USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 917 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 33 LYS NZ :NH3+ 153:sc= 0.828 (180deg=0) USER MOD Set 1.2: A 66 TYR OH : rot 180:sc= 0.738 USER MOD Set 2.1: A 6 CYS SG : rot 69:sc= -0.787! USER MOD Set 2.2: A 9 THR OG1 : rot -28:sc= -0.046 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -169:sc= 0 (180deg=-0.0672) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ -143:sc= 0.0238 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -2.43! C(o=-2.4!,f=-4!) USER MOD Single : A 17 SER OG : rot 180:sc= -0.0797 USER MOD Single : A 20 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0252) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.271 USER MOD Single : A 26 TYR OH : rot -165:sc= 1.04 USER MOD Single : A 27 GLN : amide:sc= -2.07 X(o=-2.1,f=-2!) USER MOD Single : A 29 MET CE :methyl -153:sc= -2.92! (180deg=-4.24!) USER MOD Single : A 32 THR OG1 : rot -83:sc= -0.187 USER MOD Single : A 34 SER OG : rot -25:sc= 0.00685 USER MOD Single : A 35 SER OG : rot 14:sc= 1.17 USER MOD Single : A 36 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.057) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0217) USER MOD Single : A 45 LYS NZ :NH3+ -159:sc= 1.25 (180deg=1.13) USER MOD Single : A 48 LYS NZ :NH3+ -171:sc= -0.0117 (180deg=-0.14) USER MOD Single : A 49 GLN : amide:sc= -0.227 X(o=-0.23,f=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 166:sc= -0.0301 (180deg=-0.234) USER MOD Single : A 62 SER OG : rot 76:sc= 0.345 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 70 MET CE :methyl 160:sc= -0.155 (180deg=-0.654) USER MOD Single : A 72 LYS NZ :NH3+ 156:sc= -0.164 (180deg=-0.655) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0.47) USER MOD Single : A 75 LYS NZ :NH3+ 163:sc= -0.0905 (180deg=-0.448) USER MOD Single : A 79 LYS NZ :NH3+ 168:sc= -0.0207 (180deg=-0.205) USER MOD Single : A 80 MET CE :methyl 158:sc= -0.161 (180deg=-0.744) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot -41:sc= 0.473 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00647) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -2.285 -9.265 -27.962 1.00 75.01 N ATOM 2 CA GLY A -1 -2.260 -8.660 -26.641 1.00 23.10 C ATOM 3 C GLY A -1 -2.714 -7.228 -26.690 1.00 42.15 C ATOM 4 O GLY A -1 -3.666 -6.903 -27.411 1.00 0.10 O ATOM 0 H1 GLY A -1 -2.589 -10.257 -27.884 1.00 75.01 H new ATOM 0 H2 GLY A -1 -2.951 -8.746 -28.569 1.00 75.01 H new ATOM 0 H3 GLY A -1 -1.333 -9.226 -28.380 1.00 75.01 H new ATOM 0 HA2 GLY A -1 -2.904 -9.225 -25.967 1.00 23.10 H new ATOM 0 HA3 GLY A -1 -1.250 -8.710 -26.234 1.00 23.10 H new ATOM 10 N SER A 0 -2.022 -6.381 -25.939 1.00 13.13 N ATOM 11 CA SER A 0 -2.294 -4.953 -25.834 1.00 13.45 C ATOM 12 C SER A 0 -3.752 -4.626 -25.469 1.00 55.30 C ATOM 13 O SER A 0 -4.560 -4.265 -26.329 1.00 10.43 O ATOM 14 CB SER A 0 -1.853 -4.210 -27.094 1.00 5.03 C ATOM 15 OG SER A 0 -0.477 -4.453 -27.360 1.00 74.31 O ATOM 0 H SER A 0 -1.231 -6.678 -25.368 1.00 13.13 H new ATOM 0 HA SER A 0 -1.694 -4.596 -24.997 1.00 13.45 H new ATOM 0 HB2 SER A 0 -2.456 -4.532 -27.943 1.00 5.03 H new ATOM 0 HB3 SER A 0 -2.022 -3.140 -26.970 1.00 5.03 H new ATOM 0 HG SER A 0 -0.211 -3.972 -28.171 1.00 74.31 H new ATOM 21 N MET A 1 -4.097 -4.837 -24.218 1.00 51.14 N ATOM 22 CA MET A 1 -5.410 -4.475 -23.721 1.00 50.21 C ATOM 23 C MET A 1 -5.269 -3.353 -22.739 1.00 62.00 C ATOM 24 O MET A 1 -4.293 -3.313 -21.982 1.00 2.50 O ATOM 25 CB MET A 1 -6.154 -5.642 -23.016 1.00 14.44 C ATOM 26 CG MET A 1 -6.473 -6.869 -23.862 1.00 70.20 C ATOM 27 SD MET A 1 -5.025 -7.833 -24.331 1.00 31.41 S ATOM 28 CE MET A 1 -5.809 -9.135 -25.278 1.00 73.12 C ATOM 0 H MET A 1 -3.484 -5.260 -23.521 1.00 51.14 H new ATOM 0 HA MET A 1 -6.001 -4.189 -24.591 1.00 50.21 H new ATOM 0 HB2 MET A 1 -5.552 -5.963 -22.166 1.00 14.44 H new ATOM 0 HB3 MET A 1 -7.090 -5.254 -22.615 1.00 14.44 H new ATOM 0 HG2 MET A 1 -7.160 -7.510 -23.309 1.00 70.20 H new ATOM 0 HG3 MET A 1 -6.992 -6.550 -24.766 1.00 70.20 H new ATOM 0 HE1 MET A 1 -5.085 -9.925 -25.479 1.00 73.12 H new ATOM 0 HE2 MET A 1 -6.645 -9.545 -24.711 1.00 73.12 H new ATOM 0 HE3 MET A 1 -6.175 -8.729 -26.221 1.00 73.12 H new ATOM 38 N THR A 2 -6.197 -2.438 -22.754 1.00 63.52 N ATOM 39 CA THR A 2 -6.224 -1.415 -21.758 1.00 13.11 C ATOM 40 C THR A 2 -7.037 -1.954 -20.584 1.00 74.20 C ATOM 41 O THR A 2 -8.227 -2.270 -20.736 1.00 24.04 O ATOM 42 CB THR A 2 -6.880 -0.137 -22.302 1.00 33.24 C ATOM 43 OG1 THR A 2 -6.214 0.257 -23.515 1.00 21.03 O ATOM 44 CG2 THR A 2 -6.781 0.996 -21.286 1.00 12.34 C ATOM 0 H THR A 2 -6.943 -2.383 -23.447 1.00 63.52 H new ATOM 0 HA THR A 2 -5.209 -1.159 -21.453 1.00 13.11 H new ATOM 0 HB THR A 2 -7.933 -0.341 -22.497 1.00 33.24 H new ATOM 0 HG1 THR A 2 -6.630 1.071 -23.867 1.00 21.03 H new ATOM 0 HG21 THR A 2 -7.252 1.891 -21.692 1.00 12.34 H new ATOM 0 HG22 THR A 2 -7.288 0.705 -20.366 1.00 12.34 H new ATOM 0 HG23 THR A 2 -5.732 1.203 -21.073 1.00 12.34 H new ATOM 52 N VAL A 3 -6.407 -2.092 -19.449 1.00 24.41 N ATOM 53 CA VAL A 3 -7.066 -2.657 -18.298 1.00 23.45 C ATOM 54 C VAL A 3 -7.228 -1.591 -17.230 1.00 64.52 C ATOM 55 O VAL A 3 -6.284 -0.842 -16.940 1.00 22.13 O ATOM 56 CB VAL A 3 -6.266 -3.841 -17.690 1.00 13.53 C ATOM 57 CG1 VAL A 3 -7.030 -4.505 -16.601 1.00 14.54 C ATOM 58 CG2 VAL A 3 -5.864 -4.874 -18.710 1.00 44.25 C ATOM 0 H VAL A 3 -5.436 -1.821 -19.294 1.00 24.41 H new ATOM 0 HA VAL A 3 -8.035 -3.029 -18.630 1.00 23.45 H new ATOM 0 HB VAL A 3 -5.355 -3.399 -17.288 1.00 13.53 H new ATOM 0 HG11 VAL A 3 -6.444 -5.330 -16.196 1.00 14.54 H new ATOM 0 HG12 VAL A 3 -7.237 -3.784 -15.810 1.00 14.54 H new ATOM 0 HG13 VAL A 3 -7.970 -4.889 -16.998 1.00 14.54 H new ATOM 0 HG21 VAL A 3 -5.309 -5.673 -18.219 1.00 44.25 H new ATOM 0 HG22 VAL A 3 -6.756 -5.288 -19.180 1.00 44.25 H new ATOM 0 HG23 VAL A 3 -5.236 -4.410 -19.470 1.00 44.25 H new ATOM 68 N TYR A 4 -8.408 -1.507 -16.674 1.00 71.22 N ATOM 69 CA TYR A 4 -8.685 -0.571 -15.619 1.00 13.23 C ATOM 70 C TYR A 4 -8.675 -1.283 -14.260 1.00 22.10 C ATOM 71 O TYR A 4 -9.318 -2.328 -14.082 1.00 13.13 O ATOM 72 CB TYR A 4 -10.024 0.114 -15.866 1.00 14.53 C ATOM 73 CG TYR A 4 -10.075 0.899 -17.164 1.00 44.41 C ATOM 74 CD1 TYR A 4 -10.455 0.292 -18.354 1.00 40.13 C ATOM 75 CD2 TYR A 4 -9.743 2.241 -17.197 1.00 3.23 C ATOM 76 CE1 TYR A 4 -10.507 1.001 -19.532 1.00 73.41 C ATOM 77 CE2 TYR A 4 -9.793 2.961 -18.371 1.00 4.20 C ATOM 78 CZ TYR A 4 -10.178 2.340 -19.536 1.00 15.23 C ATOM 79 OH TYR A 4 -10.224 3.063 -20.717 1.00 2.14 O ATOM 0 H TYR A 4 -9.204 -2.086 -16.941 1.00 71.22 H new ATOM 0 HA TYR A 4 -7.907 0.192 -15.607 1.00 13.23 H new ATOM 0 HB2 TYR A 4 -10.812 -0.639 -15.876 1.00 14.53 H new ATOM 0 HB3 TYR A 4 -10.237 0.787 -15.036 1.00 14.53 H new ATOM 0 HD1 TYR A 4 -10.715 -0.756 -18.355 1.00 40.13 H new ATOM 0 HD2 TYR A 4 -9.439 2.734 -16.286 1.00 3.23 H new ATOM 0 HE1 TYR A 4 -10.804 0.512 -20.448 1.00 73.41 H new ATOM 0 HE2 TYR A 4 -9.531 4.009 -18.376 1.00 4.20 H new ATOM 0 HH TYR A 4 -9.963 3.991 -20.543 1.00 2.14 H new ATOM 89 N ILE A 5 -7.930 -0.729 -13.325 1.00 25.30 N ATOM 90 CA ILE A 5 -7.792 -1.292 -11.990 1.00 41.33 C ATOM 91 C ILE A 5 -8.454 -0.358 -10.984 1.00 25.52 C ATOM 92 O ILE A 5 -8.113 0.821 -10.902 1.00 62.44 O ATOM 93 CB ILE A 5 -6.286 -1.425 -11.513 1.00 64.34 C ATOM 94 CG1 ILE A 5 -5.364 -2.278 -12.408 1.00 31.12 C ATOM 95 CG2 ILE A 5 -6.215 -1.979 -10.090 1.00 10.15 C ATOM 96 CD1 ILE A 5 -5.177 -1.825 -13.845 1.00 11.23 C ATOM 0 H ILE A 5 -7.399 0.130 -13.467 1.00 25.30 H new ATOM 0 HA ILE A 5 -8.247 -2.282 -12.037 1.00 41.33 H new ATOM 0 HB ILE A 5 -5.910 -0.404 -11.574 1.00 64.34 H new ATOM 0 HG12 ILE A 5 -4.382 -2.321 -11.937 1.00 31.12 H new ATOM 0 HG13 ILE A 5 -5.755 -3.295 -12.423 1.00 31.12 H new ATOM 0 HG21 ILE A 5 -5.172 -2.062 -9.783 1.00 10.15 H new ATOM 0 HG22 ILE A 5 -6.740 -1.307 -9.411 1.00 10.15 H new ATOM 0 HG23 ILE A 5 -6.682 -2.964 -10.059 1.00 10.15 H new ATOM 0 HD11 ILE A 5 -4.506 -2.514 -14.359 1.00 11.23 H new ATOM 0 HD12 ILE A 5 -6.142 -1.813 -14.351 1.00 11.23 H new ATOM 0 HD13 ILE A 5 -4.748 -0.823 -13.858 1.00 11.23 H new ATOM 108 N CYS A 6 -9.386 -0.855 -10.262 1.00 71.13 N ATOM 109 CA CYS A 6 -9.947 -0.138 -9.179 1.00 0.03 C ATOM 110 C CYS A 6 -9.880 -0.978 -7.919 1.00 24.35 C ATOM 111 O CYS A 6 -10.715 -1.867 -7.714 1.00 71.13 O ATOM 112 CB CYS A 6 -11.366 0.295 -9.447 1.00 4.01 C ATOM 113 SG CYS A 6 -12.130 1.158 -8.073 1.00 42.21 S ATOM 0 H CYS A 6 -9.786 -1.782 -10.407 1.00 71.13 H new ATOM 0 HA CYS A 6 -9.359 0.771 -9.047 1.00 0.03 H new ATOM 0 HB2 CYS A 6 -11.379 0.943 -10.324 1.00 4.01 H new ATOM 0 HB3 CYS A 6 -11.964 -0.583 -9.691 1.00 4.01 H new ATOM 0 HG CYS A 6 -11.559 2.315 -7.916 1.00 42.21 H new ATOM 119 N PRO A 7 -8.888 -0.739 -7.057 1.00 42.21 N ATOM 120 CA PRO A 7 -8.772 -1.453 -5.784 1.00 61.23 C ATOM 121 C PRO A 7 -9.738 -0.881 -4.732 1.00 55.13 C ATOM 122 O PRO A 7 -9.645 -1.181 -3.539 1.00 53.42 O ATOM 123 CB PRO A 7 -7.315 -1.201 -5.377 1.00 65.44 C ATOM 124 CG PRO A 7 -6.980 0.123 -5.975 1.00 23.14 C ATOM 125 CD PRO A 7 -7.777 0.232 -7.253 1.00 42.13 C ATOM 0 HA PRO A 7 -9.023 -2.511 -5.866 1.00 61.23 H new ATOM 0 HB2 PRO A 7 -7.203 -1.186 -4.293 1.00 65.44 H new ATOM 0 HB3 PRO A 7 -6.657 -1.984 -5.754 1.00 65.44 H new ATOM 0 HG2 PRO A 7 -7.233 0.933 -5.290 1.00 23.14 H new ATOM 0 HG3 PRO A 7 -5.911 0.198 -6.177 1.00 23.14 H new ATOM 0 HD2 PRO A 7 -8.152 1.244 -7.407 1.00 42.13 H new ATOM 0 HD3 PRO A 7 -7.173 -0.020 -8.125 1.00 42.13 H new ATOM 133 N GLU A 8 -10.664 -0.066 -5.199 1.00 53.44 N ATOM 134 CA GLU A 8 -11.638 0.576 -4.359 1.00 24.13 C ATOM 135 C GLU A 8 -12.924 -0.213 -4.406 1.00 5.03 C ATOM 136 O GLU A 8 -13.361 -0.789 -3.411 1.00 53.45 O ATOM 137 CB GLU A 8 -11.974 1.953 -4.906 1.00 43.44 C ATOM 138 CG GLU A 8 -10.802 2.797 -5.278 1.00 45.41 C ATOM 139 CD GLU A 8 -11.248 4.066 -5.943 1.00 51.55 C ATOM 140 OE1 GLU A 8 -11.526 4.030 -7.176 1.00 44.24 O ATOM 141 OE2 GLU A 8 -11.369 5.098 -5.253 1.00 1.21 O ATOM 0 H GLU A 8 -10.756 0.168 -6.188 1.00 53.44 H new ATOM 0 HA GLU A 8 -11.229 0.641 -3.351 1.00 24.13 H new ATOM 0 HB2 GLU A 8 -12.607 1.832 -5.785 1.00 43.44 H new ATOM 0 HB3 GLU A 8 -12.563 2.487 -4.161 1.00 43.44 H new ATOM 0 HG2 GLU A 8 -10.221 3.033 -4.387 1.00 45.41 H new ATOM 0 HG3 GLU A 8 -10.146 2.241 -5.948 1.00 45.41 H new ATOM 148 N THR A 9 -13.525 -0.243 -5.584 1.00 50.04 N ATOM 149 CA THR A 9 -14.832 -0.800 -5.748 1.00 23.32 C ATOM 150 C THR A 9 -14.909 -1.854 -6.868 1.00 33.33 C ATOM 151 O THR A 9 -16.013 -2.297 -7.225 1.00 50.10 O ATOM 152 CB THR A 9 -15.834 0.345 -6.036 1.00 52.41 C ATOM 153 OG1 THR A 9 -15.409 1.059 -7.203 1.00 54.12 O ATOM 154 CG2 THR A 9 -15.886 1.323 -4.871 1.00 72.53 C ATOM 0 H THR A 9 -13.112 0.120 -6.443 1.00 50.04 H new ATOM 0 HA THR A 9 -15.084 -1.316 -4.821 1.00 23.32 H new ATOM 0 HB THR A 9 -16.822 -0.091 -6.185 1.00 52.41 H new ATOM 0 HG1 THR A 9 -14.435 0.995 -7.289 1.00 54.12 H new ATOM 0 HG21 THR A 9 -16.596 2.119 -5.095 1.00 72.53 H new ATOM 0 HG22 THR A 9 -16.202 0.798 -3.969 1.00 72.53 H new ATOM 0 HG23 THR A 9 -14.897 1.753 -4.713 1.00 72.53 H new ATOM 162 N GLY A 10 -13.775 -2.283 -7.418 1.00 54.15 N ATOM 163 CA GLY A 10 -13.852 -3.288 -8.439 1.00 73.31 C ATOM 164 C GLY A 10 -13.419 -4.588 -7.864 1.00 14.03 C ATOM 165 O GLY A 10 -13.156 -4.668 -6.659 1.00 31.23 O ATOM 0 H GLY A 10 -12.838 -1.959 -7.179 1.00 54.15 H new ATOM 0 HA2 GLY A 10 -14.871 -3.364 -8.818 1.00 73.31 H new ATOM 0 HA3 GLY A 10 -13.217 -3.018 -9.283 1.00 73.31 H new ATOM 169 N ASP A 11 -13.324 -5.588 -8.666 1.00 71.43 N ATOM 170 CA ASP A 11 -12.927 -6.899 -8.184 1.00 44.11 C ATOM 171 C ASP A 11 -11.950 -7.501 -9.154 1.00 61.31 C ATOM 172 O ASP A 11 -12.005 -7.224 -10.349 1.00 4.31 O ATOM 173 CB ASP A 11 -14.143 -7.805 -7.984 1.00 2.52 C ATOM 174 CG ASP A 11 -13.765 -9.187 -7.524 1.00 32.23 C ATOM 175 OD1 ASP A 11 -13.575 -9.391 -6.324 1.00 23.31 O ATOM 176 OD2 ASP A 11 -13.640 -10.079 -8.370 1.00 63.15 O ATOM 0 H ASP A 11 -13.513 -5.541 -9.667 1.00 71.43 H new ATOM 0 HA ASP A 11 -12.446 -6.795 -7.211 1.00 44.11 H new ATOM 0 HB2 ASP A 11 -14.812 -7.353 -7.252 1.00 2.52 H new ATOM 0 HB3 ASP A 11 -14.696 -7.876 -8.920 1.00 2.52 H new ATOM 181 N ASP A 12 -11.050 -8.312 -8.656 1.00 72.54 N ATOM 182 CA ASP A 12 -9.985 -8.858 -9.475 1.00 33.42 C ATOM 183 C ASP A 12 -10.454 -10.036 -10.320 1.00 55.22 C ATOM 184 O ASP A 12 -9.692 -10.597 -11.079 1.00 50.31 O ATOM 185 CB ASP A 12 -8.778 -9.261 -8.626 1.00 4.44 C ATOM 186 CG ASP A 12 -9.037 -10.419 -7.696 1.00 30.41 C ATOM 187 OD1 ASP A 12 -9.550 -10.196 -6.579 1.00 60.33 O ATOM 188 OD2 ASP A 12 -8.713 -11.569 -8.060 1.00 63.41 O ATOM 0 H ASP A 12 -11.030 -8.613 -7.682 1.00 72.54 H new ATOM 0 HA ASP A 12 -9.680 -8.063 -10.156 1.00 33.42 H new ATOM 0 HB2 ASP A 12 -7.952 -9.519 -9.288 1.00 4.44 H new ATOM 0 HB3 ASP A 12 -8.458 -8.401 -8.037 1.00 4.44 H new ATOM 193 N GLY A 13 -11.695 -10.409 -10.187 1.00 63.24 N ATOM 194 CA GLY A 13 -12.223 -11.481 -10.985 1.00 70.42 C ATOM 195 C GLY A 13 -13.010 -10.972 -12.174 1.00 44.42 C ATOM 196 O GLY A 13 -13.664 -11.750 -12.865 1.00 74.31 O ATOM 0 H GLY A 13 -12.359 -9.989 -9.536 1.00 63.24 H new ATOM 0 HA2 GLY A 13 -11.404 -12.109 -11.335 1.00 70.42 H new ATOM 0 HA3 GLY A 13 -12.865 -12.109 -10.368 1.00 70.42 H new ATOM 200 N ASN A 14 -12.949 -9.666 -12.414 1.00 53.30 N ATOM 201 CA ASN A 14 -13.685 -9.056 -13.526 1.00 24.23 C ATOM 202 C ASN A 14 -12.946 -9.139 -14.850 1.00 41.12 C ATOM 203 O ASN A 14 -11.871 -9.738 -14.966 1.00 32.21 O ATOM 204 CB ASN A 14 -14.036 -7.574 -13.281 1.00 50.42 C ATOM 205 CG ASN A 14 -15.103 -7.304 -12.254 1.00 3.52 C ATOM 206 OD1 ASN A 14 -16.305 -7.373 -12.548 1.00 62.21 O ATOM 207 ND2 ASN A 14 -14.702 -6.894 -11.112 1.00 62.02 N ATOM 0 H ASN A 14 -12.401 -9.009 -11.859 1.00 53.30 H new ATOM 0 HA ASN A 14 -14.600 -9.645 -13.580 1.00 24.23 H new ATOM 0 HB2 ASN A 14 -13.128 -7.053 -12.977 1.00 50.42 H new ATOM 0 HB3 ASN A 14 -14.353 -7.136 -14.228 1.00 50.42 H new ATOM 0 HD21 ASN A 14 -15.380 -6.609 -10.405 1.00 62.02 H new ATOM 0 HD22 ASN A 14 -13.704 -6.851 -10.907 1.00 62.02 H new ATOM 214 N ASP A 15 -13.558 -8.521 -15.843 1.00 43.34 N ATOM 215 CA ASP A 15 -13.039 -8.400 -17.202 1.00 45.23 C ATOM 216 C ASP A 15 -11.919 -7.357 -17.275 1.00 51.31 C ATOM 217 O ASP A 15 -11.056 -7.404 -18.156 1.00 13.41 O ATOM 218 CB ASP A 15 -14.196 -7.998 -18.119 1.00 21.25 C ATOM 219 CG ASP A 15 -13.797 -7.726 -19.545 1.00 54.03 C ATOM 220 OD1 ASP A 15 -13.660 -8.684 -20.329 1.00 10.12 O ATOM 221 OD2 ASP A 15 -13.666 -6.537 -19.912 1.00 61.34 O ATOM 0 H ASP A 15 -14.466 -8.071 -15.725 1.00 43.34 H new ATOM 0 HA ASP A 15 -12.617 -9.354 -17.517 1.00 45.23 H new ATOM 0 HB2 ASP A 15 -14.943 -8.791 -18.109 1.00 21.25 H new ATOM 0 HB3 ASP A 15 -14.673 -7.106 -17.712 1.00 21.25 H new ATOM 226 N GLY A 16 -11.929 -6.429 -16.337 1.00 62.44 N ATOM 227 CA GLY A 16 -10.929 -5.385 -16.308 1.00 20.24 C ATOM 228 C GLY A 16 -11.253 -4.202 -17.181 1.00 12.53 C ATOM 229 O GLY A 16 -10.364 -3.443 -17.569 1.00 54.23 O ATOM 0 H GLY A 16 -12.619 -6.379 -15.587 1.00 62.44 H new ATOM 0 HA2 GLY A 16 -10.806 -5.042 -15.281 1.00 20.24 H new ATOM 0 HA3 GLY A 16 -9.972 -5.803 -16.621 1.00 20.24 H new ATOM 233 N SER A 17 -12.507 -4.041 -17.486 1.00 33.42 N ATOM 234 CA SER A 17 -12.969 -2.915 -18.250 1.00 53.40 C ATOM 235 C SER A 17 -13.161 -1.735 -17.283 1.00 53.12 C ATOM 236 O SER A 17 -12.982 -1.893 -16.084 1.00 73.42 O ATOM 237 CB SER A 17 -14.289 -3.283 -18.949 1.00 40.11 C ATOM 238 OG SER A 17 -14.782 -2.221 -19.749 1.00 61.24 O ATOM 0 H SER A 17 -13.244 -4.690 -17.211 1.00 33.42 H new ATOM 0 HA SER A 17 -12.249 -2.637 -19.019 1.00 53.40 H new ATOM 0 HB2 SER A 17 -14.136 -4.165 -19.572 1.00 40.11 H new ATOM 0 HB3 SER A 17 -15.034 -3.548 -18.199 1.00 40.11 H new ATOM 0 HG SER A 17 -15.620 -2.495 -20.177 1.00 61.24 H new ATOM 244 N GLU A 18 -13.536 -0.573 -17.786 1.00 74.21 N ATOM 245 CA GLU A 18 -13.718 0.576 -16.933 1.00 62.33 C ATOM 246 C GLU A 18 -14.946 0.360 -16.033 1.00 52.11 C ATOM 247 O GLU A 18 -15.023 0.876 -14.920 1.00 3.22 O ATOM 248 CB GLU A 18 -13.900 1.835 -17.779 1.00 43.14 C ATOM 249 CG GLU A 18 -13.887 3.099 -16.974 1.00 52.30 C ATOM 250 CD GLU A 18 -14.164 4.326 -17.795 1.00 42.23 C ATOM 251 OE1 GLU A 18 -13.217 4.912 -18.363 1.00 64.11 O ATOM 252 OE2 GLU A 18 -15.342 4.739 -17.870 1.00 73.23 O ATOM 0 H GLU A 18 -13.718 -0.405 -18.775 1.00 74.21 H new ATOM 0 HA GLU A 18 -12.834 0.702 -16.308 1.00 62.33 H new ATOM 0 HB2 GLU A 18 -13.107 1.880 -18.526 1.00 43.14 H new ATOM 0 HB3 GLU A 18 -14.844 1.767 -18.320 1.00 43.14 H new ATOM 0 HG2 GLU A 18 -14.631 3.025 -16.181 1.00 52.30 H new ATOM 0 HG3 GLU A 18 -12.916 3.205 -16.491 1.00 52.30 H new ATOM 259 N LEU A 19 -15.895 -0.419 -16.536 1.00 75.53 N ATOM 260 CA LEU A 19 -17.124 -0.713 -15.821 1.00 42.12 C ATOM 261 C LEU A 19 -16.948 -1.891 -14.873 1.00 53.13 C ATOM 262 O LEU A 19 -17.722 -2.066 -13.921 1.00 61.41 O ATOM 263 CB LEU A 19 -18.270 -0.986 -16.795 1.00 51.51 C ATOM 264 CG LEU A 19 -18.642 0.134 -17.779 1.00 33.23 C ATOM 265 CD1 LEU A 19 -18.893 1.463 -17.071 1.00 50.34 C ATOM 266 CD2 LEU A 19 -17.647 0.274 -18.935 1.00 53.22 C ATOM 0 H LEU A 19 -15.832 -0.864 -17.452 1.00 75.53 H new ATOM 0 HA LEU A 19 -17.373 0.166 -15.227 1.00 42.12 H new ATOM 0 HB2 LEU A 19 -18.015 -1.873 -17.375 1.00 51.51 H new ATOM 0 HB3 LEU A 19 -19.157 -1.230 -16.211 1.00 51.51 H new ATOM 0 HG LEU A 19 -19.586 -0.168 -18.232 1.00 33.23 H new ATOM 0 HD11 LEU A 19 -19.153 2.224 -17.807 1.00 50.34 H new ATOM 0 HD12 LEU A 19 -19.713 1.349 -16.363 1.00 50.34 H new ATOM 0 HD13 LEU A 19 -17.992 1.767 -16.537 1.00 50.34 H new ATOM 0 HD21 LEU A 19 -17.966 1.081 -19.594 1.00 53.22 H new ATOM 0 HD22 LEU A 19 -16.657 0.499 -18.538 1.00 53.22 H new ATOM 0 HD23 LEU A 19 -17.609 -0.659 -19.497 1.00 53.22 H new ATOM 278 N LYS A 20 -15.933 -2.687 -15.121 1.00 73.03 N ATOM 279 CA LYS A 20 -15.615 -3.821 -14.271 1.00 71.01 C ATOM 280 C LYS A 20 -14.142 -3.797 -14.034 1.00 73.11 C ATOM 281 O LYS A 20 -13.396 -4.563 -14.652 1.00 23.43 O ATOM 282 CB LYS A 20 -15.972 -5.166 -14.897 1.00 34.32 C ATOM 283 CG LYS A 20 -17.383 -5.308 -15.444 1.00 61.22 C ATOM 284 CD LYS A 20 -17.628 -6.751 -15.846 1.00 71.33 C ATOM 285 CE LYS A 20 -18.993 -6.968 -16.467 1.00 75.22 C ATOM 286 NZ LYS A 20 -19.127 -6.318 -17.789 1.00 72.33 N ATOM 0 H LYS A 20 -15.303 -2.570 -15.915 1.00 73.03 H new ATOM 0 HA LYS A 20 -16.200 -3.728 -13.356 1.00 71.01 H new ATOM 0 HB2 LYS A 20 -15.271 -5.361 -15.708 1.00 34.32 H new ATOM 0 HB3 LYS A 20 -15.817 -5.942 -14.148 1.00 34.32 H new ATOM 0 HG2 LYS A 20 -18.109 -5.001 -14.691 1.00 61.22 H new ATOM 0 HG3 LYS A 20 -17.519 -4.652 -16.304 1.00 61.22 H new ATOM 0 HD2 LYS A 20 -16.859 -7.061 -16.554 1.00 71.33 H new ATOM 0 HD3 LYS A 20 -17.529 -7.389 -14.968 1.00 71.33 H new ATOM 0 HE2 LYS A 20 -19.174 -8.038 -16.572 1.00 75.22 H new ATOM 0 HE3 LYS A 20 -19.759 -6.580 -15.796 1.00 75.22 H new ATOM 0 HZ1 LYS A 20 -20.046 -6.567 -18.207 1.00 72.33 H new ATOM 0 HZ2 LYS A 20 -19.066 -5.286 -17.676 1.00 72.33 H new ATOM 0 HZ3 LYS A 20 -18.363 -6.643 -18.415 1.00 72.33 H new ATOM 300 N PRO A 21 -13.693 -2.892 -13.205 1.00 31.33 N ATOM 301 CA PRO A 21 -12.301 -2.711 -12.967 1.00 31.32 C ATOM 302 C PRO A 21 -11.751 -3.772 -12.050 1.00 42.34 C ATOM 303 O PRO A 21 -12.449 -4.268 -11.148 1.00 30.23 O ATOM 304 CB PRO A 21 -12.214 -1.329 -12.343 1.00 74.54 C ATOM 305 CG PRO A 21 -13.547 -1.095 -11.709 1.00 61.41 C ATOM 306 CD PRO A 21 -14.527 -1.976 -12.414 1.00 22.42 C ATOM 0 HA PRO A 21 -11.708 -2.795 -13.878 1.00 31.32 H new ATOM 0 HB2 PRO A 21 -11.414 -1.281 -11.604 1.00 74.54 H new ATOM 0 HB3 PRO A 21 -11.999 -0.571 -13.096 1.00 74.54 H new ATOM 0 HG2 PRO A 21 -13.514 -1.329 -10.645 1.00 61.41 H new ATOM 0 HG3 PRO A 21 -13.837 -0.048 -11.797 1.00 61.41 H new ATOM 0 HD2 PRO A 21 -15.153 -2.520 -11.706 1.00 22.42 H new ATOM 0 HD3 PRO A 21 -15.195 -1.397 -13.051 1.00 22.42 H new ATOM 314 N LEU A 22 -10.534 -4.134 -12.284 1.00 31.22 N ATOM 315 CA LEU A 22 -9.893 -5.136 -11.503 1.00 64.54 C ATOM 316 C LEU A 22 -9.439 -4.564 -10.213 1.00 41.22 C ATOM 317 O LEU A 22 -9.022 -3.450 -10.149 1.00 31.31 O ATOM 318 CB LEU A 22 -8.723 -5.723 -12.250 1.00 40.32 C ATOM 319 CG LEU A 22 -9.073 -6.390 -13.556 1.00 45.11 C ATOM 320 CD1 LEU A 22 -7.844 -6.874 -14.240 1.00 24.33 C ATOM 321 CD2 LEU A 22 -10.052 -7.527 -13.339 1.00 62.31 C ATOM 0 H LEU A 22 -9.954 -3.741 -13.026 1.00 31.22 H new ATOM 0 HA LEU A 22 -10.611 -5.932 -11.305 1.00 64.54 H new ATOM 0 HB2 LEU A 22 -8.001 -4.930 -12.446 1.00 40.32 H new ATOM 0 HB3 LEU A 22 -8.229 -6.452 -11.607 1.00 40.32 H new ATOM 0 HG LEU A 22 -9.554 -5.652 -14.197 1.00 45.11 H new ATOM 0 HD11 LEU A 22 -8.116 -7.353 -15.181 1.00 24.33 H new ATOM 0 HD12 LEU A 22 -7.183 -6.031 -14.440 1.00 24.33 H new ATOM 0 HD13 LEU A 22 -7.332 -7.594 -13.601 1.00 24.33 H new ATOM 0 HD21 LEU A 22 -10.288 -7.991 -14.296 1.00 62.31 H new ATOM 0 HD22 LEU A 22 -9.607 -8.269 -12.676 1.00 62.31 H new ATOM 0 HD23 LEU A 22 -10.966 -7.139 -12.889 1.00 62.31 H new ATOM 333 N ARG A 23 -9.536 -5.323 -9.203 1.00 51.24 N ATOM 334 CA ARG A 23 -9.126 -4.901 -7.899 1.00 0.43 C ATOM 335 C ARG A 23 -7.613 -5.125 -7.705 1.00 13.13 C ATOM 336 O ARG A 23 -7.015 -4.643 -6.740 1.00 51.22 O ATOM 337 CB ARG A 23 -10.003 -5.622 -6.866 1.00 44.04 C ATOM 338 CG ARG A 23 -9.578 -5.563 -5.434 1.00 32.31 C ATOM 339 CD ARG A 23 -10.456 -6.446 -4.568 1.00 42.02 C ATOM 340 NE ARG A 23 -11.875 -6.099 -4.683 1.00 41.42 N ATOM 341 CZ ARG A 23 -12.898 -6.809 -4.186 1.00 53.14 C ATOM 342 NH1 ARG A 23 -12.686 -7.887 -3.436 1.00 53.45 N ATOM 343 NH2 ARG A 23 -14.136 -6.416 -4.425 1.00 0.15 N ATOM 0 H ARG A 23 -9.906 -6.273 -9.240 1.00 51.24 H new ATOM 0 HA ARG A 23 -9.271 -3.829 -7.766 1.00 0.43 H new ATOM 0 HB2 ARG A 23 -11.010 -5.210 -6.935 1.00 44.04 H new ATOM 0 HB3 ARG A 23 -10.067 -6.671 -7.154 1.00 44.04 H new ATOM 0 HG2 ARG A 23 -8.539 -5.880 -5.346 1.00 32.31 H new ATOM 0 HG3 ARG A 23 -9.628 -4.534 -5.078 1.00 32.31 H new ATOM 0 HD2 ARG A 23 -10.314 -7.488 -4.854 1.00 42.02 H new ATOM 0 HD3 ARG A 23 -10.145 -6.356 -3.527 1.00 42.02 H new ATOM 0 HE ARG A 23 -12.105 -5.242 -5.186 1.00 41.42 H new ATOM 0 HH11 ARG A 23 -11.733 -8.186 -3.230 1.00 53.45 H new ATOM 0 HH12 ARG A 23 -13.477 -8.415 -3.066 1.00 53.45 H new ATOM 0 HH21 ARG A 23 -14.307 -5.579 -4.983 1.00 0.15 H new ATOM 0 HH22 ARG A 23 -14.921 -6.949 -4.052 1.00 0.15 H new ATOM 357 N THR A 24 -6.995 -5.829 -8.649 1.00 25.24 N ATOM 358 CA THR A 24 -5.570 -6.067 -8.618 1.00 13.44 C ATOM 359 C THR A 24 -4.949 -5.771 -9.989 1.00 4.15 C ATOM 360 O THR A 24 -5.581 -5.983 -11.034 1.00 2.01 O ATOM 361 CB THR A 24 -5.226 -7.535 -8.223 1.00 43.22 C ATOM 362 OG1 THR A 24 -5.825 -8.453 -9.154 1.00 52.11 O ATOM 363 CG2 THR A 24 -5.688 -7.859 -6.804 1.00 62.42 C ATOM 0 H THR A 24 -7.472 -6.245 -9.449 1.00 25.24 H new ATOM 0 HA THR A 24 -5.158 -5.399 -7.861 1.00 13.44 H new ATOM 0 HB THR A 24 -4.142 -7.640 -8.256 1.00 43.22 H new ATOM 0 HG1 THR A 24 -5.601 -9.372 -8.897 1.00 52.11 H new ATOM 0 HG21 THR A 24 -5.431 -8.891 -6.564 1.00 62.42 H new ATOM 0 HG22 THR A 24 -5.195 -7.189 -6.099 1.00 62.42 H new ATOM 0 HG23 THR A 24 -6.768 -7.729 -6.734 1.00 62.42 H new ATOM 371 N LEU A 25 -3.727 -5.286 -9.972 1.00 34.50 N ATOM 372 CA LEU A 25 -2.949 -5.035 -11.178 1.00 15.45 C ATOM 373 C LEU A 25 -2.399 -6.375 -11.679 1.00 41.22 C ATOM 374 O LEU A 25 -2.041 -6.548 -12.851 1.00 52.21 O ATOM 375 CB LEU A 25 -1.817 -4.064 -10.838 1.00 54.20 C ATOM 376 CG LEU A 25 -0.895 -3.634 -11.974 1.00 63.21 C ATOM 377 CD1 LEU A 25 -1.689 -3.014 -13.114 1.00 63.21 C ATOM 378 CD2 LEU A 25 0.123 -2.647 -11.442 1.00 45.41 C ATOM 0 H LEU A 25 -3.234 -5.050 -9.111 1.00 34.50 H new ATOM 0 HA LEU A 25 -3.561 -4.589 -11.962 1.00 15.45 H new ATOM 0 HB2 LEU A 25 -2.261 -3.167 -10.407 1.00 54.20 H new ATOM 0 HB3 LEU A 25 -1.204 -4.521 -10.061 1.00 54.20 H new ATOM 0 HG LEU A 25 -0.382 -4.512 -12.366 1.00 63.21 H new ATOM 0 HD11 LEU A 25 -1.008 -2.716 -13.911 1.00 63.21 H new ATOM 0 HD12 LEU A 25 -2.402 -3.743 -13.499 1.00 63.21 H new ATOM 0 HD13 LEU A 25 -2.226 -2.139 -12.749 1.00 63.21 H new ATOM 0 HD21 LEU A 25 0.785 -2.336 -12.250 1.00 45.41 H new ATOM 0 HD22 LEU A 25 -0.392 -1.775 -11.039 1.00 45.41 H new ATOM 0 HD23 LEU A 25 0.710 -3.119 -10.654 1.00 45.41 H new ATOM 390 N TYR A 26 -2.360 -7.305 -10.759 1.00 34.12 N ATOM 391 CA TYR A 26 -1.971 -8.678 -10.976 1.00 1.43 C ATOM 392 C TYR A 26 -2.874 -9.327 -12.031 1.00 25.45 C ATOM 393 O TYR A 26 -2.383 -9.897 -13.004 1.00 72.30 O ATOM 394 CB TYR A 26 -2.134 -9.364 -9.634 1.00 13.44 C ATOM 395 CG TYR A 26 -1.767 -10.815 -9.542 1.00 73.23 C ATOM 396 CD1 TYR A 26 -0.470 -11.197 -9.319 1.00 71.40 C ATOM 397 CD2 TYR A 26 -2.735 -11.803 -9.616 1.00 55.02 C ATOM 398 CE1 TYR A 26 -0.142 -12.511 -9.186 1.00 4.52 C ATOM 399 CE2 TYR A 26 -2.405 -13.126 -9.466 1.00 11.24 C ATOM 400 CZ TYR A 26 -1.100 -13.470 -9.254 1.00 32.21 C ATOM 401 OH TYR A 26 -0.757 -14.776 -9.083 1.00 64.34 O ATOM 0 H TYR A 26 -2.611 -7.117 -9.789 1.00 34.12 H new ATOM 0 HA TYR A 26 -0.948 -8.758 -11.344 1.00 1.43 H new ATOM 0 HB2 TYR A 26 -1.534 -8.820 -8.905 1.00 13.44 H new ATOM 0 HB3 TYR A 26 -3.176 -9.262 -9.330 1.00 13.44 H new ATOM 0 HD1 TYR A 26 0.302 -10.445 -9.248 1.00 71.40 H new ATOM 0 HD2 TYR A 26 -3.764 -11.528 -9.794 1.00 55.02 H new ATOM 0 HE1 TYR A 26 0.888 -12.793 -9.025 1.00 4.52 H new ATOM 0 HE2 TYR A 26 -3.169 -13.888 -9.515 1.00 11.24 H new ATOM 0 HH TYR A 26 -1.489 -15.350 -9.392 1.00 64.34 H new ATOM 411 N GLN A 27 -4.196 -9.201 -11.856 1.00 40.14 N ATOM 412 CA GLN A 27 -5.142 -9.778 -12.807 1.00 13.04 C ATOM 413 C GLN A 27 -5.022 -9.090 -14.161 1.00 64.43 C ATOM 414 O GLN A 27 -5.184 -9.719 -15.198 1.00 52.13 O ATOM 415 CB GLN A 27 -6.583 -9.711 -12.274 1.00 11.03 C ATOM 416 CG GLN A 27 -7.654 -10.266 -13.232 1.00 40.42 C ATOM 417 CD GLN A 27 -7.483 -11.743 -13.563 1.00 42.33 C ATOM 418 OE1 GLN A 27 -6.978 -12.528 -12.761 1.00 50.22 O ATOM 419 NE2 GLN A 27 -7.923 -12.125 -14.738 1.00 44.01 N ATOM 0 H GLN A 27 -4.627 -8.710 -11.073 1.00 40.14 H new ATOM 0 HA GLN A 27 -4.893 -10.831 -12.936 1.00 13.04 H new ATOM 0 HB2 GLN A 27 -6.634 -10.263 -11.336 1.00 11.03 H new ATOM 0 HB3 GLN A 27 -6.823 -8.672 -12.046 1.00 11.03 H new ATOM 0 HG2 GLN A 27 -8.638 -10.115 -12.787 1.00 40.42 H new ATOM 0 HG3 GLN A 27 -7.631 -9.692 -14.158 1.00 40.42 H new ATOM 0 HE21 GLN A 27 -8.335 -11.443 -15.375 1.00 44.01 H new ATOM 0 HE22 GLN A 27 -7.853 -13.104 -15.015 1.00 44.01 H new ATOM 428 N ALA A 28 -4.706 -7.801 -14.138 1.00 54.04 N ATOM 429 CA ALA A 28 -4.498 -7.030 -15.333 1.00 65.42 C ATOM 430 C ALA A 28 -3.393 -7.665 -16.180 1.00 40.02 C ATOM 431 O ALA A 28 -3.525 -7.799 -17.396 1.00 52.23 O ATOM 432 CB ALA A 28 -4.178 -5.586 -14.961 1.00 31.31 C ATOM 0 H ALA A 28 -4.589 -7.267 -13.277 1.00 54.04 H new ATOM 0 HA ALA A 28 -5.406 -7.025 -15.935 1.00 65.42 H new ATOM 0 HB1 ALA A 28 -4.021 -5.003 -15.868 1.00 31.31 H new ATOM 0 HB2 ALA A 28 -5.009 -5.163 -14.397 1.00 31.31 H new ATOM 0 HB3 ALA A 28 -3.275 -5.559 -14.351 1.00 31.31 H new ATOM 438 N MET A 29 -2.319 -8.089 -15.532 1.00 21.11 N ATOM 439 CA MET A 29 -1.268 -8.787 -16.214 1.00 4.25 C ATOM 440 C MET A 29 -1.667 -10.197 -16.636 1.00 5.25 C ATOM 441 O MET A 29 -1.218 -10.684 -17.677 1.00 64.41 O ATOM 442 CB MET A 29 0.039 -8.775 -15.445 1.00 2.12 C ATOM 443 CG MET A 29 0.823 -7.482 -15.570 1.00 35.53 C ATOM 444 SD MET A 29 2.477 -7.644 -14.941 1.00 64.41 S ATOM 445 CE MET A 29 3.126 -6.051 -15.387 1.00 54.30 C ATOM 0 H MET A 29 -2.163 -7.956 -14.533 1.00 21.11 H new ATOM 0 HA MET A 29 -1.095 -8.227 -17.133 1.00 4.25 H new ATOM 0 HB2 MET A 29 -0.171 -8.959 -14.391 1.00 2.12 H new ATOM 0 HB3 MET A 29 0.661 -9.599 -15.795 1.00 2.12 H new ATOM 0 HG2 MET A 29 0.861 -7.181 -16.617 1.00 35.53 H new ATOM 0 HG3 MET A 29 0.305 -6.690 -15.029 1.00 35.53 H new ATOM 0 HE1 MET A 29 4.205 -6.122 -15.521 1.00 54.30 H new ATOM 0 HE2 MET A 29 2.666 -5.718 -16.318 1.00 54.30 H new ATOM 0 HE3 MET A 29 2.905 -5.334 -14.597 1.00 54.30 H new ATOM 455 N ILE A 30 -2.513 -10.843 -15.846 1.00 63.35 N ATOM 456 CA ILE A 30 -3.000 -12.183 -16.180 1.00 61.24 C ATOM 457 C ILE A 30 -3.839 -12.129 -17.459 1.00 42.24 C ATOM 458 O ILE A 30 -3.696 -12.960 -18.344 1.00 61.42 O ATOM 459 CB ILE A 30 -3.861 -12.812 -15.038 1.00 24.35 C ATOM 460 CG1 ILE A 30 -3.080 -12.868 -13.719 1.00 34.11 C ATOM 461 CG2 ILE A 30 -4.330 -14.218 -15.429 1.00 73.42 C ATOM 462 CD1 ILE A 30 -3.853 -13.472 -12.576 1.00 73.52 C ATOM 0 H ILE A 30 -2.878 -10.466 -14.971 1.00 63.35 H new ATOM 0 HA ILE A 30 -2.121 -12.811 -16.322 1.00 61.24 H new ATOM 0 HB ILE A 30 -4.733 -12.175 -14.892 1.00 24.35 H new ATOM 0 HG12 ILE A 30 -2.168 -13.445 -13.873 1.00 34.11 H new ATOM 0 HG13 ILE A 30 -2.776 -11.858 -13.445 1.00 34.11 H new ATOM 0 HG21 ILE A 30 -4.928 -14.640 -14.621 1.00 73.42 H new ATOM 0 HG22 ILE A 30 -4.933 -14.162 -16.335 1.00 73.42 H new ATOM 0 HG23 ILE A 30 -3.463 -14.854 -15.609 1.00 73.42 H new ATOM 0 HD11 ILE A 30 -3.233 -13.476 -11.679 1.00 73.52 H new ATOM 0 HD12 ILE A 30 -4.752 -12.883 -12.393 1.00 73.52 H new ATOM 0 HD13 ILE A 30 -4.134 -14.495 -12.827 1.00 73.52 H new ATOM 474 N ILE A 31 -4.696 -11.141 -17.544 1.00 42.41 N ATOM 475 CA ILE A 31 -5.563 -10.975 -18.686 1.00 53.11 C ATOM 476 C ILE A 31 -4.775 -10.604 -19.943 1.00 11.11 C ATOM 477 O ILE A 31 -5.013 -11.154 -21.021 1.00 5.24 O ATOM 478 CB ILE A 31 -6.652 -9.913 -18.434 1.00 72.43 C ATOM 479 CG1 ILE A 31 -7.484 -10.290 -17.222 1.00 64.43 C ATOM 480 CG2 ILE A 31 -7.549 -9.808 -19.637 1.00 4.42 C ATOM 481 CD1 ILE A 31 -8.614 -9.339 -16.938 1.00 55.21 C ATOM 0 H ILE A 31 -4.813 -10.429 -16.823 1.00 42.41 H new ATOM 0 HA ILE A 31 -6.047 -11.939 -18.843 1.00 53.11 H new ATOM 0 HB ILE A 31 -6.167 -8.954 -18.252 1.00 72.43 H new ATOM 0 HG12 ILE A 31 -7.892 -11.290 -17.371 1.00 64.43 H new ATOM 0 HG13 ILE A 31 -6.834 -10.338 -16.348 1.00 64.43 H new ATOM 0 HG21 ILE A 31 -8.317 -9.056 -19.454 1.00 4.42 H new ATOM 0 HG22 ILE A 31 -6.959 -9.519 -20.507 1.00 4.42 H new ATOM 0 HG23 ILE A 31 -8.022 -10.772 -19.823 1.00 4.42 H new ATOM 0 HD11 ILE A 31 -9.161 -9.676 -16.058 1.00 55.21 H new ATOM 0 HD12 ILE A 31 -8.213 -8.342 -16.756 1.00 55.21 H new ATOM 0 HD13 ILE A 31 -9.288 -9.309 -17.794 1.00 55.21 H new ATOM 493 N THR A 32 -3.823 -9.704 -19.797 1.00 61.43 N ATOM 494 CA THR A 32 -3.070 -9.225 -20.925 1.00 73.11 C ATOM 495 C THR A 32 -2.066 -10.262 -21.416 1.00 61.33 C ATOM 496 O THR A 32 -1.732 -10.286 -22.600 1.00 71.14 O ATOM 497 CB THR A 32 -2.359 -7.902 -20.593 1.00 11.24 C ATOM 498 OG1 THR A 32 -1.550 -8.073 -19.418 1.00 61.32 O ATOM 499 CG2 THR A 32 -3.375 -6.799 -20.346 1.00 54.33 C ATOM 0 H THR A 32 -3.556 -9.292 -18.903 1.00 61.43 H new ATOM 0 HA THR A 32 -3.780 -9.043 -21.731 1.00 73.11 H new ATOM 0 HB THR A 32 -1.731 -7.622 -21.439 1.00 11.24 H new ATOM 0 HG1 THR A 32 -2.108 -7.969 -18.619 1.00 61.32 H new ATOM 0 HG21 THR A 32 -2.854 -5.870 -20.113 1.00 54.33 H new ATOM 0 HG22 THR A 32 -3.984 -6.659 -21.239 1.00 54.33 H new ATOM 0 HG23 THR A 32 -4.016 -7.076 -19.509 1.00 54.33 H new ATOM 507 N LYS A 33 -1.563 -11.106 -20.475 1.00 15.55 N ATOM 508 CA LYS A 33 -0.595 -12.213 -20.766 1.00 3.50 C ATOM 509 C LYS A 33 0.756 -11.647 -21.228 1.00 41.13 C ATOM 510 O LYS A 33 1.682 -12.393 -21.515 1.00 12.43 O ATOM 511 CB LYS A 33 -1.142 -13.141 -21.903 1.00 12.22 C ATOM 512 CG LYS A 33 -2.485 -13.847 -21.652 1.00 13.13 C ATOM 513 CD LYS A 33 -2.386 -15.165 -20.859 1.00 72.23 C ATOM 514 CE LYS A 33 -1.801 -15.016 -19.473 1.00 13.14 C ATOM 515 NZ LYS A 33 -1.835 -16.288 -18.728 1.00 52.42 N ATOM 0 H LYS A 33 -1.815 -11.042 -19.489 1.00 15.55 H new ATOM 0 HA LYS A 33 -0.467 -12.782 -19.845 1.00 3.50 H new ATOM 0 HB2 LYS A 33 -1.239 -12.543 -22.809 1.00 12.22 H new ATOM 0 HB3 LYS A 33 -0.392 -13.905 -22.105 1.00 12.22 H new ATOM 0 HG2 LYS A 33 -3.143 -13.165 -21.114 1.00 13.13 H new ATOM 0 HG3 LYS A 33 -2.956 -14.053 -22.613 1.00 13.13 H new ATOM 0 HD2 LYS A 33 -3.382 -15.600 -20.775 1.00 72.23 H new ATOM 0 HD3 LYS A 33 -1.776 -15.870 -21.424 1.00 72.23 H new ATOM 0 HE2 LYS A 33 -0.772 -14.665 -19.548 1.00 13.14 H new ATOM 0 HE3 LYS A 33 -2.357 -14.257 -18.923 1.00 13.14 H new ATOM 0 HZ1 LYS A 33 -1.069 -16.299 -18.025 1.00 52.42 H new ATOM 0 HZ2 LYS A 33 -2.751 -16.382 -18.244 1.00 52.42 H new ATOM 0 HZ3 LYS A 33 -1.710 -17.081 -19.389 1.00 52.42 H new ATOM 529 N SER A 34 0.872 -10.346 -21.261 1.00 53.15 N ATOM 530 CA SER A 34 2.002 -9.714 -21.897 1.00 31.52 C ATOM 531 C SER A 34 2.969 -9.043 -20.928 1.00 10.54 C ATOM 532 O SER A 34 4.070 -8.696 -21.331 1.00 63.34 O ATOM 533 CB SER A 34 1.484 -8.690 -22.928 1.00 73.00 C ATOM 534 OG SER A 34 2.534 -8.045 -23.624 1.00 11.44 O ATOM 0 H SER A 34 0.196 -9.699 -20.854 1.00 53.15 H new ATOM 0 HA SER A 34 2.577 -10.503 -22.381 1.00 31.52 H new ATOM 0 HB2 SER A 34 0.835 -9.195 -23.643 1.00 73.00 H new ATOM 0 HB3 SER A 34 0.876 -7.942 -22.419 1.00 73.00 H new ATOM 0 HG SER A 34 3.348 -8.065 -23.079 1.00 11.44 H new ATOM 540 N SER A 35 2.573 -8.864 -19.649 1.00 3.02 N ATOM 541 CA SER A 35 3.386 -8.080 -18.657 1.00 32.51 C ATOM 542 C SER A 35 3.648 -6.661 -19.184 1.00 42.20 C ATOM 543 O SER A 35 4.579 -5.973 -18.773 1.00 23.52 O ATOM 544 CB SER A 35 4.710 -8.806 -18.237 1.00 44.31 C ATOM 545 OG SER A 35 5.563 -9.149 -19.323 1.00 61.52 O ATOM 0 H SER A 35 1.706 -9.243 -19.269 1.00 3.02 H new ATOM 0 HA SER A 35 2.796 -8.004 -17.743 1.00 32.51 H new ATOM 0 HB2 SER A 35 5.259 -8.164 -17.548 1.00 44.31 H new ATOM 0 HB3 SER A 35 4.454 -9.714 -17.691 1.00 44.31 H new ATOM 0 HG SER A 35 5.270 -8.678 -20.131 1.00 61.52 H new ATOM 551 N LYS A 36 2.743 -6.237 -20.040 1.00 63.52 N ATOM 552 CA LYS A 36 2.745 -5.014 -20.754 1.00 50.22 C ATOM 553 C LYS A 36 1.327 -4.789 -21.126 1.00 14.12 C ATOM 554 O LYS A 36 0.528 -5.730 -21.116 1.00 71.03 O ATOM 555 CB LYS A 36 3.590 -5.089 -22.055 1.00 3.50 C ATOM 556 CG LYS A 36 5.097 -5.224 -21.864 1.00 62.52 C ATOM 557 CD LYS A 36 5.707 -3.995 -21.182 1.00 61.33 C ATOM 558 CE LYS A 36 5.585 -2.726 -22.034 1.00 25.21 C ATOM 559 NZ LYS A 36 6.340 -2.815 -23.304 1.00 32.52 N ATOM 0 H LYS A 36 1.923 -6.802 -20.261 1.00 63.52 H new ATOM 0 HA LYS A 36 3.177 -4.220 -20.144 1.00 50.22 H new ATOM 0 HB2 LYS A 36 3.241 -5.937 -22.644 1.00 3.50 H new ATOM 0 HB3 LYS A 36 3.397 -4.192 -22.643 1.00 3.50 H new ATOM 0 HG2 LYS A 36 5.308 -6.111 -21.266 1.00 62.52 H new ATOM 0 HG3 LYS A 36 5.572 -5.373 -22.834 1.00 62.52 H new ATOM 0 HD2 LYS A 36 5.213 -3.834 -20.224 1.00 61.33 H new ATOM 0 HD3 LYS A 36 6.759 -4.186 -20.970 1.00 61.33 H new ATOM 0 HE2 LYS A 36 4.534 -2.541 -22.254 1.00 25.21 H new ATOM 0 HE3 LYS A 36 5.946 -1.872 -21.461 1.00 25.21 H new ATOM 0 HZ1 LYS A 36 6.336 -1.888 -23.776 1.00 32.52 H new ATOM 0 HZ2 LYS A 36 7.321 -3.098 -23.106 1.00 32.52 H new ATOM 0 HZ3 LYS A 36 5.894 -3.521 -23.924 1.00 32.52 H new ATOM 573 N GLY A 37 1.025 -3.608 -21.422 1.00 1.21 N ATOM 574 CA GLY A 37 -0.298 -3.229 -21.776 1.00 64.04 C ATOM 575 C GLY A 37 -0.560 -1.891 -21.210 1.00 52.43 C ATOM 576 O GLY A 37 0.304 -1.354 -20.487 1.00 62.13 O ATOM 0 H GLY A 37 1.695 -2.839 -21.432 1.00 1.21 H new ATOM 0 HA2 GLY A 37 -0.412 -3.212 -22.860 1.00 64.04 H new ATOM 0 HA3 GLY A 37 -1.017 -3.952 -21.391 1.00 64.04 H new ATOM 580 N ASP A 38 -1.674 -1.315 -21.505 1.00 24.13 N ATOM 581 CA ASP A 38 -1.961 -0.047 -20.921 1.00 24.05 C ATOM 582 C ASP A 38 -2.788 -0.284 -19.703 1.00 55.01 C ATOM 583 O ASP A 38 -3.919 -0.759 -19.782 1.00 60.10 O ATOM 584 CB ASP A 38 -2.662 0.898 -21.892 1.00 41.31 C ATOM 585 CG ASP A 38 -2.794 2.295 -21.321 1.00 45.22 C ATOM 586 OD1 ASP A 38 -1.754 3.018 -21.241 1.00 51.52 O ATOM 587 OD2 ASP A 38 -3.889 2.691 -20.944 1.00 43.32 O ATOM 0 H ASP A 38 -2.387 -1.689 -22.131 1.00 24.13 H new ATOM 0 HA ASP A 38 -1.026 0.447 -20.657 1.00 24.05 H new ATOM 0 HB2 ASP A 38 -2.103 0.939 -22.827 1.00 41.31 H new ATOM 0 HB3 ASP A 38 -3.652 0.507 -22.129 1.00 41.31 H new ATOM 592 N PHE A 39 -2.220 -0.002 -18.584 1.00 20.13 N ATOM 593 CA PHE A 39 -2.866 -0.252 -17.339 1.00 61.13 C ATOM 594 C PHE A 39 -3.198 1.051 -16.679 1.00 32.23 C ATOM 595 O PHE A 39 -2.317 1.907 -16.498 1.00 35.23 O ATOM 596 CB PHE A 39 -1.963 -1.099 -16.434 1.00 21.35 C ATOM 597 CG PHE A 39 -1.560 -2.427 -17.030 1.00 3.40 C ATOM 598 CD1 PHE A 39 -2.480 -3.435 -17.159 1.00 73.31 C ATOM 599 CD2 PHE A 39 -0.264 -2.655 -17.466 1.00 54.34 C ATOM 600 CE1 PHE A 39 -2.131 -4.651 -17.704 1.00 14.11 C ATOM 601 CE2 PHE A 39 0.092 -3.869 -18.012 1.00 0.43 C ATOM 602 CZ PHE A 39 -0.843 -4.869 -18.130 1.00 53.11 C ATOM 0 H PHE A 39 -1.291 0.410 -18.503 1.00 20.13 H new ATOM 0 HA PHE A 39 -3.788 -0.806 -17.515 1.00 61.13 H new ATOM 0 HB2 PHE A 39 -1.063 -0.529 -16.202 1.00 21.35 H new ATOM 0 HB3 PHE A 39 -2.479 -1.278 -15.491 1.00 21.35 H new ATOM 0 HD1 PHE A 39 -3.495 -3.273 -16.828 1.00 73.31 H new ATOM 0 HD2 PHE A 39 0.475 -1.872 -17.377 1.00 54.34 H new ATOM 0 HE1 PHE A 39 -2.870 -5.433 -17.796 1.00 14.11 H new ATOM 0 HE2 PHE A 39 1.105 -4.034 -18.347 1.00 0.43 H new ATOM 0 HZ PHE A 39 -0.567 -5.822 -18.556 1.00 53.11 H new ATOM 612 N LEU A 40 -4.442 1.218 -16.331 1.00 10.10 N ATOM 613 CA LEU A 40 -4.894 2.435 -15.699 1.00 11.32 C ATOM 614 C LEU A 40 -5.547 2.104 -14.386 1.00 61.40 C ATOM 615 O LEU A 40 -6.492 1.328 -14.335 1.00 74.33 O ATOM 616 CB LEU A 40 -5.880 3.200 -16.589 1.00 51.32 C ATOM 617 CG LEU A 40 -5.379 3.643 -17.967 1.00 13.21 C ATOM 618 CD1 LEU A 40 -6.493 4.315 -18.742 1.00 2.51 C ATOM 619 CD2 LEU A 40 -4.202 4.590 -17.827 1.00 54.21 C ATOM 0 H LEU A 40 -5.172 0.521 -16.474 1.00 10.10 H new ATOM 0 HA LEU A 40 -4.027 3.075 -15.535 1.00 11.32 H new ATOM 0 HB2 LEU A 40 -6.760 2.574 -16.735 1.00 51.32 H new ATOM 0 HB3 LEU A 40 -6.207 4.087 -16.047 1.00 51.32 H new ATOM 0 HG LEU A 40 -5.053 2.758 -18.513 1.00 13.21 H new ATOM 0 HD11 LEU A 40 -6.121 4.624 -19.719 1.00 2.51 H new ATOM 0 HD12 LEU A 40 -7.319 3.616 -18.873 1.00 2.51 H new ATOM 0 HD13 LEU A 40 -6.842 5.190 -18.193 1.00 2.51 H new ATOM 0 HD21 LEU A 40 -3.860 4.894 -18.816 1.00 54.21 H new ATOM 0 HD22 LEU A 40 -4.509 5.471 -17.263 1.00 54.21 H new ATOM 0 HD23 LEU A 40 -3.391 4.087 -17.301 1.00 54.21 H new ATOM 631 N ILE A 41 -5.058 2.679 -13.338 1.00 13.45 N ATOM 632 CA ILE A 41 -5.568 2.411 -12.033 1.00 73.33 C ATOM 633 C ILE A 41 -6.246 3.641 -11.500 1.00 23.04 C ATOM 634 O ILE A 41 -5.715 4.752 -11.624 1.00 75.22 O ATOM 635 CB ILE A 41 -4.445 1.968 -11.061 1.00 74.51 C ATOM 636 CG1 ILE A 41 -3.670 0.791 -11.683 1.00 5.14 C ATOM 637 CG2 ILE A 41 -5.031 1.601 -9.699 1.00 43.52 C ATOM 638 CD1 ILE A 41 -2.709 0.076 -10.766 1.00 20.44 C ATOM 0 H ILE A 41 -4.291 3.351 -13.362 1.00 13.45 H new ATOM 0 HA ILE A 41 -6.284 1.593 -12.109 1.00 73.33 H new ATOM 0 HB ILE A 41 -3.750 2.793 -10.901 1.00 74.51 H new ATOM 0 HG12 ILE A 41 -4.391 0.065 -12.059 1.00 5.14 H new ATOM 0 HG13 ILE A 41 -3.113 1.162 -12.543 1.00 5.14 H new ATOM 0 HG21 ILE A 41 -4.229 1.292 -9.029 1.00 43.52 H new ATOM 0 HG22 ILE A 41 -5.543 2.466 -9.278 1.00 43.52 H new ATOM 0 HG23 ILE A 41 -5.741 0.782 -9.817 1.00 43.52 H new ATOM 0 HD11 ILE A 41 -2.221 -0.733 -11.310 1.00 20.44 H new ATOM 0 HD12 ILE A 41 -1.957 0.779 -10.408 1.00 20.44 H new ATOM 0 HD13 ILE A 41 -3.254 -0.335 -9.917 1.00 20.44 H new ATOM 650 N ARG A 42 -7.428 3.469 -10.953 1.00 35.30 N ATOM 651 CA ARG A 42 -8.137 4.532 -10.410 1.00 43.34 C ATOM 652 C ARG A 42 -7.538 4.929 -9.088 1.00 10.15 C ATOM 653 O ARG A 42 -7.512 4.159 -8.121 1.00 42.21 O ATOM 654 CB ARG A 42 -9.593 4.194 -10.314 1.00 10.45 C ATOM 655 CG ARG A 42 -10.432 5.383 -10.079 1.00 62.51 C ATOM 656 CD ARG A 42 -11.838 5.131 -10.497 1.00 21.42 C ATOM 657 NE ARG A 42 -12.578 4.203 -9.648 1.00 52.23 N ATOM 658 CZ ARG A 42 -13.719 3.591 -10.031 1.00 23.33 C ATOM 659 NH1 ARG A 42 -14.177 3.752 -11.268 1.00 10.41 N ATOM 660 NH2 ARG A 42 -14.384 2.826 -9.190 1.00 13.11 N ATOM 0 H ARG A 42 -7.901 2.568 -10.887 1.00 35.30 H new ATOM 0 HA ARG A 42 -8.062 5.398 -11.067 1.00 43.34 H new ATOM 0 HB2 ARG A 42 -9.911 3.705 -11.235 1.00 10.45 H new ATOM 0 HB3 ARG A 42 -9.745 3.480 -9.505 1.00 10.45 H new ATOM 0 HG2 ARG A 42 -10.405 5.649 -9.022 1.00 62.51 H new ATOM 0 HG3 ARG A 42 -10.030 6.232 -10.632 1.00 62.51 H new ATOM 0 HD2 ARG A 42 -12.370 6.082 -10.520 1.00 21.42 H new ATOM 0 HD3 ARG A 42 -11.834 4.743 -11.516 1.00 21.42 H new ATOM 0 HE ARG A 42 -12.214 4.006 -8.716 1.00 52.23 H new ATOM 0 HH11 ARG A 42 -13.667 4.338 -11.929 1.00 10.41 H new ATOM 0 HH12 ARG A 42 -15.039 3.289 -11.557 1.00 10.41 H new ATOM 0 HH21 ARG A 42 -14.038 2.692 -8.240 1.00 13.11 H new ATOM 0 HH22 ARG A 42 -15.245 2.368 -9.489 1.00 13.11 H new ATOM 674 N THR A 43 -7.034 6.096 -9.088 1.00 43.22 N ATOM 675 CA THR A 43 -6.349 6.664 -8.003 1.00 3.04 C ATOM 676 C THR A 43 -7.132 7.867 -7.528 1.00 70.01 C ATOM 677 O THR A 43 -7.922 8.438 -8.300 1.00 40.53 O ATOM 678 CB THR A 43 -4.908 7.070 -8.424 1.00 32.42 C ATOM 679 OG1 THR A 43 -4.147 7.442 -7.281 1.00 75.32 O ATOM 680 CG2 THR A 43 -4.916 8.235 -9.412 1.00 0.34 C ATOM 0 H THR A 43 -7.092 6.718 -9.894 1.00 43.22 H new ATOM 0 HA THR A 43 -6.261 5.940 -7.193 1.00 3.04 H new ATOM 0 HB THR A 43 -4.458 6.204 -8.909 1.00 32.42 H new ATOM 0 HG1 THR A 43 -3.242 7.694 -7.559 1.00 75.32 H new ATOM 0 HG21 THR A 43 -3.891 8.490 -9.682 1.00 0.34 H new ATOM 0 HG22 THR A 43 -5.467 7.949 -10.308 1.00 0.34 H new ATOM 0 HG23 THR A 43 -5.395 9.099 -8.952 1.00 0.34 H new ATOM 688 N LYS A 44 -6.961 8.241 -6.296 1.00 32.11 N ATOM 689 CA LYS A 44 -7.660 9.366 -5.787 1.00 20.11 C ATOM 690 C LYS A 44 -6.679 10.494 -5.674 1.00 34.11 C ATOM 691 O LYS A 44 -5.780 10.488 -4.826 1.00 75.23 O ATOM 692 CB LYS A 44 -8.236 9.035 -4.424 1.00 12.11 C ATOM 693 CG LYS A 44 -9.255 7.916 -4.467 1.00 52.52 C ATOM 694 CD LYS A 44 -9.638 7.465 -3.083 1.00 75.12 C ATOM 695 CE LYS A 44 -10.361 8.533 -2.268 1.00 71.50 C ATOM 696 NZ LYS A 44 -11.686 8.872 -2.822 1.00 5.14 N ATOM 0 H LYS A 44 -6.342 7.779 -5.630 1.00 32.11 H new ATOM 0 HA LYS A 44 -8.482 9.643 -6.447 1.00 20.11 H new ATOM 0 HB2 LYS A 44 -7.425 8.755 -3.752 1.00 12.11 H new ATOM 0 HB3 LYS A 44 -8.702 9.927 -4.006 1.00 12.11 H new ATOM 0 HG2 LYS A 44 -10.144 8.253 -5.000 1.00 52.52 H new ATOM 0 HG3 LYS A 44 -8.848 7.073 -5.026 1.00 52.52 H new ATOM 0 HD2 LYS A 44 -10.277 6.585 -3.161 1.00 75.12 H new ATOM 0 HD3 LYS A 44 -8.739 7.159 -2.548 1.00 75.12 H new ATOM 0 HE2 LYS A 44 -10.479 8.184 -1.242 1.00 71.50 H new ATOM 0 HE3 LYS A 44 -9.747 9.433 -2.229 1.00 71.50 H new ATOM 0 HZ1 LYS A 44 -12.168 9.538 -2.185 1.00 5.14 H new ATOM 0 HZ2 LYS A 44 -11.569 9.310 -3.758 1.00 5.14 H new ATOM 0 HZ3 LYS A 44 -12.256 8.007 -2.914 1.00 5.14 H new ATOM 710 N LYS A 45 -6.839 11.451 -6.537 1.00 23.21 N ATOM 711 CA LYS A 45 -5.939 12.561 -6.638 1.00 25.12 C ATOM 712 C LYS A 45 -6.696 13.817 -6.280 1.00 11.20 C ATOM 713 O LYS A 45 -7.608 14.219 -7.007 1.00 71.21 O ATOM 714 CB LYS A 45 -5.418 12.656 -8.080 1.00 64.12 C ATOM 715 CG LYS A 45 -4.297 13.633 -8.303 1.00 44.21 C ATOM 716 CD LYS A 45 -3.868 13.600 -9.758 1.00 24.32 C ATOM 717 CE LYS A 45 -3.268 12.255 -10.202 1.00 24.35 C ATOM 718 NZ LYS A 45 -2.069 11.864 -9.435 1.00 32.13 N ATOM 0 H LYS A 45 -7.611 11.484 -7.202 1.00 23.21 H new ATOM 0 HA LYS A 45 -5.093 12.434 -5.963 1.00 25.12 H new ATOM 0 HB2 LYS A 45 -5.081 11.667 -8.392 1.00 64.12 H new ATOM 0 HB3 LYS A 45 -6.249 12.929 -8.730 1.00 64.12 H new ATOM 0 HG2 LYS A 45 -4.619 14.638 -8.032 1.00 44.21 H new ATOM 0 HG3 LYS A 45 -3.453 13.385 -7.660 1.00 44.21 H new ATOM 0 HD2 LYS A 45 -4.730 13.827 -10.386 1.00 24.32 H new ATOM 0 HD3 LYS A 45 -3.134 14.388 -9.928 1.00 24.32 H new ATOM 0 HE2 LYS A 45 -4.025 11.477 -10.100 1.00 24.35 H new ATOM 0 HE3 LYS A 45 -3.010 12.312 -11.260 1.00 24.35 H new ATOM 0 HZ1 LYS A 45 -1.517 11.172 -9.982 1.00 32.13 H new ATOM 0 HZ2 LYS A 45 -1.485 12.705 -9.251 1.00 32.13 H new ATOM 0 HZ3 LYS A 45 -2.358 11.439 -8.531 1.00 32.13 H new ATOM 732 N ASP A 46 -6.357 14.390 -5.134 1.00 24.33 N ATOM 733 CA ASP A 46 -6.991 15.613 -4.605 1.00 71.41 C ATOM 734 C ASP A 46 -8.497 15.376 -4.379 1.00 72.21 C ATOM 735 O ASP A 46 -9.332 16.281 -4.451 1.00 10.34 O ATOM 736 CB ASP A 46 -6.704 16.823 -5.535 1.00 64.52 C ATOM 737 CG ASP A 46 -7.230 18.143 -4.993 1.00 50.12 C ATOM 738 OD1 ASP A 46 -7.040 18.429 -3.783 1.00 34.23 O ATOM 739 OD2 ASP A 46 -7.863 18.909 -5.759 1.00 71.31 O ATOM 0 H ASP A 46 -5.624 14.021 -4.528 1.00 24.33 H new ATOM 0 HA ASP A 46 -6.557 15.856 -3.635 1.00 71.41 H new ATOM 0 HB2 ASP A 46 -5.628 16.906 -5.689 1.00 64.52 H new ATOM 0 HB3 ASP A 46 -7.152 16.636 -6.511 1.00 64.52 H new ATOM 744 N GLY A 47 -8.818 14.148 -4.037 1.00 2.43 N ATOM 745 CA GLY A 47 -10.180 13.783 -3.748 1.00 53.20 C ATOM 746 C GLY A 47 -10.960 13.377 -4.968 1.00 72.14 C ATOM 747 O GLY A 47 -12.176 13.265 -4.912 1.00 31.23 O ATOM 0 H GLY A 47 -8.147 13.384 -3.953 1.00 2.43 H new ATOM 0 HA2 GLY A 47 -10.184 12.961 -3.033 1.00 53.20 H new ATOM 0 HA3 GLY A 47 -10.680 14.625 -3.269 1.00 53.20 H new ATOM 751 N LYS A 48 -10.289 13.158 -6.071 1.00 22.42 N ATOM 752 CA LYS A 48 -10.981 12.749 -7.271 1.00 43.31 C ATOM 753 C LYS A 48 -10.471 11.400 -7.733 1.00 11.13 C ATOM 754 O LYS A 48 -9.262 11.178 -7.785 1.00 72.43 O ATOM 755 CB LYS A 48 -10.763 13.783 -8.384 1.00 32.51 C ATOM 756 CG LYS A 48 -11.158 15.199 -8.003 1.00 34.50 C ATOM 757 CD LYS A 48 -10.942 16.172 -9.147 1.00 54.42 C ATOM 758 CE LYS A 48 -11.243 17.602 -8.722 1.00 12.11 C ATOM 759 NZ LYS A 48 -12.631 17.776 -8.238 1.00 32.32 N ATOM 0 H LYS A 48 -9.278 13.254 -6.165 1.00 22.42 H new ATOM 0 HA LYS A 48 -12.046 12.676 -7.049 1.00 43.31 H new ATOM 0 HB2 LYS A 48 -9.711 13.776 -8.671 1.00 32.51 H new ATOM 0 HB3 LYS A 48 -11.335 13.482 -9.262 1.00 32.51 H new ATOM 0 HG2 LYS A 48 -12.206 15.216 -7.705 1.00 34.50 H new ATOM 0 HG3 LYS A 48 -10.575 15.519 -7.139 1.00 34.50 H new ATOM 0 HD2 LYS A 48 -9.912 16.103 -9.496 1.00 54.42 H new ATOM 0 HD3 LYS A 48 -11.581 15.898 -9.986 1.00 54.42 H new ATOM 0 HE2 LYS A 48 -10.549 17.896 -7.935 1.00 12.11 H new ATOM 0 HE3 LYS A 48 -11.070 18.271 -9.565 1.00 12.11 H new ATOM 0 HZ1 LYS A 48 -12.829 18.789 -8.107 1.00 32.32 H new ATOM 0 HZ2 LYS A 48 -13.294 17.381 -8.935 1.00 32.32 H new ATOM 0 HZ3 LYS A 48 -12.747 17.280 -7.331 1.00 32.32 H new ATOM 773 N GLN A 49 -11.384 10.510 -8.064 1.00 23.22 N ATOM 774 CA GLN A 49 -11.032 9.215 -8.610 1.00 51.31 C ATOM 775 C GLN A 49 -10.749 9.398 -10.085 1.00 61.22 C ATOM 776 O GLN A 49 -11.640 9.823 -10.840 1.00 74.34 O ATOM 777 CB GLN A 49 -12.205 8.243 -8.469 1.00 65.51 C ATOM 778 CG GLN A 49 -12.660 7.957 -7.055 1.00 0.04 C ATOM 779 CD GLN A 49 -13.911 7.098 -7.038 1.00 5.21 C ATOM 780 OE1 GLN A 49 -15.031 7.615 -7.054 1.00 11.34 O ATOM 781 NE2 GLN A 49 -13.748 5.803 -6.996 1.00 13.20 N ATOM 0 H GLN A 49 -12.387 10.663 -7.963 1.00 23.22 H new ATOM 0 HA GLN A 49 -10.168 8.816 -8.079 1.00 51.31 H new ATOM 0 HB2 GLN A 49 -13.051 8.642 -9.029 1.00 65.51 H new ATOM 0 HB3 GLN A 49 -11.928 7.299 -8.939 1.00 65.51 H new ATOM 0 HG2 GLN A 49 -11.863 7.452 -6.510 1.00 0.04 H new ATOM 0 HG3 GLN A 49 -12.855 8.896 -6.537 1.00 0.04 H new ATOM 0 HE21 GLN A 49 -12.808 5.407 -6.984 1.00 13.20 H new ATOM 0 HE22 GLN A 49 -14.561 5.187 -6.975 1.00 13.20 H new ATOM 790 N VAL A 50 -9.555 9.087 -10.493 1.00 44.44 N ATOM 791 CA VAL A 50 -9.147 9.217 -11.885 1.00 0.40 C ATOM 792 C VAL A 50 -8.358 7.998 -12.294 1.00 33.42 C ATOM 793 O VAL A 50 -7.829 7.301 -11.439 1.00 42.52 O ATOM 794 CB VAL A 50 -8.266 10.495 -12.125 1.00 34.31 C ATOM 795 CG1 VAL A 50 -9.054 11.776 -11.858 1.00 63.11 C ATOM 796 CG2 VAL A 50 -7.007 10.463 -11.255 1.00 31.22 C ATOM 0 H VAL A 50 -8.823 8.733 -9.877 1.00 44.44 H new ATOM 0 HA VAL A 50 -10.053 9.311 -12.484 1.00 0.40 H new ATOM 0 HB VAL A 50 -7.968 10.490 -13.174 1.00 34.31 H new ATOM 0 HG11 VAL A 50 -8.414 12.640 -12.034 1.00 63.11 H new ATOM 0 HG12 VAL A 50 -9.914 11.820 -12.526 1.00 63.11 H new ATOM 0 HG13 VAL A 50 -9.397 11.783 -10.823 1.00 63.11 H new ATOM 0 HG21 VAL A 50 -6.414 11.359 -11.440 1.00 31.22 H new ATOM 0 HG22 VAL A 50 -7.292 10.427 -10.204 1.00 31.22 H new ATOM 0 HG23 VAL A 50 -6.417 9.580 -11.501 1.00 31.22 H new ATOM 806 N TRP A 51 -8.265 7.743 -13.572 1.00 41.03 N ATOM 807 CA TRP A 51 -7.499 6.625 -14.043 1.00 42.00 C ATOM 808 C TRP A 51 -6.101 7.109 -14.375 1.00 71.43 C ATOM 809 O TRP A 51 -5.909 7.934 -15.277 1.00 0.31 O ATOM 810 CB TRP A 51 -8.142 6.010 -15.297 1.00 15.45 C ATOM 811 CG TRP A 51 -9.521 5.481 -15.116 1.00 64.22 C ATOM 812 CD1 TRP A 51 -10.637 6.009 -15.624 1.00 50.20 C ATOM 813 CD2 TRP A 51 -9.915 4.321 -14.391 1.00 13.44 C ATOM 814 NE1 TRP A 51 -11.727 5.256 -15.275 1.00 62.24 N ATOM 815 CE2 TRP A 51 -11.309 4.211 -14.510 1.00 0.34 C ATOM 816 CE3 TRP A 51 -9.229 3.366 -13.655 1.00 72.34 C ATOM 817 CZ2 TRP A 51 -12.031 3.183 -13.920 1.00 13.25 C ATOM 818 CZ3 TRP A 51 -9.948 2.342 -13.066 1.00 52.52 C ATOM 819 CH2 TRP A 51 -11.333 2.258 -13.203 1.00 13.21 C ATOM 0 H TRP A 51 -8.711 8.296 -14.304 1.00 41.03 H new ATOM 0 HA TRP A 51 -7.466 5.859 -13.268 1.00 42.00 H new ATOM 0 HB2 TRP A 51 -8.162 6.766 -16.082 1.00 15.45 H new ATOM 0 HB3 TRP A 51 -7.504 5.200 -15.651 1.00 15.45 H new ATOM 0 HD1 TRP A 51 -10.675 6.905 -16.226 1.00 50.20 H new ATOM 0 HE1 TRP A 51 -12.692 5.447 -15.544 1.00 62.24 H new ATOM 0 HE3 TRP A 51 -8.156 3.421 -13.544 1.00 72.34 H new ATOM 0 HZ2 TRP A 51 -13.104 3.119 -14.025 1.00 13.25 H new ATOM 0 HZ3 TRP A 51 -9.427 1.593 -12.489 1.00 52.52 H new ATOM 0 HH2 TRP A 51 -11.863 1.444 -12.732 1.00 13.21 H new ATOM 830 N GLU A 52 -5.149 6.623 -13.643 1.00 23.33 N ATOM 831 CA GLU A 52 -3.774 6.990 -13.822 1.00 11.24 C ATOM 832 C GLU A 52 -3.004 5.761 -14.248 1.00 22.04 C ATOM 833 O GLU A 52 -3.335 4.655 -13.835 1.00 32.44 O ATOM 834 CB GLU A 52 -3.212 7.553 -12.514 1.00 54.33 C ATOM 835 CG GLU A 52 -1.774 8.023 -12.599 1.00 62.33 C ATOM 836 CD GLU A 52 -1.254 8.536 -11.282 1.00 60.34 C ATOM 837 OE1 GLU A 52 -1.393 9.743 -10.989 1.00 21.42 O ATOM 838 OE2 GLU A 52 -0.684 7.747 -10.522 1.00 70.11 O ATOM 0 H GLU A 52 -5.304 5.950 -12.892 1.00 23.33 H new ATOM 0 HA GLU A 52 -3.684 7.760 -14.588 1.00 11.24 H new ATOM 0 HB2 GLU A 52 -3.836 8.388 -12.195 1.00 54.33 H new ATOM 0 HB3 GLU A 52 -3.286 6.787 -11.742 1.00 54.33 H new ATOM 0 HG2 GLU A 52 -1.146 7.199 -12.937 1.00 62.33 H new ATOM 0 HG3 GLU A 52 -1.697 8.811 -13.348 1.00 62.33 H new ATOM 845 N ALA A 53 -2.016 5.946 -15.084 1.00 61.51 N ATOM 846 CA ALA A 53 -1.217 4.845 -15.571 1.00 73.45 C ATOM 847 C ALA A 53 -0.486 4.146 -14.434 1.00 33.32 C ATOM 848 O ALA A 53 -0.007 4.792 -13.486 1.00 22.44 O ATOM 849 CB ALA A 53 -0.237 5.317 -16.629 1.00 22.43 C ATOM 0 H ALA A 53 -1.741 6.859 -15.447 1.00 61.51 H new ATOM 0 HA ALA A 53 -1.893 4.122 -16.027 1.00 73.45 H new ATOM 0 HB1 ALA A 53 0.354 4.471 -16.981 1.00 22.43 H new ATOM 0 HB2 ALA A 53 -0.785 5.750 -17.466 1.00 22.43 H new ATOM 0 HB3 ALA A 53 0.426 6.069 -16.201 1.00 22.43 H new ATOM 855 N ALA A 54 -0.450 2.835 -14.513 1.00 34.50 N ATOM 856 CA ALA A 54 0.265 2.014 -13.562 1.00 3.23 C ATOM 857 C ALA A 54 1.753 2.307 -13.645 1.00 75.21 C ATOM 858 O ALA A 54 2.246 2.772 -14.675 1.00 41.03 O ATOM 859 CB ALA A 54 0.000 0.545 -13.830 1.00 50.51 C ATOM 0 H ALA A 54 -0.920 2.304 -15.246 1.00 34.50 H new ATOM 0 HA ALA A 54 -0.086 2.249 -12.557 1.00 3.23 H new ATOM 0 HB1 ALA A 54 0.545 -0.061 -13.106 1.00 50.51 H new ATOM 0 HB2 ALA A 54 -1.068 0.345 -13.740 1.00 50.51 H new ATOM 0 HB3 ALA A 54 0.332 0.293 -14.837 1.00 50.51 H new ATOM 865 N SER A 55 2.459 2.013 -12.605 1.00 32.14 N ATOM 866 CA SER A 55 3.848 2.319 -12.532 1.00 21.05 C ATOM 867 C SER A 55 4.614 1.152 -13.046 1.00 23.23 C ATOM 868 O SER A 55 4.197 0.012 -12.838 1.00 73.24 O ATOM 869 CB SER A 55 4.232 2.601 -11.067 1.00 15.44 C ATOM 870 OG SER A 55 5.630 2.804 -10.908 1.00 54.15 O ATOM 0 H SER A 55 2.086 1.550 -11.776 1.00 32.14 H new ATOM 0 HA SER A 55 4.076 3.201 -13.131 1.00 21.05 H new ATOM 0 HB2 SER A 55 3.696 3.483 -10.716 1.00 15.44 H new ATOM 0 HB3 SER A 55 3.914 1.766 -10.443 1.00 15.44 H new ATOM 0 HG SER A 55 5.830 2.981 -9.965 1.00 54.15 H new ATOM 876 N LYS A 56 5.730 1.407 -13.708 1.00 53.41 N ATOM 877 CA LYS A 56 6.574 0.327 -14.183 1.00 34.11 C ATOM 878 C LYS A 56 7.029 -0.518 -13.016 1.00 1.51 C ATOM 879 O LYS A 56 7.047 -1.733 -13.097 1.00 13.52 O ATOM 880 CB LYS A 56 7.778 0.833 -15.004 1.00 70.24 C ATOM 881 CG LYS A 56 7.476 1.278 -16.451 1.00 20.55 C ATOM 882 CD LYS A 56 6.488 2.433 -16.566 1.00 71.14 C ATOM 883 CE LYS A 56 6.289 2.811 -18.030 1.00 31.41 C ATOM 884 NZ LYS A 56 5.335 3.928 -18.216 1.00 25.02 N ATOM 0 H LYS A 56 6.069 2.344 -13.927 1.00 53.41 H new ATOM 0 HA LYS A 56 5.978 -0.285 -14.860 1.00 34.11 H new ATOM 0 HB2 LYS A 56 8.226 1.673 -14.473 1.00 70.24 H new ATOM 0 HB3 LYS A 56 8.527 0.042 -15.038 1.00 70.24 H new ATOM 0 HG2 LYS A 56 8.411 1.568 -16.931 1.00 20.55 H new ATOM 0 HG3 LYS A 56 7.084 0.425 -17.005 1.00 20.55 H new ATOM 0 HD2 LYS A 56 5.533 2.150 -16.123 1.00 71.14 H new ATOM 0 HD3 LYS A 56 6.856 3.293 -16.007 1.00 71.14 H new ATOM 0 HE2 LYS A 56 7.251 3.087 -18.462 1.00 31.41 H new ATOM 0 HE3 LYS A 56 5.931 1.940 -18.579 1.00 31.41 H new ATOM 0 HZ1 LYS A 56 5.241 4.139 -19.230 1.00 25.02 H new ATOM 0 HZ2 LYS A 56 4.407 3.660 -17.831 1.00 25.02 H new ATOM 0 HZ3 LYS A 56 5.686 4.771 -17.718 1.00 25.02 H new ATOM 898 N THR A 57 7.313 0.139 -11.910 1.00 53.11 N ATOM 899 CA THR A 57 7.732 -0.529 -10.710 1.00 65.45 C ATOM 900 C THR A 57 6.566 -1.324 -10.079 1.00 52.11 C ATOM 901 O THR A 57 6.744 -2.463 -9.661 1.00 14.11 O ATOM 902 CB THR A 57 8.314 0.493 -9.714 1.00 11.25 C ATOM 903 OG1 THR A 57 9.409 1.179 -10.355 1.00 3.53 O ATOM 904 CG2 THR A 57 8.819 -0.195 -8.446 1.00 15.55 C ATOM 0 H THR A 57 7.257 1.154 -11.825 1.00 53.11 H new ATOM 0 HA THR A 57 8.512 -1.246 -10.965 1.00 65.45 H new ATOM 0 HB THR A 57 7.531 1.195 -9.427 1.00 11.25 H new ATOM 0 HG1 THR A 57 9.791 1.835 -9.736 1.00 3.53 H new ATOM 0 HG21 THR A 57 9.224 0.552 -7.763 1.00 15.55 H new ATOM 0 HG22 THR A 57 7.994 -0.719 -7.963 1.00 15.55 H new ATOM 0 HG23 THR A 57 9.600 -0.909 -8.706 1.00 15.55 H new ATOM 912 N ALA A 58 5.371 -0.735 -10.054 1.00 73.50 N ATOM 913 CA ALA A 58 4.194 -1.416 -9.480 1.00 13.15 C ATOM 914 C ALA A 58 3.803 -2.618 -10.333 1.00 32.35 C ATOM 915 O ALA A 58 3.347 -3.650 -9.821 1.00 12.14 O ATOM 916 CB ALA A 58 3.024 -0.457 -9.326 1.00 51.15 C ATOM 0 H ALA A 58 5.185 0.200 -10.418 1.00 73.50 H new ATOM 0 HA ALA A 58 4.462 -1.773 -8.486 1.00 13.15 H new ATOM 0 HB1 ALA A 58 2.172 -0.988 -8.901 1.00 51.15 H new ATOM 0 HB2 ALA A 58 3.309 0.361 -8.664 1.00 51.15 H new ATOM 0 HB3 ALA A 58 2.751 -0.056 -10.302 1.00 51.15 H new ATOM 922 N LEU A 59 3.996 -2.480 -11.625 1.00 3.10 N ATOM 923 CA LEU A 59 3.771 -3.549 -12.559 1.00 64.44 C ATOM 924 C LEU A 59 4.724 -4.721 -12.277 1.00 33.35 C ATOM 925 O LEU A 59 4.324 -5.879 -12.361 1.00 30.10 O ATOM 926 CB LEU A 59 3.929 -3.027 -13.999 1.00 31.11 C ATOM 927 CG LEU A 59 2.827 -2.112 -14.533 1.00 51.22 C ATOM 928 CD1 LEU A 59 3.247 -1.514 -15.865 1.00 11.22 C ATOM 929 CD2 LEU A 59 1.557 -2.897 -14.733 1.00 1.53 C ATOM 0 H LEU A 59 4.316 -1.613 -12.057 1.00 3.10 H new ATOM 0 HA LEU A 59 2.753 -3.920 -12.441 1.00 64.44 H new ATOM 0 HB2 LEU A 59 4.875 -2.489 -14.062 1.00 31.11 H new ATOM 0 HB3 LEU A 59 4.006 -3.887 -14.664 1.00 31.11 H new ATOM 0 HG LEU A 59 2.658 -1.315 -13.809 1.00 51.22 H new ATOM 0 HD11 LEU A 59 2.456 -0.864 -16.238 1.00 11.22 H new ATOM 0 HD12 LEU A 59 4.160 -0.934 -15.732 1.00 11.22 H new ATOM 0 HD13 LEU A 59 3.427 -2.314 -16.583 1.00 11.22 H new ATOM 0 HD21 LEU A 59 0.777 -2.237 -15.114 1.00 1.53 H new ATOM 0 HD22 LEU A 59 1.734 -3.700 -15.449 1.00 1.53 H new ATOM 0 HD23 LEU A 59 1.239 -3.323 -13.781 1.00 1.53 H new ATOM 941 N LYS A 60 5.969 -4.409 -11.894 1.00 74.20 N ATOM 942 CA LYS A 60 6.965 -5.447 -11.586 1.00 13.31 C ATOM 943 C LYS A 60 6.500 -6.328 -10.423 1.00 43.02 C ATOM 944 O LYS A 60 6.682 -7.538 -10.449 1.00 62.02 O ATOM 945 CB LYS A 60 8.345 -4.850 -11.263 1.00 31.30 C ATOM 946 CG LYS A 60 8.929 -3.957 -12.341 1.00 14.35 C ATOM 947 CD LYS A 60 9.077 -4.665 -13.679 1.00 11.20 C ATOM 948 CE LYS A 60 9.634 -3.709 -14.713 1.00 32.03 C ATOM 949 NZ LYS A 60 9.748 -4.323 -16.058 1.00 22.43 N ATOM 0 H LYS A 60 6.310 -3.453 -11.790 1.00 74.20 H new ATOM 0 HA LYS A 60 7.063 -6.059 -12.483 1.00 13.31 H new ATOM 0 HB2 LYS A 60 8.268 -4.276 -10.340 1.00 31.30 H new ATOM 0 HB3 LYS A 60 9.041 -5.667 -11.073 1.00 31.30 H new ATOM 0 HG2 LYS A 60 8.291 -3.083 -12.467 1.00 14.35 H new ATOM 0 HG3 LYS A 60 9.905 -3.595 -12.017 1.00 14.35 H new ATOM 0 HD2 LYS A 60 9.738 -5.525 -13.573 1.00 11.20 H new ATOM 0 HD3 LYS A 60 8.110 -5.045 -14.007 1.00 11.20 H new ATOM 0 HE2 LYS A 60 8.992 -2.830 -14.773 1.00 32.03 H new ATOM 0 HE3 LYS A 60 10.617 -3.364 -14.391 1.00 32.03 H new ATOM 0 HZ1 LYS A 60 10.134 -3.626 -16.726 1.00 22.43 H new ATOM 0 HZ2 LYS A 60 10.382 -5.146 -16.011 1.00 22.43 H new ATOM 0 HZ3 LYS A 60 8.808 -4.628 -16.381 1.00 22.43 H new ATOM 963 N LYS A 61 5.883 -5.713 -9.404 1.00 61.53 N ATOM 964 CA LYS A 61 5.362 -6.477 -8.251 1.00 34.01 C ATOM 965 C LYS A 61 4.233 -7.407 -8.666 1.00 54.13 C ATOM 966 O LYS A 61 4.107 -8.524 -8.145 1.00 13.12 O ATOM 967 CB LYS A 61 4.891 -5.567 -7.088 1.00 34.32 C ATOM 968 CG LYS A 61 5.993 -4.925 -6.236 1.00 12.13 C ATOM 969 CD LYS A 61 6.912 -4.020 -7.027 1.00 41.33 C ATOM 970 CE LYS A 61 7.965 -3.380 -6.141 1.00 42.44 C ATOM 971 NZ LYS A 61 8.808 -4.386 -5.462 1.00 13.33 N ATOM 0 H LYS A 61 5.732 -4.706 -9.350 1.00 61.53 H new ATOM 0 HA LYS A 61 6.200 -7.071 -7.886 1.00 34.01 H new ATOM 0 HB2 LYS A 61 4.274 -4.771 -7.505 1.00 34.32 H new ATOM 0 HB3 LYS A 61 4.251 -6.156 -6.431 1.00 34.32 H new ATOM 0 HG2 LYS A 61 5.533 -4.350 -5.432 1.00 12.13 H new ATOM 0 HG3 LYS A 61 6.585 -5.711 -5.767 1.00 12.13 H new ATOM 0 HD2 LYS A 61 7.399 -4.594 -7.815 1.00 41.33 H new ATOM 0 HD3 LYS A 61 6.325 -3.242 -7.516 1.00 41.33 H new ATOM 0 HE2 LYS A 61 8.596 -2.726 -6.743 1.00 42.44 H new ATOM 0 HE3 LYS A 61 7.477 -2.753 -5.394 1.00 42.44 H new ATOM 0 HZ1 LYS A 61 9.649 -3.922 -5.063 1.00 13.33 H new ATOM 0 HZ2 LYS A 61 8.265 -4.835 -4.697 1.00 13.33 H new ATOM 0 HZ3 LYS A 61 9.104 -5.110 -6.147 1.00 13.33 H new ATOM 985 N SER A 62 3.450 -6.961 -9.616 1.00 51.55 N ATOM 986 CA SER A 62 2.328 -7.714 -10.096 1.00 1.10 C ATOM 987 C SER A 62 2.814 -8.909 -10.919 1.00 23.11 C ATOM 988 O SER A 62 2.288 -10.018 -10.803 1.00 21.30 O ATOM 989 CB SER A 62 1.439 -6.784 -10.915 1.00 24.24 C ATOM 990 OG SER A 62 1.064 -5.660 -10.114 1.00 71.11 O ATOM 0 H SER A 62 3.577 -6.060 -10.078 1.00 51.55 H new ATOM 0 HA SER A 62 1.747 -8.112 -9.264 1.00 1.10 H new ATOM 0 HB2 SER A 62 1.968 -6.449 -11.807 1.00 24.24 H new ATOM 0 HB3 SER A 62 0.550 -7.317 -11.253 1.00 24.24 H new ATOM 0 HG SER A 62 1.821 -5.042 -10.043 1.00 71.11 H new ATOM 996 N TRP A 63 3.855 -8.690 -11.708 1.00 72.53 N ATOM 997 CA TRP A 63 4.412 -9.730 -12.524 1.00 31.45 C ATOM 998 C TRP A 63 5.224 -10.709 -11.688 1.00 13.33 C ATOM 999 O TRP A 63 5.215 -11.900 -11.951 1.00 22.11 O ATOM 1000 CB TRP A 63 5.252 -9.140 -13.641 1.00 50.40 C ATOM 1001 CG TRP A 63 5.860 -10.162 -14.536 1.00 42.14 C ATOM 1002 CD1 TRP A 63 7.151 -10.556 -14.538 1.00 51.32 C ATOM 1003 CD2 TRP A 63 5.192 -10.945 -15.536 1.00 10.10 C ATOM 1004 NE1 TRP A 63 7.354 -11.506 -15.508 1.00 72.32 N ATOM 1005 CE2 TRP A 63 6.159 -11.769 -16.128 1.00 43.54 C ATOM 1006 CE3 TRP A 63 3.868 -11.021 -15.997 1.00 51.24 C ATOM 1007 CZ2 TRP A 63 5.854 -12.654 -17.155 1.00 11.21 C ATOM 1008 CZ3 TRP A 63 3.572 -11.911 -17.017 1.00 10.35 C ATOM 1009 CH2 TRP A 63 4.563 -12.712 -17.582 1.00 42.24 C ATOM 0 H TRP A 63 4.326 -7.789 -11.793 1.00 72.53 H new ATOM 0 HA TRP A 63 3.589 -10.285 -12.974 1.00 31.45 H new ATOM 0 HB2 TRP A 63 4.630 -8.472 -14.237 1.00 50.40 H new ATOM 0 HB3 TRP A 63 6.046 -8.533 -13.205 1.00 50.40 H new ATOM 0 HD1 TRP A 63 7.914 -10.179 -13.873 1.00 51.32 H new ATOM 0 HE1 TRP A 63 8.247 -11.945 -15.731 1.00 72.32 H new ATOM 0 HE3 TRP A 63 3.097 -10.399 -15.566 1.00 51.24 H new ATOM 0 HZ2 TRP A 63 6.617 -13.276 -17.600 1.00 11.21 H new ATOM 0 HZ3 TRP A 63 2.558 -11.985 -17.380 1.00 10.35 H new ATOM 0 HH2 TRP A 63 4.300 -13.394 -18.377 1.00 42.24 H new ATOM 1020 N LYS A 64 5.913 -10.210 -10.679 1.00 31.24 N ATOM 1021 CA LYS A 64 6.684 -11.069 -9.804 1.00 23.11 C ATOM 1022 C LYS A 64 5.772 -12.053 -9.083 1.00 40.22 C ATOM 1023 O LYS A 64 6.110 -13.221 -8.899 1.00 62.44 O ATOM 1024 CB LYS A 64 7.469 -10.253 -8.805 1.00 51.10 C ATOM 1025 CG LYS A 64 8.339 -11.105 -7.917 1.00 23.30 C ATOM 1026 CD LYS A 64 9.115 -10.281 -6.946 1.00 71.25 C ATOM 1027 CE LYS A 64 10.143 -9.391 -7.628 1.00 4.33 C ATOM 1028 NZ LYS A 64 10.932 -8.624 -6.647 1.00 61.34 N ATOM 0 H LYS A 64 5.954 -9.218 -10.447 1.00 31.24 H new ATOM 0 HA LYS A 64 7.389 -11.631 -10.416 1.00 23.11 H new ATOM 0 HB2 LYS A 64 8.093 -9.535 -9.338 1.00 51.10 H new ATOM 0 HB3 LYS A 64 6.778 -9.679 -8.188 1.00 51.10 H new ATOM 0 HG2 LYS A 64 7.717 -11.817 -7.374 1.00 23.30 H new ATOM 0 HG3 LYS A 64 9.027 -11.686 -8.531 1.00 23.30 H new ATOM 0 HD2 LYS A 64 8.428 -9.661 -6.370 1.00 71.25 H new ATOM 0 HD3 LYS A 64 9.621 -10.939 -6.239 1.00 71.25 H new ATOM 0 HE2 LYS A 64 10.811 -10.004 -8.234 1.00 4.33 H new ATOM 0 HE3 LYS A 64 9.637 -8.704 -8.306 1.00 4.33 H new ATOM 0 HZ1 LYS A 64 11.623 -8.028 -7.147 1.00 61.34 H new ATOM 0 HZ2 LYS A 64 10.297 -8.021 -6.086 1.00 61.34 H new ATOM 0 HZ3 LYS A 64 11.434 -9.281 -6.016 1.00 61.34 H new ATOM 1042 N ARG A 65 4.611 -11.582 -8.693 1.00 50.14 N ATOM 1043 CA ARG A 65 3.650 -12.428 -8.032 1.00 43.34 C ATOM 1044 C ARG A 65 3.012 -13.397 -9.053 1.00 41.21 C ATOM 1045 O ARG A 65 2.589 -14.503 -8.714 1.00 11.31 O ATOM 1046 CB ARG A 65 2.622 -11.582 -7.307 1.00 42.34 C ATOM 1047 CG ARG A 65 1.698 -12.365 -6.392 1.00 22.43 C ATOM 1048 CD ARG A 65 0.849 -11.433 -5.561 1.00 44.11 C ATOM 1049 NE ARG A 65 1.674 -10.631 -4.641 1.00 45.13 N ATOM 1050 CZ ARG A 65 1.205 -9.667 -3.837 1.00 2.24 C ATOM 1051 NH1 ARG A 65 -0.075 -9.345 -3.858 1.00 75.55 N ATOM 1052 NH2 ARG A 65 2.029 -9.031 -3.010 1.00 71.45 N ATOM 0 H ARG A 65 4.310 -10.616 -8.823 1.00 50.14 H new ATOM 0 HA ARG A 65 4.149 -13.037 -7.278 1.00 43.34 H new ATOM 0 HB2 ARG A 65 3.142 -10.826 -6.718 1.00 42.34 H new ATOM 0 HB3 ARG A 65 2.019 -11.052 -8.045 1.00 42.34 H new ATOM 0 HG2 ARG A 65 1.056 -13.016 -6.986 1.00 22.43 H new ATOM 0 HG3 ARG A 65 2.286 -13.008 -5.738 1.00 22.43 H new ATOM 0 HD2 ARG A 65 0.284 -10.771 -6.217 1.00 44.11 H new ATOM 0 HD3 ARG A 65 0.123 -12.012 -4.990 1.00 44.11 H new ATOM 0 HE ARG A 65 2.675 -10.824 -4.614 1.00 45.13 H new ATOM 0 HH11 ARG A 65 -0.713 -9.831 -4.489 1.00 75.55 H new ATOM 0 HH12 ARG A 65 -0.426 -8.610 -3.244 1.00 75.55 H new ATOM 0 HH21 ARG A 65 3.019 -9.277 -2.987 1.00 71.45 H new ATOM 0 HH22 ARG A 65 1.672 -8.297 -2.398 1.00 71.45 H new ATOM 1066 N TYR A 66 2.950 -12.957 -10.292 1.00 11.24 N ATOM 1067 CA TYR A 66 2.480 -13.773 -11.413 1.00 51.22 C ATOM 1068 C TYR A 66 3.456 -14.952 -11.619 1.00 35.54 C ATOM 1069 O TYR A 66 3.027 -16.106 -11.764 1.00 74.23 O ATOM 1070 CB TYR A 66 2.413 -12.887 -12.656 1.00 61.32 C ATOM 1071 CG TYR A 66 1.866 -13.543 -13.878 1.00 75.41 C ATOM 1072 CD1 TYR A 66 0.513 -13.522 -14.148 1.00 64.43 C ATOM 1073 CD2 TYR A 66 2.696 -14.166 -14.771 1.00 63.54 C ATOM 1074 CE1 TYR A 66 0.008 -14.113 -15.280 1.00 13.34 C ATOM 1075 CE2 TYR A 66 2.208 -14.756 -15.900 1.00 34.52 C ATOM 1076 CZ TYR A 66 0.871 -14.733 -16.156 1.00 54.25 C ATOM 1077 OH TYR A 66 0.396 -15.335 -17.297 1.00 13.41 O ATOM 0 H TYR A 66 3.226 -12.013 -10.562 1.00 11.24 H new ATOM 0 HA TYR A 66 1.489 -14.181 -11.215 1.00 51.22 H new ATOM 0 HB2 TYR A 66 1.801 -12.014 -12.427 1.00 61.32 H new ATOM 0 HB3 TYR A 66 3.416 -12.523 -12.877 1.00 61.32 H new ATOM 0 HD1 TYR A 66 -0.159 -13.033 -13.458 1.00 64.43 H new ATOM 0 HD2 TYR A 66 3.758 -14.191 -14.578 1.00 63.54 H new ATOM 0 HE1 TYR A 66 -1.053 -14.092 -15.481 1.00 13.34 H new ATOM 0 HE2 TYR A 66 2.882 -15.241 -16.590 1.00 34.52 H new ATOM 0 HH TYR A 66 1.144 -15.721 -17.799 1.00 13.41 H new ATOM 1087 N GLU A 67 4.779 -14.640 -11.601 1.00 2.35 N ATOM 1088 CA GLU A 67 5.873 -15.655 -11.656 1.00 4.42 C ATOM 1089 C GLU A 67 5.636 -16.671 -10.574 1.00 5.41 C ATOM 1090 O GLU A 67 5.669 -17.868 -10.803 1.00 5.53 O ATOM 1091 CB GLU A 67 7.217 -14.982 -11.329 1.00 23.22 C ATOM 1092 CG GLU A 67 7.620 -13.866 -12.249 1.00 51.55 C ATOM 1093 CD GLU A 67 8.175 -14.334 -13.582 1.00 13.50 C ATOM 1094 OE1 GLU A 67 7.412 -14.770 -14.459 1.00 13.03 O ATOM 1095 OE2 GLU A 67 9.407 -14.243 -13.772 1.00 52.22 O ATOM 0 H GLU A 67 5.120 -13.680 -11.548 1.00 2.35 H new ATOM 0 HA GLU A 67 5.890 -16.107 -12.648 1.00 4.42 H new ATOM 0 HB2 GLU A 67 7.171 -14.593 -10.312 1.00 23.22 H new ATOM 0 HB3 GLU A 67 7.998 -15.742 -11.344 1.00 23.22 H new ATOM 0 HG2 GLU A 67 6.755 -13.229 -12.431 1.00 51.55 H new ATOM 0 HG3 GLU A 67 8.370 -13.251 -11.751 1.00 51.55 H new ATOM 1102 N GLN A 68 5.343 -16.151 -9.407 1.00 32.31 N ATOM 1103 CA GLN A 68 5.141 -16.883 -8.226 1.00 54.33 C ATOM 1104 C GLN A 68 4.081 -17.992 -8.397 1.00 34.23 C ATOM 1105 O GLN A 68 4.333 -19.140 -8.010 1.00 74.33 O ATOM 1106 CB GLN A 68 4.745 -15.862 -7.188 1.00 2.45 C ATOM 1107 CG GLN A 68 4.350 -16.370 -5.867 1.00 41.13 C ATOM 1108 CD GLN A 68 5.449 -17.102 -5.137 1.00 25.32 C ATOM 1109 OE1 GLN A 68 6.636 -16.823 -5.324 1.00 33.11 O ATOM 1110 NE2 GLN A 68 5.073 -18.013 -4.285 1.00 22.32 N ATOM 0 H GLN A 68 5.238 -15.146 -9.271 1.00 32.31 H new ATOM 0 HA GLN A 68 6.042 -17.420 -7.930 1.00 54.33 H new ATOM 0 HB2 GLN A 68 5.582 -15.177 -7.051 1.00 2.45 H new ATOM 0 HB3 GLN A 68 3.916 -15.277 -7.587 1.00 2.45 H new ATOM 0 HG2 GLN A 68 4.014 -15.534 -5.253 1.00 41.13 H new ATOM 0 HG3 GLN A 68 3.498 -17.040 -5.986 1.00 41.13 H new ATOM 0 HE21 GLN A 68 4.081 -18.215 -4.159 1.00 22.32 H new ATOM 0 HE22 GLN A 68 5.770 -18.524 -3.744 1.00 22.32 H new ATOM 1119 N GLU A 69 2.914 -17.677 -8.982 1.00 43.22 N ATOM 1120 CA GLU A 69 1.906 -18.725 -9.152 1.00 31.24 C ATOM 1121 C GLU A 69 2.252 -19.676 -10.300 1.00 73.14 C ATOM 1122 O GLU A 69 2.120 -20.891 -10.169 1.00 21.34 O ATOM 1123 CB GLU A 69 0.456 -18.218 -9.311 1.00 22.11 C ATOM 1124 CG GLU A 69 0.118 -17.526 -10.618 1.00 71.14 C ATOM 1125 CD GLU A 69 -1.375 -17.367 -10.771 1.00 40.33 C ATOM 1126 OE1 GLU A 69 -2.087 -18.390 -10.732 1.00 51.40 O ATOM 1127 OE2 GLU A 69 -1.873 -16.235 -10.900 1.00 74.24 O ATOM 0 H GLU A 69 2.656 -16.753 -9.328 1.00 43.22 H new ATOM 0 HA GLU A 69 1.937 -19.267 -8.207 1.00 31.24 H new ATOM 0 HB2 GLU A 69 -0.217 -19.067 -9.191 1.00 22.11 H new ATOM 0 HB3 GLU A 69 0.245 -17.527 -8.495 1.00 22.11 H new ATOM 0 HG2 GLU A 69 0.598 -16.548 -10.651 1.00 71.14 H new ATOM 0 HG3 GLU A 69 0.514 -18.104 -11.453 1.00 71.14 H new ATOM 1134 N MET A 70 2.712 -19.131 -11.418 1.00 13.15 N ATOM 1135 CA MET A 70 2.948 -19.946 -12.606 1.00 41.51 C ATOM 1136 C MET A 70 4.130 -20.888 -12.446 1.00 2.02 C ATOM 1137 O MET A 70 4.111 -21.996 -12.959 1.00 71.13 O ATOM 1138 CB MET A 70 3.005 -19.096 -13.912 1.00 1.03 C ATOM 1139 CG MET A 70 4.119 -18.045 -14.011 1.00 45.12 C ATOM 1140 SD MET A 70 5.786 -18.732 -14.198 1.00 73.34 S ATOM 1141 CE MET A 70 5.621 -19.576 -15.769 1.00 43.23 C ATOM 0 H MET A 70 2.928 -18.140 -11.529 1.00 13.15 H new ATOM 0 HA MET A 70 2.077 -20.592 -12.715 1.00 41.51 H new ATOM 0 HB2 MET A 70 3.107 -19.778 -14.756 1.00 1.03 H new ATOM 0 HB3 MET A 70 2.048 -18.587 -14.027 1.00 1.03 H new ATOM 0 HG2 MET A 70 3.911 -17.393 -14.859 1.00 45.12 H new ATOM 0 HG3 MET A 70 4.094 -17.423 -13.117 1.00 45.12 H new ATOM 0 HE1 MET A 70 6.609 -19.743 -16.198 1.00 43.23 H new ATOM 0 HE2 MET A 70 5.125 -20.535 -15.617 1.00 43.23 H new ATOM 0 HE3 MET A 70 5.028 -18.965 -16.450 1.00 43.23 H new ATOM 1151 N LEU A 71 5.130 -20.462 -11.695 1.00 22.31 N ATOM 1152 CA LEU A 71 6.309 -21.258 -11.437 1.00 73.51 C ATOM 1153 C LEU A 71 5.956 -22.367 -10.431 1.00 34.04 C ATOM 1154 O LEU A 71 6.593 -23.441 -10.376 1.00 74.14 O ATOM 1155 CB LEU A 71 7.402 -20.335 -10.877 1.00 5.44 C ATOM 1156 CG LEU A 71 8.752 -20.952 -10.586 1.00 54.44 C ATOM 1157 CD1 LEU A 71 9.427 -21.397 -11.873 1.00 31.04 C ATOM 1158 CD2 LEU A 71 9.631 -19.987 -9.812 1.00 53.21 C ATOM 0 H LEU A 71 5.143 -19.547 -11.245 1.00 22.31 H new ATOM 0 HA LEU A 71 6.672 -21.727 -12.352 1.00 73.51 H new ATOM 0 HB2 LEU A 71 7.550 -19.520 -11.585 1.00 5.44 H new ATOM 0 HB3 LEU A 71 7.028 -19.892 -9.954 1.00 5.44 H new ATOM 0 HG LEU A 71 8.598 -21.834 -9.964 1.00 54.44 H new ATOM 0 HD11 LEU A 71 10.397 -21.838 -11.642 1.00 31.04 H new ATOM 0 HD12 LEU A 71 8.803 -22.136 -12.375 1.00 31.04 H new ATOM 0 HD13 LEU A 71 9.567 -20.536 -12.527 1.00 31.04 H new ATOM 0 HD21 LEU A 71 10.596 -20.453 -9.614 1.00 53.21 H new ATOM 0 HD22 LEU A 71 9.779 -19.080 -10.398 1.00 53.21 H new ATOM 0 HD23 LEU A 71 9.150 -19.734 -8.867 1.00 53.21 H new ATOM 1170 N LYS A 72 4.929 -22.094 -9.651 1.00 43.31 N ATOM 1171 CA LYS A 72 4.409 -23.023 -8.680 1.00 53.20 C ATOM 1172 C LYS A 72 3.603 -24.097 -9.427 1.00 63.30 C ATOM 1173 O LYS A 72 3.799 -25.284 -9.220 1.00 5.32 O ATOM 1174 CB LYS A 72 3.537 -22.232 -7.664 1.00 30.11 C ATOM 1175 CG LYS A 72 3.025 -22.969 -6.411 1.00 32.00 C ATOM 1176 CD LYS A 72 2.039 -24.086 -6.716 1.00 34.53 C ATOM 1177 CE LYS A 72 1.416 -24.622 -5.445 1.00 34.33 C ATOM 1178 NZ LYS A 72 0.662 -23.569 -4.725 1.00 61.24 N ATOM 0 H LYS A 72 4.428 -21.206 -9.678 1.00 43.31 H new ATOM 0 HA LYS A 72 5.203 -23.521 -8.124 1.00 53.20 H new ATOM 0 HB2 LYS A 72 4.115 -21.370 -7.330 1.00 30.11 H new ATOM 0 HB3 LYS A 72 2.670 -21.846 -8.200 1.00 30.11 H new ATOM 0 HG2 LYS A 72 3.876 -23.385 -5.873 1.00 32.00 H new ATOM 0 HG3 LYS A 72 2.549 -22.248 -5.746 1.00 32.00 H new ATOM 0 HD2 LYS A 72 1.258 -23.715 -7.380 1.00 34.53 H new ATOM 0 HD3 LYS A 72 2.549 -24.892 -7.243 1.00 34.53 H new ATOM 0 HE2 LYS A 72 0.748 -25.449 -5.686 1.00 34.33 H new ATOM 0 HE3 LYS A 72 2.196 -25.021 -4.796 1.00 34.33 H new ATOM 0 HZ1 LYS A 72 -0.061 -24.011 -4.122 1.00 61.24 H new ATOM 0 HZ2 LYS A 72 1.316 -23.017 -4.134 1.00 61.24 H new ATOM 0 HZ3 LYS A 72 0.201 -22.940 -5.413 1.00 61.24 H new ATOM 1192 N ASN A 73 2.719 -23.662 -10.318 1.00 31.40 N ATOM 1193 CA ASN A 73 1.875 -24.589 -11.092 1.00 0.04 C ATOM 1194 C ASN A 73 2.628 -25.326 -12.182 1.00 33.23 C ATOM 1195 O ASN A 73 2.186 -26.375 -12.647 1.00 52.44 O ATOM 1196 CB ASN A 73 0.611 -23.927 -11.643 1.00 75.34 C ATOM 1197 CG ASN A 73 -0.392 -23.603 -10.558 1.00 62.32 C ATOM 1198 OD1 ASN A 73 -0.381 -22.508 -9.976 1.00 3.52 O ATOM 1199 ND2 ASN A 73 -1.262 -24.535 -10.272 1.00 14.43 N ATOM 0 H ASN A 73 2.562 -22.676 -10.528 1.00 31.40 H new ATOM 0 HA ASN A 73 1.558 -25.341 -10.369 1.00 0.04 H new ATOM 0 HB2 ASN A 73 0.883 -23.011 -12.167 1.00 75.34 H new ATOM 0 HB3 ASN A 73 0.148 -24.588 -12.376 1.00 75.34 H new ATOM 0 HD21 ASN A 73 -1.963 -24.374 -9.549 1.00 14.43 H new ATOM 0 HD22 ASN A 73 -1.240 -25.424 -10.772 1.00 14.43 H new ATOM 1206 N GLU A 74 3.750 -24.776 -12.610 1.00 54.35 N ATOM 1207 CA GLU A 74 4.638 -25.466 -13.555 1.00 31.33 C ATOM 1208 C GLU A 74 5.485 -26.471 -12.757 1.00 14.20 C ATOM 1209 O GLU A 74 6.192 -27.332 -13.305 1.00 70.13 O ATOM 1210 CB GLU A 74 5.512 -24.437 -14.296 1.00 25.05 C ATOM 1211 CG GLU A 74 6.431 -25.018 -15.352 1.00 14.23 C ATOM 1212 CD GLU A 74 7.175 -23.953 -16.109 1.00 10.01 C ATOM 1213 OE1 GLU A 74 6.649 -23.474 -17.141 1.00 13.21 O ATOM 1214 OE2 GLU A 74 8.289 -23.591 -15.705 1.00 23.12 O ATOM 0 H GLU A 74 4.076 -23.853 -12.323 1.00 54.35 H new ATOM 0 HA GLU A 74 4.067 -26.004 -14.312 1.00 31.33 H new ATOM 0 HB2 GLU A 74 4.860 -23.702 -14.768 1.00 25.05 H new ATOM 0 HB3 GLU A 74 6.117 -23.903 -13.564 1.00 25.05 H new ATOM 0 HG2 GLU A 74 7.146 -25.691 -14.878 1.00 14.23 H new ATOM 0 HG3 GLU A 74 5.846 -25.616 -16.051 1.00 14.23 H new ATOM 1221 N LYS A 75 5.361 -26.329 -11.458 1.00 72.53 N ATOM 1222 CA LYS A 75 5.975 -27.143 -10.448 1.00 73.22 C ATOM 1223 C LYS A 75 7.486 -27.144 -10.502 1.00 73.55 C ATOM 1224 O LYS A 75 8.125 -28.125 -10.873 1.00 32.20 O ATOM 1225 CB LYS A 75 5.368 -28.552 -10.350 1.00 54.12 C ATOM 1226 CG LYS A 75 5.871 -29.355 -9.164 1.00 2.34 C ATOM 1227 CD LYS A 75 5.195 -30.700 -9.070 1.00 33.11 C ATOM 1228 CE LYS A 75 5.657 -31.456 -7.837 1.00 71.22 C ATOM 1229 NZ LYS A 75 5.346 -30.721 -6.584 1.00 21.14 N ATOM 0 H LYS A 75 4.787 -25.588 -11.056 1.00 72.53 H new ATOM 0 HA LYS A 75 5.728 -26.655 -9.505 1.00 73.22 H new ATOM 0 HB2 LYS A 75 4.283 -28.466 -10.285 1.00 54.12 H new ATOM 0 HB3 LYS A 75 5.590 -29.098 -11.267 1.00 54.12 H new ATOM 0 HG2 LYS A 75 6.948 -29.495 -9.251 1.00 2.34 H new ATOM 0 HG3 LYS A 75 5.695 -28.795 -8.245 1.00 2.34 H new ATOM 0 HD2 LYS A 75 4.114 -30.566 -9.035 1.00 33.11 H new ATOM 0 HD3 LYS A 75 5.415 -31.285 -9.963 1.00 33.11 H new ATOM 0 HE2 LYS A 75 5.178 -32.435 -7.811 1.00 71.22 H new ATOM 0 HE3 LYS A 75 6.732 -31.628 -7.899 1.00 71.22 H new ATOM 0 HZ1 LYS A 75 5.406 -31.372 -5.775 1.00 21.14 H new ATOM 0 HZ2 LYS A 75 6.029 -29.947 -6.457 1.00 21.14 H new ATOM 0 HZ3 LYS A 75 4.385 -30.328 -6.641 1.00 21.14 H new ATOM 1243 N VAL A 76 8.043 -26.004 -10.226 1.00 44.22 N ATOM 1244 CA VAL A 76 9.469 -25.884 -10.050 1.00 5.32 C ATOM 1245 C VAL A 76 9.705 -25.622 -8.580 1.00 12.31 C ATOM 1246 O VAL A 76 10.708 -26.037 -7.989 1.00 30.14 O ATOM 1247 CB VAL A 76 10.064 -24.741 -10.904 1.00 50.24 C ATOM 1248 CG1 VAL A 76 11.575 -24.663 -10.729 1.00 61.54 C ATOM 1249 CG2 VAL A 76 9.712 -24.936 -12.369 1.00 40.32 C ATOM 0 H VAL A 76 7.529 -25.130 -10.116 1.00 44.22 H new ATOM 0 HA VAL A 76 9.963 -26.798 -10.378 1.00 5.32 H new ATOM 0 HB VAL A 76 9.632 -23.801 -10.562 1.00 50.24 H new ATOM 0 HG11 VAL A 76 11.971 -23.851 -11.340 1.00 61.54 H new ATOM 0 HG12 VAL A 76 11.811 -24.477 -9.681 1.00 61.54 H new ATOM 0 HG13 VAL A 76 12.026 -25.605 -11.041 1.00 61.54 H new ATOM 0 HG21 VAL A 76 10.138 -24.123 -12.957 1.00 40.32 H new ATOM 0 HG22 VAL A 76 10.117 -25.886 -12.717 1.00 40.32 H new ATOM 0 HG23 VAL A 76 8.628 -24.939 -12.486 1.00 40.32 H new ATOM 1259 N ALA A 77 8.745 -24.951 -7.996 1.00 33.22 N ATOM 1260 CA ALA A 77 8.716 -24.681 -6.596 1.00 44.44 C ATOM 1261 C ALA A 77 7.292 -24.803 -6.125 1.00 61.24 C ATOM 1262 O ALA A 77 6.499 -23.859 -6.254 1.00 41.23 O ATOM 1263 CB ALA A 77 9.263 -23.301 -6.295 1.00 73.52 C ATOM 0 H ALA A 77 7.945 -24.571 -8.502 1.00 33.22 H new ATOM 0 HA ALA A 77 9.348 -25.397 -6.071 1.00 44.44 H new ATOM 0 HB1 ALA A 77 9.229 -23.122 -5.220 1.00 73.52 H new ATOM 0 HB2 ALA A 77 10.294 -23.235 -6.641 1.00 73.52 H new ATOM 0 HB3 ALA A 77 8.660 -22.551 -6.807 1.00 73.52 H new ATOM 1269 N ALA A 78 6.941 -25.982 -5.671 1.00 72.42 N ATOM 1270 CA ALA A 78 5.609 -26.258 -5.195 1.00 3.02 C ATOM 1271 C ALA A 78 5.642 -27.247 -4.045 1.00 44.53 C ATOM 1272 O ALA A 78 5.739 -28.469 -4.253 1.00 34.22 O ATOM 1273 CB ALA A 78 4.723 -26.778 -6.318 1.00 24.00 C ATOM 0 H ALA A 78 7.575 -26.780 -5.622 1.00 72.42 H new ATOM 0 HA ALA A 78 5.184 -25.322 -4.833 1.00 3.02 H new ATOM 0 HB1 ALA A 78 3.724 -26.978 -5.930 1.00 24.00 H new ATOM 0 HB2 ALA A 78 4.662 -26.031 -7.109 1.00 24.00 H new ATOM 0 HB3 ALA A 78 5.147 -27.698 -6.720 1.00 24.00 H new ATOM 1279 N LYS A 79 5.619 -26.714 -2.851 1.00 0.40 N ATOM 1280 CA LYS A 79 5.611 -27.478 -1.623 1.00 5.51 C ATOM 1281 C LYS A 79 4.514 -26.923 -0.745 1.00 22.12 C ATOM 1282 O LYS A 79 4.544 -25.743 -0.365 1.00 41.41 O ATOM 1283 CB LYS A 79 6.963 -27.350 -0.895 1.00 14.30 C ATOM 1284 CG LYS A 79 8.168 -27.847 -1.688 1.00 43.13 C ATOM 1285 CD LYS A 79 8.092 -29.344 -1.954 1.00 74.24 C ATOM 1286 CE LYS A 79 9.261 -29.812 -2.806 1.00 75.02 C ATOM 1287 NZ LYS A 79 10.569 -29.501 -2.200 1.00 4.31 N ATOM 0 H LYS A 79 5.605 -25.706 -2.698 1.00 0.40 H new ATOM 0 HA LYS A 79 5.442 -28.532 -1.843 1.00 5.51 H new ATOM 0 HB2 LYS A 79 7.123 -26.303 -0.637 1.00 14.30 H new ATOM 0 HB3 LYS A 79 6.909 -27.905 0.042 1.00 14.30 H new ATOM 0 HG2 LYS A 79 8.225 -27.312 -2.636 1.00 43.13 H new ATOM 0 HG3 LYS A 79 9.082 -27.621 -1.139 1.00 43.13 H new ATOM 0 HD2 LYS A 79 8.089 -29.884 -1.007 1.00 74.24 H new ATOM 0 HD3 LYS A 79 7.154 -29.579 -2.458 1.00 74.24 H new ATOM 0 HE2 LYS A 79 9.184 -30.888 -2.961 1.00 75.02 H new ATOM 0 HE3 LYS A 79 9.200 -29.343 -3.788 1.00 75.02 H new ATOM 0 HZ1 LYS A 79 11.318 -30.012 -2.709 1.00 4.31 H new ATOM 0 HZ2 LYS A 79 10.745 -28.478 -2.261 1.00 4.31 H new ATOM 0 HZ3 LYS A 79 10.567 -29.793 -1.202 1.00 4.31 H new ATOM 1301 N MET A 80 3.553 -27.736 -0.430 1.00 54.35 N ATOM 1302 CA MET A 80 2.435 -27.295 0.352 1.00 53.44 C ATOM 1303 C MET A 80 2.210 -28.235 1.514 1.00 43.44 C ATOM 1304 O MET A 80 1.807 -29.388 1.322 1.00 21.22 O ATOM 1305 CB MET A 80 1.172 -27.213 -0.506 1.00 2.32 C ATOM 1306 CG MET A 80 -0.046 -26.709 0.247 1.00 34.13 C ATOM 1307 SD MET A 80 -1.553 -26.701 -0.746 1.00 41.55 S ATOM 1308 CE MET A 80 -1.726 -28.449 -1.110 1.00 24.11 C ATOM 0 H MET A 80 3.519 -28.718 -0.705 1.00 54.35 H new ATOM 0 HA MET A 80 2.657 -26.299 0.736 1.00 53.44 H new ATOM 0 HB2 MET A 80 1.362 -26.555 -1.354 1.00 2.32 H new ATOM 0 HB3 MET A 80 0.954 -28.201 -0.912 1.00 2.32 H new ATOM 0 HG2 MET A 80 -0.203 -27.333 1.127 1.00 34.13 H new ATOM 0 HG3 MET A 80 0.150 -25.698 0.604 1.00 34.13 H new ATOM 0 HE1 MET A 80 -2.764 -28.667 -1.362 1.00 24.11 H new ATOM 0 HE2 MET A 80 -1.086 -28.710 -1.953 1.00 24.11 H new ATOM 0 HE3 MET A 80 -1.434 -29.033 -0.237 1.00 24.11 H new ATOM 1318 N LEU A 81 2.480 -27.755 2.705 1.00 13.10 N ATOM 1319 CA LEU A 81 2.299 -28.540 3.905 1.00 11.31 C ATOM 1320 C LEU A 81 0.829 -28.607 4.262 1.00 0.51 C ATOM 1321 O LEU A 81 0.278 -27.690 4.880 1.00 53.52 O ATOM 1322 CB LEU A 81 3.130 -28.007 5.104 1.00 64.35 C ATOM 1323 CG LEU A 81 4.679 -28.076 5.014 1.00 21.33 C ATOM 1324 CD1 LEU A 81 5.244 -27.181 3.914 1.00 75.34 C ATOM 1325 CD2 LEU A 81 5.299 -27.727 6.356 1.00 1.42 C ATOM 0 H LEU A 81 2.831 -26.812 2.870 1.00 13.10 H new ATOM 0 HA LEU A 81 2.669 -29.543 3.694 1.00 11.31 H new ATOM 0 HB2 LEU A 81 2.852 -26.965 5.264 1.00 64.35 H new ATOM 0 HB3 LEU A 81 2.824 -28.559 5.993 1.00 64.35 H new ATOM 0 HG LEU A 81 4.940 -29.101 4.751 1.00 21.33 H new ATOM 0 HD11 LEU A 81 6.330 -27.268 3.896 1.00 75.34 H new ATOM 0 HD12 LEU A 81 4.839 -27.490 2.950 1.00 75.34 H new ATOM 0 HD13 LEU A 81 4.966 -26.145 4.109 1.00 75.34 H new ATOM 0 HD21 LEU A 81 6.385 -27.779 6.280 1.00 1.42 H new ATOM 0 HD22 LEU A 81 5.003 -26.718 6.642 1.00 1.42 H new ATOM 0 HD23 LEU A 81 4.954 -28.434 7.111 1.00 1.42 H new ATOM 1337 N GLU A 82 0.195 -29.653 3.820 1.00 73.23 N ATOM 1338 CA GLU A 82 -1.202 -29.872 4.069 1.00 24.44 C ATOM 1339 C GLU A 82 -1.353 -30.920 5.158 1.00 40.34 C ATOM 1340 O GLU A 82 -0.499 -31.819 5.287 1.00 74.41 O ATOM 1341 CB GLU A 82 -1.901 -30.290 2.771 1.00 23.42 C ATOM 1342 CG GLU A 82 -1.376 -31.579 2.160 1.00 43.22 C ATOM 1343 CD GLU A 82 -1.996 -31.882 0.823 1.00 44.42 C ATOM 1344 OE1 GLU A 82 -3.211 -32.157 0.762 1.00 41.24 O ATOM 1345 OE2 GLU A 82 -1.266 -31.879 -0.194 1.00 53.33 O ATOM 0 H GLU A 82 0.638 -30.388 3.269 1.00 73.23 H new ATOM 0 HA GLU A 82 -1.676 -28.953 4.413 1.00 24.44 H new ATOM 0 HB2 GLU A 82 -2.967 -30.404 2.968 1.00 23.42 H new ATOM 0 HB3 GLU A 82 -1.795 -29.487 2.041 1.00 23.42 H new ATOM 0 HG2 GLU A 82 -0.294 -31.508 2.047 1.00 43.22 H new ATOM 0 HG3 GLU A 82 -1.572 -32.406 2.843 1.00 43.22 H new ATOM 1352 N LYS A 83 -2.390 -30.811 5.948 1.00 30.32 N ATOM 1353 CA LYS A 83 -2.590 -31.710 7.052 1.00 33.32 C ATOM 1354 C LYS A 83 -4.073 -31.939 7.310 1.00 52.11 C ATOM 1355 O LYS A 83 -4.718 -31.182 8.041 1.00 53.32 O ATOM 1356 CB LYS A 83 -1.886 -31.171 8.320 1.00 65.43 C ATOM 1357 CG LYS A 83 -1.980 -32.053 9.570 1.00 61.14 C ATOM 1358 CD LYS A 83 -1.317 -33.410 9.370 1.00 73.12 C ATOM 1359 CE LYS A 83 -1.347 -34.226 10.659 1.00 62.41 C ATOM 1360 NZ LYS A 83 -0.716 -35.547 10.510 1.00 3.44 N ATOM 0 H LYS A 83 -3.115 -30.101 5.844 1.00 30.32 H new ATOM 0 HA LYS A 83 -2.146 -32.672 6.794 1.00 33.32 H new ATOM 0 HB2 LYS A 83 -0.832 -31.016 8.088 1.00 65.43 H new ATOM 0 HB3 LYS A 83 -2.307 -30.194 8.557 1.00 65.43 H new ATOM 0 HG2 LYS A 83 -1.509 -31.541 10.410 1.00 61.14 H new ATOM 0 HG3 LYS A 83 -3.028 -32.198 9.832 1.00 61.14 H new ATOM 0 HD2 LYS A 83 -1.829 -33.956 8.577 1.00 73.12 H new ATOM 0 HD3 LYS A 83 -0.285 -33.271 9.047 1.00 73.12 H new ATOM 0 HE2 LYS A 83 -0.838 -33.671 11.447 1.00 62.41 H new ATOM 0 HE3 LYS A 83 -2.381 -34.356 10.978 1.00 62.41 H new ATOM 0 HZ1 LYS A 83 -0.764 -36.059 11.414 1.00 3.44 H new ATOM 0 HZ2 LYS A 83 -1.216 -36.090 9.778 1.00 3.44 H new ATOM 0 HZ3 LYS A 83 0.279 -35.427 10.233 1.00 3.44 H new ATOM 1374 N ASP A 84 -4.619 -32.932 6.672 1.00 12.20 N ATOM 1375 CA ASP A 84 -5.988 -33.328 6.906 1.00 22.54 C ATOM 1376 C ASP A 84 -5.989 -34.763 7.342 1.00 24.14 C ATOM 1377 O ASP A 84 -5.987 -35.673 6.519 1.00 71.32 O ATOM 1378 CB ASP A 84 -6.879 -33.145 5.662 1.00 61.12 C ATOM 1379 CG ASP A 84 -8.354 -33.449 5.936 1.00 74.15 C ATOM 1380 OD1 ASP A 84 -8.783 -34.619 5.822 1.00 32.32 O ATOM 1381 OD2 ASP A 84 -9.109 -32.509 6.274 1.00 11.02 O ATOM 0 H ASP A 84 -4.133 -33.494 5.973 1.00 12.20 H new ATOM 0 HA ASP A 84 -6.409 -32.685 7.679 1.00 22.54 H new ATOM 0 HB2 ASP A 84 -6.785 -32.121 5.302 1.00 61.12 H new ATOM 0 HB3 ASP A 84 -6.521 -33.797 4.866 1.00 61.12 H new ATOM 1386 N ALA A 85 -5.889 -34.963 8.631 1.00 25.11 N ATOM 1387 CA ALA A 85 -5.873 -36.285 9.192 1.00 24.32 C ATOM 1388 C ALA A 85 -6.353 -36.246 10.622 1.00 54.12 C ATOM 1389 O ALA A 85 -5.573 -36.039 11.561 1.00 24.43 O ATOM 1390 CB ALA A 85 -4.489 -36.925 9.085 1.00 4.44 C ATOM 0 H ALA A 85 -5.817 -34.213 9.319 1.00 25.11 H new ATOM 0 HA ALA A 85 -6.555 -36.910 8.615 1.00 24.32 H new ATOM 0 HB1 ALA A 85 -4.516 -37.924 9.520 1.00 4.44 H new ATOM 0 HB2 ALA A 85 -4.200 -36.993 8.036 1.00 4.44 H new ATOM 0 HB3 ALA A 85 -3.763 -36.315 9.623 1.00 4.44 H new ATOM 1396 N THR A 86 -7.635 -36.351 10.773 1.00 72.43 N ATOM 1397 CA THR A 86 -8.261 -36.365 12.060 1.00 43.25 C ATOM 1398 C THR A 86 -9.568 -37.177 11.958 1.00 2.12 C ATOM 1399 O THR A 86 -10.494 -37.027 12.762 1.00 44.13 O ATOM 1400 CB THR A 86 -8.519 -34.892 12.564 1.00 23.34 C ATOM 1401 OG1 THR A 86 -9.076 -34.881 13.892 1.00 3.14 O ATOM 1402 CG2 THR A 86 -9.433 -34.123 11.615 1.00 45.43 C ATOM 0 H THR A 86 -8.288 -36.431 9.994 1.00 72.43 H new ATOM 0 HA THR A 86 -7.609 -36.838 12.794 1.00 43.25 H new ATOM 0 HB THR A 86 -7.549 -34.395 12.587 1.00 23.34 H new ATOM 0 HG1 THR A 86 -9.744 -35.594 13.973 1.00 3.14 H new ATOM 0 HG21 THR A 86 -9.587 -33.114 11.996 1.00 45.43 H new ATOM 0 HG22 THR A 86 -8.973 -34.072 10.628 1.00 45.43 H new ATOM 0 HG23 THR A 86 -10.393 -34.633 11.542 1.00 45.43 H new ATOM 1410 N GLU A 87 -9.614 -38.075 10.978 1.00 44.24 N ATOM 1411 CA GLU A 87 -10.782 -38.906 10.784 1.00 62.32 C ATOM 1412 C GLU A 87 -10.804 -39.983 11.833 1.00 13.12 C ATOM 1413 O GLU A 87 -9.916 -40.838 11.879 1.00 65.02 O ATOM 1414 CB GLU A 87 -10.808 -39.543 9.397 1.00 12.32 C ATOM 1415 CG GLU A 87 -10.781 -38.560 8.251 1.00 2.23 C ATOM 1416 CD GLU A 87 -10.914 -39.242 6.920 1.00 51.00 C ATOM 1417 OE1 GLU A 87 -9.910 -39.778 6.399 1.00 30.35 O ATOM 1418 OE2 GLU A 87 -12.038 -39.273 6.380 1.00 54.32 O ATOM 0 H GLU A 87 -8.858 -38.240 10.314 1.00 44.24 H new ATOM 0 HA GLU A 87 -11.663 -38.271 10.871 1.00 62.32 H new ATOM 0 HB2 GLU A 87 -9.953 -40.213 9.304 1.00 12.32 H new ATOM 0 HB3 GLU A 87 -11.705 -40.157 9.311 1.00 12.32 H new ATOM 0 HG2 GLU A 87 -11.591 -37.840 8.372 1.00 2.23 H new ATOM 0 HG3 GLU A 87 -9.848 -37.997 8.278 1.00 2.23 H new ATOM 1425 N VAL A 88 -11.781 -39.926 12.682 1.00 53.22 N ATOM 1426 CA VAL A 88 -11.928 -40.880 13.738 1.00 60.22 C ATOM 1427 C VAL A 88 -13.260 -41.604 13.634 1.00 62.10 C ATOM 1428 O VAL A 88 -14.310 -41.088 14.038 1.00 74.34 O ATOM 1429 CB VAL A 88 -11.710 -40.253 15.161 1.00 63.24 C ATOM 1430 CG1 VAL A 88 -10.245 -39.898 15.370 1.00 20.32 C ATOM 1431 CG2 VAL A 88 -12.545 -38.991 15.332 1.00 53.12 C ATOM 0 H VAL A 88 -12.507 -39.209 12.662 1.00 53.22 H new ATOM 0 HA VAL A 88 -11.135 -41.617 13.613 1.00 60.22 H new ATOM 0 HB VAL A 88 -12.019 -40.996 15.897 1.00 63.24 H new ATOM 0 HG11 VAL A 88 -10.113 -39.465 16.362 1.00 20.32 H new ATOM 0 HG12 VAL A 88 -9.637 -40.798 15.284 1.00 20.32 H new ATOM 0 HG13 VAL A 88 -9.934 -39.176 14.615 1.00 20.32 H new ATOM 0 HG21 VAL A 88 -12.377 -38.575 16.325 1.00 53.12 H new ATOM 0 HG22 VAL A 88 -12.256 -38.258 14.578 1.00 53.12 H new ATOM 0 HG23 VAL A 88 -13.601 -39.235 15.215 1.00 53.12 H new ATOM 1441 N GLY A 89 -13.220 -42.793 13.059 1.00 63.12 N ATOM 1442 CA GLY A 89 -14.417 -43.596 12.878 1.00 3.51 C ATOM 1443 C GLY A 89 -14.801 -44.346 14.135 1.00 35.33 C ATOM 1444 O GLY A 89 -15.012 -45.570 14.112 1.00 33.02 O ATOM 0 H GLY A 89 -12.366 -43.226 12.707 1.00 63.12 H new ATOM 0 HA2 GLY A 89 -15.242 -42.951 12.576 1.00 3.51 H new ATOM 0 HA3 GLY A 89 -14.256 -44.307 12.068 1.00 3.51 H new ATOM 1448 N VAL A 90 -14.900 -43.624 15.218 1.00 15.21 N ATOM 1449 CA VAL A 90 -15.234 -44.195 16.480 1.00 73.31 C ATOM 1450 C VAL A 90 -16.747 -44.184 16.702 1.00 51.34 C ATOM 1451 O VAL A 90 -17.340 -43.224 17.215 1.00 31.10 O ATOM 1452 CB VAL A 90 -14.432 -43.548 17.667 1.00 40.20 C ATOM 1453 CG1 VAL A 90 -14.625 -42.038 17.740 1.00 23.43 C ATOM 1454 CG2 VAL A 90 -14.773 -44.210 18.997 1.00 54.02 C ATOM 0 H VAL A 90 -14.749 -42.616 15.242 1.00 15.21 H new ATOM 0 HA VAL A 90 -14.922 -45.239 16.461 1.00 73.31 H new ATOM 0 HB VAL A 90 -13.376 -43.726 17.464 1.00 40.20 H new ATOM 0 HG11 VAL A 90 -14.051 -41.638 18.576 1.00 23.43 H new ATOM 0 HG12 VAL A 90 -14.280 -41.582 16.812 1.00 23.43 H new ATOM 0 HG13 VAL A 90 -15.682 -41.813 17.885 1.00 23.43 H new ATOM 0 HG21 VAL A 90 -14.201 -43.738 19.796 1.00 54.02 H new ATOM 0 HG22 VAL A 90 -15.838 -44.096 19.198 1.00 54.02 H new ATOM 0 HG23 VAL A 90 -14.524 -45.270 18.950 1.00 54.02 H new ATOM 1464 N LYS A 91 -17.362 -45.229 16.256 1.00 33.33 N ATOM 1465 CA LYS A 91 -18.767 -45.406 16.377 1.00 0.04 C ATOM 1466 C LYS A 91 -19.027 -46.839 16.763 1.00 25.52 C ATOM 1467 O LYS A 91 -18.263 -47.733 16.370 1.00 23.34 O ATOM 1468 CB LYS A 91 -19.450 -45.076 15.056 1.00 75.03 C ATOM 1469 CG LYS A 91 -20.959 -45.148 15.113 1.00 20.42 C ATOM 1470 CD LYS A 91 -21.556 -44.734 13.807 1.00 74.34 C ATOM 1471 CE LYS A 91 -23.069 -44.847 13.828 1.00 2.33 C ATOM 1472 NZ LYS A 91 -23.668 -44.477 12.532 1.00 30.14 N ATOM 0 H LYS A 91 -16.888 -46.001 15.786 1.00 33.33 H new ATOM 0 HA LYS A 91 -19.169 -44.738 17.139 1.00 0.04 H new ATOM 0 HB2 LYS A 91 -19.155 -44.073 14.746 1.00 75.03 H new ATOM 0 HB3 LYS A 91 -19.092 -45.765 14.291 1.00 75.03 H new ATOM 0 HG2 LYS A 91 -21.271 -46.164 15.356 1.00 20.42 H new ATOM 0 HG3 LYS A 91 -21.329 -44.502 15.909 1.00 20.42 H new ATOM 0 HD2 LYS A 91 -21.270 -43.706 13.584 1.00 74.34 H new ATOM 0 HD3 LYS A 91 -21.154 -45.357 13.008 1.00 74.34 H new ATOM 0 HE2 LYS A 91 -23.353 -45.869 14.080 1.00 2.33 H new ATOM 0 HE3 LYS A 91 -23.470 -44.202 14.610 1.00 2.33 H new ATOM 0 HZ1 LYS A 91 -24.702 -44.568 12.589 1.00 30.14 H new ATOM 0 HZ2 LYS A 91 -23.419 -43.494 12.303 1.00 30.14 H new ATOM 0 HZ3 LYS A 91 -23.306 -45.108 11.789 1.00 30.14 H new ATOM 1486 N ALA A 92 -20.057 -47.060 17.541 1.00 44.44 N ATOM 1487 CA ALA A 92 -20.421 -48.383 17.985 1.00 4.11 C ATOM 1488 C ALA A 92 -20.867 -49.245 16.811 1.00 34.41 C ATOM 1489 O ALA A 92 -21.890 -48.967 16.162 1.00 41.33 O ATOM 1490 CB ALA A 92 -21.514 -48.304 19.039 1.00 35.14 C ATOM 0 H ALA A 92 -20.671 -46.322 17.887 1.00 44.44 H new ATOM 0 HA ALA A 92 -19.543 -48.850 18.431 1.00 4.11 H new ATOM 0 HB1 ALA A 92 -21.779 -49.310 19.365 1.00 35.14 H new ATOM 0 HB2 ALA A 92 -21.155 -47.729 19.893 1.00 35.14 H new ATOM 0 HB3 ALA A 92 -22.393 -47.817 18.616 1.00 35.14 H new ATOM 1496 N ALA A 93 -20.088 -50.245 16.517 1.00 73.42 N ATOM 1497 CA ALA A 93 -20.384 -51.168 15.459 1.00 10.32 C ATOM 1498 C ALA A 93 -20.609 -52.536 16.047 1.00 12.21 C ATOM 1499 O ALA A 93 -19.660 -53.269 16.322 1.00 3.14 O ATOM 1500 CB ALA A 93 -19.257 -51.196 14.435 1.00 12.12 C ATOM 0 H ALA A 93 -19.218 -50.445 17.011 1.00 73.42 H new ATOM 0 HA ALA A 93 -21.288 -50.846 14.942 1.00 10.32 H new ATOM 0 HB1 ALA A 93 -19.503 -51.902 13.642 1.00 12.12 H new ATOM 0 HB2 ALA A 93 -19.129 -50.201 14.008 1.00 12.12 H new ATOM 0 HB3 ALA A 93 -18.331 -51.504 14.921 1.00 12.12 H new ATOM 1506 N LEU A 94 -21.842 -52.862 16.291 1.00 53.10 N ATOM 1507 CA LEU A 94 -22.179 -54.128 16.887 1.00 45.53 C ATOM 1508 C LEU A 94 -23.442 -54.650 16.275 1.00 3.43 C ATOM 1509 O LEU A 94 -24.218 -53.889 15.711 1.00 11.44 O ATOM 1510 CB LEU A 94 -22.349 -54.031 18.436 1.00 24.13 C ATOM 1511 CG LEU A 94 -23.524 -53.171 19.000 1.00 50.55 C ATOM 1512 CD1 LEU A 94 -23.620 -53.352 20.504 1.00 50.42 C ATOM 1513 CD2 LEU A 94 -23.354 -51.690 18.686 1.00 4.44 C ATOM 0 H LEU A 94 -22.643 -52.264 16.085 1.00 53.10 H new ATOM 0 HA LEU A 94 -21.352 -54.811 16.692 1.00 45.53 H new ATOM 0 HB2 LEU A 94 -22.464 -55.044 18.822 1.00 24.13 H new ATOM 0 HB3 LEU A 94 -21.420 -53.636 18.848 1.00 24.13 H new ATOM 0 HG LEU A 94 -24.438 -53.516 18.517 1.00 50.55 H new ATOM 0 HD11 LEU A 94 -24.442 -52.749 20.891 1.00 50.42 H new ATOM 0 HD12 LEU A 94 -23.801 -54.402 20.733 1.00 50.42 H new ATOM 0 HD13 LEU A 94 -22.687 -53.035 20.969 1.00 50.42 H new ATOM 0 HD21 LEU A 94 -24.195 -51.132 19.098 1.00 4.44 H new ATOM 0 HD22 LEU A 94 -22.426 -51.328 19.129 1.00 4.44 H new ATOM 0 HD23 LEU A 94 -23.319 -51.549 17.606 1.00 4.44 H new ATOM 1525 N GLU A 95 -23.649 -55.917 16.381 1.00 5.43 N ATOM 1526 CA GLU A 95 -24.836 -56.526 15.866 1.00 64.24 C ATOM 1527 C GLU A 95 -25.592 -57.164 16.991 1.00 21.21 C ATOM 1528 O GLU A 95 -25.014 -57.468 18.042 1.00 3.53 O ATOM 1529 CB GLU A 95 -24.505 -57.555 14.787 1.00 23.23 C ATOM 1530 CG GLU A 95 -23.580 -58.671 15.243 1.00 52.03 C ATOM 1531 CD GLU A 95 -23.291 -59.656 14.148 1.00 12.31 C ATOM 1532 OE1 GLU A 95 -22.415 -59.384 13.314 1.00 42.41 O ATOM 1533 OE2 GLU A 95 -23.929 -60.726 14.111 1.00 23.31 O ATOM 0 H GLU A 95 -23.001 -56.566 16.828 1.00 5.43 H new ATOM 0 HA GLU A 95 -25.455 -55.757 15.404 1.00 64.24 H new ATOM 0 HB2 GLU A 95 -25.434 -57.995 14.426 1.00 23.23 H new ATOM 0 HB3 GLU A 95 -24.046 -57.042 13.942 1.00 23.23 H new ATOM 0 HG2 GLU A 95 -22.643 -58.241 15.598 1.00 52.03 H new ATOM 0 HG3 GLU A 95 -24.032 -59.192 16.087 1.00 52.03 H new ATOM 1540 N GLU A 96 -26.863 -57.348 16.802 1.00 11.05 N ATOM 1541 CA GLU A 96 -27.669 -57.983 17.799 1.00 33.53 C ATOM 1542 C GLU A 96 -27.555 -59.489 17.660 1.00 33.25 C ATOM 1543 O GLU A 96 -27.464 -60.021 16.536 1.00 71.12 O ATOM 1544 CB GLU A 96 -29.125 -57.509 17.709 1.00 73.55 C ATOM 1545 CG GLU A 96 -29.806 -57.785 16.380 1.00 10.12 C ATOM 1546 CD GLU A 96 -31.202 -57.239 16.348 1.00 34.11 C ATOM 1547 OE1 GLU A 96 -32.118 -57.890 16.873 1.00 2.20 O ATOM 1548 OE2 GLU A 96 -31.402 -56.134 15.804 1.00 63.34 O ATOM 0 H GLU A 96 -27.367 -57.065 15.961 1.00 11.05 H new ATOM 0 HA GLU A 96 -27.306 -57.703 18.788 1.00 33.53 H new ATOM 0 HB2 GLU A 96 -29.698 -57.990 18.501 1.00 73.55 H new ATOM 0 HB3 GLU A 96 -29.155 -56.436 17.900 1.00 73.55 H new ATOM 0 HG2 GLU A 96 -29.223 -57.341 15.573 1.00 10.12 H new ATOM 0 HG3 GLU A 96 -29.831 -58.860 16.200 1.00 10.12 H new ATOM 1555 N ALA A 97 -27.513 -60.163 18.765 1.00 72.52 N ATOM 1556 CA ALA A 97 -27.402 -61.588 18.767 1.00 11.53 C ATOM 1557 C ALA A 97 -28.493 -62.182 19.612 1.00 11.04 C ATOM 1558 O ALA A 97 -28.393 -62.242 20.839 1.00 61.23 O ATOM 1559 CB ALA A 97 -26.028 -62.034 19.250 1.00 23.25 C ATOM 0 H ALA A 97 -27.555 -59.741 19.693 1.00 72.52 H new ATOM 0 HA ALA A 97 -27.516 -61.948 17.744 1.00 11.53 H new ATOM 0 HB1 ALA A 97 -25.975 -63.123 19.240 1.00 23.25 H new ATOM 0 HB2 ALA A 97 -25.261 -61.627 18.591 1.00 23.25 H new ATOM 0 HB3 ALA A 97 -25.864 -61.672 20.265 1.00 23.25 H new ATOM 1565 N LYS A 98 -29.550 -62.554 18.973 1.00 23.21 N ATOM 1566 CA LYS A 98 -30.666 -63.150 19.638 1.00 21.24 C ATOM 1567 C LYS A 98 -31.023 -64.392 18.852 1.00 22.14 C ATOM 1568 O LYS A 98 -31.656 -64.320 17.799 1.00 50.41 O ATOM 1569 CB LYS A 98 -31.833 -62.129 19.691 1.00 12.23 C ATOM 1570 CG LYS A 98 -33.011 -62.440 20.636 1.00 3.30 C ATOM 1571 CD LYS A 98 -33.821 -63.669 20.253 1.00 73.34 C ATOM 1572 CE LYS A 98 -35.008 -63.824 21.190 1.00 43.44 C ATOM 1573 NZ LYS A 98 -35.827 -65.003 20.878 1.00 65.32 N ATOM 0 H LYS A 98 -29.668 -62.453 17.965 1.00 23.21 H new ATOM 0 HA LYS A 98 -30.441 -63.425 20.668 1.00 21.24 H new ATOM 0 HB2 LYS A 98 -31.420 -61.161 19.976 1.00 12.23 H new ATOM 0 HB3 LYS A 98 -32.231 -62.021 18.682 1.00 12.23 H new ATOM 0 HG2 LYS A 98 -32.624 -62.576 21.646 1.00 3.30 H new ATOM 0 HG3 LYS A 98 -33.676 -61.577 20.663 1.00 3.30 H new ATOM 0 HD2 LYS A 98 -34.169 -63.579 19.224 1.00 73.34 H new ATOM 0 HD3 LYS A 98 -33.192 -64.558 20.300 1.00 73.34 H new ATOM 0 HE2 LYS A 98 -34.648 -63.898 22.216 1.00 43.44 H new ATOM 0 HE3 LYS A 98 -35.629 -62.930 21.134 1.00 43.44 H new ATOM 0 HZ1 LYS A 98 -36.640 -65.042 21.525 1.00 65.32 H new ATOM 0 HZ2 LYS A 98 -36.167 -64.940 19.897 1.00 65.32 H new ATOM 0 HZ3 LYS A 98 -35.254 -65.863 20.991 1.00 65.32 H new ATOM 1587 N LYS A 99 -30.553 -65.507 19.313 1.00 12.11 N ATOM 1588 CA LYS A 99 -30.775 -66.751 18.647 1.00 2.32 C ATOM 1589 C LYS A 99 -31.803 -67.551 19.411 1.00 73.32 C ATOM 1590 O LYS A 99 -31.924 -67.412 20.635 1.00 63.31 O ATOM 1591 CB LYS A 99 -29.475 -67.545 18.553 1.00 55.24 C ATOM 1592 CG LYS A 99 -29.624 -68.781 17.707 1.00 43.35 C ATOM 1593 CD LYS A 99 -28.402 -69.640 17.695 1.00 21.54 C ATOM 1594 CE LYS A 99 -28.656 -70.832 16.817 1.00 50.51 C ATOM 1595 NZ LYS A 99 -27.560 -71.822 16.862 1.00 3.31 N ATOM 0 H LYS A 99 -30.001 -65.581 20.167 1.00 12.11 H new ATOM 0 HA LYS A 99 -31.137 -66.553 17.638 1.00 2.32 H new ATOM 0 HB2 LYS A 99 -28.694 -66.911 18.133 1.00 55.24 H new ATOM 0 HB3 LYS A 99 -29.151 -67.829 19.554 1.00 55.24 H new ATOM 0 HG2 LYS A 99 -30.467 -69.366 18.076 1.00 43.35 H new ATOM 0 HG3 LYS A 99 -29.863 -68.487 16.685 1.00 43.35 H new ATOM 0 HD2 LYS A 99 -27.547 -69.074 17.325 1.00 21.54 H new ATOM 0 HD3 LYS A 99 -28.157 -69.962 18.707 1.00 21.54 H new ATOM 0 HE2 LYS A 99 -29.585 -71.312 17.124 1.00 50.51 H new ATOM 0 HE3 LYS A 99 -28.795 -70.497 15.789 1.00 50.51 H new ATOM 0 HZ1 LYS A 99 -27.789 -72.622 16.238 1.00 3.31 H new ATOM 0 HZ2 LYS A 99 -26.676 -71.376 16.543 1.00 3.31 H new ATOM 0 HZ3 LYS A 99 -27.442 -72.166 17.837 1.00 3.31 H new ATOM 1609 N VAL A 100 -32.545 -68.358 18.713 1.00 53.41 N ATOM 1610 CA VAL A 100 -33.528 -69.201 19.329 1.00 31.22 C ATOM 1611 C VAL A 100 -33.000 -70.629 19.427 1.00 44.53 C ATOM 1612 O VAL A 100 -31.865 -70.917 19.009 1.00 14.15 O ATOM 1613 CB VAL A 100 -34.869 -69.178 18.556 1.00 13.04 C ATOM 1614 CG1 VAL A 100 -35.449 -67.780 18.551 1.00 65.10 C ATOM 1615 CG2 VAL A 100 -34.686 -69.671 17.132 1.00 64.44 C ATOM 0 H VAL A 100 -32.486 -68.451 17.699 1.00 53.41 H new ATOM 0 HA VAL A 100 -33.719 -68.815 20.330 1.00 31.22 H new ATOM 0 HB VAL A 100 -35.562 -69.849 19.064 1.00 13.04 H new ATOM 0 HG11 VAL A 100 -36.392 -67.779 18.004 1.00 65.10 H new ATOM 0 HG12 VAL A 100 -35.624 -67.455 19.577 1.00 65.10 H new ATOM 0 HG13 VAL A 100 -34.749 -67.097 18.069 1.00 65.10 H new ATOM 0 HG21 VAL A 100 -35.644 -69.644 16.612 1.00 64.44 H new ATOM 0 HG22 VAL A 100 -33.973 -69.029 16.614 1.00 64.44 H new ATOM 0 HG23 VAL A 100 -34.309 -70.694 17.147 1.00 64.44 H new ATOM 1625 N GLN A 101 -33.792 -71.504 19.970 1.00 5.22 N ATOM 1626 CA GLN A 101 -33.409 -72.880 20.115 1.00 20.22 C ATOM 1627 C GLN A 101 -34.520 -73.754 19.604 1.00 50.22 C ATOM 1628 O GLN A 101 -35.626 -73.262 19.330 1.00 64.34 O ATOM 1629 CB GLN A 101 -33.092 -73.210 21.588 1.00 44.43 C ATOM 1630 CG GLN A 101 -34.253 -72.960 22.545 1.00 74.53 C ATOM 1631 CD GLN A 101 -33.925 -73.281 23.995 1.00 41.13 C ATOM 1632 OE1 GLN A 101 -33.116 -74.160 24.294 1.00 20.43 O ATOM 1633 NE2 GLN A 101 -34.548 -72.573 24.905 1.00 74.21 N ATOM 0 H GLN A 101 -34.723 -71.286 20.326 1.00 5.22 H new ATOM 0 HA GLN A 101 -32.505 -73.064 19.534 1.00 20.22 H new ATOM 0 HB2 GLN A 101 -32.795 -74.256 21.659 1.00 44.43 H new ATOM 0 HB3 GLN A 101 -32.237 -72.614 21.907 1.00 44.43 H new ATOM 0 HG2 GLN A 101 -34.555 -71.915 22.472 1.00 74.53 H new ATOM 0 HG3 GLN A 101 -35.107 -73.561 22.232 1.00 74.53 H new ATOM 0 HE21 GLN A 101 -35.212 -71.852 24.624 1.00 74.21 H new ATOM 0 HE22 GLN A 101 -34.368 -72.743 25.895 1.00 74.21 H new ATOM 1642 N ILE A 102 -34.241 -75.010 19.450 1.00 12.05 N ATOM 1643 CA ILE A 102 -35.236 -75.961 19.050 1.00 32.43 C ATOM 1644 C ILE A 102 -35.281 -77.105 20.034 1.00 41.24 C ATOM 1645 O ILE A 102 -34.234 -77.513 20.578 1.00 11.44 O ATOM 1646 CB ILE A 102 -35.081 -76.451 17.546 1.00 42.22 C ATOM 1647 CG1 ILE A 102 -33.668 -77.009 17.193 1.00 51.14 C ATOM 1648 CG2 ILE A 102 -35.474 -75.355 16.570 1.00 71.22 C ATOM 1649 CD1 ILE A 102 -33.320 -78.366 17.786 1.00 2.42 C ATOM 0 H ILE A 102 -33.314 -75.409 19.598 1.00 12.05 H new ATOM 0 HA ILE A 102 -36.200 -75.452 19.069 1.00 32.43 H new ATOM 0 HB ILE A 102 -35.769 -77.291 17.449 1.00 42.22 H new ATOM 0 HG12 ILE A 102 -33.587 -77.077 16.108 1.00 51.14 H new ATOM 0 HG13 ILE A 102 -32.921 -76.288 17.524 1.00 51.14 H new ATOM 0 HG21 ILE A 102 -35.358 -75.718 15.549 1.00 71.22 H new ATOM 0 HG22 ILE A 102 -36.513 -75.073 16.739 1.00 71.22 H new ATOM 0 HG23 ILE A 102 -34.833 -74.486 16.721 1.00 71.22 H new ATOM 0 HD11 ILE A 102 -32.316 -78.653 17.474 1.00 2.42 H new ATOM 0 HD12 ILE A 102 -33.359 -78.309 18.874 1.00 2.42 H new ATOM 0 HD13 ILE A 102 -34.035 -79.110 17.436 1.00 2.42 H new ATOM 1661 N GLU A 103 -36.454 -77.592 20.311 1.00 22.44 N ATOM 1662 CA GLU A 103 -36.581 -78.684 21.223 1.00 54.45 C ATOM 1663 C GLU A 103 -36.545 -79.999 20.479 1.00 50.13 C ATOM 1664 O GLU A 103 -37.042 -80.115 19.349 1.00 31.11 O ATOM 1665 CB GLU A 103 -37.861 -78.623 22.088 1.00 3.13 C ATOM 1666 CG GLU A 103 -37.995 -77.439 23.050 1.00 0.15 C ATOM 1667 CD GLU A 103 -38.281 -76.126 22.374 1.00 21.12 C ATOM 1668 OE1 GLU A 103 -39.468 -75.855 22.064 1.00 31.24 O ATOM 1669 OE2 GLU A 103 -37.354 -75.336 22.159 1.00 42.54 O ATOM 0 H GLU A 103 -37.332 -77.251 19.919 1.00 22.44 H new ATOM 0 HA GLU A 103 -35.732 -78.605 21.902 1.00 54.45 H new ATOM 0 HB2 GLU A 103 -38.722 -78.615 21.419 1.00 3.13 H new ATOM 0 HB3 GLU A 103 -37.919 -79.542 22.672 1.00 3.13 H new ATOM 0 HG2 GLU A 103 -38.794 -77.651 23.760 1.00 0.15 H new ATOM 0 HG3 GLU A 103 -37.074 -77.346 23.625 1.00 0.15 H new ATOM 1676 N LEU A 104 -35.939 -80.956 21.088 1.00 74.43 N ATOM 1677 CA LEU A 104 -35.900 -82.297 20.606 1.00 65.35 C ATOM 1678 C LEU A 104 -35.970 -83.186 21.808 1.00 74.15 C ATOM 1679 O LEU A 104 -34.954 -83.527 22.414 1.00 24.02 O ATOM 1680 CB LEU A 104 -34.641 -82.584 19.769 1.00 2.13 C ATOM 1681 CG LEU A 104 -34.526 -84.001 19.190 1.00 4.14 C ATOM 1682 CD1 LEU A 104 -35.690 -84.306 18.255 1.00 75.33 C ATOM 1683 CD2 LEU A 104 -33.205 -84.177 18.467 1.00 72.53 C ATOM 0 H LEU A 104 -35.438 -80.825 21.967 1.00 74.43 H new ATOM 0 HA LEU A 104 -36.738 -82.478 19.933 1.00 65.35 H new ATOM 0 HB2 LEU A 104 -34.607 -81.872 18.944 1.00 2.13 H new ATOM 0 HB3 LEU A 104 -33.765 -82.394 20.390 1.00 2.13 H new ATOM 0 HG LEU A 104 -34.564 -84.707 20.020 1.00 4.14 H new ATOM 0 HD11 LEU A 104 -35.584 -85.316 17.859 1.00 75.33 H new ATOM 0 HD12 LEU A 104 -36.628 -84.229 18.805 1.00 75.33 H new ATOM 0 HD13 LEU A 104 -35.692 -83.592 17.432 1.00 75.33 H new ATOM 0 HD21 LEU A 104 -33.143 -85.188 18.064 1.00 72.53 H new ATOM 0 HD22 LEU A 104 -33.137 -83.456 17.652 1.00 72.53 H new ATOM 0 HD23 LEU A 104 -32.384 -84.013 19.165 1.00 72.53 H new ATOM 1695 N ASP A 105 -37.175 -83.480 22.202 1.00 11.43 N ATOM 1696 CA ASP A 105 -37.413 -84.223 23.408 1.00 54.33 C ATOM 1697 C ASP A 105 -37.089 -85.667 23.201 1.00 64.23 C ATOM 1698 O ASP A 105 -36.243 -86.216 23.908 1.00 74.41 O ATOM 1699 CB ASP A 105 -38.873 -84.071 23.867 1.00 31.50 C ATOM 1700 CG ASP A 105 -39.287 -82.626 24.076 1.00 35.11 C ATOM 1701 OD1 ASP A 105 -39.040 -82.075 25.169 1.00 70.25 O ATOM 1702 OD2 ASP A 105 -39.873 -82.028 23.155 1.00 53.42 O ATOM 0 H ASP A 105 -38.020 -83.212 21.698 1.00 11.43 H new ATOM 0 HA ASP A 105 -36.764 -83.822 24.186 1.00 54.33 H new ATOM 0 HB2 ASP A 105 -39.529 -84.527 23.126 1.00 31.50 H new ATOM 0 HB3 ASP A 105 -39.014 -84.621 24.798 1.00 31.50 H new ATOM 1707 N THR A 106 -37.734 -86.262 22.190 1.00 61.44 N ATOM 1708 CA THR A 106 -37.600 -87.675 21.839 1.00 45.34 C ATOM 1709 C THR A 106 -37.537 -88.591 23.088 1.00 30.21 C ATOM 1710 O THR A 106 -36.460 -89.025 23.541 1.00 64.21 O ATOM 1711 CB THR A 106 -36.473 -87.966 20.763 1.00 13.20 C ATOM 1712 OG1 THR A 106 -36.444 -89.351 20.421 1.00 11.54 O ATOM 1713 CG2 THR A 106 -35.083 -87.518 21.210 1.00 74.13 C ATOM 0 H THR A 106 -38.379 -85.759 21.580 1.00 61.44 H new ATOM 0 HA THR A 106 -38.523 -87.944 21.326 1.00 45.34 H new ATOM 0 HB THR A 106 -36.736 -87.374 19.886 1.00 13.20 H new ATOM 0 HG1 THR A 106 -35.743 -89.509 19.755 1.00 11.54 H new ATOM 0 HG21 THR A 106 -34.358 -87.746 20.428 1.00 74.13 H new ATOM 0 HG22 THR A 106 -35.089 -86.444 21.397 1.00 74.13 H new ATOM 0 HG23 THR A 106 -34.808 -88.044 22.124 1.00 74.13 H new ATOM 1721 N SER A 107 -38.687 -88.827 23.671 1.00 0.24 N ATOM 1722 CA SER A 107 -38.753 -89.558 24.909 1.00 34.23 C ATOM 1723 C SER A 107 -39.126 -91.008 24.698 1.00 21.23 C ATOM 1724 O SER A 107 -38.929 -91.821 25.593 1.00 12.01 O ATOM 1725 CB SER A 107 -39.733 -88.882 25.856 1.00 22.31 C ATOM 1726 OG SER A 107 -39.318 -87.548 26.135 1.00 52.21 O ATOM 0 H SER A 107 -39.590 -88.523 23.306 1.00 0.24 H new ATOM 0 HA SER A 107 -37.758 -89.550 25.353 1.00 34.23 H new ATOM 0 HB2 SER A 107 -40.729 -88.874 25.413 1.00 22.31 H new ATOM 0 HB3 SER A 107 -39.801 -89.450 26.784 1.00 22.31 H new ATOM 0 HG SER A 107 -39.960 -87.126 26.744 1.00 52.21 H new ATOM 1732 N LEU A 108 -39.646 -91.315 23.513 1.00 12.41 N ATOM 1733 CA LEU A 108 -40.090 -92.661 23.152 1.00 10.41 C ATOM 1734 C LEU A 108 -41.248 -93.121 24.037 1.00 33.32 C ATOM 1735 O LEU A 108 -41.057 -93.547 25.185 1.00 63.44 O ATOM 1736 CB LEU A 108 -38.937 -93.682 23.186 1.00 45.21 C ATOM 1737 CG LEU A 108 -39.293 -95.121 22.806 1.00 65.13 C ATOM 1738 CD1 LEU A 108 -39.800 -95.201 21.371 1.00 42.10 C ATOM 1739 CD2 LEU A 108 -38.096 -96.034 23.006 1.00 20.21 C ATOM 0 H LEU A 108 -39.773 -90.630 22.768 1.00 12.41 H new ATOM 0 HA LEU A 108 -40.447 -92.608 22.123 1.00 10.41 H new ATOM 0 HB2 LEU A 108 -38.153 -93.335 22.513 1.00 45.21 H new ATOM 0 HB3 LEU A 108 -38.515 -93.688 24.191 1.00 45.21 H new ATOM 0 HG LEU A 108 -40.097 -95.456 23.462 1.00 65.13 H new ATOM 0 HD11 LEU A 108 -40.045 -96.235 21.129 1.00 42.10 H new ATOM 0 HD12 LEU A 108 -40.691 -94.582 21.265 1.00 42.10 H new ATOM 0 HD13 LEU A 108 -39.027 -94.843 20.691 1.00 42.10 H new ATOM 0 HD21 LEU A 108 -38.366 -97.054 22.731 1.00 20.21 H new ATOM 0 HD22 LEU A 108 -37.271 -95.696 22.379 1.00 20.21 H new ATOM 0 HD23 LEU A 108 -37.790 -96.009 24.052 1.00 20.21 H new ATOM 1751 N SER A 109 -42.437 -93.004 23.522 1.00 55.04 N ATOM 1752 CA SER A 109 -43.595 -93.436 24.234 1.00 32.24 C ATOM 1753 C SER A 109 -43.677 -94.959 24.203 1.00 52.44 C ATOM 1754 O SER A 109 -44.135 -95.561 23.219 1.00 33.23 O ATOM 1755 CB SER A 109 -44.833 -92.790 23.641 1.00 15.21 C ATOM 1756 OG SER A 109 -44.696 -91.371 23.676 1.00 60.02 O ATOM 0 H SER A 109 -42.627 -92.608 22.601 1.00 55.04 H new ATOM 0 HA SER A 109 -43.529 -93.127 25.277 1.00 32.24 H new ATOM 0 HB2 SER A 109 -44.974 -93.126 22.614 1.00 15.21 H new ATOM 0 HB3 SER A 109 -45.718 -93.094 24.201 1.00 15.21 H new ATOM 0 HG SER A 109 -45.496 -90.956 23.291 1.00 60.02 H new ATOM 1762 N TYR A 110 -43.165 -95.571 25.248 1.00 25.54 N ATOM 1763 CA TYR A 110 -43.139 -97.002 25.352 1.00 63.53 C ATOM 1764 C TYR A 110 -44.455 -97.516 25.885 1.00 2.22 C ATOM 1765 O TYR A 110 -44.940 -97.068 26.934 1.00 4.44 O ATOM 1766 CB TYR A 110 -41.926 -97.499 26.191 1.00 71.00 C ATOM 1767 CG TYR A 110 -41.857 -97.014 27.642 1.00 25.23 C ATOM 1768 CD1 TYR A 110 -41.318 -95.775 27.965 1.00 24.11 C ATOM 1769 CD2 TYR A 110 -42.308 -97.817 28.682 1.00 72.24 C ATOM 1770 CE1 TYR A 110 -41.234 -95.352 29.281 1.00 62.51 C ATOM 1771 CE2 TYR A 110 -42.230 -97.399 30.000 1.00 2.23 C ATOM 1772 CZ TYR A 110 -41.693 -96.167 30.294 1.00 53.00 C ATOM 1773 OH TYR A 110 -41.604 -95.750 31.611 1.00 2.34 O ATOM 0 H TYR A 110 -42.756 -95.085 26.046 1.00 25.54 H new ATOM 0 HA TYR A 110 -43.004 -97.414 24.352 1.00 63.53 H new ATOM 0 HB2 TYR A 110 -41.937 -98.589 26.195 1.00 71.00 H new ATOM 0 HB3 TYR A 110 -41.011 -97.192 25.684 1.00 71.00 H new ATOM 0 HD1 TYR A 110 -40.958 -95.131 27.176 1.00 24.11 H new ATOM 0 HD2 TYR A 110 -42.728 -98.787 28.458 1.00 72.24 H new ATOM 0 HE1 TYR A 110 -40.810 -94.386 29.513 1.00 62.51 H new ATOM 0 HE2 TYR A 110 -42.589 -98.037 30.794 1.00 2.23 H new ATOM 0 HH TYR A 110 -41.973 -96.442 32.199 1.00 2.34 H new ATOM 1783 N ILE A 111 -45.036 -98.415 25.148 1.00 51.53 N ATOM 1784 CA ILE A 111 -46.308 -99.005 25.457 1.00 44.33 C ATOM 1785 C ILE A 111 -46.316-100.506 25.215 1.00 71.04 C ATOM 1786 O ILE A 111 -46.600-101.256 26.148 1.00 38.44 O ATOM 1787 CB ILE A 111 -47.549 -98.248 24.818 1.00 52.24 C ATOM 1788 CG1 ILE A 111 -47.326 -97.808 23.342 1.00 31.35 C ATOM 1789 CG2 ILE A 111 -47.970 -97.060 25.669 1.00 74.12 C ATOM 1790 CD1 ILE A 111 -47.215 -98.920 22.334 1.00 1.42 C ATOM 1791 OXT ILE A 111 -45.938-100.944 24.112 1.00 38.44 O ATOM 0 H ILE A 111 -44.625 -98.771 24.285 1.00 51.53 H new ATOM 0 HA ILE A 111 -46.445 -98.867 26.530 1.00 44.33 H new ATOM 0 HB ILE A 111 -48.357 -98.980 24.801 1.00 52.24 H new ATOM 0 HG12 ILE A 111 -48.151 -97.159 23.048 1.00 31.35 H new ATOM 0 HG13 ILE A 111 -46.416 -97.209 23.295 1.00 31.35 H new ATOM 0 HG21 ILE A 111 -48.822 -96.563 25.204 1.00 74.12 H new ATOM 0 HG22 ILE A 111 -48.250 -97.406 26.664 1.00 74.12 H new ATOM 0 HG23 ILE A 111 -47.140 -96.358 25.750 1.00 74.12 H new ATOM 0 HD11 ILE A 111 -47.061 -98.497 21.341 1.00 1.42 H new ATOM 0 HD12 ILE A 111 -46.371 -99.560 22.590 1.00 1.42 H new ATOM 0 HD13 ILE A 111 -48.132 -99.509 22.339 1.00 1.42 H new TER 1803 ILE A 111