USER MOD reduce.3.24.130724 H: found=0, std=0, add=779, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 777 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 17 ASN : amide:sc= -0.735 K(o=-0.73,f=-1.7!) USER MOD Set 1.2: A 31 GLN : amide:sc= 0 K(o=-0.73,f=-1.7) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 90:sc= -0.799 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 GLN :FLIP amide:sc= -0.69 F(o=-1.3,f=-0.69) USER MOD Single : A 13 GLN : amide:sc= -0.206 X(o=-0.21,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= -0.0173 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= -1.27 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.309 K(o=-0.31,f=-2.6!) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= -1.76 USER MOD Single : A 60 THR OG1 : rot -83:sc= 0.958 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 ASN : amide:sc= -0.251 K(o=-0.25,f=-1.2) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.0701 USER MOD Single : A 81 THR OG1 : rot 46:sc= 0.0714 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 0:sc= 1.84 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.281 -3.224 -4.338 1.00 0.00 N ATOM 2 CA GLY A 1 18.716 -1.904 -4.114 1.00 0.00 C ATOM 3 C GLY A 1 17.820 -1.485 -5.281 1.00 0.00 C ATOM 4 O GLY A 1 18.251 -1.494 -6.433 1.00 0.00 O ATOM 0 H1 GLY A 1 19.885 -3.485 -3.532 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.513 -3.919 -4.434 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.850 -3.215 -5.208 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.139 -1.904 -3.190 1.00 0.00 H new ATOM 0 HA3 GLY A 1 19.519 -1.178 -3.988 1.00 0.00 H new ATOM 8 N SER A 2 16.590 -1.127 -4.943 1.00 0.00 N ATOM 9 CA SER A 2 15.630 -0.706 -5.949 1.00 0.00 C ATOM 10 C SER A 2 14.762 0.429 -5.401 1.00 0.00 C ATOM 11 O SER A 2 14.762 0.690 -4.199 1.00 0.00 O ATOM 12 CB SER A 2 14.752 -1.876 -6.397 1.00 0.00 C ATOM 13 OG SER A 2 14.426 -2.744 -5.315 1.00 0.00 O ATOM 0 H SER A 2 16.236 -1.120 -3.986 1.00 0.00 H new ATOM 0 HA SER A 2 16.181 -0.347 -6.818 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.834 -1.491 -6.842 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.269 -2.441 -7.172 1.00 0.00 H new ATOM 0 HG SER A 2 13.596 -2.441 -4.892 1.00 0.00 H new ATOM 19 N SER A 3 14.044 1.073 -6.309 1.00 0.00 N ATOM 20 CA SER A 3 13.173 2.174 -5.932 1.00 0.00 C ATOM 21 C SER A 3 12.514 2.770 -7.177 1.00 0.00 C ATOM 22 O SER A 3 13.033 2.633 -8.284 1.00 0.00 O ATOM 23 CB SER A 3 13.948 3.253 -5.173 1.00 0.00 C ATOM 24 OG SER A 3 15.052 3.747 -5.926 1.00 0.00 O ATOM 0 H SER A 3 14.047 0.854 -7.305 1.00 0.00 H new ATOM 0 HA SER A 3 12.399 1.787 -5.270 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.278 4.077 -4.929 1.00 0.00 H new ATOM 0 HB3 SER A 3 14.307 2.845 -4.228 1.00 0.00 H new ATOM 0 HG SER A 3 15.520 4.435 -5.408 1.00 0.00 H new ATOM 30 N GLY A 4 11.381 3.419 -6.954 1.00 0.00 N ATOM 31 CA GLY A 4 10.646 4.037 -8.044 1.00 0.00 C ATOM 32 C GLY A 4 10.904 5.544 -8.095 1.00 0.00 C ATOM 33 O GLY A 4 11.403 6.125 -7.133 1.00 0.00 O ATOM 0 H GLY A 4 10.954 3.530 -6.034 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.940 3.582 -8.990 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.579 3.851 -7.919 1.00 0.00 H new ATOM 37 N SER A 5 10.553 6.134 -9.229 1.00 0.00 N ATOM 38 CA SER A 5 10.741 7.562 -9.418 1.00 0.00 C ATOM 39 C SER A 5 9.734 8.092 -10.441 1.00 0.00 C ATOM 40 O SER A 5 8.962 9.002 -10.143 1.00 0.00 O ATOM 41 CB SER A 5 12.170 7.875 -9.869 1.00 0.00 C ATOM 42 OG SER A 5 12.564 9.197 -9.514 1.00 0.00 O ATOM 0 H SER A 5 10.140 5.649 -10.025 1.00 0.00 H new ATOM 0 HA SER A 5 10.573 8.058 -8.462 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.857 7.159 -9.419 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.244 7.752 -10.950 1.00 0.00 H new ATOM 0 HG SER A 5 13.482 9.357 -9.817 1.00 0.00 H new ATOM 48 N SER A 6 9.774 7.499 -11.625 1.00 0.00 N ATOM 49 CA SER A 6 8.875 7.899 -12.693 1.00 0.00 C ATOM 50 C SER A 6 7.632 7.006 -12.694 1.00 0.00 C ATOM 51 O SER A 6 7.658 5.901 -12.153 1.00 0.00 O ATOM 52 CB SER A 6 9.573 7.838 -14.053 1.00 0.00 C ATOM 53 OG SER A 6 9.158 8.895 -14.914 1.00 0.00 O ATOM 0 H SER A 6 10.416 6.744 -11.868 1.00 0.00 H new ATOM 0 HA SER A 6 8.573 8.931 -12.516 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.652 7.890 -13.909 1.00 0.00 H new ATOM 0 HB3 SER A 6 9.360 6.880 -14.527 1.00 0.00 H new ATOM 0 HG SER A 6 9.627 8.822 -15.771 1.00 0.00 H new ATOM 59 N GLY A 7 6.575 7.517 -13.307 1.00 0.00 N ATOM 60 CA GLY A 7 5.326 6.780 -13.385 1.00 0.00 C ATOM 61 C GLY A 7 4.702 6.610 -11.998 1.00 0.00 C ATOM 62 O GLY A 7 5.142 5.770 -11.214 1.00 0.00 O ATOM 0 H GLY A 7 6.558 8.433 -13.755 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.630 7.305 -14.039 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.504 5.801 -13.830 1.00 0.00 H new ATOM 66 N LEU A 8 3.687 7.421 -11.738 1.00 0.00 N ATOM 67 CA LEU A 8 2.998 7.371 -10.460 1.00 0.00 C ATOM 68 C LEU A 8 2.646 5.918 -10.131 1.00 0.00 C ATOM 69 O LEU A 8 3.250 5.315 -9.246 1.00 0.00 O ATOM 70 CB LEU A 8 1.790 8.310 -10.464 1.00 0.00 C ATOM 71 CG LEU A 8 2.095 9.795 -10.259 1.00 0.00 C ATOM 72 CD1 LEU A 8 0.807 10.621 -10.235 1.00 0.00 C ATOM 73 CD2 LEU A 8 2.939 10.013 -9.002 1.00 0.00 C ATOM 0 H LEU A 8 3.325 8.116 -12.391 1.00 0.00 H new ATOM 0 HA LEU A 8 3.649 7.730 -9.663 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.268 8.194 -11.414 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.103 7.989 -9.681 1.00 0.00 H new ATOM 0 HG LEU A 8 2.685 10.143 -11.107 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.052 11.673 -10.088 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.280 10.500 -11.181 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.171 10.279 -9.419 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.142 11.077 -8.880 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.397 9.644 -8.131 1.00 0.00 H new ATOM 0 HD23 LEU A 8 3.881 9.473 -9.098 1.00 0.00 H new ATOM 85 N ARG A 9 1.670 5.400 -10.862 1.00 0.00 N ATOM 86 CA ARG A 9 1.231 4.029 -10.659 1.00 0.00 C ATOM 87 C ARG A 9 2.433 3.121 -10.392 1.00 0.00 C ATOM 88 O ARG A 9 2.455 2.392 -9.401 1.00 0.00 O ATOM 89 CB ARG A 9 0.469 3.509 -11.880 1.00 0.00 C ATOM 90 CG ARG A 9 -0.718 2.642 -11.456 1.00 0.00 C ATOM 91 CD ARG A 9 -0.835 1.401 -12.343 1.00 0.00 C ATOM 92 NE ARG A 9 -1.207 1.796 -13.720 1.00 0.00 N ATOM 93 CZ ARG A 9 -1.543 0.929 -14.685 1.00 0.00 C ATOM 94 NH1 ARG A 9 -1.556 -0.386 -14.430 1.00 0.00 N ATOM 95 NH2 ARG A 9 -1.866 1.378 -15.906 1.00 0.00 N ATOM 0 H ARG A 9 1.171 5.904 -11.595 1.00 0.00 H new ATOM 0 HA ARG A 9 0.564 4.018 -9.797 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.115 4.349 -12.478 1.00 0.00 H new ATOM 0 HB3 ARG A 9 1.141 2.928 -12.512 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -0.599 2.340 -10.416 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -1.638 3.224 -11.516 1.00 0.00 H new ATOM 0 HD2 ARG A 9 0.112 0.861 -12.354 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -1.584 0.722 -11.936 1.00 0.00 H new ATOM 0 HE ARG A 9 -1.208 2.790 -13.949 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -1.310 -0.728 -13.501 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -1.812 -1.045 -15.165 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -1.856 2.379 -16.100 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -2.122 0.718 -16.641 1.00 0.00 H new ATOM 109 N GLU A 10 3.402 3.194 -11.292 1.00 0.00 N ATOM 110 CA GLU A 10 4.604 2.388 -11.165 1.00 0.00 C ATOM 111 C GLU A 10 5.254 2.615 -9.799 1.00 0.00 C ATOM 112 O GLU A 10 5.579 1.660 -9.096 1.00 0.00 O ATOM 113 CB GLU A 10 5.587 2.688 -12.298 1.00 0.00 C ATOM 114 CG GLU A 10 5.658 1.522 -13.286 1.00 0.00 C ATOM 115 CD GLU A 10 6.550 0.401 -12.750 1.00 0.00 C ATOM 116 OE1 GLU A 10 7.766 0.458 -13.035 1.00 0.00 O ATOM 117 OE2 GLU A 10 5.997 -0.488 -12.066 1.00 0.00 O ATOM 0 H GLU A 10 3.379 3.799 -12.113 1.00 0.00 H new ATOM 0 HA GLU A 10 4.323 1.337 -11.241 1.00 0.00 H new ATOM 0 HB2 GLU A 10 5.280 3.594 -12.821 1.00 0.00 H new ATOM 0 HB3 GLU A 10 6.577 2.879 -11.884 1.00 0.00 H new ATOM 0 HG2 GLU A 10 4.655 1.136 -13.471 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.046 1.874 -14.242 1.00 0.00 H new ATOM 124 N GLN A 11 5.425 3.886 -9.465 1.00 0.00 N ATOM 125 CA GLN A 11 6.031 4.251 -8.196 1.00 0.00 C ATOM 126 C GLN A 11 5.350 3.503 -7.048 1.00 0.00 C ATOM 127 O GLN A 11 6.010 2.805 -6.279 1.00 0.00 O ATOM 128 CB GLN A 11 5.973 5.764 -7.976 1.00 0.00 C ATOM 129 CG GLN A 11 7.277 6.433 -8.415 1.00 0.00 C ATOM 130 CD GLN A 11 7.586 7.655 -7.548 1.00 0.00 C ATOM 131 OE1 GLN A 11 6.936 8.756 -7.914 1.00 0.00 O flip ATOM 132 NE2 GLN A 11 8.363 7.601 -6.609 1.00 0.00 N flip ATOM 0 H GLN A 11 5.154 4.676 -10.051 1.00 0.00 H new ATOM 0 HA GLN A 11 7.081 3.961 -8.220 1.00 0.00 H new ATOM 0 HB2 GLN A 11 5.138 6.185 -8.536 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.789 5.975 -6.923 1.00 0.00 H new ATOM 0 HG2 GLN A 11 8.097 5.718 -8.348 1.00 0.00 H new ATOM 0 HG3 GLN A 11 7.202 6.734 -9.460 1.00 0.00 H new ATOM 0 HE21 GLN A 11 8.829 6.722 -6.382 1.00 0.00 H new ATOM 0 HE22 GLN A 11 8.547 8.435 -6.051 1.00 0.00 H new ATOM 141 N VAL A 12 4.039 3.675 -6.968 1.00 0.00 N ATOM 142 CA VAL A 12 3.261 3.025 -5.927 1.00 0.00 C ATOM 143 C VAL A 12 3.323 1.509 -6.121 1.00 0.00 C ATOM 144 O VAL A 12 3.693 0.776 -5.205 1.00 0.00 O ATOM 145 CB VAL A 12 1.831 3.570 -5.924 1.00 0.00 C ATOM 146 CG1 VAL A 12 1.002 2.927 -4.811 1.00 0.00 C ATOM 147 CG2 VAL A 12 1.826 5.095 -5.801 1.00 0.00 C ATOM 0 H VAL A 12 3.496 4.255 -7.607 1.00 0.00 H new ATOM 0 HA VAL A 12 3.680 3.244 -4.945 1.00 0.00 H new ATOM 0 HB VAL A 12 1.371 3.310 -6.877 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -0.010 3.332 -4.831 1.00 0.00 H new ATOM 0 HG12 VAL A 12 0.964 1.848 -4.962 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.460 3.142 -3.846 1.00 0.00 H new ATOM 0 HG21 VAL A 12 0.798 5.457 -5.801 1.00 0.00 H new ATOM 0 HG22 VAL A 12 2.313 5.387 -4.870 1.00 0.00 H new ATOM 0 HG23 VAL A 12 2.364 5.530 -6.644 1.00 0.00 H new ATOM 157 N GLN A 13 2.955 1.083 -7.321 1.00 0.00 N ATOM 158 CA GLN A 13 2.964 -0.333 -7.647 1.00 0.00 C ATOM 159 C GLN A 13 4.255 -0.985 -7.149 1.00 0.00 C ATOM 160 O GLN A 13 4.287 -2.185 -6.883 1.00 0.00 O ATOM 161 CB GLN A 13 2.786 -0.550 -9.151 1.00 0.00 C ATOM 162 CG GLN A 13 1.319 -0.819 -9.496 1.00 0.00 C ATOM 163 CD GLN A 13 1.201 -1.856 -10.615 1.00 0.00 C ATOM 164 OE1 GLN A 13 0.920 -3.022 -10.389 1.00 0.00 O ATOM 165 NE2 GLN A 13 1.430 -1.369 -11.831 1.00 0.00 N ATOM 0 H GLN A 13 2.649 1.693 -8.079 1.00 0.00 H new ATOM 0 HA GLN A 13 2.122 -0.807 -7.142 1.00 0.00 H new ATOM 0 HB2 GLN A 13 3.136 0.329 -9.693 1.00 0.00 H new ATOM 0 HB3 GLN A 13 3.400 -1.390 -9.476 1.00 0.00 H new ATOM 0 HG2 GLN A 13 0.792 -1.173 -8.610 1.00 0.00 H new ATOM 0 HG3 GLN A 13 0.838 0.109 -9.803 1.00 0.00 H new ATOM 0 HE21 GLN A 13 1.661 -0.383 -11.950 1.00 0.00 H new ATOM 0 HE22 GLN A 13 1.375 -1.982 -12.644 1.00 0.00 H new ATOM 174 N ASP A 14 5.290 -0.164 -7.037 1.00 0.00 N ATOM 175 CA ASP A 14 6.580 -0.646 -6.575 1.00 0.00 C ATOM 176 C ASP A 14 6.686 -0.438 -5.063 1.00 0.00 C ATOM 177 O ASP A 14 7.268 -1.262 -4.359 1.00 0.00 O ATOM 178 CB ASP A 14 7.725 0.123 -7.238 1.00 0.00 C ATOM 179 CG ASP A 14 8.967 -0.712 -7.553 1.00 0.00 C ATOM 180 OD1 ASP A 14 9.829 -0.809 -6.653 1.00 0.00 O ATOM 181 OD2 ASP A 14 9.028 -1.234 -8.687 1.00 0.00 O ATOM 0 H ASP A 14 5.261 0.831 -7.258 1.00 0.00 H new ATOM 0 HA ASP A 14 6.657 -1.702 -6.833 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.358 0.564 -8.165 1.00 0.00 H new ATOM 0 HB3 ASP A 14 8.015 0.947 -6.586 1.00 0.00 H new ATOM 186 N LEU A 15 6.114 0.667 -4.608 1.00 0.00 N ATOM 187 CA LEU A 15 6.136 0.993 -3.192 1.00 0.00 C ATOM 188 C LEU A 15 5.624 -0.204 -2.389 1.00 0.00 C ATOM 189 O LEU A 15 6.398 -0.879 -1.712 1.00 0.00 O ATOM 190 CB LEU A 15 5.363 2.287 -2.928 1.00 0.00 C ATOM 191 CG LEU A 15 5.125 2.638 -1.458 1.00 0.00 C ATOM 192 CD1 LEU A 15 6.441 2.978 -0.755 1.00 0.00 C ATOM 193 CD2 LEU A 15 4.095 3.761 -1.322 1.00 0.00 C ATOM 0 H LEU A 15 5.632 1.348 -5.195 1.00 0.00 H new ATOM 0 HA LEU A 15 7.157 1.186 -2.861 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.903 3.111 -3.395 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.396 2.217 -3.425 1.00 0.00 H new ATOM 0 HG LEU A 15 4.712 1.761 -0.960 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.243 3.224 0.288 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.112 2.121 -0.805 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.906 3.832 -1.247 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.944 3.991 -0.267 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.456 4.650 -1.839 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.150 3.443 -1.762 1.00 0.00 H new ATOM 205 N PHE A 16 4.323 -0.432 -2.492 1.00 0.00 N ATOM 206 CA PHE A 16 3.698 -1.536 -1.783 1.00 0.00 C ATOM 207 C PHE A 16 4.511 -2.822 -1.946 1.00 0.00 C ATOM 208 O PHE A 16 4.590 -3.632 -1.024 1.00 0.00 O ATOM 209 CB PHE A 16 2.314 -1.740 -2.404 1.00 0.00 C ATOM 210 CG PHE A 16 1.356 -0.568 -2.185 1.00 0.00 C ATOM 211 CD1 PHE A 16 1.397 0.137 -1.022 1.00 0.00 C ATOM 212 CD2 PHE A 16 0.462 -0.230 -3.153 1.00 0.00 C ATOM 213 CE1 PHE A 16 0.507 1.225 -0.819 1.00 0.00 C ATOM 214 CE2 PHE A 16 -0.428 0.858 -2.950 1.00 0.00 C ATOM 215 CZ PHE A 16 -0.387 1.562 -1.787 1.00 0.00 C ATOM 0 H PHE A 16 3.684 0.129 -3.056 1.00 0.00 H new ATOM 0 HA PHE A 16 3.637 -1.308 -0.719 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.429 -1.907 -3.475 1.00 0.00 H new ATOM 0 HB3 PHE A 16 1.869 -2.643 -1.986 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.106 -0.131 -0.253 1.00 0.00 H new ATOM 0 HD2 PHE A 16 0.429 -0.789 -4.076 1.00 0.00 H new ATOM 0 HE1 PHE A 16 0.540 1.785 0.104 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -1.137 1.126 -3.719 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.064 2.389 -1.632 1.00 0.00 H new ATOM 225 N ASN A 17 5.095 -2.969 -3.126 1.00 0.00 N ATOM 226 CA ASN A 17 5.899 -4.143 -3.422 1.00 0.00 C ATOM 227 C ASN A 17 7.172 -4.110 -2.574 1.00 0.00 C ATOM 228 O ASN A 17 7.386 -4.984 -1.735 1.00 0.00 O ATOM 229 CB ASN A 17 6.313 -4.171 -4.894 1.00 0.00 C ATOM 230 CG ASN A 17 5.178 -4.701 -5.773 1.00 0.00 C ATOM 231 OD1 ASN A 17 4.119 -5.080 -5.301 1.00 0.00 O ATOM 232 ND2 ASN A 17 5.457 -4.707 -7.073 1.00 0.00 N ATOM 0 H ASN A 17 5.028 -2.295 -3.888 1.00 0.00 H new ATOM 0 HA ASN A 17 5.300 -5.026 -3.199 1.00 0.00 H new ATOM 0 HB2 ASN A 17 6.589 -3.167 -5.217 1.00 0.00 H new ATOM 0 HB3 ASN A 17 7.195 -4.799 -5.015 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.764 -5.043 -7.742 1.00 0.00 H new ATOM 0 HD22 ASN A 17 6.364 -4.376 -7.401 1.00 0.00 H new ATOM 239 N LYS A 18 7.984 -3.093 -2.822 1.00 0.00 N ATOM 240 CA LYS A 18 9.231 -2.935 -2.092 1.00 0.00 C ATOM 241 C LYS A 18 8.955 -3.049 -0.591 1.00 0.00 C ATOM 242 O LYS A 18 9.587 -3.846 0.101 1.00 0.00 O ATOM 243 CB LYS A 18 9.925 -1.632 -2.493 1.00 0.00 C ATOM 244 CG LYS A 18 11.438 -1.829 -2.605 1.00 0.00 C ATOM 245 CD LYS A 18 12.178 -1.007 -1.548 1.00 0.00 C ATOM 246 CE LYS A 18 13.692 -1.080 -1.758 1.00 0.00 C ATOM 247 NZ LYS A 18 14.340 -1.775 -0.623 1.00 0.00 N ATOM 0 H LYS A 18 7.803 -2.370 -3.518 1.00 0.00 H new ATOM 0 HA LYS A 18 9.928 -3.732 -2.350 1.00 0.00 H new ATOM 0 HB2 LYS A 18 9.528 -1.283 -3.446 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.709 -0.859 -1.756 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.681 -2.885 -2.485 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.774 -1.536 -3.600 1.00 0.00 H new ATOM 0 HD2 LYS A 18 11.850 0.032 -1.595 1.00 0.00 H new ATOM 0 HD3 LYS A 18 11.927 -1.376 -0.554 1.00 0.00 H new ATOM 0 HE2 LYS A 18 13.911 -1.606 -2.687 1.00 0.00 H new ATOM 0 HE3 LYS A 18 14.100 -0.074 -1.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 15.367 -1.816 -0.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 14.146 -1.257 0.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 13.963 -2.741 -0.547 1.00 0.00 H new ATOM 261 N LYS A 19 8.012 -2.239 -0.132 1.00 0.00 N ATOM 262 CA LYS A 19 7.646 -2.239 1.274 1.00 0.00 C ATOM 263 C LYS A 19 7.589 -3.681 1.782 1.00 0.00 C ATOM 264 O LYS A 19 8.158 -3.999 2.825 1.00 0.00 O ATOM 265 CB LYS A 19 6.347 -1.460 1.489 1.00 0.00 C ATOM 266 CG LYS A 19 6.629 0.030 1.697 1.00 0.00 C ATOM 267 CD LYS A 19 6.953 0.327 3.162 1.00 0.00 C ATOM 268 CE LYS A 19 7.543 1.730 3.319 1.00 0.00 C ATOM 269 NZ LYS A 19 8.352 1.817 4.556 1.00 0.00 N ATOM 0 H LYS A 19 7.491 -1.579 -0.709 1.00 0.00 H new ATOM 0 HA LYS A 19 8.403 -1.722 1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.692 -1.593 0.628 1.00 0.00 H new ATOM 0 HB3 LYS A 19 5.819 -1.858 2.355 1.00 0.00 H new ATOM 0 HG2 LYS A 19 7.464 0.337 1.067 1.00 0.00 H new ATOM 0 HG3 LYS A 19 5.763 0.615 1.387 1.00 0.00 H new ATOM 0 HD2 LYS A 19 6.048 0.240 3.763 1.00 0.00 H new ATOM 0 HD3 LYS A 19 7.659 -0.413 3.539 1.00 0.00 H new ATOM 0 HE2 LYS A 19 8.163 1.969 2.455 1.00 0.00 H new ATOM 0 HE3 LYS A 19 6.741 2.467 3.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 8.745 2.776 4.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 7.751 1.609 5.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 9.129 1.127 4.512 1.00 0.00 H new ATOM 283 N TYR A 20 6.897 -4.516 1.021 1.00 0.00 N ATOM 284 CA TYR A 20 6.758 -5.917 1.381 1.00 0.00 C ATOM 285 C TYR A 20 8.054 -6.458 1.988 1.00 0.00 C ATOM 286 O TYR A 20 8.066 -6.916 3.130 1.00 0.00 O ATOM 287 CB TYR A 20 6.470 -6.661 0.076 1.00 0.00 C ATOM 288 CG TYR A 20 5.765 -8.006 0.268 1.00 0.00 C ATOM 289 CD1 TYR A 20 4.620 -8.081 1.035 1.00 0.00 C ATOM 290 CD2 TYR A 20 6.275 -9.143 -0.324 1.00 0.00 C ATOM 291 CE1 TYR A 20 3.956 -9.346 1.216 1.00 0.00 C ATOM 292 CE2 TYR A 20 5.611 -10.408 -0.143 1.00 0.00 C ATOM 293 CZ TYR A 20 4.485 -10.447 0.618 1.00 0.00 C ATOM 294 OH TYR A 20 3.858 -11.642 0.789 1.00 0.00 O ATOM 0 H TYR A 20 6.426 -4.249 0.156 1.00 0.00 H new ATOM 0 HA TYR A 20 5.967 -6.047 2.119 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.854 -6.028 -0.563 1.00 0.00 H new ATOM 0 HB3 TYR A 20 7.410 -6.827 -0.450 1.00 0.00 H new ATOM 0 HD1 TYR A 20 4.222 -7.191 1.499 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.172 -9.084 -0.923 1.00 0.00 H new ATOM 0 HE1 TYR A 20 3.059 -9.419 1.813 1.00 0.00 H new ATOM 0 HE2 TYR A 20 5.999 -11.306 -0.602 1.00 0.00 H new ATOM 0 HH TYR A 20 4.346 -12.340 0.304 1.00 0.00 H new ATOM 304 N GLY A 21 9.115 -6.387 1.197 1.00 0.00 N ATOM 305 CA GLY A 21 10.413 -6.864 1.642 1.00 0.00 C ATOM 306 C GLY A 21 10.645 -6.527 3.116 1.00 0.00 C ATOM 307 O GLY A 21 11.219 -7.325 3.856 1.00 0.00 O ATOM 0 H GLY A 21 9.102 -6.006 0.251 1.00 0.00 H new ATOM 0 HA2 GLY A 21 10.477 -7.942 1.497 1.00 0.00 H new ATOM 0 HA3 GLY A 21 11.198 -6.414 1.034 1.00 0.00 H new ATOM 311 N GLU A 22 10.188 -5.344 3.499 1.00 0.00 N ATOM 312 CA GLU A 22 10.339 -4.891 4.871 1.00 0.00 C ATOM 313 C GLU A 22 9.416 -5.687 5.797 1.00 0.00 C ATOM 314 O GLU A 22 9.867 -6.254 6.791 1.00 0.00 O ATOM 315 CB GLU A 22 10.069 -3.390 4.986 1.00 0.00 C ATOM 316 CG GLU A 22 10.986 -2.595 4.055 1.00 0.00 C ATOM 317 CD GLU A 22 10.674 -1.099 4.122 1.00 0.00 C ATOM 318 OE1 GLU A 22 10.719 -0.560 5.249 1.00 0.00 O ATOM 319 OE2 GLU A 22 10.396 -0.528 3.046 1.00 0.00 O ATOM 0 H GLU A 22 9.713 -4.685 2.882 1.00 0.00 H new ATOM 0 HA GLU A 22 11.370 -5.066 5.179 1.00 0.00 H new ATOM 0 HB2 GLU A 22 9.027 -3.184 4.739 1.00 0.00 H new ATOM 0 HB3 GLU A 22 10.222 -3.067 6.016 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.026 -2.766 4.331 1.00 0.00 H new ATOM 0 HG3 GLU A 22 10.866 -2.949 3.031 1.00 0.00 H new ATOM 326 N ALA A 23 8.141 -5.703 5.437 1.00 0.00 N ATOM 327 CA ALA A 23 7.150 -6.419 6.223 1.00 0.00 C ATOM 328 C ALA A 23 7.633 -7.851 6.461 1.00 0.00 C ATOM 329 O ALA A 23 7.199 -8.507 7.406 1.00 0.00 O ATOM 330 CB ALA A 23 5.799 -6.371 5.508 1.00 0.00 C ATOM 0 H ALA A 23 7.771 -5.232 4.611 1.00 0.00 H new ATOM 0 HA ALA A 23 7.020 -5.948 7.197 1.00 0.00 H new ATOM 0 HB1 ALA A 23 5.056 -6.908 6.098 1.00 0.00 H new ATOM 0 HB2 ALA A 23 5.487 -5.333 5.389 1.00 0.00 H new ATOM 0 HB3 ALA A 23 5.890 -6.837 4.527 1.00 0.00 H new ATOM 336 N LEU A 24 8.525 -8.294 5.587 1.00 0.00 N ATOM 337 CA LEU A 24 9.072 -9.636 5.690 1.00 0.00 C ATOM 338 C LEU A 24 10.479 -9.565 6.286 1.00 0.00 C ATOM 339 O LEU A 24 10.954 -10.529 6.885 1.00 0.00 O ATOM 340 CB LEU A 24 9.013 -10.345 4.335 1.00 0.00 C ATOM 341 CG LEU A 24 7.626 -10.460 3.699 1.00 0.00 C ATOM 342 CD1 LEU A 24 7.726 -10.950 2.253 1.00 0.00 C ATOM 343 CD2 LEU A 24 6.708 -11.346 4.543 1.00 0.00 C ATOM 0 H LEU A 24 8.883 -7.747 4.804 1.00 0.00 H new ATOM 0 HA LEU A 24 8.469 -10.241 6.367 1.00 0.00 H new ATOM 0 HB2 LEU A 24 9.666 -9.816 3.641 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.421 -11.349 4.454 1.00 0.00 H new ATOM 0 HG LEU A 24 7.178 -9.467 3.672 1.00 0.00 H new ATOM 0 HD11 LEU A 24 6.727 -11.023 1.824 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.320 -10.246 1.671 1.00 0.00 H new ATOM 0 HD13 LEU A 24 8.202 -11.930 2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 24 5.729 -11.411 4.069 1.00 0.00 H new ATOM 0 HD22 LEU A 24 7.139 -12.344 4.624 1.00 0.00 H new ATOM 0 HD23 LEU A 24 6.601 -10.915 5.539 1.00 0.00 H new ATOM 355 N GLY A 25 11.108 -8.413 6.101 1.00 0.00 N ATOM 356 CA GLY A 25 12.452 -8.203 6.613 1.00 0.00 C ATOM 357 C GLY A 25 13.497 -8.434 5.519 1.00 0.00 C ATOM 358 O GLY A 25 14.661 -8.073 5.683 1.00 0.00 O ATOM 0 H GLY A 25 10.712 -7.615 5.604 1.00 0.00 H new ATOM 0 HA2 GLY A 25 12.543 -7.188 7.000 1.00 0.00 H new ATOM 0 HA3 GLY A 25 12.637 -8.880 7.447 1.00 0.00 H new ATOM 362 N ILE A 26 13.043 -9.034 4.428 1.00 0.00 N ATOM 363 CA ILE A 26 13.924 -9.317 3.308 1.00 0.00 C ATOM 364 C ILE A 26 14.733 -8.062 2.972 1.00 0.00 C ATOM 365 O ILE A 26 14.405 -6.967 3.426 1.00 0.00 O ATOM 366 CB ILE A 26 13.127 -9.870 2.126 1.00 0.00 C ATOM 367 CG1 ILE A 26 12.908 -11.377 2.269 1.00 0.00 C ATOM 368 CG2 ILE A 26 13.797 -9.511 0.797 1.00 0.00 C ATOM 369 CD1 ILE A 26 11.692 -11.834 1.460 1.00 0.00 C ATOM 0 H ILE A 26 12.076 -9.332 4.296 1.00 0.00 H new ATOM 0 HA ILE A 26 14.639 -10.096 3.572 1.00 0.00 H new ATOM 0 HB ILE A 26 12.143 -9.401 2.128 1.00 0.00 H new ATOM 0 HG12 ILE A 26 13.796 -11.911 1.930 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.766 -11.629 3.320 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.210 -9.916 -0.027 1.00 0.00 H new ATOM 0 HG22 ILE A 26 13.857 -8.427 0.701 1.00 0.00 H new ATOM 0 HG23 ILE A 26 14.801 -9.934 0.770 1.00 0.00 H new ATOM 0 HD11 ILE A 26 11.559 -12.909 1.579 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.802 -11.316 1.817 1.00 0.00 H new ATOM 0 HD13 ILE A 26 11.848 -11.602 0.406 1.00 0.00 H new ATOM 381 N LYS A 27 15.775 -8.264 2.179 1.00 0.00 N ATOM 382 CA LYS A 27 16.633 -7.163 1.776 1.00 0.00 C ATOM 383 C LYS A 27 16.387 -6.843 0.300 1.00 0.00 C ATOM 384 O LYS A 27 16.459 -5.685 -0.108 1.00 0.00 O ATOM 385 CB LYS A 27 18.095 -7.476 2.102 1.00 0.00 C ATOM 386 CG LYS A 27 18.722 -8.356 1.018 1.00 0.00 C ATOM 387 CD LYS A 27 19.547 -7.518 0.040 1.00 0.00 C ATOM 388 CE LYS A 27 21.045 -7.754 0.244 1.00 0.00 C ATOM 389 NZ LYS A 27 21.834 -6.896 -0.668 1.00 0.00 N ATOM 0 H LYS A 27 16.044 -9.174 1.805 1.00 0.00 H new ATOM 0 HA LYS A 27 16.389 -6.264 2.342 1.00 0.00 H new ATOM 0 HB2 LYS A 27 18.658 -6.547 2.192 1.00 0.00 H new ATOM 0 HB3 LYS A 27 18.156 -7.981 3.066 1.00 0.00 H new ATOM 0 HG2 LYS A 27 19.357 -9.112 1.480 1.00 0.00 H new ATOM 0 HG3 LYS A 27 17.938 -8.886 0.477 1.00 0.00 H new ATOM 0 HD2 LYS A 27 19.271 -7.771 -0.984 1.00 0.00 H new ATOM 0 HD3 LYS A 27 19.319 -6.461 0.179 1.00 0.00 H new ATOM 0 HE2 LYS A 27 21.315 -7.541 1.278 1.00 0.00 H new ATOM 0 HE3 LYS A 27 21.282 -8.802 0.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 22.848 -7.069 -0.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 21.588 -7.119 -1.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 21.621 -5.896 -0.476 1.00 0.00 H new ATOM 403 N TYR A 28 16.102 -7.890 -0.460 1.00 0.00 N ATOM 404 CA TYR A 28 15.844 -7.735 -1.881 1.00 0.00 C ATOM 405 C TYR A 28 14.387 -7.344 -2.135 1.00 0.00 C ATOM 406 O TYR A 28 13.540 -7.486 -1.255 1.00 0.00 O ATOM 407 CB TYR A 28 16.109 -9.105 -2.509 1.00 0.00 C ATOM 408 CG TYR A 28 15.489 -10.273 -1.740 1.00 0.00 C ATOM 409 CD1 TYR A 28 14.171 -10.621 -1.960 1.00 0.00 C ATOM 410 CD2 TYR A 28 16.246 -10.978 -0.827 1.00 0.00 C ATOM 411 CE1 TYR A 28 13.587 -11.720 -1.236 1.00 0.00 C ATOM 412 CE2 TYR A 28 15.662 -12.078 -0.103 1.00 0.00 C ATOM 413 CZ TYR A 28 14.361 -12.394 -0.343 1.00 0.00 C ATOM 414 OH TYR A 28 13.809 -13.432 0.340 1.00 0.00 O ATOM 0 H TYR A 28 16.044 -8.849 -0.118 1.00 0.00 H new ATOM 0 HA TYR A 28 16.475 -6.952 -2.302 1.00 0.00 H new ATOM 0 HB2 TYR A 28 15.721 -9.107 -3.528 1.00 0.00 H new ATOM 0 HB3 TYR A 28 17.186 -9.260 -2.578 1.00 0.00 H new ATOM 0 HD1 TYR A 28 13.579 -10.069 -2.675 1.00 0.00 H new ATOM 0 HD2 TYR A 28 17.277 -10.705 -0.655 1.00 0.00 H new ATOM 0 HE1 TYR A 28 12.557 -12.003 -1.398 1.00 0.00 H new ATOM 0 HE2 TYR A 28 16.244 -12.639 0.614 1.00 0.00 H new ATOM 0 HH TYR A 28 14.478 -13.820 0.942 1.00 0.00 H new ATOM 424 N PRO A 29 14.133 -6.847 -3.375 1.00 0.00 N ATOM 425 CA PRO A 29 12.793 -6.435 -3.756 1.00 0.00 C ATOM 426 C PRO A 29 11.901 -7.649 -4.022 1.00 0.00 C ATOM 427 O PRO A 29 12.266 -8.536 -4.793 1.00 0.00 O ATOM 428 CB PRO A 29 12.985 -5.559 -4.983 1.00 0.00 C ATOM 429 CG PRO A 29 14.369 -5.888 -5.518 1.00 0.00 C ATOM 430 CD PRO A 29 15.112 -6.665 -4.444 1.00 0.00 C ATOM 0 HA PRO A 29 12.281 -5.885 -2.966 1.00 0.00 H new ATOM 0 HB2 PRO A 29 12.219 -5.762 -5.731 1.00 0.00 H new ATOM 0 HB3 PRO A 29 12.907 -4.503 -4.725 1.00 0.00 H new ATOM 0 HG2 PRO A 29 14.295 -6.477 -6.432 1.00 0.00 H new ATOM 0 HG3 PRO A 29 14.908 -4.975 -5.770 1.00 0.00 H new ATOM 0 HD2 PRO A 29 15.468 -7.623 -4.823 1.00 0.00 H new ATOM 0 HD3 PRO A 29 15.986 -6.117 -4.092 1.00 0.00 H new ATOM 438 N VAL A 30 10.748 -7.650 -3.370 1.00 0.00 N ATOM 439 CA VAL A 30 9.800 -8.740 -3.527 1.00 0.00 C ATOM 440 C VAL A 30 8.466 -8.183 -4.026 1.00 0.00 C ATOM 441 O VAL A 30 8.179 -7.000 -3.852 1.00 0.00 O ATOM 442 CB VAL A 30 9.671 -9.514 -2.213 1.00 0.00 C ATOM 443 CG1 VAL A 30 8.942 -10.842 -2.428 1.00 0.00 C ATOM 444 CG2 VAL A 30 11.042 -9.738 -1.572 1.00 0.00 C ATOM 0 H VAL A 30 10.449 -6.913 -2.732 1.00 0.00 H new ATOM 0 HA VAL A 30 10.155 -9.450 -4.274 1.00 0.00 H new ATOM 0 HB VAL A 30 9.075 -8.912 -1.527 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.864 -11.372 -1.479 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.943 -10.649 -2.819 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.499 -11.452 -3.139 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.922 -10.290 -0.640 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.673 -10.309 -2.253 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.509 -8.775 -1.366 1.00 0.00 H new ATOM 454 N GLN A 31 7.685 -9.062 -4.637 1.00 0.00 N ATOM 455 CA GLN A 31 6.388 -8.673 -5.163 1.00 0.00 C ATOM 456 C GLN A 31 5.271 -9.162 -4.238 1.00 0.00 C ATOM 457 O GLN A 31 5.251 -10.328 -3.846 1.00 0.00 O ATOM 458 CB GLN A 31 6.192 -9.200 -6.585 1.00 0.00 C ATOM 459 CG GLN A 31 6.735 -8.210 -7.617 1.00 0.00 C ATOM 460 CD GLN A 31 5.823 -8.140 -8.843 1.00 0.00 C ATOM 461 OE1 GLN A 31 5.180 -7.139 -9.114 1.00 0.00 O ATOM 462 NE2 GLN A 31 5.803 -9.255 -9.567 1.00 0.00 N ATOM 0 H GLN A 31 7.926 -10.043 -4.779 1.00 0.00 H new ATOM 0 HA GLN A 31 6.347 -7.585 -5.206 1.00 0.00 H new ATOM 0 HB2 GLN A 31 6.699 -10.159 -6.694 1.00 0.00 H new ATOM 0 HB3 GLN A 31 5.132 -9.377 -6.768 1.00 0.00 H new ATOM 0 HG2 GLN A 31 6.822 -7.221 -7.167 1.00 0.00 H new ATOM 0 HG3 GLN A 31 7.737 -8.510 -7.922 1.00 0.00 H new ATOM 0 HE21 GLN A 31 6.366 -10.057 -9.284 1.00 0.00 H new ATOM 0 HE22 GLN A 31 5.225 -9.308 -10.406 1.00 0.00 H new ATOM 471 N VAL A 32 4.370 -8.247 -3.915 1.00 0.00 N ATOM 472 CA VAL A 32 3.253 -8.571 -3.043 1.00 0.00 C ATOM 473 C VAL A 32 2.289 -9.501 -3.781 1.00 0.00 C ATOM 474 O VAL A 32 2.028 -9.315 -4.969 1.00 0.00 O ATOM 475 CB VAL A 32 2.585 -7.286 -2.550 1.00 0.00 C ATOM 476 CG1 VAL A 32 1.292 -7.597 -1.792 1.00 0.00 C ATOM 477 CG2 VAL A 32 3.544 -6.466 -1.685 1.00 0.00 C ATOM 0 H VAL A 32 4.390 -7.281 -4.241 1.00 0.00 H new ATOM 0 HA VAL A 32 3.601 -9.101 -2.157 1.00 0.00 H new ATOM 0 HB VAL A 32 2.326 -6.687 -3.423 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.837 -6.667 -1.452 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.600 -8.120 -2.452 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.517 -8.226 -0.931 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.044 -5.558 -1.348 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.848 -7.055 -0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 32 4.424 -6.199 -2.270 1.00 0.00 H new ATOM 487 N PRO A 33 1.772 -10.509 -3.028 1.00 0.00 N ATOM 488 CA PRO A 33 0.842 -11.469 -3.598 1.00 0.00 C ATOM 489 C PRO A 33 -0.544 -10.847 -3.780 1.00 0.00 C ATOM 490 O PRO A 33 -1.469 -11.154 -3.029 1.00 0.00 O ATOM 491 CB PRO A 33 0.846 -12.642 -2.632 1.00 0.00 C ATOM 492 CG PRO A 33 1.415 -12.106 -1.328 1.00 0.00 C ATOM 493 CD PRO A 33 2.059 -10.760 -1.619 1.00 0.00 C ATOM 0 HA PRO A 33 1.131 -11.794 -4.597 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -0.161 -13.032 -2.487 1.00 0.00 H new ATOM 0 HB3 PRO A 33 1.453 -13.462 -3.016 1.00 0.00 H new ATOM 0 HG2 PRO A 33 0.627 -11.999 -0.583 1.00 0.00 H new ATOM 0 HG3 PRO A 33 2.149 -12.800 -0.918 1.00 0.00 H new ATOM 0 HD2 PRO A 33 1.644 -9.977 -0.985 1.00 0.00 H new ATOM 0 HD3 PRO A 33 3.133 -10.786 -1.432 1.00 0.00 H new ATOM 501 N TYR A 34 -0.645 -9.986 -4.781 1.00 0.00 N ATOM 502 CA TYR A 34 -1.903 -9.319 -5.071 1.00 0.00 C ATOM 503 C TYR A 34 -3.027 -10.336 -5.281 1.00 0.00 C ATOM 504 O TYR A 34 -4.141 -10.142 -4.798 1.00 0.00 O ATOM 505 CB TYR A 34 -1.680 -8.547 -6.373 1.00 0.00 C ATOM 506 CG TYR A 34 -1.160 -7.122 -6.171 1.00 0.00 C ATOM 507 CD1 TYR A 34 -0.405 -6.815 -5.058 1.00 0.00 C ATOM 508 CD2 TYR A 34 -1.447 -6.144 -7.101 1.00 0.00 C ATOM 509 CE1 TYR A 34 0.085 -5.474 -4.867 1.00 0.00 C ATOM 510 CE2 TYR A 34 -0.958 -4.803 -6.911 1.00 0.00 C ATOM 511 CZ TYR A 34 -0.216 -4.534 -5.803 1.00 0.00 C ATOM 512 OH TYR A 34 0.246 -3.268 -5.623 1.00 0.00 O ATOM 0 H TYR A 34 0.124 -9.734 -5.402 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.193 -8.670 -4.245 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -0.971 -9.097 -6.992 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -2.620 -8.505 -6.924 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.181 -7.580 -4.330 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.039 -6.384 -7.972 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.678 -5.221 -4.000 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -1.175 -4.029 -7.632 1.00 0.00 H new ATOM 0 HH TYR A 34 -0.045 -2.704 -6.370 1.00 0.00 H new ATOM 522 N LYS A 35 -2.695 -11.397 -6.002 1.00 0.00 N ATOM 523 CA LYS A 35 -3.662 -12.444 -6.281 1.00 0.00 C ATOM 524 C LYS A 35 -4.242 -12.961 -4.963 1.00 0.00 C ATOM 525 O LYS A 35 -5.426 -12.776 -4.687 1.00 0.00 O ATOM 526 CB LYS A 35 -3.034 -13.537 -7.147 1.00 0.00 C ATOM 527 CG LYS A 35 -3.882 -13.806 -8.392 1.00 0.00 C ATOM 528 CD LYS A 35 -3.008 -14.256 -9.565 1.00 0.00 C ATOM 529 CE LYS A 35 -3.696 -13.972 -10.901 1.00 0.00 C ATOM 530 NZ LYS A 35 -2.820 -13.156 -11.772 1.00 0.00 N ATOM 0 H LYS A 35 -1.770 -11.554 -6.401 1.00 0.00 H new ATOM 0 HA LYS A 35 -4.494 -12.048 -6.863 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.029 -13.237 -7.445 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -2.934 -14.454 -6.566 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -4.624 -14.573 -8.172 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.428 -12.903 -8.666 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.049 -13.739 -9.528 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -2.798 -15.322 -9.479 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -3.940 -14.911 -11.398 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -4.637 -13.449 -10.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -3.302 -12.972 -12.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.608 -12.253 -11.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -1.933 -13.669 -11.951 1.00 0.00 H new ATOM 544 N ARG A 36 -3.381 -13.600 -4.185 1.00 0.00 N ATOM 545 CA ARG A 36 -3.793 -14.146 -2.903 1.00 0.00 C ATOM 546 C ARG A 36 -4.441 -13.056 -2.046 1.00 0.00 C ATOM 547 O ARG A 36 -5.347 -13.335 -1.263 1.00 0.00 O ATOM 548 CB ARG A 36 -2.602 -14.738 -2.148 1.00 0.00 C ATOM 549 CG ARG A 36 -1.941 -15.856 -2.957 1.00 0.00 C ATOM 550 CD ARG A 36 -2.813 -17.114 -2.968 1.00 0.00 C ATOM 551 NE ARG A 36 -2.023 -18.274 -3.436 1.00 0.00 N ATOM 552 CZ ARG A 36 -2.405 -19.550 -3.293 1.00 0.00 C ATOM 553 NH1 ARG A 36 -3.570 -19.838 -2.696 1.00 0.00 N ATOM 554 NH2 ARG A 36 -1.624 -20.539 -3.748 1.00 0.00 N ATOM 0 H ARG A 36 -2.400 -13.752 -4.418 1.00 0.00 H new ATOM 0 HA ARG A 36 -4.516 -14.939 -3.097 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -1.873 -13.955 -1.940 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -2.934 -15.128 -1.186 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -1.771 -15.518 -3.979 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -0.965 -16.089 -2.532 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -3.200 -17.307 -1.967 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -3.674 -16.964 -3.619 1.00 0.00 H new ATOM 0 HE ARG A 36 -1.131 -18.091 -3.896 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -4.166 -19.086 -2.351 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -3.861 -20.810 -2.587 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -0.738 -20.321 -4.204 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -1.915 -21.510 -3.639 1.00 0.00 H new ATOM 568 N ILE A 37 -3.950 -11.839 -2.223 1.00 0.00 N ATOM 569 CA ILE A 37 -4.469 -10.706 -1.476 1.00 0.00 C ATOM 570 C ILE A 37 -5.874 -10.368 -1.981 1.00 0.00 C ATOM 571 O ILE A 37 -6.698 -9.848 -1.231 1.00 0.00 O ATOM 572 CB ILE A 37 -3.494 -9.529 -1.540 1.00 0.00 C ATOM 573 CG1 ILE A 37 -2.376 -9.687 -0.506 1.00 0.00 C ATOM 574 CG2 ILE A 37 -4.231 -8.197 -1.388 1.00 0.00 C ATOM 575 CD1 ILE A 37 -1.366 -8.543 -0.612 1.00 0.00 C ATOM 0 H ILE A 37 -3.198 -11.612 -2.873 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.561 -10.957 -0.419 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.025 -9.527 -2.524 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -2.803 -9.708 0.497 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.869 -10.640 -0.656 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -3.514 -7.377 -1.437 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -4.960 -8.091 -2.192 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -4.745 -8.173 -0.427 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.582 -8.679 0.133 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.923 -8.540 -1.608 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.872 -7.594 -0.437 1.00 0.00 H new ATOM 587 N LYS A 38 -6.103 -10.678 -3.249 1.00 0.00 N ATOM 588 CA LYS A 38 -7.393 -10.414 -3.862 1.00 0.00 C ATOM 589 C LYS A 38 -8.397 -11.474 -3.405 1.00 0.00 C ATOM 590 O LYS A 38 -9.523 -11.148 -3.032 1.00 0.00 O ATOM 591 CB LYS A 38 -7.253 -10.315 -5.382 1.00 0.00 C ATOM 592 CG LYS A 38 -8.621 -10.156 -6.050 1.00 0.00 C ATOM 593 CD LYS A 38 -9.034 -11.443 -6.767 1.00 0.00 C ATOM 594 CE LYS A 38 -10.394 -11.935 -6.268 1.00 0.00 C ATOM 595 NZ LYS A 38 -10.905 -13.017 -7.140 1.00 0.00 N ATOM 0 H LYS A 38 -5.417 -11.109 -3.868 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.779 -9.448 -3.536 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -6.619 -9.466 -5.638 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -6.759 -11.209 -5.764 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -9.368 -9.898 -5.300 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -8.588 -9.333 -6.763 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -9.079 -11.267 -7.842 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -8.281 -12.214 -6.601 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -10.303 -12.297 -5.244 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -11.103 -11.107 -6.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -11.829 -13.340 -6.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -11.010 -12.660 -8.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -10.235 -13.813 -7.135 1.00 0.00 H new ATOM 609 N SER A 39 -7.953 -12.722 -3.449 1.00 0.00 N ATOM 610 CA SER A 39 -8.798 -13.832 -3.043 1.00 0.00 C ATOM 611 C SER A 39 -9.011 -13.802 -1.528 1.00 0.00 C ATOM 612 O SER A 39 -10.117 -14.045 -1.048 1.00 0.00 O ATOM 613 CB SER A 39 -8.191 -15.170 -3.468 1.00 0.00 C ATOM 614 OG SER A 39 -9.150 -16.017 -4.095 1.00 0.00 O ATOM 0 H SER A 39 -7.019 -12.989 -3.760 1.00 0.00 H new ATOM 0 HA SER A 39 -9.762 -13.727 -3.540 1.00 0.00 H new ATOM 0 HB2 SER A 39 -7.363 -14.991 -4.154 1.00 0.00 H new ATOM 0 HB3 SER A 39 -7.778 -15.674 -2.594 1.00 0.00 H new ATOM 0 HG SER A 39 -8.723 -16.860 -4.353 1.00 0.00 H new ATOM 620 N ASN A 40 -7.934 -13.501 -0.818 1.00 0.00 N ATOM 621 CA ASN A 40 -7.989 -13.436 0.633 1.00 0.00 C ATOM 622 C ASN A 40 -7.599 -12.029 1.091 1.00 0.00 C ATOM 623 O ASN A 40 -6.454 -11.612 0.922 1.00 0.00 O ATOM 624 CB ASN A 40 -7.010 -14.427 1.266 1.00 0.00 C ATOM 625 CG ASN A 40 -7.640 -15.123 2.475 1.00 0.00 C ATOM 626 OD1 ASN A 40 -8.846 -15.135 2.658 1.00 0.00 O ATOM 627 ND2 ASN A 40 -6.758 -15.698 3.287 1.00 0.00 N ATOM 0 H ASN A 40 -7.018 -13.299 -1.220 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.004 -13.683 0.944 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -6.712 -15.171 0.528 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -6.105 -13.903 1.574 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -7.078 -16.187 4.123 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -5.762 -15.650 3.074 1.00 0.00 H new ATOM 634 N PRO A 41 -8.599 -11.318 1.677 1.00 0.00 N ATOM 635 CA PRO A 41 -8.372 -9.966 2.161 1.00 0.00 C ATOM 636 C PRO A 41 -7.570 -9.978 3.464 1.00 0.00 C ATOM 637 O PRO A 41 -6.967 -8.972 3.834 1.00 0.00 O ATOM 638 CB PRO A 41 -9.760 -9.369 2.323 1.00 0.00 C ATOM 639 CG PRO A 41 -10.719 -10.547 2.371 1.00 0.00 C ATOM 640 CD PRO A 41 -9.967 -11.779 1.894 1.00 0.00 C ATOM 0 HA PRO A 41 -7.773 -9.368 1.474 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -9.825 -8.775 3.235 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -9.999 -8.705 1.492 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -11.091 -10.695 3.385 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -11.586 -10.360 1.737 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -10.003 -12.577 2.636 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -10.401 -12.177 0.977 1.00 0.00 H new ATOM 648 N GLY A 42 -7.590 -11.127 4.123 1.00 0.00 N ATOM 649 CA GLY A 42 -6.872 -11.283 5.377 1.00 0.00 C ATOM 650 C GLY A 42 -5.441 -11.767 5.133 1.00 0.00 C ATOM 651 O GLY A 42 -4.954 -12.653 5.833 1.00 0.00 O ATOM 0 H GLY A 42 -8.092 -11.959 3.812 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -6.852 -10.332 5.910 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.397 -11.995 6.015 1.00 0.00 H new ATOM 655 N SER A 43 -4.808 -11.163 4.138 1.00 0.00 N ATOM 656 CA SER A 43 -3.443 -11.522 3.793 1.00 0.00 C ATOM 657 C SER A 43 -2.468 -10.507 4.393 1.00 0.00 C ATOM 658 O SER A 43 -1.818 -10.786 5.399 1.00 0.00 O ATOM 659 CB SER A 43 -3.260 -11.600 2.276 1.00 0.00 C ATOM 660 OG SER A 43 -3.274 -12.945 1.805 1.00 0.00 O ATOM 0 H SER A 43 -5.215 -10.428 3.560 1.00 0.00 H new ATOM 0 HA SER A 43 -3.234 -12.508 4.208 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.053 -11.036 1.786 1.00 0.00 H new ATOM 0 HB3 SER A 43 -2.317 -11.129 2.000 1.00 0.00 H new ATOM 0 HG SER A 43 -3.156 -12.952 0.832 1.00 0.00 H new ATOM 666 N VAL A 44 -2.397 -9.351 3.750 1.00 0.00 N ATOM 667 CA VAL A 44 -1.512 -8.293 4.208 1.00 0.00 C ATOM 668 C VAL A 44 -2.343 -7.059 4.566 1.00 0.00 C ATOM 669 O VAL A 44 -3.132 -6.580 3.754 1.00 0.00 O ATOM 670 CB VAL A 44 -0.445 -8.008 3.149 1.00 0.00 C ATOM 671 CG1 VAL A 44 0.210 -6.646 3.383 1.00 0.00 C ATOM 672 CG2 VAL A 44 0.603 -9.122 3.114 1.00 0.00 C ATOM 0 H VAL A 44 -2.938 -9.123 2.916 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.982 -8.602 5.109 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.937 -7.980 2.177 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.964 -6.469 2.616 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.548 -5.864 3.334 1.00 0.00 H new ATOM 0 HG13 VAL A 44 0.681 -6.633 4.366 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.350 -8.895 2.353 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.088 -9.196 4.087 1.00 0.00 H new ATOM 0 HG23 VAL A 44 0.119 -10.069 2.876 1.00 0.00 H new ATOM 682 N ILE A 45 -2.135 -6.579 5.784 1.00 0.00 N ATOM 683 CA ILE A 45 -2.855 -5.410 6.260 1.00 0.00 C ATOM 684 C ILE A 45 -2.028 -4.155 5.972 1.00 0.00 C ATOM 685 O ILE A 45 -0.828 -4.123 6.242 1.00 0.00 O ATOM 686 CB ILE A 45 -3.230 -5.575 7.734 1.00 0.00 C ATOM 687 CG1 ILE A 45 -3.536 -7.038 8.061 1.00 0.00 C ATOM 688 CG2 ILE A 45 -4.387 -4.648 8.112 1.00 0.00 C ATOM 689 CD1 ILE A 45 -3.882 -7.207 9.542 1.00 0.00 C ATOM 0 H ILE A 45 -1.479 -6.978 6.455 1.00 0.00 H new ATOM 0 HA ILE A 45 -3.799 -5.300 5.726 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.373 -5.283 8.340 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -4.367 -7.385 7.448 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -2.675 -7.658 7.812 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.634 -4.785 9.165 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.095 -3.612 7.940 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -5.258 -4.885 7.501 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -4.095 -8.256 9.748 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -3.039 -6.881 10.152 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.758 -6.604 9.782 1.00 0.00 H new ATOM 701 N ILE A 46 -2.702 -3.152 5.429 1.00 0.00 N ATOM 702 CA ILE A 46 -2.044 -1.898 5.102 1.00 0.00 C ATOM 703 C ILE A 46 -2.658 -0.773 5.937 1.00 0.00 C ATOM 704 O ILE A 46 -3.878 -0.611 5.966 1.00 0.00 O ATOM 705 CB ILE A 46 -2.095 -1.644 3.594 1.00 0.00 C ATOM 706 CG1 ILE A 46 -1.051 -2.488 2.861 1.00 0.00 C ATOM 707 CG2 ILE A 46 -1.947 -0.153 3.285 1.00 0.00 C ATOM 708 CD1 ILE A 46 -1.122 -2.257 1.350 1.00 0.00 C ATOM 0 H ILE A 46 -3.697 -3.182 5.207 1.00 0.00 H new ATOM 0 HA ILE A 46 -0.986 -1.944 5.358 1.00 0.00 H new ATOM 0 HB ILE A 46 -3.074 -1.953 3.227 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.055 -2.237 3.225 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.213 -3.544 3.079 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.987 0.001 2.207 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.758 0.399 3.760 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -0.991 0.205 3.668 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -0.369 -2.869 0.853 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -2.112 -2.532 0.986 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -0.935 -1.205 1.134 1.00 0.00 H new ATOM 720 N GLU A 47 -1.786 -0.024 6.595 1.00 0.00 N ATOM 721 CA GLU A 47 -2.227 1.082 7.428 1.00 0.00 C ATOM 722 C GLU A 47 -1.283 2.276 7.269 1.00 0.00 C ATOM 723 O GLU A 47 -0.174 2.131 6.757 1.00 0.00 O ATOM 724 CB GLU A 47 -2.332 0.657 8.894 1.00 0.00 C ATOM 725 CG GLU A 47 -3.719 0.089 9.202 1.00 0.00 C ATOM 726 CD GLU A 47 -4.588 1.124 9.920 1.00 0.00 C ATOM 727 OE1 GLU A 47 -4.611 2.277 9.438 1.00 0.00 O ATOM 728 OE2 GLU A 47 -5.210 0.738 10.933 1.00 0.00 O ATOM 0 H GLU A 47 -0.776 -0.161 6.568 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.222 1.384 7.100 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.571 -0.092 9.115 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.134 1.513 9.540 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.204 -0.219 8.276 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.622 -0.802 9.822 1.00 0.00 H new ATOM 735 N GLY A 48 -1.758 3.428 7.718 1.00 0.00 N ATOM 736 CA GLY A 48 -0.970 4.646 7.632 1.00 0.00 C ATOM 737 C GLY A 48 -1.279 5.410 6.343 1.00 0.00 C ATOM 738 O GLY A 48 -0.861 6.555 6.180 1.00 0.00 O ATOM 0 H GLY A 48 -2.678 3.544 8.142 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -1.179 5.280 8.494 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.091 4.400 7.667 1.00 0.00 H new ATOM 742 N LEU A 49 -2.007 4.744 5.459 1.00 0.00 N ATOM 743 CA LEU A 49 -2.377 5.345 4.189 1.00 0.00 C ATOM 744 C LEU A 49 -2.954 6.740 4.439 1.00 0.00 C ATOM 745 O LEU A 49 -3.311 7.075 5.567 1.00 0.00 O ATOM 746 CB LEU A 49 -3.316 4.421 3.412 1.00 0.00 C ATOM 747 CG LEU A 49 -2.645 3.425 2.463 1.00 0.00 C ATOM 748 CD1 LEU A 49 -3.652 2.398 1.943 1.00 0.00 C ATOM 749 CD2 LEU A 49 -1.927 4.152 1.324 1.00 0.00 C ATOM 0 H LEU A 49 -2.351 3.794 5.597 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.498 5.472 3.557 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -3.917 3.861 4.128 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -4.003 5.038 2.833 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.888 2.877 3.023 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.149 1.703 1.271 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.077 1.848 2.783 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -4.449 2.910 1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.459 3.422 0.664 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -2.647 4.743 0.758 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.163 4.810 1.737 1.00 0.00 H new ATOM 761 N PRO A 50 -3.031 7.535 3.338 1.00 0.00 N ATOM 762 CA PRO A 50 -3.559 8.886 3.427 1.00 0.00 C ATOM 763 C PRO A 50 -5.082 8.871 3.565 1.00 0.00 C ATOM 764 O PRO A 50 -5.714 7.829 3.397 1.00 0.00 O ATOM 765 CB PRO A 50 -3.084 9.578 2.160 1.00 0.00 C ATOM 766 CG PRO A 50 -2.705 8.466 1.194 1.00 0.00 C ATOM 767 CD PRO A 50 -2.618 7.172 1.986 1.00 0.00 C ATOM 0 HA PRO A 50 -3.207 9.418 4.311 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -3.869 10.208 1.742 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.231 10.225 2.365 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.448 8.379 0.401 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -1.751 8.685 0.715 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -3.270 6.406 1.565 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.605 6.769 1.976 1.00 0.00 H new ATOM 775 N PRO A 51 -5.643 10.070 3.877 1.00 0.00 N ATOM 776 CA PRO A 51 -7.081 10.205 4.039 1.00 0.00 C ATOM 777 C PRO A 51 -7.790 10.187 2.683 1.00 0.00 C ATOM 778 O PRO A 51 -7.484 10.997 1.808 1.00 0.00 O ATOM 779 CB PRO A 51 -7.271 11.512 4.792 1.00 0.00 C ATOM 780 CG PRO A 51 -5.976 12.287 4.615 1.00 0.00 C ATOM 781 CD PRO A 51 -4.926 11.325 4.082 1.00 0.00 C ATOM 0 HA PRO A 51 -7.522 9.375 4.591 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.118 12.072 4.396 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -7.475 11.329 5.847 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -6.119 13.117 3.923 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -5.655 12.715 5.564 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -4.491 11.689 3.151 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.106 11.202 4.790 1.00 0.00 H new ATOM 789 N GLY A 52 -8.722 9.256 2.551 1.00 0.00 N ATOM 790 CA GLY A 52 -9.477 9.122 1.316 1.00 0.00 C ATOM 791 C GLY A 52 -8.931 7.976 0.461 1.00 0.00 C ATOM 792 O GLY A 52 -9.524 7.619 -0.555 1.00 0.00 O ATOM 0 H GLY A 52 -8.972 8.586 3.279 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.527 8.941 1.545 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.430 10.055 0.754 1.00 0.00 H new ATOM 796 N ILE A 53 -7.807 7.433 0.905 1.00 0.00 N ATOM 797 CA ILE A 53 -7.175 6.335 0.194 1.00 0.00 C ATOM 798 C ILE A 53 -7.091 5.117 1.115 1.00 0.00 C ATOM 799 O ILE A 53 -6.202 5.034 1.961 1.00 0.00 O ATOM 800 CB ILE A 53 -5.822 6.773 -0.373 1.00 0.00 C ATOM 801 CG1 ILE A 53 -5.930 8.135 -1.060 1.00 0.00 C ATOM 802 CG2 ILE A 53 -5.247 5.704 -1.305 1.00 0.00 C ATOM 803 CD1 ILE A 53 -4.572 8.585 -1.601 1.00 0.00 C ATOM 0 H ILE A 53 -7.318 7.733 1.748 1.00 0.00 H new ATOM 0 HA ILE A 53 -7.776 6.042 -0.667 1.00 0.00 H new ATOM 0 HB ILE A 53 -5.124 6.886 0.457 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -6.650 8.078 -1.876 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -6.307 8.874 -0.353 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -4.286 6.040 -1.694 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -5.110 4.775 -0.752 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -5.935 5.535 -2.133 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.677 9.556 -2.085 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -3.861 8.664 -0.779 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.209 7.856 -2.326 1.00 0.00 H new ATOM 815 N PRO A 54 -8.053 4.177 0.914 1.00 0.00 N ATOM 816 CA PRO A 54 -8.096 2.966 1.717 1.00 0.00 C ATOM 817 C PRO A 54 -7.000 1.986 1.291 1.00 0.00 C ATOM 818 O PRO A 54 -6.261 2.250 0.344 1.00 0.00 O ATOM 819 CB PRO A 54 -9.497 2.413 1.520 1.00 0.00 C ATOM 820 CG PRO A 54 -10.032 3.071 0.258 1.00 0.00 C ATOM 821 CD PRO A 54 -9.121 4.241 -0.079 1.00 0.00 C ATOM 0 HA PRO A 54 -7.902 3.154 2.773 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -9.478 1.328 1.416 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -10.131 2.640 2.377 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -10.056 2.356 -0.565 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.055 3.415 0.411 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -8.726 4.157 -1.091 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -9.657 5.189 -0.024 1.00 0.00 H new ATOM 829 N PHE A 55 -6.932 0.876 2.010 1.00 0.00 N ATOM 830 CA PHE A 55 -5.939 -0.144 1.718 1.00 0.00 C ATOM 831 C PHE A 55 -6.378 -1.014 0.538 1.00 0.00 C ATOM 832 O PHE A 55 -7.052 -2.026 0.725 1.00 0.00 O ATOM 833 CB PHE A 55 -5.820 -1.022 2.966 1.00 0.00 C ATOM 834 CG PHE A 55 -5.406 -2.465 2.675 1.00 0.00 C ATOM 835 CD1 PHE A 55 -4.573 -2.737 1.634 1.00 0.00 C ATOM 836 CD2 PHE A 55 -5.870 -3.477 3.456 1.00 0.00 C ATOM 837 CE1 PHE A 55 -4.189 -4.077 1.363 1.00 0.00 C ATOM 838 CE2 PHE A 55 -5.486 -4.817 3.185 1.00 0.00 C ATOM 839 CZ PHE A 55 -4.654 -5.089 2.144 1.00 0.00 C ATOM 0 H PHE A 55 -7.548 0.660 2.794 1.00 0.00 H new ATOM 0 HA PHE A 55 -4.990 0.324 1.457 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -5.092 -0.576 3.643 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -6.778 -1.028 3.486 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -4.204 -1.934 1.014 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -6.531 -3.261 4.283 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -3.528 -4.293 0.537 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -5.855 -5.620 3.806 1.00 0.00 H new ATOM 0 HZ PHE A 55 -4.363 -6.108 1.938 1.00 0.00 H new ATOM 849 N ARG A 56 -5.977 -0.588 -0.650 1.00 0.00 N ATOM 850 CA ARG A 56 -6.320 -1.315 -1.861 1.00 0.00 C ATOM 851 C ARG A 56 -5.253 -1.092 -2.934 1.00 0.00 C ATOM 852 O ARG A 56 -4.290 -0.358 -2.715 1.00 0.00 O ATOM 853 CB ARG A 56 -7.680 -0.871 -2.403 1.00 0.00 C ATOM 854 CG ARG A 56 -8.803 -1.231 -1.429 1.00 0.00 C ATOM 855 CD ARG A 56 -9.010 -2.746 -1.366 1.00 0.00 C ATOM 856 NE ARG A 56 -10.454 -3.055 -1.267 1.00 0.00 N ATOM 857 CZ ARG A 56 -11.362 -2.710 -2.190 1.00 0.00 C ATOM 858 NH1 ARG A 56 -10.981 -2.041 -3.287 1.00 0.00 N ATOM 859 NH2 ARG A 56 -12.651 -3.033 -2.016 1.00 0.00 N ATOM 0 H ARG A 56 -5.418 0.252 -0.801 1.00 0.00 H new ATOM 0 HA ARG A 56 -6.370 -2.374 -1.609 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.673 0.205 -2.574 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.864 -1.346 -3.367 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.563 -0.852 -0.436 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -9.728 -0.747 -1.740 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.589 -3.216 -2.255 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -8.482 -3.158 -0.506 1.00 0.00 H new ATOM 0 HE ARG A 56 -10.779 -3.563 -0.444 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -10.000 -1.795 -3.419 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.672 -1.778 -3.990 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -12.941 -3.542 -1.181 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -13.342 -2.770 -2.719 1.00 0.00 H new ATOM 873 N LYS A 57 -5.459 -1.739 -4.072 1.00 0.00 N ATOM 874 CA LYS A 57 -4.526 -1.621 -5.180 1.00 0.00 C ATOM 875 C LYS A 57 -4.491 -0.168 -5.658 1.00 0.00 C ATOM 876 O LYS A 57 -5.473 0.559 -5.520 1.00 0.00 O ATOM 877 CB LYS A 57 -4.875 -2.623 -6.283 1.00 0.00 C ATOM 878 CG LYS A 57 -4.340 -4.016 -5.947 1.00 0.00 C ATOM 879 CD LYS A 57 -5.485 -4.982 -5.632 1.00 0.00 C ATOM 880 CE LYS A 57 -5.967 -5.692 -6.898 1.00 0.00 C ATOM 881 NZ LYS A 57 -7.179 -6.492 -6.614 1.00 0.00 N ATOM 0 H LYS A 57 -6.258 -2.347 -4.251 1.00 0.00 H new ATOM 0 HA LYS A 57 -3.516 -1.876 -4.857 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.957 -2.666 -6.411 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -4.455 -2.287 -7.231 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -3.758 -4.398 -6.786 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -3.666 -3.954 -5.093 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -5.153 -5.719 -4.901 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -6.313 -4.436 -5.180 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -6.182 -4.958 -7.674 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -5.178 -6.339 -7.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -7.493 -6.967 -7.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -6.962 -7.205 -5.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -7.935 -5.866 -6.269 1.00 0.00 H new ATOM 895 N PRO A 58 -3.317 0.222 -6.224 1.00 0.00 N ATOM 896 CA PRO A 58 -3.140 1.575 -6.723 1.00 0.00 C ATOM 897 C PRO A 58 -3.884 1.773 -8.045 1.00 0.00 C ATOM 898 O PRO A 58 -4.093 2.905 -8.480 1.00 0.00 O ATOM 899 CB PRO A 58 -1.636 1.752 -6.855 1.00 0.00 C ATOM 900 CG PRO A 58 -1.051 0.349 -6.871 1.00 0.00 C ATOM 901 CD PRO A 58 -2.132 -0.612 -6.403 1.00 0.00 C ATOM 0 HA PRO A 58 -3.559 2.328 -6.055 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -1.385 2.290 -7.769 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -1.237 2.332 -6.023 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -0.715 0.087 -7.874 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -0.180 0.291 -6.218 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.308 -1.398 -7.137 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -1.849 -1.103 -5.472 1.00 0.00 H new ATOM 909 N CYS A 59 -4.263 0.656 -8.647 1.00 0.00 N ATOM 910 CA CYS A 59 -4.980 0.692 -9.911 1.00 0.00 C ATOM 911 C CYS A 59 -6.347 1.334 -9.670 1.00 0.00 C ATOM 912 O CYS A 59 -6.879 2.018 -10.543 1.00 0.00 O ATOM 913 CB CYS A 59 -5.104 -0.701 -10.532 1.00 0.00 C ATOM 914 SG CYS A 59 -6.153 -1.765 -9.475 1.00 0.00 S ATOM 0 H CYS A 59 -4.087 -0.281 -8.283 1.00 0.00 H new ATOM 0 HA CYS A 59 -4.421 1.290 -10.631 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -5.536 -0.626 -11.530 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -4.116 -1.147 -10.645 1.00 0.00 H new ATOM 0 HG CYS A 59 -6.254 -2.945 -10.012 1.00 0.00 H new ATOM 920 N THR A 60 -6.878 1.091 -8.480 1.00 0.00 N ATOM 921 CA THR A 60 -8.173 1.636 -8.113 1.00 0.00 C ATOM 922 C THR A 60 -8.038 3.104 -7.704 1.00 0.00 C ATOM 923 O THR A 60 -9.031 3.761 -7.397 1.00 0.00 O ATOM 924 CB THR A 60 -8.764 0.752 -7.013 1.00 0.00 C ATOM 925 OG1 THR A 60 -7.889 0.944 -5.905 1.00 0.00 O ATOM 926 CG2 THR A 60 -8.640 -0.740 -7.331 1.00 0.00 C ATOM 0 H THR A 60 -6.434 0.524 -7.758 1.00 0.00 H new ATOM 0 HA THR A 60 -8.859 1.629 -8.960 1.00 0.00 H new ATOM 0 HB THR A 60 -9.814 1.007 -6.868 1.00 0.00 H new ATOM 0 HG1 THR A 60 -7.111 0.356 -5.997 1.00 0.00 H new ATOM 0 HG21 THR A 60 -9.075 -1.323 -6.519 1.00 0.00 H new ATOM 0 HG22 THR A 60 -9.169 -0.960 -8.258 1.00 0.00 H new ATOM 0 HG23 THR A 60 -7.588 -1.002 -7.443 1.00 0.00 H new ATOM 934 N PHE A 61 -6.799 3.576 -7.713 1.00 0.00 N ATOM 935 CA PHE A 61 -6.521 4.954 -7.348 1.00 0.00 C ATOM 936 C PHE A 61 -6.050 5.759 -8.561 1.00 0.00 C ATOM 937 O PHE A 61 -5.499 5.197 -9.507 1.00 0.00 O ATOM 938 CB PHE A 61 -5.401 4.923 -6.305 1.00 0.00 C ATOM 939 CG PHE A 61 -5.710 4.052 -5.086 1.00 0.00 C ATOM 940 CD1 PHE A 61 -7.000 3.766 -4.764 1.00 0.00 C ATOM 941 CD2 PHE A 61 -4.695 3.564 -4.324 1.00 0.00 C ATOM 942 CE1 PHE A 61 -7.287 2.958 -3.632 1.00 0.00 C ATOM 943 CE2 PHE A 61 -4.982 2.756 -3.192 1.00 0.00 C ATOM 944 CZ PHE A 61 -6.272 2.470 -2.870 1.00 0.00 C ATOM 0 H PHE A 61 -5.977 3.028 -7.967 1.00 0.00 H new ATOM 0 HA PHE A 61 -7.424 5.426 -6.962 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.489 4.559 -6.777 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.202 5.941 -5.970 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -7.806 4.153 -5.369 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -3.671 3.791 -4.580 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -8.311 2.731 -3.376 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.176 2.369 -2.587 1.00 0.00 H new ATOM 0 HZ PHE A 61 -6.490 1.855 -2.009 1.00 0.00 H new ATOM 954 N GLY A 62 -6.283 7.061 -8.493 1.00 0.00 N ATOM 955 CA GLY A 62 -5.890 7.949 -9.574 1.00 0.00 C ATOM 956 C GLY A 62 -4.565 8.646 -9.257 1.00 0.00 C ATOM 957 O GLY A 62 -4.124 8.656 -8.109 1.00 0.00 O ATOM 0 H GLY A 62 -6.739 7.523 -7.706 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -5.794 7.381 -10.499 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -6.668 8.695 -9.737 1.00 0.00 H new ATOM 961 N SER A 63 -3.967 9.212 -10.295 1.00 0.00 N ATOM 962 CA SER A 63 -2.702 9.910 -10.141 1.00 0.00 C ATOM 963 C SER A 63 -2.713 10.734 -8.852 1.00 0.00 C ATOM 964 O SER A 63 -1.764 10.682 -8.071 1.00 0.00 O ATOM 965 CB SER A 63 -2.420 10.811 -11.345 1.00 0.00 C ATOM 966 OG SER A 63 -3.541 11.627 -11.675 1.00 0.00 O ATOM 0 H SER A 63 -4.335 9.201 -11.246 1.00 0.00 H new ATOM 0 HA SER A 63 -1.906 9.167 -10.083 1.00 0.00 H new ATOM 0 HB2 SER A 63 -1.560 11.446 -11.129 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.154 10.195 -12.204 1.00 0.00 H new ATOM 0 HG SER A 63 -3.321 12.189 -12.447 1.00 0.00 H new ATOM 972 N GLN A 64 -3.795 11.476 -8.670 1.00 0.00 N ATOM 973 CA GLN A 64 -3.941 12.310 -7.489 1.00 0.00 C ATOM 974 C GLN A 64 -3.749 11.474 -6.222 1.00 0.00 C ATOM 975 O GLN A 64 -2.860 11.754 -5.419 1.00 0.00 O ATOM 976 CB GLN A 64 -5.300 13.014 -7.480 1.00 0.00 C ATOM 977 CG GLN A 64 -5.311 14.195 -8.454 1.00 0.00 C ATOM 978 CD GLN A 64 -5.854 15.456 -7.779 1.00 0.00 C ATOM 979 OE1 GLN A 64 -7.041 15.738 -7.794 1.00 0.00 O ATOM 980 NE2 GLN A 64 -4.921 16.197 -7.187 1.00 0.00 N ATOM 0 H GLN A 64 -4.579 11.517 -9.321 1.00 0.00 H new ATOM 0 HA GLN A 64 -3.170 13.080 -7.514 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.083 12.306 -7.752 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.525 13.366 -6.473 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -4.301 14.380 -8.819 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -5.923 13.950 -9.322 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.945 15.903 -7.212 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -5.182 17.059 -6.708 1.00 0.00 H new ATOM 989 N ASN A 65 -4.596 10.464 -6.083 1.00 0.00 N ATOM 990 CA ASN A 65 -4.529 9.586 -4.927 1.00 0.00 C ATOM 991 C ASN A 65 -3.095 9.081 -4.757 1.00 0.00 C ATOM 992 O ASN A 65 -2.560 9.083 -3.649 1.00 0.00 O ATOM 993 CB ASN A 65 -5.441 8.370 -5.107 1.00 0.00 C ATOM 994 CG ASN A 65 -6.838 8.645 -4.548 1.00 0.00 C ATOM 995 OD1 ASN A 65 -7.223 9.775 -4.297 1.00 0.00 O ATOM 996 ND2 ASN A 65 -7.573 7.551 -4.368 1.00 0.00 N ATOM 0 H ASN A 65 -5.332 10.234 -6.751 1.00 0.00 H new ATOM 0 HA ASN A 65 -4.851 10.153 -4.053 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -5.512 8.118 -6.165 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -5.007 7.507 -4.602 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -8.521 7.628 -3.999 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.189 6.635 -4.599 1.00 0.00 H new ATOM 1003 N LEU A 66 -2.513 8.662 -5.871 1.00 0.00 N ATOM 1004 CA LEU A 66 -1.151 8.155 -5.859 1.00 0.00 C ATOM 1005 C LEU A 66 -0.224 9.213 -5.257 1.00 0.00 C ATOM 1006 O LEU A 66 0.415 8.973 -4.234 1.00 0.00 O ATOM 1007 CB LEU A 66 -0.737 7.700 -7.259 1.00 0.00 C ATOM 1008 CG LEU A 66 -1.641 6.657 -7.920 1.00 0.00 C ATOM 1009 CD1 LEU A 66 -1.280 6.475 -9.396 1.00 0.00 C ATOM 1010 CD2 LEU A 66 -1.603 5.334 -7.154 1.00 0.00 C ATOM 0 H LEU A 66 -2.960 8.663 -6.788 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.079 7.270 -5.227 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.693 8.576 -7.906 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.273 7.294 -7.204 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.667 7.022 -7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.937 5.729 -9.842 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.400 7.423 -9.920 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.245 6.143 -9.479 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.254 4.611 -7.645 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.582 4.952 -7.138 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.946 5.495 -6.132 1.00 0.00 H new ATOM 1022 N GLU A 67 -0.180 10.361 -5.917 1.00 0.00 N ATOM 1023 CA GLU A 67 0.659 11.456 -5.460 1.00 0.00 C ATOM 1024 C GLU A 67 0.656 11.524 -3.932 1.00 0.00 C ATOM 1025 O GLU A 67 1.657 11.896 -3.321 1.00 0.00 O ATOM 1026 CB GLU A 67 0.206 12.784 -6.069 1.00 0.00 C ATOM 1027 CG GLU A 67 1.164 13.236 -7.173 1.00 0.00 C ATOM 1028 CD GLU A 67 1.401 14.746 -7.108 1.00 0.00 C ATOM 1029 OE1 GLU A 67 0.391 15.481 -7.133 1.00 0.00 O ATOM 1030 OE2 GLU A 67 2.588 15.132 -7.036 1.00 0.00 O ATOM 0 H GLU A 67 -0.712 10.557 -6.765 1.00 0.00 H new ATOM 0 HA GLU A 67 1.680 11.270 -5.794 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.799 12.677 -6.476 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.156 13.546 -5.292 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.114 12.710 -7.073 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.754 12.970 -8.147 1.00 0.00 H new ATOM 1037 N ARG A 68 -0.480 11.158 -3.357 1.00 0.00 N ATOM 1038 CA ARG A 68 -0.626 11.173 -1.911 1.00 0.00 C ATOM 1039 C ARG A 68 0.074 9.961 -1.294 1.00 0.00 C ATOM 1040 O ARG A 68 0.926 10.110 -0.419 1.00 0.00 O ATOM 1041 CB ARG A 68 -2.102 11.161 -1.507 1.00 0.00 C ATOM 1042 CG ARG A 68 -2.871 12.285 -2.203 1.00 0.00 C ATOM 1043 CD ARG A 68 -4.370 12.186 -1.914 1.00 0.00 C ATOM 1044 NE ARG A 68 -5.055 13.419 -2.360 1.00 0.00 N ATOM 1045 CZ ARG A 68 -6.333 13.711 -2.084 1.00 0.00 C ATOM 1046 NH1 ARG A 68 -7.073 12.860 -1.361 1.00 0.00 N ATOM 1047 NH2 ARG A 68 -6.871 14.854 -2.531 1.00 0.00 N ATOM 0 H ARG A 68 -1.308 10.849 -3.866 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.167 12.089 -1.541 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -2.545 10.199 -1.764 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.188 11.272 -0.426 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -2.495 13.251 -1.865 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.700 12.235 -3.278 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -4.791 11.321 -2.426 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.534 12.035 -0.847 1.00 0.00 H new ATOM 0 HE ARG A 68 -4.520 14.089 -2.913 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.663 11.990 -1.021 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -8.046 13.082 -1.151 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -6.307 15.502 -3.082 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -7.844 15.076 -2.321 1.00 0.00 H new ATOM 1061 N ILE A 69 -0.309 8.787 -1.775 1.00 0.00 N ATOM 1062 CA ILE A 69 0.272 7.550 -1.282 1.00 0.00 C ATOM 1063 C ILE A 69 1.790 7.711 -1.177 1.00 0.00 C ATOM 1064 O ILE A 69 2.352 7.636 -0.086 1.00 0.00 O ATOM 1065 CB ILE A 69 -0.163 6.370 -2.152 1.00 0.00 C ATOM 1066 CG1 ILE A 69 -1.615 5.982 -1.865 1.00 0.00 C ATOM 1067 CG2 ILE A 69 0.790 5.185 -1.986 1.00 0.00 C ATOM 1068 CD1 ILE A 69 -2.360 5.646 -3.159 1.00 0.00 C ATOM 0 H ILE A 69 -1.015 8.667 -2.501 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.095 7.329 -0.280 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.113 6.680 -3.196 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -1.640 5.124 -1.194 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -2.120 6.801 -1.353 1.00 0.00 H new ATOM 0 HG21 ILE A 69 0.457 4.360 -2.616 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.796 5.483 -2.280 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.796 4.866 -0.944 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -3.389 5.374 -2.926 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -2.355 6.514 -3.818 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -1.867 4.810 -3.656 1.00 0.00 H new ATOM 1080 N LEU A 70 2.410 7.929 -2.328 1.00 0.00 N ATOM 1081 CA LEU A 70 3.852 8.101 -2.379 1.00 0.00 C ATOM 1082 C LEU A 70 4.273 9.154 -1.352 1.00 0.00 C ATOM 1083 O LEU A 70 5.408 9.145 -0.878 1.00 0.00 O ATOM 1084 CB LEU A 70 4.303 8.418 -3.806 1.00 0.00 C ATOM 1085 CG LEU A 70 3.871 7.422 -4.884 1.00 0.00 C ATOM 1086 CD1 LEU A 70 4.166 7.965 -6.283 1.00 0.00 C ATOM 1087 CD2 LEU A 70 4.512 6.052 -4.654 1.00 0.00 C ATOM 0 H LEU A 70 1.940 7.990 -3.231 1.00 0.00 H new ATOM 0 HA LEU A 70 4.356 7.173 -2.109 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.922 9.403 -4.076 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.391 8.484 -3.816 1.00 0.00 H new ATOM 0 HG LEU A 70 2.792 7.289 -4.812 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.849 7.237 -7.030 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.624 8.898 -6.433 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.236 8.147 -6.385 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.188 5.363 -5.434 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.597 6.149 -4.683 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.208 5.667 -3.681 1.00 0.00 H new ATOM 1099 N ALA A 71 3.336 10.037 -1.040 1.00 0.00 N ATOM 1100 CA ALA A 71 3.595 11.095 -0.078 1.00 0.00 C ATOM 1101 C ALA A 71 3.708 10.489 1.322 1.00 0.00 C ATOM 1102 O ALA A 71 4.693 10.717 2.024 1.00 0.00 O ATOM 1103 CB ALA A 71 2.491 12.150 -0.169 1.00 0.00 C ATOM 0 H ALA A 71 2.396 10.042 -1.436 1.00 0.00 H new ATOM 0 HA ALA A 71 4.540 11.592 -0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 71 2.686 12.943 0.553 1.00 0.00 H new ATOM 0 HB2 ALA A 71 2.472 12.571 -1.174 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.528 11.689 0.050 1.00 0.00 H new ATOM 1109 N VAL A 72 2.687 9.728 1.687 1.00 0.00 N ATOM 1110 CA VAL A 72 2.659 9.087 2.991 1.00 0.00 C ATOM 1111 C VAL A 72 3.240 7.677 2.874 1.00 0.00 C ATOM 1112 O VAL A 72 2.995 6.828 3.729 1.00 0.00 O ATOM 1113 CB VAL A 72 1.236 9.103 3.552 1.00 0.00 C ATOM 1114 CG1 VAL A 72 0.787 10.531 3.868 1.00 0.00 C ATOM 1115 CG2 VAL A 72 0.260 8.422 2.590 1.00 0.00 C ATOM 0 H VAL A 72 1.872 9.541 1.102 1.00 0.00 H new ATOM 0 HA VAL A 72 3.279 9.636 3.700 1.00 0.00 H new ATOM 0 HB VAL A 72 1.237 8.538 4.484 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -0.228 10.514 4.265 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.459 10.968 4.607 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.810 11.130 2.957 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -0.744 8.447 3.013 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.265 8.947 1.635 1.00 0.00 H new ATOM 0 HG23 VAL A 72 0.563 7.386 2.437 1.00 0.00 H new ATOM 1125 N ALA A 73 3.999 7.470 1.807 1.00 0.00 N ATOM 1126 CA ALA A 73 4.616 6.177 1.567 1.00 0.00 C ATOM 1127 C ALA A 73 5.318 5.707 2.843 1.00 0.00 C ATOM 1128 O ALA A 73 5.449 4.507 3.077 1.00 0.00 O ATOM 1129 CB ALA A 73 5.575 6.282 0.379 1.00 0.00 C ATOM 0 H ALA A 73 4.200 8.176 1.099 1.00 0.00 H new ATOM 0 HA ALA A 73 3.861 5.433 1.313 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.038 5.312 0.199 1.00 0.00 H new ATOM 0 HB2 ALA A 73 5.023 6.591 -0.508 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.348 7.018 0.600 1.00 0.00 H new ATOM 1135 N ASP A 74 5.749 6.678 3.635 1.00 0.00 N ATOM 1136 CA ASP A 74 6.434 6.378 4.881 1.00 0.00 C ATOM 1137 C ASP A 74 5.414 5.895 5.914 1.00 0.00 C ATOM 1138 O ASP A 74 5.696 4.983 6.691 1.00 0.00 O ATOM 1139 CB ASP A 74 7.124 7.622 5.443 1.00 0.00 C ATOM 1140 CG ASP A 74 8.629 7.478 5.676 1.00 0.00 C ATOM 1141 OD1 ASP A 74 9.365 7.516 4.666 1.00 0.00 O ATOM 1142 OD2 ASP A 74 9.010 7.332 6.857 1.00 0.00 O ATOM 0 H ASP A 74 5.637 7.673 3.438 1.00 0.00 H new ATOM 0 HA ASP A 74 7.182 5.611 4.679 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.956 8.453 4.758 1.00 0.00 H new ATOM 0 HB3 ASP A 74 6.649 7.887 6.388 1.00 0.00 H new ATOM 1147 N LYS A 75 4.250 6.528 5.891 1.00 0.00 N ATOM 1148 CA LYS A 75 3.187 6.174 6.816 1.00 0.00 C ATOM 1149 C LYS A 75 2.722 4.745 6.529 1.00 0.00 C ATOM 1150 O LYS A 75 2.632 3.923 7.440 1.00 0.00 O ATOM 1151 CB LYS A 75 2.063 7.209 6.762 1.00 0.00 C ATOM 1152 CG LYS A 75 2.619 8.630 6.873 1.00 0.00 C ATOM 1153 CD LYS A 75 2.181 9.290 8.181 1.00 0.00 C ATOM 1154 CE LYS A 75 2.392 10.805 8.129 1.00 0.00 C ATOM 1155 NZ LYS A 75 2.356 11.380 9.493 1.00 0.00 N ATOM 0 H LYS A 75 4.020 7.284 5.246 1.00 0.00 H new ATOM 0 HA LYS A 75 3.554 6.190 7.842 1.00 0.00 H new ATOM 0 HB2 LYS A 75 1.511 7.103 5.828 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.357 7.027 7.572 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.707 8.603 6.822 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.275 9.226 6.028 1.00 0.00 H new ATOM 0 HD2 LYS A 75 1.130 9.072 8.368 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.747 8.869 9.012 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.349 11.029 7.659 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.619 11.265 7.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.501 12.409 9.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.433 11.182 9.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.109 10.954 10.069 1.00 0.00 H new ATOM 1169 N ILE A 76 2.439 4.492 5.260 1.00 0.00 N ATOM 1170 CA ILE A 76 1.985 3.177 4.841 1.00 0.00 C ATOM 1171 C ILE A 76 2.786 2.106 5.585 1.00 0.00 C ATOM 1172 O ILE A 76 4.016 2.123 5.570 1.00 0.00 O ATOM 1173 CB ILE A 76 2.051 3.047 3.318 1.00 0.00 C ATOM 1174 CG1 ILE A 76 0.981 3.911 2.648 1.00 0.00 C ATOM 1175 CG2 ILE A 76 1.956 1.581 2.889 1.00 0.00 C ATOM 1176 CD1 ILE A 76 1.372 4.249 1.208 1.00 0.00 C ATOM 0 H ILE A 76 2.515 5.176 4.507 1.00 0.00 H new ATOM 0 HA ILE A 76 0.937 3.034 5.104 1.00 0.00 H new ATOM 0 HB ILE A 76 3.020 3.418 2.984 1.00 0.00 H new ATOM 0 HG12 ILE A 76 0.026 3.385 2.655 1.00 0.00 H new ATOM 0 HG13 ILE A 76 0.843 4.831 3.216 1.00 0.00 H new ATOM 0 HG21 ILE A 76 2.005 1.516 1.802 1.00 0.00 H new ATOM 0 HG22 ILE A 76 2.783 1.020 3.324 1.00 0.00 H new ATOM 0 HG23 ILE A 76 1.012 1.161 3.235 1.00 0.00 H new ATOM 0 HD11 ILE A 76 0.594 4.864 0.755 1.00 0.00 H new ATOM 0 HD12 ILE A 76 2.315 4.796 1.206 1.00 0.00 H new ATOM 0 HD13 ILE A 76 1.486 3.328 0.636 1.00 0.00 H new ATOM 1188 N LYS A 77 2.056 1.199 6.218 1.00 0.00 N ATOM 1189 CA LYS A 77 2.682 0.122 6.965 1.00 0.00 C ATOM 1190 C LYS A 77 1.951 -1.189 6.672 1.00 0.00 C ATOM 1191 O LYS A 77 0.759 -1.315 6.950 1.00 0.00 O ATOM 1192 CB LYS A 77 2.747 0.471 8.454 1.00 0.00 C ATOM 1193 CG LYS A 77 3.377 -0.669 9.257 1.00 0.00 C ATOM 1194 CD LYS A 77 3.170 -0.462 10.758 1.00 0.00 C ATOM 1195 CE LYS A 77 3.869 -1.558 11.565 1.00 0.00 C ATOM 1196 NZ LYS A 77 4.909 -0.973 12.441 1.00 0.00 N ATOM 0 H LYS A 77 1.036 1.188 6.229 1.00 0.00 H new ATOM 0 HA LYS A 77 3.716 -0.012 6.647 1.00 0.00 H new ATOM 0 HB2 LYS A 77 3.328 1.383 8.593 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.743 0.673 8.828 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.937 -1.619 8.953 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.443 -0.727 9.038 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.558 0.514 11.051 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.104 -0.462 10.985 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.138 -2.096 12.168 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.321 -2.284 10.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.374 -1.730 12.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 5.616 -0.479 11.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 4.469 -0.298 13.099 1.00 0.00 H new ATOM 1210 N PHE A 78 2.695 -2.133 6.115 1.00 0.00 N ATOM 1211 CA PHE A 78 2.132 -3.430 5.782 1.00 0.00 C ATOM 1212 C PHE A 78 2.278 -4.408 6.950 1.00 0.00 C ATOM 1213 O PHE A 78 3.203 -4.289 7.752 1.00 0.00 O ATOM 1214 CB PHE A 78 2.920 -3.965 4.584 1.00 0.00 C ATOM 1215 CG PHE A 78 2.444 -3.422 3.234 1.00 0.00 C ATOM 1216 CD1 PHE A 78 2.276 -2.084 3.061 1.00 0.00 C ATOM 1217 CD2 PHE A 78 2.189 -4.278 2.209 1.00 0.00 C ATOM 1218 CE1 PHE A 78 1.834 -1.581 1.809 1.00 0.00 C ATOM 1219 CE2 PHE A 78 1.748 -3.775 0.957 1.00 0.00 C ATOM 1220 CZ PHE A 78 1.579 -2.437 0.783 1.00 0.00 C ATOM 0 H PHE A 78 3.683 -2.025 5.886 1.00 0.00 H new ATOM 0 HA PHE A 78 1.070 -3.328 5.559 1.00 0.00 H new ATOM 0 HB2 PHE A 78 3.973 -3.715 4.714 1.00 0.00 H new ATOM 0 HB3 PHE A 78 2.850 -5.053 4.572 1.00 0.00 H new ATOM 0 HD1 PHE A 78 2.479 -1.404 3.875 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.322 -5.341 2.347 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.700 -0.518 1.671 1.00 0.00 H new ATOM 0 HE2 PHE A 78 1.547 -4.455 0.143 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.243 -2.054 -0.169 1.00 0.00 H new ATOM 1230 N THR A 79 1.351 -5.353 7.008 1.00 0.00 N ATOM 1231 CA THR A 79 1.364 -6.350 8.065 1.00 0.00 C ATOM 1232 C THR A 79 1.241 -7.755 7.473 1.00 0.00 C ATOM 1233 O THR A 79 0.246 -8.074 6.823 1.00 0.00 O ATOM 1234 CB THR A 79 0.248 -6.007 9.053 1.00 0.00 C ATOM 1235 OG1 THR A 79 0.313 -4.588 9.171 1.00 0.00 O ATOM 1236 CG2 THR A 79 0.543 -6.511 10.468 1.00 0.00 C ATOM 0 H THR A 79 0.586 -5.449 6.340 1.00 0.00 H new ATOM 0 HA THR A 79 2.310 -6.341 8.606 1.00 0.00 H new ATOM 0 HB THR A 79 -0.691 -6.436 8.703 1.00 0.00 H new ATOM 0 HG1 THR A 79 -0.379 -4.279 9.793 1.00 0.00 H new ATOM 0 HG21 THR A 79 -0.280 -6.241 11.129 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.655 -7.595 10.452 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.464 -6.056 10.832 1.00 0.00 H new ATOM 1244 N VAL A 80 2.266 -8.558 7.718 1.00 0.00 N ATOM 1245 CA VAL A 80 2.284 -9.922 7.218 1.00 0.00 C ATOM 1246 C VAL A 80 1.841 -10.875 8.329 1.00 0.00 C ATOM 1247 O VAL A 80 1.883 -10.523 9.507 1.00 0.00 O ATOM 1248 CB VAL A 80 3.670 -10.257 6.662 1.00 0.00 C ATOM 1249 CG1 VAL A 80 3.893 -11.770 6.619 1.00 0.00 C ATOM 1250 CG2 VAL A 80 3.871 -9.634 5.279 1.00 0.00 C ATOM 0 H VAL A 80 3.090 -8.290 8.256 1.00 0.00 H new ATOM 0 HA VAL A 80 1.580 -10.035 6.393 1.00 0.00 H new ATOM 0 HB VAL A 80 4.413 -9.828 7.334 1.00 0.00 H new ATOM 0 HG11 VAL A 80 4.885 -11.980 6.220 1.00 0.00 H new ATOM 0 HG12 VAL A 80 3.813 -12.178 7.626 1.00 0.00 H new ATOM 0 HG13 VAL A 80 3.140 -12.231 5.980 1.00 0.00 H new ATOM 0 HG21 VAL A 80 4.864 -9.887 4.907 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.117 -10.020 4.593 1.00 0.00 H new ATOM 0 HG23 VAL A 80 3.776 -8.551 5.351 1.00 0.00 H new ATOM 1260 N THR A 81 1.424 -12.063 7.916 1.00 0.00 N ATOM 1261 CA THR A 81 0.973 -13.069 8.862 1.00 0.00 C ATOM 1262 C THR A 81 1.081 -14.466 8.247 1.00 0.00 C ATOM 1263 O THR A 81 0.400 -14.773 7.270 1.00 0.00 O ATOM 1264 CB THR A 81 -0.448 -12.705 9.297 1.00 0.00 C ATOM 1265 OG1 THR A 81 -1.081 -12.279 8.093 1.00 0.00 O ATOM 1266 CG2 THR A 81 -0.487 -11.469 10.197 1.00 0.00 C ATOM 0 H THR A 81 1.389 -12.351 6.938 1.00 0.00 H new ATOM 0 HA THR A 81 1.605 -13.089 9.750 1.00 0.00 H new ATOM 0 HB THR A 81 -0.894 -13.549 9.822 1.00 0.00 H new ATOM 0 HG1 THR A 81 -0.883 -12.917 7.376 1.00 0.00 H new ATOM 0 HG21 THR A 81 -1.519 -11.255 10.476 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.101 -11.655 11.096 1.00 0.00 H new ATOM 0 HG23 THR A 81 -0.072 -10.616 9.661 1.00 0.00 H new ATOM 1274 N ARG A 82 1.943 -15.276 8.846 1.00 0.00 N ATOM 1275 CA ARG A 82 2.150 -16.633 8.369 1.00 0.00 C ATOM 1276 C ARG A 82 3.224 -17.331 9.205 1.00 0.00 C ATOM 1277 O ARG A 82 4.067 -16.673 9.814 1.00 0.00 O ATOM 1278 CB ARG A 82 2.571 -16.642 6.899 1.00 0.00 C ATOM 1279 CG ARG A 82 3.904 -15.916 6.706 1.00 0.00 C ATOM 1280 CD ARG A 82 4.634 -16.430 5.463 1.00 0.00 C ATOM 1281 NE ARG A 82 5.161 -15.292 4.678 1.00 0.00 N ATOM 1282 CZ ARG A 82 5.932 -15.423 3.590 1.00 0.00 C ATOM 1283 NH1 ARG A 82 6.270 -16.643 3.151 1.00 0.00 N ATOM 1284 NH2 ARG A 82 6.365 -14.333 2.941 1.00 0.00 N ATOM 0 H ARG A 82 2.506 -15.018 9.657 1.00 0.00 H new ATOM 0 HA ARG A 82 1.205 -17.167 8.467 1.00 0.00 H new ATOM 0 HB2 ARG A 82 2.659 -17.670 6.548 1.00 0.00 H new ATOM 0 HB3 ARG A 82 1.801 -16.163 6.294 1.00 0.00 H new ATOM 0 HG2 ARG A 82 3.728 -14.844 6.612 1.00 0.00 H new ATOM 0 HG3 ARG A 82 4.531 -16.060 7.586 1.00 0.00 H new ATOM 0 HD2 ARG A 82 5.451 -17.089 5.758 1.00 0.00 H new ATOM 0 HD3 ARG A 82 3.953 -17.021 4.850 1.00 0.00 H new ATOM 0 HE ARG A 82 4.922 -14.349 4.984 1.00 0.00 H new ATOM 0 HH11 ARG A 82 5.940 -17.472 3.645 1.00 0.00 H new ATOM 0 HH12 ARG A 82 6.857 -16.742 2.323 1.00 0.00 H new ATOM 0 HH21 ARG A 82 6.108 -13.404 3.275 1.00 0.00 H new ATOM 0 HH22 ARG A 82 6.952 -14.432 2.113 1.00 0.00 H new ATOM 1298 N PRO A 83 3.158 -18.689 9.208 1.00 0.00 N ATOM 1299 CA PRO A 83 4.115 -19.484 9.959 1.00 0.00 C ATOM 1300 C PRO A 83 5.472 -19.517 9.255 1.00 0.00 C ATOM 1301 O PRO A 83 5.740 -20.414 8.457 1.00 0.00 O ATOM 1302 CB PRO A 83 3.475 -20.857 10.082 1.00 0.00 C ATOM 1303 CG PRO A 83 2.404 -20.916 9.005 1.00 0.00 C ATOM 1304 CD PRO A 83 2.173 -19.502 8.499 1.00 0.00 C ATOM 0 HA PRO A 83 4.326 -19.069 10.944 1.00 0.00 H new ATOM 0 HB2 PRO A 83 4.214 -21.646 9.942 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.041 -20.998 11.072 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.719 -21.567 8.189 1.00 0.00 H new ATOM 0 HG3 PRO A 83 1.481 -21.333 9.407 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.312 -19.440 7.420 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.157 -19.167 8.710 1.00 0.00 H new ATOM 1312 N PHE A 84 6.294 -18.528 9.575 1.00 0.00 N ATOM 1313 CA PHE A 84 7.617 -18.433 8.983 1.00 0.00 C ATOM 1314 C PHE A 84 8.666 -18.078 10.039 1.00 0.00 C ATOM 1315 O PHE A 84 8.323 -17.722 11.165 1.00 0.00 O ATOM 1316 CB PHE A 84 7.562 -17.315 7.940 1.00 0.00 C ATOM 1317 CG PHE A 84 8.063 -15.963 8.451 1.00 0.00 C ATOM 1318 CD1 PHE A 84 7.699 -15.525 9.686 1.00 0.00 C ATOM 1319 CD2 PHE A 84 8.871 -15.198 7.669 1.00 0.00 C ATOM 1320 CE1 PHE A 84 8.165 -14.270 10.160 1.00 0.00 C ATOM 1321 CE2 PHE A 84 9.336 -13.943 8.143 1.00 0.00 C ATOM 1322 CZ PHE A 84 8.973 -13.505 9.378 1.00 0.00 C ATOM 0 H PHE A 84 6.069 -17.785 10.237 1.00 0.00 H new ATOM 0 HA PHE A 84 7.895 -19.389 8.540 1.00 0.00 H new ATOM 0 HB2 PHE A 84 8.158 -17.609 7.076 1.00 0.00 H new ATOM 0 HB3 PHE A 84 6.534 -17.204 7.596 1.00 0.00 H new ATOM 0 HD1 PHE A 84 7.056 -16.131 10.306 1.00 0.00 H new ATOM 0 HD2 PHE A 84 9.159 -15.545 6.688 1.00 0.00 H new ATOM 0 HE1 PHE A 84 7.878 -13.923 11.142 1.00 0.00 H new ATOM 0 HE2 PHE A 84 9.978 -13.336 7.522 1.00 0.00 H new ATOM 0 HZ PHE A 84 9.326 -12.550 9.738 1.00 0.00 H new ATOM 1332 N GLN A 85 9.924 -18.188 9.638 1.00 0.00 N ATOM 1333 CA GLN A 85 11.025 -17.882 10.535 1.00 0.00 C ATOM 1334 C GLN A 85 11.652 -16.536 10.168 1.00 0.00 C ATOM 1335 O GLN A 85 12.006 -15.751 11.047 1.00 0.00 O ATOM 1336 CB GLN A 85 12.073 -18.998 10.517 1.00 0.00 C ATOM 1337 CG GLN A 85 12.883 -18.968 9.219 1.00 0.00 C ATOM 1338 CD GLN A 85 13.960 -20.055 9.220 1.00 0.00 C ATOM 1339 OE1 GLN A 85 13.835 -21.089 8.585 1.00 0.00 O ATOM 1340 NE2 GLN A 85 15.021 -19.764 9.967 1.00 0.00 N ATOM 0 H GLN A 85 10.205 -18.485 8.704 1.00 0.00 H new ATOM 0 HA GLN A 85 10.632 -17.812 11.549 1.00 0.00 H new ATOM 0 HB2 GLN A 85 12.742 -18.887 11.370 1.00 0.00 H new ATOM 0 HB3 GLN A 85 11.581 -19.965 10.621 1.00 0.00 H new ATOM 0 HG2 GLN A 85 12.218 -19.111 8.368 1.00 0.00 H new ATOM 0 HG3 GLN A 85 13.349 -17.990 9.099 1.00 0.00 H new ATOM 0 HE21 GLN A 85 15.061 -18.879 10.473 1.00 0.00 H new ATOM 0 HE22 GLN A 85 15.795 -20.425 10.034 1.00 0.00 H new ATOM 1349 N GLY A 86 11.770 -16.309 8.868 1.00 0.00 N ATOM 1350 CA GLY A 86 12.348 -15.071 8.373 1.00 0.00 C ATOM 1351 C GLY A 86 13.740 -14.841 8.964 1.00 0.00 C ATOM 1352 O GLY A 86 14.318 -15.743 9.569 1.00 0.00 O ATOM 0 H GLY A 86 11.475 -16.962 8.142 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.412 -15.105 7.285 1.00 0.00 H new ATOM 0 HA3 GLY A 86 11.698 -14.234 8.628 1.00 0.00 H new ATOM 1356 N LEU A 87 14.239 -13.630 8.767 1.00 0.00 N ATOM 1357 CA LEU A 87 15.554 -13.271 9.272 1.00 0.00 C ATOM 1358 C LEU A 87 15.483 -11.890 9.927 1.00 0.00 C ATOM 1359 O LEU A 87 14.396 -11.360 10.152 1.00 0.00 O ATOM 1360 CB LEU A 87 16.601 -13.372 8.162 1.00 0.00 C ATOM 1361 CG LEU A 87 17.519 -14.595 8.215 1.00 0.00 C ATOM 1362 CD1 LEU A 87 18.549 -14.458 9.338 1.00 0.00 C ATOM 1363 CD2 LEU A 87 16.707 -15.886 8.336 1.00 0.00 C ATOM 0 H LEU A 87 13.757 -12.885 8.265 1.00 0.00 H new ATOM 0 HA LEU A 87 15.872 -13.974 10.042 1.00 0.00 H new ATOM 0 HB2 LEU A 87 16.085 -13.371 7.202 1.00 0.00 H new ATOM 0 HB3 LEU A 87 17.221 -12.476 8.192 1.00 0.00 H new ATOM 0 HG LEU A 87 18.071 -14.649 7.276 1.00 0.00 H new ATOM 0 HD11 LEU A 87 19.189 -15.340 9.354 1.00 0.00 H new ATOM 0 HD12 LEU A 87 19.158 -13.571 9.167 1.00 0.00 H new ATOM 0 HD13 LEU A 87 18.034 -14.365 10.294 1.00 0.00 H new ATOM 0 HD21 LEU A 87 17.384 -16.740 8.372 1.00 0.00 H new ATOM 0 HD22 LEU A 87 16.111 -15.857 9.248 1.00 0.00 H new ATOM 0 HD23 LEU A 87 16.046 -15.983 7.474 1.00 0.00 H new ATOM 1375 N ILE A 88 16.657 -11.346 10.215 1.00 0.00 N ATOM 1376 CA ILE A 88 16.742 -10.037 10.839 1.00 0.00 C ATOM 1377 C ILE A 88 16.551 -8.955 9.774 1.00 0.00 C ATOM 1378 O ILE A 88 17.049 -9.084 8.657 1.00 0.00 O ATOM 1379 CB ILE A 88 18.048 -9.902 11.626 1.00 0.00 C ATOM 1380 CG1 ILE A 88 18.194 -11.036 12.643 1.00 0.00 C ATOM 1381 CG2 ILE A 88 18.152 -8.525 12.283 1.00 0.00 C ATOM 1382 CD1 ILE A 88 19.173 -12.099 12.141 1.00 0.00 C ATOM 0 H ILE A 88 17.557 -11.788 10.027 1.00 0.00 H new ATOM 0 HA ILE A 88 15.942 -9.911 11.569 1.00 0.00 H new ATOM 0 HB ILE A 88 18.880 -9.988 10.927 1.00 0.00 H new ATOM 0 HG12 ILE A 88 18.544 -10.634 13.594 1.00 0.00 H new ATOM 0 HG13 ILE A 88 17.221 -11.491 12.828 1.00 0.00 H new ATOM 0 HG21 ILE A 88 19.089 -8.455 12.836 1.00 0.00 H new ATOM 0 HG22 ILE A 88 18.126 -7.752 11.515 1.00 0.00 H new ATOM 0 HG23 ILE A 88 17.316 -8.384 12.968 1.00 0.00 H new ATOM 0 HD11 ILE A 88 19.259 -12.894 12.882 1.00 0.00 H new ATOM 0 HD12 ILE A 88 18.808 -12.516 11.203 1.00 0.00 H new ATOM 0 HD13 ILE A 88 20.151 -11.646 11.980 1.00 0.00 H new ATOM 1394 N PRO A 89 15.810 -7.885 10.168 1.00 0.00 N ATOM 1395 CA PRO A 89 15.548 -6.782 9.260 1.00 0.00 C ATOM 1396 C PRO A 89 16.789 -5.903 9.091 1.00 0.00 C ATOM 1397 O PRO A 89 17.790 -6.097 9.779 1.00 0.00 O ATOM 1398 CB PRO A 89 14.373 -6.038 9.874 1.00 0.00 C ATOM 1399 CG PRO A 89 14.320 -6.472 11.330 1.00 0.00 C ATOM 1400 CD PRO A 89 15.204 -7.698 11.483 1.00 0.00 C ATOM 0 HA PRO A 89 15.308 -7.117 8.251 1.00 0.00 H new ATOM 0 HB2 PRO A 89 14.508 -4.959 9.793 1.00 0.00 H new ATOM 0 HB3 PRO A 89 13.444 -6.283 9.359 1.00 0.00 H new ATOM 0 HG2 PRO A 89 14.666 -5.669 11.981 1.00 0.00 H new ATOM 0 HG3 PRO A 89 13.295 -6.701 11.623 1.00 0.00 H new ATOM 0 HD2 PRO A 89 15.963 -7.546 12.251 1.00 0.00 H new ATOM 0 HD3 PRO A 89 14.622 -8.571 11.779 1.00 0.00 H new ATOM 1408 N LYS A 90 16.683 -4.955 8.171 1.00 0.00 N ATOM 1409 CA LYS A 90 17.785 -4.047 7.903 1.00 0.00 C ATOM 1410 C LYS A 90 17.247 -2.788 7.220 1.00 0.00 C ATOM 1411 O LYS A 90 17.232 -2.701 5.993 1.00 0.00 O ATOM 1412 CB LYS A 90 18.883 -4.756 7.108 1.00 0.00 C ATOM 1413 CG LYS A 90 20.147 -3.896 7.032 1.00 0.00 C ATOM 1414 CD LYS A 90 20.332 -3.317 5.628 1.00 0.00 C ATOM 1415 CE LYS A 90 21.664 -2.573 5.513 1.00 0.00 C ATOM 1416 NZ LYS A 90 21.434 -1.146 5.194 1.00 0.00 N ATOM 0 H LYS A 90 15.851 -4.796 7.602 1.00 0.00 H new ATOM 0 HA LYS A 90 18.253 -3.730 8.835 1.00 0.00 H new ATOM 0 HB2 LYS A 90 19.117 -5.712 7.577 1.00 0.00 H new ATOM 0 HB3 LYS A 90 18.526 -4.973 6.101 1.00 0.00 H new ATOM 0 HG2 LYS A 90 20.084 -3.086 7.758 1.00 0.00 H new ATOM 0 HG3 LYS A 90 21.017 -4.497 7.299 1.00 0.00 H new ATOM 0 HD2 LYS A 90 20.295 -4.120 4.892 1.00 0.00 H new ATOM 0 HD3 LYS A 90 19.511 -2.637 5.400 1.00 0.00 H new ATOM 0 HE2 LYS A 90 22.217 -2.658 6.448 1.00 0.00 H new ATOM 0 HE3 LYS A 90 22.278 -3.031 4.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 22.348 -0.655 5.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 20.925 -1.070 4.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 20.867 -0.709 5.948 1.00 0.00 H new ATOM 1430 N PRO A 91 16.808 -1.818 8.066 1.00 0.00 N ATOM 1431 CA PRO A 91 16.270 -0.568 7.557 1.00 0.00 C ATOM 1432 C PRO A 91 17.389 0.340 7.042 1.00 0.00 C ATOM 1433 O PRO A 91 18.462 0.409 7.639 1.00 0.00 O ATOM 1434 CB PRO A 91 15.505 0.036 8.724 1.00 0.00 C ATOM 1435 CG PRO A 91 16.026 -0.662 9.970 1.00 0.00 C ATOM 1436 CD PRO A 91 16.811 -1.886 9.525 1.00 0.00 C ATOM 0 HA PRO A 91 15.613 -0.711 6.699 1.00 0.00 H new ATOM 0 HB2 PRO A 91 15.668 1.112 8.782 1.00 0.00 H new ATOM 0 HB3 PRO A 91 14.432 -0.119 8.610 1.00 0.00 H new ATOM 0 HG2 PRO A 91 16.661 0.010 10.547 1.00 0.00 H new ATOM 0 HG3 PRO A 91 15.199 -0.953 10.618 1.00 0.00 H new ATOM 0 HD2 PRO A 91 17.827 -1.870 9.920 1.00 0.00 H new ATOM 0 HD3 PRO A 91 16.345 -2.806 9.880 1.00 0.00 H new ATOM 1444 N ASP A 92 17.099 1.015 5.940 1.00 0.00 N ATOM 1445 CA ASP A 92 18.067 1.916 5.337 1.00 0.00 C ATOM 1446 C ASP A 92 17.483 3.330 5.293 1.00 0.00 C ATOM 1447 O ASP A 92 16.313 3.532 5.614 1.00 0.00 O ATOM 1448 CB ASP A 92 18.395 1.495 3.904 1.00 0.00 C ATOM 1449 CG ASP A 92 17.347 1.885 2.859 1.00 0.00 C ATOM 1450 OD1 ASP A 92 17.178 3.106 2.653 1.00 0.00 O ATOM 1451 OD2 ASP A 92 16.737 0.953 2.292 1.00 0.00 O ATOM 0 H ASP A 92 16.207 0.956 5.448 1.00 0.00 H new ATOM 0 HA ASP A 92 18.976 1.885 5.938 1.00 0.00 H new ATOM 0 HB2 ASP A 92 19.350 1.937 3.621 1.00 0.00 H new ATOM 0 HB3 ASP A 92 18.525 0.413 3.880 1.00 0.00 H new ATOM 1456 N GLU A 93 18.325 4.271 4.891 1.00 0.00 N ATOM 1457 CA GLU A 93 17.906 5.659 4.801 1.00 0.00 C ATOM 1458 C GLU A 93 17.866 6.107 3.338 1.00 0.00 C ATOM 1459 O GLU A 93 18.781 5.813 2.570 1.00 0.00 O ATOM 1460 CB GLU A 93 18.824 6.564 5.626 1.00 0.00 C ATOM 1461 CG GLU A 93 18.034 7.702 6.275 1.00 0.00 C ATOM 1462 CD GLU A 93 18.964 8.834 6.715 1.00 0.00 C ATOM 1463 OE1 GLU A 93 19.740 9.298 5.853 1.00 0.00 O ATOM 1464 OE2 GLU A 93 18.878 9.209 7.904 1.00 0.00 O ATOM 0 H GLU A 93 19.294 4.099 4.624 1.00 0.00 H new ATOM 0 HA GLU A 93 16.901 5.742 5.215 1.00 0.00 H new ATOM 0 HB2 GLU A 93 19.322 5.976 6.397 1.00 0.00 H new ATOM 0 HB3 GLU A 93 19.604 6.977 4.986 1.00 0.00 H new ATOM 0 HG2 GLU A 93 17.297 8.086 5.570 1.00 0.00 H new ATOM 0 HG3 GLU A 93 17.484 7.323 7.136 1.00 0.00 H new ATOM 1471 N SER A 94 16.797 6.811 2.997 1.00 0.00 N ATOM 1472 CA SER A 94 16.626 7.303 1.641 1.00 0.00 C ATOM 1473 C SER A 94 15.851 8.622 1.656 1.00 0.00 C ATOM 1474 O SER A 94 15.170 8.935 2.631 1.00 0.00 O ATOM 1475 CB SER A 94 15.905 6.273 0.769 1.00 0.00 C ATOM 1476 OG SER A 94 16.381 6.283 -0.574 1.00 0.00 O ATOM 0 H SER A 94 16.040 7.053 3.637 1.00 0.00 H new ATOM 0 HA SER A 94 17.613 7.475 1.212 1.00 0.00 H new ATOM 0 HB2 SER A 94 16.042 5.279 1.195 1.00 0.00 H new ATOM 0 HB3 SER A 94 14.835 6.478 0.776 1.00 0.00 H new ATOM 0 HG SER A 94 15.897 5.611 -1.098 1.00 0.00 H new ATOM 1482 N GLY A 95 15.980 9.360 0.563 1.00 0.00 N ATOM 1483 CA GLY A 95 15.300 10.638 0.438 1.00 0.00 C ATOM 1484 C GLY A 95 15.569 11.270 -0.929 1.00 0.00 C ATOM 1485 O GLY A 95 16.597 11.917 -1.126 1.00 0.00 O ATOM 0 H GLY A 95 16.545 9.097 -0.244 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.228 10.498 0.573 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.636 11.311 1.227 1.00 0.00 H new ATOM 1489 N PRO A 96 14.602 11.057 -1.861 1.00 0.00 N ATOM 1490 CA PRO A 96 14.724 11.599 -3.204 1.00 0.00 C ATOM 1491 C PRO A 96 14.451 13.105 -3.214 1.00 0.00 C ATOM 1492 O PRO A 96 14.223 13.705 -2.165 1.00 0.00 O ATOM 1493 CB PRO A 96 13.730 10.809 -4.039 1.00 0.00 C ATOM 1494 CG PRO A 96 12.762 10.180 -3.050 1.00 0.00 C ATOM 1495 CD PRO A 96 13.371 10.297 -1.663 1.00 0.00 C ATOM 0 HA PRO A 96 15.731 11.499 -3.609 1.00 0.00 H new ATOM 0 HB2 PRO A 96 13.205 11.458 -4.740 1.00 0.00 H new ATOM 0 HB3 PRO A 96 14.236 10.045 -4.630 1.00 0.00 H new ATOM 0 HG2 PRO A 96 11.797 10.685 -3.087 1.00 0.00 H new ATOM 0 HG3 PRO A 96 12.585 9.134 -3.302 1.00 0.00 H new ATOM 0 HD2 PRO A 96 12.696 10.808 -0.976 1.00 0.00 H new ATOM 0 HD3 PRO A 96 13.576 9.315 -1.237 1.00 0.00 H new ATOM 1503 N SER A 97 14.482 13.671 -4.411 1.00 0.00 N ATOM 1504 CA SER A 97 14.240 15.095 -4.572 1.00 0.00 C ATOM 1505 C SER A 97 13.309 15.336 -5.762 1.00 0.00 C ATOM 1506 O SER A 97 13.016 14.415 -6.523 1.00 0.00 O ATOM 1507 CB SER A 97 15.552 15.858 -4.761 1.00 0.00 C ATOM 1508 OG SER A 97 15.446 17.215 -4.338 1.00 0.00 O ATOM 0 H SER A 97 14.671 13.170 -5.279 1.00 0.00 H new ATOM 0 HA SER A 97 13.763 15.466 -3.665 1.00 0.00 H new ATOM 0 HB2 SER A 97 16.343 15.363 -4.198 1.00 0.00 H new ATOM 0 HB3 SER A 97 15.841 15.827 -5.811 1.00 0.00 H new ATOM 0 HG SER A 97 16.305 17.668 -4.473 1.00 0.00 H new ATOM 1514 N SER A 98 12.869 16.580 -5.886 1.00 0.00 N ATOM 1515 CA SER A 98 11.977 16.954 -6.970 1.00 0.00 C ATOM 1516 C SER A 98 10.696 16.120 -6.906 1.00 0.00 C ATOM 1517 O SER A 98 10.727 14.911 -7.129 1.00 0.00 O ATOM 1518 CB SER A 98 12.658 16.778 -8.329 1.00 0.00 C ATOM 1519 OG SER A 98 12.708 15.410 -8.727 1.00 0.00 O ATOM 0 H SER A 98 13.114 17.342 -5.253 1.00 0.00 H new ATOM 0 HA SER A 98 11.722 18.008 -6.855 1.00 0.00 H new ATOM 0 HB2 SER A 98 12.121 17.355 -9.081 1.00 0.00 H new ATOM 0 HB3 SER A 98 13.670 17.179 -8.282 1.00 0.00 H new ATOM 0 HG SER A 98 12.288 14.853 -8.039 1.00 0.00 H new ATOM 1525 N GLY A 99 9.601 16.799 -6.599 1.00 0.00 N ATOM 1526 CA GLY A 99 8.311 16.135 -6.503 1.00 0.00 C ATOM 1527 C GLY A 99 7.182 17.062 -6.958 1.00 0.00 C ATOM 1528 O GLY A 99 7.230 18.268 -6.720 1.00 0.00 O ATOM 0 H GLY A 99 9.580 17.802 -6.413 1.00 0.00 H new ATOM 0 HA2 GLY A 99 8.315 15.234 -7.116 1.00 0.00 H new ATOM 0 HA3 GLY A 99 8.136 15.820 -5.474 1.00 0.00 H new TER 1532 GLY A 99