USER MOD reduce.3.24.130724 H: found=0, std=0, add=1274, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1277 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 88 GLN : amide:sc= 0.00158 K(o=0.0073,f=-0.88) USER MOD Set 1.2: A 113 THR OG1 : rot -139:sc= 0.00577 USER MOD Set 2.1: A 71 CYS SG : rot -51:sc= 1.51 USER MOD Set 2.2: A 72 GLN : amide:sc= 1.04 K(o=2.6,f=0.43) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.328 X(o=-0.33,f=-0.11) USER MOD Single : A 15 SER OG : rot 100:sc= 0.287 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 THR OG1 : rot 80:sc= 1.21 USER MOD Single : A 24 LYS NZ :NH3+ -106:sc= 2.75 (180deg=-0.851) USER MOD Single : A 25 LYS NZ :NH3+ 147:sc= 0.00075 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 MET CE :methyl 171:sc= -6.67! (180deg=-7.17!) USER MOD Single : A 36 LYS NZ :NH3+ 178:sc= 0.959 (180deg=0.956) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -0.479 X(o=-0.48,f=0) USER MOD Single : A 50 ASN : amide:sc=-0.00392 K(o=-0.0039,f=-1.5) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -3.99! C(o=-4!,f=-3.6!) USER MOD Single : A 58 ASN : amide:sc= -0.631 K(o=-0.63,f=-2.1) USER MOD Single : A 60 GLN : amide:sc= -0.0457 K(o=-0.046,f=-1.2!) USER MOD Single : A 61 SER OG : rot -24:sc= 0.0848 USER MOD Single : A 63 LYS NZ :NH3+ -175:sc= 1.15 (180deg=1.13) USER MOD Single : A 64 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0443) USER MOD Single : A 67 TYR OH : rot 150:sc= -0.0559 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -128:sc= 1.83 (180deg=0.59) USER MOD Single : A 78 LYS NZ :NH3+ 146:sc= -0.0209 (180deg=-1.15) USER MOD Single : A 81 LYS NZ :NH3+ 169:sc= -0.0248 (180deg=-0.176) USER MOD Single : A 83 LYS NZ :NH3+ -168:sc= -1.14 (180deg=-1.5) USER MOD Single : A 85 THR OG1 : rot -160:sc= -0.183 USER MOD Single : A 89 HIS : no HD1:sc= -0.114 X(o=-0.11,f=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot 15:sc= -0.109 USER MOD Single : A 104 LYS NZ :NH3+ -159:sc= 1.36 (180deg=1.25) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 172:sc= 1.3 (180deg=1.18) USER MOD Single : A 109 MET CE :methyl -169:sc= 0 (180deg=-0.044) USER MOD Single : A 112 ASN : amide:sc= 1.08 K(o=1.1,f=-0.68) USER MOD Single : A 120 GLN : amide:sc= 0.294 X(o=0.29,f=0) USER MOD Single : A 125 MET CE :methyl -164:sc= -5.76! (180deg=-7.11!) USER MOD Single : A 126 SER OG : rot -83:sc= 0.623 USER MOD Single : A 130 LYS NZ :NH3+ -166:sc= 1.56 (180deg=1.03) USER MOD Single : A 132 SER OG : rot 142:sc= 0.339! USER MOD Single : A 133 SER OG : rot 180:sc= 0.0131 USER MOD Single : A 134 SER OG : rot -150:sc= 1.27 USER MOD Single : A 136 LYS NZ :NH3+ 166:sc= -0.0151 (180deg=-0.185) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 MET CE :methyl -105:sc= -2.41 (180deg=-9.19!) USER MOD Single : A 142 LYS NZ :NH3+ 162:sc= 1.3 (180deg=1.13) USER MOD Single : A 144 MET CE :methyl 175:sc= -0.75 (180deg=-0.79) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 SER OG : rot -177:sc= 0.522 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 3 -9.455 -7.304 -11.446 1.00 1.75 N ATOM 2 CA GLU A 3 -9.181 -6.132 -10.585 1.00 1.53 C ATOM 3 C GLU A 3 -10.477 -5.616 -9.965 1.00 1.23 C ATOM 4 O GLU A 3 -10.513 -4.537 -9.366 1.00 1.66 O ATOM 5 CB GLU A 3 -8.497 -5.015 -11.387 1.00 2.07 C ATOM 6 CG GLU A 3 -7.075 -5.340 -11.833 1.00 2.60 C ATOM 7 CD GLU A 3 -7.012 -6.394 -12.924 1.00 3.08 C ATOM 8 OE1 GLU A 3 -7.102 -7.596 -12.601 1.00 3.68 O ATOM 9 OE2 GLU A 3 -6.868 -6.022 -14.108 1.00 3.25 O ATOM 0 HA GLU A 3 -8.508 -6.445 -9.787 1.00 1.53 H new ATOM 0 HB2 GLU A 3 -9.100 -4.795 -12.268 1.00 2.07 H new ATOM 0 HB3 GLU A 3 -8.477 -4.109 -10.781 1.00 2.07 H new ATOM 0 HG2 GLU A 3 -6.597 -4.428 -12.191 1.00 2.60 H new ATOM 0 HG3 GLU A 3 -6.502 -5.684 -10.972 1.00 2.60 H new ATOM 18 N GLU A 4 -11.539 -6.398 -10.100 1.00 0.80 N ATOM 19 CA GLU A 4 -12.839 -6.017 -9.580 1.00 0.70 C ATOM 20 C GLU A 4 -12.900 -6.290 -8.081 1.00 0.61 C ATOM 21 O GLU A 4 -13.181 -5.393 -7.287 1.00 0.76 O ATOM 22 CB GLU A 4 -13.957 -6.777 -10.306 1.00 0.85 C ATOM 23 CG GLU A 4 -14.142 -6.386 -11.770 1.00 0.98 C ATOM 24 CD GLU A 4 -12.990 -6.808 -12.663 1.00 1.55 C ATOM 25 OE1 GLU A 4 -12.953 -7.983 -13.085 1.00 1.65 O ATOM 26 OE2 GLU A 4 -12.121 -5.967 -12.962 1.00 2.38 O ATOM 0 H GLU A 4 -11.522 -7.304 -10.568 1.00 0.80 H new ATOM 0 HA GLU A 4 -12.984 -4.951 -9.753 1.00 0.70 H new ATOM 0 HB2 GLU A 4 -13.747 -7.845 -10.252 1.00 0.85 H new ATOM 0 HB3 GLU A 4 -14.895 -6.610 -9.777 1.00 0.85 H new ATOM 0 HG2 GLU A 4 -15.063 -6.834 -12.143 1.00 0.98 H new ATOM 0 HG3 GLU A 4 -14.264 -5.305 -11.836 1.00 0.98 H new ATOM 33 N LYS A 5 -12.612 -7.522 -7.691 1.00 0.53 N ATOM 34 CA LYS A 5 -12.605 -7.883 -6.281 1.00 0.46 C ATOM 35 C LYS A 5 -11.249 -7.569 -5.669 1.00 0.34 C ATOM 36 O LYS A 5 -10.208 -7.928 -6.223 1.00 0.39 O ATOM 37 CB LYS A 5 -12.935 -9.364 -6.092 1.00 0.54 C ATOM 38 CG LYS A 5 -13.103 -9.772 -4.635 1.00 0.60 C ATOM 39 CD LYS A 5 -13.408 -11.256 -4.492 1.00 0.89 C ATOM 40 CE LYS A 5 -14.701 -11.635 -5.199 1.00 1.36 C ATOM 41 NZ LYS A 5 -14.991 -13.089 -5.094 1.00 1.61 N ATOM 0 H LYS A 5 -12.381 -8.285 -8.327 1.00 0.53 H new ATOM 0 HA LYS A 5 -13.372 -7.296 -5.775 1.00 0.46 H new ATOM 0 HB2 LYS A 5 -13.853 -9.595 -6.633 1.00 0.54 H new ATOM 0 HB3 LYS A 5 -12.142 -9.964 -6.539 1.00 0.54 H new ATOM 0 HG2 LYS A 5 -12.193 -9.534 -4.084 1.00 0.60 H new ATOM 0 HG3 LYS A 5 -13.909 -9.191 -4.186 1.00 0.60 H new ATOM 0 HD2 LYS A 5 -12.584 -11.838 -4.904 1.00 0.89 H new ATOM 0 HD3 LYS A 5 -13.482 -11.512 -3.435 1.00 0.89 H new ATOM 0 HE2 LYS A 5 -15.528 -11.069 -4.769 1.00 1.36 H new ATOM 0 HE3 LYS A 5 -14.635 -11.354 -6.250 1.00 1.36 H new ATOM 0 HZ1 LYS A 5 -15.880 -13.302 -5.589 1.00 1.61 H new ATOM 0 HZ2 LYS A 5 -14.215 -13.630 -5.527 1.00 1.61 H new ATOM 0 HZ3 LYS A 5 -15.081 -13.354 -4.092 1.00 1.61 H new ATOM 55 N GLY A 6 -11.266 -6.884 -4.540 1.00 0.26 N ATOM 56 CA GLY A 6 -10.031 -6.522 -3.878 1.00 0.20 C ATOM 57 C GLY A 6 -10.172 -5.240 -3.090 1.00 0.17 C ATOM 58 O GLY A 6 -11.274 -4.892 -2.660 1.00 0.24 O ATOM 0 H GLY A 6 -12.114 -6.571 -4.068 1.00 0.26 H new ATOM 0 HA2 GLY A 6 -9.727 -7.328 -3.210 1.00 0.20 H new ATOM 0 HA3 GLY A 6 -9.241 -6.408 -4.620 1.00 0.20 H new ATOM 62 N ALA A 7 -9.067 -4.535 -2.905 1.00 0.15 N ATOM 63 CA ALA A 7 -9.073 -3.280 -2.168 1.00 0.14 C ATOM 64 C ALA A 7 -8.486 -2.150 -3.007 1.00 0.14 C ATOM 65 O ALA A 7 -7.582 -2.373 -3.801 1.00 0.18 O ATOM 66 CB ALA A 7 -8.300 -3.431 -0.866 1.00 0.16 C ATOM 0 H ALA A 7 -8.150 -4.812 -3.257 1.00 0.15 H new ATOM 0 HA ALA A 7 -10.107 -3.026 -1.936 1.00 0.14 H new ATOM 0 HB1 ALA A 7 -8.312 -2.485 -0.324 1.00 0.16 H new ATOM 0 HB2 ALA A 7 -8.764 -4.205 -0.255 1.00 0.16 H new ATOM 0 HB3 ALA A 7 -7.270 -3.711 -1.085 1.00 0.16 H new ATOM 72 N TYR A 8 -9.016 -0.947 -2.847 1.00 0.12 N ATOM 73 CA TYR A 8 -8.494 0.229 -3.545 1.00 0.13 C ATOM 74 C TYR A 8 -8.094 1.306 -2.548 1.00 0.12 C ATOM 75 O TYR A 8 -8.823 1.581 -1.598 1.00 0.13 O ATOM 76 CB TYR A 8 -9.527 0.800 -4.527 1.00 0.16 C ATOM 77 CG TYR A 8 -9.430 0.245 -5.938 1.00 0.24 C ATOM 78 CD1 TYR A 8 -8.348 0.548 -6.756 1.00 0.31 C ATOM 79 CD2 TYR A 8 -10.432 -0.551 -6.463 1.00 0.39 C ATOM 80 CE1 TYR A 8 -8.275 0.073 -8.054 1.00 0.40 C ATOM 81 CE2 TYR A 8 -10.362 -1.036 -7.754 1.00 0.48 C ATOM 82 CZ TYR A 8 -9.285 -0.720 -8.545 1.00 0.45 C ATOM 83 OH TYR A 8 -9.224 -1.190 -9.835 1.00 0.57 O ATOM 0 H TYR A 8 -9.811 -0.754 -2.238 1.00 0.12 H new ATOM 0 HA TYR A 8 -7.617 -0.088 -4.109 1.00 0.13 H new ATOM 0 HB2 TYR A 8 -10.526 0.601 -4.140 1.00 0.16 H new ATOM 0 HB3 TYR A 8 -9.411 1.883 -4.568 1.00 0.16 H new ATOM 0 HD1 TYR A 8 -7.550 1.165 -6.372 1.00 0.31 H new ATOM 0 HD2 TYR A 8 -11.287 -0.798 -5.851 1.00 0.39 H new ATOM 0 HE1 TYR A 8 -7.430 0.324 -8.677 1.00 0.40 H new ATOM 0 HE2 TYR A 8 -11.152 -1.662 -8.141 1.00 0.48 H new ATOM 0 HH TYR A 8 -10.016 -1.736 -10.022 1.00 0.57 H new ATOM 93 N LEU A 9 -6.927 1.892 -2.769 1.00 0.12 N ATOM 94 CA LEU A 9 -6.447 3.001 -1.960 1.00 0.12 C ATOM 95 C LEU A 9 -6.908 4.294 -2.601 1.00 0.11 C ATOM 96 O LEU A 9 -6.535 4.594 -3.727 1.00 0.13 O ATOM 97 CB LEU A 9 -4.918 2.966 -1.876 1.00 0.12 C ATOM 98 CG LEU A 9 -4.249 3.877 -0.829 1.00 0.13 C ATOM 99 CD1 LEU A 9 -4.443 5.348 -1.134 1.00 0.16 C ATOM 100 CD2 LEU A 9 -4.743 3.561 0.571 1.00 0.12 C ATOM 0 H LEU A 9 -6.287 1.613 -3.513 1.00 0.12 H new ATOM 0 HA LEU A 9 -6.845 2.927 -0.948 1.00 0.12 H new ATOM 0 HB2 LEU A 9 -4.614 1.939 -1.673 1.00 0.12 H new ATOM 0 HB3 LEU A 9 -4.520 3.229 -2.856 1.00 0.12 H new ATOM 0 HG LEU A 9 -3.180 3.670 -0.879 1.00 0.13 H new ATOM 0 HD11 LEU A 9 -3.953 5.947 -0.366 1.00 0.16 H new ATOM 0 HD12 LEU A 9 -4.008 5.578 -2.107 1.00 0.16 H new ATOM 0 HD13 LEU A 9 -5.508 5.579 -1.149 1.00 0.16 H new ATOM 0 HD21 LEU A 9 -4.253 4.220 1.287 1.00 0.12 H new ATOM 0 HD22 LEU A 9 -5.822 3.711 0.619 1.00 0.12 H new ATOM 0 HD23 LEU A 9 -4.510 2.524 0.814 1.00 0.12 H new ATOM 112 N VAL A 10 -7.699 5.053 -1.887 1.00 0.12 N ATOM 113 CA VAL A 10 -8.290 6.257 -2.444 1.00 0.14 C ATOM 114 C VAL A 10 -7.842 7.484 -1.667 1.00 0.16 C ATOM 115 O VAL A 10 -7.621 7.418 -0.460 1.00 0.14 O ATOM 116 CB VAL A 10 -9.834 6.196 -2.435 1.00 0.16 C ATOM 117 CG1 VAL A 10 -10.393 6.790 -3.718 1.00 0.19 C ATOM 118 CG2 VAL A 10 -10.335 4.771 -2.224 1.00 0.16 C ATOM 0 H VAL A 10 -7.953 4.864 -0.917 1.00 0.12 H new ATOM 0 HA VAL A 10 -7.949 6.327 -3.477 1.00 0.14 H new ATOM 0 HB VAL A 10 -10.192 6.791 -1.595 1.00 0.16 H new ATOM 0 HG11 VAL A 10 -11.482 6.740 -3.698 1.00 0.19 H new ATOM 0 HG12 VAL A 10 -10.079 7.830 -3.805 1.00 0.19 H new ATOM 0 HG13 VAL A 10 -10.020 6.226 -4.573 1.00 0.19 H new ATOM 0 HG21 VAL A 10 -11.425 4.765 -2.223 1.00 0.16 H new ATOM 0 HG22 VAL A 10 -9.969 4.134 -3.029 1.00 0.16 H new ATOM 0 HG23 VAL A 10 -9.969 4.394 -1.269 1.00 0.16 H new ATOM 128 N PHE A 11 -7.684 8.590 -2.373 1.00 0.23 N ATOM 129 CA PHE A 11 -7.378 9.866 -1.749 1.00 0.27 C ATOM 130 C PHE A 11 -8.655 10.674 -1.596 1.00 0.33 C ATOM 131 O PHE A 11 -9.465 10.744 -2.519 1.00 0.42 O ATOM 132 CB PHE A 11 -6.363 10.638 -2.597 1.00 0.35 C ATOM 133 CG PHE A 11 -6.060 12.027 -2.098 1.00 0.48 C ATOM 134 CD1 PHE A 11 -5.275 12.227 -0.972 1.00 0.66 C ATOM 135 CD2 PHE A 11 -6.543 13.136 -2.776 1.00 0.72 C ATOM 136 CE1 PHE A 11 -4.982 13.502 -0.534 1.00 0.85 C ATOM 137 CE2 PHE A 11 -6.256 14.414 -2.336 1.00 0.90 C ATOM 138 CZ PHE A 11 -5.473 14.597 -1.216 1.00 0.90 C ATOM 0 H PHE A 11 -7.764 8.630 -3.389 1.00 0.23 H new ATOM 0 HA PHE A 11 -6.945 9.690 -0.765 1.00 0.27 H new ATOM 0 HB2 PHE A 11 -5.434 10.069 -2.636 1.00 0.35 H new ATOM 0 HB3 PHE A 11 -6.739 10.706 -3.618 1.00 0.35 H new ATOM 0 HD1 PHE A 11 -4.889 11.375 -0.432 1.00 0.66 H new ATOM 0 HD2 PHE A 11 -7.151 12.999 -3.658 1.00 0.72 H new ATOM 0 HE1 PHE A 11 -4.368 13.643 0.343 1.00 0.85 H new ATOM 0 HE2 PHE A 11 -6.645 15.269 -2.869 1.00 0.90 H new ATOM 0 HZ PHE A 11 -5.244 15.595 -0.873 1.00 0.90 H new ATOM 148 N ASP A 12 -8.849 11.259 -0.433 1.00 0.32 N ATOM 149 CA ASP A 12 -10.018 12.083 -0.194 1.00 0.39 C ATOM 150 C ASP A 12 -9.597 13.481 0.237 1.00 0.41 C ATOM 151 O ASP A 12 -8.502 13.674 0.768 1.00 0.36 O ATOM 152 CB ASP A 12 -10.918 11.449 0.867 1.00 0.42 C ATOM 153 CG ASP A 12 -12.288 12.089 0.902 1.00 0.52 C ATOM 154 OD1 ASP A 12 -13.208 11.573 0.240 1.00 0.58 O ATOM 155 OD2 ASP A 12 -12.451 13.108 1.607 1.00 0.61 O ATOM 0 H ASP A 12 -8.214 11.180 0.362 1.00 0.32 H new ATOM 0 HA ASP A 12 -10.583 12.157 -1.123 1.00 0.39 H new ATOM 0 HB2 ASP A 12 -11.021 10.383 0.665 1.00 0.42 H new ATOM 0 HB3 ASP A 12 -10.448 11.545 1.846 1.00 0.42 H new ATOM 160 N ASN A 13 -10.479 14.444 0.009 1.00 0.52 N ATOM 161 CA ASN A 13 -10.179 15.851 0.252 1.00 0.56 C ATOM 162 C ASN A 13 -10.443 16.241 1.703 1.00 0.57 C ATOM 163 O ASN A 13 -10.170 17.376 2.102 1.00 0.65 O ATOM 164 CB ASN A 13 -11.006 16.739 -0.685 1.00 0.71 C ATOM 165 CG ASN A 13 -12.504 16.576 -0.489 1.00 1.50 C ATOM 166 OD1 ASN A 13 -13.113 17.259 0.333 1.00 2.37 O ATOM 167 ND2 ASN A 13 -13.111 15.674 -1.244 1.00 2.16 N ATOM 0 H ASN A 13 -11.419 14.275 -0.348 1.00 0.52 H new ATOM 0 HA ASN A 13 -9.118 16.001 0.052 1.00 0.56 H new ATOM 0 HB2 ASN A 13 -10.735 17.782 -0.521 1.00 0.71 H new ATOM 0 HB3 ASN A 13 -10.753 16.502 -1.718 1.00 0.71 H new ATOM 0 HD21 ASN A 13 -14.116 15.527 -1.154 1.00 2.16 H new ATOM 0 HD22 ASN A 13 -12.573 15.126 -1.915 1.00 2.16 H new ATOM 174 N ALA A 14 -10.989 15.317 2.482 1.00 0.55 N ATOM 175 CA ALA A 14 -11.183 15.542 3.909 1.00 0.59 C ATOM 176 C ALA A 14 -9.842 15.810 4.582 1.00 0.66 C ATOM 177 O ALA A 14 -8.862 15.107 4.319 1.00 1.31 O ATOM 178 CB ALA A 14 -11.870 14.345 4.547 1.00 0.60 C ATOM 0 H ALA A 14 -11.305 14.406 2.151 1.00 0.55 H new ATOM 0 HA ALA A 14 -11.822 16.415 4.043 1.00 0.59 H new ATOM 0 HB1 ALA A 14 -12.007 14.529 5.612 1.00 0.60 H new ATOM 0 HB2 ALA A 14 -12.841 14.190 4.077 1.00 0.60 H new ATOM 0 HB3 ALA A 14 -11.255 13.456 4.409 1.00 0.60 H new ATOM 184 N SER A 15 -9.796 16.846 5.421 1.00 0.60 N ATOM 185 CA SER A 15 -8.561 17.254 6.093 1.00 0.54 C ATOM 186 C SER A 15 -7.459 17.558 5.076 1.00 0.52 C ATOM 187 O SER A 15 -6.269 17.417 5.368 1.00 0.53 O ATOM 188 CB SER A 15 -8.106 16.167 7.073 1.00 0.53 C ATOM 189 OG SER A 15 -9.057 15.989 8.115 1.00 1.23 O ATOM 0 H SER A 15 -10.606 17.421 5.653 1.00 0.60 H new ATOM 0 HA SER A 15 -8.762 18.167 6.653 1.00 0.54 H new ATOM 0 HB2 SER A 15 -7.966 15.227 6.539 1.00 0.53 H new ATOM 0 HB3 SER A 15 -7.140 16.438 7.500 1.00 0.53 H new ATOM 0 HG SER A 15 -9.613 15.206 7.920 1.00 1.23 H new ATOM 195 N ASN A 16 -7.883 17.967 3.878 1.00 0.53 N ATOM 196 CA ASN A 16 -6.981 18.279 2.769 1.00 0.57 C ATOM 197 C ASN A 16 -6.079 17.095 2.424 1.00 0.52 C ATOM 198 O ASN A 16 -4.975 17.278 1.908 1.00 0.68 O ATOM 199 CB ASN A 16 -6.124 19.511 3.082 1.00 0.66 C ATOM 200 CG ASN A 16 -6.936 20.786 3.189 1.00 0.76 C ATOM 201 OD1 ASN A 16 -7.436 21.132 4.257 1.00 1.08 O ATOM 202 ND2 ASN A 16 -7.060 21.504 2.085 1.00 1.30 N ATOM 0 H ASN A 16 -8.869 18.092 3.649 1.00 0.53 H new ATOM 0 HA ASN A 16 -7.607 18.496 1.904 1.00 0.57 H new ATOM 0 HB2 ASN A 16 -5.590 19.347 4.018 1.00 0.66 H new ATOM 0 HB3 ASN A 16 -5.371 19.631 2.303 1.00 0.66 H new ATOM 0 HD21 ASN A 16 -7.585 22.378 2.101 1.00 1.30 H new ATOM 0 HD22 ASN A 16 -6.630 21.184 1.217 1.00 1.30 H new ATOM 209 N GLY A 17 -6.544 15.885 2.704 1.00 0.39 N ATOM 210 CA GLY A 17 -5.758 14.708 2.397 1.00 0.34 C ATOM 211 C GLY A 17 -6.065 13.546 3.311 1.00 0.28 C ATOM 212 O GLY A 17 -5.660 13.544 4.467 1.00 0.29 O ATOM 0 H GLY A 17 -7.449 15.698 3.137 1.00 0.39 H new ATOM 0 HA2 GLY A 17 -5.944 14.412 1.365 1.00 0.34 H new ATOM 0 HA3 GLY A 17 -4.699 14.954 2.472 1.00 0.34 H new ATOM 216 N THR A 18 -6.785 12.564 2.799 1.00 0.27 N ATOM 217 CA THR A 18 -7.069 11.350 3.549 1.00 0.24 C ATOM 218 C THR A 18 -6.923 10.127 2.649 1.00 0.18 C ATOM 219 O THR A 18 -7.158 10.209 1.444 1.00 0.19 O ATOM 220 CB THR A 18 -8.494 11.376 4.147 1.00 0.30 C ATOM 221 OG1 THR A 18 -8.670 12.550 4.945 1.00 0.40 O ATOM 222 CG2 THR A 18 -8.752 10.145 5.004 1.00 0.33 C ATOM 0 H THR A 18 -7.187 12.583 1.862 1.00 0.27 H new ATOM 0 HA THR A 18 -6.351 11.294 4.367 1.00 0.24 H new ATOM 0 HB THR A 18 -9.203 11.382 3.320 1.00 0.30 H new ATOM 0 HG1 THR A 18 -8.856 13.316 4.363 1.00 0.40 H new ATOM 0 HG21 THR A 18 -9.762 10.190 5.411 1.00 0.33 H new ATOM 0 HG22 THR A 18 -8.647 9.248 4.393 1.00 0.33 H new ATOM 0 HG23 THR A 18 -8.032 10.114 5.822 1.00 0.33 H new ATOM 230 N LEU A 19 -6.518 9.005 3.232 1.00 0.15 N ATOM 231 CA LEU A 19 -6.454 7.752 2.503 1.00 0.13 C ATOM 232 C LEU A 19 -7.616 6.862 2.886 1.00 0.14 C ATOM 233 O LEU A 19 -8.076 6.869 4.029 1.00 0.21 O ATOM 234 CB LEU A 19 -5.154 7.004 2.769 1.00 0.14 C ATOM 235 CG LEU A 19 -3.887 7.711 2.319 1.00 0.24 C ATOM 236 CD1 LEU A 19 -2.735 6.724 2.307 1.00 0.54 C ATOM 237 CD2 LEU A 19 -4.091 8.341 0.946 1.00 0.58 C ATOM 0 H LEU A 19 -6.230 8.941 4.208 1.00 0.15 H new ATOM 0 HA LEU A 19 -6.501 7.998 1.442 1.00 0.13 H new ATOM 0 HB2 LEU A 19 -5.080 6.810 3.839 1.00 0.14 H new ATOM 0 HB3 LEU A 19 -5.205 6.035 2.272 1.00 0.14 H new ATOM 0 HG LEU A 19 -3.649 8.513 3.018 1.00 0.24 H new ATOM 0 HD11 LEU A 19 -1.825 7.230 1.984 1.00 0.54 H new ATOM 0 HD12 LEU A 19 -2.590 6.322 3.310 1.00 0.54 H new ATOM 0 HD13 LEU A 19 -2.961 5.910 1.619 1.00 0.54 H new ATOM 0 HD21 LEU A 19 -3.175 8.844 0.637 1.00 0.58 H new ATOM 0 HD22 LEU A 19 -4.341 7.565 0.223 1.00 0.58 H new ATOM 0 HD23 LEU A 19 -4.904 9.066 0.995 1.00 0.58 H new ATOM 249 N PHE A 20 -8.061 6.089 1.927 1.00 0.13 N ATOM 250 CA PHE A 20 -9.235 5.265 2.077 1.00 0.14 C ATOM 251 C PHE A 20 -8.999 3.916 1.414 1.00 0.13 C ATOM 252 O PHE A 20 -8.555 3.850 0.277 1.00 0.12 O ATOM 253 CB PHE A 20 -10.428 6.045 1.468 1.00 0.15 C ATOM 254 CG PHE A 20 -11.663 5.261 1.098 1.00 0.16 C ATOM 255 CD1 PHE A 20 -11.964 4.064 1.700 1.00 0.17 C ATOM 256 CD2 PHE A 20 -12.527 5.750 0.128 1.00 0.17 C ATOM 257 CE1 PHE A 20 -13.093 3.357 1.351 1.00 0.19 C ATOM 258 CE2 PHE A 20 -13.663 5.049 -0.228 1.00 0.19 C ATOM 259 CZ PHE A 20 -13.946 3.848 0.385 1.00 0.19 C ATOM 0 H PHE A 20 -7.615 6.013 1.013 1.00 0.13 H new ATOM 0 HA PHE A 20 -9.459 5.054 3.123 1.00 0.14 H new ATOM 0 HB2 PHE A 20 -10.722 6.817 2.179 1.00 0.15 H new ATOM 0 HB3 PHE A 20 -10.073 6.555 0.572 1.00 0.15 H new ATOM 0 HD1 PHE A 20 -11.305 3.671 2.460 1.00 0.17 H new ATOM 0 HD2 PHE A 20 -12.308 6.691 -0.355 1.00 0.17 H new ATOM 0 HE1 PHE A 20 -13.311 2.416 1.835 1.00 0.19 H new ATOM 0 HE2 PHE A 20 -14.327 5.441 -0.984 1.00 0.19 H new ATOM 0 HZ PHE A 20 -14.831 3.294 0.110 1.00 0.19 H new ATOM 269 N ILE A 21 -9.250 2.848 2.152 1.00 0.15 N ATOM 270 CA ILE A 21 -9.162 1.510 1.597 1.00 0.16 C ATOM 271 C ILE A 21 -10.557 0.927 1.431 1.00 0.18 C ATOM 272 O ILE A 21 -11.286 0.716 2.403 1.00 0.23 O ATOM 273 CB ILE A 21 -8.290 0.563 2.456 1.00 0.20 C ATOM 274 CG1 ILE A 21 -8.357 -0.858 1.889 1.00 0.24 C ATOM 275 CG2 ILE A 21 -8.721 0.586 3.919 1.00 0.24 C ATOM 276 CD1 ILE A 21 -7.506 -1.854 2.635 1.00 0.28 C ATOM 0 H ILE A 21 -9.516 2.882 3.136 1.00 0.15 H new ATOM 0 HA ILE A 21 -8.676 1.596 0.625 1.00 0.16 H new ATOM 0 HB ILE A 21 -7.258 0.912 2.417 1.00 0.20 H new ATOM 0 HG12 ILE A 21 -9.393 -1.196 1.905 1.00 0.24 H new ATOM 0 HG13 ILE A 21 -8.044 -0.837 0.845 1.00 0.24 H new ATOM 0 HG21 ILE A 21 -8.089 -0.090 4.495 1.00 0.24 H new ATOM 0 HG22 ILE A 21 -8.623 1.598 4.311 1.00 0.24 H new ATOM 0 HG23 ILE A 21 -9.760 0.266 3.997 1.00 0.24 H new ATOM 0 HD11 ILE A 21 -7.607 -2.836 2.174 1.00 0.28 H new ATOM 0 HD12 ILE A 21 -6.463 -1.541 2.598 1.00 0.28 H new ATOM 0 HD13 ILE A 21 -7.832 -1.906 3.674 1.00 0.28 H new ATOM 288 N VAL A 22 -10.938 0.711 0.189 1.00 0.16 N ATOM 289 CA VAL A 22 -12.252 0.188 -0.118 1.00 0.18 C ATOM 290 C VAL A 22 -12.204 -1.322 -0.329 1.00 0.18 C ATOM 291 O VAL A 22 -11.451 -1.826 -1.167 1.00 0.22 O ATOM 292 CB VAL A 22 -12.851 0.880 -1.362 1.00 0.21 C ATOM 293 CG1 VAL A 22 -11.986 0.647 -2.568 1.00 0.22 C ATOM 294 CG2 VAL A 22 -14.282 0.418 -1.612 1.00 0.24 C ATOM 0 H VAL A 22 -10.353 0.891 -0.627 1.00 0.16 H new ATOM 0 HA VAL A 22 -12.896 0.399 0.736 1.00 0.18 H new ATOM 0 HB VAL A 22 -12.880 1.953 -1.171 1.00 0.21 H new ATOM 0 HG11 VAL A 22 -12.426 1.143 -3.433 1.00 0.22 H new ATOM 0 HG12 VAL A 22 -10.991 1.052 -2.385 1.00 0.22 H new ATOM 0 HG13 VAL A 22 -11.913 -0.423 -2.762 1.00 0.22 H new ATOM 0 HG21 VAL A 22 -14.678 0.922 -2.494 1.00 0.24 H new ATOM 0 HG22 VAL A 22 -14.293 -0.660 -1.774 1.00 0.24 H new ATOM 0 HG23 VAL A 22 -14.899 0.661 -0.747 1.00 0.24 H new ATOM 304 N TRP A 23 -12.983 -2.039 0.455 1.00 0.19 N ATOM 305 CA TRP A 23 -13.147 -3.464 0.261 1.00 0.21 C ATOM 306 C TRP A 23 -14.415 -3.714 -0.535 1.00 0.24 C ATOM 307 O TRP A 23 -15.526 -3.567 -0.024 1.00 0.27 O ATOM 308 CB TRP A 23 -13.178 -4.204 1.601 1.00 0.23 C ATOM 309 CG TRP A 23 -11.815 -4.389 2.188 1.00 0.23 C ATOM 310 CD1 TRP A 23 -11.329 -3.849 3.344 1.00 0.29 C ATOM 311 CD2 TRP A 23 -10.749 -5.161 1.625 1.00 0.21 C ATOM 312 NE1 TRP A 23 -10.026 -4.245 3.536 1.00 0.31 N ATOM 313 CE2 TRP A 23 -9.648 -5.049 2.492 1.00 0.26 C ATOM 314 CE3 TRP A 23 -10.621 -5.937 0.470 1.00 0.22 C ATOM 315 CZ2 TRP A 23 -8.436 -5.683 2.236 1.00 0.28 C ATOM 316 CZ3 TRP A 23 -9.417 -6.565 0.219 1.00 0.26 C ATOM 317 CH2 TRP A 23 -8.338 -6.434 1.099 1.00 0.27 C ATOM 0 H TRP A 23 -13.515 -1.655 1.236 1.00 0.19 H new ATOM 0 HA TRP A 23 -12.294 -3.851 -0.296 1.00 0.21 H new ATOM 0 HB2 TRP A 23 -13.800 -3.649 2.304 1.00 0.23 H new ATOM 0 HB3 TRP A 23 -13.645 -5.179 1.463 1.00 0.23 H new ATOM 0 HD1 TRP A 23 -11.886 -3.206 4.009 1.00 0.29 H new ATOM 0 HE1 TRP A 23 -9.437 -3.983 4.326 1.00 0.31 H new ATOM 0 HE3 TRP A 23 -11.449 -6.044 -0.215 1.00 0.22 H new ATOM 0 HZ2 TRP A 23 -7.601 -5.585 2.914 1.00 0.28 H new ATOM 0 HZ3 TRP A 23 -9.307 -7.167 -0.671 1.00 0.26 H new ATOM 0 HH2 TRP A 23 -7.409 -6.937 0.875 1.00 0.27 H new ATOM 328 N LYS A 24 -14.240 -4.082 -1.792 1.00 0.25 N ATOM 329 CA LYS A 24 -15.350 -4.171 -2.725 1.00 0.28 C ATOM 330 C LYS A 24 -15.187 -5.375 -3.645 1.00 0.33 C ATOM 331 O LYS A 24 -14.159 -6.056 -3.636 1.00 0.39 O ATOM 332 CB LYS A 24 -15.423 -2.918 -3.595 1.00 0.29 C ATOM 333 CG LYS A 24 -14.363 -2.912 -4.664 1.00 0.35 C ATOM 334 CD LYS A 24 -13.068 -2.309 -4.167 1.00 0.61 C ATOM 335 CE LYS A 24 -11.862 -2.942 -4.832 1.00 1.14 C ATOM 336 NZ LYS A 24 -12.073 -3.197 -6.280 1.00 1.36 N ATOM 0 H LYS A 24 -13.334 -4.325 -2.192 1.00 0.25 H new ATOM 0 HA LYS A 24 -16.262 -4.273 -2.137 1.00 0.28 H new ATOM 0 HB2 LYS A 24 -16.407 -2.856 -4.060 1.00 0.29 H new ATOM 0 HB3 LYS A 24 -15.310 -2.034 -2.968 1.00 0.29 H new ATOM 0 HG2 LYS A 24 -14.183 -3.932 -5.003 1.00 0.35 H new ATOM 0 HG3 LYS A 24 -14.719 -2.348 -5.526 1.00 0.35 H new ATOM 0 HD2 LYS A 24 -13.069 -1.236 -4.360 1.00 0.61 H new ATOM 0 HD3 LYS A 24 -12.997 -2.438 -3.087 1.00 0.61 H new ATOM 0 HE2 LYS A 24 -10.998 -2.290 -4.704 1.00 1.14 H new ATOM 0 HE3 LYS A 24 -11.628 -3.882 -4.332 1.00 1.14 H new ATOM 0 HZ1 LYS A 24 -12.212 -4.216 -6.436 1.00 1.36 H new ATOM 0 HZ2 LYS A 24 -12.914 -2.679 -6.605 1.00 1.36 H new ATOM 0 HZ3 LYS A 24 -11.241 -2.875 -6.814 1.00 1.36 H new ATOM 350 N LYS A 25 -16.208 -5.601 -4.454 1.00 0.36 N ATOM 351 CA LYS A 25 -16.217 -6.681 -5.422 1.00 0.42 C ATOM 352 C LYS A 25 -16.390 -6.084 -6.814 1.00 0.45 C ATOM 353 O LYS A 25 -16.679 -6.783 -7.786 1.00 0.56 O ATOM 354 CB LYS A 25 -17.356 -7.669 -5.129 1.00 0.49 C ATOM 355 CG LYS A 25 -17.290 -8.339 -3.763 1.00 0.67 C ATOM 356 CD LYS A 25 -17.701 -7.390 -2.656 1.00 0.70 C ATOM 357 CE LYS A 25 -18.125 -8.134 -1.411 1.00 0.94 C ATOM 358 NZ LYS A 25 -18.696 -7.214 -0.393 1.00 1.94 N ATOM 0 H LYS A 25 -17.058 -5.037 -4.457 1.00 0.36 H new ATOM 0 HA LYS A 25 -15.276 -7.228 -5.361 1.00 0.42 H new ATOM 0 HB2 LYS A 25 -18.306 -7.141 -5.213 1.00 0.49 H new ATOM 0 HB3 LYS A 25 -17.353 -8.442 -5.897 1.00 0.49 H new ATOM 0 HG2 LYS A 25 -17.941 -9.213 -3.754 1.00 0.67 H new ATOM 0 HG3 LYS A 25 -16.276 -8.695 -3.580 1.00 0.67 H new ATOM 0 HD2 LYS A 25 -16.870 -6.727 -2.418 1.00 0.70 H new ATOM 0 HD3 LYS A 25 -18.522 -6.761 -3.002 1.00 0.70 H new ATOM 0 HE2 LYS A 25 -18.864 -8.892 -1.673 1.00 0.94 H new ATOM 0 HE3 LYS A 25 -17.267 -8.657 -0.989 1.00 0.94 H new ATOM 0 HZ1 LYS A 25 -19.439 -7.707 0.142 1.00 1.94 H new ATOM 0 HZ2 LYS A 25 -17.945 -6.908 0.258 1.00 1.94 H new ATOM 0 HZ3 LYS A 25 -19.104 -6.383 -0.866 1.00 1.94 H new ATOM 372 N GLU A 26 -16.195 -4.774 -6.888 1.00 0.40 N ATOM 373 CA GLU A 26 -16.401 -4.015 -8.115 1.00 0.45 C ATOM 374 C GLU A 26 -15.211 -3.093 -8.365 1.00 0.41 C ATOM 375 O GLU A 26 -14.399 -2.867 -7.478 1.00 0.42 O ATOM 376 CB GLU A 26 -17.684 -3.194 -7.993 1.00 0.49 C ATOM 377 CG GLU A 26 -17.663 -2.217 -6.829 1.00 1.23 C ATOM 378 CD GLU A 26 -19.008 -1.576 -6.578 1.00 1.20 C ATOM 379 OE1 GLU A 26 -19.348 -0.604 -7.282 1.00 1.45 O ATOM 380 OE2 GLU A 26 -19.728 -2.037 -5.667 1.00 1.19 O ATOM 0 H GLU A 26 -15.889 -4.207 -6.098 1.00 0.40 H new ATOM 0 HA GLU A 26 -16.491 -4.703 -8.955 1.00 0.45 H new ATOM 0 HB2 GLU A 26 -17.843 -2.642 -8.919 1.00 0.49 H new ATOM 0 HB3 GLU A 26 -18.530 -3.871 -7.875 1.00 0.49 H new ATOM 0 HG2 GLU A 26 -17.341 -2.739 -5.928 1.00 1.23 H new ATOM 0 HG3 GLU A 26 -16.926 -1.439 -7.027 1.00 1.23 H new ATOM 387 N LYS A 27 -15.099 -2.560 -9.562 1.00 0.48 N ATOM 388 CA LYS A 27 -13.978 -1.693 -9.885 1.00 0.49 C ATOM 389 C LYS A 27 -14.171 -0.291 -9.303 1.00 0.47 C ATOM 390 O LYS A 27 -15.274 0.262 -9.321 1.00 0.68 O ATOM 391 CB LYS A 27 -13.762 -1.630 -11.396 1.00 0.64 C ATOM 392 CG LYS A 27 -14.968 -1.125 -12.174 1.00 1.53 C ATOM 393 CD LYS A 27 -14.677 -1.047 -13.663 1.00 1.71 C ATOM 394 CE LYS A 27 -13.645 0.024 -13.982 1.00 1.60 C ATOM 395 NZ LYS A 27 -13.265 0.009 -15.417 1.00 2.35 N ATOM 0 H LYS A 27 -15.761 -2.707 -10.324 1.00 0.48 H new ATOM 0 HA LYS A 27 -13.085 -2.119 -9.428 1.00 0.49 H new ATOM 0 HB2 LYS A 27 -12.911 -0.981 -11.604 1.00 0.64 H new ATOM 0 HB3 LYS A 27 -13.500 -2.625 -11.757 1.00 0.64 H new ATOM 0 HG2 LYS A 27 -15.816 -1.787 -12.002 1.00 1.53 H new ATOM 0 HG3 LYS A 27 -15.253 -0.140 -11.806 1.00 1.53 H new ATOM 0 HD2 LYS A 27 -14.317 -2.014 -14.014 1.00 1.71 H new ATOM 0 HD3 LYS A 27 -15.600 -0.835 -14.203 1.00 1.71 H new ATOM 0 HE2 LYS A 27 -14.045 1.004 -13.721 1.00 1.60 H new ATOM 0 HE3 LYS A 27 -12.757 -0.131 -13.369 1.00 1.60 H new ATOM 0 HZ1 LYS A 27 -12.560 0.752 -15.597 1.00 2.35 H new ATOM 0 HZ2 LYS A 27 -12.860 -0.918 -15.659 1.00 2.35 H new ATOM 0 HZ3 LYS A 27 -14.108 0.182 -16.001 1.00 2.35 H new ATOM 409 N VAL A 28 -13.088 0.252 -8.758 1.00 0.43 N ATOM 410 CA VAL A 28 -13.080 1.590 -8.173 1.00 0.42 C ATOM 411 C VAL A 28 -12.035 2.444 -8.885 1.00 0.40 C ATOM 412 O VAL A 28 -10.925 1.976 -9.144 1.00 0.51 O ATOM 413 CB VAL A 28 -12.742 1.551 -6.662 1.00 0.52 C ATOM 414 CG1 VAL A 28 -12.725 2.952 -6.065 1.00 1.16 C ATOM 415 CG2 VAL A 28 -13.699 0.640 -5.896 1.00 1.07 C ATOM 0 H VAL A 28 -12.187 -0.224 -8.709 1.00 0.43 H new ATOM 0 HA VAL A 28 -14.077 2.014 -8.293 1.00 0.42 H new ATOM 0 HB VAL A 28 -11.740 1.132 -6.563 1.00 0.52 H new ATOM 0 HG11 VAL A 28 -12.485 2.892 -5.003 1.00 1.16 H new ATOM 0 HG12 VAL A 28 -11.973 3.555 -6.574 1.00 1.16 H new ATOM 0 HG13 VAL A 28 -13.705 3.413 -6.190 1.00 1.16 H new ATOM 0 HG21 VAL A 28 -13.431 0.637 -4.839 1.00 1.07 H new ATOM 0 HG22 VAL A 28 -14.719 1.005 -6.011 1.00 1.07 H new ATOM 0 HG23 VAL A 28 -13.630 -0.374 -6.290 1.00 1.07 H new ATOM 425 N GLU A 29 -12.381 3.676 -9.212 1.00 0.37 N ATOM 426 CA GLU A 29 -11.440 4.575 -9.860 1.00 0.37 C ATOM 427 C GLU A 29 -11.032 5.705 -8.921 1.00 0.32 C ATOM 428 O GLU A 29 -11.531 5.794 -7.796 1.00 0.33 O ATOM 429 CB GLU A 29 -12.032 5.136 -11.149 1.00 0.45 C ATOM 430 CG GLU A 29 -12.218 4.084 -12.230 1.00 0.74 C ATOM 431 CD GLU A 29 -12.609 4.683 -13.561 1.00 1.33 C ATOM 432 OE1 GLU A 29 -11.702 5.095 -14.319 1.00 1.80 O ATOM 433 OE2 GLU A 29 -13.820 4.743 -13.859 1.00 1.98 O ATOM 0 H GLU A 29 -13.303 4.077 -9.041 1.00 0.37 H new ATOM 0 HA GLU A 29 -10.546 4.004 -10.112 1.00 0.37 H new ATOM 0 HB2 GLU A 29 -12.996 5.596 -10.929 1.00 0.45 H new ATOM 0 HB3 GLU A 29 -11.381 5.925 -11.527 1.00 0.45 H new ATOM 0 HG2 GLU A 29 -11.292 3.521 -12.347 1.00 0.74 H new ATOM 0 HG3 GLU A 29 -12.984 3.376 -11.915 1.00 0.74 H new ATOM 440 N ASN A 30 -10.113 6.552 -9.393 1.00 0.33 N ATOM 441 CA ASN A 30 -9.552 7.644 -8.590 1.00 0.34 C ATOM 442 C ASN A 30 -8.729 7.094 -7.435 1.00 0.27 C ATOM 443 O ASN A 30 -8.510 7.770 -6.427 1.00 0.31 O ATOM 444 CB ASN A 30 -10.647 8.582 -8.065 1.00 0.40 C ATOM 445 CG ASN A 30 -11.087 9.595 -9.100 1.00 1.17 C ATOM 446 OD1 ASN A 30 -11.979 9.332 -9.908 1.00 1.67 O ATOM 447 ND2 ASN A 30 -10.471 10.765 -9.076 1.00 2.06 N ATOM 0 H ASN A 30 -9.737 6.501 -10.340 1.00 0.33 H new ATOM 0 HA ASN A 30 -8.900 8.226 -9.241 1.00 0.34 H new ATOM 0 HB2 ASN A 30 -11.507 7.991 -7.751 1.00 0.40 H new ATOM 0 HB3 ASN A 30 -10.280 9.105 -7.182 1.00 0.40 H new ATOM 0 HD21 ASN A 30 -10.730 11.491 -9.744 1.00 2.06 H new ATOM 0 HD22 ASN A 30 -9.737 10.941 -8.390 1.00 2.06 H new ATOM 454 N ALA A 31 -8.262 5.866 -7.602 1.00 0.21 N ATOM 455 CA ALA A 31 -7.489 5.195 -6.580 1.00 0.18 C ATOM 456 C ALA A 31 -5.999 5.263 -6.898 1.00 0.17 C ATOM 457 O ALA A 31 -5.595 5.292 -8.062 1.00 0.20 O ATOM 458 CB ALA A 31 -7.943 3.753 -6.443 1.00 0.17 C ATOM 0 H ALA A 31 -8.410 5.313 -8.446 1.00 0.21 H new ATOM 0 HA ALA A 31 -7.654 5.703 -5.630 1.00 0.18 H new ATOM 0 HB1 ALA A 31 -7.354 3.258 -5.671 1.00 0.17 H new ATOM 0 HB2 ALA A 31 -8.997 3.728 -6.167 1.00 0.17 H new ATOM 0 HB3 ALA A 31 -7.804 3.236 -7.393 1.00 0.17 H new ATOM 464 N LEU A 32 -5.200 5.301 -5.845 1.00 0.17 N ATOM 465 CA LEU A 32 -3.753 5.436 -5.953 1.00 0.18 C ATOM 466 C LEU A 32 -3.102 4.061 -5.899 1.00 0.17 C ATOM 467 O LEU A 32 -2.016 3.856 -6.418 1.00 0.19 O ATOM 468 CB LEU A 32 -3.202 6.287 -4.798 1.00 0.22 C ATOM 469 CG LEU A 32 -3.517 7.792 -4.806 1.00 0.29 C ATOM 470 CD1 LEU A 32 -4.851 8.100 -5.457 1.00 0.38 C ATOM 471 CD2 LEU A 32 -3.494 8.330 -3.387 1.00 0.28 C ATOM 0 H LEU A 32 -5.537 5.239 -4.884 1.00 0.17 H new ATOM 0 HA LEU A 32 -3.525 5.923 -6.901 1.00 0.18 H new ATOM 0 HB2 LEU A 32 -3.580 5.870 -3.864 1.00 0.22 H new ATOM 0 HB3 LEU A 32 -2.118 6.171 -4.783 1.00 0.22 H new ATOM 0 HG LEU A 32 -2.747 8.283 -5.402 1.00 0.29 H new ATOM 0 HD11 LEU A 32 -5.026 9.176 -5.437 1.00 0.38 H new ATOM 0 HD12 LEU A 32 -4.840 7.753 -6.490 1.00 0.38 H new ATOM 0 HD13 LEU A 32 -5.647 7.593 -4.912 1.00 0.38 H new ATOM 0 HD21 LEU A 32 -3.718 9.397 -3.399 1.00 0.28 H new ATOM 0 HD22 LEU A 32 -4.241 7.809 -2.788 1.00 0.28 H new ATOM 0 HD23 LEU A 32 -2.507 8.171 -2.954 1.00 0.28 H new ATOM 483 N MET A 33 -3.767 3.122 -5.232 1.00 0.15 N ATOM 484 CA MET A 33 -3.239 1.767 -5.078 1.00 0.14 C ATOM 485 C MET A 33 -4.364 0.737 -5.038 1.00 0.12 C ATOM 486 O MET A 33 -5.538 1.098 -4.954 1.00 0.12 O ATOM 487 CB MET A 33 -2.402 1.649 -3.813 1.00 0.14 C ATOM 488 CG MET A 33 -1.132 2.473 -3.822 1.00 0.17 C ATOM 489 SD MET A 33 -0.245 2.343 -2.268 1.00 0.17 S ATOM 490 CE MET A 33 -0.063 0.567 -2.159 1.00 0.20 C ATOM 0 H MET A 33 -4.673 3.273 -4.789 1.00 0.15 H new ATOM 0 HA MET A 33 -2.608 1.567 -5.944 1.00 0.14 H new ATOM 0 HB2 MET A 33 -3.010 1.951 -2.960 1.00 0.14 H new ATOM 0 HB3 MET A 33 -2.140 0.602 -3.662 1.00 0.14 H new ATOM 0 HG2 MET A 33 -0.489 2.141 -4.637 1.00 0.17 H new ATOM 0 HG3 MET A 33 -1.377 3.517 -4.015 1.00 0.17 H new ATOM 0 HE1 MET A 33 0.605 0.320 -1.334 1.00 0.20 H new ATOM 0 HE2 MET A 33 -1.038 0.111 -1.986 1.00 0.20 H new ATOM 0 HE3 MET A 33 0.355 0.186 -3.091 1.00 0.20 H new ATOM 500 N PHE A 34 -3.998 -0.543 -5.100 1.00 0.12 N ATOM 501 CA PHE A 34 -4.977 -1.623 -5.159 1.00 0.12 C ATOM 502 C PHE A 34 -4.423 -2.894 -4.501 1.00 0.11 C ATOM 503 O PHE A 34 -3.213 -3.072 -4.407 1.00 0.12 O ATOM 504 CB PHE A 34 -5.364 -1.873 -6.627 1.00 0.13 C ATOM 505 CG PHE A 34 -6.250 -3.068 -6.862 1.00 0.15 C ATOM 506 CD1 PHE A 34 -5.713 -4.267 -7.290 1.00 0.17 C ATOM 507 CD2 PHE A 34 -7.618 -2.988 -6.669 1.00 0.19 C ATOM 508 CE1 PHE A 34 -6.519 -5.362 -7.522 1.00 0.21 C ATOM 509 CE2 PHE A 34 -8.431 -4.081 -6.895 1.00 0.23 C ATOM 510 CZ PHE A 34 -7.881 -5.269 -7.323 1.00 0.23 C ATOM 0 H PHE A 34 -3.027 -0.856 -5.111 1.00 0.12 H new ATOM 0 HA PHE A 34 -5.870 -1.336 -4.604 1.00 0.12 H new ATOM 0 HB2 PHE A 34 -5.869 -0.986 -7.009 1.00 0.13 H new ATOM 0 HB3 PHE A 34 -4.452 -1.997 -7.211 1.00 0.13 H new ATOM 0 HD1 PHE A 34 -4.647 -4.348 -7.445 1.00 0.17 H new ATOM 0 HD2 PHE A 34 -8.056 -2.058 -6.337 1.00 0.19 H new ATOM 0 HE1 PHE A 34 -6.084 -6.291 -7.859 1.00 0.21 H new ATOM 0 HE2 PHE A 34 -9.497 -4.004 -6.736 1.00 0.23 H new ATOM 0 HZ PHE A 34 -8.514 -6.125 -7.502 1.00 0.23 H new ATOM 520 N ILE A 35 -5.319 -3.748 -4.026 1.00 0.11 N ATOM 521 CA ILE A 35 -4.959 -5.036 -3.436 1.00 0.12 C ATOM 522 C ILE A 35 -5.753 -6.135 -4.123 1.00 0.12 C ATOM 523 O ILE A 35 -6.973 -6.026 -4.253 1.00 0.16 O ATOM 524 CB ILE A 35 -5.273 -5.107 -1.918 1.00 0.13 C ATOM 525 CG1 ILE A 35 -4.446 -4.092 -1.123 1.00 0.13 C ATOM 526 CG2 ILE A 35 -5.025 -6.516 -1.394 1.00 0.15 C ATOM 527 CD1 ILE A 35 -4.777 -4.056 0.362 1.00 0.14 C ATOM 0 H ILE A 35 -6.323 -3.568 -4.038 1.00 0.11 H new ATOM 0 HA ILE A 35 -3.885 -5.160 -3.572 1.00 0.12 H new ATOM 0 HB ILE A 35 -6.325 -4.855 -1.784 1.00 0.13 H new ATOM 0 HG12 ILE A 35 -3.388 -4.325 -1.244 1.00 0.13 H new ATOM 0 HG13 ILE A 35 -4.604 -3.099 -1.545 1.00 0.13 H new ATOM 0 HG21 ILE A 35 -5.249 -6.552 -0.328 1.00 0.15 H new ATOM 0 HG22 ILE A 35 -5.667 -7.220 -1.924 1.00 0.15 H new ATOM 0 HG23 ILE A 35 -3.981 -6.786 -1.555 1.00 0.15 H new ATOM 0 HD11 ILE A 35 -4.151 -3.314 0.857 1.00 0.14 H new ATOM 0 HD12 ILE A 35 -5.826 -3.792 0.495 1.00 0.14 H new ATOM 0 HD13 ILE A 35 -4.592 -5.037 0.800 1.00 0.14 H new ATOM 539 N LYS A 36 -5.081 -7.189 -4.558 1.00 0.13 N ATOM 540 CA LYS A 36 -5.770 -8.296 -5.199 1.00 0.15 C ATOM 541 C LYS A 36 -5.544 -9.576 -4.399 1.00 0.16 C ATOM 542 O LYS A 36 -4.438 -10.106 -4.374 1.00 0.22 O ATOM 543 CB LYS A 36 -5.240 -8.470 -6.626 1.00 0.25 C ATOM 544 CG LYS A 36 -6.307 -8.830 -7.652 1.00 0.64 C ATOM 545 CD LYS A 36 -6.907 -10.205 -7.408 1.00 0.70 C ATOM 546 CE LYS A 36 -5.903 -11.317 -7.668 1.00 1.57 C ATOM 547 NZ LYS A 36 -6.530 -12.658 -7.527 1.00 2.38 N ATOM 0 H LYS A 36 -4.070 -7.301 -4.480 1.00 0.13 H new ATOM 0 HA LYS A 36 -6.839 -8.086 -5.236 1.00 0.15 H new ATOM 0 HB2 LYS A 36 -4.753 -7.545 -6.935 1.00 0.25 H new ATOM 0 HB3 LYS A 36 -4.476 -9.248 -6.625 1.00 0.25 H new ATOM 0 HG2 LYS A 36 -7.099 -8.082 -7.626 1.00 0.64 H new ATOM 0 HG3 LYS A 36 -5.872 -8.799 -8.651 1.00 0.64 H new ATOM 0 HD2 LYS A 36 -7.261 -10.269 -6.379 1.00 0.70 H new ATOM 0 HD3 LYS A 36 -7.775 -10.342 -8.053 1.00 0.70 H new ATOM 0 HE2 LYS A 36 -5.491 -11.210 -8.671 1.00 1.57 H new ATOM 0 HE3 LYS A 36 -5.070 -11.228 -6.970 1.00 1.57 H new ATOM 0 HZ1 LYS A 36 -5.828 -13.394 -7.744 1.00 2.38 H new ATOM 0 HZ2 LYS A 36 -6.871 -12.781 -6.552 1.00 2.38 H new ATOM 0 HZ3 LYS A 36 -7.330 -12.738 -8.186 1.00 2.38 H new ATOM 561 N PRO A 37 -6.584 -10.101 -3.745 1.00 0.17 N ATOM 562 CA PRO A 37 -6.490 -11.346 -2.988 1.00 0.21 C ATOM 563 C PRO A 37 -6.515 -12.579 -3.885 1.00 0.27 C ATOM 564 O PRO A 37 -7.368 -12.708 -4.764 1.00 0.35 O ATOM 565 CB PRO A 37 -7.734 -11.323 -2.085 1.00 0.24 C ATOM 566 CG PRO A 37 -8.339 -9.970 -2.265 1.00 0.23 C ATOM 567 CD PRO A 37 -7.919 -9.509 -3.627 1.00 0.18 C ATOM 0 HA PRO A 37 -5.550 -11.408 -2.440 1.00 0.21 H new ATOM 0 HB2 PRO A 37 -8.437 -12.107 -2.367 1.00 0.24 H new ATOM 0 HB3 PRO A 37 -7.465 -11.496 -1.043 1.00 0.24 H new ATOM 0 HG2 PRO A 37 -9.425 -10.014 -2.186 1.00 0.23 H new ATOM 0 HG3 PRO A 37 -7.991 -9.281 -1.495 1.00 0.23 H new ATOM 0 HD2 PRO A 37 -8.594 -9.865 -4.405 1.00 0.18 H new ATOM 0 HD3 PRO A 37 -7.892 -8.422 -3.701 1.00 0.18 H new ATOM 575 N THR A 38 -5.556 -13.466 -3.679 1.00 0.31 N ATOM 576 CA THR A 38 -5.560 -14.760 -4.339 1.00 0.38 C ATOM 577 C THR A 38 -6.311 -15.756 -3.482 1.00 0.44 C ATOM 578 O THR A 38 -6.894 -16.726 -3.969 1.00 0.54 O ATOM 579 CB THR A 38 -4.130 -15.249 -4.578 1.00 0.48 C ATOM 580 OG1 THR A 38 -3.364 -15.116 -3.372 1.00 0.86 O ATOM 581 CG2 THR A 38 -3.486 -14.440 -5.678 1.00 0.78 C ATOM 0 H THR A 38 -4.762 -13.312 -3.057 1.00 0.31 H new ATOM 0 HA THR A 38 -6.053 -14.663 -5.306 1.00 0.38 H new ATOM 0 HB THR A 38 -4.159 -16.298 -4.874 1.00 0.48 H new ATOM 0 HG1 THR A 38 -2.450 -15.432 -3.529 1.00 0.86 H new ATOM 0 HG21 THR A 38 -2.468 -14.794 -5.842 1.00 0.78 H new ATOM 0 HG22 THR A 38 -4.062 -14.552 -6.597 1.00 0.78 H new ATOM 0 HG23 THR A 38 -3.462 -13.389 -5.390 1.00 0.78 H new ATOM 589 N LYS A 39 -6.287 -15.486 -2.191 1.00 0.48 N ATOM 590 CA LYS A 39 -7.070 -16.233 -1.225 1.00 0.63 C ATOM 591 C LYS A 39 -8.453 -15.602 -1.135 1.00 0.58 C ATOM 592 O LYS A 39 -8.666 -14.501 -1.649 1.00 0.54 O ATOM 593 CB LYS A 39 -6.397 -16.185 0.146 1.00 0.78 C ATOM 594 CG LYS A 39 -4.929 -16.582 0.138 1.00 0.93 C ATOM 595 CD LYS A 39 -4.737 -18.070 -0.100 1.00 1.09 C ATOM 596 CE LYS A 39 -3.261 -18.436 -0.099 1.00 1.65 C ATOM 597 NZ LYS A 39 -3.042 -19.898 -0.250 1.00 2.16 N ATOM 0 H LYS A 39 -5.723 -14.741 -1.782 1.00 0.48 H new ATOM 0 HA LYS A 39 -7.148 -17.274 -1.540 1.00 0.63 H new ATOM 0 HB2 LYS A 39 -6.486 -15.175 0.546 1.00 0.78 H new ATOM 0 HB3 LYS A 39 -6.936 -16.845 0.825 1.00 0.78 H new ATOM 0 HG2 LYS A 39 -4.407 -16.022 -0.638 1.00 0.93 H new ATOM 0 HG3 LYS A 39 -4.475 -16.307 1.090 1.00 0.93 H new ATOM 0 HD2 LYS A 39 -5.256 -18.636 0.674 1.00 1.09 H new ATOM 0 HD3 LYS A 39 -5.184 -18.350 -1.054 1.00 1.09 H new ATOM 0 HE2 LYS A 39 -2.758 -17.910 -0.910 1.00 1.65 H new ATOM 0 HE3 LYS A 39 -2.806 -18.097 0.831 1.00 1.65 H new ATOM 0 HZ1 LYS A 39 -2.022 -20.099 -0.244 1.00 2.16 H new ATOM 0 HZ2 LYS A 39 -3.499 -20.401 0.538 1.00 2.16 H new ATOM 0 HZ3 LYS A 39 -3.452 -20.219 -1.150 1.00 2.16 H new ATOM 611 N GLU A 40 -9.391 -16.287 -0.500 1.00 0.66 N ATOM 612 CA GLU A 40 -10.715 -15.726 -0.297 1.00 0.64 C ATOM 613 C GLU A 40 -10.645 -14.629 0.753 1.00 0.57 C ATOM 614 O GLU A 40 -9.932 -14.753 1.749 1.00 0.62 O ATOM 615 CB GLU A 40 -11.717 -16.812 0.104 1.00 0.76 C ATOM 616 CG GLU A 40 -11.903 -17.867 -0.974 1.00 1.44 C ATOM 617 CD GLU A 40 -13.018 -18.843 -0.666 1.00 1.86 C ATOM 618 OE1 GLU A 40 -14.172 -18.574 -1.057 1.00 2.08 O ATOM 619 OE2 GLU A 40 -12.746 -19.895 -0.054 1.00 2.42 O ATOM 0 H GLU A 40 -9.261 -17.224 -0.120 1.00 0.66 H new ATOM 0 HA GLU A 40 -11.065 -15.295 -1.235 1.00 0.64 H new ATOM 0 HB2 GLU A 40 -11.378 -17.292 1.022 1.00 0.76 H new ATOM 0 HB3 GLU A 40 -12.679 -16.349 0.323 1.00 0.76 H new ATOM 0 HG2 GLU A 40 -12.112 -17.374 -1.924 1.00 1.44 H new ATOM 0 HG3 GLU A 40 -10.971 -18.418 -1.099 1.00 1.44 H new ATOM 626 N VAL A 41 -11.367 -13.551 0.512 1.00 0.53 N ATOM 627 CA VAL A 41 -11.247 -12.354 1.326 1.00 0.49 C ATOM 628 C VAL A 41 -12.161 -12.413 2.544 1.00 0.51 C ATOM 629 O VAL A 41 -13.331 -12.776 2.438 1.00 0.54 O ATOM 630 CB VAL A 41 -11.561 -11.079 0.516 1.00 0.53 C ATOM 631 CG1 VAL A 41 -10.398 -10.106 0.604 1.00 0.73 C ATOM 632 CG2 VAL A 41 -11.876 -11.410 -0.937 1.00 0.69 C ATOM 0 H VAL A 41 -12.047 -13.479 -0.245 1.00 0.53 H new ATOM 0 HA VAL A 41 -10.211 -12.311 1.661 1.00 0.49 H new ATOM 0 HB VAL A 41 -12.446 -10.611 0.947 1.00 0.53 H new ATOM 0 HG11 VAL A 41 -10.629 -9.209 0.029 1.00 0.73 H new ATOM 0 HG12 VAL A 41 -10.228 -9.835 1.646 1.00 0.73 H new ATOM 0 HG13 VAL A 41 -9.500 -10.574 0.200 1.00 0.73 H new ATOM 0 HG21 VAL A 41 -12.093 -10.491 -1.481 1.00 0.69 H new ATOM 0 HG22 VAL A 41 -11.019 -11.907 -1.391 1.00 0.69 H new ATOM 0 HG23 VAL A 41 -12.742 -12.070 -0.980 1.00 0.69 H new ATOM 642 N PRO A 42 -11.604 -12.070 3.718 1.00 0.55 N ATOM 643 CA PRO A 42 -12.336 -12.031 4.990 1.00 0.62 C ATOM 644 C PRO A 42 -13.654 -11.268 4.897 1.00 0.63 C ATOM 645 O PRO A 42 -13.680 -10.080 4.565 1.00 0.64 O ATOM 646 CB PRO A 42 -11.375 -11.287 5.909 1.00 0.68 C ATOM 647 CG PRO A 42 -10.027 -11.607 5.379 1.00 0.65 C ATOM 648 CD PRO A 42 -10.187 -11.704 3.894 1.00 0.58 C ATOM 0 HA PRO A 42 -12.612 -13.030 5.327 1.00 0.62 H new ATOM 0 HB2 PRO A 42 -11.563 -10.213 5.893 1.00 0.68 H new ATOM 0 HB3 PRO A 42 -11.482 -11.614 6.943 1.00 0.68 H new ATOM 0 HG2 PRO A 42 -9.308 -10.832 5.645 1.00 0.65 H new ATOM 0 HG3 PRO A 42 -9.655 -12.544 5.795 1.00 0.65 H new ATOM 0 HD2 PRO A 42 -9.954 -10.759 3.404 1.00 0.58 H new ATOM 0 HD3 PRO A 42 -9.523 -12.456 3.468 1.00 0.58 H new ATOM 656 N GLU A 43 -14.738 -11.956 5.233 1.00 0.69 N ATOM 657 CA GLU A 43 -16.074 -11.420 5.120 1.00 0.75 C ATOM 658 C GLU A 43 -16.295 -10.268 6.094 1.00 0.81 C ATOM 659 O GLU A 43 -16.959 -9.285 5.773 1.00 0.83 O ATOM 660 CB GLU A 43 -17.053 -12.541 5.410 1.00 0.85 C ATOM 661 CG GLU A 43 -18.488 -12.205 5.088 1.00 1.21 C ATOM 662 CD GLU A 43 -18.728 -12.017 3.605 1.00 1.68 C ATOM 663 OE1 GLU A 43 -18.658 -10.867 3.127 1.00 2.28 O ATOM 664 OE2 GLU A 43 -18.994 -13.021 2.907 1.00 1.87 O ATOM 0 H GLU A 43 -14.706 -12.909 5.594 1.00 0.69 H new ATOM 0 HA GLU A 43 -16.223 -11.027 4.114 1.00 0.75 H new ATOM 0 HB2 GLU A 43 -16.760 -13.421 4.838 1.00 0.85 H new ATOM 0 HB3 GLU A 43 -16.981 -12.808 6.464 1.00 0.85 H new ATOM 0 HG2 GLU A 43 -19.135 -13.001 5.458 1.00 1.21 H new ATOM 0 HG3 GLU A 43 -18.770 -11.294 5.615 1.00 1.21 H new ATOM 671 N PHE A 44 -15.715 -10.393 7.280 1.00 0.86 N ATOM 672 CA PHE A 44 -15.889 -9.405 8.338 1.00 0.97 C ATOM 673 C PHE A 44 -15.280 -8.065 7.948 1.00 0.96 C ATOM 674 O PHE A 44 -15.752 -7.012 8.373 1.00 1.02 O ATOM 675 CB PHE A 44 -15.303 -9.940 9.640 1.00 1.11 C ATOM 676 CG PHE A 44 -15.333 -8.978 10.795 1.00 1.69 C ATOM 677 CD1 PHE A 44 -14.194 -8.275 11.154 1.00 2.33 C ATOM 678 CD2 PHE A 44 -16.503 -8.761 11.505 1.00 1.86 C ATOM 679 CE1 PHE A 44 -14.221 -7.375 12.201 1.00 3.18 C ATOM 680 CE2 PHE A 44 -16.535 -7.864 12.554 1.00 2.66 C ATOM 681 CZ PHE A 44 -15.386 -7.231 12.953 1.00 3.34 C ATOM 0 H PHE A 44 -15.114 -11.177 7.536 1.00 0.86 H new ATOM 0 HA PHE A 44 -16.954 -9.230 8.489 1.00 0.97 H new ATOM 0 HB2 PHE A 44 -15.848 -10.840 9.923 1.00 1.11 H new ATOM 0 HB3 PHE A 44 -14.269 -10.236 9.461 1.00 1.11 H new ATOM 0 HD1 PHE A 44 -13.275 -8.433 10.609 1.00 2.33 H new ATOM 0 HD2 PHE A 44 -17.399 -9.299 11.235 1.00 1.86 H new ATOM 0 HE1 PHE A 44 -13.346 -6.787 12.436 1.00 3.18 H new ATOM 0 HE2 PHE A 44 -17.467 -7.661 13.061 1.00 2.66 H new ATOM 0 HZ PHE A 44 -15.384 -6.624 13.846 1.00 3.34 H new ATOM 691 N LYS A 45 -14.255 -8.099 7.110 1.00 0.90 N ATOM 692 CA LYS A 45 -13.644 -6.876 6.617 1.00 0.93 C ATOM 693 C LYS A 45 -14.588 -6.145 5.667 1.00 0.89 C ATOM 694 O LYS A 45 -14.487 -4.930 5.491 1.00 0.98 O ATOM 695 CB LYS A 45 -12.304 -7.176 5.944 1.00 0.94 C ATOM 696 CG LYS A 45 -11.152 -7.251 6.935 1.00 1.07 C ATOM 697 CD LYS A 45 -11.364 -8.332 7.980 1.00 1.09 C ATOM 698 CE LYS A 45 -10.346 -8.233 9.102 1.00 1.27 C ATOM 699 NZ LYS A 45 -8.967 -8.563 8.650 1.00 1.94 N ATOM 0 H LYS A 45 -13.831 -8.957 6.759 1.00 0.90 H new ATOM 0 HA LYS A 45 -13.453 -6.220 7.466 1.00 0.93 H new ATOM 0 HB2 LYS A 45 -12.376 -8.121 5.405 1.00 0.94 H new ATOM 0 HB3 LYS A 45 -12.092 -6.403 5.205 1.00 0.94 H new ATOM 0 HG2 LYS A 45 -10.224 -7.445 6.397 1.00 1.07 H new ATOM 0 HG3 LYS A 45 -11.038 -6.287 7.430 1.00 1.07 H new ATOM 0 HD2 LYS A 45 -12.370 -8.248 8.392 1.00 1.09 H new ATOM 0 HD3 LYS A 45 -11.293 -9.313 7.509 1.00 1.09 H new ATOM 0 HE2 LYS A 45 -10.359 -7.223 9.512 1.00 1.27 H new ATOM 0 HE3 LYS A 45 -10.632 -8.908 9.909 1.00 1.27 H new ATOM 0 HZ1 LYS A 45 -8.310 -8.481 9.452 1.00 1.94 H new ATOM 0 HZ2 LYS A 45 -8.945 -9.536 8.283 1.00 1.94 H new ATOM 0 HZ3 LYS A 45 -8.681 -7.903 7.899 1.00 1.94 H new ATOM 713 N PHE A 46 -15.518 -6.887 5.077 1.00 0.79 N ATOM 714 CA PHE A 46 -16.547 -6.291 4.236 1.00 0.78 C ATOM 715 C PHE A 46 -17.733 -5.839 5.085 1.00 0.83 C ATOM 716 O PHE A 46 -18.132 -4.679 5.039 1.00 0.93 O ATOM 717 CB PHE A 46 -17.047 -7.282 3.177 1.00 0.74 C ATOM 718 CG PHE A 46 -16.012 -7.712 2.176 1.00 0.65 C ATOM 719 CD1 PHE A 46 -15.634 -9.039 2.083 1.00 0.72 C ATOM 720 CD2 PHE A 46 -15.430 -6.795 1.317 1.00 0.64 C ATOM 721 CE1 PHE A 46 -14.697 -9.446 1.155 1.00 0.66 C ATOM 722 CE2 PHE A 46 -14.489 -7.194 0.387 1.00 0.58 C ATOM 723 CZ PHE A 46 -14.122 -8.522 0.306 1.00 0.54 C ATOM 0 H PHE A 46 -15.580 -7.901 5.166 1.00 0.79 H new ATOM 0 HA PHE A 46 -16.099 -5.433 3.735 1.00 0.78 H new ATOM 0 HB2 PHE A 46 -17.433 -8.167 3.682 1.00 0.74 H new ATOM 0 HB3 PHE A 46 -17.883 -6.830 2.643 1.00 0.74 H new ATOM 0 HD1 PHE A 46 -16.078 -9.767 2.746 1.00 0.72 H new ATOM 0 HD2 PHE A 46 -15.715 -5.755 1.375 1.00 0.64 H new ATOM 0 HE1 PHE A 46 -14.414 -10.486 1.093 1.00 0.66 H new ATOM 0 HE2 PHE A 46 -14.041 -6.468 -0.275 1.00 0.58 H new ATOM 0 HZ PHE A 46 -13.387 -8.837 -0.420 1.00 0.54 H new ATOM 733 N VAL A 47 -18.265 -6.757 5.887 1.00 0.81 N ATOM 734 CA VAL A 47 -19.509 -6.522 6.612 1.00 0.88 C ATOM 735 C VAL A 47 -19.351 -5.486 7.724 1.00 0.87 C ATOM 736 O VAL A 47 -20.237 -4.656 7.933 1.00 0.92 O ATOM 737 CB VAL A 47 -20.090 -7.837 7.189 1.00 0.97 C ATOM 738 CG1 VAL A 47 -19.078 -8.566 8.061 1.00 0.98 C ATOM 739 CG2 VAL A 47 -21.371 -7.560 7.954 1.00 1.07 C ATOM 0 H VAL A 47 -17.851 -7.675 6.051 1.00 0.81 H new ATOM 0 HA VAL A 47 -20.212 -6.120 5.882 1.00 0.88 H new ATOM 0 HB VAL A 47 -20.323 -8.494 6.351 1.00 0.97 H new ATOM 0 HG11 VAL A 47 -19.524 -9.483 8.447 1.00 0.98 H new ATOM 0 HG12 VAL A 47 -18.197 -8.812 7.468 1.00 0.98 H new ATOM 0 HG13 VAL A 47 -18.787 -7.926 8.894 1.00 0.98 H new ATOM 0 HG21 VAL A 47 -21.766 -8.494 8.353 1.00 1.07 H new ATOM 0 HG22 VAL A 47 -21.163 -6.874 8.775 1.00 1.07 H new ATOM 0 HG23 VAL A 47 -22.105 -7.112 7.284 1.00 1.07 H new ATOM 749 N ASN A 48 -18.224 -5.510 8.422 1.00 0.86 N ATOM 750 CA ASN A 48 -18.028 -4.610 9.550 1.00 0.90 C ATOM 751 C ASN A 48 -17.767 -3.192 9.070 1.00 0.82 C ATOM 752 O ASN A 48 -18.313 -2.230 9.609 1.00 0.91 O ATOM 753 CB ASN A 48 -16.864 -5.078 10.429 1.00 0.96 C ATOM 754 CG ASN A 48 -16.622 -4.175 11.631 1.00 1.07 C ATOM 755 OD1 ASN A 48 -15.478 -3.949 12.027 1.00 1.50 O ATOM 756 ND2 ASN A 48 -17.689 -3.681 12.241 1.00 1.66 N ATOM 0 H ASN A 48 -17.440 -6.134 8.231 1.00 0.86 H new ATOM 0 HA ASN A 48 -18.943 -4.621 10.143 1.00 0.90 H new ATOM 0 HB2 ASN A 48 -17.064 -6.091 10.778 1.00 0.96 H new ATOM 0 HB3 ASN A 48 -15.957 -5.122 9.827 1.00 0.96 H new ATOM 0 HD21 ASN A 48 -17.578 -3.093 13.067 1.00 1.66 H new ATOM 0 HD22 ASN A 48 -18.622 -3.889 11.885 1.00 1.66 H new ATOM 763 N ARG A 49 -16.947 -3.074 8.040 1.00 0.69 N ATOM 764 CA ARG A 49 -16.523 -1.773 7.545 1.00 0.63 C ATOM 765 C ARG A 49 -17.495 -1.227 6.505 1.00 0.58 C ATOM 766 O ARG A 49 -17.413 -0.060 6.121 1.00 0.57 O ATOM 767 CB ARG A 49 -15.128 -1.883 6.946 1.00 0.59 C ATOM 768 CG ARG A 49 -14.097 -2.440 7.908 1.00 0.92 C ATOM 769 CD ARG A 49 -12.740 -2.623 7.245 1.00 1.01 C ATOM 770 NE ARG A 49 -11.765 -3.233 8.152 1.00 1.28 N ATOM 771 CZ ARG A 49 -10.475 -3.408 7.858 1.00 1.45 C ATOM 772 NH1 ARG A 49 -9.993 -2.997 6.691 1.00 1.66 N ATOM 773 NH2 ARG A 49 -9.662 -3.983 8.736 1.00 2.00 N ATOM 0 H ARG A 49 -16.559 -3.866 7.527 1.00 0.69 H new ATOM 0 HA ARG A 49 -16.509 -1.078 8.385 1.00 0.63 H new ATOM 0 HB2 ARG A 49 -15.170 -2.520 6.063 1.00 0.59 H new ATOM 0 HB3 ARG A 49 -14.806 -0.897 6.612 1.00 0.59 H new ATOM 0 HG2 ARG A 49 -13.996 -1.768 8.761 1.00 0.92 H new ATOM 0 HG3 ARG A 49 -14.443 -3.398 8.296 1.00 0.92 H new ATOM 0 HD2 ARG A 49 -12.851 -3.247 6.358 1.00 1.01 H new ATOM 0 HD3 ARG A 49 -12.367 -1.655 6.909 1.00 1.01 H new ATOM 0 HE ARG A 49 -12.093 -3.544 9.067 1.00 1.28 H new ATOM 0 HH11 ARG A 49 -10.609 -2.546 6.015 1.00 1.66 H new ATOM 0 HH12 ARG A 49 -9.006 -3.133 6.470 1.00 1.66 H new ATOM 0 HH21 ARG A 49 -10.023 -4.293 9.638 1.00 2.00 H new ATOM 0 HH22 ARG A 49 -8.677 -4.115 8.508 1.00 2.00 H new ATOM 787 N ASN A 50 -18.411 -2.087 6.051 1.00 0.60 N ATOM 788 CA ASN A 50 -19.350 -1.750 4.973 1.00 0.63 C ATOM 789 C ASN A 50 -18.591 -1.484 3.681 1.00 0.54 C ATOM 790 O ASN A 50 -19.106 -0.875 2.743 1.00 0.61 O ATOM 791 CB ASN A 50 -20.210 -0.540 5.344 1.00 0.71 C ATOM 792 CG ASN A 50 -21.256 -0.860 6.399 1.00 1.46 C ATOM 793 OD1 ASN A 50 -21.075 -1.755 7.223 1.00 2.26 O ATOM 794 ND2 ASN A 50 -22.356 -0.124 6.386 1.00 2.05 N ATOM 0 H ASN A 50 -18.524 -3.032 6.417 1.00 0.60 H new ATOM 0 HA ASN A 50 -20.016 -2.601 4.826 1.00 0.63 H new ATOM 0 HB2 ASN A 50 -19.565 0.259 5.709 1.00 0.71 H new ATOM 0 HB3 ASN A 50 -20.707 -0.165 4.449 1.00 0.71 H new ATOM 0 HD21 ASN A 50 -23.089 -0.291 7.075 1.00 2.05 H new ATOM 0 HD22 ASN A 50 -22.470 0.610 5.687 1.00 2.05 H new ATOM 801 N GLY A 51 -17.348 -1.944 3.666 1.00 0.46 N ATOM 802 CA GLY A 51 -16.482 -1.793 2.517 1.00 0.41 C ATOM 803 C GLY A 51 -15.691 -0.499 2.547 1.00 0.33 C ATOM 804 O GLY A 51 -14.717 -0.347 1.813 1.00 0.34 O ATOM 0 H GLY A 51 -16.917 -2.431 4.452 1.00 0.46 H new ATOM 0 HA2 GLY A 51 -15.792 -2.635 2.474 1.00 0.41 H new ATOM 0 HA3 GLY A 51 -17.082 -1.826 1.608 1.00 0.41 H new ATOM 808 N LYS A 52 -16.094 0.425 3.403 1.00 0.29 N ATOM 809 CA LYS A 52 -15.434 1.719 3.488 1.00 0.29 C ATOM 810 C LYS A 52 -14.606 1.838 4.762 1.00 0.30 C ATOM 811 O LYS A 52 -15.092 1.552 5.857 1.00 0.36 O ATOM 812 CB LYS A 52 -16.464 2.843 3.413 1.00 0.34 C ATOM 813 CG LYS A 52 -17.301 2.821 2.151 1.00 1.14 C ATOM 814 CD LYS A 52 -18.234 4.009 2.114 1.00 1.28 C ATOM 815 CE LYS A 52 -18.969 4.165 3.430 1.00 1.67 C ATOM 816 NZ LYS A 52 -19.949 5.281 3.400 1.00 2.43 N ATOM 0 H LYS A 52 -16.874 0.304 4.049 1.00 0.29 H new ATOM 0 HA LYS A 52 -14.754 1.806 2.641 1.00 0.29 H new ATOM 0 HB2 LYS A 52 -17.125 2.776 4.277 1.00 0.34 H new ATOM 0 HB3 LYS A 52 -15.948 3.801 3.479 1.00 0.34 H new ATOM 0 HG2 LYS A 52 -16.651 2.834 1.276 1.00 1.14 H new ATOM 0 HG3 LYS A 52 -17.877 1.897 2.106 1.00 1.14 H new ATOM 0 HD2 LYS A 52 -17.666 4.915 1.901 1.00 1.28 H new ATOM 0 HD3 LYS A 52 -18.953 3.886 1.304 1.00 1.28 H new ATOM 0 HE2 LYS A 52 -19.487 3.236 3.666 1.00 1.67 H new ATOM 0 HE3 LYS A 52 -18.247 4.340 4.228 1.00 1.67 H new ATOM 0 HZ1 LYS A 52 -20.427 5.349 4.321 1.00 2.43 H new ATOM 0 HZ2 LYS A 52 -19.453 6.173 3.201 1.00 2.43 H new ATOM 0 HZ3 LYS A 52 -20.654 5.104 2.657 1.00 2.43 H new ATOM 830 N ASN A 53 -13.353 2.249 4.621 1.00 0.30 N ATOM 831 CA ASN A 53 -12.479 2.443 5.773 1.00 0.34 C ATOM 832 C ASN A 53 -11.464 3.549 5.490 1.00 0.27 C ATOM 833 O ASN A 53 -10.660 3.443 4.562 1.00 0.24 O ATOM 834 CB ASN A 53 -11.754 1.129 6.105 1.00 0.43 C ATOM 835 CG ASN A 53 -11.104 1.100 7.488 1.00 1.14 C ATOM 836 OD1 ASN A 53 -11.022 0.045 8.115 1.00 1.72 O ATOM 837 ND2 ASN A 53 -10.626 2.235 7.972 1.00 2.05 N ATOM 0 H ASN A 53 -12.918 2.455 3.722 1.00 0.30 H new ATOM 0 HA ASN A 53 -13.085 2.741 6.629 1.00 0.34 H new ATOM 0 HB2 ASN A 53 -12.466 0.307 6.034 1.00 0.43 H new ATOM 0 HB3 ASN A 53 -10.986 0.951 5.352 1.00 0.43 H new ATOM 0 HD21 ASN A 53 -10.176 2.250 8.887 1.00 2.05 H new ATOM 0 HD22 ASN A 53 -10.708 3.095 7.430 1.00 2.05 H new ATOM 844 N GLU A 54 -11.498 4.603 6.296 1.00 0.30 N ATOM 845 CA GLU A 54 -10.513 5.671 6.192 1.00 0.28 C ATOM 846 C GLU A 54 -9.267 5.302 6.980 1.00 0.28 C ATOM 847 O GLU A 54 -9.333 5.036 8.181 1.00 0.40 O ATOM 848 CB GLU A 54 -11.069 7.004 6.695 1.00 0.33 C ATOM 849 CG GLU A 54 -12.192 7.566 5.841 1.00 0.35 C ATOM 850 CD GLU A 54 -13.526 6.905 6.119 1.00 0.87 C ATOM 851 OE1 GLU A 54 -14.013 6.160 5.243 1.00 1.15 O ATOM 852 OE2 GLU A 54 -14.091 7.125 7.207 1.00 1.47 O ATOM 0 H GLU A 54 -12.196 4.741 7.027 1.00 0.30 H new ATOM 0 HA GLU A 54 -10.261 5.791 5.138 1.00 0.28 H new ATOM 0 HB2 GLU A 54 -11.432 6.873 7.714 1.00 0.33 H new ATOM 0 HB3 GLU A 54 -10.259 7.732 6.736 1.00 0.33 H new ATOM 0 HG2 GLU A 54 -12.278 8.638 6.021 1.00 0.35 H new ATOM 0 HG3 GLU A 54 -11.941 7.439 4.788 1.00 0.35 H new ATOM 859 N LEU A 55 -8.142 5.286 6.291 1.00 0.21 N ATOM 860 CA LEU A 55 -6.880 4.848 6.866 1.00 0.22 C ATOM 861 C LEU A 55 -6.204 5.950 7.658 1.00 0.24 C ATOM 862 O LEU A 55 -6.023 5.850 8.871 1.00 0.32 O ATOM 863 CB LEU A 55 -5.939 4.400 5.754 1.00 0.21 C ATOM 864 CG LEU A 55 -6.133 2.975 5.261 1.00 0.20 C ATOM 865 CD1 LEU A 55 -5.376 2.773 3.965 1.00 0.45 C ATOM 866 CD2 LEU A 55 -5.656 1.991 6.316 1.00 0.54 C ATOM 0 H LEU A 55 -8.075 5.576 5.315 1.00 0.21 H new ATOM 0 HA LEU A 55 -7.100 4.023 7.543 1.00 0.22 H new ATOM 0 HB2 LEU A 55 -6.058 5.077 4.908 1.00 0.21 H new ATOM 0 HB3 LEU A 55 -4.913 4.507 6.106 1.00 0.21 H new ATOM 0 HG LEU A 55 -7.193 2.799 5.078 1.00 0.20 H new ATOM 0 HD11 LEU A 55 -5.518 1.750 3.616 1.00 0.45 H new ATOM 0 HD12 LEU A 55 -5.750 3.468 3.213 1.00 0.45 H new ATOM 0 HD13 LEU A 55 -4.314 2.955 4.132 1.00 0.45 H new ATOM 0 HD21 LEU A 55 -5.799 0.973 5.955 1.00 0.54 H new ATOM 0 HD22 LEU A 55 -4.598 2.159 6.519 1.00 0.54 H new ATOM 0 HD23 LEU A 55 -6.228 2.134 7.232 1.00 0.54 H new ATOM 878 N ILE A 56 -5.835 7.004 6.961 1.00 0.21 N ATOM 879 CA ILE A 56 -5.010 8.042 7.538 1.00 0.22 C ATOM 880 C ILE A 56 -5.399 9.386 6.937 1.00 0.22 C ATOM 881 O ILE A 56 -5.811 9.446 5.781 1.00 0.22 O ATOM 882 CB ILE A 56 -3.516 7.729 7.274 1.00 0.21 C ATOM 883 CG1 ILE A 56 -2.611 8.620 8.125 1.00 0.23 C ATOM 884 CG2 ILE A 56 -3.194 7.911 5.800 1.00 0.18 C ATOM 885 CD1 ILE A 56 -1.167 8.168 8.152 1.00 0.25 C ATOM 0 H ILE A 56 -6.096 7.164 5.988 1.00 0.21 H new ATOM 0 HA ILE A 56 -5.165 8.084 8.616 1.00 0.22 H new ATOM 0 HB ILE A 56 -3.332 6.691 7.553 1.00 0.21 H new ATOM 0 HG12 ILE A 56 -2.657 9.640 7.743 1.00 0.23 H new ATOM 0 HG13 ILE A 56 -2.994 8.644 9.145 1.00 0.23 H new ATOM 0 HG21 ILE A 56 -2.141 7.688 5.627 1.00 0.18 H new ATOM 0 HG22 ILE A 56 -3.810 7.235 5.207 1.00 0.18 H new ATOM 0 HG23 ILE A 56 -3.400 8.941 5.507 1.00 0.18 H new ATOM 0 HD11 ILE A 56 -0.585 8.847 8.775 1.00 0.25 H new ATOM 0 HD12 ILE A 56 -1.109 7.160 8.562 1.00 0.25 H new ATOM 0 HD13 ILE A 56 -0.766 8.171 7.139 1.00 0.25 H new ATOM 897 N ARG A 57 -5.290 10.455 7.709 1.00 0.26 N ATOM 898 CA ARG A 57 -5.765 11.750 7.247 1.00 0.27 C ATOM 899 C ARG A 57 -4.769 12.865 7.547 1.00 0.29 C ATOM 900 O ARG A 57 -3.762 12.645 8.221 1.00 0.34 O ATOM 901 CB ARG A 57 -7.128 12.070 7.868 1.00 0.37 C ATOM 902 CG ARG A 57 -7.099 12.285 9.372 1.00 0.49 C ATOM 903 CD ARG A 57 -7.420 13.728 9.712 1.00 0.88 C ATOM 904 NE ARG A 57 -7.364 13.999 11.143 1.00 1.34 N ATOM 905 CZ ARG A 57 -7.586 15.202 11.672 1.00 1.83 C ATOM 906 NH1 ARG A 57 -7.959 16.210 10.889 1.00 1.96 N ATOM 907 NH2 ARG A 57 -7.463 15.391 12.979 1.00 2.23 N ATOM 0 H ARG A 57 -4.883 10.454 8.644 1.00 0.26 H new ATOM 0 HA ARG A 57 -5.871 11.691 6.164 1.00 0.27 H new ATOM 0 HB2 ARG A 57 -7.528 12.966 7.393 1.00 0.37 H new ATOM 0 HB3 ARG A 57 -7.816 11.255 7.643 1.00 0.37 H new ATOM 0 HG2 ARG A 57 -7.819 11.624 9.853 1.00 0.49 H new ATOM 0 HG3 ARG A 57 -6.116 12.024 9.763 1.00 0.49 H new ATOM 0 HD2 ARG A 57 -6.718 14.383 9.196 1.00 0.88 H new ATOM 0 HD3 ARG A 57 -8.415 13.971 9.340 1.00 0.88 H new ATOM 0 HE ARG A 57 -7.143 13.227 11.773 1.00 1.34 H new ATOM 0 HH11 ARG A 57 -8.074 16.061 9.887 1.00 1.96 H new ATOM 0 HH12 ARG A 57 -8.130 17.132 11.291 1.00 1.96 H new ATOM 0 HH21 ARG A 57 -7.197 14.614 13.584 1.00 2.23 H new ATOM 0 HH22 ARG A 57 -7.634 16.314 13.379 1.00 2.23 H new ATOM 921 N ASN A 58 -5.071 14.051 7.014 1.00 0.30 N ATOM 922 CA ASN A 58 -4.257 15.251 7.194 1.00 0.33 C ATOM 923 C ASN A 58 -2.923 15.116 6.454 1.00 0.31 C ATOM 924 O ASN A 58 -1.873 15.544 6.932 1.00 0.33 O ATOM 925 CB ASN A 58 -4.043 15.525 8.687 1.00 0.39 C ATOM 926 CG ASN A 58 -3.316 16.828 8.967 1.00 0.46 C ATOM 927 OD1 ASN A 58 -3.483 17.820 8.254 1.00 1.01 O ATOM 928 ND2 ASN A 58 -2.494 16.827 10.004 1.00 1.40 N ATOM 0 H ASN A 58 -5.899 14.205 6.438 1.00 0.30 H new ATOM 0 HA ASN A 58 -4.786 16.103 6.766 1.00 0.33 H new ATOM 0 HB2 ASN A 58 -5.011 15.544 9.187 1.00 0.39 H new ATOM 0 HB3 ASN A 58 -3.476 14.702 9.122 1.00 0.39 H new ATOM 0 HD21 ASN A 58 -1.969 17.669 10.239 1.00 1.40 H new ATOM 0 HD22 ASN A 58 -2.385 15.984 10.568 1.00 1.40 H new ATOM 935 N LEU A 59 -2.983 14.536 5.260 1.00 0.28 N ATOM 936 CA LEU A 59 -1.789 14.312 4.452 1.00 0.27 C ATOM 937 C LEU A 59 -1.182 15.635 3.991 1.00 0.33 C ATOM 938 O LEU A 59 -0.017 15.699 3.611 1.00 0.33 O ATOM 939 CB LEU A 59 -2.126 13.446 3.242 1.00 0.24 C ATOM 940 CG LEU A 59 -2.892 12.160 3.556 1.00 0.20 C ATOM 941 CD1 LEU A 59 -3.096 11.342 2.296 1.00 0.19 C ATOM 942 CD2 LEU A 59 -2.170 11.341 4.608 1.00 0.20 C ATOM 0 H LEU A 59 -3.849 14.211 4.829 1.00 0.28 H new ATOM 0 HA LEU A 59 -1.056 13.795 5.071 1.00 0.27 H new ATOM 0 HB2 LEU A 59 -2.715 14.040 2.543 1.00 0.24 H new ATOM 0 HB3 LEU A 59 -1.198 13.183 2.734 1.00 0.24 H new ATOM 0 HG LEU A 59 -3.869 12.437 3.953 1.00 0.20 H new ATOM 0 HD11 LEU A 59 -3.643 10.431 2.538 1.00 0.19 H new ATOM 0 HD12 LEU A 59 -3.665 11.925 1.572 1.00 0.19 H new ATOM 0 HD13 LEU A 59 -2.127 11.081 1.870 1.00 0.19 H new ATOM 0 HD21 LEU A 59 -2.736 10.432 4.813 1.00 0.20 H new ATOM 0 HD22 LEU A 59 -1.177 11.076 4.245 1.00 0.20 H new ATOM 0 HD23 LEU A 59 -2.078 11.925 5.524 1.00 0.20 H new ATOM 954 N GLN A 60 -1.995 16.683 4.006 1.00 0.40 N ATOM 955 CA GLN A 60 -1.536 18.023 3.655 1.00 0.49 C ATOM 956 C GLN A 60 -0.413 18.491 4.575 1.00 0.51 C ATOM 957 O GLN A 60 0.601 19.021 4.119 1.00 0.53 O ATOM 958 CB GLN A 60 -2.684 19.006 3.771 1.00 0.62 C ATOM 959 CG GLN A 60 -2.340 20.405 3.285 1.00 0.81 C ATOM 960 CD GLN A 60 -3.334 21.448 3.750 1.00 1.00 C ATOM 961 OE1 GLN A 60 -3.928 21.323 4.824 1.00 1.76 O ATOM 962 NE2 GLN A 60 -3.526 22.484 2.950 1.00 1.27 N ATOM 0 H GLN A 60 -2.982 16.631 4.259 1.00 0.40 H new ATOM 0 HA GLN A 60 -1.163 17.982 2.632 1.00 0.49 H new ATOM 0 HB2 GLN A 60 -3.532 18.630 3.199 1.00 0.62 H new ATOM 0 HB3 GLN A 60 -3.001 19.060 4.812 1.00 0.62 H new ATOM 0 HG2 GLN A 60 -1.345 20.674 3.640 1.00 0.81 H new ATOM 0 HG3 GLN A 60 -2.301 20.407 2.196 1.00 0.81 H new ATOM 0 HE21 GLN A 60 -3.015 22.550 2.070 1.00 1.27 H new ATOM 0 HE22 GLN A 60 -4.185 23.216 3.213 1.00 1.27 H new ATOM 971 N SER A 61 -0.595 18.284 5.873 1.00 0.53 N ATOM 972 CA SER A 61 0.317 18.828 6.869 1.00 0.60 C ATOM 973 C SER A 61 1.588 17.994 6.953 1.00 0.48 C ATOM 974 O SER A 61 2.584 18.413 7.547 1.00 0.56 O ATOM 975 CB SER A 61 -0.375 18.888 8.233 1.00 0.79 C ATOM 976 OG SER A 61 0.392 19.622 9.175 1.00 1.59 O ATOM 0 H SER A 61 -1.368 17.742 6.260 1.00 0.53 H new ATOM 0 HA SER A 61 0.596 19.838 6.569 1.00 0.60 H new ATOM 0 HB2 SER A 61 -1.357 19.349 8.124 1.00 0.79 H new ATOM 0 HB3 SER A 61 -0.537 17.876 8.604 1.00 0.79 H new ATOM 0 HG SER A 61 1.335 19.613 8.907 1.00 1.59 H new ATOM 982 N ASP A 62 1.551 16.825 6.341 1.00 0.41 N ATOM 983 CA ASP A 62 2.692 15.918 6.351 1.00 0.41 C ATOM 984 C ASP A 62 2.584 14.924 5.205 1.00 0.36 C ATOM 985 O ASP A 62 1.697 14.070 5.194 1.00 0.33 O ATOM 986 CB ASP A 62 2.774 15.177 7.688 1.00 0.52 C ATOM 987 CG ASP A 62 3.975 14.257 7.774 1.00 1.18 C ATOM 988 OD1 ASP A 62 3.847 13.072 7.403 1.00 1.92 O ATOM 989 OD2 ASP A 62 5.054 14.704 8.208 1.00 1.41 O ATOM 0 H ASP A 62 0.741 16.477 5.828 1.00 0.41 H new ATOM 0 HA ASP A 62 3.602 16.504 6.222 1.00 0.41 H new ATOM 0 HB2 ASP A 62 2.819 15.904 8.499 1.00 0.52 H new ATOM 0 HB3 ASP A 62 1.864 14.594 7.832 1.00 0.52 H new ATOM 994 N LYS A 63 3.492 15.039 4.243 1.00 0.39 N ATOM 995 CA LYS A 63 3.443 14.213 3.044 1.00 0.40 C ATOM 996 C LYS A 63 3.702 12.750 3.393 1.00 0.33 C ATOM 997 O LYS A 63 3.203 11.846 2.726 1.00 0.30 O ATOM 998 CB LYS A 63 4.469 14.700 2.002 1.00 0.52 C ATOM 999 CG LYS A 63 5.765 13.893 1.982 1.00 1.06 C ATOM 1000 CD LYS A 63 6.774 14.404 0.958 1.00 1.18 C ATOM 1001 CE LYS A 63 6.160 14.617 -0.413 1.00 1.00 C ATOM 1002 NZ LYS A 63 7.139 15.186 -1.375 1.00 1.68 N ATOM 0 H LYS A 63 4.271 15.697 4.271 1.00 0.39 H new ATOM 0 HA LYS A 63 2.446 14.300 2.613 1.00 0.40 H new ATOM 0 HB2 LYS A 63 4.013 14.661 1.013 1.00 0.52 H new ATOM 0 HB3 LYS A 63 4.707 15.745 2.202 1.00 0.52 H new ATOM 0 HG2 LYS A 63 6.218 13.920 2.973 1.00 1.06 H new ATOM 0 HG3 LYS A 63 5.533 12.850 1.765 1.00 1.06 H new ATOM 0 HD2 LYS A 63 7.200 15.343 1.311 1.00 1.18 H new ATOM 0 HD3 LYS A 63 7.596 13.692 0.877 1.00 1.18 H new ATOM 0 HE2 LYS A 63 5.786 13.667 -0.795 1.00 1.00 H new ATOM 0 HE3 LYS A 63 5.304 15.286 -0.328 1.00 1.00 H new ATOM 0 HZ1 LYS A 63 6.660 15.396 -2.274 1.00 1.68 H new ATOM 0 HZ2 LYS A 63 7.541 16.062 -0.984 1.00 1.68 H new ATOM 0 HZ3 LYS A 63 7.902 14.499 -1.541 1.00 1.68 H new ATOM 1016 N LYS A 64 4.466 12.526 4.457 1.00 0.34 N ATOM 1017 CA LYS A 64 4.888 11.180 4.818 1.00 0.33 C ATOM 1018 C LYS A 64 3.721 10.349 5.336 1.00 0.27 C ATOM 1019 O LYS A 64 3.770 9.119 5.311 1.00 0.27 O ATOM 1020 CB LYS A 64 5.996 11.216 5.868 1.00 0.40 C ATOM 1021 CG LYS A 64 7.312 11.797 5.377 1.00 0.42 C ATOM 1022 CD LYS A 64 7.790 11.114 4.105 1.00 0.38 C ATOM 1023 CE LYS A 64 9.299 11.221 3.935 1.00 0.51 C ATOM 1024 NZ LYS A 64 9.779 12.628 3.944 1.00 1.07 N ATOM 0 H LYS A 64 4.804 13.258 5.082 1.00 0.34 H new ATOM 0 HA LYS A 64 5.272 10.712 3.911 1.00 0.33 H new ATOM 0 HB2 LYS A 64 5.652 11.800 6.721 1.00 0.40 H new ATOM 0 HB3 LYS A 64 6.172 10.202 6.226 1.00 0.40 H new ATOM 0 HG2 LYS A 64 7.192 12.865 5.193 1.00 0.42 H new ATOM 0 HG3 LYS A 64 8.069 11.690 6.154 1.00 0.42 H new ATOM 0 HD2 LYS A 64 7.501 10.063 4.127 1.00 0.38 H new ATOM 0 HD3 LYS A 64 7.295 11.563 3.244 1.00 0.38 H new ATOM 0 HE2 LYS A 64 9.791 10.669 4.736 1.00 0.51 H new ATOM 0 HE3 LYS A 64 9.589 10.748 2.997 1.00 0.51 H new ATOM 0 HZ1 LYS A 64 10.795 12.650 3.724 1.00 1.07 H new ATOM 0 HZ2 LYS A 64 9.258 13.177 3.230 1.00 1.07 H new ATOM 0 HZ3 LYS A 64 9.620 13.043 4.884 1.00 1.07 H new ATOM 1038 N LEU A 65 2.686 11.018 5.822 1.00 0.25 N ATOM 1039 CA LEU A 65 1.470 10.347 6.236 1.00 0.21 C ATOM 1040 C LEU A 65 0.886 9.526 5.092 1.00 0.17 C ATOM 1041 O LEU A 65 0.349 8.442 5.312 1.00 0.18 O ATOM 1042 CB LEU A 65 0.448 11.362 6.737 1.00 0.24 C ATOM 1043 CG LEU A 65 0.870 12.148 7.974 1.00 0.28 C ATOM 1044 CD1 LEU A 65 -0.243 13.084 8.418 1.00 0.34 C ATOM 1045 CD2 LEU A 65 1.261 11.205 9.099 1.00 0.31 C ATOM 0 H LEU A 65 2.668 12.031 5.938 1.00 0.25 H new ATOM 0 HA LEU A 65 1.717 9.667 7.051 1.00 0.21 H new ATOM 0 HB2 LEU A 65 0.235 12.067 5.933 1.00 0.24 H new ATOM 0 HB3 LEU A 65 -0.482 10.839 6.958 1.00 0.24 H new ATOM 0 HG LEU A 65 1.741 12.751 7.717 1.00 0.28 H new ATOM 0 HD11 LEU A 65 0.077 13.636 9.302 1.00 0.34 H new ATOM 0 HD12 LEU A 65 -0.471 13.785 7.615 1.00 0.34 H new ATOM 0 HD13 LEU A 65 -1.134 12.503 8.656 1.00 0.34 H new ATOM 0 HD21 LEU A 65 1.559 11.785 9.973 1.00 0.31 H new ATOM 0 HD22 LEU A 65 0.411 10.573 9.356 1.00 0.31 H new ATOM 0 HD23 LEU A 65 2.094 10.580 8.777 1.00 0.31 H new ATOM 1057 N PHE A 66 1.002 10.031 3.865 1.00 0.15 N ATOM 1058 CA PHE A 66 0.573 9.270 2.703 1.00 0.13 C ATOM 1059 C PHE A 66 1.426 8.014 2.565 1.00 0.14 C ATOM 1060 O PHE A 66 0.918 6.946 2.239 1.00 0.15 O ATOM 1061 CB PHE A 66 0.659 10.120 1.426 1.00 0.14 C ATOM 1062 CG PHE A 66 0.316 9.368 0.162 1.00 0.14 C ATOM 1063 CD1 PHE A 66 -0.743 8.480 0.134 1.00 0.13 C ATOM 1064 CD2 PHE A 66 1.058 9.549 -0.995 1.00 0.20 C ATOM 1065 CE1 PHE A 66 -1.058 7.782 -1.015 1.00 0.15 C ATOM 1066 CE2 PHE A 66 0.745 8.856 -2.149 1.00 0.24 C ATOM 1067 CZ PHE A 66 -0.312 7.972 -2.159 1.00 0.21 C ATOM 0 H PHE A 66 1.385 10.953 3.655 1.00 0.15 H new ATOM 0 HA PHE A 66 -0.469 8.981 2.843 1.00 0.13 H new ATOM 0 HB2 PHE A 66 -0.014 10.972 1.523 1.00 0.14 H new ATOM 0 HB3 PHE A 66 1.669 10.520 1.336 1.00 0.14 H new ATOM 0 HD1 PHE A 66 -1.334 8.330 1.026 1.00 0.13 H new ATOM 0 HD2 PHE A 66 1.889 10.239 -0.995 1.00 0.20 H new ATOM 0 HE1 PHE A 66 -1.886 7.089 -1.018 1.00 0.15 H new ATOM 0 HE2 PHE A 66 1.330 9.008 -3.044 1.00 0.24 H new ATOM 0 HZ PHE A 66 -0.556 7.429 -3.060 1.00 0.21 H new ATOM 1077 N TYR A 67 2.716 8.140 2.866 1.00 0.16 N ATOM 1078 CA TYR A 67 3.643 7.022 2.731 1.00 0.18 C ATOM 1079 C TYR A 67 3.233 5.896 3.670 1.00 0.16 C ATOM 1080 O TYR A 67 3.026 4.760 3.254 1.00 0.18 O ATOM 1081 CB TYR A 67 5.087 7.426 3.060 1.00 0.22 C ATOM 1082 CG TYR A 67 5.704 8.454 2.140 1.00 0.26 C ATOM 1083 CD1 TYR A 67 4.991 9.564 1.739 1.00 0.25 C ATOM 1084 CD2 TYR A 67 7.021 8.329 1.711 1.00 0.33 C ATOM 1085 CE1 TYR A 67 5.556 10.526 0.936 1.00 0.29 C ATOM 1086 CE2 TYR A 67 7.597 9.285 0.897 1.00 0.37 C ATOM 1087 CZ TYR A 67 6.861 10.385 0.513 1.00 0.35 C ATOM 1088 OH TYR A 67 7.428 11.347 -0.289 1.00 0.40 O ATOM 0 H TYR A 67 3.141 9.003 3.204 1.00 0.16 H new ATOM 0 HA TYR A 67 3.603 6.696 1.692 1.00 0.18 H new ATOM 0 HB2 TYR A 67 5.114 7.814 4.078 1.00 0.22 H new ATOM 0 HB3 TYR A 67 5.708 6.531 3.044 1.00 0.22 H new ATOM 0 HD1 TYR A 67 3.967 9.680 2.063 1.00 0.25 H new ATOM 0 HD2 TYR A 67 7.602 7.472 2.019 1.00 0.33 H new ATOM 0 HE1 TYR A 67 4.980 11.389 0.637 1.00 0.29 H new ATOM 0 HE2 TYR A 67 8.618 9.171 0.564 1.00 0.37 H new ATOM 0 HH TYR A 67 8.392 11.388 -0.119 1.00 0.40 H new ATOM 1098 N SER A 68 3.130 6.226 4.952 1.00 0.15 N ATOM 1099 CA SER A 68 2.757 5.257 5.961 1.00 0.18 C ATOM 1100 C SER A 68 1.314 4.792 5.771 1.00 0.17 C ATOM 1101 O SER A 68 0.980 3.651 6.073 1.00 0.20 O ATOM 1102 CB SER A 68 2.947 5.849 7.357 1.00 0.26 C ATOM 1103 OG SER A 68 4.239 6.417 7.504 1.00 1.22 O ATOM 0 H SER A 68 3.302 7.164 5.313 1.00 0.15 H new ATOM 0 HA SER A 68 3.407 4.388 5.854 1.00 0.18 H new ATOM 0 HB2 SER A 68 2.189 6.612 7.537 1.00 0.26 H new ATOM 0 HB3 SER A 68 2.802 5.072 8.107 1.00 0.26 H new ATOM 0 HG SER A 68 4.332 6.789 8.406 1.00 1.22 H new ATOM 1109 N GLY A 69 0.459 5.673 5.267 1.00 0.16 N ATOM 1110 CA GLY A 69 -0.891 5.266 4.928 1.00 0.17 C ATOM 1111 C GLY A 69 -0.875 4.149 3.910 1.00 0.16 C ATOM 1112 O GLY A 69 -1.677 3.217 3.974 1.00 0.17 O ATOM 0 H GLY A 69 0.673 6.654 5.088 1.00 0.16 H new ATOM 0 HA2 GLY A 69 -1.413 4.938 5.827 1.00 0.17 H new ATOM 0 HA3 GLY A 69 -1.444 6.118 4.531 1.00 0.17 H new ATOM 1116 N ILE A 70 0.058 4.251 2.972 1.00 0.15 N ATOM 1117 CA ILE A 70 0.306 3.203 2.003 1.00 0.16 C ATOM 1118 C ILE A 70 0.691 1.893 2.685 1.00 0.16 C ATOM 1119 O ILE A 70 0.135 0.847 2.371 1.00 0.17 O ATOM 1120 CB ILE A 70 1.429 3.616 1.036 1.00 0.16 C ATOM 1121 CG1 ILE A 70 0.966 4.781 0.164 1.00 0.16 C ATOM 1122 CG2 ILE A 70 1.864 2.433 0.187 1.00 0.17 C ATOM 1123 CD1 ILE A 70 2.041 5.328 -0.752 1.00 0.18 C ATOM 0 H ILE A 70 0.662 5.066 2.866 1.00 0.15 H new ATOM 0 HA ILE A 70 -0.619 3.051 1.447 1.00 0.16 H new ATOM 0 HB ILE A 70 2.292 3.944 1.615 1.00 0.16 H new ATOM 0 HG12 ILE A 70 0.119 4.456 -0.440 1.00 0.16 H new ATOM 0 HG13 ILE A 70 0.608 5.584 0.808 1.00 0.16 H new ATOM 0 HG21 ILE A 70 2.659 2.744 -0.491 1.00 0.17 H new ATOM 0 HG22 ILE A 70 2.230 1.636 0.834 1.00 0.17 H new ATOM 0 HG23 ILE A 70 1.015 2.069 -0.392 1.00 0.17 H new ATOM 0 HD11 ILE A 70 1.635 6.152 -1.338 1.00 0.18 H new ATOM 0 HD12 ILE A 70 2.880 5.686 -0.155 1.00 0.18 H new ATOM 0 HD13 ILE A 70 2.383 4.540 -1.423 1.00 0.18 H new ATOM 1135 N CYS A 71 1.632 1.950 3.627 1.00 0.17 N ATOM 1136 CA CYS A 71 2.114 0.737 4.285 1.00 0.18 C ATOM 1137 C CYS A 71 0.972 0.049 5.022 1.00 0.17 C ATOM 1138 O CYS A 71 0.868 -1.176 5.029 1.00 0.17 O ATOM 1139 CB CYS A 71 3.265 1.040 5.255 1.00 0.21 C ATOM 1140 SG CYS A 71 2.766 1.597 6.901 1.00 1.10 S ATOM 0 H CYS A 71 2.071 2.813 3.949 1.00 0.17 H new ATOM 0 HA CYS A 71 2.497 0.069 3.513 1.00 0.18 H new ATOM 0 HB2 CYS A 71 3.873 0.142 5.363 1.00 0.21 H new ATOM 0 HB3 CYS A 71 3.902 1.804 4.809 1.00 0.21 H new ATOM 0 HG CYS A 71 1.916 2.574 6.789 1.00 1.10 H new ATOM 1146 N GLN A 72 0.113 0.854 5.627 1.00 0.18 N ATOM 1147 CA GLN A 72 -1.074 0.346 6.303 1.00 0.19 C ATOM 1148 C GLN A 72 -2.015 -0.309 5.300 1.00 0.17 C ATOM 1149 O GLN A 72 -2.677 -1.302 5.605 1.00 0.20 O ATOM 1150 CB GLN A 72 -1.789 1.475 7.041 1.00 0.22 C ATOM 1151 CG GLN A 72 -0.935 2.129 8.117 1.00 0.28 C ATOM 1152 CD GLN A 72 -0.523 1.158 9.207 1.00 1.02 C ATOM 1153 OE1 GLN A 72 -1.235 0.979 10.196 1.00 1.82 O ATOM 1154 NE2 GLN A 72 0.635 0.536 9.042 1.00 1.56 N ATOM 0 H GLN A 72 0.215 1.868 5.665 1.00 0.18 H new ATOM 0 HA GLN A 72 -0.764 -0.404 7.031 1.00 0.19 H new ATOM 0 HB2 GLN A 72 -2.096 2.233 6.320 1.00 0.22 H new ATOM 0 HB3 GLN A 72 -2.698 1.083 7.497 1.00 0.22 H new ATOM 0 HG2 GLN A 72 -0.042 2.554 7.658 1.00 0.28 H new ATOM 0 HG3 GLN A 72 -1.489 2.955 8.562 1.00 0.28 H new ATOM 0 HE21 GLN A 72 1.195 0.713 8.208 1.00 1.56 H new ATOM 0 HE22 GLN A 72 0.967 -0.120 9.749 1.00 1.56 H new ATOM 1163 N PHE A 73 -2.056 0.251 4.098 1.00 0.16 N ATOM 1164 CA PHE A 73 -2.842 -0.309 3.010 1.00 0.15 C ATOM 1165 C PHE A 73 -2.279 -1.666 2.590 1.00 0.15 C ATOM 1166 O PHE A 73 -3.014 -2.648 2.503 1.00 0.15 O ATOM 1167 CB PHE A 73 -2.859 0.658 1.822 1.00 0.14 C ATOM 1168 CG PHE A 73 -3.612 0.151 0.628 1.00 0.14 C ATOM 1169 CD1 PHE A 73 -2.940 -0.397 -0.448 1.00 0.19 C ATOM 1170 CD2 PHE A 73 -4.993 0.218 0.585 1.00 0.17 C ATOM 1171 CE1 PHE A 73 -3.629 -0.871 -1.546 1.00 0.20 C ATOM 1172 CE2 PHE A 73 -5.689 -0.254 -0.510 1.00 0.17 C ATOM 1173 CZ PHE A 73 -5.007 -0.773 -1.586 1.00 0.15 C ATOM 0 H PHE A 73 -1.548 1.101 3.852 1.00 0.16 H new ATOM 0 HA PHE A 73 -3.866 -0.455 3.355 1.00 0.15 H new ATOM 0 HB2 PHE A 73 -3.301 1.602 2.142 1.00 0.14 H new ATOM 0 HB3 PHE A 73 -1.832 0.871 1.526 1.00 0.14 H new ATOM 0 HD1 PHE A 73 -1.862 -0.455 -0.430 1.00 0.19 H new ATOM 0 HD2 PHE A 73 -5.533 0.644 1.417 1.00 0.17 H new ATOM 0 HE1 PHE A 73 -3.093 -1.317 -2.371 1.00 0.20 H new ATOM 0 HE2 PHE A 73 -6.768 -0.216 -0.522 1.00 0.17 H new ATOM 0 HZ PHE A 73 -5.548 -1.103 -2.461 1.00 0.15 H new ATOM 1183 N VAL A 74 -0.967 -1.725 2.352 1.00 0.17 N ATOM 1184 CA VAL A 74 -0.328 -2.975 1.932 1.00 0.19 C ATOM 1185 C VAL A 74 -0.432 -4.010 3.039 1.00 0.19 C ATOM 1186 O VAL A 74 -0.436 -5.212 2.782 1.00 0.21 O ATOM 1187 CB VAL A 74 1.168 -2.800 1.550 1.00 0.22 C ATOM 1188 CG1 VAL A 74 1.419 -1.429 0.969 1.00 0.28 C ATOM 1189 CG2 VAL A 74 2.107 -3.056 2.725 1.00 0.24 C ATOM 0 H VAL A 74 -0.332 -0.932 2.441 1.00 0.17 H new ATOM 0 HA VAL A 74 -0.860 -3.305 1.039 1.00 0.19 H new ATOM 0 HB VAL A 74 1.385 -3.553 0.793 1.00 0.22 H new ATOM 0 HG11 VAL A 74 2.473 -1.331 0.710 1.00 0.28 H new ATOM 0 HG12 VAL A 74 0.811 -1.296 0.074 1.00 0.28 H new ATOM 0 HG13 VAL A 74 1.154 -0.668 1.703 1.00 0.28 H new ATOM 0 HG21 VAL A 74 3.139 -2.920 2.402 1.00 0.24 H new ATOM 0 HG22 VAL A 74 1.883 -2.355 3.529 1.00 0.24 H new ATOM 0 HG23 VAL A 74 1.971 -4.076 3.084 1.00 0.24 H new ATOM 1199 N LYS A 75 -0.512 -3.528 4.272 1.00 0.20 N ATOM 1200 CA LYS A 75 -0.617 -4.397 5.425 1.00 0.23 C ATOM 1201 C LYS A 75 -1.859 -5.271 5.331 1.00 0.24 C ATOM 1202 O LYS A 75 -1.816 -6.446 5.675 1.00 0.31 O ATOM 1203 CB LYS A 75 -0.628 -3.580 6.716 1.00 0.25 C ATOM 1204 CG LYS A 75 -0.751 -4.426 7.969 1.00 0.38 C ATOM 1205 CD LYS A 75 -1.347 -3.641 9.126 1.00 0.58 C ATOM 1206 CE LYS A 75 -2.816 -3.327 8.879 1.00 1.08 C ATOM 1207 NZ LYS A 75 -3.638 -4.562 8.778 1.00 1.85 N ATOM 0 H LYS A 75 -0.506 -2.533 4.495 1.00 0.20 H new ATOM 0 HA LYS A 75 0.256 -5.049 5.440 1.00 0.23 H new ATOM 0 HB2 LYS A 75 0.289 -2.993 6.773 1.00 0.25 H new ATOM 0 HB3 LYS A 75 -1.457 -2.873 6.682 1.00 0.25 H new ATOM 0 HG2 LYS A 75 -1.375 -5.295 7.760 1.00 0.38 H new ATOM 0 HG3 LYS A 75 0.233 -4.800 8.253 1.00 0.38 H new ATOM 0 HD2 LYS A 75 -1.245 -4.213 10.048 1.00 0.58 H new ATOM 0 HD3 LYS A 75 -0.792 -2.713 9.263 1.00 0.58 H new ATOM 0 HE2 LYS A 75 -3.195 -2.704 9.689 1.00 1.08 H new ATOM 0 HE3 LYS A 75 -2.914 -2.749 7.960 1.00 1.08 H new ATOM 0 HZ1 LYS A 75 -4.200 -4.535 7.903 1.00 1.85 H new ATOM 0 HZ2 LYS A 75 -3.014 -5.394 8.763 1.00 1.85 H new ATOM 0 HZ3 LYS A 75 -4.276 -4.622 9.597 1.00 1.85 H new ATOM 1221 N GLU A 76 -2.949 -4.703 4.829 1.00 0.21 N ATOM 1222 CA GLU A 76 -4.184 -5.455 4.638 1.00 0.24 C ATOM 1223 C GLU A 76 -3.943 -6.595 3.660 1.00 0.24 C ATOM 1224 O GLU A 76 -4.477 -7.691 3.813 1.00 0.29 O ATOM 1225 CB GLU A 76 -5.287 -4.542 4.099 1.00 0.28 C ATOM 1226 CG GLU A 76 -5.534 -3.310 4.945 1.00 1.05 C ATOM 1227 CD GLU A 76 -6.230 -3.621 6.258 1.00 1.02 C ATOM 1228 OE1 GLU A 76 -7.405 -3.228 6.418 1.00 0.89 O ATOM 1229 OE2 GLU A 76 -5.621 -4.271 7.131 1.00 1.31 O ATOM 0 H GLU A 76 -3.003 -3.724 4.547 1.00 0.21 H new ATOM 0 HA GLU A 76 -4.500 -5.859 5.600 1.00 0.24 H new ATOM 0 HB2 GLU A 76 -5.025 -4.230 3.088 1.00 0.28 H new ATOM 0 HB3 GLU A 76 -6.213 -5.112 4.026 1.00 0.28 H new ATOM 0 HG2 GLU A 76 -4.582 -2.821 5.152 1.00 1.05 H new ATOM 0 HG3 GLU A 76 -6.139 -2.602 4.378 1.00 1.05 H new ATOM 1236 N ALA A 77 -3.112 -6.333 2.663 1.00 0.21 N ATOM 1237 CA ALA A 77 -2.764 -7.341 1.680 1.00 0.22 C ATOM 1238 C ALA A 77 -1.877 -8.421 2.294 1.00 0.22 C ATOM 1239 O ALA A 77 -1.940 -9.584 1.895 1.00 0.24 O ATOM 1240 CB ALA A 77 -2.092 -6.703 0.479 1.00 0.24 C ATOM 0 H ALA A 77 -2.666 -5.428 2.515 1.00 0.21 H new ATOM 0 HA ALA A 77 -3.683 -7.819 1.342 1.00 0.22 H new ATOM 0 HB1 ALA A 77 -1.838 -7.474 -0.248 1.00 0.24 H new ATOM 0 HB2 ALA A 77 -2.771 -5.983 0.022 1.00 0.24 H new ATOM 0 HB3 ALA A 77 -1.184 -6.193 0.799 1.00 0.24 H new ATOM 1246 N LYS A 78 -1.056 -8.035 3.270 1.00 0.24 N ATOM 1247 CA LYS A 78 -0.255 -9.007 4.015 1.00 0.30 C ATOM 1248 C LYS A 78 -1.168 -9.789 4.959 1.00 0.31 C ATOM 1249 O LYS A 78 -0.868 -10.915 5.348 1.00 0.37 O ATOM 1250 CB LYS A 78 0.847 -8.334 4.858 1.00 0.42 C ATOM 1251 CG LYS A 78 1.580 -7.178 4.191 1.00 0.84 C ATOM 1252 CD LYS A 78 2.327 -6.334 5.222 1.00 0.72 C ATOM 1253 CE LYS A 78 3.422 -7.123 5.909 1.00 1.08 C ATOM 1254 NZ LYS A 78 3.890 -6.460 7.156 1.00 1.88 N ATOM 0 H LYS A 78 -0.928 -7.066 3.562 1.00 0.24 H new ATOM 0 HA LYS A 78 0.223 -9.662 3.287 1.00 0.30 H new ATOM 0 HB2 LYS A 78 0.399 -7.970 5.783 1.00 0.42 H new ATOM 0 HB3 LYS A 78 1.580 -9.092 5.135 1.00 0.42 H new ATOM 0 HG2 LYS A 78 2.284 -7.566 3.455 1.00 0.84 H new ATOM 0 HG3 LYS A 78 0.867 -6.553 3.652 1.00 0.84 H new ATOM 0 HD2 LYS A 78 2.760 -5.462 4.732 1.00 0.72 H new ATOM 0 HD3 LYS A 78 1.623 -5.964 5.968 1.00 0.72 H new ATOM 0 HE2 LYS A 78 3.055 -8.122 6.146 1.00 1.08 H new ATOM 0 HE3 LYS A 78 4.263 -7.246 5.226 1.00 1.08 H new ATOM 0 HZ1 LYS A 78 4.152 -7.183 7.856 1.00 1.88 H new ATOM 0 HZ2 LYS A 78 4.718 -5.867 6.944 1.00 1.88 H new ATOM 0 HZ3 LYS A 78 3.128 -5.866 7.540 1.00 1.88 H new ATOM 1268 N ASP A 79 -2.289 -9.171 5.313 1.00 0.31 N ATOM 1269 CA ASP A 79 -3.219 -9.729 6.282 1.00 0.36 C ATOM 1270 C ASP A 79 -4.051 -10.846 5.671 1.00 0.34 C ATOM 1271 O ASP A 79 -4.192 -11.917 6.264 1.00 0.38 O ATOM 1272 CB ASP A 79 -4.123 -8.629 6.836 1.00 0.41 C ATOM 1273 CG ASP A 79 -3.627 -8.062 8.154 1.00 1.12 C ATOM 1274 OD1 ASP A 79 -4.003 -8.602 9.219 1.00 1.77 O ATOM 1275 OD2 ASP A 79 -2.871 -7.069 8.141 1.00 1.60 O ATOM 0 H ASP A 79 -2.577 -8.269 4.935 1.00 0.31 H new ATOM 0 HA ASP A 79 -2.640 -10.157 7.100 1.00 0.36 H new ATOM 0 HB2 ASP A 79 -4.196 -7.824 6.105 1.00 0.41 H new ATOM 0 HB3 ASP A 79 -5.128 -9.027 6.973 1.00 0.41 H new ATOM 1280 N ILE A 80 -4.584 -10.610 4.478 1.00 0.30 N ATOM 1281 CA ILE A 80 -5.416 -11.612 3.810 1.00 0.32 C ATOM 1282 C ILE A 80 -4.542 -12.506 2.946 1.00 0.30 C ATOM 1283 O ILE A 80 -4.986 -13.524 2.406 1.00 0.33 O ATOM 1284 CB ILE A 80 -6.548 -10.964 2.964 1.00 0.32 C ATOM 1285 CG1 ILE A 80 -6.204 -10.868 1.464 1.00 0.29 C ATOM 1286 CG2 ILE A 80 -6.858 -9.583 3.511 1.00 0.33 C ATOM 1287 CD1 ILE A 80 -5.187 -9.806 1.110 1.00 0.22 C ATOM 0 H ILE A 80 -4.459 -9.743 3.955 1.00 0.30 H new ATOM 0 HA ILE A 80 -5.902 -12.213 4.578 1.00 0.32 H new ATOM 0 HB ILE A 80 -7.420 -11.613 3.044 1.00 0.32 H new ATOM 0 HG12 ILE A 80 -5.829 -11.835 1.130 1.00 0.29 H new ATOM 0 HG13 ILE A 80 -7.121 -10.672 0.908 1.00 0.29 H new ATOM 0 HG21 ILE A 80 -7.652 -9.127 2.919 1.00 0.33 H new ATOM 0 HG22 ILE A 80 -7.182 -9.667 4.548 1.00 0.33 H new ATOM 0 HG23 ILE A 80 -5.964 -8.962 3.459 1.00 0.33 H new ATOM 0 HD11 ILE A 80 -5.011 -9.815 0.034 1.00 0.22 H new ATOM 0 HD12 ILE A 80 -5.564 -8.828 1.407 1.00 0.22 H new ATOM 0 HD13 ILE A 80 -4.252 -10.009 1.633 1.00 0.22 H new ATOM 1299 N LYS A 81 -3.286 -12.083 2.842 1.00 0.27 N ATOM 1300 CA LYS A 81 -2.246 -12.800 2.115 1.00 0.29 C ATOM 1301 C LYS A 81 -2.513 -12.792 0.616 1.00 0.29 C ATOM 1302 O LYS A 81 -2.509 -13.833 -0.042 1.00 0.39 O ATOM 1303 CB LYS A 81 -2.086 -14.240 2.633 1.00 0.36 C ATOM 1304 CG LYS A 81 -1.558 -14.332 4.059 1.00 0.39 C ATOM 1305 CD LYS A 81 -0.157 -13.750 4.179 1.00 0.40 C ATOM 1306 CE LYS A 81 0.404 -13.910 5.585 1.00 0.53 C ATOM 1307 NZ LYS A 81 0.596 -15.338 5.954 1.00 1.47 N ATOM 0 H LYS A 81 -2.957 -11.217 3.269 1.00 0.27 H new ATOM 0 HA LYS A 81 -1.307 -12.275 2.293 1.00 0.29 H new ATOM 0 HB2 LYS A 81 -3.052 -14.743 2.581 1.00 0.36 H new ATOM 0 HB3 LYS A 81 -1.409 -14.780 1.971 1.00 0.36 H new ATOM 0 HG2 LYS A 81 -2.232 -13.801 4.731 1.00 0.39 H new ATOM 0 HG3 LYS A 81 -1.547 -15.375 4.377 1.00 0.39 H new ATOM 0 HD2 LYS A 81 0.504 -14.243 3.466 1.00 0.40 H new ATOM 0 HD3 LYS A 81 -0.179 -12.693 3.915 1.00 0.40 H new ATOM 0 HE2 LYS A 81 1.358 -13.387 5.656 1.00 0.53 H new ATOM 0 HE3 LYS A 81 -0.271 -13.439 6.300 1.00 0.53 H new ATOM 0 HZ1 LYS A 81 1.147 -15.398 6.834 1.00 1.47 H new ATOM 0 HZ2 LYS A 81 -0.331 -15.788 6.095 1.00 1.47 H new ATOM 0 HZ3 LYS A 81 1.106 -15.828 5.192 1.00 1.47 H new ATOM 1321 N GLY A 82 -2.717 -11.601 0.081 1.00 0.23 N ATOM 1322 CA GLY A 82 -2.993 -11.457 -1.330 1.00 0.26 C ATOM 1323 C GLY A 82 -1.835 -10.861 -2.100 1.00 0.22 C ATOM 1324 O GLY A 82 -0.672 -11.210 -1.879 1.00 0.23 O ATOM 0 H GLY A 82 -2.696 -10.725 0.603 1.00 0.23 H new ATOM 0 HA2 GLY A 82 -3.237 -12.433 -1.749 1.00 0.26 H new ATOM 0 HA3 GLY A 82 -3.872 -10.826 -1.460 1.00 0.26 H new ATOM 1328 N LYS A 83 -2.166 -9.979 -3.029 1.00 0.18 N ATOM 1329 CA LYS A 83 -1.184 -9.287 -3.842 1.00 0.17 C ATOM 1330 C LYS A 83 -1.348 -7.786 -3.666 1.00 0.16 C ATOM 1331 O LYS A 83 -2.439 -7.320 -3.331 1.00 0.20 O ATOM 1332 CB LYS A 83 -1.339 -9.647 -5.314 1.00 0.19 C ATOM 1333 CG LYS A 83 -0.525 -10.860 -5.697 1.00 0.26 C ATOM 1334 CD LYS A 83 -1.100 -12.125 -5.103 1.00 0.30 C ATOM 1335 CE LYS A 83 -0.012 -13.140 -4.846 1.00 0.42 C ATOM 1336 NZ LYS A 83 0.592 -13.645 -6.109 1.00 1.06 N ATOM 0 H LYS A 83 -3.130 -9.723 -3.240 1.00 0.18 H new ATOM 0 HA LYS A 83 -0.190 -9.594 -3.517 1.00 0.17 H new ATOM 0 HB2 LYS A 83 -2.391 -9.835 -5.531 1.00 0.19 H new ATOM 0 HB3 LYS A 83 -1.034 -8.799 -5.927 1.00 0.19 H new ATOM 0 HG2 LYS A 83 -0.492 -10.949 -6.783 1.00 0.26 H new ATOM 0 HG3 LYS A 83 0.503 -10.732 -5.357 1.00 0.26 H new ATOM 0 HD2 LYS A 83 -1.615 -11.893 -4.171 1.00 0.30 H new ATOM 0 HD3 LYS A 83 -1.843 -12.545 -5.781 1.00 0.30 H new ATOM 0 HE2 LYS A 83 0.765 -12.690 -4.228 1.00 0.42 H new ATOM 0 HE3 LYS A 83 -0.423 -13.977 -4.281 1.00 0.42 H new ATOM 0 HZ1 LYS A 83 1.182 -14.476 -5.903 1.00 1.06 H new ATOM 0 HZ2 LYS A 83 -0.163 -13.912 -6.772 1.00 1.06 H new ATOM 0 HZ3 LYS A 83 1.179 -12.900 -6.535 1.00 1.06 H new ATOM 1350 N LEU A 84 -0.292 -7.032 -3.899 1.00 0.16 N ATOM 1351 CA LEU A 84 -0.363 -5.587 -3.781 1.00 0.15 C ATOM 1352 C LEU A 84 -0.134 -4.943 -5.144 1.00 0.15 C ATOM 1353 O LEU A 84 0.741 -5.364 -5.898 1.00 0.17 O ATOM 1354 CB LEU A 84 0.659 -5.094 -2.751 1.00 0.16 C ATOM 1355 CG LEU A 84 0.492 -3.645 -2.266 1.00 0.16 C ATOM 1356 CD1 LEU A 84 1.117 -2.668 -3.247 1.00 0.17 C ATOM 1357 CD2 LEU A 84 -0.979 -3.308 -2.051 1.00 0.15 C ATOM 0 H LEU A 84 0.623 -7.393 -4.170 1.00 0.16 H new ATOM 0 HA LEU A 84 -1.355 -5.299 -3.434 1.00 0.15 H new ATOM 0 HB2 LEU A 84 0.615 -5.752 -1.883 1.00 0.16 H new ATOM 0 HB3 LEU A 84 1.655 -5.198 -3.181 1.00 0.16 H new ATOM 0 HG LEU A 84 1.010 -3.554 -1.311 1.00 0.16 H new ATOM 0 HD11 LEU A 84 0.985 -1.650 -2.881 1.00 0.17 H new ATOM 0 HD12 LEU A 84 2.181 -2.883 -3.347 1.00 0.17 H new ATOM 0 HD13 LEU A 84 0.634 -2.769 -4.219 1.00 0.17 H new ATOM 0 HD21 LEU A 84 -1.070 -2.277 -1.708 1.00 0.15 H new ATOM 0 HD22 LEU A 84 -1.521 -3.427 -2.989 1.00 0.15 H new ATOM 0 HD23 LEU A 84 -1.400 -3.978 -1.302 1.00 0.15 H new ATOM 1369 N THR A 85 -0.943 -3.945 -5.458 1.00 0.16 N ATOM 1370 CA THR A 85 -0.853 -3.232 -6.718 1.00 0.17 C ATOM 1371 C THR A 85 -0.631 -1.741 -6.483 1.00 0.17 C ATOM 1372 O THR A 85 -1.344 -1.108 -5.703 1.00 0.21 O ATOM 1373 CB THR A 85 -2.142 -3.423 -7.540 1.00 0.19 C ATOM 1374 OG1 THR A 85 -2.330 -4.807 -7.835 1.00 0.20 O ATOM 1375 CG2 THR A 85 -2.110 -2.621 -8.836 1.00 0.20 C ATOM 0 H THR A 85 -1.683 -3.606 -4.843 1.00 0.16 H new ATOM 0 HA THR A 85 -0.005 -3.639 -7.269 1.00 0.17 H new ATOM 0 HB THR A 85 -2.975 -3.057 -6.940 1.00 0.19 H new ATOM 0 HG1 THR A 85 -2.940 -4.899 -8.596 1.00 0.20 H new ATOM 0 HG21 THR A 85 -3.037 -2.783 -9.387 1.00 0.20 H new ATOM 0 HG22 THR A 85 -2.005 -1.561 -8.605 1.00 0.20 H new ATOM 0 HG23 THR A 85 -1.265 -2.945 -9.444 1.00 0.20 H new ATOM 1383 N LEU A 86 0.367 -1.189 -7.150 1.00 0.16 N ATOM 1384 CA LEU A 86 0.626 0.239 -7.093 1.00 0.18 C ATOM 1385 C LEU A 86 0.081 0.905 -8.345 1.00 0.19 C ATOM 1386 O LEU A 86 0.576 0.665 -9.437 1.00 0.21 O ATOM 1387 CB LEU A 86 2.138 0.491 -6.965 1.00 0.22 C ATOM 1388 CG LEU A 86 2.593 1.961 -6.898 1.00 0.53 C ATOM 1389 CD1 LEU A 86 2.702 2.570 -8.292 1.00 1.45 C ATOM 1390 CD2 LEU A 86 1.642 2.778 -6.027 1.00 1.51 C ATOM 0 H LEU A 86 1.015 -1.711 -7.740 1.00 0.16 H new ATOM 0 HA LEU A 86 0.128 0.664 -6.222 1.00 0.18 H new ATOM 0 HB2 LEU A 86 2.492 -0.016 -6.067 1.00 0.22 H new ATOM 0 HB3 LEU A 86 2.634 0.020 -7.814 1.00 0.22 H new ATOM 0 HG LEU A 86 3.584 1.984 -6.445 1.00 0.53 H new ATOM 0 HD11 LEU A 86 3.025 3.608 -8.211 1.00 1.45 H new ATOM 0 HD12 LEU A 86 3.429 2.008 -8.879 1.00 1.45 H new ATOM 0 HD13 LEU A 86 1.730 2.530 -8.784 1.00 1.45 H new ATOM 0 HD21 LEU A 86 1.980 3.814 -5.992 1.00 1.51 H new ATOM 0 HD22 LEU A 86 0.638 2.738 -6.449 1.00 1.51 H new ATOM 0 HD23 LEU A 86 1.628 2.366 -5.018 1.00 1.51 H new ATOM 1402 N LEU A 87 -0.933 1.732 -8.192 1.00 0.20 N ATOM 1403 CA LEU A 87 -1.462 2.488 -9.313 1.00 0.23 C ATOM 1404 C LEU A 87 -0.691 3.795 -9.428 1.00 0.26 C ATOM 1405 O LEU A 87 -0.243 4.344 -8.425 1.00 0.25 O ATOM 1406 CB LEU A 87 -2.953 2.772 -9.112 1.00 0.23 C ATOM 1407 CG LEU A 87 -3.825 1.544 -8.841 1.00 0.21 C ATOM 1408 CD1 LEU A 87 -5.228 1.969 -8.440 1.00 0.22 C ATOM 1409 CD2 LEU A 87 -3.872 0.638 -10.063 1.00 0.24 C ATOM 0 H LEU A 87 -1.408 1.899 -7.305 1.00 0.20 H new ATOM 0 HA LEU A 87 -1.348 1.908 -10.229 1.00 0.23 H new ATOM 0 HB2 LEU A 87 -3.064 3.466 -8.279 1.00 0.23 H new ATOM 0 HB3 LEU A 87 -3.332 3.277 -10.000 1.00 0.23 H new ATOM 0 HG LEU A 87 -3.383 0.984 -8.017 1.00 0.21 H new ATOM 0 HD11 LEU A 87 -5.836 1.084 -8.251 1.00 0.22 H new ATOM 0 HD12 LEU A 87 -5.180 2.576 -7.536 1.00 0.22 H new ATOM 0 HD13 LEU A 87 -5.676 2.551 -9.245 1.00 0.22 H new ATOM 0 HD21 LEU A 87 -4.497 -0.229 -9.849 1.00 0.24 H new ATOM 0 HD22 LEU A 87 -4.289 1.187 -10.907 1.00 0.24 H new ATOM 0 HD23 LEU A 87 -2.863 0.306 -10.309 1.00 0.24 H new ATOM 1421 N GLN A 88 -0.520 4.292 -10.633 1.00 0.34 N ATOM 1422 CA GLN A 88 0.207 5.533 -10.812 1.00 0.41 C ATOM 1423 C GLN A 88 -0.661 6.537 -11.552 1.00 0.47 C ATOM 1424 O GLN A 88 -1.299 6.199 -12.551 1.00 0.52 O ATOM 1425 CB GLN A 88 1.509 5.266 -11.568 1.00 0.50 C ATOM 1426 CG GLN A 88 2.469 6.440 -11.582 1.00 0.73 C ATOM 1427 CD GLN A 88 3.797 6.102 -12.224 1.00 1.23 C ATOM 1428 OE1 GLN A 88 4.247 4.959 -12.187 1.00 1.93 O ATOM 1429 NE2 GLN A 88 4.440 7.096 -12.817 1.00 1.78 N ATOM 0 H GLN A 88 -0.867 3.866 -11.492 1.00 0.34 H new ATOM 0 HA GLN A 88 0.458 5.953 -9.838 1.00 0.41 H new ATOM 0 HB2 GLN A 88 2.008 4.408 -11.118 1.00 0.50 H new ATOM 0 HB3 GLN A 88 1.270 4.993 -12.596 1.00 0.50 H new ATOM 0 HG2 GLN A 88 2.012 7.271 -12.119 1.00 0.73 H new ATOM 0 HG3 GLN A 88 2.640 6.776 -10.559 1.00 0.73 H new ATOM 0 HE21 GLN A 88 4.034 8.032 -12.827 1.00 1.78 H new ATOM 0 HE22 GLN A 88 5.341 6.926 -13.264 1.00 1.78 H new ATOM 1438 N HIS A 89 -0.644 7.775 -11.065 1.00 0.50 N ATOM 1439 CA HIS A 89 -1.519 8.840 -11.557 1.00 0.58 C ATOM 1440 C HIS A 89 -1.482 9.990 -10.562 1.00 0.56 C ATOM 1441 O HIS A 89 -1.320 11.154 -10.928 1.00 0.58 O ATOM 1442 CB HIS A 89 -2.970 8.340 -11.700 1.00 0.66 C ATOM 1443 CG HIS A 89 -3.886 9.274 -12.440 1.00 0.84 C ATOM 1444 ND1 HIS A 89 -4.477 8.946 -13.641 1.00 1.57 N ATOM 1445 CD2 HIS A 89 -4.330 10.517 -12.134 1.00 1.46 C ATOM 1446 CE1 HIS A 89 -5.244 9.944 -14.041 1.00 1.79 C ATOM 1447 NE2 HIS A 89 -5.172 10.908 -13.144 1.00 1.67 N ATOM 0 H HIS A 89 -0.020 8.071 -10.314 1.00 0.50 H new ATOM 0 HA HIS A 89 -1.170 9.164 -12.538 1.00 0.58 H new ATOM 0 HB2 HIS A 89 -2.960 7.379 -12.215 1.00 0.66 H new ATOM 0 HB3 HIS A 89 -3.379 8.164 -10.705 1.00 0.66 H new ATOM 0 HD2 HIS A 89 -4.070 11.093 -11.258 1.00 1.46 H new ATOM 0 HE1 HIS A 89 -5.830 9.967 -14.948 1.00 1.79 H new ATOM 0 HE2 HIS A 89 -5.663 11.801 -13.193 1.00 1.67 H new ATOM 1456 N PHE A 90 -1.628 9.627 -9.295 1.00 0.58 N ATOM 1457 CA PHE A 90 -1.650 10.576 -8.194 1.00 0.61 C ATOM 1458 C PHE A 90 -0.334 11.348 -8.102 1.00 0.61 C ATOM 1459 O PHE A 90 -0.325 12.533 -7.775 1.00 0.60 O ATOM 1460 CB PHE A 90 -1.913 9.806 -6.900 1.00 0.74 C ATOM 1461 CG PHE A 90 -2.127 10.667 -5.691 1.00 1.67 C ATOM 1462 CD1 PHE A 90 -1.203 10.673 -4.661 1.00 1.56 C ATOM 1463 CD2 PHE A 90 -3.262 11.452 -5.575 1.00 2.87 C ATOM 1464 CE1 PHE A 90 -1.408 11.443 -3.533 1.00 2.57 C ATOM 1465 CE2 PHE A 90 -3.471 12.227 -4.453 1.00 3.95 C ATOM 1466 CZ PHE A 90 -2.545 12.221 -3.429 1.00 3.79 C ATOM 0 H PHE A 90 -1.735 8.656 -9.001 1.00 0.58 H new ATOM 0 HA PHE A 90 -2.441 11.307 -8.362 1.00 0.61 H new ATOM 0 HB2 PHE A 90 -2.791 9.176 -7.040 1.00 0.74 H new ATOM 0 HB3 PHE A 90 -1.070 9.141 -6.711 1.00 0.74 H new ATOM 0 HD1 PHE A 90 -0.311 10.069 -4.740 1.00 1.56 H new ATOM 0 HD2 PHE A 90 -3.991 11.458 -6.371 1.00 2.87 H new ATOM 0 HE1 PHE A 90 -0.681 11.437 -2.734 1.00 2.57 H new ATOM 0 HE2 PHE A 90 -4.358 12.838 -4.376 1.00 3.95 H new ATOM 0 HZ PHE A 90 -2.709 12.824 -2.548 1.00 3.79 H new ATOM 1476 N ASP A 91 0.763 10.669 -8.420 1.00 0.75 N ATOM 1477 CA ASP A 91 2.106 11.247 -8.346 1.00 0.87 C ATOM 1478 C ASP A 91 2.223 12.464 -9.252 1.00 0.92 C ATOM 1479 O ASP A 91 2.917 13.429 -8.939 1.00 1.01 O ATOM 1480 CB ASP A 91 3.168 10.227 -8.786 1.00 1.07 C ATOM 1481 CG ASP A 91 2.708 8.788 -8.694 1.00 1.65 C ATOM 1482 OD1 ASP A 91 3.336 8.011 -7.928 1.00 2.22 O ATOM 1483 OD2 ASP A 91 1.702 8.441 -9.345 1.00 1.88 O ATOM 0 H ASP A 91 0.749 9.700 -8.737 1.00 0.75 H new ATOM 0 HA ASP A 91 2.272 11.535 -7.308 1.00 0.87 H new ATOM 0 HB2 ASP A 91 3.459 10.440 -9.814 1.00 1.07 H new ATOM 0 HB3 ASP A 91 4.058 10.354 -8.170 1.00 1.07 H new ATOM 1488 N SER A 92 1.544 12.401 -10.385 1.00 0.96 N ATOM 1489 CA SER A 92 1.613 13.456 -11.377 1.00 1.15 C ATOM 1490 C SER A 92 0.964 14.734 -10.853 1.00 1.10 C ATOM 1491 O SER A 92 1.456 15.837 -11.092 1.00 1.33 O ATOM 1492 CB SER A 92 0.926 12.994 -12.671 1.00 1.33 C ATOM 1493 OG SER A 92 1.020 13.971 -13.694 1.00 1.78 O ATOM 0 H SER A 92 0.935 11.624 -10.640 1.00 0.96 H new ATOM 0 HA SER A 92 2.660 13.673 -11.588 1.00 1.15 H new ATOM 0 HB2 SER A 92 1.382 12.065 -13.013 1.00 1.33 H new ATOM 0 HB3 SER A 92 -0.123 12.779 -12.469 1.00 1.33 H new ATOM 0 HG SER A 92 0.574 13.642 -14.502 1.00 1.78 H new ATOM 1499 N SER A 93 -0.118 14.580 -10.105 1.00 0.88 N ATOM 1500 CA SER A 93 -0.907 15.721 -9.674 1.00 0.93 C ATOM 1501 C SER A 93 -0.560 16.163 -8.248 1.00 0.83 C ATOM 1502 O SER A 93 -0.571 17.358 -7.940 1.00 0.96 O ATOM 1503 CB SER A 93 -2.387 15.365 -9.785 1.00 0.96 C ATOM 1504 OG SER A 93 -2.711 15.011 -11.122 1.00 1.63 O ATOM 0 H SER A 93 -0.468 13.677 -9.785 1.00 0.88 H new ATOM 0 HA SER A 93 -0.676 16.566 -10.323 1.00 0.93 H new ATOM 0 HB2 SER A 93 -2.620 14.537 -9.116 1.00 0.96 H new ATOM 0 HB3 SER A 93 -2.996 16.211 -9.468 1.00 0.96 H new ATOM 0 HG SER A 93 -3.663 14.783 -11.179 1.00 1.63 H new ATOM 1510 N PHE A 94 -0.249 15.212 -7.382 1.00 0.65 N ATOM 1511 CA PHE A 94 0.095 15.524 -6.003 1.00 0.62 C ATOM 1512 C PHE A 94 1.616 15.558 -5.849 1.00 0.55 C ATOM 1513 O PHE A 94 2.317 14.790 -6.502 1.00 0.56 O ATOM 1514 CB PHE A 94 -0.528 14.486 -5.069 1.00 0.63 C ATOM 1515 CG PHE A 94 -0.766 14.985 -3.670 1.00 1.17 C ATOM 1516 CD1 PHE A 94 0.051 14.575 -2.628 1.00 2.12 C ATOM 1517 CD2 PHE A 94 -1.795 15.868 -3.399 1.00 1.16 C ATOM 1518 CE1 PHE A 94 -0.158 15.035 -1.343 1.00 2.85 C ATOM 1519 CE2 PHE A 94 -2.010 16.331 -2.113 1.00 1.80 C ATOM 1520 CZ PHE A 94 -1.218 15.902 -1.085 1.00 2.62 C ATOM 0 H PHE A 94 -0.228 14.218 -7.609 1.00 0.65 H new ATOM 0 HA PHE A 94 -0.300 16.505 -5.737 1.00 0.62 H new ATOM 0 HB2 PHE A 94 -1.477 14.155 -5.492 1.00 0.63 H new ATOM 0 HB3 PHE A 94 0.124 13.613 -5.026 1.00 0.63 H new ATOM 0 HD1 PHE A 94 0.861 13.888 -2.824 1.00 2.12 H new ATOM 0 HD2 PHE A 94 -2.438 16.200 -4.200 1.00 1.16 H new ATOM 0 HE1 PHE A 94 0.497 14.724 -0.542 1.00 2.85 H new ATOM 0 HE2 PHE A 94 -2.807 17.034 -1.921 1.00 1.80 H new ATOM 0 HZ PHE A 94 -1.413 16.234 -0.076 1.00 2.62 H new ATOM 1530 N PRO A 95 2.149 16.448 -4.992 1.00 0.57 N ATOM 1531 CA PRO A 95 3.605 16.601 -4.797 1.00 0.56 C ATOM 1532 C PRO A 95 4.278 15.415 -4.089 1.00 0.50 C ATOM 1533 O PRO A 95 5.352 15.568 -3.502 1.00 0.68 O ATOM 1534 CB PRO A 95 3.710 17.857 -3.927 1.00 0.61 C ATOM 1535 CG PRO A 95 2.415 17.909 -3.198 1.00 0.62 C ATOM 1536 CD PRO A 95 1.389 17.411 -4.173 1.00 0.69 C ATOM 0 HA PRO A 95 4.118 16.660 -5.757 1.00 0.56 H new ATOM 0 HB2 PRO A 95 4.552 17.794 -3.238 1.00 0.61 H new ATOM 0 HB3 PRO A 95 3.861 18.750 -4.534 1.00 0.61 H new ATOM 0 HG2 PRO A 95 2.442 17.286 -2.304 1.00 0.62 H new ATOM 0 HG3 PRO A 95 2.188 18.924 -2.873 1.00 0.62 H new ATOM 0 HD2 PRO A 95 0.549 16.936 -3.667 1.00 0.69 H new ATOM 0 HD3 PRO A 95 0.980 18.221 -4.778 1.00 0.69 H new ATOM 1544 N ILE A 96 3.658 14.242 -4.133 1.00 0.36 N ATOM 1545 CA ILE A 96 4.289 13.036 -3.615 1.00 0.29 C ATOM 1546 C ILE A 96 4.468 12.021 -4.734 1.00 0.31 C ATOM 1547 O ILE A 96 3.496 11.567 -5.332 1.00 0.34 O ATOM 1548 CB ILE A 96 3.496 12.365 -2.478 1.00 0.23 C ATOM 1549 CG1 ILE A 96 3.119 13.374 -1.399 1.00 0.29 C ATOM 1550 CG2 ILE A 96 4.345 11.262 -1.873 1.00 0.26 C ATOM 1551 CD1 ILE A 96 2.371 12.764 -0.236 1.00 0.24 C ATOM 0 H ILE A 96 2.725 14.101 -4.520 1.00 0.36 H new ATOM 0 HA ILE A 96 5.249 13.353 -3.207 1.00 0.29 H new ATOM 0 HB ILE A 96 2.574 11.952 -2.888 1.00 0.23 H new ATOM 0 HG12 ILE A 96 4.025 13.852 -1.027 1.00 0.29 H new ATOM 0 HG13 ILE A 96 2.506 14.157 -1.844 1.00 0.29 H new ATOM 0 HG21 ILE A 96 3.793 10.779 -1.066 1.00 0.26 H new ATOM 0 HG22 ILE A 96 4.585 10.525 -2.640 1.00 0.26 H new ATOM 0 HG23 ILE A 96 5.267 11.688 -1.478 1.00 0.26 H new ATOM 0 HD11 ILE A 96 2.136 13.540 0.492 1.00 0.24 H new ATOM 0 HD12 ILE A 96 1.447 12.311 -0.595 1.00 0.24 H new ATOM 0 HD13 ILE A 96 2.990 12.000 0.235 1.00 0.24 H new ATOM 1563 N LYS A 97 5.712 11.677 -5.015 1.00 0.35 N ATOM 1564 CA LYS A 97 6.019 10.695 -6.041 1.00 0.38 C ATOM 1565 C LYS A 97 6.852 9.572 -5.439 1.00 0.35 C ATOM 1566 O LYS A 97 7.962 9.803 -4.959 1.00 0.44 O ATOM 1567 CB LYS A 97 6.765 11.357 -7.204 1.00 0.50 C ATOM 1568 CG LYS A 97 6.005 12.515 -7.832 1.00 0.75 C ATOM 1569 CD LYS A 97 6.760 13.113 -9.005 1.00 0.78 C ATOM 1570 CE LYS A 97 5.991 14.268 -9.622 1.00 0.91 C ATOM 1571 NZ LYS A 97 6.698 14.847 -10.792 1.00 1.38 N ATOM 0 H LYS A 97 6.530 12.065 -4.545 1.00 0.35 H new ATOM 0 HA LYS A 97 5.090 10.277 -6.428 1.00 0.38 H new ATOM 0 HB2 LYS A 97 7.730 11.717 -6.848 1.00 0.50 H new ATOM 0 HB3 LYS A 97 6.967 10.608 -7.969 1.00 0.50 H new ATOM 0 HG2 LYS A 97 5.027 12.169 -8.167 1.00 0.75 H new ATOM 0 HG3 LYS A 97 5.830 13.285 -7.081 1.00 0.75 H new ATOM 0 HD2 LYS A 97 7.738 13.460 -8.672 1.00 0.78 H new ATOM 0 HD3 LYS A 97 6.934 12.345 -9.758 1.00 0.78 H new ATOM 0 HE2 LYS A 97 5.004 13.923 -9.930 1.00 0.91 H new ATOM 0 HE3 LYS A 97 5.838 15.043 -8.871 1.00 0.91 H new ATOM 0 HZ1 LYS A 97 6.138 15.632 -11.182 1.00 1.38 H new ATOM 0 HZ2 LYS A 97 7.630 15.200 -10.495 1.00 1.38 H new ATOM 0 HZ3 LYS A 97 6.822 14.115 -11.520 1.00 1.38 H new ATOM 1585 N VAL A 98 6.324 8.354 -5.473 1.00 0.30 N ATOM 1586 CA VAL A 98 6.957 7.236 -4.780 1.00 0.26 C ATOM 1587 C VAL A 98 6.868 5.944 -5.577 1.00 0.28 C ATOM 1588 O VAL A 98 6.195 5.879 -6.606 1.00 0.33 O ATOM 1589 CB VAL A 98 6.316 6.999 -3.396 1.00 0.21 C ATOM 1590 CG1 VAL A 98 6.507 8.216 -2.509 1.00 0.25 C ATOM 1591 CG2 VAL A 98 4.837 6.660 -3.536 1.00 0.21 C ATOM 0 H VAL A 98 5.465 8.115 -5.969 1.00 0.30 H new ATOM 0 HA VAL A 98 8.005 7.510 -4.662 1.00 0.26 H new ATOM 0 HB VAL A 98 6.814 6.150 -2.928 1.00 0.21 H new ATOM 0 HG11 VAL A 98 6.049 8.033 -1.537 1.00 0.25 H new ATOM 0 HG12 VAL A 98 7.572 8.408 -2.379 1.00 0.25 H new ATOM 0 HG13 VAL A 98 6.037 9.083 -2.974 1.00 0.25 H new ATOM 0 HG21 VAL A 98 4.406 6.497 -2.548 1.00 0.21 H new ATOM 0 HG22 VAL A 98 4.320 7.485 -4.026 1.00 0.21 H new ATOM 0 HG23 VAL A 98 4.726 5.755 -4.134 1.00 0.21 H new ATOM 1601 N ASP A 99 7.581 4.935 -5.104 1.00 0.28 N ATOM 1602 CA ASP A 99 7.486 3.588 -5.642 1.00 0.32 C ATOM 1603 C ASP A 99 7.824 2.578 -4.550 1.00 0.23 C ATOM 1604 O ASP A 99 8.734 2.781 -3.748 1.00 0.27 O ATOM 1605 CB ASP A 99 8.361 3.402 -6.894 1.00 0.51 C ATOM 1606 CG ASP A 99 9.750 3.990 -6.769 1.00 0.63 C ATOM 1607 OD1 ASP A 99 10.697 3.229 -6.472 1.00 1.11 O ATOM 1608 OD2 ASP A 99 9.896 5.218 -6.922 1.00 0.98 O ATOM 0 H ASP A 99 8.244 5.027 -4.334 1.00 0.28 H new ATOM 0 HA ASP A 99 6.460 3.416 -5.968 1.00 0.32 H new ATOM 0 HB2 ASP A 99 8.447 2.337 -7.109 1.00 0.51 H new ATOM 0 HB3 ASP A 99 7.859 3.860 -7.746 1.00 0.51 H new ATOM 1613 N LEU A 100 7.048 1.508 -4.514 1.00 0.19 N ATOM 1614 CA LEU A 100 7.034 0.583 -3.394 1.00 0.13 C ATOM 1615 C LEU A 100 8.087 -0.511 -3.533 1.00 0.13 C ATOM 1616 O LEU A 100 8.314 -1.033 -4.624 1.00 0.16 O ATOM 1617 CB LEU A 100 5.647 -0.061 -3.305 1.00 0.18 C ATOM 1618 CG LEU A 100 4.500 0.855 -2.852 1.00 0.25 C ATOM 1619 CD1 LEU A 100 4.333 2.066 -3.750 1.00 0.26 C ATOM 1620 CD2 LEU A 100 3.203 0.070 -2.804 1.00 0.35 C ATOM 0 H LEU A 100 6.406 1.255 -5.266 1.00 0.19 H new ATOM 0 HA LEU A 100 7.265 1.146 -2.490 1.00 0.13 H new ATOM 0 HB2 LEU A 100 5.395 -0.467 -4.285 1.00 0.18 H new ATOM 0 HB3 LEU A 100 5.704 -0.904 -2.616 1.00 0.18 H new ATOM 0 HG LEU A 100 4.754 1.222 -1.858 1.00 0.25 H new ATOM 0 HD11 LEU A 100 3.509 2.679 -3.385 1.00 0.26 H new ATOM 0 HD12 LEU A 100 5.252 2.652 -3.745 1.00 0.26 H new ATOM 0 HD13 LEU A 100 4.118 1.738 -4.767 1.00 0.26 H new ATOM 0 HD21 LEU A 100 2.393 0.725 -2.482 1.00 0.35 H new ATOM 0 HD22 LEU A 100 2.979 -0.324 -3.795 1.00 0.35 H new ATOM 0 HD23 LEU A 100 3.303 -0.756 -2.100 1.00 0.35 H new ATOM 1632 N TYR A 101 8.720 -0.857 -2.414 1.00 0.13 N ATOM 1633 CA TYR A 101 9.706 -1.933 -2.383 1.00 0.16 C ATOM 1634 C TYR A 101 9.329 -2.981 -1.342 1.00 0.16 C ATOM 1635 O TYR A 101 8.974 -2.645 -0.209 1.00 0.19 O ATOM 1636 CB TYR A 101 11.118 -1.391 -2.096 1.00 0.19 C ATOM 1637 CG TYR A 101 11.798 -0.778 -3.304 1.00 0.21 C ATOM 1638 CD1 TYR A 101 11.167 0.193 -4.066 1.00 0.20 C ATOM 1639 CD2 TYR A 101 13.072 -1.181 -3.687 1.00 0.26 C ATOM 1640 CE1 TYR A 101 11.776 0.743 -5.170 1.00 0.24 C ATOM 1641 CE2 TYR A 101 13.692 -0.631 -4.793 1.00 0.30 C ATOM 1642 CZ TYR A 101 13.038 0.331 -5.531 1.00 0.28 C ATOM 1643 OH TYR A 101 13.644 0.881 -6.638 1.00 0.33 O ATOM 0 H TYR A 101 8.566 -0.405 -1.513 1.00 0.13 H new ATOM 0 HA TYR A 101 9.712 -2.400 -3.368 1.00 0.16 H new ATOM 0 HB2 TYR A 101 11.055 -0.641 -1.307 1.00 0.19 H new ATOM 0 HB3 TYR A 101 11.738 -2.203 -1.716 1.00 0.19 H new ATOM 0 HD1 TYR A 101 10.178 0.524 -3.787 1.00 0.20 H new ATOM 0 HD2 TYR A 101 13.586 -1.936 -3.111 1.00 0.26 H new ATOM 0 HE1 TYR A 101 11.265 1.496 -5.752 1.00 0.24 H new ATOM 0 HE2 TYR A 101 14.683 -0.953 -5.077 1.00 0.30 H new ATOM 0 HH TYR A 101 13.164 1.693 -6.904 1.00 0.33 H new ATOM 1653 N PHE A 102 9.388 -4.246 -1.742 1.00 0.16 N ATOM 1654 CA PHE A 102 9.151 -5.358 -0.832 1.00 0.16 C ATOM 1655 C PHE A 102 10.461 -6.047 -0.477 1.00 0.15 C ATOM 1656 O PHE A 102 11.379 -6.121 -1.291 1.00 0.19 O ATOM 1657 CB PHE A 102 8.206 -6.407 -1.448 1.00 0.20 C ATOM 1658 CG PHE A 102 6.751 -6.055 -1.395 1.00 0.16 C ATOM 1659 CD1 PHE A 102 6.281 -5.172 -0.451 1.00 0.24 C ATOM 1660 CD2 PHE A 102 5.851 -6.635 -2.273 1.00 0.25 C ATOM 1661 CE1 PHE A 102 4.945 -4.864 -0.372 1.00 0.27 C ATOM 1662 CE2 PHE A 102 4.507 -6.329 -2.206 1.00 0.34 C ATOM 1663 CZ PHE A 102 4.051 -5.440 -1.251 1.00 0.31 C ATOM 0 H PHE A 102 9.600 -4.527 -2.699 1.00 0.16 H new ATOM 0 HA PHE A 102 8.688 -4.940 0.062 1.00 0.16 H new ATOM 0 HB2 PHE A 102 8.489 -6.563 -2.489 1.00 0.20 H new ATOM 0 HB3 PHE A 102 8.354 -7.356 -0.932 1.00 0.20 H new ATOM 0 HD1 PHE A 102 6.974 -4.714 0.239 1.00 0.24 H new ATOM 0 HD2 PHE A 102 6.204 -7.333 -3.017 1.00 0.25 H new ATOM 0 HE1 PHE A 102 4.594 -4.171 0.378 1.00 0.27 H new ATOM 0 HE2 PHE A 102 3.813 -6.783 -2.898 1.00 0.34 H new ATOM 0 HZ PHE A 102 3.000 -5.197 -1.193 1.00 0.31 H new ATOM 1673 N LEU A 103 10.535 -6.545 0.739 1.00 0.16 N ATOM 1674 CA LEU A 103 11.641 -7.376 1.178 1.00 0.17 C ATOM 1675 C LEU A 103 11.162 -8.816 1.173 1.00 0.18 C ATOM 1676 O LEU A 103 10.270 -9.163 1.937 1.00 0.19 O ATOM 1677 CB LEU A 103 12.065 -6.961 2.595 1.00 0.18 C ATOM 1678 CG LEU A 103 13.468 -7.383 3.062 1.00 0.22 C ATOM 1679 CD1 LEU A 103 13.637 -8.894 3.107 1.00 0.22 C ATOM 1680 CD2 LEU A 103 14.539 -6.765 2.186 1.00 0.25 C ATOM 0 H LEU A 103 9.827 -6.385 1.456 1.00 0.16 H new ATOM 0 HA LEU A 103 12.500 -7.262 0.517 1.00 0.17 H new ATOM 0 HB2 LEU A 103 11.999 -5.875 2.663 1.00 0.18 H new ATOM 0 HB3 LEU A 103 11.338 -7.369 3.298 1.00 0.18 H new ATOM 0 HG LEU A 103 13.581 -7.011 4.080 1.00 0.22 H new ATOM 0 HD11 LEU A 103 14.645 -9.138 3.443 1.00 0.22 H new ATOM 0 HD12 LEU A 103 12.911 -9.321 3.799 1.00 0.22 H new ATOM 0 HD13 LEU A 103 13.476 -9.308 2.111 1.00 0.22 H new ATOM 0 HD21 LEU A 103 15.522 -7.079 2.537 1.00 0.25 H new ATOM 0 HD22 LEU A 103 14.400 -7.092 1.156 1.00 0.25 H new ATOM 0 HD23 LEU A 103 14.466 -5.678 2.234 1.00 0.25 H new ATOM 1692 N LYS A 104 11.713 -9.644 0.308 1.00 0.23 N ATOM 1693 CA LYS A 104 11.257 -11.018 0.201 1.00 0.29 C ATOM 1694 C LYS A 104 12.414 -12.000 0.315 1.00 0.33 C ATOM 1695 O LYS A 104 13.123 -12.261 -0.659 1.00 0.39 O ATOM 1696 CB LYS A 104 10.501 -11.196 -1.106 1.00 0.42 C ATOM 1697 CG LYS A 104 9.153 -10.506 -1.075 1.00 0.60 C ATOM 1698 CD LYS A 104 8.596 -10.287 -2.460 1.00 0.64 C ATOM 1699 CE LYS A 104 8.237 -11.601 -3.131 1.00 0.66 C ATOM 1700 NZ LYS A 104 7.854 -11.412 -4.553 1.00 1.22 N ATOM 0 H LYS A 104 12.471 -9.394 -0.327 1.00 0.23 H new ATOM 0 HA LYS A 104 10.584 -11.233 1.031 1.00 0.29 H new ATOM 0 HB2 LYS A 104 11.095 -10.795 -1.927 1.00 0.42 H new ATOM 0 HB3 LYS A 104 10.361 -12.259 -1.303 1.00 0.42 H new ATOM 0 HG2 LYS A 104 8.453 -11.106 -0.494 1.00 0.60 H new ATOM 0 HG3 LYS A 104 9.249 -9.546 -0.567 1.00 0.60 H new ATOM 0 HD2 LYS A 104 7.711 -9.654 -2.401 1.00 0.64 H new ATOM 0 HD3 LYS A 104 9.328 -9.755 -3.068 1.00 0.64 H new ATOM 0 HE2 LYS A 104 9.086 -12.282 -3.071 1.00 0.66 H new ATOM 0 HE3 LYS A 104 7.413 -12.070 -2.593 1.00 0.66 H new ATOM 0 HZ1 LYS A 104 7.291 -12.226 -4.872 1.00 1.22 H new ATOM 0 HZ2 LYS A 104 7.291 -10.543 -4.648 1.00 1.22 H new ATOM 0 HZ3 LYS A 104 8.712 -11.334 -5.136 1.00 1.22 H new ATOM 1714 N GLY A 105 12.597 -12.539 1.514 1.00 0.34 N ATOM 1715 CA GLY A 105 13.713 -13.421 1.773 1.00 0.42 C ATOM 1716 C GLY A 105 14.984 -12.629 1.957 1.00 0.40 C ATOM 1717 O GLY A 105 15.229 -12.066 3.025 1.00 0.40 O ATOM 0 H GLY A 105 11.986 -12.378 2.315 1.00 0.34 H new ATOM 0 HA2 GLY A 105 13.515 -14.014 2.666 1.00 0.42 H new ATOM 0 HA3 GLY A 105 13.831 -14.120 0.945 1.00 0.42 H new ATOM 1721 N SER A 106 15.786 -12.575 0.914 1.00 0.40 N ATOM 1722 CA SER A 106 16.950 -11.715 0.891 1.00 0.41 C ATOM 1723 C SER A 106 16.867 -10.769 -0.295 1.00 0.37 C ATOM 1724 O SER A 106 17.605 -9.792 -0.386 1.00 0.41 O ATOM 1725 CB SER A 106 18.226 -12.550 0.814 1.00 0.52 C ATOM 1726 OG SER A 106 18.120 -13.551 -0.187 1.00 1.31 O ATOM 0 H SER A 106 15.651 -13.122 0.064 1.00 0.40 H new ATOM 0 HA SER A 106 16.976 -11.130 1.810 1.00 0.41 H new ATOM 0 HB2 SER A 106 19.076 -11.903 0.597 1.00 0.52 H new ATOM 0 HB3 SER A 106 18.419 -13.016 1.780 1.00 0.52 H new ATOM 0 HG SER A 106 18.950 -14.071 -0.218 1.00 1.31 H new ATOM 1732 N LYS A 107 15.940 -11.054 -1.194 1.00 0.36 N ATOM 1733 CA LYS A 107 15.801 -10.279 -2.406 1.00 0.37 C ATOM 1734 C LYS A 107 14.768 -9.176 -2.225 1.00 0.32 C ATOM 1735 O LYS A 107 13.591 -9.444 -1.971 1.00 0.39 O ATOM 1736 CB LYS A 107 15.400 -11.190 -3.570 1.00 0.47 C ATOM 1737 CG LYS A 107 15.270 -10.471 -4.907 1.00 0.65 C ATOM 1738 CD LYS A 107 16.597 -9.897 -5.381 1.00 0.95 C ATOM 1739 CE LYS A 107 17.630 -10.988 -5.618 1.00 1.57 C ATOM 1740 NZ LYS A 107 18.904 -10.439 -6.151 1.00 2.27 N ATOM 0 H LYS A 107 15.272 -11.820 -1.103 1.00 0.36 H new ATOM 0 HA LYS A 107 16.762 -9.816 -2.631 1.00 0.37 H new ATOM 0 HB2 LYS A 107 16.140 -11.984 -3.667 1.00 0.47 H new ATOM 0 HB3 LYS A 107 14.449 -11.668 -3.333 1.00 0.47 H new ATOM 0 HG2 LYS A 107 14.888 -11.165 -5.656 1.00 0.65 H new ATOM 0 HG3 LYS A 107 14.540 -9.667 -4.816 1.00 0.65 H new ATOM 0 HD2 LYS A 107 16.442 -9.336 -6.303 1.00 0.95 H new ATOM 0 HD3 LYS A 107 16.975 -9.193 -4.639 1.00 0.95 H new ATOM 0 HE2 LYS A 107 17.824 -11.513 -4.683 1.00 1.57 H new ATOM 0 HE3 LYS A 107 17.230 -11.721 -6.318 1.00 1.57 H new ATOM 0 HZ1 LYS A 107 19.624 -11.189 -6.171 1.00 2.27 H new ATOM 0 HZ2 LYS A 107 18.751 -10.080 -7.115 1.00 2.27 H new ATOM 0 HZ3 LYS A 107 19.230 -9.663 -5.540 1.00 2.27 H new ATOM 1754 N VAL A 108 15.218 -7.939 -2.326 1.00 0.24 N ATOM 1755 CA VAL A 108 14.313 -6.804 -2.341 1.00 0.22 C ATOM 1756 C VAL A 108 13.682 -6.674 -3.725 1.00 0.23 C ATOM 1757 O VAL A 108 14.376 -6.688 -4.745 1.00 0.30 O ATOM 1758 CB VAL A 108 15.030 -5.492 -1.939 1.00 0.26 C ATOM 1759 CG1 VAL A 108 16.340 -5.345 -2.682 1.00 0.74 C ATOM 1760 CG2 VAL A 108 14.134 -4.286 -2.185 1.00 0.79 C ATOM 0 H VAL A 108 16.206 -7.694 -2.399 1.00 0.24 H new ATOM 0 HA VAL A 108 13.531 -6.979 -1.602 1.00 0.22 H new ATOM 0 HB VAL A 108 15.247 -5.541 -0.872 1.00 0.26 H new ATOM 0 HG11 VAL A 108 16.826 -4.416 -2.383 1.00 0.74 H new ATOM 0 HG12 VAL A 108 16.990 -6.187 -2.444 1.00 0.74 H new ATOM 0 HG13 VAL A 108 16.150 -5.326 -3.755 1.00 0.74 H new ATOM 0 HG21 VAL A 108 14.660 -3.377 -1.895 1.00 0.79 H new ATOM 0 HG22 VAL A 108 13.876 -4.234 -3.243 1.00 0.79 H new ATOM 0 HG23 VAL A 108 13.223 -4.383 -1.594 1.00 0.79 H new ATOM 1770 N MET A 109 12.367 -6.579 -3.752 1.00 0.22 N ATOM 1771 CA MET A 109 11.617 -6.562 -4.995 1.00 0.27 C ATOM 1772 C MET A 109 10.657 -5.379 -5.030 1.00 0.24 C ATOM 1773 O MET A 109 9.735 -5.302 -4.222 1.00 0.25 O ATOM 1774 CB MET A 109 10.830 -7.865 -5.146 1.00 0.36 C ATOM 1775 CG MET A 109 11.699 -9.103 -5.303 1.00 0.44 C ATOM 1776 SD MET A 109 10.727 -10.617 -5.406 1.00 1.47 S ATOM 1777 CE MET A 109 12.017 -11.845 -5.604 1.00 1.85 C ATOM 0 H MET A 109 11.788 -6.511 -2.915 1.00 0.22 H new ATOM 0 HA MET A 109 12.322 -6.464 -5.820 1.00 0.27 H new ATOM 0 HB2 MET A 109 10.189 -7.993 -4.273 1.00 0.36 H new ATOM 0 HB3 MET A 109 10.175 -7.782 -6.013 1.00 0.36 H new ATOM 0 HG2 MET A 109 12.308 -9.004 -6.201 1.00 0.44 H new ATOM 0 HG3 MET A 109 12.385 -9.172 -4.459 1.00 0.44 H new ATOM 0 HE1 MET A 109 11.570 -12.801 -5.876 1.00 1.85 H new ATOM 0 HE2 MET A 109 12.703 -11.529 -6.390 1.00 1.85 H new ATOM 0 HE3 MET A 109 12.563 -11.953 -4.667 1.00 1.85 H new ATOM 1787 N PRO A 110 10.869 -4.434 -5.954 1.00 0.24 N ATOM 1788 CA PRO A 110 9.986 -3.278 -6.112 1.00 0.23 C ATOM 1789 C PRO A 110 8.658 -3.649 -6.775 1.00 0.21 C ATOM 1790 O PRO A 110 8.565 -4.643 -7.494 1.00 0.20 O ATOM 1791 CB PRO A 110 10.804 -2.342 -6.995 1.00 0.27 C ATOM 1792 CG PRO A 110 11.653 -3.247 -7.804 1.00 0.29 C ATOM 1793 CD PRO A 110 11.987 -4.408 -6.913 1.00 0.28 C ATOM 0 HA PRO A 110 9.699 -2.836 -5.158 1.00 0.23 H new ATOM 0 HB2 PRO A 110 10.161 -1.729 -7.627 1.00 0.27 H new ATOM 0 HB3 PRO A 110 11.408 -1.659 -6.398 1.00 0.27 H new ATOM 0 HG2 PRO A 110 11.126 -3.580 -8.698 1.00 0.29 H new ATOM 0 HG3 PRO A 110 12.558 -2.739 -8.138 1.00 0.29 H new ATOM 0 HD2 PRO A 110 12.056 -5.339 -7.475 1.00 0.28 H new ATOM 0 HD3 PRO A 110 12.944 -4.267 -6.411 1.00 0.28 H new ATOM 1801 N LEU A 111 7.638 -2.839 -6.528 1.00 0.23 N ATOM 1802 CA LEU A 111 6.295 -3.103 -7.029 1.00 0.22 C ATOM 1803 C LEU A 111 6.158 -2.578 -8.456 1.00 0.22 C ATOM 1804 O LEU A 111 6.652 -1.498 -8.778 1.00 0.26 O ATOM 1805 CB LEU A 111 5.263 -2.409 -6.128 1.00 0.27 C ATOM 1806 CG LEU A 111 3.952 -3.160 -5.858 1.00 0.27 C ATOM 1807 CD1 LEU A 111 3.436 -3.885 -7.093 1.00 0.24 C ATOM 1808 CD2 LEU A 111 4.128 -4.126 -4.704 1.00 0.31 C ATOM 0 H LEU A 111 7.716 -1.984 -5.977 1.00 0.23 H new ATOM 0 HA LEU A 111 6.119 -4.179 -7.024 1.00 0.22 H new ATOM 0 HB2 LEU A 111 5.737 -2.201 -5.169 1.00 0.27 H new ATOM 0 HB3 LEU A 111 5.015 -1.447 -6.576 1.00 0.27 H new ATOM 0 HG LEU A 111 3.201 -2.417 -5.590 1.00 0.27 H new ATOM 0 HD11 LEU A 111 2.507 -4.401 -6.850 1.00 0.24 H new ATOM 0 HD12 LEU A 111 3.253 -3.163 -7.889 1.00 0.24 H new ATOM 0 HD13 LEU A 111 4.178 -4.611 -7.425 1.00 0.24 H new ATOM 0 HD21 LEU A 111 3.190 -4.652 -4.523 1.00 0.31 H new ATOM 0 HD22 LEU A 111 4.907 -4.848 -4.949 1.00 0.31 H new ATOM 0 HD23 LEU A 111 4.413 -3.574 -3.808 1.00 0.31 H new ATOM 1820 N ASN A 112 5.477 -3.339 -9.298 1.00 0.22 N ATOM 1821 CA ASN A 112 5.230 -2.933 -10.672 1.00 0.25 C ATOM 1822 C ASN A 112 3.926 -2.147 -10.745 1.00 0.23 C ATOM 1823 O ASN A 112 2.960 -2.464 -10.046 1.00 0.22 O ATOM 1824 CB ASN A 112 5.161 -4.159 -11.590 1.00 0.29 C ATOM 1825 CG ASN A 112 6.449 -4.962 -11.602 1.00 1.06 C ATOM 1826 OD1 ASN A 112 7.539 -4.422 -11.401 1.00 1.85 O ATOM 1827 ND2 ASN A 112 6.335 -6.260 -11.838 1.00 1.69 N ATOM 0 H ASN A 112 5.083 -4.247 -9.051 1.00 0.22 H new ATOM 0 HA ASN A 112 6.051 -2.300 -11.007 1.00 0.25 H new ATOM 0 HB2 ASN A 112 4.341 -4.802 -11.268 1.00 0.29 H new ATOM 0 HB3 ASN A 112 4.932 -3.834 -12.605 1.00 0.29 H new ATOM 0 HD21 ASN A 112 7.167 -6.850 -11.858 1.00 1.69 H new ATOM 0 HD22 ASN A 112 5.415 -6.670 -12.000 1.00 1.69 H new ATOM 1834 N THR A 113 3.910 -1.119 -11.580 1.00 0.29 N ATOM 1835 CA THR A 113 2.764 -0.229 -11.686 1.00 0.31 C ATOM 1836 C THR A 113 1.525 -0.968 -12.205 1.00 0.28 C ATOM 1837 O THR A 113 1.532 -1.534 -13.299 1.00 0.32 O ATOM 1838 CB THR A 113 3.075 0.958 -12.615 1.00 0.41 C ATOM 1839 OG1 THR A 113 4.250 1.642 -12.156 1.00 0.47 O ATOM 1840 CG2 THR A 113 1.906 1.931 -12.664 1.00 0.45 C ATOM 0 H THR A 113 4.685 -0.879 -12.199 1.00 0.29 H new ATOM 0 HA THR A 113 2.554 0.143 -10.683 1.00 0.31 H new ATOM 0 HB THR A 113 3.246 0.570 -13.619 1.00 0.41 H new ATOM 0 HG1 THR A 113 4.117 2.610 -12.236 1.00 0.47 H new ATOM 0 HG21 THR A 113 2.151 2.761 -13.327 1.00 0.45 H new ATOM 0 HG22 THR A 113 1.020 1.417 -13.038 1.00 0.45 H new ATOM 0 HG23 THR A 113 1.708 2.313 -11.662 1.00 0.45 H new ATOM 1848 N GLY A 114 0.477 -0.958 -11.392 1.00 0.26 N ATOM 1849 CA GLY A 114 -0.792 -1.550 -11.766 1.00 0.27 C ATOM 1850 C GLY A 114 -0.738 -3.057 -11.888 1.00 0.28 C ATOM 1851 O GLY A 114 -1.533 -3.654 -12.611 1.00 0.38 O ATOM 0 H GLY A 114 0.486 -0.541 -10.461 1.00 0.26 H new ATOM 0 HA2 GLY A 114 -1.544 -1.279 -11.024 1.00 0.27 H new ATOM 0 HA3 GLY A 114 -1.116 -1.127 -12.717 1.00 0.27 H new ATOM 1855 N GLU A 115 0.188 -3.678 -11.181 1.00 0.26 N ATOM 1856 CA GLU A 115 0.304 -5.121 -11.205 1.00 0.27 C ATOM 1857 C GLU A 115 0.203 -5.688 -9.801 1.00 0.24 C ATOM 1858 O GLU A 115 0.905 -5.241 -8.897 1.00 0.23 O ATOM 1859 CB GLU A 115 1.629 -5.534 -11.835 1.00 0.30 C ATOM 1860 CG GLU A 115 1.763 -7.033 -12.030 1.00 0.38 C ATOM 1861 CD GLU A 115 2.889 -7.394 -12.968 1.00 1.07 C ATOM 1862 OE1 GLU A 115 4.040 -7.516 -12.497 1.00 1.93 O ATOM 1863 OE2 GLU A 115 2.635 -7.563 -14.176 1.00 1.19 O ATOM 0 H GLU A 115 0.868 -3.206 -10.585 1.00 0.26 H new ATOM 0 HA GLU A 115 -0.515 -5.520 -11.804 1.00 0.27 H new ATOM 0 HB2 GLU A 115 1.734 -5.039 -12.800 1.00 0.30 H new ATOM 0 HB3 GLU A 115 2.447 -5.182 -11.206 1.00 0.30 H new ATOM 0 HG2 GLU A 115 1.932 -7.508 -11.064 1.00 0.38 H new ATOM 0 HG3 GLU A 115 0.827 -7.431 -12.421 1.00 0.38 H new ATOM 1870 N PRO A 116 -0.709 -6.646 -9.591 1.00 0.27 N ATOM 1871 CA PRO A 116 -0.791 -7.384 -8.334 1.00 0.26 C ATOM 1872 C PRO A 116 0.467 -8.208 -8.107 1.00 0.23 C ATOM 1873 O PRO A 116 0.733 -9.177 -8.820 1.00 0.27 O ATOM 1874 CB PRO A 116 -2.023 -8.281 -8.518 1.00 0.33 C ATOM 1875 CG PRO A 116 -2.780 -7.665 -9.643 1.00 0.68 C ATOM 1876 CD PRO A 116 -1.741 -7.071 -10.543 1.00 0.34 C ATOM 0 HA PRO A 116 -0.876 -6.734 -7.463 1.00 0.26 H new ATOM 0 HB2 PRO A 116 -1.734 -9.306 -8.750 1.00 0.33 H new ATOM 0 HB3 PRO A 116 -2.625 -8.317 -7.610 1.00 0.33 H new ATOM 0 HG2 PRO A 116 -3.377 -8.410 -10.170 1.00 0.68 H new ATOM 0 HG3 PRO A 116 -3.469 -6.902 -9.282 1.00 0.68 H new ATOM 0 HD2 PRO A 116 -1.359 -7.799 -11.259 1.00 0.34 H new ATOM 0 HD3 PRO A 116 -2.133 -6.233 -11.119 1.00 0.34 H new ATOM 1884 N PHE A 117 1.229 -7.812 -7.106 1.00 0.20 N ATOM 1885 CA PHE A 117 2.522 -8.414 -6.835 1.00 0.21 C ATOM 1886 C PHE A 117 2.510 -9.088 -5.466 1.00 0.21 C ATOM 1887 O PHE A 117 1.848 -8.618 -4.542 1.00 0.19 O ATOM 1888 CB PHE A 117 3.597 -7.328 -6.913 1.00 0.23 C ATOM 1889 CG PHE A 117 5.013 -7.829 -6.864 1.00 0.28 C ATOM 1890 CD1 PHE A 117 5.995 -7.076 -6.245 1.00 0.29 C ATOM 1891 CD2 PHE A 117 5.363 -9.044 -7.433 1.00 0.34 C ATOM 1892 CE1 PHE A 117 7.299 -7.523 -6.191 1.00 0.35 C ATOM 1893 CE2 PHE A 117 6.667 -9.497 -7.382 1.00 0.40 C ATOM 1894 CZ PHE A 117 7.636 -8.735 -6.760 1.00 0.41 C ATOM 0 H PHE A 117 0.971 -7.067 -6.459 1.00 0.20 H new ATOM 0 HA PHE A 117 2.742 -9.182 -7.577 1.00 0.21 H new ATOM 0 HB2 PHE A 117 3.458 -6.767 -7.837 1.00 0.23 H new ATOM 0 HB3 PHE A 117 3.446 -6.629 -6.090 1.00 0.23 H new ATOM 0 HD1 PHE A 117 5.738 -6.127 -5.799 1.00 0.29 H new ATOM 0 HD2 PHE A 117 4.608 -9.643 -7.921 1.00 0.34 H new ATOM 0 HE1 PHE A 117 8.056 -6.925 -5.704 1.00 0.35 H new ATOM 0 HE2 PHE A 117 6.928 -10.445 -7.828 1.00 0.40 H new ATOM 0 HZ PHE A 117 8.656 -9.087 -6.719 1.00 0.41 H new ATOM 1904 N VAL A 118 3.227 -10.204 -5.361 1.00 0.25 N ATOM 1905 CA VAL A 118 3.223 -11.039 -4.162 1.00 0.28 C ATOM 1906 C VAL A 118 3.602 -10.255 -2.907 1.00 0.26 C ATOM 1907 O VAL A 118 4.763 -9.893 -2.721 1.00 0.29 O ATOM 1908 CB VAL A 118 4.192 -12.232 -4.306 1.00 0.35 C ATOM 1909 CG1 VAL A 118 4.124 -13.131 -3.082 1.00 0.65 C ATOM 1910 CG2 VAL A 118 3.896 -13.024 -5.570 1.00 0.71 C ATOM 0 H VAL A 118 3.828 -10.556 -6.106 1.00 0.25 H new ATOM 0 HA VAL A 118 2.201 -11.402 -4.055 1.00 0.28 H new ATOM 0 HB VAL A 118 5.204 -11.836 -4.385 1.00 0.35 H new ATOM 0 HG11 VAL A 118 4.815 -13.965 -3.205 1.00 0.65 H new ATOM 0 HG12 VAL A 118 4.399 -12.560 -2.195 1.00 0.65 H new ATOM 0 HG13 VAL A 118 3.110 -13.513 -2.967 1.00 0.65 H new ATOM 0 HG21 VAL A 118 4.593 -13.859 -5.648 1.00 0.71 H new ATOM 0 HG22 VAL A 118 2.876 -13.405 -5.530 1.00 0.71 H new ATOM 0 HG23 VAL A 118 4.007 -12.376 -6.440 1.00 0.71 H new ATOM 1920 N VAL A 119 2.610 -10.006 -2.059 1.00 0.23 N ATOM 1921 CA VAL A 119 2.833 -9.355 -0.774 1.00 0.22 C ATOM 1922 C VAL A 119 2.664 -10.358 0.364 1.00 0.23 C ATOM 1923 O VAL A 119 3.178 -10.169 1.466 1.00 0.23 O ATOM 1924 CB VAL A 119 1.856 -8.176 -0.571 1.00 0.21 C ATOM 1925 CG1 VAL A 119 0.418 -8.656 -0.602 1.00 0.21 C ATOM 1926 CG2 VAL A 119 2.142 -7.452 0.733 1.00 0.22 C ATOM 0 H VAL A 119 1.636 -10.248 -2.241 1.00 0.23 H new ATOM 0 HA VAL A 119 3.852 -8.968 -0.769 1.00 0.22 H new ATOM 0 HB VAL A 119 2.004 -7.475 -1.392 1.00 0.21 H new ATOM 0 HG11 VAL A 119 -0.252 -7.808 -0.457 1.00 0.21 H new ATOM 0 HG12 VAL A 119 0.211 -9.122 -1.565 1.00 0.21 H new ATOM 0 HG13 VAL A 119 0.260 -9.384 0.194 1.00 0.21 H new ATOM 0 HG21 VAL A 119 1.441 -6.626 0.852 1.00 0.22 H new ATOM 0 HG22 VAL A 119 2.031 -8.146 1.566 1.00 0.22 H new ATOM 0 HG23 VAL A 119 3.160 -7.064 0.718 1.00 0.22 H new ATOM 1936 N GLN A 120 1.947 -11.434 0.073 1.00 0.27 N ATOM 1937 CA GLN A 120 1.668 -12.467 1.061 1.00 0.33 C ATOM 1938 C GLN A 120 2.948 -13.033 1.661 1.00 0.45 C ATOM 1939 O GLN A 120 3.009 -13.332 2.853 1.00 1.35 O ATOM 1940 CB GLN A 120 0.862 -13.605 0.430 1.00 0.32 C ATOM 1941 CG GLN A 120 1.471 -14.144 -0.854 1.00 0.37 C ATOM 1942 CD GLN A 120 0.813 -15.422 -1.337 1.00 0.45 C ATOM 1943 OE1 GLN A 120 1.467 -16.267 -1.948 1.00 1.23 O ATOM 1944 NE2 GLN A 120 -0.477 -15.571 -1.086 1.00 1.21 N ATOM 0 H GLN A 120 1.545 -11.615 -0.847 1.00 0.27 H new ATOM 0 HA GLN A 120 1.089 -12.002 1.859 1.00 0.33 H new ATOM 0 HB2 GLN A 120 0.774 -14.419 1.150 1.00 0.32 H new ATOM 0 HB3 GLN A 120 -0.148 -13.252 0.223 1.00 0.32 H new ATOM 0 HG2 GLN A 120 1.391 -13.385 -1.633 1.00 0.37 H new ATOM 0 HG3 GLN A 120 2.534 -14.328 -0.695 1.00 0.37 H new ATOM 0 HE21 GLN A 120 -0.984 -14.848 -0.576 1.00 1.21 H new ATOM 0 HE22 GLN A 120 -0.965 -16.409 -1.402 1.00 1.21 H new ATOM 1953 N ASP A 121 3.969 -13.167 0.835 1.00 0.72 N ATOM 1954 CA ASP A 121 5.199 -13.810 1.252 1.00 0.76 C ATOM 1955 C ASP A 121 6.349 -12.813 1.256 1.00 0.65 C ATOM 1956 O ASP A 121 7.346 -12.984 0.557 1.00 0.96 O ATOM 1957 CB ASP A 121 5.500 -14.995 0.331 1.00 0.96 C ATOM 1958 CG ASP A 121 6.655 -15.846 0.825 1.00 1.47 C ATOM 1959 OD1 ASP A 121 7.718 -15.866 0.168 1.00 1.55 O ATOM 1960 OD2 ASP A 121 6.504 -16.509 1.874 1.00 2.35 O ATOM 0 H ASP A 121 3.970 -12.838 -0.130 1.00 0.72 H new ATOM 0 HA ASP A 121 5.080 -14.182 2.269 1.00 0.76 H new ATOM 0 HB2 ASP A 121 4.609 -15.616 0.243 1.00 0.96 H new ATOM 0 HB3 ASP A 121 5.730 -14.624 -0.668 1.00 0.96 H new ATOM 1965 N ILE A 122 6.185 -11.747 2.021 1.00 0.37 N ATOM 1966 CA ILE A 122 7.243 -10.773 2.187 1.00 0.29 C ATOM 1967 C ILE A 122 7.695 -10.731 3.639 1.00 0.24 C ATOM 1968 O ILE A 122 6.982 -11.167 4.544 1.00 0.32 O ATOM 1969 CB ILE A 122 6.818 -9.351 1.750 1.00 0.29 C ATOM 1970 CG1 ILE A 122 5.795 -8.750 2.716 1.00 0.26 C ATOM 1971 CG2 ILE A 122 6.253 -9.375 0.338 1.00 0.36 C ATOM 1972 CD1 ILE A 122 5.540 -7.279 2.471 1.00 0.31 C ATOM 0 H ILE A 122 5.329 -11.537 2.535 1.00 0.37 H new ATOM 0 HA ILE A 122 8.063 -11.090 1.542 1.00 0.29 H new ATOM 0 HB ILE A 122 7.707 -8.721 1.767 1.00 0.29 H new ATOM 0 HG12 ILE A 122 4.855 -9.295 2.626 1.00 0.26 H new ATOM 0 HG13 ILE A 122 6.146 -8.886 3.739 1.00 0.26 H new ATOM 0 HG21 ILE A 122 5.959 -8.367 0.047 1.00 0.36 H new ATOM 0 HG22 ILE A 122 7.012 -9.745 -0.351 1.00 0.36 H new ATOM 0 HG23 ILE A 122 5.383 -10.030 0.305 1.00 0.36 H new ATOM 0 HD11 ILE A 122 4.806 -6.913 3.188 1.00 0.31 H new ATOM 0 HD12 ILE A 122 6.471 -6.724 2.589 1.00 0.31 H new ATOM 0 HD13 ILE A 122 5.160 -7.139 1.459 1.00 0.31 H new ATOM 1984 N ASP A 123 8.895 -10.230 3.835 1.00 0.23 N ATOM 1985 CA ASP A 123 9.460 -10.035 5.157 1.00 0.25 C ATOM 1986 C ASP A 123 9.124 -8.644 5.652 1.00 0.25 C ATOM 1987 O ASP A 123 8.772 -8.441 6.814 1.00 0.29 O ATOM 1988 CB ASP A 123 10.978 -10.202 5.096 1.00 0.26 C ATOM 1989 CG ASP A 123 11.403 -11.646 4.946 1.00 0.32 C ATOM 1990 OD1 ASP A 123 11.310 -12.188 3.823 1.00 0.30 O ATOM 1991 OD2 ASP A 123 11.834 -12.249 5.946 1.00 0.50 O ATOM 0 H ASP A 123 9.513 -9.943 3.076 1.00 0.23 H new ATOM 0 HA ASP A 123 9.042 -10.774 5.840 1.00 0.25 H new ATOM 0 HB2 ASP A 123 11.369 -9.624 4.259 1.00 0.26 H new ATOM 0 HB3 ASP A 123 11.421 -9.790 6.003 1.00 0.26 H new ATOM 1996 N ALA A 124 9.243 -7.683 4.752 1.00 0.21 N ATOM 1997 CA ALA A 124 8.958 -6.302 5.068 1.00 0.21 C ATOM 1998 C ALA A 124 8.579 -5.539 3.809 1.00 0.19 C ATOM 1999 O ALA A 124 8.862 -5.980 2.701 1.00 0.19 O ATOM 2000 CB ALA A 124 10.171 -5.665 5.732 1.00 0.22 C ATOM 0 H ALA A 124 9.538 -7.841 3.789 1.00 0.21 H new ATOM 0 HA ALA A 124 8.116 -6.262 5.759 1.00 0.21 H new ATOM 0 HB1 ALA A 124 9.952 -4.624 5.968 1.00 0.22 H new ATOM 0 HB2 ALA A 124 10.408 -6.203 6.650 1.00 0.22 H new ATOM 0 HB3 ALA A 124 11.023 -5.711 5.054 1.00 0.22 H new ATOM 2006 N MET A 125 7.912 -4.416 3.987 1.00 0.19 N ATOM 2007 CA MET A 125 7.655 -3.495 2.893 1.00 0.16 C ATOM 2008 C MET A 125 8.039 -2.077 3.321 1.00 0.16 C ATOM 2009 O MET A 125 8.057 -1.766 4.512 1.00 0.18 O ATOM 2010 CB MET A 125 6.182 -3.524 2.420 1.00 0.24 C ATOM 2011 CG MET A 125 5.825 -2.231 1.698 1.00 0.31 C ATOM 2012 SD MET A 125 4.441 -2.231 0.581 1.00 1.16 S ATOM 2013 CE MET A 125 4.456 -0.486 0.189 1.00 0.73 C ATOM 0 H MET A 125 7.535 -4.116 4.886 1.00 0.19 H new ATOM 0 HA MET A 125 8.265 -3.814 2.047 1.00 0.16 H new ATOM 0 HB2 MET A 125 6.025 -4.373 1.755 1.00 0.24 H new ATOM 0 HB3 MET A 125 5.522 -3.663 3.276 1.00 0.24 H new ATOM 0 HG2 MET A 125 5.638 -1.470 2.456 1.00 0.31 H new ATOM 0 HG3 MET A 125 6.703 -1.913 1.136 1.00 0.31 H new ATOM 0 HE1 MET A 125 3.508 -0.208 -0.271 1.00 0.73 H new ATOM 0 HE2 MET A 125 4.599 0.091 1.103 1.00 0.73 H new ATOM 0 HE3 MET A 125 5.271 -0.276 -0.504 1.00 0.73 H new ATOM 2023 N SER A 126 8.370 -1.232 2.354 1.00 0.16 N ATOM 2024 CA SER A 126 8.636 0.169 2.620 1.00 0.18 C ATOM 2025 C SER A 126 8.131 1.014 1.468 1.00 0.22 C ATOM 2026 O SER A 126 7.913 0.508 0.363 1.00 0.29 O ATOM 2027 CB SER A 126 10.129 0.396 2.803 1.00 0.24 C ATOM 2028 OG SER A 126 10.836 -0.053 1.666 1.00 1.22 O ATOM 0 H SER A 126 8.460 -1.498 1.373 1.00 0.16 H new ATOM 0 HA SER A 126 8.119 0.457 3.535 1.00 0.18 H new ATOM 0 HB2 SER A 126 10.325 1.456 2.967 1.00 0.24 H new ATOM 0 HB3 SER A 126 10.478 -0.134 3.689 1.00 0.24 H new ATOM 0 HG SER A 126 10.991 -1.018 1.737 1.00 1.22 H new ATOM 2034 N VAL A 127 7.929 2.290 1.728 1.00 0.21 N ATOM 2035 CA VAL A 127 7.539 3.209 0.684 1.00 0.23 C ATOM 2036 C VAL A 127 8.639 4.237 0.495 1.00 0.22 C ATOM 2037 O VAL A 127 8.832 5.114 1.335 1.00 0.19 O ATOM 2038 CB VAL A 127 6.223 3.927 1.028 1.00 0.23 C ATOM 2039 CG1 VAL A 127 5.638 4.587 -0.209 1.00 0.27 C ATOM 2040 CG2 VAL A 127 5.232 2.956 1.655 1.00 0.26 C ATOM 0 H VAL A 127 8.029 2.711 2.652 1.00 0.21 H new ATOM 0 HA VAL A 127 7.383 2.642 -0.234 1.00 0.23 H new ATOM 0 HB VAL A 127 6.433 4.709 1.758 1.00 0.23 H new ATOM 0 HG11 VAL A 127 4.707 5.090 0.053 1.00 0.27 H new ATOM 0 HG12 VAL A 127 6.347 5.316 -0.602 1.00 0.27 H new ATOM 0 HG13 VAL A 127 5.440 3.829 -0.967 1.00 0.27 H new ATOM 0 HG21 VAL A 127 4.307 3.482 1.892 1.00 0.26 H new ATOM 0 HG22 VAL A 127 5.021 2.148 0.954 1.00 0.26 H new ATOM 0 HG23 VAL A 127 5.657 2.541 2.569 1.00 0.26 H new ATOM 2050 N LEU A 128 9.358 4.115 -0.603 1.00 0.28 N ATOM 2051 CA LEU A 128 10.456 5.015 -0.898 1.00 0.32 C ATOM 2052 C LEU A 128 10.035 6.009 -1.976 1.00 0.33 C ATOM 2053 O LEU A 128 9.334 5.653 -2.927 1.00 0.38 O ATOM 2054 CB LEU A 128 11.675 4.229 -1.382 1.00 0.43 C ATOM 2055 CG LEU A 128 12.623 3.605 -0.330 1.00 0.21 C ATOM 2056 CD1 LEU A 128 11.931 3.221 0.974 1.00 0.34 C ATOM 2057 CD2 LEU A 128 13.289 2.380 -0.922 1.00 0.42 C ATOM 0 H LEU A 128 9.200 3.397 -1.310 1.00 0.28 H new ATOM 0 HA LEU A 128 10.718 5.552 0.013 1.00 0.32 H new ATOM 0 HB2 LEU A 128 11.316 3.423 -2.022 1.00 0.43 H new ATOM 0 HB3 LEU A 128 12.269 4.894 -2.009 1.00 0.43 H new ATOM 0 HG LEU A 128 13.355 4.373 -0.078 1.00 0.21 H new ATOM 0 HD11 LEU A 128 12.661 2.791 1.660 1.00 0.34 H new ATOM 0 HD12 LEU A 128 11.487 4.108 1.426 1.00 0.34 H new ATOM 0 HD13 LEU A 128 11.150 2.489 0.769 1.00 0.34 H new ATOM 0 HD21 LEU A 128 13.958 1.937 -0.184 1.00 0.42 H new ATOM 0 HD22 LEU A 128 12.528 1.653 -1.204 1.00 0.42 H new ATOM 0 HD23 LEU A 128 13.861 2.667 -1.804 1.00 0.42 H new ATOM 2069 N PRO A 129 10.427 7.271 -1.821 1.00 0.35 N ATOM 2070 CA PRO A 129 10.150 8.309 -2.798 1.00 0.40 C ATOM 2071 C PRO A 129 11.182 8.343 -3.917 1.00 0.56 C ATOM 2072 O PRO A 129 12.364 8.524 -3.648 1.00 0.91 O ATOM 2073 CB PRO A 129 10.217 9.584 -1.969 1.00 0.47 C ATOM 2074 CG PRO A 129 11.172 9.279 -0.858 1.00 0.52 C ATOM 2075 CD PRO A 129 11.194 7.776 -0.685 1.00 0.41 C ATOM 0 HA PRO A 129 9.196 8.157 -3.302 1.00 0.40 H new ATOM 0 HB2 PRO A 129 10.565 10.425 -2.568 1.00 0.47 H new ATOM 0 HB3 PRO A 129 9.235 9.854 -1.581 1.00 0.47 H new ATOM 0 HG2 PRO A 129 12.168 9.654 -1.094 1.00 0.52 H new ATOM 0 HG3 PRO A 129 10.858 9.768 0.064 1.00 0.52 H new ATOM 0 HD2 PRO A 129 12.213 7.390 -0.690 1.00 0.41 H new ATOM 0 HD3 PRO A 129 10.745 7.478 0.262 1.00 0.41 H new ATOM 2083 N LYS A 130 10.692 8.194 -5.152 1.00 0.43 N ATOM 2084 CA LYS A 130 11.487 8.225 -6.403 1.00 0.53 C ATOM 2085 C LYS A 130 12.917 7.676 -6.282 1.00 0.47 C ATOM 2086 O LYS A 130 13.200 6.585 -6.780 1.00 0.81 O ATOM 2087 CB LYS A 130 11.497 9.630 -7.003 1.00 0.74 C ATOM 2088 CG LYS A 130 10.169 10.040 -7.621 1.00 0.83 C ATOM 2089 CD LYS A 130 9.632 8.960 -8.552 1.00 1.76 C ATOM 2090 CE LYS A 130 8.519 8.160 -7.892 1.00 2.10 C ATOM 2091 NZ LYS A 130 8.394 6.789 -8.460 1.00 3.29 N ATOM 0 H LYS A 130 9.698 8.043 -5.324 1.00 0.43 H new ATOM 0 HA LYS A 130 10.977 7.536 -7.077 1.00 0.53 H new ATOM 0 HB2 LYS A 130 11.762 10.346 -6.225 1.00 0.74 H new ATOM 0 HB3 LYS A 130 12.275 9.685 -7.765 1.00 0.74 H new ATOM 0 HG2 LYS A 130 9.443 10.235 -6.831 1.00 0.83 H new ATOM 0 HG3 LYS A 130 10.296 10.970 -8.175 1.00 0.83 H new ATOM 0 HD2 LYS A 130 9.258 9.419 -9.467 1.00 1.76 H new ATOM 0 HD3 LYS A 130 10.442 8.290 -8.840 1.00 1.76 H new ATOM 0 HE2 LYS A 130 8.710 8.091 -6.821 1.00 2.10 H new ATOM 0 HE3 LYS A 130 7.574 8.689 -8.014 1.00 2.10 H new ATOM 0 HZ1 LYS A 130 7.491 6.369 -8.159 1.00 3.29 H new ATOM 0 HZ2 LYS A 130 8.423 6.839 -9.498 1.00 3.29 H new ATOM 0 HZ3 LYS A 130 9.180 6.199 -8.120 1.00 3.29 H new ATOM 2105 N GLY A 131 13.826 8.454 -5.684 1.00 0.43 N ATOM 2106 CA GLY A 131 15.166 7.966 -5.386 1.00 0.39 C ATOM 2107 C GLY A 131 15.148 6.859 -4.340 1.00 0.33 C ATOM 2108 O GLY A 131 15.700 6.999 -3.248 1.00 0.44 O ATOM 0 H GLY A 131 13.654 9.419 -5.400 1.00 0.43 H new ATOM 0 HA2 GLY A 131 15.628 7.594 -6.300 1.00 0.39 H new ATOM 0 HA3 GLY A 131 15.782 8.792 -5.030 1.00 0.39 H new ATOM 2112 N SER A 132 14.516 5.760 -4.705 1.00 0.31 N ATOM 2113 CA SER A 132 14.303 4.611 -3.842 1.00 0.36 C ATOM 2114 C SER A 132 15.571 3.787 -3.659 1.00 0.39 C ATOM 2115 O SER A 132 15.553 2.750 -2.995 1.00 0.44 O ATOM 2116 CB SER A 132 13.183 3.755 -4.414 1.00 0.49 C ATOM 2117 OG SER A 132 12.030 4.544 -4.646 1.00 1.23 O ATOM 0 H SER A 132 14.124 5.637 -5.639 1.00 0.31 H new ATOM 0 HA SER A 132 14.021 4.975 -2.854 1.00 0.36 H new ATOM 0 HB2 SER A 132 13.509 3.293 -5.346 1.00 0.49 H new ATOM 0 HB3 SER A 132 12.945 2.946 -3.723 1.00 0.49 H new ATOM 0 HG SER A 132 11.598 4.256 -5.477 1.00 1.23 H new ATOM 2123 N SER A 133 16.655 4.221 -4.291 1.00 0.40 N ATOM 2124 CA SER A 133 17.915 3.489 -4.272 1.00 0.48 C ATOM 2125 C SER A 133 18.420 3.208 -2.844 1.00 0.45 C ATOM 2126 O SER A 133 19.394 2.478 -2.666 1.00 0.51 O ATOM 2127 CB SER A 133 18.968 4.263 -5.061 1.00 0.58 C ATOM 2128 OG SER A 133 18.429 4.740 -6.285 1.00 1.30 O ATOM 0 H SER A 133 16.685 5.087 -4.829 1.00 0.40 H new ATOM 0 HA SER A 133 17.736 2.520 -4.737 1.00 0.48 H new ATOM 0 HB2 SER A 133 19.331 5.101 -4.467 1.00 0.58 H new ATOM 0 HB3 SER A 133 19.825 3.620 -5.262 1.00 0.58 H new ATOM 0 HG SER A 133 19.118 5.235 -6.775 1.00 1.30 H new ATOM 2134 N SER A 134 17.751 3.781 -1.841 1.00 0.40 N ATOM 2135 CA SER A 134 17.997 3.440 -0.442 1.00 0.39 C ATOM 2136 C SER A 134 17.963 1.928 -0.237 1.00 0.34 C ATOM 2137 O SER A 134 18.817 1.361 0.444 1.00 0.39 O ATOM 2138 CB SER A 134 16.929 4.084 0.443 1.00 0.39 C ATOM 2139 OG SER A 134 16.842 5.480 0.221 1.00 0.44 O ATOM 0 H SER A 134 17.029 4.489 -1.976 1.00 0.40 H new ATOM 0 HA SER A 134 18.984 3.813 -0.170 1.00 0.39 H new ATOM 0 HB2 SER A 134 15.962 3.622 0.243 1.00 0.39 H new ATOM 0 HB3 SER A 134 17.161 3.895 1.491 1.00 0.39 H new ATOM 0 HG SER A 134 16.552 5.925 1.045 1.00 0.44 H new ATOM 2145 N LEU A 135 16.969 1.283 -0.833 1.00 0.28 N ATOM 2146 CA LEU A 135 16.792 -0.150 -0.678 1.00 0.26 C ATOM 2147 C LEU A 135 16.972 -0.883 -2.004 1.00 0.28 C ATOM 2148 O LEU A 135 16.667 -2.069 -2.113 1.00 0.37 O ATOM 2149 CB LEU A 135 15.406 -0.432 -0.103 1.00 0.24 C ATOM 2150 CG LEU A 135 15.185 0.086 1.315 1.00 0.24 C ATOM 2151 CD1 LEU A 135 13.759 -0.146 1.755 1.00 0.25 C ATOM 2152 CD2 LEU A 135 16.156 -0.597 2.256 1.00 0.29 C ATOM 0 H LEU A 135 16.273 1.732 -1.429 1.00 0.28 H new ATOM 0 HA LEU A 135 17.556 -0.518 0.007 1.00 0.26 H new ATOM 0 HB2 LEU A 135 14.658 0.014 -0.759 1.00 0.24 H new ATOM 0 HB3 LEU A 135 15.236 -1.509 -0.112 1.00 0.24 H new ATOM 0 HG LEU A 135 15.365 1.161 1.334 1.00 0.24 H new ATOM 0 HD11 LEU A 135 13.625 0.231 2.769 1.00 0.25 H new ATOM 0 HD12 LEU A 135 13.081 0.377 1.081 1.00 0.25 H new ATOM 0 HD13 LEU A 135 13.541 -1.214 1.733 1.00 0.25 H new ATOM 0 HD21 LEU A 135 16.000 -0.229 3.270 1.00 0.29 H new ATOM 0 HD22 LEU A 135 15.990 -1.674 2.232 1.00 0.29 H new ATOM 0 HD23 LEU A 135 17.178 -0.381 1.944 1.00 0.29 H new ATOM 2164 N LYS A 136 17.479 -0.180 -3.006 1.00 0.30 N ATOM 2165 CA LYS A 136 17.678 -0.770 -4.319 1.00 0.35 C ATOM 2166 C LYS A 136 19.067 -1.397 -4.406 1.00 0.37 C ATOM 2167 O LYS A 136 19.988 -0.828 -4.993 1.00 0.42 O ATOM 2168 CB LYS A 136 17.493 0.292 -5.407 1.00 0.40 C ATOM 2169 CG LYS A 136 17.350 -0.276 -6.808 1.00 0.46 C ATOM 2170 CD LYS A 136 16.860 0.779 -7.792 1.00 0.57 C ATOM 2171 CE LYS A 136 17.904 1.852 -8.057 1.00 0.98 C ATOM 2172 NZ LYS A 136 19.102 1.306 -8.746 1.00 1.66 N ATOM 0 H LYS A 136 17.759 0.798 -2.934 1.00 0.30 H new ATOM 0 HA LYS A 136 16.936 -1.553 -4.474 1.00 0.35 H new ATOM 0 HB2 LYS A 136 16.608 0.885 -5.175 1.00 0.40 H new ATOM 0 HB3 LYS A 136 18.346 0.970 -5.387 1.00 0.40 H new ATOM 0 HG2 LYS A 136 18.310 -0.668 -7.142 1.00 0.46 H new ATOM 0 HG3 LYS A 136 16.652 -1.113 -6.793 1.00 0.46 H new ATOM 0 HD2 LYS A 136 16.590 0.298 -8.732 1.00 0.57 H new ATOM 0 HD3 LYS A 136 15.955 1.245 -7.401 1.00 0.57 H new ATOM 0 HE2 LYS A 136 17.465 2.642 -8.666 1.00 0.98 H new ATOM 0 HE3 LYS A 136 18.205 2.306 -7.113 1.00 0.98 H new ATOM 0 HZ1 LYS A 136 19.676 2.090 -9.117 1.00 1.66 H new ATOM 0 HZ2 LYS A 136 19.668 0.752 -8.072 1.00 1.66 H new ATOM 0 HZ3 LYS A 136 18.802 0.694 -9.532 1.00 1.66 H new ATOM 2186 N VAL A 137 19.208 -2.560 -3.798 1.00 0.37 N ATOM 2187 CA VAL A 137 20.473 -3.278 -3.777 1.00 0.42 C ATOM 2188 C VAL A 137 20.232 -4.747 -4.106 1.00 0.46 C ATOM 2189 O VAL A 137 19.133 -5.247 -3.874 1.00 0.51 O ATOM 2190 CB VAL A 137 21.167 -3.120 -2.398 1.00 0.41 C ATOM 2191 CG1 VAL A 137 20.202 -3.446 -1.277 1.00 0.34 C ATOM 2192 CG2 VAL A 137 22.413 -3.986 -2.281 1.00 0.51 C ATOM 0 H VAL A 137 18.452 -3.035 -3.305 1.00 0.37 H new ATOM 0 HA VAL A 137 21.138 -2.856 -4.531 1.00 0.42 H new ATOM 0 HB VAL A 137 21.479 -2.079 -2.314 1.00 0.41 H new ATOM 0 HG11 VAL A 137 20.706 -3.330 -0.318 1.00 0.34 H new ATOM 0 HG12 VAL A 137 19.349 -2.769 -1.323 1.00 0.34 H new ATOM 0 HG13 VAL A 137 19.856 -4.474 -1.383 1.00 0.34 H new ATOM 0 HG21 VAL A 137 22.865 -3.842 -1.300 1.00 0.51 H new ATOM 0 HG22 VAL A 137 22.141 -5.034 -2.405 1.00 0.51 H new ATOM 0 HG23 VAL A 137 23.127 -3.703 -3.054 1.00 0.51 H new ATOM 2202 N LYS A 138 21.228 -5.412 -4.684 1.00 0.50 N ATOM 2203 CA LYS A 138 21.094 -6.802 -5.126 1.00 0.57 C ATOM 2204 C LYS A 138 20.384 -7.683 -4.090 1.00 0.47 C ATOM 2205 O LYS A 138 19.498 -8.466 -4.433 1.00 0.53 O ATOM 2206 CB LYS A 138 22.465 -7.375 -5.473 1.00 0.69 C ATOM 2207 CG LYS A 138 23.487 -7.124 -4.395 1.00 1.22 C ATOM 2208 CD LYS A 138 24.911 -7.145 -4.930 1.00 1.34 C ATOM 2209 CE LYS A 138 25.204 -5.924 -5.792 1.00 1.59 C ATOM 2210 NZ LYS A 138 26.638 -5.843 -6.177 1.00 2.06 N ATOM 0 H LYS A 138 22.148 -5.008 -4.860 1.00 0.50 H new ATOM 0 HA LYS A 138 20.467 -6.801 -6.018 1.00 0.57 H new ATOM 0 HB2 LYS A 138 22.375 -8.448 -5.640 1.00 0.69 H new ATOM 0 HB3 LYS A 138 22.813 -6.935 -6.408 1.00 0.69 H new ATOM 0 HG2 LYS A 138 23.291 -6.158 -3.930 1.00 1.22 H new ATOM 0 HG3 LYS A 138 23.383 -7.880 -3.616 1.00 1.22 H new ATOM 0 HD2 LYS A 138 25.613 -7.180 -4.097 1.00 1.34 H new ATOM 0 HD3 LYS A 138 25.067 -8.051 -5.516 1.00 1.34 H new ATOM 0 HE2 LYS A 138 24.589 -5.959 -6.691 1.00 1.59 H new ATOM 0 HE3 LYS A 138 24.923 -5.022 -5.249 1.00 1.59 H new ATOM 0 HZ1 LYS A 138 26.793 -4.998 -6.763 1.00 2.06 H new ATOM 0 HZ2 LYS A 138 27.225 -5.783 -5.320 1.00 2.06 H new ATOM 0 HZ3 LYS A 138 26.901 -6.692 -6.718 1.00 2.06 H new ATOM 2224 N THR A 139 20.760 -7.534 -2.831 1.00 0.37 N ATOM 2225 CA THR A 139 20.113 -8.254 -1.745 1.00 0.29 C ATOM 2226 C THR A 139 19.973 -7.354 -0.525 1.00 0.25 C ATOM 2227 O THR A 139 20.796 -6.462 -0.310 1.00 0.28 O ATOM 2228 CB THR A 139 20.883 -9.536 -1.375 1.00 0.31 C ATOM 2229 OG1 THR A 139 22.236 -9.456 -1.850 1.00 0.39 O ATOM 2230 CG2 THR A 139 20.199 -10.757 -1.966 1.00 0.39 C ATOM 0 H THR A 139 21.515 -6.917 -2.534 1.00 0.37 H new ATOM 0 HA THR A 139 19.121 -8.549 -2.088 1.00 0.29 H new ATOM 0 HB THR A 139 20.892 -9.631 -0.289 1.00 0.31 H new ATOM 0 HG1 THR A 139 22.717 -10.275 -1.608 1.00 0.39 H new ATOM 0 HG21 THR A 139 20.757 -11.653 -1.695 1.00 0.39 H new ATOM 0 HG22 THR A 139 19.184 -10.829 -1.576 1.00 0.39 H new ATOM 0 HG23 THR A 139 20.165 -10.665 -3.052 1.00 0.39 H new ATOM 2238 N MET A 140 18.937 -7.577 0.272 1.00 0.26 N ATOM 2239 CA MET A 140 18.625 -6.666 1.362 1.00 0.32 C ATOM 2240 C MET A 140 18.207 -7.390 2.634 1.00 0.34 C ATOM 2241 O MET A 140 17.710 -8.517 2.602 1.00 0.38 O ATOM 2242 CB MET A 140 17.531 -5.695 0.949 1.00 0.38 C ATOM 2243 CG MET A 140 18.013 -4.266 0.909 1.00 0.60 C ATOM 2244 SD MET A 140 18.937 -3.803 2.375 1.00 0.78 S ATOM 2245 CE MET A 140 17.588 -3.575 3.510 1.00 0.40 C ATOM 0 H MET A 140 18.305 -8.373 0.185 1.00 0.26 H new ATOM 0 HA MET A 140 19.543 -6.121 1.580 1.00 0.32 H new ATOM 0 HB2 MET A 140 17.153 -5.975 -0.034 1.00 0.38 H new ATOM 0 HB3 MET A 140 16.697 -5.774 1.646 1.00 0.38 H new ATOM 0 HG2 MET A 140 18.641 -4.124 0.029 1.00 0.60 H new ATOM 0 HG3 MET A 140 17.156 -3.601 0.800 1.00 0.60 H new ATOM 0 HE1 MET A 140 17.424 -2.509 3.671 1.00 0.40 H new ATOM 0 HE2 MET A 140 16.685 -4.023 3.096 1.00 0.40 H new ATOM 0 HE3 MET A 140 17.827 -4.053 4.460 1.00 0.40 H new ATOM 2255 N ALA A 141 18.422 -6.708 3.750 1.00 0.34 N ATOM 2256 CA ALA A 141 18.076 -7.219 5.081 1.00 0.38 C ATOM 2257 C ALA A 141 16.667 -6.789 5.471 1.00 0.34 C ATOM 2258 O ALA A 141 16.276 -5.659 5.210 1.00 0.36 O ATOM 2259 CB ALA A 141 19.071 -6.698 6.110 1.00 0.44 C ATOM 0 H ALA A 141 18.843 -5.779 3.764 1.00 0.34 H new ATOM 0 HA ALA A 141 18.116 -8.308 5.054 1.00 0.38 H new ATOM 0 HB1 ALA A 141 18.809 -7.081 7.096 1.00 0.44 H new ATOM 0 HB2 ALA A 141 20.075 -7.031 5.847 1.00 0.44 H new ATOM 0 HB3 ALA A 141 19.043 -5.608 6.125 1.00 0.44 H new ATOM 2265 N LYS A 142 15.914 -7.676 6.117 1.00 0.32 N ATOM 2266 CA LYS A 142 14.587 -7.322 6.623 1.00 0.30 C ATOM 2267 C LYS A 142 14.701 -6.261 7.711 1.00 0.26 C ATOM 2268 O LYS A 142 13.844 -5.388 7.839 1.00 0.24 O ATOM 2269 CB LYS A 142 13.856 -8.551 7.182 1.00 0.33 C ATOM 2270 CG LYS A 142 12.556 -8.198 7.898 1.00 0.32 C ATOM 2271 CD LYS A 142 11.917 -9.402 8.577 1.00 0.38 C ATOM 2272 CE LYS A 142 10.724 -8.982 9.416 1.00 0.49 C ATOM 2273 NZ LYS A 142 10.105 -10.135 10.118 1.00 1.11 N ATOM 0 H LYS A 142 16.196 -8.639 6.302 1.00 0.32 H new ATOM 0 HA LYS A 142 14.010 -6.927 5.787 1.00 0.30 H new ATOM 0 HB2 LYS A 142 13.639 -9.240 6.366 1.00 0.33 H new ATOM 0 HB3 LYS A 142 14.515 -9.075 7.875 1.00 0.33 H new ATOM 0 HG2 LYS A 142 12.753 -7.427 8.643 1.00 0.32 H new ATOM 0 HG3 LYS A 142 11.853 -7.775 7.180 1.00 0.32 H new ATOM 0 HD2 LYS A 142 11.601 -10.124 7.824 1.00 0.38 H new ATOM 0 HD3 LYS A 142 12.652 -9.901 9.208 1.00 0.38 H new ATOM 0 HE2 LYS A 142 11.039 -8.238 10.148 1.00 0.49 H new ATOM 0 HE3 LYS A 142 9.981 -8.505 8.777 1.00 0.49 H new ATOM 0 HZ1 LYS A 142 9.510 -9.788 10.897 1.00 1.11 H new ATOM 0 HZ2 LYS A 142 9.520 -10.675 9.449 1.00 1.11 H new ATOM 0 HZ3 LYS A 142 10.851 -10.750 10.500 1.00 1.11 H new ATOM 2287 N ASP A 143 15.788 -6.327 8.457 1.00 0.29 N ATOM 2288 CA ASP A 143 15.985 -5.477 9.619 1.00 0.31 C ATOM 2289 C ASP A 143 16.351 -4.064 9.184 1.00 0.28 C ATOM 2290 O ASP A 143 15.846 -3.076 9.720 1.00 0.29 O ATOM 2291 CB ASP A 143 17.087 -6.070 10.498 1.00 0.37 C ATOM 2292 CG ASP A 143 17.198 -5.385 11.844 1.00 0.49 C ATOM 2293 OD1 ASP A 143 16.491 -5.790 12.789 1.00 0.66 O ATOM 2294 OD2 ASP A 143 17.990 -4.429 11.966 1.00 0.52 O ATOM 0 H ASP A 143 16.559 -6.970 8.276 1.00 0.29 H new ATOM 0 HA ASP A 143 15.059 -5.427 10.192 1.00 0.31 H new ATOM 0 HB2 ASP A 143 16.891 -7.131 10.651 1.00 0.37 H new ATOM 0 HB3 ASP A 143 18.041 -5.994 9.977 1.00 0.37 H new ATOM 2299 N MET A 144 17.225 -3.984 8.197 1.00 0.29 N ATOM 2300 CA MET A 144 17.634 -2.709 7.630 1.00 0.30 C ATOM 2301 C MET A 144 16.536 -2.129 6.748 1.00 0.24 C ATOM 2302 O MET A 144 16.358 -0.917 6.693 1.00 0.25 O ATOM 2303 CB MET A 144 18.912 -2.886 6.816 1.00 0.35 C ATOM 2304 CG MET A 144 19.222 -1.716 5.890 1.00 0.36 C ATOM 2305 SD MET A 144 20.625 -2.043 4.803 1.00 0.48 S ATOM 2306 CE MET A 144 20.442 -0.724 3.602 1.00 0.43 C ATOM 0 H MET A 144 17.670 -4.795 7.767 1.00 0.29 H new ATOM 0 HA MET A 144 17.820 -2.015 8.450 1.00 0.30 H new ATOM 0 HB2 MET A 144 19.749 -3.028 7.499 1.00 0.35 H new ATOM 0 HB3 MET A 144 18.829 -3.795 6.221 1.00 0.35 H new ATOM 0 HG2 MET A 144 18.343 -1.493 5.285 1.00 0.36 H new ATOM 0 HG3 MET A 144 19.430 -0.829 6.489 1.00 0.36 H new ATOM 0 HE1 MET A 144 21.287 -0.739 2.914 1.00 0.43 H new ATOM 0 HE2 MET A 144 19.517 -0.866 3.043 1.00 0.43 H new ATOM 0 HE3 MET A 144 20.410 0.236 4.118 1.00 0.43 H new ATOM 2316 N PHE A 145 15.803 -3.007 6.072 1.00 0.21 N ATOM 2317 CA PHE A 145 14.774 -2.597 5.117 1.00 0.17 C ATOM 2318 C PHE A 145 13.796 -1.629 5.764 1.00 0.15 C ATOM 2319 O PHE A 145 13.550 -0.535 5.255 1.00 0.16 O ATOM 2320 CB PHE A 145 14.025 -3.828 4.614 1.00 0.19 C ATOM 2321 CG PHE A 145 13.210 -3.583 3.383 1.00 0.17 C ATOM 2322 CD1 PHE A 145 11.845 -3.392 3.466 1.00 0.24 C ATOM 2323 CD2 PHE A 145 13.814 -3.556 2.138 1.00 0.18 C ATOM 2324 CE1 PHE A 145 11.097 -3.178 2.330 1.00 0.30 C ATOM 2325 CE2 PHE A 145 13.070 -3.341 0.998 1.00 0.23 C ATOM 2326 CZ PHE A 145 11.709 -3.153 1.095 1.00 0.29 C ATOM 0 H PHE A 145 15.903 -4.018 6.168 1.00 0.21 H new ATOM 0 HA PHE A 145 15.256 -2.093 4.279 1.00 0.17 H new ATOM 0 HB2 PHE A 145 14.745 -4.620 4.409 1.00 0.19 H new ATOM 0 HB3 PHE A 145 13.369 -4.190 5.406 1.00 0.19 H new ATOM 0 HD1 PHE A 145 11.360 -3.411 4.431 1.00 0.24 H new ATOM 0 HD2 PHE A 145 14.881 -3.705 2.059 1.00 0.18 H new ATOM 0 HE1 PHE A 145 10.030 -3.030 2.407 1.00 0.30 H new ATOM 0 HE2 PHE A 145 13.552 -3.320 0.032 1.00 0.23 H new ATOM 0 HZ PHE A 145 11.122 -2.986 0.204 1.00 0.29 H new ATOM 2336 N VAL A 146 13.259 -2.038 6.903 1.00 0.15 N ATOM 2337 CA VAL A 146 12.322 -1.213 7.641 1.00 0.14 C ATOM 2338 C VAL A 146 12.987 0.064 8.162 1.00 0.15 C ATOM 2339 O VAL A 146 12.432 1.152 8.039 1.00 0.16 O ATOM 2340 CB VAL A 146 11.656 -1.995 8.800 1.00 0.16 C ATOM 2341 CG1 VAL A 146 12.638 -2.935 9.476 1.00 0.19 C ATOM 2342 CG2 VAL A 146 11.066 -1.037 9.817 1.00 0.17 C ATOM 0 H VAL A 146 13.458 -2.940 7.336 1.00 0.15 H new ATOM 0 HA VAL A 146 11.538 -0.924 6.942 1.00 0.14 H new ATOM 0 HB VAL A 146 10.855 -2.598 8.372 1.00 0.16 H new ATOM 0 HG11 VAL A 146 12.135 -3.467 10.284 1.00 0.19 H new ATOM 0 HG12 VAL A 146 13.014 -3.653 8.748 1.00 0.19 H new ATOM 0 HG13 VAL A 146 13.471 -2.361 9.882 1.00 0.19 H new ATOM 0 HG21 VAL A 146 10.602 -1.604 10.624 1.00 0.17 H new ATOM 0 HG22 VAL A 146 11.856 -0.406 10.224 1.00 0.17 H new ATOM 0 HG23 VAL A 146 10.315 -0.412 9.335 1.00 0.17 H new ATOM 2352 N SER A 147 14.179 -0.058 8.714 1.00 0.18 N ATOM 2353 CA SER A 147 14.867 1.099 9.261 1.00 0.21 C ATOM 2354 C SER A 147 15.183 2.114 8.152 1.00 0.21 C ATOM 2355 O SER A 147 15.081 3.324 8.353 1.00 0.24 O ATOM 2356 CB SER A 147 16.134 0.651 9.987 1.00 0.25 C ATOM 2357 OG SER A 147 16.757 1.733 10.660 1.00 0.85 O ATOM 0 H SER A 147 14.689 -0.938 8.796 1.00 0.18 H new ATOM 0 HA SER A 147 14.217 1.595 9.982 1.00 0.21 H new ATOM 0 HB2 SER A 147 15.886 -0.131 10.705 1.00 0.25 H new ATOM 0 HB3 SER A 147 16.831 0.217 9.270 1.00 0.25 H new ATOM 0 HG SER A 147 17.564 1.414 11.116 1.00 0.85 H new ATOM 2363 N ARG A 148 15.535 1.609 6.976 1.00 0.20 N ATOM 2364 CA ARG A 148 15.774 2.447 5.809 1.00 0.21 C ATOM 2365 C ARG A 148 14.479 3.098 5.327 1.00 0.19 C ATOM 2366 O ARG A 148 14.426 4.304 5.117 1.00 0.27 O ATOM 2367 CB ARG A 148 16.364 1.606 4.684 1.00 0.23 C ATOM 2368 CG ARG A 148 17.847 1.304 4.805 1.00 0.29 C ATOM 2369 CD ARG A 148 18.705 2.541 4.579 1.00 0.43 C ATOM 2370 NE ARG A 148 18.785 3.390 5.769 1.00 1.22 N ATOM 2371 CZ ARG A 148 19.019 4.705 5.741 1.00 1.53 C ATOM 2372 NH1 ARG A 148 19.143 5.342 4.581 1.00 1.19 N ATOM 2373 NH2 ARG A 148 19.119 5.385 6.878 1.00 2.48 N ATOM 0 H ARG A 148 15.662 0.611 6.805 1.00 0.20 H new ATOM 0 HA ARG A 148 16.474 3.233 6.092 1.00 0.21 H new ATOM 0 HB2 ARG A 148 15.821 0.662 4.636 1.00 0.23 H new ATOM 0 HB3 ARG A 148 16.191 2.121 3.739 1.00 0.23 H new ATOM 0 HG2 ARG A 148 18.054 0.896 5.794 1.00 0.29 H new ATOM 0 HG3 ARG A 148 18.120 0.537 4.081 1.00 0.29 H new ATOM 0 HD2 ARG A 148 19.709 2.235 4.286 1.00 0.43 H new ATOM 0 HD3 ARG A 148 18.294 3.119 3.751 1.00 0.43 H new ATOM 0 HE ARG A 148 18.653 2.949 6.679 1.00 1.22 H new ATOM 0 HH11 ARG A 148 19.060 4.827 3.705 1.00 1.19 H new ATOM 0 HH12 ARG A 148 19.322 6.346 4.567 1.00 1.19 H new ATOM 0 HH21 ARG A 148 19.017 4.903 7.771 1.00 2.48 H new ATOM 0 HH22 ARG A 148 19.298 6.389 6.858 1.00 2.48 H new ATOM 2387 N GLY A 149 13.437 2.297 5.156 1.00 0.14 N ATOM 2388 CA GLY A 149 12.172 2.824 4.695 1.00 0.13 C ATOM 2389 C GLY A 149 11.588 3.835 5.662 1.00 0.15 C ATOM 2390 O GLY A 149 10.915 4.772 5.255 1.00 0.17 O ATOM 0 H GLY A 149 13.447 1.292 5.329 1.00 0.14 H new ATOM 0 HA2 GLY A 149 12.309 3.293 3.720 1.00 0.13 H new ATOM 0 HA3 GLY A 149 11.467 2.004 4.559 1.00 0.13 H new ATOM 2394 N ASN A 150 11.858 3.639 6.948 1.00 0.17 N ATOM 2395 CA ASN A 150 11.411 4.564 7.984 1.00 0.22 C ATOM 2396 C ASN A 150 11.956 5.980 7.766 1.00 0.23 C ATOM 2397 O ASN A 150 11.228 6.957 7.938 1.00 0.26 O ATOM 2398 CB ASN A 150 11.823 4.060 9.370 1.00 0.32 C ATOM 2399 CG ASN A 150 11.505 5.053 10.473 1.00 0.46 C ATOM 2400 OD1 ASN A 150 12.328 5.900 10.816 1.00 1.42 O ATOM 2401 ND2 ASN A 150 10.310 4.956 11.034 1.00 0.93 N ATOM 0 H ASN A 150 12.388 2.842 7.300 1.00 0.17 H new ATOM 0 HA ASN A 150 10.324 4.610 7.922 1.00 0.22 H new ATOM 0 HB2 ASN A 150 11.313 3.119 9.576 1.00 0.32 H new ATOM 0 HB3 ASN A 150 12.893 3.850 9.373 1.00 0.32 H new ATOM 0 HD21 ASN A 150 10.043 5.598 11.780 1.00 0.93 H new ATOM 0 HD22 ASN A 150 9.656 4.239 10.720 1.00 0.93 H new ATOM 2408 N THR A 151 13.231 6.097 7.391 1.00 0.23 N ATOM 2409 CA THR A 151 13.820 7.413 7.147 1.00 0.27 C ATOM 2410 C THR A 151 13.349 7.954 5.797 1.00 0.27 C ATOM 2411 O THR A 151 13.370 9.161 5.553 1.00 0.33 O ATOM 2412 CB THR A 151 15.370 7.395 7.220 1.00 0.30 C ATOM 2413 OG1 THR A 151 15.889 8.727 7.107 1.00 0.40 O ATOM 2414 CG2 THR A 151 15.980 6.530 6.128 1.00 0.27 C ATOM 0 H THR A 151 13.866 5.311 7.252 1.00 0.23 H new ATOM 0 HA THR A 151 13.478 8.076 7.942 1.00 0.27 H new ATOM 0 HB THR A 151 15.640 6.969 8.186 1.00 0.30 H new ATOM 0 HG1 THR A 151 16.867 8.702 7.156 1.00 0.40 H new ATOM 0 HG21 THR A 151 17.066 6.546 6.216 1.00 0.27 H new ATOM 0 HG22 THR A 151 15.622 5.506 6.233 1.00 0.27 H new ATOM 0 HG23 THR A 151 15.689 6.918 5.152 1.00 0.27 H new ATOM 2422 N GLU A 152 12.914 7.046 4.932 1.00 0.25 N ATOM 2423 CA GLU A 152 12.248 7.412 3.690 1.00 0.30 C ATOM 2424 C GLU A 152 10.796 7.785 3.978 1.00 0.28 C ATOM 2425 O GLU A 152 10.079 8.305 3.126 1.00 0.30 O ATOM 2426 CB GLU A 152 12.333 6.255 2.704 1.00 0.34 C ATOM 2427 CG GLU A 152 13.464 6.383 1.692 1.00 0.52 C ATOM 2428 CD GLU A 152 14.714 7.048 2.237 1.00 0.63 C ATOM 2429 OE1 GLU A 152 15.710 6.338 2.480 1.00 1.31 O ATOM 2430 OE2 GLU A 152 14.721 8.288 2.393 1.00 0.98 O ATOM 0 H GLU A 152 13.013 6.040 5.071 1.00 0.25 H new ATOM 0 HA GLU A 152 12.742 8.276 3.246 1.00 0.30 H new ATOM 0 HB2 GLU A 152 12.461 5.326 3.260 1.00 0.34 H new ATOM 0 HB3 GLU A 152 11.387 6.178 2.168 1.00 0.34 H new ATOM 0 HG2 GLU A 152 13.724 5.389 1.327 1.00 0.52 H new ATOM 0 HG3 GLU A 152 13.107 6.954 0.835 1.00 0.52 H new ATOM 2437 N GLY A 153 10.390 7.504 5.206 1.00 0.25 N ATOM 2438 CA GLY A 153 9.137 7.981 5.737 1.00 0.25 C ATOM 2439 C GLY A 153 8.069 6.915 5.885 1.00 0.21 C ATOM 2440 O GLY A 153 7.081 7.145 6.582 1.00 0.24 O ATOM 0 H GLY A 153 10.928 6.935 5.860 1.00 0.25 H new ATOM 0 HA2 GLY A 153 9.319 8.433 6.712 1.00 0.25 H new ATOM 0 HA3 GLY A 153 8.758 8.769 5.086 1.00 0.25 H new ATOM 2444 N ALA A 154 8.230 5.756 5.256 1.00 0.17 N ATOM 2445 CA ALA A 154 7.337 4.641 5.552 1.00 0.16 C ATOM 2446 C ALA A 154 8.025 3.291 5.461 1.00 0.14 C ATOM 2447 O ALA A 154 8.618 2.951 4.435 1.00 0.15 O ATOM 2448 CB ALA A 154 6.112 4.659 4.667 1.00 0.19 C ATOM 0 H ALA A 154 8.949 5.566 4.558 1.00 0.17 H new ATOM 0 HA ALA A 154 7.026 4.779 6.588 1.00 0.16 H new ATOM 0 HB1 ALA A 154 5.470 3.814 4.916 1.00 0.19 H new ATOM 0 HB2 ALA A 154 5.564 5.589 4.823 1.00 0.19 H new ATOM 0 HB3 ALA A 154 6.416 4.588 3.623 1.00 0.19 H new ATOM 2454 N SER A 155 7.922 2.517 6.521 1.00 0.15 N ATOM 2455 CA SER A 155 8.266 1.113 6.476 1.00 0.16 C ATOM 2456 C SER A 155 7.276 0.287 7.287 1.00 0.15 C ATOM 2457 O SER A 155 6.588 0.808 8.166 1.00 0.19 O ATOM 2458 CB SER A 155 9.668 0.907 7.004 1.00 0.23 C ATOM 2459 OG SER A 155 9.852 1.593 8.228 1.00 1.42 O ATOM 0 H SER A 155 7.599 2.842 7.433 1.00 0.15 H new ATOM 0 HA SER A 155 8.221 0.781 5.439 1.00 0.16 H new ATOM 0 HB2 SER A 155 9.854 -0.157 7.147 1.00 0.23 H new ATOM 0 HB3 SER A 155 10.393 1.262 6.271 1.00 0.23 H new ATOM 0 HG SER A 155 10.777 1.480 8.531 1.00 1.42 H new ATOM 2465 N ILE A 156 7.209 -0.998 6.982 1.00 0.14 N ATOM 2466 CA ILE A 156 6.317 -1.910 7.674 1.00 0.15 C ATOM 2467 C ILE A 156 6.879 -3.333 7.593 1.00 0.15 C ATOM 2468 O ILE A 156 7.020 -3.904 6.511 1.00 0.17 O ATOM 2469 CB ILE A 156 4.883 -1.825 7.084 1.00 0.18 C ATOM 2470 CG1 ILE A 156 3.935 -2.810 7.771 1.00 0.21 C ATOM 2471 CG2 ILE A 156 4.900 -2.054 5.578 1.00 0.21 C ATOM 2472 CD1 ILE A 156 2.477 -2.572 7.435 1.00 0.28 C ATOM 0 H ILE A 156 7.769 -1.436 6.251 1.00 0.14 H new ATOM 0 HA ILE A 156 6.250 -1.626 8.724 1.00 0.15 H new ATOM 0 HB ILE A 156 4.510 -0.819 7.273 1.00 0.18 H new ATOM 0 HG12 ILE A 156 4.206 -3.826 7.483 1.00 0.21 H new ATOM 0 HG13 ILE A 156 4.068 -2.739 8.850 1.00 0.21 H new ATOM 0 HG21 ILE A 156 3.884 -1.989 5.189 1.00 0.21 H new ATOM 0 HG22 ILE A 156 5.520 -1.295 5.101 1.00 0.21 H new ATOM 0 HG23 ILE A 156 5.308 -3.042 5.365 1.00 0.21 H new ATOM 0 HD11 ILE A 156 1.860 -3.305 7.955 1.00 0.28 H new ATOM 0 HD12 ILE A 156 2.191 -1.568 7.749 1.00 0.28 H new ATOM 0 HD13 ILE A 156 2.330 -2.672 6.360 1.00 0.28 H new ATOM 2484 N SER A 157 7.207 -3.899 8.740 1.00 0.16 N ATOM 2485 CA SER A 157 7.904 -5.174 8.793 1.00 0.19 C ATOM 2486 C SER A 157 7.044 -6.243 9.456 1.00 0.20 C ATOM 2487 O SER A 157 6.232 -5.934 10.325 1.00 0.34 O ATOM 2488 CB SER A 157 9.233 -5.004 9.538 1.00 0.34 C ATOM 2489 OG SER A 157 9.044 -4.346 10.780 1.00 1.44 O ATOM 0 H SER A 157 7.001 -3.494 9.653 1.00 0.16 H new ATOM 0 HA SER A 157 8.108 -5.504 7.774 1.00 0.19 H new ATOM 0 HB2 SER A 157 9.686 -5.981 9.706 1.00 0.34 H new ATOM 0 HB3 SER A 157 9.927 -4.432 8.922 1.00 0.34 H new ATOM 0 HG SER A 157 9.907 -4.252 11.235 1.00 1.44 H new ATOM 2495 N PHE A 158 7.186 -7.485 8.995 1.00 0.20 N ATOM 2496 CA PHE A 158 6.494 -8.622 9.603 1.00 0.32 C ATOM 2497 C PHE A 158 6.858 -8.754 11.080 1.00 0.74 C ATOM 2498 O PHE A 158 6.110 -8.228 11.932 1.00 1.33 O ATOM 2499 CB PHE A 158 6.846 -9.921 8.866 1.00 0.97 C ATOM 2500 CG PHE A 158 5.746 -10.431 7.972 1.00 1.03 C ATOM 2501 CD1 PHE A 158 5.323 -9.701 6.873 1.00 0.97 C ATOM 2502 CD2 PHE A 158 5.135 -11.646 8.237 1.00 1.42 C ATOM 2503 CE1 PHE A 158 4.310 -10.173 6.054 1.00 1.38 C ATOM 2504 CE2 PHE A 158 4.124 -12.123 7.423 1.00 1.81 C ATOM 2505 CZ PHE A 158 3.710 -11.385 6.332 1.00 1.81 C ATOM 2506 OXT PHE A 158 7.898 -9.372 11.384 1.00 1.62 O ATOM 0 H PHE A 158 7.776 -7.730 8.200 1.00 0.20 H new ATOM 0 HA PHE A 158 5.422 -8.444 9.521 1.00 0.32 H new ATOM 0 HB2 PHE A 158 7.741 -9.756 8.267 1.00 0.97 H new ATOM 0 HB3 PHE A 158 7.090 -10.689 9.600 1.00 0.97 H new ATOM 0 HD1 PHE A 158 5.789 -8.752 6.652 1.00 0.97 H new ATOM 0 HD2 PHE A 158 5.452 -12.228 9.090 1.00 1.42 H new ATOM 0 HE1 PHE A 158 3.990 -9.594 5.200 1.00 1.38 H new ATOM 0 HE2 PHE A 158 3.658 -13.073 7.641 1.00 1.81 H new ATOM 0 HZ PHE A 158 2.918 -11.755 5.697 1.00 1.81 H new TER 2516 PHE A 158