USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1092 hydrogens (44 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 29 TYR OH : rot -164:sc= 1.24 USER MOD Set 1.2: A 97 THR OG1 : rot -10:sc= 1.01 USER MOD Single : A 6 SER OG : rot 56:sc= 0.9 USER MOD Single : A 9 SER OG : rot -141:sc= -0.276 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -1.58 K(o=-1.6,f=-3.2) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 161:sc= -0.0204 (180deg=-0.135) USER MOD Single : A 33 HIS : no HD1:sc= 0.518 K(o=0.52,f=-6.3!) USER MOD Single : A 38 SER OG : rot -69:sc= 0.00704 USER MOD Single : A 47 ASN : amide:sc= -0.0382 X(o=-0.038,f=0) USER MOD Single : A 53 THR OG1 : rot -15:sc= 0.952 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 180:sc= -0.299 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 SER OG : rot 99:sc= 0.566 USER MOD Single : A 69 GLN : amide:sc= -0.21 K(o=-0.21,f=-1.1) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -44:sc= -0.093 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.809 USER MOD Single : A 80 ASN : amide:sc= -0.678 K(o=-0.68,f=-1.8) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.487 USER MOD Single : A 86 TYR OH : rot 180:sc= -0.148 USER MOD Single : A 87 CYS SG : rot 89:sc= 0.0336 USER MOD Single : A 89 HIS : no HD1:sc= -0.583 K(o=-0.1,f=-4.2!) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.095) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 151:sc=-0.00174 (180deg=-0.0842) USER MOD Single : A 108 GLN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.381 X(o=-0.38,f=-0.16) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 THR OG1 : rot 62:sc= 1.1 USER MOD Single : A 124 ASN : amide:sc= 0.0395 K(o=0.039,f=-1) USER MOD Single : A 125 ASN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 ASN : amide:sc= 0.194 X(o=0.19,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 300 PIO O2 : rot -156:sc= 0.0791 USER MOD Single : A 300 PIO O3 : rot 180:sc= 0.0625 USER MOD Single : A 300 PIO O6 : rot -168:sc= 0.49 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 8.497 2.471 -5.453 1.00 13.00 N ATOM 2 CA GLY A 2 9.667 2.291 -4.614 1.00 45.03 C ATOM 3 C GLY A 2 9.402 2.644 -3.164 1.00 71.12 C ATOM 4 O GLY A 2 8.418 3.314 -2.852 1.00 63.52 O ATOM 0 HA2 GLY A 2 9.999 1.255 -4.677 1.00 45.03 H new ATOM 0 HA3 GLY A 2 10.480 2.910 -4.992 1.00 45.03 H new ATOM 8 N ALA A 3 10.280 2.190 -2.276 1.00 21.20 N ATOM 9 CA ALA A 3 10.135 2.462 -0.851 1.00 70.14 C ATOM 10 C ALA A 3 11.220 3.416 -0.361 1.00 41.14 C ATOM 11 O ALA A 3 12.222 3.633 -1.042 1.00 14.33 O ATOM 12 CB ALA A 3 10.174 1.164 -0.059 1.00 70.14 C ATOM 0 H ALA A 3 11.099 1.632 -2.518 1.00 21.20 H new ATOM 0 HA ALA A 3 9.169 2.941 -0.694 1.00 70.14 H new ATOM 0 HB1 ALA A 3 10.065 1.383 1.003 1.00 70.14 H new ATOM 0 HB2 ALA A 3 9.359 0.516 -0.382 1.00 70.14 H new ATOM 0 HB3 ALA A 3 11.126 0.662 -0.230 1.00 70.14 H new ATOM 18 N ARG A 4 11.013 3.982 0.823 1.00 52.01 N ATOM 19 CA ARG A 4 11.973 4.914 1.403 1.00 33.12 C ATOM 20 C ARG A 4 13.133 4.165 2.050 1.00 45.23 C ATOM 21 O ARG A 4 14.283 4.303 1.635 1.00 4.24 O ATOM 22 CB ARG A 4 11.287 5.807 2.437 1.00 25.43 C ATOM 23 CG ARG A 4 10.735 7.099 1.856 1.00 60.14 C ATOM 24 CD ARG A 4 11.850 8.062 1.481 1.00 21.35 C ATOM 25 NE ARG A 4 12.453 8.686 2.656 1.00 50.04 N ATOM 26 CZ ARG A 4 11.895 9.691 3.323 1.00 72.45 C ATOM 27 NH1 ARG A 4 10.727 10.183 2.933 1.00 73.33 N ATOM 28 NH2 ARG A 4 12.505 10.205 4.384 1.00 54.12 N ATOM 0 H ARG A 4 10.189 3.812 1.400 1.00 52.01 H new ATOM 0 HA ARG A 4 12.368 5.537 0.601 1.00 33.12 H new ATOM 0 HB2 ARG A 4 10.473 5.251 2.902 1.00 25.43 H new ATOM 0 HB3 ARG A 4 11.999 6.049 3.226 1.00 25.43 H new ATOM 0 HG2 ARG A 4 10.134 6.875 0.975 1.00 60.14 H new ATOM 0 HG3 ARG A 4 10.073 7.572 2.581 1.00 60.14 H new ATOM 0 HD2 ARG A 4 12.617 7.528 0.921 1.00 21.35 H new ATOM 0 HD3 ARG A 4 11.455 8.835 0.823 1.00 21.35 H new ATOM 0 HE ARG A 4 13.352 8.331 2.983 1.00 50.04 H new ATOM 0 HH11 ARG A 4 10.254 9.790 2.119 1.00 73.33 H new ATOM 0 HH12 ARG A 4 10.301 10.954 3.447 1.00 73.33 H new ATOM 0 HH21 ARG A 4 13.403 9.829 4.688 1.00 54.12 H new ATOM 0 HH22 ARG A 4 12.076 10.976 4.895 1.00 54.12 H new ATOM 42 N ALA A 5 12.823 3.373 3.072 1.00 43.22 N ATOM 43 CA ALA A 5 13.841 2.602 3.776 1.00 30.23 C ATOM 44 C ALA A 5 13.204 1.573 4.705 1.00 3.33 C ATOM 45 O ALA A 5 12.728 1.912 5.789 1.00 43.42 O ATOM 46 CB ALA A 5 14.756 3.530 4.562 1.00 13.11 C ATOM 0 H ALA A 5 11.876 3.249 3.430 1.00 43.22 H new ATOM 0 HA ALA A 5 14.434 2.067 3.035 1.00 30.23 H new ATOM 0 HB1 ALA A 5 15.511 2.941 5.083 1.00 13.11 H new ATOM 0 HB2 ALA A 5 15.245 4.224 3.878 1.00 13.11 H new ATOM 0 HB3 ALA A 5 14.168 4.091 5.289 1.00 13.11 H new ATOM 52 N SER A 6 13.198 0.317 4.272 1.00 63.44 N ATOM 53 CA SER A 6 12.615 -0.761 5.064 1.00 3.34 C ATOM 54 C SER A 6 13.131 -2.118 4.596 1.00 51.42 C ATOM 55 O SER A 6 12.404 -2.891 3.973 1.00 15.21 O ATOM 56 CB SER A 6 11.089 -0.723 4.969 1.00 22.11 C ATOM 57 OG SER A 6 10.653 -0.971 3.644 1.00 73.33 O ATOM 0 H SER A 6 13.590 0.020 3.378 1.00 63.44 H new ATOM 0 HA SER A 6 12.911 -0.617 6.103 1.00 3.34 H new ATOM 0 HB2 SER A 6 10.661 -1.467 5.641 1.00 22.11 H new ATOM 0 HB3 SER A 6 10.725 0.250 5.298 1.00 22.11 H new ATOM 0 HG SER A 6 11.016 -1.828 3.335 1.00 73.33 H new ATOM 63 N VAL A 7 14.393 -2.402 4.901 1.00 42.42 N ATOM 64 CA VAL A 7 15.009 -3.666 4.513 1.00 64.41 C ATOM 65 C VAL A 7 14.425 -4.827 5.309 1.00 61.45 C ATOM 66 O VAL A 7 14.080 -5.867 4.748 1.00 75.31 O ATOM 67 CB VAL A 7 16.536 -3.633 4.718 1.00 24.44 C ATOM 68 CG1 VAL A 7 17.163 -4.942 4.266 1.00 12.12 C ATOM 69 CG2 VAL A 7 17.146 -2.455 3.975 1.00 45.11 C ATOM 0 H VAL A 7 15.010 -1.773 5.416 1.00 42.42 H new ATOM 0 HA VAL A 7 14.796 -3.811 3.454 1.00 64.41 H new ATOM 0 HB VAL A 7 16.741 -3.508 5.781 1.00 24.44 H new ATOM 0 HG11 VAL A 7 18.242 -4.900 4.418 1.00 12.12 H new ATOM 0 HG12 VAL A 7 16.746 -5.765 4.847 1.00 12.12 H new ATOM 0 HG13 VAL A 7 16.952 -5.101 3.209 1.00 12.12 H new ATOM 0 HG21 VAL A 7 18.225 -2.446 4.130 1.00 45.11 H new ATOM 0 HG22 VAL A 7 16.933 -2.547 2.910 1.00 45.11 H new ATOM 0 HG23 VAL A 7 16.718 -1.526 4.352 1.00 45.11 H new ATOM 79 N LEU A 8 14.318 -4.643 6.621 1.00 75.21 N ATOM 80 CA LEU A 8 13.774 -5.676 7.496 1.00 72.34 C ATOM 81 C LEU A 8 12.484 -5.206 8.160 1.00 11.41 C ATOM 82 O LEU A 8 12.321 -4.022 8.453 1.00 42.34 O ATOM 83 CB LEU A 8 14.800 -6.058 8.565 1.00 52.21 C ATOM 84 CG LEU A 8 15.984 -6.901 8.087 1.00 25.30 C ATOM 85 CD1 LEU A 8 17.028 -7.024 9.186 1.00 63.44 C ATOM 86 CD2 LEU A 8 15.514 -8.277 7.641 1.00 14.41 C ATOM 0 H LEU A 8 14.601 -3.789 7.102 1.00 75.21 H new ATOM 0 HA LEU A 8 13.549 -6.551 6.886 1.00 72.34 H new ATOM 0 HB2 LEU A 8 15.188 -5.143 9.012 1.00 52.21 H new ATOM 0 HB3 LEU A 8 14.286 -6.605 9.355 1.00 52.21 H new ATOM 0 HG LEU A 8 16.440 -6.401 7.233 1.00 25.30 H new ATOM 0 HD11 LEU A 8 17.863 -7.627 8.829 1.00 63.44 H new ATOM 0 HD12 LEU A 8 17.387 -6.032 9.459 1.00 63.44 H new ATOM 0 HD13 LEU A 8 16.583 -7.502 10.059 1.00 63.44 H new ATOM 0 HD21 LEU A 8 16.370 -8.862 7.304 1.00 14.41 H new ATOM 0 HD22 LEU A 8 15.033 -8.785 8.476 1.00 14.41 H new ATOM 0 HD23 LEU A 8 14.802 -8.171 6.822 1.00 14.41 H new ATOM 98 N SER A 9 11.570 -6.142 8.393 1.00 24.45 N ATOM 99 CA SER A 9 10.292 -5.822 9.021 1.00 42.23 C ATOM 100 C SER A 9 10.406 -5.873 10.541 1.00 73.23 C ATOM 101 O SER A 9 11.498 -6.018 11.089 1.00 41.44 O ATOM 102 CB SER A 9 9.209 -6.794 8.546 1.00 43.45 C ATOM 103 OG SER A 9 9.156 -7.942 9.375 1.00 10.14 O ATOM 0 H SER A 9 11.690 -7.127 8.157 1.00 24.45 H new ATOM 0 HA SER A 9 10.015 -4.809 8.729 1.00 42.23 H new ATOM 0 HB2 SER A 9 8.240 -6.294 8.549 1.00 43.45 H new ATOM 0 HB3 SER A 9 9.410 -7.093 7.517 1.00 43.45 H new ATOM 0 HG SER A 9 8.996 -8.736 8.824 1.00 10.14 H new ATOM 109 N GLY A 10 9.267 -5.753 11.218 1.00 63.15 N ATOM 110 CA GLY A 10 9.260 -5.788 12.669 1.00 74.31 C ATOM 111 C GLY A 10 9.822 -7.083 13.221 1.00 34.10 C ATOM 112 O GLY A 10 10.701 -7.072 14.080 1.00 5.14 O ATOM 0 H GLY A 10 8.350 -5.632 10.788 1.00 63.15 H new ATOM 0 HA2 GLY A 10 9.843 -4.950 13.052 1.00 74.31 H new ATOM 0 HA3 GLY A 10 8.239 -5.657 13.027 1.00 74.31 H new ATOM 116 N GLY A 11 9.310 -8.207 12.727 1.00 35.42 N ATOM 117 CA GLY A 11 9.775 -9.501 13.189 1.00 52.54 C ATOM 118 C GLY A 11 11.223 -9.761 12.820 1.00 61.41 C ATOM 119 O GLY A 11 11.985 -10.304 13.620 1.00 22.25 O ATOM 0 H GLY A 11 8.581 -8.244 12.015 1.00 35.42 H new ATOM 0 HA2 GLY A 11 9.663 -9.559 14.272 1.00 52.54 H new ATOM 0 HA3 GLY A 11 9.148 -10.283 12.761 1.00 52.54 H new ATOM 123 N GLU A 12 11.601 -9.375 11.607 1.00 52.41 N ATOM 124 CA GLU A 12 12.967 -9.572 11.134 1.00 0.23 C ATOM 125 C GLU A 12 13.943 -8.692 11.909 1.00 40.53 C ATOM 126 O GLU A 12 15.086 -9.080 12.155 1.00 12.31 O ATOM 127 CB GLU A 12 13.061 -9.265 9.638 1.00 42.54 C ATOM 128 CG GLU A 12 11.944 -9.884 8.818 1.00 13.44 C ATOM 129 CD GLU A 12 12.113 -9.648 7.329 1.00 31.02 C ATOM 130 OE1 GLU A 12 11.732 -8.558 6.854 1.00 31.42 O ATOM 131 OE2 GLU A 12 12.627 -10.553 6.639 1.00 51.03 O ATOM 0 H GLU A 12 10.982 -8.924 10.933 1.00 52.41 H new ATOM 0 HA GLU A 12 13.236 -10.615 11.300 1.00 0.23 H new ATOM 0 HB2 GLU A 12 13.048 -8.184 9.496 1.00 42.54 H new ATOM 0 HB3 GLU A 12 14.019 -9.625 9.262 1.00 42.54 H new ATOM 0 HG2 GLU A 12 11.909 -10.956 9.010 1.00 13.44 H new ATOM 0 HG3 GLU A 12 10.989 -9.470 9.141 1.00 13.44 H new ATOM 138 N LEU A 13 13.486 -7.504 12.289 1.00 34.12 N ATOM 139 CA LEU A 13 14.318 -6.567 13.036 1.00 4.12 C ATOM 140 C LEU A 13 14.805 -7.190 14.340 1.00 54.24 C ATOM 141 O LEU A 13 15.990 -7.124 14.667 1.00 50.03 O ATOM 142 CB LEU A 13 13.538 -5.284 13.330 1.00 33.20 C ATOM 143 CG LEU A 13 14.357 -4.108 13.861 1.00 1.53 C ATOM 144 CD1 LEU A 13 15.370 -3.649 12.822 1.00 75.32 C ATOM 145 CD2 LEU A 13 13.443 -2.959 14.261 1.00 0.53 C ATOM 0 H LEU A 13 12.544 -7.167 12.092 1.00 34.12 H new ATOM 0 HA LEU A 13 15.187 -6.325 12.425 1.00 4.12 H new ATOM 0 HB2 LEU A 13 13.038 -4.969 12.414 1.00 33.20 H new ATOM 0 HB3 LEU A 13 12.758 -5.515 14.056 1.00 33.20 H new ATOM 0 HG LEU A 13 14.900 -4.439 14.746 1.00 1.53 H new ATOM 0 HD11 LEU A 13 15.943 -2.811 13.218 1.00 75.32 H new ATOM 0 HD12 LEU A 13 16.045 -4.471 12.584 1.00 75.32 H new ATOM 0 HD13 LEU A 13 14.848 -3.336 11.918 1.00 75.32 H new ATOM 0 HD21 LEU A 13 14.043 -2.130 14.637 1.00 0.53 H new ATOM 0 HD22 LEU A 13 12.872 -2.629 13.393 1.00 0.53 H new ATOM 0 HD23 LEU A 13 12.758 -3.293 15.040 1.00 0.53 H new ATOM 157 N ASP A 14 13.884 -7.797 15.080 1.00 21.14 N ATOM 158 CA ASP A 14 14.219 -8.436 16.347 1.00 61.30 C ATOM 159 C ASP A 14 15.321 -9.473 16.158 1.00 42.33 C ATOM 160 O ASP A 14 16.355 -9.425 16.825 1.00 42.51 O ATOM 161 CB ASP A 14 12.980 -9.095 16.953 1.00 71.43 C ATOM 162 CG ASP A 14 12.330 -8.237 18.021 1.00 14.35 C ATOM 163 OD1 ASP A 14 12.996 -7.947 19.036 1.00 24.15 O ATOM 164 OD2 ASP A 14 11.155 -7.854 17.839 1.00 50.33 O ATOM 0 H ASP A 14 12.899 -7.860 14.824 1.00 21.14 H new ATOM 0 HA ASP A 14 14.582 -7.667 17.029 1.00 61.30 H new ATOM 0 HB2 ASP A 14 12.256 -9.296 16.163 1.00 71.43 H new ATOM 0 HB3 ASP A 14 13.258 -10.057 17.384 1.00 71.43 H new ATOM 169 N LYS A 15 15.094 -10.412 15.245 1.00 2.13 N ATOM 170 CA LYS A 15 16.067 -11.460 14.966 1.00 71.21 C ATOM 171 C LYS A 15 17.380 -10.867 14.466 1.00 1.20 C ATOM 172 O LYS A 15 18.459 -11.349 14.806 1.00 43.24 O ATOM 173 CB LYS A 15 15.510 -12.439 13.930 1.00 60.31 C ATOM 174 CG LYS A 15 15.683 -13.898 14.317 1.00 12.12 C ATOM 175 CD LYS A 15 14.483 -14.416 15.092 1.00 44.10 C ATOM 176 CE LYS A 15 14.911 -15.195 16.327 1.00 13.41 C ATOM 177 NZ LYS A 15 13.833 -16.100 16.812 1.00 35.23 N ATOM 0 H LYS A 15 14.243 -10.468 14.685 1.00 2.13 H new ATOM 0 HA LYS A 15 16.262 -11.995 15.895 1.00 71.21 H new ATOM 0 HB2 LYS A 15 14.450 -12.234 13.782 1.00 60.31 H new ATOM 0 HB3 LYS A 15 16.005 -12.264 12.975 1.00 60.31 H new ATOM 0 HG2 LYS A 15 15.824 -14.499 13.419 1.00 12.12 H new ATOM 0 HG3 LYS A 15 16.583 -14.011 14.921 1.00 12.12 H new ATOM 0 HD2 LYS A 15 13.852 -13.579 15.389 1.00 44.10 H new ATOM 0 HD3 LYS A 15 13.881 -15.056 14.447 1.00 44.10 H new ATOM 0 HE2 LYS A 15 15.801 -15.781 16.097 1.00 13.41 H new ATOM 0 HE3 LYS A 15 15.184 -14.498 17.119 1.00 13.41 H new ATOM 0 HZ1 LYS A 15 14.163 -16.613 17.654 1.00 35.23 H new ATOM 0 HZ2 LYS A 15 12.992 -15.539 17.056 1.00 35.23 H new ATOM 0 HZ3 LYS A 15 13.590 -16.781 16.065 1.00 35.23 H new ATOM 191 N TRP A 16 17.279 -9.817 13.659 1.00 23.13 N ATOM 192 CA TRP A 16 18.459 -9.157 13.113 1.00 4.43 C ATOM 193 C TRP A 16 19.357 -8.635 14.230 1.00 31.40 C ATOM 194 O TRP A 16 20.570 -8.841 14.209 1.00 24.34 O ATOM 195 CB TRP A 16 18.045 -8.005 12.194 1.00 60.45 C ATOM 196 CG TRP A 16 19.208 -7.317 11.545 1.00 0.01 C ATOM 197 CD1 TRP A 16 19.726 -6.097 11.874 1.00 51.43 C ATOM 198 CD2 TRP A 16 19.993 -7.808 10.454 1.00 42.02 C ATOM 199 NE1 TRP A 16 20.787 -5.800 11.052 1.00 64.43 N ATOM 200 CE2 TRP A 16 20.972 -6.835 10.174 1.00 4.34 C ATOM 201 CE3 TRP A 16 19.968 -8.976 9.688 1.00 33.04 C ATOM 202 CZ2 TRP A 16 21.912 -6.995 9.160 1.00 43.10 C ATOM 203 CZ3 TRP A 16 20.902 -9.134 8.682 1.00 11.33 C ATOM 204 CH2 TRP A 16 21.864 -8.148 8.425 1.00 3.42 C ATOM 0 H TRP A 16 16.392 -9.405 13.368 1.00 23.13 H new ATOM 0 HA TRP A 16 19.020 -9.891 12.534 1.00 4.43 H new ATOM 0 HB2 TRP A 16 17.380 -8.388 11.420 1.00 60.45 H new ATOM 0 HB3 TRP A 16 17.476 -7.276 12.771 1.00 60.45 H new ATOM 0 HD1 TRP A 16 19.357 -5.459 12.664 1.00 51.43 H new ATOM 0 HE1 TRP A 16 21.346 -4.947 11.090 1.00 64.43 H new ATOM 0 HE3 TRP A 16 19.231 -9.742 9.879 1.00 33.04 H new ATOM 0 HZ2 TRP A 16 22.653 -6.235 8.960 1.00 43.10 H new ATOM 0 HZ3 TRP A 16 20.890 -10.033 8.083 1.00 11.33 H new ATOM 0 HH2 TRP A 16 22.581 -8.301 7.632 1.00 3.42 H new ATOM 215 N GLU A 17 18.753 -7.961 15.203 1.00 33.53 N ATOM 216 CA GLU A 17 19.499 -7.411 16.328 1.00 25.55 C ATOM 217 C GLU A 17 19.969 -8.520 17.264 1.00 41.50 C ATOM 218 O GLU A 17 20.768 -8.286 18.172 1.00 74.51 O ATOM 219 CB GLU A 17 18.638 -6.409 17.099 1.00 64.41 C ATOM 220 CG GLU A 17 18.153 -5.244 16.253 1.00 0.12 C ATOM 221 CD GLU A 17 17.309 -4.261 17.041 1.00 21.15 C ATOM 222 OE1 GLU A 17 16.501 -4.713 17.879 1.00 14.25 O ATOM 223 OE2 GLU A 17 17.456 -3.041 16.820 1.00 71.15 O ATOM 0 H GLU A 17 17.749 -7.783 15.235 1.00 33.53 H new ATOM 0 HA GLU A 17 20.375 -6.897 15.933 1.00 25.55 H new ATOM 0 HB2 GLU A 17 17.775 -6.929 17.515 1.00 64.41 H new ATOM 0 HB3 GLU A 17 19.212 -6.021 17.940 1.00 64.41 H new ATOM 0 HG2 GLU A 17 19.013 -4.723 15.832 1.00 0.12 H new ATOM 0 HG3 GLU A 17 17.571 -5.626 15.415 1.00 0.12 H new ATOM 230 N LYS A 18 19.469 -9.730 17.036 1.00 65.20 N ATOM 231 CA LYS A 18 19.837 -10.878 17.857 1.00 23.23 C ATOM 232 C LYS A 18 20.997 -11.645 17.230 1.00 12.04 C ATOM 233 O LYS A 18 21.936 -12.040 17.920 1.00 63.05 O ATOM 234 CB LYS A 18 18.635 -11.807 18.039 1.00 2.44 C ATOM 235 CG LYS A 18 18.114 -11.855 19.465 1.00 74.44 C ATOM 236 CD LYS A 18 17.762 -13.274 19.882 1.00 53.22 C ATOM 237 CE LYS A 18 17.660 -13.401 21.393 1.00 60.24 C ATOM 238 NZ LYS A 18 17.733 -14.821 21.838 1.00 15.33 N ATOM 0 H LYS A 18 18.807 -9.941 16.289 1.00 65.20 H new ATOM 0 HA LYS A 18 20.154 -10.509 18.833 1.00 23.23 H new ATOM 0 HB2 LYS A 18 17.832 -11.482 17.378 1.00 2.44 H new ATOM 0 HB3 LYS A 18 18.914 -12.814 17.729 1.00 2.44 H new ATOM 0 HG2 LYS A 18 18.867 -11.452 20.142 1.00 74.44 H new ATOM 0 HG3 LYS A 18 17.233 -11.220 19.553 1.00 74.44 H new ATOM 0 HD2 LYS A 18 16.815 -13.564 19.427 1.00 53.22 H new ATOM 0 HD3 LYS A 18 18.520 -13.963 19.508 1.00 53.22 H new ATOM 0 HE2 LYS A 18 18.464 -12.833 21.860 1.00 60.24 H new ATOM 0 HE3 LYS A 18 16.721 -12.962 21.732 1.00 60.24 H new ATOM 0 HZ1 LYS A 18 17.660 -14.864 22.875 1.00 15.33 H new ATOM 0 HZ2 LYS A 18 16.951 -15.359 21.413 1.00 15.33 H new ATOM 0 HZ3 LYS A 18 18.640 -15.233 21.538 1.00 15.33 H new ATOM 252 N ILE A 19 20.923 -11.852 15.920 1.00 42.10 N ATOM 253 CA ILE A 19 21.968 -12.571 15.201 1.00 23.14 C ATOM 254 C ILE A 19 23.344 -11.986 15.502 1.00 31.34 C ATOM 255 O ILE A 19 23.556 -10.778 15.385 1.00 60.53 O ATOM 256 CB ILE A 19 21.730 -12.536 13.680 1.00 54.12 C ATOM 257 CG1 ILE A 19 20.374 -13.160 13.339 1.00 42.44 C ATOM 258 CG2 ILE A 19 22.851 -13.262 12.951 1.00 63.24 C ATOM 259 CD1 ILE A 19 19.610 -12.402 12.277 1.00 50.23 C ATOM 0 H ILE A 19 20.151 -11.532 15.335 1.00 42.10 H new ATOM 0 HA ILE A 19 21.932 -13.605 15.543 1.00 23.14 H new ATOM 0 HB ILE A 19 21.723 -11.496 13.352 1.00 54.12 H new ATOM 0 HG12 ILE A 19 20.529 -14.185 13.002 1.00 42.44 H new ATOM 0 HG13 ILE A 19 19.769 -13.211 14.244 1.00 42.44 H new ATOM 0 HG21 ILE A 19 22.668 -13.228 11.877 1.00 63.24 H new ATOM 0 HG22 ILE A 19 23.802 -12.778 13.172 1.00 63.24 H new ATOM 0 HG23 ILE A 19 22.887 -14.300 13.281 1.00 63.24 H new ATOM 0 HD11 ILE A 19 18.660 -12.901 12.086 1.00 50.23 H new ATOM 0 HD12 ILE A 19 19.423 -11.384 12.620 1.00 50.23 H new ATOM 0 HD13 ILE A 19 20.196 -12.374 11.358 1.00 50.23 H new ATOM 271 N ARG A 20 24.276 -12.850 15.888 1.00 42.22 N ATOM 272 CA ARG A 20 25.633 -12.420 16.205 1.00 51.22 C ATOM 273 C ARG A 20 26.568 -12.653 15.021 1.00 23.41 C ATOM 274 O ARG A 20 26.432 -13.638 14.294 1.00 44.11 O ATOM 275 CB ARG A 20 26.153 -13.167 17.435 1.00 5.43 C ATOM 276 CG ARG A 20 25.383 -12.854 18.708 1.00 13.22 C ATOM 277 CD ARG A 20 24.896 -14.123 19.389 1.00 22.24 C ATOM 278 NE ARG A 20 23.501 -14.415 19.068 1.00 64.31 N ATOM 279 CZ ARG A 20 22.732 -15.218 19.796 1.00 5.24 C ATOM 280 NH1 ARG A 20 23.220 -15.804 20.881 1.00 3.22 N ATOM 281 NH2 ARG A 20 21.472 -15.434 19.440 1.00 50.44 N ATOM 0 H ARG A 20 24.117 -13.852 15.989 1.00 42.22 H new ATOM 0 HA ARG A 20 25.608 -11.352 16.421 1.00 51.22 H new ATOM 0 HB2 ARG A 20 26.105 -14.239 17.246 1.00 5.43 H new ATOM 0 HB3 ARG A 20 27.203 -12.917 17.585 1.00 5.43 H new ATOM 0 HG2 ARG A 20 26.021 -12.294 19.392 1.00 13.22 H new ATOM 0 HG3 ARG A 20 24.531 -12.216 18.472 1.00 13.22 H new ATOM 0 HD2 ARG A 20 25.522 -14.962 19.083 1.00 22.24 H new ATOM 0 HD3 ARG A 20 25.006 -14.020 20.469 1.00 22.24 H new ATOM 0 HE ARG A 20 23.095 -13.979 18.240 1.00 64.31 H new ATOM 0 HH11 ARG A 20 24.188 -15.639 21.158 1.00 3.22 H new ATOM 0 HH12 ARG A 20 22.628 -16.420 21.438 1.00 3.22 H new ATOM 0 HH21 ARG A 20 21.093 -14.984 18.607 1.00 50.44 H new ATOM 0 HH22 ARG A 20 20.883 -16.050 19.999 1.00 50.44 H new ATOM 295 N LEU A 21 27.515 -11.741 14.835 1.00 51.45 N ATOM 296 CA LEU A 21 28.474 -11.847 13.740 1.00 1.13 C ATOM 297 C LEU A 21 29.238 -13.166 13.810 1.00 23.14 C ATOM 298 O LEU A 21 29.619 -13.729 12.784 1.00 34.14 O ATOM 299 CB LEU A 21 29.455 -10.674 13.779 1.00 31.51 C ATOM 300 CG LEU A 21 28.830 -9.281 13.869 1.00 11.41 C ATOM 301 CD1 LEU A 21 29.782 -8.313 14.557 1.00 30.33 C ATOM 302 CD2 LEU A 21 28.460 -8.772 12.483 1.00 51.53 C ATOM 0 H LEU A 21 27.640 -10.920 15.427 1.00 51.45 H new ATOM 0 HA LEU A 21 27.920 -11.819 12.802 1.00 1.13 H new ATOM 0 HB2 LEU A 21 30.118 -10.809 14.633 1.00 31.51 H new ATOM 0 HB3 LEU A 21 30.076 -10.715 12.884 1.00 31.51 H new ATOM 0 HG LEU A 21 27.920 -9.350 14.464 1.00 11.41 H new ATOM 0 HD11 LEU A 21 29.321 -7.327 14.612 1.00 30.33 H new ATOM 0 HD12 LEU A 21 29.998 -8.669 15.564 1.00 30.33 H new ATOM 0 HD13 LEU A 21 30.709 -8.249 13.988 1.00 30.33 H new ATOM 0 HD21 LEU A 21 28.017 -7.780 12.566 1.00 51.53 H new ATOM 0 HD22 LEU A 21 29.356 -8.719 11.864 1.00 51.53 H new ATOM 0 HD23 LEU A 21 27.742 -9.453 12.025 1.00 51.53 H new ATOM 314 N ARG A 22 29.457 -13.653 15.027 1.00 21.44 N ATOM 315 CA ARG A 22 30.174 -14.905 15.231 1.00 51.41 C ATOM 316 C ARG A 22 29.400 -15.829 16.166 1.00 60.55 C ATOM 317 O ARG A 22 28.537 -15.397 16.932 1.00 54.12 O ATOM 318 CB ARG A 22 31.566 -14.633 15.803 1.00 53.13 C ATOM 319 CG ARG A 22 32.641 -14.476 14.740 1.00 72.35 C ATOM 320 CD ARG A 22 33.919 -15.203 15.128 1.00 72.02 C ATOM 321 NE ARG A 22 34.969 -15.038 14.127 1.00 41.04 N ATOM 322 CZ ARG A 22 34.936 -15.607 12.927 1.00 45.31 C ATOM 323 NH1 ARG A 22 33.913 -16.374 12.581 1.00 13.24 N ATOM 324 NH2 ARG A 22 35.930 -15.409 12.070 1.00 41.21 N ATOM 0 H ARG A 22 29.148 -13.199 15.887 1.00 21.44 H new ATOM 0 HA ARG A 22 30.276 -15.398 14.264 1.00 51.41 H new ATOM 0 HB2 ARG A 22 31.530 -13.727 16.408 1.00 53.13 H new ATOM 0 HB3 ARG A 22 31.842 -15.451 16.469 1.00 53.13 H new ATOM 0 HG2 ARG A 22 32.274 -14.865 13.790 1.00 72.35 H new ATOM 0 HG3 ARG A 22 32.854 -13.418 14.590 1.00 72.35 H new ATOM 0 HD2 ARG A 22 34.272 -14.828 16.089 1.00 72.02 H new ATOM 0 HD3 ARG A 22 33.707 -16.264 15.259 1.00 72.02 H new ATOM 0 HE ARG A 22 35.772 -14.454 14.362 1.00 41.04 H new ATOM 0 HH11 ARG A 22 33.147 -16.529 13.237 1.00 13.24 H new ATOM 0 HH12 ARG A 22 33.891 -16.809 11.659 1.00 13.24 H new ATOM 0 HH21 ARG A 22 36.720 -14.820 12.333 1.00 41.21 H new ATOM 0 HH22 ARG A 22 35.904 -15.846 11.149 1.00 41.21 H new ATOM 338 N PRO A 23 29.712 -17.132 16.105 1.00 42.23 N ATOM 339 CA PRO A 23 29.058 -18.143 16.939 1.00 71.33 C ATOM 340 C PRO A 23 29.443 -18.020 18.409 1.00 41.03 C ATOM 341 O PRO A 23 28.634 -18.282 19.297 1.00 71.23 O ATOM 342 CB PRO A 23 29.570 -19.466 16.362 1.00 3.41 C ATOM 343 CG PRO A 23 30.876 -19.123 15.731 1.00 32.15 C ATOM 344 CD PRO A 23 30.730 -17.717 15.216 1.00 1.21 C ATOM 0 HA PRO A 23 27.973 -18.045 16.920 1.00 71.33 H new ATOM 0 HB2 PRO A 23 29.692 -20.217 17.142 1.00 3.41 H new ATOM 0 HB3 PRO A 23 28.873 -19.876 15.631 1.00 3.41 H new ATOM 0 HG2 PRO A 23 31.689 -19.191 16.454 1.00 32.15 H new ATOM 0 HG3 PRO A 23 31.111 -19.813 14.921 1.00 32.15 H new ATOM 0 HD2 PRO A 23 31.671 -17.170 15.268 1.00 1.21 H new ATOM 0 HD3 PRO A 23 30.410 -17.702 14.174 1.00 1.21 H new ATOM 352 N GLY A 24 30.687 -17.619 18.659 1.00 31.35 N ATOM 353 CA GLY A 24 31.157 -17.467 20.024 1.00 43.40 C ATOM 354 C GLY A 24 31.375 -16.016 20.404 1.00 31.40 C ATOM 355 O GLY A 24 32.102 -15.718 21.351 1.00 21.04 O ATOM 0 H GLY A 24 31.377 -17.397 17.941 1.00 31.35 H new ATOM 0 HA2 GLY A 24 30.433 -17.913 20.706 1.00 43.40 H new ATOM 0 HA3 GLY A 24 32.091 -18.016 20.147 1.00 43.40 H new ATOM 359 N GLY A 25 30.743 -15.110 19.663 1.00 40.23 N ATOM 360 CA GLY A 25 30.886 -13.693 19.943 1.00 12.53 C ATOM 361 C GLY A 25 29.699 -13.129 20.696 1.00 22.35 C ATOM 362 O GLY A 25 28.742 -13.846 20.991 1.00 21.05 O ATOM 0 H GLY A 25 30.135 -15.332 18.875 1.00 40.23 H new ATOM 0 HA2 GLY A 25 31.793 -13.531 20.526 1.00 12.53 H new ATOM 0 HA3 GLY A 25 31.008 -13.151 19.005 1.00 12.53 H new ATOM 366 N LYS A 26 29.759 -11.838 21.010 1.00 74.50 N ATOM 367 CA LYS A 26 28.680 -11.177 21.735 1.00 30.20 C ATOM 368 C LYS A 26 28.026 -10.101 20.873 1.00 71.21 C ATOM 369 O LYS A 26 26.856 -9.768 21.060 1.00 4.03 O ATOM 370 CB LYS A 26 29.213 -10.555 23.027 1.00 70.35 C ATOM 371 CG LYS A 26 28.148 -9.843 23.844 1.00 63.11 C ATOM 372 CD LYS A 26 28.579 -9.667 25.290 1.00 74.41 C ATOM 373 CE LYS A 26 27.403 -9.292 26.180 1.00 4.40 C ATOM 374 NZ LYS A 26 26.971 -7.883 25.962 1.00 73.15 N ATOM 0 H LYS A 26 30.543 -11.230 20.774 1.00 74.50 H new ATOM 0 HA LYS A 26 27.929 -11.927 21.983 1.00 30.20 H new ATOM 0 HB2 LYS A 26 29.665 -11.337 23.637 1.00 70.35 H new ATOM 0 HB3 LYS A 26 30.004 -9.847 22.780 1.00 70.35 H new ATOM 0 HG2 LYS A 26 27.942 -8.867 23.404 1.00 63.11 H new ATOM 0 HG3 LYS A 26 27.219 -10.412 23.807 1.00 63.11 H new ATOM 0 HD2 LYS A 26 29.030 -10.591 25.651 1.00 74.41 H new ATOM 0 HD3 LYS A 26 29.344 -8.893 25.351 1.00 74.41 H new ATOM 0 HE2 LYS A 26 26.568 -9.963 25.980 1.00 4.40 H new ATOM 0 HE3 LYS A 26 27.680 -9.430 27.225 1.00 4.40 H new ATOM 0 HZ1 LYS A 26 26.168 -7.666 26.586 1.00 73.15 H new ATOM 0 HZ2 LYS A 26 27.760 -7.241 26.177 1.00 73.15 H new ATOM 0 HZ3 LYS A 26 26.683 -7.758 24.971 1.00 73.15 H new ATOM 388 N LYS A 27 28.789 -9.563 19.927 1.00 35.33 N ATOM 389 CA LYS A 27 28.282 -8.528 19.034 1.00 50.31 C ATOM 390 C LYS A 27 27.076 -9.029 18.246 1.00 51.24 C ATOM 391 O LYS A 27 26.957 -10.223 17.971 1.00 10.52 O ATOM 392 CB LYS A 27 29.382 -8.075 18.070 1.00 11.23 C ATOM 393 CG LYS A 27 29.668 -6.585 18.130 1.00 23.12 C ATOM 394 CD LYS A 27 30.385 -6.103 16.880 1.00 54.11 C ATOM 395 CE LYS A 27 31.361 -4.980 17.194 1.00 52.10 C ATOM 396 NZ LYS A 27 31.278 -3.878 16.196 1.00 53.31 N ATOM 0 H LYS A 27 29.760 -9.827 19.759 1.00 35.33 H new ATOM 0 HA LYS A 27 27.968 -7.681 19.643 1.00 50.31 H new ATOM 0 HB2 LYS A 27 30.298 -8.621 18.295 1.00 11.23 H new ATOM 0 HB3 LYS A 27 29.094 -8.340 17.053 1.00 11.23 H new ATOM 0 HG2 LYS A 27 28.732 -6.039 18.247 1.00 23.12 H new ATOM 0 HG3 LYS A 27 30.277 -6.366 19.007 1.00 23.12 H new ATOM 0 HD2 LYS A 27 30.921 -6.935 16.423 1.00 54.11 H new ATOM 0 HD3 LYS A 27 29.653 -5.757 16.150 1.00 54.11 H new ATOM 0 HE2 LYS A 27 31.153 -4.586 18.189 1.00 52.10 H new ATOM 0 HE3 LYS A 27 32.376 -5.376 17.214 1.00 52.10 H new ATOM 0 HZ1 LYS A 27 31.959 -3.132 16.445 1.00 53.31 H new ATOM 0 HZ2 LYS A 27 31.501 -4.249 15.250 1.00 53.31 H new ATOM 0 HZ3 LYS A 27 30.316 -3.483 16.195 1.00 53.31 H new ATOM 410 N GLN A 28 26.187 -8.110 17.885 1.00 72.45 N ATOM 411 CA GLN A 28 24.990 -8.461 17.129 1.00 51.32 C ATOM 412 C GLN A 28 24.959 -7.730 15.791 1.00 44.42 C ATOM 413 O GLN A 28 25.892 -7.003 15.447 1.00 24.50 O ATOM 414 CB GLN A 28 23.735 -8.127 17.935 1.00 64.22 C ATOM 415 CG GLN A 28 23.782 -6.759 18.597 1.00 52.12 C ATOM 416 CD GLN A 28 23.792 -5.625 17.592 1.00 13.40 C ATOM 417 OE1 GLN A 28 22.917 -5.537 16.729 1.00 23.34 O ATOM 418 NE2 GLN A 28 24.784 -4.749 17.696 1.00 41.50 N ATOM 0 H GLN A 28 26.272 -7.117 18.103 1.00 72.45 H new ATOM 0 HA GLN A 28 25.014 -9.534 16.937 1.00 51.32 H new ATOM 0 HB2 GLN A 28 22.868 -8.173 17.276 1.00 64.22 H new ATOM 0 HB3 GLN A 28 23.593 -8.888 18.702 1.00 64.22 H new ATOM 0 HG2 GLN A 28 22.920 -6.648 19.255 1.00 52.12 H new ATOM 0 HG3 GLN A 28 24.672 -6.693 19.223 1.00 52.12 H new ATOM 0 HE21 GLN A 28 25.488 -4.860 18.426 1.00 41.50 H new ATOM 0 HE22 GLN A 28 24.842 -3.965 17.046 1.00 41.50 H new ATOM 427 N TYR A 29 23.881 -7.926 15.040 1.00 73.23 N ATOM 428 CA TYR A 29 23.730 -7.288 13.738 1.00 32.03 C ATOM 429 C TYR A 29 22.773 -6.102 13.821 1.00 41.20 C ATOM 430 O TYR A 29 21.583 -6.266 14.094 1.00 54.14 O ATOM 431 CB TYR A 29 23.220 -8.298 12.708 1.00 5.14 C ATOM 432 CG TYR A 29 24.324 -9.005 11.956 1.00 44.34 C ATOM 433 CD1 TYR A 29 24.931 -8.413 10.854 1.00 62.31 C ATOM 434 CD2 TYR A 29 24.762 -10.265 12.345 1.00 23.32 C ATOM 435 CE1 TYR A 29 25.941 -9.056 10.163 1.00 21.20 C ATOM 436 CE2 TYR A 29 25.771 -10.914 11.662 1.00 4.34 C ATOM 437 CZ TYR A 29 26.357 -10.305 10.571 1.00 43.03 C ATOM 438 OH TYR A 29 27.362 -10.949 9.887 1.00 41.55 O ATOM 0 H TYR A 29 23.099 -8.522 15.311 1.00 73.23 H new ATOM 0 HA TYR A 29 24.708 -6.922 13.425 1.00 32.03 H new ATOM 0 HB2 TYR A 29 22.603 -9.041 13.214 1.00 5.14 H new ATOM 0 HB3 TYR A 29 22.577 -7.783 11.994 1.00 5.14 H new ATOM 0 HD1 TYR A 29 24.608 -7.434 10.532 1.00 62.31 H new ATOM 0 HD2 TYR A 29 24.305 -10.745 13.197 1.00 23.32 H new ATOM 0 HE1 TYR A 29 26.401 -8.582 9.308 1.00 21.20 H new ATOM 0 HE2 TYR A 29 26.100 -11.892 11.980 1.00 4.34 H new ATOM 0 HH TYR A 29 27.365 -11.899 10.128 1.00 41.55 H new ATOM 448 N LYS A 30 23.302 -4.906 13.583 1.00 73.32 N ATOM 449 CA LYS A 30 22.497 -3.691 13.629 1.00 15.01 C ATOM 450 C LYS A 30 22.380 -3.065 12.243 1.00 51.32 C ATOM 451 O LYS A 30 22.790 -3.659 11.244 1.00 41.03 O ATOM 452 CB LYS A 30 23.111 -2.685 14.604 1.00 72.54 C ATOM 453 CG LYS A 30 22.166 -2.264 15.718 1.00 2.51 C ATOM 454 CD LYS A 30 22.640 -0.991 16.398 1.00 31.01 C ATOM 455 CE LYS A 30 22.886 -1.211 17.883 1.00 1.14 C ATOM 456 NZ LYS A 30 23.233 0.057 18.581 1.00 3.11 N ATOM 0 H LYS A 30 24.285 -4.752 13.356 1.00 73.32 H new ATOM 0 HA LYS A 30 21.498 -3.959 13.974 1.00 15.01 H new ATOM 0 HB2 LYS A 30 24.008 -3.120 15.045 1.00 72.54 H new ATOM 0 HB3 LYS A 30 23.424 -1.800 14.051 1.00 72.54 H new ATOM 0 HG2 LYS A 30 21.167 -2.110 15.310 1.00 2.51 H new ATOM 0 HG3 LYS A 30 22.090 -3.064 16.454 1.00 2.51 H new ATOM 0 HD2 LYS A 30 23.558 -0.644 15.924 1.00 31.01 H new ATOM 0 HD3 LYS A 30 21.895 -0.206 16.264 1.00 31.01 H new ATOM 0 HE2 LYS A 30 21.996 -1.644 18.338 1.00 1.14 H new ATOM 0 HE3 LYS A 30 23.694 -1.931 18.015 1.00 1.14 H new ATOM 0 HZ1 LYS A 30 23.393 -0.135 19.591 1.00 3.11 H new ATOM 0 HZ2 LYS A 30 24.097 0.458 18.164 1.00 3.11 H new ATOM 0 HZ3 LYS A 30 22.452 0.735 18.477 1.00 3.11 H new ATOM 470 N LEU A 31 21.820 -1.862 12.188 1.00 13.23 N ATOM 471 CA LEU A 31 21.650 -1.153 10.924 1.00 50.51 C ATOM 472 C LEU A 31 23.002 -0.782 10.323 1.00 10.33 C ATOM 473 O LEU A 31 23.163 -0.750 9.102 1.00 62.32 O ATOM 474 CB LEU A 31 20.807 0.106 11.131 1.00 44.31 C ATOM 475 CG LEU A 31 19.335 0.002 10.734 1.00 3.35 C ATOM 476 CD1 LEU A 31 19.196 -0.096 9.222 1.00 25.33 C ATOM 477 CD2 LEU A 31 18.684 -1.195 11.410 1.00 14.21 C ATOM 0 H LEU A 31 21.476 -1.356 13.004 1.00 13.23 H new ATOM 0 HA LEU A 31 21.134 -1.816 10.230 1.00 50.51 H new ATOM 0 HB2 LEU A 31 20.860 0.385 12.183 1.00 44.31 H new ATOM 0 HB3 LEU A 31 21.259 0.919 10.563 1.00 44.31 H new ATOM 0 HG LEU A 31 18.823 0.905 11.068 1.00 3.35 H new ATOM 0 HD11 LEU A 31 18.141 -0.169 8.958 1.00 25.33 H new ATOM 0 HD12 LEU A 31 19.625 0.792 8.759 1.00 25.33 H new ATOM 0 HD13 LEU A 31 19.722 -0.981 8.865 1.00 25.33 H new ATOM 0 HD21 LEU A 31 17.636 -1.253 11.116 1.00 14.21 H new ATOM 0 HD22 LEU A 31 19.197 -2.108 11.107 1.00 14.21 H new ATOM 0 HD23 LEU A 31 18.751 -1.083 12.492 1.00 14.21 H new ATOM 489 N LYS A 32 23.971 -0.502 11.187 1.00 42.24 N ATOM 490 CA LYS A 32 25.311 -0.136 10.743 1.00 12.42 C ATOM 491 C LYS A 32 25.856 -1.162 9.755 1.00 13.34 C ATOM 492 O LYS A 32 26.499 -0.806 8.766 1.00 43.25 O ATOM 493 CB LYS A 32 26.254 -0.017 11.943 1.00 54.21 C ATOM 494 CG LYS A 32 27.177 1.187 11.874 1.00 2.24 C ATOM 495 CD LYS A 32 28.128 1.228 13.059 1.00 2.54 C ATOM 496 CE LYS A 32 28.144 2.602 13.712 1.00 5.31 C ATOM 497 NZ LYS A 32 26.844 2.922 14.363 1.00 41.34 N ATOM 0 H LYS A 32 23.854 -0.521 12.200 1.00 42.24 H new ATOM 0 HA LYS A 32 25.249 0.829 10.240 1.00 12.42 H new ATOM 0 HB2 LYS A 32 25.661 0.042 12.856 1.00 54.21 H new ATOM 0 HB3 LYS A 32 26.857 -0.923 12.012 1.00 54.21 H new ATOM 0 HG2 LYS A 32 27.750 1.155 10.947 1.00 2.24 H new ATOM 0 HG3 LYS A 32 26.584 2.101 11.851 1.00 2.24 H new ATOM 0 HD2 LYS A 32 27.830 0.479 13.792 1.00 2.54 H new ATOM 0 HD3 LYS A 32 29.134 0.969 12.729 1.00 2.54 H new ATOM 0 HE2 LYS A 32 28.941 2.642 14.454 1.00 5.31 H new ATOM 0 HE3 LYS A 32 28.370 3.359 12.961 1.00 5.31 H new ATOM 0 HZ1 LYS A 32 26.981 3.688 15.053 1.00 41.34 H new ATOM 0 HZ2 LYS A 32 26.159 3.224 13.641 1.00 41.34 H new ATOM 0 HZ3 LYS A 32 26.483 2.077 14.851 1.00 41.34 H new ATOM 511 N HIS A 33 25.594 -2.437 10.027 1.00 12.35 N ATOM 512 CA HIS A 33 26.057 -3.515 9.159 1.00 20.43 C ATOM 513 C HIS A 33 25.256 -3.548 7.860 1.00 0.12 C ATOM 514 O HIS A 33 25.866 -3.820 6.827 1.00 54.24 O ATOM 515 CB HIS A 33 25.941 -4.861 9.876 1.00 32.54 C ATOM 516 CG HIS A 33 26.656 -4.901 11.192 1.00 14.31 C ATOM 517 ND1 HIS A 33 26.002 -4.996 12.402 1.00 52.20 N ATOM 518 CD2 HIS A 33 27.978 -4.859 11.483 1.00 34.42 C ATOM 519 CE1 HIS A 33 26.890 -5.010 13.380 1.00 50.13 C ATOM 520 NE2 HIS A 33 28.096 -4.929 12.848 1.00 41.12 N ATOM 0 H HIS A 33 25.064 -2.749 10.841 1.00 12.35 H new ATOM 0 HA HIS A 33 27.103 -3.329 8.917 1.00 20.43 H new ATOM 0 HB2 HIS A 33 24.887 -5.088 10.037 1.00 32.54 H new ATOM 0 HB3 HIS A 33 26.341 -5.643 9.230 1.00 32.54 H new ATOM 0 HD2 HIS A 33 28.788 -4.784 10.773 1.00 34.42 H new ATOM 0 HE1 HIS A 33 26.668 -5.076 14.435 1.00 50.13 H new ATOM 0 HE2 HIS A 33 28.973 -4.920 13.368 1.00 41.12 H new ATOM 528 N ILE A 34 23.953 -3.286 7.884 1.00 63.42 N ATOM 529 CA ILE A 34 23.148 -3.305 6.668 1.00 70.42 C ATOM 530 C ILE A 34 23.625 -2.248 5.678 1.00 33.31 C ATOM 531 O ILE A 34 23.627 -2.473 4.467 1.00 51.34 O ATOM 532 CB ILE A 34 21.658 -3.068 6.977 1.00 12.15 C ATOM 533 CG1 ILE A 34 21.159 -4.086 8.005 1.00 63.24 C ATOM 534 CG2 ILE A 34 20.834 -3.150 5.701 1.00 2.43 C ATOM 535 CD1 ILE A 34 19.777 -3.779 8.537 1.00 32.41 C ATOM 0 H ILE A 34 23.433 -3.058 8.731 1.00 63.42 H new ATOM 0 HA ILE A 34 23.266 -4.294 6.225 1.00 70.42 H new ATOM 0 HB ILE A 34 21.544 -2.069 7.398 1.00 12.15 H new ATOM 0 HG12 ILE A 34 21.153 -5.076 7.550 1.00 63.24 H new ATOM 0 HG13 ILE A 34 21.861 -4.123 8.838 1.00 63.24 H new ATOM 0 HG21 ILE A 34 19.783 -2.980 5.935 1.00 2.43 H new ATOM 0 HG22 ILE A 34 21.176 -2.391 4.998 1.00 2.43 H new ATOM 0 HG23 ILE A 34 20.952 -4.137 5.255 1.00 2.43 H new ATOM 0 HD11 ILE A 34 19.488 -4.541 9.260 1.00 32.41 H new ATOM 0 HD12 ILE A 34 19.782 -2.803 9.021 1.00 32.41 H new ATOM 0 HD13 ILE A 34 19.063 -3.771 7.713 1.00 32.41 H new ATOM 547 N VAL A 35 24.030 -1.095 6.199 1.00 60.43 N ATOM 548 CA VAL A 35 24.513 -0.004 5.362 1.00 13.21 C ATOM 549 C VAL A 35 25.936 -0.266 4.883 1.00 42.13 C ATOM 550 O VAL A 35 26.288 0.051 3.748 1.00 43.51 O ATOM 551 CB VAL A 35 24.473 1.340 6.113 1.00 40.52 C ATOM 552 CG1 VAL A 35 25.008 2.459 5.231 1.00 64.03 C ATOM 553 CG2 VAL A 35 23.060 1.648 6.580 1.00 64.45 C ATOM 0 H VAL A 35 24.033 -0.892 7.199 1.00 60.43 H new ATOM 0 HA VAL A 35 23.848 0.051 4.500 1.00 13.21 H new ATOM 0 HB VAL A 35 25.112 1.264 6.993 1.00 40.52 H new ATOM 0 HG11 VAL A 35 24.972 3.402 5.777 1.00 64.03 H new ATOM 0 HG12 VAL A 35 26.039 2.240 4.951 1.00 64.03 H new ATOM 0 HG13 VAL A 35 24.397 2.538 4.332 1.00 64.03 H new ATOM 0 HG21 VAL A 35 23.051 2.601 7.109 1.00 64.45 H new ATOM 0 HG22 VAL A 35 22.396 1.705 5.717 1.00 64.45 H new ATOM 0 HG23 VAL A 35 22.718 0.859 7.249 1.00 64.45 H new ATOM 563 N TRP A 36 26.750 -0.848 5.758 1.00 5.33 N ATOM 564 CA TRP A 36 28.136 -1.153 5.424 1.00 70.35 C ATOM 565 C TRP A 36 28.217 -2.027 4.178 1.00 21.13 C ATOM 566 O TRP A 36 29.109 -1.858 3.347 1.00 32.13 O ATOM 567 CB TRP A 36 28.823 -1.853 6.599 1.00 34.21 C ATOM 568 CG TRP A 36 30.211 -2.321 6.283 1.00 32.24 C ATOM 569 CD1 TRP A 36 31.380 -1.681 6.584 1.00 32.24 C ATOM 570 CD2 TRP A 36 30.575 -3.526 5.603 1.00 74.23 C ATOM 571 NE1 TRP A 36 32.448 -2.417 6.133 1.00 0.41 N ATOM 572 CE2 TRP A 36 31.982 -3.554 5.529 1.00 15.14 C ATOM 573 CE3 TRP A 36 29.851 -4.587 5.054 1.00 14.10 C ATOM 574 CZ2 TRP A 36 32.675 -4.599 4.924 1.00 32.05 C ATOM 575 CZ3 TRP A 36 30.540 -5.625 4.453 1.00 23.32 C ATOM 576 CH2 TRP A 36 31.940 -5.624 4.393 1.00 55.13 C ATOM 0 H TRP A 36 26.474 -1.117 6.702 1.00 5.33 H new ATOM 0 HA TRP A 36 28.649 -0.213 5.219 1.00 70.35 H new ATOM 0 HB2 TRP A 36 28.862 -1.169 7.447 1.00 34.21 H new ATOM 0 HB3 TRP A 36 28.220 -2.708 6.906 1.00 34.21 H new ATOM 0 HD1 TRP A 36 31.453 -0.735 7.101 1.00 32.24 H new ATOM 0 HE1 TRP A 36 33.430 -2.158 6.232 1.00 0.41 H new ATOM 0 HE3 TRP A 36 28.772 -4.597 5.098 1.00 14.10 H new ATOM 0 HZ2 TRP A 36 33.754 -4.601 4.875 1.00 32.05 H new ATOM 0 HZ3 TRP A 36 29.990 -6.449 4.023 1.00 23.32 H new ATOM 0 HH2 TRP A 36 32.450 -6.449 3.918 1.00 55.13 H new ATOM 587 N ALA A 37 27.280 -2.962 4.054 1.00 24.12 N ATOM 588 CA ALA A 37 27.245 -3.860 2.907 1.00 23.34 C ATOM 589 C ALA A 37 26.597 -3.187 1.701 1.00 61.30 C ATOM 590 O ALA A 37 27.071 -3.322 0.574 1.00 23.11 O ATOM 591 CB ALA A 37 26.501 -5.139 3.262 1.00 0.13 C ATOM 0 H ALA A 37 26.536 -3.117 4.734 1.00 24.12 H new ATOM 0 HA ALA A 37 28.272 -4.110 2.642 1.00 23.34 H new ATOM 0 HB1 ALA A 37 26.482 -5.801 2.396 1.00 0.13 H new ATOM 0 HB2 ALA A 37 27.007 -5.637 4.089 1.00 0.13 H new ATOM 0 HB3 ALA A 37 25.480 -4.896 3.555 1.00 0.13 H new ATOM 597 N SER A 38 25.510 -2.463 1.947 1.00 5.13 N ATOM 598 CA SER A 38 24.794 -1.772 0.881 1.00 23.12 C ATOM 599 C SER A 38 25.747 -0.909 0.058 1.00 74.21 C ATOM 600 O SER A 38 25.619 -0.817 -1.164 1.00 21.31 O ATOM 601 CB SER A 38 23.679 -0.903 1.465 1.00 62.33 C ATOM 602 OG SER A 38 24.041 0.467 1.457 1.00 10.20 O ATOM 0 H SER A 38 25.106 -2.340 2.875 1.00 5.13 H new ATOM 0 HA SER A 38 24.353 -2.524 0.227 1.00 23.12 H new ATOM 0 HB2 SER A 38 22.765 -1.044 0.889 1.00 62.33 H new ATOM 0 HB3 SER A 38 23.464 -1.219 2.486 1.00 62.33 H new ATOM 0 HG SER A 38 24.754 0.621 2.111 1.00 10.20 H new ATOM 608 N ARG A 39 26.701 -0.280 0.735 1.00 51.45 N ATOM 609 CA ARG A 39 27.675 0.574 0.068 1.00 4.24 C ATOM 610 C ARG A 39 28.563 -0.240 -0.869 1.00 23.32 C ATOM 611 O ARG A 39 28.762 0.128 -2.025 1.00 53.13 O ATOM 612 CB ARG A 39 28.537 1.305 1.100 1.00 51.35 C ATOM 613 CG ARG A 39 28.122 2.748 1.329 1.00 25.34 C ATOM 614 CD ARG A 39 28.377 3.604 0.097 1.00 63.42 C ATOM 615 NE ARG A 39 27.152 3.855 -0.657 1.00 22.31 N ATOM 616 CZ ARG A 39 26.220 4.724 -0.278 1.00 43.04 C ATOM 617 NH1 ARG A 39 26.374 5.419 0.841 1.00 31.14 N ATOM 618 NH2 ARG A 39 25.134 4.897 -1.018 1.00 4.15 N ATOM 0 H ARG A 39 26.820 -0.346 1.746 1.00 51.45 H new ATOM 0 HA ARG A 39 27.130 1.308 -0.525 1.00 4.24 H new ATOM 0 HB2 ARG A 39 28.489 0.768 2.047 1.00 51.35 H new ATOM 0 HB3 ARG A 39 29.577 1.283 0.773 1.00 51.35 H new ATOM 0 HG2 ARG A 39 27.064 2.787 1.587 1.00 25.34 H new ATOM 0 HG3 ARG A 39 28.672 3.156 2.177 1.00 25.34 H new ATOM 0 HD2 ARG A 39 28.817 4.554 0.400 1.00 63.42 H new ATOM 0 HD3 ARG A 39 29.103 3.107 -0.546 1.00 63.42 H new ATOM 0 HE ARG A 39 27.003 3.335 -1.522 1.00 22.31 H new ATOM 0 HH11 ARG A 39 27.209 5.287 1.412 1.00 31.14 H new ATOM 0 HH12 ARG A 39 25.658 6.085 1.130 1.00 31.14 H new ATOM 0 HH21 ARG A 39 25.013 4.363 -1.879 1.00 4.15 H new ATOM 0 HH22 ARG A 39 24.419 5.564 -0.727 1.00 4.15 H new ATOM 632 N GLU A 40 29.093 -1.346 -0.358 1.00 42.33 N ATOM 633 CA GLU A 40 29.962 -2.211 -1.148 1.00 12.30 C ATOM 634 C GLU A 40 29.206 -2.801 -2.337 1.00 43.24 C ATOM 635 O GLU A 40 29.804 -3.142 -3.359 1.00 71.40 O ATOM 636 CB GLU A 40 30.525 -3.338 -0.280 1.00 64.24 C ATOM 637 CG GLU A 40 31.852 -3.885 -0.777 1.00 44.34 C ATOM 638 CD GLU A 40 33.035 -3.348 0.005 1.00 35.10 C ATOM 639 OE1 GLU A 40 33.209 -3.756 1.173 1.00 52.12 O ATOM 640 OE2 GLU A 40 33.787 -2.521 -0.551 1.00 0.12 O ATOM 0 H GLU A 40 28.936 -1.664 0.598 1.00 42.33 H new ATOM 0 HA GLU A 40 30.787 -1.606 -1.525 1.00 12.30 H new ATOM 0 HB2 GLU A 40 30.651 -2.972 0.739 1.00 64.24 H new ATOM 0 HB3 GLU A 40 29.799 -4.150 -0.239 1.00 64.24 H new ATOM 0 HG2 GLU A 40 31.840 -4.973 -0.709 1.00 44.34 H new ATOM 0 HG3 GLU A 40 31.973 -3.632 -1.830 1.00 44.34 H new ATOM 647 N LEU A 41 27.891 -2.917 -2.194 1.00 40.41 N ATOM 648 CA LEU A 41 27.052 -3.465 -3.255 1.00 52.11 C ATOM 649 C LEU A 41 27.025 -2.535 -4.463 1.00 22.33 C ATOM 650 O LEU A 41 27.403 -2.924 -5.567 1.00 55.11 O ATOM 651 CB LEU A 41 25.630 -3.696 -2.740 1.00 4.32 C ATOM 652 CG LEU A 41 25.343 -5.079 -2.156 1.00 43.14 C ATOM 653 CD1 LEU A 41 23.920 -5.149 -1.626 1.00 31.33 C ATOM 654 CD2 LEU A 41 25.580 -6.159 -3.200 1.00 0.11 C ATOM 0 H LEU A 41 27.382 -2.639 -1.355 1.00 40.41 H new ATOM 0 HA LEU A 41 27.478 -4.419 -3.565 1.00 52.11 H new ATOM 0 HB2 LEU A 41 25.417 -2.949 -1.975 1.00 4.32 H new ATOM 0 HB3 LEU A 41 24.935 -3.519 -3.561 1.00 4.32 H new ATOM 0 HG LEU A 41 26.027 -5.251 -1.325 1.00 43.14 H new ATOM 0 HD11 LEU A 41 23.734 -6.141 -1.214 1.00 31.33 H new ATOM 0 HD12 LEU A 41 23.785 -4.401 -0.845 1.00 31.33 H new ATOM 0 HD13 LEU A 41 23.219 -4.956 -2.438 1.00 31.33 H new ATOM 0 HD21 LEU A 41 25.371 -7.137 -2.766 1.00 0.11 H new ATOM 0 HD22 LEU A 41 24.922 -5.992 -4.052 1.00 0.11 H new ATOM 0 HD23 LEU A 41 26.618 -6.124 -3.531 1.00 0.11 H new ATOM 666 N GLU A 42 26.574 -1.303 -4.244 1.00 42.24 N ATOM 667 CA GLU A 42 26.499 -0.317 -5.316 1.00 43.11 C ATOM 668 C GLU A 42 27.845 -0.175 -6.021 1.00 24.00 C ATOM 669 O GLU A 42 27.905 0.160 -7.204 1.00 23.10 O ATOM 670 CB GLU A 42 26.057 1.039 -4.761 1.00 23.54 C ATOM 671 CG GLU A 42 24.716 1.509 -5.299 1.00 1.31 C ATOM 672 CD GLU A 42 23.985 2.421 -4.333 1.00 43.14 C ATOM 673 OE1 GLU A 42 24.630 2.920 -3.386 1.00 52.42 O ATOM 674 OE2 GLU A 42 22.771 2.637 -4.522 1.00 11.14 O ATOM 0 H GLU A 42 26.256 -0.965 -3.336 1.00 42.24 H new ATOM 0 HA GLU A 42 25.763 -0.663 -6.042 1.00 43.11 H new ATOM 0 HB2 GLU A 42 26.001 0.977 -3.674 1.00 23.54 H new ATOM 0 HB3 GLU A 42 26.816 1.784 -4.999 1.00 23.54 H new ATOM 0 HG2 GLU A 42 24.871 2.034 -6.241 1.00 1.31 H new ATOM 0 HG3 GLU A 42 24.092 0.642 -5.516 1.00 1.31 H new ATOM 681 N ARG A 43 28.922 -0.431 -5.285 1.00 31.44 N ATOM 682 CA ARG A 43 30.266 -0.330 -5.838 1.00 41.34 C ATOM 683 C ARG A 43 30.477 -1.358 -6.946 1.00 73.14 C ATOM 684 O ARG A 43 31.221 -1.118 -7.897 1.00 71.32 O ATOM 685 CB ARG A 43 31.310 -0.531 -4.737 1.00 13.53 C ATOM 686 CG ARG A 43 32.536 0.355 -4.892 1.00 23.25 C ATOM 687 CD ARG A 43 33.810 -0.385 -4.516 1.00 34.34 C ATOM 688 NE ARG A 43 34.547 -0.838 -5.693 1.00 23.35 N ATOM 689 CZ ARG A 43 35.742 -1.414 -5.634 1.00 1.01 C ATOM 690 NH1 ARG A 43 36.332 -1.607 -4.463 1.00 22.34 N ATOM 691 NH2 ARG A 43 36.349 -1.799 -6.750 1.00 45.14 N ATOM 0 H ARG A 43 28.889 -0.710 -4.304 1.00 31.44 H new ATOM 0 HA ARG A 43 30.383 0.667 -6.263 1.00 41.34 H new ATOM 0 HB2 ARG A 43 30.849 -0.333 -3.770 1.00 13.53 H new ATOM 0 HB3 ARG A 43 31.624 -1.575 -4.732 1.00 13.53 H new ATOM 0 HG2 ARG A 43 32.607 0.703 -5.923 1.00 23.25 H new ATOM 0 HG3 ARG A 43 32.429 1.239 -4.264 1.00 23.25 H new ATOM 0 HD2 ARG A 43 34.446 0.269 -3.919 1.00 34.34 H new ATOM 0 HD3 ARG A 43 33.560 -1.243 -3.892 1.00 34.34 H new ATOM 0 HE ARG A 43 34.121 -0.705 -6.610 1.00 23.35 H new ATOM 0 HH11 ARG A 43 35.868 -1.313 -3.604 1.00 22.34 H new ATOM 0 HH12 ARG A 43 37.250 -2.050 -4.421 1.00 22.34 H new ATOM 0 HH21 ARG A 43 35.897 -1.652 -7.653 1.00 45.14 H new ATOM 0 HH22 ARG A 43 37.267 -2.241 -6.705 1.00 45.14 H new ATOM 705 N PHE A 44 29.816 -2.504 -6.817 1.00 40.15 N ATOM 706 CA PHE A 44 29.932 -3.570 -7.805 1.00 44.41 C ATOM 707 C PHE A 44 28.788 -3.503 -8.813 1.00 21.24 C ATOM 708 O PHE A 44 28.386 -4.519 -9.379 1.00 63.31 O ATOM 709 CB PHE A 44 29.942 -4.935 -7.116 1.00 35.33 C ATOM 710 CG PHE A 44 31.120 -5.141 -6.208 1.00 4.32 C ATOM 711 CD1 PHE A 44 32.412 -4.954 -6.674 1.00 14.14 C ATOM 712 CD2 PHE A 44 30.937 -5.521 -4.888 1.00 10.24 C ATOM 713 CE1 PHE A 44 33.498 -5.141 -5.841 1.00 54.53 C ATOM 714 CE2 PHE A 44 32.020 -5.709 -4.050 1.00 13.41 C ATOM 715 CZ PHE A 44 33.302 -5.521 -4.528 1.00 65.11 C ATOM 0 H PHE A 44 29.194 -2.718 -6.037 1.00 40.15 H new ATOM 0 HA PHE A 44 30.872 -3.435 -8.340 1.00 44.41 H new ATOM 0 HB2 PHE A 44 29.025 -5.048 -6.538 1.00 35.33 H new ATOM 0 HB3 PHE A 44 29.939 -5.716 -7.876 1.00 35.33 H new ATOM 0 HD1 PHE A 44 32.571 -4.659 -7.701 1.00 14.14 H new ATOM 0 HD2 PHE A 44 29.937 -5.672 -4.510 1.00 10.24 H new ATOM 0 HE1 PHE A 44 34.499 -4.990 -6.216 1.00 54.53 H new ATOM 0 HE2 PHE A 44 31.864 -6.003 -3.022 1.00 13.41 H new ATOM 0 HZ PHE A 44 34.150 -5.671 -3.876 1.00 65.11 H new ATOM 725 N ALA A 45 28.267 -2.300 -9.029 1.00 41.50 N ATOM 726 CA ALA A 45 27.170 -2.099 -9.967 1.00 52.50 C ATOM 727 C ALA A 45 25.913 -2.830 -9.507 1.00 4.11 C ATOM 728 O ALA A 45 25.046 -3.165 -10.314 1.00 0.41 O ATOM 729 CB ALA A 45 27.574 -2.566 -11.358 1.00 1.32 C ATOM 0 H ALA A 45 28.587 -1.449 -8.567 1.00 41.50 H new ATOM 0 HA ALA A 45 26.946 -1.033 -10.003 1.00 52.50 H new ATOM 0 HB1 ALA A 45 26.746 -2.410 -12.049 1.00 1.32 H new ATOM 0 HB2 ALA A 45 28.440 -1.997 -11.696 1.00 1.32 H new ATOM 0 HB3 ALA A 45 27.826 -3.626 -11.327 1.00 1.32 H new ATOM 735 N VAL A 46 25.820 -3.074 -8.204 1.00 62.23 N ATOM 736 CA VAL A 46 24.669 -3.764 -7.635 1.00 55.30 C ATOM 737 C VAL A 46 23.929 -2.874 -6.643 1.00 14.13 C ATOM 738 O VAL A 46 24.465 -2.515 -5.596 1.00 10.54 O ATOM 739 CB VAL A 46 25.088 -5.066 -6.926 1.00 1.24 C ATOM 740 CG1 VAL A 46 23.879 -5.751 -6.308 1.00 44.23 C ATOM 741 CG2 VAL A 46 25.799 -5.996 -7.898 1.00 4.13 C ATOM 0 H VAL A 46 26.529 -2.804 -7.522 1.00 62.23 H new ATOM 0 HA VAL A 46 24.006 -4.008 -8.465 1.00 55.30 H new ATOM 0 HB VAL A 46 25.782 -4.815 -6.124 1.00 1.24 H new ATOM 0 HG11 VAL A 46 24.195 -6.669 -5.812 1.00 44.23 H new ATOM 0 HG12 VAL A 46 23.417 -5.085 -5.579 1.00 44.23 H new ATOM 0 HG13 VAL A 46 23.158 -5.991 -7.089 1.00 44.23 H new ATOM 0 HG21 VAL A 46 26.088 -6.911 -7.381 1.00 4.13 H new ATOM 0 HG22 VAL A 46 25.130 -6.241 -8.722 1.00 4.13 H new ATOM 0 HG23 VAL A 46 26.689 -5.503 -8.288 1.00 4.13 H new ATOM 751 N ASN A 47 22.692 -2.522 -6.981 1.00 13.14 N ATOM 752 CA ASN A 47 21.877 -1.673 -6.120 1.00 23.32 C ATOM 753 C ASN A 47 21.665 -2.325 -4.756 1.00 15.20 C ATOM 754 O ASN A 47 21.519 -3.542 -4.639 1.00 5.43 O ATOM 755 CB ASN A 47 20.525 -1.391 -6.778 1.00 1.22 C ATOM 756 CG ASN A 47 20.520 -0.087 -7.551 1.00 2.52 C ATOM 757 OD1 ASN A 47 19.634 0.749 -7.374 1.00 1.45 O ATOM 758 ND2 ASN A 47 21.512 0.093 -8.416 1.00 75.02 N ATOM 0 H ASN A 47 22.233 -2.812 -7.845 1.00 13.14 H new ATOM 0 HA ASN A 47 22.406 -0.731 -5.975 1.00 23.32 H new ATOM 0 HB2 ASN A 47 20.274 -2.210 -7.451 1.00 1.22 H new ATOM 0 HB3 ASN A 47 19.751 -1.359 -6.012 1.00 1.22 H new ATOM 0 HD21 ASN A 47 21.560 0.951 -8.965 1.00 75.02 H new ATOM 0 HD22 ASN A 47 22.226 -0.627 -8.531 1.00 75.02 H new ATOM 765 N PRO A 48 21.647 -1.497 -3.702 1.00 64.14 N ATOM 766 CA PRO A 48 21.453 -1.970 -2.327 1.00 14.15 C ATOM 767 C PRO A 48 20.033 -2.472 -2.083 1.00 4.51 C ATOM 768 O PRO A 48 19.772 -3.170 -1.105 1.00 64.52 O ATOM 769 CB PRO A 48 21.733 -0.727 -1.481 1.00 3.53 C ATOM 770 CG PRO A 48 21.442 0.421 -2.385 1.00 32.44 C ATOM 771 CD PRO A 48 21.814 -0.035 -3.768 1.00 53.04 C ATOM 0 HA PRO A 48 22.099 -2.816 -2.092 1.00 14.15 H new ATOM 0 HB2 PRO A 48 21.101 -0.702 -0.593 1.00 3.53 H new ATOM 0 HB3 PRO A 48 22.767 -0.707 -1.137 1.00 3.53 H new ATOM 0 HG2 PRO A 48 20.389 0.699 -2.336 1.00 32.44 H new ATOM 0 HG3 PRO A 48 22.018 1.300 -2.096 1.00 32.44 H new ATOM 0 HD2 PRO A 48 21.168 0.409 -4.525 1.00 53.04 H new ATOM 0 HD3 PRO A 48 22.838 0.241 -4.020 1.00 53.04 H new ATOM 779 N GLY A 49 19.120 -2.111 -2.979 1.00 0.34 N ATOM 780 CA GLY A 49 17.739 -2.534 -2.842 1.00 61.40 C ATOM 781 C GLY A 49 17.583 -4.040 -2.919 1.00 33.34 C ATOM 782 O GLY A 49 16.644 -4.605 -2.357 1.00 25.25 O ATOM 0 H GLY A 49 19.312 -1.533 -3.797 1.00 0.34 H new ATOM 0 HA2 GLY A 49 17.347 -2.180 -1.889 1.00 61.40 H new ATOM 0 HA3 GLY A 49 17.141 -2.069 -3.626 1.00 61.40 H new ATOM 786 N LEU A 50 18.504 -4.693 -3.619 1.00 63.33 N ATOM 787 CA LEU A 50 18.465 -6.143 -3.769 1.00 14.12 C ATOM 788 C LEU A 50 18.451 -6.832 -2.408 1.00 1.13 C ATOM 789 O LEU A 50 17.955 -7.951 -2.272 1.00 63.44 O ATOM 790 CB LEU A 50 19.666 -6.624 -4.585 1.00 52.12 C ATOM 791 CG LEU A 50 19.719 -6.157 -6.040 1.00 0.30 C ATOM 792 CD1 LEU A 50 20.892 -6.800 -6.764 1.00 34.03 C ATOM 793 CD2 LEU A 50 18.412 -6.473 -6.751 1.00 25.41 C ATOM 0 H LEU A 50 19.287 -4.241 -4.092 1.00 63.33 H new ATOM 0 HA LEU A 50 17.548 -6.404 -4.297 1.00 14.12 H new ATOM 0 HB2 LEU A 50 20.576 -6.293 -4.085 1.00 52.12 H new ATOM 0 HB3 LEU A 50 19.675 -7.714 -4.574 1.00 52.12 H new ATOM 0 HG LEU A 50 19.861 -5.076 -6.049 1.00 0.30 H new ATOM 0 HD11 LEU A 50 20.914 -6.456 -7.798 1.00 34.03 H new ATOM 0 HD12 LEU A 50 21.822 -6.521 -6.269 1.00 34.03 H new ATOM 0 HD13 LEU A 50 20.782 -7.884 -6.744 1.00 34.03 H new ATOM 0 HD21 LEU A 50 18.469 -6.133 -7.785 1.00 25.41 H new ATOM 0 HD22 LEU A 50 18.238 -7.549 -6.732 1.00 25.41 H new ATOM 0 HD23 LEU A 50 17.591 -5.964 -6.246 1.00 25.41 H new ATOM 805 N LEU A 51 18.998 -6.155 -1.404 1.00 74.44 N ATOM 806 CA LEU A 51 19.047 -6.702 -0.052 1.00 2.12 C ATOM 807 C LEU A 51 17.667 -6.672 0.597 1.00 61.53 C ATOM 808 O LEU A 51 17.361 -7.491 1.464 1.00 50.44 O ATOM 809 CB LEU A 51 20.042 -5.912 0.802 1.00 74.12 C ATOM 810 CG LEU A 51 21.492 -5.916 0.317 1.00 3.14 C ATOM 811 CD1 LEU A 51 22.335 -4.962 1.150 1.00 13.41 C ATOM 812 CD2 LEU A 51 22.069 -7.323 0.368 1.00 22.32 C ATOM 0 H LEU A 51 19.413 -5.228 -1.500 1.00 74.44 H new ATOM 0 HA LEU A 51 19.375 -7.739 -0.117 1.00 2.12 H new ATOM 0 HB2 LEU A 51 19.701 -4.878 0.858 1.00 74.12 H new ATOM 0 HB3 LEU A 51 20.018 -6.311 1.816 1.00 74.12 H new ATOM 0 HG LEU A 51 21.509 -5.576 -0.718 1.00 3.14 H new ATOM 0 HD11 LEU A 51 23.364 -4.978 0.791 1.00 13.41 H new ATOM 0 HD12 LEU A 51 21.935 -3.952 1.062 1.00 13.41 H new ATOM 0 HD13 LEU A 51 22.310 -5.272 2.195 1.00 13.41 H new ATOM 0 HD21 LEU A 51 23.102 -7.306 0.019 1.00 22.32 H new ATOM 0 HD22 LEU A 51 22.039 -7.692 1.393 1.00 22.32 H new ATOM 0 HD23 LEU A 51 21.481 -7.981 -0.272 1.00 22.32 H new ATOM 824 N GLU A 52 16.839 -5.724 0.172 1.00 75.50 N ATOM 825 CA GLU A 52 15.491 -5.590 0.712 1.00 72.30 C ATOM 826 C GLU A 52 14.568 -6.664 0.144 1.00 31.21 C ATOM 827 O GLU A 52 13.418 -6.797 0.564 1.00 34.43 O ATOM 828 CB GLU A 52 14.928 -4.201 0.400 1.00 73.24 C ATOM 829 CG GLU A 52 13.582 -3.930 1.050 1.00 71.31 C ATOM 830 CD GLU A 52 13.316 -2.450 1.244 1.00 24.21 C ATOM 831 OE1 GLU A 52 14.294 -1.684 1.374 1.00 33.20 O ATOM 832 OE2 GLU A 52 12.131 -2.057 1.268 1.00 73.12 O ATOM 0 H GLU A 52 17.077 -5.038 -0.544 1.00 75.50 H new ATOM 0 HA GLU A 52 15.546 -5.717 1.793 1.00 72.30 H new ATOM 0 HB2 GLU A 52 15.641 -3.446 0.732 1.00 73.24 H new ATOM 0 HB3 GLU A 52 14.829 -4.093 -0.680 1.00 73.24 H new ATOM 0 HG2 GLU A 52 12.792 -4.360 0.434 1.00 71.31 H new ATOM 0 HG3 GLU A 52 13.542 -4.432 2.016 1.00 71.31 H new ATOM 839 N THR A 53 15.079 -7.430 -0.814 1.00 13.31 N ATOM 840 CA THR A 53 14.303 -8.491 -1.441 1.00 34.15 C ATOM 841 C THR A 53 15.042 -9.822 -1.383 1.00 55.14 C ATOM 842 O THR A 53 16.214 -9.910 -1.749 1.00 1.21 O ATOM 843 CB THR A 53 13.982 -8.160 -2.911 1.00 41.14 C ATOM 844 OG1 THR A 53 15.162 -8.293 -3.712 1.00 71.54 O ATOM 845 CG2 THR A 53 13.432 -6.747 -3.040 1.00 45.33 C ATOM 0 H THR A 53 16.029 -7.335 -1.173 1.00 13.31 H new ATOM 0 HA THR A 53 13.371 -8.571 -0.882 1.00 34.15 H new ATOM 0 HB THR A 53 13.225 -8.861 -3.261 1.00 41.14 H new ATOM 0 HG1 THR A 53 15.950 -8.324 -3.131 1.00 71.54 H new ATOM 0 HG21 THR A 53 13.213 -6.536 -4.087 1.00 45.33 H new ATOM 0 HG22 THR A 53 12.518 -6.657 -2.453 1.00 45.33 H new ATOM 0 HG23 THR A 53 14.171 -6.034 -2.673 1.00 45.33 H new ATOM 853 N SER A 54 14.351 -10.859 -0.919 1.00 40.31 N ATOM 854 CA SER A 54 14.944 -12.186 -0.810 1.00 72.50 C ATOM 855 C SER A 54 15.507 -12.643 -2.153 1.00 21.52 C ATOM 856 O SER A 54 16.434 -13.450 -2.207 1.00 63.20 O ATOM 857 CB SER A 54 13.905 -13.193 -0.311 1.00 23.03 C ATOM 858 OG SER A 54 13.281 -13.860 -1.395 1.00 30.41 O ATOM 0 H SER A 54 13.380 -10.805 -0.613 1.00 40.31 H new ATOM 0 HA SER A 54 15.762 -12.132 -0.092 1.00 72.50 H new ATOM 0 HB2 SER A 54 14.385 -13.922 0.342 1.00 23.03 H new ATOM 0 HB3 SER A 54 13.152 -12.678 0.286 1.00 23.03 H new ATOM 0 HG SER A 54 12.623 -14.499 -1.051 1.00 30.41 H new ATOM 864 N GLU A 55 14.939 -12.119 -3.234 1.00 1.45 N ATOM 865 CA GLU A 55 15.383 -12.473 -4.577 1.00 23.22 C ATOM 866 C GLU A 55 16.696 -11.774 -4.917 1.00 42.04 C ATOM 867 O GLU A 55 17.623 -12.392 -5.442 1.00 61.32 O ATOM 868 CB GLU A 55 14.314 -12.100 -5.606 1.00 52.31 C ATOM 869 CG GLU A 55 13.051 -12.939 -5.502 1.00 11.43 C ATOM 870 CD GLU A 55 11.847 -12.260 -6.125 1.00 2.21 C ATOM 871 OE1 GLU A 55 11.970 -11.765 -7.265 1.00 31.45 O ATOM 872 OE2 GLU A 55 10.783 -12.222 -5.474 1.00 75.35 O ATOM 0 H GLU A 55 14.171 -11.448 -3.206 1.00 1.45 H new ATOM 0 HA GLU A 55 15.546 -13.550 -4.606 1.00 23.22 H new ATOM 0 HB2 GLU A 55 14.053 -11.049 -5.482 1.00 52.31 H new ATOM 0 HB3 GLU A 55 14.731 -12.209 -6.607 1.00 52.31 H new ATOM 0 HG2 GLU A 55 13.216 -13.899 -5.991 1.00 11.43 H new ATOM 0 HG3 GLU A 55 12.843 -13.148 -4.453 1.00 11.43 H new ATOM 879 N GLY A 56 16.769 -10.482 -4.614 1.00 3.12 N ATOM 880 CA GLY A 56 17.972 -9.720 -4.895 1.00 32.22 C ATOM 881 C GLY A 56 19.193 -10.287 -4.197 1.00 22.04 C ATOM 882 O GLY A 56 20.277 -10.346 -4.779 1.00 32.22 O ATOM 0 H GLY A 56 16.016 -9.949 -4.179 1.00 3.12 H new ATOM 0 HA2 GLY A 56 18.146 -9.705 -5.971 1.00 32.22 H new ATOM 0 HA3 GLY A 56 17.825 -8.686 -4.582 1.00 32.22 H new ATOM 886 N CYS A 57 19.019 -10.701 -2.947 1.00 2.14 N ATOM 887 CA CYS A 57 20.116 -11.263 -2.168 1.00 0.24 C ATOM 888 C CYS A 57 20.709 -12.482 -2.865 1.00 11.43 C ATOM 889 O CYS A 57 21.929 -12.633 -2.943 1.00 54.23 O ATOM 890 CB CYS A 57 19.631 -11.646 -0.769 1.00 42.24 C ATOM 891 SG CYS A 57 20.000 -10.414 0.502 1.00 30.31 S ATOM 0 H CYS A 57 18.129 -10.658 -2.451 1.00 2.14 H new ATOM 0 HA CYS A 57 20.893 -10.504 -2.080 1.00 0.24 H new ATOM 0 HB2 CYS A 57 18.554 -11.808 -0.801 1.00 42.24 H new ATOM 0 HB3 CYS A 57 20.088 -12.594 -0.485 1.00 42.24 H new ATOM 0 HG CYS A 57 19.549 -10.826 1.650 1.00 30.31 H new ATOM 897 N ARG A 58 19.839 -13.350 -3.372 1.00 72.53 N ATOM 898 CA ARG A 58 20.277 -14.558 -4.060 1.00 34.13 C ATOM 899 C ARG A 58 21.276 -14.223 -5.163 1.00 44.43 C ATOM 900 O ARG A 58 22.314 -14.872 -5.292 1.00 34.01 O ATOM 901 CB ARG A 58 19.075 -15.297 -4.652 1.00 52.53 C ATOM 902 CG ARG A 58 19.369 -16.743 -5.017 1.00 51.05 C ATOM 903 CD ARG A 58 19.560 -17.602 -3.776 1.00 55.31 C ATOM 904 NE ARG A 58 19.743 -19.013 -4.111 1.00 45.13 N ATOM 905 CZ ARG A 58 20.840 -19.495 -4.685 1.00 21.31 C ATOM 906 NH1 ARG A 58 21.845 -18.686 -4.987 1.00 64.22 N ATOM 907 NH2 ARG A 58 20.932 -20.791 -4.958 1.00 23.00 N ATOM 0 H ARG A 58 18.826 -13.239 -3.319 1.00 72.53 H new ATOM 0 HA ARG A 58 20.769 -15.203 -3.332 1.00 34.13 H new ATOM 0 HB2 ARG A 58 18.254 -15.272 -3.935 1.00 52.53 H new ATOM 0 HB3 ARG A 58 18.736 -14.768 -5.543 1.00 52.53 H new ATOM 0 HG2 ARG A 58 18.550 -17.142 -5.615 1.00 51.05 H new ATOM 0 HG3 ARG A 58 20.266 -16.789 -5.634 1.00 51.05 H new ATOM 0 HD2 ARG A 58 20.426 -17.246 -3.218 1.00 55.31 H new ATOM 0 HD3 ARG A 58 18.694 -17.494 -3.123 1.00 55.31 H new ATOM 0 HE ARG A 58 18.988 -19.663 -3.892 1.00 45.13 H new ATOM 0 HH11 ARG A 58 21.778 -17.690 -4.779 1.00 64.22 H new ATOM 0 HH12 ARG A 58 22.686 -19.060 -5.428 1.00 64.22 H new ATOM 0 HH21 ARG A 58 20.160 -21.417 -4.727 1.00 23.00 H new ATOM 0 HH22 ARG A 58 21.774 -21.161 -5.399 1.00 23.00 H new ATOM 921 N GLN A 59 20.955 -13.206 -5.956 1.00 33.22 N ATOM 922 CA GLN A 59 21.824 -12.787 -7.049 1.00 4.33 C ATOM 923 C GLN A 59 23.161 -12.280 -6.518 1.00 41.12 C ATOM 924 O GLN A 59 24.205 -12.489 -7.138 1.00 2.12 O ATOM 925 CB GLN A 59 21.145 -11.694 -7.879 1.00 71.42 C ATOM 926 CG GLN A 59 20.199 -12.235 -8.938 1.00 1.33 C ATOM 927 CD GLN A 59 20.060 -11.304 -10.126 1.00 23.23 C ATOM 928 OE1 GLN A 59 20.563 -11.586 -11.213 1.00 30.02 O ATOM 929 NE2 GLN A 59 19.374 -10.185 -9.925 1.00 22.35 N ATOM 0 H GLN A 59 20.100 -12.657 -5.862 1.00 33.22 H new ATOM 0 HA GLN A 59 22.010 -13.653 -7.684 1.00 4.33 H new ATOM 0 HB2 GLN A 59 20.591 -11.034 -7.212 1.00 71.42 H new ATOM 0 HB3 GLN A 59 21.911 -11.088 -8.363 1.00 71.42 H new ATOM 0 HG2 GLN A 59 20.560 -13.205 -9.281 1.00 1.33 H new ATOM 0 HG3 GLN A 59 19.218 -12.400 -8.493 1.00 1.33 H new ATOM 0 HE21 GLN A 59 18.973 -9.990 -9.007 1.00 22.35 H new ATOM 0 HE22 GLN A 59 19.248 -9.520 -10.688 1.00 22.35 H new ATOM 938 N ILE A 60 23.122 -11.615 -5.368 1.00 10.32 N ATOM 939 CA ILE A 60 24.331 -11.080 -4.754 1.00 10.23 C ATOM 940 C ILE A 60 25.196 -12.197 -4.180 1.00 31.24 C ATOM 941 O ILE A 60 26.424 -12.153 -4.267 1.00 54.23 O ATOM 942 CB ILE A 60 23.998 -10.077 -3.634 1.00 34.54 C ATOM 943 CG1 ILE A 60 23.131 -8.940 -4.179 1.00 1.33 C ATOM 944 CG2 ILE A 60 25.274 -9.529 -3.017 1.00 21.02 C ATOM 945 CD1 ILE A 60 22.467 -8.115 -3.099 1.00 3.20 C ATOM 0 H ILE A 60 22.266 -11.434 -4.843 1.00 10.32 H new ATOM 0 HA ILE A 60 24.882 -10.564 -5.540 1.00 10.23 H new ATOM 0 HB ILE A 60 23.437 -10.596 -2.857 1.00 34.54 H new ATOM 0 HG12 ILE A 60 23.748 -8.287 -4.796 1.00 1.33 H new ATOM 0 HG13 ILE A 60 22.363 -9.359 -4.829 1.00 1.33 H new ATOM 0 HG21 ILE A 60 25.022 -8.822 -2.227 1.00 21.02 H new ATOM 0 HG22 ILE A 60 25.856 -10.349 -2.597 1.00 21.02 H new ATOM 0 HG23 ILE A 60 25.861 -9.023 -3.784 1.00 21.02 H new ATOM 0 HD11 ILE A 60 21.869 -7.328 -3.558 1.00 3.20 H new ATOM 0 HD12 ILE A 60 21.823 -8.755 -2.496 1.00 3.20 H new ATOM 0 HD13 ILE A 60 23.230 -7.666 -2.463 1.00 3.20 H new ATOM 957 N LEU A 61 24.548 -13.199 -3.595 1.00 1.45 N ATOM 958 CA LEU A 61 25.257 -14.330 -3.008 1.00 40.10 C ATOM 959 C LEU A 61 25.752 -15.283 -4.091 1.00 50.11 C ATOM 960 O LEU A 61 26.732 -16.002 -3.899 1.00 73.34 O ATOM 961 CB LEU A 61 24.348 -15.077 -2.031 1.00 1.23 C ATOM 962 CG LEU A 61 23.920 -14.300 -0.785 1.00 73.54 C ATOM 963 CD1 LEU A 61 22.802 -15.031 -0.058 1.00 74.12 C ATOM 964 CD2 LEU A 61 25.108 -14.083 0.141 1.00 33.12 C ATOM 0 H LEU A 61 23.532 -13.251 -3.515 1.00 1.45 H new ATOM 0 HA LEU A 61 26.121 -13.944 -2.467 1.00 40.10 H new ATOM 0 HB2 LEU A 61 23.451 -15.389 -2.566 1.00 1.23 H new ATOM 0 HB3 LEU A 61 24.860 -15.985 -1.711 1.00 1.23 H new ATOM 0 HG LEU A 61 23.545 -13.326 -1.098 1.00 73.54 H new ATOM 0 HD11 LEU A 61 22.511 -14.463 0.826 1.00 74.12 H new ATOM 0 HD12 LEU A 61 21.944 -15.135 -0.722 1.00 74.12 H new ATOM 0 HD13 LEU A 61 23.149 -16.019 0.244 1.00 74.12 H new ATOM 0 HD21 LEU A 61 24.786 -13.529 1.022 1.00 33.12 H new ATOM 0 HD22 LEU A 61 25.512 -15.048 0.447 1.00 33.12 H new ATOM 0 HD23 LEU A 61 25.878 -13.517 -0.382 1.00 33.12 H new ATOM 976 N GLY A 62 25.068 -15.282 -5.231 1.00 41.23 N ATOM 977 CA GLY A 62 25.455 -16.150 -6.328 1.00 34.01 C ATOM 978 C GLY A 62 26.763 -15.729 -6.968 1.00 71.21 C ATOM 979 O GLY A 62 27.508 -16.565 -7.477 1.00 15.21 O ATOM 0 H GLY A 62 24.253 -14.696 -5.414 1.00 41.23 H new ATOM 0 HA2 GLY A 62 25.546 -17.173 -5.963 1.00 34.01 H new ATOM 0 HA3 GLY A 62 24.668 -16.149 -7.082 1.00 34.01 H new ATOM 983 N GLN A 63 27.042 -14.430 -6.941 1.00 14.44 N ATOM 984 CA GLN A 63 28.268 -13.900 -7.525 1.00 74.14 C ATOM 985 C GLN A 63 29.434 -14.027 -6.550 1.00 4.50 C ATOM 986 O GLN A 63 30.573 -14.266 -6.955 1.00 31.42 O ATOM 987 CB GLN A 63 28.077 -12.435 -7.923 1.00 51.04 C ATOM 988 CG GLN A 63 27.961 -12.223 -9.424 1.00 74.41 C ATOM 989 CD GLN A 63 27.294 -10.908 -9.777 1.00 13.13 C ATOM 990 OE1 GLN A 63 26.068 -10.792 -9.744 1.00 1.42 O ATOM 991 NE2 GLN A 63 28.099 -9.908 -10.117 1.00 34.54 N ATOM 0 H GLN A 63 26.436 -13.725 -6.521 1.00 14.44 H new ATOM 0 HA GLN A 63 28.498 -14.484 -8.416 1.00 74.14 H new ATOM 0 HB2 GLN A 63 27.179 -12.050 -7.440 1.00 51.04 H new ATOM 0 HB3 GLN A 63 28.917 -11.852 -7.546 1.00 51.04 H new ATOM 0 HG2 GLN A 63 28.955 -12.253 -9.869 1.00 74.41 H new ATOM 0 HG3 GLN A 63 27.392 -13.044 -9.860 1.00 74.41 H new ATOM 0 HE21 GLN A 63 29.109 -10.049 -10.131 1.00 34.54 H new ATOM 0 HE22 GLN A 63 27.707 -8.999 -10.364 1.00 34.54 H new ATOM 1000 N LEU A 64 29.143 -13.866 -5.264 1.00 43.51 N ATOM 1001 CA LEU A 64 30.169 -13.961 -4.230 1.00 31.34 C ATOM 1002 C LEU A 64 30.452 -15.418 -3.879 1.00 63.00 C ATOM 1003 O LEU A 64 31.546 -15.755 -3.426 1.00 2.12 O ATOM 1004 CB LEU A 64 29.731 -13.199 -2.978 1.00 3.04 C ATOM 1005 CG LEU A 64 29.445 -11.709 -3.166 1.00 22.22 C ATOM 1006 CD1 LEU A 64 29.051 -11.070 -1.843 1.00 64.44 C ATOM 1007 CD2 LEU A 64 30.654 -11.004 -3.762 1.00 42.34 C ATOM 0 H LEU A 64 28.206 -13.669 -4.912 1.00 43.51 H new ATOM 0 HA LEU A 64 31.085 -13.514 -4.618 1.00 31.34 H new ATOM 0 HB2 LEU A 64 28.833 -13.674 -2.583 1.00 3.04 H new ATOM 0 HB3 LEU A 64 30.508 -13.307 -2.221 1.00 3.04 H new ATOM 0 HG LEU A 64 28.611 -11.604 -3.860 1.00 22.22 H new ATOM 0 HD11 LEU A 64 28.851 -10.009 -1.996 1.00 64.44 H new ATOM 0 HD12 LEU A 64 28.155 -11.556 -1.457 1.00 64.44 H new ATOM 0 HD13 LEU A 64 29.864 -11.186 -1.126 1.00 64.44 H new ATOM 0 HD21 LEU A 64 30.432 -9.944 -3.889 1.00 42.34 H new ATOM 0 HD22 LEU A 64 31.508 -11.118 -3.094 1.00 42.34 H new ATOM 0 HD23 LEU A 64 30.890 -11.443 -4.731 1.00 42.34 H new ATOM 1019 N GLN A 65 29.462 -16.278 -4.094 1.00 30.13 N ATOM 1020 CA GLN A 65 29.607 -17.699 -3.801 1.00 2.21 C ATOM 1021 C GLN A 65 30.860 -18.264 -4.459 1.00 75.04 C ATOM 1022 O GLN A 65 31.777 -18.747 -3.794 1.00 64.51 O ATOM 1023 CB GLN A 65 28.374 -18.468 -4.279 1.00 25.21 C ATOM 1024 CG GLN A 65 27.511 -18.998 -3.145 1.00 10.33 C ATOM 1025 CD GLN A 65 26.280 -19.731 -3.642 1.00 52.33 C ATOM 1026 OE1 GLN A 65 26.383 -20.700 -4.395 1.00 13.42 O ATOM 1027 NE2 GLN A 65 25.107 -19.272 -3.224 1.00 63.25 N ATOM 0 H GLN A 65 28.551 -16.016 -4.470 1.00 30.13 H new ATOM 0 HA GLN A 65 29.702 -17.814 -2.721 1.00 2.21 H new ATOM 0 HB2 GLN A 65 27.770 -17.815 -4.909 1.00 25.21 H new ATOM 0 HB3 GLN A 65 28.695 -19.303 -4.901 1.00 25.21 H new ATOM 0 HG2 GLN A 65 28.104 -19.671 -2.526 1.00 10.33 H new ATOM 0 HG3 GLN A 65 27.203 -18.168 -2.509 1.00 10.33 H new ATOM 0 HE21 GLN A 65 25.068 -18.466 -2.600 1.00 63.25 H new ATOM 0 HE22 GLN A 65 24.245 -19.725 -3.527 1.00 63.25 H new ATOM 1036 N PRO A 66 30.904 -18.207 -5.799 1.00 23.23 N ATOM 1037 CA PRO A 66 32.041 -18.709 -6.576 1.00 34.51 C ATOM 1038 C PRO A 66 33.287 -17.850 -6.402 1.00 61.35 C ATOM 1039 O PRO A 66 34.400 -18.286 -6.698 1.00 2.54 O ATOM 1040 CB PRO A 66 31.540 -18.638 -8.022 1.00 73.43 C ATOM 1041 CG PRO A 66 30.499 -17.574 -8.010 1.00 4.12 C ATOM 1042 CD PRO A 66 29.847 -17.646 -6.657 1.00 73.33 C ATOM 0 HA PRO A 66 32.340 -19.709 -6.262 1.00 34.51 H new ATOM 0 HB2 PRO A 66 32.349 -18.392 -8.710 1.00 73.43 H new ATOM 0 HB3 PRO A 66 31.126 -19.593 -8.345 1.00 73.43 H new ATOM 0 HG2 PRO A 66 30.943 -16.593 -8.177 1.00 4.12 H new ATOM 0 HG3 PRO A 66 29.769 -17.734 -8.804 1.00 4.12 H new ATOM 0 HD2 PRO A 66 29.529 -16.662 -6.311 1.00 73.33 H new ATOM 0 HD3 PRO A 66 28.961 -18.281 -6.671 1.00 73.33 H new ATOM 1050 N SER A 67 33.095 -16.627 -5.917 1.00 70.55 N ATOM 1051 CA SER A 67 34.206 -15.706 -5.705 1.00 34.25 C ATOM 1052 C SER A 67 34.611 -15.672 -4.235 1.00 34.32 C ATOM 1053 O SER A 67 35.146 -14.675 -3.749 1.00 24.31 O ATOM 1054 CB SER A 67 33.824 -14.300 -6.173 1.00 11.33 C ATOM 1055 OG SER A 67 33.432 -14.305 -7.535 1.00 21.42 O ATOM 0 H SER A 67 32.181 -16.251 -5.664 1.00 70.55 H new ATOM 0 HA SER A 67 35.056 -16.059 -6.289 1.00 34.25 H new ATOM 0 HB2 SER A 67 33.009 -13.917 -5.558 1.00 11.33 H new ATOM 0 HB3 SER A 67 34.670 -13.626 -6.037 1.00 11.33 H new ATOM 0 HG SER A 67 32.454 -14.311 -7.594 1.00 21.42 H new ATOM 1061 N LEU A 68 34.352 -16.768 -3.531 1.00 55.32 N ATOM 1062 CA LEU A 68 34.689 -16.867 -2.115 1.00 4.22 C ATOM 1063 C LEU A 68 36.174 -17.160 -1.928 1.00 42.34 C ATOM 1064 O LEU A 68 36.794 -16.692 -0.973 1.00 33.31 O ATOM 1065 CB LEU A 68 33.854 -17.959 -1.446 1.00 1.21 C ATOM 1066 CG LEU A 68 32.550 -17.500 -0.790 1.00 40.03 C ATOM 1067 CD1 LEU A 68 31.759 -18.695 -0.281 1.00 53.54 C ATOM 1068 CD2 LEU A 68 32.838 -16.527 0.344 1.00 21.43 C ATOM 0 H LEU A 68 33.909 -17.602 -3.918 1.00 55.32 H new ATOM 0 HA LEU A 68 34.464 -15.909 -1.646 1.00 4.22 H new ATOM 0 HB2 LEU A 68 33.615 -18.715 -2.194 1.00 1.21 H new ATOM 0 HB3 LEU A 68 34.468 -18.444 -0.687 1.00 1.21 H new ATOM 0 HG LEU A 68 31.949 -16.986 -1.540 1.00 40.03 H new ATOM 0 HD11 LEU A 68 30.835 -18.349 0.182 1.00 53.54 H new ATOM 0 HD12 LEU A 68 31.522 -19.356 -1.115 1.00 53.54 H new ATOM 0 HD13 LEU A 68 32.353 -19.238 0.455 1.00 53.54 H new ATOM 0 HD21 LEU A 68 31.899 -16.211 0.799 1.00 21.43 H new ATOM 0 HD22 LEU A 68 33.459 -17.016 1.095 1.00 21.43 H new ATOM 0 HD23 LEU A 68 33.362 -15.656 -0.048 1.00 21.43 H new ATOM 1080 N GLN A 69 36.740 -17.935 -2.848 1.00 0.32 N ATOM 1081 CA GLN A 69 38.153 -18.289 -2.785 1.00 50.11 C ATOM 1082 C GLN A 69 39.010 -17.235 -3.479 1.00 24.32 C ATOM 1083 O GLN A 69 40.101 -16.902 -3.015 1.00 42.11 O ATOM 1084 CB GLN A 69 38.387 -19.657 -3.428 1.00 52.12 C ATOM 1085 CG GLN A 69 39.775 -20.220 -3.171 1.00 12.04 C ATOM 1086 CD GLN A 69 40.584 -20.381 -4.444 1.00 33.40 C ATOM 1087 OE1 GLN A 69 40.034 -20.645 -5.513 1.00 2.01 O ATOM 1088 NE2 GLN A 69 41.898 -20.223 -4.334 1.00 13.30 N ATOM 0 H GLN A 69 36.242 -18.330 -3.646 1.00 0.32 H new ATOM 0 HA GLN A 69 38.444 -18.334 -1.735 1.00 50.11 H new ATOM 0 HB2 GLN A 69 37.644 -20.359 -3.050 1.00 52.12 H new ATOM 0 HB3 GLN A 69 38.230 -19.575 -4.504 1.00 52.12 H new ATOM 0 HG2 GLN A 69 40.309 -19.561 -2.486 1.00 12.04 H new ATOM 0 HG3 GLN A 69 39.685 -21.188 -2.677 1.00 12.04 H new ATOM 0 HE21 GLN A 69 42.311 -20.005 -3.427 1.00 13.30 H new ATOM 0 HE22 GLN A 69 42.494 -20.320 -5.156 1.00 13.30 H new ATOM 1097 N THR A 70 38.508 -16.712 -4.593 1.00 41.51 N ATOM 1098 CA THR A 70 39.228 -15.697 -5.352 1.00 1.22 C ATOM 1099 C THR A 70 38.750 -14.296 -4.988 1.00 22.42 C ATOM 1100 O THR A 70 38.836 -13.371 -5.794 1.00 13.31 O ATOM 1101 CB THR A 70 39.062 -15.906 -6.869 1.00 41.23 C ATOM 1102 OG1 THR A 70 37.681 -16.104 -7.188 1.00 32.21 O ATOM 1103 CG2 THR A 70 39.874 -17.102 -7.343 1.00 24.20 C ATOM 0 H THR A 70 37.606 -16.974 -4.990 1.00 41.51 H new ATOM 0 HA THR A 70 40.282 -15.797 -5.092 1.00 1.22 H new ATOM 0 HB THR A 70 39.428 -15.014 -7.378 1.00 41.23 H new ATOM 0 HG1 THR A 70 37.584 -16.234 -8.154 1.00 32.21 H new ATOM 0 HG21 THR A 70 39.741 -17.230 -8.417 1.00 24.20 H new ATOM 0 HG22 THR A 70 40.929 -16.935 -7.125 1.00 24.20 H new ATOM 0 HG23 THR A 70 39.535 -18.000 -6.826 1.00 24.20 H new ATOM 1111 N GLY A 71 38.244 -14.146 -3.767 1.00 34.44 N ATOM 1112 CA GLY A 71 37.759 -12.854 -3.318 1.00 61.03 C ATOM 1113 C GLY A 71 38.684 -12.209 -2.305 1.00 20.34 C ATOM 1114 O GLY A 71 39.757 -12.733 -2.011 1.00 53.33 O ATOM 0 H GLY A 71 38.162 -14.896 -3.081 1.00 34.44 H new ATOM 0 HA2 GLY A 71 37.648 -12.192 -4.177 1.00 61.03 H new ATOM 0 HA3 GLY A 71 36.769 -12.974 -2.877 1.00 61.03 H new ATOM 1118 N SER A 72 38.266 -11.066 -1.770 1.00 1.33 N ATOM 1119 CA SER A 72 39.067 -10.343 -0.788 1.00 75.04 C ATOM 1120 C SER A 72 38.336 -10.254 0.548 1.00 2.45 C ATOM 1121 O SER A 72 37.228 -10.767 0.697 1.00 52.01 O ATOM 1122 CB SER A 72 39.396 -8.939 -1.299 1.00 34.03 C ATOM 1123 OG SER A 72 38.257 -8.331 -1.884 1.00 41.11 O ATOM 0 H SER A 72 37.378 -10.621 -2.000 1.00 1.33 H new ATOM 0 HA SER A 72 39.996 -10.892 -0.638 1.00 75.04 H new ATOM 0 HB2 SER A 72 39.758 -8.324 -0.475 1.00 34.03 H new ATOM 0 HB3 SER A 72 40.200 -8.994 -2.033 1.00 34.03 H new ATOM 0 HG SER A 72 38.492 -7.434 -2.202 1.00 41.11 H new ATOM 1129 N GLU A 73 38.967 -9.597 1.517 1.00 34.15 N ATOM 1130 CA GLU A 73 38.377 -9.439 2.841 1.00 13.01 C ATOM 1131 C GLU A 73 36.966 -8.865 2.744 1.00 11.24 C ATOM 1132 O GLU A 73 36.024 -9.405 3.321 1.00 12.02 O ATOM 1133 CB GLU A 73 39.250 -8.531 3.708 1.00 63.45 C ATOM 1134 CG GLU A 73 40.057 -9.282 4.754 1.00 65.31 C ATOM 1135 CD GLU A 73 39.194 -9.826 5.877 1.00 22.22 C ATOM 1136 OE1 GLU A 73 38.204 -9.158 6.242 1.00 75.24 O ATOM 1137 OE2 GLU A 73 39.509 -10.921 6.390 1.00 2.33 O ATOM 0 H GLU A 73 39.885 -9.166 1.410 1.00 34.15 H new ATOM 0 HA GLU A 73 38.319 -10.424 3.304 1.00 13.01 H new ATOM 0 HB2 GLU A 73 39.932 -7.975 3.065 1.00 63.45 H new ATOM 0 HB3 GLU A 73 38.615 -7.799 4.207 1.00 63.45 H new ATOM 0 HG2 GLU A 73 40.587 -10.106 4.276 1.00 65.31 H new ATOM 0 HG3 GLU A 73 40.813 -8.617 5.171 1.00 65.31 H new ATOM 1144 N GLU A 74 36.831 -7.764 2.010 1.00 52.54 N ATOM 1145 CA GLU A 74 35.537 -7.115 1.838 1.00 73.22 C ATOM 1146 C GLU A 74 34.502 -8.099 1.301 1.00 12.42 C ATOM 1147 O GLU A 74 33.353 -8.115 1.745 1.00 1.55 O ATOM 1148 CB GLU A 74 35.662 -5.921 0.890 1.00 65.13 C ATOM 1149 CG GLU A 74 36.298 -4.699 1.531 1.00 24.31 C ATOM 1150 CD GLU A 74 37.612 -4.315 0.879 1.00 33.23 C ATOM 1151 OE1 GLU A 74 37.576 -3.662 -0.185 1.00 24.14 O ATOM 1152 OE2 GLU A 74 38.675 -4.667 1.430 1.00 62.42 O ATOM 0 H GLU A 74 37.602 -7.304 1.526 1.00 52.54 H new ATOM 0 HA GLU A 74 35.204 -6.761 2.814 1.00 73.22 H new ATOM 0 HB2 GLU A 74 36.254 -6.216 0.024 1.00 65.13 H new ATOM 0 HB3 GLU A 74 34.671 -5.654 0.523 1.00 65.13 H new ATOM 0 HG2 GLU A 74 35.606 -3.859 1.468 1.00 24.31 H new ATOM 0 HG3 GLU A 74 36.466 -4.895 2.590 1.00 24.31 H new ATOM 1159 N LEU A 75 34.917 -8.918 0.340 1.00 33.32 N ATOM 1160 CA LEU A 75 34.026 -9.906 -0.260 1.00 51.33 C ATOM 1161 C LEU A 75 33.517 -10.889 0.789 1.00 54.52 C ATOM 1162 O LEU A 75 32.318 -11.151 0.878 1.00 73.31 O ATOM 1163 CB LEU A 75 34.749 -10.662 -1.376 1.00 1.11 C ATOM 1164 CG LEU A 75 33.856 -11.348 -2.410 1.00 54.21 C ATOM 1165 CD1 LEU A 75 34.509 -11.316 -3.784 1.00 32.51 C ATOM 1166 CD2 LEU A 75 33.559 -12.781 -1.992 1.00 4.22 C ATOM 0 H LEU A 75 35.864 -8.918 -0.040 1.00 33.32 H new ATOM 0 HA LEU A 75 33.170 -9.379 -0.682 1.00 51.33 H new ATOM 0 HB2 LEU A 75 35.403 -9.962 -1.897 1.00 1.11 H new ATOM 0 HB3 LEU A 75 35.389 -11.417 -0.920 1.00 1.11 H new ATOM 0 HG LEU A 75 32.913 -10.804 -2.465 1.00 54.21 H new ATOM 0 HD11 LEU A 75 33.859 -11.809 -4.507 1.00 32.51 H new ATOM 0 HD12 LEU A 75 34.670 -10.281 -4.086 1.00 32.51 H new ATOM 0 HD13 LEU A 75 35.467 -11.835 -3.744 1.00 32.51 H new ATOM 0 HD21 LEU A 75 32.922 -13.254 -2.740 1.00 4.22 H new ATOM 0 HD22 LEU A 75 34.493 -13.336 -1.908 1.00 4.22 H new ATOM 0 HD23 LEU A 75 33.049 -12.781 -1.029 1.00 4.22 H new ATOM 1178 N ARG A 76 34.436 -11.429 1.582 1.00 40.42 N ATOM 1179 CA ARG A 76 34.082 -12.382 2.626 1.00 33.43 C ATOM 1180 C ARG A 76 33.062 -11.779 3.589 1.00 72.03 C ATOM 1181 O ARG A 76 32.019 -12.375 3.857 1.00 64.14 O ATOM 1182 CB ARG A 76 35.330 -12.819 3.394 1.00 22.43 C ATOM 1183 CG ARG A 76 35.117 -14.060 4.246 1.00 52.34 C ATOM 1184 CD ARG A 76 36.404 -14.491 4.933 1.00 11.33 C ATOM 1185 NE ARG A 76 36.544 -13.893 6.257 1.00 65.40 N ATOM 1186 CZ ARG A 76 35.937 -14.359 7.342 1.00 61.44 C ATOM 1187 NH1 ARG A 76 35.152 -15.425 7.261 1.00 12.31 N ATOM 1188 NH2 ARG A 76 36.113 -13.760 8.513 1.00 51.35 N ATOM 0 H ARG A 76 35.433 -11.222 1.521 1.00 40.42 H new ATOM 0 HA ARG A 76 33.635 -13.255 2.150 1.00 33.43 H new ATOM 0 HB2 ARG A 76 36.135 -13.010 2.684 1.00 22.43 H new ATOM 0 HB3 ARG A 76 35.657 -12.000 4.035 1.00 22.43 H new ATOM 0 HG2 ARG A 76 34.352 -13.861 4.996 1.00 52.34 H new ATOM 0 HG3 ARG A 76 34.747 -14.873 3.621 1.00 52.34 H new ATOM 0 HD2 ARG A 76 36.421 -15.577 5.022 1.00 11.33 H new ATOM 0 HD3 ARG A 76 37.257 -14.208 4.316 1.00 11.33 H new ATOM 0 HE ARG A 76 37.141 -13.072 6.354 1.00 65.40 H new ATOM 0 HH11 ARG A 76 35.013 -15.889 6.363 1.00 12.31 H new ATOM 0 HH12 ARG A 76 34.687 -15.781 8.096 1.00 12.31 H new ATOM 0 HH21 ARG A 76 36.716 -12.940 8.581 1.00 51.35 H new ATOM 0 HH22 ARG A 76 35.646 -14.120 9.345 1.00 51.35 H new ATOM 1202 N SER A 77 33.374 -10.595 4.105 1.00 23.13 N ATOM 1203 CA SER A 77 32.488 -9.913 5.042 1.00 32.22 C ATOM 1204 C SER A 77 31.087 -9.764 4.454 1.00 64.11 C ATOM 1205 O SER A 77 30.087 -9.877 5.166 1.00 40.52 O ATOM 1206 CB SER A 77 33.052 -8.537 5.400 1.00 73.20 C ATOM 1207 OG SER A 77 33.945 -8.623 6.498 1.00 4.34 O ATOM 0 H SER A 77 34.233 -10.088 3.891 1.00 23.13 H new ATOM 0 HA SER A 77 32.421 -10.517 5.947 1.00 32.22 H new ATOM 0 HB2 SER A 77 33.570 -8.117 4.538 1.00 73.20 H new ATOM 0 HB3 SER A 77 32.235 -7.858 5.643 1.00 73.20 H new ATOM 0 HG SER A 77 33.557 -9.197 7.191 1.00 4.34 H new ATOM 1213 N LEU A 78 31.023 -9.508 3.153 1.00 53.23 N ATOM 1214 CA LEU A 78 29.746 -9.344 2.467 1.00 24.23 C ATOM 1215 C LEU A 78 28.926 -10.628 2.527 1.00 22.14 C ATOM 1216 O LEU A 78 27.795 -10.633 3.015 1.00 21.30 O ATOM 1217 CB LEU A 78 29.975 -8.938 1.011 1.00 15.54 C ATOM 1218 CG LEU A 78 29.736 -7.465 0.678 1.00 1.12 C ATOM 1219 CD1 LEU A 78 28.314 -7.061 1.036 1.00 15.14 C ATOM 1220 CD2 LEU A 78 30.741 -6.584 1.404 1.00 4.20 C ATOM 0 H LEU A 78 31.841 -9.409 2.551 1.00 53.23 H new ATOM 0 HA LEU A 78 29.189 -8.556 2.973 1.00 24.23 H new ATOM 0 HB2 LEU A 78 31.001 -9.188 0.742 1.00 15.54 H new ATOM 0 HB3 LEU A 78 29.324 -9.543 0.380 1.00 15.54 H new ATOM 0 HG LEU A 78 29.872 -7.328 -0.395 1.00 1.12 H new ATOM 0 HD11 LEU A 78 28.162 -6.010 0.792 1.00 15.14 H new ATOM 0 HD12 LEU A 78 27.609 -7.670 0.470 1.00 15.14 H new ATOM 0 HD13 LEU A 78 28.150 -7.213 2.103 1.00 15.14 H new ATOM 0 HD21 LEU A 78 30.556 -5.539 1.155 1.00 4.20 H new ATOM 0 HD22 LEU A 78 30.638 -6.724 2.480 1.00 4.20 H new ATOM 0 HD23 LEU A 78 31.751 -6.856 1.098 1.00 4.20 H new ATOM 1232 N TYR A 79 29.503 -11.716 2.029 1.00 63.01 N ATOM 1233 CA TYR A 79 28.826 -13.007 2.026 1.00 14.11 C ATOM 1234 C TYR A 79 28.316 -13.359 3.420 1.00 45.52 C ATOM 1235 O TYR A 79 27.312 -14.053 3.569 1.00 1.01 O ATOM 1236 CB TYR A 79 29.770 -14.100 1.525 1.00 60.14 C ATOM 1237 CG TYR A 79 29.056 -15.344 1.044 1.00 43.44 C ATOM 1238 CD1 TYR A 79 28.272 -15.318 -0.102 1.00 54.32 C ATOM 1239 CD2 TYR A 79 29.166 -16.544 1.736 1.00 5.22 C ATOM 1240 CE1 TYR A 79 27.618 -16.450 -0.546 1.00 73.44 C ATOM 1241 CE2 TYR A 79 28.516 -17.681 1.300 1.00 53.31 C ATOM 1242 CZ TYR A 79 27.743 -17.631 0.159 1.00 0.25 C ATOM 1243 OH TYR A 79 27.093 -18.762 -0.279 1.00 61.02 O ATOM 0 H TYR A 79 30.438 -11.729 1.622 1.00 63.01 H new ATOM 0 HA TYR A 79 27.971 -12.938 1.353 1.00 14.11 H new ATOM 0 HB2 TYR A 79 30.375 -13.701 0.711 1.00 60.14 H new ATOM 0 HB3 TYR A 79 30.456 -14.372 2.328 1.00 60.14 H new ATOM 0 HD1 TYR A 79 28.172 -14.396 -0.656 1.00 54.32 H new ATOM 0 HD2 TYR A 79 29.770 -16.588 2.630 1.00 5.22 H new ATOM 0 HE1 TYR A 79 27.012 -16.412 -1.439 1.00 73.44 H new ATOM 0 HE2 TYR A 79 28.612 -18.606 1.850 1.00 53.31 H new ATOM 0 HH TYR A 79 27.286 -19.506 0.329 1.00 61.02 H new ATOM 1253 N ASN A 80 29.017 -12.872 4.439 1.00 54.05 N ATOM 1254 CA ASN A 80 28.637 -13.135 5.822 1.00 63.44 C ATOM 1255 C ASN A 80 27.356 -12.392 6.185 1.00 22.25 C ATOM 1256 O ASN A 80 26.368 -12.998 6.602 1.00 53.02 O ATOM 1257 CB ASN A 80 29.765 -12.722 6.770 1.00 23.51 C ATOM 1258 CG ASN A 80 30.836 -13.788 6.894 1.00 10.11 C ATOM 1259 OD1 ASN A 80 30.535 -14.973 7.031 1.00 31.43 O ATOM 1260 ND2 ASN A 80 32.095 -13.369 6.847 1.00 11.53 N ATOM 0 H ASN A 80 29.850 -12.294 4.333 1.00 54.05 H new ATOM 0 HA ASN A 80 28.457 -14.205 5.926 1.00 63.44 H new ATOM 0 HB2 ASN A 80 30.217 -11.797 6.411 1.00 23.51 H new ATOM 0 HB3 ASN A 80 29.349 -12.512 7.756 1.00 23.51 H new ATOM 0 HD21 ASN A 80 32.859 -14.040 6.926 1.00 11.53 H new ATOM 0 HD22 ASN A 80 32.298 -12.376 6.732 1.00 11.53 H new ATOM 1267 N THR A 81 27.376 -11.072 6.021 1.00 60.05 N ATOM 1268 CA THR A 81 26.217 -10.245 6.330 1.00 64.12 C ATOM 1269 C THR A 81 25.035 -10.596 5.434 1.00 43.43 C ATOM 1270 O THR A 81 23.933 -10.853 5.917 1.00 72.13 O ATOM 1271 CB THR A 81 26.538 -8.746 6.174 1.00 55.13 C ATOM 1272 OG1 THR A 81 27.722 -8.420 6.911 1.00 11.52 O ATOM 1273 CG2 THR A 81 25.379 -7.891 6.662 1.00 24.31 C ATOM 0 H THR A 81 28.184 -10.553 5.676 1.00 60.05 H new ATOM 0 HA THR A 81 25.954 -10.447 7.368 1.00 64.12 H new ATOM 0 HB THR A 81 26.700 -8.539 5.116 1.00 55.13 H new ATOM 0 HG1 THR A 81 27.921 -7.466 6.806 1.00 11.52 H new ATOM 0 HG21 THR A 81 25.629 -6.837 6.542 1.00 24.31 H new ATOM 0 HG22 THR A 81 24.487 -8.121 6.080 1.00 24.31 H new ATOM 0 HG23 THR A 81 25.190 -8.101 7.715 1.00 24.31 H new ATOM 1281 N ILE A 82 25.274 -10.605 4.127 1.00 3.15 N ATOM 1282 CA ILE A 82 24.228 -10.927 3.163 1.00 3.11 C ATOM 1283 C ILE A 82 23.589 -12.276 3.474 1.00 65.13 C ATOM 1284 O ILE A 82 22.427 -12.513 3.149 1.00 42.12 O ATOM 1285 CB ILE A 82 24.778 -10.951 1.724 1.00 23.42 C ATOM 1286 CG1 ILE A 82 25.417 -9.605 1.376 1.00 10.34 C ATOM 1287 CG2 ILE A 82 23.668 -11.287 0.740 1.00 14.23 C ATOM 1288 CD1 ILE A 82 26.269 -9.646 0.126 1.00 52.10 C ATOM 0 H ILE A 82 26.181 -10.393 3.711 1.00 3.15 H new ATOM 0 HA ILE A 82 23.474 -10.144 3.243 1.00 3.11 H new ATOM 0 HB ILE A 82 25.544 -11.723 1.656 1.00 23.42 H new ATOM 0 HG12 ILE A 82 24.631 -8.861 1.246 1.00 10.34 H new ATOM 0 HG13 ILE A 82 26.031 -9.276 2.214 1.00 10.34 H new ATOM 0 HG21 ILE A 82 24.071 -11.300 -0.273 1.00 14.23 H new ATOM 0 HG22 ILE A 82 23.254 -12.267 0.979 1.00 14.23 H new ATOM 0 HG23 ILE A 82 22.882 -10.535 0.808 1.00 14.23 H new ATOM 0 HD11 ILE A 82 26.690 -8.658 -0.060 1.00 52.10 H new ATOM 0 HD12 ILE A 82 27.077 -10.365 0.260 1.00 52.10 H new ATOM 0 HD13 ILE A 82 25.655 -9.944 -0.723 1.00 52.10 H new ATOM 1300 N ALA A 83 24.358 -13.155 4.108 1.00 74.44 N ATOM 1301 CA ALA A 83 23.866 -14.480 4.468 1.00 10.25 C ATOM 1302 C ALA A 83 22.826 -14.396 5.579 1.00 24.32 C ATOM 1303 O ALA A 83 21.789 -15.057 5.524 1.00 2.31 O ATOM 1304 CB ALA A 83 25.022 -15.375 4.889 1.00 23.32 C ATOM 0 H ALA A 83 25.323 -12.974 4.383 1.00 74.44 H new ATOM 0 HA ALA A 83 23.386 -14.914 3.591 1.00 10.25 H new ATOM 0 HB1 ALA A 83 24.641 -16.361 5.155 1.00 23.32 H new ATOM 0 HB2 ALA A 83 25.728 -15.470 4.064 1.00 23.32 H new ATOM 0 HB3 ALA A 83 25.527 -14.937 5.750 1.00 23.32 H new ATOM 1310 N VAL A 84 23.110 -13.579 6.589 1.00 53.20 N ATOM 1311 CA VAL A 84 22.199 -13.409 7.714 1.00 22.13 C ATOM 1312 C VAL A 84 20.902 -12.740 7.274 1.00 13.22 C ATOM 1313 O VAL A 84 19.820 -13.078 7.759 1.00 1.32 O ATOM 1314 CB VAL A 84 22.841 -12.570 8.835 1.00 0.01 C ATOM 1315 CG1 VAL A 84 21.885 -12.425 10.008 1.00 22.43 C ATOM 1316 CG2 VAL A 84 24.155 -13.196 9.281 1.00 0.05 C ATOM 0 H VAL A 84 23.964 -13.025 6.651 1.00 53.20 H new ATOM 0 HA VAL A 84 21.980 -14.406 8.097 1.00 22.13 H new ATOM 0 HB VAL A 84 23.052 -11.574 8.445 1.00 0.01 H new ATOM 0 HG11 VAL A 84 22.356 -11.829 10.790 1.00 22.43 H new ATOM 0 HG12 VAL A 84 20.973 -11.930 9.675 1.00 22.43 H new ATOM 0 HG13 VAL A 84 21.640 -13.411 10.402 1.00 22.43 H new ATOM 0 HG21 VAL A 84 24.596 -12.591 10.073 1.00 0.05 H new ATOM 0 HG22 VAL A 84 23.970 -14.203 9.654 1.00 0.05 H new ATOM 0 HG23 VAL A 84 24.841 -13.242 8.436 1.00 0.05 H new ATOM 1326 N LEU A 85 21.015 -11.790 6.352 1.00 53.13 N ATOM 1327 CA LEU A 85 19.851 -11.073 5.845 1.00 3.34 C ATOM 1328 C LEU A 85 18.987 -11.981 4.976 1.00 53.24 C ATOM 1329 O LEU A 85 17.786 -12.119 5.206 1.00 63.42 O ATOM 1330 CB LEU A 85 20.292 -9.848 5.042 1.00 15.11 C ATOM 1331 CG LEU A 85 19.284 -8.700 4.961 1.00 45.31 C ATOM 1332 CD1 LEU A 85 19.604 -7.636 6.000 1.00 50.23 C ATOM 1333 CD2 LEU A 85 19.274 -8.097 3.564 1.00 73.02 C ATOM 0 H LEU A 85 21.902 -11.499 5.940 1.00 53.13 H new ATOM 0 HA LEU A 85 19.257 -10.746 6.698 1.00 3.34 H new ATOM 0 HB2 LEU A 85 21.214 -9.465 5.479 1.00 15.11 H new ATOM 0 HB3 LEU A 85 20.529 -10.169 4.028 1.00 15.11 H new ATOM 0 HG LEU A 85 18.291 -9.098 5.171 1.00 45.31 H new ATOM 0 HD11 LEU A 85 18.877 -6.827 5.928 1.00 50.23 H new ATOM 0 HD12 LEU A 85 19.560 -8.076 6.996 1.00 50.23 H new ATOM 0 HD13 LEU A 85 20.604 -7.242 5.821 1.00 50.23 H new ATOM 0 HD21 LEU A 85 18.551 -7.282 3.525 1.00 73.02 H new ATOM 0 HD22 LEU A 85 20.266 -7.714 3.326 1.00 73.02 H new ATOM 0 HD23 LEU A 85 18.997 -8.863 2.839 1.00 73.02 H new ATOM 1345 N TYR A 86 19.608 -12.601 3.978 1.00 62.24 N ATOM 1346 CA TYR A 86 18.897 -13.497 3.075 1.00 15.03 C ATOM 1347 C TYR A 86 18.168 -14.590 3.852 1.00 23.42 C ATOM 1348 O TYR A 86 17.005 -14.891 3.578 1.00 25.21 O ATOM 1349 CB TYR A 86 19.869 -14.128 2.077 1.00 71.23 C ATOM 1350 CG TYR A 86 19.249 -15.217 1.232 1.00 54.34 C ATOM 1351 CD1 TYR A 86 18.503 -14.907 0.101 1.00 62.24 C ATOM 1352 CD2 TYR A 86 19.409 -16.557 1.564 1.00 53.40 C ATOM 1353 CE1 TYR A 86 17.934 -15.900 -0.673 1.00 3.43 C ATOM 1354 CE2 TYR A 86 18.845 -17.556 0.794 1.00 31.23 C ATOM 1355 CZ TYR A 86 18.107 -17.222 -0.323 1.00 60.14 C ATOM 1356 OH TYR A 86 17.543 -18.213 -1.093 1.00 61.14 O ATOM 0 H TYR A 86 20.602 -12.499 3.775 1.00 62.24 H new ATOM 0 HA TYR A 86 18.158 -12.909 2.530 1.00 15.03 H new ATOM 0 HB2 TYR A 86 20.259 -13.350 1.422 1.00 71.23 H new ATOM 0 HB3 TYR A 86 20.718 -14.542 2.622 1.00 71.23 H new ATOM 0 HD1 TYR A 86 18.366 -13.873 -0.177 1.00 62.24 H new ATOM 0 HD2 TYR A 86 19.984 -16.822 2.439 1.00 53.40 H new ATOM 0 HE1 TYR A 86 17.356 -15.642 -1.548 1.00 3.43 H new ATOM 0 HE2 TYR A 86 18.981 -18.593 1.065 1.00 31.23 H new ATOM 0 HH TYR A 86 17.761 -19.088 -0.710 1.00 61.14 H new ATOM 1366 N CYS A 87 18.859 -15.177 4.822 1.00 53.14 N ATOM 1367 CA CYS A 87 18.279 -16.237 5.640 1.00 44.30 C ATOM 1368 C CYS A 87 16.970 -15.779 6.274 1.00 1.31 C ATOM 1369 O CYS A 87 15.995 -16.530 6.322 1.00 53.33 O ATOM 1370 CB CYS A 87 19.264 -16.665 6.729 1.00 40.33 C ATOM 1371 SG CYS A 87 20.454 -17.918 6.195 1.00 63.24 S ATOM 0 H CYS A 87 19.821 -14.938 5.062 1.00 53.14 H new ATOM 0 HA CYS A 87 18.070 -17.089 4.993 1.00 44.30 H new ATOM 0 HB2 CYS A 87 19.808 -15.787 7.077 1.00 40.33 H new ATOM 0 HB3 CYS A 87 18.703 -17.051 7.580 1.00 40.33 H new ATOM 0 HG CYS A 87 21.502 -17.335 5.694 1.00 63.24 H new ATOM 1377 N VAL A 88 16.954 -14.542 6.760 1.00 31.12 N ATOM 1378 CA VAL A 88 15.765 -13.984 7.392 1.00 15.54 C ATOM 1379 C VAL A 88 14.626 -13.841 6.389 1.00 74.21 C ATOM 1380 O VAL A 88 13.506 -14.292 6.635 1.00 0.00 O ATOM 1381 CB VAL A 88 16.056 -12.608 8.020 1.00 63.42 C ATOM 1382 CG1 VAL A 88 14.811 -12.058 8.701 1.00 44.45 C ATOM 1383 CG2 VAL A 88 17.212 -12.707 9.004 1.00 63.21 C ATOM 0 H VAL A 88 17.752 -13.907 6.728 1.00 31.12 H new ATOM 0 HA VAL A 88 15.469 -14.679 8.178 1.00 15.54 H new ATOM 0 HB VAL A 88 16.342 -11.918 7.226 1.00 63.42 H new ATOM 0 HG11 VAL A 88 15.035 -11.085 9.139 1.00 44.45 H new ATOM 0 HG12 VAL A 88 14.012 -11.950 7.967 1.00 44.45 H new ATOM 0 HG13 VAL A 88 14.492 -12.744 9.485 1.00 44.45 H new ATOM 0 HG21 VAL A 88 17.405 -11.726 9.439 1.00 63.21 H new ATOM 0 HG22 VAL A 88 16.956 -13.411 9.796 1.00 63.21 H new ATOM 0 HG23 VAL A 88 18.104 -13.055 8.483 1.00 63.21 H new ATOM 1393 N HIS A 89 14.918 -13.211 5.255 1.00 74.31 N ATOM 1394 CA HIS A 89 13.918 -13.009 4.211 1.00 72.32 C ATOM 1395 C HIS A 89 13.313 -14.341 3.777 1.00 14.55 C ATOM 1396 O HIS A 89 12.106 -14.359 3.530 1.00 44.24 O ATOM 1397 CB HIS A 89 14.541 -12.302 3.008 1.00 51.32 C ATOM 1398 CG HIS A 89 14.898 -10.872 3.273 1.00 35.03 C ATOM 1399 ND1 HIS A 89 14.352 -10.139 4.305 1.00 30.32 N ATOM 1400 CD2 HIS A 89 15.753 -10.040 2.634 1.00 3.03 C ATOM 1401 CE1 HIS A 89 14.855 -8.917 4.288 1.00 32.24 C ATOM 1402 NE2 HIS A 89 15.708 -8.831 3.283 1.00 73.20 N ATOM 0 H HIS A 89 15.839 -12.831 5.035 1.00 74.31 H new ATOM 0 HA HIS A 89 13.124 -12.383 4.618 1.00 72.32 H new ATOM 0 HB2 HIS A 89 15.438 -12.842 2.704 1.00 51.32 H new ATOM 0 HB3 HIS A 89 13.844 -12.345 2.171 1.00 51.32 H new ATOM 0 HD2 HIS A 89 16.358 -10.282 1.773 1.00 3.03 H new ATOM 0 HE1 HIS A 89 14.610 -8.123 4.978 1.00 32.24 H new ATOM 0 HE2 HIS A 89 16.245 -8.002 3.030 1.00 73.20 H new ATOM 1411 N GLN A 90 14.088 -15.416 3.678 1.00 44.42 N ATOM 1412 CA GLN A 90 13.554 -16.708 3.264 1.00 64.41 C ATOM 1413 C GLN A 90 12.746 -17.347 4.390 1.00 53.45 C ATOM 1414 O GLN A 90 11.523 -17.457 4.304 1.00 53.52 O ATOM 1415 CB GLN A 90 14.689 -17.641 2.841 1.00 51.21 C ATOM 1416 CG GLN A 90 14.737 -17.901 1.344 1.00 1.44 C ATOM 1417 CD GLN A 90 14.864 -19.374 1.010 1.00 43.45 C ATOM 1418 OE1 GLN A 90 15.654 -20.094 1.622 1.00 75.22 O ATOM 1419 NE2 GLN A 90 14.087 -19.830 0.037 1.00 14.43 N ATOM 0 H GLN A 90 15.088 -15.418 3.879 1.00 44.42 H new ATOM 0 HA GLN A 90 12.893 -16.545 2.413 1.00 64.41 H new ATOM 0 HB2 GLN A 90 15.639 -17.210 3.157 1.00 51.21 H new ATOM 0 HB3 GLN A 90 14.580 -18.592 3.363 1.00 51.21 H new ATOM 0 HG2 GLN A 90 13.833 -17.504 0.881 1.00 1.44 H new ATOM 0 HG3 GLN A 90 15.580 -17.361 0.912 1.00 1.44 H new ATOM 0 HE21 GLN A 90 13.447 -19.198 -0.443 1.00 14.43 H new ATOM 0 HE22 GLN A 90 14.129 -20.813 -0.231 1.00 14.43 H new ATOM 1428 N ARG A 91 13.439 -17.769 5.442 1.00 22.40 N ATOM 1429 CA ARG A 91 12.786 -18.400 6.583 1.00 25.43 C ATOM 1430 C ARG A 91 13.806 -18.768 7.657 1.00 74.45 C ATOM 1431 O ARG A 91 13.518 -18.694 8.852 1.00 24.22 O ATOM 1432 CB ARG A 91 12.024 -19.648 6.137 1.00 60.01 C ATOM 1433 CG ARG A 91 12.816 -20.540 5.194 1.00 12.34 C ATOM 1434 CD ARG A 91 12.035 -21.790 4.821 1.00 4.35 C ATOM 1435 NE ARG A 91 12.801 -22.674 3.947 1.00 54.21 N ATOM 1436 CZ ARG A 91 12.365 -23.860 3.536 1.00 3.25 C ATOM 1437 NH1 ARG A 91 11.173 -24.300 3.917 1.00 41.12 N ATOM 1438 NH2 ARG A 91 13.120 -24.606 2.742 1.00 54.02 N ATOM 0 H ARG A 91 14.452 -17.686 5.528 1.00 22.40 H new ATOM 0 HA ARG A 91 12.080 -17.686 7.007 1.00 25.43 H new ATOM 0 HB2 ARG A 91 11.741 -20.225 7.018 1.00 60.01 H new ATOM 0 HB3 ARG A 91 11.100 -19.343 5.645 1.00 60.01 H new ATOM 0 HG2 ARG A 91 13.067 -19.984 4.291 1.00 12.34 H new ATOM 0 HG3 ARG A 91 13.757 -20.825 5.665 1.00 12.34 H new ATOM 0 HD2 ARG A 91 11.758 -22.328 5.728 1.00 4.35 H new ATOM 0 HD3 ARG A 91 11.108 -21.503 4.324 1.00 4.35 H new ATOM 0 HE ARG A 91 13.721 -22.364 3.635 1.00 54.21 H new ATOM 0 HH11 ARG A 91 10.589 -23.728 4.527 1.00 41.12 H new ATOM 0 HH12 ARG A 91 10.840 -25.211 3.600 1.00 41.12 H new ATOM 0 HH21 ARG A 91 14.036 -24.270 2.446 1.00 54.02 H new ATOM 0 HH22 ARG A 91 12.785 -25.516 2.427 1.00 54.02 H new ATOM 1452 N ILE A 92 14.996 -19.170 7.222 1.00 25.54 N ATOM 1453 CA ILE A 92 16.057 -19.550 8.146 1.00 52.24 C ATOM 1454 C ILE A 92 16.296 -18.463 9.188 1.00 44.42 C ATOM 1455 O ILE A 92 16.563 -17.310 8.846 1.00 21.23 O ATOM 1456 CB ILE A 92 17.376 -19.832 7.402 1.00 71.52 C ATOM 1457 CG1 ILE A 92 17.174 -20.935 6.361 1.00 21.13 C ATOM 1458 CG2 ILE A 92 18.467 -20.222 8.389 1.00 10.10 C ATOM 1459 CD1 ILE A 92 17.244 -20.438 4.934 1.00 4.04 C ATOM 0 H ILE A 92 15.249 -19.241 6.236 1.00 25.54 H new ATOM 0 HA ILE A 92 15.729 -20.461 8.646 1.00 52.24 H new ATOM 0 HB ILE A 92 17.687 -18.924 6.886 1.00 71.52 H new ATOM 0 HG12 ILE A 92 17.932 -21.705 6.507 1.00 21.13 H new ATOM 0 HG13 ILE A 92 16.205 -21.406 6.526 1.00 21.13 H new ATOM 0 HG21 ILE A 92 19.393 -20.418 7.849 1.00 10.10 H new ATOM 0 HG22 ILE A 92 18.625 -19.408 9.097 1.00 10.10 H new ATOM 0 HG23 ILE A 92 18.165 -21.119 8.929 1.00 10.10 H new ATOM 0 HD11 ILE A 92 17.092 -21.273 4.250 1.00 4.04 H new ATOM 0 HD12 ILE A 92 16.468 -19.690 4.771 1.00 4.04 H new ATOM 0 HD13 ILE A 92 18.222 -19.993 4.751 1.00 4.04 H new ATOM 1471 N ASP A 93 16.201 -18.837 10.459 1.00 35.54 N ATOM 1472 CA ASP A 93 16.409 -17.894 11.551 1.00 22.33 C ATOM 1473 C ASP A 93 17.644 -18.269 12.364 1.00 61.43 C ATOM 1474 O ASP A 93 17.567 -18.454 13.580 1.00 4.43 O ATOM 1475 CB ASP A 93 15.178 -17.852 12.459 1.00 24.10 C ATOM 1476 CG ASP A 93 14.759 -19.230 12.931 1.00 40.44 C ATOM 1477 OD1 ASP A 93 15.604 -20.150 12.899 1.00 43.34 O ATOM 1478 OD2 ASP A 93 13.587 -19.391 13.332 1.00 5.53 O ATOM 0 H ASP A 93 15.981 -19.787 10.758 1.00 35.54 H new ATOM 0 HA ASP A 93 16.566 -16.905 11.120 1.00 22.33 H new ATOM 0 HB2 ASP A 93 15.390 -17.224 13.324 1.00 24.10 H new ATOM 0 HB3 ASP A 93 14.350 -17.388 11.923 1.00 24.10 H new ATOM 1483 N VAL A 94 18.781 -18.382 11.686 1.00 62.24 N ATOM 1484 CA VAL A 94 20.033 -18.735 12.345 1.00 75.40 C ATOM 1485 C VAL A 94 20.297 -17.831 13.544 1.00 20.20 C ATOM 1486 O VAL A 94 19.657 -16.791 13.705 1.00 53.23 O ATOM 1487 CB VAL A 94 21.225 -18.643 11.374 1.00 33.23 C ATOM 1488 CG1 VAL A 94 21.057 -19.631 10.229 1.00 4.54 C ATOM 1489 CG2 VAL A 94 21.374 -17.224 10.847 1.00 11.01 C ATOM 0 H VAL A 94 18.861 -18.234 10.680 1.00 62.24 H new ATOM 0 HA VAL A 94 19.931 -19.765 12.686 1.00 75.40 H new ATOM 0 HB VAL A 94 22.135 -18.902 11.916 1.00 33.23 H new ATOM 0 HG11 VAL A 94 21.908 -19.552 9.553 1.00 4.54 H new ATOM 0 HG12 VAL A 94 21.003 -20.644 10.628 1.00 4.54 H new ATOM 0 HG13 VAL A 94 20.140 -19.405 9.685 1.00 4.54 H new ATOM 0 HG21 VAL A 94 22.221 -17.177 10.162 1.00 11.01 H new ATOM 0 HG22 VAL A 94 20.465 -16.934 10.320 1.00 11.01 H new ATOM 0 HG23 VAL A 94 21.543 -16.542 11.680 1.00 11.01 H new ATOM 1499 N LYS A 95 21.245 -18.233 14.384 1.00 42.03 N ATOM 1500 CA LYS A 95 21.598 -17.458 15.568 1.00 34.21 C ATOM 1501 C LYS A 95 22.855 -16.631 15.323 1.00 32.43 C ATOM 1502 O LYS A 95 23.054 -15.588 15.945 1.00 24.33 O ATOM 1503 CB LYS A 95 21.811 -18.388 16.765 1.00 35.41 C ATOM 1504 CG LYS A 95 20.560 -19.146 17.178 1.00 2.54 C ATOM 1505 CD LYS A 95 20.800 -19.981 18.423 1.00 43.03 C ATOM 1506 CE LYS A 95 20.390 -19.234 19.683 1.00 4.23 C ATOM 1507 NZ LYS A 95 20.167 -20.158 20.829 1.00 71.05 N ATOM 0 H LYS A 95 21.783 -19.092 14.267 1.00 42.03 H new ATOM 0 HA LYS A 95 20.775 -16.778 15.785 1.00 34.21 H new ATOM 0 HB2 LYS A 95 22.596 -19.104 16.523 1.00 35.41 H new ATOM 0 HB3 LYS A 95 22.166 -17.801 17.612 1.00 35.41 H new ATOM 0 HG2 LYS A 95 19.750 -18.440 17.363 1.00 2.54 H new ATOM 0 HG3 LYS A 95 20.239 -19.793 16.361 1.00 2.54 H new ATOM 0 HD2 LYS A 95 20.238 -20.912 18.352 1.00 43.03 H new ATOM 0 HD3 LYS A 95 21.855 -20.249 18.485 1.00 43.03 H new ATOM 0 HE2 LYS A 95 21.163 -18.512 19.944 1.00 4.23 H new ATOM 0 HE3 LYS A 95 19.478 -18.669 19.490 1.00 4.23 H new ATOM 0 HZ1 LYS A 95 19.889 -19.610 21.668 1.00 71.05 H new ATOM 0 HZ2 LYS A 95 19.412 -20.832 20.590 1.00 71.05 H new ATOM 0 HZ3 LYS A 95 21.044 -20.679 21.031 1.00 71.05 H new ATOM 1521 N ASP A 96 23.699 -17.102 14.412 1.00 63.34 N ATOM 1522 CA ASP A 96 24.936 -16.405 14.083 1.00 43.41 C ATOM 1523 C ASP A 96 25.220 -16.478 12.586 1.00 22.11 C ATOM 1524 O ASP A 96 24.430 -17.029 11.819 1.00 33.42 O ATOM 1525 CB ASP A 96 26.107 -17.001 14.866 1.00 64.41 C ATOM 1526 CG ASP A 96 26.057 -18.514 14.920 1.00 74.43 C ATOM 1527 OD1 ASP A 96 26.267 -19.154 13.869 1.00 53.01 O ATOM 1528 OD2 ASP A 96 25.806 -19.060 16.016 1.00 42.54 O ATOM 0 H ASP A 96 23.549 -17.964 13.888 1.00 63.34 H new ATOM 0 HA ASP A 96 24.818 -15.358 14.362 1.00 43.41 H new ATOM 0 HB2 ASP A 96 27.044 -16.688 14.406 1.00 64.41 H new ATOM 0 HB3 ASP A 96 26.101 -16.604 15.881 1.00 64.41 H new ATOM 1533 N THR A 97 26.353 -15.916 12.175 1.00 70.34 N ATOM 1534 CA THR A 97 26.740 -15.916 10.770 1.00 53.32 C ATOM 1535 C THR A 97 27.300 -17.272 10.354 1.00 2.45 C ATOM 1536 O THR A 97 27.094 -17.720 9.225 1.00 71.33 O ATOM 1537 CB THR A 97 27.790 -14.828 10.476 1.00 24.50 C ATOM 1538 OG1 THR A 97 27.266 -13.538 10.814 1.00 41.31 O ATOM 1539 CG2 THR A 97 28.196 -14.848 9.011 1.00 41.40 C ATOM 0 H THR A 97 27.018 -15.455 12.796 1.00 70.34 H new ATOM 0 HA THR A 97 25.839 -15.706 10.194 1.00 53.32 H new ATOM 0 HB THR A 97 28.672 -15.032 11.083 1.00 24.50 H new ATOM 0 HG1 THR A 97 26.308 -13.614 11.007 1.00 41.31 H new ATOM 0 HG21 THR A 97 28.938 -14.071 8.828 1.00 41.40 H new ATOM 0 HG22 THR A 97 28.621 -15.821 8.765 1.00 41.40 H new ATOM 0 HG23 THR A 97 27.320 -14.667 8.388 1.00 41.40 H new ATOM 1547 N LYS A 98 28.009 -17.920 11.270 1.00 72.31 N ATOM 1548 CA LYS A 98 28.598 -19.226 11.000 1.00 73.12 C ATOM 1549 C LYS A 98 27.541 -20.207 10.503 1.00 11.20 C ATOM 1550 O LYS A 98 27.758 -20.925 9.527 1.00 74.34 O ATOM 1551 CB LYS A 98 29.267 -19.778 12.261 1.00 12.22 C ATOM 1552 CG LYS A 98 30.028 -21.072 12.029 1.00 74.22 C ATOM 1553 CD LYS A 98 29.969 -21.980 13.246 1.00 54.43 C ATOM 1554 CE LYS A 98 29.798 -23.438 12.847 1.00 40.51 C ATOM 1555 NZ LYS A 98 29.020 -24.202 13.860 1.00 34.44 N ATOM 0 H LYS A 98 28.190 -17.562 12.208 1.00 72.31 H new ATOM 0 HA LYS A 98 29.350 -19.103 10.221 1.00 73.12 H new ATOM 0 HB2 LYS A 98 29.953 -19.029 12.656 1.00 12.22 H new ATOM 0 HB3 LYS A 98 28.505 -19.946 13.023 1.00 12.22 H new ATOM 0 HG2 LYS A 98 29.610 -21.591 11.166 1.00 74.22 H new ATOM 0 HG3 LYS A 98 31.068 -20.846 11.793 1.00 74.22 H new ATOM 0 HD2 LYS A 98 30.882 -21.866 13.830 1.00 54.43 H new ATOM 0 HD3 LYS A 98 29.141 -21.678 13.887 1.00 54.43 H new ATOM 0 HE2 LYS A 98 29.292 -23.494 11.883 1.00 40.51 H new ATOM 0 HE3 LYS A 98 30.778 -23.897 12.720 1.00 40.51 H new ATOM 0 HZ1 LYS A 98 28.925 -25.191 13.552 1.00 34.44 H new ATOM 0 HZ2 LYS A 98 29.515 -24.170 14.774 1.00 34.44 H new ATOM 0 HZ3 LYS A 98 28.075 -23.780 13.963 1.00 34.44 H new ATOM 1569 N GLU A 99 26.396 -20.229 11.178 1.00 51.03 N ATOM 1570 CA GLU A 99 25.305 -21.122 10.803 1.00 11.42 C ATOM 1571 C GLU A 99 24.706 -20.714 9.460 1.00 32.23 C ATOM 1572 O GLU A 99 24.437 -21.557 8.606 1.00 15.52 O ATOM 1573 CB GLU A 99 24.220 -21.120 11.881 1.00 2.05 C ATOM 1574 CG GLU A 99 24.374 -22.233 12.904 1.00 0.44 C ATOM 1575 CD GLU A 99 23.675 -21.924 14.213 1.00 13.43 C ATOM 1576 OE1 GLU A 99 22.576 -21.330 14.173 1.00 74.43 O ATOM 1577 OE2 GLU A 99 24.226 -22.275 15.277 1.00 52.01 O ATOM 0 H GLU A 99 26.200 -19.639 11.987 1.00 51.03 H new ATOM 0 HA GLU A 99 25.710 -22.130 10.709 1.00 11.42 H new ATOM 0 HB2 GLU A 99 24.234 -20.160 12.397 1.00 2.05 H new ATOM 0 HB3 GLU A 99 23.245 -21.210 11.403 1.00 2.05 H new ATOM 0 HG2 GLU A 99 23.972 -23.158 12.492 1.00 0.44 H new ATOM 0 HG3 GLU A 99 25.434 -22.403 13.094 1.00 0.44 H new ATOM 1584 N ALA A 100 24.497 -19.413 9.283 1.00 44.03 N ATOM 1585 CA ALA A 100 23.931 -18.892 8.046 1.00 10.24 C ATOM 1586 C ALA A 100 24.786 -19.280 6.843 1.00 73.41 C ATOM 1587 O ALA A 100 24.292 -19.363 5.719 1.00 14.42 O ATOM 1588 CB ALA A 100 23.789 -17.379 8.126 1.00 22.11 C ATOM 0 H ALA A 100 24.712 -18.701 9.981 1.00 44.03 H new ATOM 0 HA ALA A 100 22.943 -19.334 7.915 1.00 10.24 H new ATOM 0 HB1 ALA A 100 23.365 -17.004 7.195 1.00 22.11 H new ATOM 0 HB2 ALA A 100 23.131 -17.119 8.955 1.00 22.11 H new ATOM 0 HB3 ALA A 100 24.769 -16.929 8.285 1.00 22.11 H new ATOM 1594 N LEU A 101 26.069 -19.518 7.089 1.00 61.11 N ATOM 1595 CA LEU A 101 26.993 -19.898 6.026 1.00 42.14 C ATOM 1596 C LEU A 101 26.885 -21.388 5.717 1.00 51.02 C ATOM 1597 O LEU A 101 26.589 -21.779 4.588 1.00 64.34 O ATOM 1598 CB LEU A 101 28.429 -19.551 6.424 1.00 14.33 C ATOM 1599 CG LEU A 101 29.246 -18.783 5.384 1.00 2.22 C ATOM 1600 CD1 LEU A 101 29.481 -19.639 4.150 1.00 54.12 C ATOM 1601 CD2 LEU A 101 28.545 -17.485 5.008 1.00 4.14 C ATOM 0 H LEU A 101 26.493 -19.455 8.014 1.00 61.11 H new ATOM 0 HA LEU A 101 26.726 -19.340 5.129 1.00 42.14 H new ATOM 0 HB2 LEU A 101 28.399 -18.962 7.340 1.00 14.33 H new ATOM 0 HB3 LEU A 101 28.954 -20.477 6.658 1.00 14.33 H new ATOM 0 HG LEU A 101 30.214 -18.538 5.821 1.00 2.22 H new ATOM 0 HD11 LEU A 101 30.064 -19.075 3.422 1.00 54.12 H new ATOM 0 HD12 LEU A 101 30.025 -20.541 4.431 1.00 54.12 H new ATOM 0 HD13 LEU A 101 28.522 -19.916 3.711 1.00 54.12 H new ATOM 0 HD21 LEU A 101 29.140 -16.951 4.267 1.00 4.14 H new ATOM 0 HD22 LEU A 101 27.563 -17.709 4.591 1.00 4.14 H new ATOM 0 HD23 LEU A 101 28.429 -16.864 5.896 1.00 4.14 H new ATOM 1613 N ASP A 102 27.126 -22.215 6.729 1.00 75.04 N ATOM 1614 CA ASP A 102 27.052 -23.663 6.567 1.00 71.21 C ATOM 1615 C ASP A 102 25.721 -24.073 5.946 1.00 40.20 C ATOM 1616 O ASP A 102 25.668 -24.964 5.098 1.00 31.21 O ATOM 1617 CB ASP A 102 27.236 -24.358 7.918 1.00 14.35 C ATOM 1618 CG ASP A 102 27.577 -25.827 7.769 1.00 72.43 C ATOM 1619 OD1 ASP A 102 28.710 -26.134 7.342 1.00 41.31 O ATOM 1620 OD2 ASP A 102 26.712 -26.672 8.082 1.00 61.22 O ATOM 0 H ASP A 102 27.374 -21.908 7.669 1.00 75.04 H new ATOM 0 HA ASP A 102 27.854 -23.971 5.897 1.00 71.21 H new ATOM 0 HB2 ASP A 102 28.028 -23.858 8.476 1.00 14.35 H new ATOM 0 HB3 ASP A 102 26.322 -24.257 8.503 1.00 14.35 H new ATOM 1625 N LYS A 103 24.647 -23.418 6.374 1.00 52.54 N ATOM 1626 CA LYS A 103 23.315 -23.714 5.861 1.00 13.13 C ATOM 1627 C LYS A 103 23.256 -23.510 4.350 1.00 51.44 C ATOM 1628 O LYS A 103 22.932 -24.433 3.602 1.00 64.04 O ATOM 1629 CB LYS A 103 22.273 -22.826 6.547 1.00 51.54 C ATOM 1630 CG LYS A 103 20.901 -23.469 6.649 1.00 21.54 C ATOM 1631 CD LYS A 103 20.570 -23.853 8.083 1.00 52.44 C ATOM 1632 CE LYS A 103 21.126 -25.225 8.434 1.00 32.03 C ATOM 1633 NZ LYS A 103 22.512 -25.142 8.971 1.00 30.12 N ATOM 0 H LYS A 103 24.673 -22.678 7.076 1.00 52.54 H new ATOM 0 HA LYS A 103 23.093 -24.759 6.078 1.00 13.13 H new ATOM 0 HB2 LYS A 103 22.623 -22.576 7.548 1.00 51.54 H new ATOM 0 HB3 LYS A 103 22.186 -21.889 5.996 1.00 51.54 H new ATOM 0 HG2 LYS A 103 20.146 -22.779 6.273 1.00 21.54 H new ATOM 0 HG3 LYS A 103 20.866 -24.356 6.016 1.00 21.54 H new ATOM 0 HD2 LYS A 103 20.980 -23.108 8.764 1.00 52.44 H new ATOM 0 HD3 LYS A 103 19.489 -23.851 8.221 1.00 52.44 H new ATOM 0 HE2 LYS A 103 20.479 -25.701 9.171 1.00 32.03 H new ATOM 0 HE3 LYS A 103 21.118 -25.858 7.547 1.00 32.03 H new ATOM 0 HZ1 LYS A 103 22.679 -25.933 9.626 1.00 30.12 H new ATOM 0 HZ2 LYS A 103 23.192 -25.193 8.186 1.00 30.12 H new ATOM 0 HZ3 LYS A 103 22.635 -24.242 9.477 1.00 30.12 H new ATOM 1647 N ILE A 104 23.572 -22.297 3.909 1.00 0.32 N ATOM 1648 CA ILE A 104 23.558 -21.975 2.487 1.00 25.14 C ATOM 1649 C ILE A 104 24.584 -22.804 1.725 1.00 53.24 C ATOM 1650 O ILE A 104 24.424 -23.064 0.532 1.00 25.33 O ATOM 1651 CB ILE A 104 23.842 -20.480 2.247 1.00 31.31 C ATOM 1652 CG1 ILE A 104 22.825 -19.618 2.998 1.00 2.54 C ATOM 1653 CG2 ILE A 104 23.812 -20.168 0.758 1.00 70.41 C ATOM 1654 CD1 ILE A 104 23.185 -18.149 3.029 1.00 4.05 C ATOM 0 H ILE A 104 23.841 -21.522 4.515 1.00 0.32 H new ATOM 0 HA ILE A 104 22.559 -22.211 2.119 1.00 25.14 H new ATOM 0 HB ILE A 104 24.837 -20.249 2.627 1.00 31.31 H new ATOM 0 HG12 ILE A 104 21.847 -19.734 2.531 1.00 2.54 H new ATOM 0 HG13 ILE A 104 22.736 -19.984 4.021 1.00 2.54 H new ATOM 0 HG21 ILE A 104 24.014 -19.108 0.604 1.00 70.41 H new ATOM 0 HG22 ILE A 104 24.571 -20.760 0.247 1.00 70.41 H new ATOM 0 HG23 ILE A 104 22.829 -20.412 0.355 1.00 70.41 H new ATOM 0 HD11 ILE A 104 22.420 -17.599 3.577 1.00 4.05 H new ATOM 0 HD12 ILE A 104 24.148 -18.021 3.522 1.00 4.05 H new ATOM 0 HD13 ILE A 104 23.246 -17.768 2.010 1.00 4.05 H new ATOM 1666 N GLU A 105 25.637 -23.220 2.421 1.00 71.41 N ATOM 1667 CA GLU A 105 26.689 -24.023 1.809 1.00 31.20 C ATOM 1668 C GLU A 105 26.223 -25.461 1.598 1.00 25.12 C ATOM 1669 O GLU A 105 26.656 -26.133 0.663 1.00 10.21 O ATOM 1670 CB GLU A 105 27.947 -24.005 2.680 1.00 52.41 C ATOM 1671 CG GLU A 105 28.749 -22.721 2.564 1.00 22.31 C ATOM 1672 CD GLU A 105 29.906 -22.840 1.591 1.00 21.35 C ATOM 1673 OE1 GLU A 105 30.953 -23.399 1.981 1.00 1.03 O ATOM 1674 OE2 GLU A 105 29.764 -22.375 0.441 1.00 15.42 O ATOM 0 H GLU A 105 25.784 -23.014 3.409 1.00 71.41 H new ATOM 0 HA GLU A 105 26.923 -23.589 0.837 1.00 31.20 H new ATOM 0 HB2 GLU A 105 27.660 -24.151 3.721 1.00 52.41 H new ATOM 0 HB3 GLU A 105 28.582 -24.846 2.403 1.00 52.41 H new ATOM 0 HG2 GLU A 105 28.091 -21.914 2.242 1.00 22.31 H new ATOM 0 HG3 GLU A 105 29.133 -22.447 3.547 1.00 22.31 H new ATOM 1681 N GLU A 106 25.339 -25.925 2.475 1.00 21.01 N ATOM 1682 CA GLU A 106 24.815 -27.283 2.386 1.00 73.14 C ATOM 1683 C GLU A 106 23.711 -27.373 1.336 1.00 63.11 C ATOM 1684 O GLU A 106 23.708 -28.276 0.501 1.00 2.40 O ATOM 1685 CB GLU A 106 24.280 -27.739 3.745 1.00 3.13 C ATOM 1686 CG GLU A 106 24.828 -29.081 4.196 1.00 72.34 C ATOM 1687 CD GLU A 106 23.769 -29.956 4.842 1.00 52.41 C ATOM 1688 OE1 GLU A 106 22.972 -29.427 5.644 1.00 43.55 O ATOM 1689 OE2 GLU A 106 23.739 -31.168 4.544 1.00 34.21 O ATOM 0 H GLU A 106 24.971 -25.381 3.255 1.00 21.01 H new ATOM 0 HA GLU A 106 25.632 -27.940 2.087 1.00 73.14 H new ATOM 0 HB2 GLU A 106 24.525 -26.986 4.494 1.00 3.13 H new ATOM 0 HB3 GLU A 106 23.193 -27.798 3.697 1.00 3.13 H new ATOM 0 HG2 GLU A 106 25.252 -29.603 3.338 1.00 72.34 H new ATOM 0 HG3 GLU A 106 25.641 -28.918 4.904 1.00 72.34 H new ATOM 1696 N GLU A 107 22.776 -26.430 1.388 1.00 31.21 N ATOM 1697 CA GLU A 107 21.666 -26.404 0.442 1.00 45.14 C ATOM 1698 C GLU A 107 22.176 -26.428 -0.996 1.00 31.25 C ATOM 1699 O GLU A 107 21.543 -27.006 -1.878 1.00 13.45 O ATOM 1700 CB GLU A 107 20.803 -25.161 0.669 1.00 3.53 C ATOM 1701 CG GLU A 107 19.842 -25.291 1.838 1.00 13.13 C ATOM 1702 CD GLU A 107 18.409 -25.511 1.393 1.00 0.11 C ATOM 1703 OE1 GLU A 107 17.926 -24.733 0.544 1.00 32.44 O ATOM 1704 OE2 GLU A 107 17.771 -26.461 1.892 1.00 51.00 O ATOM 0 H GLU A 107 22.765 -25.675 2.074 1.00 31.21 H new ATOM 0 HA GLU A 107 21.059 -27.294 0.608 1.00 45.14 H new ATOM 0 HB2 GLU A 107 21.454 -24.303 0.839 1.00 3.53 H new ATOM 0 HB3 GLU A 107 20.233 -24.954 -0.237 1.00 3.53 H new ATOM 0 HG2 GLU A 107 20.154 -26.123 2.469 1.00 13.13 H new ATOM 0 HG3 GLU A 107 19.895 -24.390 2.449 1.00 13.13 H new ATOM 1711 N GLN A 108 23.322 -25.795 -1.222 1.00 42.14 N ATOM 1712 CA GLN A 108 23.916 -25.742 -2.553 1.00 60.24 C ATOM 1713 C GLN A 108 24.341 -27.133 -3.014 1.00 4.41 C ATOM 1714 O GLN A 108 24.006 -27.561 -4.118 1.00 25.15 O ATOM 1715 CB GLN A 108 25.120 -24.799 -2.560 1.00 70.23 C ATOM 1716 CG GLN A 108 25.565 -24.391 -3.956 1.00 30.54 C ATOM 1717 CD GLN A 108 26.901 -24.992 -4.342 1.00 61.51 C ATOM 1718 OE1 GLN A 108 27.172 -26.161 -4.066 1.00 32.21 O ATOM 1719 NE2 GLN A 108 27.745 -24.194 -4.984 1.00 5.30 N ATOM 0 H GLN A 108 23.858 -25.312 -0.501 1.00 42.14 H new ATOM 0 HA GLN A 108 23.164 -25.363 -3.245 1.00 60.24 H new ATOM 0 HB2 GLN A 108 24.873 -23.903 -1.990 1.00 70.23 H new ATOM 0 HB3 GLN A 108 25.953 -25.282 -2.049 1.00 70.23 H new ATOM 0 HG2 GLN A 108 24.810 -24.700 -4.679 1.00 30.54 H new ATOM 0 HG3 GLN A 108 25.631 -23.304 -4.009 1.00 30.54 H new ATOM 0 HE21 GLN A 108 27.479 -23.232 -5.192 1.00 5.30 H new ATOM 0 HE22 GLN A 108 28.660 -24.543 -5.269 1.00 5.30 H new ATOM 1728 N ASN A 109 25.083 -27.832 -2.161 1.00 14.12 N ATOM 1729 CA ASN A 109 25.555 -29.174 -2.482 1.00 60.31 C ATOM 1730 C ASN A 109 24.390 -30.156 -2.566 1.00 25.34 C ATOM 1731 O ASN A 109 24.389 -31.068 -3.392 1.00 51.24 O ATOM 1732 CB ASN A 109 26.561 -29.649 -1.431 1.00 31.31 C ATOM 1733 CG ASN A 109 27.925 -29.937 -2.026 1.00 73.02 C ATOM 1734 OD1 ASN A 109 28.569 -29.053 -2.591 1.00 23.35 O ATOM 1735 ND2 ASN A 109 28.373 -31.182 -1.902 1.00 30.22 N ATOM 0 H ASN A 109 25.370 -27.492 -1.243 1.00 14.12 H new ATOM 0 HA ASN A 109 26.046 -29.136 -3.455 1.00 60.31 H new ATOM 0 HB2 ASN A 109 26.659 -28.889 -0.656 1.00 31.31 H new ATOM 0 HB3 ASN A 109 26.181 -30.549 -0.948 1.00 31.31 H new ATOM 0 HD21 ASN A 109 29.284 -31.436 -2.283 1.00 30.22 H new ATOM 0 HD22 ASN A 109 27.806 -31.883 -1.426 1.00 30.22 H new ATOM 1742 N LYS A 110 23.396 -29.961 -1.705 1.00 12.23 N ATOM 1743 CA LYS A 110 22.223 -30.826 -1.682 1.00 33.31 C ATOM 1744 C LYS A 110 21.415 -30.683 -2.967 1.00 53.54 C ATOM 1745 O LYS A 110 20.865 -31.658 -3.478 1.00 32.53 O ATOM 1746 CB LYS A 110 21.343 -30.494 -0.475 1.00 70.55 C ATOM 1747 CG LYS A 110 20.551 -31.682 0.046 1.00 24.41 C ATOM 1748 CD LYS A 110 19.518 -31.255 1.075 1.00 23.12 C ATOM 1749 CE LYS A 110 20.052 -31.390 2.492 1.00 74.44 C ATOM 1750 NZ LYS A 110 19.295 -32.406 3.275 1.00 44.25 N ATOM 0 H LYS A 110 23.380 -29.211 -1.014 1.00 12.23 H new ATOM 0 HA LYS A 110 22.566 -31.858 -1.602 1.00 33.31 H new ATOM 0 HB2 LYS A 110 21.972 -30.107 0.327 1.00 70.55 H new ATOM 0 HB3 LYS A 110 20.650 -29.698 -0.749 1.00 70.55 H new ATOM 0 HG2 LYS A 110 20.053 -32.181 -0.785 1.00 24.41 H new ATOM 0 HG3 LYS A 110 21.232 -32.407 0.492 1.00 24.41 H new ATOM 0 HD2 LYS A 110 19.227 -30.221 0.892 1.00 23.12 H new ATOM 0 HD3 LYS A 110 18.620 -31.863 0.964 1.00 23.12 H new ATOM 0 HE2 LYS A 110 21.105 -31.668 2.458 1.00 74.44 H new ATOM 0 HE3 LYS A 110 19.993 -30.425 2.996 1.00 74.44 H new ATOM 0 HZ1 LYS A 110 19.689 -32.469 4.235 1.00 44.25 H new ATOM 0 HZ2 LYS A 110 18.294 -32.128 3.329 1.00 44.25 H new ATOM 0 HZ3 LYS A 110 19.372 -33.332 2.808 1.00 44.25 H new ATOM 1764 N SER A 111 21.350 -29.461 -3.487 1.00 21.21 N ATOM 1765 CA SER A 111 20.607 -29.190 -4.712 1.00 12.41 C ATOM 1766 C SER A 111 21.110 -30.064 -5.856 1.00 12.34 C ATOM 1767 O SER A 111 20.359 -30.405 -6.771 1.00 21.45 O ATOM 1768 CB SER A 111 20.730 -27.713 -5.092 1.00 30.43 C ATOM 1769 OG SER A 111 20.659 -27.540 -6.497 1.00 64.21 O ATOM 0 H SER A 111 21.803 -28.643 -3.079 1.00 21.21 H new ATOM 0 HA SER A 111 19.558 -29.425 -4.531 1.00 12.41 H new ATOM 0 HB2 SER A 111 19.935 -27.143 -4.612 1.00 30.43 H new ATOM 0 HB3 SER A 111 21.675 -27.316 -4.721 1.00 30.43 H new ATOM 0 HG SER A 111 20.739 -26.588 -6.714 1.00 64.21 H new ATOM 1775 N LYS A 112 22.388 -30.425 -5.800 1.00 61.33 N ATOM 1776 CA LYS A 112 22.994 -31.261 -6.829 1.00 15.13 C ATOM 1777 C LYS A 112 22.568 -32.717 -6.668 1.00 40.42 C ATOM 1778 O LYS A 112 22.038 -33.326 -7.598 1.00 42.34 O ATOM 1779 CB LYS A 112 24.519 -31.154 -6.769 1.00 52.23 C ATOM 1780 CG LYS A 112 25.172 -30.992 -8.131 1.00 30.13 C ATOM 1781 CD LYS A 112 25.028 -29.572 -8.653 1.00 32.14 C ATOM 1782 CE LYS A 112 26.347 -29.040 -9.191 1.00 0.25 C ATOM 1783 NZ LYS A 112 27.285 -28.668 -8.096 1.00 34.21 N ATOM 0 H LYS A 112 23.024 -30.151 -5.052 1.00 61.33 H new ATOM 0 HA LYS A 112 22.649 -30.906 -7.800 1.00 15.13 H new ATOM 0 HB2 LYS A 112 24.791 -30.305 -6.142 1.00 52.23 H new ATOM 0 HB3 LYS A 112 24.919 -32.047 -6.288 1.00 52.23 H new ATOM 0 HG2 LYS A 112 26.229 -31.250 -8.062 1.00 30.13 H new ATOM 0 HG3 LYS A 112 24.720 -31.688 -8.837 1.00 30.13 H new ATOM 0 HD2 LYS A 112 24.276 -29.548 -9.441 1.00 32.14 H new ATOM 0 HD3 LYS A 112 24.672 -28.923 -7.853 1.00 32.14 H new ATOM 0 HE2 LYS A 112 26.811 -29.795 -9.825 1.00 0.25 H new ATOM 0 HE3 LYS A 112 26.158 -28.169 -9.818 1.00 0.25 H new ATOM 0 HZ1 LYS A 112 28.172 -28.310 -8.505 1.00 34.21 H new ATOM 0 HZ2 LYS A 112 26.853 -27.929 -7.505 1.00 34.21 H new ATOM 0 HZ3 LYS A 112 27.486 -29.505 -7.512 1.00 34.21 H new ATOM 1797 N LYS A 113 22.802 -33.269 -5.483 1.00 41.23 N ATOM 1798 CA LYS A 113 22.442 -34.653 -5.198 1.00 15.24 C ATOM 1799 C LYS A 113 20.948 -34.879 -5.407 1.00 74.43 C ATOM 1800 O LYS A 113 20.517 -35.982 -5.744 1.00 40.31 O ATOM 1801 CB LYS A 113 22.829 -35.017 -3.764 1.00 73.45 C ATOM 1802 CG LYS A 113 23.955 -36.033 -3.676 1.00 5.22 C ATOM 1803 CD LYS A 113 25.189 -35.441 -3.013 1.00 33.13 C ATOM 1804 CE LYS A 113 26.268 -36.492 -2.805 1.00 0.23 C ATOM 1805 NZ LYS A 113 27.085 -36.697 -4.033 1.00 52.14 N ATOM 0 H LYS A 113 23.240 -32.779 -4.703 1.00 41.23 H new ATOM 0 HA LYS A 113 22.989 -35.295 -5.888 1.00 15.24 H new ATOM 0 HB2 LYS A 113 23.127 -34.111 -3.236 1.00 73.45 H new ATOM 0 HB3 LYS A 113 21.953 -35.413 -3.250 1.00 73.45 H new ATOM 0 HG2 LYS A 113 23.619 -36.902 -3.111 1.00 5.22 H new ATOM 0 HG3 LYS A 113 24.210 -36.382 -4.676 1.00 5.22 H new ATOM 0 HD2 LYS A 113 25.582 -34.632 -3.629 1.00 33.13 H new ATOM 0 HD3 LYS A 113 24.914 -35.006 -2.052 1.00 33.13 H new ATOM 0 HE2 LYS A 113 26.917 -36.189 -1.983 1.00 0.23 H new ATOM 0 HE3 LYS A 113 25.805 -37.435 -2.515 1.00 0.23 H new ATOM 0 HZ1 LYS A 113 27.809 -37.421 -3.851 1.00 52.14 H new ATOM 0 HZ2 LYS A 113 26.470 -37.011 -4.811 1.00 52.14 H new ATOM 0 HZ3 LYS A 113 27.547 -35.803 -4.296 1.00 52.14 H new ATOM 1819 N LYS A 114 20.160 -33.828 -5.204 1.00 45.22 N ATOM 1820 CA LYS A 114 18.715 -33.911 -5.372 1.00 1.23 C ATOM 1821 C LYS A 114 18.277 -33.226 -6.664 1.00 61.33 C ATOM 1822 O LYS A 114 17.166 -32.705 -6.754 1.00 50.42 O ATOM 1823 CB LYS A 114 18.004 -33.271 -4.177 1.00 61.14 C ATOM 1824 CG LYS A 114 18.143 -34.066 -2.890 1.00 43.32 C ATOM 1825 CD LYS A 114 17.259 -35.301 -2.900 1.00 61.50 C ATOM 1826 CE LYS A 114 15.968 -35.067 -2.128 1.00 72.25 C ATOM 1827 NZ LYS A 114 15.441 -36.327 -1.535 1.00 11.22 N ATOM 0 H LYS A 114 20.499 -32.908 -4.923 1.00 45.22 H new ATOM 0 HA LYS A 114 18.441 -34.964 -5.429 1.00 1.23 H new ATOM 0 HB2 LYS A 114 18.404 -32.269 -4.021 1.00 61.14 H new ATOM 0 HB3 LYS A 114 16.946 -33.158 -4.412 1.00 61.14 H new ATOM 0 HG2 LYS A 114 19.183 -34.363 -2.755 1.00 43.32 H new ATOM 0 HG3 LYS A 114 17.879 -33.435 -2.041 1.00 43.32 H new ATOM 0 HD2 LYS A 114 17.025 -35.574 -3.929 1.00 61.50 H new ATOM 0 HD3 LYS A 114 17.799 -36.140 -2.462 1.00 61.50 H new ATOM 0 HE2 LYS A 114 16.145 -34.339 -1.336 1.00 72.25 H new ATOM 0 HE3 LYS A 114 15.219 -34.638 -2.794 1.00 72.25 H new ATOM 0 HZ1 LYS A 114 14.562 -36.126 -1.018 1.00 11.22 H new ATOM 0 HZ2 LYS A 114 15.248 -37.013 -2.292 1.00 11.22 H new ATOM 0 HZ3 LYS A 114 16.145 -36.723 -0.880 1.00 11.22 H new ATOM 1841 N ALA A 115 19.157 -33.231 -7.659 1.00 50.05 N ATOM 1842 CA ALA A 115 18.860 -32.614 -8.945 1.00 71.11 C ATOM 1843 C ALA A 115 17.695 -33.316 -9.634 1.00 54.41 C ATOM 1844 O ALA A 115 16.957 -32.701 -10.404 1.00 74.21 O ATOM 1845 CB ALA A 115 20.093 -32.632 -9.837 1.00 74.11 C ATOM 0 H ALA A 115 20.082 -33.656 -7.599 1.00 50.05 H new ATOM 0 HA ALA A 115 18.571 -31.578 -8.765 1.00 71.11 H new ATOM 0 HB1 ALA A 115 19.856 -32.168 -10.794 1.00 74.11 H new ATOM 0 HB2 ALA A 115 20.899 -32.079 -9.355 1.00 74.11 H new ATOM 0 HB3 ALA A 115 20.408 -33.662 -10.001 1.00 74.11 H new ATOM 1851 N GLN A 116 17.538 -34.607 -9.355 1.00 25.33 N ATOM 1852 CA GLN A 116 16.464 -35.391 -9.951 1.00 31.41 C ATOM 1853 C GLN A 116 15.102 -34.917 -9.451 1.00 14.20 C ATOM 1854 O GLN A 116 14.282 -34.430 -10.229 1.00 75.03 O ATOM 1855 CB GLN A 116 16.649 -36.875 -9.629 1.00 54.25 C ATOM 1856 CG GLN A 116 17.738 -37.544 -10.452 1.00 70.43 C ATOM 1857 CD GLN A 116 18.253 -38.818 -9.812 1.00 43.22 C ATOM 1858 OE1 GLN A 116 18.899 -38.783 -8.763 1.00 31.45 O ATOM 1859 NE2 GLN A 116 17.971 -39.953 -10.440 1.00 13.52 N ATOM 0 H GLN A 116 18.141 -35.131 -8.720 1.00 25.33 H new ATOM 0 HA GLN A 116 16.503 -35.252 -11.031 1.00 31.41 H new ATOM 0 HB2 GLN A 116 16.887 -36.982 -8.571 1.00 54.25 H new ATOM 0 HB3 GLN A 116 15.706 -37.395 -9.798 1.00 54.25 H new ATOM 0 HG2 GLN A 116 17.350 -37.772 -11.445 1.00 70.43 H new ATOM 0 HG3 GLN A 116 18.566 -36.848 -10.586 1.00 70.43 H new ATOM 0 HE21 GLN A 116 17.433 -39.936 -11.306 1.00 13.52 H new ATOM 0 HE22 GLN A 116 18.292 -40.842 -10.056 1.00 13.52 H new ATOM 1868 N GLN A 117 14.871 -35.063 -8.151 1.00 21.41 N ATOM 1869 CA GLN A 117 13.608 -34.650 -7.550 1.00 73.23 C ATOM 1870 C GLN A 117 12.430 -35.334 -8.235 1.00 21.15 C ATOM 1871 O GLN A 117 11.325 -34.793 -8.280 1.00 25.12 O ATOM 1872 CB GLN A 117 13.451 -33.131 -7.634 1.00 1.45 C ATOM 1873 CG GLN A 117 12.570 -32.548 -6.541 1.00 72.12 C ATOM 1874 CD GLN A 117 11.754 -31.364 -7.019 1.00 24.15 C ATOM 1875 OE1 GLN A 117 12.302 -30.370 -7.497 1.00 54.41 O ATOM 1876 NE2 GLN A 117 10.435 -31.462 -6.891 1.00 5.32 N ATOM 0 H GLN A 117 15.541 -35.464 -7.494 1.00 21.41 H new ATOM 0 HA GLN A 117 13.619 -34.949 -6.502 1.00 73.23 H new ATOM 0 HB2 GLN A 117 14.437 -32.669 -7.579 1.00 1.45 H new ATOM 0 HB3 GLN A 117 13.030 -32.871 -8.605 1.00 1.45 H new ATOM 0 HG2 GLN A 117 11.898 -33.322 -6.170 1.00 72.12 H new ATOM 0 HG3 GLN A 117 13.194 -32.239 -5.702 1.00 72.12 H new ATOM 0 HE21 GLN A 117 10.023 -32.304 -6.489 1.00 5.32 H new ATOM 0 HE22 GLN A 117 9.835 -30.695 -7.194 1.00 5.32 H new ATOM 1885 N ALA A 118 12.672 -36.527 -8.768 1.00 64.10 N ATOM 1886 CA ALA A 118 11.630 -37.286 -9.450 1.00 64.32 C ATOM 1887 C ALA A 118 12.116 -38.686 -9.807 1.00 2.11 C ATOM 1888 O ALA A 118 11.402 -39.669 -9.613 1.00 53.22 O ATOM 1889 CB ALA A 118 11.173 -36.548 -10.698 1.00 31.15 C ATOM 0 H ALA A 118 13.581 -36.989 -8.741 1.00 64.10 H new ATOM 0 HA ALA A 118 10.783 -37.387 -8.771 1.00 64.32 H new ATOM 0 HB1 ALA A 118 10.395 -37.125 -11.198 1.00 31.15 H new ATOM 0 HB2 ALA A 118 10.777 -35.571 -10.419 1.00 31.15 H new ATOM 0 HB3 ALA A 118 12.018 -36.417 -11.374 1.00 31.15 H new ATOM 1895 N ALA A 119 13.334 -38.768 -10.332 1.00 52.35 N ATOM 1896 CA ALA A 119 13.916 -40.049 -10.716 1.00 10.00 C ATOM 1897 C ALA A 119 14.648 -40.693 -9.544 1.00 32.10 C ATOM 1898 O ALA A 119 14.790 -41.914 -9.483 1.00 54.40 O ATOM 1899 CB ALA A 119 14.861 -39.867 -11.895 1.00 2.14 C ATOM 0 H ALA A 119 13.937 -37.963 -10.501 1.00 52.35 H new ATOM 0 HA ALA A 119 13.105 -40.714 -11.013 1.00 10.00 H new ATOM 0 HB1 ALA A 119 15.288 -40.831 -12.171 1.00 2.14 H new ATOM 0 HB2 ALA A 119 14.311 -39.458 -12.742 1.00 2.14 H new ATOM 0 HB3 ALA A 119 15.662 -39.182 -11.617 1.00 2.14 H new ATOM 1905 N ALA A 120 15.111 -39.864 -8.613 1.00 11.03 N ATOM 1906 CA ALA A 120 15.827 -40.354 -7.442 1.00 12.13 C ATOM 1907 C ALA A 120 14.972 -41.336 -6.647 1.00 45.33 C ATOM 1908 O ALA A 120 15.390 -42.464 -6.384 1.00 30.01 O ATOM 1909 CB ALA A 120 16.255 -39.190 -6.561 1.00 62.35 C ATOM 0 H ALA A 120 15.003 -38.850 -8.648 1.00 11.03 H new ATOM 0 HA ALA A 120 16.717 -40.882 -7.785 1.00 12.13 H new ATOM 0 HB1 ALA A 120 16.789 -39.570 -5.690 1.00 62.35 H new ATOM 0 HB2 ALA A 120 16.909 -38.527 -7.127 1.00 62.35 H new ATOM 0 HB3 ALA A 120 15.374 -38.638 -6.234 1.00 62.35 H new ATOM 1915 N ASP A 121 13.778 -40.900 -6.267 1.00 1.25 N ATOM 1916 CA ASP A 121 12.864 -41.740 -5.502 1.00 55.02 C ATOM 1917 C ASP A 121 11.741 -42.269 -6.389 1.00 30.54 C ATOM 1918 O ASP A 121 10.562 -42.019 -6.131 1.00 71.41 O ATOM 1919 CB ASP A 121 12.278 -40.957 -4.327 1.00 64.20 C ATOM 1920 CG ASP A 121 13.336 -40.536 -3.326 1.00 31.03 C ATOM 1921 OD1 ASP A 121 13.760 -41.389 -2.518 1.00 45.43 O ATOM 1922 OD2 ASP A 121 13.740 -39.355 -3.351 1.00 43.23 O ATOM 0 H ASP A 121 13.419 -39.968 -6.476 1.00 1.25 H new ATOM 0 HA ASP A 121 13.428 -42.589 -5.116 1.00 55.02 H new ATOM 0 HB2 ASP A 121 11.766 -40.072 -4.704 1.00 64.20 H new ATOM 0 HB3 ASP A 121 11.529 -41.569 -3.824 1.00 64.20 H new ATOM 1927 N THR A 122 12.113 -42.999 -7.435 1.00 33.13 N ATOM 1928 CA THR A 122 11.137 -43.560 -8.361 1.00 55.22 C ATOM 1929 C THR A 122 10.198 -44.528 -7.650 1.00 31.22 C ATOM 1930 O THR A 122 9.019 -44.235 -7.455 1.00 31.02 O ATOM 1931 CB THR A 122 11.826 -44.295 -9.526 1.00 1.05 C ATOM 1932 OG1 THR A 122 12.694 -43.395 -10.227 1.00 70.50 O ATOM 1933 CG2 THR A 122 10.798 -44.868 -10.490 1.00 23.34 C ATOM 0 H THR A 122 13.083 -43.216 -7.662 1.00 33.13 H new ATOM 0 HA THR A 122 10.561 -42.724 -8.758 1.00 55.22 H new ATOM 0 HB THR A 122 12.410 -45.117 -9.113 1.00 1.05 H new ATOM 0 HG1 THR A 122 13.398 -43.081 -9.622 1.00 70.50 H new ATOM 0 HG21 THR A 122 11.309 -45.382 -11.304 1.00 23.34 H new ATOM 0 HG22 THR A 122 10.157 -45.573 -9.961 1.00 23.34 H new ATOM 0 HG23 THR A 122 10.190 -44.060 -10.897 1.00 23.34 H new ATOM 1941 N GLY A 123 10.729 -45.684 -7.263 1.00 33.05 N ATOM 1942 CA GLY A 123 9.924 -46.677 -6.578 1.00 74.41 C ATOM 1943 C GLY A 123 9.959 -46.513 -5.071 1.00 74.21 C ATOM 1944 O GLY A 123 8.920 -46.538 -4.413 1.00 1.45 O ATOM 0 H GLY A 123 11.702 -45.950 -7.412 1.00 33.05 H new ATOM 0 HA2 GLY A 123 8.893 -46.606 -6.924 1.00 74.41 H new ATOM 0 HA3 GLY A 123 10.280 -47.673 -6.840 1.00 74.41 H new ATOM 1948 N ASN A 124 11.159 -46.348 -4.524 1.00 64.12 N ATOM 1949 CA ASN A 124 11.326 -46.182 -3.085 1.00 41.03 C ATOM 1950 C ASN A 124 10.878 -44.792 -2.642 1.00 21.50 C ATOM 1951 O ASN A 124 10.345 -44.018 -3.436 1.00 34.30 O ATOM 1952 CB ASN A 124 12.787 -46.409 -2.691 1.00 21.44 C ATOM 1953 CG ASN A 124 12.923 -47.220 -1.416 1.00 4.11 C ATOM 1954 OD1 ASN A 124 13.100 -46.666 -0.331 1.00 35.52 O ATOM 1955 ND2 ASN A 124 12.840 -48.539 -1.543 1.00 45.23 N ATOM 0 H ASN A 124 12.029 -46.326 -5.055 1.00 64.12 H new ATOM 0 HA ASN A 124 10.702 -46.922 -2.584 1.00 41.03 H new ATOM 0 HB2 ASN A 124 13.304 -46.923 -3.502 1.00 21.44 H new ATOM 0 HB3 ASN A 124 13.279 -45.445 -2.560 1.00 21.44 H new ATOM 0 HD21 ASN A 124 12.924 -49.137 -0.721 1.00 45.23 H new ATOM 0 HD22 ASN A 124 12.693 -48.955 -2.463 1.00 45.23 H new ATOM 1962 N ASN A 125 11.099 -44.482 -1.369 1.00 72.33 N ATOM 1963 CA ASN A 125 10.718 -43.186 -0.820 1.00 62.22 C ATOM 1964 C ASN A 125 11.893 -42.536 -0.095 1.00 2.22 C ATOM 1965 O ASN A 125 12.920 -43.173 0.140 1.00 12.23 O ATOM 1966 CB ASN A 125 9.536 -43.343 0.139 1.00 71.21 C ATOM 1967 CG ASN A 125 8.204 -43.095 -0.540 1.00 2.33 C ATOM 1968 OD1 ASN A 125 7.961 -43.572 -1.649 1.00 62.20 O ATOM 1969 ND2 ASN A 125 7.333 -42.344 0.123 1.00 23.45 N ATOM 0 H ASN A 125 11.540 -45.111 -0.698 1.00 72.33 H new ATOM 0 HA ASN A 125 10.423 -42.541 -1.647 1.00 62.22 H new ATOM 0 HB2 ASN A 125 9.544 -44.348 0.560 1.00 71.21 H new ATOM 0 HB3 ASN A 125 9.652 -42.648 0.971 1.00 71.21 H new ATOM 0 HD21 ASN A 125 6.420 -42.142 -0.284 1.00 23.45 H new ATOM 0 HD22 ASN A 125 7.577 -41.969 1.040 1.00 23.45 H new ATOM 1976 N SER A 126 11.733 -41.265 0.258 1.00 4.53 N ATOM 1977 CA SER A 126 12.782 -40.526 0.953 1.00 32.13 C ATOM 1978 C SER A 126 12.374 -40.230 2.392 1.00 74.51 C ATOM 1979 O SER A 126 11.188 -40.236 2.726 1.00 50.41 O ATOM 1980 CB SER A 126 13.087 -39.220 0.218 1.00 42.11 C ATOM 1981 OG SER A 126 12.458 -38.119 0.851 1.00 34.24 O ATOM 0 H SER A 126 10.887 -40.725 0.075 1.00 4.53 H new ATOM 0 HA SER A 126 13.680 -41.144 0.968 1.00 32.13 H new ATOM 0 HB2 SER A 126 14.165 -39.059 0.188 1.00 42.11 H new ATOM 0 HB3 SER A 126 12.747 -39.292 -0.815 1.00 42.11 H new ATOM 0 HG SER A 126 12.670 -37.296 0.363 1.00 34.24 H new ATOM 1987 N GLN A 127 13.363 -39.972 3.240 1.00 44.30 N ATOM 1988 CA GLN A 127 13.108 -39.674 4.644 1.00 24.50 C ATOM 1989 C GLN A 127 13.606 -38.278 5.004 1.00 21.15 C ATOM 1990 O GLN A 127 14.316 -37.641 4.225 1.00 64.24 O ATOM 1991 CB GLN A 127 13.783 -40.714 5.539 1.00 51.24 C ATOM 1992 CG GLN A 127 13.088 -40.911 6.877 1.00 12.13 C ATOM 1993 CD GLN A 127 13.489 -42.203 7.560 1.00 53.54 C ATOM 1994 OE1 GLN A 127 13.087 -43.290 7.143 1.00 23.42 O ATOM 1995 NE2 GLN A 127 14.287 -42.092 8.615 1.00 2.52 N ATOM 0 H GLN A 127 14.349 -39.963 2.979 1.00 44.30 H new ATOM 0 HA GLN A 127 12.031 -39.709 4.806 1.00 24.50 H new ATOM 0 HB2 GLN A 127 13.815 -41.668 5.012 1.00 51.24 H new ATOM 0 HB3 GLN A 127 14.815 -40.413 5.717 1.00 51.24 H new ATOM 0 HG2 GLN A 127 13.323 -40.071 7.531 1.00 12.13 H new ATOM 0 HG3 GLN A 127 12.009 -40.905 6.725 1.00 12.13 H new ATOM 0 HE21 GLN A 127 14.596 -41.171 8.926 1.00 2.52 H new ATOM 0 HE22 GLN A 127 14.591 -42.928 9.115 1.00 2.52 H new ATOM 2004 N VAL A 128 13.227 -37.806 6.188 1.00 11.53 N ATOM 2005 CA VAL A 128 13.635 -36.485 6.651 1.00 12.02 C ATOM 2006 C VAL A 128 13.913 -36.490 8.150 1.00 34.15 C ATOM 2007 O VAL A 128 13.152 -37.063 8.931 1.00 41.04 O ATOM 2008 CB VAL A 128 12.560 -35.426 6.342 1.00 65.43 C ATOM 2009 CG1 VAL A 128 13.061 -34.036 6.705 1.00 52.22 C ATOM 2010 CG2 VAL A 128 12.154 -35.490 4.878 1.00 70.14 C ATOM 0 H VAL A 128 12.638 -38.319 6.844 1.00 11.53 H new ATOM 0 HA VAL A 128 14.550 -36.230 6.116 1.00 12.02 H new ATOM 0 HB VAL A 128 11.680 -35.639 6.948 1.00 65.43 H new ATOM 0 HG11 VAL A 128 12.289 -33.301 6.480 1.00 52.22 H new ATOM 0 HG12 VAL A 128 13.297 -34.001 7.769 1.00 52.22 H new ATOM 0 HG13 VAL A 128 13.957 -33.810 6.127 1.00 52.22 H new ATOM 0 HG21 VAL A 128 11.394 -34.735 4.678 1.00 70.14 H new ATOM 0 HG22 VAL A 128 13.025 -35.303 4.250 1.00 70.14 H new ATOM 0 HG23 VAL A 128 11.751 -36.478 4.655 1.00 70.14 H new ATOM 2020 N SER A 129 15.007 -35.848 8.546 1.00 2.11 N ATOM 2021 CA SER A 129 15.388 -35.780 9.952 1.00 31.13 C ATOM 2022 C SER A 129 15.522 -34.332 10.409 1.00 24.04 C ATOM 2023 O SER A 129 15.997 -33.476 9.663 1.00 22.11 O ATOM 2024 CB SER A 129 16.704 -36.524 10.182 1.00 41.34 C ATOM 2025 OG SER A 129 16.473 -37.887 10.491 1.00 63.14 O ATOM 0 H SER A 129 15.646 -35.367 7.913 1.00 2.11 H new ATOM 0 HA SER A 129 14.603 -36.256 10.539 1.00 31.13 H new ATOM 0 HB2 SER A 129 17.327 -36.451 9.291 1.00 41.34 H new ATOM 0 HB3 SER A 129 17.255 -36.052 10.996 1.00 41.34 H new ATOM 0 HG SER A 129 17.330 -38.340 10.632 1.00 63.14 H new ATOM 2031 N GLN A 130 15.099 -34.064 11.641 1.00 54.42 N ATOM 2032 CA GLN A 130 15.171 -32.719 12.198 1.00 65.30 C ATOM 2033 C GLN A 130 16.196 -32.652 13.326 1.00 4.55 C ATOM 2034 O GLN A 130 16.604 -33.676 13.870 1.00 14.51 O ATOM 2035 CB GLN A 130 13.799 -32.283 12.715 1.00 72.24 C ATOM 2036 CG GLN A 130 12.856 -31.817 11.618 1.00 10.51 C ATOM 2037 CD GLN A 130 11.698 -32.769 11.398 1.00 21.53 C ATOM 2038 OE1 GLN A 130 10.653 -32.653 12.040 1.00 24.01 O ATOM 2039 NE2 GLN A 130 11.876 -33.720 10.488 1.00 23.53 N ATOM 0 H GLN A 130 14.703 -34.761 12.272 1.00 54.42 H new ATOM 0 HA GLN A 130 15.484 -32.041 11.404 1.00 65.30 H new ATOM 0 HB2 GLN A 130 13.340 -33.115 13.248 1.00 72.24 H new ATOM 0 HB3 GLN A 130 13.931 -31.476 13.436 1.00 72.24 H new ATOM 0 HG2 GLN A 130 12.467 -30.831 11.874 1.00 10.51 H new ATOM 0 HG3 GLN A 130 13.413 -31.708 10.688 1.00 10.51 H new ATOM 0 HE21 GLN A 130 12.758 -33.780 9.979 1.00 23.53 H new ATOM 0 HE22 GLN A 130 11.131 -34.390 10.298 1.00 23.53 H new ATOM 2048 N ASN A 131 16.609 -31.436 13.670 1.00 65.14 N ATOM 2049 CA ASN A 131 17.589 -31.234 14.733 1.00 12.23 C ATOM 2050 C ASN A 131 17.569 -29.790 15.223 1.00 40.40 C ATOM 2051 O ASN A 131 17.638 -28.852 14.429 1.00 14.13 O ATOM 2052 CB ASN A 131 18.991 -31.598 14.238 1.00 34.32 C ATOM 2053 CG ASN A 131 19.678 -32.605 15.139 1.00 62.41 C ATOM 2054 OD1 ASN A 131 20.485 -32.240 15.994 1.00 63.51 O ATOM 2055 ND2 ASN A 131 19.360 -33.881 14.952 1.00 30.15 N ATOM 0 H ASN A 131 16.281 -30.577 13.229 1.00 65.14 H new ATOM 0 HA ASN A 131 17.325 -31.885 15.566 1.00 12.23 H new ATOM 0 HB2 ASN A 131 18.923 -32.004 13.229 1.00 34.32 H new ATOM 0 HB3 ASN A 131 19.598 -30.695 14.178 1.00 34.32 H new ATOM 0 HD21 ASN A 131 19.790 -34.604 15.529 1.00 30.15 H new ATOM 0 HD22 ASN A 131 18.686 -34.138 14.231 1.00 30.15 H new ATOM 2062 N TYR A 132 17.475 -29.618 16.537 1.00 72.40 N ATOM 2063 CA TYR A 132 17.444 -28.288 17.134 1.00 40.13 C ATOM 2064 C TYR A 132 18.699 -28.035 17.965 1.00 14.30 C ATOM 2065 O TYR A 132 19.536 -28.930 18.082 1.00 1.12 O ATOM 2066 CB TYR A 132 16.200 -28.127 18.007 1.00 63.53 C ATOM 2067 CG TYR A 132 16.060 -29.198 19.067 1.00 3.12 C ATOM 2068 CD1 TYR A 132 16.715 -29.084 20.287 1.00 55.10 C ATOM 2069 CD2 TYR A 132 15.274 -30.323 18.847 1.00 42.51 C ATOM 2070 CE1 TYR A 132 16.591 -30.060 21.258 1.00 14.51 C ATOM 2071 CE2 TYR A 132 15.144 -31.302 19.812 1.00 13.24 C ATOM 2072 CZ TYR A 132 15.804 -31.167 21.015 1.00 22.34 C ATOM 2073 OH TYR A 132 15.677 -32.141 21.978 1.00 54.23 O ATOM 0 H TYR A 132 17.419 -30.383 17.209 1.00 72.40 H new ATOM 0 HA TYR A 132 17.410 -27.556 16.327 1.00 40.13 H new ATOM 0 HB2 TYR A 132 16.230 -27.151 18.491 1.00 63.53 H new ATOM 0 HB3 TYR A 132 15.315 -28.140 17.370 1.00 63.53 H new ATOM 0 HD1 TYR A 132 17.331 -28.218 20.480 1.00 55.10 H new ATOM 0 HD2 TYR A 132 14.756 -30.433 17.906 1.00 42.51 H new ATOM 0 HE1 TYR A 132 17.107 -29.957 22.201 1.00 14.51 H new ATOM 0 HE2 TYR A 132 14.528 -32.169 19.625 1.00 13.24 H new ATOM 0 HH TYR A 132 15.087 -32.851 21.649 1.00 54.23 H new TER 2083 TYR A 132 HETATM 2084 C1 PIO A 300 33.872 -5.992 12.529 1.00 64.53 C HETATM 2085 C2 PIO A 300 33.754 -6.490 14.010 1.00 64.45 C HETATM 2086 C3 PIO A 300 33.467 -8.008 14.051 1.00 31.31 C HETATM 2087 C4 PIO A 300 34.574 -8.823 13.277 1.00 32.33 C HETATM 2088 C5 PIO A 300 34.649 -8.289 11.791 1.00 44.43 C HETATM 2089 C6 PIO A 300 34.929 -6.766 11.721 1.00 15.41 C HETATM 2090 O1 PIO A 300 34.197 -4.502 12.361 1.00 2.22 O HETATM 2091 O2 PIO A 300 34.917 -6.217 14.786 1.00 71.51 O HETATM 2092 O3 PIO A 300 33.376 -8.400 15.428 1.00 61.34 O HETATM 2093 O4 PIO A 300 34.224 -10.301 13.301 1.00 4.43 O HETATM 2094 O5 PIO A 300 35.720 -9.002 11.091 1.00 74.34 O HETATM 2095 O6 PIO A 300 34.882 -6.265 10.376 1.00 24.13 O HETATM 2096 P1 PIO A 300 33.290 -3.118 12.593 1.00 4.12 P HETATM 2097 O11 PIO A 300 31.886 -3.666 12.855 1.00 32.33 O HETATM 2098 O12 PIO A 300 33.979 -2.415 13.733 1.00 22.30 O HETATM 2099 O13 PIO A 300 33.398 -2.305 11.337 1.00 34.35 O HETATM 2100 P4 PIO A 300 35.184 -11.656 13.158 1.00 43.03 P HETATM 2101 O41 PIO A 300 35.031 -12.198 14.577 1.00 52.04 O HETATM 2102 O42 PIO A 300 34.537 -12.497 12.093 1.00 55.10 O HETATM 2103 O43 PIO A 300 36.593 -11.251 12.759 1.00 43.10 O HETATM 2104 P5 PIO A 300 35.913 -9.518 9.537 1.00 35.44 P HETATM 2105 O53 PIO A 300 36.426 -8.287 8.827 1.00 2.31 O HETATM 2106 O52 PIO A 300 34.512 -9.952 9.134 1.00 41.42 O HETATM 2107 O51 PIO A 300 36.953 -10.602 9.736 1.00 62.30 O HETATM 2108 C1C PIO A 300 33.306 -2.959 10.088 1.00 52.43 C HETATM 2109 C2C PIO A 300 31.843 -3.335 9.747 1.00 43.13 C HETATM 2110 C3C PIO A 300 30.901 -2.109 9.808 1.00 1.14 C HETATM 2111 O2C PIO A 300 31.810 -3.879 8.439 1.00 44.41 O HETATM 2112 O3C PIO A 300 31.608 -0.958 9.392 1.00 65.20 O HETATM 2113 C1A PIO A 300 32.075 -5.264 8.300 1.00 0.02 C HETATM 2114 O1A PIO A 300 33.090 -5.644 7.760 1.00 22.41 O HETATM 2115 C2A PIO A 300 31.072 -6.292 8.853 1.00 4.03 C HETATM 2116 C3A PIO A 300 30.937 -7.479 7.882 1.00 61.42 C HETATM 2117 C4A PIO A 300 30.113 -8.595 8.550 1.00 73.42 C HETATM 2118 C5A PIO A 300 30.932 -9.229 9.690 1.00 0.00 C HETATM 2119 C6A PIO A 300 31.439 -10.615 9.250 1.00 21.42 C HETATM 2120 C7A PIO A 300 31.899 -11.410 10.487 1.00 32.15 C HETATM 2121 C8A PIO A 300 31.582 -12.903 10.285 1.00 71.12 C HETATM 2122 C1B PIO A 300 31.955 0.069 10.292 1.00 3.54 C HETATM 2123 O1B PIO A 300 31.548 0.154 11.434 1.00 73.34 O HETATM 2124 C2B PIO A 300 32.881 1.177 9.712 1.00 70.35 C HETATM 2125 C3B PIO A 300 32.631 2.565 10.326 1.00 50.42 C HETATM 2126 C4B PIO A 300 33.710 3.570 9.882 1.00 33.34 C HETATM 2127 C5B PIO A 300 33.031 4.791 9.233 1.00 24.42 C HETATM 2128 C6B PIO A 300 33.925 6.031 9.416 1.00 70.30 C HETATM 2129 C7B PIO A 300 35.046 6.016 8.360 1.00 12.33 C HETATM 2130 C8B PIO A 300 36.347 6.553 8.987 1.00 54.42 C HETATM 0 H8BB PIO A 300 36.189 7.574 9.335 1.00 54.42 H new HETATM 0 H8BA PIO A 300 36.632 5.923 9.829 1.00 54.42 H new HETATM 0 H8AB PIO A 300 30.508 -13.032 10.149 1.00 71.12 H new HETATM 0 H8AA PIO A 300 32.106 -13.270 9.402 1.00 71.12 H new HETATM 0 H7BA PIO A 300 35.199 5.002 7.990 1.00 12.33 H new HETATM 0 H7AA PIO A 300 32.969 -11.272 10.644 1.00 32.15 H new HETATM 0 H6BA PIO A 300 33.330 6.939 9.318 1.00 70.30 H new HETATM 0 H6AA PIO A 300 30.648 -11.156 8.731 1.00 21.42 H new HETATM 0 H5BA PIO A 300 32.861 4.605 8.173 1.00 24.42 H new HETATM 0 H5AA PIO A 300 31.774 -8.587 9.947 1.00 0.00 H new HETATM 0 H4BA PIO A 300 34.306 3.884 10.739 1.00 33.34 H new HETATM 0 H4AA PIO A 300 29.180 -8.188 8.941 1.00 73.42 H new HETATM 0 H3CA PIO A 300 30.034 -2.269 9.167 1.00 1.14 H new HETATM 0 H3BA PIO A 300 31.647 2.927 10.026 1.00 50.42 H new HETATM 0 H3AA PIO A 300 30.453 -7.156 6.961 1.00 61.42 H new HETATM 0 H2BA PIO A 300 33.921 0.896 9.879 1.00 70.35 H new HETATM 0 H2AA PIO A 300 31.404 -6.647 9.829 1.00 4.03 H new HETATM 0 H1CA PIO A 300 33.707 -2.312 9.308 1.00 52.43 H new HETATM 0 HO6 PIO A 300 35.399 -6.855 9.789 1.00 24.13 H new HETATM 0 HO3 PIO A 300 33.193 -9.361 15.483 1.00 61.34 H new HETATM 0 HO2 PIO A 300 34.964 -6.845 15.537 1.00 71.51 H new HETATM 0 H8B PIO A 300 37.142 6.543 8.241 1.00 54.42 H new HETATM 0 H8A PIO A 300 31.907 -13.466 11.160 1.00 71.12 H new HETATM 0 H7B PIO A 300 34.762 6.628 7.504 1.00 12.33 H new HETATM 0 H7A PIO A 300 31.396 -11.038 11.379 1.00 32.15 H new HETATM 0 H6B PIO A 300 34.355 6.038 10.418 1.00 70.30 H new HETATM 0 H6A PIO A 300 32.265 -10.506 8.547 1.00 21.42 H new HETATM 0 H6 PIO A 300 35.929 -6.621 12.128 1.00 15.41 H new HETATM 0 H5B PIO A 300 32.055 4.962 9.687 1.00 24.42 H new HETATM 0 H5A PIO A 300 30.317 -9.322 10.585 1.00 0.00 H new HETATM 0 H5 PIO A 300 33.680 -8.466 11.324 1.00 44.43 H new HETATM 0 H4B PIO A 300 34.392 3.100 9.174 1.00 33.34 H new HETATM 0 H4A PIO A 300 29.846 -9.354 7.815 1.00 73.42 H new HETATM 0 H4 PIO A 300 35.546 -8.693 13.753 1.00 32.33 H new HETATM 0 H3C PIO A 300 30.526 -1.973 10.823 1.00 1.14 H new HETATM 0 H3B PIO A 300 32.625 2.489 11.413 1.00 50.42 H new HETATM 0 H3A PIO A 300 31.923 -7.854 7.609 1.00 61.42 H new HETATM 0 H3 PIO A 300 32.526 -8.228 13.546 1.00 31.31 H new HETATM 0 H2C PIO A 300 31.496 -4.059 10.484 1.00 43.13 H new HETATM 0 H2B PIO A 300 32.736 1.234 8.633 1.00 70.35 H new HETATM 0 H2A PIO A 300 30.100 -5.820 9.000 1.00 4.03 H new HETATM 0 H2 PIO A 300 32.925 -5.935 14.449 1.00 64.45 H new HETATM 0 H1C PIO A 300 33.920 -3.860 10.102 1.00 52.43 H new HETATM 0 H1 PIO A 300 32.867 -6.176 12.150 1.00 64.53 H new