USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=30 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 75 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 139 ASN : amide:sc= -0.475 K(o=-0.47,f=-1.2) USER MOD Set 2.1: A 61 TYR OH : rot 133:sc= 0.488 USER MOD Set 2.2: A 100 LYS NZ :NH3+ 153:sc= 0.0541 (180deg=0) USER MOD Set 3.1: A 99 THR OG1 : rot 61:sc= 0.839 USER MOD Set 3.2: A 103 GLN : amide:sc= 0.676 K(o=1.5,f=-1.1) USER MOD Set 4.1: A 67 LYS NZ :NH3+ 166:sc= 0.646 (180deg=0) USER MOD Set 4.2: A 84 GLN : amide:sc= 0.585 K(o=1.2,f=-4.3!) USER MOD Set 5.1: A 24 ASN : amide:sc= 0.175 K(o=0.52,f=-4.5!) USER MOD Set 5.2: A 26 GLN : amide:sc= 0.341 K(o=0.52,f=-2!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot -69:sc= -2.19 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0187) USER MOD Single : A 16 LYS NZ :NH3+ -162:sc= 1.15 (180deg=0.915) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl -168:sc= 0 (180deg=-0.177) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 0.59 K(o=0.59,f=-1.6) USER MOD Single : A 31 ASN : amide:sc= -0.573 K(o=-0.57,f=-3.5!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0.269 K(o=0.27,f=-4.5!) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -155:sc= 1.72 (180deg=0.379) USER MOD Single : A 56 ASN : amide:sc= 0.0918 X(o=0.092,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 176:sc= 0.0255 (180deg=-0.0989) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0295 USER MOD Single : A 71 LYS NZ :NH3+ -141:sc= 0.305 (180deg=-1.39!) USER MOD Single : A 72 THR OG1 : rot 18:sc= 0.00228 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 HIS : no HD1:sc= -2.16 K(o=-2.2,f=-3.5!) USER MOD Single : A 78 ASN : amide:sc= 0.228 K(o=0.23,f=-4.6!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=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 101 THR OG1 : rot -173:sc= 2.1 USER MOD Single : A 106 GLN : amide:sc= -0.43 K(o=-0.43,f=-1) USER MOD Single : A 107 SER OG : rot 120:sc= 0 USER MOD Single : A 113 ASN : amide:sc= 0.785 K(o=0.78,f=-7.6!) USER MOD Single : A 116 GLN : amide:sc= -0.0873 X(o=-0.087,f=-0.2) USER MOD Single : A 119 HIS : no HD1:sc= -0.345 K(o=-0.35,f=-0.98) 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+ -138:sc= 0.978 (180deg=-0.199!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 CYS SG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 163:sc= -0.0169 (180deg=-0.234) USER MOD Single : A 144 THR OG1 : rot 87:sc= 0.735 USER MOD Single : A 145 LYS NZ :NH3+ -149:sc= 0.384 (180deg=0.0688) USER MOD Single : A 146 LYS NZ :NH3+ -121:sc= 1.04 (180deg=-0.998!) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -21.327 -4.341 11.384 1.00 1.62 N ATOM 2 CA MET A 1 -20.477 -4.227 10.180 1.00 0.79 C ATOM 3 C MET A 1 -20.918 -3.046 9.299 1.00 0.82 C ATOM 4 O MET A 1 -21.130 -3.179 8.096 1.00 1.01 O ATOM 5 CB MET A 1 -20.449 -5.587 9.463 1.00 0.70 C ATOM 6 CG MET A 1 -19.097 -6.253 9.717 1.00 2.15 C ATOM 7 SD MET A 1 -19.030 -7.986 9.211 1.00 3.75 S ATOM 8 CE MET A 1 -19.105 -8.762 10.846 1.00 4.17 C ATOM 0 H1 MET A 1 -21.007 -5.146 11.960 1.00 1.62 H new ATOM 0 H2 MET A 1 -21.257 -3.466 11.942 1.00 1.62 H new ATOM 0 H3 MET A 1 -22.316 -4.491 11.098 1.00 1.62 H new ATOM 0 HA MET A 1 -19.449 -3.991 10.454 1.00 0.79 H new ATOM 0 HB2 MET A 1 -21.256 -6.222 9.828 1.00 0.70 H new ATOM 0 HB3 MET A 1 -20.608 -5.452 8.393 1.00 0.70 H new ATOM 0 HG2 MET A 1 -18.324 -5.699 9.185 1.00 2.15 H new ATOM 0 HG3 MET A 1 -18.863 -6.185 10.779 1.00 2.15 H new ATOM 0 HE1 MET A 1 -19.075 -9.846 10.736 1.00 4.17 H new ATOM 0 HE2 MET A 1 -18.255 -8.434 11.444 1.00 4.17 H new ATOM 0 HE3 MET A 1 -20.031 -8.474 11.344 1.00 4.17 H new ATOM 20 N ALA A 2 -21.045 -1.850 9.894 1.00 0.90 N ATOM 21 CA ALA A 2 -21.530 -0.670 9.184 1.00 1.05 C ATOM 22 C ALA A 2 -20.551 -0.198 8.109 1.00 1.03 C ATOM 23 O ALA A 2 -20.964 0.419 7.130 1.00 1.56 O ATOM 24 CB ALA A 2 -21.784 0.457 10.189 1.00 1.25 C ATOM 0 H ALA A 2 -20.815 -1.680 10.873 1.00 0.90 H new ATOM 0 HA ALA A 2 -22.457 -0.942 8.679 1.00 1.05 H new ATOM 0 HB1 ALA A 2 -22.146 1.340 9.662 1.00 1.25 H new ATOM 0 HB2 ALA A 2 -22.531 0.136 10.915 1.00 1.25 H new ATOM 0 HB3 ALA A 2 -20.856 0.699 10.707 1.00 1.25 H new ATOM 30 N ALA A 3 -19.262 -0.472 8.313 1.00 0.63 N ATOM 31 CA ALA A 3 -18.220 -0.191 7.346 1.00 0.49 C ATOM 32 C ALA A 3 -18.344 -1.175 6.194 1.00 0.42 C ATOM 33 O ALA A 3 -18.463 -0.754 5.055 1.00 0.57 O ATOM 34 CB ALA A 3 -16.844 -0.297 8.003 1.00 0.46 C ATOM 0 H ALA A 3 -18.915 -0.902 9.171 1.00 0.63 H new ATOM 0 HA ALA A 3 -18.331 0.825 6.967 1.00 0.49 H new ATOM 0 HB1 ALA A 3 -16.071 -0.083 7.265 1.00 0.46 H new ATOM 0 HB2 ALA A 3 -16.774 0.422 8.820 1.00 0.46 H new ATOM 0 HB3 ALA A 3 -16.704 -1.305 8.394 1.00 0.46 H new ATOM 40 N SER A 4 -18.330 -2.478 6.480 1.00 0.41 N ATOM 41 CA SER A 4 -18.299 -3.552 5.500 1.00 0.39 C ATOM 42 C SER A 4 -19.307 -3.388 4.382 1.00 0.45 C ATOM 43 O SER A 4 -18.942 -3.529 3.226 1.00 0.58 O ATOM 44 CB SER A 4 -18.561 -4.867 6.206 1.00 0.41 C ATOM 45 OG SER A 4 -17.502 -5.138 7.063 1.00 2.41 O ATOM 0 H SER A 4 -18.340 -2.822 7.440 1.00 0.41 H new ATOM 0 HA SER A 4 -17.312 -3.528 5.039 1.00 0.39 H new ATOM 0 HB2 SER A 4 -19.495 -4.814 6.766 1.00 0.41 H new ATOM 0 HB3 SER A 4 -18.671 -5.670 5.477 1.00 0.41 H new ATOM 0 HG SER A 4 -16.700 -5.343 6.538 1.00 2.41 H new ATOM 51 N ARG A 5 -20.569 -3.080 4.683 1.00 0.48 N ATOM 52 CA ARG A 5 -21.550 -2.856 3.618 1.00 0.58 C ATOM 53 C ARG A 5 -21.088 -1.807 2.610 1.00 0.66 C ATOM 54 O ARG A 5 -21.402 -1.895 1.427 1.00 0.96 O ATOM 55 CB ARG A 5 -22.907 -2.486 4.225 1.00 0.69 C ATOM 56 CG ARG A 5 -22.801 -1.422 5.323 1.00 1.97 C ATOM 57 CD ARG A 5 -23.989 -0.459 5.276 1.00 2.86 C ATOM 58 NE ARG A 5 -24.192 0.196 6.575 1.00 4.81 N ATOM 59 CZ ARG A 5 -24.965 -0.281 7.560 1.00 5.44 C ATOM 60 NH1 ARG A 5 -25.145 0.430 8.675 1.00 7.33 N ATOM 61 NH2 ARG A 5 -25.547 -1.474 7.439 1.00 4.68 N ATOM 0 H ARG A 5 -20.931 -2.981 5.631 1.00 0.48 H new ATOM 0 HA ARG A 5 -21.654 -3.788 3.062 1.00 0.58 H new ATOM 0 HB2 ARG A 5 -23.565 -2.122 3.436 1.00 0.69 H new ATOM 0 HB3 ARG A 5 -23.371 -3.382 4.638 1.00 0.69 H new ATOM 0 HG2 ARG A 5 -22.760 -1.906 6.299 1.00 1.97 H new ATOM 0 HG3 ARG A 5 -21.872 -0.864 5.204 1.00 1.97 H new ATOM 0 HD2 ARG A 5 -23.819 0.295 4.508 1.00 2.86 H new ATOM 0 HD3 ARG A 5 -24.891 -1.003 4.995 1.00 2.86 H new ATOM 0 HE ARG A 5 -23.709 1.079 6.739 1.00 4.81 H new ATOM 0 HH11 ARG A 5 -24.694 1.339 8.779 1.00 7.33 H new ATOM 0 HH12 ARG A 5 -25.734 0.065 9.423 1.00 7.33 H new ATOM 0 HH21 ARG A 5 -25.405 -2.028 6.594 1.00 4.68 H new ATOM 0 HH22 ARG A 5 -26.135 -1.833 8.191 1.00 4.68 H new ATOM 75 N ARG A 6 -20.354 -0.800 3.070 1.00 0.49 N ATOM 76 CA ARG A 6 -19.730 0.179 2.201 1.00 0.48 C ATOM 77 C ARG A 6 -18.515 -0.434 1.507 1.00 0.46 C ATOM 78 O ARG A 6 -18.396 -0.346 0.294 1.00 0.57 O ATOM 79 CB ARG A 6 -19.415 1.473 2.970 1.00 0.48 C ATOM 80 CG ARG A 6 -20.667 1.946 3.725 1.00 0.60 C ATOM 81 CD ARG A 6 -20.490 3.344 4.325 1.00 1.27 C ATOM 82 NE ARG A 6 -21.695 3.775 5.058 1.00 2.57 N ATOM 83 CZ ARG A 6 -22.835 4.224 4.512 1.00 3.34 C ATOM 84 NH1 ARG A 6 -23.864 4.569 5.288 1.00 5.12 N ATOM 85 NH2 ARG A 6 -22.950 4.325 3.187 1.00 2.95 N ATOM 0 H ARG A 6 -20.177 -0.643 4.062 1.00 0.49 H new ATOM 0 HA ARG A 6 -20.426 0.466 1.413 1.00 0.48 H new ATOM 0 HB2 ARG A 6 -18.599 1.301 3.672 1.00 0.48 H new ATOM 0 HB3 ARG A 6 -19.082 2.247 2.278 1.00 0.48 H new ATOM 0 HG2 ARG A 6 -21.519 1.950 3.045 1.00 0.60 H new ATOM 0 HG3 ARG A 6 -20.898 1.238 4.521 1.00 0.60 H new ATOM 0 HD2 ARG A 6 -19.633 3.346 4.999 1.00 1.27 H new ATOM 0 HD3 ARG A 6 -20.272 4.057 3.530 1.00 1.27 H new ATOM 0 HE ARG A 6 -21.658 3.727 6.076 1.00 2.57 H new ATOM 0 HH11 ARG A 6 -23.786 4.492 6.302 1.00 5.12 H new ATOM 0 HH12 ARG A 6 -24.728 4.910 4.867 1.00 5.12 H new ATOM 0 HH21 ARG A 6 -22.170 4.060 2.586 1.00 2.95 H new ATOM 0 HH22 ARG A 6 -23.818 4.667 2.775 1.00 2.95 H new ATOM 99 N LEU A 7 -17.640 -1.105 2.244 1.00 0.39 N ATOM 100 CA LEU A 7 -16.375 -1.620 1.732 1.00 0.37 C ATOM 101 C LEU A 7 -16.600 -2.673 0.658 1.00 0.37 C ATOM 102 O LEU A 7 -15.744 -2.864 -0.190 1.00 0.37 O ATOM 103 CB LEU A 7 -15.531 -2.237 2.850 1.00 0.32 C ATOM 104 CG LEU A 7 -15.260 -1.280 4.013 1.00 0.41 C ATOM 105 CD1 LEU A 7 -14.440 -2.019 5.067 1.00 0.38 C ATOM 106 CD2 LEU A 7 -14.511 -0.014 3.611 1.00 0.99 C ATOM 0 H LEU A 7 -17.791 -1.311 3.232 1.00 0.39 H new ATOM 0 HA LEU A 7 -15.844 -0.770 1.303 1.00 0.37 H new ATOM 0 HB2 LEU A 7 -16.039 -3.123 3.231 1.00 0.32 H new ATOM 0 HB3 LEU A 7 -14.580 -2.569 2.434 1.00 0.32 H new ATOM 0 HG LEU A 7 -16.231 -0.961 4.393 1.00 0.41 H new ATOM 0 HD11 LEU A 7 -14.237 -1.351 5.904 1.00 0.38 H new ATOM 0 HD12 LEU A 7 -14.999 -2.886 5.421 1.00 0.38 H new ATOM 0 HD13 LEU A 7 -13.498 -2.349 4.630 1.00 0.38 H new ATOM 0 HD21 LEU A 7 -14.357 0.612 4.490 1.00 0.99 H new ATOM 0 HD22 LEU A 7 -13.545 -0.283 3.184 1.00 0.99 H new ATOM 0 HD23 LEU A 7 -15.095 0.535 2.872 1.00 0.99 H new ATOM 118 N MET A 8 -17.730 -3.371 0.700 1.00 0.40 N ATOM 119 CA MET A 8 -18.083 -4.393 -0.262 1.00 0.44 C ATOM 120 C MET A 8 -18.331 -3.729 -1.598 1.00 0.41 C ATOM 121 O MET A 8 -17.728 -4.113 -2.598 1.00 0.41 O ATOM 122 CB MET A 8 -19.341 -5.130 0.216 1.00 0.53 C ATOM 123 CG MET A 8 -19.524 -6.444 -0.544 1.00 0.68 C ATOM 124 SD MET A 8 -18.731 -7.859 0.262 1.00 2.51 S ATOM 125 CE MET A 8 -18.835 -9.062 -1.087 1.00 2.60 C ATOM 0 H MET A 8 -18.437 -3.234 1.422 1.00 0.40 H new ATOM 0 HA MET A 8 -17.276 -5.118 -0.363 1.00 0.44 H new ATOM 0 HB2 MET A 8 -19.266 -5.331 1.285 1.00 0.53 H new ATOM 0 HB3 MET A 8 -20.216 -4.496 0.071 1.00 0.53 H new ATOM 0 HG2 MET A 8 -20.589 -6.647 -0.652 1.00 0.68 H new ATOM 0 HG3 MET A 8 -19.117 -6.333 -1.549 1.00 0.68 H new ATOM 0 HE1 MET A 8 -18.390 -10.005 -0.769 1.00 2.60 H new ATOM 0 HE2 MET A 8 -19.880 -9.224 -1.350 1.00 2.60 H new ATOM 0 HE3 MET A 8 -18.297 -8.682 -1.956 1.00 2.60 H new ATOM 135 N LYS A 9 -19.227 -2.737 -1.629 1.00 0.41 N ATOM 136 CA LYS A 9 -19.525 -2.134 -2.921 1.00 0.39 C ATOM 137 C LYS A 9 -18.292 -1.407 -3.456 1.00 0.41 C ATOM 138 O LYS A 9 -18.018 -1.458 -4.649 1.00 0.47 O ATOM 139 CB LYS A 9 -20.811 -1.293 -2.907 1.00 0.52 C ATOM 140 CG LYS A 9 -20.693 0.171 -2.468 1.00 1.69 C ATOM 141 CD LYS A 9 -21.032 0.311 -0.992 1.00 2.75 C ATOM 142 CE LYS A 9 -22.541 0.356 -0.746 1.00 3.25 C ATOM 143 NZ LYS A 9 -23.113 1.669 -1.114 1.00 4.07 N ATOM 0 H LYS A 9 -19.728 -2.357 -0.826 1.00 0.41 H new ATOM 0 HA LYS A 9 -19.753 -2.928 -3.633 1.00 0.39 H new ATOM 0 HB2 LYS A 9 -21.235 -1.310 -3.911 1.00 0.52 H new ATOM 0 HB3 LYS A 9 -21.528 -1.785 -2.249 1.00 0.52 H new ATOM 0 HG2 LYS A 9 -19.681 0.532 -2.651 1.00 1.69 H new ATOM 0 HG3 LYS A 9 -21.364 0.791 -3.062 1.00 1.69 H new ATOM 0 HD2 LYS A 9 -20.601 -0.525 -0.441 1.00 2.75 H new ATOM 0 HD3 LYS A 9 -20.575 1.220 -0.601 1.00 2.75 H new ATOM 0 HE2 LYS A 9 -23.028 -0.429 -1.324 1.00 3.25 H new ATOM 0 HE3 LYS A 9 -22.745 0.151 0.305 1.00 3.25 H new ATOM 0 HZ1 LYS A 9 -24.111 1.706 -0.825 1.00 4.07 H new ATOM 0 HZ2 LYS A 9 -22.585 2.425 -0.633 1.00 4.07 H new ATOM 0 HZ3 LYS A 9 -23.045 1.801 -2.143 1.00 4.07 H new ATOM 157 N GLU A 10 -17.542 -0.762 -2.562 1.00 0.39 N ATOM 158 CA GLU A 10 -16.316 -0.048 -2.878 1.00 0.42 C ATOM 159 C GLU A 10 -15.311 -1.016 -3.495 1.00 0.39 C ATOM 160 O GLU A 10 -14.708 -0.706 -4.509 1.00 0.44 O ATOM 161 CB GLU A 10 -15.753 0.581 -1.598 1.00 0.47 C ATOM 162 CG GLU A 10 -16.679 1.665 -1.016 1.00 0.72 C ATOM 163 CD GLU A 10 -16.489 3.070 -1.581 1.00 1.08 C ATOM 164 OE1 GLU A 10 -15.421 3.331 -2.170 1.00 1.63 O ATOM 165 OE2 GLU A 10 -17.409 3.888 -1.340 1.00 1.81 O ATOM 0 H GLU A 10 -17.782 -0.724 -1.571 1.00 0.39 H new ATOM 0 HA GLU A 10 -16.518 0.746 -3.597 1.00 0.42 H new ATOM 0 HB2 GLU A 10 -15.598 -0.198 -0.852 1.00 0.47 H new ATOM 0 HB3 GLU A 10 -14.777 1.017 -1.811 1.00 0.47 H new ATOM 0 HG2 GLU A 10 -17.713 1.362 -1.184 1.00 0.72 H new ATOM 0 HG3 GLU A 10 -16.529 1.704 0.063 1.00 0.72 H new ATOM 172 N LEU A 11 -15.123 -2.196 -2.905 1.00 0.36 N ATOM 173 CA LEU A 11 -14.179 -3.189 -3.388 1.00 0.36 C ATOM 174 C LEU A 11 -14.569 -3.665 -4.766 1.00 0.39 C ATOM 175 O LEU A 11 -13.706 -3.792 -5.628 1.00 0.39 O ATOM 176 CB LEU A 11 -14.110 -4.385 -2.437 1.00 0.35 C ATOM 177 CG LEU A 11 -12.967 -5.332 -2.843 1.00 0.33 C ATOM 178 CD1 LEU A 11 -12.403 -5.960 -1.580 1.00 0.40 C ATOM 179 CD2 LEU A 11 -13.429 -6.471 -3.763 1.00 0.35 C ATOM 0 H LEU A 11 -15.630 -2.487 -2.069 1.00 0.36 H new ATOM 0 HA LEU A 11 -13.197 -2.718 -3.435 1.00 0.36 H new ATOM 0 HB2 LEU A 11 -13.956 -4.037 -1.416 1.00 0.35 H new ATOM 0 HB3 LEU A 11 -15.058 -4.923 -2.451 1.00 0.35 H new ATOM 0 HG LEU A 11 -12.230 -4.740 -3.386 1.00 0.33 H new ATOM 0 HD11 LEU A 11 -11.590 -6.637 -1.842 1.00 0.40 H new ATOM 0 HD12 LEU A 11 -12.026 -5.177 -0.922 1.00 0.40 H new ATOM 0 HD13 LEU A 11 -13.188 -6.517 -1.069 1.00 0.40 H new ATOM 0 HD21 LEU A 11 -12.578 -7.104 -4.014 1.00 0.35 H new ATOM 0 HD22 LEU A 11 -14.186 -7.066 -3.253 1.00 0.35 H new ATOM 0 HD23 LEU A 11 -13.851 -6.052 -4.676 1.00 0.35 H new ATOM 191 N GLU A 12 -15.844 -3.981 -4.969 1.00 0.41 N ATOM 192 CA GLU A 12 -16.279 -4.434 -6.280 1.00 0.42 C ATOM 193 C GLU A 12 -15.975 -3.360 -7.328 1.00 0.40 C ATOM 194 O GLU A 12 -15.416 -3.678 -8.377 1.00 0.43 O ATOM 195 CB GLU A 12 -17.749 -4.871 -6.276 1.00 0.44 C ATOM 196 CG GLU A 12 -18.103 -5.330 -7.699 1.00 0.47 C ATOM 197 CD GLU A 12 -19.030 -6.542 -7.762 1.00 0.80 C ATOM 198 OE1 GLU A 12 -18.663 -7.465 -8.532 1.00 2.49 O ATOM 199 OE2 GLU A 12 -20.069 -6.534 -7.072 1.00 1.95 O ATOM 0 H GLU A 12 -16.576 -3.933 -4.260 1.00 0.41 H new ATOM 0 HA GLU A 12 -15.714 -5.326 -6.550 1.00 0.42 H new ATOM 0 HB2 GLU A 12 -17.906 -5.680 -5.563 1.00 0.44 H new ATOM 0 HB3 GLU A 12 -18.392 -4.047 -5.969 1.00 0.44 H new ATOM 0 HG2 GLU A 12 -18.573 -4.501 -8.228 1.00 0.47 H new ATOM 0 HG3 GLU A 12 -17.181 -5.566 -8.231 1.00 0.47 H new ATOM 206 N GLU A 13 -16.282 -2.099 -7.021 1.00 0.37 N ATOM 207 CA GLU A 13 -15.936 -0.950 -7.851 1.00 0.34 C ATOM 208 C GLU A 13 -14.439 -0.954 -8.158 1.00 0.32 C ATOM 209 O GLU A 13 -14.046 -0.882 -9.315 1.00 0.45 O ATOM 210 CB GLU A 13 -16.362 0.355 -7.152 1.00 0.35 C ATOM 211 CG GLU A 13 -17.594 0.978 -7.815 1.00 0.62 C ATOM 212 CD GLU A 13 -17.223 1.678 -9.124 1.00 2.14 C ATOM 213 OE1 GLU A 13 -17.128 2.925 -9.101 1.00 3.02 O ATOM 214 OE2 GLU A 13 -17.041 0.950 -10.124 1.00 3.18 O ATOM 0 H GLU A 13 -16.788 -1.846 -6.172 1.00 0.37 H new ATOM 0 HA GLU A 13 -16.473 -1.016 -8.797 1.00 0.34 H new ATOM 0 HB2 GLU A 13 -16.577 0.152 -6.103 1.00 0.35 H new ATOM 0 HB3 GLU A 13 -15.537 1.067 -7.176 1.00 0.35 H new ATOM 0 HG2 GLU A 13 -18.335 0.204 -8.011 1.00 0.62 H new ATOM 0 HG3 GLU A 13 -18.054 1.694 -7.134 1.00 0.62 H new ATOM 221 N ILE A 14 -13.588 -1.071 -7.139 1.00 0.29 N ATOM 222 CA ILE A 14 -12.138 -1.058 -7.286 1.00 0.28 C ATOM 223 C ILE A 14 -11.713 -2.139 -8.274 1.00 0.38 C ATOM 224 O ILE A 14 -11.005 -1.872 -9.243 1.00 0.43 O ATOM 225 CB ILE A 14 -11.465 -1.184 -5.900 1.00 0.27 C ATOM 226 CG1 ILE A 14 -11.618 0.152 -5.150 1.00 0.29 C ATOM 227 CG2 ILE A 14 -9.961 -1.465 -6.044 1.00 0.29 C ATOM 228 CD1 ILE A 14 -11.008 0.092 -3.748 1.00 0.28 C ATOM 0 H ILE A 14 -13.895 -1.179 -6.172 1.00 0.29 H new ATOM 0 HA ILE A 14 -11.804 -0.107 -7.702 1.00 0.28 H new ATOM 0 HB ILE A 14 -11.940 -2.004 -5.362 1.00 0.27 H new ATOM 0 HG12 ILE A 14 -11.138 0.946 -5.721 1.00 0.29 H new ATOM 0 HG13 ILE A 14 -12.675 0.408 -5.075 1.00 0.29 H new ATOM 0 HG21 ILE A 14 -9.510 -1.549 -5.055 1.00 0.29 H new ATOM 0 HG22 ILE A 14 -9.816 -2.397 -6.590 1.00 0.29 H new ATOM 0 HG23 ILE A 14 -9.489 -0.648 -6.589 1.00 0.29 H new ATOM 0 HD11 ILE A 14 -11.137 1.055 -3.253 1.00 0.28 H new ATOM 0 HD12 ILE A 14 -11.506 -0.684 -3.167 1.00 0.28 H new ATOM 0 HD13 ILE A 14 -9.945 -0.137 -3.823 1.00 0.28 H new ATOM 240 N ARG A 15 -12.149 -3.374 -8.054 1.00 0.46 N ATOM 241 CA ARG A 15 -11.780 -4.497 -8.897 1.00 0.59 C ATOM 242 C ARG A 15 -12.183 -4.218 -10.345 1.00 0.58 C ATOM 243 O ARG A 15 -11.393 -4.457 -11.258 1.00 0.74 O ATOM 244 CB ARG A 15 -12.426 -5.763 -8.324 1.00 0.75 C ATOM 245 CG ARG A 15 -12.001 -7.010 -9.097 1.00 1.52 C ATOM 246 CD ARG A 15 -12.506 -8.257 -8.372 1.00 1.41 C ATOM 247 NE ARG A 15 -12.282 -9.468 -9.177 1.00 1.46 N ATOM 248 CZ ARG A 15 -12.720 -10.696 -8.871 1.00 1.61 C ATOM 249 NH1 ARG A 15 -12.523 -11.707 -9.719 1.00 2.10 N ATOM 250 NH2 ARG A 15 -13.363 -10.909 -7.722 1.00 1.96 N ATOM 0 H ARG A 15 -12.770 -3.622 -7.283 1.00 0.46 H new ATOM 0 HA ARG A 15 -10.700 -4.646 -8.905 1.00 0.59 H new ATOM 0 HB2 ARG A 15 -12.148 -5.872 -7.276 1.00 0.75 H new ATOM 0 HB3 ARG A 15 -13.511 -5.666 -8.357 1.00 0.75 H new ATOM 0 HG2 ARG A 15 -12.403 -6.977 -10.110 1.00 1.52 H new ATOM 0 HG3 ARG A 15 -10.915 -7.043 -9.186 1.00 1.52 H new ATOM 0 HD2 ARG A 15 -11.996 -8.355 -7.413 1.00 1.41 H new ATOM 0 HD3 ARG A 15 -13.570 -8.151 -8.158 1.00 1.41 H new ATOM 0 HE ARG A 15 -11.749 -9.364 -10.040 1.00 1.46 H new ATOM 0 HH11 ARG A 15 -12.038 -11.545 -10.602 1.00 2.10 H new ATOM 0 HH12 ARG A 15 -12.857 -12.642 -9.485 1.00 2.10 H new ATOM 0 HH21 ARG A 15 -13.522 -10.136 -7.075 1.00 1.96 H new ATOM 0 HH22 ARG A 15 -13.696 -11.845 -7.490 1.00 1.96 H new ATOM 264 N LYS A 16 -13.404 -3.717 -10.558 1.00 0.44 N ATOM 265 CA LYS A 16 -13.911 -3.356 -11.880 1.00 0.40 C ATOM 266 C LYS A 16 -13.193 -2.133 -12.453 1.00 0.41 C ATOM 267 O LYS A 16 -13.156 -1.983 -13.670 1.00 0.43 O ATOM 268 CB LYS A 16 -15.427 -3.099 -11.821 1.00 0.40 C ATOM 269 CG LYS A 16 -16.239 -4.346 -12.199 1.00 0.59 C ATOM 270 CD LYS A 16 -16.071 -5.508 -11.217 1.00 1.04 C ATOM 271 CE LYS A 16 -16.905 -6.694 -11.713 1.00 1.37 C ATOM 272 NZ LYS A 16 -16.926 -7.810 -10.745 1.00 2.51 N ATOM 0 H LYS A 16 -14.073 -3.550 -9.807 1.00 0.44 H new ATOM 0 HA LYS A 16 -13.714 -4.197 -12.545 1.00 0.40 H new ATOM 0 HB2 LYS A 16 -15.701 -2.779 -10.816 1.00 0.40 H new ATOM 0 HB3 LYS A 16 -15.682 -2.282 -12.496 1.00 0.40 H new ATOM 0 HG2 LYS A 16 -17.294 -4.079 -12.255 1.00 0.59 H new ATOM 0 HG3 LYS A 16 -15.940 -4.676 -13.194 1.00 0.59 H new ATOM 0 HD2 LYS A 16 -15.021 -5.790 -11.141 1.00 1.04 H new ATOM 0 HD3 LYS A 16 -16.394 -5.210 -10.220 1.00 1.04 H new ATOM 0 HE2 LYS A 16 -17.926 -6.363 -11.904 1.00 1.37 H new ATOM 0 HE3 LYS A 16 -16.502 -7.047 -12.662 1.00 1.37 H new ATOM 0 HZ1 LYS A 16 -17.228 -8.681 -11.226 1.00 2.51 H new ATOM 0 HZ2 LYS A 16 -15.973 -7.945 -10.350 1.00 2.51 H new ATOM 0 HZ3 LYS A 16 -17.592 -7.591 -9.977 1.00 2.51 H new ATOM 286 N CYS A 17 -12.621 -1.275 -11.610 1.00 0.43 N ATOM 287 CA CYS A 17 -11.952 -0.053 -12.026 1.00 0.48 C ATOM 288 C CYS A 17 -10.753 -0.438 -12.884 1.00 0.49 C ATOM 289 O CYS A 17 -10.459 0.210 -13.885 1.00 0.57 O ATOM 290 CB CYS A 17 -11.541 0.747 -10.780 1.00 0.56 C ATOM 291 SG CYS A 17 -10.984 2.412 -11.231 1.00 0.93 S ATOM 0 H CYS A 17 -12.612 -1.417 -10.600 1.00 0.43 H new ATOM 0 HA CYS A 17 -12.611 0.582 -12.618 1.00 0.48 H new ATOM 0 HB2 CYS A 17 -12.384 0.816 -10.093 1.00 0.56 H new ATOM 0 HB3 CYS A 17 -10.743 0.223 -10.254 1.00 0.56 H new ATOM 0 HG CYS A 17 -10.646 3.062 -10.157 1.00 0.93 H new ATOM 297 N GLY A 18 -10.091 -1.536 -12.514 1.00 0.49 N ATOM 298 CA GLY A 18 -9.119 -2.174 -13.377 1.00 0.59 C ATOM 299 C GLY A 18 -7.915 -2.555 -12.549 1.00 0.53 C ATOM 300 O GLY A 18 -7.034 -1.727 -12.335 1.00 0.50 O ATOM 0 H GLY A 18 -10.218 -1.998 -11.614 1.00 0.49 H new ATOM 0 HA2 GLY A 18 -9.552 -3.058 -13.845 1.00 0.59 H new ATOM 0 HA3 GLY A 18 -8.827 -1.499 -14.181 1.00 0.59 H new ATOM 304 N MET A 19 -7.880 -3.802 -12.076 1.00 0.55 N ATOM 305 CA MET A 19 -6.784 -4.303 -11.260 1.00 0.49 C ATOM 306 C MET A 19 -5.467 -4.332 -12.027 1.00 0.41 C ATOM 307 O MET A 19 -5.083 -5.359 -12.585 1.00 0.45 O ATOM 308 CB MET A 19 -7.084 -5.717 -10.768 1.00 0.67 C ATOM 309 CG MET A 19 -8.143 -5.750 -9.667 1.00 1.92 C ATOM 310 SD MET A 19 -8.151 -7.284 -8.692 1.00 2.56 S ATOM 311 CE MET A 19 -8.186 -8.515 -10.019 1.00 2.81 C ATOM 0 H MET A 19 -8.613 -4.489 -12.251 1.00 0.55 H new ATOM 0 HA MET A 19 -6.687 -3.620 -10.416 1.00 0.49 H new ATOM 0 HB2 MET A 19 -7.421 -6.325 -11.608 1.00 0.67 H new ATOM 0 HB3 MET A 19 -6.165 -6.169 -10.395 1.00 0.67 H new ATOM 0 HG2 MET A 19 -7.981 -4.906 -8.996 1.00 1.92 H new ATOM 0 HG3 MET A 19 -9.126 -5.614 -10.119 1.00 1.92 H new ATOM 0 HE1 MET A 19 -8.408 -9.496 -9.599 1.00 2.81 H new ATOM 0 HE2 MET A 19 -8.956 -8.248 -10.743 1.00 2.81 H new ATOM 0 HE3 MET A 19 -7.216 -8.543 -10.515 1.00 2.81 H new ATOM 321 N LYS A 20 -4.785 -3.193 -12.069 1.00 0.35 N ATOM 322 CA LYS A 20 -3.547 -3.023 -12.798 1.00 0.34 C ATOM 323 C LYS A 20 -2.412 -2.912 -11.790 1.00 0.36 C ATOM 324 O LYS A 20 -1.789 -3.903 -11.425 1.00 0.42 O ATOM 325 CB LYS A 20 -3.741 -1.849 -13.764 1.00 0.35 C ATOM 326 CG LYS A 20 -3.019 -2.102 -15.079 1.00 1.09 C ATOM 327 CD LYS A 20 -3.475 -1.009 -16.045 1.00 1.57 C ATOM 328 CE LYS A 20 -2.504 -0.851 -17.218 1.00 1.64 C ATOM 329 NZ LYS A 20 -2.616 -1.944 -18.205 1.00 2.91 N ATOM 0 H LYS A 20 -5.089 -2.348 -11.585 1.00 0.35 H new ATOM 0 HA LYS A 20 -3.269 -3.869 -13.427 1.00 0.34 H new ATOM 0 HB2 LYS A 20 -4.804 -1.699 -13.951 1.00 0.35 H new ATOM 0 HB3 LYS A 20 -3.365 -0.933 -13.309 1.00 0.35 H new ATOM 0 HG2 LYS A 20 -1.938 -2.070 -14.940 1.00 1.09 H new ATOM 0 HG3 LYS A 20 -3.261 -3.090 -15.470 1.00 1.09 H new ATOM 0 HD2 LYS A 20 -4.468 -1.249 -16.424 1.00 1.57 H new ATOM 0 HD3 LYS A 20 -3.558 -0.062 -15.511 1.00 1.57 H new ATOM 0 HE2 LYS A 20 -2.693 0.101 -17.714 1.00 1.64 H new ATOM 0 HE3 LYS A 20 -1.484 -0.815 -16.837 1.00 1.64 H new ATOM 0 HZ1 LYS A 20 -1.937 -1.786 -18.976 1.00 2.91 H new ATOM 0 HZ2 LYS A 20 -2.410 -2.852 -17.742 1.00 2.91 H new ATOM 0 HZ3 LYS A 20 -3.581 -1.964 -18.592 1.00 2.91 H new ATOM 343 N ASN A 21 -2.232 -1.716 -11.231 1.00 0.38 N ATOM 344 CA ASN A 21 -1.284 -1.450 -10.160 1.00 0.36 C ATOM 345 C ASN A 21 -1.743 -2.042 -8.833 1.00 0.31 C ATOM 346 O ASN A 21 -1.053 -1.919 -7.827 1.00 0.27 O ATOM 347 CB ASN A 21 -1.116 0.060 -9.997 1.00 0.42 C ATOM 348 CG ASN A 21 -0.435 0.653 -11.224 1.00 0.67 C ATOM 349 OD1 ASN A 21 -1.025 0.645 -12.299 1.00 2.06 O ATOM 350 ND2 ASN A 21 0.783 1.152 -11.085 1.00 1.17 N ATOM 0 H ASN A 21 -2.755 -0.889 -11.520 1.00 0.38 H new ATOM 0 HA ASN A 21 -0.338 -1.918 -10.431 1.00 0.36 H new ATOM 0 HB2 ASN A 21 -2.090 0.527 -9.852 1.00 0.42 H new ATOM 0 HB3 ASN A 21 -0.525 0.273 -9.106 1.00 0.42 H new ATOM 0 HD21 ASN A 21 1.266 1.550 -11.890 1.00 1.17 H new ATOM 0 HD22 ASN A 21 1.238 1.139 -10.172 1.00 1.17 H new ATOM 357 N PHE A 22 -2.915 -2.666 -8.800 1.00 0.36 N ATOM 358 CA PHE A 22 -3.489 -3.255 -7.618 1.00 0.31 C ATOM 359 C PHE A 22 -4.214 -4.496 -8.101 1.00 0.32 C ATOM 360 O PHE A 22 -5.179 -4.389 -8.847 1.00 0.47 O ATOM 361 CB PHE A 22 -4.421 -2.239 -6.947 1.00 0.33 C ATOM 362 CG PHE A 22 -5.473 -1.612 -7.843 1.00 0.33 C ATOM 363 CD1 PHE A 22 -6.776 -2.138 -7.886 1.00 0.19 C ATOM 364 CD2 PHE A 22 -5.135 -0.515 -8.661 1.00 0.55 C ATOM 365 CE1 PHE A 22 -7.722 -1.588 -8.765 1.00 0.28 C ATOM 366 CE2 PHE A 22 -6.087 0.038 -9.533 1.00 0.60 C ATOM 367 CZ PHE A 22 -7.383 -0.500 -9.585 1.00 0.46 C ATOM 0 H PHE A 22 -3.503 -2.774 -9.627 1.00 0.36 H new ATOM 0 HA PHE A 22 -2.750 -3.527 -6.864 1.00 0.31 H new ATOM 0 HB2 PHE A 22 -4.926 -2.732 -6.116 1.00 0.33 H new ATOM 0 HB3 PHE A 22 -3.812 -1.442 -6.522 1.00 0.33 H new ATOM 0 HD1 PHE A 22 -7.048 -2.963 -7.244 1.00 0.19 H new ATOM 0 HD2 PHE A 22 -4.140 -0.098 -8.617 1.00 0.55 H new ATOM 0 HE1 PHE A 22 -8.717 -2.005 -8.811 1.00 0.28 H new ATOM 0 HE2 PHE A 22 -5.823 0.875 -10.162 1.00 0.60 H new ATOM 0 HZ PHE A 22 -8.118 -0.078 -10.255 1.00 0.46 H new ATOM 377 N ARG A 23 -3.748 -5.684 -7.734 1.00 0.29 N ATOM 378 CA ARG A 23 -4.491 -6.897 -8.021 1.00 0.42 C ATOM 379 C ARG A 23 -4.461 -7.782 -6.801 1.00 0.39 C ATOM 380 O ARG A 23 -4.058 -7.376 -5.717 1.00 0.34 O ATOM 381 CB ARG A 23 -3.948 -7.612 -9.267 1.00 0.77 C ATOM 382 CG ARG A 23 -2.524 -8.158 -9.095 1.00 2.10 C ATOM 383 CD ARG A 23 -2.376 -9.534 -9.753 1.00 2.73 C ATOM 384 NE ARG A 23 -3.103 -10.583 -9.018 1.00 4.42 N ATOM 385 CZ ARG A 23 -3.420 -11.799 -9.482 1.00 5.08 C ATOM 386 NH1 ARG A 23 -4.009 -12.691 -8.678 1.00 7.02 N ATOM 387 NH2 ARG A 23 -3.149 -12.118 -10.748 1.00 4.07 N ATOM 0 H ARG A 23 -2.867 -5.829 -7.242 1.00 0.29 H new ATOM 0 HA ARG A 23 -5.526 -6.644 -8.250 1.00 0.42 H new ATOM 0 HB2 ARG A 23 -4.615 -8.436 -9.522 1.00 0.77 H new ATOM 0 HB3 ARG A 23 -3.962 -6.919 -10.108 1.00 0.77 H new ATOM 0 HG2 ARG A 23 -1.809 -7.463 -9.535 1.00 2.10 H new ATOM 0 HG3 ARG A 23 -2.285 -8.232 -8.034 1.00 2.10 H new ATOM 0 HD2 ARG A 23 -2.747 -9.487 -10.777 1.00 2.73 H new ATOM 0 HD3 ARG A 23 -1.320 -9.797 -9.808 1.00 2.73 H new ATOM 0 HE ARG A 23 -3.393 -10.363 -8.065 1.00 4.42 H new ATOM 0 HH11 ARG A 23 -4.217 -12.446 -7.710 1.00 7.02 H new ATOM 0 HH12 ARG A 23 -4.250 -13.617 -9.033 1.00 7.02 H new ATOM 0 HH21 ARG A 23 -2.701 -11.437 -11.361 1.00 4.07 H new ATOM 0 HH22 ARG A 23 -3.389 -13.043 -11.103 1.00 4.07 H new ATOM 401 N ASN A 24 -4.872 -9.029 -6.996 1.00 0.39 N ATOM 402 CA ASN A 24 -4.968 -10.000 -5.940 1.00 0.29 C ATOM 403 C ASN A 24 -5.848 -9.481 -4.805 1.00 0.29 C ATOM 404 O ASN A 24 -5.658 -9.888 -3.668 1.00 0.36 O ATOM 405 CB ASN A 24 -3.559 -10.376 -5.448 1.00 0.31 C ATOM 406 CG ASN A 24 -3.506 -11.791 -4.911 1.00 0.41 C ATOM 407 OD1 ASN A 24 -4.353 -12.615 -5.237 1.00 1.60 O ATOM 408 ND2 ASN A 24 -2.463 -12.111 -4.164 1.00 1.53 N ATOM 0 H ASN A 24 -5.149 -9.388 -7.909 1.00 0.39 H new ATOM 0 HA ASN A 24 -5.443 -10.902 -6.324 1.00 0.29 H new ATOM 0 HB2 ASN A 24 -2.849 -10.272 -6.268 1.00 0.31 H new ATOM 0 HB3 ASN A 24 -3.249 -9.680 -4.668 1.00 0.31 H new ATOM 0 HD21 ASN A 24 -2.343 -13.071 -3.839 1.00 1.53 H new ATOM 0 HD22 ASN A 24 -1.778 -11.398 -3.912 1.00 1.53 H new ATOM 415 N ILE A 25 -6.785 -8.574 -5.112 1.00 0.28 N ATOM 416 CA ILE A 25 -7.741 -8.052 -4.151 1.00 0.28 C ATOM 417 C ILE A 25 -8.540 -9.262 -3.685 1.00 0.28 C ATOM 418 O ILE A 25 -9.164 -9.939 -4.502 1.00 0.30 O ATOM 419 CB ILE A 25 -8.602 -6.943 -4.816 1.00 0.28 C ATOM 420 CG1 ILE A 25 -8.205 -5.552 -4.284 1.00 0.45 C ATOM 421 CG2 ILE A 25 -10.118 -7.126 -4.664 1.00 0.38 C ATOM 422 CD1 ILE A 25 -8.903 -4.409 -5.017 1.00 0.37 C ATOM 0 H ILE A 25 -6.894 -8.183 -6.048 1.00 0.28 H new ATOM 0 HA ILE A 25 -7.279 -7.569 -3.290 1.00 0.28 H new ATOM 0 HB ILE A 25 -8.387 -7.028 -5.881 1.00 0.28 H new ATOM 0 HG12 ILE A 25 -8.444 -5.494 -3.222 1.00 0.45 H new ATOM 0 HG13 ILE A 25 -7.126 -5.429 -4.375 1.00 0.45 H new ATOM 0 HG21 ILE A 25 -10.635 -6.304 -5.160 1.00 0.38 H new ATOM 0 HG22 ILE A 25 -10.418 -8.070 -5.118 1.00 0.38 H new ATOM 0 HG23 ILE A 25 -10.379 -7.133 -3.606 1.00 0.38 H new ATOM 0 HD11 ILE A 25 -8.581 -3.456 -4.596 1.00 0.37 H new ATOM 0 HD12 ILE A 25 -8.644 -4.444 -6.075 1.00 0.37 H new ATOM 0 HD13 ILE A 25 -9.982 -4.510 -4.904 1.00 0.37 H new ATOM 434 N GLN A 26 -8.502 -9.553 -2.389 1.00 0.26 N ATOM 435 CA GLN A 26 -9.330 -10.584 -1.802 1.00 0.28 C ATOM 436 C GLN A 26 -9.920 -10.015 -0.530 1.00 0.30 C ATOM 437 O GLN A 26 -9.295 -9.196 0.149 1.00 0.37 O ATOM 438 CB GLN A 26 -8.578 -11.882 -1.513 1.00 0.33 C ATOM 439 CG GLN A 26 -7.524 -12.180 -2.579 1.00 0.37 C ATOM 440 CD GLN A 26 -7.207 -13.665 -2.677 1.00 0.57 C ATOM 441 OE1 GLN A 26 -7.959 -14.525 -2.235 1.00 1.41 O ATOM 442 NE2 GLN A 26 -6.091 -14.007 -3.292 1.00 1.14 N ATOM 0 H GLN A 26 -7.895 -9.077 -1.722 1.00 0.26 H new ATOM 0 HA GLN A 26 -10.104 -10.858 -2.518 1.00 0.28 H new ATOM 0 HB2 GLN A 26 -8.098 -11.814 -0.537 1.00 0.33 H new ATOM 0 HB3 GLN A 26 -9.287 -12.709 -1.462 1.00 0.33 H new ATOM 0 HG2 GLN A 26 -7.877 -11.821 -3.546 1.00 0.37 H new ATOM 0 HG3 GLN A 26 -6.611 -11.630 -2.349 1.00 0.37 H new ATOM 0 HE21 GLN A 26 -5.469 -13.286 -3.658 1.00 1.14 H new ATOM 0 HE22 GLN A 26 -5.850 -14.992 -3.402 1.00 1.14 H new ATOM 451 N VAL A 27 -11.125 -10.468 -0.220 1.00 0.37 N ATOM 452 CA VAL A 27 -11.859 -10.061 0.949 1.00 0.41 C ATOM 453 C VAL A 27 -12.540 -11.336 1.425 1.00 0.65 C ATOM 454 O VAL A 27 -13.177 -12.029 0.633 1.00 0.94 O ATOM 455 CB VAL A 27 -12.783 -8.898 0.550 1.00 0.35 C ATOM 456 CG1 VAL A 27 -13.849 -9.268 -0.494 1.00 0.76 C ATOM 457 CG2 VAL A 27 -13.463 -8.292 1.766 1.00 0.49 C ATOM 0 H VAL A 27 -11.625 -11.146 -0.795 1.00 0.37 H new ATOM 0 HA VAL A 27 -11.272 -9.663 1.777 1.00 0.41 H new ATOM 0 HB VAL A 27 -12.122 -8.167 0.084 1.00 0.35 H new ATOM 0 HG11 VAL A 27 -14.457 -8.392 -0.719 1.00 0.76 H new ATOM 0 HG12 VAL A 27 -13.361 -9.615 -1.405 1.00 0.76 H new ATOM 0 HG13 VAL A 27 -14.485 -10.060 -0.099 1.00 0.76 H new ATOM 0 HG21 VAL A 27 -14.109 -7.473 1.451 1.00 0.49 H new ATOM 0 HG22 VAL A 27 -14.061 -9.054 2.266 1.00 0.49 H new ATOM 0 HG23 VAL A 27 -12.707 -7.914 2.455 1.00 0.49 H new ATOM 467 N ASP A 28 -12.290 -11.723 2.671 1.00 0.66 N ATOM 468 CA ASP A 28 -12.864 -12.942 3.225 1.00 0.84 C ATOM 469 C ASP A 28 -14.316 -12.668 3.610 1.00 0.57 C ATOM 470 O ASP A 28 -14.692 -11.510 3.754 1.00 0.42 O ATOM 471 CB ASP A 28 -12.047 -13.334 4.450 1.00 1.04 C ATOM 472 CG ASP A 28 -12.654 -14.532 5.169 1.00 1.13 C ATOM 473 OD1 ASP A 28 -13.089 -15.466 4.467 1.00 2.42 O ATOM 474 OD2 ASP A 28 -12.741 -14.460 6.413 1.00 1.83 O ATOM 0 H ASP A 28 -11.692 -11.208 3.317 1.00 0.66 H new ATOM 0 HA ASP A 28 -12.842 -13.756 2.500 1.00 0.84 H new ATOM 0 HB2 ASP A 28 -11.027 -13.569 4.147 1.00 1.04 H new ATOM 0 HB3 ASP A 28 -11.989 -12.488 5.135 1.00 1.04 H new ATOM 479 N GLU A 29 -15.148 -13.689 3.812 1.00 0.77 N ATOM 480 CA GLU A 29 -16.485 -13.441 4.330 1.00 0.74 C ATOM 481 C GLU A 29 -16.413 -13.045 5.806 1.00 0.53 C ATOM 482 O GLU A 29 -17.065 -12.089 6.222 1.00 0.78 O ATOM 483 CB GLU A 29 -17.426 -14.627 4.072 1.00 1.18 C ATOM 484 CG GLU A 29 -17.060 -15.927 4.800 1.00 1.88 C ATOM 485 CD GLU A 29 -18.067 -17.033 4.477 1.00 2.27 C ATOM 486 OE1 GLU A 29 -19.256 -16.839 4.815 1.00 3.13 O ATOM 487 OE2 GLU A 29 -17.640 -18.058 3.898 1.00 2.60 O ATOM 0 H GLU A 29 -14.926 -14.668 3.630 1.00 0.77 H new ATOM 0 HA GLU A 29 -16.919 -12.601 3.788 1.00 0.74 H new ATOM 0 HB2 GLU A 29 -18.436 -14.338 4.365 1.00 1.18 H new ATOM 0 HB3 GLU A 29 -17.449 -14.825 3.000 1.00 1.18 H new ATOM 0 HG2 GLU A 29 -16.059 -16.244 4.507 1.00 1.88 H new ATOM 0 HG3 GLU A 29 -17.037 -15.753 5.876 1.00 1.88 H new ATOM 494 N ALA A 30 -15.623 -13.760 6.615 1.00 0.50 N ATOM 495 CA ALA A 30 -15.596 -13.521 8.049 1.00 0.72 C ATOM 496 C ALA A 30 -14.858 -12.219 8.348 1.00 0.69 C ATOM 497 O ALA A 30 -15.355 -11.377 9.094 1.00 0.99 O ATOM 498 CB ALA A 30 -14.960 -14.709 8.776 1.00 0.96 C ATOM 0 H ALA A 30 -15.000 -14.503 6.297 1.00 0.50 H new ATOM 0 HA ALA A 30 -16.618 -13.420 8.415 1.00 0.72 H new ATOM 0 HB1 ALA A 30 -14.947 -14.515 9.848 1.00 0.96 H new ATOM 0 HB2 ALA A 30 -15.540 -15.610 8.577 1.00 0.96 H new ATOM 0 HB3 ALA A 30 -13.939 -14.849 8.420 1.00 0.96 H new ATOM 504 N ASN A 31 -13.675 -12.033 7.759 1.00 0.58 N ATOM 505 CA ASN A 31 -12.921 -10.796 7.907 1.00 0.53 C ATOM 506 C ASN A 31 -13.031 -9.958 6.639 1.00 0.46 C ATOM 507 O ASN A 31 -12.032 -9.448 6.151 1.00 0.54 O ATOM 508 CB ASN A 31 -11.476 -11.034 8.404 1.00 0.57 C ATOM 509 CG ASN A 31 -10.475 -11.632 7.414 1.00 2.77 C ATOM 510 OD1 ASN A 31 -9.559 -10.960 6.958 1.00 4.15 O ATOM 511 ND2 ASN A 31 -10.551 -12.924 7.131 1.00 4.00 N ATOM 0 H ASN A 31 -13.220 -12.732 7.172 1.00 0.58 H new ATOM 0 HA ASN A 31 -13.370 -10.205 8.705 1.00 0.53 H new ATOM 0 HB2 ASN A 31 -11.078 -10.080 8.749 1.00 0.57 H new ATOM 0 HB3 ASN A 31 -11.524 -11.692 9.272 1.00 0.57 H new ATOM 0 HD21 ASN A 31 -9.847 -13.358 6.534 1.00 4.00 H new ATOM 0 HD22 ASN A 31 -11.314 -13.485 7.510 1.00 4.00 H new ATOM 518 N LEU A 32 -14.259 -9.728 6.157 1.00 0.29 N ATOM 519 CA LEU A 32 -14.508 -8.859 5.001 1.00 0.24 C ATOM 520 C LEU A 32 -14.061 -7.420 5.278 1.00 0.21 C ATOM 521 O LEU A 32 -13.718 -6.666 4.374 1.00 0.28 O ATOM 522 CB LEU A 32 -15.972 -9.008 4.511 1.00 0.36 C ATOM 523 CG LEU A 32 -16.933 -7.805 4.540 1.00 0.35 C ATOM 524 CD1 LEU A 32 -16.694 -6.772 3.430 1.00 0.47 C ATOM 525 CD2 LEU A 32 -18.352 -8.344 4.324 1.00 0.43 C ATOM 0 H LEU A 32 -15.104 -10.137 6.556 1.00 0.29 H new ATOM 0 HA LEU A 32 -13.889 -9.181 4.164 1.00 0.24 H new ATOM 0 HB2 LEU A 32 -15.932 -9.363 3.481 1.00 0.36 H new ATOM 0 HB3 LEU A 32 -16.430 -9.800 5.103 1.00 0.36 H new ATOM 0 HG LEU A 32 -16.775 -7.307 5.497 1.00 0.35 H new ATOM 0 HD11 LEU A 32 -17.415 -5.960 3.527 1.00 0.47 H new ATOM 0 HD12 LEU A 32 -15.684 -6.372 3.516 1.00 0.47 H new ATOM 0 HD13 LEU A 32 -16.813 -7.249 2.457 1.00 0.47 H new ATOM 0 HD21 LEU A 32 -19.062 -7.517 4.339 1.00 0.43 H new ATOM 0 HD22 LEU A 32 -18.406 -8.851 3.361 1.00 0.43 H new ATOM 0 HD23 LEU A 32 -18.599 -9.048 5.119 1.00 0.43 H new ATOM 537 N LEU A 33 -14.036 -7.026 6.550 1.00 0.22 N ATOM 538 CA LEU A 33 -13.475 -5.749 6.969 1.00 0.27 C ATOM 539 C LEU A 33 -12.012 -5.596 6.553 1.00 0.33 C ATOM 540 O LEU A 33 -11.581 -4.502 6.203 1.00 0.65 O ATOM 541 CB LEU A 33 -13.640 -5.610 8.488 1.00 0.35 C ATOM 542 CG LEU A 33 -15.081 -5.228 8.837 1.00 0.42 C ATOM 543 CD1 LEU A 33 -15.321 -5.278 10.335 1.00 0.42 C ATOM 544 CD2 LEU A 33 -15.465 -3.808 8.395 1.00 0.59 C ATOM 0 H LEU A 33 -14.406 -7.586 7.318 1.00 0.22 H new ATOM 0 HA LEU A 33 -14.017 -4.948 6.467 1.00 0.27 H new ATOM 0 HB2 LEU A 33 -13.378 -6.549 8.976 1.00 0.35 H new ATOM 0 HB3 LEU A 33 -12.954 -4.852 8.867 1.00 0.35 H new ATOM 0 HG LEU A 33 -15.687 -5.958 8.301 1.00 0.42 H new ATOM 0 HD11 LEU A 33 -16.354 -5.001 10.547 1.00 0.42 H new ATOM 0 HD12 LEU A 33 -15.133 -6.288 10.700 1.00 0.42 H new ATOM 0 HD13 LEU A 33 -14.648 -4.581 10.835 1.00 0.42 H new ATOM 0 HD21 LEU A 33 -16.499 -3.607 8.675 1.00 0.59 H new ATOM 0 HD22 LEU A 33 -14.810 -3.086 8.882 1.00 0.59 H new ATOM 0 HD23 LEU A 33 -15.359 -3.722 7.314 1.00 0.59 H new ATOM 556 N THR A 34 -11.226 -6.667 6.608 1.00 0.27 N ATOM 557 CA THR A 34 -9.823 -6.593 6.251 1.00 0.26 C ATOM 558 C THR A 34 -9.639 -6.994 4.796 1.00 0.24 C ATOM 559 O THR A 34 -10.359 -7.825 4.249 1.00 0.28 O ATOM 560 CB THR A 34 -9.012 -7.464 7.210 1.00 0.30 C ATOM 561 OG1 THR A 34 -9.242 -6.969 8.511 1.00 0.42 O ATOM 562 CG2 THR A 34 -7.508 -7.405 6.934 1.00 0.37 C ATOM 0 H THR A 34 -11.541 -7.593 6.897 1.00 0.27 H new ATOM 0 HA THR A 34 -9.458 -5.571 6.347 1.00 0.26 H new ATOM 0 HB THR A 34 -9.325 -8.501 7.086 1.00 0.30 H new ATOM 0 HG1 THR A 34 -8.738 -7.505 9.159 1.00 0.42 H new ATOM 0 HG21 THR A 34 -6.982 -8.042 7.645 1.00 0.37 H new ATOM 0 HG22 THR A 34 -7.310 -7.752 5.920 1.00 0.37 H new ATOM 0 HG23 THR A 34 -7.159 -6.378 7.040 1.00 0.37 H new ATOM 570 N TRP A 35 -8.662 -6.359 4.159 1.00 0.23 N ATOM 571 CA TRP A 35 -8.377 -6.540 2.752 1.00 0.21 C ATOM 572 C TRP A 35 -6.960 -7.056 2.622 1.00 0.22 C ATOM 573 O TRP A 35 -6.086 -6.708 3.417 1.00 0.26 O ATOM 574 CB TRP A 35 -8.452 -5.197 2.032 1.00 0.20 C ATOM 575 CG TRP A 35 -9.773 -4.510 1.971 1.00 0.18 C ATOM 576 CD1 TRP A 35 -10.608 -4.284 3.007 1.00 0.21 C ATOM 577 CD2 TRP A 35 -10.378 -3.856 0.821 1.00 0.19 C ATOM 578 NE1 TRP A 35 -11.713 -3.595 2.571 1.00 0.22 N ATOM 579 CE2 TRP A 35 -11.612 -3.269 1.233 1.00 0.18 C ATOM 580 CE3 TRP A 35 -9.974 -3.658 -0.516 1.00 0.27 C ATOM 581 CZ2 TRP A 35 -12.399 -2.513 0.353 1.00 0.19 C ATOM 582 CZ3 TRP A 35 -10.757 -2.904 -1.406 1.00 0.27 C ATOM 583 CH2 TRP A 35 -11.962 -2.327 -0.968 1.00 0.21 C ATOM 0 H TRP A 35 -8.039 -5.695 4.618 1.00 0.23 H new ATOM 0 HA TRP A 35 -9.098 -7.234 2.319 1.00 0.21 H new ATOM 0 HB2 TRP A 35 -7.745 -4.520 2.512 1.00 0.20 H new ATOM 0 HB3 TRP A 35 -8.105 -5.346 1.009 1.00 0.20 H new ATOM 0 HD1 TRP A 35 -10.433 -4.598 4.026 1.00 0.21 H new ATOM 0 HE1 TRP A 35 -12.509 -3.354 3.162 1.00 0.22 H new ATOM 0 HE3 TRP A 35 -9.048 -4.093 -0.861 1.00 0.27 H new ATOM 0 HZ2 TRP A 35 -13.330 -2.079 0.687 1.00 0.19 H new ATOM 0 HZ3 TRP A 35 -10.433 -2.768 -2.427 1.00 0.27 H new ATOM 0 HH2 TRP A 35 -12.555 -1.737 -1.652 1.00 0.21 H new ATOM 594 N GLN A 36 -6.709 -7.822 1.570 1.00 0.23 N ATOM 595 CA GLN A 36 -5.386 -8.315 1.262 1.00 0.31 C ATOM 596 C GLN A 36 -5.214 -8.254 -0.245 1.00 0.37 C ATOM 597 O GLN A 36 -6.174 -8.461 -0.982 1.00 0.53 O ATOM 598 CB GLN A 36 -5.222 -9.736 1.817 1.00 0.43 C ATOM 599 CG GLN A 36 -6.460 -10.599 1.537 1.00 0.54 C ATOM 600 CD GLN A 36 -6.213 -12.075 1.817 1.00 0.77 C ATOM 601 OE1 GLN A 36 -5.159 -12.607 1.479 1.00 1.52 O ATOM 602 NE2 GLN A 36 -7.171 -12.764 2.423 1.00 1.06 N ATOM 0 H GLN A 36 -7.425 -8.117 0.906 1.00 0.23 H new ATOM 0 HA GLN A 36 -4.610 -7.707 1.728 1.00 0.31 H new ATOM 0 HB2 GLN A 36 -4.344 -10.203 1.370 1.00 0.43 H new ATOM 0 HB3 GLN A 36 -5.046 -9.689 2.892 1.00 0.43 H new ATOM 0 HG2 GLN A 36 -7.290 -10.249 2.151 1.00 0.54 H new ATOM 0 HG3 GLN A 36 -6.759 -10.474 0.496 1.00 0.54 H new ATOM 0 HE21 GLN A 36 -8.038 -12.301 2.695 1.00 1.06 H new ATOM 0 HE22 GLN A 36 -7.040 -13.757 2.617 1.00 1.06 H new ATOM 611 N GLY A 37 -4.002 -7.965 -0.708 1.00 0.33 N ATOM 612 CA GLY A 37 -3.691 -8.100 -2.116 1.00 0.33 C ATOM 613 C GLY A 37 -2.248 -7.715 -2.367 1.00 0.33 C ATOM 614 O GLY A 37 -1.455 -7.650 -1.430 1.00 0.36 O ATOM 0 H GLY A 37 -3.228 -7.639 -0.129 1.00 0.33 H new ATOM 0 HA2 GLY A 37 -3.863 -9.127 -2.438 1.00 0.33 H new ATOM 0 HA3 GLY A 37 -4.353 -7.466 -2.706 1.00 0.33 H new ATOM 618 N LEU A 38 -1.895 -7.457 -3.622 1.00 0.36 N ATOM 619 CA LEU A 38 -0.597 -6.907 -3.956 1.00 0.38 C ATOM 620 C LEU A 38 -0.819 -5.681 -4.808 1.00 0.37 C ATOM 621 O LEU A 38 -1.813 -5.576 -5.522 1.00 0.53 O ATOM 622 CB LEU A 38 0.340 -7.950 -4.598 1.00 0.40 C ATOM 623 CG LEU A 38 -0.066 -8.497 -5.983 1.00 0.43 C ATOM 624 CD1 LEU A 38 0.287 -7.579 -7.160 1.00 0.51 C ATOM 625 CD2 LEU A 38 0.678 -9.810 -6.248 1.00 0.44 C ATOM 0 H LEU A 38 -2.499 -7.624 -4.427 1.00 0.36 H new ATOM 0 HA LEU A 38 -0.070 -6.612 -3.048 1.00 0.38 H new ATOM 0 HB2 LEU A 38 1.332 -7.506 -4.686 1.00 0.40 H new ATOM 0 HB3 LEU A 38 0.428 -8.793 -3.913 1.00 0.40 H new ATOM 0 HG LEU A 38 -1.150 -8.603 -5.935 1.00 0.43 H new ATOM 0 HD11 LEU A 38 -0.035 -8.043 -8.092 1.00 0.51 H new ATOM 0 HD12 LEU A 38 -0.218 -6.621 -7.038 1.00 0.51 H new ATOM 0 HD13 LEU A 38 1.365 -7.420 -7.187 1.00 0.51 H new ATOM 0 HD21 LEU A 38 0.393 -10.199 -7.226 1.00 0.44 H new ATOM 0 HD22 LEU A 38 1.753 -9.630 -6.228 1.00 0.44 H new ATOM 0 HD23 LEU A 38 0.418 -10.537 -5.479 1.00 0.44 H new ATOM 637 N ILE A 39 0.120 -4.755 -4.739 1.00 0.24 N ATOM 638 CA ILE A 39 0.127 -3.585 -5.575 1.00 0.24 C ATOM 639 C ILE A 39 1.346 -3.755 -6.465 1.00 0.22 C ATOM 640 O ILE A 39 2.455 -3.966 -5.972 1.00 0.24 O ATOM 641 CB ILE A 39 0.059 -2.303 -4.721 1.00 0.25 C ATOM 642 CG1 ILE A 39 1.074 -2.296 -3.562 1.00 0.25 C ATOM 643 CG2 ILE A 39 -1.368 -2.192 -4.161 1.00 0.26 C ATOM 644 CD1 ILE A 39 0.981 -1.035 -2.702 1.00 0.27 C ATOM 0 H ILE A 39 0.906 -4.802 -4.090 1.00 0.24 H new ATOM 0 HA ILE A 39 -0.749 -3.476 -6.214 1.00 0.24 H new ATOM 0 HB ILE A 39 0.313 -1.453 -5.355 1.00 0.25 H new ATOM 0 HG12 ILE A 39 0.908 -3.172 -2.934 1.00 0.25 H new ATOM 0 HG13 ILE A 39 2.082 -2.381 -3.967 1.00 0.25 H new ATOM 0 HG21 ILE A 39 -1.450 -1.293 -3.550 1.00 0.26 H new ATOM 0 HG22 ILE A 39 -2.079 -2.137 -4.985 1.00 0.26 H new ATOM 0 HG23 ILE A 39 -1.588 -3.067 -3.550 1.00 0.26 H new ATOM 0 HD11 ILE A 39 1.719 -1.085 -1.902 1.00 0.27 H new ATOM 0 HD12 ILE A 39 1.175 -0.158 -3.320 1.00 0.27 H new ATOM 0 HD13 ILE A 39 -0.017 -0.961 -2.271 1.00 0.27 H new ATOM 656 N VAL A 40 1.104 -3.800 -7.774 1.00 0.26 N ATOM 657 CA VAL A 40 2.137 -3.876 -8.787 1.00 0.24 C ATOM 658 C VAL A 40 2.633 -2.442 -8.963 1.00 0.26 C ATOM 659 O VAL A 40 1.861 -1.572 -9.371 1.00 0.39 O ATOM 660 CB VAL A 40 1.572 -4.431 -10.109 1.00 0.28 C ATOM 661 CG1 VAL A 40 2.712 -4.788 -11.064 1.00 0.29 C ATOM 662 CG2 VAL A 40 0.745 -5.705 -9.904 1.00 0.40 C ATOM 0 H VAL A 40 0.160 -3.784 -8.161 1.00 0.26 H new ATOM 0 HA VAL A 40 2.943 -4.550 -8.495 1.00 0.24 H new ATOM 0 HB VAL A 40 0.935 -3.647 -10.518 1.00 0.28 H new ATOM 0 HG11 VAL A 40 2.299 -5.179 -11.994 1.00 0.29 H new ATOM 0 HG12 VAL A 40 3.302 -3.896 -11.276 1.00 0.29 H new ATOM 0 HG13 VAL A 40 3.349 -5.544 -10.604 1.00 0.29 H new ATOM 0 HG21 VAL A 40 0.370 -6.054 -10.866 1.00 0.40 H new ATOM 0 HG22 VAL A 40 1.371 -6.477 -9.456 1.00 0.40 H new ATOM 0 HG23 VAL A 40 -0.095 -5.491 -9.244 1.00 0.40 H new ATOM 672 N PRO A 41 3.882 -2.146 -8.599 1.00 0.35 N ATOM 673 CA PRO A 41 4.442 -0.843 -8.869 1.00 0.42 C ATOM 674 C PRO A 41 4.805 -0.704 -10.350 1.00 0.31 C ATOM 675 O PRO A 41 4.763 -1.678 -11.092 1.00 0.34 O ATOM 676 CB PRO A 41 5.688 -0.754 -7.997 1.00 0.62 C ATOM 677 CG PRO A 41 6.025 -2.181 -7.552 1.00 0.58 C ATOM 678 CD PRO A 41 4.841 -3.043 -7.980 1.00 0.51 C ATOM 0 HA PRO A 41 3.734 -0.044 -8.649 1.00 0.42 H new ATOM 0 HB2 PRO A 41 6.518 -0.317 -8.553 1.00 0.62 H new ATOM 0 HB3 PRO A 41 5.510 -0.113 -7.134 1.00 0.62 H new ATOM 0 HG2 PRO A 41 6.948 -2.527 -8.016 1.00 0.58 H new ATOM 0 HG3 PRO A 41 6.173 -2.229 -6.473 1.00 0.58 H new ATOM 0 HD2 PRO A 41 5.157 -3.816 -8.680 1.00 0.51 H new ATOM 0 HD3 PRO A 41 4.400 -3.550 -7.122 1.00 0.51 H new ATOM 686 N ASP A 42 5.240 0.496 -10.745 1.00 0.33 N ATOM 687 CA ASP A 42 5.868 0.760 -12.037 1.00 0.36 C ATOM 688 C ASP A 42 7.280 1.291 -11.803 1.00 0.37 C ATOM 689 O ASP A 42 8.239 0.761 -12.353 1.00 0.46 O ATOM 690 CB ASP A 42 5.064 1.766 -12.873 1.00 0.51 C ATOM 691 CG ASP A 42 3.886 1.116 -13.587 1.00 0.76 C ATOM 692 OD1 ASP A 42 4.151 0.393 -14.572 1.00 1.49 O ATOM 693 OD2 ASP A 42 2.739 1.381 -13.155 1.00 1.30 O ATOM 0 H ASP A 42 5.162 1.328 -10.160 1.00 0.33 H new ATOM 0 HA ASP A 42 5.901 -0.174 -12.598 1.00 0.36 H new ATOM 0 HB2 ASP A 42 4.698 2.563 -12.225 1.00 0.51 H new ATOM 0 HB3 ASP A 42 5.721 2.230 -13.609 1.00 0.51 H new ATOM 698 N ASN A 43 7.408 2.358 -11.005 1.00 0.34 N ATOM 699 CA ASN A 43 8.681 3.040 -10.772 1.00 0.35 C ATOM 700 C ASN A 43 9.755 2.118 -10.178 1.00 0.35 C ATOM 701 O ASN A 43 10.812 1.956 -10.783 1.00 0.41 O ATOM 702 CB ASN A 43 8.481 4.309 -9.923 1.00 0.35 C ATOM 703 CG ASN A 43 8.972 5.549 -10.651 1.00 0.51 C ATOM 704 OD1 ASN A 43 10.162 5.833 -10.676 1.00 0.70 O ATOM 705 ND2 ASN A 43 8.069 6.295 -11.274 1.00 0.61 N ATOM 0 H ASN A 43 6.624 2.773 -10.501 1.00 0.34 H new ATOM 0 HA ASN A 43 9.058 3.344 -11.749 1.00 0.35 H new ATOM 0 HB2 ASN A 43 7.425 4.423 -9.680 1.00 0.35 H new ATOM 0 HB3 ASN A 43 9.016 4.204 -8.979 1.00 0.35 H new ATOM 0 HD21 ASN A 43 8.361 7.126 -11.788 1.00 0.61 H new ATOM 0 HD22 ASN A 43 7.083 6.038 -11.239 1.00 0.61 H new ATOM 712 N PRO A 44 9.559 1.538 -8.981 1.00 0.32 N ATOM 713 CA PRO A 44 10.519 0.601 -8.424 1.00 0.32 C ATOM 714 C PRO A 44 10.434 -0.730 -9.182 1.00 0.31 C ATOM 715 O PRO A 44 9.443 -0.988 -9.861 1.00 0.31 O ATOM 716 CB PRO A 44 10.128 0.462 -6.951 1.00 0.32 C ATOM 717 CG PRO A 44 8.618 0.617 -7.014 1.00 0.29 C ATOM 718 CD PRO A 44 8.430 1.696 -8.083 1.00 0.30 C ATOM 0 HA PRO A 44 11.553 0.934 -8.514 1.00 0.32 H new ATOM 0 HB2 PRO A 44 10.423 -0.503 -6.539 1.00 0.32 H new ATOM 0 HB3 PRO A 44 10.592 1.229 -6.331 1.00 0.32 H new ATOM 0 HG2 PRO A 44 8.127 -0.316 -7.291 1.00 0.29 H new ATOM 0 HG3 PRO A 44 8.203 0.923 -6.054 1.00 0.29 H new ATOM 0 HD2 PRO A 44 7.485 1.568 -8.611 1.00 0.30 H new ATOM 0 HD3 PRO A 44 8.415 2.692 -7.640 1.00 0.30 H new ATOM 726 N PRO A 45 11.460 -1.584 -9.051 1.00 0.33 N ATOM 727 CA PRO A 45 11.692 -2.775 -9.870 1.00 0.32 C ATOM 728 C PRO A 45 10.610 -3.867 -9.762 1.00 0.32 C ATOM 729 O PRO A 45 10.841 -4.935 -9.200 1.00 0.64 O ATOM 730 CB PRO A 45 13.086 -3.275 -9.477 1.00 0.38 C ATOM 731 CG PRO A 45 13.329 -2.643 -8.121 1.00 0.38 C ATOM 732 CD PRO A 45 12.623 -1.309 -8.235 1.00 0.38 C ATOM 0 HA PRO A 45 11.633 -2.511 -10.926 1.00 0.32 H new ATOM 0 HB2 PRO A 45 13.120 -4.363 -9.423 1.00 0.38 H new ATOM 0 HB3 PRO A 45 13.840 -2.968 -10.202 1.00 0.38 H new ATOM 0 HG2 PRO A 45 12.918 -3.249 -7.314 1.00 0.38 H new ATOM 0 HG3 PRO A 45 14.393 -2.520 -7.918 1.00 0.38 H new ATOM 0 HD2 PRO A 45 12.339 -0.925 -7.255 1.00 0.38 H new ATOM 0 HD3 PRO A 45 13.264 -0.559 -8.698 1.00 0.38 H new ATOM 740 N TYR A 46 9.444 -3.654 -10.376 1.00 0.28 N ATOM 741 CA TYR A 46 8.342 -4.608 -10.328 1.00 0.32 C ATOM 742 C TYR A 46 8.578 -5.808 -11.240 1.00 0.37 C ATOM 743 O TYR A 46 7.900 -6.826 -11.136 1.00 0.71 O ATOM 744 CB TYR A 46 7.027 -3.933 -10.712 1.00 0.35 C ATOM 745 CG TYR A 46 6.872 -3.631 -12.185 1.00 0.40 C ATOM 746 CD1 TYR A 46 6.183 -4.535 -13.014 1.00 1.50 C ATOM 747 CD2 TYR A 46 7.377 -2.431 -12.712 1.00 1.61 C ATOM 748 CE1 TYR A 46 5.974 -4.228 -14.369 1.00 1.62 C ATOM 749 CE2 TYR A 46 7.162 -2.111 -14.063 1.00 1.75 C ATOM 750 CZ TYR A 46 6.445 -3.004 -14.892 1.00 0.99 C ATOM 751 OH TYR A 46 6.184 -2.679 -16.188 1.00 1.33 O ATOM 0 H TYR A 46 9.241 -2.815 -10.919 1.00 0.28 H new ATOM 0 HA TYR A 46 8.285 -4.968 -9.301 1.00 0.32 H new ATOM 0 HB2 TYR A 46 6.202 -4.573 -10.399 1.00 0.35 H new ATOM 0 HB3 TYR A 46 6.937 -3.001 -10.154 1.00 0.35 H new ATOM 0 HD1 TYR A 46 5.814 -5.466 -12.609 1.00 1.50 H new ATOM 0 HD2 TYR A 46 7.931 -1.754 -12.078 1.00 1.61 H new ATOM 0 HE1 TYR A 46 5.455 -4.926 -15.009 1.00 1.62 H new ATOM 0 HE2 TYR A 46 7.544 -1.185 -14.467 1.00 1.75 H new ATOM 0 HH TYR A 46 6.576 -1.804 -16.391 1.00 1.33 H new ATOM 761 N ASP A 47 9.539 -5.721 -12.158 1.00 0.38 N ATOM 762 CA ASP A 47 9.854 -6.852 -13.016 1.00 0.45 C ATOM 763 C ASP A 47 10.165 -8.090 -12.169 1.00 0.42 C ATOM 764 O ASP A 47 9.818 -9.203 -12.548 1.00 0.57 O ATOM 765 CB ASP A 47 11.006 -6.490 -13.953 1.00 0.54 C ATOM 766 CG ASP A 47 11.472 -7.702 -14.759 1.00 1.93 C ATOM 767 OD1 ASP A 47 12.712 -7.809 -14.913 1.00 3.33 O ATOM 768 OD2 ASP A 47 10.601 -8.500 -15.171 1.00 2.92 O ATOM 0 H ASP A 47 10.105 -4.888 -12.323 1.00 0.38 H new ATOM 0 HA ASP A 47 8.990 -7.093 -13.635 1.00 0.45 H new ATOM 0 HB2 ASP A 47 10.689 -5.699 -14.633 1.00 0.54 H new ATOM 0 HB3 ASP A 47 11.839 -6.096 -13.372 1.00 0.54 H new ATOM 773 N LYS A 48 10.775 -7.928 -10.993 1.00 0.30 N ATOM 774 CA LYS A 48 11.193 -9.089 -10.214 1.00 0.27 C ATOM 775 C LYS A 48 10.137 -9.509 -9.188 1.00 0.26 C ATOM 776 O LYS A 48 10.325 -10.532 -8.534 1.00 0.33 O ATOM 777 CB LYS A 48 12.561 -8.825 -9.560 1.00 0.39 C ATOM 778 CG LYS A 48 13.734 -8.893 -10.556 1.00 0.54 C ATOM 779 CD LYS A 48 13.649 -7.823 -11.646 1.00 0.95 C ATOM 780 CE LYS A 48 14.937 -7.739 -12.462 1.00 1.02 C ATOM 781 NZ LYS A 48 14.823 -6.723 -13.525 1.00 2.46 N ATOM 0 H LYS A 48 10.986 -7.025 -10.569 1.00 0.30 H new ATOM 0 HA LYS A 48 11.299 -9.932 -10.897 1.00 0.27 H new ATOM 0 HB2 LYS A 48 12.548 -7.841 -9.091 1.00 0.39 H new ATOM 0 HB3 LYS A 48 12.724 -9.555 -8.767 1.00 0.39 H new ATOM 0 HG2 LYS A 48 14.672 -8.779 -10.013 1.00 0.54 H new ATOM 0 HG3 LYS A 48 13.753 -9.878 -11.021 1.00 0.54 H new ATOM 0 HD2 LYS A 48 12.813 -8.046 -12.309 1.00 0.95 H new ATOM 0 HD3 LYS A 48 13.445 -6.855 -11.189 1.00 0.95 H new ATOM 0 HE2 LYS A 48 15.772 -7.492 -11.806 1.00 1.02 H new ATOM 0 HE3 LYS A 48 15.156 -8.711 -12.905 1.00 1.02 H new ATOM 0 HZ1 LYS A 48 15.479 -6.954 -14.298 1.00 2.46 H new ATOM 0 HZ2 LYS A 48 13.849 -6.710 -13.890 1.00 2.46 H new ATOM 0 HZ3 LYS A 48 15.060 -5.787 -13.138 1.00 2.46 H new ATOM 795 N GLY A 49 9.050 -8.752 -8.999 1.00 0.24 N ATOM 796 CA GLY A 49 8.076 -9.034 -7.950 1.00 0.26 C ATOM 797 C GLY A 49 7.194 -7.814 -7.677 1.00 0.24 C ATOM 798 O GLY A 49 7.177 -6.870 -8.459 1.00 0.32 O ATOM 0 H GLY A 49 8.826 -7.934 -9.566 1.00 0.24 H new ATOM 0 HA2 GLY A 49 7.453 -9.879 -8.245 1.00 0.26 H new ATOM 0 HA3 GLY A 49 8.594 -9.324 -7.036 1.00 0.26 H new ATOM 802 N ALA A 50 6.433 -7.821 -6.587 1.00 0.23 N ATOM 803 CA ALA A 50 5.464 -6.784 -6.256 1.00 0.29 C ATOM 804 C ALA A 50 5.466 -6.566 -4.744 1.00 0.29 C ATOM 805 O ALA A 50 6.281 -7.152 -4.033 1.00 0.31 O ATOM 806 CB ALA A 50 4.077 -7.203 -6.772 1.00 0.38 C ATOM 0 H ALA A 50 6.475 -8.567 -5.893 1.00 0.23 H new ATOM 0 HA ALA A 50 5.728 -5.841 -6.735 1.00 0.29 H new ATOM 0 HB1 ALA A 50 3.349 -6.430 -6.527 1.00 0.38 H new ATOM 0 HB2 ALA A 50 4.116 -7.335 -7.853 1.00 0.38 H new ATOM 0 HB3 ALA A 50 3.782 -8.141 -6.302 1.00 0.38 H new ATOM 812 N PHE A 51 4.547 -5.745 -4.235 1.00 0.36 N ATOM 813 CA PHE A 51 4.424 -5.502 -2.807 1.00 0.37 C ATOM 814 C PHE A 51 3.102 -6.074 -2.321 1.00 0.33 C ATOM 815 O PHE A 51 2.049 -5.544 -2.667 1.00 0.30 O ATOM 816 CB PHE A 51 4.526 -3.992 -2.549 1.00 0.49 C ATOM 817 CG PHE A 51 5.961 -3.545 -2.388 1.00 0.52 C ATOM 818 CD1 PHE A 51 6.616 -2.749 -3.345 1.00 1.33 C ATOM 819 CD2 PHE A 51 6.671 -4.015 -1.277 1.00 2.07 C ATOM 820 CE1 PHE A 51 7.986 -2.457 -3.202 1.00 1.20 C ATOM 821 CE2 PHE A 51 8.024 -3.708 -1.128 1.00 2.61 C ATOM 822 CZ PHE A 51 8.695 -2.938 -2.087 1.00 1.58 C ATOM 0 H PHE A 51 3.871 -5.234 -4.803 1.00 0.36 H new ATOM 0 HA PHE A 51 5.226 -5.993 -2.255 1.00 0.37 H new ATOM 0 HB2 PHE A 51 4.067 -3.450 -3.376 1.00 0.49 H new ATOM 0 HB3 PHE A 51 3.963 -3.738 -1.651 1.00 0.49 H new ATOM 0 HD1 PHE A 51 6.067 -2.361 -4.191 1.00 1.33 H new ATOM 0 HD2 PHE A 51 6.170 -4.617 -0.533 1.00 2.07 H new ATOM 0 HE1 PHE A 51 8.492 -1.863 -3.949 1.00 1.20 H new ATOM 0 HE2 PHE A 51 8.561 -4.068 -0.263 1.00 2.61 H new ATOM 0 HZ PHE A 51 9.746 -2.716 -1.971 1.00 1.58 H new ATOM 832 N ARG A 52 3.123 -7.149 -1.523 1.00 0.40 N ATOM 833 CA ARG A 52 1.883 -7.602 -0.904 1.00 0.35 C ATOM 834 C ARG A 52 1.613 -6.707 0.296 1.00 0.31 C ATOM 835 O ARG A 52 2.508 -6.512 1.126 1.00 0.34 O ATOM 836 CB ARG A 52 1.932 -9.075 -0.479 1.00 0.40 C ATOM 837 CG ARG A 52 0.503 -9.579 -0.240 1.00 0.53 C ATOM 838 CD ARG A 52 0.489 -10.969 0.388 1.00 0.46 C ATOM 839 NE ARG A 52 -0.882 -11.427 0.655 1.00 0.94 N ATOM 840 CZ ARG A 52 -1.171 -12.621 1.189 1.00 1.31 C ATOM 841 NH1 ARG A 52 -2.434 -12.976 1.419 1.00 1.86 N ATOM 842 NH2 ARG A 52 -0.184 -13.463 1.490 1.00 1.75 N ATOM 0 H ARG A 52 3.952 -7.699 -1.300 1.00 0.40 H new ATOM 0 HA ARG A 52 1.078 -7.532 -1.636 1.00 0.35 H new ATOM 0 HB2 ARG A 52 2.417 -9.673 -1.251 1.00 0.40 H new ATOM 0 HB3 ARG A 52 2.526 -9.184 0.429 1.00 0.40 H new ATOM 0 HG2 ARG A 52 -0.024 -8.881 0.410 1.00 0.53 H new ATOM 0 HG3 ARG A 52 -0.037 -9.603 -1.187 1.00 0.53 H new ATOM 0 HD2 ARG A 52 0.986 -11.675 -0.277 1.00 0.46 H new ATOM 0 HD3 ARG A 52 1.056 -10.954 1.319 1.00 0.46 H new ATOM 0 HE ARG A 52 -1.654 -10.803 0.421 1.00 0.94 H new ATOM 0 HH11 ARG A 52 -3.194 -12.336 1.188 1.00 1.86 H new ATOM 0 HH12 ARG A 52 -2.641 -13.888 1.826 1.00 1.86 H new ATOM 0 HH21 ARG A 52 0.785 -13.197 1.314 1.00 1.75 H new ATOM 0 HH22 ARG A 52 -0.397 -14.374 1.897 1.00 1.75 H new ATOM 856 N ILE A 53 0.388 -6.198 0.407 1.00 0.28 N ATOM 857 CA ILE A 53 -0.026 -5.355 1.510 1.00 0.26 C ATOM 858 C ILE A 53 -1.380 -5.824 2.024 1.00 0.26 C ATOM 859 O ILE A 53 -2.087 -6.588 1.364 1.00 0.29 O ATOM 860 CB ILE A 53 -0.016 -3.868 1.109 1.00 0.22 C ATOM 861 CG1 ILE A 53 -1.113 -3.473 0.103 1.00 0.19 C ATOM 862 CG2 ILE A 53 1.351 -3.508 0.516 1.00 0.25 C ATOM 863 CD1 ILE A 53 -1.383 -1.967 0.175 1.00 0.20 C ATOM 0 H ILE A 53 -0.349 -6.365 -0.278 1.00 0.28 H new ATOM 0 HA ILE A 53 0.688 -5.445 2.328 1.00 0.26 H new ATOM 0 HB ILE A 53 -0.219 -3.312 2.024 1.00 0.22 H new ATOM 0 HG12 ILE A 53 -0.806 -3.746 -0.906 1.00 0.19 H new ATOM 0 HG13 ILE A 53 -2.029 -4.024 0.318 1.00 0.19 H new ATOM 0 HG21 ILE A 53 1.359 -2.456 0.232 1.00 0.25 H new ATOM 0 HG22 ILE A 53 2.129 -3.689 1.258 1.00 0.25 H new ATOM 0 HG23 ILE A 53 1.539 -4.123 -0.364 1.00 0.25 H new ATOM 0 HD11 ILE A 53 -2.161 -1.702 -0.541 1.00 0.20 H new ATOM 0 HD12 ILE A 53 -1.711 -1.704 1.181 1.00 0.20 H new ATOM 0 HD13 ILE A 53 -0.470 -1.422 -0.063 1.00 0.20 H new ATOM 875 N GLU A 54 -1.729 -5.370 3.222 1.00 0.29 N ATOM 876 CA GLU A 54 -2.900 -5.819 3.938 1.00 0.25 C ATOM 877 C GLU A 54 -3.491 -4.585 4.606 1.00 0.22 C ATOM 878 O GLU A 54 -2.810 -3.922 5.393 1.00 0.25 O ATOM 879 CB GLU A 54 -2.419 -6.860 4.945 1.00 0.32 C ATOM 880 CG GLU A 54 -3.521 -7.456 5.818 1.00 0.37 C ATOM 881 CD GLU A 54 -2.823 -8.140 6.986 1.00 0.70 C ATOM 882 OE1 GLU A 54 -2.412 -9.309 6.821 1.00 0.91 O ATOM 883 OE2 GLU A 54 -2.484 -7.435 7.965 1.00 1.82 O ATOM 0 H GLU A 54 -1.190 -4.666 3.726 1.00 0.29 H new ATOM 0 HA GLU A 54 -3.667 -6.275 3.312 1.00 0.25 H new ATOM 0 HB2 GLU A 54 -1.925 -7.668 4.405 1.00 0.32 H new ATOM 0 HB3 GLU A 54 -1.669 -6.403 5.591 1.00 0.32 H new ATOM 0 HG2 GLU A 54 -4.199 -6.679 6.172 1.00 0.37 H new ATOM 0 HG3 GLU A 54 -4.121 -8.169 5.253 1.00 0.37 H new ATOM 890 N ILE A 55 -4.729 -4.237 4.254 1.00 0.34 N ATOM 891 CA ILE A 55 -5.355 -3.006 4.699 1.00 0.32 C ATOM 892 C ILE A 55 -6.393 -3.409 5.731 1.00 0.31 C ATOM 893 O ILE A 55 -7.441 -3.964 5.407 1.00 0.47 O ATOM 894 CB ILE A 55 -5.972 -2.216 3.529 1.00 0.32 C ATOM 895 CG1 ILE A 55 -5.060 -2.211 2.281 1.00 0.33 C ATOM 896 CG2 ILE A 55 -6.254 -0.782 4.000 1.00 0.35 C ATOM 897 CD1 ILE A 55 -5.559 -3.174 1.204 1.00 0.64 C ATOM 0 H ILE A 55 -5.322 -4.807 3.651 1.00 0.34 H new ATOM 0 HA ILE A 55 -4.620 -2.329 5.134 1.00 0.32 H new ATOM 0 HB ILE A 55 -6.900 -2.704 3.231 1.00 0.32 H new ATOM 0 HG12 ILE A 55 -5.012 -1.202 1.871 1.00 0.33 H new ATOM 0 HG13 ILE A 55 -4.046 -2.486 2.572 1.00 0.33 H new ATOM 0 HG21 ILE A 55 -6.691 -0.210 3.182 1.00 0.35 H new ATOM 0 HG22 ILE A 55 -6.949 -0.805 4.839 1.00 0.35 H new ATOM 0 HG23 ILE A 55 -5.322 -0.312 4.314 1.00 0.35 H new ATOM 0 HD11 ILE A 55 -4.889 -3.138 0.345 1.00 0.64 H new ATOM 0 HD12 ILE A 55 -5.582 -4.187 1.605 1.00 0.64 H new ATOM 0 HD13 ILE A 55 -6.563 -2.884 0.893 1.00 0.64 H new ATOM 909 N ASN A 56 -6.074 -3.177 6.998 1.00 0.48 N ATOM 910 CA ASN A 56 -6.962 -3.518 8.085 1.00 0.47 C ATOM 911 C ASN A 56 -7.960 -2.368 8.203 1.00 0.46 C ATOM 912 O ASN A 56 -7.589 -1.260 8.597 1.00 0.51 O ATOM 913 CB ASN A 56 -6.154 -3.705 9.378 1.00 0.53 C ATOM 914 CG ASN A 56 -5.313 -4.985 9.410 1.00 0.63 C ATOM 915 OD1 ASN A 56 -5.465 -5.791 10.318 1.00 2.18 O ATOM 916 ND2 ASN A 56 -4.404 -5.192 8.461 1.00 1.36 N ATOM 0 H ASN A 56 -5.196 -2.749 7.293 1.00 0.48 H new ATOM 0 HA ASN A 56 -7.489 -4.455 7.905 1.00 0.47 H new ATOM 0 HB2 ASN A 56 -5.495 -2.847 9.509 1.00 0.53 H new ATOM 0 HB3 ASN A 56 -6.840 -3.713 10.225 1.00 0.53 H new ATOM 0 HD21 ASN A 56 -3.824 -6.031 8.485 1.00 1.36 H new ATOM 0 HD22 ASN A 56 -4.287 -4.512 7.710 1.00 1.36 H new ATOM 923 N PHE A 57 -9.216 -2.624 7.834 1.00 0.42 N ATOM 924 CA PHE A 57 -10.251 -1.602 7.731 1.00 0.44 C ATOM 925 C PHE A 57 -11.335 -1.922 8.762 1.00 0.44 C ATOM 926 O PHE A 57 -12.264 -2.669 8.474 1.00 0.50 O ATOM 927 CB PHE A 57 -10.789 -1.574 6.287 1.00 0.49 C ATOM 928 CG PHE A 57 -10.840 -0.205 5.646 1.00 0.49 C ATOM 929 CD1 PHE A 57 -9.789 0.212 4.813 1.00 1.74 C ATOM 930 CD2 PHE A 57 -11.953 0.628 5.836 1.00 1.83 C ATOM 931 CE1 PHE A 57 -9.846 1.463 4.176 1.00 1.63 C ATOM 932 CE2 PHE A 57 -12.016 1.875 5.187 1.00 2.10 C ATOM 933 CZ PHE A 57 -10.960 2.297 4.365 1.00 0.94 C ATOM 0 H PHE A 57 -9.544 -3.560 7.596 1.00 0.42 H new ATOM 0 HA PHE A 57 -9.863 -0.606 7.946 1.00 0.44 H new ATOM 0 HB2 PHE A 57 -10.166 -2.223 5.671 1.00 0.49 H new ATOM 0 HB3 PHE A 57 -11.793 -1.998 6.282 1.00 0.49 H new ATOM 0 HD1 PHE A 57 -8.934 -0.431 4.662 1.00 1.74 H new ATOM 0 HD2 PHE A 57 -12.761 0.312 6.480 1.00 1.83 H new ATOM 0 HE1 PHE A 57 -9.033 1.783 3.541 1.00 1.63 H new ATOM 0 HE2 PHE A 57 -12.880 2.509 5.322 1.00 2.10 H new ATOM 0 HZ PHE A 57 -11.004 3.260 3.879 1.00 0.94 H new ATOM 943 N PRO A 58 -11.227 -1.425 10.000 1.00 0.49 N ATOM 944 CA PRO A 58 -12.099 -1.875 11.071 1.00 0.57 C ATOM 945 C PRO A 58 -13.536 -1.402 10.845 1.00 0.50 C ATOM 946 O PRO A 58 -13.797 -0.496 10.054 1.00 0.43 O ATOM 947 CB PRO A 58 -11.479 -1.307 12.352 1.00 0.68 C ATOM 948 CG PRO A 58 -10.737 -0.061 11.868 1.00 0.65 C ATOM 949 CD PRO A 58 -10.242 -0.476 10.483 1.00 0.55 C ATOM 0 HA PRO A 58 -12.171 -2.961 11.125 1.00 0.57 H new ATOM 0 HB2 PRO A 58 -12.241 -1.059 13.091 1.00 0.68 H new ATOM 0 HB3 PRO A 58 -10.802 -2.021 12.821 1.00 0.68 H new ATOM 0 HG2 PRO A 58 -11.394 0.807 11.819 1.00 0.65 H new ATOM 0 HG3 PRO A 58 -9.912 0.201 12.530 1.00 0.65 H new ATOM 0 HD2 PRO A 58 -10.164 0.384 9.818 1.00 0.55 H new ATOM 0 HD3 PRO A 58 -9.252 -0.928 10.537 1.00 0.55 H new ATOM 957 N ALA A 59 -14.487 -1.985 11.584 1.00 0.54 N ATOM 958 CA ALA A 59 -15.876 -1.538 11.539 1.00 0.51 C ATOM 959 C ALA A 59 -15.974 -0.062 11.895 1.00 0.40 C ATOM 960 O ALA A 59 -16.830 0.657 11.390 1.00 0.38 O ATOM 961 CB ALA A 59 -16.747 -2.363 12.482 1.00 0.59 C ATOM 0 H ALA A 59 -14.316 -2.766 12.218 1.00 0.54 H new ATOM 0 HA ALA A 59 -16.240 -1.680 10.522 1.00 0.51 H new ATOM 0 HB1 ALA A 59 -17.777 -2.009 12.429 1.00 0.59 H new ATOM 0 HB2 ALA A 59 -16.708 -3.412 12.189 1.00 0.59 H new ATOM 0 HB3 ALA A 59 -16.379 -2.258 13.503 1.00 0.59 H new ATOM 967 N GLU A 60 -15.059 0.383 12.752 1.00 0.36 N ATOM 968 CA GLU A 60 -14.899 1.758 13.162 1.00 0.29 C ATOM 969 C GLU A 60 -14.241 2.616 12.081 1.00 0.27 C ATOM 970 O GLU A 60 -13.695 3.657 12.412 1.00 0.29 O ATOM 971 CB GLU A 60 -14.013 1.775 14.408 1.00 0.32 C ATOM 972 CG GLU A 60 -14.594 0.945 15.548 1.00 0.46 C ATOM 973 CD GLU A 60 -13.655 1.077 16.742 1.00 0.61 C ATOM 974 OE1 GLU A 60 -13.842 2.018 17.544 1.00 1.58 O ATOM 975 OE2 GLU A 60 -12.627 0.365 16.764 1.00 1.93 O ATOM 0 H GLU A 60 -14.383 -0.240 13.194 1.00 0.36 H new ATOM 0 HA GLU A 60 -15.887 2.176 13.356 1.00 0.29 H new ATOM 0 HB2 GLU A 60 -13.024 1.394 14.152 1.00 0.32 H new ATOM 0 HB3 GLU A 60 -13.881 2.804 14.742 1.00 0.32 H new ATOM 0 HG2 GLU A 60 -15.593 1.296 15.806 1.00 0.46 H new ATOM 0 HG3 GLU A 60 -14.690 -0.099 15.251 1.00 0.46 H new ATOM 982 N TYR A 61 -14.292 2.251 10.800 1.00 0.28 N ATOM 983 CA TYR A 61 -13.774 3.095 9.724 1.00 0.32 C ATOM 984 C TYR A 61 -14.276 4.549 9.818 1.00 0.31 C ATOM 985 O TYR A 61 -13.469 5.477 9.782 1.00 0.34 O ATOM 986 CB TYR A 61 -14.029 2.427 8.360 1.00 0.42 C ATOM 987 CG TYR A 61 -14.555 3.314 7.242 1.00 0.45 C ATOM 988 CD1 TYR A 61 -15.764 2.999 6.593 1.00 1.52 C ATOM 989 CD2 TYR A 61 -13.818 4.439 6.832 1.00 1.86 C ATOM 990 CE1 TYR A 61 -16.241 3.800 5.541 1.00 1.53 C ATOM 991 CE2 TYR A 61 -14.295 5.252 5.793 1.00 1.90 C ATOM 992 CZ TYR A 61 -15.507 4.934 5.135 1.00 0.58 C ATOM 993 OH TYR A 61 -15.967 5.712 4.114 1.00 0.69 O ATOM 0 H TYR A 61 -14.691 1.368 10.481 1.00 0.28 H new ATOM 0 HA TYR A 61 -12.693 3.181 9.838 1.00 0.32 H new ATOM 0 HB2 TYR A 61 -13.095 1.977 8.024 1.00 0.42 H new ATOM 0 HB3 TYR A 61 -14.739 1.614 8.509 1.00 0.42 H new ATOM 0 HD1 TYR A 61 -16.330 2.134 6.906 1.00 1.52 H new ATOM 0 HD2 TYR A 61 -12.883 4.678 7.318 1.00 1.86 H new ATOM 0 HE1 TYR A 61 -17.167 3.548 5.045 1.00 1.53 H new ATOM 0 HE2 TYR A 61 -13.734 6.125 5.494 1.00 1.90 H new ATOM 0 HH TYR A 61 -15.912 6.656 4.372 1.00 0.69 H new ATOM 1003 N PRO A 62 -15.584 4.814 9.952 1.00 0.31 N ATOM 1004 CA PRO A 62 -16.042 6.189 10.043 1.00 0.35 C ATOM 1005 C PRO A 62 -15.685 6.828 11.393 1.00 0.36 C ATOM 1006 O PRO A 62 -15.849 8.032 11.551 1.00 0.41 O ATOM 1007 CB PRO A 62 -17.550 6.125 9.790 1.00 0.40 C ATOM 1008 CG PRO A 62 -17.938 4.729 10.276 1.00 0.38 C ATOM 1009 CD PRO A 62 -16.697 3.880 9.995 1.00 0.31 C ATOM 0 HA PRO A 62 -15.551 6.832 9.312 1.00 0.35 H new ATOM 0 HB2 PRO A 62 -18.082 6.902 10.339 1.00 0.40 H new ATOM 0 HB3 PRO A 62 -17.785 6.262 8.735 1.00 0.40 H new ATOM 0 HG2 PRO A 62 -18.188 4.731 11.337 1.00 0.38 H new ATOM 0 HG3 PRO A 62 -18.810 4.349 9.744 1.00 0.38 H new ATOM 0 HD2 PRO A 62 -16.550 3.131 10.773 1.00 0.31 H new ATOM 0 HD3 PRO A 62 -16.795 3.344 9.051 1.00 0.31 H new ATOM 1017 N PHE A 63 -15.197 6.045 12.360 1.00 0.33 N ATOM 1018 CA PHE A 63 -14.747 6.474 13.679 1.00 0.36 C ATOM 1019 C PHE A 63 -13.230 6.703 13.764 1.00 0.37 C ATOM 1020 O PHE A 63 -12.791 7.445 14.639 1.00 0.48 O ATOM 1021 CB PHE A 63 -15.177 5.432 14.722 1.00 0.35 C ATOM 1022 CG PHE A 63 -16.465 5.770 15.436 1.00 0.38 C ATOM 1023 CD1 PHE A 63 -17.699 5.318 14.934 1.00 1.85 C ATOM 1024 CD2 PHE A 63 -16.424 6.528 16.620 1.00 1.84 C ATOM 1025 CE1 PHE A 63 -18.887 5.615 15.623 1.00 1.96 C ATOM 1026 CE2 PHE A 63 -17.612 6.824 17.308 1.00 1.80 C ATOM 1027 CZ PHE A 63 -18.845 6.366 16.811 1.00 0.66 C ATOM 0 H PHE A 63 -15.102 5.038 12.231 1.00 0.33 H new ATOM 0 HA PHE A 63 -15.214 7.439 13.878 1.00 0.36 H new ATOM 0 HB2 PHE A 63 -15.289 4.466 14.230 1.00 0.35 H new ATOM 0 HB3 PHE A 63 -14.382 5.323 15.460 1.00 0.35 H new ATOM 0 HD1 PHE A 63 -17.733 4.743 14.020 1.00 1.85 H new ATOM 0 HD2 PHE A 63 -15.478 6.883 17.001 1.00 1.84 H new ATOM 0 HE1 PHE A 63 -19.834 5.266 15.239 1.00 1.96 H new ATOM 0 HE2 PHE A 63 -17.579 7.403 18.219 1.00 1.80 H new ATOM 0 HZ PHE A 63 -19.759 6.591 17.341 1.00 0.66 H new ATOM 1037 N LYS A 64 -12.406 6.048 12.939 1.00 0.29 N ATOM 1038 CA LYS A 64 -10.952 6.203 12.970 1.00 0.27 C ATOM 1039 C LYS A 64 -10.378 5.707 11.646 1.00 0.24 C ATOM 1040 O LYS A 64 -10.974 4.837 11.015 1.00 0.26 O ATOM 1041 CB LYS A 64 -10.358 5.427 14.159 1.00 0.34 C ATOM 1042 CG LYS A 64 -10.420 3.902 13.988 1.00 1.34 C ATOM 1043 CD LYS A 64 -10.128 3.174 15.305 1.00 1.56 C ATOM 1044 CE LYS A 64 -11.295 3.384 16.276 1.00 2.64 C ATOM 1045 NZ LYS A 64 -11.186 2.554 17.490 1.00 3.11 N ATOM 0 H LYS A 64 -12.733 5.393 12.229 1.00 0.29 H new ATOM 0 HA LYS A 64 -10.691 7.253 13.101 1.00 0.27 H new ATOM 0 HB2 LYS A 64 -9.319 5.727 14.296 1.00 0.34 H new ATOM 0 HB3 LYS A 64 -10.893 5.705 15.067 1.00 0.34 H new ATOM 0 HG2 LYS A 64 -11.407 3.616 13.625 1.00 1.34 H new ATOM 0 HG3 LYS A 64 -9.699 3.591 13.232 1.00 1.34 H new ATOM 0 HD2 LYS A 64 -9.982 2.110 15.120 1.00 1.56 H new ATOM 0 HD3 LYS A 64 -9.204 3.551 15.744 1.00 1.56 H new ATOM 0 HE2 LYS A 64 -11.338 4.435 16.563 1.00 2.64 H new ATOM 0 HE3 LYS A 64 -12.231 3.154 15.767 1.00 2.64 H new ATOM 0 HZ1 LYS A 64 -11.964 2.786 18.140 1.00 3.11 H new ATOM 0 HZ2 LYS A 64 -11.241 1.549 17.229 1.00 3.11 H new ATOM 0 HZ3 LYS A 64 -10.276 2.741 17.958 1.00 3.11 H new ATOM 1059 N PRO A 65 -9.225 6.220 11.203 1.00 0.23 N ATOM 1060 CA PRO A 65 -8.667 5.811 9.932 1.00 0.23 C ATOM 1061 C PRO A 65 -8.186 4.354 10.000 1.00 0.24 C ATOM 1062 O PRO A 65 -7.808 3.869 11.067 1.00 0.28 O ATOM 1063 CB PRO A 65 -7.531 6.797 9.656 1.00 0.27 C ATOM 1064 CG PRO A 65 -7.085 7.236 11.051 1.00 0.28 C ATOM 1065 CD PRO A 65 -8.375 7.189 11.871 1.00 0.24 C ATOM 0 HA PRO A 65 -9.398 5.834 9.123 1.00 0.23 H new ATOM 0 HB2 PRO A 65 -6.717 6.326 9.105 1.00 0.27 H new ATOM 0 HB3 PRO A 65 -7.872 7.643 9.060 1.00 0.27 H new ATOM 0 HG2 PRO A 65 -6.326 6.568 11.458 1.00 0.28 H new ATOM 0 HG3 PRO A 65 -6.654 8.237 11.038 1.00 0.28 H new ATOM 0 HD2 PRO A 65 -8.175 6.892 12.900 1.00 0.24 H new ATOM 0 HD3 PRO A 65 -8.852 8.169 11.909 1.00 0.24 H new ATOM 1073 N PRO A 66 -8.189 3.655 8.859 1.00 0.25 N ATOM 1074 CA PRO A 66 -7.677 2.299 8.721 1.00 0.30 C ATOM 1075 C PRO A 66 -6.155 2.303 8.867 1.00 0.32 C ATOM 1076 O PRO A 66 -5.510 3.347 8.763 1.00 0.43 O ATOM 1077 CB PRO A 66 -8.111 1.851 7.323 1.00 0.38 C ATOM 1078 CG PRO A 66 -8.122 3.166 6.551 1.00 0.41 C ATOM 1079 CD PRO A 66 -8.607 4.181 7.575 1.00 0.32 C ATOM 0 HA PRO A 66 -8.058 1.621 9.485 1.00 0.30 H new ATOM 0 HB2 PRO A 66 -7.415 1.132 6.892 1.00 0.38 H new ATOM 0 HB3 PRO A 66 -9.093 1.377 7.334 1.00 0.38 H new ATOM 0 HG2 PRO A 66 -7.130 3.418 6.176 1.00 0.41 H new ATOM 0 HG3 PRO A 66 -8.787 3.118 5.688 1.00 0.41 H new ATOM 0 HD2 PRO A 66 -8.172 5.164 7.392 1.00 0.32 H new ATOM 0 HD3 PRO A 66 -9.690 4.298 7.531 1.00 0.32 H new ATOM 1087 N LYS A 67 -5.559 1.124 9.054 1.00 0.27 N ATOM 1088 CA LYS A 67 -4.109 0.974 9.105 1.00 0.29 C ATOM 1089 C LYS A 67 -3.712 -0.019 8.033 1.00 0.20 C ATOM 1090 O LYS A 67 -4.519 -0.843 7.611 1.00 0.29 O ATOM 1091 CB LYS A 67 -3.649 0.515 10.499 1.00 0.44 C ATOM 1092 CG LYS A 67 -3.177 1.702 11.352 1.00 1.07 C ATOM 1093 CD LYS A 67 -1.734 2.128 11.036 1.00 1.05 C ATOM 1094 CE LYS A 67 -0.725 1.201 11.734 1.00 1.50 C ATOM 1095 NZ LYS A 67 0.672 1.668 11.578 1.00 2.29 N ATOM 0 H LYS A 67 -6.070 0.249 9.174 1.00 0.27 H new ATOM 0 HA LYS A 67 -3.622 1.932 8.921 1.00 0.29 H new ATOM 0 HB2 LYS A 67 -4.469 0.005 11.005 1.00 0.44 H new ATOM 0 HB3 LYS A 67 -2.839 -0.207 10.397 1.00 0.44 H new ATOM 0 HG2 LYS A 67 -3.844 2.548 11.189 1.00 1.07 H new ATOM 0 HG3 LYS A 67 -3.250 1.437 12.407 1.00 1.07 H new ATOM 0 HD2 LYS A 67 -1.571 2.105 9.959 1.00 1.05 H new ATOM 0 HD3 LYS A 67 -1.574 3.156 11.360 1.00 1.05 H new ATOM 0 HE2 LYS A 67 -0.968 1.137 12.795 1.00 1.50 H new ATOM 0 HE3 LYS A 67 -0.817 0.195 11.325 1.00 1.50 H new ATOM 0 HZ1 LYS A 67 1.284 1.161 12.249 1.00 2.29 H new ATOM 0 HZ2 LYS A 67 0.994 1.482 10.607 1.00 2.29 H new ATOM 0 HZ3 LYS A 67 0.720 2.689 11.769 1.00 2.29 H new ATOM 1109 N ILE A 68 -2.463 0.059 7.592 1.00 0.16 N ATOM 1110 CA ILE A 68 -1.950 -0.809 6.552 1.00 0.14 C ATOM 1111 C ILE A 68 -0.615 -1.343 7.032 1.00 0.17 C ATOM 1112 O ILE A 68 0.131 -0.618 7.698 1.00 0.25 O ATOM 1113 CB ILE A 68 -1.770 -0.044 5.230 1.00 0.14 C ATOM 1114 CG1 ILE A 68 -2.752 1.133 5.101 1.00 0.17 C ATOM 1115 CG2 ILE A 68 -1.916 -0.999 4.042 1.00 0.19 C ATOM 1116 CD1 ILE A 68 -2.492 1.899 3.818 1.00 0.23 C ATOM 0 H ILE A 68 -1.780 0.728 7.949 1.00 0.16 H new ATOM 0 HA ILE A 68 -2.652 -1.621 6.361 1.00 0.14 H new ATOM 0 HB ILE A 68 -0.764 0.377 5.230 1.00 0.14 H new ATOM 0 HG12 ILE A 68 -3.777 0.763 5.110 1.00 0.17 H new ATOM 0 HG13 ILE A 68 -2.646 1.799 5.958 1.00 0.17 H new ATOM 0 HG21 ILE A 68 -1.787 -0.445 3.112 1.00 0.19 H new ATOM 0 HG22 ILE A 68 -1.159 -1.780 4.108 1.00 0.19 H new ATOM 0 HG23 ILE A 68 -2.907 -1.452 4.059 1.00 0.19 H new ATOM 0 HD11 ILE A 68 -3.195 2.729 3.741 1.00 0.23 H new ATOM 0 HD12 ILE A 68 -1.473 2.286 3.825 1.00 0.23 H new ATOM 0 HD13 ILE A 68 -2.621 1.234 2.964 1.00 0.23 H new ATOM 1128 N THR A 69 -0.307 -2.580 6.654 1.00 0.17 N ATOM 1129 CA THR A 69 0.979 -3.162 6.966 1.00 0.17 C ATOM 1130 C THR A 69 1.405 -4.014 5.778 1.00 0.17 C ATOM 1131 O THR A 69 0.689 -4.930 5.364 1.00 0.20 O ATOM 1132 CB THR A 69 0.870 -3.984 8.260 1.00 0.20 C ATOM 1133 OG1 THR A 69 -0.028 -3.384 9.176 1.00 0.30 O ATOM 1134 CG2 THR A 69 2.233 -4.085 8.941 1.00 0.20 C ATOM 0 H THR A 69 -0.934 -3.192 6.132 1.00 0.17 H new ATOM 0 HA THR A 69 1.734 -2.395 7.137 1.00 0.17 H new ATOM 0 HB THR A 69 0.505 -4.973 7.982 1.00 0.20 H new ATOM 0 HG1 THR A 69 -0.079 -3.929 9.989 1.00 0.30 H new ATOM 0 HG21 THR A 69 2.140 -4.670 9.856 1.00 0.20 H new ATOM 0 HG22 THR A 69 2.940 -4.572 8.269 1.00 0.20 H new ATOM 0 HG23 THR A 69 2.593 -3.085 9.184 1.00 0.20 H new ATOM 1142 N PHE A 70 2.558 -3.696 5.194 1.00 0.19 N ATOM 1143 CA PHE A 70 3.116 -4.488 4.116 1.00 0.21 C ATOM 1144 C PHE A 70 3.542 -5.826 4.702 1.00 0.22 C ATOM 1145 O PHE A 70 4.123 -5.884 5.783 1.00 0.26 O ATOM 1146 CB PHE A 70 4.305 -3.776 3.456 1.00 0.21 C ATOM 1147 CG PHE A 70 3.948 -2.605 2.549 1.00 0.20 C ATOM 1148 CD1 PHE A 70 3.077 -1.578 2.968 1.00 0.19 C ATOM 1149 CD2 PHE A 70 4.501 -2.547 1.257 1.00 0.23 C ATOM 1150 CE1 PHE A 70 2.777 -0.512 2.104 1.00 0.19 C ATOM 1151 CE2 PHE A 70 4.235 -1.461 0.408 1.00 0.24 C ATOM 1152 CZ PHE A 70 3.382 -0.434 0.838 1.00 0.21 C ATOM 0 H PHE A 70 3.123 -2.888 5.456 1.00 0.19 H new ATOM 0 HA PHE A 70 2.369 -4.634 3.336 1.00 0.21 H new ATOM 0 HB2 PHE A 70 4.971 -3.416 4.240 1.00 0.21 H new ATOM 0 HB3 PHE A 70 4.865 -4.507 2.873 1.00 0.21 H new ATOM 0 HD1 PHE A 70 2.640 -1.611 3.955 1.00 0.19 H new ATOM 0 HD2 PHE A 70 5.139 -3.348 0.914 1.00 0.23 H new ATOM 0 HE1 PHE A 70 2.078 0.251 2.414 1.00 0.19 H new ATOM 0 HE2 PHE A 70 4.685 -1.417 -0.573 1.00 0.24 H new ATOM 0 HZ PHE A 70 3.191 0.415 0.198 1.00 0.21 H new ATOM 1162 N LYS A 71 3.239 -6.911 3.994 1.00 0.28 N ATOM 1163 CA LYS A 71 3.713 -8.233 4.372 1.00 0.31 C ATOM 1164 C LYS A 71 5.161 -8.388 3.903 1.00 0.32 C ATOM 1165 O LYS A 71 5.982 -8.986 4.591 1.00 0.37 O ATOM 1166 CB LYS A 71 2.816 -9.305 3.741 1.00 0.35 C ATOM 1167 CG LYS A 71 1.307 -9.124 3.989 1.00 0.46 C ATOM 1168 CD LYS A 71 0.837 -9.403 5.424 1.00 0.57 C ATOM 1169 CE LYS A 71 0.922 -8.178 6.344 1.00 0.86 C ATOM 1170 NZ LYS A 71 0.216 -8.426 7.624 1.00 1.32 N ATOM 0 H LYS A 71 2.664 -6.897 3.152 1.00 0.28 H new ATOM 0 HA LYS A 71 3.674 -8.353 5.455 1.00 0.31 H new ATOM 0 HB2 LYS A 71 2.993 -9.317 2.665 1.00 0.35 H new ATOM 0 HB3 LYS A 71 3.117 -10.280 4.124 1.00 0.35 H new ATOM 0 HG2 LYS A 71 1.033 -8.102 3.727 1.00 0.46 H new ATOM 0 HG3 LYS A 71 0.763 -9.783 3.312 1.00 0.46 H new ATOM 0 HD2 LYS A 71 -0.193 -9.757 5.398 1.00 0.57 H new ATOM 0 HD3 LYS A 71 1.440 -10.207 5.846 1.00 0.57 H new ATOM 0 HE2 LYS A 71 1.967 -7.938 6.541 1.00 0.86 H new ATOM 0 HE3 LYS A 71 0.485 -7.313 5.845 1.00 0.86 H new ATOM 0 HZ1 LYS A 71 -0.287 -7.564 7.916 1.00 1.32 H new ATOM 0 HZ2 LYS A 71 -0.467 -9.200 7.499 1.00 1.32 H new ATOM 0 HZ3 LYS A 71 0.906 -8.689 8.356 1.00 1.32 H new ATOM 1184 N THR A 72 5.462 -7.883 2.707 1.00 0.31 N ATOM 1185 CA THR A 72 6.770 -8.041 2.085 1.00 0.33 C ATOM 1186 C THR A 72 7.711 -6.897 2.492 1.00 0.43 C ATOM 1187 O THR A 72 7.237 -5.811 2.819 1.00 0.54 O ATOM 1188 CB THR A 72 6.576 -8.124 0.567 1.00 0.29 C ATOM 1189 OG1 THR A 72 5.824 -7.026 0.080 1.00 0.35 O ATOM 1190 CG2 THR A 72 5.761 -9.365 0.188 1.00 0.24 C ATOM 0 H THR A 72 4.800 -7.351 2.142 1.00 0.31 H new ATOM 0 HA THR A 72 7.244 -8.960 2.429 1.00 0.33 H new ATOM 0 HB THR A 72 7.578 -8.144 0.139 1.00 0.29 H new ATOM 0 HG1 THR A 72 5.822 -6.309 0.748 1.00 0.35 H new ATOM 0 HG21 THR A 72 5.637 -9.402 -0.894 1.00 0.24 H new ATOM 0 HG22 THR A 72 6.284 -10.260 0.524 1.00 0.24 H new ATOM 0 HG23 THR A 72 4.782 -9.317 0.664 1.00 0.24 H new ATOM 1198 N LYS A 73 9.034 -7.119 2.474 1.00 0.47 N ATOM 1199 CA LYS A 73 10.017 -6.150 2.962 1.00 0.38 C ATOM 1200 C LYS A 73 10.052 -4.919 2.076 1.00 0.48 C ATOM 1201 O LYS A 73 10.205 -5.055 0.867 1.00 0.93 O ATOM 1202 CB LYS A 73 11.437 -6.732 2.948 1.00 0.38 C ATOM 1203 CG LYS A 73 11.612 -7.978 3.805 1.00 0.92 C ATOM 1204 CD LYS A 73 11.105 -7.761 5.225 1.00 0.48 C ATOM 1205 CE LYS A 73 11.794 -8.787 6.129 1.00 0.70 C ATOM 1206 NZ LYS A 73 11.281 -8.728 7.511 1.00 1.36 N ATOM 0 H LYS A 73 9.450 -7.980 2.119 1.00 0.47 H new ATOM 0 HA LYS A 73 9.713 -5.898 3.978 1.00 0.38 H new ATOM 0 HB2 LYS A 73 11.709 -6.971 1.920 1.00 0.38 H new ATOM 0 HB3 LYS A 73 12.134 -5.968 3.292 1.00 0.38 H new ATOM 0 HG2 LYS A 73 11.075 -8.811 3.350 1.00 0.92 H new ATOM 0 HG3 LYS A 73 12.666 -8.255 3.833 1.00 0.92 H new ATOM 0 HD2 LYS A 73 11.327 -6.747 5.559 1.00 0.48 H new ATOM 0 HD3 LYS A 73 10.022 -7.881 5.267 1.00 0.48 H new ATOM 0 HE2 LYS A 73 11.640 -9.788 5.726 1.00 0.70 H new ATOM 0 HE3 LYS A 73 12.869 -8.606 6.132 1.00 0.70 H new ATOM 0 HZ1 LYS A 73 11.771 -9.437 8.094 1.00 1.36 H new ATOM 0 HZ2 LYS A 73 11.450 -7.780 7.904 1.00 1.36 H new ATOM 0 HZ3 LYS A 73 10.260 -8.926 7.511 1.00 1.36 H new ATOM 1220 N ILE A 74 10.016 -3.730 2.672 1.00 0.28 N ATOM 1221 CA ILE A 74 9.931 -2.477 1.936 1.00 0.29 C ATOM 1222 C ILE A 74 11.280 -1.770 1.945 1.00 0.28 C ATOM 1223 O ILE A 74 12.070 -1.944 2.866 1.00 0.37 O ATOM 1224 CB ILE A 74 8.818 -1.582 2.517 1.00 0.32 C ATOM 1225 CG1 ILE A 74 9.026 -1.169 3.985 1.00 0.31 C ATOM 1226 CG2 ILE A 74 7.488 -2.331 2.398 1.00 0.44 C ATOM 1227 CD1 ILE A 74 9.874 0.097 4.162 1.00 0.31 C ATOM 0 H ILE A 74 10.045 -3.611 3.685 1.00 0.28 H new ATOM 0 HA ILE A 74 9.672 -2.692 0.899 1.00 0.29 H new ATOM 0 HB ILE A 74 8.832 -0.657 1.941 1.00 0.32 H new ATOM 0 HG12 ILE A 74 8.052 -1.010 4.448 1.00 0.31 H new ATOM 0 HG13 ILE A 74 9.503 -1.991 4.519 1.00 0.31 H new ATOM 0 HG21 ILE A 74 6.686 -1.715 2.804 1.00 0.44 H new ATOM 0 HG22 ILE A 74 7.285 -2.547 1.349 1.00 0.44 H new ATOM 0 HG23 ILE A 74 7.545 -3.265 2.956 1.00 0.44 H new ATOM 0 HD11 ILE A 74 9.975 0.322 5.224 1.00 0.31 H new ATOM 0 HD12 ILE A 74 10.862 -0.063 3.730 1.00 0.31 H new ATOM 0 HD13 ILE A 74 9.389 0.933 3.658 1.00 0.31 H new ATOM 1239 N TYR A 75 11.499 -0.922 0.937 1.00 0.29 N ATOM 1240 CA TYR A 75 12.648 -0.024 0.850 1.00 0.32 C ATOM 1241 C TYR A 75 12.182 1.413 0.598 1.00 0.42 C ATOM 1242 O TYR A 75 12.974 2.275 0.230 1.00 0.78 O ATOM 1243 CB TYR A 75 13.593 -0.502 -0.268 1.00 0.37 C ATOM 1244 CG TYR A 75 15.015 -0.715 0.204 1.00 0.67 C ATOM 1245 CD1 TYR A 75 15.770 0.361 0.711 1.00 2.12 C ATOM 1246 CD2 TYR A 75 15.572 -2.004 0.166 1.00 1.87 C ATOM 1247 CE1 TYR A 75 17.074 0.144 1.196 1.00 2.45 C ATOM 1248 CE2 TYR A 75 16.858 -2.236 0.676 1.00 2.22 C ATOM 1249 CZ TYR A 75 17.618 -1.162 1.188 1.00 1.84 C ATOM 1250 OH TYR A 75 18.882 -1.395 1.639 1.00 2.42 O ATOM 0 H TYR A 75 10.866 -0.841 0.141 1.00 0.29 H new ATOM 0 HA TYR A 75 13.191 -0.039 1.795 1.00 0.32 H new ATOM 0 HB2 TYR A 75 13.211 -1.435 -0.683 1.00 0.37 H new ATOM 0 HB3 TYR A 75 13.591 0.231 -1.075 1.00 0.37 H new ATOM 0 HD1 TYR A 75 15.348 1.355 0.728 1.00 2.12 H new ATOM 0 HD2 TYR A 75 15.007 -2.821 -0.258 1.00 1.87 H new ATOM 0 HE1 TYR A 75 17.657 0.972 1.573 1.00 2.45 H new ATOM 0 HE2 TYR A 75 17.267 -3.236 0.677 1.00 2.22 H new ATOM 0 HH TYR A 75 19.087 -2.350 1.559 1.00 2.42 H new ATOM 1260 N HIS A 76 10.883 1.681 0.752 1.00 0.29 N ATOM 1261 CA HIS A 76 10.312 2.984 0.458 1.00 0.28 C ATOM 1262 C HIS A 76 10.155 3.736 1.766 1.00 0.24 C ATOM 1263 O HIS A 76 9.602 3.170 2.701 1.00 0.24 O ATOM 1264 CB HIS A 76 8.939 2.814 -0.191 1.00 0.33 C ATOM 1265 CG HIS A 76 9.034 2.379 -1.622 1.00 0.59 C ATOM 1266 ND1 HIS A 76 9.083 1.076 -2.085 1.00 0.70 N ATOM 1267 CD2 HIS A 76 9.065 3.226 -2.693 1.00 1.16 C ATOM 1268 CE1 HIS A 76 9.168 1.136 -3.425 1.00 1.12 C ATOM 1269 NE2 HIS A 76 9.136 2.427 -3.809 1.00 1.44 N ATOM 0 H HIS A 76 10.203 0.997 1.084 1.00 0.29 H new ATOM 0 HA HIS A 76 10.962 3.531 -0.225 1.00 0.28 H new ATOM 0 HB2 HIS A 76 8.362 2.080 0.372 1.00 0.33 H new ATOM 0 HB3 HIS A 76 8.395 3.757 -0.136 1.00 0.33 H new ATOM 0 HD2 HIS A 76 9.039 4.305 -2.668 1.00 1.16 H new ATOM 0 HE1 HIS A 76 9.249 0.287 -4.087 1.00 1.12 H new ATOM 0 HE2 HIS A 76 9.161 2.758 -4.773 1.00 1.44 H new ATOM 1278 N PRO A 77 10.545 5.012 1.820 1.00 0.25 N ATOM 1279 CA PRO A 77 10.526 5.803 3.038 1.00 0.25 C ATOM 1280 C PRO A 77 9.108 6.065 3.533 1.00 0.24 C ATOM 1281 O PRO A 77 8.897 6.331 4.711 1.00 0.20 O ATOM 1282 CB PRO A 77 11.227 7.105 2.662 1.00 0.25 C ATOM 1283 CG PRO A 77 10.953 7.247 1.167 1.00 0.26 C ATOM 1284 CD PRO A 77 11.017 5.799 0.695 1.00 0.27 C ATOM 0 HA PRO A 77 11.020 5.284 3.859 1.00 0.25 H new ATOM 0 HB2 PRO A 77 10.829 7.950 3.224 1.00 0.25 H new ATOM 0 HB3 PRO A 77 12.296 7.059 2.870 1.00 0.25 H new ATOM 0 HG2 PRO A 77 9.980 7.697 0.971 1.00 0.26 H new ATOM 0 HG3 PRO A 77 11.698 7.871 0.673 1.00 0.26 H new ATOM 0 HD2 PRO A 77 10.392 5.643 -0.184 1.00 0.27 H new ATOM 0 HD3 PRO A 77 12.033 5.520 0.417 1.00 0.27 H new ATOM 1292 N ASN A 78 8.125 6.051 2.635 1.00 0.31 N ATOM 1293 CA ASN A 78 6.736 6.289 2.997 1.00 0.26 C ATOM 1294 C ASN A 78 6.137 5.148 3.823 1.00 0.22 C ATOM 1295 O ASN A 78 5.053 5.316 4.381 1.00 0.26 O ATOM 1296 CB ASN A 78 5.929 6.547 1.724 1.00 0.40 C ATOM 1297 CG ASN A 78 6.104 7.994 1.286 1.00 1.37 C ATOM 1298 OD1 ASN A 78 6.861 8.285 0.369 1.00 1.31 O ATOM 1299 ND2 ASN A 78 5.435 8.923 1.956 1.00 3.19 N ATOM 0 H ASN A 78 8.271 5.875 1.641 1.00 0.31 H new ATOM 0 HA ASN A 78 6.694 7.168 3.640 1.00 0.26 H new ATOM 0 HB2 ASN A 78 6.259 5.875 0.931 1.00 0.40 H new ATOM 0 HB3 ASN A 78 4.874 6.337 1.902 1.00 0.40 H new ATOM 0 HD21 ASN A 78 5.545 9.907 1.711 1.00 3.19 H new ATOM 0 HD22 ASN A 78 4.810 8.653 2.716 1.00 3.19 H new ATOM 1306 N ILE A 79 6.823 4.005 3.910 1.00 0.22 N ATOM 1307 CA ILE A 79 6.473 2.885 4.762 1.00 0.21 C ATOM 1308 C ILE A 79 7.669 2.682 5.710 1.00 0.24 C ATOM 1309 O ILE A 79 8.742 3.243 5.496 1.00 0.30 O ATOM 1310 CB ILE A 79 6.126 1.672 3.865 1.00 0.20 C ATOM 1311 CG1 ILE A 79 5.134 2.085 2.759 1.00 0.23 C ATOM 1312 CG2 ILE A 79 5.517 0.486 4.639 1.00 0.23 C ATOM 1313 CD1 ILE A 79 5.766 2.169 1.365 1.00 0.47 C ATOM 0 H ILE A 79 7.668 3.837 3.365 1.00 0.22 H new ATOM 0 HA ILE A 79 5.587 3.045 5.377 1.00 0.21 H new ATOM 0 HB ILE A 79 7.075 1.343 3.441 1.00 0.20 H new ATOM 0 HG12 ILE A 79 4.313 1.369 2.733 1.00 0.23 H new ATOM 0 HG13 ILE A 79 4.704 3.054 3.012 1.00 0.23 H new ATOM 0 HG21 ILE A 79 5.299 -0.327 3.946 1.00 0.23 H new ATOM 0 HG22 ILE A 79 6.225 0.141 5.392 1.00 0.23 H new ATOM 0 HG23 ILE A 79 4.595 0.804 5.126 1.00 0.23 H new ATOM 0 HD11 ILE A 79 5.008 2.465 0.639 1.00 0.47 H new ATOM 0 HD12 ILE A 79 6.568 2.907 1.373 1.00 0.47 H new ATOM 0 HD13 ILE A 79 6.171 1.195 1.090 1.00 0.47 H new ATOM 1325 N ASP A 80 7.492 1.917 6.781 1.00 0.24 N ATOM 1326 CA ASP A 80 8.517 1.583 7.756 1.00 0.28 C ATOM 1327 C ASP A 80 8.951 0.141 7.522 1.00 0.26 C ATOM 1328 O ASP A 80 8.236 -0.615 6.868 1.00 0.26 O ATOM 1329 CB ASP A 80 7.903 1.697 9.150 1.00 0.34 C ATOM 1330 CG ASP A 80 8.863 1.215 10.227 1.00 0.44 C ATOM 1331 OD1 ASP A 80 10.019 1.692 10.207 1.00 1.44 O ATOM 1332 OD2 ASP A 80 8.453 0.299 10.974 1.00 1.11 O ATOM 0 H ASP A 80 6.590 1.495 7.001 1.00 0.24 H new ATOM 0 HA ASP A 80 9.373 2.251 7.664 1.00 0.28 H new ATOM 0 HB2 ASP A 80 7.629 2.734 9.344 1.00 0.34 H new ATOM 0 HB3 ASP A 80 6.984 1.112 9.192 1.00 0.34 H new ATOM 1337 N GLU A 81 10.080 -0.281 8.093 1.00 0.26 N ATOM 1338 CA GLU A 81 10.529 -1.661 7.981 1.00 0.27 C ATOM 1339 C GLU A 81 9.475 -2.665 8.441 1.00 0.28 C ATOM 1340 O GLU A 81 9.328 -3.723 7.830 1.00 0.35 O ATOM 1341 CB GLU A 81 11.818 -1.885 8.770 1.00 0.31 C ATOM 1342 CG GLU A 81 13.032 -1.418 7.961 1.00 0.70 C ATOM 1343 CD GLU A 81 14.321 -1.997 8.542 1.00 1.88 C ATOM 1344 OE1 GLU A 81 15.075 -1.218 9.164 1.00 2.92 O ATOM 1345 OE2 GLU A 81 14.521 -3.220 8.360 1.00 2.74 O ATOM 0 H GLU A 81 10.699 0.319 8.639 1.00 0.26 H new ATOM 0 HA GLU A 81 10.713 -1.832 6.920 1.00 0.27 H new ATOM 0 HB2 GLU A 81 11.772 -1.342 9.714 1.00 0.31 H new ATOM 0 HB3 GLU A 81 11.922 -2.942 9.015 1.00 0.31 H new ATOM 0 HG2 GLU A 81 12.924 -1.728 6.922 1.00 0.70 H new ATOM 0 HG3 GLU A 81 13.082 -0.329 7.966 1.00 0.70 H new ATOM 1352 N LYS A 82 8.699 -2.357 9.483 1.00 0.25 N ATOM 1353 CA LYS A 82 7.618 -3.247 9.906 1.00 0.29 C ATOM 1354 C LYS A 82 6.398 -3.149 8.982 1.00 0.29 C ATOM 1355 O LYS A 82 5.293 -3.489 9.391 1.00 0.34 O ATOM 1356 CB LYS A 82 7.254 -2.928 11.367 1.00 0.34 C ATOM 1357 CG LYS A 82 8.152 -3.641 12.382 1.00 0.75 C ATOM 1358 CD LYS A 82 8.084 -5.165 12.221 1.00 2.61 C ATOM 1359 CE LYS A 82 8.461 -5.848 13.538 1.00 2.41 C ATOM 1360 NZ LYS A 82 8.640 -7.306 13.367 1.00 4.49 N ATOM 0 H LYS A 82 8.797 -1.510 10.042 1.00 0.25 H new ATOM 0 HA LYS A 82 7.962 -4.279 9.838 1.00 0.29 H new ATOM 0 HB2 LYS A 82 7.322 -1.852 11.525 1.00 0.34 H new ATOM 0 HB3 LYS A 82 6.217 -3.212 11.547 1.00 0.34 H new ATOM 0 HG2 LYS A 82 9.182 -3.307 12.256 1.00 0.75 H new ATOM 0 HG3 LYS A 82 7.849 -3.367 13.393 1.00 0.75 H new ATOM 0 HD2 LYS A 82 7.079 -5.463 11.922 1.00 2.61 H new ATOM 0 HD3 LYS A 82 8.760 -5.486 11.429 1.00 2.61 H new ATOM 0 HE2 LYS A 82 9.382 -5.411 13.924 1.00 2.41 H new ATOM 0 HE3 LYS A 82 7.685 -5.661 14.280 1.00 2.41 H new ATOM 0 HZ1 LYS A 82 8.895 -7.734 14.280 1.00 4.49 H new ATOM 0 HZ2 LYS A 82 7.753 -7.727 13.023 1.00 4.49 H new ATOM 0 HZ3 LYS A 82 9.398 -7.484 12.678 1.00 4.49 H new ATOM 1374 N GLY A 83 6.554 -2.673 7.747 1.00 0.27 N ATOM 1375 CA GLY A 83 5.475 -2.510 6.801 1.00 0.27 C ATOM 1376 C GLY A 83 4.493 -1.411 7.196 1.00 0.25 C ATOM 1377 O GLY A 83 3.531 -1.193 6.464 1.00 0.23 O ATOM 0 H GLY A 83 7.460 -2.386 7.378 1.00 0.27 H new ATOM 0 HA2 GLY A 83 5.891 -2.281 5.820 1.00 0.27 H new ATOM 0 HA3 GLY A 83 4.937 -3.453 6.707 1.00 0.27 H new ATOM 1381 N GLN A 84 4.688 -0.729 8.327 1.00 0.27 N ATOM 1382 CA GLN A 84 3.733 0.259 8.793 1.00 0.27 C ATOM 1383 C GLN A 84 3.714 1.449 7.854 1.00 0.26 C ATOM 1384 O GLN A 84 4.736 1.804 7.283 1.00 0.28 O ATOM 1385 CB GLN A 84 4.117 0.776 10.176 1.00 0.31 C ATOM 1386 CG GLN A 84 4.069 -0.305 11.251 1.00 0.42 C ATOM 1387 CD GLN A 84 4.067 0.377 12.608 1.00 0.80 C ATOM 1388 OE1 GLN A 84 3.002 0.752 13.093 1.00 1.23 O ATOM 1389 NE2 GLN A 84 5.236 0.611 13.191 1.00 1.30 N ATOM 0 H GLN A 84 5.501 -0.848 8.932 1.00 0.27 H new ATOM 0 HA GLN A 84 2.756 -0.223 8.830 1.00 0.27 H new ATOM 0 HB2 GLN A 84 5.122 1.195 10.135 1.00 0.31 H new ATOM 0 HB3 GLN A 84 3.444 1.587 10.454 1.00 0.31 H new ATOM 0 HG2 GLN A 84 3.177 -0.920 11.133 1.00 0.42 H new ATOM 0 HG3 GLN A 84 4.928 -0.970 11.161 1.00 0.42 H new ATOM 0 HE21 GLN A 84 6.098 0.283 12.755 1.00 1.30 H new ATOM 0 HE22 GLN A 84 5.273 1.119 14.075 1.00 1.30 H new ATOM 1398 N VAL A 85 2.579 2.124 7.751 1.00 0.28 N ATOM 1399 CA VAL A 85 2.449 3.271 6.875 1.00 0.25 C ATOM 1400 C VAL A 85 2.050 4.496 7.690 1.00 0.24 C ATOM 1401 O VAL A 85 1.429 4.355 8.745 1.00 0.25 O ATOM 1402 CB VAL A 85 1.417 2.932 5.800 1.00 0.27 C ATOM 1403 CG1 VAL A 85 1.841 1.723 4.963 1.00 0.29 C ATOM 1404 CG2 VAL A 85 0.047 2.661 6.409 1.00 0.31 C ATOM 0 H VAL A 85 1.731 1.892 8.269 1.00 0.28 H new ATOM 0 HA VAL A 85 3.396 3.505 6.388 1.00 0.25 H new ATOM 0 HB VAL A 85 1.355 3.804 5.150 1.00 0.27 H new ATOM 0 HG11 VAL A 85 1.080 1.516 4.211 1.00 0.29 H new ATOM 0 HG12 VAL A 85 2.789 1.936 4.470 1.00 0.29 H new ATOM 0 HG13 VAL A 85 1.956 0.854 5.611 1.00 0.29 H new ATOM 0 HG21 VAL A 85 -0.663 2.423 5.617 1.00 0.31 H new ATOM 0 HG22 VAL A 85 0.116 1.820 7.099 1.00 0.31 H new ATOM 0 HG23 VAL A 85 -0.293 3.546 6.947 1.00 0.31 H new ATOM 1414 N CYS A 86 2.385 5.695 7.203 1.00 0.24 N ATOM 1415 CA CYS A 86 1.861 6.937 7.747 1.00 0.26 C ATOM 1416 C CYS A 86 1.631 7.920 6.597 1.00 0.26 C ATOM 1417 O CYS A 86 2.503 8.738 6.314 1.00 0.31 O ATOM 1418 CB CYS A 86 2.827 7.506 8.791 1.00 0.31 C ATOM 1419 SG CYS A 86 2.012 8.833 9.717 1.00 0.48 S ATOM 0 H CYS A 86 3.027 5.824 6.421 1.00 0.24 H new ATOM 0 HA CYS A 86 0.911 6.757 8.249 1.00 0.26 H new ATOM 0 HB2 CYS A 86 3.147 6.718 9.472 1.00 0.31 H new ATOM 0 HB3 CYS A 86 3.723 7.888 8.302 1.00 0.31 H new ATOM 0 HG CYS A 86 2.834 9.312 10.603 1.00 0.48 H new ATOM 1425 N LEU A 87 0.487 7.839 5.913 1.00 0.24 N ATOM 1426 CA LEU A 87 0.164 8.729 4.803 1.00 0.23 C ATOM 1427 C LEU A 87 -1.000 9.617 5.221 1.00 0.23 C ATOM 1428 O LEU A 87 -1.831 9.190 6.019 1.00 0.24 O ATOM 1429 CB LEU A 87 -0.242 7.928 3.555 1.00 0.25 C ATOM 1430 CG LEU A 87 0.847 7.065 2.911 1.00 0.26 C ATOM 1431 CD1 LEU A 87 2.198 7.774 2.853 1.00 0.23 C ATOM 1432 CD2 LEU A 87 1.025 5.726 3.614 1.00 0.28 C ATOM 0 H LEU A 87 -0.240 7.153 6.116 1.00 0.24 H new ATOM 0 HA LEU A 87 1.043 9.326 4.559 1.00 0.23 H new ATOM 0 HB2 LEU A 87 -1.077 7.280 3.822 1.00 0.25 H new ATOM 0 HB3 LEU A 87 -0.610 8.628 2.805 1.00 0.25 H new ATOM 0 HG LEU A 87 0.497 6.886 1.894 1.00 0.26 H new ATOM 0 HD11 LEU A 87 2.934 7.118 2.388 1.00 0.23 H new ATOM 0 HD12 LEU A 87 2.104 8.688 2.266 1.00 0.23 H new ATOM 0 HD13 LEU A 87 2.522 8.023 3.864 1.00 0.23 H new ATOM 0 HD21 LEU A 87 1.809 5.155 3.116 1.00 0.28 H new ATOM 0 HD22 LEU A 87 1.304 5.895 4.654 1.00 0.28 H new ATOM 0 HD23 LEU A 87 0.090 5.168 3.576 1.00 0.28 H new ATOM 1444 N PRO A 88 -1.137 10.818 4.643 1.00 0.24 N ATOM 1445 CA PRO A 88 -2.205 11.741 4.994 1.00 0.26 C ATOM 1446 C PRO A 88 -3.601 11.213 4.646 1.00 0.35 C ATOM 1447 O PRO A 88 -4.587 11.750 5.129 1.00 0.63 O ATOM 1448 CB PRO A 88 -1.877 13.049 4.274 1.00 0.26 C ATOM 1449 CG PRO A 88 -1.008 12.607 3.098 1.00 0.26 C ATOM 1450 CD PRO A 88 -0.242 11.415 3.666 1.00 0.25 C ATOM 0 HA PRO A 88 -2.249 11.883 6.074 1.00 0.26 H new ATOM 0 HB2 PRO A 88 -2.780 13.557 3.936 1.00 0.26 H new ATOM 0 HB3 PRO A 88 -1.346 13.743 4.926 1.00 0.26 H new ATOM 0 HG2 PRO A 88 -1.610 12.325 2.234 1.00 0.26 H new ATOM 0 HG3 PRO A 88 -0.336 13.401 2.772 1.00 0.26 H new ATOM 0 HD2 PRO A 88 0.017 10.703 2.882 1.00 0.25 H new ATOM 0 HD3 PRO A 88 0.692 11.732 4.130 1.00 0.25 H new ATOM 1458 N VAL A 89 -3.716 10.148 3.853 1.00 0.20 N ATOM 1459 CA VAL A 89 -5.014 9.533 3.573 1.00 0.20 C ATOM 1460 C VAL A 89 -5.582 8.843 4.818 1.00 0.19 C ATOM 1461 O VAL A 89 -6.793 8.684 4.940 1.00 0.21 O ATOM 1462 CB VAL A 89 -4.919 8.575 2.369 1.00 0.23 C ATOM 1463 CG1 VAL A 89 -4.745 9.389 1.083 1.00 0.29 C ATOM 1464 CG2 VAL A 89 -3.735 7.607 2.492 1.00 0.24 C ATOM 0 H VAL A 89 -2.927 9.693 3.393 1.00 0.20 H new ATOM 0 HA VAL A 89 -5.715 10.323 3.303 1.00 0.20 H new ATOM 0 HB VAL A 89 -5.839 7.992 2.345 1.00 0.23 H new ATOM 0 HG11 VAL A 89 -4.678 8.713 0.231 1.00 0.29 H new ATOM 0 HG12 VAL A 89 -5.600 10.052 0.954 1.00 0.29 H new ATOM 0 HG13 VAL A 89 -3.833 9.982 1.148 1.00 0.29 H new ATOM 0 HG21 VAL A 89 -3.709 6.952 1.621 1.00 0.24 H new ATOM 0 HG22 VAL A 89 -2.806 8.174 2.548 1.00 0.24 H new ATOM 0 HG23 VAL A 89 -3.848 7.006 3.395 1.00 0.24 H new ATOM 1474 N ILE A 90 -4.711 8.413 5.734 1.00 0.19 N ATOM 1475 CA ILE A 90 -5.082 7.703 6.951 1.00 0.18 C ATOM 1476 C ILE A 90 -4.422 8.323 8.180 1.00 0.19 C ATOM 1477 O ILE A 90 -4.444 7.740 9.260 1.00 0.23 O ATOM 1478 CB ILE A 90 -4.727 6.217 6.799 1.00 0.19 C ATOM 1479 CG1 ILE A 90 -3.222 6.025 6.540 1.00 0.22 C ATOM 1480 CG2 ILE A 90 -5.566 5.660 5.644 1.00 0.19 C ATOM 1481 CD1 ILE A 90 -2.843 4.566 6.314 1.00 0.26 C ATOM 0 H ILE A 90 -3.705 8.554 5.644 1.00 0.19 H new ATOM 0 HA ILE A 90 -6.158 7.790 7.102 1.00 0.18 H new ATOM 0 HB ILE A 90 -4.950 5.680 7.721 1.00 0.19 H new ATOM 0 HG12 ILE A 90 -2.930 6.611 5.668 1.00 0.22 H new ATOM 0 HG13 ILE A 90 -2.659 6.415 7.388 1.00 0.22 H new ATOM 0 HG21 ILE A 90 -5.339 4.603 5.507 1.00 0.19 H new ATOM 0 HG22 ILE A 90 -6.625 5.777 5.874 1.00 0.19 H new ATOM 0 HG23 ILE A 90 -5.331 6.203 4.729 1.00 0.19 H new ATOM 0 HD11 ILE A 90 -1.770 4.492 6.137 1.00 0.26 H new ATOM 0 HD12 ILE A 90 -3.106 3.981 7.195 1.00 0.26 H new ATOM 0 HD13 ILE A 90 -3.381 4.180 5.448 1.00 0.26 H new ATOM 1493 N SER A 91 -3.821 9.502 8.033 1.00 0.23 N ATOM 1494 CA SER A 91 -3.225 10.177 9.168 1.00 0.26 C ATOM 1495 C SER A 91 -4.349 10.604 10.106 1.00 0.29 C ATOM 1496 O SER A 91 -5.422 10.978 9.641 1.00 0.40 O ATOM 1497 CB SER A 91 -2.423 11.372 8.661 1.00 0.34 C ATOM 1498 OG SER A 91 -1.926 12.124 9.750 1.00 0.60 O ATOM 0 H SER A 91 -3.738 10.000 7.147 1.00 0.23 H new ATOM 0 HA SER A 91 -2.544 9.524 9.715 1.00 0.26 H new ATOM 0 HB2 SER A 91 -1.596 11.027 8.040 1.00 0.34 H new ATOM 0 HB3 SER A 91 -3.053 12.001 8.032 1.00 0.34 H new ATOM 0 HG SER A 91 -1.412 12.887 9.413 1.00 0.60 H new ATOM 1504 N ALA A 92 -4.113 10.585 11.420 1.00 0.29 N ATOM 1505 CA ALA A 92 -5.114 11.008 12.390 1.00 0.34 C ATOM 1506 C ALA A 92 -5.529 12.457 12.133 1.00 0.37 C ATOM 1507 O ALA A 92 -6.715 12.775 12.149 1.00 0.38 O ATOM 1508 CB ALA A 92 -4.577 10.824 13.811 1.00 0.41 C ATOM 0 H ALA A 92 -3.232 10.279 11.833 1.00 0.29 H new ATOM 0 HA ALA A 92 -6.002 10.386 12.280 1.00 0.34 H new ATOM 0 HB1 ALA A 92 -5.332 11.143 14.529 1.00 0.41 H new ATOM 0 HB2 ALA A 92 -4.339 9.773 13.977 1.00 0.41 H new ATOM 0 HB3 ALA A 92 -3.677 11.425 13.940 1.00 0.41 H new ATOM 1514 N GLU A 93 -4.564 13.338 11.854 1.00 0.43 N ATOM 1515 CA GLU A 93 -4.854 14.742 11.575 1.00 0.50 C ATOM 1516 C GLU A 93 -5.655 14.920 10.283 1.00 0.47 C ATOM 1517 O GLU A 93 -6.244 15.973 10.055 1.00 0.64 O ATOM 1518 CB GLU A 93 -3.554 15.549 11.499 1.00 0.61 C ATOM 1519 CG GLU A 93 -2.848 15.580 12.860 1.00 0.96 C ATOM 1520 CD GLU A 93 -2.154 16.924 13.078 1.00 1.37 C ATOM 1521 OE1 GLU A 93 -1.063 17.103 12.493 1.00 2.24 O ATOM 1522 OE2 GLU A 93 -2.738 17.755 13.805 1.00 2.14 O ATOM 0 H GLU A 93 -3.573 13.100 11.816 1.00 0.43 H new ATOM 0 HA GLU A 93 -5.466 15.114 12.396 1.00 0.50 H new ATOM 0 HB2 GLU A 93 -2.892 15.111 10.752 1.00 0.61 H new ATOM 0 HB3 GLU A 93 -3.772 16.567 11.175 1.00 0.61 H new ATOM 0 HG2 GLU A 93 -3.573 15.406 13.655 1.00 0.96 H new ATOM 0 HG3 GLU A 93 -2.116 14.774 12.914 1.00 0.96 H new ATOM 1529 N ASN A 94 -5.686 13.901 9.423 1.00 0.38 N ATOM 1530 CA ASN A 94 -6.460 13.914 8.192 1.00 0.41 C ATOM 1531 C ASN A 94 -7.446 12.748 8.196 1.00 0.38 C ATOM 1532 O ASN A 94 -7.817 12.241 7.138 1.00 0.45 O ATOM 1533 CB ASN A 94 -5.515 13.851 6.990 1.00 0.48 C ATOM 1534 CG ASN A 94 -4.782 15.160 6.759 1.00 0.82 C ATOM 1535 OD1 ASN A 94 -5.172 15.948 5.905 1.00 1.67 O ATOM 1536 ND2 ASN A 94 -3.723 15.417 7.518 1.00 0.84 N ATOM 0 H ASN A 94 -5.166 13.035 9.568 1.00 0.38 H new ATOM 0 HA ASN A 94 -7.033 14.839 8.120 1.00 0.41 H new ATOM 0 HB2 ASN A 94 -4.788 13.053 7.144 1.00 0.48 H new ATOM 0 HB3 ASN A 94 -6.085 13.595 6.097 1.00 0.48 H new ATOM 0 HD21 ASN A 94 -3.210 16.290 7.399 1.00 0.84 H new ATOM 0 HD22 ASN A 94 -3.423 14.741 8.220 1.00 0.84 H new ATOM 1543 N TRP A 95 -7.913 12.331 9.374 1.00 0.35 N ATOM 1544 CA TRP A 95 -8.911 11.284 9.473 1.00 0.36 C ATOM 1545 C TRP A 95 -10.188 11.790 8.809 1.00 0.36 C ATOM 1546 O TRP A 95 -10.916 12.609 9.366 1.00 0.48 O ATOM 1547 CB TRP A 95 -9.130 10.915 10.943 1.00 0.37 C ATOM 1548 CG TRP A 95 -10.422 10.227 11.270 1.00 0.37 C ATOM 1549 CD1 TRP A 95 -11.032 9.250 10.558 1.00 0.31 C ATOM 1550 CD2 TRP A 95 -11.319 10.536 12.374 1.00 0.48 C ATOM 1551 NE1 TRP A 95 -12.259 8.962 11.128 1.00 0.34 N ATOM 1552 CE2 TRP A 95 -12.505 9.763 12.226 1.00 0.45 C ATOM 1553 CE3 TRP A 95 -11.251 11.418 13.474 1.00 0.64 C ATOM 1554 CZ2 TRP A 95 -13.593 9.908 13.099 1.00 0.55 C ATOM 1555 CZ3 TRP A 95 -12.320 11.534 14.381 1.00 0.75 C ATOM 1556 CH2 TRP A 95 -13.494 10.787 14.189 1.00 0.71 C ATOM 0 H TRP A 95 -7.610 12.709 10.272 1.00 0.35 H new ATOM 0 HA TRP A 95 -8.586 10.377 8.964 1.00 0.36 H new ATOM 0 HB2 TRP A 95 -8.310 10.271 11.260 1.00 0.37 H new ATOM 0 HB3 TRP A 95 -9.068 11.826 11.538 1.00 0.37 H new ATOM 0 HD1 TRP A 95 -10.624 8.770 9.681 1.00 0.31 H new ATOM 0 HE1 TRP A 95 -12.901 8.249 10.781 1.00 0.34 H new ATOM 0 HE3 TRP A 95 -10.363 12.014 13.622 1.00 0.64 H new ATOM 0 HZ2 TRP A 95 -14.501 9.347 12.934 1.00 0.55 H new ATOM 0 HZ3 TRP A 95 -12.238 12.199 15.228 1.00 0.75 H new ATOM 0 HH2 TRP A 95 -14.319 10.889 14.879 1.00 0.71 H new ATOM 1567 N LYS A 96 -10.456 11.316 7.592 1.00 0.33 N ATOM 1568 CA LYS A 96 -11.642 11.689 6.844 1.00 0.36 C ATOM 1569 C LYS A 96 -12.514 10.447 6.775 1.00 0.33 C ATOM 1570 O LYS A 96 -12.139 9.500 6.093 1.00 0.34 O ATOM 1571 CB LYS A 96 -11.249 12.181 5.436 1.00 0.46 C ATOM 1572 CG LYS A 96 -11.175 13.714 5.349 1.00 0.59 C ATOM 1573 CD LYS A 96 -10.105 14.315 6.269 1.00 0.82 C ATOM 1574 CE LYS A 96 -10.197 15.841 6.331 1.00 1.34 C ATOM 1575 NZ LYS A 96 -9.431 16.498 5.251 1.00 1.94 N ATOM 0 H LYS A 96 -9.849 10.660 7.101 1.00 0.33 H new ATOM 0 HA LYS A 96 -12.181 12.506 7.323 1.00 0.36 H new ATOM 0 HB2 LYS A 96 -10.282 11.757 5.163 1.00 0.46 H new ATOM 0 HB3 LYS A 96 -11.974 11.813 4.710 1.00 0.46 H new ATOM 0 HG2 LYS A 96 -10.966 14.004 4.319 1.00 0.59 H new ATOM 0 HG3 LYS A 96 -12.147 14.135 5.608 1.00 0.59 H new ATOM 0 HD2 LYS A 96 -10.216 13.904 7.272 1.00 0.82 H new ATOM 0 HD3 LYS A 96 -9.116 14.025 5.913 1.00 0.82 H new ATOM 0 HE2 LYS A 96 -11.243 16.142 6.265 1.00 1.34 H new ATOM 0 HE3 LYS A 96 -9.826 16.185 7.296 1.00 1.34 H new ATOM 0 HZ1 LYS A 96 -9.525 17.530 5.337 1.00 1.94 H new ATOM 0 HZ2 LYS A 96 -8.428 16.234 5.327 1.00 1.94 H new ATOM 0 HZ3 LYS A 96 -9.800 16.192 4.328 1.00 1.94 H new ATOM 1589 N PRO A 97 -13.692 10.429 7.411 1.00 0.33 N ATOM 1590 CA PRO A 97 -14.596 9.293 7.314 1.00 0.34 C ATOM 1591 C PRO A 97 -15.118 9.128 5.886 1.00 0.39 C ATOM 1592 O PRO A 97 -15.525 8.044 5.489 1.00 0.58 O ATOM 1593 CB PRO A 97 -15.701 9.568 8.336 1.00 0.35 C ATOM 1594 CG PRO A 97 -15.720 11.092 8.446 1.00 0.35 C ATOM 1595 CD PRO A 97 -14.255 11.477 8.244 1.00 0.33 C ATOM 0 HA PRO A 97 -14.105 8.346 7.535 1.00 0.34 H new ATOM 0 HB2 PRO A 97 -16.662 9.179 8.001 1.00 0.35 H new ATOM 0 HB3 PRO A 97 -15.484 9.100 9.296 1.00 0.35 H new ATOM 0 HG2 PRO A 97 -16.362 11.542 7.689 1.00 0.35 H new ATOM 0 HG3 PRO A 97 -16.092 11.421 9.416 1.00 0.35 H new ATOM 0 HD2 PRO A 97 -14.168 12.451 7.763 1.00 0.33 H new ATOM 0 HD3 PRO A 97 -13.731 11.545 9.198 1.00 0.33 H new ATOM 1603 N ALA A 98 -15.082 10.190 5.082 1.00 0.41 N ATOM 1604 CA ALA A 98 -15.430 10.108 3.677 1.00 0.45 C ATOM 1605 C ALA A 98 -14.446 9.252 2.870 1.00 0.46 C ATOM 1606 O ALA A 98 -14.825 8.762 1.808 1.00 0.55 O ATOM 1607 CB ALA A 98 -15.494 11.525 3.112 1.00 0.49 C ATOM 0 H ALA A 98 -14.811 11.124 5.391 1.00 0.41 H new ATOM 0 HA ALA A 98 -16.399 9.616 3.593 1.00 0.45 H new ATOM 0 HB1 ALA A 98 -15.755 11.484 2.054 1.00 0.49 H new ATOM 0 HB2 ALA A 98 -16.250 12.097 3.650 1.00 0.49 H new ATOM 0 HB3 ALA A 98 -14.523 12.007 3.228 1.00 0.49 H new ATOM 1613 N THR A 99 -13.197 9.098 3.331 1.00 0.42 N ATOM 1614 CA THR A 99 -12.167 8.368 2.598 1.00 0.39 C ATOM 1615 C THR A 99 -12.546 6.894 2.468 1.00 0.35 C ATOM 1616 O THR A 99 -13.473 6.428 3.129 1.00 0.44 O ATOM 1617 CB THR A 99 -10.794 8.553 3.272 1.00 0.41 C ATOM 1618 OG1 THR A 99 -9.783 8.430 2.302 1.00 0.46 O ATOM 1619 CG2 THR A 99 -10.477 7.528 4.366 1.00 0.42 C ATOM 0 H THR A 99 -12.878 9.478 4.222 1.00 0.42 H new ATOM 0 HA THR A 99 -12.093 8.775 1.590 1.00 0.39 H new ATOM 0 HB THR A 99 -10.833 9.538 3.737 1.00 0.41 H new ATOM 0 HG1 THR A 99 -9.900 9.122 1.618 1.00 0.46 H new ATOM 0 HG21 THR A 99 -9.492 7.735 4.784 1.00 0.42 H new ATOM 0 HG22 THR A 99 -11.227 7.593 5.154 1.00 0.42 H new ATOM 0 HG23 THR A 99 -10.486 6.525 3.939 1.00 0.42 H new ATOM 1627 N LYS A 100 -11.823 6.145 1.636 1.00 0.33 N ATOM 1628 CA LYS A 100 -12.059 4.721 1.450 1.00 0.28 C ATOM 1629 C LYS A 100 -10.781 4.054 0.979 1.00 0.22 C ATOM 1630 O LYS A 100 -9.757 4.699 0.764 1.00 0.20 O ATOM 1631 CB LYS A 100 -13.180 4.497 0.421 1.00 0.36 C ATOM 1632 CG LYS A 100 -14.527 4.202 1.077 1.00 1.63 C ATOM 1633 CD LYS A 100 -15.475 5.353 0.768 1.00 1.92 C ATOM 1634 CE LYS A 100 -16.844 5.052 1.360 1.00 2.89 C ATOM 1635 NZ LYS A 100 -17.562 6.310 1.611 1.00 3.96 N ATOM 0 H LYS A 100 -11.056 6.513 1.073 1.00 0.33 H new ATOM 0 HA LYS A 100 -12.367 4.283 2.399 1.00 0.28 H new ATOM 0 HB2 LYS A 100 -13.272 5.382 -0.209 1.00 0.36 H new ATOM 0 HB3 LYS A 100 -12.908 3.668 -0.232 1.00 0.36 H new ATOM 0 HG2 LYS A 100 -14.935 3.264 0.701 1.00 1.63 H new ATOM 0 HG3 LYS A 100 -14.407 4.088 2.154 1.00 1.63 H new ATOM 0 HD2 LYS A 100 -15.084 6.282 1.182 1.00 1.92 H new ATOM 0 HD3 LYS A 100 -15.555 5.493 -0.310 1.00 1.92 H new ATOM 0 HE2 LYS A 100 -17.417 4.425 0.677 1.00 2.89 H new ATOM 0 HE3 LYS A 100 -16.734 4.493 2.289 1.00 2.89 H new ATOM 0 HZ1 LYS A 100 -18.587 6.139 1.568 1.00 3.96 H new ATOM 0 HZ2 LYS A 100 -17.310 6.671 2.553 1.00 3.96 H new ATOM 0 HZ3 LYS A 100 -17.297 7.011 0.889 1.00 3.96 H new ATOM 1649 N THR A 101 -10.850 2.737 0.819 1.00 0.22 N ATOM 1650 CA THR A 101 -9.760 1.938 0.310 1.00 0.20 C ATOM 1651 C THR A 101 -9.287 2.376 -1.067 1.00 0.18 C ATOM 1652 O THR A 101 -8.143 2.107 -1.397 1.00 0.24 O ATOM 1653 CB THR A 101 -10.185 0.483 0.212 1.00 0.25 C ATOM 1654 OG1 THR A 101 -11.566 0.434 -0.090 1.00 0.42 O ATOM 1655 CG2 THR A 101 -9.920 -0.263 1.513 1.00 0.31 C ATOM 0 H THR A 101 -11.682 2.193 1.045 1.00 0.22 H new ATOM 0 HA THR A 101 -8.937 2.071 1.013 1.00 0.20 H new ATOM 0 HB THR A 101 -9.603 0.000 -0.573 1.00 0.25 H new ATOM 0 HG1 THR A 101 -11.877 -0.494 -0.048 1.00 0.42 H new ATOM 0 HG21 THR A 101 -10.236 -1.301 1.408 1.00 0.31 H new ATOM 0 HG22 THR A 101 -8.855 -0.229 1.741 1.00 0.31 H new ATOM 0 HG23 THR A 101 -10.480 0.206 2.322 1.00 0.31 H new ATOM 1663 N ASP A 102 -10.123 3.009 -1.886 1.00 0.19 N ATOM 1664 CA ASP A 102 -9.664 3.591 -3.142 1.00 0.23 C ATOM 1665 C ASP A 102 -8.570 4.614 -2.842 1.00 0.22 C ATOM 1666 O ASP A 102 -7.491 4.559 -3.425 1.00 0.29 O ATOM 1667 CB ASP A 102 -10.835 4.210 -3.924 1.00 0.31 C ATOM 1668 CG ASP A 102 -11.432 5.412 -3.195 1.00 1.19 C ATOM 1669 OD1 ASP A 102 -11.518 6.505 -3.791 1.00 1.72 O ATOM 1670 OD2 ASP A 102 -11.700 5.233 -1.986 1.00 2.81 O ATOM 0 H ASP A 102 -11.119 3.131 -1.702 1.00 0.19 H new ATOM 0 HA ASP A 102 -9.247 2.811 -3.779 1.00 0.23 H new ATOM 0 HB2 ASP A 102 -10.490 4.518 -4.911 1.00 0.31 H new ATOM 0 HB3 ASP A 102 -11.608 3.457 -4.077 1.00 0.31 H new ATOM 1675 N GLN A 103 -8.824 5.509 -1.889 1.00 0.20 N ATOM 1676 CA GLN A 103 -7.919 6.582 -1.512 1.00 0.24 C ATOM 1677 C GLN A 103 -6.695 6.018 -0.816 1.00 0.21 C ATOM 1678 O GLN A 103 -5.599 6.562 -0.958 1.00 0.26 O ATOM 1679 CB GLN A 103 -8.641 7.624 -0.649 1.00 0.28 C ATOM 1680 CG GLN A 103 -9.962 8.004 -1.330 1.00 0.39 C ATOM 1681 CD GLN A 103 -10.681 9.211 -0.747 1.00 0.66 C ATOM 1682 OE1 GLN A 103 -10.131 10.005 0.009 1.00 0.95 O ATOM 1683 NE2 GLN A 103 -11.964 9.324 -1.060 1.00 1.72 N ATOM 0 H GLN A 103 -9.688 5.504 -1.347 1.00 0.20 H new ATOM 0 HA GLN A 103 -7.580 7.092 -2.414 1.00 0.24 H new ATOM 0 HB2 GLN A 103 -8.832 7.222 0.346 1.00 0.28 H new ATOM 0 HB3 GLN A 103 -8.015 8.507 -0.522 1.00 0.28 H new ATOM 0 HG2 GLN A 103 -9.764 8.197 -2.384 1.00 0.39 H new ATOM 0 HG3 GLN A 103 -10.633 7.147 -1.283 1.00 0.39 H new ATOM 0 HE21 GLN A 103 -12.396 8.650 -1.691 1.00 1.72 H new ATOM 0 HE22 GLN A 103 -12.519 10.085 -0.669 1.00 1.72 H new ATOM 1692 N VAL A 104 -6.859 4.921 -0.079 1.00 0.17 N ATOM 1693 CA VAL A 104 -5.739 4.326 0.618 1.00 0.17 C ATOM 1694 C VAL A 104 -4.808 3.656 -0.388 1.00 0.17 C ATOM 1695 O VAL A 104 -3.618 3.957 -0.434 1.00 0.18 O ATOM 1696 CB VAL A 104 -6.280 3.370 1.684 1.00 0.17 C ATOM 1697 CG1 VAL A 104 -5.137 2.600 2.315 1.00 0.17 C ATOM 1698 CG2 VAL A 104 -6.972 4.176 2.785 1.00 0.19 C ATOM 0 H VAL A 104 -7.748 4.437 0.045 1.00 0.17 H new ATOM 0 HA VAL A 104 -5.142 5.080 1.131 1.00 0.17 H new ATOM 0 HB VAL A 104 -6.982 2.681 1.213 1.00 0.17 H new ATOM 0 HG11 VAL A 104 -5.530 1.922 3.073 1.00 0.17 H new ATOM 0 HG12 VAL A 104 -4.618 2.026 1.548 1.00 0.17 H new ATOM 0 HG13 VAL A 104 -4.440 3.298 2.779 1.00 0.17 H new ATOM 0 HG21 VAL A 104 -7.358 3.497 3.545 1.00 0.19 H new ATOM 0 HG22 VAL A 104 -6.256 4.860 3.240 1.00 0.19 H new ATOM 0 HG23 VAL A 104 -7.796 4.746 2.356 1.00 0.19 H new ATOM 1708 N ILE A 105 -5.344 2.755 -1.203 1.00 0.19 N ATOM 1709 CA ILE A 105 -4.583 1.948 -2.139 1.00 0.19 C ATOM 1710 C ILE A 105 -3.882 2.859 -3.128 1.00 0.21 C ATOM 1711 O ILE A 105 -2.683 2.707 -3.351 1.00 0.23 O ATOM 1712 CB ILE A 105 -5.503 0.936 -2.846 1.00 0.18 C ATOM 1713 CG1 ILE A 105 -5.800 -0.231 -1.896 1.00 0.19 C ATOM 1714 CG2 ILE A 105 -4.949 0.400 -4.175 1.00 0.17 C ATOM 1715 CD1 ILE A 105 -4.545 -0.991 -1.439 1.00 0.20 C ATOM 0 H ILE A 105 -6.346 2.563 -1.229 1.00 0.19 H new ATOM 0 HA ILE A 105 -3.826 1.375 -1.604 1.00 0.19 H new ATOM 0 HB ILE A 105 -6.415 1.476 -3.101 1.00 0.18 H new ATOM 0 HG12 ILE A 105 -6.322 0.150 -1.019 1.00 0.19 H new ATOM 0 HG13 ILE A 105 -6.476 -0.928 -2.391 1.00 0.19 H new ATOM 0 HG21 ILE A 105 -5.658 -0.306 -4.607 1.00 0.17 H new ATOM 0 HG22 ILE A 105 -4.796 1.229 -4.866 1.00 0.17 H new ATOM 0 HG23 ILE A 105 -3.999 -0.104 -3.996 1.00 0.17 H new ATOM 0 HD11 ILE A 105 -4.834 -1.802 -0.770 1.00 0.20 H new ATOM 0 HD12 ILE A 105 -4.033 -1.403 -2.308 1.00 0.20 H new ATOM 0 HD13 ILE A 105 -3.877 -0.308 -0.914 1.00 0.20 H new ATOM 1727 N GLN A 106 -4.615 3.809 -3.714 1.00 0.22 N ATOM 1728 CA GLN A 106 -4.007 4.746 -4.646 1.00 0.23 C ATOM 1729 C GLN A 106 -2.876 5.512 -3.966 1.00 0.23 C ATOM 1730 O GLN A 106 -1.917 5.859 -4.637 1.00 0.26 O ATOM 1731 CB GLN A 106 -5.046 5.661 -5.311 1.00 0.28 C ATOM 1732 CG GLN A 106 -5.621 6.746 -4.395 1.00 0.59 C ATOM 1733 CD GLN A 106 -4.730 7.979 -4.249 1.00 1.17 C ATOM 1734 OE1 GLN A 106 -4.285 8.561 -5.229 1.00 1.81 O ATOM 1735 NE2 GLN A 106 -4.461 8.409 -3.024 1.00 2.07 N ATOM 0 H GLN A 106 -5.614 3.945 -3.560 1.00 0.22 H new ATOM 0 HA GLN A 106 -3.565 4.178 -5.464 1.00 0.23 H new ATOM 0 HB2 GLN A 106 -4.588 6.140 -6.176 1.00 0.28 H new ATOM 0 HB3 GLN A 106 -5.866 5.047 -5.684 1.00 0.28 H new ATOM 0 HG2 GLN A 106 -6.591 7.056 -4.783 1.00 0.59 H new ATOM 0 HG3 GLN A 106 -5.794 6.318 -3.408 1.00 0.59 H new ATOM 0 HE21 GLN A 106 -4.838 7.915 -2.216 1.00 2.07 H new ATOM 0 HE22 GLN A 106 -3.877 9.234 -2.890 1.00 2.07 H new ATOM 1744 N SER A 107 -2.948 5.751 -2.653 1.00 0.20 N ATOM 1745 CA SER A 107 -1.855 6.332 -1.896 1.00 0.19 C ATOM 1746 C SER A 107 -0.654 5.402 -1.935 1.00 0.20 C ATOM 1747 O SER A 107 0.414 5.832 -2.351 1.00 0.25 O ATOM 1748 CB SER A 107 -2.259 6.612 -0.446 1.00 0.19 C ATOM 1749 OG SER A 107 -1.513 7.693 0.078 1.00 0.37 O ATOM 0 H SER A 107 -3.773 5.543 -2.091 1.00 0.20 H new ATOM 0 HA SER A 107 -1.594 7.285 -2.355 1.00 0.19 H new ATOM 0 HB2 SER A 107 -3.324 6.840 -0.397 1.00 0.19 H new ATOM 0 HB3 SER A 107 -2.095 5.722 0.161 1.00 0.19 H new ATOM 0 HG SER A 107 -2.123 8.412 0.346 1.00 0.37 H new ATOM 1755 N LEU A 108 -0.779 4.136 -1.520 1.00 0.19 N ATOM 1756 CA LEU A 108 0.399 3.278 -1.517 1.00 0.22 C ATOM 1757 C LEU A 108 1.010 3.215 -2.896 1.00 0.27 C ATOM 1758 O LEU A 108 2.218 3.274 -3.010 1.00 0.30 O ATOM 1759 CB LEU A 108 0.115 1.834 -1.115 1.00 0.22 C ATOM 1760 CG LEU A 108 -0.200 1.585 0.357 1.00 0.18 C ATOM 1761 CD1 LEU A 108 0.402 2.624 1.298 1.00 0.21 C ATOM 1762 CD2 LEU A 108 -1.695 1.435 0.589 1.00 0.20 C ATOM 0 H LEU A 108 -1.644 3.703 -1.197 1.00 0.19 H new ATOM 0 HA LEU A 108 1.065 3.729 -0.781 1.00 0.22 H new ATOM 0 HB2 LEU A 108 -0.725 1.474 -1.709 1.00 0.22 H new ATOM 0 HB3 LEU A 108 0.980 1.228 -1.386 1.00 0.22 H new ATOM 0 HG LEU A 108 0.284 0.640 0.604 1.00 0.18 H new ATOM 0 HD11 LEU A 108 0.136 2.381 2.327 1.00 0.21 H new ATOM 0 HD12 LEU A 108 1.487 2.623 1.194 1.00 0.21 H new ATOM 0 HD13 LEU A 108 0.014 3.611 1.046 1.00 0.21 H new ATOM 0 HD21 LEU A 108 -1.883 1.259 1.648 1.00 0.20 H new ATOM 0 HD22 LEU A 108 -2.205 2.346 0.277 1.00 0.20 H new ATOM 0 HD23 LEU A 108 -2.070 0.592 0.009 1.00 0.20 H new ATOM 1774 N ILE A 109 0.216 3.068 -3.945 1.00 0.29 N ATOM 1775 CA ILE A 109 0.772 3.024 -5.284 1.00 0.30 C ATOM 1776 C ILE A 109 1.466 4.352 -5.560 1.00 0.29 C ATOM 1777 O ILE A 109 2.598 4.361 -6.020 1.00 0.31 O ATOM 1778 CB ILE A 109 -0.340 2.675 -6.276 1.00 0.29 C ATOM 1779 CG1 ILE A 109 -0.732 1.217 -5.995 1.00 0.24 C ATOM 1780 CG2 ILE A 109 0.100 2.798 -7.738 1.00 0.31 C ATOM 1781 CD1 ILE A 109 -2.191 0.962 -6.331 1.00 0.23 C ATOM 0 H ILE A 109 -0.799 2.979 -3.896 1.00 0.29 H new ATOM 0 HA ILE A 109 1.528 2.246 -5.392 1.00 0.30 H new ATOM 0 HB ILE A 109 -1.166 3.373 -6.142 1.00 0.29 H new ATOM 0 HG12 ILE A 109 -0.100 0.549 -6.580 1.00 0.24 H new ATOM 0 HG13 ILE A 109 -0.553 0.986 -4.945 1.00 0.24 H new ATOM 0 HG21 ILE A 109 -0.732 2.537 -8.392 1.00 0.31 H new ATOM 0 HG22 ILE A 109 0.412 3.823 -7.939 1.00 0.31 H new ATOM 0 HG23 ILE A 109 0.934 2.121 -7.925 1.00 0.31 H new ATOM 0 HD11 ILE A 109 -2.436 -0.079 -6.121 1.00 0.23 H new ATOM 0 HD12 ILE A 109 -2.823 1.613 -5.726 1.00 0.23 H new ATOM 0 HD13 ILE A 109 -2.363 1.169 -7.387 1.00 0.23 H new ATOM 1793 N ALA A 110 0.828 5.470 -5.237 1.00 0.26 N ATOM 1794 CA ALA A 110 1.341 6.805 -5.481 1.00 0.24 C ATOM 1795 C ALA A 110 2.695 7.031 -4.807 1.00 0.22 C ATOM 1796 O ALA A 110 3.540 7.693 -5.389 1.00 0.23 O ATOM 1797 CB ALA A 110 0.296 7.836 -5.033 1.00 0.24 C ATOM 0 H ALA A 110 -0.087 5.469 -4.785 1.00 0.26 H new ATOM 0 HA ALA A 110 1.518 6.924 -6.550 1.00 0.24 H new ATOM 0 HB1 ALA A 110 0.676 8.841 -5.214 1.00 0.24 H new ATOM 0 HB2 ALA A 110 -0.625 7.689 -5.597 1.00 0.24 H new ATOM 0 HB3 ALA A 110 0.094 7.711 -3.969 1.00 0.24 H new ATOM 1803 N LEU A 111 2.915 6.499 -3.605 1.00 0.20 N ATOM 1804 CA LEU A 111 4.124 6.685 -2.809 1.00 0.19 C ATOM 1805 C LEU A 111 5.196 5.642 -3.133 1.00 0.23 C ATOM 1806 O LEU A 111 6.389 5.924 -3.151 1.00 0.35 O ATOM 1807 CB LEU A 111 3.756 6.595 -1.320 1.00 0.17 C ATOM 1808 CG LEU A 111 3.192 7.883 -0.690 1.00 0.19 C ATOM 1809 CD1 LEU A 111 3.788 9.174 -1.245 1.00 0.27 C ATOM 1810 CD2 LEU A 111 1.672 7.982 -0.786 1.00 0.31 C ATOM 0 H LEU A 111 2.228 5.904 -3.143 1.00 0.20 H new ATOM 0 HA LEU A 111 4.539 7.664 -3.048 1.00 0.19 H new ATOM 0 HB2 LEU A 111 3.021 5.800 -1.194 1.00 0.17 H new ATOM 0 HB3 LEU A 111 4.645 6.299 -0.763 1.00 0.17 H new ATOM 0 HG LEU A 111 3.491 7.790 0.354 1.00 0.19 H new ATOM 0 HD11 LEU A 111 3.333 10.029 -0.745 1.00 0.27 H new ATOM 0 HD12 LEU A 111 4.864 9.182 -1.071 1.00 0.27 H new ATOM 0 HD13 LEU A 111 3.593 9.234 -2.316 1.00 0.27 H new ATOM 0 HD21 LEU A 111 1.338 8.911 -0.324 1.00 0.31 H new ATOM 0 HD22 LEU A 111 1.372 7.969 -1.834 1.00 0.31 H new ATOM 0 HD23 LEU A 111 1.219 7.136 -0.268 1.00 0.31 H new ATOM 1822 N VAL A 112 4.783 4.399 -3.343 1.00 0.28 N ATOM 1823 CA VAL A 112 5.655 3.305 -3.741 1.00 0.30 C ATOM 1824 C VAL A 112 6.181 3.602 -5.148 1.00 0.36 C ATOM 1825 O VAL A 112 7.284 3.196 -5.503 1.00 0.47 O ATOM 1826 CB VAL A 112 4.886 1.973 -3.647 1.00 0.26 C ATOM 1827 CG1 VAL A 112 5.693 0.769 -4.125 1.00 0.25 C ATOM 1828 CG2 VAL A 112 4.521 1.651 -2.191 1.00 0.27 C ATOM 0 H VAL A 112 3.808 4.118 -3.238 1.00 0.28 H new ATOM 0 HA VAL A 112 6.514 3.212 -3.076 1.00 0.30 H new ATOM 0 HB VAL A 112 4.012 2.121 -4.282 1.00 0.26 H new ATOM 0 HG11 VAL A 112 5.090 -0.134 -4.031 1.00 0.25 H new ATOM 0 HG12 VAL A 112 5.974 0.910 -5.169 1.00 0.25 H new ATOM 0 HG13 VAL A 112 6.593 0.670 -3.518 1.00 0.25 H new ATOM 0 HG21 VAL A 112 3.979 0.706 -2.152 1.00 0.27 H new ATOM 0 HG22 VAL A 112 5.431 1.572 -1.597 1.00 0.27 H new ATOM 0 HG23 VAL A 112 3.893 2.446 -1.789 1.00 0.27 H new ATOM 1838 N ASN A 113 5.415 4.318 -5.964 1.00 0.33 N ATOM 1839 CA ASN A 113 5.891 4.762 -7.261 1.00 0.30 C ATOM 1840 C ASN A 113 6.684 6.048 -7.103 1.00 0.29 C ATOM 1841 O ASN A 113 7.804 6.131 -7.597 1.00 0.34 O ATOM 1842 CB ASN A 113 4.734 4.929 -8.245 1.00 0.34 C ATOM 1843 CG ASN A 113 4.356 3.566 -8.796 1.00 1.04 C ATOM 1844 OD1 ASN A 113 4.733 3.229 -9.906 1.00 1.79 O ATOM 1845 ND2 ASN A 113 3.706 2.717 -8.017 1.00 1.87 N ATOM 0 H ASN A 113 4.460 4.602 -5.746 1.00 0.33 H new ATOM 0 HA ASN A 113 6.551 4.000 -7.676 1.00 0.30 H new ATOM 0 HB2 ASN A 113 3.878 5.385 -7.747 1.00 0.34 H new ATOM 0 HB3 ASN A 113 5.023 5.597 -9.057 1.00 0.34 H new ATOM 0 HD21 ASN A 113 3.515 1.769 -8.343 1.00 1.87 H new ATOM 0 HD22 ASN A 113 3.396 3.010 -7.091 1.00 1.87 H new ATOM 1852 N ASP A 114 6.113 7.040 -6.425 1.00 0.26 N ATOM 1853 CA ASP A 114 6.691 8.372 -6.325 1.00 0.29 C ATOM 1854 C ASP A 114 6.753 8.785 -4.848 1.00 0.28 C ATOM 1855 O ASP A 114 5.831 9.398 -4.309 1.00 0.28 O ATOM 1856 CB ASP A 114 5.890 9.343 -7.204 1.00 0.36 C ATOM 1857 CG ASP A 114 6.751 10.539 -7.598 1.00 0.66 C ATOM 1858 OD1 ASP A 114 7.213 11.250 -6.682 1.00 1.29 O ATOM 1859 OD2 ASP A 114 6.971 10.702 -8.819 1.00 1.83 O ATOM 0 H ASP A 114 5.229 6.939 -5.926 1.00 0.26 H new ATOM 0 HA ASP A 114 7.715 8.388 -6.699 1.00 0.29 H new ATOM 0 HB2 ASP A 114 5.540 8.829 -8.099 1.00 0.36 H new ATOM 0 HB3 ASP A 114 5.006 9.685 -6.666 1.00 0.36 H new ATOM 1864 N PRO A 115 7.806 8.364 -4.135 1.00 0.32 N ATOM 1865 CA PRO A 115 7.914 8.591 -2.705 1.00 0.32 C ATOM 1866 C PRO A 115 8.270 10.049 -2.431 1.00 0.28 C ATOM 1867 O PRO A 115 9.005 10.667 -3.197 1.00 0.37 O ATOM 1868 CB PRO A 115 9.016 7.644 -2.226 1.00 0.43 C ATOM 1869 CG PRO A 115 9.897 7.474 -3.464 1.00 0.47 C ATOM 1870 CD PRO A 115 8.898 7.539 -4.618 1.00 0.38 C ATOM 0 HA PRO A 115 6.978 8.399 -2.181 1.00 0.32 H new ATOM 0 HB2 PRO A 115 9.574 8.066 -1.390 1.00 0.43 H new ATOM 0 HB3 PRO A 115 8.609 6.691 -1.888 1.00 0.43 H new ATOM 0 HG2 PRO A 115 10.646 8.262 -3.536 1.00 0.47 H new ATOM 0 HG3 PRO A 115 10.433 6.525 -3.449 1.00 0.47 H new ATOM 0 HD2 PRO A 115 9.354 7.972 -5.508 1.00 0.38 H new ATOM 0 HD3 PRO A 115 8.548 6.544 -4.891 1.00 0.38 H new ATOM 1878 N GLN A 116 7.795 10.591 -1.309 1.00 0.26 N ATOM 1879 CA GLN A 116 8.030 11.981 -0.949 1.00 0.26 C ATOM 1880 C GLN A 116 9.152 12.072 0.089 1.00 0.24 C ATOM 1881 O GLN A 116 8.888 11.866 1.271 1.00 0.31 O ATOM 1882 CB GLN A 116 6.736 12.593 -0.390 1.00 0.33 C ATOM 1883 CG GLN A 116 5.620 12.620 -1.441 1.00 1.80 C ATOM 1884 CD GLN A 116 4.411 13.408 -0.939 1.00 1.88 C ATOM 1885 OE1 GLN A 116 4.541 14.511 -0.429 1.00 2.12 O ATOM 1886 NE2 GLN A 116 3.206 12.865 -1.057 1.00 2.57 N ATOM 0 H GLN A 116 7.238 10.076 -0.628 1.00 0.26 H new ATOM 0 HA GLN A 116 8.333 12.537 -1.836 1.00 0.26 H new ATOM 0 HB2 GLN A 116 6.406 12.019 0.476 1.00 0.33 H new ATOM 0 HB3 GLN A 116 6.934 13.607 -0.043 1.00 0.33 H new ATOM 0 HG2 GLN A 116 5.994 13.069 -2.361 1.00 1.80 H new ATOM 0 HG3 GLN A 116 5.319 11.601 -1.683 1.00 1.80 H new ATOM 0 HE21 GLN A 116 3.101 11.944 -1.483 1.00 2.57 H new ATOM 0 HE22 GLN A 116 2.385 13.368 -0.722 1.00 2.57 H new ATOM 1895 N PRO A 117 10.396 12.409 -0.294 1.00 0.25 N ATOM 1896 CA PRO A 117 11.500 12.534 0.647 1.00 0.27 C ATOM 1897 C PRO A 117 11.457 13.800 1.507 1.00 0.36 C ATOM 1898 O PRO A 117 12.384 14.022 2.276 1.00 0.62 O ATOM 1899 CB PRO A 117 12.777 12.478 -0.192 1.00 0.34 C ATOM 1900 CG PRO A 117 12.319 13.041 -1.538 1.00 0.41 C ATOM 1901 CD PRO A 117 10.883 12.530 -1.657 1.00 0.32 C ATOM 0 HA PRO A 117 11.444 11.725 1.375 1.00 0.27 H new ATOM 0 HB2 PRO A 117 13.576 13.076 0.246 1.00 0.34 H new ATOM 0 HB3 PRO A 117 13.155 11.460 -0.286 1.00 0.34 H new ATOM 0 HG2 PRO A 117 12.362 14.130 -1.555 1.00 0.41 H new ATOM 0 HG3 PRO A 117 12.943 12.684 -2.357 1.00 0.41 H new ATOM 0 HD2 PRO A 117 10.268 13.221 -2.233 1.00 0.32 H new ATOM 0 HD3 PRO A 117 10.850 11.570 -2.171 1.00 0.32 H new ATOM 1909 N GLU A 118 10.406 14.617 1.416 1.00 0.33 N ATOM 1910 CA GLU A 118 10.224 15.741 2.323 1.00 0.40 C ATOM 1911 C GLU A 118 10.057 15.232 3.756 1.00 0.38 C ATOM 1912 O GLU A 118 10.951 15.387 4.587 1.00 0.77 O ATOM 1913 CB GLU A 118 8.997 16.554 1.900 1.00 0.51 C ATOM 1914 CG GLU A 118 9.330 17.609 0.840 1.00 2.14 C ATOM 1915 CD GLU A 118 8.169 18.585 0.628 1.00 2.41 C ATOM 1916 OE1 GLU A 118 7.009 18.153 0.811 1.00 2.40 O ATOM 1917 OE2 GLU A 118 8.459 19.754 0.288 1.00 3.56 O ATOM 0 H GLU A 118 9.668 14.517 0.719 1.00 0.33 H new ATOM 0 HA GLU A 118 11.103 16.384 2.281 1.00 0.40 H new ATOM 0 HB2 GLU A 118 8.235 15.879 1.510 1.00 0.51 H new ATOM 0 HB3 GLU A 118 8.571 17.045 2.775 1.00 0.51 H new ATOM 0 HG2 GLU A 118 10.219 18.162 1.143 1.00 2.14 H new ATOM 0 HG3 GLU A 118 9.567 17.116 -0.103 1.00 2.14 H new ATOM 1924 N HIS A 119 8.902 14.633 4.062 1.00 0.26 N ATOM 1925 CA HIS A 119 8.589 14.210 5.424 1.00 0.34 C ATOM 1926 C HIS A 119 7.883 12.850 5.431 1.00 0.35 C ATOM 1927 O HIS A 119 6.724 12.754 5.834 1.00 0.42 O ATOM 1928 CB HIS A 119 7.749 15.291 6.115 1.00 0.48 C ATOM 1929 CG HIS A 119 8.405 16.649 6.120 1.00 1.77 C ATOM 1930 ND1 HIS A 119 9.668 16.945 6.581 1.00 4.00 N ATOM 1931 CD2 HIS A 119 7.889 17.789 5.571 1.00 2.20 C ATOM 1932 CE1 HIS A 119 9.895 18.245 6.327 1.00 5.24 C ATOM 1933 NE2 HIS A 119 8.835 18.805 5.725 1.00 4.10 N ATOM 0 H HIS A 119 8.170 14.431 3.381 1.00 0.26 H new ATOM 0 HA HIS A 119 9.517 14.085 5.982 1.00 0.34 H new ATOM 0 HB2 HIS A 119 6.783 15.364 5.615 1.00 0.48 H new ATOM 0 HB3 HIS A 119 7.554 14.987 7.143 1.00 0.48 H new ATOM 0 HD2 HIS A 119 6.921 17.887 5.101 1.00 2.20 H new ATOM 0 HE1 HIS A 119 10.807 18.768 6.574 1.00 5.24 H new ATOM 0 HE2 HIS A 119 8.739 19.779 5.437 1.00 4.10 H new ATOM 1941 N PRO A 120 8.556 11.788 4.975 1.00 0.28 N ATOM 1942 CA PRO A 120 8.016 10.439 4.981 1.00 0.26 C ATOM 1943 C PRO A 120 8.259 9.762 6.338 1.00 0.29 C ATOM 1944 O PRO A 120 8.808 10.368 7.255 1.00 0.35 O ATOM 1945 CB PRO A 120 8.780 9.750 3.857 1.00 0.21 C ATOM 1946 CG PRO A 120 10.168 10.372 3.975 1.00 0.23 C ATOM 1947 CD PRO A 120 9.876 11.814 4.371 1.00 0.26 C ATOM 0 HA PRO A 120 6.937 10.402 4.833 1.00 0.26 H new ATOM 0 HB2 PRO A 120 8.807 8.668 3.988 1.00 0.21 H new ATOM 0 HB3 PRO A 120 8.330 9.942 2.883 1.00 0.21 H new ATOM 0 HG2 PRO A 120 10.774 9.864 4.726 1.00 0.23 H new ATOM 0 HG3 PRO A 120 10.715 10.317 3.034 1.00 0.23 H new ATOM 0 HD2 PRO A 120 10.622 12.187 5.073 1.00 0.26 H new ATOM 0 HD3 PRO A 120 9.898 12.472 3.502 1.00 0.26 H new ATOM 1955 N LEU A 121 7.875 8.486 6.462 1.00 0.26 N ATOM 1956 CA LEU A 121 8.005 7.709 7.695 1.00 0.27 C ATOM 1957 C LEU A 121 9.465 7.610 8.116 1.00 0.29 C ATOM 1958 O LEU A 121 9.821 7.892 9.257 1.00 0.37 O ATOM 1959 CB LEU A 121 7.417 6.297 7.504 1.00 0.23 C ATOM 1960 CG LEU A 121 6.214 6.073 8.421 1.00 0.25 C ATOM 1961 CD1 LEU A 121 5.461 4.819 7.989 1.00 0.52 C ATOM 1962 CD2 LEU A 121 6.629 5.925 9.885 1.00 0.51 C ATOM 0 H LEU A 121 7.459 7.958 5.695 1.00 0.26 H new ATOM 0 HA LEU A 121 7.449 8.221 8.480 1.00 0.27 H new ATOM 0 HB2 LEU A 121 7.116 6.162 6.465 1.00 0.23 H new ATOM 0 HB3 LEU A 121 8.182 5.550 7.714 1.00 0.23 H new ATOM 0 HG LEU A 121 5.573 6.950 8.336 1.00 0.25 H new ATOM 0 HD11 LEU A 121 4.605 4.664 8.646 1.00 0.52 H new ATOM 0 HD12 LEU A 121 5.114 4.938 6.963 1.00 0.52 H new ATOM 0 HD13 LEU A 121 6.125 3.957 8.049 1.00 0.52 H new ATOM 0 HD21 LEU A 121 5.743 5.768 10.500 1.00 0.51 H new ATOM 0 HD22 LEU A 121 7.299 5.072 9.989 1.00 0.51 H new ATOM 0 HD23 LEU A 121 7.141 6.830 10.211 1.00 0.51 H new ATOM 1974 N ARG A 122 10.315 7.187 7.183 1.00 0.30 N ATOM 1975 CA ARG A 122 11.747 7.126 7.382 1.00 0.33 C ATOM 1976 C ARG A 122 12.379 8.112 6.422 1.00 0.33 C ATOM 1977 O ARG A 122 12.712 7.750 5.295 1.00 0.32 O ATOM 1978 CB ARG A 122 12.258 5.700 7.145 1.00 0.33 C ATOM 1979 CG ARG A 122 11.896 4.759 8.305 1.00 0.40 C ATOM 1980 CD ARG A 122 13.123 3.981 8.805 1.00 0.49 C ATOM 1981 NE ARG A 122 14.151 4.861 9.398 1.00 0.94 N ATOM 1982 CZ ARG A 122 14.121 5.381 10.632 1.00 1.48 C ATOM 1983 NH1 ARG A 122 15.127 6.151 11.058 1.00 1.85 N ATOM 1984 NH2 ARG A 122 13.081 5.129 11.432 1.00 2.41 N ATOM 0 H ARG A 122 10.017 6.875 6.259 1.00 0.30 H new ATOM 0 HA ARG A 122 12.011 7.388 8.406 1.00 0.33 H new ATOM 0 HB2 ARG A 122 11.835 5.313 6.218 1.00 0.33 H new ATOM 0 HB3 ARG A 122 13.340 5.719 7.018 1.00 0.33 H new ATOM 0 HG2 ARG A 122 11.472 5.338 9.126 1.00 0.40 H new ATOM 0 HG3 ARG A 122 11.128 4.058 7.979 1.00 0.40 H new ATOM 0 HD2 ARG A 122 12.806 3.248 9.547 1.00 0.49 H new ATOM 0 HD3 ARG A 122 13.560 3.426 7.975 1.00 0.49 H new ATOM 0 HE ARG A 122 14.956 5.093 8.816 1.00 0.94 H new ATOM 0 HH11 ARG A 122 15.918 6.343 10.443 1.00 1.85 H new ATOM 0 HH12 ARG A 122 15.104 6.547 11.998 1.00 1.85 H new ATOM 0 HH21 ARG A 122 12.314 4.543 11.102 1.00 2.41 H new ATOM 0 HH22 ARG A 122 13.054 5.523 12.373 1.00 2.41 H new ATOM 1998 N ALA A 123 12.581 9.346 6.892 1.00 0.38 N ATOM 1999 CA ALA A 123 13.333 10.352 6.155 1.00 0.37 C ATOM 2000 C ALA A 123 14.651 9.758 5.666 1.00 0.37 C ATOM 2001 O ALA A 123 15.038 9.998 4.538 1.00 0.35 O ATOM 2002 CB ALA A 123 13.571 11.585 7.031 1.00 0.41 C ATOM 0 H ALA A 123 12.227 9.670 7.792 1.00 0.38 H new ATOM 0 HA ALA A 123 12.756 10.667 5.285 1.00 0.37 H new ATOM 0 HB1 ALA A 123 14.134 12.329 6.467 1.00 0.41 H new ATOM 0 HB2 ALA A 123 12.613 12.008 7.333 1.00 0.41 H new ATOM 0 HB3 ALA A 123 14.136 11.298 7.918 1.00 0.41 H new ATOM 2008 N ASP A 124 15.291 8.937 6.497 1.00 0.43 N ATOM 2009 CA ASP A 124 16.537 8.220 6.231 1.00 0.46 C ATOM 2010 C ASP A 124 16.512 7.459 4.904 1.00 0.42 C ATOM 2011 O ASP A 124 17.330 7.708 4.026 1.00 0.44 O ATOM 2012 CB ASP A 124 16.754 7.248 7.408 1.00 0.65 C ATOM 2013 CG ASP A 124 18.160 7.251 7.983 1.00 0.99 C ATOM 2014 OD1 ASP A 124 18.222 6.989 9.207 1.00 2.10 O ATOM 2015 OD2 ASP A 124 19.110 7.495 7.214 1.00 2.37 O ATOM 0 H ASP A 124 14.931 8.743 7.431 1.00 0.43 H new ATOM 0 HA ASP A 124 17.354 8.936 6.143 1.00 0.46 H new ATOM 0 HB2 ASP A 124 16.051 7.498 8.202 1.00 0.65 H new ATOM 0 HB3 ASP A 124 16.514 6.238 7.076 1.00 0.65 H new ATOM 2020 N LEU A 125 15.553 6.547 4.709 1.00 0.38 N ATOM 2021 CA LEU A 125 15.401 5.842 3.440 1.00 0.37 C ATOM 2022 C LEU A 125 15.230 6.840 2.289 1.00 0.35 C ATOM 2023 O LEU A 125 15.668 6.594 1.169 1.00 0.40 O ATOM 2024 CB LEU A 125 14.201 4.884 3.523 1.00 0.35 C ATOM 2025 CG LEU A 125 14.367 3.735 4.526 1.00 0.59 C ATOM 2026 CD1 LEU A 125 13.120 2.848 4.487 1.00 1.38 C ATOM 2027 CD2 LEU A 125 15.604 2.900 4.214 1.00 1.15 C ATOM 0 H LEU A 125 14.870 6.282 5.419 1.00 0.38 H new ATOM 0 HA LEU A 125 16.300 5.259 3.243 1.00 0.37 H new ATOM 0 HB2 LEU A 125 13.314 5.457 3.791 1.00 0.35 H new ATOM 0 HB3 LEU A 125 14.021 4.462 2.534 1.00 0.35 H new ATOM 0 HG LEU A 125 14.493 4.161 5.521 1.00 0.59 H new ATOM 0 HD11 LEU A 125 13.233 2.030 5.198 1.00 1.38 H new ATOM 0 HD12 LEU A 125 12.244 3.440 4.751 1.00 1.38 H new ATOM 0 HD13 LEU A 125 12.994 2.442 3.483 1.00 1.38 H new ATOM 0 HD21 LEU A 125 15.693 2.095 4.943 1.00 1.15 H new ATOM 0 HD22 LEU A 125 15.514 2.476 3.214 1.00 1.15 H new ATOM 0 HD23 LEU A 125 16.491 3.532 4.262 1.00 1.15 H new ATOM 2039 N ALA A 126 14.585 7.972 2.562 1.00 0.29 N ATOM 2040 CA ALA A 126 14.346 9.030 1.594 1.00 0.26 C ATOM 2041 C ALA A 126 15.619 9.824 1.305 1.00 0.27 C ATOM 2042 O ALA A 126 15.753 10.397 0.228 1.00 0.27 O ATOM 2043 CB ALA A 126 13.235 9.945 2.108 1.00 0.22 C ATOM 0 H ALA A 126 14.206 8.180 3.486 1.00 0.29 H new ATOM 0 HA ALA A 126 14.033 8.578 0.653 1.00 0.26 H new ATOM 0 HB1 ALA A 126 13.054 10.739 1.384 1.00 0.22 H new ATOM 0 HB2 ALA A 126 12.322 9.366 2.248 1.00 0.22 H new ATOM 0 HB3 ALA A 126 13.536 10.383 3.060 1.00 0.22 H new ATOM 2049 N GLU A 127 16.542 9.874 2.256 1.00 0.31 N ATOM 2050 CA GLU A 127 17.833 10.520 2.135 1.00 0.34 C ATOM 2051 C GLU A 127 18.725 9.680 1.252 1.00 0.39 C ATOM 2052 O GLU A 127 19.228 10.177 0.252 1.00 0.41 O ATOM 2053 CB GLU A 127 18.507 10.741 3.489 1.00 0.41 C ATOM 2054 CG GLU A 127 17.689 11.746 4.294 1.00 0.44 C ATOM 2055 CD GLU A 127 18.560 12.889 4.818 1.00 0.69 C ATOM 2056 OE1 GLU A 127 18.601 13.090 6.049 1.00 1.92 O ATOM 2057 OE2 GLU A 127 19.205 13.548 3.965 1.00 1.87 O ATOM 0 H GLU A 127 16.401 9.445 3.171 1.00 0.31 H new ATOM 0 HA GLU A 127 17.672 11.504 1.694 1.00 0.34 H new ATOM 0 HB2 GLU A 127 18.583 9.798 4.030 1.00 0.41 H new ATOM 0 HB3 GLU A 127 19.523 11.110 3.348 1.00 0.41 H new ATOM 0 HG2 GLU A 127 16.893 12.151 3.670 1.00 0.44 H new ATOM 0 HG3 GLU A 127 17.210 11.239 5.132 1.00 0.44 H new ATOM 2064 N GLU A 128 18.908 8.406 1.599 1.00 0.44 N ATOM 2065 CA GLU A 128 19.713 7.505 0.783 1.00 0.51 C ATOM 2066 C GLU A 128 19.132 7.457 -0.627 1.00 0.49 C ATOM 2067 O GLU A 128 19.874 7.404 -1.600 1.00 0.52 O ATOM 2068 CB GLU A 128 19.815 6.114 1.425 1.00 0.63 C ATOM 2069 CG GLU A 128 20.682 5.203 0.536 1.00 0.59 C ATOM 2070 CD GLU A 128 21.036 3.853 1.168 1.00 1.46 C ATOM 2071 OE1 GLU A 128 20.094 3.095 1.498 1.00 2.37 O ATOM 2072 OE2 GLU A 128 22.253 3.565 1.245 1.00 2.23 O ATOM 0 H GLU A 128 18.511 7.979 2.436 1.00 0.44 H new ATOM 0 HA GLU A 128 20.734 7.881 0.720 1.00 0.51 H new ATOM 0 HB2 GLU A 128 20.252 6.192 2.420 1.00 0.63 H new ATOM 0 HB3 GLU A 128 18.821 5.683 1.546 1.00 0.63 H new ATOM 0 HG2 GLU A 128 20.156 5.025 -0.402 1.00 0.59 H new ATOM 0 HG3 GLU A 128 21.605 5.728 0.289 1.00 0.59 H new ATOM 2079 N TYR A 129 17.806 7.542 -0.750 1.00 0.44 N ATOM 2080 CA TYR A 129 17.155 7.595 -2.053 1.00 0.45 C ATOM 2081 C TYR A 129 17.533 8.881 -2.777 1.00 0.42 C ATOM 2082 O TYR A 129 18.006 8.857 -3.905 1.00 0.51 O ATOM 2083 CB TYR A 129 15.641 7.556 -1.840 1.00 0.44 C ATOM 2084 CG TYR A 129 14.799 7.708 -3.093 1.00 0.70 C ATOM 2085 CD1 TYR A 129 14.680 6.622 -3.972 1.00 1.83 C ATOM 2086 CD2 TYR A 129 14.125 8.911 -3.375 1.00 1.82 C ATOM 2087 CE1 TYR A 129 13.895 6.723 -5.132 1.00 2.18 C ATOM 2088 CE2 TYR A 129 13.332 9.024 -4.533 1.00 2.22 C ATOM 2089 CZ TYR A 129 13.214 7.925 -5.416 1.00 1.86 C ATOM 2090 OH TYR A 129 12.460 8.006 -6.548 1.00 2.44 O ATOM 0 H TYR A 129 17.164 7.575 0.042 1.00 0.44 H new ATOM 0 HA TYR A 129 17.475 6.747 -2.658 1.00 0.45 H new ATOM 0 HB2 TYR A 129 15.383 6.610 -1.363 1.00 0.44 H new ATOM 0 HB3 TYR A 129 15.370 8.349 -1.143 1.00 0.44 H new ATOM 0 HD1 TYR A 129 15.197 5.699 -3.755 1.00 1.83 H new ATOM 0 HD2 TYR A 129 14.216 9.750 -2.701 1.00 1.82 H new ATOM 0 HE1 TYR A 129 13.813 5.882 -5.805 1.00 2.18 H new ATOM 0 HE2 TYR A 129 12.815 9.948 -4.747 1.00 2.22 H new ATOM 0 HH TYR A 129 12.052 8.895 -6.606 1.00 2.44 H new ATOM 2100 N SER A 130 17.281 10.021 -2.148 1.00 0.33 N ATOM 2101 CA SER A 130 17.369 11.335 -2.759 1.00 0.32 C ATOM 2102 C SER A 130 18.790 11.547 -3.274 1.00 0.40 C ATOM 2103 O SER A 130 18.990 11.900 -4.439 1.00 0.80 O ATOM 2104 CB SER A 130 16.928 12.381 -1.725 1.00 0.32 C ATOM 2105 OG SER A 130 17.130 13.696 -2.201 1.00 0.55 O ATOM 0 H SER A 130 17.001 10.055 -1.168 1.00 0.33 H new ATOM 0 HA SER A 130 16.706 11.432 -3.619 1.00 0.32 H new ATOM 0 HB2 SER A 130 15.874 12.237 -1.487 1.00 0.32 H new ATOM 0 HB3 SER A 130 17.486 12.238 -0.800 1.00 0.32 H new ATOM 0 HG SER A 130 16.838 14.338 -1.521 1.00 0.55 H new ATOM 2111 N LYS A 131 19.767 11.263 -2.413 1.00 0.31 N ATOM 2112 CA LYS A 131 21.180 11.264 -2.765 1.00 0.31 C ATOM 2113 C LYS A 131 21.418 10.259 -3.887 1.00 0.33 C ATOM 2114 O LYS A 131 22.041 10.600 -4.889 1.00 0.41 O ATOM 2115 CB LYS A 131 22.060 10.917 -1.548 1.00 0.36 C ATOM 2116 CG LYS A 131 22.540 12.122 -0.724 1.00 0.68 C ATOM 2117 CD LYS A 131 21.454 12.851 0.082 1.00 0.87 C ATOM 2118 CE LYS A 131 21.952 13.087 1.515 1.00 1.38 C ATOM 2119 NZ LYS A 131 21.055 13.980 2.278 1.00 1.84 N ATOM 0 H LYS A 131 19.592 11.023 -1.437 1.00 0.31 H new ATOM 0 HA LYS A 131 21.455 12.264 -3.099 1.00 0.31 H new ATOM 0 HB2 LYS A 131 21.500 10.249 -0.893 1.00 0.36 H new ATOM 0 HB3 LYS A 131 22.933 10.364 -1.896 1.00 0.36 H new ATOM 0 HG2 LYS A 131 23.313 11.783 -0.034 1.00 0.68 H new ATOM 0 HG3 LYS A 131 23.008 12.838 -1.400 1.00 0.68 H new ATOM 0 HD2 LYS A 131 21.212 13.802 -0.392 1.00 0.87 H new ATOM 0 HD3 LYS A 131 20.538 12.260 0.097 1.00 0.87 H new ATOM 0 HE2 LYS A 131 22.035 12.131 2.031 1.00 1.38 H new ATOM 0 HE3 LYS A 131 22.952 13.520 1.484 1.00 1.38 H new ATOM 0 HZ1 LYS A 131 21.623 14.651 2.833 1.00 1.84 H new ATOM 0 HZ2 LYS A 131 20.445 14.505 1.619 1.00 1.84 H new ATOM 0 HZ3 LYS A 131 20.464 13.413 2.919 1.00 1.84 H new ATOM 2133 N ASP A 132 20.971 9.016 -3.710 1.00 0.39 N ATOM 2134 CA ASP A 132 21.384 7.916 -4.569 1.00 0.55 C ATOM 2135 C ASP A 132 20.247 6.916 -4.804 1.00 0.55 C ATOM 2136 O ASP A 132 20.166 5.819 -4.243 1.00 0.59 O ATOM 2137 CB ASP A 132 22.631 7.251 -3.992 1.00 0.67 C ATOM 2138 CG ASP A 132 23.291 6.352 -5.034 1.00 0.85 C ATOM 2139 OD1 ASP A 132 22.546 5.733 -5.827 1.00 1.49 O ATOM 2140 OD2 ASP A 132 24.539 6.277 -5.027 1.00 2.15 O ATOM 0 H ASP A 132 20.318 8.749 -2.973 1.00 0.39 H new ATOM 0 HA ASP A 132 21.636 8.317 -5.551 1.00 0.55 H new ATOM 0 HB2 ASP A 132 23.337 8.013 -3.662 1.00 0.67 H new ATOM 0 HB3 ASP A 132 22.363 6.663 -3.114 1.00 0.67 H new ATOM 2145 N ARG A 133 19.388 7.268 -5.758 1.00 0.53 N ATOM 2146 CA ARG A 133 18.308 6.395 -6.181 1.00 0.50 C ATOM 2147 C ARG A 133 18.842 5.125 -6.835 1.00 0.46 C ATOM 2148 O ARG A 133 18.066 4.201 -7.041 1.00 0.36 O ATOM 2149 CB ARG A 133 17.339 7.094 -7.145 1.00 0.51 C ATOM 2150 CG ARG A 133 16.582 8.280 -6.525 1.00 0.66 C ATOM 2151 CD ARG A 133 17.290 9.642 -6.568 1.00 1.53 C ATOM 2152 NE ARG A 133 17.414 10.160 -7.935 1.00 1.98 N ATOM 2153 CZ ARG A 133 18.171 11.209 -8.278 1.00 3.07 C ATOM 2154 NH1 ARG A 133 18.197 11.613 -9.549 1.00 3.98 N ATOM 2155 NH2 ARG A 133 18.898 11.852 -7.362 1.00 4.05 N ATOM 0 H ARG A 133 19.424 8.159 -6.253 1.00 0.53 H new ATOM 0 HA ARG A 133 17.761 6.130 -5.276 1.00 0.50 H new ATOM 0 HB2 ARG A 133 17.898 7.447 -8.012 1.00 0.51 H new ATOM 0 HB3 ARG A 133 16.615 6.364 -7.508 1.00 0.51 H new ATOM 0 HG2 ARG A 133 15.624 8.377 -7.035 1.00 0.66 H new ATOM 0 HG3 ARG A 133 16.366 8.040 -5.484 1.00 0.66 H new ATOM 0 HD2 ARG A 133 16.736 10.357 -5.959 1.00 1.53 H new ATOM 0 HD3 ARG A 133 18.282 9.548 -6.126 1.00 1.53 H new ATOM 0 HE ARG A 133 16.889 9.690 -8.672 1.00 1.98 H new ATOM 0 HH11 ARG A 133 17.643 11.123 -10.251 1.00 3.98 H new ATOM 0 HH12 ARG A 133 18.771 12.412 -9.819 1.00 3.98 H new ATOM 0 HH21 ARG A 133 18.880 11.545 -6.389 1.00 4.05 H new ATOM 0 HH22 ARG A 133 19.471 12.650 -7.634 1.00 4.05 H new ATOM 2169 N LYS A 134 20.123 5.046 -7.206 1.00 0.55 N ATOM 2170 CA LYS A 134 20.659 3.844 -7.831 1.00 0.52 C ATOM 2171 C LYS A 134 20.807 2.751 -6.789 1.00 0.53 C ATOM 2172 O LYS A 134 20.465 1.608 -7.086 1.00 0.58 O ATOM 2173 CB LYS A 134 21.979 4.149 -8.546 1.00 0.50 C ATOM 2174 CG LYS A 134 21.639 4.850 -9.868 1.00 0.54 C ATOM 2175 CD LYS A 134 22.823 5.632 -10.436 1.00 1.73 C ATOM 2176 CE LYS A 134 22.332 6.403 -11.666 1.00 2.16 C ATOM 2177 NZ LYS A 134 23.404 7.216 -12.278 1.00 3.03 N ATOM 0 H LYS A 134 20.801 5.798 -7.083 1.00 0.55 H new ATOM 0 HA LYS A 134 19.965 3.488 -8.592 1.00 0.52 H new ATOM 0 HB2 LYS A 134 22.612 4.785 -7.927 1.00 0.50 H new ATOM 0 HB3 LYS A 134 22.535 3.230 -8.732 1.00 0.50 H new ATOM 0 HG2 LYS A 134 21.315 4.107 -10.597 1.00 0.54 H new ATOM 0 HG3 LYS A 134 20.801 5.529 -9.711 1.00 0.54 H new ATOM 0 HD2 LYS A 134 23.220 6.319 -9.689 1.00 1.73 H new ATOM 0 HD3 LYS A 134 23.632 4.955 -10.708 1.00 1.73 H new ATOM 0 HE2 LYS A 134 21.945 5.700 -12.403 1.00 2.16 H new ATOM 0 HE3 LYS A 134 21.504 7.052 -11.380 1.00 2.16 H new ATOM 0 HZ1 LYS A 134 23.028 7.720 -13.106 1.00 3.03 H new ATOM 0 HZ2 LYS A 134 23.756 7.905 -11.584 1.00 3.03 H new ATOM 0 HZ3 LYS A 134 24.184 6.595 -12.576 1.00 3.03 H new ATOM 2191 N LYS A 135 21.268 3.070 -5.577 1.00 0.52 N ATOM 2192 CA LYS A 135 21.222 2.081 -4.504 1.00 0.52 C ATOM 2193 C LYS A 135 19.794 1.656 -4.267 1.00 0.46 C ATOM 2194 O LYS A 135 19.523 0.470 -4.257 1.00 0.44 O ATOM 2195 CB LYS A 135 21.813 2.602 -3.196 1.00 0.56 C ATOM 2196 CG LYS A 135 23.343 2.500 -3.214 1.00 0.70 C ATOM 2197 CD LYS A 135 24.011 3.868 -3.086 1.00 1.31 C ATOM 2198 CE LYS A 135 25.129 3.883 -2.043 1.00 1.48 C ATOM 2199 NZ LYS A 135 26.421 3.474 -2.628 1.00 2.73 N ATOM 0 H LYS A 135 21.664 3.974 -5.321 1.00 0.52 H new ATOM 0 HA LYS A 135 21.829 1.234 -4.824 1.00 0.52 H new ATOM 0 HB2 LYS A 135 21.514 3.639 -3.044 1.00 0.56 H new ATOM 0 HB3 LYS A 135 21.415 2.030 -2.358 1.00 0.56 H new ATOM 0 HG2 LYS A 135 23.673 1.858 -2.397 1.00 0.70 H new ATOM 0 HG3 LYS A 135 23.664 2.026 -4.142 1.00 0.70 H new ATOM 0 HD2 LYS A 135 24.418 4.161 -4.054 1.00 1.31 H new ATOM 0 HD3 LYS A 135 23.260 4.611 -2.818 1.00 1.31 H new ATOM 0 HE2 LYS A 135 25.220 4.884 -1.621 1.00 1.48 H new ATOM 0 HE3 LYS A 135 24.872 3.213 -1.223 1.00 1.48 H new ATOM 0 HZ1 LYS A 135 27.157 3.495 -1.893 1.00 2.73 H new ATOM 0 HZ2 LYS A 135 26.340 2.510 -3.009 1.00 2.73 H new ATOM 0 HZ3 LYS A 135 26.678 4.128 -3.394 1.00 2.73 H new ATOM 2213 N PHE A 136 18.864 2.587 -4.103 1.00 0.52 N ATOM 2214 CA PHE A 136 17.489 2.223 -3.797 1.00 0.51 C ATOM 2215 C PHE A 136 16.941 1.318 -4.892 1.00 0.43 C ATOM 2216 O PHE A 136 16.239 0.356 -4.608 1.00 0.39 O ATOM 2217 CB PHE A 136 16.624 3.474 -3.640 1.00 0.57 C ATOM 2218 CG PHE A 136 15.151 3.214 -3.891 1.00 0.74 C ATOM 2219 CD1 PHE A 136 14.298 2.816 -2.846 1.00 2.15 C ATOM 2220 CD2 PHE A 136 14.649 3.347 -5.201 1.00 2.10 C ATOM 2221 CE1 PHE A 136 12.945 2.551 -3.115 1.00 2.35 C ATOM 2222 CE2 PHE A 136 13.302 3.073 -5.470 1.00 2.59 C ATOM 2223 CZ PHE A 136 12.455 2.675 -4.426 1.00 1.92 C ATOM 0 H PHE A 136 19.035 3.590 -4.176 1.00 0.52 H new ATOM 0 HA PHE A 136 17.467 1.681 -2.852 1.00 0.51 H new ATOM 0 HB2 PHE A 136 16.750 3.872 -2.633 1.00 0.57 H new ATOM 0 HB3 PHE A 136 16.975 4.240 -4.332 1.00 0.57 H new ATOM 0 HD1 PHE A 136 14.681 2.715 -1.841 1.00 2.15 H new ATOM 0 HD2 PHE A 136 15.305 3.661 -6.000 1.00 2.10 H new ATOM 0 HE1 PHE A 136 12.283 2.253 -2.316 1.00 2.35 H new ATOM 0 HE2 PHE A 136 12.918 3.168 -6.475 1.00 2.59 H new ATOM 0 HZ PHE A 136 11.416 2.462 -4.631 1.00 1.92 H new ATOM 2233 N CYS A 137 17.235 1.638 -6.149 1.00 0.43 N ATOM 2234 CA CYS A 137 16.694 0.914 -7.275 1.00 0.39 C ATOM 2235 C CYS A 137 17.240 -0.507 -7.257 1.00 0.34 C ATOM 2236 O CYS A 137 16.489 -1.455 -7.459 1.00 0.31 O ATOM 2237 CB CYS A 137 17.045 1.634 -8.581 1.00 0.42 C ATOM 2238 SG CYS A 137 16.069 0.942 -9.945 1.00 1.65 S ATOM 0 H CYS A 137 17.855 2.406 -6.406 1.00 0.43 H new ATOM 0 HA CYS A 137 15.607 0.871 -7.206 1.00 0.39 H new ATOM 0 HB2 CYS A 137 16.846 2.701 -8.484 1.00 0.42 H new ATOM 0 HB3 CYS A 137 18.109 1.526 -8.792 1.00 0.42 H new ATOM 0 HG CYS A 137 16.369 1.558 -11.050 1.00 1.65 H new ATOM 2244 N LYS A 138 18.549 -0.675 -7.040 1.00 0.36 N ATOM 2245 CA LYS A 138 19.116 -2.026 -7.143 1.00 0.35 C ATOM 2246 C LYS A 138 18.741 -2.829 -5.908 1.00 0.35 C ATOM 2247 O LYS A 138 18.254 -3.952 -6.003 1.00 0.34 O ATOM 2248 CB LYS A 138 20.637 -2.007 -7.352 1.00 0.47 C ATOM 2249 CG LYS A 138 20.983 -2.101 -8.847 1.00 0.71 C ATOM 2250 CD LYS A 138 20.746 -0.796 -9.615 1.00 0.98 C ATOM 2251 CE LYS A 138 21.844 0.231 -9.321 1.00 2.49 C ATOM 2252 NZ LYS A 138 23.141 -0.164 -9.915 1.00 3.00 N ATOM 0 H LYS A 138 19.209 0.066 -6.803 1.00 0.36 H new ATOM 0 HA LYS A 138 18.692 -2.504 -8.026 1.00 0.35 H new ATOM 0 HB2 LYS A 138 21.055 -1.091 -6.934 1.00 0.47 H new ATOM 0 HB3 LYS A 138 21.093 -2.839 -6.815 1.00 0.47 H new ATOM 0 HG2 LYS A 138 22.029 -2.390 -8.952 1.00 0.71 H new ATOM 0 HG3 LYS A 138 20.387 -2.893 -9.300 1.00 0.71 H new ATOM 0 HD2 LYS A 138 20.715 -1.002 -10.685 1.00 0.98 H new ATOM 0 HD3 LYS A 138 19.775 -0.382 -9.342 1.00 0.98 H new ATOM 0 HE2 LYS A 138 21.546 1.204 -9.713 1.00 2.49 H new ATOM 0 HE3 LYS A 138 21.957 0.343 -8.243 1.00 2.49 H new ATOM 0 HZ1 LYS A 138 23.773 0.662 -9.950 1.00 3.00 H new ATOM 0 HZ2 LYS A 138 23.576 -0.909 -9.334 1.00 3.00 H new ATOM 0 HZ3 LYS A 138 22.986 -0.523 -10.879 1.00 3.00 H new ATOM 2266 N ASN A 139 18.929 -2.221 -4.743 1.00 0.41 N ATOM 2267 CA ASN A 139 18.518 -2.760 -3.460 1.00 0.44 C ATOM 2268 C ASN A 139 17.075 -3.239 -3.537 1.00 0.42 C ATOM 2269 O ASN A 139 16.770 -4.314 -3.040 1.00 0.48 O ATOM 2270 CB ASN A 139 18.630 -1.712 -2.347 1.00 0.54 C ATOM 2271 CG ASN A 139 20.053 -1.282 -2.019 1.00 0.64 C ATOM 2272 OD1 ASN A 139 21.020 -1.846 -2.516 1.00 1.51 O ATOM 2273 ND2 ASN A 139 20.198 -0.274 -1.170 1.00 0.67 N ATOM 0 H ASN A 139 19.386 -1.312 -4.667 1.00 0.41 H new ATOM 0 HA ASN A 139 19.182 -3.592 -3.226 1.00 0.44 H new ATOM 0 HB2 ASN A 139 18.057 -0.831 -2.637 1.00 0.54 H new ATOM 0 HB3 ASN A 139 18.168 -2.110 -1.444 1.00 0.54 H new ATOM 0 HD21 ASN A 139 21.132 0.049 -0.917 1.00 0.67 H new ATOM 0 HD22 ASN A 139 19.376 0.178 -0.770 1.00 0.67 H new ATOM 2280 N ALA A 140 16.183 -2.453 -4.146 1.00 0.39 N ATOM 2281 CA ALA A 140 14.787 -2.818 -4.305 1.00 0.40 C ATOM 2282 C ALA A 140 14.638 -4.010 -5.233 1.00 0.33 C ATOM 2283 O ALA A 140 13.801 -4.854 -4.970 1.00 0.31 O ATOM 2284 CB ALA A 140 13.950 -1.667 -4.856 1.00 0.44 C ATOM 0 H ALA A 140 16.418 -1.543 -4.542 1.00 0.39 H new ATOM 0 HA ALA A 140 14.423 -3.072 -3.309 1.00 0.40 H new ATOM 0 HB1 ALA A 140 12.913 -1.987 -4.958 1.00 0.44 H new ATOM 0 HB2 ALA A 140 14.003 -0.819 -4.173 1.00 0.44 H new ATOM 0 HB3 ALA A 140 14.336 -1.371 -5.832 1.00 0.44 H new ATOM 2290 N GLU A 141 15.376 -4.078 -6.336 1.00 0.32 N ATOM 2291 CA GLU A 141 15.344 -5.198 -7.268 1.00 0.30 C ATOM 2292 C GLU A 141 15.620 -6.502 -6.516 1.00 0.29 C ATOM 2293 O GLU A 141 14.948 -7.513 -6.724 1.00 0.32 O ATOM 2294 CB GLU A 141 16.359 -4.904 -8.389 1.00 0.32 C ATOM 2295 CG GLU A 141 16.053 -5.616 -9.710 1.00 0.70 C ATOM 2296 CD GLU A 141 16.797 -4.982 -10.894 1.00 0.84 C ATOM 2297 OE1 GLU A 141 17.776 -4.240 -10.658 1.00 1.95 O ATOM 2298 OE2 GLU A 141 16.361 -5.248 -12.039 1.00 2.15 O ATOM 0 H GLU A 141 16.026 -3.342 -6.612 1.00 0.32 H new ATOM 0 HA GLU A 141 14.363 -5.320 -7.727 1.00 0.30 H new ATOM 0 HB2 GLU A 141 16.388 -3.829 -8.566 1.00 0.32 H new ATOM 0 HB3 GLU A 141 17.353 -5.198 -8.051 1.00 0.32 H new ATOM 0 HG2 GLU A 141 16.332 -6.667 -9.628 1.00 0.70 H new ATOM 0 HG3 GLU A 141 14.980 -5.585 -9.898 1.00 0.70 H new ATOM 2305 N GLU A 142 16.573 -6.465 -5.584 1.00 0.29 N ATOM 2306 CA GLU A 142 16.880 -7.624 -4.770 1.00 0.31 C ATOM 2307 C GLU A 142 15.782 -7.869 -3.743 1.00 0.32 C ATOM 2308 O GLU A 142 15.285 -8.983 -3.641 1.00 0.35 O ATOM 2309 CB GLU A 142 18.235 -7.466 -4.079 1.00 0.37 C ATOM 2310 CG GLU A 142 19.370 -7.743 -5.069 1.00 0.50 C ATOM 2311 CD GLU A 142 20.684 -7.948 -4.322 1.00 1.13 C ATOM 2312 OE1 GLU A 142 20.759 -8.991 -3.628 1.00 1.69 O ATOM 2313 OE2 GLU A 142 21.572 -7.079 -4.432 1.00 2.11 O ATOM 0 H GLU A 142 17.141 -5.642 -5.380 1.00 0.29 H new ATOM 0 HA GLU A 142 16.934 -8.491 -5.429 1.00 0.31 H new ATOM 0 HB2 GLU A 142 18.331 -6.457 -3.678 1.00 0.37 H new ATOM 0 HB3 GLU A 142 18.303 -8.153 -3.235 1.00 0.37 H new ATOM 0 HG2 GLU A 142 19.138 -8.629 -5.661 1.00 0.50 H new ATOM 0 HG3 GLU A 142 19.466 -6.910 -5.766 1.00 0.50 H new ATOM 2320 N PHE A 143 15.401 -6.853 -2.971 1.00 0.38 N ATOM 2321 CA PHE A 143 14.411 -6.957 -1.901 1.00 0.39 C ATOM 2322 C PHE A 143 13.132 -7.578 -2.446 1.00 0.31 C ATOM 2323 O PHE A 143 12.546 -8.481 -1.854 1.00 0.30 O ATOM 2324 CB PHE A 143 14.138 -5.571 -1.301 1.00 0.46 C ATOM 2325 CG PHE A 143 14.582 -5.398 0.138 1.00 1.07 C ATOM 2326 CD1 PHE A 143 13.742 -4.749 1.063 1.00 1.06 C ATOM 2327 CD2 PHE A 143 15.869 -5.808 0.533 1.00 2.06 C ATOM 2328 CE1 PHE A 143 14.195 -4.497 2.369 1.00 1.88 C ATOM 2329 CE2 PHE A 143 16.308 -5.585 1.849 1.00 2.86 C ATOM 2330 CZ PHE A 143 15.474 -4.922 2.766 1.00 2.74 C ATOM 0 H PHE A 143 15.781 -5.912 -3.075 1.00 0.38 H new ATOM 0 HA PHE A 143 14.797 -7.599 -1.109 1.00 0.39 H new ATOM 0 HB2 PHE A 143 14.640 -4.821 -1.913 1.00 0.46 H new ATOM 0 HB3 PHE A 143 13.069 -5.369 -1.362 1.00 0.46 H new ATOM 0 HD1 PHE A 143 12.749 -4.445 0.768 1.00 1.06 H new ATOM 0 HD2 PHE A 143 16.521 -6.295 -0.177 1.00 2.06 H new ATOM 0 HE1 PHE A 143 13.559 -3.976 3.069 1.00 1.88 H new ATOM 0 HE2 PHE A 143 17.287 -5.923 2.156 1.00 2.86 H new ATOM 0 HZ PHE A 143 15.816 -4.740 3.774 1.00 2.74 H new ATOM 2340 N THR A 144 12.739 -7.115 -3.622 1.00 0.30 N ATOM 2341 CA THR A 144 11.686 -7.677 -4.426 1.00 0.29 C ATOM 2342 C THR A 144 11.918 -9.178 -4.642 1.00 0.29 C ATOM 2343 O THR A 144 11.048 -9.967 -4.297 1.00 0.30 O ATOM 2344 CB THR A 144 11.572 -6.860 -5.715 1.00 0.31 C ATOM 2345 OG1 THR A 144 11.119 -5.564 -5.392 1.00 0.33 O ATOM 2346 CG2 THR A 144 10.560 -7.472 -6.660 1.00 0.34 C ATOM 0 H THR A 144 13.171 -6.299 -4.055 1.00 0.30 H new ATOM 0 HA THR A 144 10.723 -7.613 -3.920 1.00 0.29 H new ATOM 0 HB THR A 144 12.551 -6.839 -6.193 1.00 0.31 H new ATOM 0 HG1 THR A 144 11.885 -4.996 -5.168 1.00 0.33 H new ATOM 0 HG21 THR A 144 10.500 -6.871 -7.567 1.00 0.34 H new ATOM 0 HG22 THR A 144 10.868 -8.486 -6.916 1.00 0.34 H new ATOM 0 HG23 THR A 144 9.583 -7.500 -6.178 1.00 0.34 H new ATOM 2354 N LYS A 145 13.062 -9.633 -5.165 1.00 0.34 N ATOM 2355 CA LYS A 145 13.229 -11.071 -5.378 1.00 0.38 C ATOM 2356 C LYS A 145 13.620 -11.856 -4.115 1.00 0.47 C ATOM 2357 O LYS A 145 13.915 -13.050 -4.205 1.00 0.86 O ATOM 2358 CB LYS A 145 14.220 -11.317 -6.515 1.00 0.57 C ATOM 2359 CG LYS A 145 15.699 -11.231 -6.104 1.00 1.60 C ATOM 2360 CD LYS A 145 16.493 -12.318 -6.828 1.00 1.72 C ATOM 2361 CE LYS A 145 16.086 -13.743 -6.410 1.00 1.98 C ATOM 2362 NZ LYS A 145 16.545 -14.102 -5.053 1.00 3.26 N ATOM 0 H LYS A 145 13.855 -9.053 -5.438 1.00 0.34 H new ATOM 0 HA LYS A 145 12.248 -11.458 -5.655 1.00 0.38 H new ATOM 0 HB2 LYS A 145 14.031 -12.304 -6.937 1.00 0.57 H new ATOM 0 HB3 LYS A 145 14.033 -10.590 -7.306 1.00 0.57 H new ATOM 0 HG2 LYS A 145 16.100 -10.248 -6.351 1.00 1.60 H new ATOM 0 HG3 LYS A 145 15.795 -11.353 -5.025 1.00 1.60 H new ATOM 0 HD2 LYS A 145 16.352 -12.207 -7.903 1.00 1.72 H new ATOM 0 HD3 LYS A 145 17.555 -12.177 -6.629 1.00 1.72 H new ATOM 0 HE2 LYS A 145 15.001 -13.833 -6.455 1.00 1.98 H new ATOM 0 HE3 LYS A 145 16.495 -14.456 -7.126 1.00 1.98 H new ATOM 0 HZ1 LYS A 145 16.731 -15.124 -5.008 1.00 3.26 H new ATOM 0 HZ2 LYS A 145 17.418 -13.582 -4.833 1.00 3.26 H new ATOM 0 HZ3 LYS A 145 15.810 -13.853 -4.361 1.00 3.26 H new ATOM 2376 N LYS A 146 13.749 -11.200 -2.962 1.00 0.37 N ATOM 2377 CA LYS A 146 13.942 -11.826 -1.661 1.00 0.38 C ATOM 2378 C LYS A 146 12.564 -12.150 -1.084 1.00 0.36 C ATOM 2379 O LYS A 146 12.251 -13.307 -0.833 1.00 0.44 O ATOM 2380 CB LYS A 146 14.699 -10.853 -0.737 1.00 0.41 C ATOM 2381 CG LYS A 146 16.194 -11.117 -0.554 1.00 0.71 C ATOM 2382 CD LYS A 146 17.044 -11.186 -1.826 1.00 1.53 C ATOM 2383 CE LYS A 146 18.472 -10.781 -1.433 1.00 1.66 C ATOM 2384 NZ LYS A 146 19.443 -10.872 -2.542 1.00 2.65 N ATOM 0 H LYS A 146 13.720 -10.182 -2.910 1.00 0.37 H new ATOM 0 HA LYS A 146 14.527 -12.741 -1.752 1.00 0.38 H new ATOM 0 HB2 LYS A 146 14.575 -9.843 -1.129 1.00 0.41 H new ATOM 0 HB3 LYS A 146 14.225 -10.875 0.244 1.00 0.41 H new ATOM 0 HG2 LYS A 146 16.602 -10.333 0.085 1.00 0.71 H new ATOM 0 HG3 LYS A 146 16.309 -12.058 -0.017 1.00 0.71 H new ATOM 0 HD2 LYS A 146 17.030 -12.192 -2.245 1.00 1.53 H new ATOM 0 HD3 LYS A 146 16.650 -10.516 -2.590 1.00 1.53 H new ATOM 0 HE2 LYS A 146 18.459 -9.758 -1.057 1.00 1.66 H new ATOM 0 HE3 LYS A 146 18.808 -11.418 -0.615 1.00 1.66 H new ATOM 0 HZ1 LYS A 146 20.205 -11.530 -2.283 1.00 2.65 H new ATOM 0 HZ2 LYS A 146 18.962 -11.219 -3.397 1.00 2.65 H new ATOM 0 HZ3 LYS A 146 19.846 -9.932 -2.729 1.00 2.65 H new ATOM 2398 N TYR A 147 11.775 -11.106 -0.836 1.00 0.31 N ATOM 2399 CA TYR A 147 10.506 -11.140 -0.125 1.00 0.28 C ATOM 2400 C TYR A 147 9.343 -10.592 -0.945 1.00 0.23 C ATOM 2401 O TYR A 147 8.199 -10.841 -0.582 1.00 0.29 O ATOM 2402 CB TYR A 147 10.631 -10.306 1.147 1.00 0.35 C ATOM 2403 CG TYR A 147 10.917 -11.158 2.352 1.00 0.40 C ATOM 2404 CD1 TYR A 147 12.203 -11.214 2.912 1.00 1.86 C ATOM 2405 CD2 TYR A 147 9.864 -11.901 2.905 1.00 1.75 C ATOM 2406 CE1 TYR A 147 12.430 -12.004 4.050 1.00 1.91 C ATOM 2407 CE2 TYR A 147 10.088 -12.703 4.030 1.00 1.73 C ATOM 2408 CZ TYR A 147 11.374 -12.751 4.618 1.00 0.47 C ATOM 2409 OH TYR A 147 11.605 -13.500 5.731 1.00 0.54 O ATOM 0 H TYR A 147 12.020 -10.165 -1.144 1.00 0.31 H new ATOM 0 HA TYR A 147 10.291 -12.186 0.092 1.00 0.28 H new ATOM 0 HB2 TYR A 147 11.428 -9.573 1.023 1.00 0.35 H new ATOM 0 HB3 TYR A 147 9.708 -9.749 1.308 1.00 0.35 H new ATOM 0 HD1 TYR A 147 13.013 -10.653 2.470 1.00 1.86 H new ATOM 0 HD2 TYR A 147 8.880 -11.854 2.463 1.00 1.75 H new ATOM 0 HE1 TYR A 147 13.415 -12.041 4.492 1.00 1.91 H new ATOM 0 HE2 TYR A 147 9.280 -13.285 4.449 1.00 1.73 H new ATOM 0 HH TYR A 147 10.778 -13.953 5.998 1.00 0.54 H new ATOM 2419 N GLY A 148 9.605 -9.774 -1.965 1.00 0.23 N ATOM 2420 CA GLY A 148 8.556 -9.192 -2.788 1.00 0.24 C ATOM 2421 C GLY A 148 7.678 -10.276 -3.400 1.00 0.26 C ATOM 2422 O GLY A 148 8.119 -11.388 -3.678 1.00 0.28 O ATOM 0 H GLY A 148 10.548 -9.500 -2.239 1.00 0.23 H new ATOM 0 HA2 GLY A 148 7.945 -8.522 -2.184 1.00 0.24 H new ATOM 0 HA3 GLY A 148 9.002 -8.590 -3.580 1.00 0.24 H new ATOM 2426 N GLU A 149 6.404 -9.946 -3.583 1.00 0.27 N ATOM 2427 CA GLU A 149 5.401 -10.909 -3.977 1.00 0.23 C ATOM 2428 C GLU A 149 5.585 -11.315 -5.436 1.00 0.24 C ATOM 2429 O GLU A 149 6.127 -10.572 -6.255 1.00 0.33 O ATOM 2430 CB GLU A 149 4.024 -10.281 -3.744 1.00 0.31 C ATOM 2431 CG GLU A 149 2.842 -11.249 -3.806 1.00 1.05 C ATOM 2432 CD GLU A 149 3.037 -12.449 -2.885 1.00 0.53 C ATOM 2433 OE1 GLU A 149 3.732 -13.384 -3.340 1.00 1.42 O ATOM 2434 OE2 GLU A 149 2.512 -12.409 -1.752 1.00 1.43 O ATOM 0 H GLU A 149 6.044 -8.999 -3.460 1.00 0.27 H new ATOM 0 HA GLU A 149 5.496 -11.817 -3.381 1.00 0.23 H new ATOM 0 HB2 GLU A 149 4.025 -9.797 -2.767 1.00 0.31 H new ATOM 0 HB3 GLU A 149 3.870 -9.498 -4.487 1.00 0.31 H new ATOM 0 HG2 GLU A 149 1.928 -10.724 -3.528 1.00 1.05 H new ATOM 0 HG3 GLU A 149 2.711 -11.596 -4.831 1.00 1.05 H new ATOM 2441 N LYS A 150 5.089 -12.495 -5.785 1.00 0.25 N ATOM 2442 CA LYS A 150 5.165 -13.003 -7.151 1.00 0.35 C ATOM 2443 C LYS A 150 4.164 -12.261 -8.037 1.00 0.37 C ATOM 2444 O LYS A 150 3.028 -12.691 -8.220 1.00 0.48 O ATOM 2445 CB LYS A 150 5.021 -14.536 -7.184 1.00 0.47 C ATOM 2446 CG LYS A 150 3.763 -15.088 -6.494 1.00 1.76 C ATOM 2447 CD LYS A 150 3.837 -16.597 -6.232 1.00 2.46 C ATOM 2448 CE LYS A 150 3.485 -17.423 -7.475 1.00 3.39 C ATOM 2449 NZ LYS A 150 4.675 -17.979 -8.155 1.00 4.22 N ATOM 0 H LYS A 150 4.624 -13.126 -5.132 1.00 0.25 H new ATOM 0 HA LYS A 150 6.153 -12.803 -7.565 1.00 0.35 H new ATOM 0 HB2 LYS A 150 5.019 -14.863 -8.224 1.00 0.47 H new ATOM 0 HB3 LYS A 150 5.899 -14.978 -6.712 1.00 0.47 H new ATOM 0 HG2 LYS A 150 3.616 -14.567 -5.548 1.00 1.76 H new ATOM 0 HG3 LYS A 150 2.892 -14.875 -7.114 1.00 1.76 H new ATOM 0 HD2 LYS A 150 4.842 -16.857 -5.899 1.00 2.46 H new ATOM 0 HD3 LYS A 150 3.156 -16.856 -5.422 1.00 2.46 H new ATOM 0 HE2 LYS A 150 2.823 -18.240 -7.186 1.00 3.39 H new ATOM 0 HE3 LYS A 150 2.932 -16.797 -8.176 1.00 3.39 H new ATOM 0 HZ1 LYS A 150 4.375 -18.527 -8.987 1.00 4.22 H new ATOM 0 HZ2 LYS A 150 5.296 -17.202 -8.458 1.00 4.22 H new ATOM 0 HZ3 LYS A 150 5.191 -18.600 -7.499 1.00 4.22 H new ATOM 2463 N ARG A 151 4.593 -11.131 -8.602 1.00 0.38 N ATOM 2464 CA ARG A 151 3.788 -10.375 -9.553 1.00 0.49 C ATOM 2465 C ARG A 151 3.433 -11.253 -10.754 1.00 0.65 C ATOM 2466 O ARG A 151 4.239 -12.089 -11.167 1.00 0.76 O ATOM 2467 CB ARG A 151 4.535 -9.102 -9.976 1.00 0.59 C ATOM 2468 CG ARG A 151 5.855 -9.380 -10.715 1.00 1.13 C ATOM 2469 CD ARG A 151 5.834 -8.868 -12.154 1.00 1.02 C ATOM 2470 NE ARG A 151 7.010 -9.336 -12.898 1.00 1.87 N ATOM 2471 CZ ARG A 151 7.154 -10.514 -13.518 1.00 1.90 C ATOM 2472 NH1 ARG A 151 8.278 -10.784 -14.183 1.00 3.00 N ATOM 2473 NH2 ARG A 151 6.180 -11.423 -13.462 1.00 2.54 N ATOM 0 H ARG A 151 5.506 -10.718 -8.412 1.00 0.38 H new ATOM 0 HA ARG A 151 2.854 -10.070 -9.081 1.00 0.49 H new ATOM 0 HB2 ARG A 151 3.887 -8.507 -10.619 1.00 0.59 H new ATOM 0 HB3 ARG A 151 4.743 -8.502 -9.090 1.00 0.59 H new ATOM 0 HG2 ARG A 151 6.677 -8.908 -10.176 1.00 1.13 H new ATOM 0 HG3 ARG A 151 6.049 -10.453 -10.716 1.00 1.13 H new ATOM 0 HD2 ARG A 151 4.926 -9.209 -12.651 1.00 1.02 H new ATOM 0 HD3 ARG A 151 5.809 -7.778 -12.155 1.00 1.02 H new ATOM 0 HE ARG A 151 7.802 -8.695 -12.948 1.00 1.87 H new ATOM 0 HH11 ARG A 151 9.028 -10.093 -14.219 1.00 3.00 H new ATOM 0 HH12 ARG A 151 8.388 -11.681 -14.655 1.00 3.00 H new ATOM 0 HH21 ARG A 151 5.323 -11.221 -12.946 1.00 2.54 H new ATOM 0 HH22 ARG A 151 6.292 -12.320 -13.935 1.00 2.54 H new ATOM 2487 N PRO A 152 2.250 -11.058 -11.345 1.00 0.72 N ATOM 2488 CA PRO A 152 1.812 -11.837 -12.491 1.00 0.85 C ATOM 2489 C PRO A 152 2.723 -11.539 -13.684 1.00 0.98 C ATOM 2490 O PRO A 152 3.469 -10.567 -13.662 1.00 1.05 O ATOM 2491 CB PRO A 152 0.361 -11.413 -12.726 1.00 0.93 C ATOM 2492 CG PRO A 152 0.320 -9.979 -12.193 1.00 0.96 C ATOM 2493 CD PRO A 152 1.334 -9.972 -11.050 1.00 0.73 C ATOM 0 HA PRO A 152 1.867 -12.915 -12.336 1.00 0.85 H new ATOM 0 HB2 PRO A 152 0.096 -11.457 -13.782 1.00 0.93 H new ATOM 0 HB3 PRO A 152 -0.338 -12.059 -12.195 1.00 0.93 H new ATOM 0 HG2 PRO A 152 0.588 -9.259 -12.967 1.00 0.96 H new ATOM 0 HG3 PRO A 152 -0.677 -9.713 -11.842 1.00 0.96 H new ATOM 0 HD2 PRO A 152 1.859 -9.018 -10.996 1.00 0.73 H new ATOM 0 HD3 PRO A 152 0.844 -10.121 -10.088 1.00 0.73 H new ATOM 2501 N VAL A 153 2.715 -12.388 -14.711 1.00 1.13 N ATOM 2502 CA VAL A 153 3.489 -12.124 -15.924 1.00 1.27 C ATOM 2503 C VAL A 153 2.739 -11.187 -16.871 1.00 1.30 C ATOM 2504 O VAL A 153 3.341 -10.664 -17.804 1.00 1.48 O ATOM 2505 CB VAL A 153 3.856 -13.435 -16.639 1.00 1.66 C ATOM 2506 CG1 VAL A 153 4.843 -14.241 -15.786 1.00 2.04 C ATOM 2507 CG2 VAL A 153 2.633 -14.307 -16.954 1.00 1.87 C ATOM 0 H VAL A 153 2.185 -13.259 -14.728 1.00 1.13 H new ATOM 0 HA VAL A 153 4.411 -11.628 -15.623 1.00 1.27 H new ATOM 0 HB VAL A 153 4.312 -13.154 -17.588 1.00 1.66 H new ATOM 0 HG11 VAL A 153 5.097 -15.168 -16.301 1.00 2.04 H new ATOM 0 HG12 VAL A 153 5.748 -13.655 -15.626 1.00 2.04 H new ATOM 0 HG13 VAL A 153 4.387 -14.474 -14.824 1.00 2.04 H new ATOM 0 HG21 VAL A 153 2.956 -15.218 -17.458 1.00 1.87 H new ATOM 0 HG22 VAL A 153 2.123 -14.567 -16.026 1.00 1.87 H new ATOM 0 HG23 VAL A 153 1.951 -13.756 -17.601 1.00 1.87 H new ATOM 2517 N ASP A 154 1.435 -11.013 -16.651 1.00 1.40 N ATOM 2518 CA ASP A 154 0.554 -10.183 -17.455 1.00 1.84 C ATOM 2519 C ASP A 154 0.409 -8.843 -16.745 1.00 2.76 C ATOM 2520 O ASP A 154 0.419 -7.804 -17.437 1.00 3.92 O ATOM 2521 CB ASP A 154 -0.815 -10.876 -17.582 1.00 2.42 C ATOM 2522 CG ASP A 154 -1.446 -10.670 -18.959 1.00 3.62 C ATOM 2523 OD1 ASP A 154 -0.832 -11.149 -19.939 1.00 4.82 O ATOM 2524 OD2 ASP A 154 -2.564 -10.110 -19.013 1.00 4.25 O ATOM 2525 OXT ASP A 154 0.308 -8.897 -15.496 1.00 3.54 O ATOM 0 H ASP A 154 0.951 -11.467 -15.876 1.00 1.40 H new ATOM 0 HA ASP A 154 0.958 -10.032 -18.456 1.00 1.84 H new ATOM 0 HB2 ASP A 154 -0.698 -11.943 -17.395 1.00 2.42 H new ATOM 0 HB3 ASP A 154 -1.487 -10.490 -16.816 1.00 2.42 H new TER 2530 ASP A 154