USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 864 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 35 ASN : amide:sc= -32.5! C(o=-89!,f=-94!) USER MOD Set 1.2: A 74 GLN : amide:sc= -56.8! C(o=-89!,f=-99!) USER MOD Set 2.1: A 72 LYS NZ :NH3+ -129:sc= -1.48! (180deg=-2.91!) USER MOD Set 2.2: A 73 TYR OH : rot 180:sc= 0.0365 USER MOD Set 3.1: A 20 HIS : no HE2:sc= -69.6! C(o=-1.5e+02!,f=-1.4e+02!) USER MOD Set 3.2: A 21 SER OG : rot 109:sc= -5.34! USER MOD Set 3.3: A 22 THR OG1 : rot 49:sc= -3.13! USER MOD Set 3.4: A 38 HIS : no HD1:sc= -66.9! C(o=-1.5e+02!,f=-1.4e+02!) USER MOD Set 3.5: A 95 GLN : amide:sc= -3.57! C(o=-1.5e+02!,f=-1.4e+02!) USER MOD Single : A 4 GLN : amide:sc= -1.59! K(o=-1.6!,f=-0.019) USER MOD Single : A 6 TYR OH : rot 150:sc= -11.6! USER MOD Single : A 7 SER OG : rot 180:sc= -0.97 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 16:sc= -0.454! USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= -0.123 USER MOD Single : A 26 MET CE :methyl -137:sc= -13.7! (180deg=-17.2!) USER MOD Single : A 27 LYS NZ :NH3+ -174:sc= -5.74! (180deg=-6.23!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.00601 USER MOD Single : A 41 LYS NZ :NH3+ 155:sc= -0.121 (180deg=-1.36!) USER MOD Single : A 44 ASN : amide:sc= -75.1! C(o=-75!,f=-72!) USER MOD Single : A 47 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0025) USER MOD Single : A 49 LYS NZ :NH3+ -156:sc= -0.182 (180deg=-1.61!) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 66:sc= 0.884 USER MOD Single : A 63 HIS : no HE2:sc= -5.58! C(o=-5.6!,f=-8.3!) USER MOD Single : A 65 LYS NZ :NH3+ -138:sc= -0.445 (180deg=-2.71!) USER MOD Single : A 67 GLN : amide:sc= -2.47 K(o=-2.5,f=-0.57) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -0.462 X(o=-0.46,f=-0.1) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -85:sc= -0.982! USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 142:sc= -0.231 (180deg=-1.53!) USER MOD Single : A 117 HIS : no HE2:sc= -6.92! C(o=-6.9!,f=-10!) USER MOD Single : A 118 HIS : no HD1:sc= -0.57 K(o=-0.57,f=-1.4!) USER MOD Single : A 119 HIS : no HD1:sc= -3.59! C(o=-3.6!,f=-3.1!) USER MOD Single : A 121 SER OG : rot -60:sc= 0.659! USER MOD Single : A 122 LYS NZ :NH3+ 160:sc= -1.35! (180deg=-3.77!) USER MOD ----------------------------------------------------------------- ATOM 26 N GLN A 4 -1.407 -3.458 9.094 1.00 1.00 N ATOM 27 CA GLN A 4 -1.391 -2.047 8.613 1.00 1.00 C ATOM 28 C GLN A 4 -1.903 -1.969 7.172 1.00 1.00 C ATOM 29 O GLN A 4 -2.331 -2.953 6.601 1.00 1.00 O ATOM 30 CB GLN A 4 0.075 -1.620 8.684 1.00 1.00 C ATOM 31 CG GLN A 4 0.948 -2.840 8.986 1.00 1.00 C ATOM 32 CD GLN A 4 2.422 -2.437 8.941 1.00 1.00 C ATOM 33 OE1 GLN A 4 3.264 -3.104 9.508 1.00 1.00 O ATOM 34 NE2 GLN A 4 2.772 -1.364 8.286 1.00 1.00 N ATOM 0 HA GLN A 4 -2.034 -1.402 9.212 1.00 1.00 H new ATOM 0 HB2 GLN A 4 0.379 -1.167 7.740 1.00 1.00 H new ATOM 0 HB3 GLN A 4 0.208 -0.864 9.458 1.00 1.00 H new ATOM 0 HG2 GLN A 4 0.700 -3.243 9.968 1.00 1.00 H new ATOM 0 HG3 GLN A 4 0.753 -3.628 8.259 1.00 1.00 H new ATOM 0 HE21 GLN A 4 2.065 -0.804 7.810 1.00 1.00 H new ATOM 0 HE22 GLN A 4 3.753 -1.085 8.250 1.00 1.00 H new ATOM 43 N ILE A 5 -1.859 -0.808 6.581 1.00 1.00 N ATOM 44 CA ILE A 5 -2.339 -0.665 5.176 1.00 1.00 C ATOM 45 C ILE A 5 -1.146 -0.599 4.216 1.00 1.00 C ATOM 46 O ILE A 5 -0.642 0.462 3.910 1.00 1.00 O ATOM 47 CB ILE A 5 -3.116 0.651 5.159 1.00 1.00 C ATOM 48 CG1 ILE A 5 -3.760 0.846 3.784 1.00 1.00 C ATOM 49 CG2 ILE A 5 -2.161 1.812 5.442 1.00 1.00 C ATOM 50 CD1 ILE A 5 -3.039 1.970 3.037 1.00 1.00 C ATOM 0 H ILE A 5 -1.511 0.050 7.010 1.00 1.00 H new ATOM 0 HA ILE A 5 -2.955 -1.506 4.859 1.00 1.00 H new ATOM 0 HB ILE A 5 -3.892 0.623 5.924 1.00 1.00 H new ATOM 0 HG12 ILE A 5 -3.705 -0.079 3.211 1.00 1.00 H new ATOM 0 HG13 ILE A 5 -4.817 1.089 3.897 1.00 1.00 H new ATOM 0 HG21 ILE A 5 -2.715 2.750 5.430 1.00 1.00 H new ATOM 0 HG22 ILE A 5 -1.701 1.675 6.421 1.00 1.00 H new ATOM 0 HG23 ILE A 5 -1.385 1.839 4.677 1.00 1.00 H new ATOM 0 HD11 ILE A 5 -3.498 2.109 2.058 1.00 1.00 H new ATOM 0 HD12 ILE A 5 -3.117 2.895 3.608 1.00 1.00 H new ATOM 0 HD13 ILE A 5 -1.988 1.708 2.912 1.00 1.00 H new ATOM 62 N TYR A 6 -0.690 -1.728 3.743 1.00 1.00 N ATOM 63 CA TYR A 6 0.471 -1.731 2.806 1.00 1.00 C ATOM 64 C TYR A 6 0.083 -1.073 1.477 1.00 1.00 C ATOM 65 O TYR A 6 -1.071 -1.046 1.099 1.00 1.00 O ATOM 66 CB TYR A 6 0.816 -3.211 2.615 1.00 1.00 C ATOM 67 CG TYR A 6 0.718 -3.585 1.155 1.00 1.00 C ATOM 68 CD1 TYR A 6 1.312 -2.777 0.179 1.00 1.00 C ATOM 69 CD2 TYR A 6 0.035 -4.748 0.779 1.00 1.00 C ATOM 70 CE1 TYR A 6 1.223 -3.132 -1.173 1.00 1.00 C ATOM 71 CE2 TYR A 6 -0.053 -5.104 -0.573 1.00 1.00 C ATOM 72 CZ TYR A 6 0.540 -4.295 -1.549 1.00 1.00 C ATOM 73 OH TYR A 6 0.454 -4.645 -2.881 1.00 1.00 O ATOM 0 H TYR A 6 -1.071 -2.648 3.965 1.00 1.00 H new ATOM 0 HA TYR A 6 1.321 -1.167 3.190 1.00 1.00 H new ATOM 0 HB2 TYR A 6 1.824 -3.407 2.981 1.00 1.00 H new ATOM 0 HB3 TYR A 6 0.137 -3.829 3.203 1.00 1.00 H new ATOM 0 HD1 TYR A 6 1.839 -1.880 0.468 1.00 1.00 H new ATOM 0 HD2 TYR A 6 -0.424 -5.371 1.532 1.00 1.00 H new ATOM 0 HE1 TYR A 6 1.682 -2.508 -1.926 1.00 1.00 H new ATOM 0 HE2 TYR A 6 -0.578 -6.002 -0.862 1.00 1.00 H new ATOM 0 HH TYR A 6 0.404 -5.621 -2.960 1.00 1.00 H new ATOM 83 N SER A 7 1.041 -0.535 0.770 1.00 1.00 N ATOM 84 CA SER A 7 0.728 0.130 -0.529 1.00 1.00 C ATOM 85 C SER A 7 1.367 -0.632 -1.694 1.00 1.00 C ATOM 86 O SER A 7 2.419 -1.226 -1.559 1.00 1.00 O ATOM 87 CB SER A 7 1.332 1.529 -0.412 1.00 1.00 C ATOM 88 OG SER A 7 0.285 2.489 -0.353 1.00 1.00 O ATOM 0 H SER A 7 2.026 -0.527 1.035 1.00 1.00 H new ATOM 0 HA SER A 7 -0.344 0.159 -0.724 1.00 1.00 H new ATOM 0 HB2 SER A 7 1.953 1.596 0.481 1.00 1.00 H new ATOM 0 HB3 SER A 7 1.979 1.731 -1.266 1.00 1.00 H new ATOM 0 HG SER A 7 0.669 3.387 -0.276 1.00 1.00 H new ATOM 94 N ALA A 8 0.738 -0.614 -2.838 1.00 1.00 N ATOM 95 CA ALA A 8 1.303 -1.331 -4.018 1.00 1.00 C ATOM 96 C ALA A 8 0.883 -0.627 -5.312 1.00 1.00 C ATOM 97 O ALA A 8 -0.073 0.123 -5.339 1.00 1.00 O ATOM 98 CB ALA A 8 0.703 -2.736 -3.952 1.00 1.00 C ATOM 0 H ALA A 8 -0.145 -0.132 -3.007 1.00 1.00 H new ATOM 0 HA ALA A 8 2.393 -1.353 -4.007 1.00 1.00 H new ATOM 0 HB1 ALA A 8 1.071 -3.329 -4.790 1.00 1.00 H new ATOM 0 HB2 ALA A 8 0.993 -3.212 -3.015 1.00 1.00 H new ATOM 0 HB3 ALA A 8 -0.384 -2.670 -4.004 1.00 1.00 H new ATOM 104 N ARG A 9 1.586 -0.862 -6.387 1.00 1.00 N ATOM 105 CA ARG A 9 1.220 -0.205 -7.676 1.00 1.00 C ATOM 106 C ARG A 9 1.453 -1.166 -8.845 1.00 1.00 C ATOM 107 O ARG A 9 2.524 -1.718 -9.003 1.00 1.00 O ATOM 108 CB ARG A 9 2.149 1.005 -7.784 1.00 1.00 C ATOM 109 CG ARG A 9 2.275 1.426 -9.249 1.00 1.00 C ATOM 110 CD ARG A 9 3.248 0.488 -9.969 1.00 1.00 C ATOM 111 NE ARG A 9 3.424 1.083 -11.324 1.00 1.00 N ATOM 112 CZ ARG A 9 4.481 0.790 -12.032 1.00 1.00 C ATOM 113 NH1 ARG A 9 5.387 -0.015 -11.548 1.00 1.00 N ATOM 114 NH2 ARG A 9 4.631 1.303 -13.222 1.00 1.00 N ATOM 0 H ARG A 9 2.397 -1.479 -6.429 1.00 1.00 H new ATOM 0 HA ARG A 9 0.170 0.084 -7.707 1.00 1.00 H new ATOM 0 HB2 ARG A 9 1.757 1.831 -7.190 1.00 1.00 H new ATOM 0 HB3 ARG A 9 3.131 0.759 -7.380 1.00 1.00 H new ATOM 0 HG2 ARG A 9 1.299 1.395 -9.732 1.00 1.00 H new ATOM 0 HG3 ARG A 9 2.630 2.455 -9.313 1.00 1.00 H new ATOM 0 HD2 ARG A 9 4.199 0.423 -9.440 1.00 1.00 H new ATOM 0 HD3 ARG A 9 2.848 -0.524 -10.031 1.00 1.00 H new ATOM 0 HE ARG A 9 2.719 1.719 -11.698 1.00 1.00 H new ATOM 0 HH11 ARG A 9 5.269 -0.415 -10.617 1.00 1.00 H new ATOM 0 HH12 ARG A 9 6.213 -0.244 -12.101 1.00 1.00 H new ATOM 0 HH21 ARG A 9 3.923 1.933 -13.599 1.00 1.00 H new ATOM 0 HH22 ARG A 9 5.457 1.074 -13.776 1.00 1.00 H new ATOM 127 N TYR A 10 0.458 -1.372 -9.666 1.00 1.00 N ATOM 128 CA TYR A 10 0.628 -2.301 -10.820 1.00 1.00 C ATOM 129 C TYR A 10 -0.158 -1.796 -12.036 1.00 1.00 C ATOM 130 O TYR A 10 -1.023 -0.950 -11.926 1.00 1.00 O ATOM 131 CB TYR A 10 0.060 -3.637 -10.338 1.00 1.00 C ATOM 132 CG TYR A 10 0.980 -4.233 -9.299 1.00 1.00 C ATOM 133 CD1 TYR A 10 2.333 -3.874 -9.273 1.00 1.00 C ATOM 134 CD2 TYR A 10 0.481 -5.146 -8.361 1.00 1.00 C ATOM 135 CE1 TYR A 10 3.186 -4.427 -8.311 1.00 1.00 C ATOM 136 CE2 TYR A 10 1.334 -5.698 -7.398 1.00 1.00 C ATOM 137 CZ TYR A 10 2.687 -5.338 -7.374 1.00 1.00 C ATOM 138 OH TYR A 10 3.528 -5.883 -6.425 1.00 1.00 O ATOM 0 H TYR A 10 -0.462 -0.939 -9.588 1.00 1.00 H new ATOM 0 HA TYR A 10 1.670 -2.383 -11.129 1.00 1.00 H new ATOM 0 HB2 TYR A 10 -0.934 -3.490 -9.917 1.00 1.00 H new ATOM 0 HB3 TYR A 10 -0.048 -4.322 -11.179 1.00 1.00 H new ATOM 0 HD1 TYR A 10 2.719 -3.170 -9.996 1.00 1.00 H new ATOM 0 HD2 TYR A 10 -0.562 -5.424 -8.381 1.00 1.00 H new ATOM 0 HE1 TYR A 10 4.230 -4.150 -8.292 1.00 1.00 H new ATOM 0 HE2 TYR A 10 0.949 -6.401 -6.674 1.00 1.00 H new ATOM 0 HH TYR A 10 3.021 -6.495 -5.852 1.00 1.00 H new ATOM 148 N SER A 11 0.133 -2.324 -13.194 1.00 1.00 N ATOM 149 CA SER A 11 -0.595 -1.897 -14.424 1.00 1.00 C ATOM 150 C SER A 11 -0.476 -0.384 -14.644 1.00 1.00 C ATOM 151 O SER A 11 -1.426 0.269 -15.028 1.00 1.00 O ATOM 152 CB SER A 11 -2.052 -2.284 -14.171 1.00 1.00 C ATOM 153 OG SER A 11 -2.888 -1.163 -14.424 1.00 1.00 O ATOM 0 H SER A 11 0.848 -3.037 -13.342 1.00 1.00 H new ATOM 0 HA SER A 11 -0.186 -2.369 -15.317 1.00 1.00 H new ATOM 0 HB2 SER A 11 -2.336 -3.116 -14.815 1.00 1.00 H new ATOM 0 HB3 SER A 11 -2.177 -2.620 -13.142 1.00 1.00 H new ATOM 0 HG SER A 11 -2.390 -0.493 -14.937 1.00 1.00 H new ATOM 159 N GLY A 12 0.682 0.178 -14.427 1.00 1.00 N ATOM 160 CA GLY A 12 0.851 1.644 -14.650 1.00 1.00 C ATOM 161 C GLY A 12 0.111 2.434 -13.570 1.00 1.00 C ATOM 162 O GLY A 12 0.244 3.637 -13.469 1.00 1.00 O ATOM 0 H GLY A 12 1.517 -0.312 -14.106 1.00 1.00 H new ATOM 0 HA2 GLY A 12 1.910 1.901 -14.637 1.00 1.00 H new ATOM 0 HA3 GLY A 12 0.470 1.915 -15.634 1.00 1.00 H new ATOM 166 N VAL A 13 -0.670 1.773 -12.762 1.00 1.00 N ATOM 167 CA VAL A 13 -1.416 2.501 -11.695 1.00 1.00 C ATOM 168 C VAL A 13 -1.054 1.939 -10.319 1.00 1.00 C ATOM 169 O VAL A 13 -1.113 0.746 -10.091 1.00 1.00 O ATOM 170 CB VAL A 13 -2.892 2.252 -12.006 1.00 1.00 C ATOM 171 CG1 VAL A 13 -3.753 2.795 -10.864 1.00 1.00 C ATOM 172 CG2 VAL A 13 -3.264 2.965 -13.309 1.00 1.00 C ATOM 0 H VAL A 13 -0.824 0.765 -12.793 1.00 1.00 H new ATOM 0 HA VAL A 13 -1.177 3.564 -11.675 1.00 1.00 H new ATOM 0 HB VAL A 13 -3.066 1.181 -12.114 1.00 1.00 H new ATOM 0 HG11 VAL A 13 -4.805 2.618 -11.086 1.00 1.00 H new ATOM 0 HG12 VAL A 13 -3.487 2.289 -9.936 1.00 1.00 H new ATOM 0 HG13 VAL A 13 -3.581 3.866 -10.756 1.00 1.00 H new ATOM 0 HG21 VAL A 13 -4.316 2.789 -13.533 1.00 1.00 H new ATOM 0 HG22 VAL A 13 -3.091 4.036 -13.200 1.00 1.00 H new ATOM 0 HG23 VAL A 13 -2.650 2.579 -14.123 1.00 1.00 H new ATOM 182 N ASP A 14 -0.680 2.787 -9.400 1.00 1.00 N ATOM 183 CA ASP A 14 -0.314 2.294 -8.043 1.00 1.00 C ATOM 184 C ASP A 14 -1.578 2.044 -7.219 1.00 1.00 C ATOM 185 O ASP A 14 -2.653 2.497 -7.559 1.00 1.00 O ATOM 186 CB ASP A 14 0.519 3.416 -7.423 1.00 1.00 C ATOM 187 CG ASP A 14 0.197 3.528 -5.932 1.00 1.00 C ATOM 188 OD1 ASP A 14 0.413 2.557 -5.225 1.00 1.00 O ATOM 189 OD2 ASP A 14 -0.260 4.582 -5.523 1.00 1.00 O ATOM 0 H ASP A 14 -0.612 3.796 -9.530 1.00 1.00 H new ATOM 0 HA ASP A 14 0.236 1.354 -8.078 1.00 1.00 H new ATOM 0 HB2 ASP A 14 1.581 3.214 -7.562 1.00 1.00 H new ATOM 0 HB3 ASP A 14 0.306 4.360 -7.924 1.00 1.00 H new ATOM 194 N VAL A 15 -1.458 1.320 -6.143 1.00 1.00 N ATOM 195 CA VAL A 15 -2.654 1.034 -5.302 1.00 1.00 C ATOM 196 C VAL A 15 -2.245 0.853 -3.840 1.00 1.00 C ATOM 197 O VAL A 15 -1.080 0.913 -3.499 1.00 1.00 O ATOM 198 CB VAL A 15 -3.229 -0.265 -5.862 1.00 1.00 C ATOM 199 CG1 VAL A 15 -4.494 -0.635 -5.088 1.00 1.00 C ATOM 200 CG2 VAL A 15 -3.575 -0.074 -7.341 1.00 1.00 C ATOM 0 H VAL A 15 -0.584 0.914 -5.809 1.00 1.00 H new ATOM 0 HA VAL A 15 -3.380 1.847 -5.328 1.00 1.00 H new ATOM 0 HB VAL A 15 -2.493 -1.062 -5.761 1.00 1.00 H new ATOM 0 HG11 VAL A 15 -4.906 -1.562 -5.486 1.00 1.00 H new ATOM 0 HG12 VAL A 15 -4.250 -0.770 -4.034 1.00 1.00 H new ATOM 0 HG13 VAL A 15 -5.230 0.163 -5.191 1.00 1.00 H new ATOM 0 HG21 VAL A 15 -3.985 -1.001 -7.741 1.00 1.00 H new ATOM 0 HG22 VAL A 15 -4.312 0.723 -7.442 1.00 1.00 H new ATOM 0 HG23 VAL A 15 -2.674 0.192 -7.894 1.00 1.00 H new ATOM 210 N TYR A 16 -3.192 0.614 -2.977 1.00 1.00 N ATOM 211 CA TYR A 16 -2.862 0.404 -1.540 1.00 1.00 C ATOM 212 C TYR A 16 -3.295 -1.005 -1.134 1.00 1.00 C ATOM 213 O TYR A 16 -4.364 -1.457 -1.491 1.00 1.00 O ATOM 214 CB TYR A 16 -3.672 1.458 -0.785 1.00 1.00 C ATOM 215 CG TYR A 16 -3.606 2.772 -1.526 1.00 1.00 C ATOM 216 CD1 TYR A 16 -2.383 3.439 -1.663 1.00 1.00 C ATOM 217 CD2 TYR A 16 -4.769 3.325 -2.077 1.00 1.00 C ATOM 218 CE1 TYR A 16 -2.322 4.657 -2.349 1.00 1.00 C ATOM 219 CE2 TYR A 16 -4.709 4.542 -2.764 1.00 1.00 C ATOM 220 CZ TYR A 16 -3.485 5.209 -2.901 1.00 1.00 C ATOM 221 OH TYR A 16 -3.424 6.410 -3.577 1.00 1.00 O ATOM 0 H TYR A 16 -4.184 0.555 -3.206 1.00 1.00 H new ATOM 0 HA TYR A 16 -1.797 0.498 -1.328 1.00 1.00 H new ATOM 0 HB2 TYR A 16 -4.708 1.135 -0.688 1.00 1.00 H new ATOM 0 HB3 TYR A 16 -3.280 1.578 0.225 1.00 1.00 H new ATOM 0 HD1 TYR A 16 -1.486 3.013 -1.239 1.00 1.00 H new ATOM 0 HD2 TYR A 16 -5.713 2.811 -1.971 1.00 1.00 H new ATOM 0 HE1 TYR A 16 -1.378 5.172 -2.453 1.00 1.00 H new ATOM 0 HE2 TYR A 16 -5.606 4.967 -3.189 1.00 1.00 H new ATOM 0 HH TYR A 16 -4.318 6.651 -3.897 1.00 1.00 H new ATOM 231 N GLU A 17 -2.476 -1.712 -0.408 1.00 1.00 N ATOM 232 CA GLU A 17 -2.861 -3.096 -0.012 1.00 1.00 C ATOM 233 C GLU A 17 -2.919 -3.234 1.510 1.00 1.00 C ATOM 234 O GLU A 17 -1.932 -3.071 2.200 1.00 1.00 O ATOM 235 CB GLU A 17 -1.764 -3.989 -0.589 1.00 1.00 C ATOM 236 CG GLU A 17 -2.139 -4.402 -2.014 1.00 1.00 C ATOM 237 CD GLU A 17 -3.044 -5.634 -1.966 1.00 1.00 C ATOM 238 OE1 GLU A 17 -4.239 -5.461 -1.792 1.00 1.00 O ATOM 239 OE2 GLU A 17 -2.527 -6.731 -2.105 1.00 1.00 O ATOM 0 H GLU A 17 -1.565 -1.397 -0.074 1.00 1.00 H new ATOM 0 HA GLU A 17 -3.850 -3.364 -0.383 1.00 1.00 H new ATOM 0 HB2 GLU A 17 -0.812 -3.458 -0.591 1.00 1.00 H new ATOM 0 HB3 GLU A 17 -1.634 -4.873 0.035 1.00 1.00 H new ATOM 0 HG2 GLU A 17 -2.649 -3.582 -2.519 1.00 1.00 H new ATOM 0 HG3 GLU A 17 -1.239 -4.620 -2.589 1.00 1.00 H new ATOM 246 N PHE A 18 -4.071 -3.550 2.032 1.00 1.00 N ATOM 247 CA PHE A 18 -4.209 -3.717 3.507 1.00 1.00 C ATOM 248 C PHE A 18 -4.879 -5.060 3.810 1.00 1.00 C ATOM 249 O PHE A 18 -5.763 -5.495 3.097 1.00 1.00 O ATOM 250 CB PHE A 18 -5.095 -2.557 3.961 1.00 1.00 C ATOM 251 CG PHE A 18 -5.476 -2.753 5.408 1.00 1.00 C ATOM 252 CD1 PHE A 18 -4.628 -2.297 6.424 1.00 1.00 C ATOM 253 CD2 PHE A 18 -6.677 -3.393 5.735 1.00 1.00 C ATOM 254 CE1 PHE A 18 -4.981 -2.479 7.767 1.00 1.00 C ATOM 255 CE2 PHE A 18 -7.031 -3.577 7.077 1.00 1.00 C ATOM 256 CZ PHE A 18 -6.182 -3.120 8.093 1.00 1.00 C ATOM 0 H PHE A 18 -4.927 -3.701 1.499 1.00 1.00 H new ATOM 0 HA PHE A 18 -3.248 -3.710 4.021 1.00 1.00 H new ATOM 0 HB2 PHE A 18 -4.567 -1.612 3.838 1.00 1.00 H new ATOM 0 HB3 PHE A 18 -5.990 -2.505 3.342 1.00 1.00 H new ATOM 0 HD1 PHE A 18 -3.701 -1.804 6.172 1.00 1.00 H new ATOM 0 HD2 PHE A 18 -7.331 -3.745 4.951 1.00 1.00 H new ATOM 0 HE1 PHE A 18 -4.327 -2.125 8.550 1.00 1.00 H new ATOM 0 HE2 PHE A 18 -7.958 -4.071 7.329 1.00 1.00 H new ATOM 0 HZ PHE A 18 -6.454 -3.262 9.128 1.00 1.00 H new ATOM 266 N ILE A 19 -4.469 -5.723 4.855 1.00 1.00 N ATOM 267 CA ILE A 19 -5.089 -7.038 5.190 1.00 1.00 C ATOM 268 C ILE A 19 -6.439 -6.829 5.874 1.00 1.00 C ATOM 269 O ILE A 19 -6.564 -6.058 6.804 1.00 1.00 O ATOM 270 CB ILE A 19 -4.101 -7.712 6.142 1.00 1.00 C ATOM 271 CG1 ILE A 19 -2.700 -7.684 5.526 1.00 1.00 C ATOM 272 CG2 ILE A 19 -4.525 -9.162 6.376 1.00 1.00 C ATOM 273 CD1 ILE A 19 -2.499 -8.929 4.659 1.00 1.00 C ATOM 0 H ILE A 19 -3.734 -5.414 5.491 1.00 1.00 H new ATOM 0 HA ILE A 19 -5.276 -7.643 4.303 1.00 1.00 H new ATOM 0 HB ILE A 19 -4.092 -7.179 7.093 1.00 1.00 H new ATOM 0 HG12 ILE A 19 -2.574 -6.784 4.924 1.00 1.00 H new ATOM 0 HG13 ILE A 19 -1.946 -7.650 6.312 1.00 1.00 H new ATOM 0 HG21 ILE A 19 -3.820 -9.642 7.055 1.00 1.00 H new ATOM 0 HG22 ILE A 19 -5.523 -9.183 6.814 1.00 1.00 H new ATOM 0 HG23 ILE A 19 -4.535 -9.696 5.426 1.00 1.00 H new ATOM 0 HD11 ILE A 19 -1.501 -8.910 4.220 1.00 1.00 H new ATOM 0 HD12 ILE A 19 -2.607 -9.822 5.274 1.00 1.00 H new ATOM 0 HD13 ILE A 19 -3.245 -8.943 3.864 1.00 1.00 H new ATOM 285 N HIS A 20 -7.450 -7.516 5.421 1.00 1.00 N ATOM 286 CA HIS A 20 -8.795 -7.366 6.045 1.00 1.00 C ATOM 287 C HIS A 20 -9.576 -8.676 5.914 1.00 1.00 C ATOM 288 O HIS A 20 -9.020 -9.752 6.012 1.00 1.00 O ATOM 289 CB HIS A 20 -9.478 -6.251 5.254 1.00 1.00 C ATOM 290 CG HIS A 20 -10.884 -6.068 5.756 1.00 1.00 C ATOM 291 ND1 HIS A 20 -11.282 -6.503 7.010 1.00 1.00 N ATOM 292 CD2 HIS A 20 -11.996 -5.500 5.185 1.00 1.00 C ATOM 293 CE1 HIS A 20 -12.584 -6.192 7.152 1.00 1.00 C ATOM 294 NE2 HIS A 20 -13.068 -5.580 6.068 1.00 1.00 N ATOM 0 H HIS A 20 -7.403 -8.176 4.645 1.00 1.00 H new ATOM 0 HA HIS A 20 -8.738 -7.130 7.108 1.00 1.00 H new ATOM 0 HB2 HIS A 20 -8.919 -5.321 5.359 1.00 1.00 H new ATOM 0 HB3 HIS A 20 -9.489 -6.498 4.192 1.00 1.00 H new ATOM 0 HD1 HIS A 20 -10.695 -6.973 7.700 1.00 1.00 H new ATOM 0 HD2 HIS A 20 -12.033 -5.058 4.200 1.00 1.00 H new ATOM 0 HE1 HIS A 20 -13.166 -6.411 8.035 1.00 1.00 H new ATOM 302 N SER A 21 -10.856 -8.597 5.680 1.00 1.00 N ATOM 303 CA SER A 21 -11.658 -9.844 5.532 1.00 1.00 C ATOM 304 C SER A 21 -11.178 -10.621 4.305 1.00 1.00 C ATOM 305 O SER A 21 -11.109 -11.833 4.309 1.00 1.00 O ATOM 306 CB SER A 21 -13.099 -9.374 5.342 1.00 1.00 C ATOM 307 OG SER A 21 -13.128 -8.316 4.392 1.00 1.00 O ATOM 0 H SER A 21 -11.380 -7.727 5.585 1.00 1.00 H new ATOM 0 HA SER A 21 -11.563 -10.506 6.393 1.00 1.00 H new ATOM 0 HB2 SER A 21 -13.721 -10.201 5.001 1.00 1.00 H new ATOM 0 HB3 SER A 21 -13.511 -9.036 6.293 1.00 1.00 H new ATOM 0 HG SER A 21 -13.537 -8.634 3.560 1.00 1.00 H new ATOM 313 N THR A 22 -10.834 -9.924 3.256 1.00 1.00 N ATOM 314 CA THR A 22 -10.344 -10.611 2.029 1.00 1.00 C ATOM 315 C THR A 22 -8.816 -10.640 2.035 1.00 1.00 C ATOM 316 O THR A 22 -8.185 -10.927 1.037 1.00 1.00 O ATOM 317 CB THR A 22 -10.866 -9.766 0.867 1.00 1.00 C ATOM 318 OG1 THR A 22 -9.788 -9.440 -0.001 1.00 1.00 O ATOM 319 CG2 THR A 22 -11.494 -8.482 1.408 1.00 1.00 C ATOM 0 H THR A 22 -10.872 -8.906 3.197 1.00 1.00 H new ATOM 0 HA THR A 22 -10.686 -11.644 1.959 1.00 1.00 H new ATOM 0 HB THR A 22 -11.619 -10.331 0.317 1.00 1.00 H new ATOM 0 HG1 THR A 22 -9.278 -10.251 -0.208 1.00 1.00 H new ATOM 0 HG21 THR A 22 -11.866 -7.881 0.578 1.00 1.00 H new ATOM 0 HG22 THR A 22 -12.321 -8.733 2.073 1.00 1.00 H new ATOM 0 HG23 THR A 22 -10.744 -7.915 1.960 1.00 1.00 H new ATOM 327 N GLY A 23 -8.219 -10.332 3.152 1.00 1.00 N ATOM 328 CA GLY A 23 -6.732 -10.326 3.226 1.00 1.00 C ATOM 329 C GLY A 23 -6.220 -8.916 2.935 1.00 1.00 C ATOM 330 O GLY A 23 -6.517 -7.979 3.649 1.00 1.00 O ATOM 0 H GLY A 23 -8.697 -10.084 4.018 1.00 1.00 H new ATOM 0 HA2 GLY A 23 -6.404 -10.648 4.214 1.00 1.00 H new ATOM 0 HA3 GLY A 23 -6.317 -11.032 2.507 1.00 1.00 H new ATOM 334 N SER A 24 -5.455 -8.755 1.891 1.00 1.00 N ATOM 335 CA SER A 24 -4.923 -7.402 1.555 1.00 1.00 C ATOM 336 C SER A 24 -5.863 -6.683 0.586 1.00 1.00 C ATOM 337 O SER A 24 -6.499 -7.294 -0.250 1.00 1.00 O ATOM 338 CB SER A 24 -3.570 -7.664 0.896 1.00 1.00 C ATOM 339 OG SER A 24 -3.015 -8.861 1.423 1.00 1.00 O ATOM 0 H SER A 24 -5.174 -9.501 1.255 1.00 1.00 H new ATOM 0 HA SER A 24 -4.834 -6.765 2.435 1.00 1.00 H new ATOM 0 HB2 SER A 24 -3.689 -7.750 -0.184 1.00 1.00 H new ATOM 0 HB3 SER A 24 -2.896 -6.827 1.077 1.00 1.00 H new ATOM 0 HG SER A 24 -2.147 -9.033 1.001 1.00 1.00 H new ATOM 345 N ILE A 25 -5.950 -5.386 0.691 1.00 1.00 N ATOM 346 CA ILE A 25 -6.843 -4.620 -0.223 1.00 1.00 C ATOM 347 C ILE A 25 -6.014 -3.665 -1.084 1.00 1.00 C ATOM 348 O ILE A 25 -5.252 -2.863 -0.580 1.00 1.00 O ATOM 349 CB ILE A 25 -7.779 -3.838 0.698 1.00 1.00 C ATOM 350 CG1 ILE A 25 -8.370 -4.784 1.744 1.00 1.00 C ATOM 351 CG2 ILE A 25 -8.912 -3.224 -0.128 1.00 1.00 C ATOM 352 CD1 ILE A 25 -8.880 -3.971 2.936 1.00 1.00 C ATOM 0 H ILE A 25 -5.440 -4.823 1.372 1.00 1.00 H new ATOM 0 HA ILE A 25 -7.394 -5.268 -0.904 1.00 1.00 H new ATOM 0 HB ILE A 25 -7.220 -3.046 1.196 1.00 1.00 H new ATOM 0 HG12 ILE A 25 -9.185 -5.362 1.308 1.00 1.00 H new ATOM 0 HG13 ILE A 25 -7.614 -5.497 2.073 1.00 1.00 H new ATOM 0 HG21 ILE A 25 -9.580 -2.666 0.528 1.00 1.00 H new ATOM 0 HG22 ILE A 25 -8.493 -2.551 -0.876 1.00 1.00 H new ATOM 0 HG23 ILE A 25 -9.471 -4.017 -0.625 1.00 1.00 H new ATOM 0 HD11 ILE A 25 -9.302 -4.645 3.682 1.00 1.00 H new ATOM 0 HD12 ILE A 25 -8.053 -3.413 3.376 1.00 1.00 H new ATOM 0 HD13 ILE A 25 -9.649 -3.275 2.600 1.00 1.00 H new ATOM 364 N MET A 26 -6.158 -3.745 -2.376 1.00 1.00 N ATOM 365 CA MET A 26 -5.379 -2.844 -3.272 1.00 1.00 C ATOM 366 C MET A 26 -6.306 -1.828 -3.946 1.00 1.00 C ATOM 367 O MET A 26 -7.290 -2.184 -4.566 1.00 1.00 O ATOM 368 CB MET A 26 -4.748 -3.771 -4.312 1.00 1.00 C ATOM 369 CG MET A 26 -4.648 -3.045 -5.654 1.00 1.00 C ATOM 370 SD MET A 26 -4.015 -4.186 -6.909 1.00 1.00 S ATOM 371 CE MET A 26 -4.368 -3.156 -8.354 1.00 1.00 C ATOM 0 H MET A 26 -6.782 -4.396 -2.852 1.00 1.00 H new ATOM 0 HA MET A 26 -4.629 -2.270 -2.728 1.00 1.00 H new ATOM 0 HB2 MET A 26 -3.757 -4.084 -3.982 1.00 1.00 H new ATOM 0 HB3 MET A 26 -5.348 -4.675 -4.420 1.00 1.00 H new ATOM 0 HG2 MET A 26 -5.627 -2.668 -5.950 1.00 1.00 H new ATOM 0 HG3 MET A 26 -3.988 -2.182 -5.565 1.00 1.00 H new ATOM 0 HE1 MET A 26 -4.790 -3.774 -9.147 1.00 1.00 H new ATOM 0 HE2 MET A 26 -5.082 -2.379 -8.081 1.00 1.00 H new ATOM 0 HE3 MET A 26 -3.445 -2.694 -8.706 1.00 1.00 H new ATOM 381 N LYS A 27 -6.001 -0.565 -3.829 1.00 1.00 N ATOM 382 CA LYS A 27 -6.862 0.478 -4.459 1.00 1.00 C ATOM 383 C LYS A 27 -6.310 0.863 -5.836 1.00 1.00 C ATOM 384 O LYS A 27 -5.118 0.842 -6.067 1.00 1.00 O ATOM 385 CB LYS A 27 -6.803 1.669 -3.503 1.00 1.00 C ATOM 386 CG LYS A 27 -7.870 1.506 -2.419 1.00 1.00 C ATOM 387 CD LYS A 27 -7.278 0.750 -1.228 1.00 1.00 C ATOM 388 CE LYS A 27 -7.395 1.610 0.031 1.00 1.00 C ATOM 389 NZ LYS A 27 -5.991 1.872 0.450 1.00 1.00 N ATOM 0 H LYS A 27 -5.190 -0.208 -3.323 1.00 1.00 H new ATOM 0 HA LYS A 27 -7.883 0.131 -4.615 1.00 1.00 H new ATOM 0 HB2 LYS A 27 -5.815 1.735 -3.048 1.00 1.00 H new ATOM 0 HB3 LYS A 27 -6.965 2.597 -4.051 1.00 1.00 H new ATOM 0 HG2 LYS A 27 -8.231 2.484 -2.099 1.00 1.00 H new ATOM 0 HG3 LYS A 27 -8.728 0.964 -2.817 1.00 1.00 H new ATOM 0 HD2 LYS A 27 -7.803 -0.195 -1.086 1.00 1.00 H new ATOM 0 HD3 LYS A 27 -6.233 0.508 -1.420 1.00 1.00 H new ATOM 0 HE2 LYS A 27 -7.926 2.540 -0.174 1.00 1.00 H new ATOM 0 HE3 LYS A 27 -7.950 1.092 0.813 1.00 1.00 H new ATOM 0 HZ1 LYS A 27 -5.988 2.370 1.363 1.00 1.00 H new ATOM 0 HZ2 LYS A 27 -5.483 0.969 0.546 1.00 1.00 H new ATOM 0 HZ3 LYS A 27 -5.519 2.460 -0.266 1.00 1.00 H new ATOM 402 N ARG A 28 -7.171 1.210 -6.754 1.00 1.00 N ATOM 403 CA ARG A 28 -6.697 1.590 -8.118 1.00 1.00 C ATOM 404 C ARG A 28 -6.202 3.039 -8.135 1.00 1.00 C ATOM 405 O ARG A 28 -6.965 3.970 -7.968 1.00 1.00 O ATOM 406 CB ARG A 28 -7.922 1.435 -9.019 1.00 1.00 C ATOM 407 CG ARG A 28 -7.898 2.514 -10.104 1.00 1.00 C ATOM 408 CD ARG A 28 -7.144 1.992 -11.329 1.00 1.00 C ATOM 409 NE ARG A 28 -8.104 2.131 -12.458 1.00 1.00 N ATOM 410 CZ ARG A 28 -8.203 1.184 -13.350 1.00 1.00 C ATOM 411 NH1 ARG A 28 -7.459 0.115 -13.254 1.00 1.00 N ATOM 412 NH2 ARG A 28 -9.047 1.304 -14.340 1.00 1.00 N ATOM 0 H ARG A 28 -8.181 1.247 -6.620 1.00 1.00 H new ATOM 0 HA ARG A 28 -5.862 0.971 -8.446 1.00 1.00 H new ATOM 0 HB2 ARG A 28 -7.928 0.445 -9.476 1.00 1.00 H new ATOM 0 HB3 ARG A 28 -8.834 1.519 -8.428 1.00 1.00 H new ATOM 0 HG2 ARG A 28 -8.916 2.789 -10.381 1.00 1.00 H new ATOM 0 HG3 ARG A 28 -7.416 3.415 -9.725 1.00 1.00 H new ATOM 0 HD2 ARG A 28 -6.236 2.568 -11.509 1.00 1.00 H new ATOM 0 HD3 ARG A 28 -6.841 0.954 -11.194 1.00 1.00 H new ATOM 0 HE ARG A 28 -8.684 2.966 -12.534 1.00 1.00 H new ATOM 0 HH11 ARG A 28 -6.800 0.020 -12.481 1.00 1.00 H new ATOM 0 HH12 ARG A 28 -7.537 -0.625 -13.952 1.00 1.00 H new ATOM 0 HH21 ARG A 28 -9.629 2.138 -14.416 1.00 1.00 H new ATOM 0 HH22 ARG A 28 -9.124 0.563 -15.037 1.00 1.00 H new ATOM 425 N LYS A 29 -4.928 3.235 -8.341 1.00 1.00 N ATOM 426 CA LYS A 29 -4.379 4.622 -8.378 1.00 1.00 C ATOM 427 C LYS A 29 -5.059 5.430 -9.485 1.00 1.00 C ATOM 428 O LYS A 29 -5.197 6.633 -9.394 1.00 1.00 O ATOM 429 CB LYS A 29 -2.895 4.452 -8.679 1.00 1.00 C ATOM 430 CG LYS A 29 -2.069 5.032 -7.531 1.00 1.00 C ATOM 431 CD LYS A 29 -1.100 6.081 -8.077 1.00 1.00 C ATOM 432 CE LYS A 29 -1.005 7.252 -7.096 1.00 1.00 C ATOM 433 NZ LYS A 29 -0.480 8.389 -7.903 1.00 1.00 N ATOM 0 H LYS A 29 -4.242 2.494 -8.486 1.00 1.00 H new ATOM 0 HA LYS A 29 -4.547 5.157 -7.443 1.00 1.00 H new ATOM 0 HB2 LYS A 29 -2.659 3.396 -8.813 1.00 1.00 H new ATOM 0 HB3 LYS A 29 -2.643 4.955 -9.612 1.00 1.00 H new ATOM 0 HG2 LYS A 29 -2.727 5.482 -6.787 1.00 1.00 H new ATOM 0 HG3 LYS A 29 -1.516 4.238 -7.029 1.00 1.00 H new ATOM 0 HD2 LYS A 29 -0.115 5.638 -8.227 1.00 1.00 H new ATOM 0 HD3 LYS A 29 -1.442 6.435 -9.050 1.00 1.00 H new ATOM 0 HE2 LYS A 29 -1.979 7.488 -6.668 1.00 1.00 H new ATOM 0 HE3 LYS A 29 -0.340 7.018 -6.265 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 -0.387 9.230 -7.298 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 0.451 8.138 -8.292 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 -1.137 8.594 -8.683 1.00 1.00 H new ATOM 446 N LYS A 30 -5.484 4.777 -10.531 1.00 1.00 N ATOM 447 CA LYS A 30 -6.149 5.510 -11.645 1.00 1.00 C ATOM 448 C LYS A 30 -7.127 6.539 -11.076 1.00 1.00 C ATOM 449 O LYS A 30 -6.934 7.731 -11.204 1.00 1.00 O ATOM 450 CB LYS A 30 -6.897 4.438 -12.438 1.00 1.00 C ATOM 451 CG LYS A 30 -5.920 3.711 -13.363 1.00 1.00 C ATOM 452 CD LYS A 30 -5.187 4.733 -14.235 1.00 1.00 C ATOM 453 CE LYS A 30 -5.445 4.423 -15.711 1.00 1.00 C ATOM 454 NZ LYS A 30 -6.500 5.387 -16.128 1.00 1.00 N ATOM 0 H LYS A 30 -5.400 3.769 -10.663 1.00 1.00 H new ATOM 0 HA LYS A 30 -5.439 6.051 -12.270 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -7.366 3.728 -11.757 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -7.696 4.894 -13.022 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -5.203 3.138 -12.775 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -6.457 3.000 -13.991 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -5.529 5.741 -13.999 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -4.117 4.703 -14.028 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -4.539 4.548 -16.305 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -5.776 3.393 -15.846 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -6.731 5.236 -17.131 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -7.352 5.240 -15.550 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -6.155 6.359 -15.995 1.00 1.00 H new ATOM 467 N ASP A 31 -8.166 6.087 -10.435 1.00 1.00 N ATOM 468 CA ASP A 31 -9.146 7.039 -9.843 1.00 1.00 C ATOM 469 C ASP A 31 -9.049 6.988 -8.319 1.00 1.00 C ATOM 470 O ASP A 31 -8.921 8.001 -7.658 1.00 1.00 O ATOM 471 CB ASP A 31 -10.515 6.546 -10.312 1.00 1.00 C ATOM 472 CG ASP A 31 -11.405 7.746 -10.643 1.00 1.00 C ATOM 473 OD1 ASP A 31 -10.998 8.551 -11.466 1.00 1.00 O ATOM 474 OD2 ASP A 31 -12.476 7.840 -10.069 1.00 1.00 O ATOM 0 H ASP A 31 -8.380 5.100 -10.295 1.00 1.00 H new ATOM 0 HA ASP A 31 -8.966 8.070 -10.147 1.00 1.00 H new ATOM 0 HB2 ASP A 31 -10.403 5.910 -11.190 1.00 1.00 H new ATOM 0 HB3 ASP A 31 -10.980 5.938 -9.536 1.00 1.00 H new ATOM 479 N ASP A 32 -9.110 5.812 -7.757 1.00 1.00 N ATOM 480 CA ASP A 32 -9.023 5.682 -6.275 1.00 1.00 C ATOM 481 C ASP A 32 -10.182 4.827 -5.760 1.00 1.00 C ATOM 482 O ASP A 32 -10.860 5.182 -4.816 1.00 1.00 O ATOM 483 CB ASP A 32 -9.129 7.112 -5.742 1.00 1.00 C ATOM 484 CG ASP A 32 -9.312 7.080 -4.224 1.00 1.00 C ATOM 485 OD1 ASP A 32 -8.785 6.172 -3.603 1.00 1.00 O ATOM 486 OD2 ASP A 32 -9.973 7.966 -3.707 1.00 1.00 O ATOM 0 H ASP A 32 -9.217 4.932 -8.262 1.00 1.00 H new ATOM 0 HA ASP A 32 -8.100 5.199 -5.953 1.00 1.00 H new ATOM 0 HB2 ASP A 32 -8.231 7.674 -5.999 1.00 1.00 H new ATOM 0 HB3 ASP A 32 -9.970 7.624 -6.209 1.00 1.00 H new ATOM 491 N TRP A 33 -10.415 3.700 -6.377 1.00 1.00 N ATOM 492 CA TRP A 33 -11.529 2.818 -5.930 1.00 1.00 C ATOM 493 C TRP A 33 -10.996 1.717 -5.009 1.00 1.00 C ATOM 494 O TRP A 33 -9.821 1.409 -5.011 1.00 1.00 O ATOM 495 CB TRP A 33 -12.100 2.211 -7.213 1.00 1.00 C ATOM 496 CG TRP A 33 -11.750 3.082 -8.377 1.00 1.00 C ATOM 497 CD1 TRP A 33 -10.534 3.146 -8.963 1.00 1.00 C ATOM 498 CD2 TRP A 33 -12.604 4.013 -9.104 1.00 1.00 C ATOM 499 NE1 TRP A 33 -10.586 4.055 -10.005 1.00 1.00 N ATOM 500 CE2 TRP A 33 -11.841 4.615 -10.131 1.00 1.00 C ATOM 501 CE3 TRP A 33 -13.954 4.386 -8.974 1.00 1.00 C ATOM 502 CZ2 TRP A 33 -12.396 5.556 -10.999 1.00 1.00 C ATOM 503 CZ3 TRP A 33 -14.516 5.334 -9.845 1.00 1.00 C ATOM 504 CH2 TRP A 33 -13.738 5.918 -10.855 1.00 1.00 C ATOM 0 H TRP A 33 -9.880 3.352 -7.173 1.00 1.00 H new ATOM 0 HA TRP A 33 -12.285 3.366 -5.368 1.00 1.00 H new ATOM 0 HB2 TRP A 33 -11.700 1.208 -7.363 1.00 1.00 H new ATOM 0 HB3 TRP A 33 -13.183 2.113 -7.131 1.00 1.00 H new ATOM 0 HD1 TRP A 33 -9.663 2.580 -8.666 1.00 1.00 H new ATOM 0 HE1 TRP A 33 -9.794 4.283 -10.606 1.00 1.00 H new ATOM 0 HE3 TRP A 33 -14.562 3.941 -8.200 1.00 1.00 H new ATOM 0 HZ2 TRP A 33 -11.793 6.001 -11.776 1.00 1.00 H new ATOM 0 HZ3 TRP A 33 -15.553 5.615 -9.736 1.00 1.00 H new ATOM 0 HH2 TRP A 33 -14.176 6.647 -11.521 1.00 1.00 H new ATOM 515 N VAL A 34 -11.851 1.118 -4.226 1.00 1.00 N ATOM 516 CA VAL A 34 -11.392 0.033 -3.311 1.00 1.00 C ATOM 517 C VAL A 34 -12.176 -1.252 -3.591 1.00 1.00 C ATOM 518 O VAL A 34 -13.276 -1.219 -4.103 1.00 1.00 O ATOM 519 CB VAL A 34 -11.690 0.549 -1.903 1.00 1.00 C ATOM 520 CG1 VAL A 34 -13.155 0.276 -1.560 1.00 1.00 C ATOM 521 CG2 VAL A 34 -10.790 -0.171 -0.897 1.00 1.00 C ATOM 0 H VAL A 34 -12.847 1.332 -4.180 1.00 1.00 H new ATOM 0 HA VAL A 34 -10.336 -0.202 -3.441 1.00 1.00 H new ATOM 0 HB VAL A 34 -11.500 1.621 -1.861 1.00 1.00 H new ATOM 0 HG11 VAL A 34 -13.368 0.644 -0.556 1.00 1.00 H new ATOM 0 HG12 VAL A 34 -13.798 0.786 -2.277 1.00 1.00 H new ATOM 0 HG13 VAL A 34 -13.345 -0.797 -1.601 1.00 1.00 H new ATOM 0 HG21 VAL A 34 -11.001 0.196 0.108 1.00 1.00 H new ATOM 0 HG22 VAL A 34 -10.982 -1.243 -0.940 1.00 1.00 H new ATOM 0 HG23 VAL A 34 -9.745 0.021 -1.141 1.00 1.00 H new ATOM 531 N ASN A 35 -11.618 -2.384 -3.258 1.00 1.00 N ATOM 532 CA ASN A 35 -12.333 -3.670 -3.508 1.00 1.00 C ATOM 533 C ASN A 35 -13.619 -3.735 -2.680 1.00 1.00 C ATOM 534 O ASN A 35 -13.597 -4.045 -1.505 1.00 1.00 O ATOM 535 CB ASN A 35 -11.356 -4.760 -3.065 1.00 1.00 C ATOM 536 CG ASN A 35 -9.980 -4.140 -2.812 1.00 1.00 C ATOM 537 OD1 ASN A 35 -9.746 -2.995 -3.141 1.00 1.00 O ATOM 538 ND2 ASN A 35 -9.054 -4.856 -2.234 1.00 1.00 N ATOM 0 H ASN A 35 -10.699 -2.475 -2.824 1.00 1.00 H new ATOM 0 HA ASN A 35 -12.624 -3.781 -4.553 1.00 1.00 H new ATOM 0 HB2 ASN A 35 -11.721 -5.244 -2.159 1.00 1.00 H new ATOM 0 HB3 ASN A 35 -11.284 -5.532 -3.831 1.00 1.00 H new ATOM 0 HD21 ASN A 35 -8.133 -4.454 -2.059 1.00 1.00 H new ATOM 0 HD22 ASN A 35 -9.251 -5.818 -1.958 1.00 1.00 H new ATOM 545 N ALA A 36 -14.741 -3.446 -3.282 1.00 1.00 N ATOM 546 CA ALA A 36 -16.027 -3.494 -2.528 1.00 1.00 C ATOM 547 C ALA A 36 -16.094 -4.763 -1.673 1.00 1.00 C ATOM 548 O ALA A 36 -16.801 -4.818 -0.686 1.00 1.00 O ATOM 549 CB ALA A 36 -17.117 -3.513 -3.600 1.00 1.00 C ATOM 0 H ALA A 36 -14.823 -3.179 -4.263 1.00 1.00 H new ATOM 0 HA ALA A 36 -16.137 -2.648 -1.850 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -18.096 -3.548 -3.123 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -17.043 -2.613 -4.210 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -16.990 -4.391 -4.233 1.00 1.00 H new ATOM 555 N THR A 37 -15.360 -5.781 -2.035 1.00 1.00 N ATOM 556 CA THR A 37 -15.386 -7.033 -1.226 1.00 1.00 C ATOM 557 C THR A 37 -14.901 -6.733 0.191 1.00 1.00 C ATOM 558 O THR A 37 -15.503 -7.137 1.166 1.00 1.00 O ATOM 559 CB THR A 37 -14.428 -7.994 -1.931 1.00 1.00 C ATOM 560 OG1 THR A 37 -14.782 -8.093 -3.302 1.00 1.00 O ATOM 561 CG2 THR A 37 -14.520 -9.372 -1.275 1.00 1.00 C ATOM 0 H THR A 37 -14.747 -5.800 -2.850 1.00 1.00 H new ATOM 0 HA THR A 37 -16.387 -7.457 -1.147 1.00 1.00 H new ATOM 0 HB THR A 37 -13.407 -7.620 -1.848 1.00 1.00 H new ATOM 0 HG1 THR A 37 -14.167 -8.707 -3.755 1.00 1.00 H new ATOM 0 HG21 THR A 37 -13.838 -10.059 -1.775 1.00 1.00 H new ATOM 0 HG22 THR A 37 -14.248 -9.293 -0.223 1.00 1.00 H new ATOM 0 HG23 THR A 37 -15.540 -9.747 -1.359 1.00 1.00 H new ATOM 569 N HIS A 38 -13.823 -6.008 0.312 1.00 1.00 N ATOM 570 CA HIS A 38 -13.311 -5.661 1.666 1.00 1.00 C ATOM 571 C HIS A 38 -14.354 -4.808 2.386 1.00 1.00 C ATOM 572 O HIS A 38 -14.460 -4.816 3.596 1.00 1.00 O ATOM 573 CB HIS A 38 -12.033 -4.860 1.417 1.00 1.00 C ATOM 574 CG HIS A 38 -10.839 -5.751 1.617 1.00 1.00 C ATOM 575 ND1 HIS A 38 -10.380 -6.607 0.627 1.00 1.00 N ATOM 576 CD2 HIS A 38 -10.001 -5.934 2.687 1.00 1.00 C ATOM 577 CE1 HIS A 38 -9.311 -7.259 1.119 1.00 1.00 C ATOM 578 NE2 HIS A 38 -9.036 -6.886 2.372 1.00 1.00 N ATOM 0 H HIS A 38 -13.276 -5.642 -0.467 1.00 1.00 H new ATOM 0 HA HIS A 38 -13.115 -6.536 2.285 1.00 1.00 H new ATOM 0 HB2 HIS A 38 -12.035 -4.457 0.404 1.00 1.00 H new ATOM 0 HB3 HIS A 38 -11.985 -4.010 2.098 1.00 1.00 H new ATOM 0 HD2 HIS A 38 -10.078 -5.417 3.632 1.00 1.00 H new ATOM 0 HE1 HIS A 38 -8.744 -7.995 0.568 1.00 1.00 H new ATOM 0 HE2 HIS A 38 -8.282 -7.226 2.969 1.00 1.00 H new ATOM 586 N ILE A 39 -15.135 -4.080 1.635 1.00 1.00 N ATOM 587 CA ILE A 39 -16.191 -3.228 2.245 1.00 1.00 C ATOM 588 C ILE A 39 -17.490 -4.028 2.360 1.00 1.00 C ATOM 589 O ILE A 39 -18.110 -4.087 3.403 1.00 1.00 O ATOM 590 CB ILE A 39 -16.362 -2.067 1.268 1.00 1.00 C ATOM 591 CG1 ILE A 39 -15.457 -0.908 1.690 1.00 1.00 C ATOM 592 CG2 ILE A 39 -17.819 -1.605 1.266 1.00 1.00 C ATOM 593 CD1 ILE A 39 -14.230 -0.869 0.778 1.00 1.00 C ATOM 0 H ILE A 39 -15.085 -4.040 0.617 1.00 1.00 H new ATOM 0 HA ILE A 39 -15.933 -2.884 3.246 1.00 1.00 H new ATOM 0 HB ILE A 39 -16.088 -2.395 0.265 1.00 1.00 H new ATOM 0 HG12 ILE A 39 -16.001 0.035 1.628 1.00 1.00 H new ATOM 0 HG13 ILE A 39 -15.149 -1.031 2.728 1.00 1.00 H new ATOM 0 HG21 ILE A 39 -17.937 -0.776 0.568 1.00 1.00 H new ATOM 0 HG22 ILE A 39 -18.462 -2.431 0.961 1.00 1.00 H new ATOM 0 HG23 ILE A 39 -18.098 -1.278 2.268 1.00 1.00 H new ATOM 0 HD11 ILE A 39 -13.582 -0.044 1.075 1.00 1.00 H new ATOM 0 HD12 ILE A 39 -13.684 -1.808 0.863 1.00 1.00 H new ATOM 0 HD13 ILE A 39 -14.549 -0.726 -0.255 1.00 1.00 H new ATOM 605 N LEU A 40 -17.895 -4.656 1.290 1.00 1.00 N ATOM 606 CA LEU A 40 -19.143 -5.468 1.324 1.00 1.00 C ATOM 607 C LEU A 40 -18.812 -6.912 1.709 1.00 1.00 C ATOM 608 O LEU A 40 -19.409 -7.481 2.602 1.00 1.00 O ATOM 609 CB LEU A 40 -19.701 -5.403 -0.097 1.00 1.00 C ATOM 610 CG LEU A 40 -21.120 -4.835 -0.062 1.00 1.00 C ATOM 611 CD1 LEU A 40 -21.917 -5.522 1.048 1.00 1.00 C ATOM 612 CD2 LEU A 40 -21.060 -3.331 0.213 1.00 1.00 C ATOM 0 H LEU A 40 -17.413 -4.641 0.391 1.00 1.00 H new ATOM 0 HA LEU A 40 -19.861 -5.097 2.055 1.00 1.00 H new ATOM 0 HB2 LEU A 40 -19.063 -4.778 -0.721 1.00 1.00 H new ATOM 0 HB3 LEU A 40 -19.707 -6.398 -0.543 1.00 1.00 H new ATOM 0 HG LEU A 40 -21.605 -5.011 -1.022 1.00 1.00 H new ATOM 0 HD11 LEU A 40 -22.929 -5.117 1.073 1.00 1.00 H new ATOM 0 HD12 LEU A 40 -21.960 -6.594 0.855 1.00 1.00 H new ATOM 0 HD13 LEU A 40 -21.431 -5.345 2.008 1.00 1.00 H new ATOM 0 HD21 LEU A 40 -22.071 -2.925 0.238 1.00 1.00 H new ATOM 0 HD22 LEU A 40 -20.575 -3.156 1.173 1.00 1.00 H new ATOM 0 HD23 LEU A 40 -20.491 -2.839 -0.576 1.00 1.00 H new ATOM 624 N LYS A 41 -17.854 -7.503 1.048 1.00 1.00 N ATOM 625 CA LYS A 41 -17.475 -8.906 1.379 1.00 1.00 C ATOM 626 C LYS A 41 -16.863 -8.959 2.780 1.00 1.00 C ATOM 627 O LYS A 41 -16.894 -9.974 3.447 1.00 1.00 O ATOM 628 CB LYS A 41 -16.439 -9.296 0.325 1.00 1.00 C ATOM 629 CG LYS A 41 -15.392 -10.220 0.953 1.00 1.00 C ATOM 630 CD LYS A 41 -15.240 -11.477 0.094 1.00 1.00 C ATOM 631 CE LYS A 41 -13.887 -12.132 0.380 1.00 1.00 C ATOM 632 NZ LYS A 41 -13.760 -12.120 1.863 1.00 1.00 N ATOM 0 H LYS A 41 -17.318 -7.075 0.293 1.00 1.00 H new ATOM 0 HA LYS A 41 -18.330 -9.582 1.375 1.00 1.00 H new ATOM 0 HB2 LYS A 41 -16.927 -9.797 -0.511 1.00 1.00 H new ATOM 0 HB3 LYS A 41 -15.958 -8.403 -0.075 1.00 1.00 H new ATOM 0 HG2 LYS A 41 -14.436 -9.703 1.032 1.00 1.00 H new ATOM 0 HG3 LYS A 41 -15.692 -10.492 1.965 1.00 1.00 H new ATOM 0 HD2 LYS A 41 -16.047 -12.177 0.309 1.00 1.00 H new ATOM 0 HD3 LYS A 41 -15.315 -11.219 -0.962 1.00 1.00 H new ATOM 0 HE2 LYS A 41 -13.850 -13.149 -0.011 1.00 1.00 H new ATOM 0 HE3 LYS A 41 -13.074 -11.580 -0.090 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 -13.121 -12.884 2.163 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 -13.374 -11.205 2.171 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 -14.696 -12.263 2.293 1.00 1.00 H new ATOM 645 N ALA A 42 -16.313 -7.866 3.230 1.00 1.00 N ATOM 646 CA ALA A 42 -15.705 -7.843 4.589 1.00 1.00 C ATOM 647 C ALA A 42 -16.805 -7.953 5.648 1.00 1.00 C ATOM 648 O ALA A 42 -16.569 -8.380 6.761 1.00 1.00 O ATOM 649 CB ALA A 42 -14.998 -6.491 4.685 1.00 1.00 C ATOM 0 H ALA A 42 -16.258 -6.987 2.715 1.00 1.00 H new ATOM 0 HA ALA A 42 -15.015 -8.671 4.753 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -14.523 -6.397 5.662 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -14.240 -6.420 3.905 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -15.726 -5.690 4.557 1.00 1.00 H new ATOM 655 N ALA A 43 -18.004 -7.568 5.308 1.00 1.00 N ATOM 656 CA ALA A 43 -19.120 -7.647 6.293 1.00 1.00 C ATOM 657 C ALA A 43 -20.262 -8.506 5.740 1.00 1.00 C ATOM 658 O ALA A 43 -21.332 -8.570 6.313 1.00 1.00 O ATOM 659 CB ALA A 43 -19.581 -6.203 6.485 1.00 1.00 C ATOM 0 H ALA A 43 -18.260 -7.202 4.391 1.00 1.00 H new ATOM 0 HA ALA A 43 -18.808 -8.105 7.231 1.00 1.00 H new ATOM 0 HB1 ALA A 43 -20.404 -6.176 7.199 1.00 1.00 H new ATOM 0 HB2 ALA A 43 -18.753 -5.604 6.863 1.00 1.00 H new ATOM 0 HB3 ALA A 43 -19.916 -5.798 5.530 1.00 1.00 H new ATOM 665 N ASN A 44 -20.048 -9.166 4.634 1.00 1.00 N ATOM 666 CA ASN A 44 -21.131 -10.013 4.058 1.00 1.00 C ATOM 667 C ASN A 44 -20.534 -11.150 3.225 1.00 1.00 C ATOM 668 O ASN A 44 -21.207 -11.756 2.413 1.00 1.00 O ATOM 669 CB ASN A 44 -21.945 -9.070 3.173 1.00 1.00 C ATOM 670 CG ASN A 44 -21.020 -8.392 2.161 1.00 1.00 C ATOM 671 OD1 ASN A 44 -21.303 -7.306 1.694 1.00 1.00 O ATOM 672 ND2 ASN A 44 -19.918 -8.990 1.797 1.00 1.00 N ATOM 0 H ASN A 44 -19.175 -9.156 4.107 1.00 1.00 H new ATOM 0 HA ASN A 44 -21.743 -10.477 4.831 1.00 1.00 H new ATOM 0 HB2 ASN A 44 -22.725 -9.626 2.653 1.00 1.00 H new ATOM 0 HB3 ASN A 44 -22.443 -8.319 3.786 1.00 1.00 H new ATOM 0 HD21 ASN A 44 -19.296 -8.546 1.122 1.00 1.00 H new ATOM 0 HD22 ASN A 44 -19.679 -9.901 2.188 1.00 1.00 H new ATOM 679 N PHE A 45 -19.277 -11.449 3.415 1.00 1.00 N ATOM 680 CA PHE A 45 -18.650 -12.548 2.628 1.00 1.00 C ATOM 681 C PHE A 45 -19.070 -12.441 1.159 1.00 1.00 C ATOM 682 O PHE A 45 -20.112 -11.905 0.841 1.00 1.00 O ATOM 683 CB PHE A 45 -19.192 -13.836 3.248 1.00 1.00 C ATOM 684 CG PHE A 45 -18.112 -14.891 3.251 1.00 1.00 C ATOM 685 CD1 PHE A 45 -16.910 -14.667 2.569 1.00 1.00 C ATOM 686 CD2 PHE A 45 -18.314 -16.096 3.935 1.00 1.00 C ATOM 687 CE1 PHE A 45 -15.910 -15.647 2.572 1.00 1.00 C ATOM 688 CE2 PHE A 45 -17.315 -17.076 3.937 1.00 1.00 C ATOM 689 CZ PHE A 45 -16.113 -16.852 3.256 1.00 1.00 C ATOM 0 H PHE A 45 -18.660 -10.981 4.079 1.00 1.00 H new ATOM 0 HA PHE A 45 -17.561 -12.512 2.654 1.00 1.00 H new ATOM 0 HB2 PHE A 45 -19.532 -13.646 4.266 1.00 1.00 H new ATOM 0 HB3 PHE A 45 -20.056 -14.187 2.684 1.00 1.00 H new ATOM 0 HD1 PHE A 45 -16.754 -13.738 2.041 1.00 1.00 H new ATOM 0 HD2 PHE A 45 -19.241 -16.269 4.461 1.00 1.00 H new ATOM 0 HE1 PHE A 45 -14.982 -15.474 2.047 1.00 1.00 H new ATOM 0 HE2 PHE A 45 -17.472 -18.005 4.464 1.00 1.00 H new ATOM 0 HZ PHE A 45 -15.342 -17.608 3.258 1.00 1.00 H new ATOM 699 N ALA A 46 -18.270 -12.946 0.260 1.00 1.00 N ATOM 700 CA ALA A 46 -18.635 -12.867 -1.184 1.00 1.00 C ATOM 701 C ALA A 46 -19.398 -14.122 -1.610 1.00 1.00 C ATOM 702 O ALA A 46 -18.819 -15.114 -2.005 1.00 1.00 O ATOM 703 CB ALA A 46 -17.304 -12.766 -1.930 1.00 1.00 C ATOM 0 H ALA A 46 -17.383 -13.408 0.461 1.00 1.00 H new ATOM 0 HA ALA A 46 -19.284 -12.017 -1.396 1.00 1.00 H new ATOM 0 HB1 ALA A 46 -17.492 -12.704 -3.002 1.00 1.00 H new ATOM 0 HB2 ALA A 46 -16.770 -11.874 -1.603 1.00 1.00 H new ATOM 0 HB3 ALA A 46 -16.700 -13.648 -1.718 1.00 1.00 H new ATOM 709 N LYS A 47 -20.696 -14.073 -1.536 1.00 1.00 N ATOM 710 CA LYS A 47 -21.522 -15.244 -1.938 1.00 1.00 C ATOM 711 C LYS A 47 -22.632 -14.771 -2.875 1.00 1.00 C ATOM 712 O LYS A 47 -22.608 -13.654 -3.354 1.00 1.00 O ATOM 713 CB LYS A 47 -22.108 -15.790 -0.635 1.00 1.00 C ATOM 714 CG LYS A 47 -23.607 -15.493 -0.581 1.00 1.00 C ATOM 715 CD LYS A 47 -24.301 -16.528 0.308 1.00 1.00 C ATOM 716 CE LYS A 47 -25.565 -15.914 0.918 1.00 1.00 C ATOM 717 NZ LYS A 47 -26.694 -16.587 0.220 1.00 1.00 N ATOM 0 H LYS A 47 -21.226 -13.264 -1.211 1.00 1.00 H new ATOM 0 HA LYS A 47 -20.949 -16.008 -2.463 1.00 1.00 H new ATOM 0 HB2 LYS A 47 -21.938 -16.865 -0.570 1.00 1.00 H new ATOM 0 HB3 LYS A 47 -21.606 -15.336 0.219 1.00 1.00 H new ATOM 0 HG2 LYS A 47 -23.776 -14.490 -0.189 1.00 1.00 H new ATOM 0 HG3 LYS A 47 -24.030 -15.518 -1.585 1.00 1.00 H new ATOM 0 HD2 LYS A 47 -24.559 -17.411 -0.277 1.00 1.00 H new ATOM 0 HD3 LYS A 47 -23.625 -16.855 1.098 1.00 1.00 H new ATOM 0 HE2 LYS A 47 -25.608 -16.085 1.994 1.00 1.00 H new ATOM 0 HE3 LYS A 47 -25.593 -14.835 0.765 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 -27.596 -16.256 0.619 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 -26.660 -16.359 -0.794 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 -26.616 -17.616 0.347 1.00 1.00 H new ATOM 730 N ALA A 48 -23.612 -15.589 -3.136 1.00 1.00 N ATOM 731 CA ALA A 48 -24.705 -15.135 -4.037 1.00 1.00 C ATOM 732 C ALA A 48 -25.216 -13.794 -3.524 1.00 1.00 C ATOM 733 O ALA A 48 -25.724 -12.978 -4.267 1.00 1.00 O ATOM 734 CB ALA A 48 -25.789 -16.209 -3.933 1.00 1.00 C ATOM 0 H ALA A 48 -23.703 -16.537 -2.771 1.00 1.00 H new ATOM 0 HA ALA A 48 -24.388 -15.004 -5.072 1.00 1.00 H new ATOM 0 HB1 ALA A 48 -26.630 -15.941 -4.573 1.00 1.00 H new ATOM 0 HB2 ALA A 48 -25.382 -17.169 -4.252 1.00 1.00 H new ATOM 0 HB3 ALA A 48 -26.129 -16.284 -2.900 1.00 1.00 H new ATOM 740 N LYS A 49 -25.047 -13.552 -2.255 1.00 1.00 N ATOM 741 CA LYS A 49 -25.478 -12.253 -1.680 1.00 1.00 C ATOM 742 C LYS A 49 -24.582 -11.140 -2.228 1.00 1.00 C ATOM 743 O LYS A 49 -25.053 -10.142 -2.739 1.00 1.00 O ATOM 744 CB LYS A 49 -25.293 -12.405 -0.170 1.00 1.00 C ATOM 745 CG LYS A 49 -26.657 -12.595 0.494 1.00 1.00 C ATOM 746 CD LYS A 49 -26.484 -12.631 2.014 1.00 1.00 C ATOM 747 CE LYS A 49 -27.837 -12.901 2.676 1.00 1.00 C ATOM 748 NZ LYS A 49 -28.738 -11.835 2.156 1.00 1.00 N ATOM 0 H LYS A 49 -24.627 -14.202 -1.590 1.00 1.00 H new ATOM 0 HA LYS A 49 -26.508 -11.998 -1.930 1.00 1.00 H new ATOM 0 HB2 LYS A 49 -24.650 -13.259 0.044 1.00 1.00 H new ATOM 0 HB3 LYS A 49 -24.798 -11.523 0.237 1.00 1.00 H new ATOM 0 HG2 LYS A 49 -27.327 -11.782 0.213 1.00 1.00 H new ATOM 0 HG3 LYS A 49 -27.116 -13.521 0.148 1.00 1.00 H new ATOM 0 HD2 LYS A 49 -25.770 -13.407 2.291 1.00 1.00 H new ATOM 0 HD3 LYS A 49 -26.077 -11.683 2.367 1.00 1.00 H new ATOM 0 HE2 LYS A 49 -28.210 -13.893 2.421 1.00 1.00 H new ATOM 0 HE3 LYS A 49 -27.761 -12.858 3.762 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 -29.521 -11.685 2.824 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 -28.202 -10.950 2.047 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 -29.121 -12.124 1.233 1.00 1.00 H new ATOM 761 N ARG A 50 -23.285 -11.308 -2.132 1.00 1.00 N ATOM 762 CA ARG A 50 -22.359 -10.264 -2.652 1.00 1.00 C ATOM 763 C ARG A 50 -22.563 -10.092 -4.156 1.00 1.00 C ATOM 764 O ARG A 50 -22.309 -9.039 -4.710 1.00 1.00 O ATOM 765 CB ARG A 50 -20.956 -10.793 -2.354 1.00 1.00 C ATOM 766 CG ARG A 50 -20.317 -9.951 -1.248 1.00 1.00 C ATOM 767 CD ARG A 50 -20.937 -10.322 0.101 1.00 1.00 C ATOM 768 NE ARG A 50 -21.950 -9.262 0.362 1.00 1.00 N ATOM 769 CZ ARG A 50 -23.118 -9.581 0.849 1.00 1.00 C ATOM 770 NH1 ARG A 50 -23.398 -10.830 1.107 1.00 1.00 N ATOM 771 NH2 ARG A 50 -24.005 -8.652 1.078 1.00 1.00 N ATOM 0 H ARG A 50 -22.832 -12.122 -1.716 1.00 1.00 H new ATOM 0 HA ARG A 50 -22.528 -9.290 -2.193 1.00 1.00 H new ATOM 0 HB2 ARG A 50 -21.007 -11.838 -2.047 1.00 1.00 H new ATOM 0 HB3 ARG A 50 -20.343 -10.755 -3.254 1.00 1.00 H new ATOM 0 HG2 ARG A 50 -19.240 -10.120 -1.224 1.00 1.00 H new ATOM 0 HG3 ARG A 50 -20.469 -8.891 -1.450 1.00 1.00 H new ATOM 0 HD2 ARG A 50 -21.398 -11.309 0.066 1.00 1.00 H new ATOM 0 HD3 ARG A 50 -20.183 -10.350 0.888 1.00 1.00 H new ATOM 0 HE ARG A 50 -21.731 -8.286 0.160 1.00 1.00 H new ATOM 0 HH11 ARG A 50 -22.704 -11.556 0.928 1.00 1.00 H new ATOM 0 HH12 ARG A 50 -24.311 -11.080 1.488 1.00 1.00 H new ATOM 0 HH21 ARG A 50 -23.786 -7.677 0.876 1.00 1.00 H new ATOM 0 HH22 ARG A 50 -24.918 -8.901 1.459 1.00 1.00 H new ATOM 784 N THR A 51 -23.032 -11.113 -4.822 1.00 1.00 N ATOM 785 CA THR A 51 -23.263 -11.000 -6.288 1.00 1.00 C ATOM 786 C THR A 51 -24.404 -10.016 -6.550 1.00 1.00 C ATOM 787 O THR A 51 -24.386 -9.267 -7.505 1.00 1.00 O ATOM 788 CB THR A 51 -23.646 -12.408 -6.744 1.00 1.00 C ATOM 789 OG1 THR A 51 -22.811 -12.797 -7.826 1.00 1.00 O ATOM 790 CG2 THR A 51 -25.107 -12.423 -7.193 1.00 1.00 C ATOM 0 H THR A 51 -23.264 -12.018 -4.414 1.00 1.00 H new ATOM 0 HA THR A 51 -22.388 -10.632 -6.824 1.00 1.00 H new ATOM 0 HB THR A 51 -23.517 -13.105 -5.916 1.00 1.00 H new ATOM 0 HG1 THR A 51 -23.054 -13.700 -8.118 1.00 1.00 H new ATOM 0 HG21 THR A 51 -25.378 -13.428 -7.518 1.00 1.00 H new ATOM 0 HG22 THR A 51 -25.746 -12.126 -6.362 1.00 1.00 H new ATOM 0 HG23 THR A 51 -25.241 -11.726 -8.020 1.00 1.00 H new ATOM 798 N ARG A 52 -25.391 -10.007 -5.697 1.00 1.00 N ATOM 799 CA ARG A 52 -26.527 -9.061 -5.888 1.00 1.00 C ATOM 800 C ARG A 52 -26.214 -7.741 -5.181 1.00 1.00 C ATOM 801 O ARG A 52 -25.982 -6.726 -5.808 1.00 1.00 O ATOM 802 CB ARG A 52 -27.732 -9.744 -5.242 1.00 1.00 C ATOM 803 CG ARG A 52 -28.962 -8.845 -5.384 1.00 1.00 C ATOM 804 CD ARG A 52 -30.150 -9.484 -4.662 1.00 1.00 C ATOM 805 NE ARG A 52 -31.277 -8.532 -4.862 1.00 1.00 N ATOM 806 CZ ARG A 52 -32.301 -8.876 -5.595 1.00 1.00 C ATOM 807 NH1 ARG A 52 -32.335 -10.054 -6.154 1.00 1.00 N ATOM 808 NH2 ARG A 52 -33.290 -8.042 -5.767 1.00 1.00 N ATOM 0 H ARG A 52 -25.460 -10.612 -4.878 1.00 1.00 H new ATOM 0 HA ARG A 52 -26.712 -8.834 -6.938 1.00 1.00 H new ATOM 0 HB2 ARG A 52 -27.916 -10.708 -5.717 1.00 1.00 H new ATOM 0 HB3 ARG A 52 -27.531 -9.941 -4.189 1.00 1.00 H new ATOM 0 HG2 ARG A 52 -28.756 -7.860 -4.965 1.00 1.00 H new ATOM 0 HG3 ARG A 52 -29.199 -8.700 -6.438 1.00 1.00 H new ATOM 0 HD2 ARG A 52 -30.383 -10.465 -5.076 1.00 1.00 H new ATOM 0 HD3 ARG A 52 -29.938 -9.628 -3.603 1.00 1.00 H new ATOM 0 HE ARG A 52 -31.249 -7.610 -4.426 1.00 1.00 H new ATOM 0 HH11 ARG A 52 -31.562 -10.705 -6.018 1.00 1.00 H new ATOM 0 HH12 ARG A 52 -33.135 -10.324 -6.727 1.00 1.00 H new ATOM 0 HH21 ARG A 52 -33.263 -7.121 -5.329 1.00 1.00 H new ATOM 0 HH22 ARG A 52 -34.090 -8.311 -6.340 1.00 1.00 H new ATOM 821 N ILE A 53 -26.203 -7.749 -3.877 1.00 1.00 N ATOM 822 CA ILE A 53 -25.904 -6.498 -3.124 1.00 1.00 C ATOM 823 C ILE A 53 -24.676 -5.805 -3.724 1.00 1.00 C ATOM 824 O ILE A 53 -24.684 -4.616 -3.969 1.00 1.00 O ATOM 825 CB ILE A 53 -25.620 -6.956 -1.693 1.00 1.00 C ATOM 826 CG1 ILE A 53 -26.921 -7.430 -1.043 1.00 1.00 C ATOM 827 CG2 ILE A 53 -25.043 -5.790 -0.888 1.00 1.00 C ATOM 828 CD1 ILE A 53 -27.943 -6.291 -1.057 1.00 1.00 C ATOM 0 H ILE A 53 -26.388 -8.569 -3.299 1.00 1.00 H new ATOM 0 HA ILE A 53 -26.725 -5.782 -3.165 1.00 1.00 H new ATOM 0 HB ILE A 53 -24.902 -7.776 -1.710 1.00 1.00 H new ATOM 0 HG12 ILE A 53 -27.315 -8.293 -1.580 1.00 1.00 H new ATOM 0 HG13 ILE A 53 -26.732 -7.751 -0.019 1.00 1.00 H new ATOM 0 HG21 ILE A 53 -24.841 -6.117 0.132 1.00 1.00 H new ATOM 0 HG22 ILE A 53 -24.116 -5.452 -1.351 1.00 1.00 H new ATOM 0 HG23 ILE A 53 -25.760 -4.970 -0.871 1.00 1.00 H new ATOM 0 HD11 ILE A 53 -28.870 -6.628 -0.594 1.00 1.00 H new ATOM 0 HD12 ILE A 53 -27.548 -5.441 -0.501 1.00 1.00 H new ATOM 0 HD13 ILE A 53 -28.140 -5.991 -2.086 1.00 1.00 H new ATOM 840 N LEU A 54 -23.629 -6.542 -3.980 1.00 1.00 N ATOM 841 CA LEU A 54 -22.416 -5.916 -4.583 1.00 1.00 C ATOM 842 C LEU A 54 -22.726 -5.477 -6.017 1.00 1.00 C ATOM 843 O LEU A 54 -22.594 -4.322 -6.370 1.00 1.00 O ATOM 844 CB LEU A 54 -21.353 -7.016 -4.572 1.00 1.00 C ATOM 845 CG LEU A 54 -20.049 -6.457 -4.002 1.00 1.00 C ATOM 846 CD1 LEU A 54 -19.736 -5.113 -4.664 1.00 1.00 C ATOM 847 CD2 LEU A 54 -20.196 -6.257 -2.492 1.00 1.00 C ATOM 0 H LEU A 54 -23.560 -7.544 -3.799 1.00 1.00 H new ATOM 0 HA LEU A 54 -22.084 -5.032 -4.038 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -21.693 -7.860 -3.971 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -21.190 -7.390 -5.583 1.00 1.00 H new ATOM 0 HG LEU A 54 -19.238 -7.158 -4.200 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -18.806 -4.715 -4.257 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -19.631 -5.253 -5.740 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -20.548 -4.413 -4.467 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -19.266 -5.859 -2.086 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -21.008 -5.557 -2.295 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -20.419 -7.213 -2.018 1.00 1.00 H new ATOM 859 N GLU A 55 -23.133 -6.402 -6.843 1.00 1.00 N ATOM 860 CA GLU A 55 -23.450 -6.058 -8.256 1.00 1.00 C ATOM 861 C GLU A 55 -24.433 -4.886 -8.306 1.00 1.00 C ATOM 862 O GLU A 55 -24.248 -3.946 -9.050 1.00 1.00 O ATOM 863 CB GLU A 55 -24.081 -7.323 -8.836 1.00 1.00 C ATOM 864 CG GLU A 55 -25.600 -7.266 -8.669 1.00 1.00 C ATOM 865 CD GLU A 55 -26.242 -6.796 -9.976 1.00 1.00 C ATOM 866 OE1 GLU A 55 -25.660 -7.040 -11.020 1.00 1.00 O ATOM 867 OE2 GLU A 55 -27.306 -6.202 -9.909 1.00 1.00 O ATOM 0 H GLU A 55 -23.260 -7.384 -6.598 1.00 1.00 H new ATOM 0 HA GLU A 55 -22.568 -5.751 -8.818 1.00 1.00 H new ATOM 0 HB2 GLU A 55 -23.825 -7.417 -9.891 1.00 1.00 H new ATOM 0 HB3 GLU A 55 -23.683 -8.203 -8.331 1.00 1.00 H new ATOM 0 HG2 GLU A 55 -25.983 -8.249 -8.397 1.00 1.00 H new ATOM 0 HG3 GLU A 55 -25.862 -6.586 -7.858 1.00 1.00 H new ATOM 874 N LYS A 56 -25.466 -4.922 -7.511 1.00 1.00 N ATOM 875 CA LYS A 56 -26.440 -3.792 -7.516 1.00 1.00 C ATOM 876 C LYS A 56 -25.800 -2.572 -6.856 1.00 1.00 C ATOM 877 O LYS A 56 -26.177 -1.444 -7.106 1.00 1.00 O ATOM 878 CB LYS A 56 -27.637 -4.287 -6.705 1.00 1.00 C ATOM 879 CG LYS A 56 -27.886 -3.339 -5.529 1.00 1.00 C ATOM 880 CD LYS A 56 -28.689 -2.129 -6.010 1.00 1.00 C ATOM 881 CE LYS A 56 -30.086 -2.163 -5.385 1.00 1.00 C ATOM 882 NZ LYS A 56 -30.156 -0.941 -4.535 1.00 1.00 N ATOM 0 H LYS A 56 -25.678 -5.679 -6.861 1.00 1.00 H new ATOM 0 HA LYS A 56 -26.740 -3.498 -8.522 1.00 1.00 H new ATOM 0 HB2 LYS A 56 -28.523 -4.338 -7.338 1.00 1.00 H new ATOM 0 HB3 LYS A 56 -27.449 -5.296 -6.339 1.00 1.00 H new ATOM 0 HG2 LYS A 56 -28.428 -3.858 -4.738 1.00 1.00 H new ATOM 0 HG3 LYS A 56 -26.937 -3.013 -5.104 1.00 1.00 H new ATOM 0 HD2 LYS A 56 -28.178 -1.207 -5.734 1.00 1.00 H new ATOM 0 HD3 LYS A 56 -28.765 -2.138 -7.097 1.00 1.00 H new ATOM 0 HE2 LYS A 56 -30.862 -2.156 -6.151 1.00 1.00 H new ATOM 0 HE3 LYS A 56 -30.231 -3.066 -4.792 1.00 1.00 H new ATOM 0 HZ1 LYS A 56 -31.086 -0.893 -4.072 1.00 1.00 H new ATOM 0 HZ2 LYS A 56 -29.410 -0.978 -3.811 1.00 1.00 H new ATOM 0 HZ3 LYS A 56 -30.021 -0.097 -5.128 1.00 1.00 H new ATOM 895 N GLU A 57 -24.817 -2.795 -6.031 1.00 1.00 N ATOM 896 CA GLU A 57 -24.127 -1.655 -5.369 1.00 1.00 C ATOM 897 C GLU A 57 -23.012 -1.153 -6.285 1.00 1.00 C ATOM 898 O GLU A 57 -22.882 0.027 -6.539 1.00 1.00 O ATOM 899 CB GLU A 57 -23.549 -2.230 -4.075 1.00 1.00 C ATOM 900 CG GLU A 57 -23.081 -1.087 -3.172 1.00 1.00 C ATOM 901 CD GLU A 57 -21.598 -0.812 -3.427 1.00 1.00 C ATOM 902 OE1 GLU A 57 -20.880 -1.756 -3.711 1.00 1.00 O ATOM 903 OE2 GLU A 57 -21.205 0.340 -3.333 1.00 1.00 O ATOM 0 H GLU A 57 -24.461 -3.719 -5.786 1.00 1.00 H new ATOM 0 HA GLU A 57 -24.791 -0.816 -5.164 1.00 1.00 H new ATOM 0 HB2 GLU A 57 -24.302 -2.828 -3.562 1.00 1.00 H new ATOM 0 HB3 GLU A 57 -22.715 -2.894 -4.301 1.00 1.00 H new ATOM 0 HG2 GLU A 57 -23.668 -0.190 -3.369 1.00 1.00 H new ATOM 0 HG3 GLU A 57 -23.239 -1.348 -2.125 1.00 1.00 H new ATOM 910 N VAL A 58 -22.208 -2.051 -6.787 1.00 1.00 N ATOM 911 CA VAL A 58 -21.100 -1.640 -7.694 1.00 1.00 C ATOM 912 C VAL A 58 -21.555 -1.709 -9.156 1.00 1.00 C ATOM 913 O VAL A 58 -21.140 -0.915 -9.978 1.00 1.00 O ATOM 914 CB VAL A 58 -19.982 -2.649 -7.435 1.00 1.00 C ATOM 915 CG1 VAL A 58 -18.651 -1.911 -7.287 1.00 1.00 C ATOM 916 CG2 VAL A 58 -20.281 -3.423 -6.150 1.00 1.00 C ATOM 0 H VAL A 58 -22.271 -3.053 -6.607 1.00 1.00 H new ATOM 0 HA VAL A 58 -20.777 -0.615 -7.511 1.00 1.00 H new ATOM 0 HB VAL A 58 -19.920 -3.344 -8.272 1.00 1.00 H new ATOM 0 HG11 VAL A 58 -17.854 -2.631 -7.102 1.00 1.00 H new ATOM 0 HG12 VAL A 58 -18.437 -1.360 -8.203 1.00 1.00 H new ATOM 0 HG13 VAL A 58 -18.712 -1.215 -6.450 1.00 1.00 H new ATOM 0 HG21 VAL A 58 -19.484 -4.143 -5.965 1.00 1.00 H new ATOM 0 HG22 VAL A 58 -20.344 -2.728 -5.313 1.00 1.00 H new ATOM 0 HG23 VAL A 58 -21.229 -3.951 -6.255 1.00 1.00 H new ATOM 926 N LEU A 59 -22.404 -2.647 -9.493 1.00 1.00 N ATOM 927 CA LEU A 59 -22.869 -2.743 -10.909 1.00 1.00 C ATOM 928 C LEU A 59 -23.239 -1.353 -11.423 1.00 1.00 C ATOM 929 O LEU A 59 -22.838 -0.948 -12.495 1.00 1.00 O ATOM 930 CB LEU A 59 -24.101 -3.647 -10.874 1.00 1.00 C ATOM 931 CG LEU A 59 -24.645 -3.815 -12.293 1.00 1.00 C ATOM 932 CD1 LEU A 59 -25.295 -2.507 -12.746 1.00 1.00 C ATOM 933 CD2 LEU A 59 -23.494 -4.166 -13.239 1.00 1.00 C ATOM 0 H LEU A 59 -22.791 -3.343 -8.856 1.00 1.00 H new ATOM 0 HA LEU A 59 -22.100 -3.142 -11.571 1.00 1.00 H new ATOM 0 HB2 LEU A 59 -23.841 -4.619 -10.454 1.00 1.00 H new ATOM 0 HB3 LEU A 59 -24.865 -3.215 -10.228 1.00 1.00 H new ATOM 0 HG LEU A 59 -25.386 -4.614 -12.308 1.00 1.00 H new ATOM 0 HD11 LEU A 59 -25.683 -2.625 -13.758 1.00 1.00 H new ATOM 0 HD12 LEU A 59 -26.112 -2.254 -12.071 1.00 1.00 H new ATOM 0 HD13 LEU A 59 -24.553 -1.708 -12.733 1.00 1.00 H new ATOM 0 HD21 LEU A 59 -23.879 -4.286 -14.252 1.00 1.00 H new ATOM 0 HD22 LEU A 59 -22.754 -3.365 -13.225 1.00 1.00 H new ATOM 0 HD23 LEU A 59 -23.028 -5.096 -12.915 1.00 1.00 H new ATOM 945 N LYS A 60 -23.980 -0.607 -10.650 1.00 1.00 N ATOM 946 CA LYS A 60 -24.347 0.769 -11.085 1.00 1.00 C ATOM 947 C LYS A 60 -23.124 1.669 -10.917 1.00 1.00 C ATOM 948 O LYS A 60 -23.110 2.813 -11.323 1.00 1.00 O ATOM 949 CB LYS A 60 -25.475 1.202 -10.148 1.00 1.00 C ATOM 950 CG LYS A 60 -26.496 2.031 -10.929 1.00 1.00 C ATOM 951 CD LYS A 60 -27.908 1.685 -10.453 1.00 1.00 C ATOM 952 CE LYS A 60 -28.760 1.255 -11.649 1.00 1.00 C ATOM 953 NZ LYS A 60 -29.997 2.078 -11.557 1.00 1.00 N ATOM 0 H LYS A 60 -24.345 -0.890 -9.741 1.00 1.00 H new ATOM 0 HA LYS A 60 -24.664 0.822 -12.126 1.00 1.00 H new ATOM 0 HB2 LYS A 60 -25.957 0.327 -9.713 1.00 1.00 H new ATOM 0 HB3 LYS A 60 -25.071 1.787 -9.321 1.00 1.00 H new ATOM 0 HG2 LYS A 60 -26.303 3.094 -10.785 1.00 1.00 H new ATOM 0 HG3 LYS A 60 -26.402 1.831 -11.996 1.00 1.00 H new ATOM 0 HD2 LYS A 60 -27.868 0.884 -9.715 1.00 1.00 H new ATOM 0 HD3 LYS A 60 -28.359 2.548 -9.963 1.00 1.00 H new ATOM 0 HE2 LYS A 60 -28.238 1.431 -12.589 1.00 1.00 H new ATOM 0 HE3 LYS A 60 -28.990 0.190 -11.607 1.00 1.00 H new ATOM 0 HZ1 LYS A 60 -30.632 1.839 -12.345 1.00 1.00 H new ATOM 0 HZ2 LYS A 60 -30.477 1.884 -10.655 1.00 1.00 H new ATOM 0 HZ3 LYS A 60 -29.748 3.086 -11.607 1.00 1.00 H new ATOM 966 N GLU A 61 -22.094 1.134 -10.323 1.00 1.00 N ATOM 967 CA GLU A 61 -20.846 1.923 -10.119 1.00 1.00 C ATOM 968 C GLU A 61 -19.725 1.357 -10.995 1.00 1.00 C ATOM 969 O GLU A 61 -19.967 0.824 -12.060 1.00 1.00 O ATOM 970 CB GLU A 61 -20.508 1.754 -8.637 1.00 1.00 C ATOM 971 CG GLU A 61 -21.088 2.927 -7.844 1.00 1.00 C ATOM 972 CD GLU A 61 -20.383 3.026 -6.489 1.00 1.00 C ATOM 973 OE1 GLU A 61 -19.232 2.631 -6.413 1.00 1.00 O ATOM 974 OE2 GLU A 61 -21.007 3.495 -5.552 1.00 1.00 O ATOM 0 H GLU A 61 -22.063 0.178 -9.968 1.00 1.00 H new ATOM 0 HA GLU A 61 -20.966 2.972 -10.389 1.00 1.00 H new ATOM 0 HB2 GLU A 61 -20.915 0.814 -8.265 1.00 1.00 H new ATOM 0 HB3 GLU A 61 -19.427 1.709 -8.502 1.00 1.00 H new ATOM 0 HG2 GLU A 61 -20.960 3.855 -8.401 1.00 1.00 H new ATOM 0 HG3 GLU A 61 -22.159 2.787 -7.699 1.00 1.00 H new ATOM 981 N THR A 62 -18.500 1.469 -10.558 1.00 1.00 N ATOM 982 CA THR A 62 -17.369 0.937 -11.371 1.00 1.00 C ATOM 983 C THR A 62 -16.931 -0.433 -10.843 1.00 1.00 C ATOM 984 O THR A 62 -15.756 -0.736 -10.774 1.00 1.00 O ATOM 985 CB THR A 62 -16.245 1.961 -11.205 1.00 1.00 C ATOM 986 OG1 THR A 62 -15.266 1.447 -10.311 1.00 1.00 O ATOM 987 CG2 THR A 62 -16.817 3.263 -10.642 1.00 1.00 C ATOM 0 H THR A 62 -18.234 1.905 -9.675 1.00 1.00 H new ATOM 0 HA THR A 62 -17.644 0.799 -12.417 1.00 1.00 H new ATOM 0 HB THR A 62 -15.786 2.157 -12.174 1.00 1.00 H new ATOM 0 HG1 THR A 62 -14.827 0.671 -10.718 1.00 1.00 H new ATOM 0 HG21 THR A 62 -16.015 3.992 -10.524 1.00 1.00 H new ATOM 0 HG22 THR A 62 -17.568 3.657 -11.327 1.00 1.00 H new ATOM 0 HG23 THR A 62 -17.277 3.069 -9.673 1.00 1.00 H new ATOM 995 N HIS A 63 -17.867 -1.264 -10.470 1.00 1.00 N ATOM 996 CA HIS A 63 -17.503 -2.614 -9.949 1.00 1.00 C ATOM 997 C HIS A 63 -16.783 -3.422 -11.033 1.00 1.00 C ATOM 998 O HIS A 63 -17.239 -3.518 -12.155 1.00 1.00 O ATOM 999 CB HIS A 63 -18.836 -3.271 -9.587 1.00 1.00 C ATOM 1000 CG HIS A 63 -19.277 -4.167 -10.712 1.00 1.00 C ATOM 1001 ND1 HIS A 63 -19.326 -3.734 -12.027 1.00 1.00 N ATOM 1002 CD2 HIS A 63 -19.690 -5.476 -10.733 1.00 1.00 C ATOM 1003 CE1 HIS A 63 -19.755 -4.764 -12.778 1.00 1.00 C ATOM 1004 NE2 HIS A 63 -19.992 -5.851 -12.038 1.00 1.00 N ATOM 0 H HIS A 63 -18.867 -1.067 -10.503 1.00 1.00 H new ATOM 0 HA HIS A 63 -16.830 -2.559 -9.093 1.00 1.00 H new ATOM 0 HB2 HIS A 63 -18.731 -3.848 -8.668 1.00 1.00 H new ATOM 0 HB3 HIS A 63 -19.591 -2.507 -9.399 1.00 1.00 H new ATOM 0 HD1 HIS A 63 -19.081 -2.803 -12.364 1.00 1.00 H new ATOM 0 HD2 HIS A 63 -19.769 -6.117 -9.868 1.00 1.00 H new ATOM 0 HE1 HIS A 63 -19.891 -4.718 -13.848 1.00 1.00 H new ATOM 1012 N GLU A 64 -15.658 -4.001 -10.709 1.00 1.00 N ATOM 1013 CA GLU A 64 -14.911 -4.798 -11.726 1.00 1.00 C ATOM 1014 C GLU A 64 -14.122 -5.923 -11.053 1.00 1.00 C ATOM 1015 O GLU A 64 -13.874 -5.893 -9.866 1.00 1.00 O ATOM 1016 CB GLU A 64 -13.950 -3.802 -12.375 1.00 1.00 C ATOM 1017 CG GLU A 64 -14.671 -3.049 -13.496 1.00 1.00 C ATOM 1018 CD GLU A 64 -14.033 -3.402 -14.841 1.00 1.00 C ATOM 1019 OE1 GLU A 64 -12.976 -4.013 -14.832 1.00 1.00 O ATOM 1020 OE2 GLU A 64 -14.610 -3.055 -15.857 1.00 1.00 O ATOM 0 H GLU A 64 -15.224 -3.957 -9.787 1.00 1.00 H new ATOM 0 HA GLU A 64 -15.579 -5.265 -12.449 1.00 1.00 H new ATOM 0 HB2 GLU A 64 -13.581 -3.098 -11.629 1.00 1.00 H new ATOM 0 HB3 GLU A 64 -13.082 -4.326 -12.775 1.00 1.00 H new ATOM 0 HG2 GLU A 64 -15.729 -3.312 -13.503 1.00 1.00 H new ATOM 0 HG3 GLU A 64 -14.611 -1.974 -13.324 1.00 1.00 H new ATOM 1027 N LYS A 65 -13.725 -6.913 -11.805 1.00 1.00 N ATOM 1028 CA LYS A 65 -12.943 -8.036 -11.212 1.00 1.00 C ATOM 1029 C LYS A 65 -11.469 -7.904 -11.602 1.00 1.00 C ATOM 1030 O LYS A 65 -11.141 -7.650 -12.744 1.00 1.00 O ATOM 1031 CB LYS A 65 -13.546 -9.306 -11.814 1.00 1.00 C ATOM 1032 CG LYS A 65 -14.807 -8.950 -12.605 1.00 1.00 C ATOM 1033 CD LYS A 65 -15.858 -8.370 -11.657 1.00 1.00 C ATOM 1034 CE LYS A 65 -16.965 -9.401 -11.428 1.00 1.00 C ATOM 1035 NZ LYS A 65 -17.443 -9.760 -12.793 1.00 1.00 N ATOM 0 H LYS A 65 -13.908 -6.993 -12.805 1.00 1.00 H new ATOM 0 HA LYS A 65 -12.989 -8.045 -10.123 1.00 1.00 H new ATOM 0 HB2 LYS A 65 -12.820 -9.792 -12.466 1.00 1.00 H new ATOM 0 HB3 LYS A 65 -13.789 -10.016 -11.023 1.00 1.00 H new ATOM 0 HG2 LYS A 65 -14.568 -8.228 -13.385 1.00 1.00 H new ATOM 0 HG3 LYS A 65 -15.200 -9.837 -13.102 1.00 1.00 H new ATOM 0 HD2 LYS A 65 -15.396 -8.100 -10.707 1.00 1.00 H new ATOM 0 HD3 LYS A 65 -16.279 -7.457 -12.078 1.00 1.00 H new ATOM 0 HE2 LYS A 65 -16.587 -10.276 -10.899 1.00 1.00 H new ATOM 0 HE3 LYS A 65 -17.772 -8.987 -10.823 1.00 1.00 H new ATOM 0 HZ1 LYS A 65 -18.481 -9.822 -12.792 1.00 1.00 H new ATOM 0 HZ2 LYS A 65 -17.141 -9.031 -13.470 1.00 1.00 H new ATOM 0 HZ3 LYS A 65 -17.041 -10.678 -13.071 1.00 1.00 H new ATOM 1048 N VAL A 66 -10.575 -8.067 -10.665 1.00 1.00 N ATOM 1049 CA VAL A 66 -9.125 -7.943 -10.990 1.00 1.00 C ATOM 1050 C VAL A 66 -8.555 -9.300 -11.414 1.00 1.00 C ATOM 1051 O VAL A 66 -8.687 -10.286 -10.715 1.00 1.00 O ATOM 1052 CB VAL A 66 -8.467 -7.467 -9.694 1.00 1.00 C ATOM 1053 CG1 VAL A 66 -8.876 -6.019 -9.415 1.00 1.00 C ATOM 1054 CG2 VAL A 66 -8.923 -8.356 -8.534 1.00 1.00 C ATOM 0 H VAL A 66 -10.785 -8.280 -9.690 1.00 1.00 H new ATOM 0 HA VAL A 66 -8.947 -7.254 -11.816 1.00 1.00 H new ATOM 0 HB VAL A 66 -7.383 -7.526 -9.795 1.00 1.00 H new ATOM 0 HG11 VAL A 66 -8.407 -5.680 -8.491 1.00 1.00 H new ATOM 0 HG12 VAL A 66 -8.553 -5.384 -10.240 1.00 1.00 H new ATOM 0 HG13 VAL A 66 -9.960 -5.960 -9.314 1.00 1.00 H new ATOM 0 HG21 VAL A 66 -8.454 -8.017 -7.610 1.00 1.00 H new ATOM 0 HG22 VAL A 66 -10.007 -8.296 -8.434 1.00 1.00 H new ATOM 0 HG23 VAL A 66 -8.633 -9.388 -8.731 1.00 1.00 H new ATOM 1064 N GLN A 67 -7.921 -9.355 -12.552 1.00 1.00 N ATOM 1065 CA GLN A 67 -7.339 -10.644 -13.022 1.00 1.00 C ATOM 1066 C GLN A 67 -5.986 -10.396 -13.695 1.00 1.00 C ATOM 1067 O GLN A 67 -5.715 -9.317 -14.184 1.00 1.00 O ATOM 1068 CB GLN A 67 -8.350 -11.193 -14.032 1.00 1.00 C ATOM 1069 CG GLN A 67 -8.744 -10.088 -15.013 1.00 1.00 C ATOM 1070 CD GLN A 67 -10.267 -10.049 -15.152 1.00 1.00 C ATOM 1071 OE1 GLN A 67 -10.793 -10.189 -16.239 1.00 1.00 O ATOM 1072 NE2 GLN A 67 -11.003 -9.863 -14.091 1.00 1.00 N ATOM 0 H GLN A 67 -7.780 -8.562 -13.178 1.00 1.00 H new ATOM 0 HA GLN A 67 -7.164 -11.342 -12.203 1.00 1.00 H new ATOM 0 HB2 GLN A 67 -7.919 -12.036 -14.572 1.00 1.00 H new ATOM 0 HB3 GLN A 67 -9.233 -11.565 -13.513 1.00 1.00 H new ATOM 0 HG2 GLN A 67 -8.376 -9.125 -14.660 1.00 1.00 H new ATOM 0 HG3 GLN A 67 -8.284 -10.268 -15.985 1.00 1.00 H new ATOM 0 HE21 GLN A 67 -10.562 -9.746 -13.179 1.00 1.00 H new ATOM 0 HE22 GLN A 67 -12.019 -9.835 -14.174 1.00 1.00 H new ATOM 1081 N GLY A 68 -5.134 -11.384 -13.723 1.00 1.00 N ATOM 1082 CA GLY A 68 -3.800 -11.200 -14.363 1.00 1.00 C ATOM 1083 C GLY A 68 -2.788 -10.737 -13.312 1.00 1.00 C ATOM 1084 O GLY A 68 -1.605 -10.642 -13.576 1.00 1.00 O ATOM 0 H GLY A 68 -5.303 -12.310 -13.331 1.00 1.00 H new ATOM 0 HA2 GLY A 68 -3.469 -12.136 -14.814 1.00 1.00 H new ATOM 0 HA3 GLY A 68 -3.868 -10.466 -15.166 1.00 1.00 H new ATOM 1088 N GLY A 69 -3.241 -10.451 -12.123 1.00 1.00 N ATOM 1089 CA GLY A 69 -2.303 -9.997 -11.057 1.00 1.00 C ATOM 1090 C GLY A 69 -2.393 -8.476 -10.906 1.00 1.00 C ATOM 1091 O GLY A 69 -1.705 -7.882 -10.100 1.00 1.00 O ATOM 0 H GLY A 69 -4.220 -10.512 -11.843 1.00 1.00 H new ATOM 0 HA2 GLY A 69 -2.549 -10.481 -10.112 1.00 1.00 H new ATOM 0 HA3 GLY A 69 -1.283 -10.288 -11.308 1.00 1.00 H new ATOM 1095 N PHE A 70 -3.238 -7.841 -11.673 1.00 1.00 N ATOM 1096 CA PHE A 70 -3.370 -6.359 -11.569 1.00 1.00 C ATOM 1097 C PHE A 70 -4.640 -5.995 -10.794 1.00 1.00 C ATOM 1098 O PHE A 70 -5.705 -5.852 -11.362 1.00 1.00 O ATOM 1099 CB PHE A 70 -3.461 -5.868 -13.014 1.00 1.00 C ATOM 1100 CG PHE A 70 -4.893 -5.514 -13.338 1.00 1.00 C ATOM 1101 CD1 PHE A 70 -5.396 -4.251 -13.002 1.00 1.00 C ATOM 1102 CD2 PHE A 70 -5.718 -6.448 -13.976 1.00 1.00 C ATOM 1103 CE1 PHE A 70 -6.724 -3.923 -13.304 1.00 1.00 C ATOM 1104 CE2 PHE A 70 -7.046 -6.120 -14.278 1.00 1.00 C ATOM 1105 CZ PHE A 70 -7.548 -4.858 -13.942 1.00 1.00 C ATOM 0 H PHE A 70 -3.842 -8.283 -12.366 1.00 1.00 H new ATOM 0 HA PHE A 70 -2.534 -5.905 -11.037 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -2.820 -4.998 -13.154 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -3.104 -6.641 -13.695 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -4.760 -3.530 -12.510 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -5.330 -7.422 -14.236 1.00 1.00 H new ATOM 0 HE1 PHE A 70 -7.112 -2.949 -13.045 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -7.682 -6.841 -14.770 1.00 1.00 H new ATOM 0 HZ PHE A 70 -8.572 -4.605 -14.175 1.00 1.00 H new ATOM 1115 N GLY A 71 -4.536 -5.843 -9.502 1.00 1.00 N ATOM 1116 CA GLY A 71 -5.738 -5.490 -8.693 1.00 1.00 C ATOM 1117 C GLY A 71 -6.508 -6.764 -8.342 1.00 1.00 C ATOM 1118 O GLY A 71 -7.693 -6.733 -8.063 1.00 1.00 O ATOM 0 H GLY A 71 -3.671 -5.948 -8.971 1.00 1.00 H new ATOM 0 HA2 GLY A 71 -5.437 -4.971 -7.783 1.00 1.00 H new ATOM 0 HA3 GLY A 71 -6.378 -4.808 -9.252 1.00 1.00 H new ATOM 1122 N LYS A 72 -5.841 -7.887 -8.342 1.00 1.00 N ATOM 1123 CA LYS A 72 -6.536 -9.162 -8.013 1.00 1.00 C ATOM 1124 C LYS A 72 -6.848 -9.200 -6.522 1.00 1.00 C ATOM 1125 O LYS A 72 -7.562 -10.059 -6.043 1.00 1.00 O ATOM 1126 CB LYS A 72 -5.541 -10.263 -8.381 1.00 1.00 C ATOM 1127 CG LYS A 72 -5.540 -11.338 -7.292 1.00 1.00 C ATOM 1128 CD LYS A 72 -5.005 -10.747 -5.985 1.00 1.00 C ATOM 1129 CE LYS A 72 -3.475 -10.733 -6.018 1.00 1.00 C ATOM 1130 NZ LYS A 72 -3.065 -11.978 -5.310 1.00 1.00 N ATOM 0 H LYS A 72 -4.847 -7.975 -8.555 1.00 1.00 H new ATOM 0 HA LYS A 72 -7.479 -9.277 -8.547 1.00 1.00 H new ATOM 0 HB2 LYS A 72 -5.809 -10.704 -9.341 1.00 1.00 H new ATOM 0 HB3 LYS A 72 -4.542 -9.842 -8.492 1.00 1.00 H new ATOM 0 HG2 LYS A 72 -6.550 -11.720 -7.143 1.00 1.00 H new ATOM 0 HG3 LYS A 72 -4.923 -12.182 -7.601 1.00 1.00 H new ATOM 0 HD2 LYS A 72 -5.385 -9.735 -5.849 1.00 1.00 H new ATOM 0 HD3 LYS A 72 -5.355 -11.336 -5.137 1.00 1.00 H new ATOM 0 HE2 LYS A 72 -3.102 -10.720 -7.042 1.00 1.00 H new ATOM 0 HE3 LYS A 72 -3.077 -9.847 -5.522 1.00 1.00 H new ATOM 0 HZ1 LYS A 72 -2.366 -11.746 -4.576 1.00 1.00 H new ATOM 0 HZ2 LYS A 72 -3.898 -12.416 -4.868 1.00 1.00 H new ATOM 0 HZ3 LYS A 72 -2.645 -12.642 -5.991 1.00 1.00 H new ATOM 1143 N TYR A 73 -6.335 -8.256 -5.787 1.00 1.00 N ATOM 1144 CA TYR A 73 -6.620 -8.215 -4.330 1.00 1.00 C ATOM 1145 C TYR A 73 -7.926 -7.453 -4.098 1.00 1.00 C ATOM 1146 O TYR A 73 -8.610 -7.655 -3.115 1.00 1.00 O ATOM 1147 CB TYR A 73 -5.439 -7.464 -3.713 1.00 1.00 C ATOM 1148 CG TYR A 73 -4.171 -8.255 -3.931 1.00 1.00 C ATOM 1149 CD1 TYR A 73 -3.987 -9.479 -3.277 1.00 1.00 C ATOM 1150 CD2 TYR A 73 -3.178 -7.763 -4.786 1.00 1.00 C ATOM 1151 CE1 TYR A 73 -2.811 -10.211 -3.479 1.00 1.00 C ATOM 1152 CE2 TYR A 73 -2.002 -8.495 -4.988 1.00 1.00 C ATOM 1153 CZ TYR A 73 -1.818 -9.719 -4.335 1.00 1.00 C ATOM 1154 OH TYR A 73 -0.660 -10.441 -4.534 1.00 1.00 O ATOM 0 H TYR A 73 -5.730 -7.511 -6.133 1.00 1.00 H new ATOM 0 HA TYR A 73 -6.734 -9.206 -3.891 1.00 1.00 H new ATOM 0 HB2 TYR A 73 -5.346 -6.476 -4.164 1.00 1.00 H new ATOM 0 HB3 TYR A 73 -5.607 -7.313 -2.647 1.00 1.00 H new ATOM 0 HD1 TYR A 73 -4.752 -9.859 -2.616 1.00 1.00 H new ATOM 0 HD2 TYR A 73 -3.319 -6.818 -5.290 1.00 1.00 H new ATOM 0 HE1 TYR A 73 -2.670 -11.155 -2.975 1.00 1.00 H new ATOM 0 HE2 TYR A 73 -1.236 -8.115 -5.648 1.00 1.00 H new ATOM 0 HH TYR A 73 -0.077 -9.959 -5.157 1.00 1.00 H new ATOM 1164 N GLN A 74 -8.280 -6.577 -5.005 1.00 1.00 N ATOM 1165 CA GLN A 74 -9.546 -5.807 -4.838 1.00 1.00 C ATOM 1166 C GLN A 74 -10.689 -6.499 -5.583 1.00 1.00 C ATOM 1167 O GLN A 74 -11.777 -6.660 -5.063 1.00 1.00 O ATOM 1168 CB GLN A 74 -9.258 -4.435 -5.450 1.00 1.00 C ATOM 1169 CG GLN A 74 -7.886 -3.948 -4.982 1.00 1.00 C ATOM 1170 CD GLN A 74 -6.946 -5.145 -4.829 1.00 1.00 C ATOM 1171 OE1 GLN A 74 -6.935 -5.796 -3.803 1.00 1.00 O ATOM 1172 NE2 GLN A 74 -6.152 -5.464 -5.813 1.00 1.00 N ATOM 0 H GLN A 74 -7.749 -6.364 -5.849 1.00 1.00 H new ATOM 0 HA GLN A 74 -9.849 -5.732 -3.794 1.00 1.00 H new ATOM 0 HB2 GLN A 74 -9.282 -4.497 -6.538 1.00 1.00 H new ATOM 0 HB3 GLN A 74 -10.029 -3.724 -5.154 1.00 1.00 H new ATOM 0 HG2 GLN A 74 -7.475 -3.239 -5.701 1.00 1.00 H new ATOM 0 HG3 GLN A 74 -7.979 -3.421 -4.032 1.00 1.00 H new ATOM 0 HE21 GLN A 74 -6.162 -4.917 -6.674 1.00 1.00 H new ATOM 0 HE22 GLN A 74 -5.521 -6.260 -5.722 1.00 1.00 H new ATOM 1181 N GLY A 75 -10.458 -6.906 -6.801 1.00 1.00 N ATOM 1182 CA GLY A 75 -11.539 -7.580 -7.567 1.00 1.00 C ATOM 1183 C GLY A 75 -12.582 -6.539 -7.962 1.00 1.00 C ATOM 1184 O GLY A 75 -12.465 -5.884 -8.978 1.00 1.00 O ATOM 0 H GLY A 75 -9.572 -6.801 -7.295 1.00 1.00 H new ATOM 0 HA2 GLY A 75 -11.129 -8.060 -8.456 1.00 1.00 H new ATOM 0 HA3 GLY A 75 -11.997 -8.364 -6.964 1.00 1.00 H new ATOM 1188 N THR A 76 -13.594 -6.373 -7.157 1.00 1.00 N ATOM 1189 CA THR A 76 -14.645 -5.365 -7.476 1.00 1.00 C ATOM 1190 C THR A 76 -14.402 -4.092 -6.663 1.00 1.00 C ATOM 1191 O THR A 76 -15.121 -3.790 -5.732 1.00 1.00 O ATOM 1192 CB THR A 76 -15.965 -6.022 -7.067 1.00 1.00 C ATOM 1193 OG1 THR A 76 -15.910 -7.411 -7.360 1.00 1.00 O ATOM 1194 CG2 THR A 76 -17.116 -5.380 -7.840 1.00 1.00 C ATOM 0 H THR A 76 -13.739 -6.892 -6.291 1.00 1.00 H new ATOM 0 HA THR A 76 -14.646 -5.081 -8.528 1.00 1.00 H new ATOM 0 HB THR A 76 -16.127 -5.882 -5.998 1.00 1.00 H new ATOM 0 HG1 THR A 76 -16.754 -7.834 -7.097 1.00 1.00 H new ATOM 0 HG21 THR A 76 -18.056 -5.848 -7.548 1.00 1.00 H new ATOM 0 HG22 THR A 76 -17.156 -4.314 -7.614 1.00 1.00 H new ATOM 0 HG23 THR A 76 -16.958 -5.519 -8.910 1.00 1.00 H new ATOM 1202 N TRP A 77 -13.385 -3.349 -7.005 1.00 1.00 N ATOM 1203 CA TRP A 77 -13.086 -2.100 -6.250 1.00 1.00 C ATOM 1204 C TRP A 77 -14.065 -0.990 -6.633 1.00 1.00 C ATOM 1205 O TRP A 77 -14.721 -1.047 -7.654 1.00 1.00 O ATOM 1206 CB TRP A 77 -11.662 -1.719 -6.657 1.00 1.00 C ATOM 1207 CG TRP A 77 -11.388 -2.216 -8.040 1.00 1.00 C ATOM 1208 CD1 TRP A 77 -12.332 -2.503 -8.966 1.00 1.00 C ATOM 1209 CD2 TRP A 77 -10.102 -2.488 -8.669 1.00 1.00 C ATOM 1210 NE1 TRP A 77 -11.708 -2.933 -10.123 1.00 1.00 N ATOM 1211 CE2 TRP A 77 -10.333 -2.941 -9.989 1.00 1.00 C ATOM 1212 CE3 TRP A 77 -8.771 -2.386 -8.226 1.00 1.00 C ATOM 1213 CZ2 TRP A 77 -9.281 -3.282 -10.841 1.00 1.00 C ATOM 1214 CZ3 TRP A 77 -7.709 -2.728 -9.080 1.00 1.00 C ATOM 1215 CH2 TRP A 77 -7.964 -3.174 -10.385 1.00 1.00 C ATOM 0 H TRP A 77 -12.748 -3.553 -7.775 1.00 1.00 H new ATOM 0 HA TRP A 77 -13.181 -2.244 -5.174 1.00 1.00 H new ATOM 0 HB2 TRP A 77 -11.538 -0.637 -6.617 1.00 1.00 H new ATOM 0 HB3 TRP A 77 -10.945 -2.148 -5.957 1.00 1.00 H new ATOM 0 HD1 TRP A 77 -13.399 -2.411 -8.825 1.00 1.00 H new ATOM 0 HE1 TRP A 77 -12.202 -3.210 -10.971 1.00 1.00 H new ATOM 0 HE3 TRP A 77 -8.564 -2.043 -7.223 1.00 1.00 H new ATOM 0 HZ2 TRP A 77 -9.483 -3.627 -11.844 1.00 1.00 H new ATOM 0 HZ3 TRP A 77 -6.691 -2.647 -8.730 1.00 1.00 H new ATOM 0 HH2 TRP A 77 -7.143 -3.434 -11.037 1.00 1.00 H new ATOM 1226 N VAL A 78 -14.157 0.026 -5.821 1.00 1.00 N ATOM 1227 CA VAL A 78 -15.078 1.156 -6.129 1.00 1.00 C ATOM 1228 C VAL A 78 -14.415 2.476 -5.732 1.00 1.00 C ATOM 1229 O VAL A 78 -13.419 2.480 -5.037 1.00 1.00 O ATOM 1230 CB VAL A 78 -16.322 0.899 -5.279 1.00 1.00 C ATOM 1231 CG1 VAL A 78 -17.532 0.696 -6.190 1.00 1.00 C ATOM 1232 CG2 VAL A 78 -16.107 -0.356 -4.429 1.00 1.00 C ATOM 0 H VAL A 78 -13.631 0.123 -4.952 1.00 1.00 H new ATOM 0 HA VAL A 78 -15.324 1.222 -7.189 1.00 1.00 H new ATOM 0 HB VAL A 78 -16.499 1.755 -4.628 1.00 1.00 H new ATOM 0 HG11 VAL A 78 -18.418 0.513 -5.582 1.00 1.00 H new ATOM 0 HG12 VAL A 78 -17.685 1.589 -6.796 1.00 1.00 H new ATOM 0 HG13 VAL A 78 -17.357 -0.159 -6.843 1.00 1.00 H new ATOM 0 HG21 VAL A 78 -16.993 -0.541 -3.822 1.00 1.00 H new ATOM 0 HG22 VAL A 78 -15.929 -1.211 -5.081 1.00 1.00 H new ATOM 0 HG23 VAL A 78 -15.245 -0.211 -3.778 1.00 1.00 H new ATOM 1242 N PRO A 79 -14.989 3.556 -6.184 1.00 1.00 N ATOM 1243 CA PRO A 79 -14.437 4.892 -5.864 1.00 1.00 C ATOM 1244 C PRO A 79 -14.322 5.059 -4.346 1.00 1.00 C ATOM 1245 O PRO A 79 -15.308 5.070 -3.637 1.00 1.00 O ATOM 1246 CB PRO A 79 -15.457 5.875 -6.448 1.00 1.00 C ATOM 1247 CG PRO A 79 -16.652 5.054 -6.835 1.00 1.00 C ATOM 1248 CD PRO A 79 -16.187 3.635 -7.016 1.00 1.00 C ATOM 0 HA PRO A 79 -13.439 5.049 -6.272 1.00 1.00 H new ATOM 0 HB2 PRO A 79 -15.728 6.636 -5.716 1.00 1.00 H new ATOM 0 HB3 PRO A 79 -15.045 6.396 -7.313 1.00 1.00 H new ATOM 0 HG2 PRO A 79 -17.421 5.110 -6.065 1.00 1.00 H new ATOM 0 HG3 PRO A 79 -17.095 5.433 -7.756 1.00 1.00 H new ATOM 0 HD2 PRO A 79 -16.945 2.921 -6.695 1.00 1.00 H new ATOM 0 HD3 PRO A 79 -15.965 3.416 -8.060 1.00 1.00 H new ATOM 1256 N LEU A 80 -13.124 5.182 -3.841 1.00 1.00 N ATOM 1257 CA LEU A 80 -12.949 5.341 -2.368 1.00 1.00 C ATOM 1258 C LEU A 80 -13.873 6.436 -1.832 1.00 1.00 C ATOM 1259 O LEU A 80 -14.337 6.371 -0.709 1.00 1.00 O ATOM 1260 CB LEU A 80 -11.484 5.742 -2.187 1.00 1.00 C ATOM 1261 CG LEU A 80 -10.678 4.536 -1.704 1.00 1.00 C ATOM 1262 CD1 LEU A 80 -10.081 3.805 -2.907 1.00 1.00 C ATOM 1263 CD2 LEU A 80 -9.549 5.015 -0.788 1.00 1.00 C ATOM 0 H LEU A 80 -12.260 5.179 -4.383 1.00 1.00 H new ATOM 0 HA LEU A 80 -13.196 4.429 -1.825 1.00 1.00 H new ATOM 0 HB2 LEU A 80 -11.078 6.110 -3.129 1.00 1.00 H new ATOM 0 HB3 LEU A 80 -11.406 6.556 -1.467 1.00 1.00 H new ATOM 0 HG LEU A 80 -11.331 3.858 -1.155 1.00 1.00 H new ATOM 0 HD11 LEU A 80 -9.506 2.945 -2.562 1.00 1.00 H new ATOM 0 HD12 LEU A 80 -10.884 3.466 -3.562 1.00 1.00 H new ATOM 0 HD13 LEU A 80 -9.427 4.482 -3.456 1.00 1.00 H new ATOM 0 HD21 LEU A 80 -8.972 4.157 -0.442 1.00 1.00 H new ATOM 0 HD22 LEU A 80 -8.896 5.693 -1.339 1.00 1.00 H new ATOM 0 HD23 LEU A 80 -9.973 5.537 0.070 1.00 1.00 H new ATOM 1275 N ASN A 81 -14.153 7.436 -2.626 1.00 1.00 N ATOM 1276 CA ASN A 81 -15.055 8.527 -2.158 1.00 1.00 C ATOM 1277 C ASN A 81 -16.426 7.949 -1.812 1.00 1.00 C ATOM 1278 O ASN A 81 -17.128 8.448 -0.954 1.00 1.00 O ATOM 1279 CB ASN A 81 -15.158 9.490 -3.341 1.00 1.00 C ATOM 1280 CG ASN A 81 -14.596 10.855 -2.938 1.00 1.00 C ATOM 1281 OD1 ASN A 81 -13.408 10.997 -2.723 1.00 1.00 O ATOM 1282 ND2 ASN A 81 -15.405 11.873 -2.827 1.00 1.00 N ATOM 0 H ASN A 81 -13.797 7.544 -3.576 1.00 1.00 H new ATOM 0 HA ASN A 81 -14.681 9.026 -1.264 1.00 1.00 H new ATOM 0 HB2 ASN A 81 -14.606 9.095 -4.194 1.00 1.00 H new ATOM 0 HB3 ASN A 81 -16.198 9.590 -3.652 1.00 1.00 H new ATOM 0 HD21 ASN A 81 -15.040 12.787 -2.560 1.00 1.00 H new ATOM 0 HD22 ASN A 81 -16.402 11.754 -3.007 1.00 1.00 H new ATOM 1289 N ILE A 82 -16.806 6.888 -2.469 1.00 1.00 N ATOM 1290 CA ILE A 82 -18.123 6.257 -2.178 1.00 1.00 C ATOM 1291 C ILE A 82 -17.899 4.903 -1.504 1.00 1.00 C ATOM 1292 O ILE A 82 -18.718 4.433 -0.739 1.00 1.00 O ATOM 1293 CB ILE A 82 -18.789 6.078 -3.543 1.00 1.00 C ATOM 1294 CG1 ILE A 82 -17.995 5.065 -4.370 1.00 1.00 C ATOM 1295 CG2 ILE A 82 -18.820 7.421 -4.275 1.00 1.00 C ATOM 1296 CD1 ILE A 82 -17.840 3.766 -3.577 1.00 1.00 C ATOM 0 H ILE A 82 -16.259 6.430 -3.197 1.00 1.00 H new ATOM 0 HA ILE A 82 -18.739 6.856 -1.508 1.00 1.00 H new ATOM 0 HB ILE A 82 -19.808 5.715 -3.405 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -18.506 4.869 -5.313 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -17.014 5.471 -4.618 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -19.295 7.294 -5.248 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -19.386 8.143 -3.687 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -17.801 7.784 -4.413 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -17.274 3.045 -4.167 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -17.310 3.969 -2.646 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -18.825 3.357 -3.352 1.00 1.00 H new ATOM 1308 N ALA A 83 -16.788 4.277 -1.782 1.00 1.00 N ATOM 1309 CA ALA A 83 -16.504 2.956 -1.158 1.00 1.00 C ATOM 1310 C ALA A 83 -16.364 3.116 0.358 1.00 1.00 C ATOM 1311 O ALA A 83 -17.085 2.507 1.122 1.00 1.00 O ATOM 1312 CB ALA A 83 -15.181 2.502 -1.775 1.00 1.00 C ATOM 0 H ALA A 83 -16.066 4.624 -2.414 1.00 1.00 H new ATOM 0 HA ALA A 83 -17.301 2.233 -1.332 1.00 1.00 H new ATOM 0 HB1 ALA A 83 -14.902 1.532 -1.364 1.00 1.00 H new ATOM 0 HB2 ALA A 83 -15.293 2.420 -2.856 1.00 1.00 H new ATOM 0 HB3 ALA A 83 -14.403 3.230 -1.545 1.00 1.00 H new ATOM 1318 N LYS A 84 -15.441 3.929 0.803 1.00 1.00 N ATOM 1319 CA LYS A 84 -15.265 4.115 2.272 1.00 1.00 C ATOM 1320 C LYS A 84 -16.562 4.631 2.901 1.00 1.00 C ATOM 1321 O LYS A 84 -16.877 4.322 4.032 1.00 1.00 O ATOM 1322 CB LYS A 84 -14.153 5.155 2.408 1.00 1.00 C ATOM 1323 CG LYS A 84 -14.752 6.558 2.300 1.00 1.00 C ATOM 1324 CD LYS A 84 -13.734 7.589 2.794 1.00 1.00 C ATOM 1325 CE LYS A 84 -13.687 8.768 1.820 1.00 1.00 C ATOM 1326 NZ LYS A 84 -12.285 9.268 1.889 1.00 1.00 N ATOM 0 H LYS A 84 -14.805 4.469 0.216 1.00 1.00 H new ATOM 0 HA LYS A 84 -15.017 3.183 2.779 1.00 1.00 H new ATOM 0 HB2 LYS A 84 -13.645 5.037 3.365 1.00 1.00 H new ATOM 0 HB3 LYS A 84 -13.404 5.007 1.630 1.00 1.00 H new ATOM 0 HG2 LYS A 84 -15.026 6.769 1.266 1.00 1.00 H new ATOM 0 HG3 LYS A 84 -15.665 6.621 2.891 1.00 1.00 H new ATOM 0 HD2 LYS A 84 -14.007 7.937 3.790 1.00 1.00 H new ATOM 0 HD3 LYS A 84 -12.748 7.132 2.876 1.00 1.00 H new ATOM 0 HE2 LYS A 84 -13.945 8.455 0.808 1.00 1.00 H new ATOM 0 HE3 LYS A 84 -14.397 9.544 2.105 1.00 1.00 H new ATOM 0 HZ1 LYS A 84 -12.174 10.079 1.247 1.00 1.00 H new ATOM 0 HZ2 LYS A 84 -12.070 9.565 2.862 1.00 1.00 H new ATOM 0 HZ3 LYS A 84 -11.632 8.510 1.606 1.00 1.00 H new ATOM 1339 N GLN A 85 -17.319 5.410 2.179 1.00 1.00 N ATOM 1340 CA GLN A 85 -18.592 5.936 2.746 1.00 1.00 C ATOM 1341 C GLN A 85 -19.601 4.797 2.897 1.00 1.00 C ATOM 1342 O GLN A 85 -20.464 4.826 3.751 1.00 1.00 O ATOM 1343 CB GLN A 85 -19.087 6.966 1.732 1.00 1.00 C ATOM 1344 CG GLN A 85 -20.585 7.204 1.933 1.00 1.00 C ATOM 1345 CD GLN A 85 -21.242 7.492 0.583 1.00 1.00 C ATOM 1346 OE1 GLN A 85 -21.937 8.477 0.430 1.00 1.00 O ATOM 1347 NE2 GLN A 85 -21.053 6.667 -0.412 1.00 1.00 N ATOM 0 H GLN A 85 -17.112 5.704 1.224 1.00 1.00 H new ATOM 0 HA GLN A 85 -18.457 6.378 3.733 1.00 1.00 H new ATOM 0 HB2 GLN A 85 -18.540 7.901 1.852 1.00 1.00 H new ATOM 0 HB3 GLN A 85 -18.897 6.614 0.718 1.00 1.00 H new ATOM 0 HG2 GLN A 85 -21.044 6.329 2.394 1.00 1.00 H new ATOM 0 HG3 GLN A 85 -20.743 8.042 2.612 1.00 1.00 H new ATOM 0 HE21 GLN A 85 -20.470 5.840 -0.285 1.00 1.00 H new ATOM 0 HE22 GLN A 85 -21.489 6.850 -1.316 1.00 1.00 H new ATOM 1356 N LEU A 86 -19.491 3.788 2.078 1.00 1.00 N ATOM 1357 CA LEU A 86 -20.435 2.640 2.179 1.00 1.00 C ATOM 1358 C LEU A 86 -19.935 1.653 3.236 1.00 1.00 C ATOM 1359 O LEU A 86 -20.698 1.135 4.028 1.00 1.00 O ATOM 1360 CB LEU A 86 -20.426 1.997 0.796 1.00 1.00 C ATOM 1361 CG LEU A 86 -21.391 0.811 0.775 1.00 1.00 C ATOM 1362 CD1 LEU A 86 -21.987 0.614 2.171 1.00 1.00 C ATOM 1363 CD2 LEU A 86 -22.518 1.090 -0.223 1.00 1.00 C ATOM 0 H LEU A 86 -18.788 3.709 1.343 1.00 1.00 H new ATOM 0 HA LEU A 86 -21.438 2.947 2.474 1.00 1.00 H new ATOM 0 HB2 LEU A 86 -20.717 2.729 0.042 1.00 1.00 H new ATOM 0 HB3 LEU A 86 -19.419 1.664 0.545 1.00 1.00 H new ATOM 0 HG LEU A 86 -20.854 -0.090 0.477 1.00 1.00 H new ATOM 0 HD11 LEU A 86 -22.675 -0.231 2.157 1.00 1.00 H new ATOM 0 HD12 LEU A 86 -21.186 0.418 2.884 1.00 1.00 H new ATOM 0 HD13 LEU A 86 -22.525 1.515 2.467 1.00 1.00 H new ATOM 0 HD21 LEU A 86 -23.207 0.245 -0.239 1.00 1.00 H new ATOM 0 HD22 LEU A 86 -23.055 1.990 0.076 1.00 1.00 H new ATOM 0 HD23 LEU A 86 -22.096 1.233 -1.218 1.00 1.00 H new ATOM 1375 N ALA A 87 -18.658 1.390 3.251 1.00 1.00 N ATOM 1376 CA ALA A 87 -18.102 0.437 4.253 1.00 1.00 C ATOM 1377 C ALA A 87 -17.749 1.171 5.550 1.00 1.00 C ATOM 1378 O ALA A 87 -18.263 0.862 6.608 1.00 1.00 O ATOM 1379 CB ALA A 87 -16.842 -0.134 3.600 1.00 1.00 C ATOM 0 H ALA A 87 -17.974 1.794 2.612 1.00 1.00 H new ATOM 0 HA ALA A 87 -18.815 -0.344 4.517 1.00 1.00 H new ATOM 0 HB1 ALA A 87 -16.372 -0.847 4.277 1.00 1.00 H new ATOM 0 HB2 ALA A 87 -17.110 -0.638 2.671 1.00 1.00 H new ATOM 0 HB3 ALA A 87 -16.145 0.676 3.385 1.00 1.00 H new ATOM 1385 N GLU A 88 -16.871 2.136 5.481 1.00 1.00 N ATOM 1386 CA GLU A 88 -16.480 2.882 6.706 1.00 1.00 C ATOM 1387 C GLU A 88 -17.667 3.012 7.659 1.00 1.00 C ATOM 1388 O GLU A 88 -17.502 3.153 8.854 1.00 1.00 O ATOM 1389 CB GLU A 88 -16.039 4.249 6.200 1.00 1.00 C ATOM 1390 CG GLU A 88 -17.138 5.278 6.468 1.00 1.00 C ATOM 1391 CD GLU A 88 -16.563 6.689 6.336 1.00 1.00 C ATOM 1392 OE1 GLU A 88 -15.498 6.821 5.753 1.00 1.00 O ATOM 1393 OE2 GLU A 88 -17.195 7.613 6.819 1.00 1.00 O ATOM 0 H GLU A 88 -16.408 2.439 4.624 1.00 1.00 H new ATOM 0 HA GLU A 88 -15.692 2.377 7.265 1.00 1.00 H new ATOM 0 HB2 GLU A 88 -15.116 4.551 6.696 1.00 1.00 H new ATOM 0 HB3 GLU A 88 -15.826 4.201 5.132 1.00 1.00 H new ATOM 0 HG2 GLU A 88 -17.958 5.141 5.763 1.00 1.00 H new ATOM 0 HG3 GLU A 88 -17.549 5.134 7.467 1.00 1.00 H new ATOM 1400 N LYS A 89 -18.864 2.952 7.146 1.00 1.00 N ATOM 1401 CA LYS A 89 -20.055 3.057 8.034 1.00 1.00 C ATOM 1402 C LYS A 89 -20.157 1.806 8.908 1.00 1.00 C ATOM 1403 O LYS A 89 -19.484 1.676 9.911 1.00 1.00 O ATOM 1404 CB LYS A 89 -21.252 3.152 7.089 1.00 1.00 C ATOM 1405 CG LYS A 89 -22.517 2.699 7.822 1.00 1.00 C ATOM 1406 CD LYS A 89 -23.386 1.867 6.877 1.00 1.00 C ATOM 1407 CE LYS A 89 -24.464 2.759 6.258 1.00 1.00 C ATOM 1408 NZ LYS A 89 -24.419 2.459 4.800 1.00 1.00 N ATOM 0 H LYS A 89 -19.069 2.835 6.154 1.00 1.00 H new ATOM 0 HA LYS A 89 -20.003 3.916 8.703 1.00 1.00 H new ATOM 0 HB2 LYS A 89 -21.370 4.177 6.736 1.00 1.00 H new ATOM 0 HB3 LYS A 89 -21.085 2.529 6.210 1.00 1.00 H new ATOM 0 HG2 LYS A 89 -22.250 2.111 8.700 1.00 1.00 H new ATOM 0 HG3 LYS A 89 -23.074 3.566 8.177 1.00 1.00 H new ATOM 0 HD2 LYS A 89 -22.770 1.425 6.094 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -23.848 1.044 7.421 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -25.446 2.540 6.676 1.00 1.00 H new ATOM 0 HE3 LYS A 89 -24.263 3.813 6.451 1.00 1.00 H new ATOM 0 HZ1 LYS A 89 -25.131 3.033 4.305 1.00 1.00 H new ATOM 0 HZ2 LYS A 89 -23.474 2.684 4.428 1.00 1.00 H new ATOM 0 HZ3 LYS A 89 -24.620 1.450 4.647 1.00 1.00 H new ATOM 1421 N PHE A 90 -20.993 0.881 8.525 1.00 1.00 N ATOM 1422 CA PHE A 90 -21.140 -0.372 9.321 1.00 1.00 C ATOM 1423 C PHE A 90 -20.554 -1.557 8.550 1.00 1.00 C ATOM 1424 O PHE A 90 -20.626 -2.690 8.983 1.00 1.00 O ATOM 1425 CB PHE A 90 -22.647 -0.547 9.513 1.00 1.00 C ATOM 1426 CG PHE A 90 -22.916 -1.110 10.888 1.00 1.00 C ATOM 1427 CD1 PHE A 90 -22.175 -2.202 11.354 1.00 1.00 C ATOM 1428 CD2 PHE A 90 -23.906 -0.538 11.696 1.00 1.00 C ATOM 1429 CE1 PHE A 90 -22.423 -2.723 12.630 1.00 1.00 C ATOM 1430 CE2 PHE A 90 -24.154 -1.059 12.972 1.00 1.00 C ATOM 1431 CZ PHE A 90 -23.413 -2.152 13.439 1.00 1.00 C ATOM 0 H PHE A 90 -21.582 0.938 7.694 1.00 1.00 H new ATOM 0 HA PHE A 90 -20.613 -0.321 10.274 1.00 1.00 H new ATOM 0 HB2 PHE A 90 -23.153 0.411 9.395 1.00 1.00 H new ATOM 0 HB3 PHE A 90 -23.047 -1.215 8.750 1.00 1.00 H new ATOM 0 HD1 PHE A 90 -21.412 -2.643 10.730 1.00 1.00 H new ATOM 0 HD2 PHE A 90 -24.478 0.304 11.336 1.00 1.00 H new ATOM 0 HE1 PHE A 90 -21.851 -3.565 12.990 1.00 1.00 H new ATOM 0 HE2 PHE A 90 -24.917 -0.618 13.596 1.00 1.00 H new ATOM 0 HZ PHE A 90 -23.605 -2.554 14.423 1.00 1.00 H new ATOM 1441 N SER A 91 -19.983 -1.306 7.402 1.00 1.00 N ATOM 1442 CA SER A 91 -19.402 -2.416 6.597 1.00 1.00 C ATOM 1443 C SER A 91 -18.062 -2.868 7.184 1.00 1.00 C ATOM 1444 O SER A 91 -17.965 -3.914 7.794 1.00 1.00 O ATOM 1445 CB SER A 91 -19.203 -1.828 5.201 1.00 1.00 C ATOM 1446 OG SER A 91 -19.399 -2.848 4.230 1.00 1.00 O ATOM 0 H SER A 91 -19.894 -0.378 6.988 1.00 1.00 H new ATOM 0 HA SER A 91 -20.049 -3.293 6.586 1.00 1.00 H new ATOM 0 HB2 SER A 91 -19.905 -1.011 5.034 1.00 1.00 H new ATOM 0 HB3 SER A 91 -18.200 -1.410 5.109 1.00 1.00 H new ATOM 0 HG SER A 91 -18.563 -3.344 4.104 1.00 1.00 H new ATOM 1452 N VAL A 92 -17.029 -2.089 7.008 1.00 1.00 N ATOM 1453 CA VAL A 92 -15.700 -2.476 7.561 1.00 1.00 C ATOM 1454 C VAL A 92 -15.217 -1.419 8.558 1.00 1.00 C ATOM 1455 O VAL A 92 -14.093 -1.452 9.018 1.00 1.00 O ATOM 1456 CB VAL A 92 -14.768 -2.534 6.350 1.00 1.00 C ATOM 1457 CG1 VAL A 92 -13.748 -3.658 6.546 1.00 1.00 C ATOM 1458 CG2 VAL A 92 -15.589 -2.807 5.088 1.00 1.00 C ATOM 0 H VAL A 92 -17.048 -1.202 6.505 1.00 1.00 H new ATOM 0 HA VAL A 92 -15.735 -3.426 8.094 1.00 1.00 H new ATOM 0 HB VAL A 92 -14.246 -1.582 6.246 1.00 1.00 H new ATOM 0 HG11 VAL A 92 -13.083 -3.700 5.683 1.00 1.00 H new ATOM 0 HG12 VAL A 92 -13.163 -3.466 7.446 1.00 1.00 H new ATOM 0 HG13 VAL A 92 -14.270 -4.609 6.649 1.00 1.00 H new ATOM 0 HG21 VAL A 92 -14.926 -2.848 4.224 1.00 1.00 H new ATOM 0 HG22 VAL A 92 -16.110 -3.759 5.192 1.00 1.00 H new ATOM 0 HG23 VAL A 92 -16.317 -2.008 4.948 1.00 1.00 H new ATOM 1468 N TYR A 93 -16.061 -0.481 8.893 1.00 1.00 N ATOM 1469 CA TYR A 93 -15.653 0.579 9.858 1.00 1.00 C ATOM 1470 C TYR A 93 -14.827 -0.028 10.996 1.00 1.00 C ATOM 1471 O TYR A 93 -13.978 0.620 11.574 1.00 1.00 O ATOM 1472 CB TYR A 93 -16.965 1.151 10.394 1.00 1.00 C ATOM 1473 CG TYR A 93 -16.928 1.166 11.903 1.00 1.00 C ATOM 1474 CD1 TYR A 93 -16.219 2.169 12.576 1.00 1.00 C ATOM 1475 CD2 TYR A 93 -17.601 0.177 12.629 1.00 1.00 C ATOM 1476 CE1 TYR A 93 -16.183 2.182 13.974 1.00 1.00 C ATOM 1477 CE2 TYR A 93 -17.565 0.190 14.028 1.00 1.00 C ATOM 1478 CZ TYR A 93 -16.856 1.193 14.701 1.00 1.00 C ATOM 1479 OH TYR A 93 -16.820 1.205 16.081 1.00 1.00 O ATOM 0 H TYR A 93 -17.015 -0.403 8.540 1.00 1.00 H new ATOM 0 HA TYR A 93 -15.034 1.345 9.392 1.00 1.00 H new ATOM 0 HB2 TYR A 93 -17.116 2.161 10.013 1.00 1.00 H new ATOM 0 HB3 TYR A 93 -17.805 0.550 10.046 1.00 1.00 H new ATOM 0 HD1 TYR A 93 -15.700 2.932 12.015 1.00 1.00 H new ATOM 0 HD2 TYR A 93 -18.148 -0.596 12.110 1.00 1.00 H new ATOM 0 HE1 TYR A 93 -15.636 2.955 14.493 1.00 1.00 H new ATOM 0 HE2 TYR A 93 -18.084 -0.573 14.589 1.00 1.00 H new ATOM 0 HH TYR A 93 -17.339 0.450 16.428 1.00 1.00 H new ATOM 1489 N ASP A 94 -15.069 -1.268 11.319 1.00 1.00 N ATOM 1490 CA ASP A 94 -14.299 -1.917 12.417 1.00 1.00 C ATOM 1491 C ASP A 94 -13.042 -2.592 11.859 1.00 1.00 C ATOM 1492 O ASP A 94 -11.934 -2.294 12.260 1.00 1.00 O ATOM 1493 CB ASP A 94 -15.250 -2.960 13.007 1.00 1.00 C ATOM 1494 CG ASP A 94 -16.399 -3.213 12.029 1.00 1.00 C ATOM 1495 OD1 ASP A 94 -16.851 -2.260 11.417 1.00 1.00 O ATOM 1496 OD2 ASP A 94 -16.808 -4.356 11.909 1.00 1.00 O ATOM 0 H ASP A 94 -15.767 -1.861 10.870 1.00 1.00 H new ATOM 0 HA ASP A 94 -13.966 -1.198 13.166 1.00 1.00 H new ATOM 0 HB2 ASP A 94 -14.713 -3.888 13.202 1.00 1.00 H new ATOM 0 HB3 ASP A 94 -15.642 -2.611 13.963 1.00 1.00 H new ATOM 1501 N GLN A 95 -13.206 -3.502 10.938 1.00 1.00 N ATOM 1502 CA GLN A 95 -12.024 -4.201 10.358 1.00 1.00 C ATOM 1503 C GLN A 95 -11.070 -3.194 9.709 1.00 1.00 C ATOM 1504 O GLN A 95 -9.868 -3.279 9.861 1.00 1.00 O ATOM 1505 CB GLN A 95 -12.600 -5.144 9.302 1.00 1.00 C ATOM 1506 CG GLN A 95 -12.220 -6.586 9.645 1.00 1.00 C ATOM 1507 CD GLN A 95 -13.477 -7.458 9.650 1.00 1.00 C ATOM 1508 OE1 GLN A 95 -13.945 -7.874 8.610 1.00 1.00 O ATOM 1509 NE2 GLN A 95 -14.047 -7.752 10.787 1.00 1.00 N ATOM 0 H GLN A 95 -14.109 -3.792 10.562 1.00 1.00 H new ATOM 0 HA GLN A 95 -11.452 -4.734 11.117 1.00 1.00 H new ATOM 0 HB2 GLN A 95 -13.684 -5.042 9.261 1.00 1.00 H new ATOM 0 HB3 GLN A 95 -12.217 -4.880 8.316 1.00 1.00 H new ATOM 0 HG2 GLN A 95 -11.503 -6.967 8.918 1.00 1.00 H new ATOM 0 HG3 GLN A 95 -11.735 -6.623 10.620 1.00 1.00 H new ATOM 0 HE21 GLN A 95 -13.653 -7.402 11.660 1.00 1.00 H new ATOM 0 HE22 GLN A 95 -14.886 -8.332 10.802 1.00 1.00 H new ATOM 1518 N LEU A 96 -11.593 -2.243 8.984 1.00 1.00 N ATOM 1519 CA LEU A 96 -10.710 -1.238 8.325 1.00 1.00 C ATOM 1520 C LEU A 96 -10.416 -0.079 9.280 1.00 1.00 C ATOM 1521 O LEU A 96 -10.203 1.042 8.863 1.00 1.00 O ATOM 1522 CB LEU A 96 -11.502 -0.747 7.114 1.00 1.00 C ATOM 1523 CG LEU A 96 -12.331 -1.898 6.542 1.00 1.00 C ATOM 1524 CD1 LEU A 96 -12.810 -1.534 5.135 1.00 1.00 C ATOM 1525 CD2 LEU A 96 -11.470 -3.161 6.475 1.00 1.00 C ATOM 0 H LEU A 96 -12.592 -2.118 8.819 1.00 1.00 H new ATOM 0 HA LEU A 96 -9.748 -1.662 8.038 1.00 1.00 H new ATOM 0 HB2 LEU A 96 -12.155 0.076 7.403 1.00 1.00 H new ATOM 0 HB3 LEU A 96 -10.822 -0.362 6.354 1.00 1.00 H new ATOM 0 HG LEU A 96 -13.193 -2.078 7.184 1.00 1.00 H new ATOM 0 HD11 LEU A 96 -13.401 -2.355 4.728 1.00 1.00 H new ATOM 0 HD12 LEU A 96 -13.423 -0.634 5.181 1.00 1.00 H new ATOM 0 HD13 LEU A 96 -11.948 -1.354 4.492 1.00 1.00 H new ATOM 0 HD21 LEU A 96 -12.060 -3.982 6.067 1.00 1.00 H new ATOM 0 HD22 LEU A 96 -10.608 -2.980 5.833 1.00 1.00 H new ATOM 0 HD23 LEU A 96 -11.128 -3.422 7.477 1.00 1.00 H new ATOM 1537 N LYS A 97 -10.400 -0.338 10.559 1.00 1.00 N ATOM 1538 CA LYS A 97 -10.120 0.755 11.534 1.00 1.00 C ATOM 1539 C LYS A 97 -8.820 1.471 11.156 1.00 1.00 C ATOM 1540 O LYS A 97 -8.809 2.667 10.943 1.00 1.00 O ATOM 1541 CB LYS A 97 -9.975 0.056 12.886 1.00 1.00 C ATOM 1542 CG LYS A 97 -11.057 0.564 13.842 1.00 1.00 C ATOM 1543 CD LYS A 97 -10.404 1.361 14.973 1.00 1.00 C ATOM 1544 CE LYS A 97 -11.435 2.306 15.595 1.00 1.00 C ATOM 1545 NZ LYS A 97 -10.819 2.758 16.873 1.00 1.00 N ATOM 0 H LYS A 97 -10.568 -1.256 10.970 1.00 1.00 H new ATOM 0 HA LYS A 97 -10.908 1.508 11.551 1.00 1.00 H new ATOM 0 HB2 LYS A 97 -10.063 -1.023 12.761 1.00 1.00 H new ATOM 0 HB3 LYS A 97 -8.987 0.249 13.303 1.00 1.00 H new ATOM 0 HG2 LYS A 97 -11.768 1.191 13.304 1.00 1.00 H new ATOM 0 HG3 LYS A 97 -11.619 -0.275 14.251 1.00 1.00 H new ATOM 0 HD2 LYS A 97 -10.013 0.683 15.731 1.00 1.00 H new ATOM 0 HD3 LYS A 97 -9.558 1.931 14.589 1.00 1.00 H new ATOM 0 HE2 LYS A 97 -11.645 3.150 14.938 1.00 1.00 H new ATOM 0 HE3 LYS A 97 -12.382 1.796 15.772 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 -11.467 3.410 17.359 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 -10.637 1.934 17.481 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 -9.922 3.246 16.673 1.00 1.00 H new ATOM 1558 N PRO A 98 -7.766 0.706 11.078 1.00 1.00 N ATOM 1559 CA PRO A 98 -6.442 1.269 10.714 1.00 1.00 C ATOM 1560 C PRO A 98 -6.498 1.875 9.307 1.00 1.00 C ATOM 1561 O PRO A 98 -6.249 3.049 9.114 1.00 1.00 O ATOM 1562 CB PRO A 98 -5.498 0.066 10.746 1.00 1.00 C ATOM 1563 CG PRO A 98 -6.237 -1.014 11.474 1.00 1.00 C ATOM 1564 CD PRO A 98 -7.708 -0.735 11.321 1.00 1.00 C ATOM 0 HA PRO A 98 -6.121 2.064 11.387 1.00 1.00 H new ATOM 0 HB2 PRO A 98 -5.235 -0.252 9.737 1.00 1.00 H new ATOM 0 HB3 PRO A 98 -4.566 0.314 11.255 1.00 1.00 H new ATOM 0 HG2 PRO A 98 -5.987 -1.993 11.065 1.00 1.00 H new ATOM 0 HG3 PRO A 98 -5.957 -1.028 12.527 1.00 1.00 H new ATOM 0 HD2 PRO A 98 -8.138 -1.298 10.493 1.00 1.00 H new ATOM 0 HD3 PRO A 98 -8.263 -1.012 12.217 1.00 1.00 H new ATOM 1572 N LEU A 99 -6.823 1.079 8.325 1.00 1.00 N ATOM 1573 CA LEU A 99 -6.897 1.602 6.930 1.00 1.00 C ATOM 1574 C LEU A 99 -7.690 2.912 6.898 1.00 1.00 C ATOM 1575 O LEU A 99 -7.358 3.832 6.177 1.00 1.00 O ATOM 1576 CB LEU A 99 -7.626 0.515 6.140 1.00 1.00 C ATOM 1577 CG LEU A 99 -7.936 1.025 4.732 1.00 1.00 C ATOM 1578 CD1 LEU A 99 -7.206 2.347 4.494 1.00 1.00 C ATOM 1579 CD2 LEU A 99 -7.468 -0.008 3.703 1.00 1.00 C ATOM 0 H LEU A 99 -7.041 0.088 8.428 1.00 1.00 H new ATOM 0 HA LEU A 99 -5.912 1.817 6.516 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -7.011 -0.383 6.085 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -8.549 0.239 6.649 1.00 1.00 H new ATOM 0 HG LEU A 99 -9.010 1.181 4.631 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -7.428 2.709 3.490 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -7.537 3.083 5.227 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -6.132 2.193 4.595 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -7.688 0.354 2.699 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -6.394 -0.163 3.806 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -7.988 -0.951 3.871 1.00 1.00 H new ATOM 1591 N PHE A 100 -8.733 3.003 7.676 1.00 1.00 N ATOM 1592 CA PHE A 100 -9.543 4.255 7.691 1.00 1.00 C ATOM 1593 C PHE A 100 -8.868 5.306 8.574 1.00 1.00 C ATOM 1594 O PHE A 100 -9.038 6.494 8.383 1.00 1.00 O ATOM 1595 CB PHE A 100 -10.895 3.848 8.277 1.00 1.00 C ATOM 1596 CG PHE A 100 -11.985 4.144 7.275 1.00 1.00 C ATOM 1597 CD1 PHE A 100 -12.338 5.470 6.997 1.00 1.00 C ATOM 1598 CD2 PHE A 100 -12.643 3.094 6.624 1.00 1.00 C ATOM 1599 CE1 PHE A 100 -13.348 5.745 6.067 1.00 1.00 C ATOM 1600 CE2 PHE A 100 -13.651 3.368 5.694 1.00 1.00 C ATOM 1601 CZ PHE A 100 -14.005 4.695 5.416 1.00 1.00 C ATOM 0 H PHE A 100 -9.060 2.266 8.301 1.00 1.00 H new ATOM 0 HA PHE A 100 -9.647 4.692 6.698 1.00 1.00 H new ATOM 0 HB2 PHE A 100 -10.892 2.786 8.525 1.00 1.00 H new ATOM 0 HB3 PHE A 100 -11.080 4.391 9.204 1.00 1.00 H new ATOM 0 HD1 PHE A 100 -11.831 6.281 7.500 1.00 1.00 H new ATOM 0 HD2 PHE A 100 -12.372 2.071 6.840 1.00 1.00 H new ATOM 0 HE1 PHE A 100 -13.620 6.768 5.852 1.00 1.00 H new ATOM 0 HE2 PHE A 100 -14.156 2.557 5.190 1.00 1.00 H new ATOM 0 HZ PHE A 100 -14.785 4.907 4.699 1.00 1.00 H new ATOM 1611 N ASP A 101 -8.102 4.879 9.539 1.00 1.00 N ATOM 1612 CA ASP A 101 -7.413 5.853 10.432 1.00 1.00 C ATOM 1613 C ASP A 101 -6.306 6.578 9.663 1.00 1.00 C ATOM 1614 O ASP A 101 -5.894 7.663 10.023 1.00 1.00 O ATOM 1615 CB ASP A 101 -6.817 5.008 11.559 1.00 1.00 C ATOM 1616 CG ASP A 101 -7.896 4.708 12.600 1.00 1.00 C ATOM 1617 OD1 ASP A 101 -8.966 5.287 12.500 1.00 1.00 O ATOM 1618 OD2 ASP A 101 -7.635 3.906 13.481 1.00 1.00 O ATOM 0 H ASP A 101 -7.923 3.897 9.748 1.00 1.00 H new ATOM 0 HA ASP A 101 -8.091 6.617 10.812 1.00 1.00 H new ATOM 0 HB2 ASP A 101 -6.417 4.077 11.157 1.00 1.00 H new ATOM 0 HB3 ASP A 101 -5.986 5.538 12.024 1.00 1.00 H new ATOM 1805 N LYS A 116 9.770 -2.497 3.400 1.00 1.00 N ATOM 1806 CA LYS A 116 10.709 -2.383 2.248 1.00 1.00 C ATOM 1807 C LYS A 116 11.988 -3.177 2.529 1.00 1.00 C ATOM 1808 O LYS A 116 12.333 -3.434 3.664 1.00 1.00 O ATOM 1809 CB LYS A 116 11.018 -0.890 2.135 1.00 1.00 C ATOM 1810 CG LYS A 116 11.084 -0.490 0.660 1.00 1.00 C ATOM 1811 CD LYS A 116 10.383 -1.552 -0.190 1.00 1.00 C ATOM 1812 CE LYS A 116 10.512 -1.188 -1.671 1.00 1.00 C ATOM 1813 NZ LYS A 116 11.976 -1.177 -1.937 1.00 1.00 N ATOM 0 HA LYS A 116 10.284 -2.781 1.327 1.00 1.00 H new ATOM 0 HB2 LYS A 116 10.250 -0.310 2.646 1.00 1.00 H new ATOM 0 HB3 LYS A 116 11.965 -0.666 2.626 1.00 1.00 H new ATOM 0 HG2 LYS A 116 10.608 0.480 0.514 1.00 1.00 H new ATOM 0 HG3 LYS A 116 12.123 -0.386 0.347 1.00 1.00 H new ATOM 0 HD2 LYS A 116 10.825 -2.531 -0.005 1.00 1.00 H new ATOM 0 HD3 LYS A 116 9.331 -1.620 0.088 1.00 1.00 H new ATOM 0 HE2 LYS A 116 10.001 -1.915 -2.302 1.00 1.00 H new ATOM 0 HE3 LYS A 116 10.065 -0.216 -1.879 1.00 1.00 H new ATOM 0 HZ1 LYS A 116 12.160 -1.571 -2.882 1.00 1.00 H new ATOM 0 HZ2 LYS A 116 12.329 -0.200 -1.895 1.00 1.00 H new ATOM 0 HZ3 LYS A 116 12.463 -1.753 -1.221 1.00 1.00 H new ATOM 1826 N HIS A 117 12.693 -3.569 1.502 1.00 1.00 N ATOM 1827 CA HIS A 117 13.947 -4.347 1.713 1.00 1.00 C ATOM 1828 C HIS A 117 15.046 -3.440 2.275 1.00 1.00 C ATOM 1829 O HIS A 117 15.361 -2.410 1.713 1.00 1.00 O ATOM 1830 CB HIS A 117 14.333 -4.859 0.324 1.00 1.00 C ATOM 1831 CG HIS A 117 15.218 -3.849 -0.353 1.00 1.00 C ATOM 1832 ND1 HIS A 117 15.029 -2.484 -0.206 1.00 1.00 N ATOM 1833 CD2 HIS A 117 16.301 -3.990 -1.184 1.00 1.00 C ATOM 1834 CE1 HIS A 117 15.977 -1.862 -0.932 1.00 1.00 C ATOM 1835 NE2 HIS A 117 16.780 -2.734 -1.548 1.00 1.00 N ATOM 0 H HIS A 117 12.455 -3.384 0.528 1.00 1.00 H new ATOM 0 HA HIS A 117 13.813 -5.161 2.426 1.00 1.00 H new ATOM 0 HB2 HIS A 117 14.851 -5.814 0.408 1.00 1.00 H new ATOM 0 HB3 HIS A 117 13.438 -5.033 -0.273 1.00 1.00 H new ATOM 0 HD1 HIS A 117 14.303 -2.033 0.351 1.00 1.00 H new ATOM 0 HD2 HIS A 117 16.719 -4.932 -1.507 1.00 1.00 H new ATOM 0 HE1 HIS A 117 16.076 -0.789 -1.007 1.00 1.00 H new ATOM 1843 N HIS A 118 15.630 -3.815 3.380 1.00 1.00 N ATOM 1844 CA HIS A 118 16.706 -2.974 3.978 1.00 1.00 C ATOM 1845 C HIS A 118 17.877 -2.837 3.000 1.00 1.00 C ATOM 1846 O HIS A 118 18.210 -3.758 2.282 1.00 1.00 O ATOM 1847 CB HIS A 118 17.145 -3.727 5.235 1.00 1.00 C ATOM 1848 CG HIS A 118 17.306 -2.756 6.370 1.00 1.00 C ATOM 1849 ND1 HIS A 118 16.959 -1.419 6.255 1.00 1.00 N ATOM 1850 CD2 HIS A 118 17.777 -2.910 7.651 1.00 1.00 C ATOM 1851 CE1 HIS A 118 17.223 -0.827 7.434 1.00 1.00 C ATOM 1852 NE2 HIS A 118 17.723 -1.692 8.321 1.00 1.00 N ATOM 0 H HIS A 118 15.409 -4.667 3.895 1.00 1.00 H new ATOM 0 HA HIS A 118 16.362 -1.965 4.205 1.00 1.00 H new ATOM 0 HB2 HIS A 118 16.407 -4.486 5.494 1.00 1.00 H new ATOM 0 HB3 HIS A 118 18.085 -4.247 5.051 1.00 1.00 H new ATOM 0 HD2 HIS A 118 18.135 -3.837 8.074 1.00 1.00 H new ATOM 0 HE1 HIS A 118 17.052 0.220 7.638 1.00 1.00 H new ATOM 0 HE2 HIS A 118 18.005 -1.501 9.282 1.00 1.00 H new ATOM 1860 N HIS A 119 18.506 -1.694 2.968 1.00 1.00 N ATOM 1861 CA HIS A 119 19.655 -1.499 2.038 1.00 1.00 C ATOM 1862 C HIS A 119 20.849 -2.344 2.492 1.00 1.00 C ATOM 1863 O HIS A 119 21.428 -2.107 3.534 1.00 1.00 O ATOM 1864 CB HIS A 119 19.989 -0.009 2.124 1.00 1.00 C ATOM 1865 CG HIS A 119 21.067 0.205 3.151 1.00 1.00 C ATOM 1866 ND1 HIS A 119 22.324 0.679 2.813 1.00 1.00 N ATOM 1867 CD2 HIS A 119 21.090 0.015 4.511 1.00 1.00 C ATOM 1868 CE1 HIS A 119 23.046 0.757 3.946 1.00 1.00 C ATOM 1869 NE2 HIS A 119 22.340 0.364 5.011 1.00 1.00 N ATOM 0 H HIS A 119 18.274 -0.886 3.546 1.00 1.00 H new ATOM 0 HA HIS A 119 19.418 -1.804 1.019 1.00 1.00 H new ATOM 0 HB2 HIS A 119 20.320 0.357 1.152 1.00 1.00 H new ATOM 0 HB3 HIS A 119 19.098 0.559 2.392 1.00 1.00 H new ATOM 0 HD2 HIS A 119 20.263 -0.350 5.102 1.00 1.00 H new ATOM 0 HE1 HIS A 119 24.071 1.096 3.990 1.00 1.00 H new ATOM 0 HE2 HIS A 119 22.651 0.328 5.982 1.00 1.00 H new ATOM 1877 N ALA A 120 21.221 -3.325 1.719 1.00 1.00 N ATOM 1878 CA ALA A 120 22.378 -4.184 2.109 1.00 1.00 C ATOM 1879 C ALA A 120 23.491 -3.328 2.718 1.00 1.00 C ATOM 1880 O ALA A 120 23.514 -2.122 2.568 1.00 1.00 O ATOM 1881 CB ALA A 120 22.851 -4.828 0.805 1.00 1.00 C ATOM 0 H ALA A 120 20.776 -3.571 0.835 1.00 1.00 H new ATOM 0 HA ALA A 120 22.105 -4.929 2.856 1.00 1.00 H new ATOM 0 HB1 ALA A 120 23.703 -5.477 1.008 1.00 1.00 H new ATOM 0 HB2 ALA A 120 22.041 -5.416 0.375 1.00 1.00 H new ATOM 0 HB3 ALA A 120 23.147 -4.050 0.102 1.00 1.00 H new ATOM 1887 N SER A 121 24.415 -3.943 3.403 1.00 1.00 N ATOM 1888 CA SER A 121 25.528 -3.165 4.021 1.00 1.00 C ATOM 1889 C SER A 121 26.752 -3.176 3.101 1.00 1.00 C ATOM 1890 O SER A 121 27.514 -4.121 3.078 1.00 1.00 O ATOM 1891 CB SER A 121 25.835 -3.887 5.332 1.00 1.00 C ATOM 1892 OG SER A 121 27.230 -3.813 5.593 1.00 1.00 O ATOM 0 H SER A 121 24.448 -4.950 3.562 1.00 1.00 H new ATOM 0 HA SER A 121 25.263 -2.121 4.185 1.00 1.00 H new ATOM 0 HB2 SER A 121 25.276 -3.433 6.150 1.00 1.00 H new ATOM 0 HB3 SER A 121 25.520 -4.929 5.269 1.00 1.00 H new ATOM 0 HG SER A 121 27.723 -4.241 4.862 1.00 1.00 H new ATOM 1898 N LYS A 122 26.946 -2.130 2.345 1.00 1.00 N ATOM 1899 CA LYS A 122 28.120 -2.082 1.427 1.00 1.00 C ATOM 1900 C LYS A 122 29.387 -1.722 2.210 1.00 1.00 C ATOM 1901 O LYS A 122 29.410 -0.777 2.973 1.00 1.00 O ATOM 1902 CB LYS A 122 27.786 -0.986 0.415 1.00 1.00 C ATOM 1903 CG LYS A 122 28.480 -1.288 -0.914 1.00 1.00 C ATOM 1904 CD LYS A 122 27.651 -2.301 -1.706 1.00 1.00 C ATOM 1905 CE LYS A 122 28.580 -3.175 -2.550 1.00 1.00 C ATOM 1906 NZ LYS A 122 29.788 -3.381 -1.704 1.00 1.00 N ATOM 0 H LYS A 122 26.343 -1.307 2.323 1.00 1.00 H new ATOM 0 HA LYS A 122 28.307 -3.041 0.943 1.00 1.00 H new ATOM 0 HB2 LYS A 122 26.707 -0.928 0.269 1.00 1.00 H new ATOM 0 HB3 LYS A 122 28.109 -0.016 0.794 1.00 1.00 H new ATOM 0 HG2 LYS A 122 28.600 -0.371 -1.490 1.00 1.00 H new ATOM 0 HG3 LYS A 122 29.480 -1.683 -0.733 1.00 1.00 H new ATOM 0 HD2 LYS A 122 27.070 -2.922 -1.025 1.00 1.00 H new ATOM 0 HD3 LYS A 122 26.940 -1.782 -2.349 1.00 1.00 H new ATOM 0 HE2 LYS A 122 28.108 -4.125 -2.802 1.00 1.00 H new ATOM 0 HE3 LYS A 122 28.835 -2.687 -3.490 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 30.310 -4.215 -2.041 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 30.400 -2.542 -1.763 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 29.499 -3.530 -0.716 1.00 1.00 H new ATOM 1919 N VAL A 123 30.440 -2.469 2.026 1.00 1.00 N ATOM 1920 CA VAL A 123 31.703 -2.169 2.758 1.00 1.00 C ATOM 1921 C VAL A 123 32.779 -1.689 1.781 1.00 1.00 C ATOM 1922 O VAL A 123 32.861 -2.145 0.659 1.00 1.00 O ATOM 1923 CB VAL A 123 32.114 -3.495 3.399 1.00 1.00 C ATOM 1924 CG1 VAL A 123 31.879 -3.424 4.909 1.00 1.00 C ATOM 1925 CG2 VAL A 123 31.275 -4.629 2.806 1.00 1.00 C ATOM 0 H VAL A 123 30.481 -3.274 1.401 1.00 1.00 H new ATOM 0 HA VAL A 123 31.573 -1.381 3.500 1.00 1.00 H new ATOM 0 HB VAL A 123 33.170 -3.683 3.203 1.00 1.00 H new ATOM 0 HG11 VAL A 123 32.171 -4.369 5.368 1.00 1.00 H new ATOM 0 HG12 VAL A 123 32.475 -2.615 5.332 1.00 1.00 H new ATOM 0 HG13 VAL A 123 30.823 -3.237 5.105 1.00 1.00 H new ATOM 0 HG21 VAL A 123 31.567 -5.575 3.262 1.00 1.00 H new ATOM 0 HG22 VAL A 123 30.219 -4.442 3.003 1.00 1.00 H new ATOM 0 HG23 VAL A 123 31.440 -4.679 1.730 1.00 1.00 H new ATOM 1935 N ASP A 124 33.606 -0.770 2.199 1.00 1.00 N ATOM 1936 CA ASP A 124 34.675 -0.261 1.293 1.00 1.00 C ATOM 1937 C ASP A 124 35.510 -1.426 0.753 1.00 1.00 C ATOM 1938 O ASP A 124 34.925 -2.333 0.185 1.00 1.00 O ATOM 1939 CB ASP A 124 35.533 0.655 2.167 1.00 1.00 C ATOM 1940 CG ASP A 124 36.770 -0.108 2.645 1.00 1.00 C ATOM 1941 OD1 ASP A 124 36.616 -0.981 3.483 1.00 1.00 O ATOM 1942 OD2 ASP A 124 37.850 0.193 2.164 1.00 1.00 O ATOM 0 H ASP A 124 33.588 -0.350 3.128 1.00 1.00 H new ATOM 0 HA ASP A 124 34.268 0.265 0.429 1.00 1.00 H new ATOM 0 HB2 ASP A 124 35.833 1.538 1.602 1.00 1.00 H new ATOM 0 HB3 ASP A 124 34.955 1.005 3.023 1.00 1.00 H new