USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1210 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 147 THR OG1 : rot -29:sc= 0.169 USER MOD Set 1.2: A 150 GLN : amide:sc= 0 X(o=0.26,f=0.2) USER MOD Set 1.3: A 151 LYS NZ :NH3+ 172:sc= 0.0916 (180deg=-0.0152) USER MOD Set 2.1: A 118 LYS NZ :NH3+ -114:sc= 2.04 (180deg=-0.782) USER MOD Set 2.2: A 123 GLN : amide:sc= 0.683 K(o=2.6,f=-8.7!) USER MOD Set 2.3: A 127 HIS : no HE2:sc= -0.145 K(o=2.6,f=0.31) USER MOD Set 3.1: A 74 ASN : amide:sc= -0.163 K(o=0.57,f=-0.32) USER MOD Set 3.2: A 75 ASN : amide:sc= 0.734 K(o=0.57,f=-0.32) USER MOD Set 4.1: A 21 ASN : amide:sc= -0.631 K(o=0.21,f=-8.1!) USER MOD Set 4.2: A 34 CYS SG : rot 34:sc= 0.84 USER MOD Single : A 1 ALA N :NH3+ -114:sc= 0.235 (180deg=0) USER MOD Single : A 4 TYR OH : rot 35:sc= 0.817 USER MOD Single : A 5 THR OG1 : rot 180:sc=-0.00181 USER MOD Single : A 7 LYS NZ :NH3+ 163:sc= -0.0295 (180deg=-0.255) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.367 K(o=-0.37,f=-2.7!) USER MOD Single : A 25 HIS : no HD1:sc= -0.722 X(o=-0.72,f=-0.88) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 40 LYS NZ :NH3+ 157:sc= -0.0997 (180deg=-0.795) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 47 ASN : amide:sc= -0.126 X(o=-0.13,f=-0.52) USER MOD Single : A 50 THR OG1 : rot 61:sc= -0.35 USER MOD Single : A 54 THR OG1 : rot -52:sc= 0.25 USER MOD Single : A 56 LYS NZ :NH3+ 156:sc= -0.0942 (180deg=-0.472) USER MOD Single : A 57 THR OG1 : rot 94:sc= 0.94 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 CYS SG : rot 161:sc= 0.482 USER MOD Single : A 63 THR OG1 : rot -8:sc= 0.256 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : +bothHN:sc= -0.75 K(o=-0.75,f=-5.3!) USER MOD Single : A 72 ASN : amide:sc= 0.248 K(o=0.25,f=-2.4!) USER MOD Single : A 76 THR OG1 : rot 180:sc=-0.00832 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= -0.795 USER MOD Single : A 97 ASN : amide:sc= -0.282 K(o=-0.28,f=-1.3) USER MOD Single : A 100 SER OG : rot -1:sc= 0.683 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= -0.0752 USER MOD Single : A 110 SER OG : rot 44:sc= -0.276 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 171:sc= 0.499 USER MOD Single : A 122 HIS : no HE2:sc= 0.61 K(o=0.61,f=-6.7!) USER MOD Single : A 124 SER OG : rot 84:sc= 0.107 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 MET CE :methyl -150:sc= -3.29! (180deg=-3.74!) USER MOD Single : A 134 THR OG1 : rot -71:sc= 0.967 USER MOD Single : A 135 THR OG1 : rot -81:sc= 0.812 USER MOD Single : A 140 THR OG1 : rot 139:sc= 0.685 USER MOD Single : A 142 TYR OH : rot 180:sc= -0.448 USER MOD Single : A 143 CYS SG : rot 130:sc= -0.0321 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 21:sc= 1.18 USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 158 ASN : amide:sc= 0.586 K(o=0.59,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 10.455 7.410 -17.072 1.00 3.44 N ATOM 2 CA ALA A 1 11.093 7.065 -15.788 1.00 2.58 C ATOM 3 C ALA A 1 10.013 7.127 -14.715 1.00 1.89 C ATOM 4 O ALA A 1 8.981 7.743 -14.984 1.00 2.05 O ATOM 5 CB ALA A 1 12.247 8.036 -15.500 1.00 2.83 C ATOM 0 H1 ALA A 1 10.467 6.581 -17.699 1.00 3.44 H new ATOM 0 H2 ALA A 1 9.471 7.703 -16.903 1.00 3.44 H new ATOM 0 H3 ALA A 1 10.976 8.190 -17.520 1.00 3.44 H new ATOM 0 HA ALA A 1 11.523 6.064 -15.811 1.00 2.58 H new ATOM 0 HB1 ALA A 1 12.714 7.775 -14.550 1.00 2.83 H new ATOM 0 HB2 ALA A 1 12.987 7.969 -16.298 1.00 2.83 H new ATOM 0 HB3 ALA A 1 11.861 9.054 -15.447 1.00 2.83 H new ATOM 11 N PRO A 2 10.193 6.514 -13.539 1.00 1.39 N ATOM 12 CA PRO A 2 9.231 6.661 -12.462 1.00 0.97 C ATOM 13 C PRO A 2 9.221 8.119 -12.000 1.00 0.91 C ATOM 14 O PRO A 2 10.219 8.826 -12.139 1.00 1.08 O ATOM 15 CB PRO A 2 9.693 5.692 -11.369 1.00 1.01 C ATOM 16 CG PRO A 2 11.199 5.602 -11.593 1.00 1.43 C ATOM 17 CD PRO A 2 11.329 5.713 -13.112 1.00 1.63 C ATOM 0 HA PRO A 2 8.207 6.426 -12.754 1.00 0.97 H new ATOM 0 HB2 PRO A 2 9.456 6.067 -10.373 1.00 1.01 H new ATOM 0 HB3 PRO A 2 9.213 4.718 -11.466 1.00 1.01 H new ATOM 0 HG2 PRO A 2 11.731 6.405 -11.083 1.00 1.43 H new ATOM 0 HG3 PRO A 2 11.607 4.662 -11.221 1.00 1.43 H new ATOM 0 HD2 PRO A 2 12.270 6.185 -13.392 1.00 1.63 H new ATOM 0 HD3 PRO A 2 11.314 4.729 -13.581 1.00 1.63 H new ATOM 25 N ALA A 3 8.088 8.583 -11.473 1.00 0.79 N ATOM 26 CA ALA A 3 7.946 9.939 -10.971 1.00 0.86 C ATOM 27 C ALA A 3 6.876 9.932 -9.889 1.00 0.76 C ATOM 28 O ALA A 3 5.857 9.253 -10.041 1.00 0.69 O ATOM 29 CB ALA A 3 7.543 10.884 -12.107 1.00 1.03 C ATOM 0 H ALA A 3 7.241 8.021 -11.384 1.00 0.79 H new ATOM 0 HA ALA A 3 8.893 10.289 -10.561 1.00 0.86 H new ATOM 0 HB1 ALA A 3 7.440 11.897 -11.718 1.00 1.03 H new ATOM 0 HB2 ALA A 3 8.309 10.869 -12.882 1.00 1.03 H new ATOM 0 HB3 ALA A 3 6.593 10.559 -12.531 1.00 1.03 H new ATOM 35 N TYR A 4 7.113 10.676 -8.809 1.00 0.87 N ATOM 36 CA TYR A 4 6.227 10.706 -7.659 1.00 0.82 C ATOM 37 C TYR A 4 5.130 11.734 -7.918 1.00 0.79 C ATOM 38 O TYR A 4 5.391 12.791 -8.489 1.00 0.88 O ATOM 39 CB TYR A 4 7.015 11.081 -6.396 1.00 0.93 C ATOM 40 CG TYR A 4 8.401 10.471 -6.278 1.00 1.68 C ATOM 41 CD1 TYR A 4 8.618 9.108 -6.566 1.00 2.10 C ATOM 42 CD2 TYR A 4 9.485 11.284 -5.895 1.00 2.57 C ATOM 43 CE1 TYR A 4 9.914 8.561 -6.485 1.00 2.99 C ATOM 44 CE2 TYR A 4 10.777 10.743 -5.803 1.00 3.39 C ATOM 45 CZ TYR A 4 11.000 9.383 -6.106 1.00 3.50 C ATOM 46 OH TYR A 4 12.265 8.888 -6.022 1.00 4.41 O ATOM 0 H TYR A 4 7.932 11.277 -8.713 1.00 0.87 H new ATOM 0 HA TYR A 4 5.784 9.722 -7.507 1.00 0.82 H new ATOM 0 HB2 TYR A 4 7.112 12.166 -6.359 1.00 0.93 H new ATOM 0 HB3 TYR A 4 6.432 10.783 -5.525 1.00 0.93 H new ATOM 0 HD1 TYR A 4 7.787 8.480 -6.850 1.00 2.10 H new ATOM 0 HD2 TYR A 4 9.322 12.328 -5.671 1.00 2.57 H new ATOM 0 HE1 TYR A 4 10.077 7.518 -6.712 1.00 2.99 H new ATOM 0 HE2 TYR A 4 11.603 11.369 -5.499 1.00 3.39 H new ATOM 0 HH TYR A 4 12.400 8.215 -6.721 1.00 4.41 H new ATOM 56 N THR A 5 3.901 11.438 -7.503 1.00 0.77 N ATOM 57 CA THR A 5 2.749 12.315 -7.657 1.00 0.75 C ATOM 58 C THR A 5 1.894 12.144 -6.399 1.00 0.68 C ATOM 59 O THR A 5 2.178 11.262 -5.593 1.00 0.64 O ATOM 60 CB THR A 5 1.984 11.922 -8.936 1.00 0.80 C ATOM 61 OG1 THR A 5 2.870 11.663 -10.007 1.00 1.52 O ATOM 62 CG2 THR A 5 1.012 13.009 -9.408 1.00 1.45 C ATOM 0 H THR A 5 3.675 10.558 -7.039 1.00 0.77 H new ATOM 0 HA THR A 5 3.034 13.362 -7.763 1.00 0.75 H new ATOM 0 HB THR A 5 1.424 11.027 -8.666 1.00 0.80 H new ATOM 0 HG1 THR A 5 2.356 11.415 -10.804 1.00 1.52 H new ATOM 0 HG21 THR A 5 0.503 12.674 -10.312 1.00 1.45 H new ATOM 0 HG22 THR A 5 0.276 13.203 -8.628 1.00 1.45 H new ATOM 0 HG23 THR A 5 1.565 13.924 -9.620 1.00 1.45 H new ATOM 70 N VAL A 6 0.841 12.939 -6.224 1.00 0.71 N ATOM 71 CA VAL A 6 -0.136 12.788 -5.156 1.00 0.75 C ATOM 72 C VAL A 6 -1.522 13.037 -5.739 1.00 0.69 C ATOM 73 O VAL A 6 -1.654 13.805 -6.695 1.00 0.78 O ATOM 74 CB VAL A 6 0.220 13.736 -3.989 1.00 0.89 C ATOM 75 CG1 VAL A 6 0.333 15.205 -4.421 1.00 1.49 C ATOM 76 CG2 VAL A 6 -0.790 13.643 -2.840 1.00 1.74 C ATOM 0 H VAL A 6 0.641 13.727 -6.840 1.00 0.71 H new ATOM 0 HA VAL A 6 -0.127 11.780 -4.743 1.00 0.75 H new ATOM 0 HB VAL A 6 1.197 13.397 -3.645 1.00 0.89 H new ATOM 0 HG11 VAL A 6 0.585 15.820 -3.557 1.00 1.49 H new ATOM 0 HG12 VAL A 6 1.113 15.303 -5.176 1.00 1.49 H new ATOM 0 HG13 VAL A 6 -0.619 15.536 -4.837 1.00 1.49 H new ATOM 0 HG21 VAL A 6 -0.498 14.327 -2.043 1.00 1.74 H new ATOM 0 HG22 VAL A 6 -1.781 13.912 -3.204 1.00 1.74 H new ATOM 0 HG23 VAL A 6 -0.809 12.624 -2.454 1.00 1.74 H new ATOM 86 N LYS A 7 -2.554 12.390 -5.190 1.00 0.61 N ATOM 87 CA LYS A 7 -3.935 12.661 -5.572 1.00 0.63 C ATOM 88 C LYS A 7 -4.824 12.743 -4.336 1.00 0.71 C ATOM 89 O LYS A 7 -4.494 12.207 -3.280 1.00 0.94 O ATOM 90 CB LYS A 7 -4.411 11.620 -6.598 1.00 0.66 C ATOM 91 CG LYS A 7 -4.618 12.331 -7.937 1.00 1.04 C ATOM 92 CD LYS A 7 -4.789 11.339 -9.088 1.00 0.94 C ATOM 93 CE LYS A 7 -4.798 12.081 -10.431 1.00 1.59 C ATOM 94 NZ LYS A 7 -3.472 12.652 -10.759 1.00 2.54 N ATOM 0 H LYS A 7 -2.453 11.670 -4.474 1.00 0.61 H new ATOM 0 HA LYS A 7 -4.000 13.634 -6.059 1.00 0.63 H new ATOM 0 HB2 LYS A 7 -3.675 10.823 -6.700 1.00 0.66 H new ATOM 0 HB3 LYS A 7 -5.340 11.156 -6.266 1.00 0.66 H new ATOM 0 HG2 LYS A 7 -5.498 12.972 -7.876 1.00 1.04 H new ATOM 0 HG3 LYS A 7 -3.765 12.979 -8.140 1.00 1.04 H new ATOM 0 HD2 LYS A 7 -3.979 10.610 -9.073 1.00 0.94 H new ATOM 0 HD3 LYS A 7 -5.719 10.784 -8.964 1.00 0.94 H new ATOM 0 HE2 LYS A 7 -5.103 11.396 -11.222 1.00 1.59 H new ATOM 0 HE3 LYS A 7 -5.539 12.880 -10.399 1.00 1.59 H new ATOM 0 HZ1 LYS A 7 -3.436 12.886 -11.772 1.00 2.54 H new ATOM 0 HZ2 LYS A 7 -3.317 13.514 -10.199 1.00 2.54 H new ATOM 0 HZ3 LYS A 7 -2.730 11.957 -10.537 1.00 2.54 H new ATOM 108 N ARG A 8 -5.936 13.473 -4.463 1.00 0.91 N ATOM 109 CA ARG A 8 -6.696 13.974 -3.327 1.00 1.10 C ATOM 110 C ARG A 8 -8.026 13.231 -3.269 1.00 0.96 C ATOM 111 O ARG A 8 -9.054 13.741 -3.714 1.00 1.08 O ATOM 112 CB ARG A 8 -6.828 15.501 -3.474 1.00 1.57 C ATOM 113 CG ARG A 8 -7.077 16.216 -2.142 1.00 1.79 C ATOM 114 CD ARG A 8 -8.424 15.897 -1.505 1.00 2.20 C ATOM 115 NE ARG A 8 -9.545 16.317 -2.351 1.00 2.97 N ATOM 116 CZ ARG A 8 -10.002 17.572 -2.434 1.00 3.33 C ATOM 117 NH1 ARG A 8 -11.066 17.851 -3.186 1.00 4.11 N ATOM 118 NH2 ARG A 8 -9.387 18.550 -1.765 1.00 3.58 N ATOM 0 H ARG A 8 -6.332 13.732 -5.366 1.00 0.91 H new ATOM 0 HA ARG A 8 -6.200 13.792 -2.374 1.00 1.10 H new ATOM 0 HB2 ARG A 8 -5.918 15.896 -3.927 1.00 1.57 H new ATOM 0 HB3 ARG A 8 -7.647 15.724 -4.158 1.00 1.57 H new ATOM 0 HG2 ARG A 8 -6.284 15.946 -1.444 1.00 1.79 H new ATOM 0 HG3 ARG A 8 -7.009 17.292 -2.302 1.00 1.79 H new ATOM 0 HD2 ARG A 8 -8.492 14.825 -1.319 1.00 2.20 H new ATOM 0 HD3 ARG A 8 -8.494 16.394 -0.537 1.00 2.20 H new ATOM 0 HE ARG A 8 -10.008 15.604 -2.915 1.00 2.97 H new ATOM 0 HH11 ARG A 8 -11.536 17.107 -3.701 1.00 4.11 H new ATOM 0 HH12 ARG A 8 -11.411 18.809 -3.246 1.00 4.11 H new ATOM 0 HH21 ARG A 8 -8.570 18.340 -1.192 1.00 3.58 H new ATOM 0 HH22 ARG A 8 -9.734 19.507 -1.827 1.00 3.58 H new ATOM 132 N ALA A 9 -7.979 12.012 -2.738 1.00 0.89 N ATOM 133 CA ALA A 9 -9.037 11.016 -2.800 1.00 0.84 C ATOM 134 C ALA A 9 -8.653 9.854 -1.878 1.00 0.94 C ATOM 135 O ALA A 9 -7.526 9.809 -1.382 1.00 1.12 O ATOM 136 CB ALA A 9 -9.181 10.515 -4.244 1.00 0.76 C ATOM 0 H ALA A 9 -7.161 11.679 -2.229 1.00 0.89 H new ATOM 0 HA ALA A 9 -9.987 11.446 -2.482 1.00 0.84 H new ATOM 0 HB1 ALA A 9 -9.974 9.768 -4.293 1.00 0.76 H new ATOM 0 HB2 ALA A 9 -9.430 11.352 -4.896 1.00 0.76 H new ATOM 0 HB3 ALA A 9 -8.241 10.069 -4.570 1.00 0.76 H new ATOM 142 N ASP A 10 -9.580 8.919 -1.663 1.00 0.94 N ATOM 143 CA ASP A 10 -9.291 7.661 -0.980 1.00 1.09 C ATOM 144 C ASP A 10 -8.596 6.729 -1.971 1.00 0.89 C ATOM 145 O ASP A 10 -8.905 6.755 -3.168 1.00 0.86 O ATOM 146 CB ASP A 10 -10.598 6.997 -0.495 1.00 1.33 C ATOM 147 CG ASP A 10 -10.542 6.472 0.947 1.00 2.61 C ATOM 148 OD1 ASP A 10 -11.612 6.053 1.446 1.00 3.04 O ATOM 149 OD2 ASP A 10 -9.437 6.469 1.535 1.00 4.18 O ATOM 0 H ASP A 10 -10.552 9.014 -1.958 1.00 0.94 H new ATOM 0 HA ASP A 10 -8.656 7.854 -0.115 1.00 1.09 H new ATOM 0 HB2 ASP A 10 -11.410 7.719 -0.575 1.00 1.33 H new ATOM 0 HB3 ASP A 10 -10.841 6.169 -1.162 1.00 1.33 H new ATOM 154 N ILE A 11 -7.695 5.872 -1.492 1.00 0.85 N ATOM 155 CA ILE A 11 -7.130 4.814 -2.327 1.00 0.71 C ATOM 156 C ILE A 11 -8.228 3.824 -2.734 1.00 0.93 C ATOM 157 O ILE A 11 -8.529 2.874 -2.019 1.00 1.38 O ATOM 158 CB ILE A 11 -5.930 4.134 -1.639 1.00 0.58 C ATOM 159 CG1 ILE A 11 -5.290 3.049 -2.529 1.00 1.08 C ATOM 160 CG2 ILE A 11 -6.275 3.534 -0.266 1.00 1.10 C ATOM 161 CD1 ILE A 11 -4.950 3.524 -3.949 1.00 0.65 C ATOM 0 H ILE A 11 -7.342 5.889 -0.535 1.00 0.85 H new ATOM 0 HA ILE A 11 -6.736 5.255 -3.242 1.00 0.71 H new ATOM 0 HB ILE A 11 -5.208 4.935 -1.479 1.00 0.58 H new ATOM 0 HG12 ILE A 11 -4.379 2.691 -2.049 1.00 1.08 H new ATOM 0 HG13 ILE A 11 -5.970 2.200 -2.594 1.00 1.08 H new ATOM 0 HG21 ILE A 11 -5.386 3.071 0.163 1.00 1.10 H new ATOM 0 HG22 ILE A 11 -6.629 4.323 0.397 1.00 1.10 H new ATOM 0 HG23 ILE A 11 -7.055 2.782 -0.383 1.00 1.10 H new ATOM 0 HD11 ILE A 11 -4.504 2.703 -4.510 1.00 0.65 H new ATOM 0 HD12 ILE A 11 -5.860 3.854 -4.450 1.00 0.65 H new ATOM 0 HD13 ILE A 11 -4.244 4.353 -3.896 1.00 0.65 H new ATOM 173 N ALA A 12 -8.832 4.066 -3.894 1.00 0.82 N ATOM 174 CA ALA A 12 -9.802 3.207 -4.563 1.00 1.02 C ATOM 175 C ALA A 12 -10.131 3.800 -5.921 1.00 1.12 C ATOM 176 O ALA A 12 -10.147 3.094 -6.925 1.00 1.31 O ATOM 177 CB ALA A 12 -11.090 3.076 -3.750 1.00 1.15 C ATOM 0 H ALA A 12 -8.646 4.918 -4.423 1.00 0.82 H new ATOM 0 HA ALA A 12 -9.364 2.214 -4.670 1.00 1.02 H new ATOM 0 HB1 ALA A 12 -11.790 2.429 -4.279 1.00 1.15 H new ATOM 0 HB2 ALA A 12 -10.863 2.645 -2.775 1.00 1.15 H new ATOM 0 HB3 ALA A 12 -11.537 4.061 -3.616 1.00 1.15 H new ATOM 183 N THR A 13 -10.387 5.108 -5.955 1.00 1.21 N ATOM 184 CA THR A 13 -10.649 5.819 -7.194 1.00 1.45 C ATOM 185 C THR A 13 -9.292 6.291 -7.725 1.00 1.37 C ATOM 186 O THR A 13 -8.968 7.475 -7.820 1.00 2.07 O ATOM 187 CB THR A 13 -11.738 6.879 -6.956 1.00 1.74 C ATOM 188 OG1 THR A 13 -12.217 7.415 -8.169 1.00 2.14 O ATOM 189 CG2 THR A 13 -11.336 8.022 -6.022 1.00 1.95 C ATOM 0 H THR A 13 -10.417 5.698 -5.123 1.00 1.21 H new ATOM 0 HA THR A 13 -11.080 5.209 -7.988 1.00 1.45 H new ATOM 0 HB THR A 13 -12.530 6.329 -6.448 1.00 1.74 H new ATOM 0 HG1 THR A 13 -12.908 8.084 -7.981 1.00 2.14 H new ATOM 0 HG21 THR A 13 -12.169 8.717 -5.917 1.00 1.95 H new ATOM 0 HG22 THR A 13 -11.076 7.618 -5.044 1.00 1.95 H new ATOM 0 HG23 THR A 13 -10.476 8.547 -6.438 1.00 1.95 H new ATOM 197 N ALA A 14 -8.456 5.302 -8.027 1.00 0.77 N ATOM 198 CA ALA A 14 -7.210 5.516 -8.717 1.00 0.72 C ATOM 199 C ALA A 14 -7.475 5.381 -10.210 1.00 0.78 C ATOM 200 O ALA A 14 -8.549 4.943 -10.621 1.00 1.91 O ATOM 201 CB ALA A 14 -6.198 4.496 -8.208 1.00 0.71 C ATOM 0 H ALA A 14 -8.635 4.325 -7.793 1.00 0.77 H new ATOM 0 HA ALA A 14 -6.799 6.509 -8.533 1.00 0.72 H new ATOM 0 HB1 ALA A 14 -5.246 4.642 -8.719 1.00 0.71 H new ATOM 0 HB2 ALA A 14 -6.058 4.627 -7.135 1.00 0.71 H new ATOM 0 HB3 ALA A 14 -6.566 3.489 -8.405 1.00 0.71 H new ATOM 207 N ILE A 15 -6.492 5.755 -11.019 1.00 1.24 N ATOM 208 CA ILE A 15 -6.582 5.754 -12.467 1.00 1.34 C ATOM 209 C ILE A 15 -5.362 5.040 -13.049 1.00 1.12 C ATOM 210 O ILE A 15 -4.911 5.370 -14.144 1.00 1.40 O ATOM 211 CB ILE A 15 -6.754 7.196 -12.998 1.00 1.87 C ATOM 212 CG1 ILE A 15 -5.552 8.137 -12.758 1.00 2.16 C ATOM 213 CG2 ILE A 15 -8.051 7.815 -12.454 1.00 2.20 C ATOM 214 CD1 ILE A 15 -5.505 8.838 -11.395 1.00 2.63 C ATOM 0 H ILE A 15 -5.587 6.075 -10.673 1.00 1.24 H new ATOM 0 HA ILE A 15 -7.466 5.204 -12.790 1.00 1.34 H new ATOM 0 HB ILE A 15 -6.811 7.095 -14.082 1.00 1.87 H new ATOM 0 HG12 ILE A 15 -4.635 7.560 -12.879 1.00 2.16 H new ATOM 0 HG13 ILE A 15 -5.553 8.900 -13.536 1.00 2.16 H new ATOM 0 HG21 ILE A 15 -8.158 8.830 -12.837 1.00 2.20 H new ATOM 0 HG22 ILE A 15 -8.903 7.215 -12.774 1.00 2.20 H new ATOM 0 HG23 ILE A 15 -8.013 7.840 -11.365 1.00 2.20 H new ATOM 0 HD11 ILE A 15 -4.619 9.471 -11.342 1.00 2.63 H new ATOM 0 HD12 ILE A 15 -6.397 9.452 -11.270 1.00 2.63 H new ATOM 0 HD13 ILE A 15 -5.465 8.091 -10.603 1.00 2.63 H new ATOM 226 N GLU A 16 -4.832 4.043 -12.332 1.00 0.78 N ATOM 227 CA GLU A 16 -3.603 3.376 -12.722 1.00 0.77 C ATOM 228 C GLU A 16 -3.836 1.898 -13.044 1.00 0.67 C ATOM 229 O GLU A 16 -4.872 1.330 -12.700 1.00 0.64 O ATOM 230 CB GLU A 16 -2.570 3.542 -11.604 1.00 0.83 C ATOM 231 CG GLU A 16 -2.009 4.967 -11.523 1.00 0.99 C ATOM 232 CD GLU A 16 -2.656 5.782 -10.410 1.00 1.01 C ATOM 233 OE1 GLU A 16 -3.742 6.352 -10.637 1.00 1.85 O ATOM 234 OE2 GLU A 16 -2.026 5.863 -9.336 1.00 2.19 O ATOM 0 H GLU A 16 -5.246 3.684 -11.472 1.00 0.78 H new ATOM 0 HA GLU A 16 -3.227 3.837 -13.636 1.00 0.77 H new ATOM 0 HB2 GLU A 16 -3.028 3.282 -10.650 1.00 0.83 H new ATOM 0 HB3 GLU A 16 -1.750 2.842 -11.765 1.00 0.83 H new ATOM 0 HG2 GLU A 16 -0.932 4.922 -11.358 1.00 0.99 H new ATOM 0 HG3 GLU A 16 -2.165 5.471 -12.477 1.00 0.99 H new ATOM 241 N ASP A 17 -2.852 1.277 -13.706 1.00 0.70 N ATOM 242 CA ASP A 17 -2.884 -0.118 -14.148 1.00 0.70 C ATOM 243 C ASP A 17 -2.946 -1.058 -12.948 1.00 0.67 C ATOM 244 O ASP A 17 -3.509 -2.152 -13.015 1.00 0.80 O ATOM 245 CB ASP A 17 -1.595 -0.457 -14.896 1.00 0.75 C ATOM 246 CG ASP A 17 -1.323 0.398 -16.129 1.00 0.82 C ATOM 247 OD1 ASP A 17 -2.103 0.292 -17.096 1.00 1.54 O ATOM 248 OD2 ASP A 17 -0.305 1.131 -16.092 1.00 1.78 O ATOM 0 H ASP A 17 -1.983 1.750 -13.956 1.00 0.70 H new ATOM 0 HA ASP A 17 -3.760 -0.240 -14.785 1.00 0.70 H new ATOM 0 HB2 ASP A 17 -0.756 -0.354 -14.208 1.00 0.75 H new ATOM 0 HB3 ASP A 17 -1.633 -1.503 -15.199 1.00 0.75 H new ATOM 253 N ALA A 18 -2.293 -0.647 -11.859 1.00 0.57 N ATOM 254 CA ALA A 18 -2.370 -1.335 -10.588 1.00 0.45 C ATOM 255 C ALA A 18 -2.782 -0.372 -9.486 1.00 0.32 C ATOM 256 O ALA A 18 -2.542 0.834 -9.547 1.00 0.35 O ATOM 257 CB ALA A 18 -1.016 -1.954 -10.269 1.00 0.50 C ATOM 0 H ALA A 18 -1.695 0.179 -11.844 1.00 0.57 H new ATOM 0 HA ALA A 18 -3.122 -2.121 -10.651 1.00 0.45 H new ATOM 0 HB1 ALA A 18 -1.070 -2.473 -9.312 1.00 0.50 H new ATOM 0 HB2 ALA A 18 -0.746 -2.663 -11.052 1.00 0.50 H new ATOM 0 HB3 ALA A 18 -0.261 -1.170 -10.214 1.00 0.50 H new ATOM 263 N VAL A 19 -3.351 -0.942 -8.432 1.00 0.28 N ATOM 264 CA VAL A 19 -3.806 -0.231 -7.256 1.00 0.24 C ATOM 265 C VAL A 19 -3.259 -1.015 -6.085 1.00 0.25 C ATOM 266 O VAL A 19 -3.573 -2.192 -5.964 1.00 0.49 O ATOM 267 CB VAL A 19 -5.344 -0.191 -7.255 1.00 0.34 C ATOM 268 CG1 VAL A 19 -5.916 0.255 -5.904 1.00 0.55 C ATOM 269 CG2 VAL A 19 -5.816 0.765 -8.350 1.00 0.68 C ATOM 0 H VAL A 19 -3.512 -1.948 -8.376 1.00 0.28 H new ATOM 0 HA VAL A 19 -3.466 0.804 -7.217 1.00 0.24 H new ATOM 0 HB VAL A 19 -5.705 -1.202 -7.441 1.00 0.34 H new ATOM 0 HG11 VAL A 19 -7.005 0.267 -5.956 1.00 0.55 H new ATOM 0 HG12 VAL A 19 -5.597 -0.439 -5.127 1.00 0.55 H new ATOM 0 HG13 VAL A 19 -5.553 1.255 -5.668 1.00 0.55 H new ATOM 0 HG21 VAL A 19 -6.905 0.800 -8.357 1.00 0.68 H new ATOM 0 HG22 VAL A 19 -5.422 1.763 -8.157 1.00 0.68 H new ATOM 0 HG23 VAL A 19 -5.458 0.415 -9.318 1.00 0.68 H new ATOM 279 N VAL A 20 -2.425 -0.409 -5.248 1.00 0.20 N ATOM 280 CA VAL A 20 -1.922 -1.080 -4.065 1.00 0.21 C ATOM 281 C VAL A 20 -2.889 -0.772 -2.924 1.00 0.23 C ATOM 282 O VAL A 20 -3.557 0.261 -2.933 1.00 0.43 O ATOM 283 CB VAL A 20 -0.497 -0.607 -3.754 1.00 0.32 C ATOM 284 CG1 VAL A 20 0.121 -1.381 -2.579 1.00 1.14 C ATOM 285 CG2 VAL A 20 0.422 -0.749 -4.975 1.00 1.07 C ATOM 0 H VAL A 20 -2.086 0.545 -5.370 1.00 0.20 H new ATOM 0 HA VAL A 20 -1.866 -2.158 -4.214 1.00 0.21 H new ATOM 0 HB VAL A 20 -0.580 0.445 -3.482 1.00 0.32 H new ATOM 0 HG11 VAL A 20 1.130 -1.014 -2.392 1.00 1.14 H new ATOM 0 HG12 VAL A 20 -0.488 -1.236 -1.687 1.00 1.14 H new ATOM 0 HG13 VAL A 20 0.160 -2.443 -2.823 1.00 1.14 H new ATOM 0 HG21 VAL A 20 1.424 -0.405 -4.718 1.00 1.07 H new ATOM 0 HG22 VAL A 20 0.465 -1.795 -5.279 1.00 1.07 H new ATOM 0 HG23 VAL A 20 0.031 -0.148 -5.796 1.00 1.07 H new ATOM 295 N ASN A 21 -2.955 -1.644 -1.921 1.00 0.20 N ATOM 296 CA ASN A 21 -3.821 -1.486 -0.771 1.00 0.30 C ATOM 297 C ASN A 21 -2.998 -1.638 0.504 1.00 0.34 C ATOM 298 O ASN A 21 -2.032 -2.400 0.516 1.00 0.37 O ATOM 299 CB ASN A 21 -4.924 -2.540 -0.843 1.00 0.44 C ATOM 300 CG ASN A 21 -6.077 -2.134 0.054 1.00 1.10 C ATOM 301 OD1 ASN A 21 -5.912 -2.023 1.257 1.00 2.35 O ATOM 302 ND2 ASN A 21 -7.246 -1.883 -0.511 1.00 1.84 N ATOM 0 H ASN A 21 -2.394 -2.495 -1.891 1.00 0.20 H new ATOM 0 HA ASN A 21 -4.278 -0.497 -0.765 1.00 0.30 H new ATOM 0 HB2 ASN A 21 -5.271 -2.648 -1.871 1.00 0.44 H new ATOM 0 HB3 ASN A 21 -4.534 -3.510 -0.534 1.00 0.44 H new ATOM 0 HD21 ASN A 21 -8.037 -1.589 0.062 1.00 1.84 H new ATOM 0 HD22 ASN A 21 -7.357 -1.984 -1.520 1.00 1.84 H new ATOM 309 N ALA A 22 -3.374 -0.928 1.570 1.00 0.43 N ATOM 310 CA ALA A 22 -2.744 -1.032 2.873 1.00 0.43 C ATOM 311 C ALA A 22 -3.367 -2.222 3.609 1.00 0.47 C ATOM 312 O ALA A 22 -4.163 -2.067 4.532 1.00 0.80 O ATOM 313 CB ALA A 22 -2.937 0.300 3.608 1.00 0.54 C ATOM 0 H ALA A 22 -4.140 -0.254 1.543 1.00 0.43 H new ATOM 0 HA ALA A 22 -1.671 -1.213 2.804 1.00 0.43 H new ATOM 0 HB1 ALA A 22 -2.470 0.244 4.591 1.00 0.54 H new ATOM 0 HB2 ALA A 22 -2.476 1.103 3.033 1.00 0.54 H new ATOM 0 HB3 ALA A 22 -4.002 0.501 3.723 1.00 0.54 H new ATOM 319 N ALA A 23 -3.031 -3.427 3.156 1.00 0.42 N ATOM 320 CA ALA A 23 -3.653 -4.653 3.619 1.00 0.47 C ATOM 321 C ALA A 23 -3.153 -5.006 5.023 1.00 0.56 C ATOM 322 O ALA A 23 -1.958 -4.943 5.300 1.00 0.82 O ATOM 323 CB ALA A 23 -3.347 -5.752 2.596 1.00 0.52 C ATOM 0 H ALA A 23 -2.311 -3.576 2.449 1.00 0.42 H new ATOM 0 HA ALA A 23 -4.734 -4.537 3.698 1.00 0.47 H new ATOM 0 HB1 ALA A 23 -3.804 -6.687 2.919 1.00 0.52 H new ATOM 0 HB2 ALA A 23 -3.751 -5.468 1.625 1.00 0.52 H new ATOM 0 HB3 ALA A 23 -2.268 -5.884 2.515 1.00 0.52 H new ATOM 329 N ASN A 24 -4.044 -5.428 5.926 1.00 0.84 N ATOM 330 CA ASN A 24 -3.638 -5.736 7.299 1.00 0.89 C ATOM 331 C ASN A 24 -3.425 -7.240 7.440 1.00 1.06 C ATOM 332 O ASN A 24 -3.989 -7.855 8.343 1.00 2.53 O ATOM 333 CB ASN A 24 -4.695 -5.315 8.327 1.00 1.36 C ATOM 334 CG ASN A 24 -4.940 -3.820 8.452 1.00 2.48 C ATOM 335 OD1 ASN A 24 -4.009 -3.045 8.643 1.00 3.76 O ATOM 336 ND2 ASN A 24 -6.203 -3.414 8.429 1.00 2.88 N ATOM 0 H ASN A 24 -5.037 -5.562 5.734 1.00 0.84 H new ATOM 0 HA ASN A 24 -2.721 -5.180 7.493 1.00 0.89 H new ATOM 0 HB2 ASN A 24 -5.638 -5.798 8.069 1.00 1.36 H new ATOM 0 HB3 ASN A 24 -4.397 -5.698 9.303 1.00 1.36 H new ATOM 0 HD21 ASN A 24 -6.425 -2.429 8.573 1.00 2.88 H new ATOM 0 HD22 ASN A 24 -6.952 -4.087 8.267 1.00 2.88 H new ATOM 343 N HIS A 25 -2.646 -7.850 6.546 1.00 0.88 N ATOM 344 CA HIS A 25 -2.320 -9.276 6.562 1.00 0.84 C ATOM 345 C HIS A 25 -3.497 -10.124 6.050 1.00 1.04 C ATOM 346 O HIS A 25 -3.326 -10.934 5.140 1.00 1.54 O ATOM 347 CB HIS A 25 -1.825 -9.708 7.957 1.00 0.87 C ATOM 348 CG HIS A 25 -0.941 -10.930 7.992 1.00 1.27 C ATOM 349 ND1 HIS A 25 0.246 -11.028 8.685 1.00 2.81 N ATOM 350 CD2 HIS A 25 -1.215 -12.164 7.465 1.00 1.43 C ATOM 351 CE1 HIS A 25 0.667 -12.301 8.587 1.00 3.03 C ATOM 352 NE2 HIS A 25 -0.185 -13.027 7.849 1.00 1.90 N ATOM 0 H HIS A 25 -2.212 -7.351 5.769 1.00 0.88 H new ATOM 0 HA HIS A 25 -1.497 -9.453 5.870 1.00 0.84 H new ATOM 0 HB2 HIS A 25 -1.280 -8.876 8.402 1.00 0.87 H new ATOM 0 HB3 HIS A 25 -2.694 -9.893 8.588 1.00 0.87 H new ATOM 0 HD2 HIS A 25 -2.072 -12.423 6.862 1.00 1.43 H new ATOM 0 HE1 HIS A 25 1.568 -12.686 9.041 1.00 3.03 H new ATOM 0 HE2 HIS A 25 -0.098 -14.016 7.614 1.00 1.90 H new ATOM 360 N ARG A 26 -4.708 -9.962 6.599 1.00 1.45 N ATOM 361 CA ARG A 26 -5.895 -10.586 6.063 1.00 1.83 C ATOM 362 C ARG A 26 -6.323 -9.709 4.907 1.00 1.95 C ATOM 363 O ARG A 26 -6.698 -8.556 5.098 1.00 2.94 O ATOM 364 CB ARG A 26 -7.009 -10.644 7.115 1.00 2.36 C ATOM 365 CG ARG A 26 -6.654 -11.610 8.247 1.00 2.61 C ATOM 366 CD ARG A 26 -7.831 -11.709 9.221 1.00 3.24 C ATOM 367 NE ARG A 26 -7.486 -12.523 10.394 1.00 3.75 N ATOM 368 CZ ARG A 26 -8.324 -12.810 11.400 1.00 4.53 C ATOM 369 NH1 ARG A 26 -7.889 -13.505 12.452 1.00 5.16 N ATOM 370 NH2 ARG A 26 -9.591 -12.399 11.351 1.00 4.92 N ATOM 0 H ARG A 26 -4.878 -9.392 7.427 1.00 1.45 H new ATOM 0 HA ARG A 26 -5.697 -11.612 5.754 1.00 1.83 H new ATOM 0 HB2 ARG A 26 -7.178 -9.648 7.524 1.00 2.36 H new ATOM 0 HB3 ARG A 26 -7.941 -10.958 6.644 1.00 2.36 H new ATOM 0 HG2 ARG A 26 -6.421 -12.594 7.840 1.00 2.61 H new ATOM 0 HG3 ARG A 26 -5.763 -11.262 8.770 1.00 2.61 H new ATOM 0 HD2 ARG A 26 -8.125 -10.710 9.543 1.00 3.24 H new ATOM 0 HD3 ARG A 26 -8.691 -12.146 8.713 1.00 3.24 H new ATOM 0 HE ARG A 26 -6.539 -12.898 10.447 1.00 3.75 H new ATOM 0 HH11 ARG A 26 -6.919 -13.818 12.491 1.00 5.16 H new ATOM 0 HH12 ARG A 26 -8.526 -13.724 13.218 1.00 5.16 H new ATOM 0 HH21 ARG A 26 -9.923 -11.866 10.548 1.00 4.92 H new ATOM 0 HH22 ARG A 26 -10.228 -12.618 12.117 1.00 4.92 H new ATOM 384 N GLY A 27 -6.293 -10.268 3.709 1.00 1.35 N ATOM 385 CA GLY A 27 -6.807 -9.624 2.524 1.00 1.50 C ATOM 386 C GLY A 27 -8.282 -9.951 2.422 1.00 1.68 C ATOM 387 O GLY A 27 -8.693 -10.636 1.489 1.00 2.13 O ATOM 0 H GLY A 27 -5.904 -11.195 3.536 1.00 1.35 H new ATOM 0 HA2 GLY A 27 -6.658 -8.546 2.580 1.00 1.50 H new ATOM 0 HA3 GLY A 27 -6.276 -9.974 1.639 1.00 1.50 H new ATOM 391 N GLN A 28 -9.055 -9.489 3.405 1.00 1.91 N ATOM 392 CA GLN A 28 -10.509 -9.579 3.402 1.00 2.44 C ATOM 393 C GLN A 28 -11.069 -8.237 3.858 1.00 2.02 C ATOM 394 O GLN A 28 -10.322 -7.376 4.320 1.00 2.17 O ATOM 395 CB GLN A 28 -10.996 -10.718 4.310 1.00 3.19 C ATOM 396 CG GLN A 28 -10.745 -12.090 3.676 1.00 4.10 C ATOM 397 CD GLN A 28 -11.434 -13.196 4.471 1.00 4.75 C ATOM 398 OE1 GLN A 28 -11.347 -13.243 5.692 1.00 4.54 O ATOM 399 NE2 GLN A 28 -12.134 -14.102 3.800 1.00 6.00 N ATOM 0 H GLN A 28 -8.679 -9.035 4.237 1.00 1.91 H new ATOM 0 HA GLN A 28 -10.862 -9.805 2.396 1.00 2.44 H new ATOM 0 HB2 GLN A 28 -10.485 -10.662 5.271 1.00 3.19 H new ATOM 0 HB3 GLN A 28 -12.061 -10.597 4.507 1.00 3.19 H new ATOM 0 HG2 GLN A 28 -11.112 -12.093 2.650 1.00 4.10 H new ATOM 0 HG3 GLN A 28 -9.673 -12.283 3.632 1.00 4.10 H new ATOM 0 HE21 GLN A 28 -12.196 -14.048 2.783 1.00 6.00 H new ATOM 0 HE22 GLN A 28 -12.610 -14.852 4.301 1.00 6.00 H new ATOM 408 N VAL A 29 -12.379 -8.037 3.705 1.00 2.31 N ATOM 409 CA VAL A 29 -13.006 -6.817 4.184 1.00 2.17 C ATOM 410 C VAL A 29 -12.848 -6.760 5.704 1.00 1.99 C ATOM 411 O VAL A 29 -13.124 -7.731 6.405 1.00 2.46 O ATOM 412 CB VAL A 29 -14.457 -6.724 3.679 1.00 2.78 C ATOM 413 CG1 VAL A 29 -15.379 -7.839 4.192 1.00 3.27 C ATOM 414 CG2 VAL A 29 -15.070 -5.359 4.013 1.00 3.79 C ATOM 0 H VAL A 29 -13.014 -8.698 3.258 1.00 2.31 H new ATOM 0 HA VAL A 29 -12.518 -5.929 3.782 1.00 2.17 H new ATOM 0 HB VAL A 29 -14.386 -6.851 2.599 1.00 2.78 H new ATOM 0 HG11 VAL A 29 -16.381 -7.697 3.788 1.00 3.27 H new ATOM 0 HG12 VAL A 29 -14.993 -8.807 3.872 1.00 3.27 H new ATOM 0 HG13 VAL A 29 -15.419 -7.806 5.281 1.00 3.27 H new ATOM 0 HG21 VAL A 29 -16.095 -5.321 3.645 1.00 3.79 H new ATOM 0 HG22 VAL A 29 -15.067 -5.213 5.093 1.00 3.79 H new ATOM 0 HG23 VAL A 29 -14.485 -4.571 3.539 1.00 3.79 H new ATOM 424 N GLY A 30 -12.345 -5.633 6.200 1.00 2.09 N ATOM 425 CA GLY A 30 -11.987 -5.435 7.589 1.00 2.33 C ATOM 426 C GLY A 30 -11.877 -3.935 7.819 1.00 2.04 C ATOM 427 O GLY A 30 -12.627 -3.174 7.208 1.00 2.58 O ATOM 0 H GLY A 30 -12.172 -4.810 5.622 1.00 2.09 H new ATOM 0 HA2 GLY A 30 -12.740 -5.870 8.246 1.00 2.33 H new ATOM 0 HA3 GLY A 30 -11.042 -5.929 7.816 1.00 2.33 H new ATOM 431 N ASP A 31 -10.945 -3.499 8.667 1.00 2.14 N ATOM 432 CA ASP A 31 -10.910 -2.118 9.131 1.00 2.28 C ATOM 433 C ASP A 31 -9.630 -1.422 8.666 1.00 2.21 C ATOM 434 O ASP A 31 -8.656 -2.078 8.291 1.00 2.83 O ATOM 435 CB ASP A 31 -11.059 -2.088 10.659 1.00 3.23 C ATOM 436 CG ASP A 31 -11.866 -0.873 11.118 1.00 3.97 C ATOM 437 OD1 ASP A 31 -11.733 0.188 10.465 1.00 4.63 O ATOM 438 OD2 ASP A 31 -12.625 -1.029 12.098 1.00 4.58 O ATOM 0 H ASP A 31 -10.203 -4.087 9.046 1.00 2.14 H new ATOM 0 HA ASP A 31 -11.744 -1.567 8.697 1.00 2.28 H new ATOM 0 HB2 ASP A 31 -11.550 -3.001 10.996 1.00 3.23 H new ATOM 0 HB3 ASP A 31 -10.072 -2.067 11.122 1.00 3.23 H new ATOM 443 N GLY A 32 -9.626 -0.090 8.679 1.00 2.28 N ATOM 444 CA GLY A 32 -8.514 0.721 8.223 1.00 2.48 C ATOM 445 C GLY A 32 -8.678 1.082 6.750 1.00 2.03 C ATOM 446 O GLY A 32 -9.754 0.933 6.165 1.00 2.02 O ATOM 0 H GLY A 32 -10.416 0.461 9.015 1.00 2.28 H new ATOM 0 HA2 GLY A 32 -8.452 1.630 8.821 1.00 2.48 H new ATOM 0 HA3 GLY A 32 -7.579 0.180 8.368 1.00 2.48 H new ATOM 450 N VAL A 33 -7.605 1.588 6.139 1.00 2.25 N ATOM 451 CA VAL A 33 -7.599 1.950 4.729 1.00 2.12 C ATOM 452 C VAL A 33 -7.510 0.664 3.906 1.00 2.12 C ATOM 453 O VAL A 33 -6.443 0.280 3.443 1.00 3.33 O ATOM 454 CB VAL A 33 -6.442 2.919 4.435 1.00 2.68 C ATOM 455 CG1 VAL A 33 -6.462 3.372 2.972 1.00 2.52 C ATOM 456 CG2 VAL A 33 -6.556 4.173 5.311 1.00 3.48 C ATOM 0 H VAL A 33 -6.717 1.757 6.612 1.00 2.25 H new ATOM 0 HA VAL A 33 -8.516 2.472 4.457 1.00 2.12 H new ATOM 0 HB VAL A 33 -5.515 2.386 4.648 1.00 2.68 H new ATOM 0 HG11 VAL A 33 -5.633 4.057 2.792 1.00 2.52 H new ATOM 0 HG12 VAL A 33 -6.364 2.503 2.321 1.00 2.52 H new ATOM 0 HG13 VAL A 33 -7.404 3.879 2.761 1.00 2.52 H new ATOM 0 HG21 VAL A 33 -5.729 4.848 5.090 1.00 3.48 H new ATOM 0 HG22 VAL A 33 -7.500 4.676 5.104 1.00 3.48 H new ATOM 0 HG23 VAL A 33 -6.520 3.887 6.362 1.00 3.48 H new ATOM 466 N CYS A 34 -8.644 -0.010 3.735 1.00 1.47 N ATOM 467 CA CYS A 34 -8.712 -1.267 3.008 1.00 1.87 C ATOM 468 C CYS A 34 -10.055 -1.337 2.285 1.00 1.58 C ATOM 469 O CYS A 34 -10.111 -1.512 1.065 1.00 1.43 O ATOM 470 CB CYS A 34 -8.499 -2.430 3.990 1.00 2.58 C ATOM 471 SG CYS A 34 -7.661 -3.800 3.155 1.00 3.68 S ATOM 0 H CYS A 34 -9.543 0.304 4.100 1.00 1.47 H new ATOM 0 HA CYS A 34 -7.927 -1.337 2.255 1.00 1.87 H new ATOM 0 HB2 CYS A 34 -7.906 -2.094 4.841 1.00 2.58 H new ATOM 0 HB3 CYS A 34 -9.459 -2.765 4.383 1.00 2.58 H new ATOM 0 HG CYS A 34 -6.835 -3.328 2.269 1.00 3.68 H new ATOM 477 N ARG A 35 -11.132 -1.107 3.053 1.00 1.65 N ATOM 478 CA ARG A 35 -12.522 -1.081 2.602 1.00 1.58 C ATOM 479 C ARG A 35 -12.734 -0.287 1.316 1.00 1.40 C ATOM 480 O ARG A 35 -13.639 -0.613 0.554 1.00 1.33 O ATOM 481 CB ARG A 35 -13.438 -0.545 3.720 1.00 1.95 C ATOM 482 CG ARG A 35 -13.178 0.939 4.032 1.00 3.52 C ATOM 483 CD ARG A 35 -14.210 1.535 4.989 1.00 3.95 C ATOM 484 NE ARG A 35 -14.134 3.005 4.945 1.00 5.82 N ATOM 485 CZ ARG A 35 -15.026 3.851 5.470 1.00 6.56 C ATOM 486 NH1 ARG A 35 -14.909 5.161 5.241 1.00 8.45 N ATOM 487 NH2 ARG A 35 -16.033 3.386 6.210 1.00 5.73 N ATOM 0 H ARG A 35 -11.047 -0.926 4.053 1.00 1.65 H new ATOM 0 HA ARG A 35 -12.786 -2.113 2.370 1.00 1.58 H new ATOM 0 HB2 ARG A 35 -14.479 -0.674 3.426 1.00 1.95 H new ATOM 0 HB3 ARG A 35 -13.287 -1.135 4.624 1.00 1.95 H new ATOM 0 HG2 ARG A 35 -12.184 1.045 4.466 1.00 3.52 H new ATOM 0 HG3 ARG A 35 -13.182 1.507 3.102 1.00 3.52 H new ATOM 0 HD2 ARG A 35 -15.211 1.204 4.712 1.00 3.95 H new ATOM 0 HD3 ARG A 35 -14.027 1.182 6.004 1.00 3.95 H new ATOM 0 HE ARG A 35 -13.329 3.414 4.472 1.00 5.82 H new ATOM 0 HH11 ARG A 35 -14.142 5.512 4.668 1.00 8.45 H new ATOM 0 HH12 ARG A 35 -15.587 5.811 5.639 1.00 8.45 H new ATOM 0 HH21 ARG A 35 -16.123 2.384 6.376 1.00 5.73 H new ATOM 0 HH22 ARG A 35 -16.713 4.033 6.610 1.00 5.73 H new ATOM 501 N ALA A 36 -11.958 0.780 1.104 1.00 1.45 N ATOM 502 CA ALA A 36 -12.135 1.693 -0.011 1.00 1.43 C ATOM 503 C ALA A 36 -12.121 0.903 -1.316 1.00 1.09 C ATOM 504 O ALA A 36 -13.049 0.996 -2.119 1.00 1.22 O ATOM 505 CB ALA A 36 -11.040 2.768 0.038 1.00 1.56 C ATOM 0 H ALA A 36 -11.181 1.031 1.715 1.00 1.45 H new ATOM 0 HA ALA A 36 -13.097 2.202 0.052 1.00 1.43 H new ATOM 0 HB1 ALA A 36 -11.168 3.456 -0.797 1.00 1.56 H new ATOM 0 HB2 ALA A 36 -11.112 3.318 0.976 1.00 1.56 H new ATOM 0 HB3 ALA A 36 -10.061 2.294 -0.030 1.00 1.56 H new ATOM 511 N VAL A 37 -11.069 0.109 -1.517 1.00 0.83 N ATOM 512 CA VAL A 37 -10.971 -0.754 -2.679 1.00 0.69 C ATOM 513 C VAL A 37 -11.971 -1.896 -2.555 1.00 0.74 C ATOM 514 O VAL A 37 -12.696 -2.167 -3.507 1.00 0.94 O ATOM 515 CB VAL A 37 -9.551 -1.302 -2.819 1.00 0.82 C ATOM 516 CG1 VAL A 37 -9.449 -2.213 -4.034 1.00 1.10 C ATOM 517 CG2 VAL A 37 -8.531 -0.179 -3.003 1.00 0.89 C ATOM 0 H VAL A 37 -10.272 0.051 -0.883 1.00 0.83 H new ATOM 0 HA VAL A 37 -11.202 -0.174 -3.572 1.00 0.69 H new ATOM 0 HB VAL A 37 -9.335 -1.851 -1.902 1.00 0.82 H new ATOM 0 HG11 VAL A 37 -8.431 -2.594 -4.118 1.00 1.10 H new ATOM 0 HG12 VAL A 37 -10.141 -3.048 -3.922 1.00 1.10 H new ATOM 0 HG13 VAL A 37 -9.701 -1.650 -4.933 1.00 1.10 H new ATOM 0 HG21 VAL A 37 -7.533 -0.606 -3.099 1.00 0.89 H new ATOM 0 HG22 VAL A 37 -8.772 0.387 -3.903 1.00 0.89 H new ATOM 0 HG23 VAL A 37 -8.560 0.484 -2.138 1.00 0.89 H new ATOM 527 N ALA A 38 -12.003 -2.570 -1.398 1.00 0.82 N ATOM 528 CA ALA A 38 -12.773 -3.797 -1.205 1.00 0.93 C ATOM 529 C ALA A 38 -14.215 -3.649 -1.698 1.00 0.98 C ATOM 530 O ALA A 38 -14.742 -4.546 -2.352 1.00 1.53 O ATOM 531 CB ALA A 38 -12.747 -4.198 0.271 1.00 1.13 C ATOM 0 H ALA A 38 -11.491 -2.274 -0.567 1.00 0.82 H new ATOM 0 HA ALA A 38 -12.309 -4.583 -1.801 1.00 0.93 H new ATOM 0 HB1 ALA A 38 -13.322 -5.113 0.410 1.00 1.13 H new ATOM 0 HB2 ALA A 38 -11.717 -4.366 0.584 1.00 1.13 H new ATOM 0 HB3 ALA A 38 -13.183 -3.401 0.872 1.00 1.13 H new ATOM 537 N ARG A 39 -14.830 -2.494 -1.417 1.00 1.27 N ATOM 538 CA ARG A 39 -16.179 -2.120 -1.842 1.00 1.48 C ATOM 539 C ARG A 39 -16.460 -2.482 -3.297 1.00 1.52 C ATOM 540 O ARG A 39 -17.570 -2.899 -3.611 1.00 2.02 O ATOM 541 CB ARG A 39 -16.383 -0.613 -1.626 1.00 1.51 C ATOM 542 CG ARG A 39 -16.926 -0.299 -0.230 1.00 1.91 C ATOM 543 CD ARG A 39 -16.990 1.222 -0.046 1.00 2.64 C ATOM 544 NE ARG A 39 -17.904 1.602 1.041 1.00 2.89 N ATOM 545 CZ ARG A 39 -18.211 2.862 1.376 1.00 3.42 C ATOM 546 NH1 ARG A 39 -19.161 3.101 2.282 1.00 3.73 N ATOM 547 NH2 ARG A 39 -17.574 3.883 0.799 1.00 4.10 N ATOM 0 H ARG A 39 -14.380 -1.765 -0.863 1.00 1.27 H new ATOM 0 HA ARG A 39 -16.883 -2.688 -1.234 1.00 1.48 H new ATOM 0 HB2 ARG A 39 -15.435 -0.095 -1.770 1.00 1.51 H new ATOM 0 HB3 ARG A 39 -17.073 -0.230 -2.378 1.00 1.51 H new ATOM 0 HG2 ARG A 39 -17.917 -0.735 -0.106 1.00 1.91 H new ATOM 0 HG3 ARG A 39 -16.285 -0.743 0.531 1.00 1.91 H new ATOM 0 HD2 ARG A 39 -15.992 1.605 0.168 1.00 2.64 H new ATOM 0 HD3 ARG A 39 -17.317 1.687 -0.976 1.00 2.64 H new ATOM 0 HE ARG A 39 -18.336 0.851 1.579 1.00 2.89 H new ATOM 0 HH11 ARG A 39 -19.655 2.324 2.721 1.00 3.73 H new ATOM 0 HH12 ARG A 39 -19.394 4.061 2.536 1.00 3.73 H new ATOM 0 HH21 ARG A 39 -16.852 3.705 0.101 1.00 4.10 H new ATOM 0 HH22 ARG A 39 -17.810 4.842 1.056 1.00 4.10 H new ATOM 561 N LYS A 40 -15.497 -2.272 -4.196 1.00 1.20 N ATOM 562 CA LYS A 40 -15.668 -2.558 -5.616 1.00 1.39 C ATOM 563 C LYS A 40 -14.570 -3.474 -6.159 1.00 1.08 C ATOM 564 O LYS A 40 -14.324 -3.496 -7.359 1.00 1.32 O ATOM 565 CB LYS A 40 -15.782 -1.242 -6.389 1.00 1.92 C ATOM 566 CG LYS A 40 -14.612 -0.277 -6.140 1.00 1.63 C ATOM 567 CD LYS A 40 -14.916 0.885 -5.181 1.00 2.00 C ATOM 568 CE LYS A 40 -15.681 2.037 -5.852 1.00 2.28 C ATOM 569 NZ LYS A 40 -17.145 1.824 -5.894 1.00 3.21 N ATOM 0 H LYS A 40 -14.578 -1.899 -3.957 1.00 1.20 H new ATOM 0 HA LYS A 40 -16.595 -3.115 -5.754 1.00 1.39 H new ATOM 0 HB2 LYS A 40 -15.841 -1.461 -7.455 1.00 1.92 H new ATOM 0 HB3 LYS A 40 -16.714 -0.748 -6.113 1.00 1.92 H new ATOM 0 HG2 LYS A 40 -13.771 -0.845 -5.742 1.00 1.63 H new ATOM 0 HG3 LYS A 40 -14.293 0.136 -7.097 1.00 1.63 H new ATOM 0 HD2 LYS A 40 -15.500 0.511 -4.340 1.00 2.00 H new ATOM 0 HD3 LYS A 40 -13.980 1.267 -4.774 1.00 2.00 H new ATOM 0 HE2 LYS A 40 -15.471 2.963 -5.317 1.00 2.28 H new ATOM 0 HE3 LYS A 40 -15.311 2.166 -6.869 1.00 2.28 H new ATOM 0 HZ1 LYS A 40 -17.627 2.741 -5.983 1.00 3.21 H new ATOM 0 HZ2 LYS A 40 -17.386 1.226 -6.710 1.00 3.21 H new ATOM 0 HZ3 LYS A 40 -17.453 1.355 -5.019 1.00 3.21 H new ATOM 583 N TRP A 41 -13.959 -4.276 -5.291 1.00 1.13 N ATOM 584 CA TRP A 41 -12.995 -5.301 -5.674 1.00 1.02 C ATOM 585 C TRP A 41 -13.122 -6.538 -4.769 1.00 0.82 C ATOM 586 O TRP A 41 -12.135 -7.024 -4.215 1.00 0.90 O ATOM 587 CB TRP A 41 -11.586 -4.682 -5.672 1.00 1.48 C ATOM 588 CG TRP A 41 -11.149 -4.161 -7.004 1.00 1.37 C ATOM 589 CD1 TRP A 41 -10.717 -4.953 -8.006 1.00 1.96 C ATOM 590 CD2 TRP A 41 -11.082 -2.795 -7.524 1.00 1.16 C ATOM 591 NE1 TRP A 41 -10.421 -4.191 -9.114 1.00 1.99 N ATOM 592 CE2 TRP A 41 -10.596 -2.847 -8.864 1.00 1.34 C ATOM 593 CE3 TRP A 41 -11.364 -1.513 -7.007 1.00 1.58 C ATOM 594 CZ2 TRP A 41 -10.392 -1.695 -9.638 1.00 1.31 C ATOM 595 CZ3 TRP A 41 -11.110 -0.345 -7.749 1.00 1.71 C ATOM 596 CH2 TRP A 41 -10.632 -0.434 -9.068 1.00 1.33 C ATOM 0 H TRP A 41 -14.123 -4.230 -4.285 1.00 1.13 H new ATOM 0 HA TRP A 41 -13.199 -5.657 -6.684 1.00 1.02 H new ATOM 0 HB2 TRP A 41 -11.559 -3.868 -4.948 1.00 1.48 H new ATOM 0 HB3 TRP A 41 -10.871 -5.432 -5.334 1.00 1.48 H new ATOM 0 HD1 TRP A 41 -10.618 -6.027 -7.948 1.00 1.96 H new ATOM 0 HE1 TRP A 41 -10.111 -4.573 -10.008 1.00 1.99 H new ATOM 0 HE3 TRP A 41 -11.786 -1.426 -6.016 1.00 1.58 H new ATOM 0 HZ2 TRP A 41 -10.054 -1.777 -10.661 1.00 1.31 H new ATOM 0 HZ3 TRP A 41 -11.283 0.624 -7.304 1.00 1.71 H new ATOM 0 HH2 TRP A 41 -10.450 0.463 -9.641 1.00 1.33 H new ATOM 607 N PRO A 42 -14.322 -7.127 -4.656 1.00 0.78 N ATOM 608 CA PRO A 42 -14.544 -8.277 -3.795 1.00 0.95 C ATOM 609 C PRO A 42 -13.751 -9.487 -4.287 1.00 0.84 C ATOM 610 O PRO A 42 -13.165 -10.214 -3.492 1.00 0.98 O ATOM 611 CB PRO A 42 -16.054 -8.526 -3.824 1.00 1.19 C ATOM 612 CG PRO A 42 -16.492 -7.945 -5.169 1.00 1.05 C ATOM 613 CD PRO A 42 -15.544 -6.760 -5.352 1.00 0.85 C ATOM 0 HA PRO A 42 -14.200 -8.099 -2.776 1.00 0.95 H new ATOM 0 HB2 PRO A 42 -16.286 -9.589 -3.752 1.00 1.19 H new ATOM 0 HB3 PRO A 42 -16.557 -8.033 -2.992 1.00 1.19 H new ATOM 0 HG2 PRO A 42 -16.391 -8.672 -5.975 1.00 1.05 H new ATOM 0 HG3 PRO A 42 -17.535 -7.629 -5.153 1.00 1.05 H new ATOM 0 HD2 PRO A 42 -15.352 -6.571 -6.408 1.00 0.85 H new ATOM 0 HD3 PRO A 42 -15.972 -5.847 -4.938 1.00 0.85 H new ATOM 621 N GLN A 43 -13.739 -9.722 -5.601 1.00 0.74 N ATOM 622 CA GLN A 43 -13.132 -10.919 -6.159 1.00 0.84 C ATOM 623 C GLN A 43 -11.618 -10.917 -5.942 1.00 0.78 C ATOM 624 O GLN A 43 -11.037 -11.956 -5.648 1.00 0.84 O ATOM 625 CB GLN A 43 -13.534 -11.052 -7.635 1.00 1.01 C ATOM 626 CG GLN A 43 -13.532 -12.513 -8.112 1.00 1.19 C ATOM 627 CD GLN A 43 -14.746 -12.794 -8.997 1.00 1.58 C ATOM 628 OE1 GLN A 43 -15.016 -12.068 -9.941 1.00 2.49 O ATOM 629 NE2 GLN A 43 -15.525 -13.826 -8.692 1.00 2.48 N ATOM 0 H GLN A 43 -14.145 -9.094 -6.295 1.00 0.74 H new ATOM 0 HA GLN A 43 -13.503 -11.802 -5.638 1.00 0.84 H new ATOM 0 HB2 GLN A 43 -14.527 -10.627 -7.778 1.00 1.01 H new ATOM 0 HB3 GLN A 43 -12.847 -10.471 -8.250 1.00 1.01 H new ATOM 0 HG2 GLN A 43 -12.616 -12.719 -8.666 1.00 1.19 H new ATOM 0 HG3 GLN A 43 -13.541 -13.182 -7.251 1.00 1.19 H new ATOM 0 HE21 GLN A 43 -15.290 -14.426 -7.901 1.00 2.48 H new ATOM 0 HE22 GLN A 43 -16.358 -14.018 -9.249 1.00 2.48 H new ATOM 638 N ALA A 44 -10.975 -9.748 -6.028 1.00 0.71 N ATOM 639 CA ALA A 44 -9.574 -9.618 -5.650 1.00 0.68 C ATOM 640 C ALA A 44 -9.404 -9.958 -4.166 1.00 0.82 C ATOM 641 O ALA A 44 -8.525 -10.729 -3.788 1.00 1.00 O ATOM 642 CB ALA A 44 -9.082 -8.204 -5.956 1.00 0.64 C ATOM 0 H ALA A 44 -11.406 -8.883 -6.356 1.00 0.71 H new ATOM 0 HA ALA A 44 -8.972 -10.318 -6.230 1.00 0.68 H new ATOM 0 HB1 ALA A 44 -8.034 -8.114 -5.671 1.00 0.64 H new ATOM 0 HB2 ALA A 44 -9.186 -8.005 -7.023 1.00 0.64 H new ATOM 0 HB3 ALA A 44 -9.674 -7.483 -5.393 1.00 0.64 H new ATOM 648 N PHE A 45 -10.284 -9.423 -3.320 1.00 0.93 N ATOM 649 CA PHE A 45 -10.290 -9.695 -1.886 1.00 1.18 C ATOM 650 C PHE A 45 -10.779 -11.115 -1.559 1.00 1.23 C ATOM 651 O PHE A 45 -10.982 -11.445 -0.393 1.00 1.71 O ATOM 652 CB PHE A 45 -11.139 -8.627 -1.178 1.00 1.64 C ATOM 653 CG PHE A 45 -10.395 -7.331 -0.909 1.00 1.06 C ATOM 654 CD1 PHE A 45 -9.785 -6.611 -1.954 1.00 0.87 C ATOM 655 CD2 PHE A 45 -10.272 -6.867 0.413 1.00 1.01 C ATOM 656 CE1 PHE A 45 -9.036 -5.456 -1.676 1.00 0.96 C ATOM 657 CE2 PHE A 45 -9.535 -5.705 0.690 1.00 0.97 C ATOM 658 CZ PHE A 45 -8.912 -5.003 -0.352 1.00 1.10 C ATOM 0 H PHE A 45 -11.020 -8.782 -3.616 1.00 0.93 H new ATOM 0 HA PHE A 45 -9.264 -9.644 -1.520 1.00 1.18 H new ATOM 0 HB2 PHE A 45 -12.017 -8.411 -1.787 1.00 1.64 H new ATOM 0 HB3 PHE A 45 -11.499 -9.031 -0.232 1.00 1.64 H new ATOM 0 HD1 PHE A 45 -9.894 -6.949 -2.974 1.00 0.87 H new ATOM 0 HD2 PHE A 45 -10.747 -7.407 1.219 1.00 1.01 H new ATOM 0 HE1 PHE A 45 -8.556 -4.917 -2.479 1.00 0.96 H new ATOM 0 HE2 PHE A 45 -9.448 -5.351 1.707 1.00 0.97 H new ATOM 0 HZ PHE A 45 -8.337 -4.114 -0.137 1.00 1.10 H new ATOM 668 N ARG A 46 -10.952 -11.997 -2.549 1.00 0.96 N ATOM 669 CA ARG A 46 -11.348 -13.370 -2.279 1.00 1.17 C ATOM 670 C ARG A 46 -10.214 -14.139 -1.612 1.00 1.12 C ATOM 671 O ARG A 46 -10.479 -14.968 -0.747 1.00 2.14 O ATOM 672 CB ARG A 46 -11.823 -14.035 -3.573 1.00 1.34 C ATOM 673 CG ARG A 46 -12.466 -15.397 -3.296 1.00 1.85 C ATOM 674 CD ARG A 46 -13.640 -15.606 -4.260 1.00 2.28 C ATOM 675 NE ARG A 46 -14.305 -16.901 -4.055 1.00 2.70 N ATOM 676 CZ ARG A 46 -15.138 -17.204 -3.048 1.00 2.92 C ATOM 677 NH1 ARG A 46 -15.708 -18.408 -2.998 1.00 3.49 N ATOM 678 NH2 ARG A 46 -15.402 -16.309 -2.096 1.00 3.72 N ATOM 0 H ARG A 46 -10.823 -11.780 -3.537 1.00 0.96 H new ATOM 0 HA ARG A 46 -12.182 -13.376 -1.578 1.00 1.17 H new ATOM 0 HB2 ARG A 46 -12.541 -13.387 -4.075 1.00 1.34 H new ATOM 0 HB3 ARG A 46 -10.979 -14.160 -4.251 1.00 1.34 H new ATOM 0 HG2 ARG A 46 -11.731 -16.192 -3.422 1.00 1.85 H new ATOM 0 HG3 ARG A 46 -12.814 -15.445 -2.264 1.00 1.85 H new ATOM 0 HD2 ARG A 46 -14.365 -14.803 -4.127 1.00 2.28 H new ATOM 0 HD3 ARG A 46 -13.280 -15.543 -5.287 1.00 2.28 H new ATOM 0 HE ARG A 46 -14.116 -17.634 -4.739 1.00 2.70 H new ATOM 0 HH11 ARG A 46 -15.510 -19.096 -3.724 1.00 3.49 H new ATOM 0 HH12 ARG A 46 -16.342 -18.641 -2.233 1.00 3.49 H new ATOM 0 HH21 ARG A 46 -14.970 -15.386 -2.130 1.00 3.72 H new ATOM 0 HH22 ARG A 46 -16.037 -16.547 -1.334 1.00 3.72 H new ATOM 692 N ASN A 47 -8.963 -13.890 -2.011 1.00 1.93 N ATOM 693 CA ASN A 47 -7.814 -14.485 -1.339 1.00 1.96 C ATOM 694 C ASN A 47 -6.608 -13.560 -1.465 1.00 1.84 C ATOM 695 O ASN A 47 -5.602 -13.910 -2.077 1.00 2.33 O ATOM 696 CB ASN A 47 -7.498 -15.874 -1.909 1.00 2.49 C ATOM 697 CG ASN A 47 -6.429 -16.542 -1.049 1.00 3.65 C ATOM 698 OD1 ASN A 47 -6.553 -16.582 0.168 1.00 3.98 O ATOM 699 ND2 ASN A 47 -5.368 -17.067 -1.646 1.00 4.88 N ATOM 0 H ASN A 47 -8.725 -13.282 -2.794 1.00 1.93 H new ATOM 0 HA ASN A 47 -8.055 -14.611 -0.283 1.00 1.96 H new ATOM 0 HB2 ASN A 47 -8.400 -16.486 -1.928 1.00 2.49 H new ATOM 0 HB3 ASN A 47 -7.150 -15.787 -2.938 1.00 2.49 H new ATOM 0 HD21 ASN A 47 -4.639 -17.513 -1.090 1.00 4.88 H new ATOM 0 HD22 ASN A 47 -5.281 -17.025 -2.661 1.00 4.88 H new ATOM 706 N ALA A 48 -6.712 -12.361 -0.891 1.00 1.37 N ATOM 707 CA ALA A 48 -5.639 -11.377 -0.955 1.00 1.55 C ATOM 708 C ALA A 48 -4.724 -11.436 0.275 1.00 1.56 C ATOM 709 O ALA A 48 -3.820 -10.615 0.409 1.00 2.32 O ATOM 710 CB ALA A 48 -6.267 -9.994 -1.117 1.00 1.52 C ATOM 0 H ALA A 48 -7.535 -12.050 -0.374 1.00 1.37 H new ATOM 0 HA ALA A 48 -5.001 -11.599 -1.811 1.00 1.55 H new ATOM 0 HB1 ALA A 48 -5.481 -9.241 -1.167 1.00 1.52 H new ATOM 0 HB2 ALA A 48 -6.855 -9.967 -2.035 1.00 1.52 H new ATOM 0 HB3 ALA A 48 -6.914 -9.786 -0.265 1.00 1.52 H new ATOM 716 N ALA A 49 -4.972 -12.365 1.202 1.00 1.14 N ATOM 717 CA ALA A 49 -4.193 -12.485 2.420 1.00 1.13 C ATOM 718 C ALA A 49 -2.744 -12.817 2.104 1.00 0.99 C ATOM 719 O ALA A 49 -2.438 -13.555 1.163 1.00 1.01 O ATOM 720 CB ALA A 49 -4.814 -13.553 3.327 1.00 1.28 C ATOM 0 H ALA A 49 -5.721 -13.052 1.121 1.00 1.14 H new ATOM 0 HA ALA A 49 -4.206 -11.529 2.943 1.00 1.13 H new ATOM 0 HB1 ALA A 49 -4.226 -13.641 4.241 1.00 1.28 H new ATOM 0 HB2 ALA A 49 -5.836 -13.268 3.578 1.00 1.28 H new ATOM 0 HB3 ALA A 49 -4.822 -14.511 2.808 1.00 1.28 H new ATOM 726 N THR A 50 -1.832 -12.258 2.894 1.00 0.85 N ATOM 727 CA THR A 50 -0.426 -12.485 2.669 1.00 0.71 C ATOM 728 C THR A 50 0.356 -12.061 3.911 1.00 0.63 C ATOM 729 O THR A 50 -0.170 -11.300 4.725 1.00 0.65 O ATOM 730 CB THR A 50 -0.030 -11.762 1.370 1.00 0.65 C ATOM 731 OG1 THR A 50 0.585 -12.716 0.536 1.00 0.88 O ATOM 732 CG2 THR A 50 0.819 -10.502 1.537 1.00 0.57 C ATOM 0 H THR A 50 -2.048 -11.652 3.686 1.00 0.85 H new ATOM 0 HA THR A 50 -0.186 -13.538 2.524 1.00 0.71 H new ATOM 0 HB THR A 50 -0.940 -11.362 0.922 1.00 0.65 H new ATOM 0 HG1 THR A 50 -0.053 -13.432 0.332 1.00 0.88 H new ATOM 0 HG21 THR A 50 1.037 -10.078 0.557 1.00 0.57 H new ATOM 0 HG22 THR A 50 0.273 -9.772 2.135 1.00 0.57 H new ATOM 0 HG23 THR A 50 1.753 -10.756 2.038 1.00 0.57 H new ATOM 740 N PRO A 51 1.577 -12.581 4.093 1.00 0.60 N ATOM 741 CA PRO A 51 2.335 -12.368 5.305 1.00 0.54 C ATOM 742 C PRO A 51 2.821 -10.925 5.411 1.00 0.47 C ATOM 743 O PRO A 51 2.793 -10.150 4.455 1.00 0.57 O ATOM 744 CB PRO A 51 3.487 -13.376 5.255 1.00 0.60 C ATOM 745 CG PRO A 51 3.688 -13.627 3.763 1.00 0.63 C ATOM 746 CD PRO A 51 2.290 -13.448 3.172 1.00 0.68 C ATOM 0 HA PRO A 51 1.728 -12.524 6.197 1.00 0.54 H new ATOM 0 HB2 PRO A 51 4.389 -12.976 5.718 1.00 0.60 H new ATOM 0 HB3 PRO A 51 3.237 -14.295 5.785 1.00 0.60 H new ATOM 0 HG2 PRO A 51 4.398 -12.922 3.331 1.00 0.63 H new ATOM 0 HG3 PRO A 51 4.077 -14.628 3.574 1.00 0.63 H new ATOM 0 HD2 PRO A 51 2.340 -13.005 2.178 1.00 0.68 H new ATOM 0 HD3 PRO A 51 1.784 -14.408 3.068 1.00 0.68 H new ATOM 754 N VAL A 52 3.299 -10.566 6.598 1.00 0.37 N ATOM 755 CA VAL A 52 3.879 -9.256 6.839 1.00 0.36 C ATOM 756 C VAL A 52 5.114 -9.074 5.957 1.00 0.34 C ATOM 757 O VAL A 52 5.782 -10.047 5.614 1.00 0.35 O ATOM 758 CB VAL A 52 4.171 -9.125 8.350 1.00 0.44 C ATOM 759 CG1 VAL A 52 5.585 -8.657 8.709 1.00 1.48 C ATOM 760 CG2 VAL A 52 3.151 -8.157 8.947 1.00 1.07 C ATOM 0 H VAL A 52 3.294 -11.175 7.416 1.00 0.37 H new ATOM 0 HA VAL A 52 3.192 -8.454 6.569 1.00 0.36 H new ATOM 0 HB VAL A 52 4.093 -10.130 8.765 1.00 0.44 H new ATOM 0 HG11 VAL A 52 5.685 -8.599 9.793 1.00 1.48 H new ATOM 0 HG12 VAL A 52 6.314 -9.365 8.315 1.00 1.48 H new ATOM 0 HG13 VAL A 52 5.764 -7.673 8.275 1.00 1.48 H new ATOM 0 HG21 VAL A 52 3.336 -8.047 10.016 1.00 1.07 H new ATOM 0 HG22 VAL A 52 3.243 -7.186 8.461 1.00 1.07 H new ATOM 0 HG23 VAL A 52 2.145 -8.547 8.791 1.00 1.07 H new ATOM 770 N GLY A 53 5.414 -7.828 5.583 1.00 0.40 N ATOM 771 CA GLY A 53 6.634 -7.483 4.886 1.00 0.41 C ATOM 772 C GLY A 53 6.611 -7.946 3.439 1.00 0.43 C ATOM 773 O GLY A 53 7.666 -8.065 2.823 1.00 0.45 O ATOM 0 H GLY A 53 4.805 -7.030 5.762 1.00 0.40 H new ATOM 0 HA2 GLY A 53 6.778 -6.403 4.919 1.00 0.41 H new ATOM 0 HA3 GLY A 53 7.484 -7.934 5.398 1.00 0.41 H new ATOM 777 N THR A 54 5.430 -8.199 2.867 1.00 0.43 N ATOM 778 CA THR A 54 5.359 -8.659 1.490 1.00 0.43 C ATOM 779 C THR A 54 4.186 -7.984 0.781 1.00 0.37 C ATOM 780 O THR A 54 3.540 -7.096 1.345 1.00 0.37 O ATOM 781 CB THR A 54 5.305 -10.195 1.447 1.00 0.47 C ATOM 782 OG1 THR A 54 4.124 -10.672 2.031 1.00 0.73 O ATOM 783 CG2 THR A 54 6.480 -10.859 2.166 1.00 0.59 C ATOM 0 H THR A 54 4.528 -8.093 3.332 1.00 0.43 H new ATOM 0 HA THR A 54 6.259 -8.372 0.946 1.00 0.43 H new ATOM 0 HB THR A 54 5.351 -10.454 0.389 1.00 0.47 H new ATOM 0 HG1 THR A 54 4.018 -10.279 2.923 1.00 0.73 H new ATOM 0 HG21 THR A 54 6.382 -11.943 2.099 1.00 0.59 H new ATOM 0 HG22 THR A 54 7.415 -10.549 1.698 1.00 0.59 H new ATOM 0 HG23 THR A 54 6.482 -10.559 3.214 1.00 0.59 H new ATOM 791 N ALA A 55 3.938 -8.375 -0.470 1.00 0.35 N ATOM 792 CA ALA A 55 2.891 -7.823 -1.302 1.00 0.33 C ATOM 793 C ALA A 55 2.246 -8.978 -2.056 1.00 0.35 C ATOM 794 O ALA A 55 2.954 -9.879 -2.502 1.00 0.49 O ATOM 795 CB ALA A 55 3.479 -6.794 -2.276 1.00 0.37 C ATOM 0 H ALA A 55 4.479 -9.104 -0.936 1.00 0.35 H new ATOM 0 HA ALA A 55 2.144 -7.310 -0.696 1.00 0.33 H new ATOM 0 HB1 ALA A 55 2.683 -6.385 -2.897 1.00 0.37 H new ATOM 0 HB2 ALA A 55 3.950 -5.988 -1.713 1.00 0.37 H new ATOM 0 HB3 ALA A 55 4.222 -7.277 -2.910 1.00 0.37 H new ATOM 801 N LYS A 56 0.923 -8.953 -2.215 1.00 0.35 N ATOM 802 CA LYS A 56 0.206 -9.979 -2.954 1.00 0.40 C ATOM 803 C LYS A 56 -0.603 -9.330 -4.058 1.00 0.37 C ATOM 804 O LYS A 56 -1.563 -8.617 -3.773 1.00 0.40 O ATOM 805 CB LYS A 56 -0.719 -10.758 -2.013 1.00 0.52 C ATOM 806 CG LYS A 56 -1.465 -11.865 -2.771 1.00 0.63 C ATOM 807 CD LYS A 56 -0.996 -13.271 -2.380 1.00 1.24 C ATOM 808 CE LYS A 56 -1.158 -14.237 -3.558 1.00 1.64 C ATOM 809 NZ LYS A 56 -0.223 -13.919 -4.663 1.00 3.56 N ATOM 0 H LYS A 56 0.324 -8.221 -1.834 1.00 0.35 H new ATOM 0 HA LYS A 56 0.922 -10.675 -3.391 1.00 0.40 H new ATOM 0 HB2 LYS A 56 -0.135 -11.196 -1.203 1.00 0.52 H new ATOM 0 HB3 LYS A 56 -1.437 -10.077 -1.556 1.00 0.52 H new ATOM 0 HG2 LYS A 56 -2.534 -11.776 -2.576 1.00 0.63 H new ATOM 0 HG3 LYS A 56 -1.324 -11.724 -3.843 1.00 0.63 H new ATOM 0 HD2 LYS A 56 0.048 -13.239 -2.069 1.00 1.24 H new ATOM 0 HD3 LYS A 56 -1.572 -13.629 -1.527 1.00 1.24 H new ATOM 0 HE2 LYS A 56 -0.985 -15.258 -3.217 1.00 1.64 H new ATOM 0 HE3 LYS A 56 -2.183 -14.193 -3.925 1.00 1.64 H new ATOM 0 HZ1 LYS A 56 -0.059 -14.772 -5.235 1.00 3.56 H new ATOM 0 HZ2 LYS A 56 -0.633 -13.174 -5.261 1.00 3.56 H new ATOM 0 HZ3 LYS A 56 0.681 -13.588 -4.269 1.00 3.56 H new ATOM 823 N THR A 57 -0.282 -9.635 -5.309 1.00 0.38 N ATOM 824 CA THR A 57 -1.188 -9.290 -6.386 1.00 0.31 C ATOM 825 C THR A 57 -2.301 -10.331 -6.422 1.00 0.45 C ATOM 826 O THR A 57 -2.028 -11.528 -6.282 1.00 0.64 O ATOM 827 CB THR A 57 -0.444 -9.223 -7.722 1.00 0.46 C ATOM 828 OG1 THR A 57 0.636 -8.337 -7.586 1.00 0.68 O ATOM 829 CG2 THR A 57 -1.336 -8.681 -8.842 1.00 0.67 C ATOM 0 H THR A 57 0.576 -10.108 -5.594 1.00 0.38 H new ATOM 0 HA THR A 57 -1.617 -8.303 -6.214 1.00 0.31 H new ATOM 0 HB THR A 57 -0.123 -10.233 -7.977 1.00 0.46 H new ATOM 0 HG1 THR A 57 1.445 -8.840 -7.355 1.00 0.68 H new ATOM 0 HG21 THR A 57 -0.771 -8.649 -9.774 1.00 0.67 H new ATOM 0 HG22 THR A 57 -2.202 -9.332 -8.965 1.00 0.67 H new ATOM 0 HG23 THR A 57 -1.671 -7.676 -8.586 1.00 0.67 H new ATOM 837 N VAL A 58 -3.535 -9.879 -6.652 1.00 0.46 N ATOM 838 CA VAL A 58 -4.625 -10.718 -7.109 1.00 0.48 C ATOM 839 C VAL A 58 -5.175 -10.019 -8.346 1.00 0.44 C ATOM 840 O VAL A 58 -5.621 -8.878 -8.272 1.00 0.82 O ATOM 841 CB VAL A 58 -5.696 -10.897 -6.019 1.00 0.57 C ATOM 842 CG1 VAL A 58 -6.714 -11.953 -6.466 1.00 1.18 C ATOM 843 CG2 VAL A 58 -5.069 -11.355 -4.698 1.00 1.25 C ATOM 0 H VAL A 58 -3.801 -8.903 -6.521 1.00 0.46 H new ATOM 0 HA VAL A 58 -4.290 -11.729 -7.341 1.00 0.48 H new ATOM 0 HB VAL A 58 -6.184 -9.934 -5.867 1.00 0.57 H new ATOM 0 HG11 VAL A 58 -7.472 -12.078 -5.693 1.00 1.18 H new ATOM 0 HG12 VAL A 58 -7.190 -11.630 -7.392 1.00 1.18 H new ATOM 0 HG13 VAL A 58 -6.205 -12.902 -6.632 1.00 1.18 H new ATOM 0 HG21 VAL A 58 -5.850 -11.473 -3.946 1.00 1.25 H new ATOM 0 HG22 VAL A 58 -4.562 -12.308 -4.847 1.00 1.25 H new ATOM 0 HG23 VAL A 58 -4.349 -10.610 -4.359 1.00 1.25 H new ATOM 853 N LYS A 59 -5.102 -10.663 -9.508 1.00 0.53 N ATOM 854 CA LYS A 59 -5.717 -10.095 -10.698 1.00 0.58 C ATOM 855 C LYS A 59 -7.224 -10.115 -10.482 1.00 0.53 C ATOM 856 O LYS A 59 -7.774 -11.164 -10.151 1.00 0.64 O ATOM 857 CB LYS A 59 -5.315 -10.900 -11.939 1.00 0.77 C ATOM 858 CG LYS A 59 -3.896 -10.499 -12.362 1.00 1.10 C ATOM 859 CD LYS A 59 -3.296 -11.443 -13.408 1.00 1.67 C ATOM 860 CE LYS A 59 -4.183 -11.527 -14.655 1.00 1.36 C ATOM 861 NZ LYS A 59 -3.530 -12.286 -15.744 1.00 2.09 N ATOM 0 H LYS A 59 -4.634 -11.558 -9.648 1.00 0.53 H new ATOM 0 HA LYS A 59 -5.381 -9.071 -10.864 1.00 0.58 H new ATOM 0 HB2 LYS A 59 -5.355 -11.968 -11.723 1.00 0.77 H new ATOM 0 HB3 LYS A 59 -6.016 -10.712 -12.752 1.00 0.77 H new ATOM 0 HG2 LYS A 59 -3.915 -9.486 -12.763 1.00 1.10 H new ATOM 0 HG3 LYS A 59 -3.252 -10.482 -11.483 1.00 1.10 H new ATOM 0 HD2 LYS A 59 -2.302 -11.094 -13.689 1.00 1.67 H new ATOM 0 HD3 LYS A 59 -3.175 -12.437 -12.977 1.00 1.67 H new ATOM 0 HE2 LYS A 59 -5.129 -12.003 -14.397 1.00 1.36 H new ATOM 0 HE3 LYS A 59 -4.417 -10.521 -15.003 1.00 1.36 H new ATOM 0 HZ1 LYS A 59 -4.161 -12.321 -16.570 1.00 2.09 H new ATOM 0 HZ2 LYS A 59 -2.640 -11.818 -16.008 1.00 2.09 H new ATOM 0 HZ3 LYS A 59 -3.329 -13.254 -15.421 1.00 2.09 H new ATOM 875 N CYS A 60 -7.878 -8.963 -10.628 1.00 0.56 N ATOM 876 CA CYS A 60 -9.327 -8.929 -10.732 1.00 0.70 C ATOM 877 C CYS A 60 -9.673 -9.216 -12.197 1.00 1.03 C ATOM 878 O CYS A 60 -9.135 -10.162 -12.763 1.00 2.28 O ATOM 879 CB CYS A 60 -9.824 -7.576 -10.209 1.00 0.90 C ATOM 880 SG CYS A 60 -11.621 -7.594 -9.947 1.00 1.32 S ATOM 0 H CYS A 60 -7.427 -8.050 -10.676 1.00 0.56 H new ATOM 0 HA CYS A 60 -9.828 -9.682 -10.123 1.00 0.70 H new ATOM 0 HB2 CYS A 60 -9.320 -7.337 -9.273 1.00 0.90 H new ATOM 0 HB3 CYS A 60 -9.565 -6.791 -10.920 1.00 0.90 H new ATOM 0 HG CYS A 60 -11.954 -6.620 -9.153 1.00 1.32 H new ATOM 886 N ASP A 61 -10.532 -8.407 -12.822 1.00 0.68 N ATOM 887 CA ASP A 61 -10.849 -8.540 -14.238 1.00 0.70 C ATOM 888 C ASP A 61 -9.608 -8.210 -15.061 1.00 0.68 C ATOM 889 O ASP A 61 -8.964 -9.090 -15.628 1.00 0.82 O ATOM 890 CB ASP A 61 -12.004 -7.601 -14.614 1.00 0.80 C ATOM 891 CG ASP A 61 -13.348 -8.162 -14.166 1.00 1.02 C ATOM 892 OD1 ASP A 61 -13.713 -9.240 -14.682 1.00 1.78 O ATOM 893 OD2 ASP A 61 -13.975 -7.509 -13.305 1.00 1.85 O ATOM 0 H ASP A 61 -11.024 -7.644 -12.358 1.00 0.68 H new ATOM 0 HA ASP A 61 -11.160 -9.564 -14.447 1.00 0.70 H new ATOM 0 HB2 ASP A 61 -11.845 -6.625 -14.155 1.00 0.80 H new ATOM 0 HB3 ASP A 61 -12.014 -7.448 -15.693 1.00 0.80 H new ATOM 898 N GLU A 62 -9.261 -6.923 -15.126 1.00 0.63 N ATOM 899 CA GLU A 62 -8.215 -6.443 -16.018 1.00 0.70 C ATOM 900 C GLU A 62 -7.360 -5.396 -15.300 1.00 0.73 C ATOM 901 O GLU A 62 -6.800 -4.499 -15.922 1.00 1.27 O ATOM 902 CB GLU A 62 -8.871 -5.903 -17.302 1.00 0.80 C ATOM 903 CG GLU A 62 -8.023 -6.259 -18.530 1.00 1.49 C ATOM 904 CD GLU A 62 -8.598 -5.703 -19.835 1.00 1.57 C ATOM 905 OE1 GLU A 62 -7.824 -5.645 -20.816 1.00 2.42 O ATOM 906 OE2 GLU A 62 -9.802 -5.360 -19.850 1.00 1.68 O ATOM 0 H GLU A 62 -9.697 -6.192 -14.564 1.00 0.63 H new ATOM 0 HA GLU A 62 -7.543 -7.252 -16.302 1.00 0.70 H new ATOM 0 HB2 GLU A 62 -9.872 -6.322 -17.410 1.00 0.80 H new ATOM 0 HB3 GLU A 62 -8.984 -4.821 -17.232 1.00 0.80 H new ATOM 0 HG2 GLU A 62 -7.013 -5.874 -18.391 1.00 1.49 H new ATOM 0 HG3 GLU A 62 -7.943 -7.343 -18.607 1.00 1.49 H new ATOM 913 N THR A 63 -7.237 -5.517 -13.974 1.00 0.49 N ATOM 914 CA THR A 63 -6.375 -4.653 -13.181 1.00 0.44 C ATOM 915 C THR A 63 -5.545 -5.536 -12.266 1.00 0.34 C ATOM 916 O THR A 63 -5.994 -6.613 -11.851 1.00 0.43 O ATOM 917 CB THR A 63 -7.198 -3.607 -12.407 1.00 0.51 C ATOM 918 OG1 THR A 63 -6.422 -2.452 -12.203 1.00 0.75 O ATOM 919 CG2 THR A 63 -7.630 -4.067 -11.012 1.00 0.84 C ATOM 0 H THR A 63 -7.735 -6.219 -13.426 1.00 0.49 H new ATOM 0 HA THR A 63 -5.707 -4.082 -13.826 1.00 0.44 H new ATOM 0 HB THR A 63 -8.084 -3.432 -13.017 1.00 0.51 H new ATOM 0 HG1 THR A 63 -5.500 -2.622 -12.490 1.00 0.75 H new ATOM 0 HG21 THR A 63 -8.205 -3.276 -10.530 1.00 0.84 H new ATOM 0 HG22 THR A 63 -8.246 -4.962 -11.099 1.00 0.84 H new ATOM 0 HG23 THR A 63 -6.747 -4.290 -10.413 1.00 0.84 H new ATOM 927 N TYR A 64 -4.344 -5.071 -11.933 1.00 0.33 N ATOM 928 CA TYR A 64 -3.422 -5.833 -11.120 1.00 0.38 C ATOM 929 C TYR A 64 -3.393 -5.190 -9.740 1.00 0.37 C ATOM 930 O TYR A 64 -2.573 -4.319 -9.466 1.00 0.61 O ATOM 931 CB TYR A 64 -2.045 -5.846 -11.782 1.00 0.60 C ATOM 932 CG TYR A 64 -2.027 -6.289 -13.232 1.00 0.56 C ATOM 933 CD1 TYR A 64 -1.848 -7.645 -13.556 1.00 0.66 C ATOM 934 CD2 TYR A 64 -2.162 -5.332 -14.257 1.00 0.63 C ATOM 935 CE1 TYR A 64 -1.803 -8.047 -14.903 1.00 0.72 C ATOM 936 CE2 TYR A 64 -2.120 -5.726 -15.605 1.00 0.73 C ATOM 937 CZ TYR A 64 -1.941 -7.090 -15.932 1.00 0.73 C ATOM 938 OH TYR A 64 -1.899 -7.500 -17.231 1.00 0.90 O ATOM 0 H TYR A 64 -3.991 -4.159 -12.221 1.00 0.33 H new ATOM 0 HA TYR A 64 -3.735 -6.873 -11.021 1.00 0.38 H new ATOM 0 HB2 TYR A 64 -1.621 -4.844 -11.720 1.00 0.60 H new ATOM 0 HB3 TYR A 64 -1.391 -6.504 -11.210 1.00 0.60 H new ATOM 0 HD1 TYR A 64 -1.745 -8.379 -12.770 1.00 0.66 H new ATOM 0 HD2 TYR A 64 -2.298 -4.291 -14.005 1.00 0.63 H new ATOM 0 HE1 TYR A 64 -1.663 -9.089 -15.151 1.00 0.72 H new ATOM 0 HE2 TYR A 64 -2.224 -4.990 -16.388 1.00 0.73 H new ATOM 0 HH TYR A 64 -2.009 -6.726 -17.822 1.00 0.90 H new ATOM 948 N ILE A 65 -4.322 -5.572 -8.868 1.00 0.30 N ATOM 949 CA ILE A 65 -4.371 -4.978 -7.544 1.00 0.28 C ATOM 950 C ILE A 65 -3.406 -5.720 -6.630 1.00 0.29 C ATOM 951 O ILE A 65 -3.338 -6.946 -6.663 1.00 0.39 O ATOM 952 CB ILE A 65 -5.809 -4.917 -7.014 1.00 0.31 C ATOM 953 CG1 ILE A 65 -5.774 -4.640 -5.505 1.00 0.39 C ATOM 954 CG2 ILE A 65 -6.647 -6.170 -7.271 1.00 0.39 C ATOM 955 CD1 ILE A 65 -7.020 -3.911 -5.065 1.00 0.63 C ATOM 0 H ILE A 65 -5.036 -6.276 -9.052 1.00 0.30 H new ATOM 0 HA ILE A 65 -4.044 -3.939 -7.585 1.00 0.28 H new ATOM 0 HB ILE A 65 -6.296 -4.115 -7.569 1.00 0.31 H new ATOM 0 HG12 ILE A 65 -5.686 -5.580 -4.960 1.00 0.39 H new ATOM 0 HG13 ILE A 65 -4.894 -4.046 -5.260 1.00 0.39 H new ATOM 0 HG21 ILE A 65 -7.647 -6.030 -6.860 1.00 0.39 H new ATOM 0 HG22 ILE A 65 -6.718 -6.347 -8.344 1.00 0.39 H new ATOM 0 HG23 ILE A 65 -6.175 -7.028 -6.793 1.00 0.39 H new ATOM 0 HD11 ILE A 65 -6.973 -3.725 -3.992 1.00 0.63 H new ATOM 0 HD12 ILE A 65 -7.092 -2.961 -5.595 1.00 0.63 H new ATOM 0 HD13 ILE A 65 -7.896 -4.519 -5.290 1.00 0.63 H new ATOM 967 N ILE A 66 -2.667 -4.972 -5.812 1.00 0.25 N ATOM 968 CA ILE A 66 -1.587 -5.458 -4.976 1.00 0.27 C ATOM 969 C ILE A 66 -1.961 -5.129 -3.531 1.00 0.30 C ATOM 970 O ILE A 66 -2.534 -4.081 -3.256 1.00 0.51 O ATOM 971 CB ILE A 66 -0.267 -4.783 -5.400 1.00 0.27 C ATOM 972 CG1 ILE A 66 0.079 -4.978 -6.894 1.00 0.57 C ATOM 973 CG2 ILE A 66 0.888 -5.327 -4.550 1.00 0.38 C ATOM 974 CD1 ILE A 66 0.936 -3.829 -7.439 1.00 0.80 C ATOM 0 H ILE A 66 -2.817 -3.968 -5.715 1.00 0.25 H new ATOM 0 HA ILE A 66 -1.442 -6.533 -5.078 1.00 0.27 H new ATOM 0 HB ILE A 66 -0.408 -3.714 -5.240 1.00 0.27 H new ATOM 0 HG12 ILE A 66 0.611 -5.920 -7.023 1.00 0.57 H new ATOM 0 HG13 ILE A 66 -0.842 -5.050 -7.473 1.00 0.57 H new ATOM 0 HG21 ILE A 66 1.819 -4.848 -4.852 1.00 0.38 H new ATOM 0 HG22 ILE A 66 0.696 -5.116 -3.498 1.00 0.38 H new ATOM 0 HG23 ILE A 66 0.970 -6.404 -4.695 1.00 0.38 H new ATOM 0 HD11 ILE A 66 1.156 -4.007 -8.492 1.00 0.80 H new ATOM 0 HD12 ILE A 66 0.393 -2.889 -7.335 1.00 0.80 H new ATOM 0 HD13 ILE A 66 1.869 -3.773 -6.878 1.00 0.80 H new ATOM 986 N HIS A 67 -1.644 -6.011 -2.589 1.00 0.31 N ATOM 987 CA HIS A 67 -1.987 -5.874 -1.191 1.00 0.34 C ATOM 988 C HIS A 67 -0.675 -5.873 -0.426 1.00 0.34 C ATOM 989 O HIS A 67 -0.069 -6.930 -0.270 1.00 0.43 O ATOM 990 CB HIS A 67 -2.892 -7.051 -0.821 1.00 0.38 C ATOM 991 CG HIS A 67 -4.130 -7.100 -1.677 1.00 0.95 C ATOM 992 ND1 HIS A 67 -4.230 -7.739 -2.892 1.00 2.31 N ATOM 993 CD2 HIS A 67 -5.340 -6.517 -1.408 1.00 1.97 C ATOM 994 CE1 HIS A 67 -5.486 -7.564 -3.335 1.00 2.69 C ATOM 995 NE2 HIS A 67 -6.196 -6.820 -2.471 1.00 2.40 N ATOM 0 H HIS A 67 -1.125 -6.865 -2.791 1.00 0.31 H new ATOM 0 HA HIS A 67 -2.528 -4.957 -0.956 1.00 0.34 H new ATOM 0 HB2 HIS A 67 -2.338 -7.983 -0.931 1.00 0.38 H new ATOM 0 HB3 HIS A 67 -3.179 -6.972 0.228 1.00 0.38 H new ATOM 0 HD1 HIS A 67 -3.487 -8.251 -3.368 1.00 2.31 H new ATOM 0 HD2 HIS A 67 -5.587 -5.931 -0.535 1.00 1.97 H new ATOM 0 HE1 HIS A 67 -5.872 -7.967 -4.260 1.00 2.69 H new ATOM 0 HE2 HIS A 67 -7.169 -6.532 -2.571 1.00 2.40 H new ATOM 1003 N ALA A 68 -0.202 -4.701 -0.008 1.00 0.32 N ATOM 1004 CA ALA A 68 1.051 -4.585 0.722 1.00 0.31 C ATOM 1005 C ALA A 68 0.722 -4.672 2.206 1.00 0.36 C ATOM 1006 O ALA A 68 -0.237 -4.038 2.644 1.00 0.44 O ATOM 1007 CB ALA A 68 1.708 -3.239 0.396 1.00 0.33 C ATOM 0 H ALA A 68 -0.676 -3.812 -0.166 1.00 0.32 H new ATOM 0 HA ALA A 68 1.745 -5.378 0.444 1.00 0.31 H new ATOM 0 HB1 ALA A 68 2.647 -3.151 0.942 1.00 0.33 H new ATOM 0 HB2 ALA A 68 1.904 -3.180 -0.675 1.00 0.33 H new ATOM 0 HB3 ALA A 68 1.041 -2.428 0.688 1.00 0.33 H new ATOM 1013 N VAL A 69 1.498 -5.436 2.980 1.00 0.42 N ATOM 1014 CA VAL A 69 1.211 -5.638 4.395 1.00 0.46 C ATOM 1015 C VAL A 69 2.369 -5.112 5.218 1.00 0.37 C ATOM 1016 O VAL A 69 3.504 -5.566 5.072 1.00 0.31 O ATOM 1017 CB VAL A 69 0.961 -7.117 4.704 1.00 0.51 C ATOM 1018 CG1 VAL A 69 0.628 -7.304 6.191 1.00 0.93 C ATOM 1019 CG2 VAL A 69 -0.202 -7.658 3.874 1.00 0.74 C ATOM 0 H VAL A 69 2.330 -5.923 2.646 1.00 0.42 H new ATOM 0 HA VAL A 69 0.303 -5.092 4.652 1.00 0.46 H new ATOM 0 HB VAL A 69 1.870 -7.664 4.455 1.00 0.51 H new ATOM 0 HG11 VAL A 69 0.453 -8.360 6.395 1.00 0.93 H new ATOM 0 HG12 VAL A 69 1.462 -6.951 6.798 1.00 0.93 H new ATOM 0 HG13 VAL A 69 -0.268 -6.734 6.438 1.00 0.93 H new ATOM 0 HG21 VAL A 69 -0.360 -8.710 4.111 1.00 0.74 H new ATOM 0 HG22 VAL A 69 -1.106 -7.094 4.104 1.00 0.74 H new ATOM 0 HG23 VAL A 69 0.029 -7.556 2.814 1.00 0.74 H new ATOM 1029 N GLY A 70 2.065 -4.179 6.117 1.00 0.49 N ATOM 1030 CA GLY A 70 3.066 -3.569 6.970 1.00 0.56 C ATOM 1031 C GLY A 70 3.136 -4.314 8.301 1.00 0.51 C ATOM 1032 O GLY A 70 2.135 -4.880 8.742 1.00 0.49 O ATOM 0 H GLY A 70 1.119 -3.829 6.270 1.00 0.49 H new ATOM 0 HA2 GLY A 70 4.039 -3.592 6.478 1.00 0.56 H new ATOM 0 HA3 GLY A 70 2.821 -2.521 7.142 1.00 0.56 H new ATOM 1036 N PRO A 71 4.307 -4.314 8.946 1.00 0.55 N ATOM 1037 CA PRO A 71 4.543 -4.998 10.203 1.00 0.59 C ATOM 1038 C PRO A 71 3.861 -4.305 11.369 1.00 0.68 C ATOM 1039 O PRO A 71 3.387 -3.177 11.285 1.00 0.67 O ATOM 1040 CB PRO A 71 6.054 -5.003 10.403 1.00 0.62 C ATOM 1041 CG PRO A 71 6.492 -3.763 9.634 1.00 0.62 C ATOM 1042 CD PRO A 71 5.510 -3.663 8.478 1.00 0.58 C ATOM 0 HA PRO A 71 4.129 -6.006 10.168 1.00 0.59 H new ATOM 0 HB2 PRO A 71 6.324 -4.943 11.457 1.00 0.62 H new ATOM 0 HB3 PRO A 71 6.513 -5.909 10.007 1.00 0.62 H new ATOM 0 HG2 PRO A 71 6.456 -2.873 10.263 1.00 0.62 H new ATOM 0 HG3 PRO A 71 7.517 -3.860 9.276 1.00 0.62 H new ATOM 0 HD2 PRO A 71 5.318 -2.623 8.213 1.00 0.58 H new ATOM 0 HD3 PRO A 71 5.901 -4.152 7.586 1.00 0.58 H new ATOM 1050 N ASN A 72 3.863 -4.998 12.499 1.00 0.91 N ATOM 1051 CA ASN A 72 3.182 -4.598 13.709 1.00 0.98 C ATOM 1052 C ASN A 72 4.212 -4.066 14.695 1.00 0.85 C ATOM 1053 O ASN A 72 4.595 -4.768 15.619 1.00 0.88 O ATOM 1054 CB ASN A 72 2.384 -5.793 14.268 1.00 1.28 C ATOM 1055 CG ASN A 72 3.114 -7.137 14.230 1.00 2.59 C ATOM 1056 OD1 ASN A 72 4.332 -7.216 14.142 1.00 3.51 O ATOM 1057 ND2 ASN A 72 2.367 -8.232 14.197 1.00 3.25 N ATOM 0 H ASN A 72 4.358 -5.885 12.595 1.00 0.91 H new ATOM 0 HA ASN A 72 2.466 -3.800 13.512 1.00 0.98 H new ATOM 0 HB2 ASN A 72 2.110 -5.575 15.300 1.00 1.28 H new ATOM 0 HB3 ASN A 72 1.456 -5.885 13.704 1.00 1.28 H new ATOM 0 HD21 ASN A 72 2.807 -9.147 14.098 1.00 3.25 H new ATOM 0 HD22 ASN A 72 1.352 -8.160 14.271 1.00 3.25 H new ATOM 1064 N PHE A 73 4.625 -2.800 14.559 1.00 0.83 N ATOM 1065 CA PHE A 73 5.539 -2.145 15.507 1.00 0.84 C ATOM 1066 C PHE A 73 4.984 -2.161 16.940 1.00 0.86 C ATOM 1067 O PHE A 73 5.728 -2.116 17.909 1.00 1.00 O ATOM 1068 CB PHE A 73 5.857 -0.719 15.025 1.00 1.00 C ATOM 1069 CG PHE A 73 6.833 0.074 15.885 1.00 1.82 C ATOM 1070 CD1 PHE A 73 8.038 -0.505 16.330 1.00 2.06 C ATOM 1071 CD2 PHE A 73 6.551 1.411 16.234 1.00 3.35 C ATOM 1072 CE1 PHE A 73 8.924 0.237 17.131 1.00 3.24 C ATOM 1073 CE2 PHE A 73 7.453 2.162 17.005 1.00 4.63 C ATOM 1074 CZ PHE A 73 8.642 1.573 17.459 1.00 4.45 C ATOM 0 H PHE A 73 4.335 -2.199 13.788 1.00 0.83 H new ATOM 0 HA PHE A 73 6.470 -2.711 15.537 1.00 0.84 H new ATOM 0 HB2 PHE A 73 6.261 -0.780 14.014 1.00 1.00 H new ATOM 0 HB3 PHE A 73 4.923 -0.161 14.962 1.00 1.00 H new ATOM 0 HD1 PHE A 73 8.282 -1.521 16.055 1.00 2.06 H new ATOM 0 HD2 PHE A 73 5.628 1.864 15.904 1.00 3.35 H new ATOM 0 HE1 PHE A 73 9.829 -0.225 17.497 1.00 3.24 H new ATOM 0 HE2 PHE A 73 7.232 3.191 17.248 1.00 4.63 H new ATOM 0 HZ PHE A 73 9.337 2.144 18.057 1.00 4.45 H new ATOM 1084 N ASN A 74 3.666 -2.291 17.098 1.00 0.81 N ATOM 1085 CA ASN A 74 3.020 -2.395 18.407 1.00 0.87 C ATOM 1086 C ASN A 74 3.379 -3.701 19.127 1.00 0.98 C ATOM 1087 O ASN A 74 3.124 -3.842 20.319 1.00 1.12 O ATOM 1088 CB ASN A 74 1.498 -2.277 18.250 1.00 0.90 C ATOM 1089 CG ASN A 74 0.933 -3.401 17.391 1.00 2.56 C ATOM 1090 OD1 ASN A 74 0.741 -4.515 17.858 1.00 3.84 O ATOM 1091 ND2 ASN A 74 0.688 -3.160 16.110 1.00 4.04 N ATOM 0 H ASN A 74 3.012 -2.327 16.316 1.00 0.81 H new ATOM 0 HA ASN A 74 3.389 -1.574 19.022 1.00 0.87 H new ATOM 0 HB2 ASN A 74 1.028 -2.298 19.233 1.00 0.90 H new ATOM 0 HB3 ASN A 74 1.252 -1.315 17.800 1.00 0.90 H new ATOM 0 HD21 ASN A 74 0.338 -3.906 15.509 1.00 4.04 H new ATOM 0 HD22 ASN A 74 0.850 -2.229 15.726 1.00 4.04 H new ATOM 1098 N ASN A 75 3.951 -4.655 18.396 1.00 1.05 N ATOM 1099 CA ASN A 75 4.365 -5.972 18.838 1.00 1.30 C ATOM 1100 C ASN A 75 5.774 -6.296 18.317 1.00 1.31 C ATOM 1101 O ASN A 75 6.187 -7.448 18.412 1.00 1.50 O ATOM 1102 CB ASN A 75 3.341 -7.015 18.345 1.00 1.48 C ATOM 1103 CG ASN A 75 2.409 -7.465 19.461 1.00 1.53 C ATOM 1104 OD1 ASN A 75 2.692 -8.421 20.171 1.00 2.02 O ATOM 1105 ND2 ASN A 75 1.276 -6.802 19.633 1.00 2.53 N ATOM 0 H ASN A 75 4.149 -4.510 17.406 1.00 1.05 H new ATOM 0 HA ASN A 75 4.402 -5.996 19.927 1.00 1.30 H new ATOM 0 HB2 ASN A 75 2.754 -6.591 17.530 1.00 1.48 H new ATOM 0 HB3 ASN A 75 3.868 -7.879 17.941 1.00 1.48 H new ATOM 0 HD21 ASN A 75 0.625 -7.086 20.365 1.00 2.53 H new ATOM 0 HD22 ASN A 75 1.054 -6.007 19.033 1.00 2.53 H new ATOM 1112 N THR A 76 6.542 -5.328 17.791 1.00 1.17 N ATOM 1113 CA THR A 76 7.917 -5.638 17.400 1.00 1.20 C ATOM 1114 C THR A 76 8.845 -4.442 17.595 1.00 1.19 C ATOM 1115 O THR A 76 8.395 -3.326 17.839 1.00 1.35 O ATOM 1116 CB THR A 76 7.989 -6.224 15.978 1.00 1.12 C ATOM 1117 OG1 THR A 76 9.237 -6.870 15.849 1.00 1.29 O ATOM 1118 CG2 THR A 76 7.866 -5.198 14.843 1.00 0.91 C ATOM 0 H THR A 76 6.247 -4.365 17.633 1.00 1.17 H new ATOM 0 HA THR A 76 8.279 -6.418 18.070 1.00 1.20 H new ATOM 0 HB THR A 76 7.134 -6.892 15.873 1.00 1.12 H new ATOM 0 HG1 THR A 76 9.314 -7.257 14.952 1.00 1.29 H new ATOM 0 HG21 THR A 76 7.929 -5.709 13.882 1.00 0.91 H new ATOM 0 HG22 THR A 76 6.908 -4.684 14.919 1.00 0.91 H new ATOM 0 HG23 THR A 76 8.674 -4.471 14.921 1.00 0.91 H new ATOM 1126 N SER A 77 10.151 -4.688 17.517 1.00 1.21 N ATOM 1127 CA SER A 77 11.177 -3.680 17.716 1.00 1.25 C ATOM 1128 C SER A 77 11.206 -2.704 16.541 1.00 1.10 C ATOM 1129 O SER A 77 10.687 -3.000 15.468 1.00 0.95 O ATOM 1130 CB SER A 77 12.527 -4.386 17.843 1.00 1.35 C ATOM 1131 OG SER A 77 12.459 -5.356 18.869 1.00 1.66 O ATOM 0 H SER A 77 10.528 -5.613 17.309 1.00 1.21 H new ATOM 0 HA SER A 77 10.962 -3.111 18.621 1.00 1.25 H new ATOM 0 HB2 SER A 77 12.792 -4.860 16.898 1.00 1.35 H new ATOM 0 HB3 SER A 77 13.309 -3.660 18.066 1.00 1.35 H new ATOM 0 HG SER A 77 13.324 -5.809 18.949 1.00 1.66 H new ATOM 1137 N GLU A 78 11.858 -1.549 16.710 1.00 1.19 N ATOM 1138 CA GLU A 78 12.010 -0.601 15.611 1.00 1.10 C ATOM 1139 C GLU A 78 12.771 -1.250 14.458 1.00 0.95 C ATOM 1140 O GLU A 78 12.361 -1.114 13.315 1.00 0.73 O ATOM 1141 CB GLU A 78 12.609 0.730 16.099 1.00 1.23 C ATOM 1142 CG GLU A 78 13.983 0.643 16.782 1.00 2.31 C ATOM 1143 CD GLU A 78 15.153 0.673 15.798 1.00 3.51 C ATOM 1144 OE1 GLU A 78 15.365 1.740 15.184 1.00 4.05 O ATOM 1145 OE2 GLU A 78 15.819 -0.380 15.691 1.00 4.92 O ATOM 0 H GLU A 78 12.283 -1.254 17.589 1.00 1.19 H new ATOM 0 HA GLU A 78 11.028 -0.338 15.217 1.00 1.10 H new ATOM 0 HB2 GLU A 78 12.692 1.402 15.245 1.00 1.23 H new ATOM 0 HB3 GLU A 78 11.907 1.187 16.797 1.00 1.23 H new ATOM 0 HG2 GLU A 78 14.086 1.472 17.482 1.00 2.31 H new ATOM 0 HG3 GLU A 78 14.033 -0.276 17.366 1.00 2.31 H new ATOM 1152 N ALA A 79 13.820 -2.019 14.755 1.00 1.10 N ATOM 1153 CA ALA A 79 14.638 -2.705 13.768 1.00 1.03 C ATOM 1154 C ALA A 79 13.788 -3.555 12.828 1.00 0.91 C ATOM 1155 O ALA A 79 13.744 -3.316 11.624 1.00 0.82 O ATOM 1156 CB ALA A 79 15.652 -3.583 14.501 1.00 1.13 C ATOM 0 H ALA A 79 14.127 -2.182 15.714 1.00 1.10 H new ATOM 0 HA ALA A 79 15.152 -1.962 13.157 1.00 1.03 H new ATOM 0 HB1 ALA A 79 16.274 -4.105 13.774 1.00 1.13 H new ATOM 0 HB2 ALA A 79 16.281 -2.959 15.136 1.00 1.13 H new ATOM 0 HB3 ALA A 79 15.125 -4.312 15.117 1.00 1.13 H new ATOM 1162 N GLU A 80 13.132 -4.577 13.377 1.00 0.93 N ATOM 1163 CA GLU A 80 12.303 -5.494 12.610 1.00 0.85 C ATOM 1164 C GLU A 80 11.125 -4.751 11.999 1.00 0.70 C ATOM 1165 O GLU A 80 10.683 -5.086 10.906 1.00 0.61 O ATOM 1166 CB GLU A 80 11.803 -6.622 13.516 1.00 1.00 C ATOM 1167 CG GLU A 80 12.963 -7.522 13.947 1.00 1.34 C ATOM 1168 CD GLU A 80 12.491 -8.565 14.958 1.00 1.58 C ATOM 1169 OE1 GLU A 80 11.973 -9.610 14.507 1.00 2.07 O ATOM 1170 OE2 GLU A 80 12.651 -8.287 16.169 1.00 2.83 O ATOM 0 H GLU A 80 13.164 -4.790 14.374 1.00 0.93 H new ATOM 0 HA GLU A 80 12.899 -5.923 11.805 1.00 0.85 H new ATOM 0 HB2 GLU A 80 11.317 -6.200 14.396 1.00 1.00 H new ATOM 0 HB3 GLU A 80 11.053 -7.213 12.990 1.00 1.00 H new ATOM 0 HG2 GLU A 80 13.387 -8.020 13.075 1.00 1.34 H new ATOM 0 HG3 GLU A 80 13.756 -6.916 14.385 1.00 1.34 H new ATOM 1177 N GLY A 81 10.616 -3.733 12.689 1.00 0.70 N ATOM 1178 CA GLY A 81 9.426 -3.020 12.262 1.00 0.62 C ATOM 1179 C GLY A 81 9.716 -2.261 10.978 1.00 0.47 C ATOM 1180 O GLY A 81 8.910 -2.231 10.057 1.00 0.43 O ATOM 0 H GLY A 81 11.020 -3.383 13.558 1.00 0.70 H new ATOM 0 HA2 GLY A 81 8.607 -3.722 12.104 1.00 0.62 H new ATOM 0 HA3 GLY A 81 9.106 -2.328 13.041 1.00 0.62 H new ATOM 1184 N ASP A 82 10.876 -1.632 10.902 1.00 0.54 N ATOM 1185 CA ASP A 82 11.225 -0.815 9.756 1.00 0.49 C ATOM 1186 C ASP A 82 11.861 -1.667 8.660 1.00 0.52 C ATOM 1187 O ASP A 82 11.723 -1.347 7.480 1.00 0.62 O ATOM 1188 CB ASP A 82 12.069 0.379 10.200 1.00 0.66 C ATOM 1189 CG ASP A 82 11.170 1.564 10.575 1.00 1.23 C ATOM 1190 OD1 ASP A 82 10.010 1.348 11.007 1.00 2.43 O ATOM 1191 OD2 ASP A 82 11.611 2.712 10.367 1.00 2.08 O ATOM 0 H ASP A 82 11.594 -1.673 11.625 1.00 0.54 H new ATOM 0 HA ASP A 82 10.325 -0.395 9.307 1.00 0.49 H new ATOM 0 HB2 ASP A 82 12.685 0.098 11.054 1.00 0.66 H new ATOM 0 HB3 ASP A 82 12.748 0.670 9.398 1.00 0.66 H new ATOM 1196 N ARG A 83 12.498 -2.791 9.011 1.00 0.50 N ATOM 1197 CA ARG A 83 12.897 -3.785 8.018 1.00 0.47 C ATOM 1198 C ARG A 83 11.663 -4.261 7.268 1.00 0.38 C ATOM 1199 O ARG A 83 11.610 -4.131 6.051 1.00 0.35 O ATOM 1200 CB ARG A 83 13.620 -4.985 8.654 1.00 0.52 C ATOM 1201 CG ARG A 83 15.114 -5.018 8.322 1.00 1.09 C ATOM 1202 CD ARG A 83 15.895 -3.865 8.968 1.00 3.00 C ATOM 1203 NE ARG A 83 16.248 -2.803 8.012 1.00 4.50 N ATOM 1204 CZ ARG A 83 17.225 -2.882 7.099 1.00 5.53 C ATOM 1205 NH1 ARG A 83 17.555 -1.814 6.373 1.00 7.07 N ATOM 1206 NH2 ARG A 83 17.876 -4.033 6.912 1.00 5.54 N ATOM 0 H ARG A 83 12.745 -3.030 9.971 1.00 0.50 H new ATOM 0 HA ARG A 83 13.600 -3.313 7.332 1.00 0.47 H new ATOM 0 HB2 ARG A 83 13.493 -4.949 9.736 1.00 0.52 H new ATOM 0 HB3 ARG A 83 13.155 -5.909 8.309 1.00 0.52 H new ATOM 0 HG2 ARG A 83 15.534 -5.967 8.656 1.00 1.09 H new ATOM 0 HG3 ARG A 83 15.242 -4.976 7.240 1.00 1.09 H new ATOM 0 HD2 ARG A 83 15.300 -3.437 9.774 1.00 3.00 H new ATOM 0 HD3 ARG A 83 16.806 -4.258 9.419 1.00 3.00 H new ATOM 0 HE ARG A 83 15.706 -1.939 8.047 1.00 4.50 H new ATOM 0 HH11 ARG A 83 17.063 -0.931 6.511 1.00 7.07 H new ATOM 0 HH12 ARG A 83 18.300 -1.879 5.679 1.00 7.07 H new ATOM 0 HH21 ARG A 83 17.630 -4.854 7.465 1.00 5.54 H new ATOM 0 HH22 ARG A 83 18.620 -4.091 6.216 1.00 5.54 H new ATOM 1220 N ASP A 84 10.683 -4.824 7.972 1.00 0.41 N ATOM 1221 CA ASP A 84 9.503 -5.388 7.333 1.00 0.38 C ATOM 1222 C ASP A 84 8.683 -4.299 6.656 1.00 0.36 C ATOM 1223 O ASP A 84 8.049 -4.556 5.641 1.00 0.34 O ATOM 1224 CB ASP A 84 8.629 -6.175 8.318 1.00 0.43 C ATOM 1225 CG ASP A 84 8.929 -7.671 8.333 1.00 0.53 C ATOM 1226 OD1 ASP A 84 9.303 -8.192 7.259 1.00 2.00 O ATOM 1227 OD2 ASP A 84 8.733 -8.278 9.407 1.00 1.66 O ATOM 0 H ASP A 84 10.686 -4.900 8.989 1.00 0.41 H new ATOM 0 HA ASP A 84 9.857 -6.089 6.577 1.00 0.38 H new ATOM 0 HB2 ASP A 84 8.773 -5.773 9.321 1.00 0.43 H new ATOM 0 HB3 ASP A 84 7.580 -6.025 8.062 1.00 0.43 H new ATOM 1232 N LEU A 85 8.675 -3.068 7.166 1.00 0.38 N ATOM 1233 CA LEU A 85 7.995 -1.983 6.482 1.00 0.36 C ATOM 1234 C LEU A 85 8.654 -1.740 5.123 1.00 0.31 C ATOM 1235 O LEU A 85 7.974 -1.608 4.105 1.00 0.31 O ATOM 1236 CB LEU A 85 8.021 -0.755 7.394 1.00 0.38 C ATOM 1237 CG LEU A 85 7.222 0.433 6.866 1.00 0.37 C ATOM 1238 CD1 LEU A 85 5.803 0.013 6.477 1.00 0.46 C ATOM 1239 CD2 LEU A 85 7.151 1.488 7.972 1.00 0.43 C ATOM 0 H LEU A 85 9.128 -2.805 8.041 1.00 0.38 H new ATOM 0 HA LEU A 85 6.952 -2.227 6.278 1.00 0.36 H new ATOM 0 HB2 LEU A 85 7.631 -1.035 8.373 1.00 0.38 H new ATOM 0 HB3 LEU A 85 9.056 -0.446 7.540 1.00 0.38 H new ATOM 0 HG LEU A 85 7.713 0.830 5.977 1.00 0.37 H new ATOM 0 HD11 LEU A 85 5.256 0.879 6.104 1.00 0.46 H new ATOM 0 HD12 LEU A 85 5.849 -0.749 5.699 1.00 0.46 H new ATOM 0 HD13 LEU A 85 5.291 -0.391 7.350 1.00 0.46 H new ATOM 0 HD21 LEU A 85 6.584 2.349 7.618 1.00 0.43 H new ATOM 0 HD22 LEU A 85 6.659 1.065 8.848 1.00 0.43 H new ATOM 0 HD23 LEU A 85 8.160 1.803 8.239 1.00 0.43 H new ATOM 1251 N ALA A 86 9.988 -1.734 5.085 1.00 0.29 N ATOM 1252 CA ALA A 86 10.725 -1.611 3.840 1.00 0.25 C ATOM 1253 C ALA A 86 10.498 -2.840 2.964 1.00 0.24 C ATOM 1254 O ALA A 86 10.506 -2.726 1.744 1.00 0.29 O ATOM 1255 CB ALA A 86 12.214 -1.404 4.126 1.00 0.27 C ATOM 0 H ALA A 86 10.578 -1.814 5.913 1.00 0.29 H new ATOM 0 HA ALA A 86 10.359 -0.740 3.297 1.00 0.25 H new ATOM 0 HB1 ALA A 86 12.756 -1.313 3.185 1.00 0.27 H new ATOM 0 HB2 ALA A 86 12.349 -0.495 4.712 1.00 0.27 H new ATOM 0 HB3 ALA A 86 12.599 -2.257 4.686 1.00 0.27 H new ATOM 1261 N ALA A 87 10.301 -4.013 3.567 1.00 0.23 N ATOM 1262 CA ALA A 87 10.060 -5.263 2.871 1.00 0.25 C ATOM 1263 C ALA A 87 8.731 -5.194 2.133 1.00 0.24 C ATOM 1264 O ALA A 87 8.657 -5.564 0.967 1.00 0.25 O ATOM 1265 CB ALA A 87 10.072 -6.419 3.872 1.00 0.27 C ATOM 0 H ALA A 87 10.306 -4.115 4.582 1.00 0.23 H new ATOM 0 HA ALA A 87 10.849 -5.433 2.138 1.00 0.25 H new ATOM 0 HB1 ALA A 87 9.891 -7.357 3.347 1.00 0.27 H new ATOM 0 HB2 ALA A 87 11.042 -6.462 4.367 1.00 0.27 H new ATOM 0 HB3 ALA A 87 9.291 -6.263 4.617 1.00 0.27 H new ATOM 1271 N ALA A 88 7.695 -4.669 2.790 1.00 0.25 N ATOM 1272 CA ALA A 88 6.388 -4.458 2.201 1.00 0.27 C ATOM 1273 C ALA A 88 6.552 -3.591 0.964 1.00 0.27 C ATOM 1274 O ALA A 88 6.153 -3.989 -0.130 1.00 0.27 O ATOM 1275 CB ALA A 88 5.455 -3.804 3.225 1.00 0.33 C ATOM 0 H ALA A 88 7.751 -4.376 3.765 1.00 0.25 H new ATOM 0 HA ALA A 88 5.941 -5.408 1.910 1.00 0.27 H new ATOM 0 HB1 ALA A 88 4.474 -3.648 2.776 1.00 0.33 H new ATOM 0 HB2 ALA A 88 5.357 -4.454 4.095 1.00 0.33 H new ATOM 0 HB3 ALA A 88 5.869 -2.844 3.534 1.00 0.33 H new ATOM 1281 N TYR A 89 7.173 -2.418 1.123 1.00 0.31 N ATOM 1282 CA TYR A 89 7.367 -1.505 0.013 1.00 0.35 C ATOM 1283 C TYR A 89 8.217 -2.126 -1.104 1.00 0.34 C ATOM 1284 O TYR A 89 7.985 -1.870 -2.284 1.00 0.44 O ATOM 1285 CB TYR A 89 7.971 -0.208 0.532 1.00 0.38 C ATOM 1286 CG TYR A 89 7.158 0.499 1.608 1.00 0.53 C ATOM 1287 CD1 TYR A 89 5.750 0.593 1.537 1.00 0.80 C ATOM 1288 CD2 TYR A 89 7.834 1.123 2.666 1.00 0.63 C ATOM 1289 CE1 TYR A 89 5.031 1.297 2.522 1.00 1.11 C ATOM 1290 CE2 TYR A 89 7.130 1.869 3.625 1.00 0.82 C ATOM 1291 CZ TYR A 89 5.725 1.945 3.573 1.00 1.07 C ATOM 1292 OH TYR A 89 5.086 2.692 4.517 1.00 1.42 O ATOM 0 H TYR A 89 7.547 -2.087 2.012 1.00 0.31 H new ATOM 0 HA TYR A 89 6.398 -1.289 -0.436 1.00 0.35 H new ATOM 0 HB2 TYR A 89 8.963 -0.421 0.930 1.00 0.38 H new ATOM 0 HB3 TYR A 89 8.104 0.474 -0.308 1.00 0.38 H new ATOM 0 HD1 TYR A 89 5.222 0.122 0.722 1.00 0.80 H new ATOM 0 HD2 TYR A 89 8.907 1.029 2.744 1.00 0.63 H new ATOM 0 HE1 TYR A 89 3.953 1.343 2.476 1.00 1.11 H new ATOM 0 HE2 TYR A 89 7.668 2.386 4.405 1.00 0.82 H new ATOM 0 HH TYR A 89 5.743 3.050 5.150 1.00 1.42 H new ATOM 1302 N ARG A 90 9.201 -2.953 -0.755 1.00 0.30 N ATOM 1303 CA ARG A 90 10.064 -3.624 -1.719 1.00 0.34 C ATOM 1304 C ARG A 90 9.280 -4.654 -2.514 1.00 0.29 C ATOM 1305 O ARG A 90 9.517 -4.824 -3.707 1.00 0.33 O ATOM 1306 CB ARG A 90 11.243 -4.266 -0.982 1.00 0.44 C ATOM 1307 CG ARG A 90 12.261 -4.845 -1.967 1.00 0.58 C ATOM 1308 CD ARG A 90 13.533 -5.258 -1.221 1.00 1.29 C ATOM 1309 NE ARG A 90 14.704 -5.195 -2.107 1.00 1.19 N ATOM 1310 CZ ARG A 90 15.974 -5.123 -1.693 1.00 1.59 C ATOM 1311 NH1 ARG A 90 16.948 -4.882 -2.571 1.00 2.30 N ATOM 1312 NH2 ARG A 90 16.266 -5.286 -0.402 1.00 2.00 N ATOM 0 H ARG A 90 9.422 -3.177 0.215 1.00 0.30 H new ATOM 0 HA ARG A 90 10.452 -2.894 -2.429 1.00 0.34 H new ATOM 0 HB2 ARG A 90 11.728 -3.523 -0.349 1.00 0.44 H new ATOM 0 HB3 ARG A 90 10.878 -5.056 -0.325 1.00 0.44 H new ATOM 0 HG2 ARG A 90 11.834 -5.707 -2.480 1.00 0.58 H new ATOM 0 HG3 ARG A 90 12.501 -4.106 -2.731 1.00 0.58 H new ATOM 0 HD2 ARG A 90 13.685 -4.603 -0.363 1.00 1.29 H new ATOM 0 HD3 ARG A 90 13.419 -6.270 -0.833 1.00 1.29 H new ATOM 0 HE ARG A 90 14.536 -5.207 -3.113 1.00 1.19 H new ATOM 0 HH11 ARG A 90 16.725 -4.753 -3.558 1.00 2.30 H new ATOM 0 HH12 ARG A 90 17.917 -4.827 -2.256 1.00 2.30 H new ATOM 0 HH21 ARG A 90 15.521 -5.466 0.271 1.00 2.00 H new ATOM 0 HH22 ARG A 90 17.235 -5.231 -0.087 1.00 2.00 H new ATOM 1326 N ALA A 91 8.369 -5.365 -1.861 1.00 0.27 N ATOM 1327 CA ALA A 91 7.584 -6.395 -2.502 1.00 0.28 C ATOM 1328 C ALA A 91 6.645 -5.746 -3.507 1.00 0.28 C ATOM 1329 O ALA A 91 6.597 -6.175 -4.653 1.00 0.31 O ATOM 1330 CB ALA A 91 6.839 -7.205 -1.444 1.00 0.28 C ATOM 0 H ALA A 91 8.159 -5.238 -0.871 1.00 0.27 H new ATOM 0 HA ALA A 91 8.225 -7.090 -3.045 1.00 0.28 H new ATOM 0 HB1 ALA A 91 6.248 -7.981 -1.930 1.00 0.28 H new ATOM 0 HB2 ALA A 91 7.557 -7.667 -0.767 1.00 0.28 H new ATOM 0 HB3 ALA A 91 6.179 -6.546 -0.879 1.00 0.28 H new ATOM 1336 N VAL A 92 5.912 -4.701 -3.111 1.00 0.32 N ATOM 1337 CA VAL A 92 5.018 -4.023 -4.043 1.00 0.36 C ATOM 1338 C VAL A 92 5.815 -3.483 -5.222 1.00 0.33 C ATOM 1339 O VAL A 92 5.421 -3.701 -6.362 1.00 0.33 O ATOM 1340 CB VAL A 92 4.155 -2.954 -3.355 1.00 0.58 C ATOM 1341 CG1 VAL A 92 4.937 -1.913 -2.562 1.00 2.31 C ATOM 1342 CG2 VAL A 92 3.325 -2.184 -4.371 1.00 2.24 C ATOM 0 H VAL A 92 5.921 -4.314 -2.167 1.00 0.32 H new ATOM 0 HA VAL A 92 4.304 -4.750 -4.431 1.00 0.36 H new ATOM 0 HB VAL A 92 3.540 -3.528 -2.662 1.00 0.58 H new ATOM 0 HG11 VAL A 92 4.244 -1.201 -2.113 1.00 2.31 H new ATOM 0 HG12 VAL A 92 5.508 -2.408 -1.777 1.00 2.31 H new ATOM 0 HG13 VAL A 92 5.619 -1.384 -3.228 1.00 2.31 H new ATOM 0 HG21 VAL A 92 2.724 -1.434 -3.857 1.00 2.24 H new ATOM 0 HG22 VAL A 92 3.987 -1.692 -5.084 1.00 2.24 H new ATOM 0 HG23 VAL A 92 2.668 -2.873 -4.902 1.00 2.24 H new ATOM 1352 N ALA A 93 6.942 -2.816 -4.963 1.00 0.39 N ATOM 1353 CA ALA A 93 7.833 -2.328 -5.999 1.00 0.39 C ATOM 1354 C ALA A 93 8.146 -3.442 -7.000 1.00 0.36 C ATOM 1355 O ALA A 93 8.006 -3.249 -8.205 1.00 0.44 O ATOM 1356 CB ALA A 93 9.109 -1.774 -5.370 1.00 0.42 C ATOM 0 H ALA A 93 7.258 -2.601 -4.017 1.00 0.39 H new ATOM 0 HA ALA A 93 7.342 -1.520 -6.542 1.00 0.39 H new ATOM 0 HB1 ALA A 93 9.773 -1.410 -6.154 1.00 0.42 H new ATOM 0 HB2 ALA A 93 8.857 -0.954 -4.698 1.00 0.42 H new ATOM 0 HB3 ALA A 93 9.610 -2.563 -4.808 1.00 0.42 H new ATOM 1362 N ALA A 94 8.530 -4.621 -6.509 1.00 0.32 N ATOM 1363 CA ALA A 94 8.780 -5.746 -7.389 1.00 0.30 C ATOM 1364 C ALA A 94 7.550 -6.033 -8.240 1.00 0.32 C ATOM 1365 O ALA A 94 7.679 -6.161 -9.452 1.00 0.36 O ATOM 1366 CB ALA A 94 9.198 -6.984 -6.603 1.00 0.31 C ATOM 0 H ALA A 94 8.671 -4.814 -5.517 1.00 0.32 H new ATOM 0 HA ALA A 94 9.607 -5.483 -8.049 1.00 0.30 H new ATOM 0 HB1 ALA A 94 9.378 -7.809 -7.292 1.00 0.31 H new ATOM 0 HB2 ALA A 94 10.111 -6.771 -6.046 1.00 0.31 H new ATOM 0 HB3 ALA A 94 8.405 -7.258 -5.908 1.00 0.31 H new ATOM 1372 N GLU A 95 6.359 -6.125 -7.640 1.00 0.33 N ATOM 1373 CA GLU A 95 5.137 -6.385 -8.383 1.00 0.34 C ATOM 1374 C GLU A 95 4.917 -5.360 -9.497 1.00 0.31 C ATOM 1375 O GLU A 95 4.350 -5.709 -10.521 1.00 0.33 O ATOM 1376 CB GLU A 95 3.913 -6.494 -7.458 1.00 0.37 C ATOM 1377 CG GLU A 95 4.003 -7.648 -6.446 1.00 0.81 C ATOM 1378 CD GLU A 95 4.012 -9.038 -7.095 1.00 0.87 C ATOM 1379 OE1 GLU A 95 2.991 -9.749 -6.924 1.00 1.74 O ATOM 1380 OE2 GLU A 95 5.024 -9.377 -7.750 1.00 1.55 O ATOM 0 H GLU A 95 6.222 -6.021 -6.635 1.00 0.33 H new ATOM 0 HA GLU A 95 5.260 -7.356 -8.863 1.00 0.34 H new ATOM 0 HB2 GLU A 95 3.794 -5.556 -6.916 1.00 0.37 H new ATOM 0 HB3 GLU A 95 3.019 -6.626 -8.067 1.00 0.37 H new ATOM 0 HG2 GLU A 95 4.909 -7.528 -5.852 1.00 0.81 H new ATOM 0 HG3 GLU A 95 3.160 -7.583 -5.758 1.00 0.81 H new ATOM 1387 N ILE A 96 5.384 -4.118 -9.387 1.00 0.31 N ATOM 1388 CA ILE A 96 5.215 -3.137 -10.451 1.00 0.31 C ATOM 1389 C ILE A 96 5.914 -3.630 -11.714 1.00 0.32 C ATOM 1390 O ILE A 96 5.310 -3.705 -12.788 1.00 0.36 O ATOM 1391 CB ILE A 96 5.791 -1.793 -9.997 1.00 0.33 C ATOM 1392 CG1 ILE A 96 5.322 -1.396 -8.596 1.00 0.42 C ATOM 1393 CG2 ILE A 96 5.444 -0.681 -10.971 1.00 0.40 C ATOM 1394 CD1 ILE A 96 3.867 -1.691 -8.252 1.00 1.91 C ATOM 0 H ILE A 96 5.883 -3.769 -8.569 1.00 0.31 H new ATOM 0 HA ILE A 96 4.156 -3.005 -10.672 1.00 0.31 H new ATOM 0 HB ILE A 96 6.872 -1.928 -9.971 1.00 0.33 H new ATOM 0 HG12 ILE A 96 5.954 -1.906 -7.869 1.00 0.42 H new ATOM 0 HG13 ILE A 96 5.491 -0.326 -8.471 1.00 0.42 H new ATOM 0 HG21 ILE A 96 5.869 0.258 -10.617 1.00 0.40 H new ATOM 0 HG22 ILE A 96 5.853 -0.917 -11.953 1.00 0.40 H new ATOM 0 HG23 ILE A 96 4.361 -0.585 -11.043 1.00 0.40 H new ATOM 0 HD11 ILE A 96 3.660 -1.363 -7.233 1.00 1.91 H new ATOM 0 HD12 ILE A 96 3.214 -1.159 -8.944 1.00 1.91 H new ATOM 0 HD13 ILE A 96 3.684 -2.763 -8.332 1.00 1.91 H new ATOM 1406 N ASN A 97 7.200 -3.978 -11.598 1.00 0.32 N ATOM 1407 CA ASN A 97 7.901 -4.504 -12.761 1.00 0.40 C ATOM 1408 C ASN A 97 7.397 -5.909 -13.092 1.00 0.46 C ATOM 1409 O ASN A 97 7.473 -6.337 -14.241 1.00 0.66 O ATOM 1410 CB ASN A 97 9.425 -4.463 -12.573 1.00 0.52 C ATOM 1411 CG ASN A 97 9.915 -5.315 -11.412 1.00 2.16 C ATOM 1412 OD1 ASN A 97 10.204 -4.801 -10.340 1.00 3.84 O ATOM 1413 ND2 ASN A 97 10.021 -6.624 -11.597 1.00 2.66 N ATOM 0 H ASN A 97 7.754 -3.907 -10.744 1.00 0.32 H new ATOM 0 HA ASN A 97 7.682 -3.861 -13.614 1.00 0.40 H new ATOM 0 HB2 ASN A 97 9.906 -4.802 -13.491 1.00 0.52 H new ATOM 0 HB3 ASN A 97 9.736 -3.431 -12.413 1.00 0.52 H new ATOM 0 HD21 ASN A 97 10.348 -7.221 -10.838 1.00 2.66 H new ATOM 0 HD22 ASN A 97 9.775 -7.033 -12.498 1.00 2.66 H new ATOM 1420 N ARG A 98 6.878 -6.648 -12.109 1.00 0.42 N ATOM 1421 CA ARG A 98 6.509 -8.050 -12.304 1.00 0.48 C ATOM 1422 C ARG A 98 5.294 -8.151 -13.213 1.00 0.52 C ATOM 1423 O ARG A 98 5.268 -8.931 -14.159 1.00 0.59 O ATOM 1424 CB ARG A 98 6.226 -8.724 -10.951 1.00 0.51 C ATOM 1425 CG ARG A 98 6.553 -10.220 -10.985 1.00 0.69 C ATOM 1426 CD ARG A 98 7.558 -10.536 -9.873 1.00 1.65 C ATOM 1427 NE ARG A 98 8.301 -11.772 -10.149 1.00 2.10 N ATOM 1428 CZ ARG A 98 9.359 -12.177 -9.440 1.00 3.02 C ATOM 1429 NH1 ARG A 98 10.100 -13.201 -9.867 1.00 3.50 N ATOM 1430 NH2 ARG A 98 9.679 -11.543 -8.311 1.00 4.08 N ATOM 0 H ARG A 98 6.704 -6.297 -11.167 1.00 0.42 H new ATOM 0 HA ARG A 98 7.343 -8.568 -12.778 1.00 0.48 H new ATOM 0 HB2 ARG A 98 6.816 -8.240 -10.173 1.00 0.51 H new ATOM 0 HB3 ARG A 98 5.177 -8.586 -10.688 1.00 0.51 H new ATOM 0 HG2 ARG A 98 5.645 -10.807 -10.850 1.00 0.69 H new ATOM 0 HG3 ARG A 98 6.967 -10.493 -11.956 1.00 0.69 H new ATOM 0 HD2 ARG A 98 8.257 -9.707 -9.768 1.00 1.65 H new ATOM 0 HD3 ARG A 98 7.032 -10.632 -8.923 1.00 1.65 H new ATOM 0 HE ARG A 98 7.992 -12.355 -10.927 1.00 2.10 H new ATOM 0 HH11 ARG A 98 9.860 -13.677 -10.737 1.00 3.50 H new ATOM 0 HH12 ARG A 98 10.907 -13.508 -9.324 1.00 3.50 H new ATOM 0 HH21 ARG A 98 9.117 -10.753 -7.993 1.00 4.08 H new ATOM 0 HH22 ARG A 98 10.485 -11.848 -7.766 1.00 4.08 H new ATOM 1444 N LEU A 99 4.293 -7.336 -12.904 1.00 0.53 N ATOM 1445 CA LEU A 99 3.059 -7.163 -13.644 1.00 0.63 C ATOM 1446 C LEU A 99 3.366 -6.410 -14.941 1.00 0.60 C ATOM 1447 O LEU A 99 2.593 -6.504 -15.887 1.00 0.73 O ATOM 1448 CB LEU A 99 2.077 -6.356 -12.781 1.00 0.66 C ATOM 1449 CG LEU A 99 1.418 -7.089 -11.593 1.00 0.95 C ATOM 1450 CD1 LEU A 99 2.235 -8.197 -10.924 1.00 2.26 C ATOM 1451 CD2 LEU A 99 1.054 -6.053 -10.522 1.00 2.68 C ATOM 0 H LEU A 99 4.329 -6.742 -12.076 1.00 0.53 H new ATOM 0 HA LEU A 99 2.615 -8.129 -13.886 1.00 0.63 H new ATOM 0 HB2 LEU A 99 2.606 -5.486 -12.391 1.00 0.66 H new ATOM 0 HB3 LEU A 99 1.285 -5.983 -13.430 1.00 0.66 H new ATOM 0 HG LEU A 99 0.557 -7.596 -12.028 1.00 0.95 H new ATOM 0 HD11 LEU A 99 1.659 -8.630 -10.106 1.00 2.26 H new ATOM 0 HD12 LEU A 99 2.465 -8.971 -11.656 1.00 2.26 H new ATOM 0 HD13 LEU A 99 3.163 -7.779 -10.533 1.00 2.26 H new ATOM 0 HD21 LEU A 99 0.587 -6.555 -9.675 1.00 2.68 H new ATOM 0 HD22 LEU A 99 1.957 -5.542 -10.188 1.00 2.68 H new ATOM 0 HD23 LEU A 99 0.359 -5.325 -10.941 1.00 2.68 H new ATOM 1463 N SER A 100 4.491 -5.681 -14.989 1.00 0.57 N ATOM 1464 CA SER A 100 4.958 -4.951 -16.159 1.00 0.74 C ATOM 1465 C SER A 100 3.932 -3.902 -16.570 1.00 0.74 C ATOM 1466 O SER A 100 3.388 -3.936 -17.671 1.00 0.97 O ATOM 1467 CB SER A 100 5.299 -5.927 -17.289 1.00 1.03 C ATOM 1468 OG SER A 100 6.365 -6.773 -16.901 1.00 1.32 O ATOM 0 H SER A 100 5.114 -5.586 -14.187 1.00 0.57 H new ATOM 0 HA SER A 100 5.876 -4.415 -15.916 1.00 0.74 H new ATOM 0 HB2 SER A 100 4.423 -6.526 -17.539 1.00 1.03 H new ATOM 0 HB3 SER A 100 5.573 -5.373 -18.187 1.00 1.03 H new ATOM 0 HG SER A 100 6.657 -6.537 -15.996 1.00 1.32 H new ATOM 1474 N ILE A 101 3.689 -2.948 -15.669 1.00 0.64 N ATOM 1475 CA ILE A 101 2.680 -1.919 -15.864 1.00 0.78 C ATOM 1476 C ILE A 101 3.307 -0.546 -16.033 1.00 0.67 C ATOM 1477 O ILE A 101 4.503 -0.368 -15.817 1.00 0.70 O ATOM 1478 CB ILE A 101 1.687 -1.924 -14.700 1.00 1.03 C ATOM 1479 CG1 ILE A 101 2.331 -1.513 -13.360 1.00 1.07 C ATOM 1480 CG2 ILE A 101 0.951 -3.265 -14.710 1.00 2.53 C ATOM 1481 CD1 ILE A 101 1.706 -2.215 -12.164 1.00 0.78 C ATOM 0 H ILE A 101 4.190 -2.872 -14.784 1.00 0.64 H new ATOM 0 HA ILE A 101 2.142 -2.146 -16.785 1.00 0.78 H new ATOM 0 HB ILE A 101 0.936 -1.145 -14.830 1.00 1.03 H new ATOM 0 HG12 ILE A 101 3.397 -1.738 -13.391 1.00 1.07 H new ATOM 0 HG13 ILE A 101 2.236 -0.435 -13.233 1.00 1.07 H new ATOM 0 HG21 ILE A 101 0.236 -3.294 -13.888 1.00 2.53 H new ATOM 0 HG22 ILE A 101 0.422 -3.383 -15.656 1.00 2.53 H new ATOM 0 HG23 ILE A 101 1.670 -4.076 -14.594 1.00 2.53 H new ATOM 0 HD11 ILE A 101 2.200 -1.886 -11.250 1.00 0.78 H new ATOM 0 HD12 ILE A 101 0.645 -1.970 -12.112 1.00 0.78 H new ATOM 0 HD13 ILE A 101 1.824 -3.293 -12.272 1.00 0.78 H new ATOM 1493 N SER A 102 2.479 0.427 -16.410 1.00 0.65 N ATOM 1494 CA SER A 102 2.925 1.787 -16.656 1.00 0.67 C ATOM 1495 C SER A 102 2.653 2.701 -15.463 1.00 0.60 C ATOM 1496 O SER A 102 3.353 3.703 -15.309 1.00 0.67 O ATOM 1497 CB SER A 102 2.248 2.318 -17.919 1.00 0.80 C ATOM 1498 OG SER A 102 2.644 1.532 -19.024 1.00 1.10 O ATOM 0 H SER A 102 1.479 0.289 -16.552 1.00 0.65 H new ATOM 0 HA SER A 102 4.005 1.776 -16.800 1.00 0.67 H new ATOM 0 HB2 SER A 102 1.164 2.287 -17.805 1.00 0.80 H new ATOM 0 HB3 SER A 102 2.522 3.360 -18.082 1.00 0.80 H new ATOM 0 HG SER A 102 2.211 1.868 -19.836 1.00 1.10 H new ATOM 1504 N SER A 103 1.671 2.395 -14.606 1.00 0.60 N ATOM 1505 CA SER A 103 1.292 3.293 -13.527 1.00 0.57 C ATOM 1506 C SER A 103 0.771 2.476 -12.358 1.00 0.61 C ATOM 1507 O SER A 103 0.148 1.434 -12.571 1.00 0.72 O ATOM 1508 CB SER A 103 0.183 4.240 -14.003 1.00 0.65 C ATOM 1509 OG SER A 103 0.375 4.639 -15.343 1.00 1.61 O ATOM 0 H SER A 103 1.130 1.531 -14.645 1.00 0.60 H new ATOM 0 HA SER A 103 2.162 3.874 -13.222 1.00 0.57 H new ATOM 0 HB2 SER A 103 -0.784 3.746 -13.906 1.00 0.65 H new ATOM 0 HB3 SER A 103 0.157 5.121 -13.361 1.00 0.65 H new ATOM 0 HG SER A 103 -0.351 5.240 -15.613 1.00 1.61 H new ATOM 1515 N VAL A 104 0.962 2.958 -11.131 1.00 0.52 N ATOM 1516 CA VAL A 104 0.394 2.294 -9.974 1.00 0.48 C ATOM 1517 C VAL A 104 0.149 3.303 -8.849 1.00 0.44 C ATOM 1518 O VAL A 104 0.954 4.209 -8.620 1.00 0.45 O ATOM 1519 CB VAL A 104 1.315 1.131 -9.578 1.00 0.48 C ATOM 1520 CG1 VAL A 104 2.779 1.569 -9.585 1.00 0.44 C ATOM 1521 CG2 VAL A 104 0.901 0.519 -8.237 1.00 0.44 C ATOM 0 H VAL A 104 1.501 3.798 -10.920 1.00 0.52 H new ATOM 0 HA VAL A 104 -0.584 1.871 -10.203 1.00 0.48 H new ATOM 0 HB VAL A 104 1.208 0.345 -10.326 1.00 0.48 H new ATOM 0 HG11 VAL A 104 3.412 0.728 -9.301 1.00 0.44 H new ATOM 0 HG12 VAL A 104 3.053 1.908 -10.584 1.00 0.44 H new ATOM 0 HG13 VAL A 104 2.918 2.384 -8.875 1.00 0.44 H new ATOM 0 HG21 VAL A 104 1.574 -0.301 -7.988 1.00 0.44 H new ATOM 0 HG22 VAL A 104 0.953 1.280 -7.458 1.00 0.44 H new ATOM 0 HG23 VAL A 104 -0.119 0.142 -8.309 1.00 0.44 H new ATOM 1531 N ALA A 105 -0.963 3.122 -8.133 1.00 0.42 N ATOM 1532 CA ALA A 105 -1.279 3.897 -6.943 1.00 0.40 C ATOM 1533 C ALA A 105 -0.694 3.187 -5.729 1.00 0.38 C ATOM 1534 O ALA A 105 -0.728 1.961 -5.669 1.00 0.44 O ATOM 1535 CB ALA A 105 -2.796 3.991 -6.775 1.00 0.43 C ATOM 0 H ALA A 105 -1.671 2.427 -8.369 1.00 0.42 H new ATOM 0 HA ALA A 105 -0.861 4.899 -7.038 1.00 0.40 H new ATOM 0 HB1 ALA A 105 -3.028 4.572 -5.883 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -3.229 4.479 -7.648 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -3.214 2.989 -6.674 1.00 0.43 H new ATOM 1541 N ILE A 106 -0.201 3.933 -4.743 1.00 0.32 N ATOM 1542 CA ILE A 106 0.461 3.391 -3.569 1.00 0.31 C ATOM 1543 C ILE A 106 -0.024 4.175 -2.341 1.00 0.33 C ATOM 1544 O ILE A 106 0.209 5.377 -2.239 1.00 0.33 O ATOM 1545 CB ILE A 106 1.987 3.413 -3.799 1.00 0.28 C ATOM 1546 CG1 ILE A 106 2.792 2.997 -2.556 1.00 0.39 C ATOM 1547 CG2 ILE A 106 2.473 4.770 -4.338 1.00 0.35 C ATOM 1548 CD1 ILE A 106 2.675 1.504 -2.250 1.00 0.75 C ATOM 0 H ILE A 106 -0.254 4.952 -4.742 1.00 0.32 H new ATOM 0 HA ILE A 106 0.208 2.347 -3.386 1.00 0.31 H new ATOM 0 HB ILE A 106 2.176 2.660 -4.564 1.00 0.28 H new ATOM 0 HG12 ILE A 106 3.841 3.252 -2.706 1.00 0.39 H new ATOM 0 HG13 ILE A 106 2.445 3.568 -1.695 1.00 0.39 H new ATOM 0 HG21 ILE A 106 3.553 4.738 -4.484 1.00 0.35 H new ATOM 0 HG22 ILE A 106 1.984 4.980 -5.289 1.00 0.35 H new ATOM 0 HG23 ILE A 106 2.227 5.555 -3.623 1.00 0.35 H new ATOM 0 HD11 ILE A 106 3.263 1.267 -1.363 1.00 0.75 H new ATOM 0 HD12 ILE A 106 1.630 1.250 -2.071 1.00 0.75 H new ATOM 0 HD13 ILE A 106 3.048 0.929 -3.097 1.00 0.75 H new ATOM 1560 N PRO A 107 -0.750 3.545 -1.411 1.00 0.37 N ATOM 1561 CA PRO A 107 -1.206 4.228 -0.217 1.00 0.41 C ATOM 1562 C PRO A 107 -0.066 4.330 0.791 1.00 0.38 C ATOM 1563 O PRO A 107 0.744 3.412 0.925 1.00 0.43 O ATOM 1564 CB PRO A 107 -2.348 3.370 0.316 1.00 0.47 C ATOM 1565 CG PRO A 107 -1.981 1.957 -0.134 1.00 0.45 C ATOM 1566 CD PRO A 107 -1.250 2.182 -1.455 1.00 0.41 C ATOM 0 HA PRO A 107 -1.536 5.248 -0.414 1.00 0.41 H new ATOM 0 HB2 PRO A 107 -2.426 3.437 1.401 1.00 0.47 H new ATOM 0 HB3 PRO A 107 -3.309 3.683 -0.093 1.00 0.47 H new ATOM 0 HG2 PRO A 107 -1.345 1.456 0.596 1.00 0.45 H new ATOM 0 HG3 PRO A 107 -2.866 1.335 -0.266 1.00 0.45 H new ATOM 0 HD2 PRO A 107 -0.433 1.471 -1.574 1.00 0.41 H new ATOM 0 HD3 PRO A 107 -1.922 2.040 -2.301 1.00 0.41 H new ATOM 1574 N LEU A 108 -0.017 5.429 1.544 1.00 0.38 N ATOM 1575 CA LEU A 108 0.903 5.525 2.660 1.00 0.37 C ATOM 1576 C LEU A 108 0.468 4.527 3.742 1.00 0.40 C ATOM 1577 O LEU A 108 -0.510 4.759 4.452 1.00 0.51 O ATOM 1578 CB LEU A 108 0.932 6.977 3.170 1.00 0.40 C ATOM 1579 CG LEU A 108 2.183 7.288 4.009 1.00 0.45 C ATOM 1580 CD1 LEU A 108 2.234 6.390 5.238 1.00 0.68 C ATOM 1581 CD2 LEU A 108 3.435 7.176 3.140 1.00 0.63 C ATOM 0 H LEU A 108 -0.600 6.253 1.398 1.00 0.38 H new ATOM 0 HA LEU A 108 1.919 5.269 2.359 1.00 0.37 H new ATOM 0 HB2 LEU A 108 0.892 7.657 2.319 1.00 0.40 H new ATOM 0 HB3 LEU A 108 0.042 7.165 3.770 1.00 0.40 H new ATOM 0 HG LEU A 108 2.136 8.314 4.373 1.00 0.45 H new ATOM 0 HD11 LEU A 108 3.125 6.622 5.822 1.00 0.68 H new ATOM 0 HD12 LEU A 108 1.347 6.558 5.848 1.00 0.68 H new ATOM 0 HD13 LEU A 108 2.267 5.346 4.925 1.00 0.68 H new ATOM 0 HD21 LEU A 108 4.316 7.398 3.742 1.00 0.63 H new ATOM 0 HD22 LEU A 108 3.512 6.164 2.742 1.00 0.63 H new ATOM 0 HD23 LEU A 108 3.370 7.886 2.316 1.00 0.63 H new ATOM 1593 N LEU A 109 1.198 3.419 3.898 1.00 0.38 N ATOM 1594 CA LEU A 109 0.983 2.521 5.026 1.00 0.49 C ATOM 1595 C LEU A 109 1.525 3.159 6.296 1.00 0.59 C ATOM 1596 O LEU A 109 2.718 3.057 6.566 1.00 1.06 O ATOM 1597 CB LEU A 109 1.682 1.171 4.837 1.00 0.62 C ATOM 1598 CG LEU A 109 0.812 0.168 4.090 1.00 0.85 C ATOM 1599 CD1 LEU A 109 0.611 0.600 2.642 1.00 1.21 C ATOM 1600 CD2 LEU A 109 1.495 -1.186 4.199 1.00 1.44 C ATOM 0 H LEU A 109 1.938 3.127 3.259 1.00 0.38 H new ATOM 0 HA LEU A 109 -0.091 2.348 5.096 1.00 0.49 H new ATOM 0 HB2 LEU A 109 2.613 1.320 4.289 1.00 0.62 H new ATOM 0 HB3 LEU A 109 1.948 0.763 5.812 1.00 0.62 H new ATOM 0 HG LEU A 109 -0.186 0.110 4.526 1.00 0.85 H new ATOM 0 HD11 LEU A 109 -0.013 -0.131 2.128 1.00 1.21 H new ATOM 0 HD12 LEU A 109 0.124 1.575 2.617 1.00 1.21 H new ATOM 0 HD13 LEU A 109 1.578 0.665 2.144 1.00 1.21 H new ATOM 0 HD21 LEU A 109 0.902 -1.936 3.675 1.00 1.44 H new ATOM 0 HD22 LEU A 109 2.487 -1.130 3.751 1.00 1.44 H new ATOM 0 HD23 LEU A 109 1.586 -1.464 5.249 1.00 1.44 H new ATOM 1612 N SER A 110 0.627 3.739 7.084 1.00 1.54 N ATOM 1613 CA SER A 110 0.878 4.119 8.474 1.00 1.60 C ATOM 1614 C SER A 110 -0.449 4.407 9.180 1.00 1.46 C ATOM 1615 O SER A 110 -0.760 5.565 9.447 1.00 2.07 O ATOM 1616 CB SER A 110 1.862 5.304 8.580 1.00 2.44 C ATOM 1617 OG SER A 110 1.364 6.541 8.095 1.00 4.21 O ATOM 0 H SER A 110 -0.317 3.964 6.770 1.00 1.54 H new ATOM 0 HA SER A 110 1.360 3.282 8.979 1.00 1.60 H new ATOM 0 HB2 SER A 110 2.146 5.428 9.625 1.00 2.44 H new ATOM 0 HB3 SER A 110 2.769 5.054 8.030 1.00 2.44 H new ATOM 0 HG SER A 110 0.446 6.672 8.414 1.00 4.21 H new ATOM 1623 N THR A 111 -1.264 3.383 9.427 1.00 1.11 N ATOM 1624 CA THR A 111 -2.623 3.579 9.931 1.00 1.60 C ATOM 1625 C THR A 111 -3.141 2.307 10.592 1.00 1.62 C ATOM 1626 O THR A 111 -3.652 2.352 11.707 1.00 2.52 O ATOM 1627 CB THR A 111 -3.581 3.947 8.785 1.00 2.30 C ATOM 1628 OG1 THR A 111 -3.252 3.205 7.622 1.00 3.07 O ATOM 1629 CG2 THR A 111 -3.582 5.440 8.448 1.00 2.86 C ATOM 0 H THR A 111 -1.006 2.406 9.286 1.00 1.11 H new ATOM 0 HA THR A 111 -2.586 4.389 10.659 1.00 1.60 H new ATOM 0 HB THR A 111 -4.584 3.697 9.132 1.00 2.30 H new ATOM 0 HG1 THR A 111 -3.867 3.443 6.897 1.00 3.07 H new ATOM 0 HG21 THR A 111 -4.279 5.628 7.632 1.00 2.86 H new ATOM 0 HG22 THR A 111 -3.887 6.011 9.325 1.00 2.86 H new ATOM 0 HG23 THR A 111 -2.580 5.746 8.147 1.00 2.86 H new ATOM 1637 N GLY A 112 -3.065 1.186 9.870 1.00 2.83 N ATOM 1638 CA GLY A 112 -3.529 -0.101 10.356 1.00 3.65 C ATOM 1639 C GLY A 112 -2.581 -0.657 11.412 1.00 3.31 C ATOM 1640 O GLY A 112 -1.926 0.087 12.138 1.00 3.42 O ATOM 0 H GLY A 112 -2.676 1.153 8.927 1.00 2.83 H new ATOM 0 HA2 GLY A 112 -4.529 0.004 10.778 1.00 3.65 H new ATOM 0 HA3 GLY A 112 -3.606 -0.802 9.525 1.00 3.65 H new ATOM 1644 N ILE A 113 -2.476 -1.985 11.499 1.00 3.43 N ATOM 1645 CA ILE A 113 -1.617 -2.623 12.498 1.00 3.35 C ATOM 1646 C ILE A 113 -0.178 -2.080 12.407 1.00 2.73 C ATOM 1647 O ILE A 113 0.513 -1.928 13.420 1.00 2.77 O ATOM 1648 CB ILE A 113 -1.735 -4.153 12.358 1.00 4.29 C ATOM 1649 CG1 ILE A 113 -1.143 -4.885 13.571 1.00 5.48 C ATOM 1650 CG2 ILE A 113 -1.071 -4.664 11.071 1.00 5.31 C ATOM 1651 CD1 ILE A 113 -2.012 -4.751 14.828 1.00 5.66 C ATOM 0 H ILE A 113 -2.973 -2.637 10.892 1.00 3.43 H new ATOM 0 HA ILE A 113 -1.945 -2.375 13.507 1.00 3.35 H new ATOM 0 HB ILE A 113 -2.802 -4.372 12.307 1.00 4.29 H new ATOM 0 HG12 ILE A 113 -1.022 -5.941 13.329 1.00 5.48 H new ATOM 0 HG13 ILE A 113 -0.149 -4.490 13.778 1.00 5.48 H new ATOM 0 HG21 ILE A 113 -1.177 -5.747 11.012 1.00 5.31 H new ATOM 0 HG22 ILE A 113 -1.551 -4.205 10.207 1.00 5.31 H new ATOM 0 HG23 ILE A 113 -0.013 -4.403 11.079 1.00 5.31 H new ATOM 0 HD11 ILE A 113 -1.544 -5.288 15.653 1.00 5.66 H new ATOM 0 HD12 ILE A 113 -2.112 -3.698 15.091 1.00 5.66 H new ATOM 0 HD13 ILE A 113 -2.999 -5.172 14.635 1.00 5.66 H new ATOM 1663 N PHE A 114 0.231 -1.730 11.184 1.00 2.52 N ATOM 1664 CA PHE A 114 1.373 -0.885 10.863 1.00 2.11 C ATOM 1665 C PHE A 114 1.081 0.567 11.249 1.00 1.47 C ATOM 1666 O PHE A 114 0.937 1.454 10.411 1.00 2.42 O ATOM 1667 CB PHE A 114 1.725 -1.041 9.372 1.00 2.44 C ATOM 1668 CG PHE A 114 0.531 -1.009 8.430 1.00 2.69 C ATOM 1669 CD1 PHE A 114 0.045 0.212 7.928 1.00 3.94 C ATOM 1670 CD2 PHE A 114 -0.142 -2.205 8.116 1.00 3.01 C ATOM 1671 CE1 PHE A 114 -1.154 0.254 7.199 1.00 4.70 C ATOM 1672 CE2 PHE A 114 -1.324 -2.167 7.361 1.00 3.95 C ATOM 1673 CZ PHE A 114 -1.849 -0.937 6.933 1.00 4.52 C ATOM 0 H PHE A 114 -0.257 -2.050 10.348 1.00 2.52 H new ATOM 0 HA PHE A 114 2.243 -1.197 11.441 1.00 2.11 H new ATOM 0 HB2 PHE A 114 2.414 -0.245 9.090 1.00 2.44 H new ATOM 0 HB3 PHE A 114 2.254 -1.984 9.234 1.00 2.44 H new ATOM 0 HD1 PHE A 114 0.598 1.123 8.105 1.00 3.94 H new ATOM 0 HD2 PHE A 114 0.251 -3.152 8.456 1.00 3.01 H new ATOM 0 HE1 PHE A 114 -1.540 1.198 6.844 1.00 4.70 H new ATOM 0 HE2 PHE A 114 -1.831 -3.086 7.108 1.00 3.95 H new ATOM 0 HZ PHE A 114 -2.787 -0.907 6.399 1.00 4.52 H new ATOM 1683 N SER A 115 1.050 0.831 12.549 1.00 1.05 N ATOM 1684 CA SER A 115 1.046 2.181 13.070 1.00 1.03 C ATOM 1685 C SER A 115 1.761 2.142 14.408 1.00 1.07 C ATOM 1686 O SER A 115 2.867 2.662 14.528 1.00 1.70 O ATOM 1687 CB SER A 115 -0.387 2.721 13.174 1.00 1.71 C ATOM 1688 OG SER A 115 -0.417 3.817 14.058 1.00 2.55 O ATOM 0 H SER A 115 1.027 0.109 13.269 1.00 1.05 H new ATOM 0 HA SER A 115 1.566 2.868 12.403 1.00 1.03 H new ATOM 0 HB2 SER A 115 -0.744 3.025 12.190 1.00 1.71 H new ATOM 0 HB3 SER A 115 -1.057 1.937 13.528 1.00 1.71 H new ATOM 0 HG SER A 115 -1.295 4.250 14.013 1.00 2.55 H new ATOM 1694 N ALA A 116 1.136 1.521 15.414 1.00 0.98 N ATOM 1695 CA ALA A 116 1.567 1.626 16.803 1.00 0.95 C ATOM 1696 C ALA A 116 1.739 3.092 17.226 1.00 1.42 C ATOM 1697 O ALA A 116 2.571 3.403 18.073 1.00 1.87 O ATOM 1698 CB ALA A 116 2.846 0.807 16.997 1.00 0.82 C ATOM 0 H ALA A 116 0.315 0.931 15.282 1.00 0.98 H new ATOM 0 HA ALA A 116 0.796 1.214 17.454 1.00 0.95 H new ATOM 0 HB1 ALA A 116 3.172 0.882 18.034 1.00 0.82 H new ATOM 0 HB2 ALA A 116 2.650 -0.237 16.753 1.00 0.82 H new ATOM 0 HB3 ALA A 116 3.627 1.192 16.342 1.00 0.82 H new ATOM 1704 N GLY A 117 0.951 3.994 16.635 1.00 2.01 N ATOM 1705 CA GLY A 117 1.007 5.417 16.909 1.00 2.69 C ATOM 1706 C GLY A 117 2.195 6.106 16.238 1.00 2.27 C ATOM 1707 O GLY A 117 2.588 7.183 16.682 1.00 2.52 O ATOM 0 H GLY A 117 0.246 3.743 15.942 1.00 2.01 H new ATOM 0 HA2 GLY A 117 0.083 5.884 16.568 1.00 2.69 H new ATOM 0 HA3 GLY A 117 1.064 5.572 17.986 1.00 2.69 H new ATOM 1711 N LYS A 118 2.777 5.542 15.167 1.00 1.83 N ATOM 1712 CA LYS A 118 3.899 6.180 14.478 1.00 1.57 C ATOM 1713 C LYS A 118 3.412 6.742 13.141 1.00 1.46 C ATOM 1714 O LYS A 118 4.129 6.705 12.147 1.00 2.14 O ATOM 1715 CB LYS A 118 5.095 5.203 14.406 1.00 1.95 C ATOM 1716 CG LYS A 118 5.245 4.379 13.114 1.00 2.22 C ATOM 1717 CD LYS A 118 6.036 3.091 13.351 1.00 3.06 C ATOM 1718 CE LYS A 118 6.471 2.482 12.016 1.00 4.14 C ATOM 1719 NZ LYS A 118 7.912 2.682 11.732 1.00 4.64 N ATOM 0 H LYS A 118 2.488 4.650 14.765 1.00 1.83 H new ATOM 0 HA LYS A 118 4.281 7.039 15.029 1.00 1.57 H new ATOM 0 HB2 LYS A 118 6.011 5.776 14.551 1.00 1.95 H new ATOM 0 HB3 LYS A 118 5.017 4.510 15.243 1.00 1.95 H new ATOM 0 HG2 LYS A 118 4.258 4.133 12.723 1.00 2.22 H new ATOM 0 HG3 LYS A 118 5.747 4.980 12.356 1.00 2.22 H new ATOM 0 HD2 LYS A 118 6.912 3.302 13.965 1.00 3.06 H new ATOM 0 HD3 LYS A 118 5.424 2.377 13.902 1.00 3.06 H new ATOM 0 HE2 LYS A 118 6.252 1.414 12.021 1.00 4.14 H new ATOM 0 HE3 LYS A 118 5.883 2.924 11.212 1.00 4.14 H new ATOM 0 HZ1 LYS A 118 8.020 3.306 10.907 1.00 4.64 H new ATOM 0 HZ2 LYS A 118 8.371 3.117 12.557 1.00 4.64 H new ATOM 0 HZ3 LYS A 118 8.357 1.764 11.532 1.00 4.64 H new ATOM 1733 N ASP A 119 2.179 7.249 13.111 1.00 2.55 N ATOM 1734 CA ASP A 119 1.432 7.605 11.906 1.00 3.09 C ATOM 1735 C ASP A 119 2.120 8.758 11.172 1.00 2.43 C ATOM 1736 O ASP A 119 1.773 9.926 11.339 1.00 2.88 O ATOM 1737 CB ASP A 119 -0.022 7.950 12.274 1.00 4.48 C ATOM 1738 CG ASP A 119 -0.668 6.818 13.071 1.00 5.56 C ATOM 1739 OD1 ASP A 119 -1.420 6.010 12.487 1.00 6.68 O ATOM 1740 OD2 ASP A 119 -0.325 6.703 14.268 1.00 5.86 O ATOM 0 H ASP A 119 1.651 7.430 13.965 1.00 2.55 H new ATOM 0 HA ASP A 119 1.414 6.752 11.228 1.00 3.09 H new ATOM 0 HB2 ASP A 119 -0.045 8.870 12.858 1.00 4.48 H new ATOM 0 HB3 ASP A 119 -0.597 8.135 11.366 1.00 4.48 H new ATOM 1745 N ARG A 120 3.141 8.442 10.372 1.00 1.87 N ATOM 1746 CA ARG A 120 4.080 9.420 9.851 1.00 1.20 C ATOM 1747 C ARG A 120 4.349 9.114 8.395 1.00 0.86 C ATOM 1748 O ARG A 120 5.128 8.222 8.043 1.00 0.79 O ATOM 1749 CB ARG A 120 5.368 9.406 10.681 1.00 1.74 C ATOM 1750 CG ARG A 120 5.161 10.215 11.964 1.00 2.43 C ATOM 1751 CD ARG A 120 6.297 9.984 12.959 1.00 3.31 C ATOM 1752 NE ARG A 120 6.118 10.831 14.150 1.00 3.60 N ATOM 1753 CZ ARG A 120 6.554 12.090 14.290 1.00 3.22 C ATOM 1754 NH1 ARG A 120 6.280 12.768 15.405 1.00 3.72 N ATOM 1755 NH2 ARG A 120 7.258 12.677 13.322 1.00 3.30 N ATOM 0 H ARG A 120 3.335 7.488 10.068 1.00 1.87 H new ATOM 0 HA ARG A 120 3.658 10.423 9.922 1.00 1.20 H new ATOM 0 HB2 ARG A 120 5.643 8.380 10.926 1.00 1.74 H new ATOM 0 HB3 ARG A 120 6.190 9.827 10.102 1.00 1.74 H new ATOM 0 HG2 ARG A 120 5.099 11.276 11.721 1.00 2.43 H new ATOM 0 HG3 ARG A 120 4.212 9.937 12.422 1.00 2.43 H new ATOM 0 HD2 ARG A 120 6.324 8.935 13.252 1.00 3.31 H new ATOM 0 HD3 ARG A 120 7.254 10.208 12.487 1.00 3.31 H new ATOM 0 HE ARG A 120 5.617 10.423 14.939 1.00 3.60 H new ATOM 0 HH11 ARG A 120 5.739 12.328 16.150 1.00 3.72 H new ATOM 0 HH12 ARG A 120 6.611 13.727 15.513 1.00 3.72 H new ATOM 0 HH21 ARG A 120 7.470 12.167 12.464 1.00 3.30 H new ATOM 0 HH22 ARG A 120 7.585 13.636 13.439 1.00 3.30 H new ATOM 1769 N VAL A 121 3.725 9.908 7.534 1.00 0.69 N ATOM 1770 CA VAL A 121 3.900 9.762 6.107 1.00 0.46 C ATOM 1771 C VAL A 121 5.355 10.006 5.739 1.00 0.35 C ATOM 1772 O VAL A 121 5.913 9.235 4.981 1.00 0.39 O ATOM 1773 CB VAL A 121 2.891 10.622 5.337 1.00 0.48 C ATOM 1774 CG1 VAL A 121 1.493 10.427 5.937 1.00 0.58 C ATOM 1775 CG2 VAL A 121 3.244 12.100 5.343 1.00 0.56 C ATOM 0 H VAL A 121 3.092 10.660 7.807 1.00 0.69 H new ATOM 0 HA VAL A 121 3.679 8.738 5.804 1.00 0.46 H new ATOM 0 HB VAL A 121 2.915 10.293 4.298 1.00 0.48 H new ATOM 0 HG11 VAL A 121 0.774 11.038 5.391 1.00 0.58 H new ATOM 0 HG12 VAL A 121 1.208 9.378 5.862 1.00 0.58 H new ATOM 0 HG13 VAL A 121 1.502 10.727 6.985 1.00 0.58 H new ATOM 0 HG21 VAL A 121 2.493 12.656 4.782 1.00 0.56 H new ATOM 0 HG22 VAL A 121 3.272 12.463 6.370 1.00 0.56 H new ATOM 0 HG23 VAL A 121 4.221 12.243 4.881 1.00 0.56 H new ATOM 1785 N HIS A 122 6.007 11.007 6.324 1.00 0.51 N ATOM 1786 CA HIS A 122 7.416 11.298 6.049 1.00 0.65 C ATOM 1787 C HIS A 122 8.321 10.083 6.268 1.00 0.53 C ATOM 1788 O HIS A 122 9.380 9.978 5.652 1.00 0.74 O ATOM 1789 CB HIS A 122 7.906 12.485 6.890 1.00 0.95 C ATOM 1790 CG HIS A 122 8.189 12.138 8.332 1.00 2.54 C ATOM 1791 ND1 HIS A 122 9.344 11.550 8.800 1.00 3.32 N ATOM 1792 CD2 HIS A 122 7.350 12.319 9.397 1.00 4.17 C ATOM 1793 CE1 HIS A 122 9.197 11.374 10.125 1.00 4.82 C ATOM 1794 NE2 HIS A 122 7.998 11.824 10.534 1.00 5.40 N ATOM 0 H HIS A 122 5.578 11.639 7.000 1.00 0.51 H new ATOM 0 HA HIS A 122 7.478 11.561 4.993 1.00 0.65 H new ATOM 0 HB2 HIS A 122 8.813 12.888 6.439 1.00 0.95 H new ATOM 0 HB3 HIS A 122 7.156 13.275 6.857 1.00 0.95 H new ATOM 0 HD1 HIS A 122 10.160 11.295 8.244 1.00 3.32 H new ATOM 0 HD2 HIS A 122 6.366 12.763 9.366 1.00 4.17 H new ATOM 0 HE1 HIS A 122 9.940 10.932 10.772 1.00 4.82 H new ATOM 1802 N GLN A 123 7.938 9.192 7.182 1.00 0.42 N ATOM 1803 CA GLN A 123 8.744 8.036 7.534 1.00 0.40 C ATOM 1804 C GLN A 123 8.468 6.951 6.505 1.00 0.34 C ATOM 1805 O GLN A 123 9.379 6.316 5.979 1.00 0.39 O ATOM 1806 CB GLN A 123 8.379 7.611 8.965 1.00 0.56 C ATOM 1807 CG GLN A 123 9.511 6.870 9.680 1.00 0.93 C ATOM 1808 CD GLN A 123 9.442 5.356 9.534 1.00 2.37 C ATOM 1809 OE1 GLN A 123 8.528 4.729 10.062 1.00 3.45 O ATOM 1810 NE2 GLN A 123 10.418 4.745 8.885 1.00 3.31 N ATOM 0 H GLN A 123 7.059 9.256 7.696 1.00 0.42 H new ATOM 0 HA GLN A 123 9.813 8.249 7.521 1.00 0.40 H new ATOM 0 HB2 GLN A 123 8.110 8.495 9.543 1.00 0.56 H new ATOM 0 HB3 GLN A 123 7.497 6.971 8.933 1.00 0.56 H new ATOM 0 HG2 GLN A 123 10.466 7.220 9.289 1.00 0.93 H new ATOM 0 HG3 GLN A 123 9.488 7.125 10.739 1.00 0.93 H new ATOM 0 HE21 GLN A 123 11.165 5.291 8.456 1.00 3.31 H new ATOM 0 HE22 GLN A 123 10.424 3.728 8.813 1.00 3.31 H new ATOM 1819 N SER A 124 7.189 6.785 6.186 1.00 0.40 N ATOM 1820 CA SER A 124 6.726 5.767 5.281 1.00 0.57 C ATOM 1821 C SER A 124 7.200 6.073 3.860 1.00 0.60 C ATOM 1822 O SER A 124 7.974 5.299 3.323 1.00 0.76 O ATOM 1823 CB SER A 124 5.223 5.724 5.437 1.00 0.73 C ATOM 1824 OG SER A 124 4.913 5.429 6.786 1.00 1.17 O ATOM 0 H SER A 124 6.441 7.369 6.561 1.00 0.40 H new ATOM 0 HA SER A 124 7.133 4.780 5.502 1.00 0.57 H new ATOM 0 HB2 SER A 124 4.786 6.680 5.150 1.00 0.73 H new ATOM 0 HB3 SER A 124 4.797 4.968 4.778 1.00 0.73 H new ATOM 0 HG SER A 124 4.931 6.254 7.314 1.00 1.17 H new ATOM 1830 N LEU A 125 6.841 7.228 3.286 1.00 0.60 N ATOM 1831 CA LEU A 125 7.371 7.801 2.042 1.00 0.72 C ATOM 1832 C LEU A 125 8.891 7.717 1.968 1.00 0.60 C ATOM 1833 O LEU A 125 9.433 7.657 0.871 1.00 0.75 O ATOM 1834 CB LEU A 125 6.905 9.258 1.854 1.00 0.92 C ATOM 1835 CG LEU A 125 5.511 9.324 1.210 1.00 1.46 C ATOM 1836 CD1 LEU A 125 4.646 10.414 1.840 1.00 2.64 C ATOM 1837 CD2 LEU A 125 5.590 9.598 -0.291 1.00 2.40 C ATOM 0 H LEU A 125 6.128 7.825 3.704 1.00 0.60 H new ATOM 0 HA LEU A 125 6.969 7.199 1.227 1.00 0.72 H new ATOM 0 HB2 LEU A 125 6.885 9.762 2.820 1.00 0.92 H new ATOM 0 HB3 LEU A 125 7.621 9.793 1.230 1.00 0.92 H new ATOM 0 HG LEU A 125 5.060 8.347 1.384 1.00 1.46 H new ATOM 0 HD11 LEU A 125 3.669 10.428 1.357 1.00 2.64 H new ATOM 0 HD12 LEU A 125 4.522 10.211 2.904 1.00 2.64 H new ATOM 0 HD13 LEU A 125 5.129 11.382 1.710 1.00 2.64 H new ATOM 0 HD21 LEU A 125 4.583 9.637 -0.707 1.00 2.40 H new ATOM 0 HD22 LEU A 125 6.090 10.552 -0.461 1.00 2.40 H new ATOM 0 HD23 LEU A 125 6.153 8.801 -0.777 1.00 2.40 H new ATOM 1849 N SER A 126 9.599 7.704 3.097 1.00 0.45 N ATOM 1850 CA SER A 126 11.033 7.464 3.052 1.00 0.51 C ATOM 1851 C SER A 126 11.324 6.094 2.431 1.00 0.42 C ATOM 1852 O SER A 126 12.054 6.005 1.443 1.00 0.53 O ATOM 1853 CB SER A 126 11.654 7.606 4.448 1.00 0.64 C ATOM 1854 OG SER A 126 12.832 8.383 4.361 1.00 1.20 O ATOM 0 H SER A 126 9.212 7.853 4.029 1.00 0.45 H new ATOM 0 HA SER A 126 11.497 8.219 2.417 1.00 0.51 H new ATOM 0 HB2 SER A 126 10.944 8.077 5.128 1.00 0.64 H new ATOM 0 HB3 SER A 126 11.883 6.622 4.858 1.00 0.64 H new ATOM 0 HG SER A 126 13.229 8.476 5.252 1.00 1.20 H new ATOM 1860 N HIS A 127 10.766 5.020 2.996 1.00 0.33 N ATOM 1861 CA HIS A 127 11.093 3.671 2.537 1.00 0.39 C ATOM 1862 C HIS A 127 10.291 3.331 1.284 1.00 0.37 C ATOM 1863 O HIS A 127 10.839 2.842 0.303 1.00 0.63 O ATOM 1864 CB HIS A 127 10.859 2.666 3.669 1.00 0.48 C ATOM 1865 CG HIS A 127 11.714 2.991 4.866 1.00 0.65 C ATOM 1866 ND1 HIS A 127 13.084 3.128 4.863 1.00 1.02 N ATOM 1867 CD2 HIS A 127 11.261 3.337 6.111 1.00 0.79 C ATOM 1868 CE1 HIS A 127 13.448 3.545 6.090 1.00 1.10 C ATOM 1869 NE2 HIS A 127 12.374 3.693 6.879 1.00 0.98 N ATOM 0 H HIS A 127 10.094 5.058 3.762 1.00 0.33 H new ATOM 0 HA HIS A 127 12.147 3.620 2.266 1.00 0.39 H new ATOM 0 HB2 HIS A 127 9.807 2.675 3.956 1.00 0.48 H new ATOM 0 HB3 HIS A 127 11.086 1.659 3.319 1.00 0.48 H new ATOM 0 HD1 HIS A 127 13.708 2.947 4.076 1.00 1.02 H new ATOM 0 HD2 HIS A 127 10.232 3.335 6.440 1.00 0.79 H new ATOM 0 HE1 HIS A 127 14.466 3.734 6.397 1.00 1.10 H new ATOM 1877 N LEU A 128 8.994 3.617 1.325 1.00 0.36 N ATOM 1878 CA LEU A 128 8.033 3.533 0.242 1.00 0.54 C ATOM 1879 C LEU A 128 8.616 4.121 -1.030 1.00 0.65 C ATOM 1880 O LEU A 128 8.688 3.411 -2.026 1.00 0.81 O ATOM 1881 CB LEU A 128 6.739 4.207 0.702 1.00 0.83 C ATOM 1882 CG LEU A 128 5.534 4.140 -0.247 1.00 1.13 C ATOM 1883 CD1 LEU A 128 4.320 4.586 0.573 1.00 2.98 C ATOM 1884 CD2 LEU A 128 5.674 5.081 -1.449 1.00 2.24 C ATOM 0 H LEU A 128 8.557 3.939 2.189 1.00 0.36 H new ATOM 0 HA LEU A 128 7.798 2.497 -0.003 1.00 0.54 H new ATOM 0 HB2 LEU A 128 6.445 3.760 1.652 1.00 0.83 H new ATOM 0 HB3 LEU A 128 6.957 5.257 0.897 1.00 0.83 H new ATOM 0 HG LEU A 128 5.445 3.128 -0.641 1.00 1.13 H new ATOM 0 HD11 LEU A 128 3.428 4.559 -0.053 1.00 2.98 H new ATOM 0 HD12 LEU A 128 4.188 3.915 1.422 1.00 2.98 H new ATOM 0 HD13 LEU A 128 4.478 5.602 0.934 1.00 2.98 H new ATOM 0 HD21 LEU A 128 4.794 4.992 -2.086 1.00 2.24 H new ATOM 0 HD22 LEU A 128 5.765 6.109 -1.098 1.00 2.24 H new ATOM 0 HD23 LEU A 128 6.563 4.813 -2.020 1.00 2.24 H new ATOM 1896 N LEU A 129 9.043 5.388 -1.032 1.00 0.65 N ATOM 1897 CA LEU A 129 9.637 5.938 -2.243 1.00 0.75 C ATOM 1898 C LEU A 129 10.949 5.235 -2.548 1.00 0.71 C ATOM 1899 O LEU A 129 11.156 4.866 -3.691 1.00 0.75 O ATOM 1900 CB LEU A 129 9.843 7.455 -2.192 1.00 0.89 C ATOM 1901 CG LEU A 129 8.530 8.243 -2.088 1.00 0.99 C ATOM 1902 CD1 LEU A 129 8.849 9.740 -2.094 1.00 1.41 C ATOM 1903 CD2 LEU A 129 7.573 7.933 -3.243 1.00 1.70 C ATOM 0 H LEU A 129 8.990 6.027 -0.239 1.00 0.65 H new ATOM 0 HA LEU A 129 8.923 5.756 -3.046 1.00 0.75 H new ATOM 0 HB2 LEU A 129 10.474 7.700 -1.338 1.00 0.89 H new ATOM 0 HB3 LEU A 129 10.379 7.772 -3.087 1.00 0.89 H new ATOM 0 HG LEU A 129 8.037 7.949 -1.161 1.00 0.99 H new ATOM 0 HD11 LEU A 129 7.923 10.310 -2.020 1.00 1.41 H new ATOM 0 HD12 LEU A 129 9.490 9.979 -1.245 1.00 1.41 H new ATOM 0 HD13 LEU A 129 9.362 9.999 -3.020 1.00 1.41 H new ATOM 0 HD21 LEU A 129 6.659 8.515 -3.124 1.00 1.70 H new ATOM 0 HD22 LEU A 129 8.048 8.193 -4.189 1.00 1.70 H new ATOM 0 HD23 LEU A 129 7.330 6.870 -3.239 1.00 1.70 H new ATOM 1915 N ALA A 130 11.834 5.013 -1.571 1.00 0.67 N ATOM 1916 CA ALA A 130 13.122 4.378 -1.851 1.00 0.73 C ATOM 1917 C ALA A 130 12.981 3.008 -2.536 1.00 0.62 C ATOM 1918 O ALA A 130 13.878 2.581 -3.255 1.00 0.70 O ATOM 1919 CB ALA A 130 13.929 4.255 -0.557 1.00 0.84 C ATOM 0 H ALA A 130 11.684 5.260 -0.593 1.00 0.67 H new ATOM 0 HA ALA A 130 13.652 5.018 -2.556 1.00 0.73 H new ATOM 0 HB1 ALA A 130 14.888 3.782 -0.770 1.00 0.84 H new ATOM 0 HB2 ALA A 130 14.099 5.247 -0.139 1.00 0.84 H new ATOM 0 HB3 ALA A 130 13.376 3.649 0.160 1.00 0.84 H new ATOM 1925 N ALA A 131 11.876 2.305 -2.299 1.00 0.53 N ATOM 1926 CA ALA A 131 11.577 1.013 -2.883 1.00 0.53 C ATOM 1927 C ALA A 131 10.906 1.191 -4.239 1.00 0.48 C ATOM 1928 O ALA A 131 11.298 0.581 -5.224 1.00 0.47 O ATOM 1929 CB ALA A 131 10.639 0.258 -1.945 1.00 0.62 C ATOM 0 H ALA A 131 11.143 2.637 -1.672 1.00 0.53 H new ATOM 0 HA ALA A 131 12.502 0.453 -3.022 1.00 0.53 H new ATOM 0 HB1 ALA A 131 10.405 -0.717 -2.372 1.00 0.62 H new ATOM 0 HB2 ALA A 131 11.122 0.124 -0.977 1.00 0.62 H new ATOM 0 HB3 ALA A 131 9.719 0.827 -1.815 1.00 0.62 H new ATOM 1935 N MET A 132 9.853 1.997 -4.308 1.00 0.53 N ATOM 1936 CA MET A 132 9.057 2.146 -5.514 1.00 0.63 C ATOM 1937 C MET A 132 9.805 2.942 -6.586 1.00 0.67 C ATOM 1938 O MET A 132 9.463 2.891 -7.763 1.00 0.74 O ATOM 1939 CB MET A 132 7.737 2.813 -5.153 1.00 0.85 C ATOM 1940 CG MET A 132 6.613 2.246 -6.008 1.00 2.00 C ATOM 1941 SD MET A 132 5.017 2.904 -5.493 1.00 3.34 S ATOM 1942 CE MET A 132 3.999 2.272 -6.832 1.00 4.50 C ATOM 0 H MET A 132 9.529 2.566 -3.526 1.00 0.53 H new ATOM 0 HA MET A 132 8.862 1.160 -5.937 1.00 0.63 H new ATOM 0 HB2 MET A 132 7.517 2.654 -4.097 1.00 0.85 H new ATOM 0 HB3 MET A 132 7.812 3.890 -5.304 1.00 0.85 H new ATOM 0 HG2 MET A 132 6.790 2.489 -7.056 1.00 2.00 H new ATOM 0 HG3 MET A 132 6.605 1.159 -5.930 1.00 2.00 H new ATOM 0 HE1 MET A 132 3.166 2.952 -7.008 1.00 4.50 H new ATOM 0 HE2 MET A 132 4.599 2.192 -7.738 1.00 4.50 H new ATOM 0 HE3 MET A 132 3.614 1.288 -6.563 1.00 4.50 H new ATOM 1952 N ASP A 133 10.855 3.656 -6.192 1.00 0.69 N ATOM 1953 CA ASP A 133 11.782 4.315 -7.094 1.00 0.80 C ATOM 1954 C ASP A 133 12.475 3.279 -7.969 1.00 0.74 C ATOM 1955 O ASP A 133 12.807 3.551 -9.116 1.00 0.90 O ATOM 1956 CB ASP A 133 12.811 5.100 -6.280 1.00 0.88 C ATOM 1957 CG ASP A 133 13.734 5.888 -7.196 1.00 1.07 C ATOM 1958 OD1 ASP A 133 14.934 5.544 -7.251 1.00 1.71 O ATOM 1959 OD2 ASP A 133 13.211 6.864 -7.783 1.00 2.49 O ATOM 0 H ASP A 133 11.087 3.793 -5.208 1.00 0.69 H new ATOM 0 HA ASP A 133 11.238 5.005 -7.738 1.00 0.80 H new ATOM 0 HB2 ASP A 133 12.300 5.780 -5.598 1.00 0.88 H new ATOM 0 HB3 ASP A 133 13.397 4.415 -5.668 1.00 0.88 H new ATOM 1964 N THR A 134 12.648 2.058 -7.454 1.00 0.59 N ATOM 1965 CA THR A 134 13.318 1.005 -8.202 1.00 0.58 C ATOM 1966 C THR A 134 12.428 0.429 -9.317 1.00 0.49 C ATOM 1967 O THR A 134 12.846 -0.500 -10.003 1.00 0.71 O ATOM 1968 CB THR A 134 13.874 -0.076 -7.247 1.00 0.63 C ATOM 1969 OG1 THR A 134 12.915 -1.036 -6.856 1.00 0.62 O ATOM 1970 CG2 THR A 134 14.491 0.527 -5.973 1.00 0.73 C ATOM 0 H THR A 134 12.332 1.781 -6.525 1.00 0.59 H new ATOM 0 HA THR A 134 14.173 1.446 -8.715 1.00 0.58 H new ATOM 0 HB THR A 134 14.645 -0.573 -7.836 1.00 0.63 H new ATOM 0 HG1 THR A 134 12.266 -0.622 -6.249 1.00 0.62 H new ATOM 0 HG21 THR A 134 14.867 -0.274 -5.336 1.00 0.73 H new ATOM 0 HG22 THR A 134 15.313 1.190 -6.245 1.00 0.73 H new ATOM 0 HG23 THR A 134 13.732 1.093 -5.434 1.00 0.73 H new ATOM 1978 N THR A 135 11.204 0.943 -9.509 1.00 0.46 N ATOM 1979 CA THR A 135 10.300 0.428 -10.529 1.00 0.53 C ATOM 1980 C THR A 135 10.488 1.173 -11.854 1.00 0.68 C ATOM 1981 O THR A 135 11.369 2.019 -12.001 1.00 0.87 O ATOM 1982 CB THR A 135 8.843 0.513 -10.050 1.00 0.49 C ATOM 1983 OG1 THR A 135 8.320 1.822 -10.145 1.00 0.42 O ATOM 1984 CG2 THR A 135 8.677 -0.020 -8.627 1.00 0.66 C ATOM 0 H THR A 135 10.823 1.718 -8.965 1.00 0.46 H new ATOM 0 HA THR A 135 10.541 -0.621 -10.701 1.00 0.53 H new ATOM 0 HB THR A 135 8.270 -0.124 -10.723 1.00 0.49 H new ATOM 0 HG1 THR A 135 8.608 2.347 -9.369 1.00 0.42 H new ATOM 0 HG21 THR A 135 7.632 0.059 -8.329 1.00 0.66 H new ATOM 0 HG22 THR A 135 8.987 -1.064 -8.591 1.00 0.66 H new ATOM 0 HG23 THR A 135 9.294 0.565 -7.945 1.00 0.66 H new ATOM 1992 N GLU A 136 9.614 0.891 -12.821 1.00 0.86 N ATOM 1993 CA GLU A 136 9.642 1.488 -14.147 1.00 1.25 C ATOM 1994 C GLU A 136 8.284 2.130 -14.458 1.00 1.10 C ATOM 1995 O GLU A 136 7.954 2.354 -15.619 1.00 1.51 O ATOM 1996 CB GLU A 136 10.055 0.391 -15.149 1.00 1.82 C ATOM 1997 CG GLU A 136 11.572 0.430 -15.370 1.00 2.07 C ATOM 1998 CD GLU A 136 12.088 -0.866 -15.999 1.00 3.27 C ATOM 1999 OE1 GLU A 136 12.903 -1.544 -15.335 1.00 4.44 O ATOM 2000 OE2 GLU A 136 11.664 -1.158 -17.139 1.00 3.71 O ATOM 0 H GLU A 136 8.851 0.225 -12.696 1.00 0.86 H new ATOM 0 HA GLU A 136 10.372 2.294 -14.215 1.00 1.25 H new ATOM 0 HB2 GLU A 136 9.759 -0.588 -14.772 1.00 1.82 H new ATOM 0 HB3 GLU A 136 9.537 0.538 -16.097 1.00 1.82 H new ATOM 0 HG2 GLU A 136 11.824 1.272 -16.014 1.00 2.07 H new ATOM 0 HG3 GLU A 136 12.074 0.597 -14.417 1.00 2.07 H new ATOM 2007 N ALA A 137 7.500 2.477 -13.426 1.00 0.61 N ATOM 2008 CA ALA A 137 6.141 2.981 -13.599 1.00 0.57 C ATOM 2009 C ALA A 137 5.927 4.264 -12.796 1.00 0.59 C ATOM 2010 O ALA A 137 6.746 4.629 -11.954 1.00 0.69 O ATOM 2011 CB ALA A 137 5.161 1.900 -13.143 1.00 0.61 C ATOM 0 H ALA A 137 7.795 2.414 -12.452 1.00 0.61 H new ATOM 0 HA ALA A 137 5.974 3.219 -14.650 1.00 0.57 H new ATOM 0 HB1 ALA A 137 4.139 2.260 -13.265 1.00 0.61 H new ATOM 0 HB2 ALA A 137 5.304 1.002 -13.744 1.00 0.61 H new ATOM 0 HB3 ALA A 137 5.340 1.666 -12.094 1.00 0.61 H new ATOM 2017 N ARG A 138 4.815 4.963 -13.037 1.00 0.56 N ATOM 2018 CA ARG A 138 4.448 6.110 -12.215 1.00 0.61 C ATOM 2019 C ARG A 138 4.162 5.673 -10.784 1.00 0.63 C ATOM 2020 O ARG A 138 3.702 4.557 -10.552 1.00 0.66 O ATOM 2021 CB ARG A 138 3.223 6.836 -12.785 1.00 0.65 C ATOM 2022 CG ARG A 138 3.622 7.969 -13.737 1.00 1.18 C ATOM 2023 CD ARG A 138 2.877 9.246 -13.328 1.00 1.58 C ATOM 2024 NE ARG A 138 3.278 10.399 -14.145 1.00 1.96 N ATOM 2025 CZ ARG A 138 2.864 10.649 -15.392 1.00 2.14 C ATOM 2026 NH1 ARG A 138 3.297 11.738 -16.029 1.00 2.70 N ATOM 2027 NH2 ARG A 138 2.022 9.813 -16.002 1.00 2.68 N ATOM 0 H ARG A 138 4.160 4.754 -13.790 1.00 0.56 H new ATOM 0 HA ARG A 138 5.292 6.800 -12.220 1.00 0.61 H new ATOM 0 HB2 ARG A 138 2.592 6.122 -13.314 1.00 0.65 H new ATOM 0 HB3 ARG A 138 2.628 7.242 -11.967 1.00 0.65 H new ATOM 0 HG2 ARG A 138 4.699 8.132 -13.699 1.00 1.18 H new ATOM 0 HG3 ARG A 138 3.376 7.702 -14.765 1.00 1.18 H new ATOM 0 HD2 ARG A 138 1.803 9.087 -13.426 1.00 1.58 H new ATOM 0 HD3 ARG A 138 3.073 9.460 -12.277 1.00 1.58 H new ATOM 0 HE ARG A 138 3.927 11.065 -13.726 1.00 1.96 H new ATOM 0 HH11 ARG A 138 3.942 12.378 -15.565 1.00 2.70 H new ATOM 0 HH12 ARG A 138 2.983 11.931 -16.980 1.00 2.70 H new ATOM 0 HH21 ARG A 138 1.691 8.979 -15.517 1.00 2.68 H new ATOM 0 HH22 ARG A 138 1.709 10.008 -16.953 1.00 2.68 H new ATOM 2041 N VAL A 139 4.378 6.599 -9.849 1.00 0.66 N ATOM 2042 CA VAL A 139 4.250 6.388 -8.423 1.00 0.63 C ATOM 2043 C VAL A 139 3.296 7.457 -7.906 1.00 0.60 C ATOM 2044 O VAL A 139 3.681 8.614 -7.739 1.00 0.72 O ATOM 2045 CB VAL A 139 5.648 6.479 -7.783 1.00 0.68 C ATOM 2046 CG1 VAL A 139 5.584 6.488 -6.252 1.00 0.78 C ATOM 2047 CG2 VAL A 139 6.510 5.303 -8.251 1.00 0.93 C ATOM 0 H VAL A 139 4.658 7.552 -10.083 1.00 0.66 H new ATOM 0 HA VAL A 139 3.849 5.406 -8.173 1.00 0.63 H new ATOM 0 HB VAL A 139 6.092 7.422 -8.102 1.00 0.68 H new ATOM 0 HG11 VAL A 139 6.593 6.553 -5.846 1.00 0.78 H new ATOM 0 HG12 VAL A 139 5.002 7.347 -5.917 1.00 0.78 H new ATOM 0 HG13 VAL A 139 5.111 5.570 -5.902 1.00 0.78 H new ATOM 0 HG21 VAL A 139 7.498 5.372 -7.795 1.00 0.93 H new ATOM 0 HG22 VAL A 139 6.039 4.366 -7.955 1.00 0.93 H new ATOM 0 HG23 VAL A 139 6.608 5.333 -9.336 1.00 0.93 H new ATOM 2057 N THR A 140 2.043 7.089 -7.664 1.00 0.51 N ATOM 2058 CA THR A 140 1.023 8.041 -7.269 1.00 0.50 C ATOM 2059 C THR A 140 0.663 7.764 -5.820 1.00 0.42 C ATOM 2060 O THR A 140 0.079 6.726 -5.520 1.00 0.40 O ATOM 2061 CB THR A 140 -0.191 7.850 -8.179 1.00 0.56 C ATOM 2062 OG1 THR A 140 0.223 7.455 -9.469 1.00 0.90 O ATOM 2063 CG2 THR A 140 -0.999 9.134 -8.309 1.00 0.63 C ATOM 0 H THR A 140 1.711 6.127 -7.737 1.00 0.51 H new ATOM 0 HA THR A 140 1.372 9.069 -7.362 1.00 0.50 H new ATOM 0 HB THR A 140 -0.814 7.079 -7.726 1.00 0.56 H new ATOM 0 HG1 THR A 140 -0.378 6.759 -9.807 1.00 0.90 H new ATOM 0 HG21 THR A 140 -1.854 8.961 -8.963 1.00 0.63 H new ATOM 0 HG22 THR A 140 -1.351 9.443 -7.325 1.00 0.63 H new ATOM 0 HG23 THR A 140 -0.371 9.918 -8.732 1.00 0.63 H new ATOM 2071 N ILE A 141 1.004 8.665 -4.903 1.00 0.39 N ATOM 2072 CA ILE A 141 0.728 8.435 -3.500 1.00 0.36 C ATOM 2073 C ILE A 141 -0.745 8.764 -3.256 1.00 0.41 C ATOM 2074 O ILE A 141 -1.264 9.768 -3.756 1.00 0.44 O ATOM 2075 CB ILE A 141 1.707 9.248 -2.628 1.00 0.37 C ATOM 2076 CG1 ILE A 141 1.944 8.574 -1.266 1.00 0.42 C ATOM 2077 CG2 ILE A 141 1.257 10.683 -2.373 1.00 0.47 C ATOM 2078 CD1 ILE A 141 2.954 7.431 -1.370 1.00 0.72 C ATOM 0 H ILE A 141 1.467 9.550 -5.109 1.00 0.39 H new ATOM 0 HA ILE A 141 0.888 7.394 -3.218 1.00 0.36 H new ATOM 0 HB ILE A 141 2.630 9.277 -3.208 1.00 0.37 H new ATOM 0 HG12 ILE A 141 2.304 9.314 -0.551 1.00 0.42 H new ATOM 0 HG13 ILE A 141 0.999 8.191 -0.880 1.00 0.42 H new ATOM 0 HG21 ILE A 141 1.996 11.191 -1.753 1.00 0.47 H new ATOM 0 HG22 ILE A 141 1.158 11.208 -3.323 1.00 0.47 H new ATOM 0 HG23 ILE A 141 0.295 10.677 -1.860 1.00 0.47 H new ATOM 0 HD11 ILE A 141 3.095 6.980 -0.388 1.00 0.72 H new ATOM 0 HD12 ILE A 141 2.582 6.678 -2.065 1.00 0.72 H new ATOM 0 HD13 ILE A 141 3.906 7.819 -1.731 1.00 0.72 H new ATOM 2090 N TYR A 142 -1.413 7.914 -2.480 1.00 0.47 N ATOM 2091 CA TYR A 142 -2.794 8.095 -2.071 1.00 0.56 C ATOM 2092 C TYR A 142 -2.879 8.019 -0.552 1.00 0.64 C ATOM 2093 O TYR A 142 -1.938 7.597 0.127 1.00 0.54 O ATOM 2094 CB TYR A 142 -3.695 7.040 -2.718 1.00 0.60 C ATOM 2095 CG TYR A 142 -4.181 7.395 -4.107 1.00 0.51 C ATOM 2096 CD1 TYR A 142 -3.339 7.229 -5.220 1.00 0.54 C ATOM 2097 CD2 TYR A 142 -5.494 7.874 -4.283 1.00 0.52 C ATOM 2098 CE1 TYR A 142 -3.800 7.549 -6.510 1.00 0.57 C ATOM 2099 CE2 TYR A 142 -5.963 8.193 -5.567 1.00 0.59 C ATOM 2100 CZ TYR A 142 -5.111 8.049 -6.685 1.00 0.60 C ATOM 2101 OH TYR A 142 -5.560 8.407 -7.920 1.00 0.79 O ATOM 0 H TYR A 142 -0.994 7.060 -2.112 1.00 0.47 H new ATOM 0 HA TYR A 142 -3.142 9.073 -2.403 1.00 0.56 H new ATOM 0 HB2 TYR A 142 -3.151 6.097 -2.767 1.00 0.60 H new ATOM 0 HB3 TYR A 142 -4.560 6.876 -2.075 1.00 0.60 H new ATOM 0 HD1 TYR A 142 -2.335 6.855 -5.085 1.00 0.54 H new ATOM 0 HD2 TYR A 142 -6.142 7.996 -3.427 1.00 0.52 H new ATOM 0 HE1 TYR A 142 -3.154 7.413 -7.365 1.00 0.57 H new ATOM 0 HE2 TYR A 142 -6.974 8.548 -5.700 1.00 0.59 H new ATOM 0 HH TYR A 142 -6.484 8.728 -7.852 1.00 0.79 H new ATOM 2111 N CYS A 143 -4.014 8.463 -0.017 1.00 0.97 N ATOM 2112 CA CYS A 143 -4.228 8.600 1.408 1.00 0.94 C ATOM 2113 C CYS A 143 -5.732 8.525 1.666 1.00 1.12 C ATOM 2114 O CYS A 143 -6.427 7.826 0.933 1.00 2.25 O ATOM 2115 CB CYS A 143 -3.587 9.919 1.845 1.00 1.13 C ATOM 2116 SG CYS A 143 -4.334 11.346 0.998 1.00 3.32 S ATOM 0 H CYS A 143 -4.820 8.740 -0.577 1.00 0.97 H new ATOM 0 HA CYS A 143 -3.766 7.806 1.994 1.00 0.94 H new ATOM 0 HB2 CYS A 143 -3.697 10.037 2.923 1.00 1.13 H new ATOM 0 HB3 CYS A 143 -2.518 9.891 1.635 1.00 1.13 H new ATOM 0 HG CYS A 143 -4.662 12.248 1.875 1.00 3.32 H new ATOM 2122 N ARG A 144 -6.233 9.261 2.665 1.00 1.17 N ATOM 2123 CA ARG A 144 -7.657 9.400 2.923 1.00 1.35 C ATOM 2124 C ARG A 144 -8.022 10.876 2.752 1.00 1.39 C ATOM 2125 O ARG A 144 -8.458 11.524 3.703 1.00 2.62 O ATOM 2126 CB ARG A 144 -7.999 8.870 4.323 1.00 1.72 C ATOM 2127 CG ARG A 144 -9.524 8.736 4.460 1.00 1.94 C ATOM 2128 CD ARG A 144 -10.004 8.975 5.893 1.00 2.40 C ATOM 2129 NE ARG A 144 -9.864 7.788 6.749 1.00 2.56 N ATOM 2130 CZ ARG A 144 -10.400 7.680 7.972 1.00 3.11 C ATOM 2131 NH1 ARG A 144 -10.339 6.527 8.640 1.00 4.05 N ATOM 2132 NH2 ARG A 144 -11.014 8.729 8.522 1.00 3.66 N ATOM 0 H ARG A 144 -5.648 9.780 3.320 1.00 1.17 H new ATOM 0 HA ARG A 144 -8.243 8.808 2.220 1.00 1.35 H new ATOM 0 HB2 ARG A 144 -7.522 7.903 4.484 1.00 1.72 H new ATOM 0 HB3 ARG A 144 -7.613 9.547 5.085 1.00 1.72 H new ATOM 0 HG2 ARG A 144 -10.010 9.448 3.793 1.00 1.94 H new ATOM 0 HG3 ARG A 144 -9.829 7.740 4.139 1.00 1.94 H new ATOM 0 HD2 ARG A 144 -9.438 9.799 6.328 1.00 2.40 H new ATOM 0 HD3 ARG A 144 -11.050 9.282 5.874 1.00 2.40 H new ATOM 0 HE ARG A 144 -9.326 6.999 6.390 1.00 2.56 H new ATOM 0 HH11 ARG A 144 -9.881 5.718 8.220 1.00 4.05 H new ATOM 0 HH12 ARG A 144 -10.750 6.454 9.571 1.00 4.05 H new ATOM 0 HH21 ARG A 144 -11.074 9.610 8.011 1.00 3.66 H new ATOM 0 HH22 ARG A 144 -11.423 8.650 9.453 1.00 3.66 H new ATOM 2146 N ASP A 145 -7.798 11.381 1.535 1.00 1.47 N ATOM 2147 CA ASP A 145 -8.134 12.729 1.081 1.00 1.61 C ATOM 2148 C ASP A 145 -7.885 13.829 2.135 1.00 1.74 C ATOM 2149 O ASP A 145 -6.877 13.792 2.839 1.00 3.56 O ATOM 2150 CB ASP A 145 -9.537 12.709 0.435 1.00 2.21 C ATOM 2151 CG ASP A 145 -10.726 12.678 1.398 1.00 2.34 C ATOM 2152 OD1 ASP A 145 -11.301 13.775 1.598 1.00 2.99 O ATOM 2153 OD2 ASP A 145 -11.069 11.581 1.883 1.00 3.08 O ATOM 0 H ASP A 145 -7.353 10.828 0.802 1.00 1.47 H new ATOM 0 HA ASP A 145 -7.434 13.031 0.302 1.00 1.61 H new ATOM 0 HB2 ASP A 145 -9.634 13.590 -0.200 1.00 2.21 H new ATOM 0 HB3 ASP A 145 -9.601 11.837 -0.216 1.00 2.21 H new ATOM 2158 N LYS A 146 -8.756 14.841 2.209 1.00 1.33 N ATOM 2159 CA LYS A 146 -8.739 15.928 3.199 1.00 1.85 C ATOM 2160 C LYS A 146 -7.375 16.636 3.303 1.00 1.41 C ATOM 2161 O LYS A 146 -6.552 16.587 2.394 1.00 1.41 O ATOM 2162 CB LYS A 146 -9.201 15.388 4.571 1.00 2.62 C ATOM 2163 CG LYS A 146 -10.548 14.657 4.582 1.00 3.11 C ATOM 2164 CD LYS A 146 -11.701 15.556 4.125 1.00 3.72 C ATOM 2165 CE LYS A 146 -13.014 14.812 4.373 1.00 4.56 C ATOM 2166 NZ LYS A 146 -14.190 15.625 3.994 1.00 5.64 N ATOM 0 H LYS A 146 -9.529 14.930 1.550 1.00 1.33 H new ATOM 0 HA LYS A 146 -9.437 16.692 2.856 1.00 1.85 H new ATOM 0 HB2 LYS A 146 -8.437 14.708 4.948 1.00 2.62 H new ATOM 0 HB3 LYS A 146 -9.257 16.223 5.269 1.00 2.62 H new ATOM 0 HG2 LYS A 146 -10.491 13.784 3.931 1.00 3.11 H new ATOM 0 HG3 LYS A 146 -10.752 14.291 5.588 1.00 3.11 H new ATOM 0 HD2 LYS A 146 -11.689 16.498 4.673 1.00 3.72 H new ATOM 0 HD3 LYS A 146 -11.596 15.801 3.068 1.00 3.72 H new ATOM 0 HE2 LYS A 146 -13.017 13.882 3.804 1.00 4.56 H new ATOM 0 HE3 LYS A 146 -13.084 14.541 5.427 1.00 4.56 H new ATOM 0 HZ1 LYS A 146 -15.059 15.085 4.178 1.00 5.64 H new ATOM 0 HZ2 LYS A 146 -14.202 16.501 4.555 1.00 5.64 H new ATOM 0 HZ3 LYS A 146 -14.137 15.862 2.983 1.00 5.64 H new ATOM 2180 N THR A 147 -7.126 17.322 4.426 1.00 1.31 N ATOM 2181 CA THR A 147 -5.830 17.915 4.749 1.00 1.09 C ATOM 2182 C THR A 147 -4.745 16.842 4.901 1.00 0.98 C ATOM 2183 O THR A 147 -3.559 17.168 4.892 1.00 0.91 O ATOM 2184 CB THR A 147 -5.958 18.793 6.009 1.00 1.46 C ATOM 2185 OG1 THR A 147 -4.785 19.561 6.247 1.00 2.86 O ATOM 2186 CG2 THR A 147 -6.272 17.973 7.265 1.00 2.21 C ATOM 0 H THR A 147 -7.833 17.481 5.144 1.00 1.31 H new ATOM 0 HA THR A 147 -5.518 18.552 3.922 1.00 1.09 H new ATOM 0 HB THR A 147 -6.793 19.464 5.808 1.00 1.46 H new ATOM 0 HG1 THR A 147 -4.005 19.085 5.893 1.00 2.86 H new ATOM 0 HG21 THR A 147 -6.352 18.639 8.124 1.00 2.21 H new ATOM 0 HG22 THR A 147 -7.215 17.444 7.128 1.00 2.21 H new ATOM 0 HG23 THR A 147 -5.473 17.252 7.438 1.00 2.21 H new ATOM 2194 N TRP A 148 -5.124 15.565 5.035 1.00 1.21 N ATOM 2195 CA TRP A 148 -4.173 14.462 5.015 1.00 1.35 C ATOM 2196 C TRP A 148 -3.346 14.541 3.737 1.00 1.16 C ATOM 2197 O TRP A 148 -2.118 14.559 3.812 1.00 1.12 O ATOM 2198 CB TRP A 148 -4.891 13.107 5.139 1.00 1.79 C ATOM 2199 CG TRP A 148 -4.675 12.381 6.428 1.00 1.98 C ATOM 2200 CD1 TRP A 148 -3.473 12.087 6.973 1.00 2.18 C ATOM 2201 CD2 TRP A 148 -5.675 11.822 7.333 1.00 2.74 C ATOM 2202 NE1 TRP A 148 -3.658 11.402 8.157 1.00 2.56 N ATOM 2203 CE2 TRP A 148 -4.997 11.210 8.428 1.00 2.84 C ATOM 2204 CE3 TRP A 148 -7.086 11.767 7.336 1.00 3.78 C ATOM 2205 CZ2 TRP A 148 -5.684 10.583 9.479 1.00 3.59 C ATOM 2206 CZ3 TRP A 148 -7.785 11.150 8.391 1.00 4.66 C ATOM 2207 CH2 TRP A 148 -7.088 10.559 9.460 1.00 4.46 C ATOM 0 H TRP A 148 -6.094 15.275 5.159 1.00 1.21 H new ATOM 0 HA TRP A 148 -3.507 14.545 5.874 1.00 1.35 H new ATOM 0 HB2 TRP A 148 -5.961 13.269 5.008 1.00 1.79 H new ATOM 0 HB3 TRP A 148 -4.563 12.465 4.321 1.00 1.79 H new ATOM 0 HD1 TRP A 148 -2.515 12.348 6.547 1.00 2.18 H new ATOM 0 HE1 TRP A 148 -2.899 11.078 8.757 1.00 2.56 H new ATOM 0 HE3 TRP A 148 -7.637 12.205 6.517 1.00 3.78 H new ATOM 0 HZ2 TRP A 148 -5.140 10.125 10.292 1.00 3.59 H new ATOM 0 HZ3 TRP A 148 -8.865 11.130 8.379 1.00 4.66 H new ATOM 0 HH2 TRP A 148 -7.632 10.087 10.265 1.00 4.46 H new ATOM 2218 N GLU A 149 -4.013 14.643 2.581 1.00 1.13 N ATOM 2219 CA GLU A 149 -3.343 14.827 1.301 1.00 1.04 C ATOM 2220 C GLU A 149 -2.354 15.972 1.409 1.00 0.89 C ATOM 2221 O GLU A 149 -1.208 15.821 1.024 1.00 0.90 O ATOM 2222 CB GLU A 149 -4.354 15.085 0.177 1.00 1.17 C ATOM 2223 CG GLU A 149 -3.668 15.501 -1.141 1.00 2.36 C ATOM 2224 CD GLU A 149 -3.531 17.027 -1.303 1.00 3.45 C ATOM 2225 OE1 GLU A 149 -4.575 17.712 -1.221 1.00 4.17 O ATOM 2226 OE2 GLU A 149 -2.394 17.500 -1.521 1.00 4.39 O ATOM 0 H GLU A 149 -5.030 14.600 2.513 1.00 1.13 H new ATOM 0 HA GLU A 149 -2.806 13.912 1.052 1.00 1.04 H new ATOM 0 HB2 GLU A 149 -4.945 14.185 0.008 1.00 1.17 H new ATOM 0 HB3 GLU A 149 -5.047 15.867 0.487 1.00 1.17 H new ATOM 0 HG2 GLU A 149 -2.678 15.048 -1.186 1.00 2.36 H new ATOM 0 HG3 GLU A 149 -4.239 15.104 -1.980 1.00 2.36 H new ATOM 2233 N GLN A 150 -2.784 17.102 1.958 1.00 0.94 N ATOM 2234 CA GLN A 150 -1.968 18.303 2.030 1.00 0.95 C ATOM 2235 C GLN A 150 -0.660 18.052 2.790 1.00 0.91 C ATOM 2236 O GLN A 150 0.411 18.445 2.332 1.00 0.92 O ATOM 2237 CB GLN A 150 -2.814 19.414 2.661 1.00 1.14 C ATOM 2238 CG GLN A 150 -2.644 20.754 1.946 1.00 1.65 C ATOM 2239 CD GLN A 150 -3.851 21.635 2.246 1.00 2.13 C ATOM 2240 OE1 GLN A 150 -4.265 21.762 3.395 1.00 2.47 O ATOM 2241 NE2 GLN A 150 -4.464 22.210 1.217 1.00 2.86 N ATOM 0 H GLN A 150 -3.712 17.209 2.367 1.00 0.94 H new ATOM 0 HA GLN A 150 -1.664 18.612 1.030 1.00 0.95 H new ATOM 0 HB2 GLN A 150 -3.864 19.124 2.638 1.00 1.14 H new ATOM 0 HB3 GLN A 150 -2.537 19.527 3.709 1.00 1.14 H new ATOM 0 HG2 GLN A 150 -1.729 21.244 2.278 1.00 1.65 H new ATOM 0 HG3 GLN A 150 -2.550 20.598 0.871 1.00 1.65 H new ATOM 0 HE21 GLN A 150 -4.098 22.088 0.273 1.00 2.86 H new ATOM 0 HE22 GLN A 150 -5.300 22.773 1.371 1.00 2.86 H new ATOM 2250 N LYS A 151 -0.723 17.375 3.940 1.00 0.96 N ATOM 2251 CA LYS A 151 0.472 16.960 4.676 1.00 1.05 C ATOM 2252 C LYS A 151 1.357 16.078 3.799 1.00 0.98 C ATOM 2253 O LYS A 151 2.579 16.215 3.790 1.00 1.07 O ATOM 2254 CB LYS A 151 0.054 16.229 5.962 1.00 1.27 C ATOM 2255 CG LYS A 151 0.174 17.146 7.187 1.00 1.33 C ATOM 2256 CD LYS A 151 -0.957 16.891 8.191 1.00 1.53 C ATOM 2257 CE LYS A 151 -2.251 17.604 7.774 1.00 2.21 C ATOM 2258 NZ LYS A 151 -2.209 19.063 8.016 1.00 3.04 N ATOM 0 H LYS A 151 -1.599 17.101 4.384 1.00 0.96 H new ATOM 0 HA LYS A 151 1.053 17.840 4.951 1.00 1.05 H new ATOM 0 HB2 LYS A 151 -0.974 15.879 5.866 1.00 1.27 H new ATOM 0 HB3 LYS A 151 0.680 15.347 6.102 1.00 1.27 H new ATOM 0 HG2 LYS A 151 1.136 16.983 7.672 1.00 1.33 H new ATOM 0 HG3 LYS A 151 0.150 18.188 6.867 1.00 1.33 H new ATOM 0 HD2 LYS A 151 -1.140 15.819 8.270 1.00 1.53 H new ATOM 0 HD3 LYS A 151 -0.652 17.236 9.179 1.00 1.53 H new ATOM 0 HE2 LYS A 151 -2.435 17.422 6.715 1.00 2.21 H new ATOM 0 HE3 LYS A 151 -3.089 17.174 8.322 1.00 2.21 H new ATOM 0 HZ1 LYS A 151 -3.048 19.509 7.594 1.00 3.04 H new ATOM 0 HZ2 LYS A 151 -2.198 19.245 9.040 1.00 3.04 H new ATOM 0 HZ3 LYS A 151 -1.351 19.462 7.584 1.00 3.04 H new ATOM 2272 N ILE A 152 0.761 15.148 3.065 1.00 0.90 N ATOM 2273 CA ILE A 152 1.518 14.278 2.187 1.00 0.88 C ATOM 2274 C ILE A 152 2.197 15.100 1.088 1.00 0.83 C ATOM 2275 O ILE A 152 3.365 14.874 0.809 1.00 0.96 O ATOM 2276 CB ILE A 152 0.594 13.157 1.698 1.00 0.91 C ATOM 2277 CG1 ILE A 152 0.347 12.200 2.876 1.00 0.95 C ATOM 2278 CG2 ILE A 152 1.191 12.366 0.532 1.00 1.14 C ATOM 2279 CD1 ILE A 152 -1.037 11.564 2.807 1.00 1.30 C ATOM 0 H ILE A 152 -0.245 14.980 3.063 1.00 0.90 H new ATOM 0 HA ILE A 152 2.341 13.788 2.707 1.00 0.88 H new ATOM 0 HB ILE A 152 -0.330 13.610 1.339 1.00 0.91 H new ATOM 0 HG12 ILE A 152 1.107 11.418 2.875 1.00 0.95 H new ATOM 0 HG13 ILE A 152 0.451 12.744 3.815 1.00 0.95 H new ATOM 0 HG21 ILE A 152 0.494 11.586 0.227 1.00 1.14 H new ATOM 0 HG22 ILE A 152 1.374 13.037 -0.307 1.00 1.14 H new ATOM 0 HG23 ILE A 152 2.131 11.911 0.844 1.00 1.14 H new ATOM 0 HD11 ILE A 152 -1.173 10.895 3.657 1.00 1.30 H new ATOM 0 HD12 ILE A 152 -1.798 12.344 2.835 1.00 1.30 H new ATOM 0 HD13 ILE A 152 -1.131 10.998 1.880 1.00 1.30 H new ATOM 2291 N LYS A 153 1.537 16.096 0.500 1.00 0.75 N ATOM 2292 CA LYS A 153 2.103 16.991 -0.498 1.00 0.79 C ATOM 2293 C LYS A 153 3.331 17.700 0.066 1.00 0.88 C ATOM 2294 O LYS A 153 4.353 17.793 -0.611 1.00 0.91 O ATOM 2295 CB LYS A 153 1.016 17.983 -0.932 1.00 0.83 C ATOM 2296 CG LYS A 153 1.465 18.913 -2.061 1.00 0.89 C ATOM 2297 CD LYS A 153 0.404 19.999 -2.260 1.00 1.20 C ATOM 2298 CE LYS A 153 0.856 20.961 -3.362 1.00 1.50 C ATOM 2299 NZ LYS A 153 -0.011 22.156 -3.432 1.00 2.02 N ATOM 0 H LYS A 153 0.562 16.306 0.715 1.00 0.75 H new ATOM 0 HA LYS A 153 2.434 16.430 -1.372 1.00 0.79 H new ATOM 0 HB2 LYS A 153 0.135 17.428 -1.255 1.00 0.83 H new ATOM 0 HB3 LYS A 153 0.717 18.583 -0.073 1.00 0.83 H new ATOM 0 HG2 LYS A 153 2.426 19.365 -1.817 1.00 0.89 H new ATOM 0 HG3 LYS A 153 1.603 18.348 -2.983 1.00 0.89 H new ATOM 0 HD2 LYS A 153 -0.550 19.545 -2.528 1.00 1.20 H new ATOM 0 HD3 LYS A 153 0.247 20.544 -1.329 1.00 1.20 H new ATOM 0 HE2 LYS A 153 1.885 21.268 -3.178 1.00 1.50 H new ATOM 0 HE3 LYS A 153 0.844 20.446 -4.322 1.00 1.50 H new ATOM 0 HZ1 LYS A 153 0.325 22.785 -4.189 1.00 2.02 H new ATOM 0 HZ2 LYS A 153 -0.989 21.864 -3.633 1.00 2.02 H new ATOM 0 HZ3 LYS A 153 0.020 22.661 -2.523 1.00 2.02 H new ATOM 2313 N THR A 154 3.256 18.209 1.297 1.00 1.00 N ATOM 2314 CA THR A 154 4.420 18.843 1.893 1.00 1.18 C ATOM 2315 C THR A 154 5.565 17.835 2.052 1.00 1.26 C ATOM 2316 O THR A 154 6.727 18.212 1.922 1.00 1.44 O ATOM 2317 CB THR A 154 4.048 19.567 3.196 1.00 1.29 C ATOM 2318 OG1 THR A 154 3.248 18.786 4.052 1.00 2.54 O ATOM 2319 CG2 THR A 154 3.223 20.816 2.881 1.00 1.46 C ATOM 0 H THR A 154 2.422 18.194 1.884 1.00 1.00 H new ATOM 0 HA THR A 154 4.789 19.617 1.219 1.00 1.18 H new ATOM 0 HB THR A 154 4.995 19.796 3.684 1.00 1.29 H new ATOM 0 HG1 THR A 154 3.357 17.838 3.827 1.00 2.54 H new ATOM 0 HG21 THR A 154 2.963 21.324 3.810 1.00 1.46 H new ATOM 0 HG22 THR A 154 3.806 21.488 2.251 1.00 1.46 H new ATOM 0 HG23 THR A 154 2.311 20.527 2.358 1.00 1.46 H new ATOM 2327 N VAL A 155 5.276 16.554 2.309 1.00 1.20 N ATOM 2328 CA VAL A 155 6.319 15.537 2.335 1.00 1.30 C ATOM 2329 C VAL A 155 6.930 15.331 0.951 1.00 1.17 C ATOM 2330 O VAL A 155 8.147 15.299 0.836 1.00 1.29 O ATOM 2331 CB VAL A 155 5.787 14.240 2.950 1.00 1.40 C ATOM 2332 CG1 VAL A 155 6.812 13.113 2.837 1.00 1.38 C ATOM 2333 CG2 VAL A 155 5.459 14.517 4.420 1.00 1.99 C ATOM 0 H VAL A 155 4.337 16.205 2.499 1.00 1.20 H new ATOM 0 HA VAL A 155 7.130 15.885 2.974 1.00 1.30 H new ATOM 0 HB VAL A 155 4.895 13.918 2.413 1.00 1.40 H new ATOM 0 HG11 VAL A 155 6.405 12.205 3.282 1.00 1.38 H new ATOM 0 HG12 VAL A 155 7.039 12.932 1.786 1.00 1.38 H new ATOM 0 HG13 VAL A 155 7.724 13.397 3.361 1.00 1.38 H new ATOM 0 HG21 VAL A 155 5.077 13.608 4.885 1.00 1.99 H new ATOM 0 HG22 VAL A 155 6.361 14.839 4.940 1.00 1.99 H new ATOM 0 HG23 VAL A 155 4.705 15.302 4.483 1.00 1.99 H new ATOM 2343 N LEU A 156 6.114 15.195 -0.091 1.00 0.98 N ATOM 2344 CA LEU A 156 6.556 15.054 -1.479 1.00 0.91 C ATOM 2345 C LEU A 156 7.606 16.116 -1.811 1.00 1.04 C ATOM 2346 O LEU A 156 8.683 15.776 -2.282 1.00 1.36 O ATOM 2347 CB LEU A 156 5.352 15.128 -2.437 1.00 0.88 C ATOM 2348 CG LEU A 156 4.701 13.781 -2.797 1.00 0.94 C ATOM 2349 CD1 LEU A 156 5.512 13.043 -3.864 1.00 1.54 C ATOM 2350 CD2 LEU A 156 4.503 12.845 -1.603 1.00 2.25 C ATOM 0 H LEU A 156 5.099 15.179 0.008 1.00 0.98 H new ATOM 0 HA LEU A 156 7.019 14.076 -1.607 1.00 0.91 H new ATOM 0 HB2 LEU A 156 4.593 15.769 -1.988 1.00 0.88 H new ATOM 0 HB3 LEU A 156 5.674 15.613 -3.359 1.00 0.88 H new ATOM 0 HG LEU A 156 3.714 14.043 -3.177 1.00 0.94 H new ATOM 0 HD11 LEU A 156 5.028 12.095 -4.098 1.00 1.54 H new ATOM 0 HD12 LEU A 156 5.569 13.654 -4.765 1.00 1.54 H new ATOM 0 HD13 LEU A 156 6.518 12.854 -3.490 1.00 1.54 H new ATOM 0 HD21 LEU A 156 4.039 11.918 -1.940 1.00 2.25 H new ATOM 0 HD22 LEU A 156 5.469 12.623 -1.150 1.00 2.25 H new ATOM 0 HD23 LEU A 156 3.859 13.326 -0.867 1.00 2.25 H new ATOM 2362 N GLN A 157 7.318 17.393 -1.553 1.00 0.96 N ATOM 2363 CA GLN A 157 8.293 18.468 -1.763 1.00 1.20 C ATOM 2364 C GLN A 157 9.519 18.344 -0.845 1.00 1.46 C ATOM 2365 O GLN A 157 10.602 18.792 -1.206 1.00 1.70 O ATOM 2366 CB GLN A 157 7.606 19.824 -1.568 1.00 1.20 C ATOM 2367 CG GLN A 157 6.871 20.263 -2.842 1.00 1.29 C ATOM 2368 CD GLN A 157 7.654 21.336 -3.601 1.00 1.81 C ATOM 2369 OE1 GLN A 157 8.799 21.135 -3.978 1.00 3.22 O ATOM 2370 NE2 GLN A 157 7.060 22.500 -3.837 1.00 2.12 N ATOM 0 H GLN A 157 6.416 17.710 -1.198 1.00 0.96 H new ATOM 0 HA GLN A 157 8.664 18.384 -2.784 1.00 1.20 H new ATOM 0 HB2 GLN A 157 6.899 19.761 -0.741 1.00 1.20 H new ATOM 0 HB3 GLN A 157 8.348 20.575 -1.296 1.00 1.20 H new ATOM 0 HG2 GLN A 157 6.715 19.400 -3.489 1.00 1.29 H new ATOM 0 HG3 GLN A 157 5.885 20.648 -2.580 1.00 1.29 H new ATOM 0 HE21 GLN A 157 6.104 22.659 -3.519 1.00 2.12 H new ATOM 0 HE22 GLN A 157 7.560 23.235 -4.337 1.00 2.12 H new ATOM 2379 N ASN A 158 9.366 17.778 0.352 1.00 1.52 N ATOM 2380 CA ASN A 158 10.485 17.516 1.261 1.00 1.92 C ATOM 2381 C ASN A 158 11.311 16.278 0.872 1.00 2.00 C ATOM 2382 O ASN A 158 12.282 15.977 1.568 1.00 2.63 O ATOM 2383 CB ASN A 158 9.970 17.320 2.700 1.00 2.11 C ATOM 2384 CG ASN A 158 9.964 18.605 3.512 1.00 2.31 C ATOM 2385 OD1 ASN A 158 11.003 19.069 3.961 1.00 3.13 O ATOM 2386 ND2 ASN A 158 8.798 19.182 3.756 1.00 2.52 N ATOM 0 H ASN A 158 8.461 17.487 0.721 1.00 1.52 H new ATOM 0 HA ASN A 158 11.135 18.388 1.191 1.00 1.92 H new ATOM 0 HB2 ASN A 158 8.959 16.915 2.665 1.00 2.11 H new ATOM 0 HB3 ASN A 158 10.593 16.581 3.205 1.00 2.11 H new ATOM 0 HD21 ASN A 158 8.756 20.027 4.326 1.00 2.52 H new ATOM 0 HD22 ASN A 158 7.941 18.782 3.374 1.00 2.52 H new ATOM 2393 N ARG A 159 10.939 15.515 -0.159 1.00 1.51 N ATOM 2394 CA ARG A 159 11.579 14.242 -0.477 1.00 1.67 C ATOM 2395 C ARG A 159 12.279 14.299 -1.823 1.00 1.85 C ATOM 2396 O ARG A 159 13.009 13.319 -2.086 1.00 2.33 O ATOM 2397 CB ARG A 159 10.533 13.117 -0.465 1.00 1.75 C ATOM 2398 CG ARG A 159 10.135 12.686 0.952 1.00 2.80 C ATOM 2399 CD ARG A 159 11.296 12.070 1.737 1.00 4.04 C ATOM 2400 NE ARG A 159 11.881 10.912 1.043 1.00 4.94 N ATOM 2401 CZ ARG A 159 13.004 10.280 1.400 1.00 6.06 C ATOM 2402 NH1 ARG A 159 13.408 9.204 0.724 1.00 7.19 N ATOM 2403 NH2 ARG A 159 13.709 10.713 2.446 1.00 6.67 N ATOM 0 H ARG A 159 10.183 15.766 -0.797 1.00 1.51 H new ATOM 0 HA ARG A 159 12.335 14.039 0.282 1.00 1.67 H new ATOM 0 HB2 ARG A 159 9.644 13.449 -1.001 1.00 1.75 H new ATOM 0 HB3 ARG A 159 10.927 12.256 -1.004 1.00 1.75 H new ATOM 0 HG2 ARG A 159 9.754 13.551 1.496 1.00 2.80 H new ATOM 0 HG3 ARG A 159 9.321 11.964 0.891 1.00 2.80 H new ATOM 0 HD2 ARG A 159 12.067 12.824 1.895 1.00 4.04 H new ATOM 0 HD3 ARG A 159 10.944 11.762 2.722 1.00 4.04 H new ATOM 0 HE ARG A 159 11.389 10.562 0.221 1.00 4.94 H new ATOM 0 HH11 ARG A 159 12.860 8.863 -0.066 1.00 7.19 H new ATOM 0 HH12 ARG A 159 14.265 8.722 0.997 1.00 7.19 H new ATOM 0 HH21 ARG A 159 13.392 11.526 2.974 1.00 6.67 H new ATOM 0 HH22 ARG A 159 14.566 10.231 2.718 1.00 6.67 H new TER 2417 ARG A 159