USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 940 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 77 SER OG : rot 170:sc= -0.554 USER MOD Set 1.2: A 78 ASN : amide:sc= -1.18! K(o=-1.7!,f=-5.4) USER MOD Set 2.1: A 28 LYS NZ :NH3+ 147:sc= -0.403 (180deg=-1.45!) USER MOD Set 2.2: A 31 ASN : amide:sc= -0.504 K(o=-0.91,f=-2.9!) USER MOD Single : A 8 ASN : amide:sc= -0.0146 K(o=-0.015,f=-0.76) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 110:sc= -0.0914 USER MOD Single : A 22 LYS NZ :NH3+ 163:sc= -0.0174 (180deg=-0.21) USER MOD Single : A 26 THR OG1 : rot -31:sc= 0.972 USER MOD Single : A 34 SER OG : rot -78:sc= 0.243 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -119:sc= -0.307 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -178:sc= -3.81! (180deg=-4!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00414) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 62 TYR OH : rot 180:sc= -1.19 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot -109:sc= -0.0143 USER MOD Single : A 82 TYR OH : rot 180:sc= 0.371 USER MOD Single : A 91 LYS NZ :NH3+ 161:sc= -0.0761 (180deg=-0.415) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 98 CYS SG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0023 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 79:sc= 0.228 USER MOD Single : A 105 HIS : no HD1:sc= -0.213 X(o=-0.21,f=0) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 LYS NZ :NH3+ -144:sc= -1.27 (180deg=-3.58!) USER MOD Single : A 120 CYS SG : rot 87:sc= -1.16 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 0.265 18.360 4.252 1.00 0.00 N ATOM 60 CA GLY A 7 1.299 17.816 5.113 1.00 0.00 C ATOM 61 C GLY A 7 0.731 16.991 6.251 1.00 0.00 C ATOM 62 O GLY A 7 0.773 15.762 6.217 1.00 0.00 O ATOM 0 HA2 GLY A 7 1.972 17.197 4.520 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.894 18.633 5.522 1.00 0.00 H new ATOM 66 N ASN A 8 0.200 17.670 7.263 1.00 0.00 N ATOM 67 CA ASN A 8 -0.376 16.992 8.419 1.00 0.00 C ATOM 68 C ASN A 8 -1.506 16.058 7.994 1.00 0.00 C ATOM 69 O ASN A 8 -1.689 14.985 8.570 1.00 0.00 O ATOM 70 CB ASN A 8 -0.898 18.016 9.429 1.00 0.00 C ATOM 71 CG ASN A 8 0.182 18.975 9.890 1.00 0.00 C ATOM 72 OD1 ASN A 8 1.373 18.677 9.799 1.00 0.00 O ATOM 73 ND2 ASN A 8 -0.231 20.135 10.389 1.00 0.00 N ATOM 0 H ASN A 8 0.157 18.688 7.306 1.00 0.00 H new ATOM 0 HA ASN A 8 0.407 16.396 8.888 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -1.715 18.581 8.980 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -1.309 17.493 10.293 1.00 0.00 H new ATOM 0 HD21 ASN A 8 0.450 20.821 10.716 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -1.229 20.340 10.445 1.00 0.00 H new ATOM 80 N THR A 9 -2.261 16.474 6.982 1.00 0.00 N ATOM 81 CA THR A 9 -3.372 15.676 6.480 1.00 0.00 C ATOM 82 C THR A 9 -2.894 14.315 5.987 1.00 0.00 C ATOM 83 O THR A 9 -3.541 13.295 6.224 1.00 0.00 O ATOM 84 CB THR A 9 -4.107 16.396 5.333 1.00 0.00 C ATOM 85 OG1 THR A 9 -4.592 17.666 5.783 1.00 0.00 O ATOM 86 CG2 THR A 9 -5.269 15.556 4.824 1.00 0.00 C ATOM 0 H THR A 9 -2.123 17.359 6.494 1.00 0.00 H new ATOM 0 HA THR A 9 -4.061 15.535 7.312 1.00 0.00 H new ATOM 0 HB THR A 9 -3.401 16.546 4.516 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.056 18.118 5.048 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.773 16.084 4.015 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.894 14.601 4.456 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.974 15.380 5.636 1.00 0.00 H new ATOM 94 N LEU A 10 -1.757 14.307 5.299 1.00 0.00 N ATOM 95 CA LEU A 10 -1.191 13.070 4.773 1.00 0.00 C ATOM 96 C LEU A 10 -0.584 12.229 5.892 1.00 0.00 C ATOM 97 O LEU A 10 -0.829 11.025 5.979 1.00 0.00 O ATOM 98 CB LEU A 10 -0.127 13.381 3.719 1.00 0.00 C ATOM 99 CG LEU A 10 -0.633 13.561 2.287 1.00 0.00 C ATOM 100 CD1 LEU A 10 0.332 14.420 1.484 1.00 0.00 C ATOM 101 CD2 LEU A 10 -0.830 12.208 1.617 1.00 0.00 C ATOM 0 H LEU A 10 -1.210 15.143 5.093 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.996 12.499 4.311 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.395 14.291 4.016 1.00 0.00 H new ATOM 0 HB3 LEU A 10 0.608 12.576 3.725 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.596 14.070 2.323 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -0.044 14.537 0.468 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.423 15.400 1.953 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.310 13.939 1.456 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -1.190 12.355 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.119 11.673 1.592 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.560 11.626 2.180 1.00 0.00 H new ATOM 113 N ARG A 11 0.206 12.871 6.746 1.00 0.00 N ATOM 114 CA ARG A 11 0.847 12.183 7.860 1.00 0.00 C ATOM 115 C ARG A 11 -0.099 11.160 8.483 1.00 0.00 C ATOM 116 O ARG A 11 0.257 9.995 8.652 1.00 0.00 O ATOM 117 CB ARG A 11 1.296 13.190 8.919 1.00 0.00 C ATOM 118 CG ARG A 11 2.030 12.557 10.090 1.00 0.00 C ATOM 119 CD ARG A 11 2.053 13.480 11.298 1.00 0.00 C ATOM 120 NE ARG A 11 3.159 14.432 11.237 1.00 0.00 N ATOM 121 CZ ARG A 11 3.393 15.348 12.171 1.00 0.00 C ATOM 122 NH1 ARG A 11 2.601 15.435 13.231 1.00 0.00 N ATOM 123 NH2 ARG A 11 4.419 16.179 12.045 1.00 0.00 N ATOM 0 H ARG A 11 0.418 13.867 6.688 1.00 0.00 H new ATOM 0 HA ARG A 11 1.721 11.657 7.476 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.945 13.930 8.452 1.00 0.00 H new ATOM 0 HB3 ARG A 11 0.423 13.723 9.294 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.547 11.617 10.358 1.00 0.00 H new ATOM 0 HG3 ARG A 11 3.051 12.318 9.794 1.00 0.00 H new ATOM 0 HD2 ARG A 11 1.110 14.023 11.358 1.00 0.00 H new ATOM 0 HD3 ARG A 11 2.136 12.885 12.208 1.00 0.00 H new ATOM 0 HE ARG A 11 3.786 14.392 10.434 1.00 0.00 H new ATOM 0 HH11 ARG A 11 1.810 14.798 13.331 1.00 0.00 H new ATOM 0 HH12 ARG A 11 2.782 16.139 13.947 1.00 0.00 H new ATOM 0 HH21 ARG A 11 5.030 16.116 11.230 1.00 0.00 H new ATOM 0 HH22 ARG A 11 4.597 16.882 12.763 1.00 0.00 H new ATOM 137 N GLU A 12 -1.304 11.607 8.823 1.00 0.00 N ATOM 138 CA GLU A 12 -2.300 10.731 9.429 1.00 0.00 C ATOM 139 C GLU A 12 -2.654 9.580 8.492 1.00 0.00 C ATOM 140 O GLU A 12 -2.660 8.415 8.895 1.00 0.00 O ATOM 141 CB GLU A 12 -3.561 11.522 9.783 1.00 0.00 C ATOM 142 CG GLU A 12 -3.343 12.560 10.871 1.00 0.00 C ATOM 143 CD GLU A 12 -2.599 12.003 12.069 1.00 0.00 C ATOM 144 OE1 GLU A 12 -1.357 11.893 11.997 1.00 0.00 O ATOM 145 OE2 GLU A 12 -3.259 11.675 13.077 1.00 0.00 O ATOM 0 H GLU A 12 -1.614 12.570 8.689 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.873 10.316 10.342 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.931 12.020 8.887 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.337 10.828 10.105 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -2.784 13.400 10.459 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.308 12.948 11.196 1.00 0.00 H new ATOM 152 N LEU A 13 -2.950 9.913 7.241 1.00 0.00 N ATOM 153 CA LEU A 13 -3.307 8.909 6.245 1.00 0.00 C ATOM 154 C LEU A 13 -2.271 7.789 6.206 1.00 0.00 C ATOM 155 O LEU A 13 -2.617 6.609 6.257 1.00 0.00 O ATOM 156 CB LEU A 13 -3.430 9.553 4.863 1.00 0.00 C ATOM 157 CG LEU A 13 -3.721 8.601 3.702 1.00 0.00 C ATOM 158 CD1 LEU A 13 -5.220 8.439 3.507 1.00 0.00 C ATOM 159 CD2 LEU A 13 -3.066 9.104 2.424 1.00 0.00 C ATOM 0 H LEU A 13 -2.950 10.871 6.892 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.269 8.481 6.526 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -4.223 10.300 4.902 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.503 10.084 4.648 1.00 0.00 H new ATOM 0 HG LEU A 13 -3.300 7.625 3.943 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -5.407 7.758 2.677 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -5.663 8.033 4.416 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -5.665 9.409 3.288 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.283 8.415 1.608 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.457 10.091 2.179 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.987 9.167 2.568 1.00 0.00 H new ATOM 171 N ARG A 14 -1.000 8.169 6.118 1.00 0.00 N ATOM 172 CA ARG A 14 0.085 7.197 6.073 1.00 0.00 C ATOM 173 C ARG A 14 -0.051 6.176 7.200 1.00 0.00 C ATOM 174 O ARG A 14 -0.185 4.977 6.953 1.00 0.00 O ATOM 175 CB ARG A 14 1.437 7.906 6.174 1.00 0.00 C ATOM 176 CG ARG A 14 2.610 6.957 6.363 1.00 0.00 C ATOM 177 CD ARG A 14 3.940 7.674 6.189 1.00 0.00 C ATOM 178 NE ARG A 14 5.023 6.999 6.899 1.00 0.00 N ATOM 179 CZ ARG A 14 5.215 7.096 8.210 1.00 0.00 C ATOM 180 NH1 ARG A 14 4.401 7.837 8.949 1.00 0.00 N ATOM 181 NH2 ARG A 14 6.223 6.451 8.783 1.00 0.00 N ATOM 0 H ARG A 14 -0.697 9.142 6.077 1.00 0.00 H new ATOM 0 HA ARG A 14 0.028 6.670 5.120 1.00 0.00 H new ATOM 0 HB2 ARG A 14 1.598 8.494 5.270 1.00 0.00 H new ATOM 0 HB3 ARG A 14 1.409 8.606 7.009 1.00 0.00 H new ATOM 0 HG2 ARG A 14 2.563 6.512 7.357 1.00 0.00 H new ATOM 0 HG3 ARG A 14 2.539 6.141 5.644 1.00 0.00 H new ATOM 0 HD2 ARG A 14 4.184 7.733 5.128 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.850 8.697 6.553 1.00 0.00 H new ATOM 0 HE ARG A 14 5.667 6.421 6.359 1.00 0.00 H new ATOM 0 HH11 ARG A 14 3.625 8.334 8.511 1.00 0.00 H new ATOM 0 HH12 ARG A 14 4.550 7.910 9.955 1.00 0.00 H new ATOM 0 HH21 ARG A 14 6.851 5.880 8.217 1.00 0.00 H new ATOM 0 HH22 ARG A 14 6.370 6.526 9.790 1.00 0.00 H new ATOM 195 N LEU A 15 -0.017 6.660 8.436 1.00 0.00 N ATOM 196 CA LEU A 15 -0.136 5.791 9.602 1.00 0.00 C ATOM 197 C LEU A 15 -1.414 4.961 9.533 1.00 0.00 C ATOM 198 O LEU A 15 -1.395 3.752 9.764 1.00 0.00 O ATOM 199 CB LEU A 15 -0.123 6.622 10.886 1.00 0.00 C ATOM 200 CG LEU A 15 1.234 7.192 11.302 1.00 0.00 C ATOM 201 CD1 LEU A 15 1.069 8.181 12.446 1.00 0.00 C ATOM 202 CD2 LEU A 15 2.185 6.071 11.696 1.00 0.00 C ATOM 0 H LEU A 15 0.092 7.650 8.657 1.00 0.00 H new ATOM 0 HA LEU A 15 0.717 5.112 9.608 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.821 7.450 10.766 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.500 6.003 11.700 1.00 0.00 H new ATOM 0 HG LEU A 15 1.661 7.721 10.450 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.045 8.576 12.729 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.424 9.000 12.129 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.620 7.676 13.302 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.146 6.495 11.989 1.00 0.00 H new ATOM 0 HD22 LEU A 15 1.764 5.514 12.533 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.328 5.400 10.849 1.00 0.00 H new ATOM 214 N PHE A 16 -2.524 5.618 9.211 1.00 0.00 N ATOM 215 CA PHE A 16 -3.811 4.941 9.111 1.00 0.00 C ATOM 216 C PHE A 16 -3.712 3.716 8.205 1.00 0.00 C ATOM 217 O PHE A 16 -3.997 2.594 8.626 1.00 0.00 O ATOM 218 CB PHE A 16 -4.876 5.900 8.575 1.00 0.00 C ATOM 219 CG PHE A 16 -6.109 5.207 8.070 1.00 0.00 C ATOM 220 CD1 PHE A 16 -6.909 4.474 8.932 1.00 0.00 C ATOM 221 CD2 PHE A 16 -6.467 5.288 6.734 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.044 3.835 8.469 1.00 0.00 C ATOM 223 CE2 PHE A 16 -7.601 4.651 6.266 1.00 0.00 C ATOM 224 CZ PHE A 16 -8.391 3.924 7.135 1.00 0.00 C ATOM 0 H PHE A 16 -2.557 6.618 9.015 1.00 0.00 H new ATOM 0 HA PHE A 16 -4.098 4.611 10.109 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -5.158 6.595 9.366 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.446 6.493 7.768 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -6.643 4.401 9.976 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -5.853 5.855 6.050 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -8.659 3.266 9.150 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -7.869 4.722 5.222 1.00 0.00 H new ATOM 0 HZ PHE A 16 -9.278 3.426 6.772 1.00 0.00 H new ATOM 234 N LEU A 17 -3.308 3.940 6.960 1.00 0.00 N ATOM 235 CA LEU A 17 -3.171 2.857 5.993 1.00 0.00 C ATOM 236 C LEU A 17 -2.166 1.817 6.479 1.00 0.00 C ATOM 237 O LEU A 17 -2.494 0.638 6.613 1.00 0.00 O ATOM 238 CB LEU A 17 -2.735 3.410 4.635 1.00 0.00 C ATOM 239 CG LEU A 17 -3.758 4.279 3.904 1.00 0.00 C ATOM 240 CD1 LEU A 17 -3.156 4.858 2.633 1.00 0.00 C ATOM 241 CD2 LEU A 17 -5.009 3.474 3.584 1.00 0.00 C ATOM 0 H LEU A 17 -3.069 4.862 6.596 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.142 2.374 5.886 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.827 3.996 4.778 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.474 2.571 3.990 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.038 5.105 4.558 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -3.899 5.474 2.126 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -2.290 5.469 2.886 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.847 4.046 1.974 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -5.727 4.108 3.064 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.745 2.628 2.949 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.453 3.108 4.510 1.00 0.00 H new ATOM 253 N ARG A 18 -0.943 2.263 6.742 1.00 0.00 N ATOM 254 CA ARG A 18 0.110 1.371 7.214 1.00 0.00 C ATOM 255 C ARG A 18 -0.413 0.443 8.306 1.00 0.00 C ATOM 256 O ARG A 18 -0.123 -0.754 8.309 1.00 0.00 O ATOM 257 CB ARG A 18 1.295 2.181 7.743 1.00 0.00 C ATOM 258 CG ARG A 18 2.621 1.442 7.668 1.00 0.00 C ATOM 259 CD ARG A 18 3.793 2.371 7.942 1.00 0.00 C ATOM 260 NE ARG A 18 3.876 2.746 9.351 1.00 0.00 N ATOM 261 CZ ARG A 18 4.483 2.007 10.274 1.00 0.00 C ATOM 262 NH1 ARG A 18 5.057 0.860 9.938 1.00 0.00 N ATOM 263 NH2 ARG A 18 4.517 2.416 11.536 1.00 0.00 N ATOM 0 H ARG A 18 -0.656 3.236 6.637 1.00 0.00 H new ATOM 0 HA ARG A 18 0.441 0.763 6.372 1.00 0.00 H new ATOM 0 HB2 ARG A 18 1.373 3.108 7.175 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.101 2.458 8.779 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.625 0.626 8.391 1.00 0.00 H new ATOM 0 HG3 ARG A 18 2.734 0.994 6.681 1.00 0.00 H new ATOM 0 HD2 ARG A 18 4.720 1.883 7.641 1.00 0.00 H new ATOM 0 HD3 ARG A 18 3.694 3.269 7.333 1.00 0.00 H new ATOM 0 HE ARG A 18 3.445 3.623 9.643 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.034 0.543 8.969 1.00 0.00 H new ATOM 0 HH12 ARG A 18 5.522 0.295 10.649 1.00 0.00 H new ATOM 0 HH21 ARG A 18 4.077 3.298 11.798 1.00 0.00 H new ATOM 0 HH22 ARG A 18 4.983 1.848 12.244 1.00 0.00 H new ATOM 277 N ASP A 19 -1.184 1.002 9.232 1.00 0.00 N ATOM 278 CA ASP A 19 -1.748 0.225 10.329 1.00 0.00 C ATOM 279 C ASP A 19 -2.656 -0.882 9.801 1.00 0.00 C ATOM 280 O ASP A 19 -2.688 -1.986 10.345 1.00 0.00 O ATOM 281 CB ASP A 19 -2.531 1.134 11.277 1.00 0.00 C ATOM 282 CG ASP A 19 -3.013 0.403 12.515 1.00 0.00 C ATOM 283 OD1 ASP A 19 -3.415 -0.773 12.392 1.00 0.00 O ATOM 284 OD2 ASP A 19 -2.986 1.007 13.608 1.00 0.00 O ATOM 0 H ASP A 19 -1.433 1.991 9.245 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.925 -0.235 10.876 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -1.901 1.972 11.576 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -3.388 1.552 10.749 1.00 0.00 H new ATOM 289 N VAL A 20 -3.394 -0.578 8.738 1.00 0.00 N ATOM 290 CA VAL A 20 -4.302 -1.546 8.135 1.00 0.00 C ATOM 291 C VAL A 20 -3.532 -2.666 7.444 1.00 0.00 C ATOM 292 O VAL A 20 -3.591 -3.824 7.860 1.00 0.00 O ATOM 293 CB VAL A 20 -5.240 -0.876 7.113 1.00 0.00 C ATOM 294 CG1 VAL A 20 -6.100 -1.918 6.415 1.00 0.00 C ATOM 295 CG2 VAL A 20 -6.106 0.173 7.794 1.00 0.00 C ATOM 0 H VAL A 20 -3.381 0.332 8.277 1.00 0.00 H new ATOM 0 HA VAL A 20 -4.900 -1.966 8.944 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.631 -0.378 6.358 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -6.756 -1.426 5.697 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.459 -2.629 5.893 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.702 -2.447 7.154 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -6.763 0.637 7.058 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.708 -0.300 8.570 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -5.469 0.935 8.243 1.00 0.00 H new ATOM 305 N THR A 21 -2.809 -2.314 6.386 1.00 0.00 N ATOM 306 CA THR A 21 -2.027 -3.289 5.636 1.00 0.00 C ATOM 307 C THR A 21 -1.206 -4.171 6.569 1.00 0.00 C ATOM 308 O THR A 21 -1.193 -5.394 6.434 1.00 0.00 O ATOM 309 CB THR A 21 -1.081 -2.600 4.634 1.00 0.00 C ATOM 310 OG1 THR A 21 -1.827 -1.733 3.772 1.00 0.00 O ATOM 311 CG2 THR A 21 -0.331 -3.629 3.802 1.00 0.00 C ATOM 0 H THR A 21 -2.749 -1.360 6.029 1.00 0.00 H new ATOM 0 HA THR A 21 -2.737 -3.908 5.087 1.00 0.00 H new ATOM 0 HB THR A 21 -0.355 -2.014 5.198 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.617 -0.800 3.985 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.331 -3.119 3.102 1.00 0.00 H new ATOM 0 HG22 THR A 21 0.259 -4.268 4.459 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.045 -4.239 3.248 1.00 0.00 H new ATOM 319 N LYS A 22 -0.520 -3.542 7.518 1.00 0.00 N ATOM 320 CA LYS A 22 0.304 -4.269 8.477 1.00 0.00 C ATOM 321 C LYS A 22 -0.506 -5.355 9.176 1.00 0.00 C ATOM 322 O LYS A 22 -0.171 -6.538 9.101 1.00 0.00 O ATOM 323 CB LYS A 22 0.887 -3.305 9.513 1.00 0.00 C ATOM 324 CG LYS A 22 1.591 -4.003 10.664 1.00 0.00 C ATOM 325 CD LYS A 22 1.907 -3.037 11.793 1.00 0.00 C ATOM 326 CE LYS A 22 0.680 -2.758 12.648 1.00 0.00 C ATOM 327 NZ LYS A 22 0.291 -3.942 13.463 1.00 0.00 N ATOM 0 H LYS A 22 -0.518 -2.530 7.643 1.00 0.00 H new ATOM 0 HA LYS A 22 1.120 -4.743 7.932 1.00 0.00 H new ATOM 0 HB2 LYS A 22 1.592 -2.636 9.019 1.00 0.00 H new ATOM 0 HB3 LYS A 22 0.085 -2.684 9.912 1.00 0.00 H new ATOM 0 HG2 LYS A 22 0.963 -4.810 11.040 1.00 0.00 H new ATOM 0 HG3 LYS A 22 2.514 -4.458 10.305 1.00 0.00 H new ATOM 0 HD2 LYS A 22 2.700 -3.451 12.416 1.00 0.00 H new ATOM 0 HD3 LYS A 22 2.283 -2.102 11.378 1.00 0.00 H new ATOM 0 HE2 LYS A 22 0.881 -1.914 13.307 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -0.152 -2.470 12.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -0.347 -3.643 14.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -0.194 -4.635 12.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 1.142 -4.376 13.873 1.00 0.00 H new ATOM 341 N ARG A 23 -1.574 -4.947 9.854 1.00 0.00 N ATOM 342 CA ARG A 23 -2.432 -5.887 10.566 1.00 0.00 C ATOM 343 C ARG A 23 -2.738 -7.106 9.702 1.00 0.00 C ATOM 344 O ARG A 23 -2.625 -8.246 10.155 1.00 0.00 O ATOM 345 CB ARG A 23 -3.736 -5.204 10.984 1.00 0.00 C ATOM 346 CG ARG A 23 -4.632 -6.078 11.847 1.00 0.00 C ATOM 347 CD ARG A 23 -4.207 -6.041 13.306 1.00 0.00 C ATOM 348 NE ARG A 23 -5.089 -6.840 14.153 1.00 0.00 N ATOM 349 CZ ARG A 23 -6.272 -6.418 14.586 1.00 0.00 C ATOM 350 NH1 ARG A 23 -6.713 -5.213 14.252 1.00 0.00 N ATOM 351 NH2 ARG A 23 -7.017 -7.204 15.353 1.00 0.00 N ATOM 0 H ARG A 23 -1.866 -3.972 9.925 1.00 0.00 H new ATOM 0 HA ARG A 23 -1.902 -6.220 11.458 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.499 -4.291 11.530 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -4.284 -4.908 10.090 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -5.665 -5.741 11.759 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -4.600 -7.105 11.483 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -3.186 -6.411 13.396 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -4.204 -5.009 13.657 1.00 0.00 H new ATOM 0 HE ARG A 23 -4.780 -7.773 14.427 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -6.144 -4.607 13.661 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -7.622 -4.892 14.586 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -6.681 -8.132 15.610 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -7.925 -6.880 15.685 1.00 0.00 H new ATOM 365 N LEU A 24 -3.126 -6.859 8.456 1.00 0.00 N ATOM 366 CA LEU A 24 -3.449 -7.937 7.527 1.00 0.00 C ATOM 367 C LEU A 24 -2.261 -8.877 7.349 1.00 0.00 C ATOM 368 O LEU A 24 -2.392 -10.092 7.491 1.00 0.00 O ATOM 369 CB LEU A 24 -3.867 -7.362 6.173 1.00 0.00 C ATOM 370 CG LEU A 24 -5.091 -6.446 6.181 1.00 0.00 C ATOM 371 CD1 LEU A 24 -5.210 -5.701 4.860 1.00 0.00 C ATOM 372 CD2 LEU A 24 -6.355 -7.247 6.458 1.00 0.00 C ATOM 0 H LEU A 24 -3.225 -5.922 8.065 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.279 -8.506 7.945 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.025 -6.806 5.762 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.064 -8.192 5.494 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.966 -5.713 6.978 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.087 -5.054 4.885 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.317 -5.096 4.702 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.311 -6.418 4.046 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.216 -6.579 6.460 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -6.484 -8.003 5.683 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.272 -7.734 7.430 1.00 0.00 H new ATOM 384 N ALA A 25 -1.102 -8.305 7.040 1.00 0.00 N ATOM 385 CA ALA A 25 0.110 -9.091 6.847 1.00 0.00 C ATOM 386 C ALA A 25 0.394 -9.970 8.060 1.00 0.00 C ATOM 387 O ALA A 25 0.392 -11.198 7.965 1.00 0.00 O ATOM 388 CB ALA A 25 1.293 -8.176 6.567 1.00 0.00 C ATOM 0 H ALA A 25 -0.977 -7.300 6.918 1.00 0.00 H new ATOM 0 HA ALA A 25 -0.043 -9.743 5.987 1.00 0.00 H new ATOM 0 HB1 ALA A 25 2.192 -8.776 6.425 1.00 0.00 H new ATOM 0 HB2 ALA A 25 1.098 -7.595 5.665 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.438 -7.500 7.410 1.00 0.00 H new ATOM 394 N THR A 26 0.638 -9.334 9.202 1.00 0.00 N ATOM 395 CA THR A 26 0.925 -10.057 10.434 1.00 0.00 C ATOM 396 C THR A 26 0.074 -11.318 10.542 1.00 0.00 C ATOM 397 O THR A 26 0.566 -12.379 10.925 1.00 0.00 O ATOM 398 CB THR A 26 0.679 -9.177 11.673 1.00 0.00 C ATOM 399 OG1 THR A 26 -0.677 -8.715 11.684 1.00 0.00 O ATOM 400 CG2 THR A 26 1.626 -7.986 11.688 1.00 0.00 C ATOM 0 H THR A 26 0.642 -8.319 9.299 1.00 0.00 H new ATOM 0 HA THR A 26 1.978 -10.335 10.399 1.00 0.00 H new ATOM 0 HB THR A 26 0.865 -9.780 12.562 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.997 -8.618 10.763 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.433 -7.379 12.573 1.00 0.00 H new ATOM 0 HG22 THR A 26 2.656 -8.341 11.709 1.00 0.00 H new ATOM 0 HG23 THR A 26 1.468 -7.384 10.793 1.00 0.00 H new ATOM 408 N ASP A 27 -1.204 -11.193 10.203 1.00 0.00 N ATOM 409 CA ASP A 27 -2.124 -12.324 10.260 1.00 0.00 C ATOM 410 C ASP A 27 -1.799 -13.344 9.174 1.00 0.00 C ATOM 411 O ASP A 27 -1.997 -13.087 7.986 1.00 0.00 O ATOM 412 CB ASP A 27 -3.568 -11.842 10.111 1.00 0.00 C ATOM 413 CG ASP A 27 -4.182 -11.433 11.435 1.00 0.00 C ATOM 414 OD1 ASP A 27 -3.932 -12.126 12.443 1.00 0.00 O ATOM 415 OD2 ASP A 27 -4.913 -10.421 11.463 1.00 0.00 O ATOM 0 H ASP A 27 -1.627 -10.321 9.886 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.009 -12.806 11.231 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.596 -10.996 9.424 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -4.168 -12.635 9.665 1.00 0.00 H new ATOM 420 N LYS A 28 -1.299 -14.503 9.588 1.00 0.00 N ATOM 421 CA LYS A 28 -0.947 -15.563 8.651 1.00 0.00 C ATOM 422 C LYS A 28 -1.996 -15.688 7.550 1.00 0.00 C ATOM 423 O LYS A 28 -1.671 -15.986 6.401 1.00 0.00 O ATOM 424 CB LYS A 28 -0.805 -16.897 9.388 1.00 0.00 C ATOM 425 CG LYS A 28 0.504 -17.037 10.146 1.00 0.00 C ATOM 426 CD LYS A 28 1.576 -17.692 9.292 1.00 0.00 C ATOM 427 CE LYS A 28 2.397 -16.657 8.538 1.00 0.00 C ATOM 428 NZ LYS A 28 2.929 -15.603 9.446 1.00 0.00 N ATOM 0 H LYS A 28 -1.128 -14.732 10.567 1.00 0.00 H new ATOM 0 HA LYS A 28 0.007 -15.305 8.192 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -1.634 -17.006 10.088 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.887 -17.711 8.668 1.00 0.00 H new ATOM 0 HG2 LYS A 28 0.845 -16.053 10.469 1.00 0.00 H new ATOM 0 HG3 LYS A 28 0.342 -17.630 11.046 1.00 0.00 H new ATOM 0 HD2 LYS A 28 2.233 -18.288 9.925 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.110 -18.376 8.582 1.00 0.00 H new ATOM 0 HE2 LYS A 28 3.225 -17.151 8.030 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.780 -16.195 7.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.854 -15.279 9.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.268 -14.801 9.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 3.037 -15.993 10.404 1.00 0.00 H new ATOM 442 N ARG A 29 -3.254 -15.456 7.910 1.00 0.00 N ATOM 443 CA ARG A 29 -4.350 -15.541 6.952 1.00 0.00 C ATOM 444 C ARG A 29 -4.017 -14.776 5.675 1.00 0.00 C ATOM 445 O ARG A 29 -4.077 -15.327 4.575 1.00 0.00 O ATOM 446 CB ARG A 29 -5.638 -14.992 7.568 1.00 0.00 C ATOM 447 CG ARG A 29 -6.895 -15.400 6.818 1.00 0.00 C ATOM 448 CD ARG A 29 -8.092 -15.501 7.750 1.00 0.00 C ATOM 449 NE ARG A 29 -8.732 -14.206 7.961 1.00 0.00 N ATOM 450 CZ ARG A 29 -9.490 -13.924 9.015 1.00 0.00 C ATOM 451 NH1 ARG A 29 -9.701 -14.842 9.949 1.00 0.00 N ATOM 452 NH2 ARG A 29 -10.039 -12.722 9.137 1.00 0.00 N ATOM 0 H ARG A 29 -3.540 -15.208 8.857 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.496 -16.591 6.698 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.713 -15.337 8.599 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -5.581 -13.904 7.599 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -7.104 -14.673 6.033 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -6.732 -16.360 6.328 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -8.817 -16.200 7.334 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -7.771 -15.907 8.709 1.00 0.00 H new ATOM 0 HE ARG A 29 -8.589 -13.478 7.261 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -9.281 -15.767 9.859 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -10.283 -14.623 10.757 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -9.879 -12.013 8.421 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -10.621 -12.507 9.947 1.00 0.00 H new ATOM 466 N PHE A 30 -3.667 -13.503 5.828 1.00 0.00 N ATOM 467 CA PHE A 30 -3.327 -12.661 4.687 1.00 0.00 C ATOM 468 C PHE A 30 -1.816 -12.471 4.583 1.00 0.00 C ATOM 469 O PHE A 30 -1.332 -11.356 4.396 1.00 0.00 O ATOM 470 CB PHE A 30 -4.016 -11.301 4.806 1.00 0.00 C ATOM 471 CG PHE A 30 -5.463 -11.394 5.200 1.00 0.00 C ATOM 472 CD1 PHE A 30 -6.348 -12.161 4.461 1.00 0.00 C ATOM 473 CD2 PHE A 30 -5.937 -10.715 6.311 1.00 0.00 C ATOM 474 CE1 PHE A 30 -7.679 -12.250 4.821 1.00 0.00 C ATOM 475 CE2 PHE A 30 -7.267 -10.800 6.676 1.00 0.00 C ATOM 476 CZ PHE A 30 -8.140 -11.567 5.930 1.00 0.00 C ATOM 0 H PHE A 30 -3.611 -13.032 6.731 1.00 0.00 H new ATOM 0 HA PHE A 30 -3.677 -13.159 3.783 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -3.485 -10.697 5.542 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -3.940 -10.780 3.852 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -5.993 -12.696 3.593 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -5.259 -10.113 6.898 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.358 -12.853 4.236 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -7.624 -10.267 7.545 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.180 -11.633 6.213 1.00 0.00 H new ATOM 486 N ASN A 31 -1.078 -13.569 4.708 1.00 0.00 N ATOM 487 CA ASN A 31 0.378 -13.524 4.629 1.00 0.00 C ATOM 488 C ASN A 31 0.873 -14.155 3.331 1.00 0.00 C ATOM 489 O ASN A 31 1.834 -13.680 2.726 1.00 0.00 O ATOM 490 CB ASN A 31 0.997 -14.246 5.828 1.00 0.00 C ATOM 491 CG ASN A 31 2.506 -14.105 5.872 1.00 0.00 C ATOM 492 OD1 ASN A 31 3.204 -14.496 4.936 1.00 0.00 O ATOM 493 ND2 ASN A 31 3.017 -13.545 6.962 1.00 0.00 N ATOM 0 H ASN A 31 -1.464 -14.500 4.864 1.00 0.00 H new ATOM 0 HA ASN A 31 0.685 -12.478 4.644 1.00 0.00 H new ATOM 0 HB2 ASN A 31 0.571 -13.847 6.748 1.00 0.00 H new ATOM 0 HB3 ASN A 31 0.735 -15.303 5.787 1.00 0.00 H new ATOM 0 HD21 ASN A 31 4.026 -13.424 7.048 1.00 0.00 H new ATOM 0 HD22 ASN A 31 2.400 -13.236 7.713 1.00 0.00 H new ATOM 500 N ILE A 32 0.208 -15.226 2.910 1.00 0.00 N ATOM 501 CA ILE A 32 0.579 -15.920 1.683 1.00 0.00 C ATOM 502 C ILE A 32 0.558 -14.973 0.487 1.00 0.00 C ATOM 503 O ILE A 32 1.089 -15.289 -0.578 1.00 0.00 O ATOM 504 CB ILE A 32 -0.361 -17.106 1.401 1.00 0.00 C ATOM 505 CG1 ILE A 32 -1.771 -16.603 1.083 1.00 0.00 C ATOM 506 CG2 ILE A 32 -0.387 -18.056 2.589 1.00 0.00 C ATOM 507 CD1 ILE A 32 -2.656 -17.649 0.443 1.00 0.00 C ATOM 0 H ILE A 32 -0.589 -15.631 3.400 1.00 0.00 H new ATOM 0 HA ILE A 32 1.592 -16.296 1.827 1.00 0.00 H new ATOM 0 HB ILE A 32 0.015 -17.650 0.534 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.240 -16.256 2.004 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.700 -15.743 0.417 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.056 -18.889 2.374 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.618 -18.436 2.773 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -0.742 -17.525 3.472 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.639 -17.222 0.246 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.209 -17.979 -0.495 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -2.758 -18.500 1.116 1.00 0.00 H new ATOM 519 N PHE A 33 -0.057 -13.810 0.672 1.00 0.00 N ATOM 520 CA PHE A 33 -0.147 -12.816 -0.391 1.00 0.00 C ATOM 521 C PHE A 33 1.024 -11.840 -0.324 1.00 0.00 C ATOM 522 O PHE A 33 1.405 -11.241 -1.330 1.00 0.00 O ATOM 523 CB PHE A 33 -1.469 -12.051 -0.293 1.00 0.00 C ATOM 524 CG PHE A 33 -2.676 -12.944 -0.238 1.00 0.00 C ATOM 525 CD1 PHE A 33 -3.278 -13.388 -1.404 1.00 0.00 C ATOM 526 CD2 PHE A 33 -3.208 -13.338 0.979 1.00 0.00 C ATOM 527 CE1 PHE A 33 -4.389 -14.210 -1.358 1.00 0.00 C ATOM 528 CE2 PHE A 33 -4.317 -14.160 1.031 1.00 0.00 C ATOM 529 CZ PHE A 33 -4.909 -14.595 -0.138 1.00 0.00 C ATOM 0 H PHE A 33 -0.500 -13.533 1.548 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.107 -13.339 -1.347 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -1.451 -11.423 0.598 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -1.559 -11.385 -1.151 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.875 -13.089 -2.360 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -2.751 -12.999 1.897 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.849 -14.550 -2.274 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.721 -14.462 1.986 1.00 0.00 H new ATOM 0 HZ PHE A 33 -5.778 -15.236 -0.098 1.00 0.00 H new ATOM 539 N SER A 34 1.590 -11.686 0.868 1.00 0.00 N ATOM 540 CA SER A 34 2.716 -10.780 1.069 1.00 0.00 C ATOM 541 C SER A 34 3.898 -11.180 0.191 1.00 0.00 C ATOM 542 O SER A 34 4.766 -10.361 -0.112 1.00 0.00 O ATOM 543 CB SER A 34 3.137 -10.775 2.539 1.00 0.00 C ATOM 544 OG SER A 34 4.119 -11.765 2.792 1.00 0.00 O ATOM 0 H SER A 34 1.288 -12.176 1.710 1.00 0.00 H new ATOM 0 HA SER A 34 2.399 -9.776 0.786 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.529 -9.793 2.805 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.266 -10.952 3.170 1.00 0.00 H new ATOM 0 HG SER A 34 3.688 -12.643 2.861 1.00 0.00 H new ATOM 550 N LYS A 35 3.923 -12.444 -0.216 1.00 0.00 N ATOM 551 CA LYS A 35 4.997 -12.955 -1.061 1.00 0.00 C ATOM 552 C LYS A 35 4.441 -13.526 -2.362 1.00 0.00 C ATOM 553 O LYS A 35 3.255 -13.838 -2.474 1.00 0.00 O ATOM 554 CB LYS A 35 5.790 -14.032 -0.317 1.00 0.00 C ATOM 555 CG LYS A 35 6.959 -13.482 0.482 1.00 0.00 C ATOM 556 CD LYS A 35 7.841 -14.598 1.017 1.00 0.00 C ATOM 557 CE LYS A 35 7.194 -15.302 2.200 1.00 0.00 C ATOM 558 NZ LYS A 35 7.915 -16.553 2.563 1.00 0.00 N ATOM 0 H LYS A 35 3.212 -13.134 0.025 1.00 0.00 H new ATOM 0 HA LYS A 35 5.661 -12.125 -1.303 1.00 0.00 H new ATOM 0 HB2 LYS A 35 5.119 -14.565 0.356 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.163 -14.760 -1.038 1.00 0.00 H new ATOM 0 HG2 LYS A 35 7.552 -12.818 -0.148 1.00 0.00 H new ATOM 0 HG3 LYS A 35 6.584 -12.883 1.312 1.00 0.00 H new ATOM 0 HD2 LYS A 35 8.036 -15.321 0.225 1.00 0.00 H new ATOM 0 HD3 LYS A 35 8.805 -14.188 1.319 1.00 0.00 H new ATOM 0 HE2 LYS A 35 7.178 -14.630 3.058 1.00 0.00 H new ATOM 0 HE3 LYS A 35 6.157 -15.537 1.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 7.443 -17.003 3.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 7.909 -17.205 1.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 8.898 -16.326 2.817 1.00 0.00 H new ATOM 572 N PRO A 36 5.315 -13.667 -3.369 1.00 0.00 N ATOM 573 CA PRO A 36 4.934 -14.203 -4.679 1.00 0.00 C ATOM 574 C PRO A 36 4.608 -15.691 -4.624 1.00 0.00 C ATOM 575 O PRO A 36 5.498 -16.527 -4.465 1.00 0.00 O ATOM 576 CB PRO A 36 6.179 -13.959 -5.537 1.00 0.00 C ATOM 577 CG PRO A 36 7.306 -13.914 -4.565 1.00 0.00 C ATOM 578 CD PRO A 36 6.744 -13.315 -3.305 1.00 0.00 C ATOM 0 HA PRO A 36 4.032 -13.729 -5.067 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.318 -14.755 -6.268 1.00 0.00 H new ATOM 0 HB3 PRO A 36 6.099 -13.025 -6.094 1.00 0.00 H new ATOM 0 HG2 PRO A 36 7.701 -14.913 -4.380 1.00 0.00 H new ATOM 0 HG3 PRO A 36 8.129 -13.312 -4.950 1.00 0.00 H new ATOM 0 HD2 PRO A 36 7.220 -13.728 -2.416 1.00 0.00 H new ATOM 0 HD3 PRO A 36 6.891 -12.235 -3.273 1.00 0.00 H new ATOM 586 N VAL A 37 3.326 -16.016 -4.757 1.00 0.00 N ATOM 587 CA VAL A 37 2.882 -17.405 -4.724 1.00 0.00 C ATOM 588 C VAL A 37 3.105 -18.085 -6.070 1.00 0.00 C ATOM 589 O VAL A 37 2.810 -19.269 -6.235 1.00 0.00 O ATOM 590 CB VAL A 37 1.391 -17.508 -4.349 1.00 0.00 C ATOM 591 CG1 VAL A 37 1.155 -16.973 -2.945 1.00 0.00 C ATOM 592 CG2 VAL A 37 0.534 -16.766 -5.364 1.00 0.00 C ATOM 0 H VAL A 37 2.577 -15.337 -4.889 1.00 0.00 H new ATOM 0 HA VAL A 37 3.476 -17.910 -3.963 1.00 0.00 H new ATOM 0 HB VAL A 37 1.102 -18.559 -4.364 1.00 0.00 H new ATOM 0 HG11 VAL A 37 0.096 -17.054 -2.698 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.740 -17.554 -2.231 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.460 -15.927 -2.898 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -0.516 -16.849 -5.084 1.00 0.00 H new ATOM 0 HG22 VAL A 37 0.822 -15.715 -5.384 1.00 0.00 H new ATOM 0 HG23 VAL A 37 0.681 -17.202 -6.352 1.00 0.00 H new ATOM 602 N SER A 38 3.628 -17.329 -7.030 1.00 0.00 N ATOM 603 CA SER A 38 3.888 -17.858 -8.363 1.00 0.00 C ATOM 604 C SER A 38 5.062 -18.831 -8.342 1.00 0.00 C ATOM 605 O SER A 38 5.058 -19.842 -9.044 1.00 0.00 O ATOM 606 CB SER A 38 4.174 -16.716 -9.341 1.00 0.00 C ATOM 607 OG SER A 38 3.040 -15.880 -9.495 1.00 0.00 O ATOM 0 H SER A 38 3.880 -16.348 -6.909 1.00 0.00 H new ATOM 0 HA SER A 38 2.999 -18.396 -8.693 1.00 0.00 H new ATOM 0 HB2 SER A 38 5.017 -16.127 -8.981 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.462 -17.126 -10.309 1.00 0.00 H new ATOM 0 HG SER A 38 2.755 -15.885 -10.433 1.00 0.00 H new ATOM 613 N ASP A 39 6.067 -18.518 -7.531 1.00 0.00 N ATOM 614 CA ASP A 39 7.249 -19.365 -7.417 1.00 0.00 C ATOM 615 C ASP A 39 8.148 -19.211 -8.639 1.00 0.00 C ATOM 616 O ASP A 39 8.652 -20.196 -9.180 1.00 0.00 O ATOM 617 CB ASP A 39 6.840 -20.829 -7.250 1.00 0.00 C ATOM 618 CG ASP A 39 7.844 -21.622 -6.438 1.00 0.00 C ATOM 619 OD1 ASP A 39 8.497 -21.026 -5.556 1.00 0.00 O ATOM 620 OD2 ASP A 39 7.979 -22.839 -6.685 1.00 0.00 O ATOM 0 H ASP A 39 6.087 -17.685 -6.943 1.00 0.00 H new ATOM 0 HA ASP A 39 7.808 -19.050 -6.536 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.865 -20.878 -6.765 1.00 0.00 H new ATOM 0 HB3 ASP A 39 6.730 -21.287 -8.233 1.00 0.00 H new ATOM 625 N TYR A 40 8.345 -17.970 -9.070 1.00 0.00 N ATOM 626 CA TYR A 40 9.181 -17.687 -10.231 1.00 0.00 C ATOM 627 C TYR A 40 9.611 -16.223 -10.249 1.00 0.00 C ATOM 628 O TYR A 40 8.999 -15.376 -9.598 1.00 0.00 O ATOM 629 CB TYR A 40 8.430 -18.026 -11.520 1.00 0.00 C ATOM 630 CG TYR A 40 9.298 -17.974 -12.757 1.00 0.00 C ATOM 631 CD1 TYR A 40 9.526 -16.774 -13.420 1.00 0.00 C ATOM 632 CD2 TYR A 40 9.889 -19.124 -13.264 1.00 0.00 C ATOM 633 CE1 TYR A 40 10.318 -16.721 -14.551 1.00 0.00 C ATOM 634 CE2 TYR A 40 10.684 -19.081 -14.394 1.00 0.00 C ATOM 635 CZ TYR A 40 10.895 -17.877 -15.034 1.00 0.00 C ATOM 636 OH TYR A 40 11.684 -17.830 -16.160 1.00 0.00 O ATOM 0 H TYR A 40 7.937 -17.144 -8.633 1.00 0.00 H new ATOM 0 HA TYR A 40 10.074 -18.308 -10.164 1.00 0.00 H new ATOM 0 HB2 TYR A 40 8.001 -19.024 -11.429 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.599 -17.331 -11.640 1.00 0.00 H new ATOM 0 HD1 TYR A 40 9.076 -15.867 -13.045 1.00 0.00 H new ATOM 0 HD2 TYR A 40 9.725 -20.068 -12.767 1.00 0.00 H new ATOM 0 HE1 TYR A 40 10.484 -15.780 -15.054 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.137 -19.985 -14.774 1.00 0.00 H new ATOM 0 HH TYR A 40 12.014 -18.729 -16.366 1.00 0.00 H new ATOM 646 N LEU A 41 10.668 -15.934 -11.000 1.00 0.00 N ATOM 647 CA LEU A 41 11.181 -14.572 -11.106 1.00 0.00 C ATOM 648 C LEU A 41 10.547 -13.841 -12.284 1.00 0.00 C ATOM 649 O LEU A 41 10.582 -14.321 -13.416 1.00 0.00 O ATOM 650 CB LEU A 41 12.703 -14.591 -11.262 1.00 0.00 C ATOM 651 CG LEU A 41 13.229 -14.786 -12.684 1.00 0.00 C ATOM 652 CD1 LEU A 41 13.329 -13.449 -13.403 1.00 0.00 C ATOM 653 CD2 LEU A 41 14.581 -15.484 -12.661 1.00 0.00 C ATOM 0 H LEU A 41 11.186 -16.624 -11.544 1.00 0.00 H new ATOM 0 HA LEU A 41 10.922 -14.040 -10.191 1.00 0.00 H new ATOM 0 HB2 LEU A 41 13.100 -13.652 -10.875 1.00 0.00 H new ATOM 0 HB3 LEU A 41 13.103 -15.389 -10.636 1.00 0.00 H new ATOM 0 HG LEU A 41 12.526 -15.417 -13.228 1.00 0.00 H new ATOM 0 HD11 LEU A 41 13.705 -13.607 -14.414 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.343 -12.987 -13.451 1.00 0.00 H new ATOM 0 HD13 LEU A 41 14.011 -12.794 -12.860 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.940 -15.615 -13.682 1.00 0.00 H new ATOM 0 HD22 LEU A 41 15.293 -14.879 -12.100 1.00 0.00 H new ATOM 0 HD23 LEU A 41 14.479 -16.459 -12.185 1.00 0.00 H new ATOM 665 N GLU A 42 9.969 -12.675 -12.009 1.00 0.00 N ATOM 666 CA GLU A 42 9.329 -11.877 -13.047 1.00 0.00 C ATOM 667 C GLU A 42 8.226 -12.671 -13.741 1.00 0.00 C ATOM 668 O GLU A 42 8.191 -12.765 -14.968 1.00 0.00 O ATOM 669 CB GLU A 42 10.362 -11.412 -14.075 1.00 0.00 C ATOM 670 CG GLU A 42 11.056 -10.115 -13.697 1.00 0.00 C ATOM 671 CD GLU A 42 10.183 -8.897 -13.930 1.00 0.00 C ATOM 672 OE1 GLU A 42 9.316 -8.616 -13.076 1.00 0.00 O ATOM 673 OE2 GLU A 42 10.367 -8.225 -14.966 1.00 0.00 O ATOM 0 H GLU A 42 9.931 -12.263 -11.077 1.00 0.00 H new ATOM 0 HA GLU A 42 8.881 -11.004 -12.573 1.00 0.00 H new ATOM 0 HB2 GLU A 42 11.113 -12.192 -14.202 1.00 0.00 H new ATOM 0 HB3 GLU A 42 9.870 -11.283 -15.039 1.00 0.00 H new ATOM 0 HG2 GLU A 42 11.345 -10.155 -12.647 1.00 0.00 H new ATOM 0 HG3 GLU A 42 11.974 -10.016 -14.277 1.00 0.00 H new ATOM 680 N VAL A 43 7.326 -13.242 -12.947 1.00 0.00 N ATOM 681 CA VAL A 43 6.222 -14.028 -13.484 1.00 0.00 C ATOM 682 C VAL A 43 4.895 -13.294 -13.322 1.00 0.00 C ATOM 683 O VAL A 43 3.906 -13.629 -13.974 1.00 0.00 O ATOM 684 CB VAL A 43 6.123 -15.402 -12.794 1.00 0.00 C ATOM 685 CG1 VAL A 43 5.942 -15.234 -11.293 1.00 0.00 C ATOM 686 CG2 VAL A 43 4.984 -16.216 -13.389 1.00 0.00 C ATOM 0 H VAL A 43 7.340 -13.175 -11.929 1.00 0.00 H new ATOM 0 HA VAL A 43 6.426 -14.176 -14.545 1.00 0.00 H new ATOM 0 HB VAL A 43 7.054 -15.943 -12.965 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.874 -16.215 -10.823 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.794 -14.693 -10.882 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.028 -14.674 -11.097 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.929 -17.183 -12.890 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.044 -15.682 -13.250 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.162 -16.367 -14.454 1.00 0.00 H new ATOM 696 N ILE A 44 4.882 -12.292 -12.449 1.00 0.00 N ATOM 697 CA ILE A 44 3.677 -11.510 -12.203 1.00 0.00 C ATOM 698 C ILE A 44 3.755 -10.151 -12.891 1.00 0.00 C ATOM 699 O ILE A 44 4.446 -9.245 -12.426 1.00 0.00 O ATOM 700 CB ILE A 44 3.442 -11.297 -10.696 1.00 0.00 C ATOM 701 CG1 ILE A 44 3.364 -12.644 -9.975 1.00 0.00 C ATOM 702 CG2 ILE A 44 2.172 -10.492 -10.467 1.00 0.00 C ATOM 703 CD1 ILE A 44 4.700 -13.135 -9.464 1.00 0.00 C ATOM 0 H ILE A 44 5.692 -12.003 -11.901 1.00 0.00 H new ATOM 0 HA ILE A 44 2.842 -12.077 -12.616 1.00 0.00 H new ATOM 0 HB ILE A 44 4.282 -10.736 -10.287 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.673 -12.558 -9.137 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.949 -13.388 -10.656 1.00 0.00 H new ATOM 0 HG21 ILE A 44 2.019 -10.350 -9.397 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.264 -9.521 -10.953 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.321 -11.028 -10.887 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.568 -14.095 -8.964 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.388 -13.253 -10.301 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.108 -12.411 -8.758 1.00 0.00 H new ATOM 715 N LYS A 45 3.038 -10.015 -14.002 1.00 0.00 N ATOM 716 CA LYS A 45 3.022 -8.766 -14.754 1.00 0.00 C ATOM 717 C LYS A 45 2.855 -7.571 -13.821 1.00 0.00 C ATOM 718 O LYS A 45 3.536 -6.557 -13.970 1.00 0.00 O ATOM 719 CB LYS A 45 1.891 -8.783 -15.786 1.00 0.00 C ATOM 720 CG LYS A 45 2.283 -9.422 -17.107 1.00 0.00 C ATOM 721 CD LYS A 45 2.367 -10.935 -16.991 1.00 0.00 C ATOM 722 CE LYS A 45 2.209 -11.607 -18.347 1.00 0.00 C ATOM 723 NZ LYS A 45 2.455 -13.074 -18.270 1.00 0.00 N ATOM 0 H LYS A 45 2.460 -10.755 -14.401 1.00 0.00 H new ATOM 0 HA LYS A 45 3.977 -8.670 -15.271 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.039 -9.321 -15.370 1.00 0.00 H new ATOM 0 HB3 LYS A 45 1.563 -7.760 -15.970 1.00 0.00 H new ATOM 0 HG2 LYS A 45 1.554 -9.155 -17.872 1.00 0.00 H new ATOM 0 HG3 LYS A 45 3.246 -9.027 -17.432 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.326 -11.215 -16.554 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.592 -11.293 -16.314 1.00 0.00 H new ATOM 0 HE2 LYS A 45 1.203 -11.427 -18.727 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.903 -11.159 -19.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.338 -13.496 -19.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 3.423 -13.246 -17.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.776 -13.506 -17.611 1.00 0.00 H new ATOM 737 N GLU A 46 1.947 -7.700 -12.859 1.00 0.00 N ATOM 738 CA GLU A 46 1.692 -6.629 -11.902 1.00 0.00 C ATOM 739 C GLU A 46 1.866 -7.127 -10.470 1.00 0.00 C ATOM 740 O GLU A 46 0.933 -7.630 -9.843 1.00 0.00 O ATOM 741 CB GLU A 46 0.281 -6.071 -12.091 1.00 0.00 C ATOM 742 CG GLU A 46 0.071 -5.387 -13.432 1.00 0.00 C ATOM 743 CD GLU A 46 -1.020 -4.335 -13.386 1.00 0.00 C ATOM 744 OE1 GLU A 46 -1.125 -3.634 -12.357 1.00 0.00 O ATOM 745 OE2 GLU A 46 -1.768 -4.212 -14.378 1.00 0.00 O ATOM 0 H GLU A 46 1.376 -8.534 -12.721 1.00 0.00 H new ATOM 0 HA GLU A 46 2.416 -5.835 -12.083 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.438 -6.884 -11.991 1.00 0.00 H new ATOM 0 HB3 GLU A 46 0.071 -5.359 -11.293 1.00 0.00 H new ATOM 0 HG2 GLU A 46 1.005 -4.923 -13.749 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -0.183 -6.136 -14.182 1.00 0.00 H new ATOM 752 N PRO A 47 3.090 -6.986 -9.939 1.00 0.00 N ATOM 753 CA PRO A 47 3.416 -7.416 -8.576 1.00 0.00 C ATOM 754 C PRO A 47 2.750 -6.542 -7.518 1.00 0.00 C ATOM 755 O PRO A 47 3.106 -5.377 -7.349 1.00 0.00 O ATOM 756 CB PRO A 47 4.938 -7.266 -8.512 1.00 0.00 C ATOM 757 CG PRO A 47 5.260 -6.226 -9.529 1.00 0.00 C ATOM 758 CD PRO A 47 4.250 -6.397 -10.629 1.00 0.00 C ATOM 0 HA PRO A 47 3.064 -8.427 -8.372 1.00 0.00 H new ATOM 0 HB2 PRO A 47 5.264 -6.961 -7.518 1.00 0.00 H new ATOM 0 HB3 PRO A 47 5.438 -8.208 -8.737 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.202 -5.227 -9.097 1.00 0.00 H new ATOM 0 HG3 PRO A 47 6.274 -6.351 -9.908 1.00 0.00 H new ATOM 0 HD2 PRO A 47 3.999 -5.444 -11.095 1.00 0.00 H new ATOM 0 HD3 PRO A 47 4.622 -7.050 -11.418 1.00 0.00 H new ATOM 766 N MET A 48 1.782 -7.114 -6.810 1.00 0.00 N ATOM 767 CA MET A 48 1.068 -6.387 -5.767 1.00 0.00 C ATOM 768 C MET A 48 1.024 -7.194 -4.473 1.00 0.00 C ATOM 769 O MET A 48 0.045 -7.889 -4.197 1.00 0.00 O ATOM 770 CB MET A 48 -0.355 -6.060 -6.226 1.00 0.00 C ATOM 771 CG MET A 48 -1.063 -5.050 -5.338 1.00 0.00 C ATOM 772 SD MET A 48 -0.869 -3.355 -5.920 1.00 0.00 S ATOM 773 CE MET A 48 0.854 -3.361 -6.410 1.00 0.00 C ATOM 0 H MET A 48 1.474 -8.078 -6.939 1.00 0.00 H new ATOM 0 HA MET A 48 1.604 -5.457 -5.576 1.00 0.00 H new ATOM 0 HB2 MET A 48 -0.320 -5.674 -7.245 1.00 0.00 H new ATOM 0 HB3 MET A 48 -0.939 -6.980 -6.254 1.00 0.00 H new ATOM 0 HG2 MET A 48 -2.124 -5.294 -5.291 1.00 0.00 H new ATOM 0 HG3 MET A 48 -0.673 -5.128 -4.323 1.00 0.00 H new ATOM 0 HE1 MET A 48 1.136 -2.368 -6.760 1.00 0.00 H new ATOM 0 HE2 MET A 48 1.474 -3.635 -5.556 1.00 0.00 H new ATOM 0 HE3 MET A 48 1.002 -4.084 -7.212 1.00 0.00 H new ATOM 783 N ASP A 49 2.089 -7.099 -3.685 1.00 0.00 N ATOM 784 CA ASP A 49 2.171 -7.820 -2.420 1.00 0.00 C ATOM 785 C ASP A 49 2.058 -6.861 -1.239 1.00 0.00 C ATOM 786 O ASP A 49 2.332 -5.667 -1.367 1.00 0.00 O ATOM 787 CB ASP A 49 3.485 -8.599 -2.337 1.00 0.00 C ATOM 788 CG ASP A 49 4.636 -7.863 -2.994 1.00 0.00 C ATOM 789 OD1 ASP A 49 4.620 -6.614 -2.993 1.00 0.00 O ATOM 790 OD2 ASP A 49 5.554 -8.536 -3.508 1.00 0.00 O ATOM 0 H ASP A 49 2.908 -6.530 -3.900 1.00 0.00 H new ATOM 0 HA ASP A 49 1.338 -8.522 -2.375 1.00 0.00 H new ATOM 0 HB2 ASP A 49 3.727 -8.787 -1.291 1.00 0.00 H new ATOM 0 HB3 ASP A 49 3.359 -9.571 -2.814 1.00 0.00 H new ATOM 795 N LEU A 50 1.651 -7.391 -0.091 1.00 0.00 N ATOM 796 CA LEU A 50 1.501 -6.582 1.113 1.00 0.00 C ATOM 797 C LEU A 50 2.784 -5.817 1.420 1.00 0.00 C ATOM 798 O LEU A 50 2.753 -4.758 2.048 1.00 0.00 O ATOM 799 CB LEU A 50 1.125 -7.467 2.303 1.00 0.00 C ATOM 800 CG LEU A 50 -0.354 -7.834 2.426 1.00 0.00 C ATOM 801 CD1 LEU A 50 -0.525 -9.089 3.267 1.00 0.00 C ATOM 802 CD2 LEU A 50 -1.143 -6.678 3.024 1.00 0.00 C ATOM 0 H LEU A 50 1.419 -8.377 0.031 1.00 0.00 H new ATOM 0 HA LEU A 50 0.703 -5.860 0.938 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.703 -8.389 2.242 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.430 -6.960 3.218 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.742 -8.035 1.427 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.584 -9.334 3.343 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.006 -9.917 2.797 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.120 -8.917 4.264 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.194 -6.957 3.104 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.753 -6.445 4.015 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.048 -5.802 2.382 1.00 0.00 H new ATOM 814 N SER A 51 3.911 -6.359 0.970 1.00 0.00 N ATOM 815 CA SER A 51 5.207 -5.728 1.198 1.00 0.00 C ATOM 816 C SER A 51 5.277 -4.368 0.510 1.00 0.00 C ATOM 817 O SER A 51 5.409 -3.333 1.165 1.00 0.00 O ATOM 818 CB SER A 51 6.333 -6.629 0.687 1.00 0.00 C ATOM 819 OG SER A 51 7.524 -6.426 1.428 1.00 0.00 O ATOM 0 H SER A 51 3.954 -7.233 0.446 1.00 0.00 H new ATOM 0 HA SER A 51 5.328 -5.580 2.271 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.029 -7.673 0.760 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.517 -6.424 -0.367 1.00 0.00 H new ATOM 0 HG SER A 51 8.228 -7.014 1.083 1.00 0.00 H new ATOM 825 N THR A 52 5.187 -4.377 -0.817 1.00 0.00 N ATOM 826 CA THR A 52 5.242 -3.146 -1.595 1.00 0.00 C ATOM 827 C THR A 52 4.212 -2.137 -1.100 1.00 0.00 C ATOM 828 O THR A 52 4.459 -0.931 -1.102 1.00 0.00 O ATOM 829 CB THR A 52 5.001 -3.417 -3.092 1.00 0.00 C ATOM 830 OG1 THR A 52 5.675 -2.431 -3.883 1.00 0.00 O ATOM 831 CG2 THR A 52 3.514 -3.401 -3.412 1.00 0.00 C ATOM 0 H THR A 52 5.076 -5.224 -1.375 1.00 0.00 H new ATOM 0 HA THR A 52 6.242 -2.733 -1.465 1.00 0.00 H new ATOM 0 HB THR A 52 5.397 -4.405 -3.328 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.518 -2.611 -4.833 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.368 -3.595 -4.475 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.008 -4.172 -2.830 1.00 0.00 H new ATOM 0 HG23 THR A 52 3.098 -2.425 -3.161 1.00 0.00 H new ATOM 839 N VAL A 53 3.056 -2.638 -0.675 1.00 0.00 N ATOM 840 CA VAL A 53 1.988 -1.780 -0.176 1.00 0.00 C ATOM 841 C VAL A 53 2.465 -0.941 1.005 1.00 0.00 C ATOM 842 O VAL A 53 2.310 0.280 1.014 1.00 0.00 O ATOM 843 CB VAL A 53 0.761 -2.604 0.256 1.00 0.00 C ATOM 844 CG1 VAL A 53 -0.296 -1.703 0.876 1.00 0.00 C ATOM 845 CG2 VAL A 53 0.192 -3.372 -0.928 1.00 0.00 C ATOM 0 H VAL A 53 2.836 -3.634 -0.666 1.00 0.00 H new ATOM 0 HA VAL A 53 1.702 -1.121 -0.995 1.00 0.00 H new ATOM 0 HB VAL A 53 1.076 -3.325 1.010 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.156 -2.303 1.175 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.120 -1.203 1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.611 -0.956 0.147 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.675 -3.949 -0.605 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.109 -2.670 -1.706 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.951 -4.048 -1.322 1.00 0.00 H new ATOM 855 N ILE A 54 3.045 -1.605 1.999 1.00 0.00 N ATOM 856 CA ILE A 54 3.545 -0.920 3.185 1.00 0.00 C ATOM 857 C ILE A 54 4.583 0.134 2.814 1.00 0.00 C ATOM 858 O ILE A 54 4.620 1.217 3.397 1.00 0.00 O ATOM 859 CB ILE A 54 4.171 -1.911 4.185 1.00 0.00 C ATOM 860 CG1 ILE A 54 3.128 -2.932 4.644 1.00 0.00 C ATOM 861 CG2 ILE A 54 4.751 -1.164 5.377 1.00 0.00 C ATOM 862 CD1 ILE A 54 3.717 -4.088 5.422 1.00 0.00 C ATOM 0 H ILE A 54 3.180 -2.616 2.007 1.00 0.00 H new ATOM 0 HA ILE A 54 2.689 -0.435 3.654 1.00 0.00 H new ATOM 0 HB ILE A 54 4.980 -2.446 3.688 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.386 -2.428 5.263 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.604 -3.321 3.771 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.190 -1.877 6.075 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.520 -0.472 5.034 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.959 -0.607 5.878 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.921 -4.772 5.715 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.438 -4.616 4.798 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.217 -3.709 6.314 1.00 0.00 H new ATOM 874 N THR A 55 5.425 -0.190 1.837 1.00 0.00 N ATOM 875 CA THR A 55 6.463 0.728 1.387 1.00 0.00 C ATOM 876 C THR A 55 5.860 1.936 0.680 1.00 0.00 C ATOM 877 O THR A 55 6.279 3.072 0.901 1.00 0.00 O ATOM 878 CB THR A 55 7.454 0.032 0.435 1.00 0.00 C ATOM 879 OG1 THR A 55 8.111 -1.044 1.113 1.00 0.00 O ATOM 880 CG2 THR A 55 8.490 1.019 -0.084 1.00 0.00 C ATOM 0 H THR A 55 5.408 -1.082 1.342 1.00 0.00 H new ATOM 0 HA THR A 55 6.998 1.061 2.277 1.00 0.00 H new ATOM 0 HB THR A 55 6.893 -0.362 -0.413 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.738 -1.482 0.500 1.00 0.00 H new ATOM 0 HG21 THR A 55 9.179 0.505 -0.754 1.00 0.00 H new ATOM 0 HG22 THR A 55 7.989 1.822 -0.625 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.045 1.438 0.755 1.00 0.00 H new ATOM 888 N LYS A 56 4.872 1.684 -0.173 1.00 0.00 N ATOM 889 CA LYS A 56 4.208 2.751 -0.912 1.00 0.00 C ATOM 890 C LYS A 56 3.673 3.819 0.036 1.00 0.00 C ATOM 891 O LYS A 56 3.719 5.012 -0.268 1.00 0.00 O ATOM 892 CB LYS A 56 3.063 2.181 -1.753 1.00 0.00 C ATOM 893 CG LYS A 56 3.487 1.751 -3.146 1.00 0.00 C ATOM 894 CD LYS A 56 2.291 1.593 -4.070 1.00 0.00 C ATOM 895 CE LYS A 56 2.723 1.453 -5.522 1.00 0.00 C ATOM 896 NZ LYS A 56 3.516 0.213 -5.747 1.00 0.00 N ATOM 0 H LYS A 56 4.514 0.749 -0.369 1.00 0.00 H new ATOM 0 HA LYS A 56 4.942 3.212 -1.573 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.633 1.325 -1.233 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.277 2.931 -1.837 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.174 2.488 -3.562 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.029 0.807 -3.087 1.00 0.00 H new ATOM 0 HD2 LYS A 56 1.715 0.716 -3.775 1.00 0.00 H new ATOM 0 HD3 LYS A 56 1.633 2.456 -3.967 1.00 0.00 H new ATOM 0 HE2 LYS A 56 1.842 1.442 -6.164 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.316 2.321 -5.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.763 0.137 -6.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.387 0.250 -5.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 2.953 -0.615 -5.465 1.00 0.00 H new ATOM 910 N ILE A 57 3.168 3.384 1.186 1.00 0.00 N ATOM 911 CA ILE A 57 2.628 4.304 2.179 1.00 0.00 C ATOM 912 C ILE A 57 3.737 5.119 2.834 1.00 0.00 C ATOM 913 O ILE A 57 3.572 6.310 3.100 1.00 0.00 O ATOM 914 CB ILE A 57 1.843 3.555 3.272 1.00 0.00 C ATOM 915 CG1 ILE A 57 0.841 2.588 2.638 1.00 0.00 C ATOM 916 CG2 ILE A 57 1.131 4.543 4.184 1.00 0.00 C ATOM 917 CD1 ILE A 57 0.550 1.374 3.492 1.00 0.00 C ATOM 0 H ILE A 57 3.122 2.401 1.453 1.00 0.00 H new ATOM 0 HA ILE A 57 1.950 4.975 1.651 1.00 0.00 H new ATOM 0 HB ILE A 57 2.546 2.978 3.873 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.091 3.118 2.445 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.226 2.259 1.673 1.00 0.00 H new ATOM 0 HG21 ILE A 57 0.581 3.998 4.951 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.865 5.195 4.658 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.437 5.144 3.597 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.168 0.733 2.980 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.473 0.820 3.664 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.135 1.693 4.448 1.00 0.00 H new ATOM 929 N ASP A 58 4.868 4.471 3.090 1.00 0.00 N ATOM 930 CA ASP A 58 6.007 5.137 3.711 1.00 0.00 C ATOM 931 C ASP A 58 6.602 6.184 2.775 1.00 0.00 C ATOM 932 O ASP A 58 7.019 7.257 3.212 1.00 0.00 O ATOM 933 CB ASP A 58 7.077 4.112 4.095 1.00 0.00 C ATOM 934 CG ASP A 58 8.094 4.675 5.068 1.00 0.00 C ATOM 935 OD1 ASP A 58 8.576 5.804 4.836 1.00 0.00 O ATOM 936 OD2 ASP A 58 8.409 3.986 6.061 1.00 0.00 O ATOM 0 H ASP A 58 5.021 3.485 2.877 1.00 0.00 H new ATOM 0 HA ASP A 58 5.655 5.640 4.612 1.00 0.00 H new ATOM 0 HB2 ASP A 58 6.598 3.240 4.539 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.589 3.771 3.195 1.00 0.00 H new ATOM 941 N LYS A 59 6.639 5.866 1.486 1.00 0.00 N ATOM 942 CA LYS A 59 7.181 6.778 0.487 1.00 0.00 C ATOM 943 C LYS A 59 6.119 7.768 0.020 1.00 0.00 C ATOM 944 O LYS A 59 6.140 8.222 -1.125 1.00 0.00 O ATOM 945 CB LYS A 59 7.724 5.993 -0.710 1.00 0.00 C ATOM 946 CG LYS A 59 9.186 5.606 -0.571 1.00 0.00 C ATOM 947 CD LYS A 59 9.417 4.729 0.647 1.00 0.00 C ATOM 948 CE LYS A 59 10.890 4.387 0.816 1.00 0.00 C ATOM 949 NZ LYS A 59 11.138 3.602 2.057 1.00 0.00 N ATOM 0 H LYS A 59 6.299 4.982 1.108 1.00 0.00 H new ATOM 0 HA LYS A 59 7.996 7.337 0.947 1.00 0.00 H new ATOM 0 HB2 LYS A 59 7.129 5.089 -0.842 1.00 0.00 H new ATOM 0 HB3 LYS A 59 7.599 6.591 -1.613 1.00 0.00 H new ATOM 0 HG2 LYS A 59 9.510 5.078 -1.468 1.00 0.00 H new ATOM 0 HG3 LYS A 59 9.796 6.506 -0.493 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.057 5.241 1.539 1.00 0.00 H new ATOM 0 HD3 LYS A 59 8.838 3.811 0.551 1.00 0.00 H new ATOM 0 HE2 LYS A 59 11.232 3.818 -0.048 1.00 0.00 H new ATOM 0 HE3 LYS A 59 11.475 5.306 0.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 12.153 3.389 2.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.835 4.155 2.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 10.600 2.713 2.019 1.00 0.00 H new ATOM 963 N HIS A 60 5.192 8.100 0.913 1.00 0.00 N ATOM 964 CA HIS A 60 4.123 9.038 0.593 1.00 0.00 C ATOM 965 C HIS A 60 3.632 8.835 -0.838 1.00 0.00 C ATOM 966 O HIS A 60 3.450 9.795 -1.584 1.00 0.00 O ATOM 967 CB HIS A 60 4.605 10.477 0.778 1.00 0.00 C ATOM 968 CG HIS A 60 5.162 10.751 2.142 1.00 0.00 C ATOM 969 ND1 HIS A 60 6.234 11.590 2.362 1.00 0.00 N ATOM 970 CD2 HIS A 60 4.788 10.293 3.359 1.00 0.00 C ATOM 971 CE1 HIS A 60 6.497 11.634 3.656 1.00 0.00 C ATOM 972 NE2 HIS A 60 5.633 10.856 4.283 1.00 0.00 N ATOM 0 H HIS A 60 5.160 7.733 1.864 1.00 0.00 H new ATOM 0 HA HIS A 60 3.293 8.850 1.274 1.00 0.00 H new ATOM 0 HB2 HIS A 60 5.369 10.694 0.032 1.00 0.00 H new ATOM 0 HB3 HIS A 60 3.774 11.157 0.590 1.00 0.00 H new ATOM 0 HD2 HIS A 60 3.976 9.611 3.565 1.00 0.00 H new ATOM 0 HE1 HIS A 60 7.284 12.208 4.122 1.00 0.00 H new ATOM 0 HE2 HIS A 60 5.599 10.699 5.290 1.00 0.00 H new ATOM 981 N ASN A 61 3.420 7.577 -1.212 1.00 0.00 N ATOM 982 CA ASN A 61 2.951 7.247 -2.553 1.00 0.00 C ATOM 983 C ASN A 61 1.443 7.450 -2.668 1.00 0.00 C ATOM 984 O ASN A 61 0.964 8.111 -3.589 1.00 0.00 O ATOM 985 CB ASN A 61 3.311 5.801 -2.900 1.00 0.00 C ATOM 986 CG ASN A 61 3.388 5.568 -4.397 1.00 0.00 C ATOM 987 OD1 ASN A 61 2.443 5.857 -5.131 1.00 0.00 O ATOM 988 ND2 ASN A 61 4.518 5.044 -4.856 1.00 0.00 N ATOM 0 H ASN A 61 3.566 6.770 -0.606 1.00 0.00 H new ATOM 0 HA ASN A 61 3.444 7.916 -3.258 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.269 5.549 -2.446 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.568 5.131 -2.468 1.00 0.00 H new ATOM 0 HD21 ASN A 61 4.629 4.865 -5.854 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.275 4.820 -4.211 1.00 0.00 H new ATOM 995 N TYR A 62 0.702 6.877 -1.726 1.00 0.00 N ATOM 996 CA TYR A 62 -0.751 6.992 -1.722 1.00 0.00 C ATOM 997 C TYR A 62 -1.186 8.381 -1.265 1.00 0.00 C ATOM 998 O TYR A 62 -0.938 8.779 -0.126 1.00 0.00 O ATOM 999 CB TYR A 62 -1.366 5.928 -0.811 1.00 0.00 C ATOM 1000 CG TYR A 62 -1.194 4.517 -1.327 1.00 0.00 C ATOM 1001 CD1 TYR A 62 -1.508 4.194 -2.642 1.00 0.00 C ATOM 1002 CD2 TYR A 62 -0.718 3.507 -0.500 1.00 0.00 C ATOM 1003 CE1 TYR A 62 -1.353 2.906 -3.117 1.00 0.00 C ATOM 1004 CE2 TYR A 62 -0.559 2.217 -0.967 1.00 0.00 C ATOM 1005 CZ TYR A 62 -0.879 1.921 -2.276 1.00 0.00 C ATOM 1006 OH TYR A 62 -0.722 0.637 -2.746 1.00 0.00 O ATOM 0 H TYR A 62 1.084 6.328 -0.956 1.00 0.00 H new ATOM 0 HA TYR A 62 -1.105 6.837 -2.741 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.913 6.002 0.178 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.429 6.135 -0.691 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -1.879 4.963 -3.303 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.468 3.735 0.526 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -1.602 2.672 -4.142 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -0.186 1.444 -0.311 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.378 0.066 -2.028 1.00 0.00 H new ATOM 1016 N LEU A 63 -1.837 9.115 -2.161 1.00 0.00 N ATOM 1017 CA LEU A 63 -2.308 10.460 -1.851 1.00 0.00 C ATOM 1018 C LEU A 63 -3.634 10.413 -1.098 1.00 0.00 C ATOM 1019 O LEU A 63 -3.826 11.124 -0.111 1.00 0.00 O ATOM 1020 CB LEU A 63 -2.468 11.274 -3.137 1.00 0.00 C ATOM 1021 CG LEU A 63 -1.187 11.887 -3.706 1.00 0.00 C ATOM 1022 CD1 LEU A 63 -1.356 12.196 -5.185 1.00 0.00 C ATOM 1023 CD2 LEU A 63 -0.809 13.144 -2.936 1.00 0.00 C ATOM 0 H LEU A 63 -2.051 8.801 -3.108 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.566 10.940 -1.213 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.909 10.630 -3.898 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.179 12.078 -2.949 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.380 11.162 -3.597 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.435 12.631 -5.573 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.579 11.276 -5.726 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -2.176 12.902 -5.318 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.105 13.566 -3.355 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.615 13.874 -3.013 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.646 12.893 -1.888 1.00 0.00 H new ATOM 1035 N THR A 64 -4.547 9.568 -1.569 1.00 0.00 N ATOM 1036 CA THR A 64 -5.854 9.427 -0.940 1.00 0.00 C ATOM 1037 C THR A 64 -6.080 7.999 -0.459 1.00 0.00 C ATOM 1038 O THR A 64 -5.320 7.092 -0.796 1.00 0.00 O ATOM 1039 CB THR A 64 -6.987 9.817 -1.908 1.00 0.00 C ATOM 1040 OG1 THR A 64 -6.845 9.105 -3.142 1.00 0.00 O ATOM 1041 CG2 THR A 64 -6.979 11.314 -2.176 1.00 0.00 C ATOM 0 H THR A 64 -4.405 8.971 -2.384 1.00 0.00 H new ATOM 0 HA THR A 64 -5.869 10.102 -0.084 1.00 0.00 H new ATOM 0 HB THR A 64 -7.937 9.552 -1.444 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.570 9.358 -3.751 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.788 11.565 -2.862 1.00 0.00 H new ATOM 0 HG22 THR A 64 -7.118 11.852 -1.238 1.00 0.00 H new ATOM 0 HG23 THR A 64 -6.025 11.599 -2.620 1.00 0.00 H new ATOM 1049 N ALA A 65 -7.132 7.805 0.331 1.00 0.00 N ATOM 1050 CA ALA A 65 -7.460 6.486 0.857 1.00 0.00 C ATOM 1051 C ALA A 65 -8.074 5.602 -0.223 1.00 0.00 C ATOM 1052 O ALA A 65 -7.911 4.382 -0.209 1.00 0.00 O ATOM 1053 CB ALA A 65 -8.407 6.610 2.041 1.00 0.00 C ATOM 0 H ALA A 65 -7.771 8.545 0.620 1.00 0.00 H new ATOM 0 HA ALA A 65 -6.536 6.016 1.193 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -8.643 5.617 2.423 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -7.932 7.198 2.827 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -9.325 7.104 1.723 1.00 0.00 H new ATOM 1059 N LYS A 66 -8.781 6.225 -1.160 1.00 0.00 N ATOM 1060 CA LYS A 66 -9.420 5.495 -2.249 1.00 0.00 C ATOM 1061 C LYS A 66 -8.378 4.833 -3.145 1.00 0.00 C ATOM 1062 O LYS A 66 -8.554 3.696 -3.582 1.00 0.00 O ATOM 1063 CB LYS A 66 -10.295 6.438 -3.077 1.00 0.00 C ATOM 1064 CG LYS A 66 -11.065 5.738 -4.184 1.00 0.00 C ATOM 1065 CD LYS A 66 -12.393 5.195 -3.682 1.00 0.00 C ATOM 1066 CE LYS A 66 -13.375 4.984 -4.824 1.00 0.00 C ATOM 1067 NZ LYS A 66 -14.320 3.868 -4.543 1.00 0.00 N ATOM 0 H LYS A 66 -8.926 7.234 -1.187 1.00 0.00 H new ATOM 0 HA LYS A 66 -10.046 4.716 -1.814 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -11.001 6.939 -2.415 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.666 7.212 -3.517 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -11.242 6.436 -5.003 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -10.465 4.921 -4.585 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -12.229 4.251 -3.163 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -12.820 5.888 -2.957 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -13.937 5.902 -4.994 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -12.825 4.772 -5.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -14.973 3.756 -5.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -13.785 2.987 -4.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -14.863 4.081 -3.682 1.00 0.00 H new ATOM 1081 N ASP A 67 -7.293 5.551 -3.413 1.00 0.00 N ATOM 1082 CA ASP A 67 -6.222 5.032 -4.255 1.00 0.00 C ATOM 1083 C ASP A 67 -5.539 3.839 -3.592 1.00 0.00 C ATOM 1084 O ASP A 67 -5.160 2.877 -4.261 1.00 0.00 O ATOM 1085 CB ASP A 67 -5.194 6.128 -4.543 1.00 0.00 C ATOM 1086 CG ASP A 67 -5.574 6.977 -5.740 1.00 0.00 C ATOM 1087 OD1 ASP A 67 -6.308 6.473 -6.616 1.00 0.00 O ATOM 1088 OD2 ASP A 67 -5.136 8.145 -5.802 1.00 0.00 O ATOM 0 H ASP A 67 -7.132 6.494 -3.059 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.661 4.700 -5.196 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -5.093 6.767 -3.666 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -4.220 5.671 -4.719 1.00 0.00 H new ATOM 1093 N PHE A 68 -5.385 3.909 -2.274 1.00 0.00 N ATOM 1094 CA PHE A 68 -4.747 2.837 -1.521 1.00 0.00 C ATOM 1095 C PHE A 68 -5.497 1.521 -1.705 1.00 0.00 C ATOM 1096 O PHE A 68 -4.895 0.482 -1.980 1.00 0.00 O ATOM 1097 CB PHE A 68 -4.682 3.196 -0.035 1.00 0.00 C ATOM 1098 CG PHE A 68 -4.530 2.003 0.864 1.00 0.00 C ATOM 1099 CD1 PHE A 68 -3.273 1.508 1.174 1.00 0.00 C ATOM 1100 CD2 PHE A 68 -5.643 1.375 1.399 1.00 0.00 C ATOM 1101 CE1 PHE A 68 -3.129 0.411 2.002 1.00 0.00 C ATOM 1102 CE2 PHE A 68 -5.505 0.277 2.228 1.00 0.00 C ATOM 1103 CZ PHE A 68 -4.247 -0.206 2.529 1.00 0.00 C ATOM 0 H PHE A 68 -5.694 4.698 -1.706 1.00 0.00 H new ATOM 0 HA PHE A 68 -3.733 2.714 -1.902 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.845 3.874 0.130 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.588 3.735 0.240 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -2.396 1.985 0.763 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.630 1.747 1.166 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.144 0.036 2.237 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -6.381 -0.203 2.640 1.00 0.00 H new ATOM 0 HZ PHE A 68 -4.137 -1.064 3.175 1.00 0.00 H new ATOM 1113 N LEU A 69 -6.816 1.573 -1.552 1.00 0.00 N ATOM 1114 CA LEU A 69 -7.650 0.386 -1.701 1.00 0.00 C ATOM 1115 C LEU A 69 -7.519 -0.200 -3.103 1.00 0.00 C ATOM 1116 O LEU A 69 -7.468 -1.418 -3.277 1.00 0.00 O ATOM 1117 CB LEU A 69 -9.113 0.728 -1.414 1.00 0.00 C ATOM 1118 CG LEU A 69 -9.558 0.605 0.044 1.00 0.00 C ATOM 1119 CD1 LEU A 69 -10.933 1.224 0.237 1.00 0.00 C ATOM 1120 CD2 LEU A 69 -9.561 -0.852 0.481 1.00 0.00 C ATOM 0 H LEU A 69 -7.330 2.424 -1.325 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.309 -0.360 -0.983 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.298 1.750 -1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.743 0.078 -2.021 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.847 1.148 0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.233 1.127 1.281 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.898 2.279 -0.034 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.656 0.710 -0.397 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.880 -0.919 1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.248 -1.419 -0.147 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.556 -1.263 0.383 1.00 0.00 H new ATOM 1132 N LYS A 70 -7.463 0.675 -4.101 1.00 0.00 N ATOM 1133 CA LYS A 70 -7.333 0.247 -5.489 1.00 0.00 C ATOM 1134 C LYS A 70 -6.186 -0.746 -5.647 1.00 0.00 C ATOM 1135 O LYS A 70 -6.259 -1.669 -6.459 1.00 0.00 O ATOM 1136 CB LYS A 70 -7.104 1.456 -6.399 1.00 0.00 C ATOM 1137 CG LYS A 70 -8.368 2.246 -6.690 1.00 0.00 C ATOM 1138 CD LYS A 70 -8.069 3.500 -7.494 1.00 0.00 C ATOM 1139 CE LYS A 70 -9.147 4.556 -7.302 1.00 0.00 C ATOM 1140 NZ LYS A 70 -10.405 4.200 -8.015 1.00 0.00 N ATOM 0 H LYS A 70 -7.506 1.686 -3.974 1.00 0.00 H new ATOM 0 HA LYS A 70 -8.261 -0.247 -5.779 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.372 2.116 -5.934 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -6.674 1.115 -7.341 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.071 1.620 -7.239 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -8.851 2.521 -5.752 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -7.103 3.905 -7.192 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.991 3.246 -8.551 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -9.354 4.675 -6.238 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -8.783 5.517 -7.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -11.115 4.944 -7.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -10.214 4.111 -9.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -10.767 3.296 -7.651 1.00 0.00 H new ATOM 1154 N ASP A 71 -5.130 -0.552 -4.865 1.00 0.00 N ATOM 1155 CA ASP A 71 -3.969 -1.433 -4.917 1.00 0.00 C ATOM 1156 C ASP A 71 -4.263 -2.761 -4.228 1.00 0.00 C ATOM 1157 O ASP A 71 -3.904 -3.826 -4.732 1.00 0.00 O ATOM 1158 CB ASP A 71 -2.762 -0.759 -4.261 1.00 0.00 C ATOM 1159 CG ASP A 71 -2.026 0.164 -5.212 1.00 0.00 C ATOM 1160 OD1 ASP A 71 -2.655 1.116 -5.720 1.00 0.00 O ATOM 1161 OD2 ASP A 71 -0.821 -0.066 -5.449 1.00 0.00 O ATOM 0 H ASP A 71 -5.054 0.207 -4.188 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.740 -1.631 -5.964 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.095 -0.191 -3.392 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.076 -1.524 -3.898 1.00 0.00 H new ATOM 1166 N ILE A 72 -4.916 -2.691 -3.073 1.00 0.00 N ATOM 1167 CA ILE A 72 -5.258 -3.888 -2.315 1.00 0.00 C ATOM 1168 C ILE A 72 -6.131 -4.829 -3.138 1.00 0.00 C ATOM 1169 O ILE A 72 -5.935 -6.044 -3.125 1.00 0.00 O ATOM 1170 CB ILE A 72 -5.993 -3.536 -1.008 1.00 0.00 C ATOM 1171 CG1 ILE A 72 -5.086 -2.709 -0.094 1.00 0.00 C ATOM 1172 CG2 ILE A 72 -6.452 -4.802 -0.301 1.00 0.00 C ATOM 1173 CD1 ILE A 72 -3.965 -3.509 0.530 1.00 0.00 C ATOM 0 H ILE A 72 -5.219 -1.818 -2.642 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.320 -4.386 -2.072 1.00 0.00 H new ATOM 0 HB ILE A 72 -6.872 -2.940 -1.252 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -4.659 -1.887 -0.668 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.689 -2.266 0.698 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -6.970 -4.537 0.621 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.129 -5.356 -0.951 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.587 -5.421 -0.066 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.363 -2.858 1.165 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.385 -4.316 1.131 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.338 -3.931 -0.256 1.00 0.00 H new ATOM 1185 N ASP A 73 -7.093 -4.259 -3.854 1.00 0.00 N ATOM 1186 CA ASP A 73 -7.995 -5.047 -4.686 1.00 0.00 C ATOM 1187 C ASP A 73 -7.214 -5.871 -5.705 1.00 0.00 C ATOM 1188 O ASP A 73 -7.626 -6.971 -6.077 1.00 0.00 O ATOM 1189 CB ASP A 73 -8.989 -4.133 -5.405 1.00 0.00 C ATOM 1190 CG ASP A 73 -10.077 -4.910 -6.121 1.00 0.00 C ATOM 1191 OD1 ASP A 73 -9.836 -6.085 -6.469 1.00 0.00 O ATOM 1192 OD2 ASP A 73 -11.169 -4.343 -6.333 1.00 0.00 O ATOM 0 H ASP A 73 -7.269 -3.254 -3.875 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.544 -5.730 -4.038 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.445 -3.457 -4.682 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.454 -3.515 -6.126 1.00 0.00 H new ATOM 1197 N LEU A 74 -6.086 -5.333 -6.153 1.00 0.00 N ATOM 1198 CA LEU A 74 -5.246 -6.017 -7.131 1.00 0.00 C ATOM 1199 C LEU A 74 -4.576 -7.240 -6.511 1.00 0.00 C ATOM 1200 O LEU A 74 -3.998 -8.067 -7.217 1.00 0.00 O ATOM 1201 CB LEU A 74 -4.184 -5.062 -7.678 1.00 0.00 C ATOM 1202 CG LEU A 74 -3.449 -5.526 -8.936 1.00 0.00 C ATOM 1203 CD1 LEU A 74 -4.441 -5.928 -10.017 1.00 0.00 C ATOM 1204 CD2 LEU A 74 -2.518 -4.435 -9.443 1.00 0.00 C ATOM 0 H LEU A 74 -5.731 -4.424 -5.855 1.00 0.00 H new ATOM 0 HA LEU A 74 -5.882 -6.350 -7.951 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.660 -4.105 -7.892 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.447 -4.884 -6.895 1.00 0.00 H new ATOM 0 HG LEU A 74 -2.848 -6.399 -8.681 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -3.899 -6.255 -10.904 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -5.066 -6.743 -9.652 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -5.069 -5.074 -10.270 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -2.003 -4.783 -10.339 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -3.098 -3.543 -9.681 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.784 -4.196 -8.673 1.00 0.00 H new ATOM 1216 N ILE A 75 -4.660 -7.348 -5.190 1.00 0.00 N ATOM 1217 CA ILE A 75 -4.065 -8.471 -4.477 1.00 0.00 C ATOM 1218 C ILE A 75 -4.935 -9.719 -4.592 1.00 0.00 C ATOM 1219 O ILE A 75 -4.426 -10.836 -4.685 1.00 0.00 O ATOM 1220 CB ILE A 75 -3.853 -8.144 -2.987 1.00 0.00 C ATOM 1221 CG1 ILE A 75 -2.889 -6.965 -2.834 1.00 0.00 C ATOM 1222 CG2 ILE A 75 -3.328 -9.364 -2.246 1.00 0.00 C ATOM 1223 CD1 ILE A 75 -2.465 -6.713 -1.404 1.00 0.00 C ATOM 0 H ILE A 75 -5.134 -6.672 -4.592 1.00 0.00 H new ATOM 0 HA ILE A 75 -3.097 -8.661 -4.941 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.812 -7.864 -2.551 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.002 -7.150 -3.440 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -3.362 -6.066 -3.228 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -3.183 -9.117 -1.194 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -4.047 -10.179 -2.332 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.377 -9.672 -2.680 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.783 -5.864 -1.371 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -3.344 -6.496 -0.797 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -1.963 -7.597 -1.012 1.00 0.00 H new ATOM 1235 N CYS A 76 -6.248 -9.520 -4.588 1.00 0.00 N ATOM 1236 CA CYS A 76 -7.190 -10.629 -4.693 1.00 0.00 C ATOM 1237 C CYS A 76 -7.265 -11.143 -6.127 1.00 0.00 C ATOM 1238 O CYS A 76 -7.093 -12.336 -6.380 1.00 0.00 O ATOM 1239 CB CYS A 76 -8.577 -10.194 -4.221 1.00 0.00 C ATOM 1240 SG CYS A 76 -8.584 -9.367 -2.613 1.00 0.00 S ATOM 0 H CYS A 76 -6.685 -8.601 -4.513 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.835 -11.437 -4.054 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -9.008 -9.523 -4.964 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -9.223 -11.070 -4.170 1.00 0.00 H new ATOM 0 HG CYS A 76 -9.118 -10.151 -1.724 1.00 0.00 H new ATOM 1246 N SER A 77 -7.527 -10.236 -7.063 1.00 0.00 N ATOM 1247 CA SER A 77 -7.631 -10.599 -8.471 1.00 0.00 C ATOM 1248 C SER A 77 -6.364 -11.302 -8.947 1.00 0.00 C ATOM 1249 O SER A 77 -6.418 -12.413 -9.473 1.00 0.00 O ATOM 1250 CB SER A 77 -7.887 -9.354 -9.323 1.00 0.00 C ATOM 1251 OG SER A 77 -6.697 -8.606 -9.502 1.00 0.00 O ATOM 0 H SER A 77 -7.671 -9.245 -6.871 1.00 0.00 H new ATOM 0 HA SER A 77 -8.470 -11.286 -8.582 1.00 0.00 H new ATOM 0 HB2 SER A 77 -8.284 -9.649 -10.294 1.00 0.00 H new ATOM 0 HB3 SER A 77 -8.643 -8.731 -8.845 1.00 0.00 H new ATOM 0 HG SER A 77 -6.846 -7.910 -10.176 1.00 0.00 H new ATOM 1257 N ASN A 78 -5.224 -10.646 -8.757 1.00 0.00 N ATOM 1258 CA ASN A 78 -3.941 -11.208 -9.167 1.00 0.00 C ATOM 1259 C ASN A 78 -3.852 -12.685 -8.798 1.00 0.00 C ATOM 1260 O ASN A 78 -3.607 -13.535 -9.654 1.00 0.00 O ATOM 1261 CB ASN A 78 -2.792 -10.437 -8.514 1.00 0.00 C ATOM 1262 CG ASN A 78 -2.397 -9.206 -9.306 1.00 0.00 C ATOM 1263 OD1 ASN A 78 -3.233 -8.577 -9.955 1.00 0.00 O ATOM 1264 ND2 ASN A 78 -1.117 -8.857 -9.257 1.00 0.00 N ATOM 0 H ASN A 78 -5.162 -9.725 -8.322 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.861 -11.117 -10.250 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -3.084 -10.139 -7.507 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.928 -11.094 -8.414 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.792 -8.038 -9.770 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.459 -9.408 -8.706 1.00 0.00 H new ATOM 1271 N ALA A 79 -4.053 -12.984 -7.519 1.00 0.00 N ATOM 1272 CA ALA A 79 -3.998 -14.359 -7.038 1.00 0.00 C ATOM 1273 C ALA A 79 -4.832 -15.283 -7.919 1.00 0.00 C ATOM 1274 O ALA A 79 -4.303 -16.197 -8.553 1.00 0.00 O ATOM 1275 CB ALA A 79 -4.474 -14.432 -5.594 1.00 0.00 C ATOM 0 H ALA A 79 -4.255 -12.292 -6.797 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.962 -14.693 -7.085 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -4.428 -15.464 -5.247 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.834 -13.810 -4.968 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.502 -14.074 -5.531 1.00 0.00 H new ATOM 1281 N LEU A 80 -6.138 -15.040 -7.953 1.00 0.00 N ATOM 1282 CA LEU A 80 -7.046 -15.851 -8.757 1.00 0.00 C ATOM 1283 C LEU A 80 -6.391 -16.260 -10.072 1.00 0.00 C ATOM 1284 O LEU A 80 -6.676 -17.329 -10.612 1.00 0.00 O ATOM 1285 CB LEU A 80 -8.338 -15.082 -9.034 1.00 0.00 C ATOM 1286 CG LEU A 80 -9.354 -15.041 -7.892 1.00 0.00 C ATOM 1287 CD1 LEU A 80 -10.243 -13.813 -8.012 1.00 0.00 C ATOM 1288 CD2 LEU A 80 -10.193 -16.310 -7.878 1.00 0.00 C ATOM 0 H LEU A 80 -6.592 -14.288 -7.434 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.282 -16.754 -8.194 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.077 -14.057 -9.298 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.820 -15.524 -9.906 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.810 -14.979 -6.950 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -10.960 -13.801 -7.191 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -9.629 -12.914 -7.971 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.779 -13.843 -8.961 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -10.910 -16.263 -7.059 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -10.727 -16.403 -8.823 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -9.543 -17.174 -7.742 1.00 0.00 H new ATOM 1300 N GLU A 81 -5.512 -15.403 -10.581 1.00 0.00 N ATOM 1301 CA GLU A 81 -4.816 -15.677 -11.833 1.00 0.00 C ATOM 1302 C GLU A 81 -3.556 -16.501 -11.587 1.00 0.00 C ATOM 1303 O GLU A 81 -3.429 -17.623 -12.078 1.00 0.00 O ATOM 1304 CB GLU A 81 -4.452 -14.367 -12.537 1.00 0.00 C ATOM 1305 CG GLU A 81 -3.513 -14.552 -13.718 1.00 0.00 C ATOM 1306 CD GLU A 81 -4.250 -14.870 -15.004 1.00 0.00 C ATOM 1307 OE1 GLU A 81 -4.775 -15.997 -15.124 1.00 0.00 O ATOM 1308 OE2 GLU A 81 -4.300 -13.993 -15.891 1.00 0.00 O ATOM 0 H GLU A 81 -5.265 -14.514 -10.146 1.00 0.00 H new ATOM 0 HA GLU A 81 -5.486 -16.252 -12.472 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.366 -13.884 -12.882 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -3.988 -13.694 -11.816 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -2.925 -13.645 -13.855 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -2.811 -15.356 -13.497 1.00 0.00 H new ATOM 1315 N TYR A 82 -2.627 -15.937 -10.823 1.00 0.00 N ATOM 1316 CA TYR A 82 -1.376 -16.618 -10.512 1.00 0.00 C ATOM 1317 C TYR A 82 -1.586 -17.683 -9.440 1.00 0.00 C ATOM 1318 O TYR A 82 -1.101 -17.553 -8.317 1.00 0.00 O ATOM 1319 CB TYR A 82 -0.324 -15.610 -10.047 1.00 0.00 C ATOM 1320 CG TYR A 82 -0.050 -14.513 -11.051 1.00 0.00 C ATOM 1321 CD1 TYR A 82 0.736 -14.751 -12.172 1.00 0.00 C ATOM 1322 CD2 TYR A 82 -0.578 -13.239 -10.879 1.00 0.00 C ATOM 1323 CE1 TYR A 82 0.989 -13.751 -13.091 1.00 0.00 C ATOM 1324 CE2 TYR A 82 -0.331 -12.234 -11.794 1.00 0.00 C ATOM 1325 CZ TYR A 82 0.453 -12.495 -12.898 1.00 0.00 C ATOM 1326 OH TYR A 82 0.703 -11.497 -13.812 1.00 0.00 O ATOM 0 H TYR A 82 -2.717 -15.010 -10.408 1.00 0.00 H new ATOM 0 HA TYR A 82 -1.024 -17.108 -11.420 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -0.653 -15.160 -9.111 1.00 0.00 H new ATOM 0 HB3 TYR A 82 0.606 -16.139 -9.837 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.156 -15.734 -12.327 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -1.192 -13.031 -10.015 1.00 0.00 H new ATOM 0 HE1 TYR A 82 1.603 -13.952 -13.956 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -0.750 -11.250 -11.646 1.00 0.00 H new ATOM 0 HH TYR A 82 0.252 -10.674 -13.530 1.00 0.00 H new ATOM 1431 N ASP A 90 -4.427 -25.171 -2.888 1.00 0.00 N ATOM 1432 CA ASP A 90 -4.454 -23.981 -3.731 1.00 0.00 C ATOM 1433 C ASP A 90 -5.877 -23.668 -4.183 1.00 0.00 C ATOM 1434 O ASP A 90 -6.250 -22.505 -4.334 1.00 0.00 O ATOM 1435 CB ASP A 90 -3.549 -24.173 -4.950 1.00 0.00 C ATOM 1436 CG ASP A 90 -4.239 -24.929 -6.069 1.00 0.00 C ATOM 1437 OD1 ASP A 90 -4.936 -25.923 -5.773 1.00 0.00 O ATOM 1438 OD2 ASP A 90 -4.081 -24.527 -7.240 1.00 0.00 O ATOM 0 HA ASP A 90 -4.085 -23.140 -3.143 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -3.228 -23.198 -5.318 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -2.651 -24.713 -4.651 1.00 0.00 H new ATOM 1443 N LYS A 91 -6.668 -24.714 -4.398 1.00 0.00 N ATOM 1444 CA LYS A 91 -8.050 -24.552 -4.832 1.00 0.00 C ATOM 1445 C LYS A 91 -8.840 -23.714 -3.832 1.00 0.00 C ATOM 1446 O LYS A 91 -9.848 -23.099 -4.182 1.00 0.00 O ATOM 1447 CB LYS A 91 -8.715 -25.919 -5.005 1.00 0.00 C ATOM 1448 CG LYS A 91 -8.270 -26.659 -6.255 1.00 0.00 C ATOM 1449 CD LYS A 91 -8.937 -26.100 -7.501 1.00 0.00 C ATOM 1450 CE LYS A 91 -8.610 -26.935 -8.729 1.00 0.00 C ATOM 1451 NZ LYS A 91 -9.085 -28.339 -8.589 1.00 0.00 N ATOM 0 H LYS A 91 -6.375 -25.684 -4.279 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.045 -24.033 -5.790 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -8.495 -26.533 -4.132 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.796 -25.786 -5.037 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -7.187 -26.585 -6.357 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -8.510 -27.718 -6.157 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.017 -26.072 -7.356 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -8.610 -25.073 -7.660 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -9.069 -26.483 -9.608 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -7.533 -26.931 -8.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -9.142 -28.782 -9.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -8.420 -28.873 -7.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.026 -28.345 -8.146 1.00 0.00 H new ATOM 1465 N ILE A 92 -8.375 -23.692 -2.587 1.00 0.00 N ATOM 1466 CA ILE A 92 -9.037 -22.927 -1.538 1.00 0.00 C ATOM 1467 C ILE A 92 -8.558 -21.479 -1.528 1.00 0.00 C ATOM 1468 O ILE A 92 -9.352 -20.553 -1.365 1.00 0.00 O ATOM 1469 CB ILE A 92 -8.793 -23.547 -0.150 1.00 0.00 C ATOM 1470 CG1 ILE A 92 -9.633 -24.814 0.022 1.00 0.00 C ATOM 1471 CG2 ILE A 92 -9.115 -22.539 0.944 1.00 0.00 C ATOM 1472 CD1 ILE A 92 -9.075 -26.013 -0.713 1.00 0.00 C ATOM 0 H ILE A 92 -7.542 -24.195 -2.281 1.00 0.00 H new ATOM 0 HA ILE A 92 -10.105 -22.952 -1.755 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.740 -23.818 -0.069 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.706 -25.050 1.084 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -10.646 -24.620 -0.332 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.938 -22.992 1.920 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -8.478 -21.662 0.830 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -10.160 -22.240 0.867 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -9.721 -26.875 -0.546 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -9.028 -25.796 -1.780 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.074 -26.233 -0.343 1.00 0.00 H new ATOM 1484 N ILE A 93 -7.254 -21.292 -1.705 1.00 0.00 N ATOM 1485 CA ILE A 93 -6.669 -19.957 -1.719 1.00 0.00 C ATOM 1486 C ILE A 93 -7.500 -19.002 -2.569 1.00 0.00 C ATOM 1487 O ILE A 93 -7.713 -17.848 -2.196 1.00 0.00 O ATOM 1488 CB ILE A 93 -5.226 -19.981 -2.255 1.00 0.00 C ATOM 1489 CG1 ILE A 93 -4.358 -20.912 -1.406 1.00 0.00 C ATOM 1490 CG2 ILE A 93 -4.644 -18.575 -2.272 1.00 0.00 C ATOM 1491 CD1 ILE A 93 -2.919 -20.984 -1.867 1.00 0.00 C ATOM 0 H ILE A 93 -6.583 -22.048 -1.841 1.00 0.00 H new ATOM 0 HA ILE A 93 -6.659 -19.606 -0.687 1.00 0.00 H new ATOM 0 HB ILE A 93 -5.240 -20.360 -3.277 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -4.383 -20.574 -0.370 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -4.788 -21.914 -1.425 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -3.623 -18.608 -2.653 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -5.251 -17.938 -2.915 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -4.640 -18.171 -1.260 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -2.363 -21.662 -1.219 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -2.883 -21.351 -2.893 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -2.472 -19.991 -1.821 1.00 0.00 H new ATOM 1503 N ARG A 94 -7.969 -19.491 -3.712 1.00 0.00 N ATOM 1504 CA ARG A 94 -8.778 -18.682 -4.615 1.00 0.00 C ATOM 1505 C ARG A 94 -9.833 -17.895 -3.843 1.00 0.00 C ATOM 1506 O ARG A 94 -10.132 -16.747 -4.174 1.00 0.00 O ATOM 1507 CB ARG A 94 -9.453 -19.568 -5.663 1.00 0.00 C ATOM 1508 CG ARG A 94 -10.802 -20.112 -5.222 1.00 0.00 C ATOM 1509 CD ARG A 94 -11.334 -21.146 -6.203 1.00 0.00 C ATOM 1510 NE ARG A 94 -11.911 -20.525 -7.392 1.00 0.00 N ATOM 1511 CZ ARG A 94 -12.641 -21.185 -8.285 1.00 0.00 C ATOM 1512 NH1 ARG A 94 -12.883 -22.478 -8.122 1.00 0.00 N ATOM 1513 NH2 ARG A 94 -13.132 -20.551 -9.342 1.00 0.00 N ATOM 0 H ARG A 94 -7.802 -20.444 -4.035 1.00 0.00 H new ATOM 0 HA ARG A 94 -8.118 -17.975 -5.118 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -9.584 -18.995 -6.581 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -8.794 -20.403 -5.900 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -10.709 -20.561 -4.233 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -11.515 -19.292 -5.134 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -10.526 -21.815 -6.499 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -12.090 -21.758 -5.711 1.00 0.00 H new ATOM 0 HE ARG A 94 -11.745 -19.530 -7.545 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -12.509 -22.968 -7.310 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -13.444 -22.982 -8.809 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -12.949 -19.556 -9.470 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -13.692 -21.059 -10.027 1.00 0.00 H new ATOM 1527 N HIS A 95 -10.393 -18.520 -2.812 1.00 0.00 N ATOM 1528 CA HIS A 95 -11.414 -17.878 -1.992 1.00 0.00 C ATOM 1529 C HIS A 95 -10.780 -16.937 -0.972 1.00 0.00 C ATOM 1530 O HIS A 95 -11.156 -15.768 -0.875 1.00 0.00 O ATOM 1531 CB HIS A 95 -12.259 -18.932 -1.275 1.00 0.00 C ATOM 1532 CG HIS A 95 -13.392 -18.354 -0.483 1.00 0.00 C ATOM 1533 ND1 HIS A 95 -13.543 -18.557 0.872 1.00 0.00 N ATOM 1534 CD2 HIS A 95 -14.430 -17.574 -0.864 1.00 0.00 C ATOM 1535 CE1 HIS A 95 -14.627 -17.929 1.291 1.00 0.00 C ATOM 1536 NE2 HIS A 95 -15.183 -17.324 0.257 1.00 0.00 N ATOM 0 H HIS A 95 -10.157 -19.470 -2.525 1.00 0.00 H new ATOM 0 HA HIS A 95 -12.057 -17.292 -2.649 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -12.660 -19.628 -2.012 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -11.617 -19.508 -0.608 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -14.629 -17.215 -1.863 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -14.996 -17.913 2.306 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -16.034 -16.762 0.286 1.00 0.00 H new ATOM 1545 N ARG A 96 -9.819 -17.454 -0.214 1.00 0.00 N ATOM 1546 CA ARG A 96 -9.135 -16.660 0.799 1.00 0.00 C ATOM 1547 C ARG A 96 -8.930 -15.226 0.320 1.00 0.00 C ATOM 1548 O ARG A 96 -9.036 -14.280 1.099 1.00 0.00 O ATOM 1549 CB ARG A 96 -7.785 -17.291 1.146 1.00 0.00 C ATOM 1550 CG ARG A 96 -7.902 -18.569 1.961 1.00 0.00 C ATOM 1551 CD ARG A 96 -6.552 -19.250 2.126 1.00 0.00 C ATOM 1552 NE ARG A 96 -5.791 -18.694 3.241 1.00 0.00 N ATOM 1553 CZ ARG A 96 -6.114 -18.880 4.516 1.00 0.00 C ATOM 1554 NH1 ARG A 96 -7.178 -19.604 4.835 1.00 0.00 N ATOM 1555 NH2 ARG A 96 -5.371 -18.342 5.475 1.00 0.00 N ATOM 0 H ARG A 96 -9.496 -18.419 -0.282 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.760 -16.640 1.692 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -7.246 -17.506 0.223 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -7.188 -16.568 1.702 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -8.317 -18.339 2.942 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -8.598 -19.251 1.472 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -6.702 -20.318 2.286 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -5.977 -19.143 1.206 1.00 0.00 H new ATOM 0 HE ARG A 96 -4.966 -18.132 3.029 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -7.751 -20.020 4.101 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -7.424 -19.745 5.815 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -4.551 -17.785 5.233 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -5.620 -18.485 6.454 1.00 0.00 H new ATOM 1569 N ALA A 97 -8.635 -15.074 -0.967 1.00 0.00 N ATOM 1570 CA ALA A 97 -8.417 -13.757 -1.551 1.00 0.00 C ATOM 1571 C ALA A 97 -9.637 -12.862 -1.359 1.00 0.00 C ATOM 1572 O ALA A 97 -9.562 -11.827 -0.697 1.00 0.00 O ATOM 1573 CB ALA A 97 -8.080 -13.883 -3.029 1.00 0.00 C ATOM 0 H ALA A 97 -8.542 -15.848 -1.625 1.00 0.00 H new ATOM 0 HA ALA A 97 -7.575 -13.294 -1.036 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -7.920 -12.891 -3.452 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.174 -14.478 -3.146 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.904 -14.370 -3.550 1.00 0.00 H new ATOM 1579 N CYS A 98 -10.759 -13.268 -1.943 1.00 0.00 N ATOM 1580 CA CYS A 98 -11.996 -12.502 -1.837 1.00 0.00 C ATOM 1581 C CYS A 98 -12.129 -11.872 -0.455 1.00 0.00 C ATOM 1582 O CYS A 98 -12.356 -10.668 -0.327 1.00 0.00 O ATOM 1583 CB CYS A 98 -13.202 -13.399 -2.121 1.00 0.00 C ATOM 1584 SG CYS A 98 -13.436 -13.790 -3.870 1.00 0.00 S ATOM 0 H CYS A 98 -10.838 -14.123 -2.494 1.00 0.00 H new ATOM 0 HA CYS A 98 -11.964 -11.703 -2.578 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -13.089 -14.329 -1.564 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -14.101 -12.910 -1.746 1.00 0.00 H new ATOM 0 HG CYS A 98 -14.478 -14.554 -4.008 1.00 0.00 H new ATOM 1590 N THR A 99 -11.988 -12.694 0.581 1.00 0.00 N ATOM 1591 CA THR A 99 -12.096 -12.219 1.954 1.00 0.00 C ATOM 1592 C THR A 99 -11.224 -10.989 2.180 1.00 0.00 C ATOM 1593 O THR A 99 -11.669 -9.998 2.761 1.00 0.00 O ATOM 1594 CB THR A 99 -11.691 -13.313 2.960 1.00 0.00 C ATOM 1595 OG1 THR A 99 -12.355 -14.541 2.643 1.00 0.00 O ATOM 1596 CG2 THR A 99 -12.037 -12.896 4.382 1.00 0.00 C ATOM 0 H THR A 99 -11.799 -13.692 0.494 1.00 0.00 H new ATOM 0 HA THR A 99 -13.141 -11.955 2.116 1.00 0.00 H new ATOM 0 HB THR A 99 -10.613 -13.456 2.892 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.091 -15.231 3.286 1.00 0.00 H new ATOM 0 HG21 THR A 99 -11.742 -13.684 5.074 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.506 -11.977 4.631 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.111 -12.728 4.461 1.00 0.00 H new ATOM 1604 N LEU A 100 -9.981 -11.057 1.716 1.00 0.00 N ATOM 1605 CA LEU A 100 -9.046 -9.948 1.867 1.00 0.00 C ATOM 1606 C LEU A 100 -9.694 -8.630 1.455 1.00 0.00 C ATOM 1607 O LEU A 100 -9.498 -7.600 2.101 1.00 0.00 O ATOM 1608 CB LEU A 100 -7.791 -10.195 1.029 1.00 0.00 C ATOM 1609 CG LEU A 100 -6.650 -9.194 1.218 1.00 0.00 C ATOM 1610 CD1 LEU A 100 -5.993 -9.383 2.576 1.00 0.00 C ATOM 1611 CD2 LEU A 100 -5.625 -9.339 0.103 1.00 0.00 C ATOM 0 H LEU A 100 -9.597 -11.869 1.232 1.00 0.00 H new ATOM 0 HA LEU A 100 -8.766 -9.882 2.918 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.415 -11.192 1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -8.075 -10.197 -0.023 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.065 -8.187 1.176 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.184 -8.662 2.692 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.732 -9.229 3.362 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.592 -10.394 2.648 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.820 -8.619 0.253 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.215 -10.349 0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.104 -9.153 -0.858 1.00 0.00 H new ATOM 1623 N LYS A 101 -10.470 -8.669 0.377 1.00 0.00 N ATOM 1624 CA LYS A 101 -11.151 -7.480 -0.120 1.00 0.00 C ATOM 1625 C LYS A 101 -12.148 -6.954 0.908 1.00 0.00 C ATOM 1626 O LYS A 101 -11.990 -5.851 1.431 1.00 0.00 O ATOM 1627 CB LYS A 101 -11.874 -7.792 -1.433 1.00 0.00 C ATOM 1628 CG LYS A 101 -11.993 -6.596 -2.361 1.00 0.00 C ATOM 1629 CD LYS A 101 -12.197 -7.027 -3.803 1.00 0.00 C ATOM 1630 CE LYS A 101 -13.636 -7.448 -4.061 1.00 0.00 C ATOM 1631 NZ LYS A 101 -13.833 -7.921 -5.459 1.00 0.00 N ATOM 0 H LYS A 101 -10.643 -9.513 -0.170 1.00 0.00 H new ATOM 0 HA LYS A 101 -10.400 -6.711 -0.299 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -11.342 -8.591 -1.950 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -12.872 -8.167 -1.208 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -12.829 -5.971 -2.045 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -11.093 -5.986 -2.287 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -11.932 -6.207 -4.470 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -11.527 -7.855 -4.034 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -13.912 -8.242 -3.367 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -14.301 -6.607 -3.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -14.826 -8.199 -5.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -13.594 -7.156 -6.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -13.217 -8.739 -5.639 1.00 0.00 H new ATOM 1645 N ASP A 102 -13.172 -7.750 1.194 1.00 0.00 N ATOM 1646 CA ASP A 102 -14.193 -7.365 2.161 1.00 0.00 C ATOM 1647 C ASP A 102 -13.559 -6.754 3.406 1.00 0.00 C ATOM 1648 O ASP A 102 -13.913 -5.649 3.819 1.00 0.00 O ATOM 1649 CB ASP A 102 -15.041 -8.578 2.549 1.00 0.00 C ATOM 1650 CG ASP A 102 -16.203 -8.207 3.451 1.00 0.00 C ATOM 1651 OD1 ASP A 102 -16.921 -7.239 3.125 1.00 0.00 O ATOM 1652 OD2 ASP A 102 -16.393 -8.885 4.482 1.00 0.00 O ATOM 0 H ASP A 102 -13.317 -8.666 0.770 1.00 0.00 H new ATOM 0 HA ASP A 102 -14.834 -6.616 1.697 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -15.423 -9.054 1.646 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -14.412 -9.311 3.054 1.00 0.00 H new ATOM 1657 N THR A 103 -12.618 -7.481 4.003 1.00 0.00 N ATOM 1658 CA THR A 103 -11.936 -7.011 5.202 1.00 0.00 C ATOM 1659 C THR A 103 -11.373 -5.609 5.001 1.00 0.00 C ATOM 1660 O THR A 103 -11.796 -4.660 5.660 1.00 0.00 O ATOM 1661 CB THR A 103 -10.791 -7.960 5.604 1.00 0.00 C ATOM 1662 OG1 THR A 103 -11.288 -9.295 5.748 1.00 0.00 O ATOM 1663 CG2 THR A 103 -10.148 -7.509 6.907 1.00 0.00 C ATOM 0 H THR A 103 -12.312 -8.397 3.675 1.00 0.00 H new ATOM 0 HA THR A 103 -12.678 -6.990 6.000 1.00 0.00 H new ATOM 0 HB THR A 103 -10.037 -7.937 4.818 1.00 0.00 H new ATOM 0 HG1 THR A 103 -11.392 -9.703 4.863 1.00 0.00 H new ATOM 0 HG21 THR A 103 -9.342 -8.194 7.171 1.00 0.00 H new ATOM 0 HG22 THR A 103 -9.744 -6.504 6.785 1.00 0.00 H new ATOM 0 HG23 THR A 103 -10.896 -7.506 7.700 1.00 0.00 H new ATOM 1671 N ALA A 104 -10.416 -5.486 4.087 1.00 0.00 N ATOM 1672 CA ALA A 104 -9.796 -4.199 3.798 1.00 0.00 C ATOM 1673 C ALA A 104 -10.851 -3.132 3.522 1.00 0.00 C ATOM 1674 O ALA A 104 -10.978 -2.163 4.271 1.00 0.00 O ATOM 1675 CB ALA A 104 -8.848 -4.324 2.615 1.00 0.00 C ATOM 0 H ALA A 104 -10.053 -6.262 3.534 1.00 0.00 H new ATOM 0 HA ALA A 104 -9.226 -3.892 4.675 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.392 -3.355 2.410 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -8.069 -5.050 2.848 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -9.403 -4.657 1.738 1.00 0.00 H new ATOM 1681 N HIS A 105 -11.605 -3.316 2.443 1.00 0.00 N ATOM 1682 CA HIS A 105 -12.648 -2.369 2.069 1.00 0.00 C ATOM 1683 C HIS A 105 -13.510 -2.006 3.274 1.00 0.00 C ATOM 1684 O HIS A 105 -13.914 -0.855 3.437 1.00 0.00 O ATOM 1685 CB HIS A 105 -13.523 -2.953 0.959 1.00 0.00 C ATOM 1686 CG HIS A 105 -12.944 -2.782 -0.412 1.00 0.00 C ATOM 1687 ND1 HIS A 105 -13.292 -1.746 -1.252 1.00 0.00 N ATOM 1688 CD2 HIS A 105 -12.035 -3.523 -1.087 1.00 0.00 C ATOM 1689 CE1 HIS A 105 -12.624 -1.858 -2.386 1.00 0.00 C ATOM 1690 NE2 HIS A 105 -11.853 -2.928 -2.311 1.00 0.00 N ATOM 0 H HIS A 105 -11.513 -4.112 1.813 1.00 0.00 H new ATOM 0 HA HIS A 105 -12.166 -1.462 1.703 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -13.677 -4.015 1.150 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -14.503 -2.478 0.992 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -11.544 -4.416 -0.730 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -12.696 -1.189 -3.231 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -11.225 -3.258 -3.043 1.00 0.00 H new ATOM 1699 N ALA A 106 -13.789 -2.996 4.116 1.00 0.00 N ATOM 1700 CA ALA A 106 -14.602 -2.781 5.307 1.00 0.00 C ATOM 1701 C ALA A 106 -13.878 -1.890 6.311 1.00 0.00 C ATOM 1702 O ALA A 106 -14.466 -0.962 6.867 1.00 0.00 O ATOM 1703 CB ALA A 106 -14.965 -4.113 5.945 1.00 0.00 C ATOM 0 H ALA A 106 -13.464 -3.955 3.995 1.00 0.00 H new ATOM 0 HA ALA A 106 -15.519 -2.274 5.006 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -15.572 -3.938 6.833 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -15.529 -4.716 5.233 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -14.054 -4.642 6.227 1.00 0.00 H new ATOM 1709 N ILE A 107 -12.602 -2.180 6.540 1.00 0.00 N ATOM 1710 CA ILE A 107 -11.799 -1.405 7.478 1.00 0.00 C ATOM 1711 C ILE A 107 -11.756 0.067 7.078 1.00 0.00 C ATOM 1712 O ILE A 107 -11.928 0.953 7.916 1.00 0.00 O ATOM 1713 CB ILE A 107 -10.360 -1.944 7.567 1.00 0.00 C ATOM 1714 CG1 ILE A 107 -10.357 -3.360 8.146 1.00 0.00 C ATOM 1715 CG2 ILE A 107 -9.499 -1.018 8.413 1.00 0.00 C ATOM 1716 CD1 ILE A 107 -9.109 -4.147 7.812 1.00 0.00 C ATOM 0 H ILE A 107 -12.102 -2.946 6.089 1.00 0.00 H new ATOM 0 HA ILE A 107 -12.274 -1.500 8.454 1.00 0.00 H new ATOM 0 HB ILE A 107 -9.939 -1.982 6.562 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.460 -3.301 9.229 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -11.227 -3.899 7.772 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -8.484 -1.413 8.467 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -9.479 -0.026 7.962 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -9.916 -0.951 9.418 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -9.176 -5.141 8.255 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.015 -4.238 6.730 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.236 -3.631 8.210 1.00 0.00 H new ATOM 1728 N ILE A 108 -11.525 0.319 5.794 1.00 0.00 N ATOM 1729 CA ILE A 108 -11.462 1.682 5.283 1.00 0.00 C ATOM 1730 C ILE A 108 -12.817 2.374 5.392 1.00 0.00 C ATOM 1731 O ILE A 108 -12.928 3.456 5.967 1.00 0.00 O ATOM 1732 CB ILE A 108 -11.000 1.712 3.815 1.00 0.00 C ATOM 1733 CG1 ILE A 108 -9.714 0.901 3.645 1.00 0.00 C ATOM 1734 CG2 ILE A 108 -10.791 3.147 3.354 1.00 0.00 C ATOM 1735 CD1 ILE A 108 -8.548 1.442 4.443 1.00 0.00 C ATOM 0 H ILE A 108 -11.378 -0.403 5.089 1.00 0.00 H new ATOM 0 HA ILE A 108 -10.734 2.215 5.895 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.776 1.261 3.197 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -9.902 -0.130 3.945 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.443 0.881 2.589 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.464 3.151 2.314 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.728 3.698 3.442 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -10.031 3.622 3.975 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.671 0.818 4.274 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.333 2.463 4.127 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.799 1.436 5.504 1.00 0.00 H new ATOM 1747 N ALA A 109 -13.845 1.740 4.838 1.00 0.00 N ATOM 1748 CA ALA A 109 -15.193 2.291 4.876 1.00 0.00 C ATOM 1749 C ALA A 109 -15.608 2.630 6.304 1.00 0.00 C ATOM 1750 O ALA A 109 -16.140 3.708 6.566 1.00 0.00 O ATOM 1751 CB ALA A 109 -16.181 1.314 4.256 1.00 0.00 C ATOM 0 H ALA A 109 -13.769 0.844 4.357 1.00 0.00 H new ATOM 0 HA ALA A 109 -15.198 3.213 4.295 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -17.184 1.739 4.291 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -15.903 1.125 3.219 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -16.164 0.377 4.813 1.00 0.00 H new ATOM 1757 N ALA A 110 -15.360 1.703 7.223 1.00 0.00 N ATOM 1758 CA ALA A 110 -15.706 1.905 8.625 1.00 0.00 C ATOM 1759 C ALA A 110 -14.837 2.987 9.255 1.00 0.00 C ATOM 1760 O ALA A 110 -15.341 4.008 9.721 1.00 0.00 O ATOM 1761 CB ALA A 110 -15.569 0.600 9.395 1.00 0.00 C ATOM 0 H ALA A 110 -14.921 0.805 7.022 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.743 2.236 8.674 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -15.830 0.765 10.440 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.238 -0.147 8.967 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -14.540 0.245 9.330 1.00 0.00 H new ATOM 1767 N GLU A 111 -13.527 2.756 9.266 1.00 0.00 N ATOM 1768 CA GLU A 111 -12.589 3.712 9.840 1.00 0.00 C ATOM 1769 C GLU A 111 -12.697 5.066 9.145 1.00 0.00 C ATOM 1770 O GLU A 111 -13.130 6.052 9.744 1.00 0.00 O ATOM 1771 CB GLU A 111 -11.157 3.183 9.732 1.00 0.00 C ATOM 1772 CG GLU A 111 -10.878 1.991 10.631 1.00 0.00 C ATOM 1773 CD GLU A 111 -9.419 1.889 11.029 1.00 0.00 C ATOM 1774 OE1 GLU A 111 -8.993 2.650 11.923 1.00 0.00 O ATOM 1775 OE2 GLU A 111 -8.703 1.048 10.447 1.00 0.00 O ATOM 0 H GLU A 111 -13.093 1.916 8.884 1.00 0.00 H new ATOM 0 HA GLU A 111 -12.842 3.843 10.892 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.960 2.901 8.698 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.463 3.985 9.981 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -11.491 2.067 11.529 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.176 1.076 10.118 1.00 0.00 H new ATOM 1782 N LEU A 112 -12.299 5.107 7.878 1.00 0.00 N ATOM 1783 CA LEU A 112 -12.350 6.340 7.100 1.00 0.00 C ATOM 1784 C LEU A 112 -13.711 7.015 7.237 1.00 0.00 C ATOM 1785 O LEU A 112 -14.706 6.367 7.563 1.00 0.00 O ATOM 1786 CB LEU A 112 -12.060 6.048 5.626 1.00 0.00 C ATOM 1787 CG LEU A 112 -11.438 7.193 4.826 1.00 0.00 C ATOM 1788 CD1 LEU A 112 -9.960 7.333 5.154 1.00 0.00 C ATOM 1789 CD2 LEU A 112 -11.636 6.969 3.334 1.00 0.00 C ATOM 0 H LEU A 112 -11.938 4.301 7.368 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.589 7.017 7.488 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -11.393 5.188 5.571 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -12.993 5.759 5.143 1.00 0.00 H new ATOM 0 HG LEU A 112 -11.940 8.120 5.104 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.535 8.153 4.575 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.841 7.540 6.218 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.443 6.406 4.905 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -11.187 7.793 2.780 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -11.161 6.033 3.040 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -12.702 6.920 3.112 1.00 0.00 H new ATOM 1801 N ASP A 113 -13.747 8.319 6.985 1.00 0.00 N ATOM 1802 CA ASP A 113 -14.987 9.081 7.077 1.00 0.00 C ATOM 1803 C ASP A 113 -15.210 9.911 5.817 1.00 0.00 C ATOM 1804 O ASP A 113 -14.272 10.256 5.098 1.00 0.00 O ATOM 1805 CB ASP A 113 -14.959 9.994 8.305 1.00 0.00 C ATOM 1806 CG ASP A 113 -15.210 9.237 9.594 1.00 0.00 C ATOM 1807 OD1 ASP A 113 -16.134 8.397 9.620 1.00 0.00 O ATOM 1808 OD2 ASP A 113 -14.481 9.484 10.578 1.00 0.00 O ATOM 0 H ASP A 113 -12.932 8.870 6.716 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.812 8.375 7.176 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.991 10.492 8.362 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.712 10.773 8.192 1.00 0.00 H new ATOM 1813 N PRO A 114 -16.481 10.237 5.540 1.00 0.00 N ATOM 1814 CA PRO A 114 -16.857 11.029 4.365 1.00 0.00 C ATOM 1815 C PRO A 114 -16.405 12.481 4.476 1.00 0.00 C ATOM 1816 O PRO A 114 -16.671 13.292 3.590 1.00 0.00 O ATOM 1817 CB PRO A 114 -18.386 10.944 4.354 1.00 0.00 C ATOM 1818 CG PRO A 114 -18.761 10.689 5.773 1.00 0.00 C ATOM 1819 CD PRO A 114 -17.649 9.859 6.353 1.00 0.00 C ATOM 0 HA PRO A 114 -16.389 10.655 3.454 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -18.831 11.869 3.987 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -18.733 10.142 3.702 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -18.876 11.625 6.320 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -19.714 10.164 5.836 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -17.492 10.079 7.409 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -17.862 8.793 6.278 1.00 0.00 H new ATOM 1827 N GLU A 115 -15.721 12.801 5.570 1.00 0.00 N ATOM 1828 CA GLU A 115 -15.233 14.157 5.795 1.00 0.00 C ATOM 1829 C GLU A 115 -13.731 14.244 5.542 1.00 0.00 C ATOM 1830 O GLU A 115 -13.249 15.188 4.916 1.00 0.00 O ATOM 1831 CB GLU A 115 -15.547 14.605 7.225 1.00 0.00 C ATOM 1832 CG GLU A 115 -14.815 13.804 8.288 1.00 0.00 C ATOM 1833 CD GLU A 115 -15.045 14.343 9.686 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -16.216 14.396 10.116 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -14.054 14.713 10.351 1.00 0.00 O ATOM 0 H GLU A 115 -15.492 12.141 6.313 1.00 0.00 H new ATOM 0 HA GLU A 115 -15.741 14.819 5.094 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.287 15.658 7.332 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.621 14.523 7.395 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -15.143 12.765 8.245 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -13.747 13.811 8.071 1.00 0.00 H new ATOM 1842 N PHE A 116 -12.996 13.252 6.033 1.00 0.00 N ATOM 1843 CA PHE A 116 -11.548 13.216 5.862 1.00 0.00 C ATOM 1844 C PHE A 116 -11.179 13.026 4.394 1.00 0.00 C ATOM 1845 O PHE A 116 -10.333 13.741 3.858 1.00 0.00 O ATOM 1846 CB PHE A 116 -10.942 12.090 6.702 1.00 0.00 C ATOM 1847 CG PHE A 116 -9.440 12.098 6.721 1.00 0.00 C ATOM 1848 CD1 PHE A 116 -8.748 13.041 7.464 1.00 0.00 C ATOM 1849 CD2 PHE A 116 -8.720 11.163 5.995 1.00 0.00 C ATOM 1850 CE1 PHE A 116 -7.366 13.051 7.484 1.00 0.00 C ATOM 1851 CE2 PHE A 116 -7.338 11.168 6.011 1.00 0.00 C ATOM 1852 CZ PHE A 116 -6.660 12.114 6.756 1.00 0.00 C ATOM 0 H PHE A 116 -13.379 12.462 6.553 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.143 14.170 6.200 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -11.311 12.171 7.724 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -11.287 11.132 6.314 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -9.295 13.777 8.034 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.245 10.422 5.410 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -6.839 13.791 8.068 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -6.788 10.433 5.442 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.580 12.120 6.769 1.00 0.00 H new ATOM 1862 N ASN A 117 -11.819 12.056 3.750 1.00 0.00 N ATOM 1863 CA ASN A 117 -11.558 11.770 2.343 1.00 0.00 C ATOM 1864 C ASN A 117 -11.536 13.055 1.522 1.00 0.00 C ATOM 1865 O ASN A 117 -10.647 13.263 0.697 1.00 0.00 O ATOM 1866 CB ASN A 117 -12.618 10.815 1.790 1.00 0.00 C ATOM 1867 CG ASN A 117 -12.317 10.378 0.369 1.00 0.00 C ATOM 1868 OD1 ASN A 117 -11.288 9.757 0.104 1.00 0.00 O ATOM 1869 ND2 ASN A 117 -13.216 10.702 -0.552 1.00 0.00 N ATOM 0 H ASN A 117 -12.522 11.454 4.179 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.579 11.297 2.269 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -12.682 9.936 2.432 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -13.593 11.302 1.819 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -13.068 10.435 -1.525 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -14.055 11.218 -0.287 1.00 0.00 H new ATOM 1876 N LYS A 118 -12.522 13.916 1.754 1.00 0.00 N ATOM 1877 CA LYS A 118 -12.617 15.182 1.038 1.00 0.00 C ATOM 1878 C LYS A 118 -11.342 16.002 1.211 1.00 0.00 C ATOM 1879 O LYS A 118 -10.975 16.790 0.338 1.00 0.00 O ATOM 1880 CB LYS A 118 -13.822 15.984 1.535 1.00 0.00 C ATOM 1881 CG LYS A 118 -15.143 15.249 1.388 1.00 0.00 C ATOM 1882 CD LYS A 118 -16.217 15.848 2.281 1.00 0.00 C ATOM 1883 CE LYS A 118 -16.800 17.117 1.677 1.00 0.00 C ATOM 1884 NZ LYS A 118 -15.800 18.219 1.629 1.00 0.00 N ATOM 0 H LYS A 118 -13.267 13.759 2.433 1.00 0.00 H new ATOM 0 HA LYS A 118 -12.746 14.962 -0.022 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -13.672 16.238 2.584 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -13.875 16.923 0.985 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.469 15.289 0.349 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -15.005 14.197 1.639 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -17.012 15.119 2.435 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -15.795 16.071 3.261 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -17.158 16.908 0.669 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -17.663 17.435 2.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -16.274 19.126 1.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -15.070 18.057 2.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -15.356 18.245 0.689 1.00 0.00 H new ATOM 1898 N LEU A 119 -10.669 15.810 2.340 1.00 0.00 N ATOM 1899 CA LEU A 119 -9.434 16.531 2.627 1.00 0.00 C ATOM 1900 C LEU A 119 -8.248 15.881 1.921 1.00 0.00 C ATOM 1901 O LEU A 119 -7.273 16.551 1.579 1.00 0.00 O ATOM 1902 CB LEU A 119 -9.183 16.572 4.135 1.00 0.00 C ATOM 1903 CG LEU A 119 -10.221 17.325 4.968 1.00 0.00 C ATOM 1904 CD1 LEU A 119 -10.137 16.910 6.429 1.00 0.00 C ATOM 1905 CD2 LEU A 119 -10.029 18.828 4.827 1.00 0.00 C ATOM 0 H LEU A 119 -10.958 15.161 3.072 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.542 17.550 2.255 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.126 15.547 4.502 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.208 17.027 4.309 1.00 0.00 H new ATOM 0 HG LEU A 119 -11.213 17.069 4.596 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.883 17.456 7.006 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -10.325 15.840 6.515 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -9.143 17.136 6.815 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -10.776 19.348 5.426 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -9.032 19.101 5.173 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -10.141 19.113 3.781 1.00 0.00 H new ATOM 1917 N CYS A 120 -8.340 14.574 1.703 1.00 0.00 N ATOM 1918 CA CYS A 120 -7.275 13.833 1.035 1.00 0.00 C ATOM 1919 C CYS A 120 -7.254 14.140 -0.459 1.00 0.00 C ATOM 1920 O CYS A 120 -6.255 14.625 -0.988 1.00 0.00 O ATOM 1921 CB CYS A 120 -7.454 12.331 1.258 1.00 0.00 C ATOM 1922 SG CYS A 120 -6.687 11.713 2.774 1.00 0.00 S ATOM 0 H CYS A 120 -9.141 14.005 1.979 1.00 0.00 H new ATOM 0 HA CYS A 120 -6.323 14.145 1.464 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -8.520 12.103 1.284 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -7.034 11.796 0.407 1.00 0.00 H new ATOM 0 HG CYS A 120 -7.522 11.834 3.763 1.00 0.00 H new ATOM 1928 N GLU A 121 -8.363 13.851 -1.132 1.00 0.00 N ATOM 1929 CA GLU A 121 -8.470 14.094 -2.566 1.00 0.00 C ATOM 1930 C GLU A 121 -8.125 15.542 -2.900 1.00 0.00 C ATOM 1931 O GLU A 121 -7.677 15.845 -4.005 1.00 0.00 O ATOM 1932 CB GLU A 121 -9.882 13.768 -3.057 1.00 0.00 C ATOM 1933 CG GLU A 121 -10.968 14.577 -2.368 1.00 0.00 C ATOM 1934 CD GLU A 121 -12.281 14.557 -3.126 1.00 0.00 C ATOM 1935 OE1 GLU A 121 -12.249 14.409 -4.366 1.00 0.00 O ATOM 1936 OE2 GLU A 121 -13.341 14.688 -2.479 1.00 0.00 O ATOM 0 H GLU A 121 -9.199 13.449 -0.708 1.00 0.00 H new ATOM 0 HA GLU A 121 -7.758 13.443 -3.073 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -9.934 13.946 -4.131 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -10.076 12.707 -2.900 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.127 14.184 -1.364 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -10.633 15.608 -2.257 1.00 0.00 H new ATOM 1943 N GLU A 122 -8.338 16.433 -1.936 1.00 0.00 N ATOM 1944 CA GLU A 122 -8.052 17.849 -2.128 1.00 0.00 C ATOM 1945 C GLU A 122 -6.609 18.056 -2.581 1.00 0.00 C ATOM 1946 O GLU A 122 -6.356 18.616 -3.648 1.00 0.00 O ATOM 1947 CB GLU A 122 -8.308 18.625 -0.834 1.00 0.00 C ATOM 1948 CG GLU A 122 -8.740 20.063 -1.062 1.00 0.00 C ATOM 1949 CD GLU A 122 -9.875 20.180 -2.060 1.00 0.00 C ATOM 1950 OE1 GLU A 122 -10.682 19.231 -2.154 1.00 0.00 O ATOM 1951 OE2 GLU A 122 -9.957 21.219 -2.748 1.00 0.00 O ATOM 0 H GLU A 122 -8.708 16.198 -1.015 1.00 0.00 H new ATOM 0 HA GLU A 122 -8.717 18.225 -2.906 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -9.077 18.111 -0.258 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -7.400 18.619 -0.231 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -9.049 20.500 -0.113 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -7.888 20.642 -1.417 1.00 0.00 H new ATOM 1958 N ILE A 123 -5.667 17.600 -1.762 1.00 0.00 N ATOM 1959 CA ILE A 123 -4.251 17.734 -2.078 1.00 0.00 C ATOM 1960 C ILE A 123 -3.921 17.079 -3.415 1.00 0.00 C ATOM 1961 O ILE A 123 -2.994 17.494 -4.111 1.00 0.00 O ATOM 1962 CB ILE A 123 -3.368 17.108 -0.982 1.00 0.00 C ATOM 1963 CG1 ILE A 123 -3.652 17.767 0.370 1.00 0.00 C ATOM 1964 CG2 ILE A 123 -1.897 17.245 -1.344 1.00 0.00 C ATOM 1965 CD1 ILE A 123 -3.391 16.859 1.551 1.00 0.00 C ATOM 0 H ILE A 123 -5.859 17.135 -0.875 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.041 18.802 -2.137 1.00 0.00 H new ATOM 0 HB ILE A 123 -3.606 16.047 -0.906 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.036 18.661 0.466 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.692 18.093 0.395 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -1.286 16.798 -0.560 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -1.706 16.735 -2.288 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -1.644 18.300 -1.444 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.613 17.392 2.476 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.027 15.976 1.479 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.345 16.554 1.551 1.00 0.00 H new ATOM 1977 N LYS A 124 -4.688 16.054 -3.770 1.00 0.00 N ATOM 1978 CA LYS A 124 -4.481 15.342 -5.026 1.00 0.00 C ATOM 1979 C LYS A 124 -4.667 16.276 -6.218 1.00 0.00 C ATOM 1980 O LYS A 124 -3.838 16.309 -7.126 1.00 0.00 O ATOM 1981 CB LYS A 124 -5.450 14.162 -5.133 1.00 0.00 C ATOM 1982 CG LYS A 124 -5.066 13.155 -6.203 1.00 0.00 C ATOM 1983 CD LYS A 124 -6.288 12.455 -6.774 1.00 0.00 C ATOM 1984 CE LYS A 124 -6.837 11.416 -5.807 1.00 0.00 C ATOM 1985 NZ LYS A 124 -7.768 10.469 -6.481 1.00 0.00 N ATOM 0 H LYS A 124 -5.459 15.697 -3.206 1.00 0.00 H new ATOM 0 HA LYS A 124 -3.458 14.966 -5.037 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -5.499 13.655 -4.169 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -6.450 14.542 -5.345 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.528 13.662 -7.004 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.386 12.415 -5.781 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -7.060 13.192 -6.996 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -6.026 11.974 -7.717 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.011 10.860 -5.364 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -7.357 11.918 -4.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.120 9.777 -5.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -8.570 10.997 -6.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -7.265 9.971 -7.243 1.00 0.00 H new