USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 759 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 66 ASN : amide:sc= 0.596 K(o=0.87,f=-1.9) USER MOD Set 1.2: A 78 LYS NZ :NH3+ -165:sc= 0.277 (180deg=0) USER MOD Set 2.1: A 73 SER OG : rot -130:sc= 0.598 USER MOD Set 2.2: A 75 GLN : amide:sc= 0.64 X(o=1.2,f=1) USER MOD Set 3.1: A 53 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 107 HIS : no HD1:sc= -0.254 X(o=-0.25,f=-0.21) USER MOD Set 4.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc=-0.00903 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.0364 X(o=-0.036,f=-0.014) USER MOD Single : A 55 SER OG : rot -57:sc= 1.27 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 174:sc=-0.000506 (180deg=-0.0427) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -0.0494 K(o=-0.049,f=-3.4!) USER MOD Single : A 102 ASN : amide:sc= 1.05 K(o=1.1,f=-0.41) USER MOD Single : A 108 MET CE :methyl -148:sc= -1.51 (180deg=-6.11!) USER MOD Single : A 116 ASN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Single : A 118 SER OG : rot 180:sc= 0.829 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -2:sc= 1.12 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 8:sc= 0.0688 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.663 -6.795 8.995 1.00 0.00 N ATOM 49 CA THR A 36 -0.726 -6.615 8.544 1.00 0.00 C ATOM 50 C THR A 36 -0.928 -5.248 7.887 1.00 0.00 C ATOM 51 O THR A 36 -0.048 -4.385 7.953 1.00 0.00 O ATOM 52 CB THR A 36 -1.702 -6.865 9.711 1.00 0.00 C ATOM 53 OG1 THR A 36 -3.003 -7.048 9.194 1.00 0.00 O ATOM 54 CG2 THR A 36 -1.734 -5.728 10.736 1.00 0.00 C ATOM 0 HA THR A 36 -0.943 -7.355 7.774 1.00 0.00 H new ATOM 0 HB THR A 36 -1.347 -7.754 10.232 1.00 0.00 H new ATOM 0 HG1 THR A 36 -3.628 -7.209 9.931 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.442 -5.972 11.528 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.741 -5.597 11.165 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.042 -4.805 10.246 1.00 0.00 H new ATOM 62 N PHE A 37 -2.097 -5.046 7.278 1.00 0.00 N ATOM 63 CA PHE A 37 -2.533 -3.798 6.645 1.00 0.00 C ATOM 64 C PHE A 37 -4.050 -3.711 6.463 1.00 0.00 C ATOM 65 O PHE A 37 -4.757 -4.719 6.404 1.00 0.00 O ATOM 66 CB PHE A 37 -1.826 -3.538 5.296 1.00 0.00 C ATOM 67 CG PHE A 37 -1.407 -4.763 4.530 1.00 0.00 C ATOM 68 CD1 PHE A 37 -2.344 -5.480 3.770 1.00 0.00 C ATOM 69 CD2 PHE A 37 -0.073 -5.194 4.612 1.00 0.00 C ATOM 70 CE1 PHE A 37 -1.941 -6.628 3.070 1.00 0.00 C ATOM 71 CE2 PHE A 37 0.321 -6.365 3.938 1.00 0.00 C ATOM 72 CZ PHE A 37 -0.607 -7.065 3.147 1.00 0.00 C ATOM 0 H PHE A 37 -2.800 -5.782 7.209 1.00 0.00 H new ATOM 0 HA PHE A 37 -2.238 -3.016 7.345 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.492 -2.949 4.666 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -0.942 -2.929 5.482 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -3.371 -5.150 3.724 1.00 0.00 H new ATOM 0 HD2 PHE A 37 0.646 -4.631 5.188 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.655 -7.175 2.473 1.00 0.00 H new ATOM 0 HE2 PHE A 37 1.335 -6.726 4.028 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.294 -7.940 2.597 1.00 0.00 H new ATOM 82 N SER A 38 -4.544 -2.480 6.336 1.00 0.00 N ATOM 83 CA SER A 38 -5.945 -2.158 6.048 1.00 0.00 C ATOM 84 C SER A 38 -6.092 -0.967 5.069 1.00 0.00 C ATOM 85 O SER A 38 -5.161 -0.157 4.932 1.00 0.00 O ATOM 86 CB SER A 38 -6.698 -1.900 7.369 1.00 0.00 C ATOM 87 OG SER A 38 -6.192 -0.767 8.066 1.00 0.00 O ATOM 0 H SER A 38 -3.961 -1.649 6.434 1.00 0.00 H new ATOM 0 HA SER A 38 -6.391 -3.016 5.544 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.757 -1.751 7.158 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.621 -2.781 8.007 1.00 0.00 H new ATOM 0 HG SER A 38 -6.699 -0.640 8.895 1.00 0.00 H new ATOM 93 N PRO A 39 -7.249 -0.835 4.384 1.00 0.00 N ATOM 94 CA PRO A 39 -8.340 -1.810 4.314 1.00 0.00 C ATOM 95 C PRO A 39 -7.962 -3.008 3.431 1.00 0.00 C ATOM 96 O PRO A 39 -7.065 -2.921 2.592 1.00 0.00 O ATOM 97 CB PRO A 39 -9.524 -1.044 3.723 1.00 0.00 C ATOM 98 CG PRO A 39 -8.841 -0.060 2.781 1.00 0.00 C ATOM 99 CD PRO A 39 -7.556 0.305 3.527 1.00 0.00 C ATOM 0 HA PRO A 39 -8.572 -2.225 5.295 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.211 -1.704 3.193 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -10.103 -0.534 4.493 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.629 -0.511 1.812 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.462 0.817 2.596 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.742 0.498 2.829 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.692 1.211 4.117 1.00 0.00 H new ATOM 107 N ALA A 40 -8.680 -4.124 3.594 1.00 0.00 N ATOM 108 CA ALA A 40 -8.558 -5.284 2.703 1.00 0.00 C ATOM 109 C ALA A 40 -9.013 -4.971 1.262 1.00 0.00 C ATOM 110 O ALA A 40 -8.458 -5.521 0.309 1.00 0.00 O ATOM 111 CB ALA A 40 -9.360 -6.444 3.308 1.00 0.00 C ATOM 0 H ALA A 40 -9.360 -4.249 4.344 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.507 -5.561 2.624 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.282 -7.317 2.660 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.962 -6.687 4.293 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.406 -6.153 3.401 1.00 0.00 H new ATOM 117 N LEU A 41 -9.976 -4.052 1.103 1.00 0.00 N ATOM 118 CA LEU A 41 -10.429 -3.493 -0.173 1.00 0.00 C ATOM 119 C LEU A 41 -10.608 -1.976 -0.020 1.00 0.00 C ATOM 120 O LEU A 41 -11.447 -1.519 0.759 1.00 0.00 O ATOM 121 CB LEU A 41 -11.735 -4.194 -0.603 1.00 0.00 C ATOM 122 CG LEU A 41 -12.444 -3.571 -1.829 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.580 -3.572 -3.099 1.00 0.00 C ATOM 124 CD2 LEU A 41 -13.749 -4.332 -2.105 1.00 0.00 C ATOM 0 H LEU A 41 -10.482 -3.662 1.898 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.690 -3.665 -0.956 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.513 -5.238 -0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.427 -4.187 0.239 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.642 -2.528 -1.581 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.138 -3.121 -3.919 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.670 -2.998 -2.921 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.317 -4.597 -3.359 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.250 -3.894 -2.969 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.524 -5.379 -2.308 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.401 -4.264 -1.234 1.00 0.00 H new ATOM 136 N LEU A 42 -9.834 -1.200 -0.780 1.00 0.00 N ATOM 137 CA LEU A 42 -9.930 0.255 -0.879 1.00 0.00 C ATOM 138 C LEU A 42 -10.681 0.631 -2.163 1.00 0.00 C ATOM 139 O LEU A 42 -10.287 0.201 -3.246 1.00 0.00 O ATOM 140 CB LEU A 42 -8.498 0.827 -0.881 1.00 0.00 C ATOM 141 CG LEU A 42 -8.397 2.360 -0.960 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.128 3.077 0.185 1.00 0.00 C ATOM 143 CD2 LEU A 42 -6.917 2.757 -0.928 1.00 0.00 C ATOM 0 H LEU A 42 -9.094 -1.585 -1.367 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.482 0.670 -0.036 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.991 0.493 0.024 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -7.956 0.401 -1.725 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.879 2.667 -1.888 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.017 4.155 0.069 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.186 2.816 0.161 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.700 2.769 1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.830 3.842 -0.983 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.465 2.404 -0.001 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.401 2.308 -1.777 1.00 0.00 H new ATOM 155 N VAL A 43 -11.724 1.456 -2.055 1.00 0.00 N ATOM 156 CA VAL A 43 -12.445 2.028 -3.207 1.00 0.00 C ATOM 157 C VAL A 43 -12.145 3.528 -3.282 1.00 0.00 C ATOM 158 O VAL A 43 -12.374 4.252 -2.313 1.00 0.00 O ATOM 159 CB VAL A 43 -13.972 1.778 -3.141 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.651 2.226 -4.448 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.300 0.292 -2.903 1.00 0.00 C ATOM 0 H VAL A 43 -12.101 1.753 -1.155 1.00 0.00 H new ATOM 0 HA VAL A 43 -12.094 1.527 -4.109 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.350 2.361 -2.302 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.723 2.042 -4.382 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.474 3.290 -4.604 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.237 1.663 -5.285 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.381 0.160 -2.863 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.891 -0.306 -3.718 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.860 -0.031 -1.960 1.00 0.00 H new ATOM 171 N VAL A 44 -11.641 3.983 -4.431 1.00 0.00 N ATOM 172 CA VAL A 44 -11.423 5.411 -4.754 1.00 0.00 C ATOM 173 C VAL A 44 -12.065 5.791 -6.094 1.00 0.00 C ATOM 174 O VAL A 44 -12.432 4.913 -6.873 1.00 0.00 O ATOM 175 CB VAL A 44 -9.924 5.795 -4.773 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.273 5.590 -3.398 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.130 5.040 -5.852 1.00 0.00 C ATOM 0 H VAL A 44 -11.363 3.359 -5.188 1.00 0.00 H new ATOM 0 HA VAL A 44 -11.905 5.973 -3.954 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.890 6.855 -5.024 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.221 5.870 -3.448 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.779 6.212 -2.660 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.357 4.543 -3.108 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.085 5.350 -5.818 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.197 3.968 -5.669 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.544 5.267 -6.834 1.00 0.00 H new ATOM 187 N THR A 45 -12.171 7.096 -6.373 1.00 0.00 N ATOM 188 CA THR A 45 -12.655 7.639 -7.656 1.00 0.00 C ATOM 189 C THR A 45 -11.475 7.913 -8.591 1.00 0.00 C ATOM 190 O THR A 45 -10.385 8.262 -8.139 1.00 0.00 O ATOM 191 CB THR A 45 -13.475 8.916 -7.419 1.00 0.00 C ATOM 192 OG1 THR A 45 -14.538 8.626 -6.533 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.112 9.455 -8.700 1.00 0.00 C ATOM 0 H THR A 45 -11.919 7.822 -5.702 1.00 0.00 H new ATOM 0 HA THR A 45 -13.304 6.902 -8.130 1.00 0.00 H new ATOM 0 HB THR A 45 -12.785 9.660 -7.021 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.064 9.438 -6.376 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.679 10.358 -8.472 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.331 9.690 -9.424 1.00 0.00 H new ATOM 0 HG23 THR A 45 -14.780 8.703 -9.118 1.00 0.00 H new ATOM 201 N GLU A 46 -11.694 7.776 -9.897 1.00 0.00 N ATOM 202 CA GLU A 46 -10.708 8.047 -10.944 1.00 0.00 C ATOM 203 C GLU A 46 -10.119 9.466 -10.819 1.00 0.00 C ATOM 204 O GLU A 46 -10.840 10.465 -10.894 1.00 0.00 O ATOM 205 CB GLU A 46 -11.353 7.828 -12.325 1.00 0.00 C ATOM 206 CG GLU A 46 -10.323 7.583 -13.431 1.00 0.00 C ATOM 207 CD GLU A 46 -10.835 8.111 -14.776 1.00 0.00 C ATOM 208 OE1 GLU A 46 -11.596 7.386 -15.457 1.00 0.00 O ATOM 209 OE2 GLU A 46 -10.489 9.261 -15.138 1.00 0.00 O1- ATOM 0 H GLU A 46 -12.591 7.463 -10.269 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.876 7.353 -10.827 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -12.032 6.977 -12.273 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.954 8.700 -12.582 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.384 8.074 -13.176 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.113 6.516 -13.510 1.00 0.00 H new ATOM 216 N GLY A 47 -8.798 9.544 -10.636 1.00 0.00 N ATOM 217 CA GLY A 47 -8.023 10.775 -10.443 1.00 0.00 C ATOM 218 C GLY A 47 -7.773 11.157 -8.980 1.00 0.00 C ATOM 219 O GLY A 47 -7.059 12.128 -8.734 1.00 0.00 O ATOM 0 H GLY A 47 -8.210 8.710 -10.617 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.061 10.664 -10.944 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.545 11.596 -10.934 1.00 0.00 H new ATOM 223 N ASP A 48 -8.313 10.413 -8.008 1.00 0.00 N ATOM 224 CA ASP A 48 -8.051 10.611 -6.574 1.00 0.00 C ATOM 225 C ASP A 48 -6.824 9.804 -6.105 1.00 0.00 C ATOM 226 O ASP A 48 -6.472 8.784 -6.700 1.00 0.00 O ATOM 227 CB ASP A 48 -9.312 10.239 -5.771 1.00 0.00 C ATOM 228 CG ASP A 48 -9.263 10.658 -4.291 1.00 0.00 C ATOM 229 OD1 ASP A 48 -8.594 11.666 -3.960 1.00 0.00 O1- ATOM 230 OD2 ASP A 48 -9.935 9.991 -3.469 1.00 0.00 O ATOM 0 H ASP A 48 -8.955 9.643 -8.197 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.817 11.661 -6.400 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.179 10.705 -6.240 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.460 9.161 -5.827 1.00 0.00 H new ATOM 235 N ASN A 49 -6.167 10.240 -5.028 1.00 0.00 N ATOM 236 CA ASN A 49 -5.081 9.491 -4.398 1.00 0.00 C ATOM 237 C ASN A 49 -5.623 8.382 -3.475 1.00 0.00 C ATOM 238 O ASN A 49 -6.548 8.590 -2.686 1.00 0.00 O ATOM 239 CB ASN A 49 -4.087 10.431 -3.691 1.00 0.00 C ATOM 240 CG ASN A 49 -4.692 11.231 -2.540 1.00 0.00 C ATOM 241 OD1 ASN A 49 -4.712 10.797 -1.395 1.00 0.00 O ATOM 242 ND2 ASN A 49 -5.184 12.429 -2.808 1.00 0.00 N ATOM 0 H ASN A 49 -6.375 11.126 -4.568 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.519 8.986 -5.183 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -3.254 9.840 -3.310 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -3.676 11.125 -4.424 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -5.582 12.996 -2.059 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -5.165 12.786 -3.763 1.00 0.00 H new ATOM 249 N ALA A 50 -5.034 7.193 -3.593 1.00 0.00 N ATOM 250 CA ALA A 50 -5.343 5.995 -2.810 1.00 0.00 C ATOM 251 C ALA A 50 -4.223 5.707 -1.798 1.00 0.00 C ATOM 252 O ALA A 50 -3.051 5.690 -2.191 1.00 0.00 O ATOM 253 CB ALA A 50 -5.504 4.829 -3.794 1.00 0.00 C ATOM 0 H ALA A 50 -4.290 7.030 -4.272 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.262 6.137 -2.241 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.736 3.917 -3.243 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.314 5.049 -4.489 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.577 4.691 -4.350 1.00 0.00 H new ATOM 259 N THR A 51 -4.570 5.454 -0.527 1.00 0.00 N ATOM 260 CA THR A 51 -3.601 5.182 0.550 1.00 0.00 C ATOM 261 C THR A 51 -4.009 3.960 1.367 1.00 0.00 C ATOM 262 O THR A 51 -5.109 3.923 1.918 1.00 0.00 O ATOM 263 CB THR A 51 -3.419 6.407 1.457 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.116 7.526 0.651 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.265 6.219 2.448 1.00 0.00 C ATOM 0 H THR A 51 -5.540 5.432 -0.213 1.00 0.00 H new ATOM 0 HA THR A 51 -2.642 4.966 0.079 1.00 0.00 H new ATOM 0 HB THR A 51 -4.343 6.547 2.018 1.00 0.00 H new ATOM 0 HG1 THR A 51 -2.999 8.316 1.219 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.171 7.109 3.070 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.465 5.354 3.080 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.337 6.060 1.899 1.00 0.00 H new ATOM 273 N PHE A 52 -3.099 2.990 1.474 1.00 0.00 N ATOM 274 CA PHE A 52 -3.195 1.833 2.374 1.00 0.00 C ATOM 275 C PHE A 52 -2.315 2.048 3.618 1.00 0.00 C ATOM 276 O PHE A 52 -1.308 2.756 3.543 1.00 0.00 O ATOM 277 CB PHE A 52 -2.761 0.562 1.627 1.00 0.00 C ATOM 278 CG PHE A 52 -3.681 0.149 0.493 1.00 0.00 C ATOM 279 CD1 PHE A 52 -3.456 0.627 -0.814 1.00 0.00 C ATOM 280 CD2 PHE A 52 -4.753 -0.730 0.740 1.00 0.00 C ATOM 281 CE1 PHE A 52 -4.286 0.212 -1.869 1.00 0.00 C ATOM 282 CE2 PHE A 52 -5.587 -1.139 -0.315 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.348 -0.675 -1.619 1.00 0.00 C ATOM 0 H PHE A 52 -2.244 2.986 0.918 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.229 1.720 2.700 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.759 0.716 1.226 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.696 -0.259 2.341 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -2.644 1.313 -1.005 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -4.935 -1.091 1.742 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.108 0.574 -2.871 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -6.411 -1.810 -0.123 1.00 0.00 H new ATOM 0 HZ PHE A 52 -5.981 -1.000 -2.431 1.00 0.00 H new ATOM 293 N THR A 53 -2.669 1.420 4.748 1.00 0.00 N ATOM 294 CA THR A 53 -1.916 1.503 6.014 1.00 0.00 C ATOM 295 C THR A 53 -1.389 0.127 6.403 1.00 0.00 C ATOM 296 O THR A 53 -2.202 -0.753 6.670 1.00 0.00 O ATOM 297 CB THR A 53 -2.808 2.044 7.142 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.333 3.300 6.769 1.00 0.00 O ATOM 299 CG2 THR A 53 -2.031 2.239 8.448 1.00 0.00 C ATOM 0 H THR A 53 -3.499 0.830 4.812 1.00 0.00 H new ATOM 0 HA THR A 53 -1.079 2.185 5.866 1.00 0.00 H new ATOM 0 HB THR A 53 -3.598 1.310 7.303 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.903 3.643 7.489 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.702 2.623 9.217 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.617 1.284 8.771 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.220 2.949 8.286 1.00 0.00 H new ATOM 307 N CYS A 54 -0.066 -0.058 6.483 1.00 0.00 N ATOM 308 CA CYS A 54 0.581 -1.254 7.051 1.00 0.00 C ATOM 309 C CYS A 54 1.096 -1.040 8.481 1.00 0.00 C ATOM 310 O CYS A 54 1.533 0.054 8.847 1.00 0.00 O ATOM 311 CB CYS A 54 1.757 -1.736 6.183 1.00 0.00 C ATOM 312 SG CYS A 54 1.513 -1.911 4.397 1.00 0.00 S ATOM 0 H CYS A 54 0.603 0.635 6.147 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.203 -2.011 7.072 1.00 0.00 H new ATOM 0 HB2 CYS A 54 2.585 -1.044 6.336 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.076 -2.704 6.568 1.00 0.00 H new ATOM 317 N SER A 55 1.135 -2.119 9.261 1.00 0.00 N ATOM 318 CA SER A 55 1.695 -2.158 10.616 1.00 0.00 C ATOM 319 C SER A 55 2.721 -3.297 10.706 1.00 0.00 C ATOM 320 O SER A 55 2.369 -4.468 10.551 1.00 0.00 O ATOM 321 CB SER A 55 0.577 -2.376 11.651 1.00 0.00 C ATOM 322 OG SER A 55 -0.366 -1.314 11.653 1.00 0.00 O ATOM 0 H SER A 55 0.766 -3.021 8.960 1.00 0.00 H new ATOM 0 HA SER A 55 2.183 -1.207 10.830 1.00 0.00 H new ATOM 0 HB2 SER A 55 0.065 -3.314 11.438 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.017 -2.471 12.644 1.00 0.00 H new ATOM 0 HG SER A 55 0.097 -0.466 11.817 1.00 0.00 H new ATOM 328 N PHE A 56 3.993 -2.952 10.929 1.00 0.00 N ATOM 329 CA PHE A 56 5.139 -3.866 11.016 1.00 0.00 C ATOM 330 C PHE A 56 6.136 -3.363 12.071 1.00 0.00 C ATOM 331 O PHE A 56 6.270 -2.159 12.287 1.00 0.00 O ATOM 332 CB PHE A 56 5.869 -3.935 9.657 1.00 0.00 C ATOM 333 CG PHE A 56 5.241 -4.799 8.575 1.00 0.00 C ATOM 334 CD1 PHE A 56 4.074 -4.383 7.911 1.00 0.00 C ATOM 335 CD2 PHE A 56 5.868 -5.998 8.179 1.00 0.00 C ATOM 336 CE1 PHE A 56 3.511 -5.178 6.898 1.00 0.00 C ATOM 337 CE2 PHE A 56 5.338 -6.763 7.123 1.00 0.00 C ATOM 338 CZ PHE A 56 4.148 -6.363 6.493 1.00 0.00 C ATOM 0 H PHE A 56 4.266 -1.978 11.061 1.00 0.00 H new ATOM 0 HA PHE A 56 4.767 -4.853 11.291 1.00 0.00 H new ATOM 0 HB2 PHE A 56 5.959 -2.920 9.270 1.00 0.00 H new ATOM 0 HB3 PHE A 56 6.881 -4.299 9.835 1.00 0.00 H new ATOM 0 HD1 PHE A 56 3.607 -3.447 8.181 1.00 0.00 H new ATOM 0 HD2 PHE A 56 6.760 -6.331 8.689 1.00 0.00 H new ATOM 0 HE1 PHE A 56 2.586 -4.877 6.429 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.847 -7.658 6.797 1.00 0.00 H new ATOM 0 HZ PHE A 56 3.725 -6.963 5.701 1.00 0.00 H new ATOM 424 N PHE A 63 14.945 -1.745 9.965 1.00 0.00 N ATOM 425 CA PHE A 63 14.263 -2.354 8.819 1.00 0.00 C ATOM 426 C PHE A 63 13.711 -1.338 7.805 1.00 0.00 C ATOM 427 O PHE A 63 13.478 -0.171 8.120 1.00 0.00 O ATOM 428 CB PHE A 63 13.163 -3.316 9.317 1.00 0.00 C ATOM 429 CG PHE A 63 11.908 -2.660 9.872 1.00 0.00 C ATOM 430 CD1 PHE A 63 11.891 -2.149 11.184 1.00 0.00 C ATOM 431 CD2 PHE A 63 10.737 -2.602 9.089 1.00 0.00 C ATOM 432 CE1 PHE A 63 10.714 -1.586 11.709 1.00 0.00 C ATOM 433 CE2 PHE A 63 9.559 -2.046 9.618 1.00 0.00 C ATOM 434 CZ PHE A 63 9.548 -1.535 10.927 1.00 0.00 C ATOM 0 HA PHE A 63 15.016 -2.916 8.267 1.00 0.00 H new ATOM 0 HB2 PHE A 63 12.875 -3.966 8.491 1.00 0.00 H new ATOM 0 HB3 PHE A 63 13.589 -3.954 10.091 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.785 -2.190 11.789 1.00 0.00 H new ATOM 0 HD2 PHE A 63 10.745 -2.986 8.080 1.00 0.00 H new ATOM 0 HE1 PHE A 63 10.707 -1.192 12.715 1.00 0.00 H new ATOM 0 HE2 PHE A 63 8.662 -2.012 9.018 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.644 -1.104 11.331 1.00 0.00 H new ATOM 444 N VAL A 64 13.484 -1.828 6.585 1.00 0.00 N ATOM 445 CA VAL A 64 12.812 -1.150 5.470 1.00 0.00 C ATOM 446 C VAL A 64 11.469 -1.847 5.238 1.00 0.00 C ATOM 447 O VAL A 64 11.426 -3.079 5.187 1.00 0.00 O ATOM 448 CB VAL A 64 13.662 -1.225 4.173 1.00 0.00 C ATOM 449 CG1 VAL A 64 13.001 -0.440 3.030 1.00 0.00 C ATOM 450 CG2 VAL A 64 15.091 -0.690 4.387 1.00 0.00 C ATOM 0 H VAL A 64 13.783 -2.769 6.331 1.00 0.00 H new ATOM 0 HA VAL A 64 12.673 -0.098 5.718 1.00 0.00 H new ATOM 0 HB VAL A 64 13.721 -2.280 3.905 1.00 0.00 H new ATOM 0 HG11 VAL A 64 13.619 -0.511 2.135 1.00 0.00 H new ATOM 0 HG12 VAL A 64 12.015 -0.858 2.824 1.00 0.00 H new ATOM 0 HG13 VAL A 64 12.899 0.606 3.319 1.00 0.00 H new ATOM 0 HG21 VAL A 64 15.650 -0.762 3.454 1.00 0.00 H new ATOM 0 HG22 VAL A 64 15.046 0.352 4.704 1.00 0.00 H new ATOM 0 HG23 VAL A 64 15.590 -1.281 5.155 1.00 0.00 H new ATOM 460 N LEU A 65 10.385 -1.080 5.076 1.00 0.00 N ATOM 461 CA LEU A 65 9.085 -1.603 4.637 1.00 0.00 C ATOM 462 C LEU A 65 8.785 -1.136 3.209 1.00 0.00 C ATOM 463 O LEU A 65 8.975 0.035 2.877 1.00 0.00 O ATOM 464 CB LEU A 65 7.990 -1.200 5.641 1.00 0.00 C ATOM 465 CG LEU A 65 6.631 -1.896 5.402 1.00 0.00 C ATOM 466 CD1 LEU A 65 6.698 -3.419 5.546 1.00 0.00 C ATOM 467 CD2 LEU A 65 5.618 -1.392 6.427 1.00 0.00 C ATOM 0 H LEU A 65 10.384 -0.074 5.246 1.00 0.00 H new ATOM 0 HA LEU A 65 9.111 -2.692 4.614 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.333 -1.432 6.649 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.847 -0.120 5.593 1.00 0.00 H new ATOM 0 HG LEU A 65 6.342 -1.658 4.378 1.00 0.00 H new ATOM 0 HD11 LEU A 65 5.711 -3.845 5.366 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.405 -3.822 4.821 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.025 -3.675 6.554 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.658 -1.881 6.261 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.973 -1.621 7.432 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.499 -0.314 6.321 1.00 0.00 H new ATOM 479 N ASN A 66 8.331 -2.066 2.369 1.00 0.00 N ATOM 480 CA ASN A 66 8.189 -1.907 0.920 1.00 0.00 C ATOM 481 C ASN A 66 6.748 -2.217 0.462 1.00 0.00 C ATOM 482 O ASN A 66 6.083 -3.077 1.046 1.00 0.00 O ATOM 483 CB ASN A 66 9.169 -2.861 0.208 1.00 0.00 C ATOM 484 CG ASN A 66 10.611 -2.843 0.723 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.491 -2.204 0.163 1.00 0.00 O ATOM 486 ND2 ASN A 66 10.911 -3.589 1.770 1.00 0.00 N ATOM 0 H ASN A 66 8.040 -2.989 2.692 1.00 0.00 H new ATOM 0 HA ASN A 66 8.413 -0.872 0.663 1.00 0.00 H new ATOM 0 HB2 ASN A 66 8.785 -3.877 0.295 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.179 -2.614 -0.854 1.00 0.00 H new ATOM 0 HD21 ASN A 66 11.872 -3.630 2.108 1.00 0.00 H new ATOM 0 HD22 ASN A 66 10.181 -4.124 2.241 1.00 0.00 H new ATOM 493 N TRP A 67 6.285 -1.556 -0.603 1.00 0.00 N ATOM 494 CA TRP A 67 4.983 -1.781 -1.244 1.00 0.00 C ATOM 495 C TRP A 67 5.137 -2.428 -2.630 1.00 0.00 C ATOM 496 O TRP A 67 6.008 -2.047 -3.420 1.00 0.00 O ATOM 497 CB TRP A 67 4.228 -0.449 -1.360 1.00 0.00 C ATOM 498 CG TRP A 67 2.751 -0.582 -1.617 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.103 -0.112 -2.707 1.00 0.00 C ATOM 500 CD2 TRP A 67 1.713 -1.220 -0.797 1.00 0.00 C ATOM 501 NE1 TRP A 67 0.767 -0.455 -2.648 1.00 0.00 N ATOM 502 CE2 TRP A 67 0.457 -1.076 -1.460 1.00 0.00 C ATOM 503 CE3 TRP A 67 1.692 -1.894 0.444 1.00 0.00 C ATOM 504 CZ2 TRP A 67 -0.747 -1.547 -0.916 1.00 0.00 C ATOM 505 CZ3 TRP A 67 0.489 -2.389 0.989 1.00 0.00 C ATOM 506 CH2 TRP A 67 -0.730 -2.212 0.317 1.00 0.00 C ATOM 0 H TRP A 67 6.826 -0.822 -1.060 1.00 0.00 H new ATOM 0 HA TRP A 67 4.413 -2.471 -0.622 1.00 0.00 H new ATOM 0 HB2 TRP A 67 4.373 0.116 -0.439 1.00 0.00 H new ATOM 0 HB3 TRP A 67 4.672 0.135 -2.166 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.563 0.449 -3.507 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.094 -0.271 -3.392 1.00 0.00 H new ATOM 0 HE3 TRP A 67 2.615 -2.033 0.986 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -1.678 -1.398 -1.443 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 0.506 -2.910 1.935 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -1.648 -2.585 0.747 1.00 0.00 H new ATOM 517 N TYR A 68 4.262 -3.389 -2.933 1.00 0.00 N ATOM 518 CA TYR A 68 4.268 -4.172 -4.166 1.00 0.00 C ATOM 519 C TYR A 68 2.875 -4.270 -4.805 1.00 0.00 C ATOM 520 O TYR A 68 1.866 -4.368 -4.107 1.00 0.00 O ATOM 521 CB TYR A 68 4.767 -5.598 -3.872 1.00 0.00 C ATOM 522 CG TYR A 68 6.143 -5.691 -3.239 1.00 0.00 C ATOM 523 CD1 TYR A 68 6.277 -5.639 -1.838 1.00 0.00 C ATOM 524 CD2 TYR A 68 7.286 -5.846 -4.046 1.00 0.00 C ATOM 525 CE1 TYR A 68 7.549 -5.725 -1.243 1.00 0.00 C ATOM 526 CE2 TYR A 68 8.563 -5.918 -3.457 1.00 0.00 C ATOM 527 CZ TYR A 68 8.701 -5.842 -2.054 1.00 0.00 C ATOM 528 OH TYR A 68 9.942 -5.874 -1.493 1.00 0.00 O ATOM 0 H TYR A 68 3.504 -3.651 -2.303 1.00 0.00 H new ATOM 0 HA TYR A 68 4.930 -3.660 -4.864 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.049 -6.087 -3.213 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.777 -6.160 -4.806 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.399 -5.533 -1.218 1.00 0.00 H new ATOM 0 HD2 TYR A 68 7.183 -5.910 -5.119 1.00 0.00 H new ATOM 0 HE1 TYR A 68 7.645 -5.702 -0.168 1.00 0.00 H new ATOM 0 HE2 TYR A 68 9.438 -6.032 -4.079 1.00 0.00 H new ATOM 0 HH TYR A 68 10.618 -5.959 -2.198 1.00 0.00 H new ATOM 538 N ARG A 69 2.837 -4.302 -6.138 1.00 0.00 N ATOM 539 CA ARG A 69 1.667 -4.654 -6.954 1.00 0.00 C ATOM 540 C ARG A 69 1.729 -6.158 -7.224 1.00 0.00 C ATOM 541 O ARG A 69 2.811 -6.668 -7.518 1.00 0.00 O ATOM 542 CB ARG A 69 1.728 -3.846 -8.257 1.00 0.00 C ATOM 543 CG ARG A 69 0.663 -4.199 -9.305 1.00 0.00 C ATOM 544 CD ARG A 69 0.584 -3.105 -10.381 1.00 0.00 C ATOM 545 NE ARG A 69 1.902 -2.817 -10.990 1.00 0.00 N ATOM 546 CZ ARG A 69 2.286 -1.669 -11.537 1.00 0.00 C ATOM 547 NH1 ARG A 69 1.456 -0.662 -11.710 1.00 0.00 N ATOM 548 NH2 ARG A 69 3.536 -1.518 -11.917 1.00 0.00 N1+ ATOM 0 H ARG A 69 3.654 -4.074 -6.705 1.00 0.00 H new ATOM 0 HA ARG A 69 0.729 -4.421 -6.451 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.635 -2.788 -8.012 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.712 -3.985 -8.704 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.903 -5.156 -9.768 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.307 -4.313 -8.822 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.113 -3.415 -11.160 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.184 -2.193 -9.939 1.00 0.00 H new ATOM 0 HE ARG A 69 2.584 -3.576 -10.990 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.482 -0.748 -11.420 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.787 0.205 -12.134 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.203 -2.279 -11.791 1.00 0.00 H new ATOM 0 HH22 ARG A 69 3.839 -0.639 -12.338 1.00 0.00 H new ATOM 562 N MET A 70 0.614 -6.880 -7.118 1.00 0.00 N ATOM 563 CA MET A 70 0.528 -8.316 -7.328 1.00 0.00 C ATOM 564 C MET A 70 -0.277 -8.619 -8.602 1.00 0.00 C ATOM 565 O MET A 70 -1.357 -8.074 -8.829 1.00 0.00 O ATOM 566 CB MET A 70 -0.054 -8.935 -6.049 1.00 0.00 C ATOM 567 CG MET A 70 -0.657 -10.308 -6.318 1.00 0.00 C ATOM 568 SD MET A 70 -0.923 -11.345 -4.858 1.00 0.00 S ATOM 569 CE MET A 70 0.768 -11.959 -4.646 1.00 0.00 C ATOM 0 H MET A 70 -0.284 -6.461 -6.875 1.00 0.00 H new ATOM 0 HA MET A 70 1.506 -8.765 -7.500 1.00 0.00 H new ATOM 0 HB2 MET A 70 0.730 -9.022 -5.296 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.818 -8.275 -5.639 1.00 0.00 H new ATOM 0 HG2 MET A 70 -1.613 -10.172 -6.824 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.004 -10.843 -7.008 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.832 -12.538 -3.725 1.00 0.00 H new ATOM 0 HE2 MET A 70 1.034 -12.593 -5.492 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.457 -11.116 -4.594 1.00 0.00 H new ATOM 579 N SER A 71 0.257 -9.509 -9.431 1.00 0.00 N ATOM 580 CA SER A 71 -0.345 -9.963 -10.691 1.00 0.00 C ATOM 581 C SER A 71 -1.341 -11.131 -10.482 1.00 0.00 C ATOM 582 O SER A 71 -1.241 -11.839 -9.471 1.00 0.00 O ATOM 583 CB SER A 71 0.773 -10.395 -11.656 1.00 0.00 C ATOM 584 OG SER A 71 1.660 -9.316 -11.928 1.00 0.00 O ATOM 0 H SER A 71 1.155 -9.954 -9.242 1.00 0.00 H new ATOM 0 HA SER A 71 -0.911 -9.131 -11.110 1.00 0.00 H new ATOM 0 HB2 SER A 71 1.329 -11.227 -11.224 1.00 0.00 H new ATOM 0 HB3 SER A 71 0.335 -10.754 -12.588 1.00 0.00 H new ATOM 0 HG SER A 71 2.362 -9.617 -12.542 1.00 0.00 H new ATOM 590 N PRO A 72 -2.258 -11.400 -11.441 1.00 0.00 N ATOM 591 CA PRO A 72 -3.173 -12.550 -11.411 1.00 0.00 C ATOM 592 C PRO A 72 -2.466 -13.915 -11.349 1.00 0.00 C ATOM 593 O PRO A 72 -3.021 -14.878 -10.827 1.00 0.00 O ATOM 594 CB PRO A 72 -4.008 -12.453 -12.695 1.00 0.00 C ATOM 595 CG PRO A 72 -3.921 -10.982 -13.085 1.00 0.00 C ATOM 596 CD PRO A 72 -2.517 -10.598 -12.627 1.00 0.00 C ATOM 0 HA PRO A 72 -3.772 -12.504 -10.502 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.610 -13.097 -13.479 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -5.040 -12.760 -12.524 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -4.051 -10.839 -14.158 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -4.686 -10.385 -12.589 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.782 -10.801 -13.406 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -2.456 -9.533 -12.401 1.00 0.00 H new ATOM 604 N SER A 73 -1.232 -13.998 -11.854 1.00 0.00 N ATOM 605 CA SER A 73 -0.351 -15.176 -11.791 1.00 0.00 C ATOM 606 C SER A 73 0.313 -15.380 -10.411 1.00 0.00 C ATOM 607 O SER A 73 1.111 -16.303 -10.236 1.00 0.00 O ATOM 608 CB SER A 73 0.723 -15.031 -12.885 1.00 0.00 C ATOM 609 OG SER A 73 1.359 -13.752 -12.843 1.00 0.00 O ATOM 0 H SER A 73 -0.797 -13.214 -12.340 1.00 0.00 H new ATOM 0 HA SER A 73 -0.965 -16.062 -11.954 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.473 -15.813 -12.763 1.00 0.00 H new ATOM 0 HB3 SER A 73 0.266 -15.177 -13.864 1.00 0.00 H new ATOM 0 HG SER A 73 1.359 -13.357 -13.740 1.00 0.00 H new ATOM 615 N ASN A 74 0.011 -14.512 -9.434 1.00 0.00 N ATOM 616 CA ASN A 74 0.575 -14.456 -8.075 1.00 0.00 C ATOM 617 C ASN A 74 2.047 -14.000 -8.058 1.00 0.00 C ATOM 618 O ASN A 74 2.768 -14.232 -7.083 1.00 0.00 O ATOM 619 CB ASN A 74 0.338 -15.764 -7.289 1.00 0.00 C ATOM 620 CG ASN A 74 -1.120 -16.210 -7.303 1.00 0.00 C ATOM 621 OD1 ASN A 74 -1.956 -15.698 -6.566 1.00 0.00 O ATOM 622 ND2 ASN A 74 -1.470 -17.177 -8.135 1.00 0.00 N ATOM 0 H ASN A 74 -0.682 -13.779 -9.582 1.00 0.00 H new ATOM 0 HA ASN A 74 0.024 -13.680 -7.544 1.00 0.00 H new ATOM 0 HB2 ASN A 74 0.958 -16.554 -7.713 1.00 0.00 H new ATOM 0 HB3 ASN A 74 0.660 -15.625 -6.257 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.437 -17.499 -8.165 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -0.772 -17.601 -8.747 1.00 0.00 H new ATOM 629 N GLN A 75 2.487 -13.322 -9.123 1.00 0.00 N ATOM 630 CA GLN A 75 3.781 -12.637 -9.171 1.00 0.00 C ATOM 631 C GLN A 75 3.659 -11.219 -8.582 1.00 0.00 C ATOM 632 O GLN A 75 2.545 -10.751 -8.328 1.00 0.00 O ATOM 633 CB GLN A 75 4.308 -12.629 -10.618 1.00 0.00 C ATOM 634 CG GLN A 75 4.592 -14.051 -11.139 1.00 0.00 C ATOM 635 CD GLN A 75 5.118 -14.037 -12.574 1.00 0.00 C ATOM 636 OE1 GLN A 75 6.314 -14.094 -12.834 1.00 0.00 O ATOM 637 NE2 GLN A 75 4.247 -13.948 -13.559 1.00 0.00 N ATOM 0 H GLN A 75 1.948 -13.233 -9.985 1.00 0.00 H new ATOM 0 HA GLN A 75 4.506 -13.173 -8.558 1.00 0.00 H new ATOM 0 HB2 GLN A 75 3.578 -12.145 -11.267 1.00 0.00 H new ATOM 0 HB3 GLN A 75 5.221 -12.036 -10.668 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.321 -14.537 -10.490 1.00 0.00 H new ATOM 0 HG3 GLN A 75 3.679 -14.644 -11.093 1.00 0.00 H new ATOM 0 HE21 GLN A 75 3.249 -13.900 -13.354 1.00 0.00 H new ATOM 0 HE22 GLN A 75 4.571 -13.927 -14.526 1.00 0.00 H new ATOM 646 N THR A 76 4.787 -10.533 -8.359 1.00 0.00 N ATOM 647 CA THR A 76 4.861 -9.228 -7.681 1.00 0.00 C ATOM 648 C THR A 76 5.846 -8.288 -8.361 1.00 0.00 C ATOM 649 O THR A 76 6.818 -8.714 -8.988 1.00 0.00 O ATOM 650 CB THR A 76 5.221 -9.353 -6.190 1.00 0.00 C ATOM 651 OG1 THR A 76 6.232 -10.326 -6.003 1.00 0.00 O ATOM 652 CG2 THR A 76 4.003 -9.722 -5.342 1.00 0.00 C ATOM 0 H THR A 76 5.701 -10.878 -8.653 1.00 0.00 H new ATOM 0 HA THR A 76 3.859 -8.806 -7.755 1.00 0.00 H new ATOM 0 HB THR A 76 5.585 -8.378 -5.865 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.450 -10.392 -5.050 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.298 -9.801 -4.296 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.240 -8.951 -5.446 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.601 -10.678 -5.679 1.00 0.00 H new ATOM 660 N ASP A 77 5.582 -6.993 -8.216 1.00 0.00 N ATOM 661 CA ASP A 77 6.348 -5.882 -8.784 1.00 0.00 C ATOM 662 C ASP A 77 6.525 -4.770 -7.742 1.00 0.00 C ATOM 663 O ASP A 77 5.566 -4.350 -7.093 1.00 0.00 O ATOM 664 CB ASP A 77 5.575 -5.348 -9.992 1.00 0.00 C ATOM 665 CG ASP A 77 6.307 -4.261 -10.790 1.00 0.00 C ATOM 666 OD1 ASP A 77 7.544 -4.359 -10.972 1.00 0.00 O ATOM 667 OD2 ASP A 77 5.616 -3.324 -11.259 1.00 0.00 O1- ATOM 0 H ASP A 77 4.784 -6.670 -7.669 1.00 0.00 H new ATOM 0 HA ASP A 77 7.338 -6.224 -9.085 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.350 -6.180 -10.659 1.00 0.00 H new ATOM 0 HB3 ASP A 77 4.621 -4.948 -9.648 1.00 0.00 H new ATOM 672 N LYS A 78 7.756 -4.293 -7.574 1.00 0.00 N ATOM 673 CA LYS A 78 8.132 -3.328 -6.531 1.00 0.00 C ATOM 674 C LYS A 78 7.869 -1.880 -6.967 1.00 0.00 C ATOM 675 O LYS A 78 8.286 -1.451 -8.047 1.00 0.00 O ATOM 676 CB LYS A 78 9.597 -3.564 -6.123 1.00 0.00 C ATOM 677 CG LYS A 78 9.927 -2.862 -4.797 1.00 0.00 C ATOM 678 CD LYS A 78 11.333 -3.227 -4.306 1.00 0.00 C ATOM 679 CE LYS A 78 11.526 -2.681 -2.889 1.00 0.00 C ATOM 680 NZ LYS A 78 12.857 -3.026 -2.332 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.538 -4.568 -8.168 1.00 0.00 H new ATOM 0 HA LYS A 78 7.502 -3.488 -5.656 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.782 -4.634 -6.026 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.259 -3.195 -6.907 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.854 -1.782 -4.927 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.192 -3.142 -4.042 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.465 -4.309 -4.313 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.085 -2.810 -4.975 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.408 -1.597 -2.900 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.747 -3.080 -2.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 12.855 -2.867 -1.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.066 -4.026 -2.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.584 -2.428 -2.774 1.00 0.00 H new ATOM 694 N LEU A 79 7.173 -1.131 -6.108 1.00 0.00 N ATOM 695 CA LEU A 79 6.690 0.221 -6.396 1.00 0.00 C ATOM 696 C LEU A 79 7.499 1.266 -5.623 1.00 0.00 C ATOM 697 O LEU A 79 8.118 2.143 -6.229 1.00 0.00 O ATOM 698 CB LEU A 79 5.196 0.277 -6.027 1.00 0.00 C ATOM 699 CG LEU A 79 4.309 -0.742 -6.775 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.938 -0.738 -6.098 1.00 0.00 C ATOM 701 CD2 LEU A 79 4.184 -0.423 -8.270 1.00 0.00 C ATOM 0 H LEU A 79 6.925 -1.455 -5.173 1.00 0.00 H new ATOM 0 HA LEU A 79 6.816 0.451 -7.454 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.094 0.109 -4.955 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.823 1.281 -6.230 1.00 0.00 H new ATOM 0 HG LEU A 79 4.767 -1.730 -6.721 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.282 -1.448 -6.601 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.048 -1.023 -5.052 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.505 0.261 -6.158 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.550 -1.169 -8.750 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.740 0.565 -8.395 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.173 -0.437 -8.729 1.00 0.00 H new ATOM 713 N ALA A 80 7.537 1.144 -4.293 1.00 0.00 N ATOM 714 CA ALA A 80 8.139 2.126 -3.385 1.00 0.00 C ATOM 715 C ALA A 80 8.415 1.512 -2.002 1.00 0.00 C ATOM 716 O ALA A 80 8.039 0.370 -1.738 1.00 0.00 O ATOM 717 CB ALA A 80 7.215 3.358 -3.315 1.00 0.00 C ATOM 0 H ALA A 80 7.141 0.340 -3.806 1.00 0.00 H new ATOM 0 HA ALA A 80 9.110 2.441 -3.766 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.648 4.100 -2.643 1.00 0.00 H new ATOM 0 HB2 ALA A 80 7.107 3.789 -4.310 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.236 3.058 -2.942 1.00 0.00 H new ATOM 723 N ALA A 81 9.077 2.263 -1.122 1.00 0.00 N ATOM 724 CA ALA A 81 9.469 1.836 0.224 1.00 0.00 C ATOM 725 C ALA A 81 9.750 3.037 1.140 1.00 0.00 C ATOM 726 O ALA A 81 9.785 4.175 0.667 1.00 0.00 O ATOM 727 CB ALA A 81 10.693 0.915 0.101 1.00 0.00 C ATOM 0 H ALA A 81 9.366 3.218 -1.332 1.00 0.00 H new ATOM 0 HA ALA A 81 8.648 1.290 0.688 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.001 0.585 1.093 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.436 0.047 -0.506 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.511 1.458 -0.371 1.00 0.00 H new ATOM 733 N PHE A 82 9.961 2.793 2.436 1.00 0.00 N ATOM 734 CA PHE A 82 10.480 3.795 3.369 1.00 0.00 C ATOM 735 C PHE A 82 11.521 3.162 4.320 1.00 0.00 C ATOM 736 O PHE A 82 11.155 2.252 5.075 1.00 0.00 O ATOM 737 CB PHE A 82 9.345 4.482 4.136 1.00 0.00 C ATOM 738 CG PHE A 82 9.829 5.708 4.886 1.00 0.00 C ATOM 739 CD1 PHE A 82 9.908 6.948 4.223 1.00 0.00 C ATOM 740 CD2 PHE A 82 10.266 5.604 6.220 1.00 0.00 C ATOM 741 CE1 PHE A 82 10.382 8.084 4.903 1.00 0.00 C ATOM 742 CE2 PHE A 82 10.750 6.737 6.895 1.00 0.00 C ATOM 743 CZ PHE A 82 10.798 7.981 6.241 1.00 0.00 C ATOM 0 H PHE A 82 9.775 1.889 2.870 1.00 0.00 H new ATOM 0 HA PHE A 82 10.986 4.570 2.794 1.00 0.00 H new ATOM 0 HB2 PHE A 82 8.558 4.770 3.439 1.00 0.00 H new ATOM 0 HB3 PHE A 82 8.904 3.777 4.840 1.00 0.00 H new ATOM 0 HD1 PHE A 82 9.604 7.027 3.190 1.00 0.00 H new ATOM 0 HD2 PHE A 82 10.229 4.651 6.726 1.00 0.00 H new ATOM 0 HE1 PHE A 82 10.426 9.037 4.396 1.00 0.00 H new ATOM 0 HE2 PHE A 82 11.086 6.652 7.918 1.00 0.00 H new ATOM 0 HZ PHE A 82 11.154 8.855 6.766 1.00 0.00 H new ATOM 753 N PRO A 83 12.794 3.619 4.309 1.00 0.00 N ATOM 754 CA PRO A 83 13.383 4.562 3.351 1.00 0.00 C ATOM 755 C PRO A 83 13.293 4.022 1.914 1.00 0.00 C ATOM 756 O PRO A 83 13.359 2.813 1.697 1.00 0.00 O ATOM 757 CB PRO A 83 14.835 4.764 3.801 1.00 0.00 C ATOM 758 CG PRO A 83 15.156 3.474 4.555 1.00 0.00 C ATOM 759 CD PRO A 83 13.824 3.131 5.216 1.00 0.00 C ATOM 0 HA PRO A 83 12.847 5.511 3.338 1.00 0.00 H new ATOM 0 HB2 PRO A 83 15.502 4.909 2.951 1.00 0.00 H new ATOM 0 HB3 PRO A 83 14.939 5.640 4.441 1.00 0.00 H new ATOM 0 HG2 PRO A 83 15.489 2.684 3.882 1.00 0.00 H new ATOM 0 HG3 PRO A 83 15.947 3.621 5.290 1.00 0.00 H new ATOM 0 HD2 PRO A 83 13.730 2.056 5.372 1.00 0.00 H new ATOM 0 HD3 PRO A 83 13.740 3.604 6.194 1.00 0.00 H new ATOM 907 N ARG A 94 4.403 9.073 -8.590 1.00 0.00 N ATOM 908 CA ARG A 94 3.071 8.792 -8.040 1.00 0.00 C ATOM 909 C ARG A 94 2.985 7.701 -6.961 1.00 0.00 C ATOM 910 O ARG A 94 1.983 7.674 -6.244 1.00 0.00 O ATOM 911 CB ARG A 94 2.133 8.463 -9.211 1.00 0.00 C ATOM 912 CG ARG A 94 2.452 7.134 -9.922 1.00 0.00 C ATOM 913 CD ARG A 94 1.674 6.989 -11.234 1.00 0.00 C ATOM 914 NE ARG A 94 0.215 7.034 -11.020 1.00 0.00 N ATOM 915 CZ ARG A 94 -0.609 6.004 -10.888 1.00 0.00 C ATOM 916 NH1 ARG A 94 -0.198 4.754 -10.872 1.00 0.00 N1+ ATOM 917 NH2 ARG A 94 -1.894 6.226 -10.779 1.00 0.00 N ATOM 0 HA ARG A 94 2.775 9.694 -7.505 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.108 8.428 -8.842 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.182 9.272 -9.939 1.00 0.00 H new ATOM 0 HG2 ARG A 94 3.521 7.078 -10.126 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.209 6.301 -9.262 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.965 7.787 -11.918 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.941 6.046 -11.712 1.00 0.00 H new ATOM 0 HE ARG A 94 -0.207 7.961 -10.968 1.00 0.00 H new ATOM 0 HH11 ARG A 94 0.796 4.543 -10.964 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.873 3.996 -10.768 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -2.250 7.182 -10.796 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.540 5.443 -10.677 1.00 0.00 H new ATOM 931 N PHE A 95 3.984 6.828 -6.825 1.00 0.00 N ATOM 932 CA PHE A 95 4.051 5.782 -5.793 1.00 0.00 C ATOM 933 C PHE A 95 5.036 6.201 -4.693 1.00 0.00 C ATOM 934 O PHE A 95 6.227 6.349 -4.970 1.00 0.00 O ATOM 935 CB PHE A 95 4.499 4.447 -6.418 1.00 0.00 C ATOM 936 CG PHE A 95 3.532 3.828 -7.411 1.00 0.00 C ATOM 937 CD1 PHE A 95 2.422 3.101 -6.945 1.00 0.00 C ATOM 938 CD2 PHE A 95 3.765 3.929 -8.796 1.00 0.00 C ATOM 939 CE1 PHE A 95 1.545 2.483 -7.856 1.00 0.00 C ATOM 940 CE2 PHE A 95 2.890 3.310 -9.708 1.00 0.00 C ATOM 941 CZ PHE A 95 1.780 2.585 -9.238 1.00 0.00 C ATOM 0 H PHE A 95 4.794 6.826 -7.445 1.00 0.00 H new ATOM 0 HA PHE A 95 3.061 5.651 -5.357 1.00 0.00 H new ATOM 0 HB2 PHE A 95 5.454 4.604 -6.919 1.00 0.00 H new ATOM 0 HB3 PHE A 95 4.674 3.731 -5.615 1.00 0.00 H new ATOM 0 HD1 PHE A 95 2.242 3.017 -5.884 1.00 0.00 H new ATOM 0 HD2 PHE A 95 4.618 4.483 -9.159 1.00 0.00 H new ATOM 0 HE1 PHE A 95 0.691 1.930 -7.493 1.00 0.00 H new ATOM 0 HE2 PHE A 95 3.071 3.392 -10.770 1.00 0.00 H new ATOM 0 HZ PHE A 95 1.110 2.108 -9.938 1.00 0.00 H new ATOM 951 N ARG A 96 4.563 6.379 -3.451 1.00 0.00 N ATOM 952 CA ARG A 96 5.404 6.787 -2.302 1.00 0.00 C ATOM 953 C ARG A 96 4.958 6.125 -0.990 1.00 0.00 C ATOM 954 O ARG A 96 3.799 5.741 -0.847 1.00 0.00 O ATOM 955 CB ARG A 96 5.398 8.323 -2.136 1.00 0.00 C ATOM 956 CG ARG A 96 6.050 9.124 -3.277 1.00 0.00 C ATOM 957 CD ARG A 96 7.562 8.896 -3.441 1.00 0.00 C ATOM 958 NE ARG A 96 8.081 9.707 -4.558 1.00 0.00 N ATOM 959 CZ ARG A 96 9.205 10.413 -4.577 1.00 0.00 C ATOM 960 NH1 ARG A 96 10.120 10.344 -3.641 1.00 0.00 N ATOM 961 NH2 ARG A 96 9.445 11.228 -5.578 1.00 0.00 N1+ ATOM 0 H ARG A 96 3.582 6.245 -3.208 1.00 0.00 H new ATOM 0 HA ARG A 96 6.417 6.449 -2.521 1.00 0.00 H new ATOM 0 HB2 ARG A 96 4.365 8.654 -2.030 1.00 0.00 H new ATOM 0 HB3 ARG A 96 5.909 8.571 -1.206 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.554 8.866 -4.213 1.00 0.00 H new ATOM 0 HG3 ARG A 96 5.873 10.186 -3.104 1.00 0.00 H new ATOM 0 HD2 ARG A 96 8.079 9.161 -2.519 1.00 0.00 H new ATOM 0 HD3 ARG A 96 7.760 7.840 -3.626 1.00 0.00 H new ATOM 0 HE ARG A 96 7.516 9.728 -5.407 1.00 0.00 H new ATOM 0 HH11 ARG A 96 9.988 9.722 -2.843 1.00 0.00 H new ATOM 0 HH12 ARG A 96 10.965 10.912 -3.711 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.769 11.317 -6.337 1.00 0.00 H new ATOM 0 HH22 ARG A 96 10.307 11.773 -5.597 1.00 0.00 H new ATOM 975 N VAL A 97 5.879 5.999 -0.032 1.00 0.00 N ATOM 976 CA VAL A 97 5.630 5.453 1.321 1.00 0.00 C ATOM 977 C VAL A 97 6.111 6.438 2.398 1.00 0.00 C ATOM 978 O VAL A 97 7.165 7.053 2.228 1.00 0.00 O ATOM 979 CB VAL A 97 6.300 4.074 1.514 1.00 0.00 C ATOM 980 CG1 VAL A 97 5.931 3.422 2.856 1.00 0.00 C ATOM 981 CG2 VAL A 97 5.951 3.105 0.369 1.00 0.00 C ATOM 0 H VAL A 97 6.850 6.280 -0.172 1.00 0.00 H new ATOM 0 HA VAL A 97 4.554 5.315 1.425 1.00 0.00 H new ATOM 0 HB VAL A 97 7.373 4.266 1.508 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.428 2.456 2.940 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.251 4.067 3.674 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.851 3.280 2.907 1.00 0.00 H new ATOM 0 HG21 VAL A 97 6.441 2.147 0.541 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.871 2.959 0.332 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.293 3.522 -0.578 1.00 0.00 H new ATOM 991 N THR A 98 5.350 6.583 3.494 1.00 0.00 N ATOM 992 CA THR A 98 5.649 7.475 4.634 1.00 0.00 C ATOM 993 C THR A 98 5.524 6.729 5.965 1.00 0.00 C ATOM 994 O THR A 98 4.534 6.038 6.186 1.00 0.00 O ATOM 995 CB THR A 98 4.687 8.676 4.604 1.00 0.00 C ATOM 996 OG1 THR A 98 4.892 9.397 3.408 1.00 0.00 O ATOM 997 CG2 THR A 98 4.907 9.660 5.754 1.00 0.00 C ATOM 0 H THR A 98 4.479 6.067 3.619 1.00 0.00 H new ATOM 0 HA THR A 98 6.677 7.826 4.545 1.00 0.00 H new ATOM 0 HB THR A 98 3.681 8.265 4.688 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.282 10.163 3.379 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.195 10.482 5.671 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.760 9.147 6.705 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.922 10.053 5.707 1.00 0.00 H new ATOM 1005 N GLN A 99 6.496 6.899 6.866 1.00 0.00 N ATOM 1006 CA GLN A 99 6.439 6.444 8.268 1.00 0.00 C ATOM 1007 C GLN A 99 5.591 7.421 9.104 1.00 0.00 C ATOM 1008 O GLN A 99 5.761 8.641 9.010 1.00 0.00 O ATOM 1009 CB GLN A 99 7.883 6.355 8.808 1.00 0.00 C ATOM 1010 CG GLN A 99 8.059 6.122 10.323 1.00 0.00 C ATOM 1011 CD GLN A 99 7.721 4.706 10.792 1.00 0.00 C ATOM 1012 OE1 GLN A 99 6.730 4.451 11.462 1.00 0.00 O ATOM 1013 NE2 GLN A 99 8.545 3.729 10.481 1.00 0.00 N ATOM 0 H GLN A 99 7.372 7.370 6.639 1.00 0.00 H new ATOM 0 HA GLN A 99 5.970 5.462 8.332 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.391 5.547 8.281 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.398 7.279 8.547 1.00 0.00 H new ATOM 0 HG2 GLN A 99 9.091 6.344 10.594 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.429 6.829 10.862 1.00 0.00 H new ATOM 0 HE21 GLN A 99 9.377 3.922 9.923 1.00 0.00 H new ATOM 0 HE22 GLN A 99 8.352 2.779 10.798 1.00 0.00 H new ATOM 1022 N LEU A 100 4.702 6.894 9.953 1.00 0.00 N ATOM 1023 CA LEU A 100 3.831 7.685 10.832 1.00 0.00 C ATOM 1024 C LEU A 100 4.548 8.130 12.124 1.00 0.00 C ATOM 1025 O LEU A 100 5.506 7.474 12.551 1.00 0.00 O ATOM 1026 CB LEU A 100 2.558 6.873 11.162 1.00 0.00 C ATOM 1027 CG LEU A 100 1.707 6.448 9.949 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.338 5.943 10.427 1.00 0.00 C ATOM 1029 CD2 LEU A 100 1.492 7.575 8.926 1.00 0.00 C ATOM 0 H LEU A 100 4.565 5.888 10.051 1.00 0.00 H new ATOM 0 HA LEU A 100 3.556 8.596 10.301 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.852 5.977 11.709 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.934 7.465 11.831 1.00 0.00 H new ATOM 0 HG LEU A 100 2.264 5.658 9.446 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.260 5.644 9.566 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.476 5.087 11.088 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.175 6.739 10.966 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.885 7.205 8.100 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.981 8.410 9.406 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.457 7.910 8.546 1.00 0.00 H new ATOM 1041 N PRO A 101 4.053 9.183 12.813 1.00 0.00 N ATOM 1042 CA PRO A 101 4.583 9.618 14.106 1.00 0.00 C ATOM 1043 C PRO A 101 4.414 8.588 15.239 1.00 0.00 C ATOM 1044 O PRO A 101 4.983 8.793 16.311 1.00 0.00 O ATOM 1045 CB PRO A 101 3.876 10.943 14.421 1.00 0.00 C ATOM 1046 CG PRO A 101 2.566 10.846 13.644 1.00 0.00 C ATOM 1047 CD PRO A 101 2.989 10.088 12.388 1.00 0.00 C ATOM 0 HA PRO A 101 5.664 9.737 14.040 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.700 11.059 15.490 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.469 11.800 14.101 1.00 0.00 H new ATOM 0 HG2 PRO A 101 1.800 10.310 14.204 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.159 11.829 13.408 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.151 9.535 11.963 1.00 0.00 H new ATOM 0 HD3 PRO A 101 3.342 10.773 11.617 1.00 0.00 H new ATOM 1055 N ASN A 102 3.699 7.467 15.029 1.00 0.00 N ATOM 1056 CA ASN A 102 3.681 6.354 15.992 1.00 0.00 C ATOM 1057 C ASN A 102 4.993 5.526 15.996 1.00 0.00 C ATOM 1058 O ASN A 102 5.174 4.641 16.836 1.00 0.00 O ATOM 1059 CB ASN A 102 2.443 5.477 15.733 1.00 0.00 C ATOM 1060 CG ASN A 102 2.135 4.550 16.911 1.00 0.00 C ATOM 1061 OD1 ASN A 102 2.198 4.936 18.073 1.00 0.00 O ATOM 1062 ND2 ASN A 102 1.792 3.302 16.657 1.00 0.00 N ATOM 0 H ASN A 102 3.126 7.310 14.200 1.00 0.00 H new ATOM 0 HA ASN A 102 3.616 6.778 16.994 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.581 6.116 15.541 1.00 0.00 H new ATOM 0 HB3 ASN A 102 2.604 4.880 14.835 1.00 0.00 H new ATOM 0 HD21 ASN A 102 1.581 2.665 17.425 1.00 0.00 H new ATOM 0 HD22 ASN A 102 1.738 2.974 15.693 1.00 0.00 H new ATOM 1069 N GLY A 103 5.914 5.784 15.057 1.00 0.00 N ATOM 1070 CA GLY A 103 7.290 5.259 15.041 1.00 0.00 C ATOM 1071 C GLY A 103 7.469 3.855 14.453 1.00 0.00 C ATOM 1072 O GLY A 103 8.606 3.478 14.167 1.00 0.00 O ATOM 0 H GLY A 103 5.716 6.386 14.258 1.00 0.00 H new ATOM 0 HA2 GLY A 103 7.914 5.950 14.475 1.00 0.00 H new ATOM 0 HA3 GLY A 103 7.667 5.253 16.064 1.00 0.00 H new ATOM 1076 N ARG A 104 6.381 3.093 14.265 1.00 0.00 N ATOM 1077 CA ARG A 104 6.376 1.801 13.562 1.00 0.00 C ATOM 1078 C ARG A 104 4.990 1.491 12.970 1.00 0.00 C ATOM 1079 O ARG A 104 4.248 0.621 13.419 1.00 0.00 O ATOM 1080 CB ARG A 104 6.973 0.684 14.452 1.00 0.00 C ATOM 1081 CG ARG A 104 6.215 0.245 15.720 1.00 0.00 C ATOM 1082 CD ARG A 104 5.847 1.357 16.713 1.00 0.00 C ATOM 1083 NE ARG A 104 5.348 0.795 17.978 1.00 0.00 N ATOM 1084 CZ ARG A 104 4.816 1.471 18.991 1.00 0.00 C ATOM 1085 NH1 ARG A 104 4.666 2.778 18.964 1.00 0.00 N ATOM 1086 NH2 ARG A 104 4.414 0.824 20.064 1.00 0.00 N1+ ATOM 0 H ARG A 104 5.459 3.364 14.606 1.00 0.00 H new ATOM 0 HA ARG A 104 7.038 1.859 12.698 1.00 0.00 H new ATOM 0 HB2 ARG A 104 7.104 -0.199 13.826 1.00 0.00 H new ATOM 0 HB3 ARG A 104 7.968 1.007 14.760 1.00 0.00 H new ATOM 0 HG2 ARG A 104 5.297 -0.257 15.413 1.00 0.00 H new ATOM 0 HG3 ARG A 104 6.823 -0.493 16.243 1.00 0.00 H new ATOM 0 HD2 ARG A 104 6.721 1.979 16.908 1.00 0.00 H new ATOM 0 HD3 ARG A 104 5.087 2.004 16.274 1.00 0.00 H new ATOM 0 HE ARG A 104 5.417 -0.217 18.089 1.00 0.00 H new ATOM 0 HH11 ARG A 104 4.963 3.309 18.145 1.00 0.00 H new ATOM 0 HH12 ARG A 104 4.253 3.261 19.762 1.00 0.00 H new ATOM 0 HH21 ARG A 104 4.512 -0.190 20.115 1.00 0.00 H new ATOM 0 HH22 ARG A 104 4.005 1.337 20.845 1.00 0.00 H new ATOM 1100 N ASP A 105 4.671 2.208 11.899 1.00 0.00 N ATOM 1101 CA ASP A 105 3.418 2.213 11.149 1.00 0.00 C ATOM 1102 C ASP A 105 3.624 3.049 9.877 1.00 0.00 C ATOM 1103 O ASP A 105 4.356 4.040 9.900 1.00 0.00 O ATOM 1104 CB ASP A 105 2.306 2.849 11.987 1.00 0.00 C ATOM 1105 CG ASP A 105 1.538 1.870 12.886 1.00 0.00 C ATOM 1106 OD1 ASP A 105 1.035 0.843 12.372 1.00 0.00 O ATOM 1107 OD2 ASP A 105 1.396 2.174 14.093 1.00 0.00 O1- ATOM 0 H ASP A 105 5.343 2.861 11.496 1.00 0.00 H new ATOM 0 HA ASP A 105 3.134 1.191 10.900 1.00 0.00 H new ATOM 0 HB2 ASP A 105 2.742 3.629 12.612 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.598 3.336 11.316 1.00 0.00 H new ATOM 1112 N PHE A 106 2.986 2.675 8.766 1.00 0.00 N ATOM 1113 CA PHE A 106 3.303 3.257 7.460 1.00 0.00 C ATOM 1114 C PHE A 106 2.069 3.455 6.570 1.00 0.00 C ATOM 1115 O PHE A 106 1.188 2.599 6.513 1.00 0.00 O ATOM 1116 CB PHE A 106 4.309 2.352 6.732 1.00 0.00 C ATOM 1117 CG PHE A 106 5.647 2.091 7.412 1.00 0.00 C ATOM 1118 CD1 PHE A 106 5.742 1.154 8.463 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.823 2.682 6.910 1.00 0.00 C ATOM 1120 CE1 PHE A 106 6.994 0.796 8.992 1.00 0.00 C ATOM 1121 CE2 PHE A 106 8.078 2.309 7.426 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.166 1.359 8.458 1.00 0.00 C ATOM 0 H PHE A 106 2.247 1.972 8.744 1.00 0.00 H new ATOM 0 HA PHE A 106 3.725 4.245 7.647 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.829 1.390 6.556 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.509 2.791 5.755 1.00 0.00 H new ATOM 0 HD1 PHE A 106 4.844 0.708 8.865 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.761 3.423 6.127 1.00 0.00 H new ATOM 0 HE1 PHE A 106 7.055 0.090 9.807 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.977 2.755 7.027 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.132 1.062 8.840 1.00 0.00 H new ATOM 1132 N HIS A 107 2.051 4.567 5.833 1.00 0.00 N ATOM 1133 CA HIS A 107 1.103 4.860 4.752 1.00 0.00 C ATOM 1134 C HIS A 107 1.760 4.646 3.375 1.00 0.00 C ATOM 1135 O HIS A 107 2.839 5.184 3.117 1.00 0.00 O ATOM 1136 CB HIS A 107 0.608 6.311 4.877 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.516 6.538 5.855 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.182 7.755 6.030 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.086 5.607 6.674 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.135 7.521 6.948 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.103 6.239 7.351 1.00 0.00 N ATOM 0 H HIS A 107 2.723 5.320 5.978 1.00 0.00 H new ATOM 0 HA HIS A 107 0.257 4.178 4.837 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.450 6.939 5.168 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.283 6.650 3.893 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -0.794 4.572 6.772 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.831 8.262 7.312 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -2.724 5.810 8.038 1.00 0.00 H new ATOM 1149 N MET A 108 1.095 3.903 2.487 1.00 0.00 N ATOM 1150 CA MET A 108 1.536 3.590 1.121 1.00 0.00 C ATOM 1151 C MET A 108 0.567 4.239 0.135 1.00 0.00 C ATOM 1152 O MET A 108 -0.594 3.838 0.045 1.00 0.00 O ATOM 1153 CB MET A 108 1.577 2.068 0.904 1.00 0.00 C ATOM 1154 CG MET A 108 2.704 1.384 1.683 1.00 0.00 C ATOM 1155 SD MET A 108 2.510 1.292 3.477 1.00 0.00 S ATOM 1156 CE MET A 108 4.055 0.438 3.841 1.00 0.00 C ATOM 0 H MET A 108 0.192 3.483 2.709 1.00 0.00 H new ATOM 0 HA MET A 108 2.542 3.979 0.963 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.622 1.638 1.204 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.700 1.861 -0.159 1.00 0.00 H new ATOM 0 HG2 MET A 108 2.815 0.369 1.300 1.00 0.00 H new ATOM 0 HG3 MET A 108 3.634 1.910 1.468 1.00 0.00 H new ATOM 0 HE1 MET A 108 3.920 -0.203 4.712 1.00 0.00 H new ATOM 0 HE2 MET A 108 4.345 -0.170 2.984 1.00 0.00 H new ATOM 0 HE3 MET A 108 4.836 1.170 4.047 1.00 0.00 H new ATOM 1166 N SER A 109 1.039 5.245 -0.592 1.00 0.00 N ATOM 1167 CA SER A 109 0.215 6.141 -1.408 1.00 0.00 C ATOM 1168 C SER A 109 0.423 5.937 -2.919 1.00 0.00 C ATOM 1169 O SER A 109 1.559 5.963 -3.406 1.00 0.00 O ATOM 1170 CB SER A 109 0.551 7.602 -1.062 1.00 0.00 C ATOM 1171 OG SER A 109 0.388 7.869 0.326 1.00 0.00 O ATOM 0 H SER A 109 2.033 5.470 -0.634 1.00 0.00 H new ATOM 0 HA SER A 109 -0.825 5.907 -1.181 1.00 0.00 H new ATOM 0 HB2 SER A 109 1.579 7.817 -1.355 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.091 8.268 -1.638 1.00 0.00 H new ATOM 0 HG SER A 109 0.612 8.806 0.507 1.00 0.00 H new ATOM 1177 N VAL A 110 -0.685 5.797 -3.657 1.00 0.00 N ATOM 1178 CA VAL A 110 -0.777 5.820 -5.126 1.00 0.00 C ATOM 1179 C VAL A 110 -1.505 7.112 -5.512 1.00 0.00 C ATOM 1180 O VAL A 110 -2.725 7.206 -5.384 1.00 0.00 O ATOM 1181 CB VAL A 110 -1.541 4.597 -5.700 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -1.481 4.596 -7.239 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.011 3.259 -5.162 1.00 0.00 C ATOM 0 H VAL A 110 -1.596 5.656 -3.221 1.00 0.00 H new ATOM 0 HA VAL A 110 0.229 5.776 -5.544 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.575 4.696 -5.370 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.022 3.731 -7.624 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.937 5.509 -7.621 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.441 4.547 -7.563 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.583 2.440 -5.598 1.00 0.00 H new ATOM 0 HG22 VAL A 110 0.040 3.150 -5.429 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.114 3.237 -4.077 1.00 0.00 H new ATOM 1193 N VAL A 111 -0.760 8.126 -5.947 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.307 9.444 -6.323 1.00 0.00 C ATOM 1195 C VAL A 111 -2.025 9.355 -7.675 1.00 0.00 C ATOM 1196 O VAL A 111 -1.484 8.787 -8.625 1.00 0.00 O ATOM 1197 CB VAL A 111 -0.213 10.539 -6.356 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.768 11.916 -6.761 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.458 10.677 -4.976 1.00 0.00 C ATOM 0 H VAL A 111 0.253 8.063 -6.052 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.027 9.732 -5.557 1.00 0.00 H new ATOM 0 HB VAL A 111 0.511 10.221 -7.106 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.041 12.647 -6.768 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.208 11.852 -7.756 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.530 12.226 -6.046 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.224 11.451 -5.020 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.291 10.949 -4.233 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.917 9.728 -4.698 1.00 0.00 H new ATOM 1209 N ARG A 112 -3.232 9.938 -7.757 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.008 10.099 -8.999 1.00 0.00 C ATOM 1211 C ARG A 112 -4.257 8.736 -9.666 1.00 0.00 C ATOM 1212 O ARG A 112 -3.739 8.433 -10.743 1.00 0.00 O ATOM 1213 CB ARG A 112 -3.298 11.137 -9.891 1.00 0.00 C ATOM 1214 CG ARG A 112 -4.135 11.613 -11.088 1.00 0.00 C ATOM 1215 CD ARG A 112 -3.387 12.706 -11.863 1.00 0.00 C ATOM 1216 NE ARG A 112 -3.387 13.991 -11.136 1.00 0.00 N ATOM 1217 CZ ARG A 112 -2.683 15.073 -11.450 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -1.880 15.108 -12.495 1.00 0.00 N1+ ATOM 1219 NH2 ARG A 112 -2.780 16.153 -10.705 1.00 0.00 N ATOM 0 H ARG A 112 -3.708 10.321 -6.940 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.005 10.489 -8.794 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.030 12.001 -9.282 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.367 10.707 -10.260 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -4.349 10.772 -11.748 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -5.094 11.997 -10.740 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.359 12.388 -12.039 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -3.851 12.841 -12.840 1.00 0.00 H new ATOM 0 HE ARG A 112 -3.986 14.054 -10.313 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.784 14.287 -13.092 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -1.354 15.956 -12.706 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -3.394 16.157 -9.890 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.241 16.986 -10.942 1.00 0.00 H new ATOM 1233 N ALA A 113 -4.983 7.863 -8.966 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.254 6.490 -9.384 1.00 0.00 C ATOM 1235 C ALA A 113 -6.238 6.453 -10.570 1.00 0.00 C ATOM 1236 O ALA A 113 -7.246 7.161 -10.561 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.752 5.703 -8.164 1.00 0.00 C ATOM 0 H ALA A 113 -5.409 8.099 -8.070 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.342 6.017 -9.750 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -5.960 4.674 -8.455 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -4.987 5.713 -7.388 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.663 6.163 -7.781 1.00 0.00 H new ATOM 1243 N ARG A 114 -5.950 5.630 -11.584 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.813 5.385 -12.753 1.00 0.00 C ATOM 1245 C ARG A 114 -7.361 3.952 -12.742 1.00 0.00 C ATOM 1246 O ARG A 114 -6.846 3.094 -12.032 1.00 0.00 O ATOM 1247 CB ARG A 114 -6.072 5.699 -14.073 1.00 0.00 C ATOM 1248 CG ARG A 114 -4.843 4.826 -14.379 1.00 0.00 C ATOM 1249 CD ARG A 114 -3.506 5.451 -13.957 1.00 0.00 C ATOM 1250 NE ARG A 114 -2.530 4.393 -13.650 1.00 0.00 N ATOM 1251 CZ ARG A 114 -1.892 3.592 -14.490 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -1.867 3.795 -15.790 1.00 0.00 N ATOM 1253 NH2 ARG A 114 -1.289 2.537 -13.998 1.00 0.00 N1+ ATOM 0 H ARG A 114 -5.081 5.096 -11.618 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.664 6.064 -12.689 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -6.779 5.598 -14.897 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.756 6.742 -14.050 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -4.958 3.867 -13.874 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -4.814 4.622 -15.449 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -3.125 6.088 -14.755 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -3.652 6.087 -13.084 1.00 0.00 H new ATOM 0 HE ARG A 114 -2.317 4.259 -12.661 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -2.353 4.598 -16.190 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -1.362 3.150 -16.397 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -1.320 2.353 -12.995 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -0.789 1.900 -14.618 1.00 0.00 H new ATOM 1267 N ARG A 115 -8.355 3.651 -13.582 1.00 0.00 N ATOM 1268 CA ARG A 115 -8.969 2.310 -13.684 1.00 0.00 C ATOM 1269 C ARG A 115 -7.971 1.191 -14.054 1.00 0.00 C ATOM 1270 O ARG A 115 -8.184 0.036 -13.687 1.00 0.00 O ATOM 1271 CB ARG A 115 -10.167 2.379 -14.646 1.00 0.00 C ATOM 1272 CG ARG A 115 -11.323 3.212 -14.043 1.00 0.00 C ATOM 1273 CD ARG A 115 -11.873 4.275 -14.997 1.00 0.00 C ATOM 1274 NE ARG A 115 -12.509 3.692 -16.191 1.00 0.00 N ATOM 1275 CZ ARG A 115 -12.907 4.373 -17.261 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -12.764 5.679 -17.356 1.00 0.00 N ATOM 1277 NH2 ARG A 115 -13.468 3.736 -18.267 1.00 0.00 N1+ ATOM 0 H ARG A 115 -8.765 4.333 -14.220 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.321 2.027 -12.692 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.852 2.820 -15.592 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.518 1.371 -14.866 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -12.132 2.541 -13.755 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -10.973 3.699 -13.133 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -12.600 4.892 -14.468 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -11.062 4.934 -15.307 1.00 0.00 H new ATOM 0 HE ARG A 115 -12.656 2.683 -16.197 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -12.335 6.202 -16.592 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -13.082 6.167 -18.193 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -13.595 2.725 -18.223 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -13.775 4.253 -19.091 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.841 1.532 -14.687 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.715 0.616 -14.923 1.00 0.00 C ATOM 1293 C ASN A 116 -4.941 0.218 -13.637 1.00 0.00 C ATOM 1294 O ASN A 116 -4.296 -0.831 -13.627 1.00 0.00 O ATOM 1295 CB ASN A 116 -4.783 1.265 -15.962 1.00 0.00 C ATOM 1296 CG ASN A 116 -3.653 0.342 -16.417 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -2.488 0.552 -16.099 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -3.958 -0.696 -17.176 1.00 0.00 N ATOM 0 H ASN A 116 -6.680 2.469 -15.057 1.00 0.00 H new ATOM 0 HA ASN A 116 -6.119 -0.325 -15.297 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -5.370 1.565 -16.830 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.354 2.173 -15.538 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -3.223 -1.325 -17.499 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -4.928 -0.868 -17.439 1.00 0.00 H new ATOM 1305 N ASP A 117 -5.008 1.002 -12.549 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.393 0.641 -11.256 1.00 0.00 C ATOM 1307 C ASP A 117 -5.199 -0.403 -10.461 1.00 0.00 C ATOM 1308 O ASP A 117 -4.635 -1.040 -9.576 1.00 0.00 O ATOM 1309 CB ASP A 117 -4.196 1.875 -10.357 1.00 0.00 C ATOM 1310 CG ASP A 117 -3.229 2.910 -10.920 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -2.067 2.587 -11.263 1.00 0.00 O ATOM 1312 OD2 ASP A 117 -3.618 4.091 -11.024 1.00 0.00 O1- ATOM 0 H ASP A 117 -5.488 1.902 -12.538 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.430 0.204 -11.522 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.164 2.349 -10.193 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.833 1.547 -9.383 1.00 0.00 H new ATOM 1317 N SER A 118 -6.495 -0.593 -10.734 1.00 0.00 N ATOM 1318 CA SER A 118 -7.340 -1.542 -9.990 1.00 0.00 C ATOM 1319 C SER A 118 -6.782 -2.982 -10.030 1.00 0.00 C ATOM 1320 O SER A 118 -6.476 -3.514 -11.105 1.00 0.00 O ATOM 1321 CB SER A 118 -8.777 -1.535 -10.531 1.00 0.00 C ATOM 1322 OG SER A 118 -9.389 -0.251 -10.443 1.00 0.00 O ATOM 0 H SER A 118 -6.989 -0.096 -11.475 1.00 0.00 H new ATOM 0 HA SER A 118 -7.339 -1.209 -8.952 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.771 -1.860 -11.571 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.374 -2.257 -9.975 1.00 0.00 H new ATOM 0 HG SER A 118 -10.300 -0.298 -10.801 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.652 -3.625 -8.861 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.977 -4.922 -8.701 1.00 0.00 C ATOM 1330 C GLY A 119 -5.422 -5.149 -7.294 1.00 0.00 C ATOM 1331 O GLY A 119 -5.788 -4.431 -6.360 1.00 0.00 O ATOM 0 H GLY A 119 -7.019 -3.253 -7.985 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.679 -5.721 -8.940 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -5.161 -4.990 -9.421 1.00 0.00 H new ATOM 1335 N THR A 120 -4.566 -6.164 -7.131 1.00 0.00 N ATOM 1336 CA THR A 120 -4.007 -6.582 -5.834 1.00 0.00 C ATOM 1337 C THR A 120 -2.694 -5.863 -5.548 1.00 0.00 C ATOM 1338 O THR A 120 -1.875 -5.656 -6.441 1.00 0.00 O ATOM 1339 CB THR A 120 -3.786 -8.099 -5.795 1.00 0.00 C ATOM 1340 OG1 THR A 120 -4.896 -8.771 -6.355 1.00 0.00 O ATOM 1341 CG2 THR A 120 -3.587 -8.637 -4.375 1.00 0.00 C ATOM 0 H THR A 120 -4.234 -6.731 -7.911 1.00 0.00 H new ATOM 0 HA THR A 120 -4.730 -6.312 -5.064 1.00 0.00 H new ATOM 0 HB THR A 120 -2.878 -8.283 -6.369 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.742 -9.738 -6.326 1.00 0.00 H new ATOM 0 HG21 THR A 120 -3.435 -9.716 -4.413 1.00 0.00 H new ATOM 0 HG22 THR A 120 -2.714 -8.163 -3.925 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.470 -8.415 -3.775 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.474 -5.533 -4.280 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.265 -4.910 -3.736 1.00 0.00 C ATOM 1351 C TYR A 121 -0.914 -5.515 -2.357 1.00 0.00 C ATOM 1352 O TYR A 121 -1.788 -6.069 -1.686 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.473 -3.394 -3.626 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.634 -2.663 -4.948 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.891 -2.598 -5.580 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.518 -2.049 -5.551 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -3.023 -1.970 -6.831 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.654 -1.386 -6.786 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.902 -1.362 -7.439 1.00 0.00 C ATOM 1360 OH TYR A 121 -2.014 -0.761 -8.654 1.00 0.00 O ATOM 0 H TYR A 121 -3.175 -5.702 -3.558 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.430 -5.105 -4.409 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.358 -3.209 -3.017 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.624 -2.965 -3.094 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.757 -3.032 -5.102 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.445 -2.087 -5.064 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.982 -1.952 -7.327 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.199 -0.896 -7.233 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.930 -0.865 -8.987 1.00 0.00 H new ATOM 1370 N LEU A 122 0.342 -5.422 -1.905 1.00 0.00 N ATOM 1371 CA LEU A 122 0.795 -5.985 -0.621 1.00 0.00 C ATOM 1372 C LEU A 122 2.068 -5.323 -0.079 1.00 0.00 C ATOM 1373 O LEU A 122 2.773 -4.604 -0.785 1.00 0.00 O ATOM 1374 CB LEU A 122 0.887 -7.529 -0.702 1.00 0.00 C ATOM 1375 CG LEU A 122 1.933 -8.124 -1.673 1.00 0.00 C ATOM 1376 CD1 LEU A 122 3.356 -8.143 -1.093 1.00 0.00 C ATOM 1377 CD2 LEU A 122 1.532 -9.567 -2.013 1.00 0.00 C ATOM 0 H LEU A 122 1.083 -4.949 -2.423 1.00 0.00 H new ATOM 0 HA LEU A 122 0.036 -5.746 0.123 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.100 -7.908 0.298 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.093 -7.912 -0.986 1.00 0.00 H new ATOM 0 HG LEU A 122 1.946 -7.485 -2.556 1.00 0.00 H new ATOM 0 HD11 LEU A 122 4.041 -8.572 -1.824 1.00 0.00 H new ATOM 0 HD12 LEU A 122 3.667 -7.125 -0.858 1.00 0.00 H new ATOM 0 HD13 LEU A 122 3.371 -8.745 -0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 122 2.264 -9.996 -2.698 1.00 0.00 H new ATOM 0 HD22 LEU A 122 1.499 -10.160 -1.099 1.00 0.00 H new ATOM 0 HD23 LEU A 122 0.549 -9.570 -2.484 1.00 0.00 H new ATOM 1389 N CYS A 123 2.355 -5.596 1.195 1.00 0.00 N ATOM 1390 CA CYS A 123 3.444 -5.008 1.984 1.00 0.00 C ATOM 1391 C CYS A 123 4.486 -6.078 2.355 1.00 0.00 C ATOM 1392 O CYS A 123 4.112 -7.179 2.768 1.00 0.00 O ATOM 1393 CB CYS A 123 2.809 -4.397 3.242 1.00 0.00 C ATOM 1394 SG CYS A 123 3.266 -2.714 3.682 1.00 0.00 S ATOM 0 H CYS A 123 1.807 -6.267 1.734 1.00 0.00 H new ATOM 0 HA CYS A 123 3.968 -4.243 1.411 1.00 0.00 H new ATOM 0 HB2 CYS A 123 1.726 -4.428 3.119 1.00 0.00 H new ATOM 0 HB3 CYS A 123 3.053 -5.042 4.087 1.00 0.00 H new ATOM 1399 N GLY A 124 5.781 -5.764 2.224 1.00 0.00 N ATOM 1400 CA GLY A 124 6.887 -6.677 2.556 1.00 0.00 C ATOM 1401 C GLY A 124 8.048 -5.985 3.268 1.00 0.00 C ATOM 1402 O GLY A 124 8.529 -4.952 2.801 1.00 0.00 O ATOM 0 H GLY A 124 6.096 -4.857 1.880 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.509 -7.480 3.188 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.255 -7.139 1.640 1.00 0.00 H new ATOM 1406 N ALA A 125 8.507 -6.550 4.386 1.00 0.00 N ATOM 1407 CA ALA A 125 9.571 -5.991 5.231 1.00 0.00 C ATOM 1408 C ALA A 125 10.920 -6.696 5.030 1.00 0.00 C ATOM 1409 O ALA A 125 10.966 -7.870 4.678 1.00 0.00 O ATOM 1410 CB ALA A 125 9.138 -6.085 6.698 1.00 0.00 C ATOM 0 H ALA A 125 8.141 -7.433 4.741 1.00 0.00 H new ATOM 0 HA ALA A 125 9.719 -4.951 4.941 1.00 0.00 H new ATOM 0 HB1 ALA A 125 9.920 -5.673 7.335 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.217 -5.520 6.842 1.00 0.00 H new ATOM 0 HB3 ALA A 125 8.968 -7.129 6.961 1.00 0.00 H new ATOM 1416 N ILE A 126 12.023 -6.004 5.317 1.00 0.00 N ATOM 1417 CA ILE A 126 13.398 -6.532 5.266 1.00 0.00 C ATOM 1418 C ILE A 126 14.301 -5.706 6.194 1.00 0.00 C ATOM 1419 O ILE A 126 14.097 -4.499 6.326 1.00 0.00 O ATOM 1420 CB ILE A 126 13.900 -6.559 3.798 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.223 -7.341 3.681 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.062 -5.143 3.215 1.00 0.00 C ATOM 1423 CD1 ILE A 126 15.683 -7.581 2.240 1.00 0.00 C ATOM 0 H ILE A 126 11.989 -5.025 5.602 1.00 0.00 H new ATOM 0 HA ILE A 126 13.423 -7.561 5.626 1.00 0.00 H new ATOM 0 HB ILE A 126 13.137 -7.071 3.212 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.003 -6.797 4.214 1.00 0.00 H new ATOM 0 HG13 ILE A 126 15.109 -8.304 4.180 1.00 0.00 H new ATOM 0 HG21 ILE A 126 14.415 -5.211 2.186 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.101 -4.629 3.235 1.00 0.00 H new ATOM 0 HG23 ILE A 126 14.785 -4.585 3.810 1.00 0.00 H new ATOM 0 HD11 ILE A 126 16.620 -8.137 2.245 1.00 0.00 H new ATOM 0 HD12 ILE A 126 14.924 -8.154 1.706 1.00 0.00 H new ATOM 0 HD13 ILE A 126 15.832 -6.623 1.741 1.00 0.00 H new ATOM 1435 N SER A 127 15.282 -6.314 6.860 1.00 0.00 N ATOM 1436 CA SER A 127 16.203 -5.576 7.740 1.00 0.00 C ATOM 1437 C SER A 127 17.090 -4.577 6.978 1.00 0.00 C ATOM 1438 O SER A 127 17.318 -4.698 5.770 1.00 0.00 O ATOM 1439 CB SER A 127 17.122 -6.505 8.547 1.00 0.00 C ATOM 1440 OG SER A 127 16.432 -7.652 9.030 1.00 0.00 O ATOM 0 H SER A 127 15.464 -7.316 6.810 1.00 0.00 H new ATOM 0 HA SER A 127 15.547 -5.031 8.418 1.00 0.00 H new ATOM 0 HB2 SER A 127 17.957 -6.821 7.922 1.00 0.00 H new ATOM 0 HB3 SER A 127 17.544 -5.955 9.388 1.00 0.00 H new ATOM 0 HG SER A 127 17.052 -8.218 9.536 1.00 0.00 H new ATOM 1446 N LEU A 128 17.662 -3.619 7.714 1.00 0.00 N ATOM 1447 CA LEU A 128 18.702 -2.715 7.220 1.00 0.00 C ATOM 1448 C LEU A 128 19.967 -3.476 6.764 1.00 0.00 C ATOM 1449 O LEU A 128 20.618 -3.076 5.798 1.00 0.00 O ATOM 1450 CB LEU A 128 18.982 -1.712 8.356 1.00 0.00 C ATOM 1451 CG LEU A 128 20.162 -0.759 8.104 1.00 0.00 C ATOM 1452 CD1 LEU A 128 19.935 0.145 6.880 1.00 0.00 C ATOM 1453 CD2 LEU A 128 20.401 0.120 9.340 1.00 0.00 C ATOM 0 H LEU A 128 17.410 -3.448 8.687 1.00 0.00 H new ATOM 0 HA LEU A 128 18.369 -2.188 6.326 1.00 0.00 H new ATOM 0 HB2 LEU A 128 18.084 -1.118 8.525 1.00 0.00 H new ATOM 0 HB3 LEU A 128 19.173 -2.269 9.273 1.00 0.00 H new ATOM 0 HG LEU A 128 21.035 -1.380 7.905 1.00 0.00 H new ATOM 0 HD11 LEU A 128 20.797 0.799 6.746 1.00 0.00 H new ATOM 0 HD12 LEU A 128 19.805 -0.472 5.991 1.00 0.00 H new ATOM 0 HD13 LEU A 128 19.042 0.750 7.035 1.00 0.00 H new ATOM 0 HD21 LEU A 128 21.239 0.792 9.152 1.00 0.00 H new ATOM 0 HD22 LEU A 128 19.506 0.706 9.549 1.00 0.00 H new ATOM 0 HD23 LEU A 128 20.629 -0.513 10.198 1.00 0.00 H new ATOM 1465 N ALA A 129 20.310 -4.579 7.438 1.00 0.00 N ATOM 1466 CA ALA A 129 21.457 -5.429 7.109 1.00 0.00 C ATOM 1467 C ALA A 129 21.271 -6.151 5.745 1.00 0.00 C ATOM 1468 O ALA A 129 20.251 -6.832 5.575 1.00 0.00 O ATOM 1469 CB ALA A 129 21.663 -6.428 8.257 1.00 0.00 C ATOM 0 H ALA A 129 19.785 -4.912 8.246 1.00 0.00 H new ATOM 0 HA ALA A 129 22.347 -4.810 6.999 1.00 0.00 H new ATOM 0 HB1 ALA A 129 22.514 -7.071 8.031 1.00 0.00 H new ATOM 0 HB2 ALA A 129 21.854 -5.885 9.182 1.00 0.00 H new ATOM 0 HB3 ALA A 129 20.767 -7.038 8.373 1.00 0.00 H new ATOM 1475 N PRO A 130 22.234 -6.071 4.797 1.00 0.00 N ATOM 1476 CA PRO A 130 22.138 -6.696 3.469 1.00 0.00 C ATOM 1477 C PRO A 130 21.898 -8.214 3.459 1.00 0.00 C ATOM 1478 O PRO A 130 21.355 -8.737 2.489 1.00 0.00 O ATOM 1479 CB PRO A 130 23.459 -6.371 2.764 1.00 0.00 C ATOM 1480 CG PRO A 130 23.890 -5.059 3.407 1.00 0.00 C ATOM 1481 CD PRO A 130 23.423 -5.225 4.851 1.00 0.00 C ATOM 0 HA PRO A 130 21.256 -6.295 2.970 1.00 0.00 H new ATOM 0 HB2 PRO A 130 24.200 -7.156 2.917 1.00 0.00 H new ATOM 0 HB3 PRO A 130 23.324 -6.266 1.687 1.00 0.00 H new ATOM 0 HG2 PRO A 130 24.968 -4.912 3.344 1.00 0.00 H new ATOM 0 HG3 PRO A 130 23.423 -4.200 2.926 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.200 -5.684 5.462 1.00 0.00 H new ATOM 0 HD3 PRO A 130 23.194 -4.259 5.300 1.00 0.00 H new ATOM 1489 N LYS A 131 22.279 -8.929 4.527 1.00 0.00 N ATOM 1490 CA LYS A 131 22.090 -10.384 4.668 1.00 0.00 C ATOM 1491 C LYS A 131 20.623 -10.837 4.871 1.00 0.00 C ATOM 1492 O LYS A 131 20.348 -12.040 4.910 1.00 0.00 O ATOM 1493 CB LYS A 131 23.013 -10.889 5.797 1.00 0.00 C ATOM 1494 CG LYS A 131 22.632 -10.368 7.194 1.00 0.00 C ATOM 1495 CD LYS A 131 23.603 -10.898 8.258 1.00 0.00 C ATOM 1496 CE LYS A 131 23.209 -10.368 9.645 1.00 0.00 C ATOM 1497 NZ LYS A 131 24.127 -10.863 10.704 1.00 0.00 N1+ ATOM 0 H LYS A 131 22.737 -8.506 5.334 1.00 0.00 H new ATOM 0 HA LYS A 131 22.364 -10.840 3.717 1.00 0.00 H new ATOM 0 HB2 LYS A 131 22.994 -11.979 5.809 1.00 0.00 H new ATOM 0 HB3 LYS A 131 24.038 -10.591 5.576 1.00 0.00 H new ATOM 0 HG2 LYS A 131 22.643 -9.278 7.196 1.00 0.00 H new ATOM 0 HG3 LYS A 131 21.615 -10.677 7.437 1.00 0.00 H new ATOM 0 HD2 LYS A 131 23.592 -11.988 8.260 1.00 0.00 H new ATOM 0 HD3 LYS A 131 24.621 -10.590 8.018 1.00 0.00 H new ATOM 0 HE2 LYS A 131 23.220 -9.278 9.635 1.00 0.00 H new ATOM 0 HE3 LYS A 131 22.189 -10.675 9.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 23.830 -10.485 11.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 24.098 -11.902 10.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 25.097 -10.549 10.497 1.00 0.00 H new ATOM 1511 N ALA A 132 19.687 -9.895 5.033 1.00 0.00 N ATOM 1512 CA ALA A 132 18.261 -10.144 5.265 1.00 0.00 C ATOM 1513 C ALA A 132 17.517 -10.737 4.046 1.00 0.00 C ATOM 1514 O ALA A 132 18.051 -10.826 2.938 1.00 0.00 O ATOM 1515 CB ALA A 132 17.644 -8.820 5.732 1.00 0.00 C ATOM 0 H ALA A 132 19.911 -8.900 5.005 1.00 0.00 H new ATOM 0 HA ALA A 132 18.155 -10.916 6.028 1.00 0.00 H new ATOM 0 HB1 ALA A 132 16.579 -8.960 5.917 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.132 -8.495 6.651 1.00 0.00 H new ATOM 0 HB3 ALA A 132 17.782 -8.062 4.961 1.00 0.00 H new ATOM 1521 N GLN A 133 16.252 -11.109 4.258 1.00 0.00 N ATOM 1522 CA GLN A 133 15.310 -11.588 3.245 1.00 0.00 C ATOM 1523 C GLN A 133 13.911 -11.010 3.524 1.00 0.00 C ATOM 1524 O GLN A 133 13.639 -10.528 4.627 1.00 0.00 O ATOM 1525 CB GLN A 133 15.313 -13.129 3.192 1.00 0.00 C ATOM 1526 CG GLN A 133 14.850 -13.810 4.494 1.00 0.00 C ATOM 1527 CD GLN A 133 14.875 -15.336 4.379 1.00 0.00 C ATOM 1528 OE1 GLN A 133 13.856 -15.995 4.212 1.00 0.00 O ATOM 1529 NE2 GLN A 133 16.034 -15.962 4.449 1.00 0.00 N ATOM 0 H GLN A 133 15.837 -11.083 5.189 1.00 0.00 H new ATOM 0 HA GLN A 133 15.619 -11.240 2.260 1.00 0.00 H new ATOM 0 HB2 GLN A 133 14.667 -13.454 2.376 1.00 0.00 H new ATOM 0 HB3 GLN A 133 16.321 -13.471 2.956 1.00 0.00 H new ATOM 0 HG2 GLN A 133 15.494 -13.497 5.316 1.00 0.00 H new ATOM 0 HG3 GLN A 133 13.840 -13.481 4.737 1.00 0.00 H new ATOM 0 HE21 GLN A 133 16.893 -15.430 4.588 1.00 0.00 H new ATOM 0 HE22 GLN A 133 16.071 -16.978 4.364 1.00 0.00 H new ATOM 1538 N ILE A 134 13.026 -11.027 2.524 1.00 0.00 N ATOM 1539 CA ILE A 134 11.737 -10.316 2.583 1.00 0.00 C ATOM 1540 C ILE A 134 10.673 -11.140 3.334 1.00 0.00 C ATOM 1541 O ILE A 134 10.362 -12.273 2.960 1.00 0.00 O ATOM 1542 CB ILE A 134 11.245 -9.887 1.174 1.00 0.00 C ATOM 1543 CG1 ILE A 134 12.350 -9.184 0.345 1.00 0.00 C ATOM 1544 CG2 ILE A 134 10.035 -8.940 1.325 1.00 0.00 C ATOM 1545 CD1 ILE A 134 11.973 -8.946 -1.123 1.00 0.00 C ATOM 0 H ILE A 134 13.178 -11.531 1.651 1.00 0.00 H new ATOM 0 HA ILE A 134 11.900 -9.400 3.151 1.00 0.00 H new ATOM 0 HB ILE A 134 10.963 -10.792 0.636 1.00 0.00 H new ATOM 0 HG12 ILE A 134 12.584 -8.226 0.809 1.00 0.00 H new ATOM 0 HG13 ILE A 134 13.257 -9.787 0.383 1.00 0.00 H new ATOM 0 HG21 ILE A 134 9.686 -8.636 0.338 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.232 -9.457 1.851 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.332 -8.058 1.893 1.00 0.00 H new ATOM 0 HD11 ILE A 134 12.798 -8.450 -1.635 1.00 0.00 H new ATOM 0 HD12 ILE A 134 11.768 -9.902 -1.606 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.084 -8.317 -1.173 1.00 0.00 H new ATOM 1557 N LYS A 135 10.083 -10.546 4.372 1.00 0.00 N ATOM 1558 CA LYS A 135 8.935 -11.058 5.130 1.00 0.00 C ATOM 1559 C LYS A 135 7.620 -10.532 4.523 1.00 0.00 C ATOM 1560 O LYS A 135 7.468 -9.319 4.368 1.00 0.00 O ATOM 1561 CB LYS A 135 9.056 -10.596 6.597 1.00 0.00 C ATOM 1562 CG LYS A 135 10.334 -11.079 7.306 1.00 0.00 C ATOM 1563 CD LYS A 135 10.387 -10.526 8.740 1.00 0.00 C ATOM 1564 CE LYS A 135 11.692 -10.884 9.466 1.00 0.00 C ATOM 1565 NZ LYS A 135 11.793 -12.335 9.782 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.409 -9.647 4.727 1.00 0.00 H new ATOM 0 HA LYS A 135 8.927 -12.147 5.085 1.00 0.00 H new ATOM 0 HB2 LYS A 135 9.027 -9.507 6.627 1.00 0.00 H new ATOM 0 HB3 LYS A 135 8.189 -10.954 7.152 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.357 -12.169 7.328 1.00 0.00 H new ATOM 0 HG3 LYS A 135 11.213 -10.753 6.750 1.00 0.00 H new ATOM 0 HD2 LYS A 135 10.278 -9.442 8.711 1.00 0.00 H new ATOM 0 HD3 LYS A 135 9.542 -10.916 9.307 1.00 0.00 H new ATOM 0 HE2 LYS A 135 12.540 -10.591 8.847 1.00 0.00 H new ATOM 0 HE3 LYS A 135 11.759 -10.309 10.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 12.692 -12.522 10.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 11.001 -12.613 10.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 11.758 -12.886 8.900 1.00 0.00 H new ATOM 1579 N GLU A 136 6.666 -11.412 4.204 1.00 0.00 N ATOM 1580 CA GLU A 136 5.375 -11.073 3.581 1.00 0.00 C ATOM 1581 C GLU A 136 4.224 -11.854 4.236 1.00 0.00 C ATOM 1582 O GLU A 136 4.340 -13.058 4.476 1.00 0.00 O ATOM 1583 CB GLU A 136 5.397 -11.424 2.081 1.00 0.00 C ATOM 1584 CG GLU A 136 6.236 -10.473 1.221 1.00 0.00 C ATOM 1585 CD GLU A 136 6.443 -11.059 -0.185 1.00 0.00 C ATOM 1586 OE1 GLU A 136 5.458 -11.176 -0.951 1.00 0.00 O1- ATOM 1587 OE2 GLU A 136 7.593 -11.424 -0.528 1.00 0.00 O ATOM 0 H GLU A 136 6.770 -12.412 4.376 1.00 0.00 H new ATOM 0 HA GLU A 136 5.218 -10.003 3.719 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.782 -12.437 1.963 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.374 -11.426 1.706 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.740 -9.505 1.149 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.202 -10.301 1.695 1.00 0.00 H new ATOM 1594 N SER A 137 3.090 -11.186 4.453 1.00 0.00 N ATOM 1595 CA SER A 137 1.813 -11.775 4.897 1.00 0.00 C ATOM 1596 C SER A 137 0.631 -10.987 4.299 1.00 0.00 C ATOM 1597 O SER A 137 0.711 -9.759 4.206 1.00 0.00 O ATOM 1598 CB SER A 137 1.684 -11.738 6.433 1.00 0.00 C ATOM 1599 OG SER A 137 2.583 -12.631 7.080 1.00 0.00 O ATOM 0 H SER A 137 3.027 -10.177 4.320 1.00 0.00 H new ATOM 0 HA SER A 137 1.796 -12.810 4.557 1.00 0.00 H new ATOM 0 HB2 SER A 137 1.870 -10.723 6.785 1.00 0.00 H new ATOM 0 HB3 SER A 137 0.662 -11.991 6.714 1.00 0.00 H new ATOM 0 HG SER A 137 3.197 -13.013 6.419 1.00 0.00 H new ATOM 1605 N LEU A 138 -0.461 -11.683 3.935 1.00 0.00 N ATOM 1606 CA LEU A 138 -1.736 -11.134 3.416 1.00 0.00 C ATOM 1607 C LEU A 138 -1.602 -10.471 2.021 1.00 0.00 C ATOM 1608 O LEU A 138 -0.522 -10.439 1.427 1.00 0.00 O ATOM 1609 CB LEU A 138 -2.388 -10.176 4.450 1.00 0.00 C ATOM 1610 CG LEU A 138 -2.530 -10.710 5.891 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -3.174 -9.627 6.768 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -3.371 -11.995 5.955 1.00 0.00 C ATOM 0 H LEU A 138 -0.483 -12.701 3.997 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.401 -11.985 3.269 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -1.800 -9.259 4.483 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -3.380 -9.906 4.087 1.00 0.00 H new ATOM 0 HG LEU A 138 -1.533 -10.956 6.257 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.277 -9.998 7.788 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -2.545 -8.737 6.768 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.158 -9.376 6.372 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.442 -12.332 6.989 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -4.370 -11.795 5.569 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -2.897 -12.770 5.353 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.714 -9.925 1.503 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.787 -9.067 0.313 1.00 0.00 C ATOM 1626 C ARG A 139 -4.048 -8.184 0.359 1.00 0.00 C ATOM 1627 O ARG A 139 -5.093 -8.623 0.846 1.00 0.00 O ATOM 1628 CB ARG A 139 -2.669 -9.901 -0.982 1.00 0.00 C ATOM 1629 CG ARG A 139 -3.970 -10.493 -1.551 1.00 0.00 C ATOM 1630 CD ARG A 139 -4.750 -11.463 -0.648 1.00 0.00 C ATOM 1631 NE ARG A 139 -6.048 -11.806 -1.261 1.00 0.00 N ATOM 1632 CZ ARG A 139 -7.112 -11.011 -1.364 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -7.202 -9.837 -0.778 1.00 0.00 N1+ ATOM 1634 NH2 ARG A 139 -8.145 -11.366 -2.090 1.00 0.00 N ATOM 0 H ARG A 139 -3.630 -10.078 1.924 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.934 -8.389 0.311 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.218 -9.273 -1.750 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -1.977 -10.722 -0.795 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -4.632 -9.667 -1.812 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -3.728 -11.013 -2.478 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -4.166 -12.369 -0.487 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -4.911 -11.010 0.330 1.00 0.00 H new ATOM 0 HE ARG A 139 -6.140 -12.747 -1.645 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -6.430 -9.491 -0.208 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.043 -9.272 -0.894 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -8.139 -12.259 -2.583 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -8.954 -10.749 -2.162 1.00 0.00 H new ATOM 1648 N ALA A 140 -3.967 -6.962 -0.156 1.00 0.00 N ATOM 1649 CA ALA A 140 -5.050 -5.975 -0.198 1.00 0.00 C ATOM 1650 C ALA A 140 -5.448 -5.659 -1.649 1.00 0.00 C ATOM 1651 O ALA A 140 -4.735 -6.007 -2.589 1.00 0.00 O ATOM 1652 CB ALA A 140 -4.580 -4.714 0.540 1.00 0.00 C ATOM 0 H ALA A 140 -3.106 -6.612 -0.576 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.938 -6.375 0.292 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.372 -3.965 0.521 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.342 -4.965 1.574 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -3.692 -4.315 0.050 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.601 -5.025 -1.839 1.00 0.00 N ATOM 1659 CA GLU A 141 -7.220 -4.808 -3.149 1.00 0.00 C ATOM 1660 C GLU A 141 -7.547 -3.324 -3.341 1.00 0.00 C ATOM 1661 O GLU A 141 -8.071 -2.674 -2.437 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.492 -5.670 -3.261 1.00 0.00 C ATOM 1663 CG GLU A 141 -8.183 -7.173 -3.156 1.00 0.00 C ATOM 1664 CD GLU A 141 -9.444 -8.049 -3.124 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -10.304 -7.932 -4.029 1.00 0.00 O ATOM 1666 OE2 GLU A 141 -9.549 -8.898 -2.206 1.00 0.00 O1- ATOM 0 H GLU A 141 -7.147 -4.637 -1.070 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.524 -5.103 -3.935 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -9.191 -5.388 -2.474 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.984 -5.467 -4.212 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.564 -7.470 -4.002 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -7.599 -7.355 -2.254 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.248 -2.792 -4.526 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.585 -1.436 -4.959 1.00 0.00 C ATOM 1675 C LEU A 142 -8.655 -1.497 -6.051 1.00 0.00 C ATOM 1676 O LEU A 142 -8.497 -2.220 -7.039 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.306 -0.752 -5.482 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.494 0.691 -5.996 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -7.005 1.639 -4.901 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.161 1.212 -6.547 1.00 0.00 C ATOM 0 H LEU A 142 -6.743 -3.316 -5.241 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.983 -0.859 -4.124 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.566 -0.742 -4.682 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.894 -1.357 -6.290 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.248 0.666 -6.783 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.121 2.642 -5.313 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.968 1.284 -4.533 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.290 1.665 -4.079 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.291 2.231 -6.911 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.411 1.202 -5.756 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.832 0.573 -7.367 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.701 -0.683 -5.899 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.739 -0.431 -6.898 1.00 0.00 C ATOM 1694 C ARG A 143 -10.808 1.070 -7.199 1.00 0.00 C ATOM 1695 O ARG A 143 -11.078 1.880 -6.310 1.00 0.00 O ATOM 1696 CB ARG A 143 -12.080 -0.961 -6.362 1.00 0.00 C ATOM 1697 CG ARG A 143 -13.222 -0.822 -7.379 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.549 -1.313 -6.789 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.641 -1.189 -7.770 1.00 0.00 N ATOM 1700 CZ ARG A 143 -16.944 -1.179 -7.510 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -17.417 -1.299 -6.286 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -17.805 -1.049 -8.497 1.00 0.00 N ATOM 0 H ARG A 143 -9.854 -0.159 -5.038 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.508 -0.947 -7.830 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.968 -2.010 -6.089 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.342 -0.421 -5.452 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.319 0.221 -7.682 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.986 -1.394 -8.276 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.450 -2.353 -6.479 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.790 -0.736 -5.896 1.00 0.00 H new ATOM 0 HE ARG A 143 -15.369 -1.102 -8.749 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.776 -1.404 -5.500 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.424 -1.287 -6.125 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.471 -0.957 -9.456 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -18.806 -1.041 -8.303 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.599 1.437 -8.459 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.826 2.793 -8.978 1.00 0.00 C ATOM 1718 C VAL A 144 -12.120 2.803 -9.802 1.00 0.00 C ATOM 1719 O VAL A 144 -12.219 2.094 -10.805 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.634 3.292 -9.817 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.845 4.762 -10.205 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.300 3.149 -9.067 1.00 0.00 C ATOM 0 H VAL A 144 -10.259 0.789 -9.169 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.924 3.478 -8.136 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.584 2.671 -10.712 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -8.998 5.107 -10.798 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.760 4.856 -10.790 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -9.927 5.368 -9.303 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.488 3.513 -9.696 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.335 3.732 -8.147 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -8.129 2.100 -8.825 1.00 0.00 H new ATOM 1732 N THR A 145 -13.105 3.595 -9.368 1.00 0.00 N ATOM 1733 CA THR A 145 -14.422 3.760 -10.008 1.00 0.00 C ATOM 1734 C THR A 145 -14.455 5.019 -10.872 1.00 0.00 C ATOM 1735 O THR A 145 -13.680 5.949 -10.656 1.00 0.00 O ATOM 1736 CB THR A 145 -15.538 3.796 -8.950 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.314 4.861 -8.054 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.597 2.493 -8.150 1.00 0.00 C ATOM 0 H THR A 145 -13.007 4.164 -8.527 1.00 0.00 H new ATOM 0 HA THR A 145 -14.593 2.901 -10.657 1.00 0.00 H new ATOM 0 HB THR A 145 -16.483 3.930 -9.476 1.00 0.00 H new ATOM 0 HG1 THR A 145 -16.028 4.880 -7.383 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.397 2.555 -7.412 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.790 1.660 -8.826 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.646 2.335 -7.642 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.338 5.055 -11.870 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.437 6.177 -12.814 1.00 0.00 C ATOM 1748 C GLU A 146 -15.868 7.486 -12.125 1.00 0.00 C ATOM 1749 O GLU A 146 -16.743 7.501 -11.252 1.00 0.00 O ATOM 1750 CB GLU A 146 -16.413 5.846 -13.955 1.00 0.00 C ATOM 1751 CG GLU A 146 -15.858 4.777 -14.902 1.00 0.00 C ATOM 1752 CD GLU A 146 -16.861 4.461 -16.022 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -16.867 5.173 -17.054 1.00 0.00 O1- ATOM 1754 OE2 GLU A 146 -17.650 3.497 -15.878 1.00 0.00 O ATOM 0 H GLU A 146 -16.008 4.307 -12.050 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.438 6.329 -13.224 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -17.357 5.501 -13.534 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.629 6.753 -14.520 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.919 5.122 -15.336 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.635 3.869 -14.341 1.00 0.00 H new ATOM 1761 N ARG A 147 -15.268 8.599 -12.562 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.533 9.952 -12.063 1.00 0.00 C ATOM 1763 C ARG A 147 -16.802 10.516 -12.713 1.00 0.00 C ATOM 1764 O ARG A 147 -16.899 10.590 -13.942 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.298 10.819 -12.340 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.406 12.240 -11.767 1.00 0.00 C ATOM 1767 CD ARG A 147 -13.090 13.023 -11.901 1.00 0.00 C ATOM 1768 NE ARG A 147 -12.698 13.225 -13.313 1.00 0.00 N ATOM 1769 CZ ARG A 147 -11.914 12.439 -14.047 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -11.260 11.418 -13.540 1.00 0.00 N1+ ATOM 1771 NH2 ARG A 147 -11.787 12.655 -15.337 1.00 0.00 N ATOM 0 H ARG A 147 -14.561 8.581 -13.297 1.00 0.00 H new ATOM 0 HA ARG A 147 -15.713 9.940 -10.988 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.419 10.331 -11.918 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -14.141 10.881 -13.417 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -15.201 12.778 -12.283 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -14.689 12.185 -10.716 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -13.195 13.992 -11.413 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -12.297 12.488 -11.379 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.068 14.056 -13.774 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.343 11.202 -12.547 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -10.670 10.842 -14.140 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -12.290 13.426 -15.777 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -11.186 12.052 -15.898 1.00 0.00 H new