USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1271 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 43 ASN : amide:sc= 0.607 K(o=0.44,f=-0.73) USER MOD Set 1.2: A 113 ASN : amide:sc= -0.169 K(o=0.44,f=-2.2) USER MOD Set 2.1: A 99 THR OG1 : rot 180:sc= -0.0882 USER MOD Set 2.2: A 103 GLN : amide:sc= -0.0277 K(o=-0.12,f=-1.3) USER MOD Set 3.1: A 73 LYS NZ :NH3+ -145:sc= 0.0971 (180deg=0) USER MOD Set 3.2: A 147 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 31 ASN :FLIP amide:sc= 0.799 F(o=-0.097,f=1.7) USER MOD Set 4.2: A 34 THR OG1 : rot 111:sc= 0.916 USER MOD Set 5.1: A 24 ASN :FLIP amide:sc= -0.0392 F(o=-0.77,f=-0.26) USER MOD Set 5.2: A 26 GLN : amide:sc= -0.24 K(o=-0.26,f=-3.2) USER MOD Set 5.3: A 36 GLN : amide:sc= 0.0211 K(o=-0.26,f=-3.2!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -108:sc= 1.36 (180deg=-0.145) USER MOD Single : A 4 SER OG : rot 150:sc= -0.528 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -168:sc= -0.0138 (180deg=-0.184) USER MOD Single : A 16 LYS NZ :NH3+ -133:sc= 1.18 (180deg=-0.533) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 0.564 K(o=0.56,f=-1.5) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.3) USER MOD Single : A 56 ASN : amide:sc= 0.58 K(o=0.58,f=0) USER MOD Single : A 61 TYR OH : rot -153:sc= 0.889 USER MOD Single : A 64 LYS NZ :NH3+ -129:sc= 1.3 (180deg=-0.476) USER MOD Single : A 67 LYS NZ :NH3+ -177:sc= 0.267 (180deg=0.263) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -179:sc= 1.18 (180deg=1.18) USER MOD Single : A 72 THR OG1 : rot 35:sc= 0.367 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-2.3!) USER MOD Single : A 78 ASN : amide:sc= -2.77 K(o=-2.8,f=-4.6!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0.631 K(o=0.63,f=0) USER MOD Single : A 86 CYS SG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 142:sc= 1.14 (180deg=-1.77!) USER MOD Single : A 101 THR OG1 : rot -162:sc= 1.67 USER MOD Single : A 106 GLN : amide:sc= -0.458 K(o=-0.46,f=-1.1) USER MOD Single : A 107 SER OG : rot 130:sc= 0 USER MOD Single : A 116 GLN : amide:sc= -0.0804 X(o=-0.08,f=-0.56) USER MOD Single : A 119 HIS : no HE2:sc= 0.243 K(o=0.24,f=-1.8) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ -169:sc= 1.25 (180deg=0.975) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ -114:sc= 1.26 (180deg=-0.333) USER MOD Single : A 137 CYS SG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 162:sc= -0.0182 (180deg=-0.19) USER MOD Single : A 139 ASN : amide:sc= -0.439 K(o=-0.44,f=-1.6) USER MOD Single : A 144 THR OG1 : rot 85:sc= 0.299 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ 157:sc= 1.15 (180deg=0.551) USER MOD Single : A 150 LYS NZ :NH3+ -126:sc= -0.106 (180deg=-0.579) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -21.557 -4.264 11.491 1.00 1.71 N ATOM 2 CA MET A 1 -20.757 -4.281 10.253 1.00 0.81 C ATOM 3 C MET A 1 -21.390 -3.330 9.233 1.00 0.71 C ATOM 4 O MET A 1 -22.074 -3.769 8.315 1.00 1.18 O ATOM 5 CB MET A 1 -20.607 -5.711 9.695 1.00 0.78 C ATOM 6 CG MET A 1 -20.122 -6.727 10.734 1.00 1.90 C ATOM 7 SD MET A 1 -21.383 -7.288 11.913 1.00 2.54 S ATOM 8 CE MET A 1 -21.997 -8.754 11.039 1.00 3.47 C ATOM 0 H1 MET A 1 -21.034 -3.761 12.236 1.00 1.71 H new ATOM 0 H2 MET A 1 -22.460 -3.779 11.314 1.00 1.71 H new ATOM 0 H3 MET A 1 -21.743 -5.240 11.798 1.00 1.71 H new ATOM 0 HA MET A 1 -19.747 -3.935 10.474 1.00 0.81 H new ATOM 0 HB2 MET A 1 -21.568 -6.040 9.298 1.00 0.78 H new ATOM 0 HB3 MET A 1 -19.906 -5.695 8.860 1.00 0.78 H new ATOM 0 HG2 MET A 1 -19.724 -7.597 10.210 1.00 1.90 H new ATOM 0 HG3 MET A 1 -19.296 -6.286 11.292 1.00 1.90 H new ATOM 0 HE1 MET A 1 -22.784 -9.225 11.628 1.00 3.47 H new ATOM 0 HE2 MET A 1 -22.397 -8.458 10.069 1.00 3.47 H new ATOM 0 HE3 MET A 1 -21.180 -9.460 10.894 1.00 3.47 H new ATOM 20 N ALA A 2 -21.231 -2.015 9.426 1.00 0.61 N ATOM 21 CA ALA A 2 -21.695 -1.027 8.454 1.00 0.57 C ATOM 22 C ALA A 2 -20.615 -0.796 7.402 1.00 0.48 C ATOM 23 O ALA A 2 -20.874 -0.878 6.203 1.00 0.63 O ATOM 24 CB ALA A 2 -22.051 0.283 9.159 1.00 0.74 C ATOM 0 H ALA A 2 -20.783 -1.613 10.250 1.00 0.61 H new ATOM 0 HA ALA A 2 -22.592 -1.402 7.961 1.00 0.57 H new ATOM 0 HB1 ALA A 2 -22.395 1.010 8.424 1.00 0.74 H new ATOM 0 HB2 ALA A 2 -22.842 0.101 9.887 1.00 0.74 H new ATOM 0 HB3 ALA A 2 -21.170 0.672 9.670 1.00 0.74 H new ATOM 30 N ALA A 3 -19.392 -0.525 7.871 1.00 0.42 N ATOM 31 CA ALA A 3 -18.225 -0.298 7.037 1.00 0.36 C ATOM 32 C ALA A 3 -18.127 -1.367 5.963 1.00 0.31 C ATOM 33 O ALA A 3 -17.957 -1.040 4.799 1.00 0.31 O ATOM 34 CB ALA A 3 -16.961 -0.306 7.897 1.00 0.38 C ATOM 0 H ALA A 3 -19.190 -0.458 8.869 1.00 0.42 H new ATOM 0 HA ALA A 3 -18.324 0.674 6.554 1.00 0.36 H new ATOM 0 HB1 ALA A 3 -16.090 -0.135 7.265 1.00 0.38 H new ATOM 0 HB2 ALA A 3 -17.026 0.483 8.646 1.00 0.38 H new ATOM 0 HB3 ALA A 3 -16.865 -1.271 8.394 1.00 0.38 H new ATOM 40 N SER A 4 -18.269 -2.635 6.348 1.00 0.32 N ATOM 41 CA SER A 4 -18.150 -3.790 5.473 1.00 0.31 C ATOM 42 C SER A 4 -19.005 -3.625 4.231 1.00 0.32 C ATOM 43 O SER A 4 -18.579 -3.958 3.135 1.00 0.36 O ATOM 44 CB SER A 4 -18.589 -5.030 6.237 1.00 0.34 C ATOM 45 OG SER A 4 -19.907 -4.831 6.693 1.00 1.22 O ATOM 0 H SER A 4 -18.477 -2.890 7.313 1.00 0.32 H new ATOM 0 HA SER A 4 -17.112 -3.888 5.156 1.00 0.31 H new ATOM 0 HB2 SER A 4 -18.539 -5.909 5.594 1.00 0.34 H new ATOM 0 HB3 SER A 4 -17.921 -5.213 7.078 1.00 0.34 H new ATOM 0 HG SER A 4 -20.370 -5.694 6.743 1.00 1.22 H new ATOM 51 N ARG A 5 -20.222 -3.110 4.389 1.00 0.34 N ATOM 52 CA ARG A 5 -21.122 -2.934 3.264 1.00 0.38 C ATOM 53 C ARG A 5 -20.491 -1.987 2.259 1.00 0.39 C ATOM 54 O ARG A 5 -20.424 -2.275 1.067 1.00 0.53 O ATOM 55 CB ARG A 5 -22.472 -2.405 3.750 1.00 0.45 C ATOM 56 CG ARG A 5 -23.015 -3.282 4.881 1.00 0.82 C ATOM 57 CD ARG A 5 -24.541 -3.177 4.984 1.00 1.23 C ATOM 58 NE ARG A 5 -25.154 -4.508 5.136 1.00 1.85 N ATOM 59 CZ ARG A 5 -25.214 -5.446 4.177 1.00 2.73 C ATOM 60 NH1 ARG A 5 -25.702 -6.657 4.452 1.00 3.35 N ATOM 61 NH2 ARG A 5 -24.774 -5.180 2.946 1.00 3.61 N ATOM 0 H ARG A 5 -20.603 -2.809 5.286 1.00 0.34 H new ATOM 0 HA ARG A 5 -21.295 -3.894 2.777 1.00 0.38 H new ATOM 0 HB2 ARG A 5 -22.363 -1.378 4.098 1.00 0.45 H new ATOM 0 HB3 ARG A 5 -23.182 -2.387 2.923 1.00 0.45 H new ATOM 0 HG2 ARG A 5 -22.731 -4.320 4.708 1.00 0.82 H new ATOM 0 HG3 ARG A 5 -22.563 -2.981 5.826 1.00 0.82 H new ATOM 0 HD2 ARG A 5 -24.809 -2.550 5.834 1.00 1.23 H new ATOM 0 HD3 ARG A 5 -24.936 -2.691 4.092 1.00 1.23 H new ATOM 0 HE ARG A 5 -25.565 -4.735 6.041 1.00 1.85 H new ATOM 0 HH11 ARG A 5 -26.031 -6.873 5.393 1.00 3.35 H new ATOM 0 HH12 ARG A 5 -25.746 -7.367 3.721 1.00 3.35 H new ATOM 0 HH21 ARG A 5 -24.390 -4.260 2.729 1.00 3.61 H new ATOM 0 HH22 ARG A 5 -24.822 -5.896 2.221 1.00 3.61 H new ATOM 75 N ARG A 6 -20.012 -0.847 2.748 1.00 0.30 N ATOM 76 CA ARG A 6 -19.365 0.146 1.902 1.00 0.32 C ATOM 77 C ARG A 6 -18.099 -0.454 1.307 1.00 0.33 C ATOM 78 O ARG A 6 -17.792 -0.209 0.157 1.00 0.51 O ATOM 79 CB ARG A 6 -19.066 1.414 2.717 1.00 0.33 C ATOM 80 CG ARG A 6 -20.351 2.010 3.312 1.00 0.38 C ATOM 81 CD ARG A 6 -20.050 3.059 4.384 1.00 1.34 C ATOM 82 NE ARG A 6 -19.438 4.279 3.826 1.00 1.55 N ATOM 83 CZ ARG A 6 -20.098 5.359 3.391 1.00 1.58 C ATOM 84 NH1 ARG A 6 -19.414 6.435 3.003 1.00 2.22 N ATOM 85 NH2 ARG A 6 -21.433 5.364 3.348 1.00 2.06 N ATOM 0 H ARG A 6 -20.061 -0.588 3.733 1.00 0.30 H new ATOM 0 HA ARG A 6 -20.026 0.431 1.084 1.00 0.32 H new ATOM 0 HB2 ARG A 6 -18.367 1.177 3.519 1.00 0.33 H new ATOM 0 HB3 ARG A 6 -18.581 2.153 2.079 1.00 0.33 H new ATOM 0 HG2 ARG A 6 -20.943 2.463 2.517 1.00 0.38 H new ATOM 0 HG3 ARG A 6 -20.955 1.212 3.744 1.00 0.38 H new ATOM 0 HD2 ARG A 6 -20.974 3.323 4.899 1.00 1.34 H new ATOM 0 HD3 ARG A 6 -19.381 2.630 5.130 1.00 1.34 H new ATOM 0 HE ARG A 6 -18.420 4.302 3.766 1.00 1.55 H new ATOM 0 HH11 ARG A 6 -18.395 6.432 3.039 1.00 2.22 H new ATOM 0 HH12 ARG A 6 -19.910 7.262 2.670 1.00 2.22 H new ATOM 0 HH21 ARG A 6 -21.956 4.541 3.648 1.00 2.06 H new ATOM 0 HH22 ARG A 6 -21.929 6.191 3.015 1.00 2.06 H new ATOM 99 N LEU A 7 -17.378 -1.278 2.054 1.00 0.25 N ATOM 100 CA LEU A 7 -16.139 -1.881 1.605 1.00 0.24 C ATOM 101 C LEU A 7 -16.429 -2.933 0.542 1.00 0.23 C ATOM 102 O LEU A 7 -15.585 -3.183 -0.304 1.00 0.33 O ATOM 103 CB LEU A 7 -15.395 -2.474 2.807 1.00 0.23 C ATOM 104 CG LEU A 7 -14.924 -1.364 3.761 1.00 0.28 C ATOM 105 CD1 LEU A 7 -14.653 -1.926 5.154 1.00 0.32 C ATOM 106 CD2 LEU A 7 -13.655 -0.678 3.269 1.00 0.40 C ATOM 0 H LEU A 7 -17.644 -1.548 3.001 1.00 0.25 H new ATOM 0 HA LEU A 7 -15.498 -1.124 1.152 1.00 0.24 H new ATOM 0 HB2 LEU A 7 -16.049 -3.164 3.340 1.00 0.23 H new ATOM 0 HB3 LEU A 7 -14.537 -3.050 2.461 1.00 0.23 H new ATOM 0 HG LEU A 7 -15.730 -0.631 3.796 1.00 0.28 H new ATOM 0 HD11 LEU A 7 -14.321 -1.123 5.812 1.00 0.32 H new ATOM 0 HD12 LEU A 7 -15.567 -2.367 5.552 1.00 0.32 H new ATOM 0 HD13 LEU A 7 -13.878 -2.690 5.094 1.00 0.32 H new ATOM 0 HD21 LEU A 7 -13.363 0.098 3.977 1.00 0.40 H new ATOM 0 HD22 LEU A 7 -12.854 -1.412 3.184 1.00 0.40 H new ATOM 0 HD23 LEU A 7 -13.839 -0.228 2.293 1.00 0.40 H new ATOM 118 N MET A 8 -17.614 -3.542 0.557 1.00 0.24 N ATOM 119 CA MET A 8 -18.008 -4.523 -0.434 1.00 0.30 C ATOM 120 C MET A 8 -18.241 -3.842 -1.769 1.00 0.28 C ATOM 121 O MET A 8 -17.642 -4.230 -2.770 1.00 0.29 O ATOM 122 CB MET A 8 -19.225 -5.310 0.068 1.00 0.36 C ATOM 123 CG MET A 8 -19.607 -6.420 -0.910 1.00 0.51 C ATOM 124 SD MET A 8 -20.709 -7.664 -0.188 1.00 1.61 S ATOM 125 CE MET A 8 -20.711 -8.864 -1.544 1.00 1.84 C ATOM 0 H MET A 8 -18.327 -3.362 1.264 1.00 0.24 H new ATOM 0 HA MET A 8 -17.209 -5.248 -0.589 1.00 0.30 H new ATOM 0 HB2 MET A 8 -19.005 -5.742 1.044 1.00 0.36 H new ATOM 0 HB3 MET A 8 -20.069 -4.633 0.202 1.00 0.36 H new ATOM 0 HG2 MET A 8 -20.091 -5.977 -1.780 1.00 0.51 H new ATOM 0 HG3 MET A 8 -18.700 -6.910 -1.265 1.00 0.51 H new ATOM 0 HE1 MET A 8 -21.344 -9.711 -1.279 1.00 1.84 H new ATOM 0 HE2 MET A 8 -21.096 -8.391 -2.448 1.00 1.84 H new ATOM 0 HE3 MET A 8 -19.694 -9.213 -1.723 1.00 1.84 H new ATOM 135 N LYS A 9 -19.094 -2.815 -1.795 1.00 0.28 N ATOM 136 CA LYS A 9 -19.323 -2.093 -3.041 1.00 0.29 C ATOM 137 C LYS A 9 -18.037 -1.438 -3.536 1.00 0.28 C ATOM 138 O LYS A 9 -17.693 -1.615 -4.696 1.00 0.32 O ATOM 139 CB LYS A 9 -20.504 -1.120 -2.948 1.00 0.38 C ATOM 140 CG LYS A 9 -20.620 -0.296 -1.664 1.00 1.79 C ATOM 141 CD LYS A 9 -21.918 -0.651 -0.934 1.00 2.10 C ATOM 142 CE LYS A 9 -23.157 -0.196 -1.715 1.00 2.70 C ATOM 143 NZ LYS A 9 -23.219 1.275 -1.869 1.00 3.65 N ATOM 0 H LYS A 9 -19.622 -2.475 -0.991 1.00 0.28 H new ATOM 0 HA LYS A 9 -19.617 -2.821 -3.797 1.00 0.29 H new ATOM 0 HB2 LYS A 9 -20.443 -0.430 -3.790 1.00 0.38 H new ATOM 0 HB3 LYS A 9 -21.425 -1.691 -3.070 1.00 0.38 H new ATOM 0 HG2 LYS A 9 -19.764 -0.491 -1.018 1.00 1.79 H new ATOM 0 HG3 LYS A 9 -20.605 0.768 -1.901 1.00 1.79 H new ATOM 0 HD2 LYS A 9 -21.963 -1.729 -0.778 1.00 2.10 H new ATOM 0 HD3 LYS A 9 -21.919 -0.185 0.052 1.00 2.10 H new ATOM 0 HE2 LYS A 9 -23.153 -0.662 -2.700 1.00 2.70 H new ATOM 0 HE3 LYS A 9 -24.054 -0.543 -1.202 1.00 2.70 H new ATOM 0 HZ1 LYS A 9 -24.160 1.548 -2.218 1.00 3.65 H new ATOM 0 HZ2 LYS A 9 -23.046 1.728 -0.949 1.00 3.65 H new ATOM 0 HZ3 LYS A 9 -22.495 1.584 -2.549 1.00 3.65 H new ATOM 157 N GLU A 10 -17.304 -0.751 -2.662 1.00 0.26 N ATOM 158 CA GLU A 10 -16.053 -0.077 -2.998 1.00 0.28 C ATOM 159 C GLU A 10 -15.075 -1.089 -3.592 1.00 0.24 C ATOM 160 O GLU A 10 -14.483 -0.825 -4.625 1.00 0.29 O ATOM 161 CB GLU A 10 -15.433 0.588 -1.753 1.00 0.33 C ATOM 162 CG GLU A 10 -16.257 1.754 -1.164 1.00 0.57 C ATOM 163 CD GLU A 10 -15.767 3.167 -1.487 1.00 1.02 C ATOM 164 OE1 GLU A 10 -14.955 3.334 -2.418 1.00 1.73 O ATOM 165 OE2 GLU A 10 -16.191 4.094 -0.753 1.00 1.75 O ATOM 0 H GLU A 10 -17.568 -0.646 -1.683 1.00 0.26 H new ATOM 0 HA GLU A 10 -16.262 0.704 -3.729 1.00 0.28 H new ATOM 0 HB2 GLU A 10 -15.300 -0.170 -0.982 1.00 0.33 H new ATOM 0 HB3 GLU A 10 -14.441 0.957 -2.012 1.00 0.33 H new ATOM 0 HG2 GLU A 10 -17.284 1.659 -1.518 1.00 0.57 H new ATOM 0 HG3 GLU A 10 -16.282 1.641 -0.080 1.00 0.57 H new ATOM 172 N LEU A 11 -14.872 -2.250 -2.965 1.00 0.24 N ATOM 173 CA LEU A 11 -13.923 -3.245 -3.447 1.00 0.22 C ATOM 174 C LEU A 11 -14.306 -3.730 -4.831 1.00 0.23 C ATOM 175 O LEU A 11 -13.446 -3.854 -5.705 1.00 0.23 O ATOM 176 CB LEU A 11 -13.839 -4.433 -2.480 1.00 0.24 C ATOM 177 CG LEU A 11 -12.732 -5.409 -2.910 1.00 0.19 C ATOM 178 CD1 LEU A 11 -11.931 -5.915 -1.709 1.00 0.34 C ATOM 179 CD2 LEU A 11 -13.315 -6.597 -3.679 1.00 0.31 C ATOM 0 H LEU A 11 -15.361 -2.522 -2.112 1.00 0.24 H new ATOM 0 HA LEU A 11 -12.943 -2.770 -3.502 1.00 0.22 H new ATOM 0 HB2 LEU A 11 -13.641 -4.073 -1.471 1.00 0.24 H new ATOM 0 HB3 LEU A 11 -14.797 -4.952 -2.451 1.00 0.24 H new ATOM 0 HG LEU A 11 -12.058 -4.858 -3.566 1.00 0.19 H new ATOM 0 HD11 LEU A 11 -11.157 -6.603 -2.051 1.00 0.34 H new ATOM 0 HD12 LEU A 11 -11.467 -5.071 -1.200 1.00 0.34 H new ATOM 0 HD13 LEU A 11 -12.597 -6.433 -1.019 1.00 0.34 H new ATOM 0 HD21 LEU A 11 -12.510 -7.272 -3.971 1.00 0.31 H new ATOM 0 HD22 LEU A 11 -14.022 -7.130 -3.044 1.00 0.31 H new ATOM 0 HD23 LEU A 11 -13.828 -6.237 -4.571 1.00 0.31 H new ATOM 191 N GLU A 12 -15.580 -4.066 -5.030 1.00 0.26 N ATOM 192 CA GLU A 12 -15.986 -4.591 -6.323 1.00 0.33 C ATOM 193 C GLU A 12 -15.775 -3.525 -7.399 1.00 0.31 C ATOM 194 O GLU A 12 -15.223 -3.812 -8.461 1.00 0.33 O ATOM 195 CB GLU A 12 -17.422 -5.126 -6.269 1.00 0.45 C ATOM 196 CG GLU A 12 -17.764 -5.726 -7.639 1.00 0.55 C ATOM 197 CD GLU A 12 -18.911 -6.738 -7.630 1.00 0.90 C ATOM 198 OE1 GLU A 12 -19.565 -6.914 -6.582 1.00 1.46 O ATOM 199 OE2 GLU A 12 -19.075 -7.360 -8.708 1.00 1.59 O ATOM 0 H GLU A 12 -16.323 -3.987 -4.336 1.00 0.26 H new ATOM 0 HA GLU A 12 -15.362 -5.444 -6.589 1.00 0.33 H new ATOM 0 HB2 GLU A 12 -17.517 -5.882 -5.489 1.00 0.45 H new ATOM 0 HB3 GLU A 12 -18.117 -4.324 -6.022 1.00 0.45 H new ATOM 0 HG2 GLU A 12 -18.019 -4.915 -8.321 1.00 0.55 H new ATOM 0 HG3 GLU A 12 -16.874 -6.211 -8.040 1.00 0.55 H new ATOM 206 N GLU A 13 -16.162 -2.288 -7.095 1.00 0.32 N ATOM 207 CA GLU A 13 -15.960 -1.105 -7.916 1.00 0.36 C ATOM 208 C GLU A 13 -14.475 -0.896 -8.212 1.00 0.32 C ATOM 209 O GLU A 13 -14.130 -0.541 -9.333 1.00 0.37 O ATOM 210 CB GLU A 13 -16.592 0.109 -7.212 1.00 0.47 C ATOM 211 CG GLU A 13 -18.105 0.160 -7.495 1.00 0.94 C ATOM 212 CD GLU A 13 -18.929 0.799 -6.366 1.00 2.52 C ATOM 213 OE1 GLU A 13 -18.384 1.662 -5.645 1.00 3.19 O ATOM 214 OE2 GLU A 13 -20.121 0.430 -6.244 1.00 3.83 O ATOM 0 H GLU A 13 -16.649 -2.077 -6.224 1.00 0.32 H new ATOM 0 HA GLU A 13 -16.451 -1.235 -8.880 1.00 0.36 H new ATOM 0 HB2 GLU A 13 -16.417 0.047 -6.138 1.00 0.47 H new ATOM 0 HB3 GLU A 13 -16.119 1.027 -7.559 1.00 0.47 H new ATOM 0 HG2 GLU A 13 -18.274 0.719 -8.416 1.00 0.94 H new ATOM 0 HG3 GLU A 13 -18.467 -0.854 -7.667 1.00 0.94 H new ATOM 221 N ILE A 14 -13.580 -1.139 -7.253 1.00 0.28 N ATOM 222 CA ILE A 14 -12.142 -0.992 -7.434 1.00 0.27 C ATOM 223 C ILE A 14 -11.674 -1.993 -8.489 1.00 0.27 C ATOM 224 O ILE A 14 -11.042 -1.604 -9.473 1.00 0.28 O ATOM 225 CB ILE A 14 -11.403 -1.140 -6.085 1.00 0.23 C ATOM 226 CG1 ILE A 14 -11.544 0.159 -5.270 1.00 0.26 C ATOM 227 CG2 ILE A 14 -9.897 -1.360 -6.292 1.00 0.26 C ATOM 228 CD1 ILE A 14 -10.970 0.004 -3.858 1.00 0.24 C ATOM 0 H ILE A 14 -13.842 -1.448 -6.317 1.00 0.28 H new ATOM 0 HA ILE A 14 -11.904 0.009 -7.794 1.00 0.27 H new ATOM 0 HB ILE A 14 -11.844 -1.994 -5.571 1.00 0.23 H new ATOM 0 HG12 ILE A 14 -11.030 0.970 -5.785 1.00 0.26 H new ATOM 0 HG13 ILE A 14 -12.596 0.437 -5.207 1.00 0.26 H new ATOM 0 HG21 ILE A 14 -9.407 -1.460 -5.323 1.00 0.26 H new ATOM 0 HG22 ILE A 14 -9.739 -2.268 -6.874 1.00 0.26 H new ATOM 0 HG23 ILE A 14 -9.475 -0.508 -6.826 1.00 0.26 H new ATOM 0 HD11 ILE A 14 -11.087 0.941 -3.313 1.00 0.24 H new ATOM 0 HD12 ILE A 14 -11.502 -0.790 -3.334 1.00 0.24 H new ATOM 0 HD13 ILE A 14 -9.912 -0.249 -3.921 1.00 0.24 H new ATOM 240 N ARG A 15 -11.963 -3.287 -8.307 1.00 0.26 N ATOM 241 CA ARG A 15 -11.530 -4.291 -9.279 1.00 0.28 C ATOM 242 C ARG A 15 -12.036 -3.914 -10.668 1.00 0.31 C ATOM 243 O ARG A 15 -11.255 -3.907 -11.621 1.00 0.36 O ATOM 244 CB ARG A 15 -12.008 -5.701 -8.905 1.00 0.35 C ATOM 245 CG ARG A 15 -10.936 -6.436 -8.097 1.00 0.81 C ATOM 246 CD ARG A 15 -11.333 -7.898 -7.872 1.00 0.73 C ATOM 247 NE ARG A 15 -11.170 -8.709 -9.090 1.00 1.00 N ATOM 248 CZ ARG A 15 -11.572 -9.980 -9.224 1.00 1.16 C ATOM 249 NH1 ARG A 15 -11.366 -10.631 -10.371 1.00 1.85 N ATOM 250 NH2 ARG A 15 -12.179 -10.599 -8.211 1.00 1.42 N ATOM 0 H ARG A 15 -12.484 -3.656 -7.512 1.00 0.26 H new ATOM 0 HA ARG A 15 -10.440 -4.308 -9.276 1.00 0.28 H new ATOM 0 HB2 ARG A 15 -12.928 -5.637 -8.325 1.00 0.35 H new ATOM 0 HB3 ARG A 15 -12.240 -6.264 -9.809 1.00 0.35 H new ATOM 0 HG2 ARG A 15 -9.982 -6.390 -8.623 1.00 0.81 H new ATOM 0 HG3 ARG A 15 -10.795 -5.941 -7.136 1.00 0.81 H new ATOM 0 HD2 ARG A 15 -10.724 -8.320 -7.072 1.00 0.73 H new ATOM 0 HD3 ARG A 15 -12.371 -7.945 -7.542 1.00 0.73 H new ATOM 0 HE ARG A 15 -10.717 -8.270 -9.892 1.00 1.00 H new ATOM 0 HH11 ARG A 15 -10.902 -10.161 -11.148 1.00 1.85 H new ATOM 0 HH12 ARG A 15 -11.673 -11.599 -10.470 1.00 1.85 H new ATOM 0 HH21 ARG A 15 -12.338 -10.105 -7.333 1.00 1.42 H new ATOM 0 HH22 ARG A 15 -12.485 -11.567 -8.314 1.00 1.42 H new ATOM 264 N LYS A 16 -13.336 -3.616 -10.769 1.00 0.33 N ATOM 265 CA LYS A 16 -13.989 -3.239 -12.018 1.00 0.38 C ATOM 266 C LYS A 16 -13.340 -1.997 -12.630 1.00 0.40 C ATOM 267 O LYS A 16 -13.255 -1.904 -13.850 1.00 0.41 O ATOM 268 CB LYS A 16 -15.490 -2.977 -11.799 1.00 0.39 C ATOM 269 CG LYS A 16 -16.402 -4.126 -12.248 1.00 0.61 C ATOM 270 CD LYS A 16 -16.254 -5.405 -11.420 1.00 0.95 C ATOM 271 CE LYS A 16 -17.514 -6.254 -11.630 1.00 1.30 C ATOM 272 NZ LYS A 16 -17.545 -7.441 -10.755 1.00 2.35 N ATOM 0 H LYS A 16 -13.970 -3.632 -9.970 1.00 0.33 H new ATOM 0 HA LYS A 16 -13.870 -4.074 -12.708 1.00 0.38 H new ATOM 0 HB2 LYS A 16 -15.663 -2.784 -10.740 1.00 0.39 H new ATOM 0 HB3 LYS A 16 -15.772 -2.073 -12.338 1.00 0.39 H new ATOM 0 HG2 LYS A 16 -17.439 -3.793 -12.199 1.00 0.61 H new ATOM 0 HG3 LYS A 16 -16.190 -4.356 -13.292 1.00 0.61 H new ATOM 0 HD2 LYS A 16 -15.366 -5.958 -11.728 1.00 0.95 H new ATOM 0 HD3 LYS A 16 -16.129 -5.163 -10.365 1.00 0.95 H new ATOM 0 HE2 LYS A 16 -18.396 -5.643 -11.440 1.00 1.30 H new ATOM 0 HE3 LYS A 16 -17.565 -6.572 -12.671 1.00 1.30 H new ATOM 0 HZ1 LYS A 16 -17.800 -8.279 -11.316 1.00 2.35 H new ATOM 0 HZ2 LYS A 16 -16.607 -7.582 -10.329 1.00 2.35 H new ATOM 0 HZ3 LYS A 16 -18.249 -7.300 -10.003 1.00 2.35 H new ATOM 286 N CYS A 17 -12.902 -1.047 -11.803 1.00 0.42 N ATOM 287 CA CYS A 17 -12.338 0.218 -12.256 1.00 0.48 C ATOM 288 C CYS A 17 -11.085 -0.070 -13.067 1.00 0.46 C ATOM 289 O CYS A 17 -10.850 0.557 -14.097 1.00 0.60 O ATOM 290 CB CYS A 17 -11.988 1.110 -11.053 1.00 0.49 C ATOM 291 SG CYS A 17 -13.146 2.500 -10.945 1.00 2.00 S ATOM 0 H CYS A 17 -12.931 -1.139 -10.788 1.00 0.42 H new ATOM 0 HA CYS A 17 -13.069 0.743 -12.871 1.00 0.48 H new ATOM 0 HB2 CYS A 17 -12.025 0.525 -10.134 1.00 0.49 H new ATOM 0 HB3 CYS A 17 -10.969 1.483 -11.152 1.00 0.49 H new ATOM 0 HG CYS A 17 -12.839 3.242 -9.923 1.00 2.00 H new ATOM 297 N GLY A 18 -10.277 -1.020 -12.600 1.00 0.37 N ATOM 298 CA GLY A 18 -9.150 -1.493 -13.370 1.00 0.37 C ATOM 299 C GLY A 18 -8.043 -1.914 -12.431 1.00 0.37 C ATOM 300 O GLY A 18 -7.106 -1.152 -12.209 1.00 0.35 O ATOM 0 H GLY A 18 -10.389 -1.471 -11.692 1.00 0.37 H new ATOM 0 HA2 GLY A 18 -9.450 -2.333 -13.996 1.00 0.37 H new ATOM 0 HA3 GLY A 18 -8.796 -0.708 -14.038 1.00 0.37 H new ATOM 304 N MET A 19 -8.144 -3.128 -11.887 1.00 0.39 N ATOM 305 CA MET A 19 -7.087 -3.715 -11.073 1.00 0.38 C ATOM 306 C MET A 19 -5.779 -3.846 -11.863 1.00 0.39 C ATOM 307 O MET A 19 -5.513 -4.865 -12.501 1.00 0.46 O ATOM 308 CB MET A 19 -7.552 -5.045 -10.470 1.00 0.42 C ATOM 309 CG MET A 19 -8.190 -6.018 -11.463 1.00 0.70 C ATOM 310 SD MET A 19 -8.357 -7.698 -10.803 1.00 1.15 S ATOM 311 CE MET A 19 -8.256 -8.615 -12.359 1.00 1.76 C ATOM 0 H MET A 19 -8.961 -3.728 -12.000 1.00 0.39 H new ATOM 0 HA MET A 19 -6.872 -3.043 -10.242 1.00 0.38 H new ATOM 0 HB2 MET A 19 -6.697 -5.534 -10.004 1.00 0.42 H new ATOM 0 HB3 MET A 19 -8.270 -4.836 -9.677 1.00 0.42 H new ATOM 0 HG2 MET A 19 -9.174 -5.646 -11.746 1.00 0.70 H new ATOM 0 HG3 MET A 19 -7.588 -6.049 -12.371 1.00 0.70 H new ATOM 0 HE1 MET A 19 -8.340 -9.683 -12.158 1.00 1.76 H new ATOM 0 HE2 MET A 19 -9.067 -8.305 -13.018 1.00 1.76 H new ATOM 0 HE3 MET A 19 -7.300 -8.411 -12.840 1.00 1.76 H new ATOM 321 N LYS A 20 -4.983 -2.776 -11.877 1.00 0.36 N ATOM 322 CA LYS A 20 -3.689 -2.693 -12.543 1.00 0.38 C ATOM 323 C LYS A 20 -2.572 -2.603 -11.515 1.00 0.34 C ATOM 324 O LYS A 20 -1.986 -3.619 -11.153 1.00 0.44 O ATOM 325 CB LYS A 20 -3.730 -1.562 -13.579 1.00 0.39 C ATOM 326 CG LYS A 20 -3.513 -2.121 -14.987 1.00 1.12 C ATOM 327 CD LYS A 20 -4.150 -1.177 -16.011 1.00 1.66 C ATOM 328 CE LYS A 20 -3.223 -0.910 -17.200 1.00 1.71 C ATOM 329 NZ LYS A 20 -2.989 -2.110 -18.030 1.00 2.94 N ATOM 0 H LYS A 20 -5.236 -1.909 -11.404 1.00 0.36 H new ATOM 0 HA LYS A 20 -3.468 -3.601 -13.105 1.00 0.38 H new ATOM 0 HB2 LYS A 20 -4.690 -1.049 -13.529 1.00 0.39 H new ATOM 0 HB3 LYS A 20 -2.961 -0.824 -13.351 1.00 0.39 H new ATOM 0 HG2 LYS A 20 -2.447 -2.228 -15.188 1.00 1.12 H new ATOM 0 HG3 LYS A 20 -3.954 -3.115 -15.068 1.00 1.12 H new ATOM 0 HD2 LYS A 20 -5.084 -1.609 -16.370 1.00 1.66 H new ATOM 0 HD3 LYS A 20 -4.400 -0.233 -15.527 1.00 1.66 H new ATOM 0 HE2 LYS A 20 -3.654 -0.124 -17.820 1.00 1.71 H new ATOM 0 HE3 LYS A 20 -2.267 -0.537 -16.832 1.00 1.71 H new ATOM 0 HZ1 LYS A 20 -2.355 -1.869 -18.818 1.00 2.94 H new ATOM 0 HZ2 LYS A 20 -2.552 -2.854 -17.449 1.00 2.94 H new ATOM 0 HZ3 LYS A 20 -3.895 -2.453 -18.407 1.00 2.94 H new ATOM 343 N ASN A 21 -2.328 -1.394 -10.996 1.00 0.33 N ATOM 344 CA ASN A 21 -1.352 -1.166 -9.934 1.00 0.28 C ATOM 345 C ASN A 21 -1.800 -1.817 -8.626 1.00 0.24 C ATOM 346 O ASN A 21 -1.046 -1.845 -7.662 1.00 0.18 O ATOM 347 CB ASN A 21 -1.140 0.332 -9.677 1.00 0.33 C ATOM 348 CG ASN A 21 -0.007 0.947 -10.498 1.00 0.68 C ATOM 349 OD1 ASN A 21 1.063 1.211 -9.967 1.00 2.36 O ATOM 350 ND2 ASN A 21 -0.219 1.225 -11.775 1.00 1.12 N ATOM 0 H ASN A 21 -2.805 -0.547 -11.304 1.00 0.33 H new ATOM 0 HA ASN A 21 -0.417 -1.614 -10.270 1.00 0.28 H new ATOM 0 HB2 ASN A 21 -2.066 0.863 -9.898 1.00 0.33 H new ATOM 0 HB3 ASN A 21 -0.931 0.483 -8.618 1.00 0.33 H new ATOM 0 HD21 ASN A 21 0.515 1.665 -12.330 1.00 1.12 H new ATOM 0 HD22 ASN A 21 -1.116 0.999 -12.204 1.00 1.12 H new ATOM 357 N PHE A 22 -3.027 -2.325 -8.558 1.00 0.33 N ATOM 358 CA PHE A 22 -3.578 -3.000 -7.407 1.00 0.29 C ATOM 359 C PHE A 22 -4.220 -4.262 -7.952 1.00 0.32 C ATOM 360 O PHE A 22 -5.095 -4.179 -8.810 1.00 0.51 O ATOM 361 CB PHE A 22 -4.577 -2.079 -6.698 1.00 0.26 C ATOM 362 CG PHE A 22 -5.532 -1.329 -7.608 1.00 0.29 C ATOM 363 CD1 PHE A 22 -6.815 -1.838 -7.876 1.00 0.32 C ATOM 364 CD2 PHE A 22 -5.118 -0.124 -8.208 1.00 0.34 C ATOM 365 CE1 PHE A 22 -7.670 -1.145 -8.751 1.00 0.39 C ATOM 366 CE2 PHE A 22 -5.974 0.565 -9.082 1.00 0.41 C ATOM 367 CZ PHE A 22 -7.252 0.053 -9.353 1.00 0.42 C ATOM 0 H PHE A 22 -3.683 -2.271 -9.337 1.00 0.33 H new ATOM 0 HA PHE A 22 -2.829 -3.256 -6.657 1.00 0.29 H new ATOM 0 HB2 PHE A 22 -5.162 -2.676 -5.999 1.00 0.26 H new ATOM 0 HB3 PHE A 22 -4.019 -1.352 -6.107 1.00 0.26 H new ATOM 0 HD1 PHE A 22 -7.142 -2.757 -7.412 1.00 0.32 H new ATOM 0 HD2 PHE A 22 -4.136 0.272 -7.995 1.00 0.34 H new ATOM 0 HE1 PHE A 22 -8.654 -1.536 -8.961 1.00 0.39 H new ATOM 0 HE2 PHE A 22 -5.650 1.486 -9.544 1.00 0.41 H new ATOM 0 HZ PHE A 22 -7.914 0.580 -10.024 1.00 0.42 H new ATOM 377 N ARG A 23 -3.753 -5.428 -7.510 1.00 0.31 N ATOM 378 CA ARG A 23 -4.258 -6.720 -7.949 1.00 0.32 C ATOM 379 C ARG A 23 -4.261 -7.664 -6.767 1.00 0.30 C ATOM 380 O ARG A 23 -3.937 -7.281 -5.649 1.00 0.29 O ATOM 381 CB ARG A 23 -3.395 -7.272 -9.096 1.00 0.40 C ATOM 382 CG ARG A 23 -4.074 -6.994 -10.434 1.00 0.99 C ATOM 383 CD ARG A 23 -3.117 -7.181 -11.608 1.00 1.59 C ATOM 384 NE ARG A 23 -3.867 -7.139 -12.869 1.00 2.39 N ATOM 385 CZ ARG A 23 -4.259 -8.173 -13.623 1.00 2.66 C ATOM 386 NH1 ARG A 23 -5.027 -7.952 -14.690 1.00 3.90 N ATOM 387 NH2 ARG A 23 -3.901 -9.420 -13.312 1.00 2.23 N ATOM 0 H ARG A 23 -3.000 -5.499 -6.825 1.00 0.31 H new ATOM 0 HA ARG A 23 -5.275 -6.613 -8.327 1.00 0.32 H new ATOM 0 HB2 ARG A 23 -2.408 -6.810 -9.076 1.00 0.40 H new ATOM 0 HB3 ARG A 23 -3.247 -8.344 -8.969 1.00 0.40 H new ATOM 0 HG2 ARG A 23 -4.929 -7.660 -10.553 1.00 0.99 H new ATOM 0 HG3 ARG A 23 -4.461 -5.975 -10.440 1.00 0.99 H new ATOM 0 HD2 ARG A 23 -2.358 -6.399 -11.599 1.00 1.59 H new ATOM 0 HD3 ARG A 23 -2.595 -8.133 -11.516 1.00 1.59 H new ATOM 0 HE ARG A 23 -4.119 -6.212 -13.211 1.00 2.39 H new ATOM 0 HH11 ARG A 23 -5.311 -7.001 -14.926 1.00 3.90 H new ATOM 0 HH12 ARG A 23 -5.331 -8.734 -15.271 1.00 3.90 H new ATOM 0 HH21 ARG A 23 -3.322 -9.594 -12.491 1.00 2.23 H new ATOM 0 HH22 ARG A 23 -4.207 -10.199 -13.895 1.00 2.23 H new ATOM 401 N ASN A 24 -4.673 -8.903 -7.015 1.00 0.31 N ATOM 402 CA ASN A 24 -4.955 -9.869 -5.973 1.00 0.33 C ATOM 403 C ASN A 24 -5.827 -9.241 -4.882 1.00 0.33 C ATOM 404 O ASN A 24 -5.648 -9.533 -3.708 1.00 0.37 O ATOM 405 CB ASN A 24 -3.648 -10.456 -5.419 1.00 0.34 C ATOM 406 CG ASN A 24 -3.874 -11.816 -4.771 1.00 0.59 C ATOM 407 OD1 ASN A 24 -4.222 -11.864 -3.496 1.00 1.38 O flip ATOM 408 ND2 ASN A 24 -3.759 -12.840 -5.431 1.00 1.50 N flip ATOM 0 H ASN A 24 -4.820 -9.263 -7.958 1.00 0.31 H new ATOM 0 HA ASN A 24 -5.523 -10.698 -6.395 1.00 0.33 H new ATOM 0 HB2 ASN A 24 -2.921 -10.553 -6.226 1.00 0.34 H new ATOM 0 HB3 ASN A 24 -3.222 -9.770 -4.687 1.00 0.34 H new ATOM 0 HD21 ASN A 24 -3.490 -12.786 -6.413 1.00 1.50 H new ATOM 0 HD22 ASN A 24 -3.932 -13.747 -4.999 1.00 1.50 H new ATOM 415 N ILE A 25 -6.756 -8.357 -5.253 1.00 0.32 N ATOM 416 CA ILE A 25 -7.702 -7.810 -4.297 1.00 0.31 C ATOM 417 C ILE A 25 -8.567 -8.986 -3.846 1.00 0.37 C ATOM 418 O ILE A 25 -9.170 -9.654 -4.687 1.00 0.41 O ATOM 419 CB ILE A 25 -8.510 -6.660 -4.949 1.00 0.32 C ATOM 420 CG1 ILE A 25 -7.866 -5.306 -4.601 1.00 0.29 C ATOM 421 CG2 ILE A 25 -9.977 -6.659 -4.510 1.00 0.43 C ATOM 422 CD1 ILE A 25 -8.639 -4.111 -5.141 1.00 0.35 C ATOM 0 H ILE A 25 -6.868 -8.010 -6.206 1.00 0.32 H new ATOM 0 HA ILE A 25 -7.219 -7.362 -3.428 1.00 0.31 H new ATOM 0 HB ILE A 25 -8.489 -6.819 -6.027 1.00 0.32 H new ATOM 0 HG12 ILE A 25 -7.786 -5.218 -3.517 1.00 0.29 H new ATOM 0 HG13 ILE A 25 -6.851 -5.282 -4.998 1.00 0.29 H new ATOM 0 HG21 ILE A 25 -10.501 -5.835 -4.994 1.00 0.43 H new ATOM 0 HG22 ILE A 25 -10.443 -7.602 -4.795 1.00 0.43 H new ATOM 0 HG23 ILE A 25 -10.033 -6.539 -3.428 1.00 0.43 H new ATOM 0 HD11 ILE A 25 -8.129 -3.190 -4.859 1.00 0.35 H new ATOM 0 HD12 ILE A 25 -8.696 -4.176 -6.228 1.00 0.35 H new ATOM 0 HD13 ILE A 25 -9.646 -4.110 -4.724 1.00 0.35 H new ATOM 434 N GLN A 26 -8.628 -9.242 -2.539 1.00 0.41 N ATOM 435 CA GLN A 26 -9.509 -10.251 -1.976 1.00 0.48 C ATOM 436 C GLN A 26 -10.140 -9.683 -0.713 1.00 0.52 C ATOM 437 O GLN A 26 -9.612 -8.745 -0.112 1.00 0.54 O ATOM 438 CB GLN A 26 -8.771 -11.562 -1.663 1.00 0.51 C ATOM 439 CG GLN A 26 -7.591 -11.836 -2.599 1.00 0.44 C ATOM 440 CD GLN A 26 -7.094 -13.274 -2.498 1.00 0.49 C ATOM 441 OE1 GLN A 26 -7.175 -13.918 -1.459 1.00 1.47 O ATOM 442 NE2 GLN A 26 -6.551 -13.814 -3.580 1.00 1.41 N ATOM 0 H GLN A 26 -8.065 -8.752 -1.844 1.00 0.41 H new ATOM 0 HA GLN A 26 -10.275 -10.495 -2.712 1.00 0.48 H new ATOM 0 HB2 GLN A 26 -8.410 -11.530 -0.635 1.00 0.51 H new ATOM 0 HB3 GLN A 26 -9.476 -12.391 -1.727 1.00 0.51 H new ATOM 0 HG2 GLN A 26 -7.889 -11.628 -3.627 1.00 0.44 H new ATOM 0 HG3 GLN A 26 -6.775 -11.154 -2.360 1.00 0.44 H new ATOM 0 HE21 GLN A 26 -6.486 -13.273 -4.442 1.00 1.41 H new ATOM 0 HE22 GLN A 26 -6.198 -14.770 -3.550 1.00 1.41 H new ATOM 451 N VAL A 27 -11.256 -10.280 -0.302 1.00 0.54 N ATOM 452 CA VAL A 27 -12.001 -9.888 0.877 1.00 0.56 C ATOM 453 C VAL A 27 -12.450 -11.206 1.511 1.00 0.56 C ATOM 454 O VAL A 27 -12.889 -12.100 0.789 1.00 0.67 O ATOM 455 CB VAL A 27 -13.135 -8.938 0.434 1.00 0.60 C ATOM 456 CG1 VAL A 27 -14.384 -9.649 -0.103 1.00 0.70 C ATOM 457 CG2 VAL A 27 -13.531 -7.989 1.558 1.00 0.60 C ATOM 0 H VAL A 27 -11.672 -11.069 -0.797 1.00 0.54 H new ATOM 0 HA VAL A 27 -11.442 -9.325 1.624 1.00 0.56 H new ATOM 0 HB VAL A 27 -12.715 -8.375 -0.400 1.00 0.60 H new ATOM 0 HG11 VAL A 27 -15.129 -8.908 -0.391 1.00 0.70 H new ATOM 0 HG12 VAL A 27 -14.115 -10.250 -0.972 1.00 0.70 H new ATOM 0 HG13 VAL A 27 -14.796 -10.296 0.672 1.00 0.70 H new ATOM 0 HG21 VAL A 27 -14.331 -7.333 1.215 1.00 0.60 H new ATOM 0 HG22 VAL A 27 -13.877 -8.565 2.416 1.00 0.60 H new ATOM 0 HG23 VAL A 27 -12.669 -7.389 1.848 1.00 0.60 H new ATOM 467 N ASP A 28 -12.246 -11.381 2.815 1.00 0.50 N ATOM 468 CA ASP A 28 -12.648 -12.604 3.513 1.00 0.51 C ATOM 469 C ASP A 28 -14.164 -12.565 3.722 1.00 0.45 C ATOM 470 O ASP A 28 -14.736 -11.482 3.714 1.00 0.43 O ATOM 471 CB ASP A 28 -11.897 -12.659 4.846 1.00 0.54 C ATOM 472 CG ASP A 28 -12.080 -13.997 5.557 1.00 0.61 C ATOM 473 OD1 ASP A 28 -13.121 -14.151 6.234 1.00 1.09 O ATOM 474 OD2 ASP A 28 -11.160 -14.833 5.443 1.00 1.33 O ATOM 0 H ASP A 28 -11.801 -10.686 3.415 1.00 0.50 H new ATOM 0 HA ASP A 28 -12.404 -13.497 2.938 1.00 0.51 H new ATOM 0 HB2 ASP A 28 -10.835 -12.485 4.670 1.00 0.54 H new ATOM 0 HB3 ASP A 28 -12.249 -11.855 5.493 1.00 0.54 H new ATOM 479 N GLU A 29 -14.854 -13.691 3.897 1.00 0.56 N ATOM 480 CA GLU A 29 -16.293 -13.645 4.126 1.00 0.58 C ATOM 481 C GLU A 29 -16.587 -13.124 5.530 1.00 0.50 C ATOM 482 O GLU A 29 -17.436 -12.255 5.721 1.00 0.52 O ATOM 483 CB GLU A 29 -16.938 -15.028 3.960 1.00 0.76 C ATOM 484 CG GLU A 29 -16.920 -15.520 2.508 1.00 1.95 C ATOM 485 CD GLU A 29 -15.767 -16.487 2.229 1.00 2.72 C ATOM 486 OE1 GLU A 29 -16.057 -17.569 1.671 1.00 3.45 O ATOM 487 OE2 GLU A 29 -14.619 -16.141 2.585 1.00 4.00 O ATOM 0 H GLU A 29 -14.449 -14.627 3.885 1.00 0.56 H new ATOM 0 HA GLU A 29 -16.719 -12.973 3.381 1.00 0.58 H new ATOM 0 HB2 GLU A 29 -16.413 -15.747 4.589 1.00 0.76 H new ATOM 0 HB3 GLU A 29 -17.969 -14.988 4.313 1.00 0.76 H new ATOM 0 HG2 GLU A 29 -17.866 -16.013 2.284 1.00 1.95 H new ATOM 0 HG3 GLU A 29 -16.841 -14.663 1.839 1.00 1.95 H new ATOM 494 N ALA A 30 -15.914 -13.695 6.526 1.00 0.50 N ATOM 495 CA ALA A 30 -16.116 -13.338 7.916 1.00 0.49 C ATOM 496 C ALA A 30 -15.401 -12.025 8.186 1.00 0.39 C ATOM 497 O ALA A 30 -15.995 -11.035 8.611 1.00 0.41 O ATOM 498 CB ALA A 30 -15.564 -14.456 8.806 1.00 0.60 C ATOM 0 H ALA A 30 -15.212 -14.421 6.384 1.00 0.50 H new ATOM 0 HA ALA A 30 -17.177 -13.216 8.135 1.00 0.49 H new ATOM 0 HB1 ALA A 30 -15.713 -14.194 9.854 1.00 0.60 H new ATOM 0 HB2 ALA A 30 -16.087 -15.387 8.587 1.00 0.60 H new ATOM 0 HB3 ALA A 30 -14.499 -14.584 8.612 1.00 0.60 H new ATOM 504 N ASN A 31 -14.097 -12.007 7.927 1.00 0.36 N ATOM 505 CA ASN A 31 -13.246 -10.879 8.238 1.00 0.31 C ATOM 506 C ASN A 31 -13.229 -9.880 7.080 1.00 0.24 C ATOM 507 O ASN A 31 -12.194 -9.263 6.853 1.00 0.37 O ATOM 508 CB ASN A 31 -11.837 -11.399 8.585 1.00 0.44 C ATOM 509 CG ASN A 31 -11.290 -10.669 9.800 1.00 1.13 C ATOM 510 OD1 ASN A 31 -11.057 -9.370 9.696 1.00 2.42 O flip ATOM 511 ND2 ASN A 31 -11.114 -11.254 10.861 1.00 2.34 N flip ATOM 0 H ASN A 31 -13.603 -12.786 7.491 1.00 0.36 H new ATOM 0 HA ASN A 31 -13.636 -10.342 9.103 1.00 0.31 H new ATOM 0 HB2 ASN A 31 -11.876 -12.470 8.783 1.00 0.44 H new ATOM 0 HB3 ASN A 31 -11.170 -11.256 7.735 1.00 0.44 H new ATOM 0 HD21 ASN A 31 -11.297 -12.255 10.928 1.00 2.34 H new ATOM 0 HD22 ASN A 31 -10.784 -10.740 11.678 1.00 2.34 H new ATOM 518 N LEU A 32 -14.354 -9.694 6.373 1.00 0.20 N ATOM 519 CA LEU A 32 -14.455 -8.921 5.127 1.00 0.21 C ATOM 520 C LEU A 32 -14.029 -7.466 5.299 1.00 0.20 C ATOM 521 O LEU A 32 -13.610 -6.798 4.360 1.00 0.24 O ATOM 522 CB LEU A 32 -15.871 -9.070 4.521 1.00 0.32 C ATOM 523 CG LEU A 32 -16.890 -7.934 4.706 1.00 0.34 C ATOM 524 CD1 LEU A 32 -16.659 -6.765 3.735 1.00 0.52 C ATOM 525 CD2 LEU A 32 -18.281 -8.511 4.411 1.00 0.38 C ATOM 0 H LEU A 32 -15.248 -10.091 6.663 1.00 0.20 H new ATOM 0 HA LEU A 32 -13.744 -9.337 4.413 1.00 0.21 H new ATOM 0 HB2 LEU A 32 -15.754 -9.234 3.450 1.00 0.32 H new ATOM 0 HB3 LEU A 32 -16.312 -9.977 4.936 1.00 0.32 H new ATOM 0 HG LEU A 32 -16.790 -7.553 5.722 1.00 0.34 H new ATOM 0 HD11 LEU A 32 -17.407 -5.992 3.911 1.00 0.52 H new ATOM 0 HD12 LEU A 32 -15.664 -6.350 3.896 1.00 0.52 H new ATOM 0 HD13 LEU A 32 -16.741 -7.123 2.709 1.00 0.52 H new ATOM 0 HD21 LEU A 32 -19.032 -7.730 4.533 1.00 0.38 H new ATOM 0 HD22 LEU A 32 -18.310 -8.886 3.388 1.00 0.38 H new ATOM 0 HD23 LEU A 32 -18.491 -9.327 5.103 1.00 0.38 H new ATOM 537 N LEU A 33 -14.152 -6.967 6.525 1.00 0.21 N ATOM 538 CA LEU A 33 -13.656 -5.666 6.933 1.00 0.25 C ATOM 539 C LEU A 33 -12.178 -5.495 6.575 1.00 0.31 C ATOM 540 O LEU A 33 -11.761 -4.433 6.120 1.00 0.68 O ATOM 541 CB LEU A 33 -13.905 -5.547 8.440 1.00 0.27 C ATOM 542 CG LEU A 33 -15.383 -5.272 8.748 1.00 0.31 C ATOM 543 CD1 LEU A 33 -15.582 -5.289 10.256 1.00 0.33 C ATOM 544 CD2 LEU A 33 -15.841 -3.905 8.239 1.00 0.41 C ATOM 0 H LEU A 33 -14.613 -7.474 7.280 1.00 0.21 H new ATOM 0 HA LEU A 33 -14.177 -4.868 6.404 1.00 0.25 H new ATOM 0 HB2 LEU A 33 -13.595 -6.468 8.934 1.00 0.27 H new ATOM 0 HB3 LEU A 33 -13.292 -4.744 8.848 1.00 0.27 H new ATOM 0 HG LEU A 33 -15.967 -6.043 8.246 1.00 0.31 H new ATOM 0 HD11 LEU A 33 -16.629 -5.095 10.487 1.00 0.33 H new ATOM 0 HD12 LEU A 33 -15.299 -6.265 10.649 1.00 0.33 H new ATOM 0 HD13 LEU A 33 -14.961 -4.519 10.714 1.00 0.33 H new ATOM 0 HD21 LEU A 33 -16.894 -3.760 8.482 1.00 0.41 H new ATOM 0 HD22 LEU A 33 -15.248 -3.123 8.713 1.00 0.41 H new ATOM 0 HD23 LEU A 33 -15.708 -3.856 7.158 1.00 0.41 H new ATOM 556 N THR A 34 -11.375 -6.534 6.776 1.00 0.22 N ATOM 557 CA THR A 34 -9.977 -6.537 6.406 1.00 0.19 C ATOM 558 C THR A 34 -9.798 -6.951 4.953 1.00 0.20 C ATOM 559 O THR A 34 -10.511 -7.799 4.420 1.00 0.26 O ATOM 560 CB THR A 34 -9.196 -7.489 7.317 1.00 0.24 C ATOM 561 OG1 THR A 34 -9.500 -7.211 8.667 1.00 0.39 O ATOM 562 CG2 THR A 34 -7.688 -7.311 7.130 1.00 0.23 C ATOM 0 H THR A 34 -11.687 -7.405 7.206 1.00 0.22 H new ATOM 0 HA THR A 34 -9.592 -5.524 6.525 1.00 0.19 H new ATOM 0 HB THR A 34 -9.480 -8.508 7.056 1.00 0.24 H new ATOM 0 HG1 THR A 34 -10.023 -7.949 9.043 1.00 0.39 H new ATOM 0 HG21 THR A 34 -7.156 -7.998 7.788 1.00 0.23 H new ATOM 0 HG22 THR A 34 -7.422 -7.522 6.094 1.00 0.23 H new ATOM 0 HG23 THR A 34 -7.410 -6.286 7.375 1.00 0.23 H new ATOM 570 N TRP A 35 -8.803 -6.335 4.325 1.00 0.16 N ATOM 571 CA TRP A 35 -8.484 -6.497 2.923 1.00 0.14 C ATOM 572 C TRP A 35 -7.085 -7.056 2.815 1.00 0.14 C ATOM 573 O TRP A 35 -6.219 -6.744 3.632 1.00 0.16 O ATOM 574 CB TRP A 35 -8.491 -5.134 2.239 1.00 0.15 C ATOM 575 CG TRP A 35 -9.814 -4.470 2.106 1.00 0.15 C ATOM 576 CD1 TRP A 35 -10.745 -4.359 3.074 1.00 0.19 C ATOM 577 CD2 TRP A 35 -10.351 -3.765 0.955 1.00 0.16 C ATOM 578 NE1 TRP A 35 -11.849 -3.715 2.589 1.00 0.21 N ATOM 579 CE2 TRP A 35 -11.664 -3.310 1.281 1.00 0.17 C ATOM 580 CE3 TRP A 35 -9.834 -3.427 -0.313 1.00 0.24 C ATOM 581 CZ2 TRP A 35 -12.432 -2.577 0.368 1.00 0.19 C ATOM 582 CZ3 TRP A 35 -10.600 -2.693 -1.234 1.00 0.27 C ATOM 583 CH2 TRP A 35 -11.899 -2.277 -0.894 1.00 0.21 C ATOM 0 H TRP A 35 -8.177 -5.686 4.802 1.00 0.16 H new ATOM 0 HA TRP A 35 -9.214 -7.158 2.456 1.00 0.14 H new ATOM 0 HB2 TRP A 35 -7.829 -4.469 2.794 1.00 0.15 H new ATOM 0 HB3 TRP A 35 -8.064 -5.249 1.243 1.00 0.15 H new ATOM 0 HD1 TRP A 35 -10.635 -4.725 4.084 1.00 0.19 H new ATOM 0 HE1 TRP A 35 -12.702 -3.554 3.125 1.00 0.21 H new ATOM 0 HE3 TRP A 35 -8.834 -3.737 -0.580 1.00 0.24 H new ATOM 0 HZ2 TRP A 35 -13.425 -2.246 0.633 1.00 0.19 H new ATOM 0 HZ3 TRP A 35 -10.191 -2.448 -2.203 1.00 0.27 H new ATOM 0 HH2 TRP A 35 -12.490 -1.723 -1.609 1.00 0.21 H new ATOM 594 N GLN A 36 -6.834 -7.813 1.755 1.00 0.15 N ATOM 595 CA GLN A 36 -5.502 -8.282 1.451 1.00 0.20 C ATOM 596 C GLN A 36 -5.332 -8.262 -0.058 1.00 0.29 C ATOM 597 O GLN A 36 -6.295 -8.467 -0.799 1.00 0.49 O ATOM 598 CB GLN A 36 -5.293 -9.688 2.029 1.00 0.28 C ATOM 599 CG GLN A 36 -6.437 -10.651 1.656 1.00 0.47 C ATOM 600 CD GLN A 36 -5.971 -12.012 1.146 1.00 1.35 C ATOM 601 OE1 GLN A 36 -4.835 -12.187 0.704 1.00 2.17 O ATOM 602 NE2 GLN A 36 -6.872 -12.985 1.157 1.00 1.77 N ATOM 0 H GLN A 36 -7.547 -8.114 1.090 1.00 0.15 H new ATOM 0 HA GLN A 36 -4.750 -7.637 1.905 1.00 0.20 H new ATOM 0 HB2 GLN A 36 -4.348 -10.091 1.664 1.00 0.28 H new ATOM 0 HB3 GLN A 36 -5.214 -9.624 3.114 1.00 0.28 H new ATOM 0 HG2 GLN A 36 -7.070 -10.801 2.531 1.00 0.47 H new ATOM 0 HG3 GLN A 36 -7.056 -10.182 0.891 1.00 0.47 H new ATOM 0 HE21 GLN A 36 -7.806 -12.811 1.529 1.00 1.77 H new ATOM 0 HE22 GLN A 36 -6.631 -13.907 0.793 1.00 1.77 H new ATOM 611 N GLY A 37 -4.109 -8.015 -0.511 1.00 0.21 N ATOM 612 CA GLY A 37 -3.786 -8.129 -1.914 1.00 0.21 C ATOM 613 C GLY A 37 -2.359 -7.681 -2.134 1.00 0.19 C ATOM 614 O GLY A 37 -1.553 -7.687 -1.206 1.00 0.25 O ATOM 0 H GLY A 37 -3.327 -7.734 0.081 1.00 0.21 H new ATOM 0 HA2 GLY A 37 -3.911 -9.160 -2.246 1.00 0.21 H new ATOM 0 HA3 GLY A 37 -4.467 -7.518 -2.507 1.00 0.21 H new ATOM 618 N LEU A 38 -2.039 -7.286 -3.359 1.00 0.21 N ATOM 619 CA LEU A 38 -0.757 -6.691 -3.660 1.00 0.23 C ATOM 620 C LEU A 38 -0.984 -5.446 -4.490 1.00 0.26 C ATOM 621 O LEU A 38 -2.063 -5.212 -5.034 1.00 0.33 O ATOM 622 CB LEU A 38 0.206 -7.710 -4.302 1.00 0.25 C ATOM 623 CG LEU A 38 -0.275 -8.412 -5.587 1.00 0.25 C ATOM 624 CD1 LEU A 38 -0.344 -7.481 -6.798 1.00 0.49 C ATOM 625 CD2 LEU A 38 0.707 -9.536 -5.931 1.00 0.28 C ATOM 0 H LEU A 38 -2.661 -7.371 -4.163 1.00 0.21 H new ATOM 0 HA LEU A 38 -0.256 -6.387 -2.741 1.00 0.23 H new ATOM 0 HB2 LEU A 38 1.142 -7.198 -4.526 1.00 0.25 H new ATOM 0 HB3 LEU A 38 0.432 -8.477 -3.561 1.00 0.25 H new ATOM 0 HG LEU A 38 -1.281 -8.778 -5.384 1.00 0.25 H new ATOM 0 HD11 LEU A 38 -0.690 -8.040 -7.668 1.00 0.49 H new ATOM 0 HD12 LEU A 38 -1.038 -6.666 -6.591 1.00 0.49 H new ATOM 0 HD13 LEU A 38 0.646 -7.072 -7.000 1.00 0.49 H new ATOM 0 HD21 LEU A 38 0.378 -10.041 -6.839 1.00 0.28 H new ATOM 0 HD22 LEU A 38 1.700 -9.116 -6.089 1.00 0.28 H new ATOM 0 HD23 LEU A 38 0.743 -10.252 -5.110 1.00 0.28 H new ATOM 637 N ILE A 39 0.060 -4.644 -4.590 1.00 0.23 N ATOM 638 CA ILE A 39 0.096 -3.486 -5.433 1.00 0.21 C ATOM 639 C ILE A 39 1.303 -3.718 -6.326 1.00 0.19 C ATOM 640 O ILE A 39 2.399 -4.000 -5.841 1.00 0.24 O ATOM 641 CB ILE A 39 0.087 -2.193 -4.592 1.00 0.20 C ATOM 642 CG1 ILE A 39 1.122 -2.213 -3.451 1.00 0.20 C ATOM 643 CG2 ILE A 39 -1.324 -2.021 -4.002 1.00 0.20 C ATOM 644 CD1 ILE A 39 1.040 -0.973 -2.560 1.00 0.19 C ATOM 0 H ILE A 39 0.924 -4.793 -4.069 1.00 0.23 H new ATOM 0 HA ILE A 39 -0.783 -3.345 -6.062 1.00 0.21 H new ATOM 0 HB ILE A 39 0.356 -1.361 -5.243 1.00 0.20 H new ATOM 0 HG12 ILE A 39 0.969 -3.104 -2.842 1.00 0.20 H new ATOM 0 HG13 ILE A 39 2.123 -2.285 -3.875 1.00 0.20 H new ATOM 0 HG21 ILE A 39 -1.359 -1.112 -3.401 1.00 0.20 H new ATOM 0 HG22 ILE A 39 -2.051 -1.949 -4.811 1.00 0.20 H new ATOM 0 HG23 ILE A 39 -1.563 -2.880 -3.375 1.00 0.20 H new ATOM 0 HD11 ILE A 39 1.791 -1.040 -1.773 1.00 0.19 H new ATOM 0 HD12 ILE A 39 1.221 -0.081 -3.160 1.00 0.19 H new ATOM 0 HD13 ILE A 39 0.049 -0.913 -2.111 1.00 0.19 H new ATOM 656 N VAL A 40 1.050 -3.751 -7.632 1.00 0.22 N ATOM 657 CA VAL A 40 2.050 -3.913 -8.664 1.00 0.23 C ATOM 658 C VAL A 40 2.568 -2.504 -8.929 1.00 0.27 C ATOM 659 O VAL A 40 1.803 -1.681 -9.423 1.00 0.38 O ATOM 660 CB VAL A 40 1.404 -4.518 -9.925 1.00 0.22 C ATOM 661 CG1 VAL A 40 2.474 -4.863 -10.966 1.00 0.25 C ATOM 662 CG2 VAL A 40 0.612 -5.792 -9.608 1.00 0.28 C ATOM 0 H VAL A 40 0.105 -3.662 -8.006 1.00 0.22 H new ATOM 0 HA VAL A 40 2.856 -4.586 -8.373 1.00 0.23 H new ATOM 0 HB VAL A 40 0.721 -3.765 -10.318 1.00 0.22 H new ATOM 0 HG11 VAL A 40 1.998 -5.289 -11.849 1.00 0.25 H new ATOM 0 HG12 VAL A 40 3.015 -3.959 -11.246 1.00 0.25 H new ATOM 0 HG13 VAL A 40 3.171 -5.587 -10.545 1.00 0.25 H new ATOM 0 HG21 VAL A 40 0.173 -6.185 -10.525 1.00 0.28 H new ATOM 0 HG22 VAL A 40 1.280 -6.538 -9.176 1.00 0.28 H new ATOM 0 HG23 VAL A 40 -0.181 -5.560 -8.897 1.00 0.28 H new ATOM 672 N PRO A 41 3.806 -2.177 -8.541 1.00 0.35 N ATOM 673 CA PRO A 41 4.361 -0.869 -8.823 1.00 0.41 C ATOM 674 C PRO A 41 4.618 -0.694 -10.320 1.00 0.31 C ATOM 675 O PRO A 41 4.520 -1.646 -11.089 1.00 0.32 O ATOM 676 CB PRO A 41 5.680 -0.793 -8.052 1.00 0.63 C ATOM 677 CG PRO A 41 5.885 -2.154 -7.386 1.00 0.60 C ATOM 678 CD PRO A 41 4.765 -3.052 -7.901 1.00 0.50 C ATOM 0 HA PRO A 41 3.670 -0.081 -8.524 1.00 0.41 H new ATOM 0 HB2 PRO A 41 6.507 -0.563 -8.724 1.00 0.63 H new ATOM 0 HB3 PRO A 41 5.646 0.001 -7.306 1.00 0.63 H new ATOM 0 HG2 PRO A 41 6.862 -2.567 -7.637 1.00 0.60 H new ATOM 0 HG3 PRO A 41 5.846 -2.066 -6.300 1.00 0.60 H new ATOM 0 HD2 PRO A 41 5.150 -3.789 -8.606 1.00 0.50 H new ATOM 0 HD3 PRO A 41 4.302 -3.605 -7.083 1.00 0.50 H new ATOM 686 N ASP A 42 5.049 0.515 -10.689 1.00 0.36 N ATOM 687 CA ASP A 42 5.578 0.826 -12.014 1.00 0.35 C ATOM 688 C ASP A 42 7.009 1.344 -11.857 1.00 0.33 C ATOM 689 O ASP A 42 7.929 0.819 -12.473 1.00 0.35 O ATOM 690 CB ASP A 42 4.720 1.876 -12.734 1.00 0.47 C ATOM 691 CG ASP A 42 3.374 1.351 -13.237 1.00 0.72 C ATOM 692 OD1 ASP A 42 3.381 0.362 -14.001 1.00 1.18 O ATOM 693 OD2 ASP A 42 2.349 1.986 -12.898 1.00 1.53 O ATOM 0 H ASP A 42 5.039 1.319 -10.061 1.00 0.36 H new ATOM 0 HA ASP A 42 5.562 -0.080 -12.620 1.00 0.35 H new ATOM 0 HB2 ASP A 42 4.541 2.710 -12.055 1.00 0.47 H new ATOM 0 HB3 ASP A 42 5.283 2.270 -13.581 1.00 0.47 H new ATOM 698 N ASN A 43 7.205 2.393 -11.045 1.00 0.33 N ATOM 699 CA ASN A 43 8.517 3.028 -10.887 1.00 0.31 C ATOM 700 C ASN A 43 9.571 2.076 -10.315 1.00 0.29 C ATOM 701 O ASN A 43 10.592 1.851 -10.960 1.00 0.33 O ATOM 702 CB ASN A 43 8.432 4.316 -10.051 1.00 0.32 C ATOM 703 CG ASN A 43 8.938 5.519 -10.831 1.00 0.45 C ATOM 704 OD1 ASN A 43 10.137 5.680 -11.021 1.00 0.59 O ATOM 705 ND2 ASN A 43 8.041 6.370 -11.307 1.00 0.61 N ATOM 0 H ASN A 43 6.466 2.820 -10.486 1.00 0.33 H new ATOM 0 HA ASN A 43 8.842 3.298 -11.892 1.00 0.31 H new ATOM 0 HB2 ASN A 43 7.399 4.486 -9.747 1.00 0.32 H new ATOM 0 HB3 ASN A 43 9.018 4.199 -9.139 1.00 0.32 H new ATOM 0 HD21 ASN A 43 8.344 7.182 -11.846 1.00 0.61 H new ATOM 0 HD22 ASN A 43 7.048 6.213 -11.135 1.00 0.61 H new ATOM 712 N PRO A 44 9.408 1.555 -9.088 1.00 0.27 N ATOM 713 CA PRO A 44 10.393 0.648 -8.534 1.00 0.27 C ATOM 714 C PRO A 44 10.273 -0.715 -9.223 1.00 0.29 C ATOM 715 O PRO A 44 9.214 -1.063 -9.742 1.00 0.41 O ATOM 716 CB PRO A 44 10.079 0.574 -7.039 1.00 0.29 C ATOM 717 CG PRO A 44 8.567 0.752 -7.023 1.00 0.29 C ATOM 718 CD PRO A 44 8.318 1.757 -8.149 1.00 0.28 C ATOM 0 HA PRO A 44 11.419 0.981 -8.689 1.00 0.27 H new ATOM 0 HB2 PRO A 44 10.382 -0.379 -6.605 1.00 0.29 H new ATOM 0 HB3 PRO A 44 10.588 1.357 -6.476 1.00 0.29 H new ATOM 0 HG2 PRO A 44 8.049 -0.190 -7.203 1.00 0.29 H new ATOM 0 HG3 PRO A 44 8.217 1.130 -6.062 1.00 0.29 H new ATOM 0 HD2 PRO A 44 7.352 1.585 -8.624 1.00 0.28 H new ATOM 0 HD3 PRO A 44 8.309 2.779 -7.770 1.00 0.28 H new ATOM 726 N PRO A 45 11.350 -1.507 -9.196 1.00 0.25 N ATOM 727 CA PRO A 45 11.471 -2.761 -9.915 1.00 0.29 C ATOM 728 C PRO A 45 10.373 -3.749 -9.538 1.00 0.42 C ATOM 729 O PRO A 45 10.406 -4.353 -8.463 1.00 0.93 O ATOM 730 CB PRO A 45 12.875 -3.280 -9.631 1.00 0.30 C ATOM 731 CG PRO A 45 13.303 -2.518 -8.390 1.00 0.27 C ATOM 732 CD PRO A 45 12.588 -1.185 -8.526 1.00 0.27 C ATOM 0 HA PRO A 45 11.335 -2.618 -10.987 1.00 0.29 H new ATOM 0 HB2 PRO A 45 12.876 -4.356 -9.459 1.00 0.30 H new ATOM 0 HB3 PRO A 45 13.548 -3.091 -10.468 1.00 0.30 H new ATOM 0 HG2 PRO A 45 13.010 -3.039 -7.479 1.00 0.27 H new ATOM 0 HG3 PRO A 45 14.385 -2.391 -8.351 1.00 0.27 H new ATOM 0 HD2 PRO A 45 12.406 -0.731 -7.552 1.00 0.27 H new ATOM 0 HD3 PRO A 45 13.179 -0.474 -9.104 1.00 0.27 H new ATOM 740 N TYR A 46 9.433 -3.925 -10.470 1.00 0.32 N ATOM 741 CA TYR A 46 8.279 -4.799 -10.333 1.00 0.36 C ATOM 742 C TYR A 46 8.372 -6.010 -11.262 1.00 0.39 C ATOM 743 O TYR A 46 7.619 -6.966 -11.119 1.00 0.74 O ATOM 744 CB TYR A 46 6.991 -4.018 -10.604 1.00 0.40 C ATOM 745 CG TYR A 46 6.805 -3.614 -12.050 1.00 0.42 C ATOM 746 CD1 TYR A 46 6.114 -4.468 -12.929 1.00 1.48 C ATOM 747 CD2 TYR A 46 7.327 -2.395 -12.516 1.00 1.65 C ATOM 748 CE1 TYR A 46 5.940 -4.108 -14.276 1.00 1.58 C ATOM 749 CE2 TYR A 46 7.160 -2.029 -13.863 1.00 1.82 C ATOM 750 CZ TYR A 46 6.465 -2.882 -14.747 1.00 1.04 C ATOM 751 OH TYR A 46 6.305 -2.516 -16.051 1.00 1.40 O ATOM 0 H TYR A 46 9.461 -3.444 -11.369 1.00 0.32 H new ATOM 0 HA TYR A 46 8.264 -5.171 -9.309 1.00 0.36 H new ATOM 0 HB2 TYR A 46 6.140 -4.624 -10.295 1.00 0.40 H new ATOM 0 HB3 TYR A 46 6.985 -3.121 -9.984 1.00 0.40 H new ATOM 0 HD1 TYR A 46 5.716 -5.404 -12.567 1.00 1.48 H new ATOM 0 HD2 TYR A 46 7.856 -1.740 -11.840 1.00 1.65 H new ATOM 0 HE1 TYR A 46 5.408 -4.764 -14.949 1.00 1.58 H new ATOM 0 HE2 TYR A 46 7.564 -1.094 -14.222 1.00 1.82 H new ATOM 0 HH TYR A 46 6.727 -1.644 -16.200 1.00 1.40 H new ATOM 761 N ASP A 47 9.308 -6.031 -12.209 1.00 0.35 N ATOM 762 CA ASP A 47 9.516 -7.209 -13.049 1.00 0.38 C ATOM 763 C ASP A 47 9.816 -8.409 -12.149 1.00 0.39 C ATOM 764 O ASP A 47 9.321 -9.522 -12.343 1.00 0.61 O ATOM 765 CB ASP A 47 10.680 -6.972 -14.021 1.00 0.42 C ATOM 766 CG ASP A 47 10.492 -5.704 -14.846 1.00 1.39 C ATOM 767 OD1 ASP A 47 10.178 -5.833 -16.047 1.00 2.22 O ATOM 768 OD2 ASP A 47 10.674 -4.627 -14.231 1.00 2.78 O ATOM 0 H ASP A 47 9.932 -5.250 -12.413 1.00 0.35 H new ATOM 0 HA ASP A 47 8.618 -7.404 -13.635 1.00 0.38 H new ATOM 0 HB2 ASP A 47 11.612 -6.903 -13.460 1.00 0.42 H new ATOM 0 HB3 ASP A 47 10.773 -7.828 -14.689 1.00 0.42 H new ATOM 773 N LYS A 48 10.637 -8.162 -11.125 1.00 0.30 N ATOM 774 CA LYS A 48 11.095 -9.199 -10.215 1.00 0.27 C ATOM 775 C LYS A 48 10.023 -9.580 -9.190 1.00 0.23 C ATOM 776 O LYS A 48 10.220 -10.563 -8.483 1.00 0.30 O ATOM 777 CB LYS A 48 12.420 -8.788 -9.534 1.00 0.34 C ATOM 778 CG LYS A 48 13.606 -8.796 -10.517 1.00 0.48 C ATOM 779 CD LYS A 48 13.798 -7.464 -11.257 1.00 0.94 C ATOM 780 CE LYS A 48 14.660 -7.611 -12.518 1.00 1.10 C ATOM 781 NZ LYS A 48 16.051 -8.020 -12.226 1.00 1.89 N ATOM 0 H LYS A 48 11.000 -7.234 -10.909 1.00 0.30 H new ATOM 0 HA LYS A 48 11.288 -10.093 -10.808 1.00 0.27 H new ATOM 0 HB2 LYS A 48 12.312 -7.792 -9.105 1.00 0.34 H new ATOM 0 HB3 LYS A 48 12.629 -9.469 -8.709 1.00 0.34 H new ATOM 0 HG2 LYS A 48 14.519 -9.034 -9.971 1.00 0.48 H new ATOM 0 HG3 LYS A 48 13.456 -9.590 -11.248 1.00 0.48 H new ATOM 0 HD2 LYS A 48 12.823 -7.061 -11.532 1.00 0.94 H new ATOM 0 HD3 LYS A 48 14.263 -6.743 -10.585 1.00 0.94 H new ATOM 0 HE2 LYS A 48 14.203 -8.347 -13.180 1.00 1.10 H new ATOM 0 HE3 LYS A 48 14.672 -6.663 -13.055 1.00 1.10 H new ATOM 0 HZ1 LYS A 48 16.705 -7.488 -12.835 1.00 1.89 H new ATOM 0 HZ2 LYS A 48 16.269 -7.822 -11.228 1.00 1.89 H new ATOM 0 HZ3 LYS A 48 16.159 -9.038 -12.409 1.00 1.89 H new ATOM 795 N GLY A 49 8.919 -8.834 -9.059 1.00 0.25 N ATOM 796 CA GLY A 49 7.940 -9.101 -8.015 1.00 0.25 C ATOM 797 C GLY A 49 7.064 -7.881 -7.722 1.00 0.27 C ATOM 798 O GLY A 49 6.970 -6.966 -8.527 1.00 0.37 O ATOM 0 H GLY A 49 8.688 -8.046 -9.663 1.00 0.25 H new ATOM 0 HA2 GLY A 49 7.308 -9.937 -8.316 1.00 0.25 H new ATOM 0 HA3 GLY A 49 8.456 -9.404 -7.104 1.00 0.25 H new ATOM 802 N ALA A 50 6.386 -7.858 -6.579 1.00 0.24 N ATOM 803 CA ALA A 50 5.405 -6.844 -6.232 1.00 0.31 C ATOM 804 C ALA A 50 5.444 -6.620 -4.726 1.00 0.29 C ATOM 805 O ALA A 50 6.279 -7.189 -4.022 1.00 0.32 O ATOM 806 CB ALA A 50 4.017 -7.304 -6.702 1.00 0.39 C ATOM 0 H ALA A 50 6.509 -8.563 -5.852 1.00 0.24 H new ATOM 0 HA ALA A 50 5.631 -5.899 -6.726 1.00 0.31 H new ATOM 0 HB1 ALA A 50 3.276 -6.547 -6.444 1.00 0.39 H new ATOM 0 HB2 ALA A 50 4.028 -7.448 -7.782 1.00 0.39 H new ATOM 0 HB3 ALA A 50 3.760 -8.244 -6.213 1.00 0.39 H new ATOM 812 N PHE A 51 4.520 -5.805 -4.223 1.00 0.35 N ATOM 813 CA PHE A 51 4.461 -5.432 -2.824 1.00 0.39 C ATOM 814 C PHE A 51 3.141 -5.930 -2.269 1.00 0.33 C ATOM 815 O PHE A 51 2.085 -5.459 -2.677 1.00 0.31 O ATOM 816 CB PHE A 51 4.594 -3.906 -2.696 1.00 0.55 C ATOM 817 CG PHE A 51 6.012 -3.489 -2.380 1.00 0.53 C ATOM 818 CD1 PHE A 51 6.803 -2.753 -3.280 1.00 1.26 C ATOM 819 CD2 PHE A 51 6.562 -3.923 -1.170 1.00 2.12 C ATOM 820 CE1 PHE A 51 8.148 -2.475 -2.969 1.00 1.15 C ATOM 821 CE2 PHE A 51 7.896 -3.648 -0.857 1.00 2.77 C ATOM 822 CZ PHE A 51 8.699 -2.929 -1.757 1.00 1.80 C ATOM 0 H PHE A 51 3.784 -5.383 -4.789 1.00 0.35 H new ATOM 0 HA PHE A 51 5.278 -5.879 -2.257 1.00 0.39 H new ATOM 0 HB2 PHE A 51 4.275 -3.434 -3.626 1.00 0.55 H new ATOM 0 HB3 PHE A 51 3.927 -3.548 -1.912 1.00 0.55 H new ATOM 0 HD1 PHE A 51 6.379 -2.401 -4.209 1.00 1.26 H new ATOM 0 HD2 PHE A 51 5.951 -4.475 -0.471 1.00 2.12 H new ATOM 0 HE1 PHE A 51 8.757 -1.913 -3.662 1.00 1.15 H new ATOM 0 HE2 PHE A 51 8.311 -3.990 0.080 1.00 2.77 H new ATOM 0 HZ PHE A 51 9.733 -2.726 -1.520 1.00 1.80 H new ATOM 832 N ARG A 52 3.174 -6.902 -1.358 1.00 0.33 N ATOM 833 CA ARG A 52 1.931 -7.392 -0.785 1.00 0.29 C ATOM 834 C ARG A 52 1.595 -6.549 0.422 1.00 0.25 C ATOM 835 O ARG A 52 2.469 -6.314 1.259 1.00 0.27 O ATOM 836 CB ARG A 52 2.057 -8.850 -0.376 1.00 0.35 C ATOM 837 CG ARG A 52 0.662 -9.471 -0.335 1.00 0.57 C ATOM 838 CD ARG A 52 0.713 -10.947 0.032 1.00 0.59 C ATOM 839 NE ARG A 52 -0.640 -11.483 0.228 1.00 1.07 N ATOM 840 CZ ARG A 52 -0.920 -12.788 0.313 1.00 1.52 C ATOM 841 NH1 ARG A 52 -2.132 -13.180 0.715 1.00 2.02 N ATOM 842 NH2 ARG A 52 0.012 -13.694 0.002 1.00 1.89 N ATOM 0 H ARG A 52 4.022 -7.351 -1.012 1.00 0.33 H new ATOM 0 HA ARG A 52 1.139 -7.321 -1.531 1.00 0.29 H new ATOM 0 HB2 ARG A 52 2.689 -9.387 -1.083 1.00 0.35 H new ATOM 0 HB3 ARG A 52 2.534 -8.928 0.601 1.00 0.35 H new ATOM 0 HG2 ARG A 52 0.047 -8.937 0.390 1.00 0.57 H new ATOM 0 HG3 ARG A 52 0.183 -9.354 -1.307 1.00 0.57 H new ATOM 0 HD2 ARG A 52 1.219 -11.505 -0.756 1.00 0.59 H new ATOM 0 HD3 ARG A 52 1.297 -11.080 0.943 1.00 0.59 H new ATOM 0 HE ARG A 52 -1.412 -10.821 0.304 1.00 1.07 H new ATOM 0 HH11 ARG A 52 -2.839 -12.485 0.955 1.00 2.02 H new ATOM 0 HH12 ARG A 52 -2.350 -14.174 0.781 1.00 2.02 H new ATOM 0 HH21 ARG A 52 0.938 -13.390 -0.300 1.00 1.89 H new ATOM 0 HH22 ARG A 52 -0.202 -14.689 0.067 1.00 1.89 H new ATOM 856 N ILE A 53 0.337 -6.137 0.540 1.00 0.20 N ATOM 857 CA ILE A 53 -0.096 -5.310 1.643 1.00 0.18 C ATOM 858 C ILE A 53 -1.438 -5.813 2.159 1.00 0.17 C ATOM 859 O ILE A 53 -2.214 -6.437 1.433 1.00 0.29 O ATOM 860 CB ILE A 53 -0.097 -3.822 1.236 1.00 0.16 C ATOM 861 CG1 ILE A 53 -1.145 -3.437 0.180 1.00 0.17 C ATOM 862 CG2 ILE A 53 1.285 -3.440 0.684 1.00 0.18 C ATOM 863 CD1 ILE A 53 -1.450 -1.940 0.276 1.00 0.19 C ATOM 0 H ILE A 53 -0.401 -6.369 -0.125 1.00 0.20 H new ATOM 0 HA ILE A 53 0.606 -5.385 2.473 1.00 0.18 H new ATOM 0 HB ILE A 53 -0.351 -3.280 2.147 1.00 0.16 H new ATOM 0 HG12 ILE A 53 -0.777 -3.679 -0.817 1.00 0.17 H new ATOM 0 HG13 ILE A 53 -2.057 -4.014 0.332 1.00 0.17 H new ATOM 0 HG21 ILE A 53 1.284 -2.389 0.396 1.00 0.18 H new ATOM 0 HG22 ILE A 53 2.042 -3.606 1.451 1.00 0.18 H new ATOM 0 HG23 ILE A 53 1.511 -4.054 -0.188 1.00 0.18 H new ATOM 0 HD11 ILE A 53 -2.193 -1.671 -0.474 1.00 0.19 H new ATOM 0 HD12 ILE A 53 -1.837 -1.710 1.269 1.00 0.19 H new ATOM 0 HD13 ILE A 53 -0.537 -1.371 0.102 1.00 0.19 H new ATOM 875 N GLU A 54 -1.697 -5.546 3.434 1.00 0.17 N ATOM 876 CA GLU A 54 -2.938 -5.878 4.102 1.00 0.15 C ATOM 877 C GLU A 54 -3.450 -4.564 4.669 1.00 0.18 C ATOM 878 O GLU A 54 -2.666 -3.809 5.250 1.00 0.26 O ATOM 879 CB GLU A 54 -2.637 -6.906 5.194 1.00 0.20 C ATOM 880 CG GLU A 54 -3.874 -7.279 6.021 1.00 0.37 C ATOM 881 CD GLU A 54 -3.474 -8.088 7.253 1.00 0.72 C ATOM 882 OE1 GLU A 54 -2.490 -8.858 7.144 1.00 0.87 O ATOM 883 OE2 GLU A 54 -4.099 -7.877 8.312 1.00 1.83 O ATOM 0 H GLU A 54 -1.026 -5.079 4.044 1.00 0.17 H new ATOM 0 HA GLU A 54 -3.689 -6.320 3.447 1.00 0.15 H new ATOM 0 HB2 GLU A 54 -2.228 -7.806 4.735 1.00 0.20 H new ATOM 0 HB3 GLU A 54 -1.869 -6.509 5.858 1.00 0.20 H new ATOM 0 HG2 GLU A 54 -4.399 -6.374 6.328 1.00 0.37 H new ATOM 0 HG3 GLU A 54 -4.566 -7.857 5.409 1.00 0.37 H new ATOM 890 N ILE A 55 -4.737 -4.273 4.470 1.00 0.17 N ATOM 891 CA ILE A 55 -5.343 -3.020 4.882 1.00 0.19 C ATOM 892 C ILE A 55 -6.436 -3.365 5.883 1.00 0.20 C ATOM 893 O ILE A 55 -7.403 -4.048 5.554 1.00 0.37 O ATOM 894 CB ILE A 55 -5.927 -2.236 3.688 1.00 0.21 C ATOM 895 CG1 ILE A 55 -5.084 -2.312 2.397 1.00 0.25 C ATOM 896 CG2 ILE A 55 -6.088 -0.768 4.096 1.00 0.37 C ATOM 897 CD1 ILE A 55 -5.620 -3.359 1.418 1.00 0.67 C ATOM 0 H ILE A 55 -5.388 -4.911 4.013 1.00 0.17 H new ATOM 0 HA ILE A 55 -4.587 -2.373 5.327 1.00 0.19 H new ATOM 0 HB ILE A 55 -6.883 -2.703 3.450 1.00 0.21 H new ATOM 0 HG12 ILE A 55 -5.075 -1.335 1.913 1.00 0.25 H new ATOM 0 HG13 ILE A 55 -4.052 -2.551 2.653 1.00 0.25 H new ATOM 0 HG21 ILE A 55 -6.500 -0.201 3.261 1.00 0.37 H new ATOM 0 HG22 ILE A 55 -6.763 -0.699 4.949 1.00 0.37 H new ATOM 0 HG23 ILE A 55 -5.116 -0.357 4.368 1.00 0.37 H new ATOM 0 HD11 ILE A 55 -4.995 -3.376 0.525 1.00 0.67 H new ATOM 0 HD12 ILE A 55 -5.604 -4.341 1.891 1.00 0.67 H new ATOM 0 HD13 ILE A 55 -6.643 -3.107 1.140 1.00 0.67 H new ATOM 909 N ASN A 56 -6.285 -2.914 7.120 1.00 0.31 N ATOM 910 CA ASN A 56 -7.217 -3.233 8.177 1.00 0.29 C ATOM 911 C ASN A 56 -8.253 -2.116 8.234 1.00 0.28 C ATOM 912 O ASN A 56 -7.956 -1.028 8.731 1.00 0.28 O ATOM 913 CB ASN A 56 -6.454 -3.365 9.505 1.00 0.34 C ATOM 914 CG ASN A 56 -5.261 -4.308 9.391 1.00 0.38 C ATOM 915 OD1 ASN A 56 -4.115 -3.876 9.471 1.00 1.24 O ATOM 916 ND2 ASN A 56 -5.521 -5.589 9.171 1.00 0.92 N ATOM 0 H ASN A 56 -5.511 -2.317 7.413 1.00 0.31 H new ATOM 0 HA ASN A 56 -7.722 -4.181 7.992 1.00 0.29 H new ATOM 0 HB2 ASN A 56 -6.109 -2.381 9.823 1.00 0.34 H new ATOM 0 HB3 ASN A 56 -7.131 -3.730 10.277 1.00 0.34 H new ATOM 0 HD21 ASN A 56 -4.755 -6.253 9.062 1.00 0.92 H new ATOM 0 HD22 ASN A 56 -6.487 -5.910 9.111 1.00 0.92 H new ATOM 923 N PHE A 57 -9.460 -2.385 7.731 1.00 0.31 N ATOM 924 CA PHE A 57 -10.568 -1.436 7.711 1.00 0.28 C ATOM 925 C PHE A 57 -11.650 -1.939 8.672 1.00 0.28 C ATOM 926 O PHE A 57 -12.569 -2.635 8.255 1.00 0.35 O ATOM 927 CB PHE A 57 -11.101 -1.287 6.272 1.00 0.32 C ATOM 928 CG PHE A 57 -10.731 -0.008 5.549 1.00 0.51 C ATOM 929 CD1 PHE A 57 -11.675 1.028 5.424 1.00 1.44 C ATOM 930 CD2 PHE A 57 -9.480 0.116 4.925 1.00 2.28 C ATOM 931 CE1 PHE A 57 -11.391 2.164 4.644 1.00 1.27 C ATOM 932 CE2 PHE A 57 -9.183 1.265 4.168 1.00 2.62 C ATOM 933 CZ PHE A 57 -10.145 2.277 4.006 1.00 1.25 C ATOM 0 H PHE A 57 -9.696 -3.288 7.319 1.00 0.31 H new ATOM 0 HA PHE A 57 -10.241 -0.449 8.038 1.00 0.28 H new ATOM 0 HB2 PHE A 57 -10.738 -2.130 5.684 1.00 0.32 H new ATOM 0 HB3 PHE A 57 -12.188 -1.362 6.300 1.00 0.32 H new ATOM 0 HD1 PHE A 57 -12.625 0.950 5.931 1.00 1.44 H new ATOM 0 HD2 PHE A 57 -8.746 -0.670 5.026 1.00 2.28 H new ATOM 0 HE1 PHE A 57 -12.128 2.946 4.536 1.00 1.27 H new ATOM 0 HE2 PHE A 57 -8.211 1.370 3.709 1.00 2.62 H new ATOM 0 HZ PHE A 57 -9.927 3.139 3.393 1.00 1.25 H new ATOM 943 N PRO A 58 -11.564 -1.630 9.973 1.00 0.28 N ATOM 944 CA PRO A 58 -12.505 -2.156 10.949 1.00 0.32 C ATOM 945 C PRO A 58 -13.901 -1.569 10.739 1.00 0.29 C ATOM 946 O PRO A 58 -14.101 -0.655 9.939 1.00 0.26 O ATOM 947 CB PRO A 58 -11.916 -1.782 12.313 1.00 0.37 C ATOM 948 CG PRO A 58 -11.101 -0.525 12.014 1.00 0.34 C ATOM 949 CD PRO A 58 -10.562 -0.794 10.610 1.00 0.29 C ATOM 0 HA PRO A 58 -12.634 -3.235 10.860 1.00 0.32 H new ATOM 0 HB2 PRO A 58 -12.697 -1.589 13.049 1.00 0.37 H new ATOM 0 HB3 PRO A 58 -11.291 -2.580 12.713 1.00 0.37 H new ATOM 0 HG2 PRO A 58 -11.718 0.373 12.045 1.00 0.34 H new ATOM 0 HG3 PRO A 58 -10.296 -0.384 12.736 1.00 0.34 H new ATOM 0 HD2 PRO A 58 -10.416 0.135 10.059 1.00 0.29 H new ATOM 0 HD3 PRO A 58 -9.596 -1.297 10.648 1.00 0.29 H new ATOM 957 N ALA A 59 -14.882 -2.061 11.503 1.00 0.31 N ATOM 958 CA ALA A 59 -16.230 -1.509 11.473 1.00 0.30 C ATOM 959 C ALA A 59 -16.198 -0.016 11.776 1.00 0.26 C ATOM 960 O ALA A 59 -16.962 0.759 11.211 1.00 0.27 O ATOM 961 CB ALA A 59 -17.123 -2.229 12.476 1.00 0.34 C ATOM 0 H ALA A 59 -14.762 -2.841 12.149 1.00 0.31 H new ATOM 0 HA ALA A 59 -16.640 -1.655 10.474 1.00 0.30 H new ATOM 0 HB1 ALA A 59 -18.126 -1.804 12.441 1.00 0.34 H new ATOM 0 HB2 ALA A 59 -17.169 -3.289 12.227 1.00 0.34 H new ATOM 0 HB3 ALA A 59 -16.714 -2.109 13.479 1.00 0.34 H new ATOM 967 N GLU A 60 -15.274 0.375 12.651 1.00 0.24 N ATOM 968 CA GLU A 60 -15.022 1.745 13.045 1.00 0.21 C ATOM 969 C GLU A 60 -14.233 2.519 11.985 1.00 0.26 C ATOM 970 O GLU A 60 -13.609 3.517 12.316 1.00 0.33 O ATOM 971 CB GLU A 60 -14.241 1.722 14.363 1.00 0.29 C ATOM 972 CG GLU A 60 -15.028 1.007 15.461 1.00 0.44 C ATOM 973 CD GLU A 60 -14.255 1.089 16.773 1.00 0.63 C ATOM 974 OE1 GLU A 60 -13.275 0.320 16.893 1.00 1.67 O ATOM 975 OE2 GLU A 60 -14.632 1.937 17.611 1.00 1.79 O ATOM 0 H GLU A 60 -14.658 -0.289 13.121 1.00 0.24 H new ATOM 0 HA GLU A 60 -15.977 2.257 13.162 1.00 0.21 H new ATOM 0 HB2 GLU A 60 -13.285 1.221 14.213 1.00 0.29 H new ATOM 0 HB3 GLU A 60 -14.021 2.743 14.676 1.00 0.29 H new ATOM 0 HG2 GLU A 60 -16.011 1.464 15.576 1.00 0.44 H new ATOM 0 HG3 GLU A 60 -15.191 -0.035 15.187 1.00 0.44 H new ATOM 982 N TYR A 61 -14.270 2.128 10.709 1.00 0.29 N ATOM 983 CA TYR A 61 -13.666 2.913 9.631 1.00 0.38 C ATOM 984 C TYR A 61 -14.116 4.384 9.649 1.00 0.37 C ATOM 985 O TYR A 61 -13.274 5.277 9.570 1.00 0.37 O ATOM 986 CB TYR A 61 -13.875 2.217 8.272 1.00 0.52 C ATOM 987 CG TYR A 61 -14.384 3.079 7.126 1.00 0.55 C ATOM 988 CD1 TYR A 61 -15.649 2.825 6.569 1.00 1.55 C ATOM 989 CD2 TYR A 61 -13.612 4.148 6.629 1.00 1.90 C ATOM 990 CE1 TYR A 61 -16.157 3.630 5.540 1.00 1.57 C ATOM 991 CE2 TYR A 61 -14.122 4.972 5.608 1.00 1.92 C ATOM 992 CZ TYR A 61 -15.402 4.719 5.057 1.00 0.67 C ATOM 993 OH TYR A 61 -15.927 5.513 4.080 1.00 0.75 O ATOM 0 H TYR A 61 -14.716 1.266 10.396 1.00 0.29 H new ATOM 0 HA TYR A 61 -12.590 2.954 9.802 1.00 0.38 H new ATOM 0 HB2 TYR A 61 -12.926 1.775 7.968 1.00 0.52 H new ATOM 0 HB3 TYR A 61 -14.577 1.396 8.416 1.00 0.52 H new ATOM 0 HD1 TYR A 61 -16.238 1.998 6.939 1.00 1.55 H new ATOM 0 HD2 TYR A 61 -12.628 4.335 7.032 1.00 1.90 H new ATOM 0 HE1 TYR A 61 -17.127 3.416 5.117 1.00 1.57 H new ATOM 0 HE2 TYR A 61 -13.534 5.801 5.243 1.00 1.92 H new ATOM 0 HH TYR A 61 -15.200 5.917 3.561 1.00 0.75 H new ATOM 1003 N PRO A 62 -15.416 4.702 9.756 1.00 0.37 N ATOM 1004 CA PRO A 62 -15.827 6.094 9.794 1.00 0.40 C ATOM 1005 C PRO A 62 -15.513 6.740 11.151 1.00 0.38 C ATOM 1006 O PRO A 62 -15.637 7.951 11.288 1.00 0.44 O ATOM 1007 CB PRO A 62 -17.321 6.076 9.469 1.00 0.44 C ATOM 1008 CG PRO A 62 -17.791 4.719 9.990 1.00 0.42 C ATOM 1009 CD PRO A 62 -16.565 3.815 9.852 1.00 0.39 C ATOM 0 HA PRO A 62 -15.282 6.706 9.076 1.00 0.40 H new ATOM 0 HB2 PRO A 62 -17.847 6.896 9.958 1.00 0.44 H new ATOM 0 HB3 PRO A 62 -17.499 6.177 8.398 1.00 0.44 H new ATOM 0 HG2 PRO A 62 -18.122 4.784 11.026 1.00 0.42 H new ATOM 0 HG3 PRO A 62 -18.632 4.340 9.410 1.00 0.42 H new ATOM 0 HD2 PRO A 62 -16.473 3.150 10.711 1.00 0.39 H new ATOM 0 HD3 PRO A 62 -16.644 3.184 8.967 1.00 0.39 H new ATOM 1017 N PHE A 63 -15.101 5.957 12.153 1.00 0.33 N ATOM 1018 CA PHE A 63 -14.749 6.425 13.488 1.00 0.31 C ATOM 1019 C PHE A 63 -13.250 6.677 13.649 1.00 0.33 C ATOM 1020 O PHE A 63 -12.861 7.475 14.497 1.00 0.38 O ATOM 1021 CB PHE A 63 -15.199 5.393 14.533 1.00 0.31 C ATOM 1022 CG PHE A 63 -16.332 5.862 15.417 1.00 0.40 C ATOM 1023 CD1 PHE A 63 -17.562 5.179 15.431 1.00 1.69 C ATOM 1024 CD2 PHE A 63 -16.138 6.977 16.253 1.00 1.97 C ATOM 1025 CE1 PHE A 63 -18.596 5.613 16.280 1.00 1.67 C ATOM 1026 CE2 PHE A 63 -17.172 7.412 17.098 1.00 2.13 C ATOM 1027 CZ PHE A 63 -18.401 6.729 17.112 1.00 0.88 C ATOM 0 H PHE A 63 -15.002 4.947 12.049 1.00 0.33 H new ATOM 0 HA PHE A 63 -15.261 7.375 13.637 1.00 0.31 H new ATOM 0 HB2 PHE A 63 -15.507 4.482 14.019 1.00 0.31 H new ATOM 0 HB3 PHE A 63 -14.347 5.132 15.161 1.00 0.31 H new ATOM 0 HD1 PHE A 63 -17.712 4.322 14.791 1.00 1.69 H new ATOM 0 HD2 PHE A 63 -15.193 7.499 16.245 1.00 1.97 H new ATOM 0 HE1 PHE A 63 -19.540 5.089 16.293 1.00 1.67 H new ATOM 0 HE2 PHE A 63 -17.023 8.270 17.736 1.00 2.13 H new ATOM 0 HZ PHE A 63 -19.196 7.062 17.763 1.00 0.88 H new ATOM 1037 N LYS A 64 -12.396 5.978 12.900 1.00 0.31 N ATOM 1038 CA LYS A 64 -10.954 6.123 13.008 1.00 0.30 C ATOM 1039 C LYS A 64 -10.323 5.646 11.709 1.00 0.30 C ATOM 1040 O LYS A 64 -10.872 4.760 11.057 1.00 0.35 O ATOM 1041 CB LYS A 64 -10.410 5.312 14.196 1.00 0.33 C ATOM 1042 CG LYS A 64 -10.803 3.825 14.166 1.00 1.29 C ATOM 1043 CD LYS A 64 -9.921 2.997 15.108 1.00 1.69 C ATOM 1044 CE LYS A 64 -8.487 2.833 14.582 1.00 2.94 C ATOM 1045 NZ LYS A 64 -8.436 2.061 13.323 1.00 4.47 N ATOM 0 H LYS A 64 -12.691 5.296 12.202 1.00 0.31 H new ATOM 0 HA LYS A 64 -10.705 7.170 13.182 1.00 0.30 H new ATOM 0 HB2 LYS A 64 -9.323 5.390 14.210 1.00 0.33 H new ATOM 0 HB3 LYS A 64 -10.773 5.755 15.123 1.00 0.33 H new ATOM 0 HG2 LYS A 64 -11.849 3.717 14.455 1.00 1.29 H new ATOM 0 HG3 LYS A 64 -10.712 3.443 13.149 1.00 1.29 H new ATOM 0 HD2 LYS A 64 -9.893 3.475 16.087 1.00 1.69 H new ATOM 0 HD3 LYS A 64 -10.368 2.013 15.247 1.00 1.69 H new ATOM 0 HE2 LYS A 64 -8.047 3.817 14.420 1.00 2.94 H new ATOM 0 HE3 LYS A 64 -7.880 2.333 15.337 1.00 2.94 H new ATOM 0 HZ1 LYS A 64 -7.738 1.295 13.413 1.00 4.47 H new ATOM 0 HZ2 LYS A 64 -9.373 1.654 13.127 1.00 4.47 H new ATOM 0 HZ3 LYS A 64 -8.161 2.690 12.541 1.00 4.47 H new ATOM 1059 N PRO A 65 -9.151 6.162 11.330 1.00 0.30 N ATOM 1060 CA PRO A 65 -8.527 5.723 10.105 1.00 0.31 C ATOM 1061 C PRO A 65 -8.140 4.239 10.196 1.00 0.25 C ATOM 1062 O PRO A 65 -7.880 3.715 11.284 1.00 0.27 O ATOM 1063 CB PRO A 65 -7.321 6.639 9.901 1.00 0.38 C ATOM 1064 CG PRO A 65 -6.997 7.143 11.308 1.00 0.34 C ATOM 1065 CD PRO A 65 -8.357 7.169 12.006 1.00 0.27 C ATOM 0 HA PRO A 65 -9.199 5.792 9.250 1.00 0.31 H new ATOM 0 HB2 PRO A 65 -6.479 6.100 9.466 1.00 0.38 H new ATOM 0 HB3 PRO A 65 -7.555 7.462 9.226 1.00 0.38 H new ATOM 0 HG2 PRO A 65 -6.297 6.482 11.819 1.00 0.34 H new ATOM 0 HG3 PRO A 65 -6.540 8.132 11.284 1.00 0.34 H new ATOM 0 HD2 PRO A 65 -8.259 6.945 13.068 1.00 0.27 H new ATOM 0 HD3 PRO A 65 -8.820 8.153 11.929 1.00 0.27 H new ATOM 1073 N PRO A 66 -8.109 3.553 9.051 1.00 0.22 N ATOM 1074 CA PRO A 66 -7.583 2.207 8.919 1.00 0.22 C ATOM 1075 C PRO A 66 -6.072 2.216 9.132 1.00 0.22 C ATOM 1076 O PRO A 66 -5.439 3.268 9.215 1.00 0.27 O ATOM 1077 CB PRO A 66 -7.977 1.748 7.517 1.00 0.28 C ATOM 1078 CG PRO A 66 -8.267 3.024 6.738 1.00 0.34 C ATOM 1079 CD PRO A 66 -8.441 4.129 7.767 1.00 0.30 C ATOM 0 HA PRO A 66 -7.984 1.521 9.665 1.00 0.22 H new ATOM 0 HB2 PRO A 66 -7.174 1.177 7.051 1.00 0.28 H new ATOM 0 HB3 PRO A 66 -8.852 1.099 7.548 1.00 0.28 H new ATOM 0 HG2 PRO A 66 -7.450 3.255 6.055 1.00 0.34 H new ATOM 0 HG3 PRO A 66 -9.167 2.913 6.133 1.00 0.34 H new ATOM 0 HD2 PRO A 66 -7.791 4.974 7.542 1.00 0.30 H new ATOM 0 HD3 PRO A 66 -9.464 4.504 7.763 1.00 0.30 H new ATOM 1087 N LYS A 67 -5.479 1.027 9.199 1.00 0.24 N ATOM 1088 CA LYS A 67 -4.034 0.864 9.267 1.00 0.23 C ATOM 1089 C LYS A 67 -3.646 -0.008 8.088 1.00 0.21 C ATOM 1090 O LYS A 67 -4.496 -0.693 7.525 1.00 0.35 O ATOM 1091 CB LYS A 67 -3.626 0.230 10.610 1.00 0.34 C ATOM 1092 CG LYS A 67 -2.787 1.173 11.487 1.00 0.92 C ATOM 1093 CD LYS A 67 -1.325 1.262 11.017 1.00 0.92 C ATOM 1094 CE LYS A 67 -0.455 2.020 12.033 1.00 1.65 C ATOM 1095 NZ LYS A 67 -0.103 3.391 11.591 1.00 2.84 N ATOM 0 H LYS A 67 -5.993 0.146 9.208 1.00 0.24 H new ATOM 0 HA LYS A 67 -3.517 1.822 9.214 1.00 0.23 H new ATOM 0 HB2 LYS A 67 -4.523 -0.062 11.155 1.00 0.34 H new ATOM 0 HB3 LYS A 67 -3.058 -0.681 10.418 1.00 0.34 H new ATOM 0 HG2 LYS A 67 -3.231 2.168 11.475 1.00 0.92 H new ATOM 0 HG3 LYS A 67 -2.814 0.825 12.520 1.00 0.92 H new ATOM 0 HD2 LYS A 67 -0.926 0.258 10.871 1.00 0.92 H new ATOM 0 HD3 LYS A 67 -1.282 1.765 10.051 1.00 0.92 H new ATOM 0 HE2 LYS A 67 -0.984 2.076 12.984 1.00 1.65 H new ATOM 0 HE3 LYS A 67 0.461 1.456 12.210 1.00 1.65 H new ATOM 0 HZ1 LYS A 67 0.525 3.832 12.293 1.00 2.84 H new ATOM 0 HZ2 LYS A 67 0.383 3.346 10.672 1.00 2.84 H new ATOM 0 HZ3 LYS A 67 -0.969 3.959 11.497 1.00 2.84 H new ATOM 1109 N ILE A 68 -2.376 0.016 7.704 1.00 0.18 N ATOM 1110 CA ILE A 68 -1.877 -0.856 6.655 1.00 0.15 C ATOM 1111 C ILE A 68 -0.547 -1.402 7.131 1.00 0.16 C ATOM 1112 O ILE A 68 0.220 -0.673 7.769 1.00 0.25 O ATOM 1113 CB ILE A 68 -1.712 -0.100 5.326 1.00 0.13 C ATOM 1114 CG1 ILE A 68 -2.745 1.030 5.188 1.00 0.17 C ATOM 1115 CG2 ILE A 68 -1.796 -1.075 4.149 1.00 0.17 C ATOM 1116 CD1 ILE A 68 -2.551 1.781 3.886 1.00 0.26 C ATOM 0 H ILE A 68 -1.672 0.634 8.107 1.00 0.18 H new ATOM 0 HA ILE A 68 -2.585 -1.663 6.465 1.00 0.15 H new ATOM 0 HB ILE A 68 -0.726 0.365 5.320 1.00 0.13 H new ATOM 0 HG12 ILE A 68 -3.752 0.615 5.227 1.00 0.17 H new ATOM 0 HG13 ILE A 68 -2.652 1.719 6.028 1.00 0.17 H new ATOM 0 HG21 ILE A 68 -1.678 -0.528 3.214 1.00 0.17 H new ATOM 0 HG22 ILE A 68 -1.005 -1.820 4.236 1.00 0.17 H new ATOM 0 HG23 ILE A 68 -2.765 -1.573 4.158 1.00 0.17 H new ATOM 0 HD11 ILE A 68 -3.293 2.576 3.810 1.00 0.26 H new ATOM 0 HD12 ILE A 68 -1.551 2.215 3.862 1.00 0.26 H new ATOM 0 HD13 ILE A 68 -2.669 1.094 3.048 1.00 0.26 H new ATOM 1128 N THR A 69 -0.278 -2.664 6.804 1.00 0.14 N ATOM 1129 CA THR A 69 0.990 -3.281 7.126 1.00 0.18 C ATOM 1130 C THR A 69 1.417 -4.126 5.929 1.00 0.16 C ATOM 1131 O THR A 69 0.720 -5.066 5.540 1.00 0.23 O ATOM 1132 CB THR A 69 0.857 -4.119 8.407 1.00 0.23 C ATOM 1133 OG1 THR A 69 0.046 -3.477 9.372 1.00 0.26 O ATOM 1134 CG2 THR A 69 2.229 -4.345 9.035 1.00 0.31 C ATOM 0 H THR A 69 -0.931 -3.276 6.314 1.00 0.14 H new ATOM 0 HA THR A 69 1.755 -2.529 7.320 1.00 0.18 H new ATOM 0 HB THR A 69 0.399 -5.065 8.118 1.00 0.23 H new ATOM 0 HG1 THR A 69 -0.017 -4.039 10.172 1.00 0.26 H new ATOM 0 HG21 THR A 69 2.121 -4.940 9.942 1.00 0.31 H new ATOM 0 HG22 THR A 69 2.870 -4.873 8.329 1.00 0.31 H new ATOM 0 HG23 THR A 69 2.678 -3.383 9.284 1.00 0.31 H new ATOM 1142 N PHE A 70 2.545 -3.771 5.318 1.00 0.13 N ATOM 1143 CA PHE A 70 3.110 -4.529 4.218 1.00 0.14 C ATOM 1144 C PHE A 70 3.560 -5.883 4.750 1.00 0.18 C ATOM 1145 O PHE A 70 4.174 -5.970 5.810 1.00 0.24 O ATOM 1146 CB PHE A 70 4.292 -3.775 3.593 1.00 0.16 C ATOM 1147 CG PHE A 70 3.928 -2.602 2.692 1.00 0.17 C ATOM 1148 CD1 PHE A 70 3.031 -1.594 3.100 1.00 0.16 C ATOM 1149 CD2 PHE A 70 4.506 -2.521 1.412 1.00 0.21 C ATOM 1150 CE1 PHE A 70 2.735 -0.523 2.241 1.00 0.18 C ATOM 1151 CE2 PHE A 70 4.239 -1.435 0.564 1.00 0.23 C ATOM 1152 CZ PHE A 70 3.361 -0.424 0.988 1.00 0.21 C ATOM 0 H PHE A 70 3.089 -2.948 5.576 1.00 0.13 H new ATOM 0 HA PHE A 70 2.359 -4.667 3.440 1.00 0.14 H new ATOM 0 HB2 PHE A 70 4.930 -3.407 4.397 1.00 0.16 H new ATOM 0 HB3 PHE A 70 4.885 -4.483 3.014 1.00 0.16 H new ATOM 0 HD1 PHE A 70 2.570 -1.645 4.075 1.00 0.16 H new ATOM 0 HD2 PHE A 70 5.166 -3.307 1.076 1.00 0.21 H new ATOM 0 HE1 PHE A 70 2.022 0.229 2.546 1.00 0.18 H new ATOM 0 HE2 PHE A 70 4.706 -1.377 -0.408 1.00 0.23 H new ATOM 0 HZ PHE A 70 3.168 0.427 0.352 1.00 0.21 H new ATOM 1162 N LYS A 71 3.247 -6.952 4.019 1.00 0.26 N ATOM 1163 CA LYS A 71 3.749 -8.281 4.330 1.00 0.33 C ATOM 1164 C LYS A 71 5.187 -8.399 3.830 1.00 0.35 C ATOM 1165 O LYS A 71 6.020 -9.029 4.474 1.00 0.40 O ATOM 1166 CB LYS A 71 2.882 -9.358 3.664 1.00 0.41 C ATOM 1167 CG LYS A 71 1.362 -9.169 3.794 1.00 0.60 C ATOM 1168 CD LYS A 71 0.826 -9.377 5.214 1.00 0.62 C ATOM 1169 CE LYS A 71 0.956 -8.112 6.068 1.00 0.88 C ATOM 1170 NZ LYS A 71 0.277 -8.277 7.368 1.00 1.29 N ATOM 0 H LYS A 71 2.641 -6.917 3.199 1.00 0.26 H new ATOM 0 HA LYS A 71 3.714 -8.430 5.409 1.00 0.33 H new ATOM 0 HB2 LYS A 71 3.135 -9.397 2.604 1.00 0.41 H new ATOM 0 HB3 LYS A 71 3.146 -10.326 4.091 1.00 0.41 H new ATOM 0 HG2 LYS A 71 1.102 -8.164 3.462 1.00 0.60 H new ATOM 0 HG3 LYS A 71 0.861 -9.866 3.122 1.00 0.60 H new ATOM 0 HD2 LYS A 71 -0.221 -9.676 5.166 1.00 0.62 H new ATOM 0 HD3 LYS A 71 1.369 -10.193 5.690 1.00 0.62 H new ATOM 0 HE2 LYS A 71 2.010 -7.886 6.231 1.00 0.88 H new ATOM 0 HE3 LYS A 71 0.527 -7.264 5.535 1.00 0.88 H new ATOM 0 HZ1 LYS A 71 0.366 -7.400 7.920 1.00 1.29 H new ATOM 0 HZ2 LYS A 71 -0.729 -8.486 7.210 1.00 1.29 H new ATOM 0 HZ3 LYS A 71 0.716 -9.061 7.892 1.00 1.29 H new ATOM 1184 N THR A 72 5.472 -7.842 2.652 1.00 0.35 N ATOM 1185 CA THR A 72 6.763 -8.023 2.015 1.00 0.38 C ATOM 1186 C THR A 72 7.679 -6.859 2.384 1.00 0.51 C ATOM 1187 O THR A 72 7.249 -5.707 2.331 1.00 0.89 O ATOM 1188 CB THR A 72 6.573 -8.098 0.499 1.00 0.34 C ATOM 1189 OG1 THR A 72 5.850 -6.962 0.068 1.00 0.36 O ATOM 1190 CG2 THR A 72 5.759 -9.334 0.097 1.00 0.30 C ATOM 0 H THR A 72 4.820 -7.262 2.124 1.00 0.35 H new ATOM 0 HA THR A 72 7.221 -8.951 2.358 1.00 0.38 H new ATOM 0 HB THR A 72 7.561 -8.148 0.042 1.00 0.34 H new ATOM 0 HG1 THR A 72 6.097 -6.189 0.618 1.00 0.36 H new ATOM 0 HG21 THR A 72 5.643 -9.356 -0.987 1.00 0.30 H new ATOM 0 HG22 THR A 72 6.279 -10.234 0.425 1.00 0.30 H new ATOM 0 HG23 THR A 72 4.776 -9.291 0.567 1.00 0.30 H new ATOM 1198 N LYS A 73 8.937 -7.167 2.705 1.00 0.31 N ATOM 1199 CA LYS A 73 9.980 -6.228 3.113 1.00 0.29 C ATOM 1200 C LYS A 73 10.012 -4.975 2.241 1.00 0.39 C ATOM 1201 O LYS A 73 10.109 -5.081 1.021 1.00 0.83 O ATOM 1202 CB LYS A 73 11.330 -6.955 3.035 1.00 0.34 C ATOM 1203 CG LYS A 73 12.010 -7.086 4.390 1.00 0.75 C ATOM 1204 CD LYS A 73 11.132 -7.864 5.378 1.00 0.43 C ATOM 1205 CE LYS A 73 12.008 -8.782 6.231 1.00 0.65 C ATOM 1206 NZ LYS A 73 11.198 -9.612 7.146 1.00 1.52 N ATOM 0 H LYS A 73 9.272 -8.130 2.686 1.00 0.31 H new ATOM 0 HA LYS A 73 9.770 -5.895 4.129 1.00 0.29 H new ATOM 0 HB2 LYS A 73 11.178 -7.948 2.612 1.00 0.34 H new ATOM 0 HB3 LYS A 73 11.989 -6.416 2.354 1.00 0.34 H new ATOM 0 HG2 LYS A 73 12.967 -7.594 4.272 1.00 0.75 H new ATOM 0 HG3 LYS A 73 12.222 -6.095 4.791 1.00 0.75 H new ATOM 0 HD2 LYS A 73 10.584 -7.171 6.017 1.00 0.43 H new ATOM 0 HD3 LYS A 73 10.391 -8.452 4.836 1.00 0.43 H new ATOM 0 HE2 LYS A 73 12.600 -9.427 5.582 1.00 0.65 H new ATOM 0 HE3 LYS A 73 12.710 -8.181 6.809 1.00 0.65 H new ATOM 0 HZ1 LYS A 73 11.713 -9.747 8.040 1.00 1.52 H new ATOM 0 HZ2 LYS A 73 10.293 -9.137 7.336 1.00 1.52 H new ATOM 0 HZ3 LYS A 73 11.018 -10.538 6.707 1.00 1.52 H new ATOM 1220 N ILE A 74 9.998 -3.794 2.863 1.00 0.23 N ATOM 1221 CA ILE A 74 9.910 -2.516 2.167 1.00 0.26 C ATOM 1222 C ILE A 74 11.254 -1.802 2.214 1.00 0.27 C ATOM 1223 O ILE A 74 11.911 -1.798 3.250 1.00 0.48 O ATOM 1224 CB ILE A 74 8.801 -1.641 2.787 1.00 0.32 C ATOM 1225 CG1 ILE A 74 9.073 -1.215 4.241 1.00 0.32 C ATOM 1226 CG2 ILE A 74 7.472 -2.398 2.742 1.00 0.41 C ATOM 1227 CD1 ILE A 74 9.760 0.150 4.358 1.00 0.38 C ATOM 0 H ILE A 74 10.048 -3.701 3.878 1.00 0.23 H new ATOM 0 HA ILE A 74 9.653 -2.699 1.124 1.00 0.26 H new ATOM 0 HB ILE A 74 8.770 -0.729 2.191 1.00 0.32 H new ATOM 0 HG12 ILE A 74 8.129 -1.186 4.786 1.00 0.32 H new ATOM 0 HG13 ILE A 74 9.696 -1.969 4.722 1.00 0.32 H new ATOM 0 HG21 ILE A 74 6.687 -1.781 3.180 1.00 0.41 H new ATOM 0 HG22 ILE A 74 7.219 -2.627 1.707 1.00 0.41 H new ATOM 0 HG23 ILE A 74 7.562 -3.326 3.307 1.00 0.41 H new ATOM 0 HD11 ILE A 74 9.921 0.387 5.410 1.00 0.38 H new ATOM 0 HD12 ILE A 74 10.719 0.120 3.842 1.00 0.38 H new ATOM 0 HD13 ILE A 74 9.129 0.915 3.906 1.00 0.38 H new ATOM 1239 N TYR A 75 11.631 -1.147 1.113 1.00 0.21 N ATOM 1240 CA TYR A 75 12.717 -0.169 1.113 1.00 0.26 C ATOM 1241 C TYR A 75 12.174 1.260 1.114 1.00 0.52 C ATOM 1242 O TYR A 75 12.929 2.202 1.316 1.00 1.17 O ATOM 1243 CB TYR A 75 13.644 -0.377 -0.102 1.00 0.42 C ATOM 1244 CG TYR A 75 14.950 -1.057 0.246 1.00 0.68 C ATOM 1245 CD1 TYR A 75 15.799 -0.486 1.211 1.00 1.93 C ATOM 1246 CD2 TYR A 75 15.332 -2.239 -0.406 1.00 2.22 C ATOM 1247 CE1 TYR A 75 17.002 -1.117 1.566 1.00 2.21 C ATOM 1248 CE2 TYR A 75 16.522 -2.892 -0.041 1.00 2.79 C ATOM 1249 CZ TYR A 75 17.363 -2.337 0.948 1.00 2.11 C ATOM 1250 OH TYR A 75 18.534 -2.957 1.258 1.00 2.83 O ATOM 0 H TYR A 75 11.193 -1.280 0.201 1.00 0.21 H new ATOM 0 HA TYR A 75 13.294 -0.321 2.026 1.00 0.26 H new ATOM 0 HB2 TYR A 75 13.121 -0.973 -0.850 1.00 0.42 H new ATOM 0 HB3 TYR A 75 13.857 0.591 -0.557 1.00 0.42 H new ATOM 0 HD1 TYR A 75 15.523 0.446 1.683 1.00 1.93 H new ATOM 0 HD2 TYR A 75 14.711 -2.648 -1.189 1.00 2.22 H new ATOM 0 HE1 TYR A 75 17.649 -0.673 2.308 1.00 2.21 H new ATOM 0 HE2 TYR A 75 16.794 -3.822 -0.519 1.00 2.79 H new ATOM 0 HH TYR A 75 18.614 -3.783 0.737 1.00 2.83 H new ATOM 1260 N HIS A 76 10.883 1.462 0.836 1.00 0.23 N ATOM 1261 CA HIS A 76 10.374 2.801 0.585 1.00 0.20 C ATOM 1262 C HIS A 76 10.204 3.554 1.898 1.00 0.19 C ATOM 1263 O HIS A 76 9.575 3.028 2.807 1.00 0.22 O ATOM 1264 CB HIS A 76 9.035 2.720 -0.150 1.00 0.26 C ATOM 1265 CG HIS A 76 9.192 2.353 -1.600 1.00 0.56 C ATOM 1266 ND1 HIS A 76 9.258 1.072 -2.123 1.00 0.74 N ATOM 1267 CD2 HIS A 76 9.304 3.244 -2.630 1.00 1.16 C ATOM 1268 CE1 HIS A 76 9.412 1.192 -3.456 1.00 1.20 C ATOM 1269 NE2 HIS A 76 9.431 2.500 -3.782 1.00 1.50 N ATOM 0 H HIS A 76 10.184 0.722 0.781 1.00 0.23 H new ATOM 0 HA HIS A 76 11.089 3.339 -0.037 1.00 0.20 H new ATOM 0 HB2 HIS A 76 8.400 1.983 0.341 1.00 0.26 H new ATOM 0 HB3 HIS A 76 8.525 3.681 -0.075 1.00 0.26 H new ATOM 0 HD2 HIS A 76 9.295 4.321 -2.555 1.00 1.16 H new ATOM 0 HE1 HIS A 76 9.505 0.372 -4.152 1.00 1.20 H new ATOM 0 HE2 HIS A 76 9.524 2.876 -4.725 1.00 1.50 H new ATOM 1278 N PRO A 77 10.644 4.818 1.963 1.00 0.18 N ATOM 1279 CA PRO A 77 10.610 5.626 3.176 1.00 0.17 C ATOM 1280 C PRO A 77 9.192 5.905 3.648 1.00 0.16 C ATOM 1281 O PRO A 77 8.971 6.254 4.804 1.00 0.16 O ATOM 1282 CB PRO A 77 11.298 6.934 2.791 1.00 0.18 C ATOM 1283 CG PRO A 77 11.037 7.056 1.293 1.00 0.20 C ATOM 1284 CD PRO A 77 11.137 5.602 0.842 1.00 0.21 C ATOM 0 HA PRO A 77 11.099 5.108 4.001 1.00 0.17 H new ATOM 0 HB2 PRO A 77 10.884 7.780 3.339 1.00 0.18 H new ATOM 0 HB3 PRO A 77 12.365 6.904 3.010 1.00 0.18 H new ATOM 0 HG2 PRO A 77 10.057 7.484 1.082 1.00 0.20 H new ATOM 0 HG3 PRO A 77 11.774 7.689 0.799 1.00 0.20 H new ATOM 0 HD2 PRO A 77 10.541 5.426 -0.053 1.00 0.21 H new ATOM 0 HD3 PRO A 77 12.165 5.336 0.598 1.00 0.21 H new ATOM 1292 N ASN A 78 8.223 5.820 2.739 1.00 0.17 N ATOM 1293 CA ASN A 78 6.838 6.142 3.035 1.00 0.17 C ATOM 1294 C ASN A 78 6.226 5.107 3.984 1.00 0.18 C ATOM 1295 O ASN A 78 5.165 5.353 4.556 1.00 0.26 O ATOM 1296 CB ASN A 78 6.020 6.217 1.743 1.00 0.25 C ATOM 1297 CG ASN A 78 6.802 6.756 0.551 1.00 0.92 C ATOM 1298 OD1 ASN A 78 7.139 7.931 0.473 1.00 1.16 O ATOM 1299 ND2 ASN A 78 7.100 5.878 -0.396 1.00 2.55 N ATOM 0 H ASN A 78 8.382 5.525 1.776 1.00 0.17 H new ATOM 0 HA ASN A 78 6.815 7.115 3.526 1.00 0.17 H new ATOM 0 HB2 ASN A 78 5.648 5.222 1.501 1.00 0.25 H new ATOM 0 HB3 ASN A 78 5.149 6.851 1.911 1.00 0.25 H new ATOM 0 HD21 ASN A 78 7.624 6.174 -1.219 1.00 2.55 H new ATOM 0 HD22 ASN A 78 6.805 4.906 -0.302 1.00 2.55 H new ATOM 1306 N ILE A 79 6.868 3.943 4.120 1.00 0.16 N ATOM 1307 CA ILE A 79 6.465 2.850 4.981 1.00 0.19 C ATOM 1308 C ILE A 79 7.637 2.593 5.943 1.00 0.21 C ATOM 1309 O ILE A 79 8.754 3.056 5.718 1.00 0.23 O ATOM 1310 CB ILE A 79 6.069 1.642 4.097 1.00 0.23 C ATOM 1311 CG1 ILE A 79 5.104 2.072 2.974 1.00 0.24 C ATOM 1312 CG2 ILE A 79 5.437 0.501 4.915 1.00 0.32 C ATOM 1313 CD1 ILE A 79 5.772 2.125 1.591 1.00 0.45 C ATOM 0 H ILE A 79 7.723 3.737 3.604 1.00 0.16 H new ATOM 0 HA ILE A 79 5.585 3.066 5.587 1.00 0.19 H new ATOM 0 HB ILE A 79 6.992 1.266 3.655 1.00 0.23 H new ATOM 0 HG12 ILE A 79 4.265 1.377 2.939 1.00 0.24 H new ATOM 0 HG13 ILE A 79 4.695 3.054 3.211 1.00 0.24 H new ATOM 0 HG21 ILE A 79 5.177 -0.323 4.250 1.00 0.32 H new ATOM 0 HG22 ILE A 79 6.149 0.152 5.663 1.00 0.32 H new ATOM 0 HG23 ILE A 79 4.537 0.864 5.412 1.00 0.32 H new ATOM 0 HD11 ILE A 79 5.040 2.434 0.845 1.00 0.45 H new ATOM 0 HD12 ILE A 79 6.594 2.841 1.611 1.00 0.45 H new ATOM 0 HD13 ILE A 79 6.157 1.138 1.335 1.00 0.45 H new ATOM 1325 N ASP A 80 7.372 1.905 7.045 1.00 0.28 N ATOM 1326 CA ASP A 80 8.317 1.550 8.093 1.00 0.35 C ATOM 1327 C ASP A 80 8.828 0.144 7.816 1.00 0.31 C ATOM 1328 O ASP A 80 8.175 -0.620 7.111 1.00 0.27 O ATOM 1329 CB ASP A 80 7.540 1.543 9.407 1.00 0.42 C ATOM 1330 CG ASP A 80 8.332 1.042 10.604 1.00 0.58 C ATOM 1331 OD1 ASP A 80 9.546 1.335 10.659 1.00 1.15 O ATOM 1332 OD2 ASP A 80 7.708 0.326 11.422 1.00 1.53 O ATOM 0 H ASP A 80 6.433 1.559 7.242 1.00 0.28 H new ATOM 0 HA ASP A 80 9.154 2.247 8.135 1.00 0.35 H new ATOM 0 HB2 ASP A 80 7.193 2.555 9.615 1.00 0.42 H new ATOM 0 HB3 ASP A 80 6.654 0.920 9.287 1.00 0.42 H new ATOM 1337 N GLU A 81 9.955 -0.242 8.407 1.00 0.34 N ATOM 1338 CA GLU A 81 10.508 -1.581 8.239 1.00 0.33 C ATOM 1339 C GLU A 81 9.515 -2.666 8.649 1.00 0.27 C ATOM 1340 O GLU A 81 9.448 -3.719 8.018 1.00 0.30 O ATOM 1341 CB GLU A 81 11.836 -1.711 8.992 1.00 0.38 C ATOM 1342 CG GLU A 81 12.972 -1.184 8.111 1.00 0.80 C ATOM 1343 CD GLU A 81 14.299 -1.184 8.865 1.00 1.97 C ATOM 1344 OE1 GLU A 81 14.840 -2.294 9.065 1.00 2.93 O ATOM 1345 OE2 GLU A 81 14.741 -0.075 9.239 1.00 3.24 O ATOM 0 H GLU A 81 10.509 0.363 9.014 1.00 0.34 H new ATOM 0 HA GLU A 81 10.705 -1.730 7.177 1.00 0.33 H new ATOM 0 HB2 GLU A 81 11.794 -1.150 9.925 1.00 0.38 H new ATOM 0 HB3 GLU A 81 12.018 -2.753 9.255 1.00 0.38 H new ATOM 0 HG2 GLU A 81 13.059 -1.801 7.217 1.00 0.80 H new ATOM 0 HG3 GLU A 81 12.739 -0.172 7.779 1.00 0.80 H new ATOM 1352 N LYS A 82 8.689 -2.411 9.665 1.00 0.24 N ATOM 1353 CA LYS A 82 7.639 -3.343 10.072 1.00 0.23 C ATOM 1354 C LYS A 82 6.412 -3.280 9.156 1.00 0.21 C ATOM 1355 O LYS A 82 5.330 -3.700 9.551 1.00 0.29 O ATOM 1356 CB LYS A 82 7.278 -3.040 11.535 1.00 0.28 C ATOM 1357 CG LYS A 82 7.887 -4.088 12.464 1.00 0.82 C ATOM 1358 CD LYS A 82 8.104 -3.456 13.835 1.00 1.14 C ATOM 1359 CE LYS A 82 8.335 -4.558 14.871 1.00 1.52 C ATOM 1360 NZ LYS A 82 8.592 -4.002 16.216 1.00 2.16 N ATOM 0 H LYS A 82 8.729 -1.559 10.224 1.00 0.24 H new ATOM 0 HA LYS A 82 8.009 -4.364 9.984 1.00 0.23 H new ATOM 0 HB2 LYS A 82 7.641 -2.049 11.808 1.00 0.28 H new ATOM 0 HB3 LYS A 82 6.195 -3.026 11.653 1.00 0.28 H new ATOM 0 HG2 LYS A 82 7.226 -4.951 12.546 1.00 0.82 H new ATOM 0 HG3 LYS A 82 8.833 -4.448 12.059 1.00 0.82 H new ATOM 0 HD2 LYS A 82 8.961 -2.783 13.806 1.00 1.14 H new ATOM 0 HD3 LYS A 82 7.237 -2.856 14.113 1.00 1.14 H new ATOM 0 HE2 LYS A 82 7.463 -5.211 14.908 1.00 1.52 H new ATOM 0 HE3 LYS A 82 9.181 -5.174 14.564 1.00 1.52 H new ATOM 0 HZ1 LYS A 82 8.744 -4.779 16.890 1.00 2.16 H new ATOM 0 HZ2 LYS A 82 9.439 -3.399 16.186 1.00 2.16 H new ATOM 0 HZ3 LYS A 82 7.774 -3.435 16.519 1.00 2.16 H new ATOM 1374 N GLY A 83 6.534 -2.734 7.947 1.00 0.20 N ATOM 1375 CA GLY A 83 5.433 -2.591 7.019 1.00 0.19 C ATOM 1376 C GLY A 83 4.426 -1.517 7.426 1.00 0.20 C ATOM 1377 O GLY A 83 3.516 -1.251 6.645 1.00 0.18 O ATOM 0 H GLY A 83 7.418 -2.375 7.587 1.00 0.20 H new ATOM 0 HA2 GLY A 83 5.829 -2.351 6.032 1.00 0.19 H new ATOM 0 HA3 GLY A 83 4.917 -3.547 6.931 1.00 0.19 H new ATOM 1381 N GLN A 84 4.542 -0.911 8.614 1.00 0.27 N ATOM 1382 CA GLN A 84 3.576 0.068 9.086 1.00 0.29 C ATOM 1383 C GLN A 84 3.588 1.285 8.183 1.00 0.28 C ATOM 1384 O GLN A 84 4.649 1.749 7.786 1.00 0.45 O ATOM 1385 CB GLN A 84 3.937 0.568 10.485 1.00 0.32 C ATOM 1386 CG GLN A 84 3.804 -0.488 11.575 1.00 0.44 C ATOM 1387 CD GLN A 84 4.101 0.156 12.924 1.00 0.77 C ATOM 1388 OE1 GLN A 84 3.190 0.425 13.699 1.00 1.07 O ATOM 1389 NE2 GLN A 84 5.361 0.465 13.205 1.00 1.31 N ATOM 0 H GLN A 84 5.306 -1.089 9.266 1.00 0.27 H new ATOM 0 HA GLN A 84 2.602 -0.422 9.092 1.00 0.29 H new ATOM 0 HB2 GLN A 84 4.963 0.937 10.474 1.00 0.32 H new ATOM 0 HB3 GLN A 84 3.297 1.414 10.733 1.00 0.32 H new ATOM 0 HG2 GLN A 84 2.799 -0.909 11.571 1.00 0.44 H new ATOM 0 HG3 GLN A 84 4.495 -1.310 11.390 1.00 0.44 H new ATOM 0 HE21 GLN A 84 6.103 0.231 12.545 1.00 1.31 H new ATOM 0 HE22 GLN A 84 5.587 0.936 14.081 1.00 1.31 H new ATOM 1398 N VAL A 85 2.429 1.872 7.923 1.00 0.32 N ATOM 1399 CA VAL A 85 2.371 3.063 7.095 1.00 0.23 C ATOM 1400 C VAL A 85 1.996 4.288 7.928 1.00 0.27 C ATOM 1401 O VAL A 85 1.351 4.165 8.979 1.00 0.31 O ATOM 1402 CB VAL A 85 1.387 2.821 5.956 1.00 0.16 C ATOM 1403 CG1 VAL A 85 1.781 1.611 5.104 1.00 0.18 C ATOM 1404 CG2 VAL A 85 -0.026 2.628 6.489 1.00 0.26 C ATOM 0 H VAL A 85 1.527 1.546 8.270 1.00 0.32 H new ATOM 0 HA VAL A 85 3.353 3.268 6.670 1.00 0.23 H new ATOM 0 HB VAL A 85 1.417 3.708 5.323 1.00 0.16 H new ATOM 0 HG11 VAL A 85 1.052 1.476 4.305 1.00 0.18 H new ATOM 0 HG12 VAL A 85 2.768 1.776 4.671 1.00 0.18 H new ATOM 0 HG13 VAL A 85 1.804 0.718 5.729 1.00 0.18 H new ATOM 0 HG21 VAL A 85 -0.709 2.457 5.657 1.00 0.26 H new ATOM 0 HG22 VAL A 85 -0.048 1.768 7.159 1.00 0.26 H new ATOM 0 HG23 VAL A 85 -0.334 3.520 7.034 1.00 0.26 H new ATOM 1414 N CYS A 86 2.376 5.471 7.432 1.00 0.27 N ATOM 1415 CA CYS A 86 1.922 6.753 7.944 1.00 0.26 C ATOM 1416 C CYS A 86 1.742 7.716 6.762 1.00 0.25 C ATOM 1417 O CYS A 86 2.652 8.481 6.452 1.00 0.31 O ATOM 1418 CB CYS A 86 2.933 7.291 8.963 1.00 0.31 C ATOM 1419 SG CYS A 86 2.120 8.482 10.059 1.00 0.47 S ATOM 0 H CYS A 86 3.022 5.557 6.647 1.00 0.27 H new ATOM 0 HA CYS A 86 0.966 6.646 8.456 1.00 0.26 H new ATOM 0 HB2 CYS A 86 3.348 6.469 9.547 1.00 0.31 H new ATOM 0 HB3 CYS A 86 3.766 7.767 8.446 1.00 0.31 H new ATOM 0 HG CYS A 86 2.980 8.934 10.923 1.00 0.47 H new ATOM 1425 N LEU A 87 0.599 7.667 6.069 1.00 0.20 N ATOM 1426 CA LEU A 87 0.284 8.582 4.978 1.00 0.18 C ATOM 1427 C LEU A 87 -0.906 9.436 5.403 1.00 0.20 C ATOM 1428 O LEU A 87 -1.740 8.966 6.180 1.00 0.20 O ATOM 1429 CB LEU A 87 -0.085 7.814 3.696 1.00 0.15 C ATOM 1430 CG LEU A 87 1.017 6.977 3.042 1.00 0.14 C ATOM 1431 CD1 LEU A 87 2.340 7.729 2.957 1.00 0.17 C ATOM 1432 CD2 LEU A 87 1.249 5.639 3.731 1.00 0.14 C ATOM 0 H LEU A 87 -0.136 6.984 6.255 1.00 0.20 H new ATOM 0 HA LEU A 87 1.158 9.198 4.767 1.00 0.18 H new ATOM 0 HB2 LEU A 87 -0.920 7.153 3.927 1.00 0.15 H new ATOM 0 HB3 LEU A 87 -0.443 8.535 2.961 1.00 0.15 H new ATOM 0 HG LEU A 87 0.650 6.780 2.035 1.00 0.14 H new ATOM 0 HD11 LEU A 87 3.090 7.094 2.486 1.00 0.17 H new ATOM 0 HD12 LEU A 87 2.207 8.634 2.364 1.00 0.17 H new ATOM 0 HD13 LEU A 87 2.671 7.998 3.960 1.00 0.17 H new ATOM 0 HD21 LEU A 87 2.043 5.097 3.216 1.00 0.14 H new ATOM 0 HD22 LEU A 87 1.539 5.809 4.768 1.00 0.14 H new ATOM 0 HD23 LEU A 87 0.331 5.051 3.703 1.00 0.14 H new ATOM 1444 N PRO A 88 -1.049 10.658 4.866 1.00 0.22 N ATOM 1445 CA PRO A 88 -2.121 11.565 5.245 1.00 0.24 C ATOM 1446 C PRO A 88 -3.509 10.962 5.021 1.00 0.32 C ATOM 1447 O PRO A 88 -4.426 11.246 5.781 1.00 0.54 O ATOM 1448 CB PRO A 88 -1.886 12.860 4.465 1.00 0.25 C ATOM 1449 CG PRO A 88 -0.961 12.449 3.321 1.00 0.25 C ATOM 1450 CD PRO A 88 -0.157 11.293 3.913 1.00 0.23 C ATOM 0 HA PRO A 88 -2.102 11.765 6.316 1.00 0.24 H new ATOM 0 HB2 PRO A 88 -2.822 13.274 4.090 1.00 0.25 H new ATOM 0 HB3 PRO A 88 -1.428 13.625 5.092 1.00 0.25 H new ATOM 0 HG2 PRO A 88 -1.524 12.138 2.441 1.00 0.25 H new ATOM 0 HG3 PRO A 88 -0.315 13.271 3.012 1.00 0.25 H new ATOM 0 HD2 PRO A 88 0.155 10.593 3.138 1.00 0.23 H new ATOM 0 HD3 PRO A 88 0.749 11.653 4.401 1.00 0.23 H new ATOM 1458 N VAL A 89 -3.664 10.087 4.027 1.00 0.21 N ATOM 1459 CA VAL A 89 -4.937 9.439 3.703 1.00 0.19 C ATOM 1460 C VAL A 89 -5.541 8.699 4.905 1.00 0.18 C ATOM 1461 O VAL A 89 -6.756 8.520 4.965 1.00 0.20 O ATOM 1462 CB VAL A 89 -4.782 8.507 2.484 1.00 0.17 C ATOM 1463 CG1 VAL A 89 -4.536 9.341 1.222 1.00 0.19 C ATOM 1464 CG2 VAL A 89 -3.626 7.517 2.655 1.00 0.16 C ATOM 0 H VAL A 89 -2.899 9.804 3.415 1.00 0.21 H new ATOM 0 HA VAL A 89 -5.643 10.227 3.441 1.00 0.19 H new ATOM 0 HB VAL A 89 -5.707 7.937 2.395 1.00 0.17 H new ATOM 0 HG11 VAL A 89 -4.427 8.678 0.363 1.00 0.19 H new ATOM 0 HG12 VAL A 89 -5.380 10.011 1.058 1.00 0.19 H new ATOM 0 HG13 VAL A 89 -3.626 9.928 1.345 1.00 0.19 H new ATOM 0 HG21 VAL A 89 -3.557 6.882 1.771 1.00 0.16 H new ATOM 0 HG22 VAL A 89 -2.693 8.066 2.782 1.00 0.16 H new ATOM 0 HG23 VAL A 89 -3.805 6.897 3.534 1.00 0.16 H new ATOM 1474 N ILE A 90 -4.700 8.250 5.843 1.00 0.18 N ATOM 1475 CA ILE A 90 -5.103 7.552 7.061 1.00 0.18 C ATOM 1476 C ILE A 90 -4.430 8.160 8.292 1.00 0.20 C ATOM 1477 O ILE A 90 -4.328 7.516 9.334 1.00 0.24 O ATOM 1478 CB ILE A 90 -4.789 6.056 6.917 1.00 0.17 C ATOM 1479 CG1 ILE A 90 -3.287 5.833 6.669 1.00 0.16 C ATOM 1480 CG2 ILE A 90 -5.629 5.501 5.762 1.00 0.16 C ATOM 1481 CD1 ILE A 90 -2.939 4.371 6.411 1.00 0.16 C ATOM 0 H ILE A 90 -3.689 8.368 5.770 1.00 0.18 H new ATOM 0 HA ILE A 90 -6.177 7.667 7.204 1.00 0.18 H new ATOM 0 HB ILE A 90 -5.040 5.531 7.839 1.00 0.17 H new ATOM 0 HG12 ILE A 90 -2.972 6.432 5.815 1.00 0.16 H new ATOM 0 HG13 ILE A 90 -2.725 6.188 7.533 1.00 0.16 H new ATOM 0 HG21 ILE A 90 -5.423 4.438 5.640 1.00 0.16 H new ATOM 0 HG22 ILE A 90 -6.687 5.643 5.981 1.00 0.16 H new ATOM 0 HG23 ILE A 90 -5.375 6.027 4.842 1.00 0.16 H new ATOM 0 HD11 ILE A 90 -1.866 4.277 6.243 1.00 0.16 H new ATOM 0 HD12 ILE A 90 -3.225 3.771 7.275 1.00 0.16 H new ATOM 0 HD13 ILE A 90 -3.476 4.019 5.530 1.00 0.16 H new ATOM 1493 N SER A 91 -3.945 9.393 8.184 1.00 0.22 N ATOM 1494 CA SER A 91 -3.337 10.071 9.313 1.00 0.26 C ATOM 1495 C SER A 91 -4.443 10.542 10.251 1.00 0.26 C ATOM 1496 O SER A 91 -5.579 10.727 9.826 1.00 0.32 O ATOM 1497 CB SER A 91 -2.502 11.230 8.779 1.00 0.36 C ATOM 1498 OG SER A 91 -1.995 12.008 9.846 1.00 0.63 O ATOM 0 H SER A 91 -3.963 9.940 7.323 1.00 0.22 H new ATOM 0 HA SER A 91 -2.680 9.409 9.878 1.00 0.26 H new ATOM 0 HB2 SER A 91 -1.678 10.846 8.178 1.00 0.36 H new ATOM 0 HB3 SER A 91 -3.111 11.853 8.124 1.00 0.36 H new ATOM 0 HG SER A 91 -1.460 12.747 9.487 1.00 0.63 H new ATOM 1504 N ALA A 92 -4.123 10.764 11.527 1.00 0.33 N ATOM 1505 CA ALA A 92 -5.099 11.245 12.493 1.00 0.40 C ATOM 1506 C ALA A 92 -5.542 12.663 12.133 1.00 0.42 C ATOM 1507 O ALA A 92 -6.733 12.940 12.052 1.00 0.43 O ATOM 1508 CB ALA A 92 -4.512 11.182 13.905 1.00 0.51 C ATOM 0 H ALA A 92 -3.190 10.616 11.912 1.00 0.33 H new ATOM 0 HA ALA A 92 -5.980 10.604 12.466 1.00 0.40 H new ATOM 0 HB1 ALA A 92 -5.249 11.544 14.622 1.00 0.51 H new ATOM 0 HB2 ALA A 92 -4.249 10.152 14.144 1.00 0.51 H new ATOM 0 HB3 ALA A 92 -3.620 11.806 13.956 1.00 0.51 H new ATOM 1514 N GLU A 93 -4.590 13.566 11.883 1.00 0.46 N ATOM 1515 CA GLU A 93 -4.901 14.952 11.540 1.00 0.53 C ATOM 1516 C GLU A 93 -5.673 15.055 10.225 1.00 0.50 C ATOM 1517 O GLU A 93 -6.364 16.040 9.980 1.00 0.64 O ATOM 1518 CB GLU A 93 -3.613 15.773 11.442 1.00 0.64 C ATOM 1519 CG GLU A 93 -3.017 16.031 12.828 1.00 0.95 C ATOM 1520 CD GLU A 93 -1.803 16.951 12.719 1.00 1.48 C ATOM 1521 OE1 GLU A 93 -1.893 18.088 13.230 1.00 2.36 O ATOM 1522 OE2 GLU A 93 -0.811 16.500 12.105 1.00 2.76 O ATOM 0 H GLU A 93 -3.592 13.358 11.913 1.00 0.46 H new ATOM 0 HA GLU A 93 -5.533 15.349 12.334 1.00 0.53 H new ATOM 0 HB2 GLU A 93 -2.888 15.245 10.823 1.00 0.64 H new ATOM 0 HB3 GLU A 93 -3.820 16.723 10.949 1.00 0.64 H new ATOM 0 HG2 GLU A 93 -3.768 16.483 13.476 1.00 0.95 H new ATOM 0 HG3 GLU A 93 -2.726 15.087 13.288 1.00 0.95 H new ATOM 1529 N ASN A 94 -5.558 14.045 9.359 1.00 0.40 N ATOM 1530 CA ASN A 94 -6.233 14.044 8.069 1.00 0.42 C ATOM 1531 C ASN A 94 -7.234 12.892 8.010 1.00 0.37 C ATOM 1532 O ASN A 94 -7.638 12.477 6.925 1.00 0.40 O ATOM 1533 CB ASN A 94 -5.198 13.984 6.941 1.00 0.46 C ATOM 1534 CG ASN A 94 -4.463 15.302 6.753 1.00 0.83 C ATOM 1535 OD1 ASN A 94 -4.741 16.043 5.819 1.00 1.64 O ATOM 1536 ND2 ASN A 94 -3.517 15.617 7.628 1.00 0.84 N ATOM 0 H ASN A 94 -4.997 13.212 9.535 1.00 0.40 H new ATOM 0 HA ASN A 94 -6.797 14.968 7.939 1.00 0.42 H new ATOM 0 HB2 ASN A 94 -4.476 13.197 7.157 1.00 0.46 H new ATOM 0 HB3 ASN A 94 -5.696 13.713 6.010 1.00 0.46 H new ATOM 0 HD21 ASN A 94 -3.003 16.493 7.531 1.00 0.84 H new ATOM 0 HD22 ASN A 94 -3.303 14.983 8.398 1.00 0.84 H new ATOM 1543 N TRP A 95 -7.689 12.406 9.168 1.00 0.34 N ATOM 1544 CA TRP A 95 -8.687 11.355 9.236 1.00 0.32 C ATOM 1545 C TRP A 95 -9.946 11.881 8.562 1.00 0.33 C ATOM 1546 O TRP A 95 -10.564 12.837 9.028 1.00 0.45 O ATOM 1547 CB TRP A 95 -8.935 10.959 10.697 1.00 0.33 C ATOM 1548 CG TRP A 95 -10.236 10.279 11.014 1.00 0.31 C ATOM 1549 CD1 TRP A 95 -10.825 9.267 10.330 1.00 0.29 C ATOM 1550 CD2 TRP A 95 -11.148 10.604 12.105 1.00 0.39 C ATOM 1551 NE1 TRP A 95 -12.047 8.969 10.908 1.00 0.32 N ATOM 1552 CE2 TRP A 95 -12.313 9.795 11.982 1.00 0.39 C ATOM 1553 CE3 TRP A 95 -11.107 11.519 13.179 1.00 0.51 C ATOM 1554 CZ2 TRP A 95 -13.404 9.928 12.852 1.00 0.49 C ATOM 1555 CZ3 TRP A 95 -12.180 11.630 14.082 1.00 0.61 C ATOM 1556 CH2 TRP A 95 -13.332 10.842 13.915 1.00 0.60 C ATOM 0 H TRP A 95 -7.371 12.735 10.080 1.00 0.34 H new ATOM 0 HA TRP A 95 -8.353 10.454 8.722 1.00 0.32 H new ATOM 0 HB2 TRP A 95 -8.125 10.301 11.010 1.00 0.33 H new ATOM 0 HB3 TRP A 95 -8.868 11.860 11.307 1.00 0.33 H new ATOM 0 HD1 TRP A 95 -10.406 8.770 9.468 1.00 0.29 H new ATOM 0 HE1 TRP A 95 -12.672 8.232 10.582 1.00 0.32 H new ATOM 0 HE3 TRP A 95 -10.237 12.145 13.310 1.00 0.51 H new ATOM 0 HZ2 TRP A 95 -14.293 9.332 12.706 1.00 0.49 H new ATOM 0 HZ3 TRP A 95 -12.118 12.324 14.907 1.00 0.61 H new ATOM 0 HH2 TRP A 95 -14.159 10.939 14.602 1.00 0.60 H new ATOM 1567 N LYS A 96 -10.314 11.272 7.436 1.00 0.34 N ATOM 1568 CA LYS A 96 -11.493 11.656 6.689 1.00 0.38 C ATOM 1569 C LYS A 96 -12.377 10.424 6.617 1.00 0.32 C ATOM 1570 O LYS A 96 -11.998 9.467 5.954 1.00 0.32 O ATOM 1571 CB LYS A 96 -11.104 12.158 5.286 1.00 0.49 C ATOM 1572 CG LYS A 96 -11.309 13.673 5.182 1.00 0.60 C ATOM 1573 CD LYS A 96 -10.235 14.465 5.934 1.00 0.86 C ATOM 1574 CE LYS A 96 -10.829 15.782 6.437 1.00 1.61 C ATOM 1575 NZ LYS A 96 -9.784 16.775 6.770 1.00 2.27 N ATOM 0 H LYS A 96 -9.796 10.497 7.022 1.00 0.34 H new ATOM 0 HA LYS A 96 -12.023 12.477 7.173 1.00 0.38 H new ATOM 0 HB2 LYS A 96 -10.062 11.911 5.081 1.00 0.49 H new ATOM 0 HB3 LYS A 96 -11.706 11.651 4.532 1.00 0.49 H new ATOM 0 HG2 LYS A 96 -11.303 13.966 4.132 1.00 0.60 H new ATOM 0 HG3 LYS A 96 -12.291 13.931 5.579 1.00 0.60 H new ATOM 0 HD2 LYS A 96 -9.858 13.880 6.773 1.00 0.86 H new ATOM 0 HD3 LYS A 96 -9.388 14.663 5.277 1.00 0.86 H new ATOM 0 HE2 LYS A 96 -11.490 16.195 5.675 1.00 1.61 H new ATOM 0 HE3 LYS A 96 -11.440 15.590 7.319 1.00 1.61 H new ATOM 0 HZ1 LYS A 96 -10.232 17.651 7.106 1.00 2.27 H new ATOM 0 HZ2 LYS A 96 -9.167 16.393 7.515 1.00 2.27 H new ATOM 0 HZ3 LYS A 96 -9.217 16.980 5.923 1.00 2.27 H new ATOM 1589 N PRO A 97 -13.558 10.418 7.245 1.00 0.31 N ATOM 1590 CA PRO A 97 -14.454 9.274 7.177 1.00 0.31 C ATOM 1591 C PRO A 97 -14.981 9.062 5.756 1.00 0.40 C ATOM 1592 O PRO A 97 -15.301 7.945 5.364 1.00 0.69 O ATOM 1593 CB PRO A 97 -15.552 9.568 8.201 1.00 0.32 C ATOM 1594 CG PRO A 97 -15.567 11.092 8.304 1.00 0.35 C ATOM 1595 CD PRO A 97 -14.106 11.474 8.077 1.00 0.33 C ATOM 0 HA PRO A 97 -13.955 8.334 7.415 1.00 0.31 H new ATOM 0 HB2 PRO A 97 -16.517 9.181 7.873 1.00 0.32 H new ATOM 0 HB3 PRO A 97 -15.334 9.106 9.164 1.00 0.32 H new ATOM 0 HG2 PRO A 97 -16.221 11.539 7.555 1.00 0.35 H new ATOM 0 HG3 PRO A 97 -15.923 11.426 9.279 1.00 0.35 H new ATOM 0 HD2 PRO A 97 -14.025 12.444 7.586 1.00 0.33 H new ATOM 0 HD3 PRO A 97 -13.568 11.549 9.022 1.00 0.33 H new ATOM 1603 N ALA A 98 -15.034 10.127 4.956 1.00 0.36 N ATOM 1604 CA ALA A 98 -15.393 10.043 3.549 1.00 0.41 C ATOM 1605 C ALA A 98 -14.378 9.244 2.723 1.00 0.40 C ATOM 1606 O ALA A 98 -14.711 8.789 1.624 1.00 0.46 O ATOM 1607 CB ALA A 98 -15.510 11.464 3.003 1.00 0.48 C ATOM 0 H ALA A 98 -14.827 11.075 5.272 1.00 0.36 H new ATOM 0 HA ALA A 98 -16.341 9.511 3.468 1.00 0.41 H new ATOM 0 HB1 ALA A 98 -15.779 11.427 1.947 1.00 0.48 H new ATOM 0 HB2 ALA A 98 -16.280 12.004 3.555 1.00 0.48 H new ATOM 0 HB3 ALA A 98 -14.555 11.977 3.116 1.00 0.48 H new ATOM 1613 N THR A 99 -13.141 9.104 3.221 1.00 0.36 N ATOM 1614 CA THR A 99 -12.097 8.368 2.528 1.00 0.35 C ATOM 1615 C THR A 99 -12.521 6.917 2.350 1.00 0.33 C ATOM 1616 O THR A 99 -13.532 6.466 2.892 1.00 0.52 O ATOM 1617 CB THR A 99 -10.745 8.498 3.253 1.00 0.41 C ATOM 1618 OG1 THR A 99 -9.730 8.369 2.290 1.00 0.47 O ATOM 1619 CG2 THR A 99 -10.470 7.438 4.327 1.00 0.44 C ATOM 0 H THR A 99 -12.846 9.500 4.113 1.00 0.36 H new ATOM 0 HA THR A 99 -11.955 8.800 1.537 1.00 0.35 H new ATOM 0 HB THR A 99 -10.771 9.462 3.760 1.00 0.41 H new ATOM 0 HG1 THR A 99 -8.855 8.450 2.724 1.00 0.47 H new ATOM 0 HG21 THR A 99 -9.493 7.620 4.776 1.00 0.44 H new ATOM 0 HG22 THR A 99 -11.239 7.492 5.097 1.00 0.44 H new ATOM 0 HG23 THR A 99 -10.482 6.448 3.872 1.00 0.44 H new ATOM 1627 N LYS A 100 -11.750 6.172 1.569 1.00 0.31 N ATOM 1628 CA LYS A 100 -12.047 4.779 1.311 1.00 0.25 C ATOM 1629 C LYS A 100 -10.773 4.076 0.904 1.00 0.20 C ATOM 1630 O LYS A 100 -9.725 4.699 0.742 1.00 0.20 O ATOM 1631 CB LYS A 100 -13.111 4.654 0.215 1.00 0.40 C ATOM 1632 CG LYS A 100 -12.727 5.388 -1.080 1.00 2.56 C ATOM 1633 CD LYS A 100 -13.341 6.784 -1.242 1.00 2.81 C ATOM 1634 CE LYS A 100 -14.825 6.723 -1.606 1.00 3.01 C ATOM 1635 NZ LYS A 100 -15.696 6.705 -0.416 1.00 2.76 N ATOM 0 H LYS A 100 -10.911 6.516 1.103 1.00 0.31 H new ATOM 0 HA LYS A 100 -12.443 4.314 2.214 1.00 0.25 H new ATOM 0 HB2 LYS A 100 -13.275 3.599 -0.006 1.00 0.40 H new ATOM 0 HB3 LYS A 100 -14.055 5.052 0.586 1.00 0.40 H new ATOM 0 HG2 LYS A 100 -11.641 5.478 -1.120 1.00 2.56 H new ATOM 0 HG3 LYS A 100 -13.027 4.775 -1.930 1.00 2.56 H new ATOM 0 HD2 LYS A 100 -13.219 7.343 -0.314 1.00 2.81 H new ATOM 0 HD3 LYS A 100 -12.801 7.329 -2.016 1.00 2.81 H new ATOM 0 HE2 LYS A 100 -15.080 7.582 -2.226 1.00 3.01 H new ATOM 0 HE3 LYS A 100 -15.013 5.831 -2.204 1.00 3.01 H new ATOM 0 HZ1 LYS A 100 -16.547 7.274 -0.600 1.00 2.76 H new ATOM 0 HZ2 LYS A 100 -15.974 5.726 -0.204 1.00 2.76 H new ATOM 0 HZ3 LYS A 100 -15.182 7.102 0.396 1.00 2.76 H new ATOM 1649 N THR A 101 -10.878 2.776 0.697 1.00 0.21 N ATOM 1650 CA THR A 101 -9.781 1.979 0.214 1.00 0.21 C ATOM 1651 C THR A 101 -9.264 2.441 -1.136 1.00 0.19 C ATOM 1652 O THR A 101 -8.096 2.205 -1.404 1.00 0.23 O ATOM 1653 CB THR A 101 -10.219 0.534 0.118 1.00 0.27 C ATOM 1654 OG1 THR A 101 -11.584 0.509 -0.252 1.00 0.45 O ATOM 1655 CG2 THR A 101 -10.035 -0.138 1.472 1.00 0.31 C ATOM 0 H THR A 101 -11.734 2.247 0.862 1.00 0.21 H new ATOM 0 HA THR A 101 -8.962 2.091 0.925 1.00 0.21 H new ATOM 0 HB THR A 101 -9.624 0.002 -0.624 1.00 0.27 H new ATOM 0 HG1 THR A 101 -11.963 -0.371 -0.046 1.00 0.45 H new ATOM 0 HG21 THR A 101 -10.350 -1.180 1.407 1.00 0.31 H new ATOM 0 HG22 THR A 101 -8.985 -0.093 1.761 1.00 0.31 H new ATOM 0 HG23 THR A 101 -10.639 0.377 2.219 1.00 0.31 H new ATOM 1663 N ASP A 102 -10.072 3.080 -1.986 1.00 0.18 N ATOM 1664 CA ASP A 102 -9.531 3.673 -3.208 1.00 0.20 C ATOM 1665 C ASP A 102 -8.426 4.660 -2.832 1.00 0.17 C ATOM 1666 O ASP A 102 -7.292 4.513 -3.275 1.00 0.23 O ATOM 1667 CB ASP A 102 -10.638 4.261 -4.101 1.00 0.26 C ATOM 1668 CG ASP A 102 -10.512 5.770 -4.296 1.00 1.06 C ATOM 1669 OD1 ASP A 102 -11.039 6.492 -3.423 1.00 1.62 O ATOM 1670 OD2 ASP A 102 -9.845 6.176 -5.269 1.00 2.36 O ATOM 0 H ASP A 102 -11.077 3.198 -1.855 1.00 0.18 H new ATOM 0 HA ASP A 102 -9.077 2.902 -3.830 1.00 0.20 H new ATOM 0 HB2 ASP A 102 -10.610 3.771 -5.074 1.00 0.26 H new ATOM 0 HB3 ASP A 102 -11.609 4.038 -3.660 1.00 0.26 H new ATOM 1675 N GLN A 103 -8.724 5.601 -1.938 1.00 0.17 N ATOM 1676 CA GLN A 103 -7.773 6.608 -1.498 1.00 0.17 C ATOM 1677 C GLN A 103 -6.595 5.995 -0.767 1.00 0.17 C ATOM 1678 O GLN A 103 -5.487 6.526 -0.841 1.00 0.23 O ATOM 1679 CB GLN A 103 -8.448 7.664 -0.624 1.00 0.21 C ATOM 1680 CG GLN A 103 -9.676 8.216 -1.350 1.00 0.26 C ATOM 1681 CD GLN A 103 -10.139 9.575 -0.834 1.00 0.36 C ATOM 1682 OE1 GLN A 103 -9.411 10.312 -0.179 1.00 1.11 O ATOM 1683 NE2 GLN A 103 -11.383 9.932 -1.127 1.00 1.28 N ATOM 0 H GLN A 103 -9.641 5.683 -1.498 1.00 0.17 H new ATOM 0 HA GLN A 103 -7.392 7.094 -2.396 1.00 0.17 H new ATOM 0 HB2 GLN A 103 -8.742 7.228 0.331 1.00 0.21 H new ATOM 0 HB3 GLN A 103 -7.749 8.471 -0.404 1.00 0.21 H new ATOM 0 HG2 GLN A 103 -9.451 8.299 -2.413 1.00 0.26 H new ATOM 0 HG3 GLN A 103 -10.495 7.503 -1.253 1.00 0.26 H new ATOM 0 HE21 GLN A 103 -11.977 9.308 -1.673 1.00 1.28 H new ATOM 0 HE22 GLN A 103 -11.745 10.830 -0.806 1.00 1.28 H new ATOM 1692 N VAL A 104 -6.809 4.894 -0.051 1.00 0.14 N ATOM 1693 CA VAL A 104 -5.715 4.292 0.678 1.00 0.15 C ATOM 1694 C VAL A 104 -4.754 3.638 -0.306 1.00 0.15 C ATOM 1695 O VAL A 104 -3.565 3.950 -0.326 1.00 0.16 O ATOM 1696 CB VAL A 104 -6.286 3.328 1.720 1.00 0.16 C ATOM 1697 CG1 VAL A 104 -5.155 2.541 2.354 1.00 0.16 C ATOM 1698 CG2 VAL A 104 -6.989 4.138 2.809 1.00 0.18 C ATOM 0 H VAL A 104 -7.707 4.417 0.035 1.00 0.14 H new ATOM 0 HA VAL A 104 -5.136 5.038 1.222 1.00 0.15 H new ATOM 0 HB VAL A 104 -6.988 2.645 1.241 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.561 1.854 3.096 1.00 0.16 H new ATOM 0 HG12 VAL A 104 -4.630 1.975 1.585 1.00 0.16 H new ATOM 0 HG13 VAL A 104 -4.460 3.228 2.837 1.00 0.16 H new ATOM 0 HG21 VAL A 104 -7.400 3.461 3.558 1.00 0.18 H new ATOM 0 HG22 VAL A 104 -6.273 4.810 3.282 1.00 0.18 H new ATOM 0 HG23 VAL A 104 -7.796 4.721 2.365 1.00 0.18 H new ATOM 1708 N ILE A 105 -5.267 2.735 -1.132 1.00 0.14 N ATOM 1709 CA ILE A 105 -4.483 1.930 -2.047 1.00 0.15 C ATOM 1710 C ILE A 105 -3.754 2.844 -3.015 1.00 0.15 C ATOM 1711 O ILE A 105 -2.545 2.706 -3.193 1.00 0.16 O ATOM 1712 CB ILE A 105 -5.397 0.912 -2.754 1.00 0.15 C ATOM 1713 CG1 ILE A 105 -5.698 -0.260 -1.805 1.00 0.16 C ATOM 1714 CG2 ILE A 105 -4.836 0.383 -4.081 1.00 0.16 C ATOM 1715 CD1 ILE A 105 -4.445 -0.986 -1.301 1.00 0.19 C ATOM 0 H ILE A 105 -6.267 2.541 -1.182 1.00 0.14 H new ATOM 0 HA ILE A 105 -3.728 1.357 -1.510 1.00 0.15 H new ATOM 0 HB ILE A 105 -6.312 1.447 -3.008 1.00 0.15 H new ATOM 0 HG12 ILE A 105 -6.259 0.113 -0.949 1.00 0.16 H new ATOM 0 HG13 ILE A 105 -6.339 -0.976 -2.319 1.00 0.16 H new ATOM 0 HG21 ILE A 105 -5.539 -0.328 -4.515 1.00 0.16 H new ATOM 0 HG22 ILE A 105 -4.688 1.214 -4.771 1.00 0.16 H new ATOM 0 HG23 ILE A 105 -3.882 -0.113 -3.901 1.00 0.16 H new ATOM 0 HD11 ILE A 105 -4.738 -1.800 -0.637 1.00 0.19 H new ATOM 0 HD12 ILE A 105 -3.893 -1.391 -2.149 1.00 0.19 H new ATOM 0 HD13 ILE A 105 -3.812 -0.285 -0.758 1.00 0.19 H new ATOM 1727 N GLN A 106 -4.472 3.793 -3.620 1.00 0.16 N ATOM 1728 CA GLN A 106 -3.855 4.749 -4.529 1.00 0.17 C ATOM 1729 C GLN A 106 -2.740 5.515 -3.827 1.00 0.18 C ATOM 1730 O GLN A 106 -1.785 5.885 -4.486 1.00 0.22 O ATOM 1731 CB GLN A 106 -4.884 5.683 -5.187 1.00 0.23 C ATOM 1732 CG GLN A 106 -5.456 6.753 -4.250 1.00 0.60 C ATOM 1733 CD GLN A 106 -4.569 7.985 -4.069 1.00 1.26 C ATOM 1734 OE1 GLN A 106 -4.073 8.561 -5.028 1.00 1.85 O ATOM 1735 NE2 GLN A 106 -4.357 8.422 -2.834 1.00 2.19 N ATOM 0 H GLN A 106 -5.477 3.916 -3.495 1.00 0.16 H new ATOM 0 HA GLN A 106 -3.406 4.185 -5.346 1.00 0.17 H new ATOM 0 HB2 GLN A 106 -4.417 6.176 -6.040 1.00 0.23 H new ATOM 0 HB3 GLN A 106 -5.705 5.082 -5.577 1.00 0.23 H new ATOM 0 HG2 GLN A 106 -6.424 7.073 -4.635 1.00 0.60 H new ATOM 0 HG3 GLN A 106 -5.634 6.303 -3.273 1.00 0.60 H new ATOM 0 HE21 GLN A 106 -4.775 7.934 -2.042 1.00 2.19 H new ATOM 0 HE22 GLN A 106 -3.776 9.245 -2.677 1.00 2.19 H new ATOM 1744 N SER A 107 -2.826 5.745 -2.513 1.00 0.16 N ATOM 1745 CA SER A 107 -1.747 6.344 -1.750 1.00 0.17 C ATOM 1746 C SER A 107 -0.537 5.428 -1.775 1.00 0.15 C ATOM 1747 O SER A 107 0.535 5.871 -2.169 1.00 0.16 O ATOM 1748 CB SER A 107 -2.167 6.618 -0.305 1.00 0.18 C ATOM 1749 OG SER A 107 -1.397 7.664 0.255 1.00 0.45 O ATOM 0 H SER A 107 -3.650 5.518 -1.956 1.00 0.16 H new ATOM 0 HA SER A 107 -1.495 7.300 -2.209 1.00 0.17 H new ATOM 0 HB2 SER A 107 -3.224 6.882 -0.273 1.00 0.18 H new ATOM 0 HB3 SER A 107 -2.046 5.713 0.291 1.00 0.18 H new ATOM 0 HG SER A 107 -1.993 8.325 0.666 1.00 0.45 H new ATOM 1755 N LEU A 108 -0.667 4.159 -1.374 1.00 0.13 N ATOM 1756 CA LEU A 108 0.512 3.302 -1.360 1.00 0.13 C ATOM 1757 C LEU A 108 1.144 3.270 -2.730 1.00 0.14 C ATOM 1758 O LEU A 108 2.352 3.376 -2.836 1.00 0.15 O ATOM 1759 CB LEU A 108 0.227 1.853 -0.977 1.00 0.13 C ATOM 1760 CG LEU A 108 -0.138 1.597 0.483 1.00 0.14 C ATOM 1761 CD1 LEU A 108 0.429 2.633 1.449 1.00 0.15 C ATOM 1762 CD2 LEU A 108 -1.641 1.451 0.664 1.00 0.19 C ATOM 0 H LEU A 108 -1.536 3.722 -1.069 1.00 0.13 H new ATOM 0 HA LEU A 108 1.166 3.736 -0.604 1.00 0.13 H new ATOM 0 HB2 LEU A 108 -0.588 1.488 -1.602 1.00 0.13 H new ATOM 0 HB3 LEU A 108 1.106 1.256 -1.219 1.00 0.13 H new ATOM 0 HG LEU A 108 0.338 0.651 0.740 1.00 0.14 H new ATOM 0 HD11 LEU A 108 0.128 2.385 2.467 1.00 0.15 H new ATOM 0 HD12 LEU A 108 1.517 2.635 1.383 1.00 0.15 H new ATOM 0 HD13 LEU A 108 0.048 3.620 1.188 1.00 0.15 H new ATOM 0 HD21 LEU A 108 -1.865 1.270 1.715 1.00 0.19 H new ATOM 0 HD22 LEU A 108 -2.137 2.366 0.340 1.00 0.19 H new ATOM 0 HD23 LEU A 108 -2.000 0.613 0.067 1.00 0.19 H new ATOM 1774 N ILE A 109 0.355 3.113 -3.781 1.00 0.19 N ATOM 1775 CA ILE A 109 0.897 3.088 -5.124 1.00 0.21 C ATOM 1776 C ILE A 109 1.567 4.419 -5.423 1.00 0.23 C ATOM 1777 O ILE A 109 2.669 4.434 -5.944 1.00 0.28 O ATOM 1778 CB ILE A 109 -0.225 2.761 -6.103 1.00 0.21 C ATOM 1779 CG1 ILE A 109 -0.619 1.296 -5.866 1.00 0.18 C ATOM 1780 CG2 ILE A 109 0.226 2.940 -7.554 1.00 0.25 C ATOM 1781 CD1 ILE A 109 -2.086 1.084 -6.216 1.00 0.17 C ATOM 0 H ILE A 109 -0.658 3.002 -3.728 1.00 0.19 H new ATOM 0 HA ILE A 109 1.659 2.315 -5.225 1.00 0.21 H new ATOM 0 HB ILE A 109 -1.065 3.436 -5.938 1.00 0.21 H new ATOM 0 HG12 ILE A 109 0.006 0.641 -6.473 1.00 0.18 H new ATOM 0 HG13 ILE A 109 -0.444 1.028 -4.824 1.00 0.18 H new ATOM 0 HG21 ILE A 109 -0.599 2.698 -8.224 1.00 0.25 H new ATOM 0 HG22 ILE A 109 0.533 3.973 -7.715 1.00 0.25 H new ATOM 0 HG23 ILE A 109 1.066 2.276 -7.759 1.00 0.25 H new ATOM 0 HD11 ILE A 109 -2.354 0.042 -6.044 1.00 0.17 H new ATOM 0 HD12 ILE A 109 -2.706 1.726 -5.590 1.00 0.17 H new ATOM 0 HD13 ILE A 109 -2.249 1.332 -7.265 1.00 0.17 H new ATOM 1793 N ALA A 110 0.926 5.532 -5.090 1.00 0.22 N ATOM 1794 CA ALA A 110 1.408 6.871 -5.377 1.00 0.23 C ATOM 1795 C ALA A 110 2.774 7.102 -4.742 1.00 0.19 C ATOM 1796 O ALA A 110 3.617 7.748 -5.343 1.00 0.20 O ATOM 1797 CB ALA A 110 0.375 7.896 -4.887 1.00 0.24 C ATOM 0 H ALA A 110 0.032 5.525 -4.599 1.00 0.22 H new ATOM 0 HA ALA A 110 1.533 6.990 -6.453 1.00 0.23 H new ATOM 0 HB1 ALA A 110 0.733 8.903 -5.100 1.00 0.24 H new ATOM 0 HB2 ALA A 110 -0.573 7.731 -5.400 1.00 0.24 H new ATOM 0 HB3 ALA A 110 0.231 7.782 -3.813 1.00 0.24 H new ATOM 1803 N LEU A 111 2.995 6.576 -3.541 1.00 0.17 N ATOM 1804 CA LEU A 111 4.192 6.785 -2.743 1.00 0.17 C ATOM 1805 C LEU A 111 5.285 5.759 -3.072 1.00 0.20 C ATOM 1806 O LEU A 111 6.474 6.065 -3.087 1.00 0.33 O ATOM 1807 CB LEU A 111 3.782 6.703 -1.261 1.00 0.17 C ATOM 1808 CG LEU A 111 3.245 7.999 -0.621 1.00 0.17 C ATOM 1809 CD1 LEU A 111 3.775 9.287 -1.239 1.00 0.29 C ATOM 1810 CD2 LEU A 111 1.721 8.078 -0.631 1.00 0.25 C ATOM 0 H LEU A 111 2.316 5.969 -3.082 1.00 0.17 H new ATOM 0 HA LEU A 111 4.618 7.763 -2.968 1.00 0.17 H new ATOM 0 HB2 LEU A 111 3.018 5.932 -1.161 1.00 0.17 H new ATOM 0 HB3 LEU A 111 4.647 6.372 -0.686 1.00 0.17 H new ATOM 0 HG LEU A 111 3.619 7.929 0.401 1.00 0.17 H new ATOM 0 HD11 LEU A 111 3.341 10.144 -0.723 1.00 0.29 H new ATOM 0 HD12 LEU A 111 4.860 9.317 -1.143 1.00 0.29 H new ATOM 0 HD13 LEU A 111 3.503 9.323 -2.294 1.00 0.29 H new ATOM 0 HD21 LEU A 111 1.402 9.012 -0.168 1.00 0.25 H new ATOM 0 HD22 LEU A 111 1.362 8.042 -1.659 1.00 0.25 H new ATOM 0 HD23 LEU A 111 1.309 7.237 -0.073 1.00 0.25 H new ATOM 1822 N VAL A 112 4.910 4.503 -3.271 1.00 0.22 N ATOM 1823 CA VAL A 112 5.815 3.420 -3.638 1.00 0.22 C ATOM 1824 C VAL A 112 6.348 3.701 -5.050 1.00 0.26 C ATOM 1825 O VAL A 112 7.512 3.443 -5.351 1.00 0.34 O ATOM 1826 CB VAL A 112 5.056 2.081 -3.517 1.00 0.20 C ATOM 1827 CG1 VAL A 112 5.868 0.863 -3.953 1.00 0.26 C ATOM 1828 CG2 VAL A 112 4.666 1.784 -2.060 1.00 0.22 C ATOM 0 H VAL A 112 3.940 4.200 -3.179 1.00 0.22 H new ATOM 0 HA VAL A 112 6.677 3.354 -2.974 1.00 0.22 H new ATOM 0 HB VAL A 112 4.195 2.219 -4.171 1.00 0.20 H new ATOM 0 HG11 VAL A 112 5.264 -0.037 -3.838 1.00 0.26 H new ATOM 0 HG12 VAL A 112 6.158 0.974 -4.998 1.00 0.26 H new ATOM 0 HG13 VAL A 112 6.762 0.782 -3.335 1.00 0.26 H new ATOM 0 HG21 VAL A 112 4.133 0.834 -2.012 1.00 0.22 H new ATOM 0 HG22 VAL A 112 5.565 1.727 -1.447 1.00 0.22 H new ATOM 0 HG23 VAL A 112 4.022 2.580 -1.686 1.00 0.22 H new ATOM 1838 N ASN A 113 5.495 4.244 -5.915 1.00 0.27 N ATOM 1839 CA ASN A 113 5.836 4.714 -7.246 1.00 0.32 C ATOM 1840 C ASN A 113 6.683 5.980 -7.120 1.00 0.29 C ATOM 1841 O ASN A 113 7.812 6.010 -7.603 1.00 0.35 O ATOM 1842 CB ASN A 113 4.534 4.947 -8.029 1.00 0.43 C ATOM 1843 CG ASN A 113 4.729 5.212 -9.511 1.00 1.65 C ATOM 1844 OD1 ASN A 113 5.512 6.057 -9.915 1.00 2.82 O ATOM 1845 ND2 ASN A 113 4.021 4.480 -10.362 1.00 2.23 N ATOM 0 H ASN A 113 4.507 4.372 -5.694 1.00 0.27 H new ATOM 0 HA ASN A 113 6.427 3.980 -7.794 1.00 0.32 H new ATOM 0 HB2 ASN A 113 3.892 4.074 -7.910 1.00 0.43 H new ATOM 0 HB3 ASN A 113 4.006 5.793 -7.588 1.00 0.43 H new ATOM 0 HD21 ASN A 113 4.128 4.620 -11.367 1.00 2.23 H new ATOM 0 HD22 ASN A 113 3.370 3.777 -10.011 1.00 2.23 H new ATOM 1852 N ASP A 114 6.159 6.996 -6.432 1.00 0.24 N ATOM 1853 CA ASP A 114 6.766 8.320 -6.343 1.00 0.28 C ATOM 1854 C ASP A 114 6.913 8.732 -4.869 1.00 0.25 C ATOM 1855 O ASP A 114 6.006 9.318 -4.281 1.00 0.24 O ATOM 1856 CB ASP A 114 5.922 9.317 -7.151 1.00 0.35 C ATOM 1857 CG ASP A 114 6.648 10.644 -7.357 1.00 0.65 C ATOM 1858 OD1 ASP A 114 7.878 10.669 -7.126 1.00 0.84 O ATOM 1859 OD2 ASP A 114 5.974 11.602 -7.797 1.00 1.14 O ATOM 0 H ASP A 114 5.285 6.917 -5.912 1.00 0.24 H new ATOM 0 HA ASP A 114 7.768 8.309 -6.771 1.00 0.28 H new ATOM 0 HB2 ASP A 114 5.677 8.883 -8.121 1.00 0.35 H new ATOM 0 HB3 ASP A 114 4.979 9.496 -6.635 1.00 0.35 H new ATOM 1864 N PRO A 115 8.025 8.362 -4.216 1.00 0.27 N ATOM 1865 CA PRO A 115 8.194 8.537 -2.780 1.00 0.26 C ATOM 1866 C PRO A 115 8.428 10.000 -2.416 1.00 0.25 C ATOM 1867 O PRO A 115 9.008 10.757 -3.190 1.00 0.37 O ATOM 1868 CB PRO A 115 9.401 7.670 -2.409 1.00 0.34 C ATOM 1869 CG PRO A 115 10.210 7.628 -3.704 1.00 0.41 C ATOM 1870 CD PRO A 115 9.131 7.617 -4.784 1.00 0.35 C ATOM 0 HA PRO A 115 7.299 8.241 -2.232 1.00 0.26 H new ATOM 0 HB2 PRO A 115 9.974 8.106 -1.590 1.00 0.34 H new ATOM 0 HB3 PRO A 115 9.098 6.673 -2.091 1.00 0.34 H new ATOM 0 HG2 PRO A 115 10.866 8.493 -3.798 1.00 0.41 H new ATOM 0 HG3 PRO A 115 10.842 6.742 -3.756 1.00 0.41 H new ATOM 0 HD2 PRO A 115 9.488 8.080 -5.704 1.00 0.35 H new ATOM 0 HD3 PRO A 115 8.834 6.599 -5.035 1.00 0.35 H new ATOM 1878 N GLN A 116 8.034 10.387 -1.198 1.00 0.29 N ATOM 1879 CA GLN A 116 8.064 11.781 -0.775 1.00 0.31 C ATOM 1880 C GLN A 116 9.175 11.989 0.267 1.00 0.26 C ATOM 1881 O GLN A 116 8.949 11.792 1.456 1.00 0.33 O ATOM 1882 CB GLN A 116 6.649 12.192 -0.309 1.00 0.45 C ATOM 1883 CG GLN A 116 6.191 11.579 1.029 1.00 2.19 C ATOM 1884 CD GLN A 116 4.679 11.597 1.231 1.00 2.32 C ATOM 1885 OE1 GLN A 116 3.938 12.320 0.580 1.00 2.27 O ATOM 1886 NE2 GLN A 116 4.178 10.779 2.149 1.00 3.01 N ATOM 0 H GLN A 116 7.688 9.744 -0.486 1.00 0.29 H new ATOM 0 HA GLN A 116 8.320 12.446 -1.600 1.00 0.31 H new ATOM 0 HB2 GLN A 116 6.614 13.278 -0.223 1.00 0.45 H new ATOM 0 HB3 GLN A 116 5.934 11.911 -1.082 1.00 0.45 H new ATOM 0 HG2 GLN A 116 6.543 10.549 1.085 1.00 2.19 H new ATOM 0 HG3 GLN A 116 6.664 12.122 1.847 1.00 2.19 H new ATOM 0 HE21 GLN A 116 4.799 10.178 2.690 1.00 3.01 H new ATOM 0 HE22 GLN A 116 3.172 10.752 2.313 1.00 3.01 H new ATOM 1895 N PRO A 117 10.398 12.389 -0.121 1.00 0.25 N ATOM 1896 CA PRO A 117 11.487 12.600 0.828 1.00 0.26 C ATOM 1897 C PRO A 117 11.324 13.880 1.660 1.00 0.37 C ATOM 1898 O PRO A 117 12.184 14.173 2.482 1.00 0.65 O ATOM 1899 CB PRO A 117 12.772 12.594 -0.008 1.00 0.34 C ATOM 1900 CG PRO A 117 12.288 13.123 -1.359 1.00 0.39 C ATOM 1901 CD PRO A 117 10.878 12.541 -1.484 1.00 0.32 C ATOM 0 HA PRO A 117 11.503 11.811 1.580 1.00 0.26 H new ATOM 0 HB2 PRO A 117 13.542 13.232 0.426 1.00 0.34 H new ATOM 0 HB3 PRO A 117 13.197 11.594 -0.092 1.00 0.34 H new ATOM 0 HG2 PRO A 117 12.276 14.213 -1.383 1.00 0.39 H new ATOM 0 HG3 PRO A 117 12.932 12.793 -2.174 1.00 0.39 H new ATOM 0 HD2 PRO A 117 10.229 13.204 -2.057 1.00 0.32 H new ATOM 0 HD3 PRO A 117 10.894 11.583 -2.004 1.00 0.32 H new ATOM 1909 N GLU A 118 10.231 14.628 1.486 1.00 0.31 N ATOM 1910 CA GLU A 118 9.920 15.820 2.265 1.00 0.39 C ATOM 1911 C GLU A 118 9.801 15.507 3.759 1.00 0.36 C ATOM 1912 O GLU A 118 10.490 16.123 4.569 1.00 0.56 O ATOM 1913 CB GLU A 118 8.668 16.497 1.689 1.00 0.46 C ATOM 1914 CG GLU A 118 7.415 15.607 1.718 1.00 2.24 C ATOM 1915 CD GLU A 118 6.373 16.068 0.699 1.00 2.82 C ATOM 1916 OE1 GLU A 118 6.714 16.024 -0.503 1.00 3.30 O ATOM 1917 OE2 GLU A 118 5.258 16.436 1.131 1.00 3.69 O ATOM 0 H GLU A 118 9.524 14.413 0.782 1.00 0.31 H new ATOM 0 HA GLU A 118 10.746 16.527 2.185 1.00 0.39 H new ATOM 0 HB2 GLU A 118 8.468 17.409 2.251 1.00 0.46 H new ATOM 0 HB3 GLU A 118 8.868 16.794 0.660 1.00 0.46 H new ATOM 0 HG2 GLU A 118 7.696 14.575 1.510 1.00 2.24 H new ATOM 0 HG3 GLU A 118 6.980 15.623 2.717 1.00 2.24 H new ATOM 1924 N HIS A 119 8.934 14.567 4.140 1.00 0.22 N ATOM 1925 CA HIS A 119 8.808 14.123 5.524 1.00 0.20 C ATOM 1926 C HIS A 119 8.098 12.762 5.587 1.00 0.21 C ATOM 1927 O HIS A 119 6.970 12.654 6.069 1.00 0.28 O ATOM 1928 CB HIS A 119 8.097 15.200 6.360 1.00 0.28 C ATOM 1929 CG HIS A 119 6.816 15.737 5.769 1.00 0.85 C ATOM 1930 ND1 HIS A 119 5.653 15.029 5.573 1.00 2.13 N ATOM 1931 CD2 HIS A 119 6.598 17.020 5.346 1.00 1.44 C ATOM 1932 CE1 HIS A 119 4.753 15.872 5.036 1.00 2.45 C ATOM 1933 NE2 HIS A 119 5.277 17.100 4.899 1.00 1.91 N ATOM 0 H HIS A 119 8.301 14.094 3.496 1.00 0.22 H new ATOM 0 HA HIS A 119 9.799 13.982 5.955 1.00 0.20 H new ATOM 0 HB2 HIS A 119 7.878 14.786 7.344 1.00 0.28 H new ATOM 0 HB3 HIS A 119 8.785 16.032 6.510 1.00 0.28 H new ATOM 0 HD1 HIS A 119 5.501 14.045 5.794 1.00 2.13 H new ATOM 0 HD2 HIS A 119 7.317 17.825 5.356 1.00 1.44 H new ATOM 0 HE1 HIS A 119 3.747 15.598 4.754 1.00 2.45 H new ATOM 1941 N PRO A 120 8.734 11.703 5.077 1.00 0.17 N ATOM 1942 CA PRO A 120 8.174 10.364 5.092 1.00 0.17 C ATOM 1943 C PRO A 120 8.442 9.680 6.440 1.00 0.18 C ATOM 1944 O PRO A 120 9.034 10.272 7.340 1.00 0.24 O ATOM 1945 CB PRO A 120 8.888 9.664 3.943 1.00 0.16 C ATOM 1946 CG PRO A 120 10.281 10.282 3.987 1.00 0.17 C ATOM 1947 CD PRO A 120 10.031 11.720 4.428 1.00 0.18 C ATOM 0 HA PRO A 120 7.091 10.346 4.973 1.00 0.17 H new ATOM 0 HB2 PRO A 120 8.920 8.584 4.084 1.00 0.16 H new ATOM 0 HB3 PRO A 120 8.394 9.846 2.988 1.00 0.16 H new ATOM 0 HG2 PRO A 120 10.929 9.756 4.688 1.00 0.17 H new ATOM 0 HG3 PRO A 120 10.767 10.242 3.012 1.00 0.17 H new ATOM 0 HD2 PRO A 120 10.808 12.062 5.112 1.00 0.18 H new ATOM 0 HD3 PRO A 120 10.035 12.399 3.575 1.00 0.18 H new ATOM 1955 N LEU A 121 8.023 8.416 6.575 1.00 0.16 N ATOM 1956 CA LEU A 121 8.148 7.642 7.809 1.00 0.17 C ATOM 1957 C LEU A 121 9.608 7.511 8.223 1.00 0.20 C ATOM 1958 O LEU A 121 9.971 7.785 9.363 1.00 0.30 O ATOM 1959 CB LEU A 121 7.519 6.247 7.625 1.00 0.16 C ATOM 1960 CG LEU A 121 6.320 6.060 8.555 1.00 0.22 C ATOM 1961 CD1 LEU A 121 5.519 4.838 8.116 1.00 0.52 C ATOM 1962 CD2 LEU A 121 6.747 5.875 10.010 1.00 0.50 C ATOM 0 H LEU A 121 7.581 7.897 5.816 1.00 0.16 H new ATOM 0 HA LEU A 121 7.616 8.170 8.600 1.00 0.17 H new ATOM 0 HB2 LEU A 121 7.204 6.120 6.589 1.00 0.16 H new ATOM 0 HB3 LEU A 121 8.265 5.478 7.828 1.00 0.16 H new ATOM 0 HG LEU A 121 5.712 6.962 8.491 1.00 0.22 H new ATOM 0 HD11 LEU A 121 4.664 4.705 8.780 1.00 0.52 H new ATOM 0 HD12 LEU A 121 5.166 4.982 7.095 1.00 0.52 H new ATOM 0 HD13 LEU A 121 6.153 3.952 8.160 1.00 0.52 H new ATOM 0 HD21 LEU A 121 5.863 5.746 10.635 1.00 0.50 H new ATOM 0 HD22 LEU A 121 7.383 4.993 10.093 1.00 0.50 H new ATOM 0 HD23 LEU A 121 7.300 6.754 10.341 1.00 0.50 H new ATOM 1974 N ARG A 122 10.446 7.068 7.289 1.00 0.20 N ATOM 1975 CA ARG A 122 11.879 6.964 7.488 1.00 0.22 C ATOM 1976 C ARG A 122 12.537 7.921 6.519 1.00 0.21 C ATOM 1977 O ARG A 122 12.797 7.557 5.373 1.00 0.22 O ATOM 1978 CB ARG A 122 12.348 5.528 7.240 1.00 0.25 C ATOM 1979 CG ARG A 122 12.072 4.608 8.439 1.00 0.31 C ATOM 1980 CD ARG A 122 13.349 3.868 8.860 1.00 0.44 C ATOM 1981 NE ARG A 122 14.348 4.786 9.444 1.00 0.92 N ATOM 1982 CZ ARG A 122 14.378 5.195 10.719 1.00 1.32 C ATOM 1983 NH1 ARG A 122 15.328 6.029 11.136 1.00 1.77 N ATOM 1984 NH2 ARG A 122 13.451 4.776 11.581 1.00 2.17 N ATOM 0 H ARG A 122 10.140 6.769 6.363 1.00 0.20 H new ATOM 0 HA ARG A 122 12.148 7.219 8.513 1.00 0.22 H new ATOM 0 HB2 ARG A 122 11.846 5.132 6.358 1.00 0.25 H new ATOM 0 HB3 ARG A 122 13.417 5.529 7.025 1.00 0.25 H new ATOM 0 HG2 ARG A 122 11.694 5.196 9.275 1.00 0.31 H new ATOM 0 HG3 ARG A 122 11.297 3.887 8.180 1.00 0.31 H new ATOM 0 HD2 ARG A 122 13.098 3.094 9.586 1.00 0.44 H new ATOM 0 HD3 ARG A 122 13.780 3.365 7.994 1.00 0.44 H new ATOM 0 HE ARG A 122 15.077 5.138 8.824 1.00 0.92 H new ATOM 0 HH11 ARG A 122 16.038 6.360 10.483 1.00 1.77 H new ATOM 0 HH12 ARG A 122 15.346 6.337 12.108 1.00 1.77 H new ATOM 0 HH21 ARG A 122 12.715 4.141 11.270 1.00 2.17 H new ATOM 0 HH22 ARG A 122 13.478 5.090 12.551 1.00 2.17 H new ATOM 1998 N ALA A 123 12.835 9.133 6.988 1.00 0.24 N ATOM 1999 CA ALA A 123 13.571 10.100 6.196 1.00 0.23 C ATOM 2000 C ALA A 123 14.850 9.470 5.647 1.00 0.24 C ATOM 2001 O ALA A 123 15.167 9.714 4.495 1.00 0.23 O ATOM 2002 CB ALA A 123 13.856 11.361 7.015 1.00 0.25 C ATOM 0 H ALA A 123 12.574 9.463 7.917 1.00 0.24 H new ATOM 0 HA ALA A 123 12.962 10.401 5.344 1.00 0.23 H new ATOM 0 HB1 ALA A 123 14.409 12.075 6.404 1.00 0.25 H new ATOM 0 HB2 ALA A 123 12.915 11.809 7.333 1.00 0.25 H new ATOM 0 HB3 ALA A 123 14.448 11.099 7.892 1.00 0.25 H new ATOM 2008 N ASP A 124 15.543 8.622 6.416 1.00 0.28 N ATOM 2009 CA ASP A 124 16.765 7.935 5.980 1.00 0.31 C ATOM 2010 C ASP A 124 16.600 7.234 4.639 1.00 0.30 C ATOM 2011 O ASP A 124 17.382 7.458 3.724 1.00 0.31 O ATOM 2012 CB ASP A 124 17.180 6.875 7.002 1.00 0.49 C ATOM 2013 CG ASP A 124 17.530 7.481 8.348 1.00 1.20 C ATOM 2014 OD1 ASP A 124 18.714 7.805 8.562 1.00 2.06 O ATOM 2015 OD2 ASP A 124 16.573 7.586 9.149 1.00 2.55 O ATOM 0 H ASP A 124 15.268 8.391 7.370 1.00 0.28 H new ATOM 0 HA ASP A 124 17.524 8.712 5.885 1.00 0.31 H new ATOM 0 HB2 ASP A 124 16.369 6.158 7.128 1.00 0.49 H new ATOM 0 HB3 ASP A 124 18.038 6.322 6.621 1.00 0.49 H new ATOM 2020 N LEU A 125 15.597 6.366 4.494 1.00 0.29 N ATOM 2021 CA LEU A 125 15.374 5.664 3.240 1.00 0.30 C ATOM 2022 C LEU A 125 15.126 6.657 2.094 1.00 0.30 C ATOM 2023 O LEU A 125 15.420 6.378 0.934 1.00 0.39 O ATOM 2024 CB LEU A 125 14.203 4.692 3.437 1.00 0.30 C ATOM 2025 CG LEU A 125 14.536 3.551 4.409 1.00 0.47 C ATOM 2026 CD1 LEU A 125 13.267 2.764 4.731 1.00 1.35 C ATOM 2027 CD2 LEU A 125 15.589 2.624 3.814 1.00 1.19 C ATOM 0 H LEU A 125 14.930 6.136 5.231 1.00 0.29 H new ATOM 0 HA LEU A 125 16.260 5.095 2.959 1.00 0.30 H new ATOM 0 HB2 LEU A 125 13.339 5.242 3.811 1.00 0.30 H new ATOM 0 HB3 LEU A 125 13.920 4.271 2.472 1.00 0.30 H new ATOM 0 HG LEU A 125 14.939 3.980 5.326 1.00 0.47 H new ATOM 0 HD11 LEU A 125 13.506 1.955 5.421 1.00 1.35 H new ATOM 0 HD12 LEU A 125 12.534 3.428 5.190 1.00 1.35 H new ATOM 0 HD13 LEU A 125 12.854 2.347 3.812 1.00 1.35 H new ATOM 0 HD21 LEU A 125 15.809 1.823 4.520 1.00 1.19 H new ATOM 0 HD22 LEU A 125 15.213 2.196 2.885 1.00 1.19 H new ATOM 0 HD23 LEU A 125 16.499 3.189 3.611 1.00 1.19 H new ATOM 2039 N ALA A 126 14.587 7.831 2.422 1.00 0.23 N ATOM 2040 CA ALA A 126 14.326 8.915 1.491 1.00 0.21 C ATOM 2041 C ALA A 126 15.597 9.704 1.177 1.00 0.21 C ATOM 2042 O ALA A 126 15.708 10.312 0.118 1.00 0.22 O ATOM 2043 CB ALA A 126 13.255 9.830 2.084 1.00 0.18 C ATOM 0 H ALA A 126 14.312 8.056 3.378 1.00 0.23 H new ATOM 0 HA ALA A 126 13.971 8.494 0.550 1.00 0.21 H new ATOM 0 HB1 ALA A 126 13.051 10.648 1.393 1.00 0.18 H new ATOM 0 HB2 ALA A 126 12.341 9.260 2.251 1.00 0.18 H new ATOM 0 HB3 ALA A 126 13.608 10.236 3.032 1.00 0.18 H new ATOM 2049 N GLU A 127 16.547 9.717 2.103 1.00 0.23 N ATOM 2050 CA GLU A 127 17.840 10.352 1.973 1.00 0.24 C ATOM 2051 C GLU A 127 18.683 9.530 1.023 1.00 0.25 C ATOM 2052 O GLU A 127 19.117 10.052 0.008 1.00 0.28 O ATOM 2053 CB GLU A 127 18.529 10.510 3.330 1.00 0.28 C ATOM 2054 CG GLU A 127 17.723 11.486 4.188 1.00 0.32 C ATOM 2055 CD GLU A 127 18.507 12.772 4.445 1.00 0.70 C ATOM 2056 OE1 GLU A 127 18.731 13.502 3.451 1.00 2.01 O ATOM 2057 OE2 GLU A 127 18.905 13.004 5.604 1.00 1.51 O ATOM 0 H GLU A 127 16.425 9.261 3.007 1.00 0.23 H new ATOM 0 HA GLU A 127 17.710 11.358 1.574 1.00 0.24 H new ATOM 0 HB2 GLU A 127 18.604 9.544 3.829 1.00 0.28 H new ATOM 0 HB3 GLU A 127 19.546 10.879 3.195 1.00 0.28 H new ATOM 0 HG2 GLU A 127 16.784 11.723 3.689 1.00 0.32 H new ATOM 0 HG3 GLU A 127 17.469 11.015 5.138 1.00 0.32 H new ATOM 2064 N GLU A 128 18.872 8.237 1.298 1.00 0.25 N ATOM 2065 CA GLU A 128 19.604 7.342 0.407 1.00 0.26 C ATOM 2066 C GLU A 128 19.017 7.444 -1.003 1.00 0.24 C ATOM 2067 O GLU A 128 19.746 7.437 -1.990 1.00 0.26 O ATOM 2068 CB GLU A 128 19.527 5.898 0.936 1.00 0.33 C ATOM 2069 CG GLU A 128 20.568 4.980 0.261 1.00 0.46 C ATOM 2070 CD GLU A 128 20.252 3.478 0.370 1.00 1.63 C ATOM 2071 OE1 GLU A 128 19.309 3.120 1.107 1.00 2.65 O ATOM 2072 OE2 GLU A 128 20.941 2.689 -0.319 1.00 2.43 O ATOM 0 H GLU A 128 18.522 7.785 2.143 1.00 0.25 H new ATOM 0 HA GLU A 128 20.654 7.632 0.370 1.00 0.26 H new ATOM 0 HB2 GLU A 128 19.688 5.898 2.014 1.00 0.33 H new ATOM 0 HB3 GLU A 128 18.527 5.501 0.763 1.00 0.33 H new ATOM 0 HG2 GLU A 128 20.643 5.248 -0.793 1.00 0.46 H new ATOM 0 HG3 GLU A 128 21.544 5.167 0.708 1.00 0.46 H new ATOM 2079 N TYR A 129 17.694 7.593 -1.097 1.00 0.23 N ATOM 2080 CA TYR A 129 17.020 7.747 -2.380 1.00 0.23 C ATOM 2081 C TYR A 129 17.419 9.066 -3.044 1.00 0.23 C ATOM 2082 O TYR A 129 17.906 9.097 -4.169 1.00 0.29 O ATOM 2083 CB TYR A 129 15.508 7.702 -2.142 1.00 0.23 C ATOM 2084 CG TYR A 129 14.655 7.850 -3.386 1.00 0.69 C ATOM 2085 CD1 TYR A 129 14.504 6.758 -4.254 1.00 1.78 C ATOM 2086 CD2 TYR A 129 13.997 9.060 -3.672 1.00 1.89 C ATOM 2087 CE1 TYR A 129 13.698 6.846 -5.399 1.00 2.16 C ATOM 2088 CE2 TYR A 129 13.196 9.169 -4.824 1.00 2.29 C ATOM 2089 CZ TYR A 129 13.036 8.061 -5.688 1.00 1.90 C ATOM 2090 OH TYR A 129 12.252 8.178 -6.795 1.00 2.49 O ATOM 0 H TYR A 129 17.068 7.610 -0.292 1.00 0.23 H new ATOM 0 HA TYR A 129 17.314 6.938 -3.049 1.00 0.23 H new ATOM 0 HB2 TYR A 129 15.260 6.756 -1.661 1.00 0.23 H new ATOM 0 HB3 TYR A 129 15.243 8.494 -1.442 1.00 0.23 H new ATOM 0 HD1 TYR A 129 15.017 5.833 -4.037 1.00 1.78 H new ATOM 0 HD2 TYR A 129 14.106 9.905 -3.008 1.00 1.89 H new ATOM 0 HE1 TYR A 129 13.585 5.994 -6.053 1.00 2.16 H new ATOM 0 HE2 TYR A 129 12.702 10.102 -5.049 1.00 2.29 H new ATOM 0 HH TYR A 129 11.875 9.082 -6.835 1.00 2.49 H new ATOM 2100 N SER A 130 17.182 10.171 -2.345 1.00 0.23 N ATOM 2101 CA SER A 130 17.330 11.531 -2.835 1.00 0.27 C ATOM 2102 C SER A 130 18.752 11.721 -3.349 1.00 0.33 C ATOM 2103 O SER A 130 18.972 12.152 -4.483 1.00 0.66 O ATOM 2104 CB SER A 130 16.969 12.483 -1.679 1.00 0.35 C ATOM 2105 OG SER A 130 17.365 13.816 -1.939 1.00 0.77 O ATOM 0 H SER A 130 16.867 10.138 -1.376 1.00 0.23 H new ATOM 0 HA SER A 130 16.665 11.746 -3.671 1.00 0.27 H new ATOM 0 HB2 SER A 130 15.893 12.453 -1.508 1.00 0.35 H new ATOM 0 HB3 SER A 130 17.447 12.136 -0.763 1.00 0.35 H new ATOM 0 HG SER A 130 17.115 14.385 -1.181 1.00 0.77 H new ATOM 2111 N LYS A 131 19.706 11.357 -2.495 1.00 0.30 N ATOM 2112 CA LYS A 131 21.131 11.403 -2.754 1.00 0.30 C ATOM 2113 C LYS A 131 21.459 10.473 -3.916 1.00 0.30 C ATOM 2114 O LYS A 131 22.217 10.863 -4.802 1.00 0.37 O ATOM 2115 CB LYS A 131 21.925 11.027 -1.484 1.00 0.34 C ATOM 2116 CG LYS A 131 22.120 12.205 -0.509 1.00 0.55 C ATOM 2117 CD LYS A 131 20.856 12.589 0.268 1.00 0.82 C ATOM 2118 CE LYS A 131 21.112 13.782 1.192 1.00 1.34 C ATOM 2119 NZ LYS A 131 19.890 14.590 1.376 1.00 2.41 N ATOM 0 H LYS A 131 19.489 11.007 -1.562 1.00 0.30 H new ATOM 0 HA LYS A 131 21.422 12.417 -3.027 1.00 0.30 H new ATOM 0 HB2 LYS A 131 21.406 10.220 -0.967 1.00 0.34 H new ATOM 0 HB3 LYS A 131 22.902 10.642 -1.777 1.00 0.34 H new ATOM 0 HG2 LYS A 131 22.906 11.949 0.201 1.00 0.55 H new ATOM 0 HG3 LYS A 131 22.467 13.073 -1.069 1.00 0.55 H new ATOM 0 HD2 LYS A 131 20.057 12.833 -0.432 1.00 0.82 H new ATOM 0 HD3 LYS A 131 20.515 11.737 0.856 1.00 0.82 H new ATOM 0 HE2 LYS A 131 21.464 13.426 2.160 1.00 1.34 H new ATOM 0 HE3 LYS A 131 21.903 14.405 0.774 1.00 1.34 H new ATOM 0 HZ1 LYS A 131 20.133 15.484 1.848 1.00 2.41 H new ATOM 0 HZ2 LYS A 131 19.465 14.792 0.449 1.00 2.41 H new ATOM 0 HZ3 LYS A 131 19.210 14.063 1.961 1.00 2.41 H new ATOM 2133 N ASP A 132 20.936 9.244 -3.923 1.00 0.26 N ATOM 2134 CA ASP A 132 21.375 8.265 -4.908 1.00 0.32 C ATOM 2135 C ASP A 132 20.324 7.194 -5.209 1.00 0.32 C ATOM 2136 O ASP A 132 20.413 6.038 -4.787 1.00 0.40 O ATOM 2137 CB ASP A 132 22.683 7.631 -4.441 1.00 0.41 C ATOM 2138 CG ASP A 132 23.355 6.842 -5.560 1.00 0.57 C ATOM 2139 OD1 ASP A 132 24.490 6.373 -5.298 1.00 1.86 O ATOM 2140 OD2 ASP A 132 22.744 6.734 -6.654 1.00 1.60 O ATOM 0 H ASP A 132 20.224 8.913 -3.272 1.00 0.26 H new ATOM 0 HA ASP A 132 21.532 8.795 -5.848 1.00 0.32 H new ATOM 0 HB2 ASP A 132 23.359 8.409 -4.087 1.00 0.41 H new ATOM 0 HB3 ASP A 132 22.487 6.971 -3.596 1.00 0.41 H new ATOM 2145 N ARG A 133 19.366 7.544 -6.069 1.00 0.29 N ATOM 2146 CA ARG A 133 18.332 6.610 -6.495 1.00 0.29 C ATOM 2147 C ARG A 133 18.901 5.366 -7.173 1.00 0.31 C ATOM 2148 O ARG A 133 18.156 4.407 -7.341 1.00 0.34 O ATOM 2149 CB ARG A 133 17.292 7.254 -7.426 1.00 0.31 C ATOM 2150 CG ARG A 133 16.441 8.340 -6.751 1.00 0.51 C ATOM 2151 CD ARG A 133 16.968 9.770 -6.918 1.00 1.24 C ATOM 2152 NE ARG A 133 16.833 10.218 -8.311 1.00 1.65 N ATOM 2153 CZ ARG A 133 17.557 11.178 -8.898 1.00 2.62 C ATOM 2154 NH1 ARG A 133 17.348 11.461 -10.186 1.00 3.58 N ATOM 2155 NH2 ARG A 133 18.482 11.847 -8.205 1.00 3.54 N ATOM 0 H ARG A 133 19.288 8.473 -6.484 1.00 0.29 H new ATOM 0 HA ARG A 133 17.837 6.311 -5.571 1.00 0.29 H new ATOM 0 HB2 ARG A 133 17.806 7.689 -8.283 1.00 0.31 H new ATOM 0 HB3 ARG A 133 16.632 6.476 -7.811 1.00 0.31 H new ATOM 0 HG2 ARG A 133 15.430 8.292 -7.155 1.00 0.51 H new ATOM 0 HG3 ARG A 133 16.370 8.116 -5.687 1.00 0.51 H new ATOM 0 HD2 ARG A 133 16.419 10.444 -6.260 1.00 1.24 H new ATOM 0 HD3 ARG A 133 18.015 9.814 -6.617 1.00 1.24 H new ATOM 0 HE ARG A 133 16.124 9.756 -8.881 1.00 1.65 H new ATOM 0 HH11 ARG A 133 16.642 10.947 -10.713 1.00 3.58 H new ATOM 0 HH12 ARG A 133 17.895 12.191 -10.643 1.00 3.58 H new ATOM 0 HH21 ARG A 133 18.640 11.627 -7.222 1.00 3.54 H new ATOM 0 HH22 ARG A 133 19.030 12.578 -8.659 1.00 3.54 H new ATOM 2169 N LYS A 134 20.175 5.321 -7.584 1.00 0.34 N ATOM 2170 CA LYS A 134 20.691 4.076 -8.142 1.00 0.34 C ATOM 2171 C LYS A 134 20.765 3.015 -7.065 1.00 0.32 C ATOM 2172 O LYS A 134 20.410 1.871 -7.345 1.00 0.39 O ATOM 2173 CB LYS A 134 22.057 4.251 -8.806 1.00 0.39 C ATOM 2174 CG LYS A 134 21.882 4.806 -10.229 1.00 0.55 C ATOM 2175 CD LYS A 134 22.682 6.086 -10.471 1.00 1.80 C ATOM 2176 CE LYS A 134 22.065 7.246 -9.687 1.00 3.05 C ATOM 2177 NZ LYS A 134 22.831 8.494 -9.871 1.00 4.11 N ATOM 0 H LYS A 134 20.837 6.096 -7.543 1.00 0.34 H new ATOM 0 HA LYS A 134 19.996 3.761 -8.921 1.00 0.34 H new ATOM 0 HB2 LYS A 134 22.673 4.929 -8.216 1.00 0.39 H new ATOM 0 HB3 LYS A 134 22.579 3.295 -8.841 1.00 0.39 H new ATOM 0 HG2 LYS A 134 22.191 4.049 -10.949 1.00 0.55 H new ATOM 0 HG3 LYS A 134 20.825 5.004 -10.409 1.00 0.55 H new ATOM 0 HD2 LYS A 134 23.718 5.940 -10.165 1.00 1.80 H new ATOM 0 HD3 LYS A 134 22.694 6.321 -11.535 1.00 1.80 H new ATOM 0 HE2 LYS A 134 21.036 7.399 -10.012 1.00 3.05 H new ATOM 0 HE3 LYS A 134 22.031 6.992 -8.627 1.00 3.05 H new ATOM 0 HZ1 LYS A 134 22.385 9.259 -9.326 1.00 4.11 H new ATOM 0 HZ2 LYS A 134 23.806 8.355 -9.538 1.00 4.11 H new ATOM 0 HZ3 LYS A 134 22.842 8.749 -10.879 1.00 4.11 H new ATOM 2191 N LYS A 135 21.212 3.356 -5.852 1.00 0.29 N ATOM 2192 CA LYS A 135 21.159 2.360 -4.793 1.00 0.29 C ATOM 2193 C LYS A 135 19.727 1.967 -4.543 1.00 0.27 C ATOM 2194 O LYS A 135 19.454 0.790 -4.429 1.00 0.35 O ATOM 2195 CB LYS A 135 21.778 2.815 -3.474 1.00 0.37 C ATOM 2196 CG LYS A 135 23.301 2.666 -3.497 1.00 0.50 C ATOM 2197 CD LYS A 135 24.005 3.996 -3.724 1.00 1.16 C ATOM 2198 CE LYS A 135 25.205 4.157 -2.796 1.00 1.44 C ATOM 2199 NZ LYS A 135 25.923 5.401 -3.140 1.00 2.86 N ATOM 0 H LYS A 135 21.594 4.265 -5.592 1.00 0.29 H new ATOM 0 HA LYS A 135 21.753 1.517 -5.146 1.00 0.29 H new ATOM 0 HB2 LYS A 135 21.515 3.856 -3.286 1.00 0.37 H new ATOM 0 HB3 LYS A 135 21.365 2.228 -2.654 1.00 0.37 H new ATOM 0 HG2 LYS A 135 23.637 2.236 -2.554 1.00 0.50 H new ATOM 0 HG3 LYS A 135 23.584 1.968 -4.285 1.00 0.50 H new ATOM 0 HD2 LYS A 135 24.334 4.063 -4.761 1.00 1.16 H new ATOM 0 HD3 LYS A 135 23.303 4.814 -3.559 1.00 1.16 H new ATOM 0 HE2 LYS A 135 24.875 4.189 -1.758 1.00 1.44 H new ATOM 0 HE3 LYS A 135 25.872 3.300 -2.892 1.00 1.44 H new ATOM 0 HZ1 LYS A 135 26.866 5.166 -3.511 1.00 2.86 H new ATOM 0 HZ2 LYS A 135 25.387 5.923 -3.862 1.00 2.86 H new ATOM 0 HZ3 LYS A 135 26.023 5.991 -2.289 1.00 2.86 H new ATOM 2213 N PHE A 136 18.797 2.910 -4.475 1.00 0.27 N ATOM 2214 CA PHE A 136 17.439 2.558 -4.097 1.00 0.27 C ATOM 2215 C PHE A 136 16.848 1.598 -5.118 1.00 0.25 C ATOM 2216 O PHE A 136 16.201 0.621 -4.762 1.00 0.27 O ATOM 2217 CB PHE A 136 16.565 3.800 -3.978 1.00 0.29 C ATOM 2218 CG PHE A 136 15.210 3.470 -3.387 1.00 0.83 C ATOM 2219 CD1 PHE A 136 14.957 3.754 -2.034 1.00 2.66 C ATOM 2220 CD2 PHE A 136 14.213 2.861 -4.175 1.00 1.62 C ATOM 2221 CE1 PHE A 136 13.723 3.404 -1.468 1.00 3.27 C ATOM 2222 CE2 PHE A 136 12.997 2.470 -3.595 1.00 1.90 C ATOM 2223 CZ PHE A 136 12.759 2.732 -2.238 1.00 2.30 C ATOM 0 H PHE A 136 18.953 3.899 -4.671 1.00 0.27 H new ATOM 0 HA PHE A 136 17.471 2.071 -3.122 1.00 0.27 H new ATOM 0 HB2 PHE A 136 17.065 4.540 -3.353 1.00 0.29 H new ATOM 0 HB3 PHE A 136 16.434 4.250 -4.962 1.00 0.29 H new ATOM 0 HD1 PHE A 136 15.711 4.240 -1.432 1.00 2.66 H new ATOM 0 HD2 PHE A 136 14.386 2.695 -5.228 1.00 1.62 H new ATOM 0 HE1 PHE A 136 13.513 3.651 -0.438 1.00 3.27 H new ATOM 0 HE2 PHE A 136 12.248 1.970 -4.191 1.00 1.90 H new ATOM 0 HZ PHE A 136 11.832 2.416 -1.783 1.00 2.30 H new ATOM 2233 N CYS A 137 17.047 1.899 -6.398 1.00 0.25 N ATOM 2234 CA CYS A 137 16.529 1.097 -7.483 1.00 0.25 C ATOM 2235 C CYS A 137 17.119 -0.302 -7.383 1.00 0.23 C ATOM 2236 O CYS A 137 16.382 -1.274 -7.458 1.00 0.28 O ATOM 2237 CB CYS A 137 16.860 1.738 -8.834 1.00 0.29 C ATOM 2238 SG CYS A 137 15.977 0.863 -10.162 1.00 1.74 S ATOM 0 H CYS A 137 17.577 2.714 -6.705 1.00 0.25 H new ATOM 0 HA CYS A 137 15.443 1.036 -7.409 1.00 0.25 H new ATOM 0 HB2 CYS A 137 16.576 2.790 -8.827 1.00 0.29 H new ATOM 0 HB3 CYS A 137 17.935 1.699 -9.012 1.00 0.29 H new ATOM 0 HG CYS A 137 16.260 1.412 -11.306 1.00 1.74 H new ATOM 2244 N LYS A 138 18.441 -0.416 -7.230 1.00 0.23 N ATOM 2245 CA LYS A 138 19.071 -1.738 -7.303 1.00 0.24 C ATOM 2246 C LYS A 138 18.721 -2.554 -6.061 1.00 0.24 C ATOM 2247 O LYS A 138 18.360 -3.726 -6.149 1.00 0.26 O ATOM 2248 CB LYS A 138 20.590 -1.623 -7.503 1.00 0.32 C ATOM 2249 CG LYS A 138 20.952 -1.697 -8.996 1.00 0.63 C ATOM 2250 CD LYS A 138 20.590 -0.443 -9.806 1.00 1.18 C ATOM 2251 CE LYS A 138 21.707 0.605 -9.764 1.00 2.46 C ATOM 2252 NZ LYS A 138 22.883 0.184 -10.559 1.00 2.78 N ATOM 0 H LYS A 138 19.078 0.362 -7.060 1.00 0.23 H new ATOM 0 HA LYS A 138 18.679 -2.263 -8.174 1.00 0.24 H new ATOM 0 HB2 LYS A 138 20.946 -0.682 -7.084 1.00 0.32 H new ATOM 0 HB3 LYS A 138 21.094 -2.424 -6.962 1.00 0.32 H new ATOM 0 HG2 LYS A 138 22.023 -1.876 -9.088 1.00 0.63 H new ATOM 0 HG3 LYS A 138 20.446 -2.556 -9.437 1.00 0.63 H new ATOM 0 HD2 LYS A 138 20.394 -0.723 -10.841 1.00 1.18 H new ATOM 0 HD3 LYS A 138 19.670 -0.010 -9.413 1.00 1.18 H new ATOM 0 HE2 LYS A 138 21.330 1.554 -10.146 1.00 2.46 H new ATOM 0 HE3 LYS A 138 22.008 0.775 -8.730 1.00 2.46 H new ATOM 0 HZ1 LYS A 138 23.478 1.012 -10.763 1.00 2.78 H new ATOM 0 HZ2 LYS A 138 23.434 -0.514 -10.020 1.00 2.78 H new ATOM 0 HZ3 LYS A 138 22.564 -0.242 -11.453 1.00 2.78 H new ATOM 2266 N ASN A 139 18.805 -1.906 -4.906 1.00 0.25 N ATOM 2267 CA ASN A 139 18.363 -2.398 -3.611 1.00 0.28 C ATOM 2268 C ASN A 139 16.971 -2.992 -3.754 1.00 0.26 C ATOM 2269 O ASN A 139 16.766 -4.129 -3.352 1.00 0.32 O ATOM 2270 CB ASN A 139 18.361 -1.268 -2.564 1.00 0.39 C ATOM 2271 CG ASN A 139 19.740 -0.844 -2.067 1.00 0.62 C ATOM 2272 OD1 ASN A 139 20.736 -1.508 -2.331 1.00 1.36 O ATOM 2273 ND2 ASN A 139 19.801 0.265 -1.332 1.00 0.77 N ATOM 0 H ASN A 139 19.206 -0.970 -4.847 1.00 0.25 H new ATOM 0 HA ASN A 139 19.055 -3.167 -3.267 1.00 0.28 H new ATOM 0 HB2 ASN A 139 17.863 -0.398 -2.992 1.00 0.39 H new ATOM 0 HB3 ASN A 139 17.766 -1.587 -1.708 1.00 0.39 H new ATOM 0 HD21 ASN A 139 20.698 0.587 -0.969 1.00 0.77 H new ATOM 0 HD22 ASN A 139 18.951 0.792 -1.133 1.00 0.77 H new ATOM 2280 N ALA A 140 16.022 -2.244 -4.321 1.00 0.24 N ATOM 2281 CA ALA A 140 14.662 -2.697 -4.558 1.00 0.23 C ATOM 2282 C ALA A 140 14.629 -3.897 -5.496 1.00 0.22 C ATOM 2283 O ALA A 140 13.912 -4.838 -5.219 1.00 0.25 O ATOM 2284 CB ALA A 140 13.801 -1.565 -5.115 1.00 0.26 C ATOM 0 H ALA A 140 16.188 -1.287 -4.633 1.00 0.24 H new ATOM 0 HA ALA A 140 14.250 -3.009 -3.598 1.00 0.23 H new ATOM 0 HB1 ALA A 140 12.787 -1.928 -5.284 1.00 0.26 H new ATOM 0 HB2 ALA A 140 13.777 -0.741 -4.401 1.00 0.26 H new ATOM 0 HB3 ALA A 140 14.224 -1.216 -6.057 1.00 0.26 H new ATOM 2290 N GLU A 141 15.361 -3.892 -6.604 1.00 0.23 N ATOM 2291 CA GLU A 141 15.467 -5.009 -7.539 1.00 0.28 C ATOM 2292 C GLU A 141 15.701 -6.317 -6.787 1.00 0.29 C ATOM 2293 O GLU A 141 15.040 -7.327 -7.031 1.00 0.35 O ATOM 2294 CB GLU A 141 16.608 -4.697 -8.530 1.00 0.35 C ATOM 2295 CG GLU A 141 16.185 -4.837 -9.991 1.00 0.78 C ATOM 2296 CD GLU A 141 17.071 -4.015 -10.927 1.00 1.18 C ATOM 2297 OE1 GLU A 141 17.186 -2.786 -10.707 1.00 2.74 O ATOM 2298 OE2 GLU A 141 17.608 -4.657 -11.858 1.00 1.32 O ATOM 0 H GLU A 141 15.916 -3.084 -6.887 1.00 0.23 H new ATOM 0 HA GLU A 141 14.538 -5.134 -8.095 1.00 0.28 H new ATOM 0 HB2 GLU A 141 16.965 -3.682 -8.357 1.00 0.35 H new ATOM 0 HB3 GLU A 141 17.445 -5.367 -8.334 1.00 0.35 H new ATOM 0 HG2 GLU A 141 16.227 -5.887 -10.281 1.00 0.78 H new ATOM 0 HG3 GLU A 141 15.149 -4.518 -10.100 1.00 0.78 H new ATOM 2305 N GLU A 142 16.635 -6.275 -5.842 1.00 0.29 N ATOM 2306 CA GLU A 142 16.960 -7.413 -5.011 1.00 0.33 C ATOM 2307 C GLU A 142 15.862 -7.674 -3.984 1.00 0.32 C ATOM 2308 O GLU A 142 15.471 -8.817 -3.794 1.00 0.37 O ATOM 2309 CB GLU A 142 18.306 -7.173 -4.308 1.00 0.39 C ATOM 2310 CG GLU A 142 19.469 -7.890 -5.019 1.00 0.49 C ATOM 2311 CD GLU A 142 20.419 -8.575 -4.030 1.00 1.06 C ATOM 2312 OE1 GLU A 142 19.908 -9.195 -3.068 1.00 1.84 O ATOM 2313 OE2 GLU A 142 21.647 -8.465 -4.225 1.00 1.79 O ATOM 0 H GLU A 142 17.187 -5.442 -5.636 1.00 0.29 H new ATOM 0 HA GLU A 142 17.039 -8.295 -5.646 1.00 0.33 H new ATOM 0 HB2 GLU A 142 18.509 -6.103 -4.271 1.00 0.39 H new ATOM 0 HB3 GLU A 142 18.243 -7.521 -3.277 1.00 0.39 H new ATOM 0 HG2 GLU A 142 19.068 -8.633 -5.709 1.00 0.49 H new ATOM 0 HG3 GLU A 142 20.027 -7.169 -5.616 1.00 0.49 H new ATOM 2320 N PHE A 143 15.393 -6.647 -3.278 1.00 0.31 N ATOM 2321 CA PHE A 143 14.450 -6.779 -2.167 1.00 0.32 C ATOM 2322 C PHE A 143 13.143 -7.402 -2.641 1.00 0.27 C ATOM 2323 O PHE A 143 12.595 -8.291 -1.999 1.00 0.27 O ATOM 2324 CB PHE A 143 14.195 -5.407 -1.527 1.00 0.36 C ATOM 2325 CG PHE A 143 14.336 -5.345 -0.018 1.00 0.96 C ATOM 2326 CD1 PHE A 143 13.393 -4.633 0.745 1.00 0.91 C ATOM 2327 CD2 PHE A 143 15.477 -5.880 0.611 1.00 2.01 C ATOM 2328 CE1 PHE A 143 13.600 -4.451 2.123 1.00 1.67 C ATOM 2329 CE2 PHE A 143 15.673 -5.708 1.992 1.00 2.76 C ATOM 2330 CZ PHE A 143 14.736 -4.987 2.748 1.00 2.55 C ATOM 0 H PHE A 143 15.662 -5.681 -3.465 1.00 0.31 H new ATOM 0 HA PHE A 143 14.886 -7.439 -1.417 1.00 0.32 H new ATOM 0 HB2 PHE A 143 14.886 -4.688 -1.967 1.00 0.36 H new ATOM 0 HB3 PHE A 143 13.188 -5.085 -1.792 1.00 0.36 H new ATOM 0 HD1 PHE A 143 12.511 -4.227 0.272 1.00 0.91 H new ATOM 0 HD2 PHE A 143 16.205 -6.425 0.029 1.00 2.01 H new ATOM 0 HE1 PHE A 143 12.880 -3.895 2.705 1.00 1.67 H new ATOM 0 HE2 PHE A 143 16.544 -6.130 2.471 1.00 2.76 H new ATOM 0 HZ PHE A 143 14.889 -4.845 3.808 1.00 2.55 H new ATOM 2340 N THR A 144 12.665 -6.950 -3.793 1.00 0.25 N ATOM 2341 CA THR A 144 11.559 -7.521 -4.522 1.00 0.24 C ATOM 2342 C THR A 144 11.831 -9.010 -4.732 1.00 0.26 C ATOM 2343 O THR A 144 11.009 -9.844 -4.377 1.00 0.28 O ATOM 2344 CB THR A 144 11.385 -6.751 -5.841 1.00 0.26 C ATOM 2345 OG1 THR A 144 11.015 -5.411 -5.598 1.00 0.31 O ATOM 2346 CG2 THR A 144 10.283 -7.384 -6.671 1.00 0.26 C ATOM 0 H THR A 144 13.063 -6.135 -4.260 1.00 0.25 H new ATOM 0 HA THR A 144 10.623 -7.434 -3.970 1.00 0.24 H new ATOM 0 HB THR A 144 12.339 -6.785 -6.368 1.00 0.26 H new ATOM 0 HG1 THR A 144 11.818 -4.875 -5.430 1.00 0.31 H new ATOM 0 HG21 THR A 144 10.167 -6.832 -7.604 1.00 0.26 H new ATOM 0 HG22 THR A 144 10.543 -8.419 -6.892 1.00 0.26 H new ATOM 0 HG23 THR A 144 9.346 -7.356 -6.114 1.00 0.26 H new ATOM 2354 N LYS A 145 12.988 -9.377 -5.284 1.00 0.30 N ATOM 2355 CA LYS A 145 13.309 -10.785 -5.497 1.00 0.37 C ATOM 2356 C LYS A 145 13.457 -11.580 -4.189 1.00 0.39 C ATOM 2357 O LYS A 145 13.246 -12.788 -4.193 1.00 0.49 O ATOM 2358 CB LYS A 145 14.549 -10.857 -6.399 1.00 0.47 C ATOM 2359 CG LYS A 145 14.923 -12.273 -6.855 1.00 1.15 C ATOM 2360 CD LYS A 145 15.995 -12.903 -5.960 1.00 1.66 C ATOM 2361 CE LYS A 145 16.563 -14.143 -6.655 1.00 2.04 C ATOM 2362 NZ LYS A 145 17.700 -14.717 -5.904 1.00 3.19 N ATOM 0 H LYS A 145 13.711 -8.725 -5.588 1.00 0.30 H new ATOM 0 HA LYS A 145 12.473 -11.275 -5.997 1.00 0.37 H new ATOM 0 HB2 LYS A 145 14.378 -10.239 -7.280 1.00 0.47 H new ATOM 0 HB3 LYS A 145 15.396 -10.425 -5.866 1.00 0.47 H new ATOM 0 HG2 LYS A 145 14.033 -12.902 -6.851 1.00 1.15 H new ATOM 0 HG3 LYS A 145 15.284 -12.239 -7.883 1.00 1.15 H new ATOM 0 HD2 LYS A 145 16.791 -12.184 -5.764 1.00 1.66 H new ATOM 0 HD3 LYS A 145 15.567 -13.176 -4.995 1.00 1.66 H new ATOM 0 HE2 LYS A 145 15.779 -14.893 -6.759 1.00 2.04 H new ATOM 0 HE3 LYS A 145 16.887 -13.880 -7.662 1.00 2.04 H new ATOM 0 HZ1 LYS A 145 18.059 -15.555 -6.404 1.00 3.19 H new ATOM 0 HZ2 LYS A 145 18.458 -14.009 -5.827 1.00 3.19 H new ATOM 0 HZ3 LYS A 145 17.384 -14.991 -4.952 1.00 3.19 H new ATOM 2376 N LYS A 146 13.860 -10.951 -3.080 1.00 0.35 N ATOM 2377 CA LYS A 146 14.050 -11.609 -1.790 1.00 0.37 C ATOM 2378 C LYS A 146 12.695 -11.939 -1.168 1.00 0.35 C ATOM 2379 O LYS A 146 12.417 -13.086 -0.837 1.00 0.38 O ATOM 2380 CB LYS A 146 14.864 -10.691 -0.866 1.00 0.43 C ATOM 2381 CG LYS A 146 16.375 -10.846 -1.092 1.00 0.66 C ATOM 2382 CD LYS A 146 17.096 -9.506 -0.934 1.00 1.18 C ATOM 2383 CE LYS A 146 18.518 -9.692 -0.390 1.00 1.43 C ATOM 2384 NZ LYS A 146 19.327 -8.460 -0.506 1.00 2.43 N ATOM 0 H LYS A 146 14.066 -9.952 -3.057 1.00 0.35 H new ATOM 0 HA LYS A 146 14.596 -12.542 -1.931 1.00 0.37 H new ATOM 0 HB2 LYS A 146 14.576 -9.654 -1.038 1.00 0.43 H new ATOM 0 HB3 LYS A 146 14.627 -10.919 0.173 1.00 0.43 H new ATOM 0 HG2 LYS A 146 16.780 -11.566 -0.381 1.00 0.66 H new ATOM 0 HG3 LYS A 146 16.558 -11.245 -2.090 1.00 0.66 H new ATOM 0 HD2 LYS A 146 17.138 -8.999 -1.898 1.00 1.18 H new ATOM 0 HD3 LYS A 146 16.529 -8.864 -0.260 1.00 1.18 H new ATOM 0 HE2 LYS A 146 18.468 -9.994 0.656 1.00 1.43 H new ATOM 0 HE3 LYS A 146 19.010 -10.500 -0.932 1.00 1.43 H new ATOM 0 HZ1 LYS A 146 20.101 -8.486 0.189 1.00 2.43 H new ATOM 0 HZ2 LYS A 146 19.725 -8.395 -1.465 1.00 2.43 H new ATOM 0 HZ3 LYS A 146 18.726 -7.631 -0.324 1.00 2.43 H new ATOM 2398 N TYR A 147 11.896 -10.900 -0.938 1.00 0.32 N ATOM 2399 CA TYR A 147 10.679 -10.910 -0.145 1.00 0.33 C ATOM 2400 C TYR A 147 9.444 -10.457 -0.909 1.00 0.27 C ATOM 2401 O TYR A 147 8.339 -10.700 -0.435 1.00 0.39 O ATOM 2402 CB TYR A 147 10.869 -9.963 1.040 1.00 0.49 C ATOM 2403 CG TYR A 147 11.031 -10.703 2.336 1.00 0.50 C ATOM 2404 CD1 TYR A 147 9.925 -11.380 2.875 1.00 1.64 C ATOM 2405 CD2 TYR A 147 12.283 -10.761 2.965 1.00 2.03 C ATOM 2406 CE1 TYR A 147 10.065 -12.113 4.062 1.00 1.69 C ATOM 2407 CE2 TYR A 147 12.428 -11.491 4.153 1.00 2.04 C ATOM 2408 CZ TYR A 147 11.318 -12.161 4.716 1.00 0.66 C ATOM 2409 OH TYR A 147 11.456 -12.817 5.901 1.00 0.80 O ATOM 0 H TYR A 147 12.096 -9.977 -1.324 1.00 0.32 H new ATOM 0 HA TYR A 147 10.511 -11.943 0.160 1.00 0.33 H new ATOM 0 HB2 TYR A 147 11.746 -9.339 0.868 1.00 0.49 H new ATOM 0 HB3 TYR A 147 10.011 -9.294 1.110 1.00 0.49 H new ATOM 0 HD1 TYR A 147 8.968 -11.336 2.376 1.00 1.64 H new ATOM 0 HD2 TYR A 147 13.130 -10.246 2.537 1.00 2.03 H new ATOM 0 HE1 TYR A 147 9.218 -12.640 4.476 1.00 1.69 H new ATOM 0 HE2 TYR A 147 13.391 -11.542 4.640 1.00 2.04 H new ATOM 0 HH TYR A 147 12.385 -12.749 6.206 1.00 0.80 H new ATOM 2419 N GLY A 148 9.604 -9.710 -2.001 1.00 0.24 N ATOM 2420 CA GLY A 148 8.484 -9.198 -2.775 1.00 0.23 C ATOM 2421 C GLY A 148 7.587 -10.334 -3.255 1.00 0.23 C ATOM 2422 O GLY A 148 8.030 -11.466 -3.442 1.00 0.31 O ATOM 0 H GLY A 148 10.517 -9.445 -2.371 1.00 0.24 H new ATOM 0 HA2 GLY A 148 7.904 -8.504 -2.167 1.00 0.23 H new ATOM 0 HA3 GLY A 148 8.856 -8.637 -3.632 1.00 0.23 H new ATOM 2426 N GLU A 149 6.304 -10.035 -3.455 1.00 0.23 N ATOM 2427 CA GLU A 149 5.369 -11.028 -3.958 1.00 0.25 C ATOM 2428 C GLU A 149 5.711 -11.339 -5.416 1.00 0.28 C ATOM 2429 O GLU A 149 6.370 -10.563 -6.104 1.00 0.35 O ATOM 2430 CB GLU A 149 3.921 -10.521 -3.846 1.00 0.35 C ATOM 2431 CG GLU A 149 3.118 -11.223 -2.739 1.00 0.61 C ATOM 2432 CD GLU A 149 2.797 -12.707 -2.934 1.00 0.57 C ATOM 2433 OE1 GLU A 149 3.259 -13.278 -3.947 1.00 1.53 O ATOM 2434 OE2 GLU A 149 2.076 -13.240 -2.051 1.00 1.25 O ATOM 0 H GLU A 149 5.895 -9.118 -3.276 1.00 0.23 H new ATOM 0 HA GLU A 149 5.453 -11.935 -3.359 1.00 0.25 H new ATOM 0 HB2 GLU A 149 3.932 -9.448 -3.653 1.00 0.35 H new ATOM 0 HB3 GLU A 149 3.416 -10.668 -4.801 1.00 0.35 H new ATOM 0 HG2 GLU A 149 3.669 -11.118 -1.805 1.00 0.61 H new ATOM 0 HG3 GLU A 149 2.176 -10.688 -2.615 1.00 0.61 H new ATOM 2441 N LYS A 150 5.203 -12.446 -5.935 1.00 0.34 N ATOM 2442 CA LYS A 150 5.340 -12.772 -7.350 1.00 0.40 C ATOM 2443 C LYS A 150 4.181 -12.129 -8.104 1.00 0.36 C ATOM 2444 O LYS A 150 3.067 -12.658 -8.108 1.00 0.44 O ATOM 2445 CB LYS A 150 5.413 -14.288 -7.575 1.00 0.60 C ATOM 2446 CG LYS A 150 4.750 -15.094 -6.450 1.00 1.20 C ATOM 2447 CD LYS A 150 4.415 -16.515 -6.904 1.00 2.08 C ATOM 2448 CE LYS A 150 3.146 -16.521 -7.763 1.00 3.63 C ATOM 2449 NZ LYS A 150 1.957 -16.086 -6.994 1.00 5.19 N ATOM 0 H LYS A 150 4.688 -13.140 -5.394 1.00 0.34 H new ATOM 0 HA LYS A 150 6.279 -12.373 -7.733 1.00 0.40 H new ATOM 0 HB2 LYS A 150 4.932 -14.533 -8.522 1.00 0.60 H new ATOM 0 HB3 LYS A 150 6.458 -14.587 -7.662 1.00 0.60 H new ATOM 0 HG2 LYS A 150 5.416 -15.133 -5.588 1.00 1.20 H new ATOM 0 HG3 LYS A 150 3.839 -14.590 -6.127 1.00 1.20 H new ATOM 0 HD2 LYS A 150 5.248 -16.927 -7.474 1.00 2.08 H new ATOM 0 HD3 LYS A 150 4.275 -17.157 -6.034 1.00 2.08 H new ATOM 0 HE2 LYS A 150 3.285 -15.862 -8.620 1.00 3.63 H new ATOM 0 HE3 LYS A 150 2.978 -17.524 -8.155 1.00 3.63 H new ATOM 0 HZ1 LYS A 150 1.211 -16.806 -7.071 1.00 5.19 H new ATOM 0 HZ2 LYS A 150 2.216 -15.962 -5.995 1.00 5.19 H new ATOM 0 HZ3 LYS A 150 1.608 -15.184 -7.376 1.00 5.19 H new ATOM 2463 N ARG A 151 4.446 -10.972 -8.715 1.00 0.36 N ATOM 2464 CA ARG A 151 3.471 -10.230 -9.509 1.00 0.36 C ATOM 2465 C ARG A 151 2.995 -11.072 -10.698 1.00 0.47 C ATOM 2466 O ARG A 151 3.733 -11.941 -11.157 1.00 0.59 O ATOM 2467 CB ARG A 151 4.058 -8.857 -9.907 1.00 0.42 C ATOM 2468 CG ARG A 151 4.762 -8.700 -11.266 1.00 0.87 C ATOM 2469 CD ARG A 151 5.913 -9.681 -11.548 1.00 1.03 C ATOM 2470 NE ARG A 151 5.640 -10.497 -12.738 1.00 1.47 N ATOM 2471 CZ ARG A 151 6.313 -11.591 -13.104 1.00 2.03 C ATOM 2472 NH1 ARG A 151 5.780 -12.431 -13.989 1.00 2.69 N ATOM 2473 NH2 ARG A 151 7.517 -11.838 -12.591 1.00 2.96 N ATOM 0 H ARG A 151 5.359 -10.520 -8.670 1.00 0.36 H new ATOM 0 HA ARG A 151 2.579 -10.025 -8.917 1.00 0.36 H new ATOM 0 HB2 ARG A 151 3.245 -8.132 -9.875 1.00 0.42 H new ATOM 0 HB3 ARG A 151 4.771 -8.570 -9.134 1.00 0.42 H new ATOM 0 HG2 ARG A 151 4.016 -8.810 -12.054 1.00 0.87 H new ATOM 0 HG3 ARG A 151 5.152 -7.684 -11.335 1.00 0.87 H new ATOM 0 HD2 ARG A 151 6.840 -9.126 -11.690 1.00 1.03 H new ATOM 0 HD3 ARG A 151 6.060 -10.331 -10.685 1.00 1.03 H new ATOM 0 HE ARG A 151 4.869 -10.203 -13.337 1.00 1.47 H new ATOM 0 HH11 ARG A 151 4.860 -12.238 -14.385 1.00 2.69 H new ATOM 0 HH12 ARG A 151 6.292 -13.267 -14.271 1.00 2.69 H new ATOM 0 HH21 ARG A 151 7.927 -11.191 -11.917 1.00 2.96 H new ATOM 0 HH22 ARG A 151 8.029 -12.674 -12.872 1.00 2.96 H new ATOM 2487 N PRO A 152 1.772 -10.842 -11.200 1.00 0.49 N ATOM 2488 CA PRO A 152 1.266 -11.500 -12.394 1.00 0.62 C ATOM 2489 C PRO A 152 1.835 -10.860 -13.632 1.00 0.84 C ATOM 2490 O PRO A 152 2.863 -10.214 -13.527 1.00 0.66 O ATOM 2491 CB PRO A 152 -0.252 -11.419 -12.270 1.00 0.55 C ATOM 2492 CG PRO A 152 -0.449 -10.071 -11.573 1.00 0.56 C ATOM 2493 CD PRO A 152 0.789 -9.907 -10.685 1.00 0.45 C ATOM 0 HA PRO A 152 1.568 -12.543 -12.484 1.00 0.62 H new ATOM 0 HB2 PRO A 152 -0.742 -11.449 -13.243 1.00 0.55 H new ATOM 0 HB3 PRO A 152 -0.657 -12.244 -11.683 1.00 0.55 H new ATOM 0 HG2 PRO A 152 -0.528 -9.259 -12.296 1.00 0.56 H new ATOM 0 HG3 PRO A 152 -1.365 -10.061 -10.982 1.00 0.56 H new ATOM 0 HD2 PRO A 152 1.165 -8.884 -10.723 1.00 0.45 H new ATOM 0 HD3 PRO A 152 0.554 -10.122 -9.643 1.00 0.45 H new ATOM 2501 N VAL A 153 1.231 -11.121 -14.796 1.00 1.62 N ATOM 2502 CA VAL A 153 1.853 -10.964 -16.108 1.00 1.63 C ATOM 2503 C VAL A 153 2.852 -12.094 -16.370 1.00 1.68 C ATOM 2504 O VAL A 153 3.586 -12.057 -17.352 1.00 2.29 O ATOM 2505 CB VAL A 153 2.449 -9.558 -16.324 1.00 3.90 C ATOM 2506 CG1 VAL A 153 1.528 -8.490 -15.712 1.00 6.25 C ATOM 2507 CG2 VAL A 153 3.899 -9.367 -15.841 1.00 5.40 C ATOM 0 H VAL A 153 0.269 -11.456 -14.849 1.00 1.62 H new ATOM 0 HA VAL A 153 1.068 -11.048 -16.860 1.00 1.63 H new ATOM 0 HB VAL A 153 2.505 -9.440 -17.406 1.00 3.90 H new ATOM 0 HG11 VAL A 153 1.960 -7.502 -15.871 1.00 6.25 H new ATOM 0 HG12 VAL A 153 0.548 -8.538 -16.188 1.00 6.25 H new ATOM 0 HG13 VAL A 153 1.421 -8.671 -14.642 1.00 6.25 H new ATOM 0 HG21 VAL A 153 4.217 -8.344 -16.041 1.00 5.40 H new ATOM 0 HG22 VAL A 153 3.954 -9.561 -14.770 1.00 5.40 H new ATOM 0 HG23 VAL A 153 4.553 -10.061 -16.370 1.00 5.40 H new ATOM 2517 N ASP A 154 2.899 -13.070 -15.462 1.00 3.34 N ATOM 2518 CA ASP A 154 3.539 -14.351 -15.705 1.00 5.98 C ATOM 2519 C ASP A 154 2.550 -15.176 -16.521 1.00 6.56 C ATOM 2520 O ASP A 154 1.338 -14.988 -16.256 1.00 6.28 O ATOM 2521 CB ASP A 154 3.838 -15.044 -14.364 1.00 7.69 C ATOM 2522 CG ASP A 154 5.149 -15.829 -14.405 1.00 9.92 C ATOM 2523 OD1 ASP A 154 6.193 -15.148 -14.561 1.00 10.66 O ATOM 2524 OD2 ASP A 154 5.115 -17.058 -14.184 1.00 11.17 O ATOM 2525 OXT ASP A 154 3.006 -15.937 -17.398 1.00 7.81 O ATOM 0 H ASP A 154 2.489 -12.987 -14.532 1.00 3.34 H new ATOM 0 HA ASP A 154 4.484 -14.235 -16.236 1.00 5.98 H new ATOM 0 HB2 ASP A 154 3.888 -14.296 -13.573 1.00 7.69 H new ATOM 0 HB3 ASP A 154 3.019 -15.719 -14.114 1.00 7.69 H new TER 2530 ASP A 154