6.745 -5.748 1.00 1.51 H new ATOM 0 HD22 LEU A 69 8.313 -6.909 -4.640 1.00 1.51 H new ATOM 0 HD23 LEU A 69 7.922 -8.223 -5.775 1.00 1.51 H new ATOM 1025 N LEU A 70 7.659 -7.526 -0.655 1.00 0.33 N ATOM 1026 CA LEU A 70 7.416 -6.443 0.281 1.00 0.39 C ATOM 1027 C LEU A 70 8.761 -5.934 0.773 1.00 0.42 C ATOM 1028 O LEU A 70 9.001 -4.729 0.843 1.00 0.61 O ATOM 1029 CB LEU A 70 6.552 -6.917 1.461 1.00 0.44 C ATOM 1030 CG LEU A 70 6.501 -5.962 2.664 1.00 0.58 C ATOM 1031 CD1 LEU A 70 5.224 -6.168 3.460 1.00 1.16 C ATOM 1032 CD2 LEU A 70 7.708 -6.176 3.567 1.00 1.01 C ATOM 0 H LEU A 70 7.190 -8.403 -0.430 1.00 0.33 H new ATOM 0 HA LEU A 70 6.870 -5.642 -0.217 1.00 0.39 H new ATOM 0 HB2 LEU A 70 5.535 -7.079 1.103 1.00 0.44 H new ATOM 0 HB3 LEU A 70 6.928 -7.882 1.800 1.00 0.44 H new ATOM 0 HG LEU A 70 6.518 -4.941 2.284 1.00 0.58 H new ATOM 0 HD11 LEU A 70 5.208 -5.482 4.307 1.00 1.16 H new ATOM 0 HD12 LEU A 70 4.362 -5.975 2.821 1.00 1.16 H new ATOM 0 HD13 LEU A 70 5.184 -7.195 3.824 1.00 1.16 H new ATOM 0 HD21 LEU A 70 7.655 -5.491 4.413 1.00 1.01 H new ATOM 0 HD22 LEU A 70 7.712 -7.203 3.931 1.00 1.01 H new ATOM 0 HD23 LEU A 70 8.622 -5.987 3.004 1.00 1.01 H new ATOM 1044 N ASN A 71 9.643 -6.878 1.094 1.00 0.31 N ATOM 1045 CA ASN A 71 10.984 -6.554 1.563 1.00 0.35 C ATOM 1046 C ASN A 71 11.711 -5.684 0.543 1.00 0.38 C ATOM 1047 O ASN A 71 12.536 -4.846 0.905 1.00 0.45 O ATOM 1048 CB ASN A 71 11.779 -7.834 1.829 1.00 0.36 C ATOM 1049 CG ASN A 71 13.162 -7.547 2.381 1.00 1.06 C ATOM 1050 OD1 ASN A 71 14.011 -6.974 1.700 1.00 1.87 O ATOM 1051 ND2 ASN A 71 13.390 -7.938 3.629 1.00 1.53 N ATOM 0 H ASN A 71 9.449 -7.878 1.037 1.00 0.31 H new ATOM 0 HA ASN A 71 10.897 -5.996 2.496 1.00 0.35 H new ATOM 0 HB2 ASN A 71 11.231 -8.460 2.534 1.00 0.36 H new ATOM 0 HB3 ASN A 71 11.870 -8.402 0.903 1.00 0.36 H new ATOM 0 HD21 ASN A 71 14.299 -7.766 4.059 1.00 1.53 H new ATOM 0 HD22 ASN A 71 12.657 -8.410 4.158 1.00 1.53 H new ATOM 1058 N HIS A 72 11.378 -5.867 -0.734 1.00 0.35 N ATOM 1059 CA HIS A 72 11.979 -5.072 -1.791 1.00 0.42 C ATOM 1060 C HIS A 72 11.389 -3.680 -1.756 1.00 0.41 C ATOM 1061 O HIS A 72 12.112 -2.689 -1.686 1.00 0.43 O ATOM 1062 CB HIS A 72 11.750 -5.702 -3.165 1.00 0.51 C ATOM 1063 CG HIS A 72 12.696 -6.815 -3.485 1.00 1.07 C ATOM 1064 ND1 HIS A 72 14.062 -6.702 -3.339 1.00 2.09 N ATOM 1065 CD2 HIS A 72 12.473 -8.057 -3.972 1.00 1.39 C ATOM 1066 CE1 HIS A 72 14.638 -7.828 -3.721 1.00 2.99 C ATOM 1067 NE2 HIS A 72 13.694 -8.666 -4.111 1.00 2.56 N ATOM 0 H HIS A 72 10.698 -6.556 -1.055 1.00 0.35 H new ATOM 0 HA HIS A 72 13.055 -5.028 -1.624 1.00 0.42 H new ATOM 0 HB2 HIS A 72 10.729 -6.080 -3.215 1.00 0.51 H new ATOM 0 HB3 HIS A 72 11.842 -4.929 -3.928 1.00 0.51 H new ATOM 0 HD2 HIS A 72 11.512 -8.489 -4.208 1.00 1.39 H new ATOM 0 HE1 HIS A 72 15.699 -8.029 -3.715 1.00 2.99 H new ATOM 0 HE2 HIS A 72 13.848 -9.612 -4.459 1.00 2.56 H new ATOM 1076 N THR A 73 10.062 -3.610 -1.778 1.00 0.45 N ATOM 1077 CA THR A 73 9.378 -2.330 -1.720 1.00 0.49 C ATOM 1078 C THR A 73 9.836 -1.552 -0.490 1.00 0.46 C ATOM 1079 O THR A 73 9.704 -0.331 -0.425 1.00 0.47 O ATOM 1080 CB THR A 73 7.861 -2.532 -1.685 1.00 0.58 C ATOM 1081 OG1 THR A 73 7.476 -3.267 -0.539 1.00 0.62 O ATOM 1082 CG2 THR A 73 7.327 -3.261 -2.899 1.00 0.66 C ATOM 0 H THR A 73 9.445 -4.420 -1.835 1.00 0.45 H new ATOM 0 HA THR A 73 9.627 -1.759 -2.615 1.00 0.49 H new ATOM 0 HB THR A 73 7.438 -1.528 -1.668 1.00 0.58 H new ATOM 0 HG1 THR A 73 8.273 -3.636 -0.104 1.00 0.62 H new ATOM 0 HG21 THR A 73 6.246 -3.371 -2.811 1.00 0.66 H new ATOM 0 HG22 THR A 73 7.562 -2.691 -3.798 1.00 0.66 H new ATOM 0 HG23 THR A 73 7.788 -4.247 -2.964 1.00 0.66 H new ATOM 1090 N GLN A 74 10.395 -2.275 0.481 1.00 0.49 N ATOM 1091 CA GLN A 74 10.892 -1.663 1.708 1.00 0.49 C ATOM 1092 C GLN A 74 12.030 -0.689 1.416 1.00 0.43 C ATOM 1093 O GLN A 74 12.058 0.420 1.949 1.00 0.45 O ATOM 1094 CB GLN A 74 11.380 -2.733 2.693 1.00 0.60 C ATOM 1095 CG GLN A 74 10.279 -3.615 3.264 1.00 0.65 C ATOM 1096 CD GLN A 74 9.261 -2.863 4.112 1.00 0.87 C ATOM 1097 OE1 GLN A 74 8.306 -3.453 4.614 1.00 1.66 O ATOM 1098 NE2 GLN A 74 9.457 -1.559 4.285 1.00 1.05 N ATOM 0 H GLN A 74 10.514 -3.287 0.439 1.00 0.49 H new ATOM 0 HA GLN A 74 10.063 -1.114 2.156 1.00 0.49 H new ATOM 0 HB2 GLN A 74 12.111 -3.366 2.189 1.00 0.60 H new ATOM 0 HB3 GLN A 74 11.898 -2.241 3.516 1.00 0.60 H new ATOM 0 HG2 GLN A 74 9.759 -4.108 2.442 1.00 0.65 H new ATOM 0 HG3 GLN A 74 10.733 -4.399 3.870 1.00 0.65 H new ATOM 0 HE21 GLN A 74 10.260 -1.102 3.853 1.00 1.05 H new ATOM 0 HE22 GLN A 74 8.804 -1.016 4.849 1.00 1.05 H new ATOM 1107 N ARG A 75 12.979 -1.114 0.578 1.00 0.44 N ATOM 1108 CA ARG A 75 14.120 -0.273 0.240 1.00 0.46 C ATOM 1109 C ARG A 75 13.667 1.020 -0.424 1.00 0.43 C ATOM 1110 O ARG A 75 14.271 2.065 -0.220 1.00 0.52 O ATOM 1111 CB ARG A 75 15.104 -1.011 -0.672 1.00 0.59 C ATOM 1112 CG ARG A 75 14.622 -1.178 -2.104 1.00 1.17 C ATOM 1113 CD ARG A 75 15.633 -1.924 -2.968 1.00 1.93 C ATOM 1114 NE ARG A 75 15.810 -3.318 -2.553 1.00 2.51 N ATOM 1115 CZ ARG A 75 16.607 -3.709 -1.559 1.00 2.97 C ATOM 1116 NH1 ARG A 75 17.365 -2.828 -0.918 1.00 3.08 N ATOM 1117 NH2 ARG A 75 16.660 -4.990 -1.219 1.00 3.82 N ATOM 0 H ARG A 75 12.977 -2.029 0.126 1.00 0.44 H new ATOM 0 HA ARG A 75 14.630 -0.029 1.172 1.00 0.46 H new ATOM 0 HB2 ARG A 75 16.050 -0.470 -0.680 1.00 0.59 H new ATOM 0 HB3 ARG A 75 15.304 -1.996 -0.251 1.00 0.59 H new ATOM 0 HG2 ARG A 75 13.675 -1.719 -2.106 1.00 1.17 H new ATOM 0 HG3 ARG A 75 14.430 -0.197 -2.538 1.00 1.17 H new ATOM 0 HD2 ARG A 75 15.307 -1.897 -4.008 1.00 1.93 H new ATOM 0 HD3 ARG A 75 16.593 -1.411 -2.922 1.00 1.93 H new ATOM 0 HE ARG A 75 15.290 -4.036 -3.058 1.00 2.51 H new ATOM 0 HH11 ARG A 75 17.340 -1.844 -1.185 1.00 3.08 H new ATOM 0 HH12 ARG A 75 17.972 -3.135 -0.158 1.00 3.08 H new ATOM 0 HH21 ARG A 75 16.091 -5.674 -1.718 1.00 3.82 H new ATOM 0 HH22 ARG A 75 17.269 -5.291 -0.458 1.00 3.82 H new ATOM 1131 N ILE A 76 12.598 0.944 -1.213 1.00 0.43 N ATOM 1132 CA ILE A 76 12.073 2.122 -1.894 1.00 0.48 C ATOM 1133 C ILE A 76 11.797 3.236 -0.888 1.00 0.49 C ATOM 1134 O ILE A 76 11.952 4.417 -1.194 1.00 0.60 O ATOM 1135 CB ILE A 76 10.777 1.805 -2.679 1.00 0.53 C ATOM 1136 CG1 ILE A 76 11.077 0.934 -3.905 1.00 0.62 C ATOM 1137 CG2 ILE A 76 10.086 3.092 -3.111 1.00 0.64 C ATOM 1138 CD1 ILE A 76 11.569 -0.459 -3.575 1.00 1.42 C ATOM 0 H ILE A 76 12.082 0.084 -1.395 1.00 0.43 H new ATOM 0 HA ILE A 76 12.831 2.447 -2.607 1.00 0.48 H new ATOM 0 HB ILE A 76 10.111 1.251 -2.017 1.00 0.53 H new ATOM 0 HG12 ILE A 76 10.173 0.854 -4.509 1.00 0.62 H new ATOM 0 HG13 ILE A 76 11.826 1.435 -4.518 1.00 0.62 H new ATOM 0 HG21 ILE A 76 9.177 2.850 -3.661 1.00 0.64 H new ATOM 0 HG22 ILE A 76 9.831 3.681 -2.230 1.00 0.64 H new ATOM 0 HG23 ILE A 76 10.755 3.667 -3.751 1.00 0.64 H new ATOM 0 HD11 ILE A 76 11.757 -1.007 -4.498 1.00 1.42 H new ATOM 0 HD12 ILE A 76 12.492 -0.392 -2.999 1.00 1.42 H new ATOM 0 HD13 ILE A 76 10.813 -0.983 -2.990 1.00 1.42 H new ATOM 1150 N GLU A 77 11.399 2.841 0.317 1.00 0.45 N ATOM 1151 CA GLU A 77 11.108 3.796 1.379 1.00 0.52 C ATOM 1152 C GLU A 77 12.382 4.522 1.793 1.00 0.52 C ATOM 1153 O GLU A 77 12.364 5.719 2.083 1.00 0.71 O ATOM 1154 CB GLU A 77 10.495 3.069 2.577 1.00 0.59 C ATOM 1155 CG GLU A 77 9.798 3.984 3.569 1.00 0.95 C ATOM 1156 CD GLU A 77 9.117 3.211 4.684 1.00 1.15 C ATOM 1157 OE1 GLU A 77 8.290 2.330 4.373 1.00 1.52 O ATOM 1158 OE2 GLU A 77 9.408 3.489 5.865 1.00 1.59 O ATOM 0 H GLU A 77 11.271 1.864 0.582 1.00 0.45 H new ATOM 0 HA GLU A 77 10.393 4.532 1.012 1.00 0.52 H new ATOM 0 HB2 GLU A 77 9.778 2.333 2.213 1.00 0.59 H new ATOM 0 HB3 GLU A 77 11.281 2.520 3.096 1.00 0.59 H new ATOM 0 HG2 GLU A 77 10.526 4.672 3.999 1.00 0.95 H new ATOM 0 HG3 GLU A 77 9.058 4.589 3.045 1.00 0.95 H new ATOM 1165 N LEU A 78 13.492 3.790 1.797 1.00 0.47 N ATOM 1166 CA LEU A 78 14.788 4.355 2.151 1.00 0.56 C ATOM 1167 C LEU A 78 15.343 5.165 0.987 1.00 0.57 C ATOM 1168 O LEU A 78 15.845 6.274 1.168 1.00 0.66 O ATOM 1169 CB LEU A 78 15.768 3.243 2.530 1.00 0.63 C ATOM 1170 CG LEU A 78 15.372 2.414 3.754 1.00 0.71 C ATOM 1171 CD1 LEU A 78 16.360 1.280 3.971 1.00 0.83 C ATOM 1172 CD2 LEU A 78 15.296 3.295 4.994 1.00 0.84 C ATOM 0 H LEU A 78 13.518 2.799 1.558 1.00 0.47 H new ATOM 0 HA LEU A 78 14.657 5.014 3.010 1.00 0.56 H new ATOM 0 HB2 LEU A 78 15.879 2.573 1.678 1.00 0.63 H new ATOM 0 HB3 LEU A 78 16.745 3.689 2.714 1.00 0.63 H new ATOM 0 HG LEU A 78 14.386 1.985 3.574 1.00 0.71 H new ATOM 0 HD11 LEU A 78 16.063 0.701 4.845 1.00 0.83 H new ATOM 0 HD12 LEU A 78 16.370 0.633 3.094 1.00 0.83 H new ATOM 0 HD13 LEU A 78 17.357 1.691 4.130 1.00 0.83 H new ATOM 0 HD21 LEU A 78 15.013 2.689 5.854 1.00 0.84 H new ATOM 0 HD22 LEU A 78 16.269 3.752 5.176 1.00 0.84 H new ATOM 0 HD23 LEU A 78 14.552 4.076 4.840 1.00 0.84 H new ATOM 1184 N GLN A 79 15.243 4.597 -0.213 1.00 0.56 N ATOM 1185 CA GLN A 79 15.726 5.258 -1.418 1.00 0.63 C ATOM 1186 C GLN A 79 14.994 6.576 -1.645 1.00 0.66 C ATOM 1187 O GLN A 79 15.546 7.511 -2.225 1.00 0.84 O ATOM 1188 CB GLN A 79 15.542 4.348 -2.633 1.00 0.67 C ATOM 1189 CG GLN A 79 16.191 2.984 -2.469 1.00 0.93 C ATOM 1190 CD GLN A 79 16.085 2.116 -3.710 1.00 1.22 C ATOM 1191 OE1 GLN A 79 16.594 0.995 -3.738 1.00 1.95 O ATOM 1192 NE2 GLN A 79 15.418 2.620 -4.746 1.00 1.30 N ATOM 0 H GLN A 79 14.830 3.678 -0.374 1.00 0.56 H new ATOM 0 HA GLN A 79 16.787 5.468 -1.286 1.00 0.63 H new ATOM 0 HB2 GLN A 79 14.476 4.215 -2.820 1.00 0.67 H new ATOM 0 HB3 GLN A 79 15.961 4.838 -3.512 1.00 0.67 H new ATOM 0 HG2 GLN A 79 17.243 3.118 -2.216 1.00 0.93 H new ATOM 0 HG3 GLN A 79 15.725 2.466 -1.631 1.00 0.93 H new ATOM 0 HE21 GLN A 79 15.010 3.553 -4.685 1.00 1.30 H new ATOM 0 HE22 GLN A 79 15.315 2.073 -5.601 1.00 1.30 H new ATOM 1201 N GLN A 80 13.752 6.645 -1.174 1.00 0.54 N ATOM 1202 CA GLN A 80 12.953 7.851 -1.317 1.00 0.59 C ATOM 1203 C GLN A 80 13.308 8.833 -0.210 1.00 0.68 C ATOM 1204 O GLN A 80 12.989 10.019 -0.283 1.00 0.78 O ATOM 1205 CB GLN A 80 11.462 7.507 -1.271 1.00 0.54 C ATOM 1206 CG GLN A 80 10.548 8.694 -1.524 1.00 0.99 C ATOM 1207 CD GLN A 80 10.757 9.318 -2.892 1.00 0.98 C ATOM 1208 OE1 GLN A 80 11.823 9.864 -3.182 1.00 1.68 O ATOM 1209 NE2 GLN A 80 9.742 9.233 -3.742 1.00 0.74 N ATOM 0 H GLN A 80 13.281 5.880 -0.691 1.00 0.54 H new ATOM 0 HA GLN A 80 13.168 8.312 -2.281 1.00 0.59 H new ATOM 0 HB2 GLN A 80 11.254 6.736 -2.013 1.00 0.54 H new ATOM 0 HB3 GLN A 80 11.227 7.082 -0.295 1.00 0.54 H new ATOM 0 HG2 GLN A 80 9.510 8.374 -1.431 1.00 0.99 H new ATOM 0 HG3 GLN A 80 10.719 9.448 -0.756 1.00 0.99 H new ATOM 0 HE21 GLN A 80 8.877 8.772 -3.459 1.00 0.74 H new ATOM 0 HE22 GLN A 80 9.826 9.629 -4.678 1.00 0.74 H new ATOM 1218 N GLY A 81 13.984 8.317 0.811 1.00 0.74 N ATOM 1219 CA GLY A 81 14.392 9.141 1.926 1.00 0.88 C ATOM 1220 C GLY A 81 13.363 9.171 3.034 1.00 0.89 C ATOM 1221 O GLY A 81 12.884 10.243 3.405 1.00 0.99 O ATOM 0 H GLY A 81 14.256 7.337 0.883 1.00 0.74 H new ATOM 0 HA2 GLY A 81 15.336 8.768 2.322 1.00 0.88 H new ATOM 0 HA3 GLY A 81 14.573 10.157 1.575 1.00 0.88 H new ATOM 1225 N ARG A 82 13.019 8.000 3.569 1.00 0.95 N ATOM 1226 CA ARG A 82 12.042 7.929 4.643 1.00 1.07 C ATOM 1227 C ARG A 82 12.470 8.834 5.793 1.00 1.09 C ATOM 1228 O ARG A 82 13.594 8.743 6.292 1.00 1.50 O ATOM 1229 CB ARG A 82 11.858 6.481 5.119 1.00 1.34 C ATOM 1230 CG ARG A 82 12.150 6.263 6.596 1.00 1.78 C ATOM 1231 CD ARG A 82 11.678 4.896 7.062 1.00 2.05 C ATOM 1232 NE ARG A 82 12.313 3.809 6.320 1.00 2.68 N ATOM 1233 CZ ARG A 82 12.091 2.521 6.567 1.00 3.14 C ATOM 1234 NH1 ARG A 82 11.261 2.161 7.537 1.00 3.20 N ATOM 1235 NH2 ARG A 82 12.700 1.591 5.845 1.00 3.90 N ATOM 0 H ARG A 82 13.400 7.100 3.277 1.00 0.95 H new ATOM 0 HA ARG A 82 11.080 8.276 4.267 1.00 1.07 H new ATOM 0 HB2 ARG A 82 10.833 6.172 4.914 1.00 1.34 H new ATOM 0 HB3 ARG A 82 12.510 5.833 4.533 1.00 1.34 H new ATOM 0 HG2 ARG A 82 13.221 6.359 6.774 1.00 1.78 H new ATOM 0 HG3 ARG A 82 11.658 7.038 7.183 1.00 1.78 H new ATOM 0 HD2 ARG A 82 11.893 4.782 8.124 1.00 2.05 H new ATOM 0 HD3 ARG A 82 10.596 4.829 6.947 1.00 2.05 H new ATOM 0 HE ARG A 82 12.962 4.051 5.571 1.00 2.68 H new ATOM 0 HH11 ARG A 82 10.791 2.873 8.096 1.00 3.20 H new ATOM 0 HH12 ARG A 82 11.093 1.172 7.724 1.00 3.20 H new ATOM 0 HH21 ARG A 82 13.340 1.863 5.099 1.00 3.90 H new ATOM 0 HH22 ARG A 82 12.529 0.604 6.036 1.00 3.90 H new ATOM 1249 N VAL A 83 11.573 9.724 6.187 1.00 1.01 N ATOM 1250 CA VAL A 83 11.848 10.670 7.255 1.00 1.24 C ATOM 1251 C VAL A 83 11.733 10.006 8.623 1.00 1.17 C ATOM 1252 O VAL A 83 10.641 9.869 9.173 1.00 1.65 O ATOM 1253 CB VAL A 83 10.891 11.867 7.168 1.00 1.94 C ATOM 1254 CG1 VAL A 83 11.322 12.973 8.118 1.00 2.77 C ATOM 1255 CG2 VAL A 83 10.822 12.368 5.731 1.00 2.45 C ATOM 0 H VAL A 83 10.642 9.810 5.779 1.00 1.01 H new ATOM 0 HA VAL A 83 12.872 11.024 7.134 1.00 1.24 H new ATOM 0 HB VAL A 83 9.894 11.547 7.471 1.00 1.94 H new ATOM 0 HG11 VAL A 83 10.629 13.811 8.039 1.00 2.77 H new ATOM 0 HG12 VAL A 83 11.320 12.596 9.141 1.00 2.77 H new ATOM 0 HG13 VAL A 83 12.326 13.307 7.856 1.00 2.77 H new ATOM 0 HG21 VAL A 83 10.142 13.218 5.674 1.00 2.45 H new ATOM 0 HG22 VAL A 83 11.815 12.676 5.405 1.00 2.45 H new ATOM 0 HG23 VAL A 83 10.460 11.569 5.084 1.00 2.45 H new ATOM 1384 N GLY A 90 0.675 5.763 12.383 1.00 1.35 N ATOM 1385 CA GLY A 90 0.670 6.637 11.223 1.00 1.15 C ATOM 1386 C GLY A 90 1.781 6.330 10.234 1.00 1.08 C ATOM 1387 O GLY A 90 2.594 5.435 10.464 1.00 1.29 O ATOM 0 HA2 GLY A 90 -0.291 6.552 10.717 1.00 1.15 H new ATOM 0 HA3 GLY A 90 0.764 7.671 11.555 1.00 1.15 H new ATOM 1391 N PRO A 91 1.832 7.066 9.108 1.00 0.96 N ATOM 1392 CA PRO A 91 2.844 6.875 8.065 1.00 1.07 C ATOM 1393 C PRO A 91 4.196 7.474 8.445 1.00 1.17 C ATOM 1394 O PRO A 91 5.220 6.798 8.370 1.00 1.60 O ATOM 1395 CB PRO A 91 2.257 7.613 6.847 1.00 1.09 C ATOM 1396 CG PRO A 91 0.880 8.036 7.254 1.00 1.09 C ATOM 1397 CD PRO A 91 0.906 8.141 8.747 1.00 0.91 C ATOM 0 HA PRO A 91 3.040 5.818 7.886 1.00 1.07 H new ATOM 0 HB2 PRO A 91 2.868 8.475 6.580 1.00 1.09 H new ATOM 0 HB3 PRO A 91 2.224 6.962 5.973 1.00 1.09 H new ATOM 0 HG2 PRO A 91 0.615 8.991 6.800 1.00 1.09 H new ATOM 0 HG3 PRO A 91 0.136 7.310 6.927 1.00 1.09 H new ATOM 0 HD2 PRO A 91 1.261 9.116 9.082 1.00 0.91 H new ATOM 0 HD3 PRO A 91 -0.082 7.994 9.184 1.00 0.91 H new ATOM 1405 N ARG A 92 4.181 8.746 8.849 1.00 0.93 N ATOM 1406 CA ARG A 92 5.389 9.469 9.252 1.00 1.03 C ATOM 1407 C ARG A 92 6.192 9.953 8.038 1.00 1.13 C ATOM 1408 O ARG A 92 7.197 10.648 8.189 1.00 1.95 O ATOM 1409 CB ARG A 92 6.220 8.626 10.244 1.00 1.21 C ATOM 1410 CG ARG A 92 7.710 8.526 9.950 1.00 1.04 C ATOM 1411 CD ARG A 92 7.996 7.412 8.964 1.00 1.71 C ATOM 1412 NE ARG A 92 9.417 7.086 8.901 1.00 2.57 N ATOM 1413 CZ ARG A 92 10.086 6.514 9.899 1.00 3.53 C ATOM 1414 NH1 ARG A 92 9.454 6.166 11.010 1.00 3.96 N ATOM 1415 NH2 ARG A 92 11.385 6.282 9.785 1.00 4.39 N ATOM 0 H ARG A 92 3.329 9.305 8.906 1.00 0.93 H new ATOM 0 HA ARG A 92 5.093 10.374 9.782 1.00 1.03 H new ATOM 0 HB2 ARG A 92 6.094 9.047 11.242 1.00 1.21 H new ATOM 0 HB3 ARG A 92 5.806 7.618 10.269 1.00 1.21 H new ATOM 0 HG2 ARG A 92 8.069 9.473 9.548 1.00 1.04 H new ATOM 0 HG3 ARG A 92 8.256 8.346 10.876 1.00 1.04 H new ATOM 0 HD2 ARG A 92 7.433 6.523 9.249 1.00 1.71 H new ATOM 0 HD3 ARG A 92 7.648 7.706 7.974 1.00 1.71 H new ATOM 0 HE ARG A 92 9.925 7.309 8.045 1.00 2.57 H new ATOM 0 HH11 ARG A 92 8.453 6.336 11.102 1.00 3.96 H new ATOM 0 HH12 ARG A 92 9.969 5.728 11.774 1.00 3.96 H new ATOM 0 HH21 ARG A 92 11.876 6.542 8.930 1.00 4.39 H new ATOM 0 HH22 ARG A 92 11.894 5.843 10.552 1.00 4.39 H new ATOM 1429 N THR A 93 5.689 9.630 6.834 1.00 0.94 N ATOM 1430 CA THR A 93 6.293 10.059 5.557 1.00 0.91 C ATOM 1431 C THR A 93 5.895 9.131 4.403 1.00 0.83 C ATOM 1432 O THR A 93 5.321 9.583 3.417 1.00 1.08 O ATOM 1433 CB THR A 93 7.824 10.186 5.632 1.00 1.02 C ATOM 1434 OG1 THR A 93 8.362 10.491 4.359 1.00 1.52 O ATOM 1435 CG2 THR A 93 8.530 8.950 6.142 1.00 1.47 C ATOM 0 H THR A 93 4.850 9.062 6.717 1.00 0.94 H new ATOM 0 HA THR A 93 5.893 11.054 5.360 1.00 0.91 H new ATOM 0 HB THR A 93 7.998 10.989 6.349 1.00 1.02 H new ATOM 0 HG1 THR A 93 9.246 10.077 4.270 1.00 1.52 H new ATOM 0 HG21 THR A 93 9.605 9.127 6.162 1.00 1.47 H new ATOM 0 HG22 THR A 93 8.181 8.721 7.149 1.00 1.47 H new ATOM 0 HG23 THR A 93 8.313 8.109 5.483 1.00 1.47 H new ATOM 1443 N LEU A 94 6.184 7.836 4.527 1.00 0.68 N ATOM 1444 CA LEU A 94 5.827 6.869 3.491 1.00 0.64 C ATOM 1445 C LEU A 94 6.038 5.449 3.999 1.00 0.56 C ATOM 1446 O LEU A 94 6.864 5.212 4.880 1.00 0.71 O ATOM 1447 CB LEU A 94 6.623 7.092 2.194 1.00 0.72 C ATOM 1448 CG LEU A 94 8.107 6.729 2.246 1.00 1.00 C ATOM 1449 CD1 LEU A 94 8.689 6.686 0.840 1.00 1.44 C ATOM 1450 CD2 LEU A 94 8.876 7.723 3.099 1.00 1.87 C ATOM 0 H LEU A 94 6.663 7.434 5.333 1.00 0.68 H new ATOM 0 HA LEU A 94 4.773 7.016 3.258 1.00 0.64 H new ATOM 0 HB2 LEU A 94 6.155 6.510 1.400 1.00 0.72 H new ATOM 0 HB3 LEU A 94 6.536 8.142 1.914 1.00 0.72 H new ATOM 0 HG LEU A 94 8.201 5.742 2.699 1.00 1.00 H new ATOM 0 HD11 LEU A 94 9.746 6.426 0.892 1.00 1.44 H new ATOM 0 HD12 LEU A 94 8.160 5.938 0.250 1.00 1.44 H new ATOM 0 HD13 LEU A 94 8.578 7.663 0.370 1.00 1.44 H new ATOM 0 HD21 LEU A 94 9.930 7.445 3.121 1.00 1.87 H new ATOM 0 HD22 LEU A 94 8.774 8.722 2.675 1.00 1.87 H new ATOM 0 HD23 LEU A 94 8.477 7.717 4.113 1.00 1.87 H new ATOM 1462 N ASP A 95 5.280 4.511 3.443 1.00 0.52 N ATOM 1463 CA ASP A 95 5.378 3.114 3.848 1.00 0.53 C ATOM 1464 C ASP A 95 4.654 2.208 2.856 1.00 0.46 C ATOM 1465 O ASP A 95 3.448 1.992 2.965 1.00 0.59 O ATOM 1466 CB ASP A 95 4.795 2.931 5.252 1.00 0.73 C ATOM 1467 CG ASP A 95 4.902 1.504 5.751 1.00 1.16 C ATOM 1468 OD1 ASP A 95 4.279 0.610 5.140 1.00 1.64 O ATOM 1469 OD2 ASP A 95 5.613 1.277 6.754 1.00 1.72 O ATOM 0 H ASP A 95 4.592 4.692 2.712 1.00 0.52 H new ATOM 0 HA ASP A 95 6.431 2.834 3.860 1.00 0.53 H new ATOM 0 HB2 ASP A 95 5.314 3.593 5.945 1.00 0.73 H new ATOM 0 HB3 ASP A 95 3.747 3.232 5.247 1.00 0.73 H new ATOM 1474 N LEU A 96 5.404 1.678 1.898 1.00 0.38 N ATOM 1475 CA LEU A 96 4.840 0.788 0.892 1.00 0.36 C ATOM 1476 C LEU A 96 5.051 -0.672 1.299 1.00 0.40 C ATOM 1477 O LEU A 96 6.179 -1.161 1.337 1.00 0.53 O ATOM 1478 CB LEU A 96 5.449 1.063 -0.495 1.00 0.43 C ATOM 1479 CG LEU A 96 6.961 0.840 -0.632 1.00 0.52 C ATOM 1480 CD1 LEU A 96 7.365 0.869 -2.099 1.00 0.97 C ATOM 1481 CD2 LEU A 96 7.741 1.893 0.141 1.00 0.89 C ATOM 0 H LEU A 96 6.404 1.849 1.797 1.00 0.38 H new ATOM 0 HA LEU A 96 3.769 0.979 0.827 1.00 0.36 H new ATOM 0 HB2 LEU A 96 4.943 0.429 -1.222 1.00 0.43 H new ATOM 0 HB3 LEU A 96 5.230 2.096 -0.766 1.00 0.43 H new ATOM 0 HG LEU A 96 7.198 -0.138 -0.213 1.00 0.52 H new ATOM 0 HD11 LEU A 96 8.440 0.710 -2.184 1.00 0.97 H new ATOM 0 HD12 LEU A 96 6.838 0.081 -2.637 1.00 0.97 H new ATOM 0 HD13 LEU A 96 7.107 1.837 -2.528 1.00 0.97 H new ATOM 0 HD21 LEU A 96 8.810 1.711 0.027 1.00 0.89 H new ATOM 0 HD22 LEU A 96 7.498 2.883 -0.246 1.00 0.89 H new ATOM 0 HD23 LEU A 96 7.475 1.841 1.197 1.00 0.89 H new ATOM 1493 N ASP A 97 3.953 -1.351 1.629 1.00 0.38 N ATOM 1494 CA ASP A 97 4.015 -2.745 2.062 1.00 0.44 C ATOM 1495 C ASP A 97 2.916 -3.589 1.425 1.00 0.39 C ATOM 1496 O ASP A 97 1.869 -3.074 1.033 1.00 0.40 O ATOM 1497 CB ASP A 97 3.892 -2.819 3.585 1.00 0.55 C ATOM 1498 CG ASP A 97 5.190 -2.480 4.291 1.00 1.14 C ATOM 1499 OD1 ASP A 97 5.710 -1.365 4.075 1.00 1.45 O ATOM 1500 OD2 ASP A 97 5.685 -3.327 5.064 1.00 1.93 O ATOM 0 H ASP A 97 3.012 -0.959 1.605 1.00 0.38 H new ATOM 0 HA ASP A 97 4.976 -3.147 1.741 1.00 0.44 H new ATOM 0 HB2 ASP A 97 3.112 -2.133 3.917 1.00 0.55 H new ATOM 0 HB3 ASP A 97 3.578 -3.822 3.872 1.00 0.55 H new ATOM 1505 N ILE A 98 3.160 -4.898 1.344 1.00 0.39 N ATOM 1506 CA ILE A 98 2.190 -5.824 0.776 1.00 0.36 C ATOM 1507 C ILE A 98 0.914 -5.847 1.609 1.00 0.35 C ATOM 1508 O ILE A 98 0.909 -6.299 2.754 1.00 0.53 O ATOM 1509 CB ILE A 98 2.760 -7.262 0.662 1.00 0.36 C ATOM 1510 CG1 ILE A 98 3.587 -7.404 -0.617 1.00 0.48 C ATOM 1511 CG2 ILE A 98 1.644 -8.303 0.688 1.00 0.44 C ATOM 1512 CD1 ILE A 98 2.774 -7.260 -1.887 1.00 1.20 C ATOM 0 H ILE A 98 4.023 -5.337 1.666 1.00 0.39 H new ATOM 0 HA ILE A 98 1.962 -5.467 -0.228 1.00 0.36 H new ATOM 0 HB ILE A 98 3.405 -7.438 1.523 1.00 0.36 H new ATOM 0 HG12 ILE A 98 4.376 -6.652 -0.614 1.00 0.48 H new ATOM 0 HG13 ILE A 98 4.075 -8.379 -0.617 1.00 0.48 H new ATOM 0 HG21 ILE A 98 2.075 -9.301 0.606 1.00 0.44 H new ATOM 0 HG22 ILE A 98 1.092 -8.222 1.625 1.00 0.44 H new ATOM 0 HG23 ILE A 98 0.966 -8.131 -0.148 1.00 0.44 H new ATOM 0 HD11 ILE A 98 3.428 -7.372 -2.752 1.00 1.20 H new ATOM 0 HD12 ILE A 98 2.001 -8.028 -1.914 1.00 1.20 H new ATOM 0 HD13 ILE A 98 2.307 -6.275 -1.911 1.00 1.20 H new ATOM 1524 N MET A 99 -0.166 -5.365 1.015 1.00 0.32 N ATOM 1525 CA MET A 99 -1.456 -5.334 1.679 1.00 0.36 C ATOM 1526 C MET A 99 -2.350 -6.424 1.105 1.00 0.33 C ATOM 1527 O MET A 99 -3.368 -6.790 1.693 1.00 0.37 O ATOM 1528 CB MET A 99 -2.116 -3.965 1.512 1.00 0.43 C ATOM 1529 CG MET A 99 -1.262 -2.813 2.018 1.00 0.68 C ATOM 1530 SD MET A 99 -0.810 -2.988 3.755 1.00 1.56 S ATOM 1531 CE MET A 99 -2.428 -3.005 4.524 1.00 2.37 C ATOM 0 H MET A 99 -0.172 -4.988 0.067 1.00 0.32 H new ATOM 0 HA MET A 99 -1.309 -5.512 2.744 1.00 0.36 H new ATOM 0 HB2 MET A 99 -2.340 -3.805 0.457 1.00 0.43 H new ATOM 0 HB3 MET A 99 -3.068 -3.962 2.044 1.00 0.43 H new ATOM 0 HG2 MET A 99 -0.355 -2.747 1.416 1.00 0.68 H new ATOM 0 HG3 MET A 99 -1.804 -1.877 1.881 1.00 0.68 H new ATOM 0 HE1 MET A 99 -2.323 -2.840 5.596 1.00 2.37 H new ATOM 0 HE2 MET A 99 -3.044 -2.215 4.094 1.00 2.37 H new ATOM 0 HE3 MET A 99 -2.903 -3.970 4.350 1.00 2.37 H new ATOM 1541 N LEU A 100 -1.951 -6.941 -0.052 1.00 0.30 N ATOM 1542 CA LEU A 100 -2.701 -7.996 -0.726 1.00 0.30 C ATOM 1543 C LEU A 100 -1.844 -8.681 -1.781 1.00 0.31 C ATOM 1544 O LEU A 100 -1.640 -8.152 -2.872 1.00 0.58 O ATOM 1545 CB LEU A 100 -3.977 -7.424 -1.360 1.00 0.30 C ATOM 1546 CG LEU A 100 -5.272 -7.738 -0.606 1.00 0.37 C ATOM 1547 CD1 LEU A 100 -6.471 -7.149 -1.330 1.00 0.40 C ATOM 1548 CD2 LEU A 100 -5.439 -9.239 -0.430 1.00 0.43 C ATOM 0 H LEU A 100 -1.108 -6.645 -0.545 1.00 0.30 H new ATOM 0 HA LEU A 100 -2.985 -8.741 0.017 1.00 0.30 H new ATOM 0 HB2 LEU A 100 -3.873 -6.342 -1.437 1.00 0.30 H new ATOM 0 HB3 LEU A 100 -4.064 -7.809 -2.376 1.00 0.30 H new ATOM 0 HG LEU A 100 -5.211 -7.281 0.382 1.00 0.37 H new ATOM 0 HD11 LEU A 100 -7.381 -7.384 -0.778 1.00 0.40 H new ATOM 0 HD12 LEU A 100 -6.358 -6.067 -1.400 1.00 0.40 H new ATOM 0 HD13 LEU A 100 -6.535 -7.573 -2.332 1.00 0.40 H new ATOM 0 HD21 LEU A 100 -6.365 -9.441 0.108 1.00 0.43 H new ATOM 0 HD22 LEU A 100 -5.476 -9.718 -1.408 1.00 0.43 H new ATOM 0 HD23 LEU A 100 -4.596 -9.635 0.137 1.00 0.43 H new ATOM 1560 N PHE A 101 -1.335 -9.858 -1.443 1.00 0.36 N ATOM 1561 CA PHE A 101 -0.489 -10.611 -2.356 1.00 0.36 C ATOM 1562 C PHE A 101 -1.102 -11.978 -2.649 1.00 0.38 C ATOM 1563 O PHE A 101 -0.831 -12.951 -1.946 1.00 0.88 O ATOM 1564 CB PHE A 101 0.908 -10.780 -1.757 1.00 0.46 C ATOM 1565 CG PHE A 101 1.936 -11.234 -2.751 1.00 0.70 C ATOM 1566 CD1 PHE A 101 2.506 -10.335 -3.636 1.00 1.13 C ATOM 1567 CD2 PHE A 101 2.335 -12.557 -2.796 1.00 1.10 C ATOM 1568 CE1 PHE A 101 3.457 -10.745 -4.549 1.00 1.59 C ATOM 1569 CE2 PHE A 101 3.286 -12.977 -3.709 1.00 1.59 C ATOM 1570 CZ PHE A 101 3.846 -12.070 -4.587 1.00 1.75 C ATOM 0 H PHE A 101 -1.494 -10.311 -0.543 1.00 0.36 H new ATOM 0 HA PHE A 101 -0.410 -10.058 -3.292 1.00 0.36 H new ATOM 0 HB2 PHE A 101 1.226 -9.831 -1.325 1.00 0.46 H new ATOM 0 HB3 PHE A 101 0.860 -11.501 -0.941 1.00 0.46 H new ATOM 0 HD1 PHE A 101 2.203 -9.299 -3.612 1.00 1.13 H new ATOM 0 HD2 PHE A 101 1.900 -13.270 -2.111 1.00 1.10 H new ATOM 0 HE1 PHE A 101 3.896 -10.032 -5.231 1.00 1.59 H new ATOM 0 HE2 PHE A 101 3.590 -14.013 -3.735 1.00 1.59 H new ATOM 0 HZ PHE A 101 4.587 -12.396 -5.302 1.00 1.75 H new ATOM 1580 N GLY A 102 -1.932 -12.039 -3.687 1.00 0.58 N ATOM 1581 CA GLY A 102 -2.576 -13.289 -4.054 1.00 0.60 C ATOM 1582 C GLY A 102 -3.411 -13.864 -2.927 1.00 0.73 C ATOM 1583 O GLY A 102 -4.165 -13.141 -2.273 1.00 1.49 O ATOM 0 H GLY A 102 -2.170 -11.245 -4.281 1.00 0.58 H new ATOM 0 HA2 GLY A 102 -3.211 -13.125 -4.925 1.00 0.60 H new ATOM 0 HA3 GLY A 102 -1.816 -14.014 -4.345 1.00 0.60 H new ATOM 1587 N ASN A 103 -3.279 -15.167 -2.696 1.00 0.56 N ATOM 1588 CA ASN A 103 -4.027 -15.836 -1.637 1.00 0.58 C ATOM 1589 C ASN A 103 -3.087 -16.515 -0.646 1.00 0.52 C ATOM 1590 O ASN A 103 -3.531 -17.226 0.257 1.00 0.67 O ATOM 1591 CB ASN A 103 -5.000 -16.860 -2.231 1.00 0.76 C ATOM 1592 CG ASN A 103 -4.311 -17.946 -3.046 1.00 0.85 C ATOM 1593 OD1 ASN A 103 -4.969 -18.852 -3.559 1.00 1.55 O ATOM 1594 ND2 ASN A 103 -2.991 -17.866 -3.172 1.00 0.90 N ATOM 0 H ASN A 103 -2.661 -15.780 -3.228 1.00 0.56 H new ATOM 0 HA ASN A 103 -4.598 -15.079 -1.100 1.00 0.58 H new ATOM 0 HB2 ASN A 103 -5.564 -17.325 -1.423 1.00 0.76 H new ATOM 0 HB3 ASN A 103 -5.719 -16.342 -2.865 1.00 0.76 H new ATOM 0 HD21 ASN A 103 -2.486 -18.571 -3.709 1.00 0.90 H new ATOM 0 HD22 ASN A 103 -2.482 -17.100 -2.732 1.00 0.90 H new ATOM 1601 N GLU A 104 -1.785 -16.286 -0.812 1.00 0.43 N ATOM 1602 CA GLU A 104 -0.788 -16.876 0.078 1.00 0.42 C ATOM 1603 C GLU A 104 -0.905 -16.311 1.485 1.00 0.42 C ATOM 1604 O GLU A 104 -1.548 -15.283 1.704 1.00 0.58 O ATOM 1605 CB GLU A 104 0.634 -16.656 -0.442 1.00 0.51 C ATOM 1606 CG GLU A 104 0.801 -15.414 -1.301 1.00 0.56 C ATOM 1607 CD GLU A 104 0.304 -15.616 -2.721 1.00 1.57 C ATOM 1608 OE1 GLU A 104 -0.174 -16.728 -3.031 1.00 2.29 O ATOM 1609 OE2 GLU A 104 0.389 -14.663 -3.524 1.00 2.14 O ATOM 0 H GLU A 104 -1.398 -15.699 -1.551 1.00 0.43 H new ATOM 0 HA GLU A 104 -0.986 -17.947 0.106 1.00 0.42 H new ATOM 0 HB2 GLU A 104 1.313 -16.589 0.408 1.00 0.51 H new ATOM 0 HB3 GLU A 104 0.935 -17.528 -1.023 1.00 0.51 H new ATOM 0 HG2 GLU A 104 0.259 -14.585 -0.845 1.00 0.56 H new ATOM 0 HG3 GLU A 104 1.854 -15.132 -1.325 1.00 0.56 H new ATOM 1616 N VAL A 105 -0.280 -16.995 2.432 1.00 0.50 N ATOM 1617 CA VAL A 105 -0.300 -16.581 3.827 1.00 0.56 C ATOM 1618 C VAL A 105 1.018 -16.926 4.509 1.00 0.61 C ATOM 1619 O VAL A 105 1.155 -17.986 5.123 1.00 0.72 O ATOM 1620 CB VAL A 105 -1.461 -17.252 4.587 1.00 0.66 C ATOM 1621 CG1 VAL A 105 -1.428 -16.880 6.063 1.00 0.80 C ATOM 1622 CG2 VAL A 105 -2.800 -16.870 3.973 1.00 0.67 C ATOM 0 H VAL A 105 0.252 -17.847 2.257 1.00 0.50 H new ATOM 0 HA VAL A 105 -0.443 -15.501 3.847 1.00 0.56 H new ATOM 0 HB VAL A 105 -1.339 -18.332 4.502 1.00 0.66 H new ATOM 0 HG11 VAL A 105 -2.257 -17.365 6.579 1.00 0.80 H new ATOM 0 HG12 VAL A 105 -0.485 -17.209 6.500 1.00 0.80 H new ATOM 0 HG13 VAL A 105 -1.518 -15.799 6.168 1.00 0.80 H new ATOM 0 HG21 VAL A 105 -3.605 -17.355 4.525 1.00 0.67 H new ATOM 0 HG22 VAL A 105 -2.927 -15.788 4.021 1.00 0.67 H new ATOM 0 HG23 VAL A 105 -2.828 -17.193 2.932 1.00 0.67 H new ATOM 1632 N ILE A 106 1.991 -16.026 4.395 1.00 0.58 N ATOM 1633 CA ILE A 106 3.299 -16.235 4.998 1.00 0.64 C ATOM 1634 C ILE A 106 3.754 -14.989 5.751 1.00 0.61 C ATOM 1635 O ILE A 106 3.633 -13.873 5.250 1.00 0.57 O ATOM 1636 CB ILE A 106 4.354 -16.605 3.937 1.00 0.74 C ATOM 1637 CG1 ILE A 106 3.916 -17.856 3.170 1.00 0.76 C ATOM 1638 CG2 ILE A 106 5.711 -16.824 4.593 1.00 1.31 C ATOM 1639 CD1 ILE A 106 4.863 -18.254 2.057 1.00 1.45 C ATOM 0 H ILE A 106 1.896 -15.145 3.890 1.00 0.58 H new ATOM 0 HA ILE A 106 3.202 -17.064 5.699 1.00 0.64 H new ATOM 0 HB ILE A 106 4.445 -15.781 3.230 1.00 0.74 H new ATOM 0 HG12 ILE A 106 3.824 -18.686 3.870 1.00 0.76 H new ATOM 0 HG13 ILE A 106 2.926 -17.684 2.748 1.00 0.76 H new ATOM 0 HG21 ILE A 106 6.446 -17.085 3.831 1.00 1.31 H new ATOM 0 HG22 ILE A 106 6.022 -15.910 5.099 1.00 1.31 H new ATOM 0 HG23 ILE A 106 5.638 -17.634 5.319 1.00 1.31 H new ATOM 0 HD11 ILE A 106 4.486 -19.148 1.560 1.00 1.45 H new ATOM 0 HD12 ILE A 106 4.937 -17.441 1.334 1.00 1.45 H new ATOM 0 HD13 ILE A 106 5.849 -18.460 2.474 1.00 1.45 H new ATOM 1651 N ASN A 107 4.278 -15.195 6.956 1.00 0.84 N ATOM 1652 CA ASN A 107 4.757 -14.096 7.791 1.00 0.90 C ATOM 1653 C ASN A 107 6.211 -14.318 8.190 1.00 0.91 C ATOM 1654 O ASN A 107 6.535 -15.300 8.856 1.00 1.02 O ATOM 1655 CB ASN A 107 3.902 -13.965 9.059 1.00 1.09 C ATOM 1656 CG ASN A 107 2.440 -13.617 8.795 1.00 1.00 C ATOM 1657 OD1 ASN A 107 1.637 -13.558 9.725 1.00 1.28 O ATOM 1658 ND2 ASN A 107 2.084 -13.376 7.539 1.00 1.21 N ATOM 0 H ASN A 107 4.382 -16.118 7.378 1.00 0.84 H new ATOM 0 HA ASN A 107 4.679 -13.178 7.208 1.00 0.90 H new ATOM 0 HB2 ASN A 107 3.946 -14.903 9.612 1.00 1.09 H new ATOM 0 HB3 ASN A 107 4.337 -13.197 9.699 1.00 1.09 H new ATOM 0 HD21 ASN A 107 1.118 -13.133 7.320 1.00 1.21 H new ATOM 0 HD22 ASN A 107 2.777 -13.434 6.792 1.00 1.21 H new ATOM 1665 N THR A 108 7.082 -13.400 7.788 1.00 0.86 N ATOM 1666 CA THR A 108 8.500 -13.505 8.117 1.00 0.89 C ATOM 1667 C THR A 108 8.911 -12.399 9.096 1.00 0.91 C ATOM 1668 O THR A 108 8.328 -12.271 10.172 1.00 1.16 O ATOM 1669 CB THR A 108 9.353 -13.448 6.846 1.00 0.90 C ATOM 1670 OG1 THR A 108 9.214 -12.195 6.204 1.00 1.07 O ATOM 1671 CG2 THR A 108 8.998 -14.523 5.843 1.00 0.92 C ATOM 0 H THR A 108 6.834 -12.578 7.237 1.00 0.86 H new ATOM 0 HA THR A 108 8.670 -14.467 8.600 1.00 0.89 H new ATOM 0 HB THR A 108 10.379 -13.607 7.177 1.00 0.90 H new ATOM 0 HG1 THR A 108 9.768 -12.178 5.396 1.00 1.07 H new ATOM 0 HG21 THR A 108 9.638 -14.428 4.966 1.00 0.92 H new ATOM 0 HG22 THR A 108 9.144 -15.504 6.294 1.00 0.92 H new ATOM 0 HG23 THR A 108 7.955 -14.413 5.545 1.00 0.92 H new ATOM 1679 N GLU A 109 9.907 -11.599 8.718 1.00 0.83 N ATOM 1680 CA GLU A 109 10.375 -10.508 9.570 1.00 0.86 C ATOM 1681 C GLU A 109 9.663 -9.211 9.211 1.00 0.73 C ATOM 1682 O GLU A 109 9.276 -8.438 10.087 1.00 0.87 O ATOM 1683 CB GLU A 109 11.888 -10.330 9.428 1.00 0.95 C ATOM 1684 CG GLU A 109 12.689 -11.556 9.836 1.00 1.22 C ATOM 1685 CD GLU A 109 14.186 -11.350 9.706 1.00 1.93 C ATOM 1686 OE1 GLU A 109 14.600 -10.246 9.293 1.00 2.60 O ATOM 1687 OE2 GLU A 109 14.944 -12.293 10.016 1.00 2.37 O ATOM 0 H GLU A 109 10.403 -11.685 7.831 1.00 0.83 H new ATOM 0 HA GLU A 109 10.147 -10.760 10.606 1.00 0.86 H new ATOM 0 HB2 GLU A 109 12.120 -10.084 8.392 1.00 0.95 H new ATOM 0 HB3 GLU A 109 12.204 -9.482 10.036 1.00 0.95 H new ATOM 0 HG2 GLU A 109 12.451 -11.813 10.868 1.00 1.22 H new ATOM 0 HG3 GLU A 109 12.388 -12.403 9.219 1.00 1.22 H new ATOM 1694 N ARG A 110 9.489 -8.987 7.915 1.00 0.63 N ATOM 1695 CA ARG A 110 8.816 -7.794 7.423 1.00 0.64 C ATOM 1696 C ARG A 110 7.646 -8.169 6.523 1.00 0.66 C ATOM 1697 O ARG A 110 6.726 -7.376 6.321 1.00 0.77 O ATOM 1698 CB ARG A 110 9.797 -6.904 6.655 1.00 0.63 C ATOM 1699 CG ARG A 110 10.855 -6.254 7.533 1.00 0.86 C ATOM 1700 CD ARG A 110 10.231 -5.337 8.574 1.00 1.64 C ATOM 1701 NE ARG A 110 9.414 -4.291 7.962 1.00 2.22 N ATOM 1702 CZ ARG A 110 8.753 -3.368 8.654 1.00 2.77 C ATOM 1703 NH1 ARG A 110 8.814 -3.355 9.979 1.00 3.01 N ATOM 1704 NH2 ARG A 110 8.031 -2.456 8.021 1.00 3.68 N ATOM 0 H ARG A 110 9.807 -9.621 7.182 1.00 0.63 H new ATOM 0 HA ARG A 110 8.435 -7.242 8.282 1.00 0.64 H new ATOM 0 HB2 ARG A 110 10.291 -7.501 5.889 1.00 0.63 H new ATOM 0 HB3 ARG A 110 9.237 -6.124 6.139 1.00 0.63 H new ATOM 0 HG2 ARG A 110 11.440 -7.027 8.032 1.00 0.86 H new ATOM 0 HG3 ARG A 110 11.545 -5.683 6.911 1.00 0.86 H new ATOM 0 HD2 ARG A 110 9.616 -5.926 9.254 1.00 1.64 H new ATOM 0 HD3 ARG A 110 11.018 -4.879 9.172 1.00 1.64 H new ATOM 0 HE ARG A 110 9.347 -4.268 6.944 1.00 2.22 H new ATOM 0 HH11 ARG A 110 9.370 -4.055 10.471 1.00 3.01 H new ATOM 0 HH12 ARG A 110 8.305 -2.645 10.506 1.00 3.01 H new ATOM 0 HH21 ARG A 110 7.982 -2.462 7.002 1.00 3.68 H new ATOM 0 HH22 ARG A 110 7.524 -1.748 8.552 1.00 3.68 H new ATOM 1718 N LEU A 111 7.689 -9.386 5.990 1.00 0.62 N ATOM 1719 CA LEU A 111 6.633 -9.870 5.112 1.00 0.63 C ATOM 1720 C LEU A 111 5.286 -9.898 5.821 1.00 0.56 C ATOM 1721 O LEU A 111 5.127 -10.539 6.858 1.00 0.66 O ATOM 1722 CB LEU A 111 6.960 -11.272 4.588 1.00 0.73 C ATOM 1723 CG LEU A 111 5.745 -12.089 4.128 1.00 0.94 C ATOM 1724 CD1 LEU A 111 4.980 -11.362 3.033 1.00 1.15 C ATOM 1725 CD2 LEU A 111 6.161 -13.469 3.653 1.00 1.64 C ATOM 0 H LEU A 111 8.443 -10.053 6.151 1.00 0.62 H new ATOM 0 HA LEU A 111 6.571 -9.176 4.274 1.00 0.63 H new ATOM 0 HB2 LEU A 111 7.654 -11.179 3.753 1.00 0.73 H new ATOM 0 HB3 LEU A 111 7.476 -11.826 5.372 1.00 0.73 H new ATOM 0 HG LEU A 111 5.085 -12.207 4.988 1.00 0.94 H new ATOM 0 HD11 LEU A 111 4.124 -11.964 2.726 1.00 1.15 H new ATOM 0 HD12 LEU A 111 4.631 -10.401 3.410 1.00 1.15 H new ATOM 0 HD13 LEU A 111 5.635 -11.200 2.177 1.00 1.15 H new ATOM 0 HD21 LEU A 111 5.280 -14.025 3.333 1.00 1.64 H new ATOM 0 HD22 LEU A 111 6.852 -13.373 2.816 1.00 1.64 H new ATOM 0 HD23 LEU A 111 6.650 -14.002 4.468 1.00 1.64 H new ATOM 1737 N THR A 112 4.319 -9.215 5.228 1.00 0.46 N ATOM 1738 CA THR A 112 2.975 -9.171 5.760 1.00 0.42 C ATOM 1739 C THR A 112 1.965 -9.344 4.638 1.00 0.39 C ATOM 1740 O THR A 112 1.866 -8.505 3.744 1.00 0.43 O ATOM 1741 CB THR A 112 2.719 -7.851 6.484 1.00 0.45 C ATOM 1742 OG1 THR A 112 3.208 -6.758 5.728 1.00 0.65 O ATOM 1743 CG2 THR A 112 3.336 -7.782 7.864 1.00 0.68 C ATOM 0 H THR A 112 4.447 -8.680 4.369 1.00 0.46 H new ATOM 0 HA THR A 112 2.865 -9.986 6.475 1.00 0.42 H new ATOM 0 HB THR A 112 1.636 -7.796 6.597 1.00 0.45 H new ATOM 0 HG1 THR A 112 2.906 -6.841 4.799 1.00 0.65 H new ATOM 0 HG21 THR A 112 3.111 -6.815 8.315 1.00 0.68 H new ATOM 0 HG22 THR A 112 2.925 -8.577 8.486 1.00 0.68 H new ATOM 0 HG23 THR A 112 4.416 -7.904 7.786 1.00 0.68 H new ATOM 1751 N VAL A 113 1.199 -10.423 4.702 1.00 0.36 N ATOM 1752 CA VAL A 113 0.178 -10.684 3.704 1.00 0.38 C ATOM 1753 C VAL A 113 -1.065 -9.907 4.154 1.00 0.32 C ATOM 1754 O VAL A 113 -0.990 -9.290 5.213 1.00 0.30 O ATOM 1755 CB VAL A 113 -0.072 -12.215 3.591 1.00 0.45 C ATOM 1756 CG1 VAL A 113 -1.323 -12.650 4.337 1.00 1.52 C ATOM 1757 CG2 VAL A 113 -0.108 -12.656 2.134 1.00 1.18 C ATOM 0 H VAL A 113 1.267 -11.130 5.434 1.00 0.36 H new ATOM 0 HA VAL A 113 0.472 -10.357 2.707 1.00 0.38 H new ATOM 0 HB VAL A 113 0.768 -12.715 4.073 1.00 0.45 H new ATOM 0 HG11 VAL A 113 -1.455 -13.727 4.229 1.00 1.52 H new ATOM 0 HG12 VAL A 113 -1.222 -12.401 5.393 1.00 1.52 H new ATOM 0 HG13 VAL A 113 -2.190 -12.135 3.924 1.00 1.52 H new ATOM 0 HG21 VAL A 113 -0.284 -13.730 2.083 1.00 1.18 H new ATOM 0 HG22 VAL A 113 -0.910 -12.132 1.615 1.00 1.18 H new ATOM 0 HG23 VAL A 113 0.845 -12.422 1.659 1.00 1.18 H new ATOM 1767 N PRO A 114 -2.209 -9.884 3.409 1.00 0.35 N ATOM 1768 CA PRO A 114 -3.397 -9.144 3.812 1.00 0.36 C ATOM 1769 C PRO A 114 -3.379 -8.785 5.295 1.00 0.33 C ATOM 1770 O PRO A 114 -3.828 -9.550 6.148 1.00 0.35 O ATOM 1771 CB PRO A 114 -4.493 -10.145 3.460 1.00 0.43 C ATOM 1772 CG PRO A 114 -3.963 -10.875 2.250 1.00 0.46 C ATOM 1773 CD PRO A 114 -2.480 -10.556 2.138 1.00 0.42 C ATOM 0 HA PRO A 114 -3.511 -8.174 3.327 1.00 0.36 H new ATOM 0 HB2 PRO A 114 -4.684 -10.831 4.285 1.00 0.43 H new ATOM 0 HB3 PRO A 114 -5.434 -9.642 3.239 1.00 0.43 H new ATOM 0 HG2 PRO A 114 -4.118 -11.949 2.352 1.00 0.46 H new ATOM 0 HG3 PRO A 114 -4.492 -10.561 1.350 1.00 0.46 H new ATOM 0 HD2 PRO A 114 -1.878 -11.457 2.018 1.00 0.42 H new ATOM 0 HD3 PRO A 114 -2.266 -9.913 1.284 1.00 0.42 H new ATOM 1781 N HIS A 115 -2.796 -7.620 5.575 1.00 0.33 N ATOM 1782 CA HIS A 115 -2.629 -7.125 6.928 1.00 0.33 C ATOM 1783 C HIS A 115 -3.895 -6.473 7.449 1.00 0.34 C ATOM 1784 O HIS A 115 -4.415 -5.538 6.841 1.00 0.46 O ATOM 1785 CB HIS A 115 -1.472 -6.120 6.931 1.00 0.39 C ATOM 1786 CG HIS A 115 -1.178 -5.499 8.259 1.00 0.44 C ATOM 1787 ND1 HIS A 115 -1.075 -6.222 9.430 1.00 0.97 N ATOM 1788 CD2 HIS A 115 -0.931 -4.210 8.593 1.00 0.76 C ATOM 1789 CE1 HIS A 115 -0.779 -5.403 10.425 1.00 0.87 C ATOM 1790 NE2 HIS A 115 -0.686 -4.178 9.943 1.00 0.67 N ATOM 0 H HIS A 115 -2.426 -6.994 4.860 1.00 0.33 H new ATOM 0 HA HIS A 115 -2.409 -7.963 7.589 1.00 0.33 H new ATOM 0 HB2 HIS A 115 -0.573 -6.623 6.575 1.00 0.39 H new ATOM 0 HB3 HIS A 115 -1.697 -5.327 6.218 1.00 0.39 H new ATOM 0 HD2 HIS A 115 -0.927 -3.364 7.922 1.00 0.76 H new ATOM 0 HE1 HIS A 115 -0.637 -5.688 11.457 1.00 0.87 H new ATOM 0 HE2 HIS A 115 -0.467 -3.343 10.486 1.00 0.67 H new ATOM 1799 N TYR A 116 -4.372 -6.958 8.590 1.00 0.34 N ATOM 1800 CA TYR A 116 -5.566 -6.390 9.201 1.00 0.42 C ATOM 1801 C TYR A 116 -5.321 -4.919 9.501 1.00 0.43 C ATOM 1802 O TYR A 116 -4.814 -4.558 10.564 1.00 0.49 O ATOM 1803 CB TYR A 116 -5.963 -7.155 10.474 1.00 0.52 C ATOM 1804 CG TYR A 116 -4.805 -7.773 11.240 1.00 0.70 C ATOM 1805 CD1 TYR A 116 -3.617 -7.079 11.455 1.00 1.13 C ATOM 1806 CD2 TYR A 116 -4.912 -9.059 11.756 1.00 0.89 C ATOM 1807 CE1 TYR A 116 -2.575 -7.653 12.158 1.00 1.64 C ATOM 1808 CE2 TYR A 116 -3.872 -9.636 12.461 1.00 1.31 C ATOM 1809 CZ TYR A 116 -2.707 -8.929 12.658 1.00 1.68 C ATOM 1810 OH TYR A 116 -1.669 -9.501 13.357 1.00 2.22 O ATOM 0 H TYR A 116 -3.956 -7.734 9.105 1.00 0.34 H new ATOM 0 HA TYR A 116 -6.398 -6.482 8.503 1.00 0.42 H new ATOM 0 HB2 TYR A 116 -6.496 -6.474 11.138 1.00 0.52 H new ATOM 0 HB3 TYR A 116 -6.662 -7.946 10.201 1.00 0.52 H new ATOM 0 HD1 TYR A 116 -3.508 -6.077 11.066 1.00 1.13 H new ATOM 0 HD2 TYR A 116 -5.824 -9.618 11.604 1.00 0.89 H new ATOM 0 HE1 TYR A 116 -1.659 -7.102 12.315 1.00 1.64 H new ATOM 0 HE2 TYR A 116 -3.973 -10.636 12.855 1.00 1.31 H new ATOM 0 HH TYR A 116 -1.924 -10.403 13.642 1.00 2.22 H new ATOM 1820 N ASP A 117 -5.660 -4.080 8.531 1.00 0.42 N ATOM 1821 CA ASP A 117 -5.452 -2.645 8.643 1.00 0.50 C ATOM 1822 C ASP A 117 -6.042 -1.936 7.431 1.00 0.52 C ATOM 1823 O ASP A 117 -6.459 -0.781 7.507 1.00 0.73 O ATOM 1824 CB ASP A 117 -3.952 -2.353 8.712 1.00 0.52 C ATOM 1825 CG ASP A 117 -3.651 -0.983 9.292 1.00 0.67 C ATOM 1826 OD1 ASP A 117 -4.609 -0.259 9.637 1.00 1.07 O ATOM 1827 OD2 ASP A 117 -2.457 -0.634 9.402 1.00 0.87 O ATOM 0 H ASP A 117 -6.084 -4.374 7.651 1.00 0.42 H new ATOM 0 HA ASP A 117 -5.943 -2.284 9.547 1.00 0.50 H new ATOM 0 HB2 ASP A 117 -3.465 -3.116 9.319 1.00 0.52 H new ATOM 0 HB3 ASP A 117 -3.526 -2.422 7.711 1.00 0.52 H new ATOM 1832 N MET A 118 -6.047 -2.643 6.307 1.00 0.38 N ATOM 1833 CA MET A 118 -6.554 -2.109 5.051 1.00 0.39 C ATOM 1834 C MET A 118 -8.069 -2.254 4.934 1.00 0.38 C ATOM 1835 O MET A 118 -8.755 -1.372 4.418 1.00 0.45 O ATOM 1836 CB MET A 118 -5.888 -2.848 3.890 1.00 0.44 C ATOM 1837 CG MET A 118 -6.271 -4.317 3.810 1.00 0.48 C ATOM 1838 SD MET A 118 -5.653 -5.122 2.323 1.00 1.29 S ATOM 1839 CE MET A 118 -6.330 -6.766 2.533 1.00 2.05 C ATOM 0 H MET A 118 -5.700 -3.600 6.242 1.00 0.38 H new ATOM 0 HA MET A 118 -6.319 -1.045 5.021 1.00 0.39 H new ATOM 0 HB2 MET A 118 -6.158 -2.358 2.955 1.00 0.44 H new ATOM 0 HB3 MET A 118 -4.806 -2.767 3.991 1.00 0.44 H new ATOM 0 HG2 MET A 118 -5.883 -4.837 4.686 1.00 0.48 H new ATOM 0 HG3 MET A 118 -7.357 -4.406 3.841 1.00 0.48 H new ATOM 0 HE1 MET A 118 -5.518 -7.492 2.571 1.00 2.05 H new ATOM 0 HE2 MET A 118 -6.899 -6.809 3.462 1.00 2.05 H new ATOM 0 HE3 MET A 118 -6.986 -6.999 1.694 1.00 2.05 H new ATOM 1849 N LYS A 119 -8.573 -3.390 5.394 1.00 0.40 N ATOM 1850 CA LYS A 119 -9.998 -3.702 5.330 1.00 0.47 C ATOM 1851 C LYS A 119 -10.810 -2.875 6.318 1.00 0.50 C ATOM 1852 O LYS A 119 -12.037 -2.967 6.360 1.00 0.80 O ATOM 1853 CB LYS A 119 -10.186 -5.191 5.583 1.00 0.57 C ATOM 1854 CG LYS A 119 -9.397 -5.693 6.779 1.00 0.69 C ATOM 1855 CD LYS A 119 -9.550 -7.195 6.969 1.00 0.80 C ATOM 1856 CE LYS A 119 -8.985 -7.973 5.791 1.00 1.02 C ATOM 1857 NZ LYS A 119 -9.123 -9.443 5.979 1.00 1.93 N ATOM 0 H LYS A 119 -8.008 -4.123 5.823 1.00 0.40 H new ATOM 0 HA LYS A 119 -10.367 -3.446 4.337 1.00 0.47 H new ATOM 0 HB2 LYS A 119 -11.245 -5.396 5.741 1.00 0.57 H new ATOM 0 HB3 LYS A 119 -9.882 -5.746 4.695 1.00 0.57 H new ATOM 0 HG2 LYS A 119 -8.343 -5.449 6.647 1.00 0.69 H new ATOM 0 HG3 LYS A 119 -9.733 -5.177 7.678 1.00 0.69 H new ATOM 0 HD2 LYS A 119 -9.041 -7.500 7.884 1.00 0.80 H new ATOM 0 HD3 LYS A 119 -10.605 -7.440 7.094 1.00 0.80 H new ATOM 0 HE2 LYS A 119 -9.500 -7.674 4.878 1.00 1.02 H new ATOM 0 HE3 LYS A 119 -7.933 -7.721 5.661 1.00 1.02 H new ATOM 0 HZ1 LYS A 119 -8.181 -9.884 5.968 1.00 1.93 H new ATOM 0 HZ2 LYS A 119 -9.584 -9.635 6.891 1.00 1.93 H new ATOM 0 HZ3 LYS A 119 -9.700 -9.839 5.209 1.00 1.93 H new ATOM 1871 N ASN A 120 -10.121 -2.051 7.091 1.00 0.49 N ATOM 1872 CA ASN A 120 -10.772 -1.181 8.060 1.00 0.52 C ATOM 1873 C ASN A 120 -10.447 0.268 7.730 1.00 0.56 C ATOM 1874 O ASN A 120 -10.491 1.145 8.592 1.00 0.74 O ATOM 1875 CB ASN A 120 -10.329 -1.526 9.482 1.00 0.53 C ATOM 1876 CG ASN A 120 -8.838 -1.775 9.581 1.00 1.17 C ATOM 1877 OD1 ASN A 120 -8.321 -2.723 8.993 1.00 2.11 O ATOM 1878 ND2 ASN A 120 -8.139 -0.926 10.324 1.00 1.30 N ATOM 0 H ASN A 120 -9.105 -1.966 7.066 1.00 0.49 H new ATOM 0 HA ASN A 120 -11.851 -1.328 8.006 1.00 0.52 H new ATOM 0 HB2 ASN A 120 -10.603 -0.711 10.152 1.00 0.53 H new ATOM 0 HB3 ASN A 120 -10.865 -2.412 9.821 1.00 0.53 H new ATOM 0 HD21 ASN A 120 -7.131 -1.047 10.425 1.00 1.30 H new ATOM 0 HD22 ASN A 120 -8.610 -0.153 10.794 1.00 1.30 H new ATOM 1885 N ARG A 121 -10.117 0.495 6.461 1.00 0.49 N ATOM 1886 CA ARG A 121 -9.770 1.822 5.962 1.00 0.58 C ATOM 1887 C ARG A 121 -10.204 1.958 4.505 1.00 0.63 C ATOM 1888 O ARG A 121 -10.628 0.982 3.889 1.00 1.07 O ATOM 1889 CB ARG A 121 -8.260 2.042 6.073 1.00 0.64 C ATOM 1890 CG ARG A 121 -7.721 1.901 7.488 1.00 0.91 C ATOM 1891 CD ARG A 121 -7.906 3.177 8.297 1.00 1.24 C ATOM 1892 NE ARG A 121 -9.312 3.555 8.424 1.00 1.84 N ATOM 1893 CZ ARG A 121 -9.731 4.627 9.090 1.00 2.55 C ATOM 1894 NH1 ARG A 121 -8.860 5.425 9.690 1.00 2.86 N ATOM 1895 NH2 ARG A 121 -11.028 4.899 9.158 1.00 3.50 N ATOM 0 H ARG A 121 -10.083 -0.236 5.750 1.00 0.49 H new ATOM 0 HA ARG A 121 -10.286 2.572 6.561 1.00 0.58 H new ATOM 0 HB2 ARG A 121 -7.750 1.327 5.427 1.00 0.64 H new ATOM 0 HB3 ARG A 121 -8.019 3.037 5.700 1.00 0.64 H new ATOM 0 HG2 ARG A 121 -8.229 1.077 7.989 1.00 0.91 H new ATOM 0 HG3 ARG A 121 -6.662 1.646 7.449 1.00 0.91 H new ATOM 0 HD2 ARG A 121 -7.478 3.040 9.290 1.00 1.24 H new ATOM 0 HD3 ARG A 121 -7.355 3.989 7.822 1.00 1.24 H new ATOM 0 HE ARG A 121 -10.012 2.963 7.976 1.00 1.84 H new ATOM 0 HH11 ARG A 121 -7.862 5.218 9.642 1.00 2.86 H new ATOM 0 HH12 ARG A 121 -9.187 6.246 10.199 1.00 2.86 H new ATOM 0 HH21 ARG A 121 -11.702 4.286 8.700 1.00 3.50 H new ATOM 0 HH22 ARG A 121 -11.351 5.721 9.669 1.00 3.50 H new ATOM 1909 N GLY A 122 -10.090 3.163 3.956 1.00 0.62 N ATOM 1910 CA GLY A 122 -10.472 3.381 2.574 1.00 0.61 C ATOM 1911 C GLY A 122 -9.330 3.891 1.726 1.00 0.56 C ATOM 1912 O GLY A 122 -9.510 4.166 0.547 1.00 0.70 O ATOM 0 H GLY A 122 -9.741 3.989 4.442 1.00 0.62 H new ATOM 0 HA2 GLY A 122 -10.843 2.447 2.152 1.00 0.61 H new ATOM 0 HA3 GLY A 122 -11.294 4.096 2.537 1.00 0.61 H new ATOM 1916 N PHE A 123 -8.146 3.991 2.315 1.00 0.52 N ATOM 1917 CA PHE A 123 -6.981 4.439 1.570 1.00 0.58 C ATOM 1918 C PHE A 123 -6.186 3.233 1.092 1.00 0.42 C ATOM 1919 O PHE A 123 -5.412 3.315 0.144 1.00 0.43 O ATOM 1920 CB PHE A 123 -6.118 5.405 2.397 1.00 0.84 C ATOM 1921 CG PHE A 123 -5.801 4.940 3.791 1.00 1.19 C ATOM 1922 CD1 PHE A 123 -5.004 3.830 4.009 1.00 1.62 C ATOM 1923 CD2 PHE A 123 -6.298 5.630 4.886 1.00 2.11 C ATOM 1924 CE1 PHE A 123 -4.706 3.415 5.294 1.00 2.59 C ATOM 1925 CE2 PHE A 123 -6.005 5.219 6.172 1.00 3.16 C ATOM 1926 CZ PHE A 123 -5.209 4.110 6.376 1.00 3.31 C ATOM 0 H PHE A 123 -7.969 3.770 3.295 1.00 0.52 H new ATOM 0 HA PHE A 123 -7.316 4.999 0.697 1.00 0.58 H new ATOM 0 HB2 PHE A 123 -5.182 5.577 1.866 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -6.631 6.365 2.458 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -4.610 3.282 3.166 1.00 1.62 H new ATOM 0 HD2 PHE A 123 -6.921 6.499 4.732 1.00 2.11 H new ATOM 0 HE1 PHE A 123 -4.081 2.549 5.451 1.00 2.59 H new ATOM 0 HE2 PHE A 123 -6.398 5.765 7.017 1.00 3.16 H new ATOM 0 HZ PHE A 123 -4.980 3.786 7.381 1.00 3.31 H new ATOM 1936 N MET A 124 -6.421 2.099 1.742 1.00 0.37 N ATOM 1937 CA MET A 124 -5.770 0.848 1.374 1.00 0.38 C ATOM 1938 C MET A 124 -6.611 0.084 0.355 1.00 0.38 C ATOM 1939 O MET A 124 -6.093 -0.458 -0.622 1.00 0.57 O ATOM 1940 CB MET A 124 -5.563 -0.037 2.605 1.00 0.50 C ATOM 1941 CG MET A 124 -4.575 0.517 3.616 1.00 0.90 C ATOM 1942 SD MET A 124 -2.902 0.647 2.957 1.00 1.99 S ATOM 1943 CE MET A 124 -2.021 1.258 4.391 1.00 2.44 C ATOM 0 H MET A 124 -7.062 2.021 2.532 1.00 0.37 H new ATOM 0 HA MET A 124 -4.802 1.095 0.937 1.00 0.38 H new ATOM 0 HB2 MET A 124 -6.524 -0.184 3.097 1.00 0.50 H new ATOM 0 HB3 MET A 124 -5.219 -1.018 2.278 1.00 0.50 H new ATOM 0 HG2 MET A 124 -4.910 1.502 3.943 1.00 0.90 H new ATOM 0 HG3 MET A 124 -4.565 -0.125 4.497 1.00 0.90 H new ATOM 0 HE1 MET A 124 -0.966 0.997 4.308 1.00 2.44 H new ATOM 0 HE2 MET A 124 -2.123 2.342 4.446 1.00 2.44 H new ATOM 0 HE3 MET A 124 -2.437 0.808 5.292 1.00 2.44 H new ATOM 1953 N LEU A 125 -7.910 0.013 0.634 1.00 0.37 N ATOM 1954 CA LEU A 125 -8.856 -0.724 -0.202 1.00 0.41 C ATOM 1955 C LEU A 125 -9.341 0.054 -1.422 1.00 0.34 C ATOM 1956 O LEU A 125 -9.265 -0.453 -2.542 1.00 0.40 O ATOM 1957 CB LEU A 125 -10.059 -1.137 0.644 1.00 0.53 C ATOM 1958 CG LEU A 125 -9.795 -2.200 1.719 1.00 0.61 C ATOM 1959 CD1 LEU A 125 -10.952 -3.178 1.787 1.00 0.85 C ATOM 1960 CD2 LEU A 125 -8.488 -2.943 1.475 1.00 0.76 C ATOM 0 H LEU A 125 -8.337 0.463 1.444 1.00 0.37 H new ATOM 0 HA LEU A 125 -8.320 -1.593 -0.583 1.00 0.41 H new ATOM 0 HB2 LEU A 125 -10.457 -0.247 1.132 1.00 0.53 H new ATOM 0 HB3 LEU A 125 -10.836 -1.509 -0.023 1.00 0.53 H new ATOM 0 HG LEU A 125 -9.705 -1.684 2.675 1.00 0.61 H new ATOM 0 HD11 LEU A 125 -10.751 -3.926 2.554 1.00 0.85 H new ATOM 0 HD12 LEU A 125 -11.868 -2.641 2.035 1.00 0.85 H new ATOM 0 HD13 LEU A 125 -11.070 -3.670 0.822 1.00 0.85 H new ATOM 0 HD21 LEU A 125 -8.340 -3.686 2.259 1.00 0.76 H new ATOM 0 HD22 LEU A 125 -8.528 -3.441 0.506 1.00 0.76 H new ATOM 0 HD23 LEU A 125 -7.659 -2.235 1.485 1.00 0.76 H new ATOM 1972 N TRP A 126 -9.876 1.255 -1.210 1.00 0.31 N ATOM 1973 CA TRP A 126 -10.407 2.050 -2.319 1.00 0.32 C ATOM 1974 C TRP A 126 -9.437 2.079 -3.509 1.00 0.29 C ATOM 1975 O TRP A 126 -9.818 1.709 -4.620 1.00 0.31 O ATOM 1976 CB TRP A 126 -10.738 3.467 -1.853 1.00 0.38 C ATOM 1977 CG TRP A 126 -11.222 4.375 -2.943 1.00 0.46 C ATOM 1978 CD1 TRP A 126 -10.829 5.661 -3.149 1.00 0.46 C ATOM 1979 CD2 TRP A 126 -12.183 4.076 -3.962 1.00 0.93 C ATOM 1980 NE1 TRP A 126 -11.477 6.185 -4.240 1.00 0.54 N ATOM 1981 CE2 TRP A 126 -12.315 5.231 -4.758 1.00 0.94 C ATOM 1982 CE3 TRP A 126 -12.942 2.948 -4.286 1.00 1.45 C ATOM 1983 CZ2 TRP A 126 -13.173 5.290 -5.852 1.00 1.42 C ATOM 1984 CZ3 TRP A 126 -13.794 3.007 -5.373 1.00 1.96 C ATOM 1985 CH2 TRP A 126 -13.903 4.170 -6.145 1.00 1.93 C ATOM 0 H TRP A 126 -9.954 1.696 -0.293 1.00 0.31 H new ATOM 0 HA TRP A 126 -11.326 1.573 -2.659 1.00 0.32 H new ATOM 0 HB2 TRP A 126 -11.500 3.413 -1.075 1.00 0.38 H new ATOM 0 HB3 TRP A 126 -9.849 3.905 -1.399 1.00 0.38 H new ATOM 0 HD1 TRP A 126 -10.111 6.193 -2.542 1.00 0.46 H new ATOM 0 HE1 TRP A 126 -11.355 7.129 -4.606 1.00 0.54 H new ATOM 0 HE3 TRP A 126 -12.864 2.046 -3.697 1.00 1.45 H new ATOM 0 HZ2 TRP A 126 -13.260 6.187 -6.448 1.00 1.42 H new ATOM 0 HZ3 TRP A 126 -14.386 2.141 -5.631 1.00 1.96 H new ATOM 0 HH2 TRP A 126 -14.577 4.184 -6.989 1.00 1.93 H new ATOM 1996 N PRO A 127 -8.169 2.504 -3.312 1.00 0.28 N ATOM 1997 CA PRO A 127 -7.181 2.547 -4.401 1.00 0.29 C ATOM 1998 C PRO A 127 -6.902 1.164 -4.984 1.00 0.28 C ATOM 1999 O PRO A 127 -6.810 0.997 -6.198 1.00 0.31 O ATOM 2000 CB PRO A 127 -5.921 3.102 -3.730 1.00 0.30 C ATOM 2001 CG PRO A 127 -6.407 3.774 -2.499 1.00 0.31 C ATOM 2002 CD PRO A 127 -7.589 2.970 -2.040 1.00 0.29 C ATOM 0 HA PRO A 127 -7.532 3.149 -5.239 1.00 0.29 H new ATOM 0 HB2 PRO A 127 -5.216 2.305 -3.493 1.00 0.30 H new ATOM 0 HB3 PRO A 127 -5.402 3.803 -4.384 1.00 0.30 H new ATOM 0 HG2 PRO A 127 -5.631 3.801 -1.734 1.00 0.31 H new ATOM 0 HG3 PRO A 127 -6.690 4.807 -2.702 1.00 0.31 H new ATOM 0 HD2 PRO A 127 -7.291 2.139 -1.401 1.00 0.29 H new ATOM 0 HD3 PRO A 127 -8.294 3.574 -1.469 1.00 0.29 H new ATOM 2010 N LEU A 128 -6.771 0.174 -4.100 1.00 0.25 N ATOM 2011 CA LEU A 128 -6.505 -1.202 -4.512 1.00 0.26 C ATOM 2012 C LEU A 128 -7.624 -1.703 -5.419 1.00 0.27 C ATOM 2013 O LEU A 128 -7.408 -2.524 -6.311 1.00 0.29 O ATOM 2014 CB LEU A 128 -6.424 -2.103 -3.284 1.00 0.26 C ATOM 2015 CG LEU A 128 -5.268 -3.086 -3.256 1.00 0.29 C ATOM 2016 CD1 LEU A 128 -3.942 -2.344 -3.244 1.00 0.30 C ATOM 2017 CD2 LEU A 128 -5.383 -3.988 -2.036 1.00 0.44 C ATOM 0 H LEU A 128 -6.845 0.302 -3.091 1.00 0.25 H new ATOM 0 HA LEU A 128 -5.559 -1.227 -5.052 1.00 0.26 H new ATOM 0 HB2 LEU A 128 -6.360 -1.471 -2.398 1.00 0.26 H new ATOM 0 HB3 LEU A 128 -7.355 -2.665 -3.208 1.00 0.26 H new ATOM 0 HG LEU A 128 -5.308 -3.702 -4.154 1.00 0.29 H new ATOM 0 HD11 LEU A 128 -3.123 -3.063 -3.224 1.00 0.30 H new ATOM 0 HD12 LEU A 128 -3.862 -1.728 -4.139 1.00 0.30 H new ATOM 0 HD13 LEU A 128 -3.889 -1.708 -2.360 1.00 0.30 H new ATOM 0 HD21 LEU A 128 -4.550 -4.691 -2.023 1.00 0.44 H new ATOM 0 HD22 LEU A 128 -5.360 -3.381 -1.131 1.00 0.44 H new ATOM 0 HD23 LEU A 128 -6.322 -4.540 -2.079 1.00 0.44 H new ATOM 2029 N PHE A 129 -8.820 -1.188 -5.168 1.00 0.28 N ATOM 2030 CA PHE A 129 -10.012 -1.547 -5.932 1.00 0.30 C ATOM 2031 C PHE A 129 -9.839 -1.176 -7.406 1.00 0.30 C ATOM 2032 O PHE A 129 -10.620 -1.587 -8.260 1.00 0.32 O ATOM 2033 CB PHE A 129 -11.230 -0.819 -5.355 1.00 0.36 C ATOM 2034 CG PHE A 129 -12.505 -1.032 -6.123 1.00 0.42 C ATOM 2035 CD1 PHE A 129 -13.171 -2.245 -6.073 1.00 0.47 C ATOM 2036 CD2 PHE A 129 -13.044 -0.011 -6.890 1.00 0.48 C ATOM 2037 CE1 PHE A 129 -14.347 -2.438 -6.774 1.00 0.55 C ATOM 2038 CE2 PHE A 129 -14.219 -0.195 -7.591 1.00 0.56 C ATOM 2039 CZ PHE A 129 -14.872 -1.411 -7.535 1.00 0.58 C ATOM 0 H PHE A 129 -8.994 -0.508 -4.428 1.00 0.28 H new ATOM 0 HA PHE A 129 -10.162 -2.624 -5.861 1.00 0.30 H new ATOM 0 HB2 PHE A 129 -11.381 -1.148 -4.327 1.00 0.36 H new ATOM 0 HB3 PHE A 129 -11.016 0.249 -5.320 1.00 0.36 H new ATOM 0 HD1 PHE A 129 -12.767 -3.051 -5.479 1.00 0.47 H new ATOM 0 HD2 PHE A 129 -12.538 0.942 -6.940 1.00 0.48 H new ATOM 0 HE1 PHE A 129 -14.855 -3.390 -6.727 1.00 0.55 H new ATOM 0 HE2 PHE A 129 -14.627 0.611 -8.183 1.00 0.56 H new ATOM 0 HZ PHE A 129 -15.790 -1.559 -8.084 1.00 0.58 H new ATOM 2049 N GLU A 130 -8.826 -0.370 -7.690 1.00 0.29 N ATOM 2050 CA GLU A 130 -8.566 0.084 -9.049 1.00 0.31 C ATOM 2051 C GLU A 130 -7.388 -0.654 -9.674 1.00 0.29 C ATOM 2052 O GLU A 130 -7.375 -0.901 -10.881 1.00 0.32 O ATOM 2053 CB GLU A 130 -8.298 1.588 -9.060 1.00 0.36 C ATOM 2054 CG GLU A 130 -9.439 2.415 -8.488 1.00 0.93 C ATOM 2055 CD GLU A 130 -9.150 3.901 -8.509 1.00 1.41 C ATOM 2056 OE1 GLU A 130 -8.149 4.319 -7.888 1.00 2.43 O ATOM 2057 OE2 GLU A 130 -9.921 4.648 -9.145 1.00 1.52 O ATOM 0 H GLU A 130 -8.169 -0.016 -6.995 1.00 0.29 H new ATOM 0 HA GLU A 130 -9.453 -0.133 -9.644 1.00 0.31 H new ATOM 0 HB2 GLU A 130 -7.392 1.791 -8.489 1.00 0.36 H new ATOM 0 HB3 GLU A 130 -8.108 1.907 -10.085 1.00 0.36 H new ATOM 0 HG2 GLU A 130 -10.347 2.217 -9.058 1.00 0.93 H new ATOM 0 HG3 GLU A 130 -9.632 2.101 -7.462 1.00 0.93 H new ATOM 2064 N ILE A 131 -6.387 -0.991 -8.863 1.00 0.26 N ATOM 2065 CA ILE A 131 -5.212 -1.681 -9.379 1.00 0.27 C ATOM 2066 C ILE A 131 -5.552 -3.118 -9.737 1.00 0.27 C ATOM 2067 O ILE A 131 -4.991 -3.688 -10.673 1.00 0.30 O ATOM 2068 CB ILE A 131 -4.062 -1.664 -8.352 1.00 0.27 C ATOM 2069 CG1 ILE A 131 -4.242 -2.755 -7.284 1.00 0.29 C ATOM 2070 CG2 ILE A 131 -3.990 -0.295 -7.699 1.00 0.32 C ATOM 2071 CD1 ILE A 131 -3.079 -2.862 -6.324 1.00 0.59 C ATOM 0 H ILE A 131 -6.367 -0.800 -7.861 1.00 0.26 H new ATOM 0 HA ILE A 131 -4.887 -1.154 -10.276 1.00 0.27 H new ATOM 0 HB ILE A 131 -3.129 -1.871 -8.877 1.00 0.27 H new ATOM 0 HG12 ILE A 131 -5.151 -2.551 -6.718 1.00 0.29 H new ATOM 0 HG13 ILE A 131 -4.383 -3.716 -7.779 1.00 0.29 H new ATOM 0 HG21 ILE A 131 -3.178 -0.281 -6.972 1.00 0.32 H new ATOM 0 HG22 ILE A 131 -3.808 0.463 -8.461 1.00 0.32 H new ATOM 0 HG23 ILE A 131 -4.932 -0.083 -7.194 1.00 0.32 H new ATOM 0 HD11 ILE A 131 -3.277 -3.652 -5.599 1.00 0.59 H new ATOM 0 HD12 ILE A 131 -2.170 -3.097 -6.878 1.00 0.59 H new ATOM 0 HD13 ILE A 131 -2.950 -1.914 -5.801 1.00 0.59 H new ATOM 2083 N ALA A 132 -6.505 -3.674 -9.000 1.00 0.24 N ATOM 2084 CA ALA A 132 -6.976 -5.038 -9.228 1.00 0.25 C ATOM 2085 C ALA A 132 -7.879 -5.510 -8.094 1.00 0.23 C ATOM 2086 O ALA A 132 -7.416 -6.115 -7.135 1.00 0.28 O ATOM 2087 CB ALA A 132 -5.807 -6.005 -9.393 1.00 0.30 C ATOM 0 H ALA A 132 -6.973 -3.196 -8.230 1.00 0.24 H new ATOM 0 HA ALA A 132 -7.555 -5.027 -10.152 1.00 0.25 H new ATOM 0 HB1 ALA A 132 -6.189 -7.012 -9.561 1.00 0.30 H new ATOM 0 HB2 ALA A 132 -5.200 -5.700 -10.245 1.00 0.30 H new ATOM 0 HB3 ALA A 132 -5.196 -5.995 -8.490 1.00 0.30 H new ATOM 2093 N PRO A 133 -9.187 -5.235 -8.184 1.00 0.25 N ATOM 2094 CA PRO A 133 -10.150 -5.626 -7.164 1.00 0.31 C ATOM 2095 C PRO A 133 -10.796 -6.974 -7.454 1.00 0.35 C ATOM 2096 O PRO A 133 -11.822 -7.322 -6.869 1.00 0.45 O ATOM 2097 CB PRO A 133 -11.162 -4.507 -7.274 1.00 0.37 C ATOM 2098 CG PRO A 133 -11.242 -4.260 -8.746 1.00 0.37 C ATOM 2099 CD PRO A 133 -9.850 -4.508 -9.285 1.00 0.29 C ATOM 0 HA PRO A 133 -9.707 -5.752 -6.176 1.00 0.31 H new ATOM 0 HB2 PRO A 133 -12.128 -4.797 -6.862 1.00 0.37 H new ATOM 0 HB3 PRO A 133 -10.838 -3.617 -6.734 1.00 0.37 H new ATOM 0 HG2 PRO A 133 -11.967 -4.926 -9.215 1.00 0.37 H new ATOM 0 HG3 PRO A 133 -11.565 -3.240 -8.954 1.00 0.37 H new ATOM 0 HD2 PRO A 133 -9.872 -5.098 -10.201 1.00 0.29 H new ATOM 0 HD3 PRO A 133 -9.336 -3.575 -9.519 1.00 0.29 H new ATOM 2107 N GLU A 134 -10.173 -7.738 -8.342 1.00 0.32 N ATOM 2108 CA GLU A 134 -10.670 -9.062 -8.694 1.00 0.37 C ATOM 2109 C GLU A 134 -9.966 -10.073 -7.820 1.00 0.37 C ATOM 2110 O GLU A 134 -9.896 -11.263 -8.124 1.00 0.52 O ATOM 2111 CB GLU A 134 -10.419 -9.364 -10.173 1.00 0.44 C ATOM 2112 CG GLU A 134 -8.952 -9.319 -10.563 1.00 0.46 C ATOM 2113 CD GLU A 134 -8.726 -9.655 -12.026 1.00 0.54 C ATOM 2114 OE1 GLU A 134 -9.087 -10.776 -12.439 1.00 1.14 O ATOM 2115 OE2 GLU A 134 -8.190 -8.796 -12.757 1.00 0.87 O ATOM 0 H GLU A 134 -9.322 -7.463 -8.832 1.00 0.32 H new ATOM 0 HA GLU A 134 -11.747 -9.108 -8.532 1.00 0.37 H new ATOM 0 HB2 GLU A 134 -10.818 -10.351 -10.406 1.00 0.44 H new ATOM 0 HB3 GLU A 134 -10.970 -8.646 -10.780 1.00 0.44 H new ATOM 0 HG2 GLU A 134 -8.556 -8.325 -10.357 1.00 0.46 H new ATOM 0 HG3 GLU A 134 -8.393 -10.020 -9.943 1.00 0.46 H new ATOM 2122 N LEU A 135 -9.422 -9.548 -6.738 1.00 0.30 N ATOM 2123 CA LEU A 135 -8.676 -10.324 -5.778 1.00 0.35 C ATOM 2124 C LEU A 135 -9.597 -10.949 -4.747 1.00 0.34 C ATOM 2125 O LEU A 135 -10.556 -10.327 -4.305 1.00 0.39 O ATOM 2126 CB LEU A 135 -7.685 -9.400 -5.088 1.00 0.41 C ATOM 2127 CG LEU A 135 -6.458 -10.063 -4.472 1.00 0.69 C ATOM 2128 CD1 LEU A 135 -6.818 -10.774 -3.177 1.00 1.27 C ATOM 2129 CD2 LEU A 135 -5.810 -11.032 -5.450 1.00 1.41 C ATOM 0 H LEU A 135 -9.489 -8.558 -6.503 1.00 0.30 H new ATOM 0 HA LEU A 135 -8.156 -11.132 -6.293 1.00 0.35 H new ATOM 0 HB2 LEU A 135 -7.346 -8.660 -5.813 1.00 0.41 H new ATOM 0 HB3 LEU A 135 -8.212 -8.859 -4.302 1.00 0.41 H new ATOM 0 HG LEU A 135 -5.737 -9.278 -4.243 1.00 0.69 H new ATOM 0 HD11 LEU A 135 -5.926 -11.239 -2.757 1.00 1.27 H new ATOM 0 HD12 LEU A 135 -7.220 -10.053 -2.466 1.00 1.27 H new ATOM 0 HD13 LEU A 135 -7.566 -11.541 -3.379 1.00 1.27 H new ATOM 0 HD21 LEU A 135 -4.938 -11.490 -4.984 1.00 1.41 H new ATOM 0 HD22 LEU A 135 -6.526 -11.808 -5.722 1.00 1.41 H new ATOM 0 HD23 LEU A 135 -5.502 -10.493 -6.346 1.00 1.41 H new ATOM 2141 N VAL A 136 -9.281 -12.170 -4.354 1.00 0.36 N ATOM 2142 CA VAL A 136 -10.062 -12.878 -3.356 1.00 0.38 C ATOM 2143 C VAL A 136 -9.134 -13.656 -2.427 1.00 0.42 C ATOM 2144 O VAL A 136 -8.068 -14.102 -2.846 1.00 0.53 O ATOM 2145 CB VAL A 136 -11.071 -13.843 -4.011 1.00 0.41 C ATOM 2146 CG1 VAL A 136 -10.357 -14.837 -4.915 1.00 0.46 C ATOM 2147 CG2 VAL A 136 -11.890 -14.568 -2.953 1.00 0.44 C ATOM 0 H VAL A 136 -8.484 -12.695 -4.714 1.00 0.36 H new ATOM 0 HA VAL A 136 -10.622 -12.140 -2.782 1.00 0.38 H new ATOM 0 HB VAL A 136 -11.754 -13.255 -4.624 1.00 0.41 H new ATOM 0 HG11 VAL A 136 -11.088 -15.508 -5.367 1.00 0.46 H new ATOM 0 HG12 VAL A 136 -9.825 -14.299 -5.699 1.00 0.46 H new ATOM 0 HG13 VAL A 136 -9.646 -15.418 -4.327 1.00 0.46 H new ATOM 0 HG21 VAL A 136 -12.595 -15.243 -3.438 1.00 0.44 H new ATOM 0 HG22 VAL A 136 -11.225 -15.141 -2.307 1.00 0.44 H new ATOM 0 HG23 VAL A 136 -12.438 -13.840 -2.355 1.00 0.44 H new ATOM 2157 N PHE A 137 -9.534 -13.824 -1.171 1.00 0.46 N ATOM 2158 CA PHE A 137 -8.718 -14.555 -0.213 1.00 0.53 C ATOM 2159 C PHE A 137 -8.921 -16.054 -0.395 1.00 0.57 C ATOM 2160 O PHE A 137 -9.927 -16.475 -0.966 1.00 0.60 O ATOM 2161 CB PHE A 137 -9.084 -14.150 1.221 1.00 0.59 C ATOM 2162 CG PHE A 137 -8.637 -12.766 1.613 1.00 0.58 C ATOM 2163 CD1 PHE A 137 -8.731 -11.704 0.725 1.00 0.55 C ATOM 2164 CD2 PHE A 137 -8.126 -12.530 2.880 1.00 0.66 C ATOM 2165 CE1 PHE A 137 -8.326 -10.435 1.095 1.00 0.59 C ATOM 2166 CE2 PHE A 137 -7.719 -11.264 3.254 1.00 0.68 C ATOM 2167 CZ PHE A 137 -7.819 -10.215 2.360 1.00 0.64 C ATOM 0 H PHE A 137 -10.412 -13.466 -0.796 1.00 0.46 H new ATOM 0 HA PHE A 137 -7.670 -14.311 -0.389 1.00 0.53 H new ATOM 0 HB2 PHE A 137 -10.166 -14.216 1.339 1.00 0.59 H new ATOM 0 HB3 PHE A 137 -8.644 -14.869 1.912 1.00 0.59 H new ATOM 0 HD1 PHE A 137 -9.125 -11.871 -0.267 1.00 0.55 H new ATOM 0 HD2 PHE A 137 -8.045 -13.346 3.583 1.00 0.66 H new ATOM 0 HE1 PHE A 137 -8.406 -9.616 0.395 1.00 0.59 H new ATOM 0 HE2 PHE A 137 -7.323 -11.094 4.244 1.00 0.68 H new ATOM 0 HZ PHE A 137 -7.501 -9.225 2.651 1.00 0.64 H new ATOM 2177 N PRO A 138 -7.982 -16.888 0.097 1.00 0.60 N ATOM 2178 CA PRO A 138 -8.102 -18.341 -0.007 1.00 0.66 C ATOM 2179 C PRO A 138 -9.485 -18.794 0.437 1.00 0.73 C ATOM 2180 O PRO A 138 -9.963 -19.867 0.065 1.00 0.78 O ATOM 2181 CB PRO A 138 -7.022 -18.878 0.946 1.00 0.70 C ATOM 2182 CG PRO A 138 -6.474 -17.688 1.670 1.00 0.75 C ATOM 2183 CD PRO A 138 -6.760 -16.493 0.807 1.00 0.62 C ATOM 0 HA PRO A 138 -7.973 -18.701 -1.028 1.00 0.66 H new ATOM 0 HB2 PRO A 138 -7.444 -19.599 1.646 1.00 0.70 H new ATOM 0 HB3 PRO A 138 -6.236 -19.393 0.393 1.00 0.70 H new ATOM 0 HG2 PRO A 138 -6.942 -17.580 2.649 1.00 0.75 H new ATOM 0 HG3 PRO A 138 -5.403 -17.797 1.839 1.00 0.75 H new ATOM 0 HD2 PRO A 138 -6.911 -15.592 1.401 1.00 0.62 H new ATOM 0 HD3 PRO A 138 -5.941 -16.287 0.118 1.00 0.62 H new ATOM 2191 N ASP A 139 -10.123 -17.937 1.226 1.00 0.77 N ATOM 2192 CA ASP A 139 -11.462 -18.179 1.736 1.00 0.87 C ATOM 2193 C ASP A 139 -12.516 -17.767 0.712 1.00 0.80 C ATOM 2194 O ASP A 139 -13.146 -18.611 0.075 1.00 1.03 O ATOM 2195 CB ASP A 139 -11.666 -17.386 3.025 1.00 0.92 C ATOM 2196 CG ASP A 139 -10.933 -17.993 4.205 1.00 1.33 C ATOM 2197 OD1 ASP A 139 -11.224 -19.160 4.549 1.00 1.72 O ATOM 2198 OD2 ASP A 139 -10.067 -17.304 4.786 1.00 1.91 O ATOM 0 H ASP A 139 -9.721 -17.050 1.530 1.00 0.77 H new ATOM 0 HA ASP A 139 -11.571 -19.245 1.934 1.00 0.87 H new ATOM 0 HB2 ASP A 139 -11.322 -16.362 2.876 1.00 0.92 H new ATOM 0 HB3 ASP A 139 -12.731 -17.335 3.251 1.00 0.92 H new ATOM 2203 N GLY A 140 -12.701 -16.458 0.568 1.00 0.59 N ATOM 2204 CA GLY A 140 -13.676 -15.932 -0.370 1.00 0.59 C ATOM 2205 C GLY A 140 -13.929 -14.454 -0.156 1.00 0.61 C ATOM 2206 O GLY A 140 -15.042 -13.968 -0.359 1.00 0.95 O ATOM 0 H GLY A 140 -12.188 -15.747 1.089 1.00 0.59 H new ATOM 0 HA2 GLY A 140 -13.324 -16.096 -1.389 1.00 0.59 H new ATOM 0 HA3 GLY A 140 -14.613 -16.479 -0.264 1.00 0.59 H new ATOM 2210 N GLU A 141 -12.889 -13.741 0.263 1.00 0.51 N ATOM 2211 CA GLU A 141 -12.980 -12.309 0.520 1.00 0.62 C ATOM 2212 C GLU A 141 -12.303 -11.510 -0.588 1.00 0.53 C ATOM 2213 O GLU A 141 -11.135 -11.724 -0.891 1.00 0.59 O ATOM 2214 CB GLU A 141 -12.322 -11.988 1.858 1.00 0.86 C ATOM 2215 CG GLU A 141 -12.317 -10.510 2.200 1.00 1.38 C ATOM 2216 CD GLU A 141 -11.674 -10.227 3.543 1.00 2.15 C ATOM 2217 OE1 GLU A 141 -12.178 -10.741 4.563 1.00 2.53 O ATOM 2218 OE2 GLU A 141 -10.666 -9.488 3.574 1.00 2.76 O ATOM 0 H GLU A 141 -11.964 -14.137 0.433 1.00 0.51 H new ATOM 0 HA GLU A 141 -14.033 -12.031 0.549 1.00 0.62 H new ATOM 0 HB2 GLU A 141 -12.841 -12.532 2.647 1.00 0.86 H new ATOM 0 HB3 GLU A 141 -11.294 -12.351 1.843 1.00 0.86 H new ATOM 0 HG2 GLU A 141 -11.784 -9.962 1.423 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -13.342 -10.138 2.206 1.00 1.38 H new ATOM 2225 N MET A 142 -13.041 -10.587 -1.189 1.00 0.48 N ATOM 2226 CA MET A 142 -12.496 -9.763 -2.261 1.00 0.41 C ATOM 2227 C MET A 142 -12.501 -8.296 -1.865 1.00 0.37 C ATOM 2228 O MET A 142 -13.280 -7.895 -1.001 1.00 0.39 O ATOM 2229 CB MET A 142 -13.320 -9.960 -3.533 1.00 0.42 C ATOM 2230 CG MET A 142 -13.437 -11.412 -3.961 1.00 0.49 C ATOM 2231 SD MET A 142 -14.337 -11.611 -5.510 1.00 0.55 S ATOM 2232 CE MET A 142 -14.282 -13.388 -5.710 1.00 1.68 C ATOM 0 H MET A 142 -14.014 -10.390 -0.955 1.00 0.48 H new ATOM 0 HA MET A 142 -11.466 -10.068 -2.445 1.00 0.41 H new ATOM 0 HB2 MET A 142 -14.319 -9.555 -3.375 1.00 0.42 H new ATOM 0 HB3 MET A 142 -12.867 -9.387 -4.342 1.00 0.42 H new ATOM 0 HG2 MET A 142 -12.439 -11.836 -4.069 1.00 0.49 H new ATOM 0 HG3 MET A 142 -13.941 -11.978 -3.178 1.00 0.49 H new ATOM 0 HE1 MET A 142 -15.160 -13.719 -6.264 1.00 1.68 H new ATOM 0 HE2 MET A 142 -13.381 -13.665 -6.258 1.00 1.68 H new ATOM 0 HE3 MET A 142 -14.271 -13.864 -4.730 1.00 1.68 H new ATOM 2242 N LEU A 143 -11.649 -7.481 -2.500 1.00 0.38 N ATOM 2243 CA LEU A 143 -11.614 -6.067 -2.187 1.00 0.39 C ATOM 2244 C LEU A 143 -13.020 -5.507 -2.329 1.00 0.41 C ATOM 2245 O LEU A 143 -13.415 -4.577 -1.627 1.00 0.50 O ATOM 2246 CB LEU A 143 -10.665 -5.331 -3.133 1.00 0.44 C ATOM 2247 CG LEU A 143 -10.038 -4.044 -2.587 1.00 0.51 C ATOM 2248 CD1 LEU A 143 -11.064 -3.151 -1.908 1.00 1.38 C ATOM 2249 CD2 LEU A 143 -8.896 -4.372 -1.639 1.00 1.56 C ATOM 0 H LEU A 143 -10.990 -7.779 -3.219 1.00 0.38 H new ATOM 0 HA LEU A 143 -11.253 -5.928 -1.168 1.00 0.39 H new ATOM 0 HB2 LEU A 143 -9.862 -6.013 -3.413 1.00 0.44 H new ATOM 0 HB3 LEU A 143 -11.209 -5.088 -4.045 1.00 0.44 H new ATOM 0 HG LEU A 143 -9.642 -3.487 -3.436 1.00 0.51 H new ATOM 0 HD11 LEU A 143 -10.574 -2.251 -1.537 1.00 1.38 H new ATOM 0 HD12 LEU A 143 -11.837 -2.874 -2.625 1.00 1.38 H new ATOM 0 HD13 LEU A 143 -11.518 -3.687 -1.075 1.00 1.38 H new ATOM 0 HD21 LEU A 143 -8.461 -3.447 -1.260 1.00 1.56 H new ATOM 0 HD22 LEU A 143 -9.274 -4.964 -0.805 1.00 1.56 H new ATOM 0 HD23 LEU A 143 -8.133 -4.940 -2.171 1.00 1.56 H new ATOM 2261 N ARG A 144 -13.780 -6.109 -3.234 1.00 0.39 N ATOM 2262 CA ARG A 144 -15.151 -5.687 -3.459 1.00 0.47 C ATOM 2263 C ARG A 144 -16.013 -6.128 -2.287 1.00 0.49 C ATOM 2264 O ARG A 144 -16.743 -5.327 -1.704 1.00 0.56 O ATOM 2265 CB ARG A 144 -15.690 -6.266 -4.771 1.00 0.54 C ATOM 2266 CG ARG A 144 -16.995 -5.629 -5.234 1.00 0.77 C ATOM 2267 CD ARG A 144 -18.162 -5.999 -4.333 1.00 0.88 C ATOM 2268 NE ARG A 144 -18.549 -7.399 -4.477 1.00 1.47 N ATOM 2269 CZ ARG A 144 -19.546 -7.965 -3.802 1.00 2.12 C ATOM 2270 NH1 ARG A 144 -20.260 -7.248 -2.944 1.00 2.68 N ATOM 2271 NH2 ARG A 144 -19.830 -9.247 -3.985 1.00 2.83 N ATOM 0 H ARG A 144 -13.471 -6.885 -3.819 1.00 0.39 H new ATOM 0 HA ARG A 144 -15.180 -4.600 -3.538 1.00 0.47 H new ATOM 0 HB2 ARG A 144 -14.938 -6.139 -5.550 1.00 0.54 H new ATOM 0 HB3 ARG A 144 -15.843 -7.338 -4.648 1.00 0.54 H new ATOM 0 HG2 ARG A 144 -16.882 -4.545 -5.254 1.00 0.77 H new ATOM 0 HG3 ARG A 144 -17.211 -5.946 -6.254 1.00 0.77 H new ATOM 0 HD2 ARG A 144 -17.893 -5.803 -3.295 1.00 0.88 H new ATOM 0 HD3 ARG A 144 -19.015 -5.362 -4.567 1.00 0.88 H new ATOM 0 HE ARG A 144 -18.024 -7.977 -5.133 1.00 1.47 H new ATOM 0 HH11 ARG A 144 -20.045 -6.261 -2.801 1.00 2.68 H new ATOM 0 HH12 ARG A 144 -21.024 -7.684 -2.427 1.00 2.68 H new ATOM 0 HH21 ARG A 144 -19.284 -9.801 -4.644 1.00 2.83 H new ATOM 0 HH22 ARG A 144 -20.595 -9.679 -3.466 1.00 2.83 H new ATOM 2285 N GLN A 145 -15.912 -7.407 -1.943 1.00 0.47 N ATOM 2286 CA GLN A 145 -16.672 -7.963 -0.834 1.00 0.52 C ATOM 2287 C GLN A 145 -16.459 -7.135 0.427 1.00 0.48 C ATOM 2288 O GLN A 145 -17.344 -7.045 1.278 1.00 0.56 O ATOM 2289 CB GLN A 145 -16.271 -9.426 -0.605 1.00 0.57 C ATOM 2290 CG GLN A 145 -16.895 -10.062 0.629 1.00 0.64 C ATOM 2291 CD GLN A 145 -16.156 -9.727 1.914 1.00 0.60 C ATOM 2292 OE1 GLN A 145 -16.591 -10.094 3.006 1.00 0.67 O ATOM 2293 NE2 GLN A 145 -15.026 -9.038 1.793 1.00 0.52 N ATOM 0 H GLN A 145 -15.309 -8.078 -2.419 1.00 0.47 H new ATOM 0 HA GLN A 145 -17.733 -7.931 -1.081 1.00 0.52 H new ATOM 0 HB2 GLN A 145 -16.553 -10.009 -1.482 1.00 0.57 H new ATOM 0 HB3 GLN A 145 -15.186 -9.484 -0.520 1.00 0.57 H new ATOM 0 HG2 GLN A 145 -17.930 -9.732 0.716 1.00 0.64 H new ATOM 0 HG3 GLN A 145 -16.916 -11.144 0.501 1.00 0.64 H new ATOM 0 HE21 GLN A 145 -14.699 -8.752 0.870 1.00 0.52 H new ATOM 0 HE22 GLN A 145 -14.486 -8.795 2.623 1.00 0.52 H new ATOM 2302 N ILE A 146 -15.283 -6.520 0.538 1.00 0.40 N ATOM 2303 CA ILE A 146 -14.969 -5.696 1.695 1.00 0.40 C ATOM 2304 C ILE A 146 -15.542 -4.294 1.519 1.00 0.43 C ATOM 2305 O ILE A 146 -16.171 -3.758 2.429 1.00 0.53 O ATOM 2306 CB ILE A 146 -13.454 -5.590 1.944 1.00 0.42 C ATOM 2307 CG1 ILE A 146 -12.801 -6.970 1.873 1.00 0.43 C ATOM 2308 CG2 ILE A 146 -13.202 -4.956 3.305 1.00 0.50 C ATOM 2309 CD1 ILE A 146 -11.293 -6.933 1.987 1.00 0.78 C ATOM 0 H ILE A 146 -14.538 -6.578 -0.157 1.00 0.40 H new ATOM 0 HA ILE A 146 -15.422 -6.183 2.559 1.00 0.40 H new ATOM 0 HB ILE A 146 -13.012 -4.963 1.170 1.00 0.42 H new ATOM 0 HG12 ILE A 146 -13.202 -7.594 2.672 1.00 0.43 H new ATOM 0 HG13 ILE A 146 -13.074 -7.444 0.930 1.00 0.43 H new ATOM 0 HG21 ILE A 146 -12.128 -4.882 3.479 1.00 0.50 H new ATOM 0 HG22 ILE A 146 -13.643 -3.959 3.329 1.00 0.50 H new ATOM 0 HG23 ILE A 146 -13.654 -5.572 4.083 1.00 0.50 H new ATOM 0 HD11 ILE A 146 -10.899 -7.947 1.929 1.00 0.78 H new ATOM 0 HD12 ILE A 146 -10.881 -6.336 1.173 1.00 0.78 H new ATOM 0 HD13 ILE A 146 -11.011 -6.489 2.942 1.00 0.78 H new ATOM 2321 N LEU A 147 -15.334 -3.703 0.338 1.00 0.42 N ATOM 2322 CA LEU A 147 -15.854 -2.368 0.068 1.00 0.50 C ATOM 2323 C LEU A 147 -17.377 -2.352 0.162 1.00 0.59 C ATOM 2324 O LEU A 147 -17.986 -1.304 0.368 1.00 0.72 O ATOM 2325 CB LEU A 147 -15.426 -1.894 -1.322 1.00 0.55 C ATOM 2326 CG LEU A 147 -14.007 -1.332 -1.414 1.00 0.61 C ATOM 2327 CD1 LEU A 147 -13.631 -1.078 -2.863 1.00 0.76 C ATOM 2328 CD2 LEU A 147 -13.896 -0.047 -0.609 1.00 0.62 C ATOM 0 H LEU A 147 -14.816 -4.124 -0.433 1.00 0.42 H new ATOM 0 HA LEU A 147 -15.444 -1.693 0.819 1.00 0.50 H new ATOM 0 HB2 LEU A 147 -15.513 -2.730 -2.016 1.00 0.55 H new ATOM 0 HB3 LEU A 147 -16.125 -1.128 -1.657 1.00 0.55 H new ATOM 0 HG LEU A 147 -13.316 -2.066 -0.999 1.00 0.61 H new ATOM 0 HD11 LEU A 147 -12.618 -0.678 -2.911 1.00 0.76 H new ATOM 0 HD12 LEU A 147 -13.679 -2.013 -3.421 1.00 0.76 H new ATOM 0 HD13 LEU A 147 -14.326 -0.360 -3.299 1.00 0.76 H new ATOM 0 HD21 LEU A 147 -12.881 0.342 -0.683 1.00 0.62 H new ATOM 0 HD22 LEU A 147 -14.597 0.690 -1.001 1.00 0.62 H new ATOM 0 HD23 LEU A 147 -14.131 -0.251 0.436 1.00 0.62 H new ATOM 2340 N HIS A 148 -17.986 -3.521 -0.003 1.00 0.59 N ATOM 2341 CA HIS A 148 -19.439 -3.646 0.050 1.00 0.73 C ATOM 2342 C HIS A 148 -19.931 -3.848 1.483 1.00 0.79 C ATOM 2343 O HIS A 148 -21.085 -3.556 1.798 1.00 0.90 O ATOM 2344 CB HIS A 148 -19.894 -4.812 -0.832 1.00 0.77 C ATOM 2345 CG HIS A 148 -21.383 -4.928 -0.966 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -22.221 -5.191 0.095 1.00 1.36 N ATOM 2347 CD2 HIS A 148 -22.184 -4.814 -2.055 1.00 1.58 C ATOM 2348 CE1 HIS A 148 -23.472 -5.235 -0.331 1.00 1.28 C ATOM 2349 NE2 HIS A 148 -23.475 -5.008 -1.632 1.00 1.34 N ATOM 0 H HIS A 148 -17.495 -4.398 -0.175 1.00 0.59 H new ATOM 0 HA HIS A 148 -19.872 -2.718 -0.324 1.00 0.73 H new ATOM 0 HB2 HIS A 148 -19.458 -4.696 -1.824 1.00 0.77 H new ATOM 0 HB3 HIS A 148 -19.503 -5.742 -0.419 1.00 0.77 H new ATOM 0 HD1 HIS A 148 -21.923 -5.330 1.060 1.00 1.36 H new ATOM 0 HD2 HIS A 148 -21.865 -4.609 -3.066 1.00 1.58 H new ATOM 0 HE1 HIS A 148 -24.342 -5.424 0.280 1.00 1.28 H new ATOM 2358 N THR A 149 -19.058 -4.364 2.341 1.00 0.77 N ATOM 2359 CA THR A 149 -19.418 -4.622 3.730 1.00 0.88 C ATOM 2360 C THR A 149 -19.145 -3.415 4.621 1.00 0.86 C ATOM 2361 O THR A 149 -19.844 -3.199 5.611 1.00 0.94 O ATOM 2362 CB THR A 149 -18.656 -5.841 4.254 1.00 0.90 C ATOM 2363 OG1 THR A 149 -18.952 -6.987 3.477 1.00 1.10 O ATOM 2364 CG2 THR A 149 -18.971 -6.172 5.696 1.00 1.18 C ATOM 0 H THR A 149 -18.098 -4.611 2.100 1.00 0.77 H new ATOM 0 HA THR A 149 -20.489 -4.821 3.760 1.00 0.88 H new ATOM 0 HB THR A 149 -17.602 -5.574 4.183 1.00 0.90 H new ATOM 0 HG1 THR A 149 -18.301 -7.065 2.748 1.00 1.10 H new ATOM 0 HG21 THR A 149 -18.397 -7.046 6.002 1.00 1.18 H new ATOM 0 HG22 THR A 149 -18.708 -5.325 6.330 1.00 1.18 H new ATOM 0 HG23 THR A 149 -20.036 -6.384 5.797 1.00 1.18 H new ATOM 2372 N ARG A 150 -18.125 -2.637 4.280 1.00 0.86 N ATOM 2373 CA ARG A 150 -17.775 -1.467 5.076 1.00 0.93 C ATOM 2374 C ARG A 150 -18.041 -0.171 4.310 1.00 0.95 C ATOM 2375 O ARG A 150 -18.433 0.836 4.900 1.00 1.05 O ATOM 2376 CB ARG A 150 -16.304 -1.530 5.494 1.00 0.99 C ATOM 2377 CG ARG A 150 -15.342 -1.225 4.362 1.00 0.96 C ATOM 2378 CD ARG A 150 -13.905 -1.164 4.844 1.00 1.26 C ATOM 2379 NE ARG A 150 -13.077 -0.350 3.960 1.00 2.01 N ATOM 2380 CZ ARG A 150 -12.943 -0.571 2.655 1.00 2.55 C ATOM 2381 NH1 ARG A 150 -13.506 -1.631 2.090 1.00 2.55 N ATOM 2382 NH2 ARG A 150 -12.241 0.273 1.916 1.00 3.55 N ATOM 0 H ARG A 150 -17.531 -2.792 3.466 1.00 0.86 H new ATOM 0 HA ARG A 150 -18.404 -1.472 5.966 1.00 0.93 H new ATOM 0 HB2 ARG A 150 -16.134 -0.823 6.306 1.00 0.99 H new ATOM 0 HB3 ARG A 150 -16.088 -2.524 5.887 1.00 0.99 H new ATOM 0 HG2 ARG A 150 -15.434 -1.990 3.591 1.00 0.96 H new ATOM 0 HG3 ARG A 150 -15.612 -0.274 3.902 1.00 0.96 H new ATOM 0 HD2 ARG A 150 -13.876 -0.752 5.853 1.00 1.26 H new ATOM 0 HD3 ARG A 150 -13.496 -2.173 4.900 1.00 1.26 H new ATOM 0 HE ARG A 150 -12.570 0.436 4.367 1.00 2.01 H new ATOM 0 HH11 ARG A 150 -14.047 -2.284 2.657 1.00 2.55 H new ATOM 0 HH12 ARG A 150 -13.398 -1.793 1.089 1.00 2.55 H new ATOM 0 HH21 ARG A 150 -11.806 1.088 2.347 1.00 3.55 H new ATOM 0 HH22 ARG A 150 -12.135 0.108 0.915 1.00 3.55 H new ATOM 2396 N ALA A 151 -17.814 -0.199 2.997 1.00 0.94 N ATOM 2397 CA ALA A 151 -18.018 0.978 2.155 1.00 1.04 C ATOM 2398 C ALA A 151 -17.128 2.130 2.607 1.00 1.11 C ATOM 2399 O ALA A 151 -17.567 3.018 3.339 1.00 1.59 O ATOM 2400 CB ALA A 151 -19.481 1.397 2.171 1.00 1.61 C ATOM 0 H ALA A 151 -17.489 -1.024 2.494 1.00 0.94 H new ATOM 0 HA ALA A 151 -17.743 0.717 1.133 1.00 1.04 H new ATOM 0 HB1 ALA A 151 -19.615 2.275 1.539 1.00 1.61 H new ATOM 0 HB2 ALA A 151 -20.097 0.581 1.794 1.00 1.61 H new ATOM 0 HB3 ALA A 151 -19.780 1.636 3.192 1.00 1.61 H new ATOM 2406 N PHE A 152 -15.868 2.107 2.174 1.00 1.09 N ATOM 2407 CA PHE A 152 -14.912 3.145 2.544 1.00 1.61 C ATOM 2408 C PHE A 152 -14.313 3.838 1.328 1.00 1.38 C ATOM 2409 O PHE A 152 -13.123 4.156 1.318 1.00 1.90 O ATOM 2410 CB PHE A 152 -13.787 2.556 3.396 1.00 2.51 C ATOM 2411 CG PHE A 152 -14.096 2.476 4.864 1.00 3.40 C ATOM 2412 CD1 PHE A 152 -15.341 2.069 5.317 1.00 3.42 C ATOM 2413 CD2 PHE A 152 -13.129 2.817 5.792 1.00 4.44 C ATOM 2414 CE1 PHE A 152 -15.613 2.000 6.671 1.00 4.40 C ATOM 2415 CE2 PHE A 152 -13.393 2.751 7.147 1.00 5.41 C ATOM 2416 CZ PHE A 152 -14.636 2.344 7.586 1.00 5.37 C ATOM 0 H PHE A 152 -15.488 1.381 1.567 1.00 1.09 H new ATOM 0 HA PHE A 152 -15.462 3.890 3.119 1.00 1.61 H new ATOM 0 HB2 PHE A 152 -13.557 1.555 3.031 1.00 2.51 H new ATOM 0 HB3 PHE A 152 -12.890 3.159 3.258 1.00 2.51 H new ATOM 0 HD1 PHE A 152 -16.108 1.803 4.604 1.00 3.42 H new ATOM 0 HD2 PHE A 152 -12.155 3.139 5.454 1.00 4.44 H new ATOM 0 HE1 PHE A 152 -16.586 1.678 7.012 1.00 4.40 H new ATOM 0 HE2 PHE A 152 -12.628 3.018 7.861 1.00 5.41 H new ATOM 0 HZ PHE A 152 -14.845 2.294 8.644 1.00 5.37 H new ATOM 2426 N ASP A 153 -15.136 4.084 0.313 1.00 1.04 N ATOM 2427 CA ASP A 153 -14.671 4.761 -0.894 1.00 1.18 C ATOM 2428 C ASP A 153 -13.773 5.935 -0.515 1.00 1.01 C ATOM 2429 O ASP A 153 -12.588 5.947 -0.835 1.00 1.40 O ATOM 2430 CB ASP A 153 -15.857 5.252 -1.726 1.00 1.46 C ATOM 2431 CG ASP A 153 -16.769 4.120 -2.158 1.00 2.05 C ATOM 2432 OD1 ASP A 153 -17.319 3.429 -1.274 1.00 2.54 O ATOM 2433 OD2 ASP A 153 -16.933 3.923 -3.381 1.00 2.52 O ATOM 0 H ASP A 153 -16.123 3.827 0.301 1.00 1.04 H new ATOM 0 HA ASP A 153 -14.100 4.053 -1.494 1.00 1.18 H new ATOM 0 HB2 ASP A 153 -16.430 5.975 -1.145 1.00 1.46 H new ATOM 0 HB3 ASP A 153 -15.487 5.774 -2.609 1.00 1.46 H new ATOM 2438 N LYS A 154 -14.350 6.892 0.214 1.00 0.68 N ATOM 2439 CA LYS A 154 -13.626 8.062 0.698 1.00 0.59 C ATOM 2440 C LYS A 154 -12.505 8.496 -0.248 1.00 0.52 C ATOM 2441 O LYS A 154 -12.634 8.406 -1.468 1.00 0.67 O ATOM 2442 CB LYS A 154 -13.055 7.741 2.072 1.00 0.63 C ATOM 2443 CG LYS A 154 -14.104 7.632 3.166 1.00 0.79 C ATOM 2444 CD LYS A 154 -13.471 7.406 4.531 1.00 0.93 C ATOM 2445 CE LYS A 154 -12.671 6.112 4.574 1.00 0.94 C ATOM 2446 NZ LYS A 154 -12.006 5.915 5.891 1.00 1.77 N ATOM 0 H LYS A 154 -15.333 6.875 0.484 1.00 0.68 H new ATOM 0 HA LYS A 154 -14.325 8.896 0.752 1.00 0.59 H new ATOM 0 HB2 LYS A 154 -12.505 6.802 2.015 1.00 0.63 H new ATOM 0 HB3 LYS A 154 -12.338 8.515 2.346 1.00 0.63 H new ATOM 0 HG2 LYS A 154 -14.702 8.543 3.189 1.00 0.79 H new ATOM 0 HG3 LYS A 154 -14.783 6.810 2.939 1.00 0.79 H new ATOM 0 HD2 LYS A 154 -12.819 8.245 4.773 1.00 0.93 H new ATOM 0 HD3 LYS A 154 -14.250 7.378 5.293 1.00 0.93 H new ATOM 0 HE2 LYS A 154 -13.332 5.269 4.371 1.00 0.94 H new ATOM 0 HE3 LYS A 154 -11.919 6.124 3.785 1.00 0.94 H new ATOM 0 HZ1 LYS A 154 -10.982 6.062 5.788 1.00 1.77 H new ATOM 0 HZ2 LYS A 154 -12.387 6.597 6.578 1.00 1.77 H new ATOM 0 HZ3 LYS A 154 -12.184 4.948 6.229 1.00 1.77 H new ATOM 2460 N LEU A 155 -11.403 8.962 0.339 1.00 0.55 N ATOM 2461 CA LEU A 155 -10.244 9.405 -0.426 1.00 0.57 C ATOM 2462 C LEU A 155 -10.598 10.491 -1.436 1.00 0.51 C ATOM 2463 O LEU A 155 -11.019 10.203 -2.556 1.00 0.61 O ATOM 2464 CB LEU A 155 -9.600 8.219 -1.144 1.00 0.67 C ATOM 2465 CG LEU A 155 -8.663 7.370 -0.291 1.00 0.81 C ATOM 2466 CD1 LEU A 155 -8.151 6.193 -1.097 1.00 1.81 C ATOM 2467 CD2 LEU A 155 -7.497 8.204 0.214 1.00 1.95 C ATOM 0 H LEU A 155 -11.291 9.042 1.350 1.00 0.55 H new ATOM 0 HA LEU A 155 -9.536 9.834 0.283 1.00 0.57 H new ATOM 0 HB2 LEU A 155 -10.391 7.578 -1.533 1.00 0.67 H new ATOM 0 HB3 LEU A 155 -9.043 8.594 -2.002 1.00 0.67 H new ATOM 0 HG LEU A 155 -9.219 6.997 0.569 1.00 0.81 H new ATOM 0 HD11 LEU A 155 -7.483 5.593 -0.480 1.00 1.81 H new ATOM 0 HD12 LEU A 155 -8.992 5.581 -1.422 1.00 1.81 H new ATOM 0 HD13 LEU A 155 -7.609 6.558 -1.970 1.00 1.81 H new ATOM 0 HD21 LEU A 155 -6.840 7.581 0.820 1.00 1.95 H new ATOM 0 HD22 LEU A 155 -6.940 8.601 -0.634 1.00 1.95 H new ATOM 0 HD23 LEU A 155 -7.874 9.029 0.818 1.00 1.95 H new ATOM 2479 N ASN A 156 -10.391 11.742 -1.039 1.00 0.54 N ATOM 2480 CA ASN A 156 -10.652 12.876 -1.913 1.00 0.54 C ATOM 2481 C ASN A 156 -9.382 13.262 -2.647 1.00 0.53 C ATOM 2482 O ASN A 156 -8.389 13.638 -2.029 1.00 0.75 O ATOM 2483 CB ASN A 156 -11.172 14.066 -1.114 1.00 0.63 C ATOM 2484 CG ASN A 156 -11.194 15.348 -1.925 1.00 1.07 C ATOM 2485 OD1 ASN A 156 -11.890 15.448 -2.933 1.00 2.09 O ATOM 2486 ND2 ASN A 156 -10.423 16.335 -1.482 1.00 1.34 N ATOM 0 H ASN A 156 -10.042 11.995 -0.114 1.00 0.54 H new ATOM 0 HA ASN A 156 -11.415 12.587 -2.636 1.00 0.54 H new ATOM 0 HB2 ASN A 156 -12.179 13.848 -0.758 1.00 0.63 H new ATOM 0 HB3 ASN A 156 -10.547 14.209 -0.233 1.00 0.63 H new ATOM 0 HD21 ASN A 156 -10.392 17.222 -1.984 1.00 1.34 H new ATOM 0 HD22 ASN A 156 -9.862 16.205 -0.640 1.00 1.34 H new ATOM 2493 N LYS A 157 -9.424 13.149 -3.965 1.00 0.46 N ATOM 2494 CA LYS A 157 -8.273 13.466 -4.810 1.00 0.46 C ATOM 2495 C LYS A 157 -7.556 14.730 -4.350 1.00 0.48 C ATOM 2496 O LYS A 157 -8.188 15.749 -4.064 1.00 0.64 O ATOM 2497 CB LYS A 157 -8.710 13.609 -6.269 1.00 0.54 C ATOM 2498 CG LYS A 157 -9.026 12.281 -6.938 1.00 0.60 C ATOM 2499 CD LYS A 157 -9.624 12.479 -8.321 1.00 1.33 C ATOM 2500 CE LYS A 157 -9.978 11.152 -8.970 1.00 1.77 C ATOM 2501 NZ LYS A 157 -10.604 11.339 -10.309 1.00 2.30 N ATOM 0 H LYS A 157 -10.247 12.838 -4.480 1.00 0.46 H new ATOM 0 HA LYS A 157 -7.568 12.639 -4.723 1.00 0.46 H new ATOM 0 HB2 LYS A 157 -9.591 14.249 -6.316 1.00 0.54 H new ATOM 0 HB3 LYS A 157 -7.921 14.111 -6.829 1.00 0.54 H new ATOM 0 HG2 LYS A 157 -8.116 11.687 -7.016 1.00 0.60 H new ATOM 0 HG3 LYS A 157 -9.722 11.717 -6.317 1.00 0.60 H new ATOM 0 HD2 LYS A 157 -10.518 13.099 -8.247 1.00 1.33 H new ATOM 0 HD3 LYS A 157 -8.915 13.016 -8.951 1.00 1.33 H new ATOM 0 HE2 LYS A 157 -9.078 10.546 -9.071 1.00 1.77 H new ATOM 0 HE3 LYS A 157 -10.662 10.602 -8.323 1.00 1.77 H new ATOM 0 HZ1 LYS A 157 -10.831 10.410 -10.719 1.00 2.30 H new ATOM 0 HZ2 LYS A 157 -11.477 11.896 -10.210 1.00 2.30 H new ATOM 0 HZ3 LYS A 157 -9.942 11.841 -10.935 1.00 2.30 H new ATOM 2515 N TRP A 158 -6.228 14.638 -4.280 1.00 0.45 N ATOM 2516 CA TRP A 158 -5.378 15.748 -3.858 1.00 0.54 C ATOM 2517 C TRP A 158 -5.909 17.085 -4.370 1.00 0.75 C ATOM 2518 O TRP A 158 -6.102 17.213 -5.599 1.00 1.21 O ATOM 2519 CB TRP A 158 -3.954 15.526 -4.371 1.00 0.62 C ATOM 2520 CG TRP A 158 -2.985 16.578 -3.927 1.00 0.71 C ATOM 2521 CD1 TRP A 158 -2.549 17.652 -4.649 1.00 0.98 C ATOM 2522 CD2 TRP A 158 -2.314 16.641 -2.666 1.00 0.72 C ATOM 2523 NE1 TRP A 158 -1.660 18.390 -3.906 1.00 1.04 N ATOM 2524 CE2 TRP A 158 -1.497 17.788 -2.685 1.00 0.89 C ATOM 2525 CE3 TRP A 158 -2.328 15.843 -1.517 1.00 0.81 C ATOM 2526 CZ2 TRP A 158 -0.703 18.155 -1.603 1.00 1.01 C ATOM 2527 CZ3 TRP A 158 -1.539 16.208 -0.446 1.00 1.03 C ATOM 2528 CH2 TRP A 158 -0.736 17.356 -0.494 1.00 1.07 C ATOM 2529 OXT TRP A 158 -6.128 17.991 -3.540 1.00 1.47 O ATOM 0 H TRP A 158 -5.712 13.790 -4.515 1.00 0.45 H new ATOM 0 HA TRP A 158 -5.379 15.782 -2.769 1.00 0.54 H new ATOM 0 HB2 TRP A 158 -3.602 14.552 -4.030 1.00 0.62 H new ATOM 0 HB3 TRP A 158 -3.970 15.495 -5.460 1.00 0.62 H new ATOM 0 HD1 TRP A 158 -2.858 17.887 -5.657 1.00 0.98 H new ATOM 0 HE1 TRP A 158 -1.197 19.246 -4.212 1.00 1.04 H new ATOM 0 HE3 TRP A 158 -2.945 14.958 -1.469 1.00 0.81 H new ATOM 0 HZ2 TRP A 158 -0.083 19.039 -1.638 1.00 1.01 H new ATOM 0 HZ3 TRP A 158 -1.540 15.598 0.445 1.00 1.03 H new ATOM 0 HH2 TRP A 158 -0.131 17.615 0.362 1.00 1.07 H new