USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 796 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 117 CYS SG : rot 170:sc= 1.03 USER MOD Set 1.2: A 121 THR OG1 : rot 80:sc= 1.25 USER MOD Set 2.1: A 98 GLN : amide:sc= -0.3 K(o=-0.59,f=-2.8!) USER MOD Set 2.2: A 99 ASN : amide:sc= -0.293 K(o=-0.59,f=-3.7) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 SER OG : rot 180:sc= -0.0244 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= -0.192 X(o=-0.19,f=-0.19) USER MOD Single : A 14 ASN : amide:sc= -0.147 K(o=-0.15,f=-0.87) USER MOD Single : A 15 GLN : amide:sc= -0.0479 X(o=-0.048,f=-0.048) USER MOD Single : A 32 GLN : amide:sc= -0.0947 X(o=-0.095,f=-0.12) USER MOD Single : A 39 HIS : no HE2:sc= 0.68 K(o=0.68,f=-2.1!) USER MOD Single : A 40 GLN : amide:sc= 0.233 X(o=0.23,f=0) USER MOD Single : A 45 CYS SG : rot 180:sc= -0.0379 USER MOD Single : A 48 SER OG : rot -86:sc= 0.88 USER MOD Single : A 50 GLN : amide:sc= 0.0356 X(o=0.036,f=-0.25) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 57 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 166:sc= 0.825 (180deg=0.641) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ -120:sc= -0.199 (180deg=-0.575) USER MOD Single : A 95 TYR OH : rot 16:sc= 1.07 USER MOD Single : A 96 LYS NZ :NH3+ 179:sc= 0.595 (180deg=0.584) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.414 USER MOD Single : A 102 MET CE :methyl 180:sc= -0.635 (180deg=-0.635) USER MOD Single : A 119 ASN : amide:sc= 0.354 X(o=0.35,f=-0.009) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= 0.39 K(o=0.39,f=-3.6!) USER MOD Single : A 134 THR OG1 : rot -3:sc= 0.882 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 83.842 11.233 -3.710 1.00 73.41 N ATOM 35 CA HIS A 3 83.503 11.918 -2.471 1.00 43.13 C ATOM 36 C HIS A 3 82.078 12.480 -2.512 1.00 14.15 C ATOM 37 O HIS A 3 81.878 13.690 -2.608 1.00 74.32 O ATOM 38 CB HIS A 3 84.565 12.976 -2.139 1.00 34.12 C ATOM 39 CG HIS A 3 84.409 13.549 -0.754 1.00 3.21 C ATOM 40 ND1 HIS A 3 84.794 12.857 0.385 1.00 21.22 N ATOM 41 CD2 HIS A 3 83.892 14.738 -0.297 1.00 41.32 C ATOM 42 CE1 HIS A 3 84.506 13.635 1.442 1.00 51.41 C ATOM 43 NE2 HIS A 3 83.951 14.798 1.093 1.00 53.14 N ATOM 0 HA HIS A 3 83.510 11.196 -1.655 1.00 43.13 H new ATOM 0 HB2 HIS A 3 85.556 12.531 -2.233 1.00 34.12 H new ATOM 0 HB3 HIS A 3 84.507 13.783 -2.869 1.00 34.12 H new ATOM 0 HD2 HIS A 3 83.495 15.518 -0.929 1.00 41.32 H new ATOM 0 HE1 HIS A 3 84.703 13.350 2.465 1.00 51.41 H new ATOM 0 HE2 HIS A 3 83.642 15.555 1.703 1.00 53.14 H new ATOM 51 N ASN A 4 81.087 11.584 -2.424 1.00 51.44 N ATOM 52 CA ASN A 4 79.672 11.921 -2.333 1.00 25.45 C ATOM 53 C ASN A 4 79.003 11.008 -1.308 1.00 62.30 C ATOM 54 O ASN A 4 79.479 9.902 -1.049 1.00 1.01 O ATOM 55 CB ASN A 4 78.989 11.778 -3.700 1.00 1.20 C ATOM 56 CG ASN A 4 79.445 12.847 -4.690 1.00 11.44 C ATOM 57 OD1 ASN A 4 78.848 13.917 -4.767 1.00 61.22 O ATOM 58 ND2 ASN A 4 80.498 12.557 -5.456 1.00 54.12 N ATOM 0 H ASN A 4 81.258 10.579 -2.414 1.00 51.44 H new ATOM 0 HA ASN A 4 79.573 12.959 -2.016 1.00 25.45 H new ATOM 0 HB2 ASN A 4 79.204 10.791 -4.110 1.00 1.20 H new ATOM 0 HB3 ASN A 4 77.908 11.842 -3.572 1.00 1.20 H new ATOM 0 HD21 ASN A 4 80.835 13.237 -6.138 1.00 54.12 H new ATOM 0 HD22 ASN A 4 80.966 11.656 -5.360 1.00 54.12 H new ATOM 65 N SER A 5 77.895 11.485 -0.729 1.00 51.10 N ATOM 66 CA SER A 5 77.103 10.762 0.257 1.00 54.52 C ATOM 67 C SER A 5 75.652 11.241 0.187 1.00 51.44 C ATOM 68 O SER A 5 74.738 10.428 0.065 1.00 23.42 O ATOM 69 CB SER A 5 77.684 10.959 1.663 1.00 10.12 C ATOM 70 OG SER A 5 79.036 10.552 1.717 1.00 53.04 O ATOM 0 H SER A 5 77.520 12.409 -0.943 1.00 51.10 H new ATOM 0 HA SER A 5 77.133 9.695 0.036 1.00 54.52 H new ATOM 0 HB2 SER A 5 77.605 12.008 1.949 1.00 10.12 H new ATOM 0 HB3 SER A 5 77.100 10.388 2.384 1.00 10.12 H new ATOM 0 HG SER A 5 79.383 10.689 2.623 1.00 53.04 H new ATOM 76 N ILE A 6 75.452 12.564 0.265 1.00 54.35 N ATOM 77 CA ILE A 6 74.166 13.232 0.093 1.00 33.54 C ATOM 78 C ILE A 6 73.173 12.750 1.157 1.00 13.43 C ATOM 79 O ILE A 6 72.260 11.979 0.869 1.00 4.11 O ATOM 80 CB ILE A 6 73.649 13.087 -1.358 1.00 72.13 C ATOM 81 CG1 ILE A 6 74.756 13.444 -2.373 1.00 33.34 C ATOM 82 CG2 ILE A 6 72.429 13.999 -1.569 1.00 14.02 C ATOM 83 CD1 ILE A 6 74.304 13.334 -3.832 1.00 3.25 C ATOM 0 H ILE A 6 76.212 13.217 0.457 1.00 54.35 H new ATOM 0 HA ILE A 6 74.291 14.304 0.249 1.00 33.54 H new ATOM 0 HB ILE A 6 73.357 12.049 -1.520 1.00 72.13 H new ATOM 0 HG12 ILE A 6 75.099 14.461 -2.183 1.00 33.34 H new ATOM 0 HG13 ILE A 6 75.610 12.785 -2.215 1.00 33.34 H new ATOM 0 HG21 ILE A 6 72.068 13.893 -2.592 1.00 14.02 H new ATOM 0 HG22 ILE A 6 71.638 13.715 -0.875 1.00 14.02 H new ATOM 0 HG23 ILE A 6 72.714 15.036 -1.390 1.00 14.02 H new ATOM 0 HD11 ILE A 6 75.131 13.599 -4.490 1.00 3.25 H new ATOM 0 HD12 ILE A 6 73.989 12.311 -4.039 1.00 3.25 H new ATOM 0 HD13 ILE A 6 73.470 14.013 -4.007 1.00 3.25 H new ATOM 95 N ARG A 7 73.373 13.204 2.401 1.00 5.13 N ATOM 96 CA ARG A 7 72.449 12.991 3.507 1.00 34.10 C ATOM 97 C ARG A 7 71.521 14.206 3.562 1.00 62.30 C ATOM 98 O ARG A 7 71.887 15.238 4.123 1.00 40.22 O ATOM 99 CB ARG A 7 73.220 12.819 4.828 1.00 71.00 C ATOM 100 CG ARG A 7 73.590 11.369 5.174 1.00 33.31 C ATOM 101 CD ARG A 7 74.600 10.702 4.231 1.00 42.53 C ATOM 102 NE ARG A 7 74.003 10.268 2.960 1.00 12.00 N ATOM 103 CZ ARG A 7 73.164 9.235 2.780 1.00 4.25 C ATOM 104 NH1 ARG A 7 72.769 8.474 3.810 1.00 3.12 N ATOM 105 NH2 ARG A 7 72.722 8.965 1.545 1.00 53.24 N ATOM 0 H ARG A 7 74.200 13.739 2.665 1.00 5.13 H new ATOM 0 HA ARG A 7 71.868 12.081 3.359 1.00 34.10 H new ATOM 0 HB2 ARG A 7 74.134 13.410 4.778 1.00 71.00 H new ATOM 0 HB3 ARG A 7 72.619 13.229 5.639 1.00 71.00 H new ATOM 0 HG2 ARG A 7 73.995 11.347 6.186 1.00 33.31 H new ATOM 0 HG3 ARG A 7 72.678 10.772 5.183 1.00 33.31 H new ATOM 0 HD2 ARG A 7 75.411 11.400 4.025 1.00 42.53 H new ATOM 0 HD3 ARG A 7 75.041 9.840 4.732 1.00 42.53 H new ATOM 0 HE ARG A 7 74.251 10.806 2.130 1.00 12.00 H new ATOM 0 HH11 ARG A 7 73.106 8.675 4.751 1.00 3.12 H new ATOM 0 HH12 ARG A 7 72.131 7.694 3.653 1.00 3.12 H new ATOM 0 HH21 ARG A 7 73.023 9.540 0.758 1.00 53.24 H new ATOM 0 HH22 ARG A 7 72.084 8.184 1.391 1.00 53.24 H new ATOM 119 N SER A 8 70.329 14.086 2.967 1.00 22.04 N ATOM 120 CA SER A 8 69.331 15.146 2.924 1.00 52.03 C ATOM 121 C SER A 8 67.936 14.529 2.820 1.00 12.53 C ATOM 122 O SER A 8 67.741 13.581 2.059 1.00 63.22 O ATOM 123 CB SER A 8 69.616 16.079 1.741 1.00 22.02 C ATOM 124 OG SER A 8 69.674 15.349 0.533 1.00 44.22 O ATOM 0 H SER A 8 70.031 13.232 2.495 1.00 22.04 H new ATOM 0 HA SER A 8 69.378 15.737 3.839 1.00 52.03 H new ATOM 0 HB2 SER A 8 68.838 16.839 1.675 1.00 22.02 H new ATOM 0 HB3 SER A 8 70.559 16.601 1.902 1.00 22.02 H new ATOM 0 HG SER A 8 69.855 15.961 -0.211 1.00 44.22 H new ATOM 130 N GLY A 9 66.973 15.065 3.578 1.00 32.04 N ATOM 131 CA GLY A 9 65.602 14.583 3.591 1.00 61.50 C ATOM 132 C GLY A 9 64.757 15.378 4.585 1.00 70.10 C ATOM 133 O GLY A 9 65.271 16.253 5.282 1.00 31.51 O ATOM 0 H GLY A 9 67.133 15.854 4.204 1.00 32.04 H new ATOM 0 HA2 GLY A 9 65.173 14.667 2.593 1.00 61.50 H new ATOM 0 HA3 GLY A 9 65.586 13.526 3.857 1.00 61.50 H new ATOM 137 N HIS A 10 63.457 15.066 4.645 1.00 14.53 N ATOM 138 CA HIS A 10 62.497 15.709 5.532 1.00 1.52 C ATOM 139 C HIS A 10 61.262 14.817 5.689 1.00 31.32 C ATOM 140 O HIS A 10 60.930 14.045 4.790 1.00 72.23 O ATOM 141 CB HIS A 10 62.109 17.086 4.969 1.00 0.03 C ATOM 142 CG HIS A 10 60.991 17.755 5.729 1.00 14.53 C ATOM 143 ND1 HIS A 10 61.136 18.205 7.034 1.00 42.42 N ATOM 144 CD2 HIS A 10 59.675 17.988 5.409 1.00 31.43 C ATOM 145 CE1 HIS A 10 59.938 18.672 7.427 1.00 43.52 C ATOM 146 NE2 HIS A 10 59.003 18.565 6.481 1.00 62.34 N ATOM 0 H HIS A 10 63.039 14.341 4.061 1.00 14.53 H new ATOM 0 HA HIS A 10 62.947 15.853 6.514 1.00 1.52 H new ATOM 0 HB2 HIS A 10 62.985 17.735 4.982 1.00 0.03 H new ATOM 0 HB3 HIS A 10 61.812 16.973 3.927 1.00 0.03 H new ATOM 0 HD2 HIS A 10 59.224 17.755 4.456 1.00 31.43 H new ATOM 0 HE1 HIS A 10 59.752 19.090 8.405 1.00 43.52 H new ATOM 0 HE2 HIS A 10 58.023 18.842 6.532 1.00 62.34 H new ATOM 154 N GLY A 11 60.576 14.952 6.829 1.00 31.23 N ATOM 155 CA GLY A 11 59.284 14.347 7.102 1.00 12.42 C ATOM 156 C GLY A 11 58.569 15.169 8.173 1.00 20.04 C ATOM 157 O GLY A 11 59.221 15.817 8.992 1.00 43.13 O ATOM 0 H GLY A 11 60.925 15.507 7.610 1.00 31.23 H new ATOM 0 HA2 GLY A 11 58.685 14.311 6.192 1.00 12.42 H new ATOM 0 HA3 GLY A 11 59.413 13.319 7.440 1.00 12.42 H new ATOM 161 N GLY A 12 57.231 15.157 8.162 1.00 13.24 N ATOM 162 CA GLY A 12 56.425 15.925 9.098 1.00 1.30 C ATOM 163 C GLY A 12 54.942 15.661 8.859 1.00 34.30 C ATOM 164 O GLY A 12 54.341 16.288 7.989 1.00 51.54 O ATOM 0 H GLY A 12 56.682 14.610 7.499 1.00 13.24 H new ATOM 0 HA2 GLY A 12 56.689 15.657 10.121 1.00 1.30 H new ATOM 0 HA3 GLY A 12 56.635 16.988 8.983 1.00 1.30 H new ATOM 168 N LEU A 13 54.362 14.732 9.631 1.00 64.45 N ATOM 169 CA LEU A 13 52.957 14.348 9.560 1.00 75.00 C ATOM 170 C LEU A 13 52.280 14.646 10.900 1.00 72.23 C ATOM 171 O LEU A 13 52.923 14.584 11.947 1.00 51.40 O ATOM 172 CB LEU A 13 52.820 12.861 9.193 1.00 14.44 C ATOM 173 CG LEU A 13 53.380 12.528 7.796 1.00 34.43 C ATOM 174 CD1 LEU A 13 54.857 12.110 7.846 1.00 2.30 C ATOM 175 CD2 LEU A 13 52.582 11.380 7.168 1.00 31.13 C ATOM 0 H LEU A 13 54.879 14.215 10.342 1.00 64.45 H new ATOM 0 HA LEU A 13 52.465 14.928 8.779 1.00 75.00 H new ATOM 0 HB2 LEU A 13 53.340 12.260 9.939 1.00 14.44 H new ATOM 0 HB3 LEU A 13 51.768 12.579 9.233 1.00 14.44 H new ATOM 0 HG LEU A 13 53.292 13.436 7.199 1.00 34.43 H new ATOM 0 HD11 LEU A 13 55.206 11.886 6.838 1.00 2.30 H new ATOM 0 HD12 LEU A 13 55.451 12.923 8.263 1.00 2.30 H new ATOM 0 HD13 LEU A 13 54.963 11.224 8.472 1.00 2.30 H new ATOM 0 HD21 LEU A 13 52.986 11.153 6.181 1.00 31.13 H new ATOM 0 HD22 LEU A 13 52.655 10.496 7.802 1.00 31.13 H new ATOM 0 HD23 LEU A 13 51.536 11.673 7.073 1.00 31.13 H new ATOM 187 N ASN A 14 50.986 14.984 10.857 1.00 35.55 N ATOM 188 CA ASN A 14 50.197 15.389 12.012 1.00 33.01 C ATOM 189 C ASN A 14 48.720 15.102 11.716 1.00 5.21 C ATOM 190 O ASN A 14 48.270 15.320 10.593 1.00 10.43 O ATOM 191 CB ASN A 14 50.459 16.878 12.288 1.00 53.24 C ATOM 192 CG ASN A 14 49.578 17.460 13.392 1.00 60.42 C ATOM 193 OD1 ASN A 14 49.068 18.569 13.253 1.00 74.14 O ATOM 194 ND2 ASN A 14 49.397 16.724 14.490 1.00 42.32 N ATOM 0 H ASN A 14 50.449 14.981 9.990 1.00 35.55 H new ATOM 0 HA ASN A 14 50.475 14.831 12.906 1.00 33.01 H new ATOM 0 HB2 ASN A 14 51.506 17.009 12.563 1.00 53.24 H new ATOM 0 HB3 ASN A 14 50.297 17.443 11.370 1.00 53.24 H new ATOM 0 HD21 ASN A 14 48.818 17.078 15.251 1.00 42.32 H new ATOM 0 HD22 ASN A 14 49.838 15.807 14.568 1.00 42.32 H new ATOM 201 N GLN A 15 47.989 14.564 12.704 1.00 52.44 N ATOM 202 CA GLN A 15 46.649 14.022 12.512 1.00 4.40 C ATOM 203 C GLN A 15 45.564 15.083 12.724 1.00 22.01 C ATOM 204 O GLN A 15 44.796 15.356 11.802 1.00 1.11 O ATOM 205 CB GLN A 15 46.429 12.803 13.424 1.00 34.42 C ATOM 206 CG GLN A 15 47.448 11.673 13.213 1.00 22.41 C ATOM 207 CD GLN A 15 47.421 11.131 11.787 1.00 34.25 C ATOM 208 OE1 GLN A 15 46.583 10.297 11.453 1.00 60.52 O ATOM 209 NE2 GLN A 15 48.337 11.604 10.937 1.00 41.11 N ATOM 0 H GLN A 15 48.321 14.496 13.666 1.00 52.44 H new ATOM 0 HA GLN A 15 46.567 13.696 11.475 1.00 4.40 H new ATOM 0 HB2 GLN A 15 46.472 13.128 14.464 1.00 34.42 H new ATOM 0 HB3 GLN A 15 45.426 12.411 13.254 1.00 34.42 H new ATOM 0 HG2 GLN A 15 48.448 12.041 13.441 1.00 22.41 H new ATOM 0 HG3 GLN A 15 47.239 10.863 13.912 1.00 22.41 H new ATOM 0 HE21 GLN A 15 49.016 12.296 11.253 1.00 41.11 H new ATOM 0 HE22 GLN A 15 48.357 11.273 9.972 1.00 41.11 H new ATOM 218 N LEU A 16 45.474 15.648 13.936 1.00 65.55 N ATOM 219 CA LEU A 16 44.374 16.507 14.368 1.00 21.43 C ATOM 220 C LEU A 16 43.025 15.784 14.217 1.00 12.20 C ATOM 221 O LEU A 16 42.955 14.571 14.414 1.00 53.14 O ATOM 222 CB LEU A 16 44.423 17.882 13.677 1.00 40.43 C ATOM 223 CG LEU A 16 45.785 18.588 13.769 1.00 10.42 C ATOM 224 CD1 LEU A 16 45.697 19.930 13.034 1.00 74.44 C ATOM 225 CD2 LEU A 16 46.202 18.834 15.225 1.00 55.21 C ATOM 0 H LEU A 16 46.183 15.514 14.657 1.00 65.55 H new ATOM 0 HA LEU A 16 44.491 16.715 15.432 1.00 21.43 H new ATOM 0 HB2 LEU A 16 44.162 17.757 12.626 1.00 40.43 H new ATOM 0 HB3 LEU A 16 43.663 18.525 14.120 1.00 40.43 H new ATOM 0 HG LEU A 16 46.536 17.944 13.311 1.00 10.42 H new ATOM 0 HD11 LEU A 16 46.658 20.441 13.092 1.00 74.44 H new ATOM 0 HD12 LEU A 16 45.441 19.756 11.989 1.00 74.44 H new ATOM 0 HD13 LEU A 16 44.929 20.549 13.497 1.00 74.44 H new ATOM 0 HD21 LEU A 16 47.170 19.335 15.247 1.00 55.21 H new ATOM 0 HD22 LEU A 16 45.458 19.461 15.716 1.00 55.21 H new ATOM 0 HD23 LEU A 16 46.275 17.881 15.749 1.00 55.21 H new ATOM 375 N PRO A 27 30.998 13.225 20.584 1.00 32.03 N ATOM 376 CA PRO A 27 30.722 12.515 19.344 1.00 71.33 C ATOM 377 C PRO A 27 31.968 11.745 18.888 1.00 42.44 C ATOM 378 O PRO A 27 33.043 11.900 19.465 1.00 73.03 O ATOM 379 CB PRO A 27 30.287 13.595 18.347 1.00 35.23 C ATOM 380 CG PRO A 27 31.019 14.843 18.838 1.00 62.50 C ATOM 381 CD PRO A 27 31.027 14.660 20.355 1.00 11.11 C ATOM 0 HA PRO A 27 29.940 11.763 19.448 1.00 71.33 H new ATOM 0 HB2 PRO A 27 30.571 13.338 17.326 1.00 35.23 H new ATOM 0 HB3 PRO A 27 29.206 13.735 18.352 1.00 35.23 H new ATOM 0 HG2 PRO A 27 32.029 14.904 18.433 1.00 62.50 H new ATOM 0 HG3 PRO A 27 30.502 15.756 18.544 1.00 62.50 H new ATOM 0 HD2 PRO A 27 31.917 15.108 20.798 1.00 11.11 H new ATOM 0 HD3 PRO A 27 30.165 15.146 20.811 1.00 11.11 H new ATOM 389 N GLU A 28 31.810 10.894 17.865 1.00 53.21 N ATOM 390 CA GLU A 28 32.787 9.883 17.462 1.00 70.13 C ATOM 391 C GLU A 28 34.185 10.438 17.146 1.00 15.14 C ATOM 392 O GLU A 28 35.166 9.700 17.233 1.00 12.43 O ATOM 393 CB GLU A 28 32.200 9.058 16.309 1.00 34.13 C ATOM 394 CG GLU A 28 33.064 7.837 15.979 1.00 54.33 C ATOM 395 CD GLU A 28 32.262 6.779 15.231 1.00 44.33 C ATOM 396 OE1 GLU A 28 32.156 6.911 13.992 1.00 1.12 O ATOM 397 OE2 GLU A 28 31.762 5.858 15.915 1.00 64.15 O ATOM 0 H GLU A 28 30.974 10.893 17.281 1.00 53.21 H new ATOM 0 HA GLU A 28 32.965 9.235 18.320 1.00 70.13 H new ATOM 0 HB2 GLU A 28 31.195 8.730 16.573 1.00 34.13 H new ATOM 0 HB3 GLU A 28 32.108 9.687 15.423 1.00 34.13 H new ATOM 0 HG2 GLU A 28 33.917 8.145 15.375 1.00 54.33 H new ATOM 0 HG3 GLU A 28 33.463 7.411 16.900 1.00 54.33 H new ATOM 404 N VAL A 29 34.292 11.737 16.837 1.00 54.41 N ATOM 405 CA VAL A 29 35.555 12.455 16.678 1.00 52.32 C ATOM 406 C VAL A 29 36.513 12.228 17.861 1.00 72.25 C ATOM 407 O VAL A 29 37.728 12.259 17.678 1.00 41.14 O ATOM 408 CB VAL A 29 35.255 13.950 16.460 1.00 75.31 C ATOM 409 CG1 VAL A 29 34.882 14.654 17.772 1.00 23.22 C ATOM 410 CG2 VAL A 29 36.439 14.675 15.812 1.00 34.14 C ATOM 0 H VAL A 29 33.476 12.331 16.687 1.00 54.41 H new ATOM 0 HA VAL A 29 36.073 12.061 15.804 1.00 52.32 H new ATOM 0 HB VAL A 29 34.401 13.996 15.784 1.00 75.31 H new ATOM 0 HG11 VAL A 29 34.678 15.706 17.575 1.00 23.22 H new ATOM 0 HG12 VAL A 29 33.994 14.186 18.197 1.00 23.22 H new ATOM 0 HG13 VAL A 29 35.709 14.571 18.477 1.00 23.22 H new ATOM 0 HG21 VAL A 29 36.190 15.727 15.674 1.00 34.14 H new ATOM 0 HG22 VAL A 29 37.314 14.591 16.456 1.00 34.14 H new ATOM 0 HG23 VAL A 29 36.656 14.224 14.844 1.00 34.14 H new ATOM 420 N VAL A 30 35.970 11.992 19.065 1.00 50.13 N ATOM 421 CA VAL A 30 36.733 11.690 20.269 1.00 64.15 C ATOM 422 C VAL A 30 37.693 10.517 20.057 1.00 33.53 C ATOM 423 O VAL A 30 38.812 10.561 20.563 1.00 3.52 O ATOM 424 CB VAL A 30 35.782 11.467 21.459 1.00 4.14 C ATOM 425 CG1 VAL A 30 34.952 10.189 21.334 1.00 0.42 C ATOM 426 CG2 VAL A 30 36.546 11.431 22.789 1.00 75.55 C ATOM 0 H VAL A 30 34.963 12.008 19.224 1.00 50.13 H new ATOM 0 HA VAL A 30 37.361 12.550 20.503 1.00 64.15 H new ATOM 0 HB VAL A 30 35.100 12.317 21.445 1.00 4.14 H new ATOM 0 HG11 VAL A 30 34.303 10.090 22.204 1.00 0.42 H new ATOM 0 HG12 VAL A 30 34.344 10.237 20.431 1.00 0.42 H new ATOM 0 HG13 VAL A 30 35.617 9.327 21.278 1.00 0.42 H new ATOM 0 HG21 VAL A 30 35.844 11.272 23.608 1.00 75.55 H new ATOM 0 HG22 VAL A 30 37.271 10.618 22.770 1.00 75.55 H new ATOM 0 HG23 VAL A 30 37.066 12.378 22.936 1.00 75.55 H new ATOM 436 N ARG A 31 37.291 9.497 19.284 1.00 15.43 N ATOM 437 CA ARG A 31 38.158 8.374 18.951 1.00 33.30 C ATOM 438 C ARG A 31 39.454 8.917 18.343 1.00 45.31 C ATOM 439 O ARG A 31 40.545 8.638 18.835 1.00 10.24 O ATOM 440 CB ARG A 31 37.448 7.417 17.973 1.00 22.34 C ATOM 441 CG ARG A 31 37.808 5.934 18.151 1.00 0.04 C ATOM 442 CD ARG A 31 39.307 5.608 18.060 1.00 32.54 C ATOM 443 NE ARG A 31 40.006 5.878 19.326 1.00 53.32 N ATOM 444 CZ ARG A 31 39.878 5.158 20.455 1.00 14.45 C ATOM 445 NH1 ARG A 31 39.191 4.007 20.471 1.00 32.20 N ATOM 446 NH2 ARG A 31 40.434 5.594 21.591 1.00 73.34 N ATOM 0 H ARG A 31 36.358 9.434 18.877 1.00 15.43 H new ATOM 0 HA ARG A 31 38.393 7.808 19.852 1.00 33.30 H new ATOM 0 HB2 ARG A 31 36.371 7.532 18.091 1.00 22.34 H new ATOM 0 HB3 ARG A 31 37.690 7.716 16.953 1.00 22.34 H new ATOM 0 HG2 ARG A 31 37.439 5.601 19.121 1.00 0.04 H new ATOM 0 HG3 ARG A 31 37.280 5.355 17.393 1.00 0.04 H new ATOM 0 HD2 ARG A 31 39.435 4.559 17.792 1.00 32.54 H new ATOM 0 HD3 ARG A 31 39.759 6.198 17.263 1.00 32.54 H new ATOM 0 HE ARG A 31 40.640 6.677 19.350 1.00 53.32 H new ATOM 0 HH11 ARG A 31 38.754 3.662 19.616 1.00 32.20 H new ATOM 0 HH12 ARG A 31 39.106 3.476 21.338 1.00 32.20 H new ATOM 0 HH21 ARG A 31 40.954 6.471 21.600 1.00 73.34 H new ATOM 0 HH22 ARG A 31 40.338 5.049 22.448 1.00 73.34 H new ATOM 460 N GLN A 32 39.310 9.733 17.292 1.00 54.43 N ATOM 461 CA GLN A 32 40.416 10.312 16.550 1.00 74.42 C ATOM 462 C GLN A 32 41.206 11.320 17.389 1.00 2.41 C ATOM 463 O GLN A 32 42.411 11.440 17.190 1.00 44.44 O ATOM 464 CB GLN A 32 39.913 10.945 15.244 1.00 63.21 C ATOM 465 CG GLN A 32 39.213 9.945 14.312 1.00 63.04 C ATOM 466 CD GLN A 32 40.078 8.733 13.979 1.00 21.01 C ATOM 467 OE1 GLN A 32 41.259 8.871 13.669 1.00 71.22 O ATOM 468 NE2 GLN A 32 39.489 7.539 14.036 1.00 13.32 N ATOM 0 H GLN A 32 38.397 10.010 16.932 1.00 54.43 H new ATOM 0 HA GLN A 32 41.104 9.505 16.299 1.00 74.42 H new ATOM 0 HB2 GLN A 32 39.221 11.753 15.483 1.00 63.21 H new ATOM 0 HB3 GLN A 32 40.756 11.392 14.717 1.00 63.21 H new ATOM 0 HG2 GLN A 32 38.288 9.607 14.780 1.00 63.04 H new ATOM 0 HG3 GLN A 32 38.936 10.451 13.387 1.00 63.04 H new ATOM 0 HE21 GLN A 32 38.506 7.467 14.298 1.00 13.32 H new ATOM 0 HE22 GLN A 32 40.021 6.697 13.818 1.00 13.32 H new ATOM 477 N ARG A 33 40.566 12.022 18.335 1.00 34.20 N ATOM 478 CA ARG A 33 41.281 12.929 19.230 1.00 11.32 C ATOM 479 C ARG A 33 42.271 12.156 20.106 1.00 25.30 C ATOM 480 O ARG A 33 43.398 12.605 20.306 1.00 4.21 O ATOM 481 CB ARG A 33 40.317 13.840 20.017 1.00 51.43 C ATOM 482 CG ARG A 33 40.195 13.593 21.529 1.00 61.34 C ATOM 483 CD ARG A 33 39.188 14.565 22.164 1.00 12.00 C ATOM 484 NE ARG A 33 39.550 15.973 21.939 1.00 60.04 N ATOM 485 CZ ARG A 33 38.854 17.034 22.378 1.00 63.34 C ATOM 486 NH1 ARG A 33 37.794 16.879 23.184 1.00 4.21 N ATOM 487 NH2 ARG A 33 39.222 18.263 21.997 1.00 44.40 N ATOM 0 H ARG A 33 39.560 11.976 18.496 1.00 34.20 H new ATOM 0 HA ARG A 33 41.880 13.613 18.629 1.00 11.32 H new ATOM 0 HB2 ARG A 33 40.631 14.873 19.868 1.00 51.43 H new ATOM 0 HB3 ARG A 33 39.324 13.742 19.577 1.00 51.43 H new ATOM 0 HG2 ARG A 33 39.878 12.566 21.709 1.00 61.34 H new ATOM 0 HG3 ARG A 33 41.170 13.713 22.001 1.00 61.34 H new ATOM 0 HD2 ARG A 33 38.196 14.377 21.752 1.00 12.00 H new ATOM 0 HD3 ARG A 33 39.129 14.374 23.236 1.00 12.00 H new ATOM 0 HE ARG A 33 40.399 16.158 21.406 1.00 60.04 H new ATOM 0 HH11 ARG A 33 37.505 15.944 23.473 1.00 4.21 H new ATOM 0 HH12 ARG A 33 37.276 17.696 23.508 1.00 4.21 H new ATOM 0 HH21 ARG A 33 40.024 18.387 21.379 1.00 44.40 H new ATOM 0 HH22 ARG A 33 38.700 19.076 22.324 1.00 44.40 H new ATOM 501 N ILE A 34 41.865 10.980 20.601 1.00 14.04 N ATOM 502 CA ILE A 34 42.747 10.108 21.364 1.00 74.12 C ATOM 503 C ILE A 34 43.850 9.521 20.476 1.00 22.14 C ATOM 504 O ILE A 34 44.959 9.327 20.961 1.00 33.01 O ATOM 505 CB ILE A 34 41.934 9.028 22.098 1.00 44.44 C ATOM 506 CG1 ILE A 34 40.933 9.625 23.104 1.00 73.22 C ATOM 507 CG2 ILE A 34 42.846 8.024 22.820 1.00 13.10 C ATOM 508 CD1 ILE A 34 41.538 10.574 24.147 1.00 3.10 C ATOM 0 H ILE A 34 40.921 10.614 20.481 1.00 14.04 H new ATOM 0 HA ILE A 34 43.252 10.700 22.127 1.00 74.12 H new ATOM 0 HB ILE A 34 41.370 8.506 21.325 1.00 44.44 H new ATOM 0 HG12 ILE A 34 40.164 10.163 22.550 1.00 73.22 H new ATOM 0 HG13 ILE A 34 40.436 8.807 23.626 1.00 73.22 H new ATOM 0 HG21 ILE A 34 42.235 7.277 23.327 1.00 13.10 H new ATOM 0 HG22 ILE A 34 43.493 7.532 22.093 1.00 13.10 H new ATOM 0 HG23 ILE A 34 43.458 8.550 23.553 1.00 13.10 H new ATOM 0 HD11 ILE A 34 40.751 10.939 24.807 1.00 3.10 H new ATOM 0 HD12 ILE A 34 42.285 10.040 24.734 1.00 3.10 H new ATOM 0 HD13 ILE A 34 42.008 11.418 23.642 1.00 3.10 H new ATOM 520 N VAL A 35 43.582 9.253 19.190 1.00 15.14 N ATOM 521 CA VAL A 35 44.615 8.803 18.258 1.00 34.44 C ATOM 522 C VAL A 35 45.664 9.905 18.048 1.00 43.25 C ATOM 523 O VAL A 35 46.859 9.640 18.176 1.00 24.10 O ATOM 524 CB VAL A 35 43.984 8.324 16.938 1.00 20.23 C ATOM 525 CG1 VAL A 35 45.056 7.972 15.900 1.00 44.34 C ATOM 526 CG2 VAL A 35 43.129 7.072 17.171 1.00 11.31 C ATOM 0 H VAL A 35 42.655 9.342 18.775 1.00 15.14 H new ATOM 0 HA VAL A 35 45.135 7.946 18.686 1.00 34.44 H new ATOM 0 HB VAL A 35 43.369 9.144 16.567 1.00 20.23 H new ATOM 0 HG11 VAL A 35 44.576 7.638 14.980 1.00 44.34 H new ATOM 0 HG12 VAL A 35 45.664 8.852 15.692 1.00 44.34 H new ATOM 0 HG13 VAL A 35 45.691 7.176 16.288 1.00 44.34 H new ATOM 0 HG21 VAL A 35 42.692 6.749 16.226 1.00 11.31 H new ATOM 0 HG22 VAL A 35 43.754 6.274 17.573 1.00 11.31 H new ATOM 0 HG23 VAL A 35 42.333 7.302 17.879 1.00 11.31 H new ATOM 536 N ASP A 36 45.223 11.132 17.740 1.00 34.13 N ATOM 537 CA ASP A 36 46.078 12.304 17.572 1.00 14.44 C ATOM 538 C ASP A 36 46.970 12.507 18.797 1.00 64.33 C ATOM 539 O ASP A 36 48.182 12.667 18.666 1.00 34.43 O ATOM 540 CB ASP A 36 45.203 13.541 17.330 1.00 41.41 C ATOM 541 CG ASP A 36 46.030 14.822 17.232 1.00 24.13 C ATOM 542 OD1 ASP A 36 46.861 14.903 16.301 1.00 54.01 O ATOM 543 OD2 ASP A 36 45.817 15.702 18.095 1.00 23.42 O ATOM 0 H ASP A 36 44.234 11.337 17.598 1.00 34.13 H new ATOM 0 HA ASP A 36 46.728 12.149 16.711 1.00 14.44 H new ATOM 0 HB2 ASP A 36 44.633 13.407 16.410 1.00 41.41 H new ATOM 0 HB3 ASP A 36 44.481 13.638 18.141 1.00 41.41 H new ATOM 548 N LEU A 37 46.362 12.469 19.988 1.00 45.44 N ATOM 549 CA LEU A 37 47.074 12.497 21.258 1.00 44.12 C ATOM 550 C LEU A 37 48.111 11.378 21.296 1.00 12.21 C ATOM 551 O LEU A 37 49.286 11.652 21.514 1.00 24.41 O ATOM 552 CB LEU A 37 46.053 12.408 22.405 1.00 4.13 C ATOM 553 CG LEU A 37 46.618 12.432 23.839 1.00 43.31 C ATOM 554 CD1 LEU A 37 45.462 12.761 24.793 1.00 73.22 C ATOM 555 CD2 LEU A 37 47.231 11.099 24.282 1.00 52.23 C ATOM 0 H LEU A 37 45.349 12.417 20.092 1.00 45.44 H new ATOM 0 HA LEU A 37 47.620 13.433 21.375 1.00 44.12 H new ATOM 0 HB2 LEU A 37 45.352 13.236 22.302 1.00 4.13 H new ATOM 0 HB3 LEU A 37 45.481 11.489 22.280 1.00 4.13 H new ATOM 0 HG LEU A 37 47.415 13.175 23.861 1.00 43.31 H new ATOM 0 HD11 LEU A 37 45.832 12.785 25.818 1.00 73.22 H new ATOM 0 HD12 LEU A 37 45.043 13.734 24.535 1.00 73.22 H new ATOM 0 HD13 LEU A 37 44.689 11.998 24.704 1.00 73.22 H new ATOM 0 HD21 LEU A 37 47.607 11.192 25.301 1.00 52.23 H new ATOM 0 HD22 LEU A 37 46.470 10.319 24.246 1.00 52.23 H new ATOM 0 HD23 LEU A 37 48.052 10.836 23.615 1.00 52.23 H new ATOM 567 N ALA A 38 47.680 10.127 21.098 1.00 41.31 N ATOM 568 CA ALA A 38 48.508 8.937 21.248 1.00 52.54 C ATOM 569 C ALA A 38 49.730 8.948 20.328 1.00 41.12 C ATOM 570 O ALA A 38 50.774 8.422 20.708 1.00 71.41 O ATOM 571 CB ALA A 38 47.662 7.681 21.022 1.00 75.14 C ATOM 0 H ALA A 38 46.721 9.915 20.822 1.00 41.31 H new ATOM 0 HA ALA A 38 48.893 8.933 22.268 1.00 52.54 H new ATOM 0 HB1 ALA A 38 48.288 6.796 21.136 1.00 75.14 H new ATOM 0 HB2 ALA A 38 46.854 7.650 21.753 1.00 75.14 H new ATOM 0 HB3 ALA A 38 47.242 7.702 20.017 1.00 75.14 H new ATOM 577 N HIS A 39 49.621 9.563 19.142 1.00 21.43 N ATOM 578 CA HIS A 39 50.728 9.734 18.216 1.00 43.32 C ATOM 579 C HIS A 39 51.893 10.530 18.824 1.00 2.24 C ATOM 580 O HIS A 39 53.021 10.371 18.359 1.00 64.21 O ATOM 581 CB HIS A 39 50.217 10.380 16.921 1.00 65.00 C ATOM 582 CG HIS A 39 49.713 9.389 15.903 1.00 64.41 C ATOM 583 ND1 HIS A 39 48.569 8.630 16.090 1.00 3.42 N ATOM 584 CD2 HIS A 39 50.200 9.010 14.675 1.00 40.33 C ATOM 585 CE1 HIS A 39 48.429 7.846 15.006 1.00 53.24 C ATOM 586 NE2 HIS A 39 49.391 8.034 14.102 1.00 23.14 N ATOM 0 H HIS A 39 48.744 9.958 18.802 1.00 21.43 H new ATOM 0 HA HIS A 39 51.132 8.747 17.989 1.00 43.32 H new ATOM 0 HB2 HIS A 39 49.414 11.075 17.165 1.00 65.00 H new ATOM 0 HB3 HIS A 39 51.022 10.966 16.476 1.00 65.00 H new ATOM 0 HD1 HIS A 39 47.949 8.660 16.899 1.00 3.42 H new ATOM 0 HD2 HIS A 39 51.090 9.415 14.217 1.00 40.33 H new ATOM 0 HE1 HIS A 39 47.622 7.139 14.881 1.00 53.24 H new ATOM 594 N GLN A 40 51.662 11.348 19.865 1.00 65.24 N ATOM 595 CA GLN A 40 52.749 12.011 20.583 1.00 42.23 C ATOM 596 C GLN A 40 53.657 10.996 21.292 1.00 40.11 C ATOM 597 O GLN A 40 54.836 11.273 21.504 1.00 64.34 O ATOM 598 CB GLN A 40 52.202 13.069 21.556 1.00 54.00 C ATOM 599 CG GLN A 40 51.872 12.533 22.959 1.00 73.11 C ATOM 600 CD GLN A 40 51.130 13.572 23.794 1.00 53.44 C ATOM 601 OE1 GLN A 40 51.664 14.087 24.773 1.00 23.20 O ATOM 602 NE2 GLN A 40 49.892 13.878 23.407 1.00 64.20 N ATOM 0 H GLN A 40 50.731 11.562 20.223 1.00 65.24 H new ATOM 0 HA GLN A 40 53.366 12.530 19.850 1.00 42.23 H new ATOM 0 HB2 GLN A 40 52.934 13.871 21.650 1.00 54.00 H new ATOM 0 HB3 GLN A 40 51.301 13.508 21.127 1.00 54.00 H new ATOM 0 HG2 GLN A 40 51.264 11.633 22.872 1.00 73.11 H new ATOM 0 HG3 GLN A 40 52.793 12.247 23.467 1.00 73.11 H new ATOM 0 HE21 GLN A 40 49.487 13.426 22.587 1.00 64.20 H new ATOM 0 HE22 GLN A 40 49.349 14.565 23.931 1.00 64.20 H new ATOM 611 N GLY A 41 53.104 9.834 21.665 1.00 12.33 N ATOM 612 CA GLY A 41 53.813 8.776 22.360 1.00 25.04 C ATOM 613 C GLY A 41 53.749 8.997 23.866 1.00 1.14 C ATOM 614 O GLY A 41 54.787 9.154 24.507 1.00 73.10 O ATOM 0 H GLY A 41 52.126 9.608 21.482 1.00 12.33 H new ATOM 0 HA2 GLY A 41 53.376 7.810 22.109 1.00 25.04 H new ATOM 0 HA3 GLY A 41 54.853 8.750 22.033 1.00 25.04 H new ATOM 618 N VAL A 42 52.532 8.993 24.427 1.00 14.01 N ATOM 619 CA VAL A 42 52.298 9.059 25.864 1.00 31.31 C ATOM 620 C VAL A 42 51.350 7.924 26.265 1.00 4.32 C ATOM 621 O VAL A 42 50.546 7.469 25.452 1.00 72.13 O ATOM 622 CB VAL A 42 51.780 10.460 26.235 1.00 51.20 C ATOM 623 CG1 VAL A 42 50.353 10.702 25.729 1.00 73.21 C ATOM 624 CG2 VAL A 42 51.846 10.703 27.746 1.00 1.40 C ATOM 0 H VAL A 42 51.672 8.943 23.880 1.00 14.01 H new ATOM 0 HA VAL A 42 53.221 8.915 26.425 1.00 31.31 H new ATOM 0 HB VAL A 42 52.440 11.171 25.738 1.00 51.20 H new ATOM 0 HG11 VAL A 42 50.031 11.703 26.015 1.00 73.21 H new ATOM 0 HG12 VAL A 42 50.331 10.610 24.643 1.00 73.21 H new ATOM 0 HG13 VAL A 42 49.681 9.965 26.169 1.00 73.21 H new ATOM 0 HG21 VAL A 42 51.472 11.702 27.971 1.00 1.40 H new ATOM 0 HG22 VAL A 42 51.234 9.962 28.261 1.00 1.40 H new ATOM 0 HG23 VAL A 42 52.879 10.618 28.083 1.00 1.40 H new ATOM 634 N ARG A 43 51.475 7.445 27.508 1.00 33.41 N ATOM 635 CA ARG A 43 50.733 6.302 28.019 1.00 24.32 C ATOM 636 C ARG A 43 49.222 6.571 28.006 1.00 63.32 C ATOM 637 O ARG A 43 48.804 7.720 28.141 1.00 71.33 O ATOM 638 CB ARG A 43 51.213 6.008 29.446 1.00 12.11 C ATOM 639 CG ARG A 43 52.710 5.677 29.534 1.00 14.44 C ATOM 640 CD ARG A 43 53.112 4.399 28.783 1.00 21.44 C ATOM 641 NE ARG A 43 52.263 3.247 29.121 1.00 25.40 N ATOM 642 CZ ARG A 43 52.292 2.557 30.275 1.00 31.45 C ATOM 643 NH1 ARG A 43 53.142 2.888 31.258 1.00 33.11 N ATOM 644 NH2 ARG A 43 51.459 1.522 30.444 1.00 5.51 N ATOM 0 H ARG A 43 52.109 7.854 28.195 1.00 33.41 H new ATOM 0 HA ARG A 43 50.915 5.439 27.378 1.00 24.32 H new ATOM 0 HB2 ARG A 43 51.003 6.872 30.077 1.00 12.11 H new ATOM 0 HB3 ARG A 43 50.640 5.172 29.848 1.00 12.11 H new ATOM 0 HG2 ARG A 43 53.281 6.515 29.135 1.00 14.44 H new ATOM 0 HG3 ARG A 43 52.988 5.572 30.583 1.00 14.44 H new ATOM 0 HD2 ARG A 43 53.058 4.582 27.710 1.00 21.44 H new ATOM 0 HD3 ARG A 43 54.150 4.159 29.013 1.00 21.44 H new ATOM 0 HE ARG A 43 51.591 2.944 28.416 1.00 25.40 H new ATOM 0 HH11 ARG A 43 53.780 3.674 31.137 1.00 33.11 H new ATOM 0 HH12 ARG A 43 53.150 2.353 32.127 1.00 33.11 H new ATOM 0 HH21 ARG A 43 50.810 1.263 29.701 1.00 5.51 H new ATOM 0 HH22 ARG A 43 51.474 0.993 31.316 1.00 5.51 H new ATOM 658 N PRO A 44 48.389 5.525 27.857 1.00 60.04 N ATOM 659 CA PRO A 44 46.940 5.654 27.824 1.00 43.50 C ATOM 660 C PRO A 44 46.394 6.121 29.177 1.00 5.23 C ATOM 661 O PRO A 44 45.476 6.936 29.224 1.00 20.22 O ATOM 662 CB PRO A 44 46.416 4.267 27.439 1.00 22.23 C ATOM 663 CG PRO A 44 47.504 3.320 27.941 1.00 34.15 C ATOM 664 CD PRO A 44 48.779 4.130 27.719 1.00 42.25 C ATOM 0 HA PRO A 44 46.615 6.408 27.108 1.00 43.50 H new ATOM 0 HB2 PRO A 44 45.454 4.057 27.908 1.00 22.23 H new ATOM 0 HB3 PRO A 44 46.272 4.177 26.362 1.00 22.23 H new ATOM 0 HG2 PRO A 44 47.365 3.063 28.991 1.00 34.15 H new ATOM 0 HG3 PRO A 44 47.516 2.384 27.383 1.00 34.15 H new ATOM 0 HD2 PRO A 44 49.544 3.863 28.448 1.00 42.25 H new ATOM 0 HD3 PRO A 44 49.199 3.937 26.732 1.00 42.25 H new ATOM 672 N CYS A 45 46.967 5.616 30.276 1.00 21.21 N ATOM 673 CA CYS A 45 46.577 5.995 31.628 1.00 32.41 C ATOM 674 C CYS A 45 46.902 7.463 31.925 1.00 41.44 C ATOM 675 O CYS A 45 46.097 8.149 32.548 1.00 50.51 O ATOM 676 CB CYS A 45 47.187 5.029 32.657 1.00 75.43 C ATOM 677 SG CYS A 45 49.004 5.038 32.622 1.00 4.14 S ATOM 0 H CYS A 45 47.719 4.928 30.246 1.00 21.21 H new ATOM 0 HA CYS A 45 45.493 5.909 31.708 1.00 32.41 H new ATOM 0 HB2 CYS A 45 46.844 5.301 33.655 1.00 75.43 H new ATOM 0 HB3 CYS A 45 46.827 4.019 32.461 1.00 75.43 H new ATOM 0 HG CYS A 45 49.459 4.207 33.512 1.00 4.14 H new ATOM 683 N ASP A 46 48.061 7.946 31.456 1.00 13.20 N ATOM 684 CA ASP A 46 48.564 9.305 31.662 1.00 52.30 C ATOM 685 C ASP A 46 47.604 10.381 31.133 1.00 44.45 C ATOM 686 O ASP A 46 47.635 11.518 31.599 1.00 42.35 O ATOM 687 CB ASP A 46 49.948 9.410 31.007 1.00 4.14 C ATOM 688 CG ASP A 46 50.633 10.757 31.226 1.00 44.21 C ATOM 689 OD1 ASP A 46 50.289 11.710 30.496 1.00 44.25 O ATOM 690 OD2 ASP A 46 51.521 10.810 32.104 1.00 31.24 O ATOM 0 H ASP A 46 48.697 7.374 30.900 1.00 13.20 H new ATOM 0 HA ASP A 46 48.643 9.492 32.733 1.00 52.30 H new ATOM 0 HB2 ASP A 46 50.587 8.620 31.401 1.00 4.14 H new ATOM 0 HB3 ASP A 46 49.847 9.234 29.936 1.00 4.14 H new ATOM 695 N ILE A 47 46.717 10.025 30.197 1.00 32.42 N ATOM 696 CA ILE A 47 45.672 10.908 29.684 1.00 12.24 C ATOM 697 C ILE A 47 44.825 11.487 30.833 1.00 12.42 C ATOM 698 O ILE A 47 44.316 12.601 30.719 1.00 64.23 O ATOM 699 CB ILE A 47 44.850 10.162 28.611 1.00 2.35 C ATOM 700 CG1 ILE A 47 45.811 9.690 27.500 1.00 33.20 C ATOM 701 CG2 ILE A 47 43.763 11.067 28.013 1.00 62.10 C ATOM 702 CD1 ILE A 47 45.136 8.975 26.328 1.00 21.15 C ATOM 0 H ILE A 47 46.708 9.099 29.770 1.00 32.42 H new ATOM 0 HA ILE A 47 46.119 11.774 29.195 1.00 12.24 H new ATOM 0 HB ILE A 47 44.352 9.309 29.072 1.00 2.35 H new ATOM 0 HG12 ILE A 47 46.353 10.555 27.116 1.00 33.20 H new ATOM 0 HG13 ILE A 47 46.550 9.020 27.939 1.00 33.20 H new ATOM 0 HG21 ILE A 47 43.202 10.513 27.261 1.00 62.10 H new ATOM 0 HG22 ILE A 47 43.087 11.394 28.803 1.00 62.10 H new ATOM 0 HG23 ILE A 47 44.228 11.937 27.550 1.00 62.10 H new ATOM 0 HD11 ILE A 47 45.890 8.681 25.598 1.00 21.15 H new ATOM 0 HD12 ILE A 47 44.618 8.088 26.693 1.00 21.15 H new ATOM 0 HD13 ILE A 47 44.418 9.646 25.857 1.00 21.15 H new ATOM 714 N SER A 48 44.743 10.766 31.961 1.00 62.41 N ATOM 715 CA SER A 48 44.186 11.244 33.219 1.00 41.42 C ATOM 716 C SER A 48 44.638 12.663 33.573 1.00 32.24 C ATOM 717 O SER A 48 43.792 13.540 33.724 1.00 40.54 O ATOM 718 CB SER A 48 44.545 10.274 34.349 1.00 60.42 C ATOM 719 OG SER A 48 45.944 10.132 34.484 1.00 11.30 O ATOM 0 H SER A 48 45.076 9.803 32.016 1.00 62.41 H new ATOM 0 HA SER A 48 43.104 11.285 33.094 1.00 41.42 H new ATOM 0 HB2 SER A 48 44.123 10.634 35.287 1.00 60.42 H new ATOM 0 HB3 SER A 48 44.097 9.300 34.150 1.00 60.42 H new ATOM 0 HG SER A 48 46.264 9.442 33.866 1.00 11.30 H new ATOM 725 N ARG A 49 45.949 12.893 33.729 1.00 21.45 N ATOM 726 CA ARG A 49 46.464 14.185 34.172 1.00 42.25 C ATOM 727 C ARG A 49 46.346 15.251 33.081 1.00 12.44 C ATOM 728 O ARG A 49 46.149 16.420 33.404 1.00 12.11 O ATOM 729 CB ARG A 49 47.890 14.077 34.735 1.00 42.14 C ATOM 730 CG ARG A 49 48.942 13.685 33.694 1.00 11.52 C ATOM 731 CD ARG A 49 50.357 13.768 34.267 1.00 10.54 C ATOM 732 NE ARG A 49 51.323 13.332 33.252 1.00 54.11 N ATOM 733 CZ ARG A 49 51.912 14.103 32.323 1.00 30.42 C ATOM 734 NH1 ARG A 49 51.811 15.440 32.355 1.00 12.04 N ATOM 735 NH2 ARG A 49 52.607 13.512 31.344 1.00 24.04 N ATOM 0 H ARG A 49 46.671 12.194 33.553 1.00 21.45 H new ATOM 0 HA ARG A 49 45.832 14.513 34.997 1.00 42.25 H new ATOM 0 HB2 ARG A 49 48.169 15.034 35.176 1.00 42.14 H new ATOM 0 HB3 ARG A 49 47.897 13.341 35.539 1.00 42.14 H new ATOM 0 HG2 ARG A 49 48.749 12.671 33.345 1.00 11.52 H new ATOM 0 HG3 ARG A 49 48.860 14.342 32.828 1.00 11.52 H new ATOM 0 HD2 ARG A 49 50.576 14.790 34.577 1.00 10.54 H new ATOM 0 HD3 ARG A 49 50.439 13.141 35.155 1.00 10.54 H new ATOM 0 HE ARG A 49 51.573 12.343 33.252 1.00 54.11 H new ATOM 0 HH11 ARG A 49 51.278 15.894 33.097 1.00 12.04 H new ATOM 0 HH12 ARG A 49 52.268 16.003 31.638 1.00 12.04 H new ATOM 0 HH21 ARG A 49 52.681 12.495 31.314 1.00 24.04 H new ATOM 0 HH22 ARG A 49 53.062 14.078 30.628 1.00 24.04 H new ATOM 749 N GLN A 50 46.457 14.865 31.801 1.00 11.03 N ATOM 750 CA GLN A 50 46.327 15.790 30.685 1.00 23.30 C ATOM 751 C GLN A 50 44.943 16.445 30.660 1.00 54.40 C ATOM 752 O GLN A 50 44.842 17.663 30.521 1.00 22.42 O ATOM 753 CB GLN A 50 46.588 15.040 29.375 1.00 75.45 C ATOM 754 CG GLN A 50 48.010 14.469 29.317 1.00 73.13 C ATOM 755 CD GLN A 50 48.188 13.610 28.071 1.00 42.20 C ATOM 756 OE1 GLN A 50 47.808 14.010 26.973 1.00 14.53 O ATOM 757 NE2 GLN A 50 48.740 12.411 28.238 1.00 1.52 N ATOM 0 H GLN A 50 46.639 13.902 31.519 1.00 11.03 H new ATOM 0 HA GLN A 50 47.062 16.586 30.804 1.00 23.30 H new ATOM 0 HB2 GLN A 50 45.867 14.229 29.271 1.00 75.45 H new ATOM 0 HB3 GLN A 50 46.433 15.715 28.533 1.00 75.45 H new ATOM 0 HG2 GLN A 50 48.735 15.283 29.312 1.00 73.13 H new ATOM 0 HG3 GLN A 50 48.206 13.873 30.208 1.00 73.13 H new ATOM 0 HE21 GLN A 50 49.043 12.114 29.165 1.00 1.52 H new ATOM 0 HE22 GLN A 50 48.860 11.789 27.439 1.00 1.52 H new ATOM 766 N LEU A 51 43.882 15.639 30.794 1.00 31.01 N ATOM 767 CA LEU A 51 42.499 16.105 30.737 1.00 33.30 C ATOM 768 C LEU A 51 41.955 16.422 32.139 1.00 31.31 C ATOM 769 O LEU A 51 40.870 16.986 32.248 1.00 54.35 O ATOM 770 CB LEU A 51 41.626 15.047 30.040 1.00 15.40 C ATOM 771 CG LEU A 51 41.733 14.991 28.502 1.00 52.22 C ATOM 772 CD1 LEU A 51 41.135 16.234 27.833 1.00 23.40 C ATOM 773 CD2 LEU A 51 43.159 14.768 27.990 1.00 2.54 C ATOM 0 H LEU A 51 43.966 14.634 30.947 1.00 31.01 H new ATOM 0 HA LEU A 51 42.469 17.030 30.161 1.00 33.30 H new ATOM 0 HB2 LEU A 51 41.889 14.067 30.439 1.00 15.40 H new ATOM 0 HB3 LEU A 51 40.585 15.231 30.306 1.00 15.40 H new ATOM 0 HG LEU A 51 41.145 14.117 28.220 1.00 52.22 H new ATOM 0 HD11 LEU A 51 41.234 16.148 26.751 1.00 23.40 H new ATOM 0 HD12 LEU A 51 40.080 16.317 28.095 1.00 23.40 H new ATOM 0 HD13 LEU A 51 41.665 17.122 28.176 1.00 23.40 H new ATOM 0 HD21 LEU A 51 43.154 14.740 26.900 1.00 2.54 H new ATOM 0 HD22 LEU A 51 43.799 15.582 28.329 1.00 2.54 H new ATOM 0 HD23 LEU A 51 43.540 13.822 28.375 1.00 2.54 H new ATOM 785 N ARG A 52 42.694 16.060 33.198 1.00 44.30 N ATOM 786 CA ARG A 52 42.281 16.141 34.591 1.00 42.52 C ATOM 787 C ARG A 52 41.009 15.322 34.823 1.00 43.34 C ATOM 788 O ARG A 52 39.916 15.880 34.917 1.00 31.33 O ATOM 789 CB ARG A 52 42.146 17.592 35.081 1.00 31.20 C ATOM 790 CG ARG A 52 43.490 18.314 35.249 1.00 53.25 C ATOM 791 CD ARG A 52 44.057 18.899 33.950 1.00 61.21 C ATOM 792 NE ARG A 52 45.292 19.647 34.226 1.00 51.33 N ATOM 793 CZ ARG A 52 46.209 20.018 33.318 1.00 34.22 C ATOM 794 NH1 ARG A 52 46.074 19.702 32.023 1.00 24.10 N ATOM 795 NH2 ARG A 52 47.279 20.722 33.714 1.00 24.45 N ATOM 0 H ARG A 52 43.637 15.687 33.093 1.00 44.30 H new ATOM 0 HA ARG A 52 43.072 15.701 35.198 1.00 42.52 H new ATOM 0 HB2 ARG A 52 41.530 18.149 34.375 1.00 31.20 H new ATOM 0 HB3 ARG A 52 41.619 17.596 36.035 1.00 31.20 H new ATOM 0 HG2 ARG A 52 43.369 19.119 35.974 1.00 53.25 H new ATOM 0 HG3 ARG A 52 44.215 17.615 35.666 1.00 53.25 H new ATOM 0 HD2 ARG A 52 44.260 18.097 33.240 1.00 61.21 H new ATOM 0 HD3 ARG A 52 43.321 19.556 33.487 1.00 61.21 H new ATOM 0 HE ARG A 52 45.469 19.908 35.196 1.00 51.33 H new ATOM 0 HH11 ARG A 52 45.262 19.169 31.710 1.00 24.10 H new ATOM 0 HH12 ARG A 52 46.783 19.994 31.350 1.00 24.10 H new ATOM 0 HH21 ARG A 52 47.391 20.971 34.697 1.00 24.45 H new ATOM 0 HH22 ARG A 52 47.982 21.009 33.032 1.00 24.45 H new ATOM 809 N VAL A 53 41.168 13.996 34.911 1.00 72.14 N ATOM 810 CA VAL A 53 40.081 13.043 35.111 1.00 53.15 C ATOM 811 C VAL A 53 40.433 12.129 36.295 1.00 3.41 C ATOM 812 O VAL A 53 40.411 12.592 37.433 1.00 32.30 O ATOM 813 CB VAL A 53 39.754 12.322 33.785 1.00 73.43 C ATOM 814 CG1 VAL A 53 38.497 11.444 33.905 1.00 5.34 C ATOM 815 CG2 VAL A 53 39.501 13.330 32.655 1.00 70.33 C ATOM 0 H VAL A 53 42.082 13.549 34.843 1.00 72.14 H new ATOM 0 HA VAL A 53 39.151 13.541 35.386 1.00 53.15 H new ATOM 0 HB VAL A 53 40.621 11.700 33.559 1.00 73.43 H new ATOM 0 HG11 VAL A 53 38.302 10.955 32.951 1.00 5.34 H new ATOM 0 HG12 VAL A 53 38.653 10.688 34.675 1.00 5.34 H new ATOM 0 HG13 VAL A 53 37.643 12.066 34.175 1.00 5.34 H new ATOM 0 HG21 VAL A 53 39.273 12.794 31.734 1.00 70.33 H new ATOM 0 HG22 VAL A 53 38.659 13.970 32.920 1.00 70.33 H new ATOM 0 HG23 VAL A 53 40.390 13.943 32.508 1.00 70.33 H new ATOM 825 N SER A 54 40.736 10.848 36.051 1.00 11.54 N ATOM 826 CA SER A 54 40.969 9.852 37.091 1.00 30.40 C ATOM 827 C SER A 54 41.706 8.650 36.489 1.00 72.41 C ATOM 828 O SER A 54 42.926 8.699 36.361 1.00 53.54 O ATOM 829 CB SER A 54 39.638 9.484 37.770 1.00 33.34 C ATOM 830 OG SER A 54 39.821 8.433 38.696 1.00 63.22 O ATOM 0 H SER A 54 40.826 10.473 35.107 1.00 11.54 H new ATOM 0 HA SER A 54 41.611 10.254 37.875 1.00 30.40 H new ATOM 0 HB2 SER A 54 39.231 10.357 38.280 1.00 33.34 H new ATOM 0 HB3 SER A 54 38.909 9.187 37.015 1.00 33.34 H new ATOM 0 HG SER A 54 38.964 8.216 39.118 1.00 63.22 H new ATOM 836 N HIS A 55 40.986 7.583 36.115 1.00 20.04 N ATOM 837 CA HIS A 55 41.554 6.389 35.495 1.00 74.14 C ATOM 838 C HIS A 55 40.431 5.491 34.974 1.00 43.31 C ATOM 839 O HIS A 55 40.420 5.126 33.800 1.00 65.42 O ATOM 840 CB HIS A 55 42.449 5.620 36.478 1.00 64.34 C ATOM 841 CG HIS A 55 43.038 4.375 35.864 1.00 12.02 C ATOM 842 ND1 HIS A 55 42.779 3.103 36.350 1.00 70.14 N ATOM 843 CD2 HIS A 55 43.860 4.189 34.778 1.00 10.24 C ATOM 844 CE1 HIS A 55 43.437 2.235 35.562 1.00 74.51 C ATOM 845 NE2 HIS A 55 44.115 2.835 34.582 1.00 43.42 N ATOM 0 H HIS A 55 39.975 7.530 36.239 1.00 20.04 H new ATOM 0 HA HIS A 55 42.179 6.701 34.658 1.00 74.14 H new ATOM 0 HB2 HIS A 55 43.255 6.271 36.817 1.00 64.34 H new ATOM 0 HB3 HIS A 55 41.867 5.348 37.358 1.00 64.34 H new ATOM 0 HD2 HIS A 55 44.254 4.984 34.162 1.00 10.24 H new ATOM 0 HE1 HIS A 55 43.419 1.165 35.707 1.00 74.51 H new ATOM 0 HE2 HIS A 55 44.687 2.402 33.857 1.00 43.42 H new ATOM 853 N GLY A 56 39.475 5.140 35.842 1.00 31.42 N ATOM 854 CA GLY A 56 38.308 4.358 35.461 1.00 0.42 C ATOM 855 C GLY A 56 37.457 5.109 34.437 1.00 2.01 C ATOM 856 O GLY A 56 36.995 4.526 33.458 1.00 65.32 O ATOM 0 H GLY A 56 39.495 5.394 36.830 1.00 31.42 H new ATOM 0 HA2 GLY A 56 38.626 3.402 35.044 1.00 0.42 H new ATOM 0 HA3 GLY A 56 37.709 4.137 36.345 1.00 0.42 H new ATOM 860 N CYS A 57 37.280 6.418 34.652 1.00 73.25 N ATOM 861 CA CYS A 57 36.545 7.289 33.746 1.00 3.03 C ATOM 862 C CYS A 57 37.355 7.608 32.484 1.00 32.22 C ATOM 863 O CYS A 57 36.772 8.057 31.501 1.00 41.53 O ATOM 864 CB CYS A 57 36.123 8.569 34.475 1.00 31.35 C ATOM 865 SG CYS A 57 34.802 8.207 35.665 1.00 3.21 S ATOM 0 H CYS A 57 37.650 6.901 35.471 1.00 73.25 H new ATOM 0 HA CYS A 57 35.648 6.762 33.421 1.00 3.03 H new ATOM 0 HB2 CYS A 57 36.980 9.001 34.992 1.00 31.35 H new ATOM 0 HB3 CYS A 57 35.779 9.310 33.754 1.00 31.35 H new ATOM 0 HG CYS A 57 34.457 9.301 36.276 1.00 3.21 H new ATOM 871 N VAL A 58 38.673 7.367 32.498 1.00 45.31 N ATOM 872 CA VAL A 58 39.537 7.489 31.330 1.00 71.51 C ATOM 873 C VAL A 58 39.423 6.225 30.474 1.00 33.32 C ATOM 874 O VAL A 58 39.358 6.324 29.252 1.00 44.42 O ATOM 875 CB VAL A 58 40.986 7.758 31.768 1.00 64.45 C ATOM 876 CG1 VAL A 58 41.923 7.931 30.563 1.00 62.13 C ATOM 877 CG2 VAL A 58 41.062 9.025 32.625 1.00 51.15 C ATOM 0 H VAL A 58 39.171 7.077 33.339 1.00 45.31 H new ATOM 0 HA VAL A 58 39.219 8.336 30.722 1.00 71.51 H new ATOM 0 HB VAL A 58 41.307 6.891 32.346 1.00 64.45 H new ATOM 0 HG11 VAL A 58 42.937 8.119 30.915 1.00 62.13 H new ATOM 0 HG12 VAL A 58 41.911 7.023 29.959 1.00 62.13 H new ATOM 0 HG13 VAL A 58 41.586 8.773 29.958 1.00 62.13 H new ATOM 0 HG21 VAL A 58 42.095 9.199 32.926 1.00 51.15 H new ATOM 0 HG22 VAL A 58 40.703 9.877 32.047 1.00 51.15 H new ATOM 0 HG23 VAL A 58 40.442 8.902 33.513 1.00 51.15 H new ATOM 887 N SER A 59 39.385 5.042 31.106 1.00 11.41 N ATOM 888 CA SER A 59 39.306 3.747 30.438 1.00 52.22 C ATOM 889 C SER A 59 38.197 3.710 29.381 1.00 10.15 C ATOM 890 O SER A 59 38.409 3.189 28.288 1.00 43.53 O ATOM 891 CB SER A 59 39.118 2.638 31.481 1.00 64.03 C ATOM 892 OG SER A 59 39.177 1.368 30.865 1.00 45.45 O ATOM 0 H SER A 59 39.409 4.965 32.123 1.00 11.41 H new ATOM 0 HA SER A 59 40.244 3.581 29.908 1.00 52.22 H new ATOM 0 HB2 SER A 59 39.891 2.715 32.246 1.00 64.03 H new ATOM 0 HB3 SER A 59 38.159 2.761 31.984 1.00 64.03 H new ATOM 0 HG SER A 59 39.057 0.670 31.542 1.00 45.45 H new ATOM 898 N LYS A 60 37.024 4.279 29.692 1.00 33.21 N ATOM 899 CA LYS A 60 35.919 4.351 28.746 1.00 22.33 C ATOM 900 C LYS A 60 36.265 5.161 27.491 1.00 52.50 C ATOM 901 O LYS A 60 35.872 4.767 26.396 1.00 64.42 O ATOM 902 CB LYS A 60 34.619 4.804 29.422 1.00 20.24 C ATOM 903 CG LYS A 60 34.697 6.148 30.154 1.00 0.42 C ATOM 904 CD LYS A 60 33.276 6.651 30.452 1.00 73.32 C ATOM 905 CE LYS A 60 33.251 7.835 31.426 1.00 22.31 C ATOM 906 NZ LYS A 60 34.054 8.974 30.947 1.00 32.24 N ATOM 0 H LYS A 60 36.822 4.697 30.600 1.00 33.21 H new ATOM 0 HA LYS A 60 35.740 3.337 28.390 1.00 22.33 H new ATOM 0 HB2 LYS A 60 33.837 4.866 28.665 1.00 20.24 H new ATOM 0 HB3 LYS A 60 34.313 4.038 30.134 1.00 20.24 H new ATOM 0 HG2 LYS A 60 35.257 6.037 31.082 1.00 0.42 H new ATOM 0 HG3 LYS A 60 35.232 6.876 29.544 1.00 0.42 H new ATOM 0 HD2 LYS A 60 32.798 6.946 29.518 1.00 73.32 H new ATOM 0 HD3 LYS A 60 32.687 5.833 30.868 1.00 73.32 H new ATOM 0 HE2 LYS A 60 32.221 8.158 31.575 1.00 22.31 H new ATOM 0 HE3 LYS A 60 33.627 7.511 32.397 1.00 22.31 H new ATOM 0 HZ1 LYS A 60 33.822 9.821 31.504 1.00 32.24 H new ATOM 0 HZ2 LYS A 60 35.065 8.755 31.054 1.00 32.24 H new ATOM 0 HZ3 LYS A 60 33.842 9.151 29.944 1.00 32.24 H new ATOM 920 N ILE A 61 37.021 6.256 27.648 1.00 33.33 N ATOM 921 CA ILE A 61 37.439 7.132 26.559 1.00 25.32 C ATOM 922 C ILE A 61 38.348 6.372 25.587 1.00 74.31 C ATOM 923 O ILE A 61 38.196 6.502 24.373 1.00 5.51 O ATOM 924 CB ILE A 61 38.122 8.403 27.105 1.00 20.11 C ATOM 925 CG1 ILE A 61 37.358 9.077 28.260 1.00 71.24 C ATOM 926 CG2 ILE A 61 38.353 9.417 25.981 1.00 31.23 C ATOM 927 CD1 ILE A 61 35.924 9.490 27.919 1.00 72.45 C ATOM 0 H ILE A 61 37.364 6.559 28.559 1.00 33.33 H new ATOM 0 HA ILE A 61 36.555 7.454 26.009 1.00 25.32 H new ATOM 0 HB ILE A 61 39.076 8.069 27.514 1.00 20.11 H new ATOM 0 HG12 ILE A 61 37.333 8.394 29.109 1.00 71.24 H new ATOM 0 HG13 ILE A 61 37.911 9.961 28.577 1.00 71.24 H new ATOM 0 HG21 ILE A 61 38.836 10.306 26.387 1.00 31.23 H new ATOM 0 HG22 ILE A 61 38.992 8.974 25.217 1.00 31.23 H new ATOM 0 HG23 ILE A 61 37.396 9.694 25.538 1.00 31.23 H new ATOM 0 HD11 ILE A 61 35.463 9.956 28.790 1.00 72.45 H new ATOM 0 HD12 ILE A 61 35.937 10.200 27.092 1.00 72.45 H new ATOM 0 HD13 ILE A 61 35.350 8.609 27.632 1.00 72.45 H new ATOM 939 N LEU A 62 39.275 5.560 26.117 1.00 13.02 N ATOM 940 CA LEU A 62 40.096 4.667 25.307 1.00 3.44 C ATOM 941 C LEU A 62 39.184 3.670 24.584 1.00 54.00 C ATOM 942 O LEU A 62 39.198 3.613 23.354 1.00 43.31 O ATOM 943 CB LEU A 62 41.142 3.937 26.171 1.00 5.04 C ATOM 944 CG LEU A 62 42.417 4.737 26.500 1.00 42.45 C ATOM 945 CD1 LEU A 62 43.368 4.830 25.302 1.00 22.11 C ATOM 946 CD2 LEU A 62 42.123 6.133 27.054 1.00 75.13 C ATOM 0 H LEU A 62 39.471 5.509 27.117 1.00 13.02 H new ATOM 0 HA LEU A 62 40.644 5.253 24.570 1.00 3.44 H new ATOM 0 HB2 LEU A 62 40.669 3.642 27.108 1.00 5.04 H new ATOM 0 HB3 LEU A 62 41.433 3.020 25.658 1.00 5.04 H new ATOM 0 HG LEU A 62 42.914 4.172 27.289 1.00 42.45 H new ATOM 0 HD11 LEU A 62 44.252 5.403 25.583 1.00 22.11 H new ATOM 0 HD12 LEU A 62 43.667 3.827 24.996 1.00 22.11 H new ATOM 0 HD13 LEU A 62 42.862 5.326 24.474 1.00 22.11 H new ATOM 0 HD21 LEU A 62 43.061 6.645 27.266 1.00 75.13 H new ATOM 0 HD22 LEU A 62 41.556 6.704 26.319 1.00 75.13 H new ATOM 0 HD23 LEU A 62 41.542 6.045 27.972 1.00 75.13 H new ATOM 958 N GLY A 63 38.383 2.910 25.343 1.00 42.01 N ATOM 959 CA GLY A 63 37.397 1.987 24.799 1.00 60.25 C ATOM 960 C GLY A 63 37.131 0.829 25.760 1.00 62.21 C ATOM 961 O GLY A 63 37.542 -0.298 25.486 1.00 74.43 O ATOM 0 H GLY A 63 38.407 2.924 26.363 1.00 42.01 H new ATOM 0 HA2 GLY A 63 36.467 2.520 24.602 1.00 60.25 H new ATOM 0 HA3 GLY A 63 37.749 1.597 23.844 1.00 60.25 H new ATOM 1314 N LYS A 87 0.102 -0.448 4.485 1.00 42.52 N ATOM 1315 CA LYS A 87 -0.178 -1.541 3.563 1.00 61.32 C ATOM 1316 C LYS A 87 -1.587 -2.113 3.770 1.00 74.41 C ATOM 1317 O LYS A 87 -2.092 -2.809 2.894 1.00 73.33 O ATOM 1318 CB LYS A 87 0.918 -2.612 3.692 1.00 14.25 C ATOM 1319 CG LYS A 87 1.046 -3.444 2.409 1.00 52.03 C ATOM 1320 CD LYS A 87 2.208 -4.438 2.504 1.00 23.20 C ATOM 1321 CE LYS A 87 2.312 -5.248 1.207 1.00 63.41 C ATOM 1322 NZ LYS A 87 3.445 -6.190 1.243 1.00 3.15 N ATOM 0 HA LYS A 87 -0.162 -1.159 2.542 1.00 61.32 H new ATOM 0 HB2 LYS A 87 1.872 -2.133 3.913 1.00 14.25 H new ATOM 0 HB3 LYS A 87 0.689 -3.269 4.531 1.00 14.25 H new ATOM 0 HG2 LYS A 87 0.116 -3.984 2.229 1.00 52.03 H new ATOM 0 HG3 LYS A 87 1.200 -2.782 1.557 1.00 52.03 H new ATOM 0 HD2 LYS A 87 3.141 -3.904 2.685 1.00 23.20 H new ATOM 0 HD3 LYS A 87 2.056 -5.108 3.350 1.00 23.20 H new ATOM 0 HE2 LYS A 87 1.385 -5.799 1.047 1.00 63.41 H new ATOM 0 HE3 LYS A 87 2.430 -4.569 0.362 1.00 63.41 H new ATOM 0 HZ1 LYS A 87 3.484 -6.720 0.349 1.00 3.15 H new ATOM 0 HZ2 LYS A 87 4.332 -5.662 1.371 1.00 3.15 H new ATOM 0 HZ3 LYS A 87 3.320 -6.853 2.034 1.00 3.15 H new ATOM 1336 N VAL A 88 -2.235 -1.791 4.899 1.00 30.20 N ATOM 1337 CA VAL A 88 -3.637 -2.086 5.181 1.00 14.44 C ATOM 1338 C VAL A 88 -4.518 -1.735 3.975 1.00 11.31 C ATOM 1339 O VAL A 88 -5.362 -2.538 3.577 1.00 34.30 O ATOM 1340 CB VAL A 88 -4.082 -1.313 6.435 1.00 42.01 C ATOM 1341 CG1 VAL A 88 -5.558 -1.588 6.753 1.00 71.24 C ATOM 1342 CG2 VAL A 88 -3.234 -1.680 7.662 1.00 31.44 C ATOM 0 H VAL A 88 -1.775 -1.300 5.666 1.00 30.20 H new ATOM 0 HA VAL A 88 -3.748 -3.154 5.369 1.00 14.44 H new ATOM 0 HB VAL A 88 -3.943 -0.254 6.215 1.00 42.01 H new ATOM 0 HG11 VAL A 88 -5.848 -1.030 7.643 1.00 71.24 H new ATOM 0 HG12 VAL A 88 -6.176 -1.275 5.911 1.00 71.24 H new ATOM 0 HG13 VAL A 88 -5.699 -2.654 6.930 1.00 71.24 H new ATOM 0 HG21 VAL A 88 -3.580 -1.113 8.526 1.00 31.44 H new ATOM 0 HG22 VAL A 88 -3.331 -2.746 7.865 1.00 31.44 H new ATOM 0 HG23 VAL A 88 -2.189 -1.441 7.466 1.00 31.44 H new ATOM 1352 N VAL A 89 -4.301 -0.549 3.390 1.00 71.34 N ATOM 1353 CA VAL A 89 -5.003 -0.067 2.205 1.00 35.50 C ATOM 1354 C VAL A 89 -4.926 -1.100 1.076 1.00 25.13 C ATOM 1355 O VAL A 89 -5.940 -1.427 0.461 1.00 3.14 O ATOM 1356 CB VAL A 89 -4.416 1.291 1.768 1.00 61.13 C ATOM 1357 CG1 VAL A 89 -5.129 1.828 0.519 1.00 13.01 C ATOM 1358 CG2 VAL A 89 -4.549 2.341 2.880 1.00 4.22 C ATOM 0 H VAL A 89 -3.612 0.116 3.742 1.00 71.34 H new ATOM 0 HA VAL A 89 -6.056 0.076 2.445 1.00 35.50 H new ATOM 0 HB VAL A 89 -3.363 1.117 1.549 1.00 61.13 H new ATOM 0 HG11 VAL A 89 -4.694 2.786 0.235 1.00 13.01 H new ATOM 0 HG12 VAL A 89 -5.011 1.119 -0.300 1.00 13.01 H new ATOM 0 HG13 VAL A 89 -6.189 1.961 0.734 1.00 13.01 H new ATOM 0 HG21 VAL A 89 -4.126 3.286 2.540 1.00 4.22 H new ATOM 0 HG22 VAL A 89 -5.602 2.481 3.124 1.00 4.22 H new ATOM 0 HG23 VAL A 89 -4.014 2.002 3.767 1.00 4.22 H new ATOM 1368 N GLU A 90 -3.720 -1.619 0.816 1.00 34.04 N ATOM 1369 CA GLU A 90 -3.485 -2.627 -0.204 1.00 14.14 C ATOM 1370 C GLU A 90 -4.247 -3.915 0.119 1.00 1.51 C ATOM 1371 O GLU A 90 -4.842 -4.493 -0.785 1.00 62.24 O ATOM 1372 CB GLU A 90 -1.984 -2.892 -0.381 1.00 32.32 C ATOM 1373 CG GLU A 90 -1.219 -1.622 -0.782 1.00 53.12 C ATOM 1374 CD GLU A 90 0.292 -1.846 -0.794 1.00 32.44 C ATOM 1375 OE1 GLU A 90 0.710 -2.956 -1.190 1.00 3.45 O ATOM 1376 OE2 GLU A 90 1.008 -0.906 -0.386 1.00 43.21 O ATOM 0 H GLU A 90 -2.876 -1.343 1.318 1.00 34.04 H new ATOM 0 HA GLU A 90 -3.864 -2.246 -1.152 1.00 14.14 H new ATOM 0 HB2 GLU A 90 -1.573 -3.284 0.549 1.00 32.32 H new ATOM 0 HB3 GLU A 90 -1.838 -3.659 -1.142 1.00 32.32 H new ATOM 0 HG2 GLU A 90 -1.546 -1.298 -1.770 1.00 53.12 H new ATOM 0 HG3 GLU A 90 -1.461 -0.818 -0.087 1.00 53.12 H new ATOM 1383 N LYS A 91 -4.255 -4.354 1.391 1.00 1.23 N ATOM 1384 CA LYS A 91 -4.932 -5.589 1.788 1.00 70.40 C ATOM 1385 C LYS A 91 -6.428 -5.523 1.470 1.00 14.50 C ATOM 1386 O LYS A 91 -6.919 -6.364 0.717 1.00 62.34 O ATOM 1387 CB LYS A 91 -4.734 -5.931 3.272 1.00 51.22 C ATOM 1388 CG LYS A 91 -3.298 -5.904 3.807 1.00 42.24 C ATOM 1389 CD LYS A 91 -2.327 -6.770 2.997 1.00 70.33 C ATOM 1390 CE LYS A 91 -0.916 -6.749 3.603 1.00 24.43 C ATOM 1391 NZ LYS A 91 -0.871 -7.298 4.972 1.00 13.35 N ATOM 0 H LYS A 91 -3.796 -3.865 2.160 1.00 1.23 H new ATOM 0 HA LYS A 91 -4.470 -6.385 1.204 1.00 70.40 H new ATOM 0 HB2 LYS A 91 -5.329 -5.234 3.862 1.00 51.22 H new ATOM 0 HB3 LYS A 91 -5.142 -6.926 3.448 1.00 51.22 H new ATOM 0 HG2 LYS A 91 -2.939 -4.875 3.809 1.00 42.24 H new ATOM 0 HG3 LYS A 91 -3.298 -6.244 4.843 1.00 42.24 H new ATOM 0 HD2 LYS A 91 -2.694 -7.796 2.963 1.00 70.33 H new ATOM 0 HD3 LYS A 91 -2.288 -6.411 1.969 1.00 70.33 H new ATOM 0 HE2 LYS A 91 -0.243 -7.322 2.965 1.00 24.43 H new ATOM 0 HE3 LYS A 91 -0.547 -5.724 3.616 1.00 24.43 H new ATOM 0 HZ1 LYS A 91 -0.525 -6.568 5.627 1.00 13.35 H new ATOM 0 HZ2 LYS A 91 -1.825 -7.596 5.258 1.00 13.35 H new ATOM 0 HZ3 LYS A 91 -0.231 -8.117 4.997 1.00 13.35 H new ATOM 1405 N ILE A 92 -7.135 -4.521 2.026 1.00 73.31 N ATOM 1406 CA ILE A 92 -8.522 -4.199 1.689 1.00 44.41 C ATOM 1407 C ILE A 92 -8.717 -4.299 0.176 1.00 63.05 C ATOM 1408 O ILE A 92 -9.594 -5.025 -0.289 1.00 64.33 O ATOM 1409 CB ILE A 92 -8.881 -2.780 2.182 1.00 51.43 C ATOM 1410 CG1 ILE A 92 -8.747 -2.663 3.709 1.00 50.34 C ATOM 1411 CG2 ILE A 92 -10.316 -2.405 1.764 1.00 14.21 C ATOM 1412 CD1 ILE A 92 -8.833 -1.209 4.186 1.00 10.54 C ATOM 0 H ILE A 92 -6.743 -3.903 2.737 1.00 73.31 H new ATOM 0 HA ILE A 92 -9.183 -4.911 2.184 1.00 44.41 H new ATOM 0 HB ILE A 92 -8.176 -2.090 1.718 1.00 51.43 H new ATOM 0 HG12 ILE A 92 -9.533 -3.248 4.187 1.00 50.34 H new ATOM 0 HG13 ILE A 92 -7.795 -3.091 4.023 1.00 50.34 H new ATOM 0 HG21 ILE A 92 -10.549 -1.402 2.121 1.00 14.21 H new ATOM 0 HG22 ILE A 92 -10.397 -2.431 0.677 1.00 14.21 H new ATOM 0 HG23 ILE A 92 -11.019 -3.116 2.197 1.00 14.21 H new ATOM 0 HD11 ILE A 92 -8.733 -1.175 5.271 1.00 10.54 H new ATOM 0 HD12 ILE A 92 -8.031 -0.628 3.730 1.00 10.54 H new ATOM 0 HD13 ILE A 92 -9.796 -0.788 3.897 1.00 10.54 H new ATOM 1424 N GLY A 93 -7.872 -3.571 -0.568 1.00 2.12 N ATOM 1425 CA GLY A 93 -7.853 -3.543 -2.018 1.00 13.43 C ATOM 1426 C GLY A 93 -7.906 -4.945 -2.615 1.00 13.10 C ATOM 1427 O GLY A 93 -8.852 -5.257 -3.330 1.00 55.43 O ATOM 0 H GLY A 93 -7.162 -2.968 -0.152 1.00 2.12 H new ATOM 0 HA2 GLY A 93 -8.701 -2.962 -2.381 1.00 13.43 H new ATOM 0 HA3 GLY A 93 -6.950 -3.037 -2.359 1.00 13.43 H new ATOM 1431 N ASP A 94 -6.905 -5.784 -2.320 1.00 4.33 N ATOM 1432 CA ASP A 94 -6.779 -7.112 -2.902 1.00 74.14 C ATOM 1433 C ASP A 94 -8.044 -7.931 -2.681 1.00 42.13 C ATOM 1434 O ASP A 94 -8.628 -8.386 -3.658 1.00 61.31 O ATOM 1435 CB ASP A 94 -5.556 -7.858 -2.365 1.00 40.23 C ATOM 1436 CG ASP A 94 -4.260 -7.057 -2.487 1.00 54.24 C ATOM 1437 OD1 ASP A 94 -4.125 -6.338 -3.502 1.00 70.54 O ATOM 1438 OD2 ASP A 94 -3.428 -7.176 -1.562 1.00 11.43 O ATOM 0 H ASP A 94 -6.158 -5.552 -1.665 1.00 4.33 H new ATOM 0 HA ASP A 94 -6.638 -6.977 -3.974 1.00 74.14 H new ATOM 0 HB2 ASP A 94 -5.723 -8.109 -1.318 1.00 40.23 H new ATOM 0 HB3 ASP A 94 -5.446 -8.799 -2.905 1.00 40.23 H new ATOM 1443 N TYR A 95 -8.486 -8.100 -1.427 1.00 72.53 N ATOM 1444 CA TYR A 95 -9.714 -8.815 -1.129 1.00 61.43 C ATOM 1445 C TYR A 95 -10.916 -8.305 -1.922 1.00 2.41 C ATOM 1446 O TYR A 95 -11.675 -9.114 -2.453 1.00 1.51 O ATOM 1447 CB TYR A 95 -9.974 -8.792 0.374 1.00 20.04 C ATOM 1448 CG TYR A 95 -8.914 -9.532 1.162 1.00 71.51 C ATOM 1449 CD1 TYR A 95 -8.643 -10.876 0.854 1.00 1.44 C ATOM 1450 CD2 TYR A 95 -8.152 -8.876 2.145 1.00 24.43 C ATOM 1451 CE1 TYR A 95 -7.622 -11.560 1.522 1.00 30.55 C ATOM 1452 CE2 TYR A 95 -7.156 -9.578 2.844 1.00 14.33 C ATOM 1453 CZ TYR A 95 -6.915 -10.932 2.560 1.00 33.11 C ATOM 1454 OH TYR A 95 -6.004 -11.634 3.291 1.00 45.20 O ATOM 0 H TYR A 95 -8.000 -7.745 -0.604 1.00 72.53 H new ATOM 0 HA TYR A 95 -9.577 -9.848 -1.449 1.00 61.43 H new ATOM 0 HB2 TYR A 95 -10.018 -7.758 0.715 1.00 20.04 H new ATOM 0 HB3 TYR A 95 -10.948 -9.237 0.577 1.00 20.04 H new ATOM 0 HD1 TYR A 95 -9.225 -11.383 0.099 1.00 1.44 H new ATOM 0 HD2 TYR A 95 -8.332 -7.834 2.362 1.00 24.43 H new ATOM 0 HE1 TYR A 95 -7.377 -12.573 1.239 1.00 30.55 H new ATOM 0 HE2 TYR A 95 -6.574 -9.075 3.602 1.00 14.33 H new ATOM 0 HH TYR A 95 -5.773 -12.461 2.818 1.00 45.20 H new ATOM 1464 N LYS A 96 -11.084 -6.983 -2.035 1.00 44.35 N ATOM 1465 CA LYS A 96 -12.177 -6.412 -2.807 1.00 43.14 C ATOM 1466 C LYS A 96 -12.054 -6.760 -4.295 1.00 54.35 C ATOM 1467 O LYS A 96 -13.055 -7.090 -4.925 1.00 72.31 O ATOM 1468 CB LYS A 96 -12.261 -4.891 -2.589 1.00 23.32 C ATOM 1469 CG LYS A 96 -13.701 -4.469 -2.265 1.00 41.31 C ATOM 1470 CD LYS A 96 -14.003 -4.723 -0.781 1.00 62.12 C ATOM 1471 CE LYS A 96 -15.504 -4.688 -0.472 1.00 33.55 C ATOM 1472 NZ LYS A 96 -16.181 -5.917 -0.922 1.00 30.30 N ATOM 0 H LYS A 96 -10.473 -6.293 -1.599 1.00 44.35 H new ATOM 0 HA LYS A 96 -13.107 -6.854 -2.450 1.00 43.14 H new ATOM 0 HB2 LYS A 96 -11.599 -4.598 -1.774 1.00 23.32 H new ATOM 0 HB3 LYS A 96 -11.916 -4.371 -3.483 1.00 23.32 H new ATOM 0 HG2 LYS A 96 -13.840 -3.413 -2.497 1.00 41.31 H new ATOM 0 HG3 LYS A 96 -14.401 -5.027 -2.887 1.00 41.31 H new ATOM 0 HD2 LYS A 96 -13.599 -5.693 -0.492 1.00 62.12 H new ATOM 0 HD3 LYS A 96 -13.493 -3.973 -0.176 1.00 62.12 H new ATOM 0 HE2 LYS A 96 -15.652 -4.563 0.601 1.00 33.55 H new ATOM 0 HE3 LYS A 96 -15.956 -3.824 -0.959 1.00 33.55 H new ATOM 0 HZ1 LYS A 96 -17.191 -5.865 -0.681 1.00 30.30 H new ATOM 0 HZ2 LYS A 96 -16.075 -6.014 -1.952 1.00 30.30 H new ATOM 0 HZ3 LYS A 96 -15.755 -6.740 -0.451 1.00 30.30 H new ATOM 1486 N ARG A 97 -10.838 -6.684 -4.851 1.00 14.21 N ATOM 1487 CA ARG A 97 -10.573 -6.951 -6.260 1.00 45.03 C ATOM 1488 C ARG A 97 -10.838 -8.421 -6.595 1.00 3.23 C ATOM 1489 O ARG A 97 -11.499 -8.712 -7.589 1.00 2.12 O ATOM 1490 CB ARG A 97 -9.123 -6.584 -6.608 1.00 31.44 C ATOM 1491 CG ARG A 97 -8.845 -5.076 -6.517 1.00 64.22 C ATOM 1492 CD ARG A 97 -7.332 -4.822 -6.479 1.00 4.34 C ATOM 1493 NE ARG A 97 -7.028 -3.446 -6.052 1.00 50.13 N ATOM 1494 CZ ARG A 97 -6.047 -3.069 -5.211 1.00 21.14 C ATOM 1495 NH1 ARG A 97 -5.213 -3.954 -4.643 1.00 3.30 N ATOM 1496 NH2 ARG A 97 -5.897 -1.769 -4.925 1.00 2.00 N ATOM 0 H ARG A 97 -10.003 -6.431 -4.323 1.00 14.21 H new ATOM 0 HA ARG A 97 -11.247 -6.335 -6.856 1.00 45.03 H new ATOM 0 HB2 ARG A 97 -8.449 -7.113 -5.934 1.00 31.44 H new ATOM 0 HB3 ARG A 97 -8.900 -6.928 -7.618 1.00 31.44 H new ATOM 0 HG2 ARG A 97 -9.286 -4.564 -7.372 1.00 64.22 H new ATOM 0 HG3 ARG A 97 -9.314 -4.665 -5.623 1.00 64.22 H new ATOM 0 HD2 ARG A 97 -6.860 -5.529 -5.797 1.00 4.34 H new ATOM 0 HD3 ARG A 97 -6.907 -5.000 -7.467 1.00 4.34 H new ATOM 0 HE ARG A 97 -7.619 -2.706 -6.431 1.00 50.13 H new ATOM 0 HH11 ARG A 97 -5.311 -4.949 -4.844 1.00 3.30 H new ATOM 0 HH12 ARG A 97 -4.481 -3.631 -4.010 1.00 3.30 H new ATOM 0 HH21 ARG A 97 -6.522 -1.079 -5.343 1.00 2.00 H new ATOM 0 HH22 ARG A 97 -5.158 -1.469 -4.289 1.00 2.00 H new ATOM 1510 N GLN A 98 -10.305 -9.344 -5.782 1.00 3.21 N ATOM 1511 CA GLN A 98 -10.434 -10.777 -6.019 1.00 51.32 C ATOM 1512 C GLN A 98 -11.874 -11.260 -5.797 1.00 53.43 C ATOM 1513 O GLN A 98 -12.299 -12.216 -6.442 1.00 21.31 O ATOM 1514 CB GLN A 98 -9.365 -11.585 -5.262 1.00 74.43 C ATOM 1515 CG GLN A 98 -9.511 -11.592 -3.740 1.00 31.21 C ATOM 1516 CD GLN A 98 -10.575 -12.548 -3.220 1.00 2.23 C ATOM 1517 OE1 GLN A 98 -10.607 -13.723 -3.579 1.00 21.11 O ATOM 1518 NE2 GLN A 98 -11.438 -12.044 -2.341 1.00 12.34 N ATOM 0 H GLN A 98 -9.773 -9.111 -4.943 1.00 3.21 H new ATOM 0 HA GLN A 98 -10.229 -10.966 -7.073 1.00 51.32 H new ATOM 0 HB2 GLN A 98 -9.391 -12.615 -5.618 1.00 74.43 H new ATOM 0 HB3 GLN A 98 -8.383 -11.185 -5.515 1.00 74.43 H new ATOM 0 HG2 GLN A 98 -8.552 -11.857 -3.295 1.00 31.21 H new ATOM 0 HG3 GLN A 98 -9.750 -10.583 -3.404 1.00 31.21 H new ATOM 0 HE21 GLN A 98 -11.376 -11.063 -2.070 1.00 12.34 H new ATOM 0 HE22 GLN A 98 -12.162 -12.639 -1.938 1.00 12.34 H new ATOM 1527 N ASN A 99 -12.641 -10.586 -4.925 1.00 40.41 N ATOM 1528 CA ASN A 99 -14.073 -10.812 -4.793 1.00 1.34 C ATOM 1529 C ASN A 99 -14.809 -10.191 -5.986 1.00 21.00 C ATOM 1530 O ASN A 99 -14.355 -9.179 -6.519 1.00 12.35 O ATOM 1531 CB ASN A 99 -14.585 -10.146 -3.508 1.00 35.20 C ATOM 1532 CG ASN A 99 -14.304 -10.935 -2.234 1.00 4.10 C ATOM 1533 OD1 ASN A 99 -14.311 -12.164 -2.233 1.00 14.41 O ATOM 1534 ND2 ASN A 99 -14.088 -10.225 -1.127 1.00 41.33 N ATOM 0 H ASN A 99 -12.277 -9.871 -4.295 1.00 40.41 H new ATOM 0 HA ASN A 99 -14.257 -11.886 -4.759 1.00 1.34 H new ATOM 0 HB2 ASN A 99 -14.129 -9.160 -3.418 1.00 35.20 H new ATOM 0 HB3 ASN A 99 -15.661 -9.993 -3.596 1.00 35.20 H new ATOM 0 HD21 ASN A 99 -13.921 -10.701 -0.240 1.00 41.33 H new ATOM 0 HD22 ASN A 99 -14.090 -9.206 -1.166 1.00 41.33 H new ATOM 1541 N PRO A 100 -15.970 -10.739 -6.386 1.00 33.15 N ATOM 1542 CA PRO A 100 -16.856 -10.087 -7.335 1.00 11.24 C ATOM 1543 C PRO A 100 -17.446 -8.820 -6.705 1.00 52.11 C ATOM 1544 O PRO A 100 -17.291 -7.729 -7.248 1.00 62.32 O ATOM 1545 CB PRO A 100 -17.927 -11.128 -7.676 1.00 12.32 C ATOM 1546 CG PRO A 100 -17.969 -12.050 -6.456 1.00 1.15 C ATOM 1547 CD PRO A 100 -16.539 -11.993 -5.913 1.00 40.43 C ATOM 0 HA PRO A 100 -16.345 -9.762 -8.241 1.00 11.24 H new ATOM 0 HB2 PRO A 100 -18.895 -10.658 -7.852 1.00 12.32 H new ATOM 0 HB3 PRO A 100 -17.671 -11.679 -8.581 1.00 12.32 H new ATOM 0 HG2 PRO A 100 -18.692 -11.705 -5.717 1.00 1.15 H new ATOM 0 HG3 PRO A 100 -18.254 -13.066 -6.731 1.00 1.15 H new ATOM 0 HD2 PRO A 100 -16.535 -12.035 -4.824 1.00 40.43 H new ATOM 0 HD3 PRO A 100 -15.955 -12.843 -6.267 1.00 40.43 H new ATOM 1555 N THR A 101 -18.119 -8.978 -5.558 1.00 21.40 N ATOM 1556 CA THR A 101 -18.808 -7.930 -4.826 1.00 44.12 C ATOM 1557 C THR A 101 -18.381 -8.009 -3.358 1.00 20.23 C ATOM 1558 O THR A 101 -17.391 -7.387 -2.974 1.00 14.24 O ATOM 1559 CB THR A 101 -20.325 -8.105 -5.020 1.00 42.54 C ATOM 1560 OG1 THR A 101 -20.715 -9.439 -4.744 1.00 23.53 O ATOM 1561 CG2 THR A 101 -20.735 -7.769 -6.455 1.00 55.43 C ATOM 0 H THR A 101 -18.196 -9.887 -5.101 1.00 21.40 H new ATOM 0 HA THR A 101 -18.548 -6.937 -5.194 1.00 44.12 H new ATOM 0 HB THR A 101 -20.821 -7.424 -4.328 1.00 42.54 H new ATOM 0 HG1 THR A 101 -21.682 -9.530 -4.871 1.00 23.53 H new ATOM 0 HG21 THR A 101 -21.811 -7.901 -6.566 1.00 55.43 H new ATOM 0 HG22 THR A 101 -20.471 -6.735 -6.676 1.00 55.43 H new ATOM 0 HG23 THR A 101 -20.215 -8.432 -7.147 1.00 55.43 H new ATOM 1569 N MET A 102 -19.112 -8.801 -2.561 1.00 13.32 N ATOM 1570 CA MET A 102 -18.860 -9.137 -1.174 1.00 22.44 C ATOM 1571 C MET A 102 -18.717 -7.919 -0.259 1.00 2.41 C ATOM 1572 O MET A 102 -18.956 -6.780 -0.660 1.00 63.43 O ATOM 1573 CB MET A 102 -17.675 -10.102 -1.131 1.00 61.55 C ATOM 1574 CG MET A 102 -18.031 -11.495 -1.666 1.00 53.33 C ATOM 1575 SD MET A 102 -18.434 -12.769 -0.434 1.00 2.41 S ATOM 1576 CE MET A 102 -19.582 -11.912 0.682 1.00 1.21 C ATOM 0 H MET A 102 -19.958 -9.253 -2.907 1.00 13.32 H new ATOM 0 HA MET A 102 -19.735 -9.636 -0.757 1.00 22.44 H new ATOM 0 HB2 MET A 102 -16.854 -9.690 -1.718 1.00 61.55 H new ATOM 0 HB3 MET A 102 -17.320 -10.191 -0.104 1.00 61.55 H new ATOM 0 HG2 MET A 102 -18.882 -11.393 -2.339 1.00 53.33 H new ATOM 0 HG3 MET A 102 -17.193 -11.854 -2.264 1.00 53.33 H new ATOM 0 HE1 MET A 102 -19.895 -12.592 1.474 1.00 1.21 H new ATOM 0 HE2 MET A 102 -19.085 -11.047 1.122 1.00 1.21 H new ATOM 0 HE3 MET A 102 -20.456 -11.581 0.121 1.00 1.21 H new ATOM 1586 N PHE A 103 -18.386 -8.189 1.006 1.00 12.32 N ATOM 1587 CA PHE A 103 -18.513 -7.252 2.110 1.00 25.43 C ATOM 1588 C PHE A 103 -17.370 -7.437 3.106 1.00 71.42 C ATOM 1589 O PHE A 103 -16.634 -8.421 3.052 1.00 50.50 O ATOM 1590 CB PHE A 103 -19.865 -7.491 2.790 1.00 44.10 C ATOM 1591 CG PHE A 103 -21.057 -7.195 1.903 1.00 10.54 C ATOM 1592 CD1 PHE A 103 -21.451 -5.861 1.689 1.00 51.10 C ATOM 1593 CD2 PHE A 103 -21.737 -8.238 1.244 1.00 70.43 C ATOM 1594 CE1 PHE A 103 -22.534 -5.573 0.843 1.00 14.45 C ATOM 1595 CE2 PHE A 103 -22.822 -7.948 0.397 1.00 5.13 C ATOM 1596 CZ PHE A 103 -23.216 -6.614 0.192 1.00 54.22 C ATOM 0 H PHE A 103 -18.012 -9.094 1.292 1.00 12.32 H new ATOM 0 HA PHE A 103 -18.461 -6.229 1.737 1.00 25.43 H new ATOM 0 HB2 PHE A 103 -19.917 -8.529 3.118 1.00 44.10 H new ATOM 0 HB3 PHE A 103 -19.926 -6.870 3.684 1.00 44.10 H new ATOM 0 HD1 PHE A 103 -20.919 -5.057 2.176 1.00 51.10 H new ATOM 0 HD2 PHE A 103 -21.425 -9.262 1.389 1.00 70.43 H new ATOM 0 HE1 PHE A 103 -22.843 -4.549 0.693 1.00 14.45 H new ATOM 0 HE2 PHE A 103 -23.352 -8.750 -0.096 1.00 5.13 H new ATOM 0 HZ PHE A 103 -24.043 -6.390 -0.466 1.00 54.22 H new ATOM 1606 N ALA A 104 -17.239 -6.470 4.020 1.00 52.03 N ATOM 1607 CA ALA A 104 -16.181 -6.399 5.016 1.00 70.25 C ATOM 1608 C ALA A 104 -16.131 -7.614 5.950 1.00 40.04 C ATOM 1609 O ALA A 104 -15.060 -7.934 6.463 1.00 32.02 O ATOM 1610 CB ALA A 104 -16.361 -5.112 5.821 1.00 63.02 C ATOM 0 H ALA A 104 -17.894 -5.690 4.083 1.00 52.03 H new ATOM 0 HA ALA A 104 -15.228 -6.400 4.487 1.00 70.25 H new ATOM 0 HB1 ALA A 104 -15.576 -5.041 6.574 1.00 63.02 H new ATOM 0 HB2 ALA A 104 -16.301 -4.253 5.152 1.00 63.02 H new ATOM 0 HB3 ALA A 104 -17.334 -5.123 6.312 1.00 63.02 H new ATOM 1616 N TRP A 105 -17.273 -8.275 6.187 1.00 5.44 N ATOM 1617 CA TRP A 105 -17.388 -9.375 7.140 1.00 34.24 C ATOM 1618 C TRP A 105 -16.398 -10.490 6.795 1.00 33.14 C ATOM 1619 O TRP A 105 -15.559 -10.850 7.619 1.00 51.54 O ATOM 1620 CB TRP A 105 -18.828 -9.909 7.185 1.00 43.13 C ATOM 1621 CG TRP A 105 -19.924 -8.900 7.030 1.00 51.13 C ATOM 1622 CD1 TRP A 105 -20.073 -7.771 7.758 1.00 23.11 C ATOM 1623 CD2 TRP A 105 -21.006 -8.886 6.051 1.00 33.34 C ATOM 1624 NE1 TRP A 105 -21.146 -7.045 7.285 1.00 12.54 N ATOM 1625 CE2 TRP A 105 -21.749 -7.680 6.218 1.00 73.14 C ATOM 1626 CE3 TRP A 105 -21.429 -9.766 5.032 1.00 73.53 C ATOM 1627 CZ2 TRP A 105 -22.835 -7.350 5.393 1.00 14.22 C ATOM 1628 CZ3 TRP A 105 -22.532 -9.454 4.214 1.00 5.25 C ATOM 1629 CH2 TRP A 105 -23.216 -8.237 4.375 1.00 62.34 C ATOM 0 H TRP A 105 -18.149 -8.054 5.714 1.00 5.44 H new ATOM 0 HA TRP A 105 -17.141 -8.998 8.132 1.00 34.24 H new ATOM 0 HB2 TRP A 105 -18.939 -10.656 6.399 1.00 43.13 H new ATOM 0 HB3 TRP A 105 -18.971 -10.423 8.135 1.00 43.13 H new ATOM 0 HD1 TRP A 105 -19.445 -7.480 8.587 1.00 23.11 H new ATOM 0 HE1 TRP A 105 -21.454 -6.154 7.674 1.00 12.54 H new ATOM 0 HE3 TRP A 105 -20.898 -10.694 4.877 1.00 73.53 H new ATOM 0 HZ2 TRP A 105 -23.371 -6.424 5.540 1.00 14.22 H new ATOM 0 HZ3 TRP A 105 -22.854 -10.155 3.458 1.00 5.25 H new ATOM 0 HH2 TRP A 105 -24.034 -7.985 3.716 1.00 62.34 H new ATOM 1640 N GLU A 106 -16.477 -10.984 5.553 1.00 61.44 N ATOM 1641 CA GLU A 106 -15.553 -11.951 4.982 1.00 53.50 C ATOM 1642 C GLU A 106 -14.106 -11.510 5.183 1.00 24.34 C ATOM 1643 O GLU A 106 -13.258 -12.295 5.594 1.00 44.45 O ATOM 1644 CB GLU A 106 -15.824 -12.061 3.475 1.00 34.44 C ATOM 1645 CG GLU A 106 -17.222 -12.605 3.172 1.00 60.10 C ATOM 1646 CD GLU A 106 -17.408 -14.025 3.691 1.00 40.02 C ATOM 1647 OE1 GLU A 106 -16.723 -14.919 3.149 1.00 1.04 O ATOM 1648 OE2 GLU A 106 -18.226 -14.189 4.623 1.00 32.13 O ATOM 0 H GLU A 106 -17.213 -10.708 4.903 1.00 61.44 H new ATOM 0 HA GLU A 106 -15.701 -12.910 5.479 1.00 53.50 H new ATOM 0 HB2 GLU A 106 -15.712 -11.079 3.016 1.00 34.44 H new ATOM 0 HB3 GLU A 106 -15.077 -12.712 3.021 1.00 34.44 H new ATOM 0 HG2 GLU A 106 -17.970 -11.953 3.624 1.00 60.10 H new ATOM 0 HG3 GLU A 106 -17.392 -12.588 2.095 1.00 60.10 H new ATOM 1655 N ILE A 107 -13.839 -10.250 4.837 1.00 60.14 N ATOM 1656 CA ILE A 107 -12.507 -9.719 4.621 1.00 51.43 C ATOM 1657 C ILE A 107 -11.736 -9.599 5.935 1.00 12.13 C ATOM 1658 O ILE A 107 -10.550 -9.927 5.975 1.00 15.31 O ATOM 1659 CB ILE A 107 -12.640 -8.397 3.849 1.00 63.52 C ATOM 1660 CG1 ILE A 107 -13.277 -8.717 2.480 1.00 1.23 C ATOM 1661 CG2 ILE A 107 -11.270 -7.730 3.685 1.00 12.14 C ATOM 1662 CD1 ILE A 107 -13.660 -7.484 1.670 1.00 63.54 C ATOM 0 H ILE A 107 -14.572 -9.555 4.697 1.00 60.14 H new ATOM 0 HA ILE A 107 -11.910 -10.402 4.017 1.00 51.43 H new ATOM 0 HB ILE A 107 -13.270 -7.695 4.395 1.00 63.52 H new ATOM 0 HG12 ILE A 107 -12.579 -9.319 1.898 1.00 1.23 H new ATOM 0 HG13 ILE A 107 -14.167 -9.326 2.639 1.00 1.23 H new ATOM 0 HG21 ILE A 107 -11.384 -6.795 3.136 1.00 12.14 H new ATOM 0 HG22 ILE A 107 -10.845 -7.524 4.668 1.00 12.14 H new ATOM 0 HG23 ILE A 107 -10.605 -8.395 3.135 1.00 12.14 H new ATOM 0 HD11 ILE A 107 -14.101 -7.794 0.722 1.00 63.54 H new ATOM 0 HD12 ILE A 107 -14.383 -6.891 2.230 1.00 63.54 H new ATOM 0 HD13 ILE A 107 -12.770 -6.884 1.478 1.00 63.54 H new ATOM 1674 N ARG A 108 -12.398 -9.151 7.008 1.00 33.13 N ATOM 1675 CA ARG A 108 -11.765 -9.019 8.310 1.00 51.32 C ATOM 1676 C ARG A 108 -11.280 -10.380 8.819 1.00 73.13 C ATOM 1677 O ARG A 108 -10.169 -10.485 9.334 1.00 3.14 O ATOM 1678 CB ARG A 108 -12.723 -8.349 9.298 1.00 52.23 C ATOM 1679 CG ARG A 108 -11.948 -7.772 10.493 1.00 43.24 C ATOM 1680 CD ARG A 108 -12.507 -8.230 11.841 1.00 12.41 C ATOM 1681 NE ARG A 108 -12.084 -9.603 12.155 1.00 24.34 N ATOM 1682 CZ ARG A 108 -12.797 -10.730 11.986 1.00 75.53 C ATOM 1683 NH1 ARG A 108 -14.046 -10.704 11.501 1.00 21.52 N ATOM 1684 NH2 ARG A 108 -12.235 -11.902 12.304 1.00 63.24 N ATOM 0 H ARG A 108 -13.379 -8.874 6.991 1.00 33.13 H new ATOM 0 HA ARG A 108 -10.887 -8.380 8.213 1.00 51.32 H new ATOM 0 HB2 ARG A 108 -13.274 -7.554 8.796 1.00 52.23 H new ATOM 0 HB3 ARG A 108 -13.458 -9.074 9.649 1.00 52.23 H new ATOM 0 HG2 ARG A 108 -10.902 -8.069 10.419 1.00 43.24 H new ATOM 0 HG3 ARG A 108 -11.974 -6.683 10.445 1.00 43.24 H new ATOM 0 HD2 ARG A 108 -12.168 -7.554 12.626 1.00 12.41 H new ATOM 0 HD3 ARG A 108 -13.596 -8.178 11.823 1.00 12.41 H new ATOM 0 HE ARG A 108 -11.147 -9.712 12.543 1.00 24.34 H new ATOM 0 HH11 ARG A 108 -14.477 -9.814 11.250 1.00 21.52 H new ATOM 0 HH12 ARG A 108 -14.565 -11.574 11.383 1.00 21.52 H new ATOM 0 HH21 ARG A 108 -11.282 -11.929 12.667 1.00 63.24 H new ATOM 0 HH22 ARG A 108 -12.759 -12.769 12.183 1.00 63.24 H new ATOM 1698 N ASP A 109 -12.099 -11.426 8.648 1.00 11.55 N ATOM 1699 CA ASP A 109 -11.686 -12.798 8.914 1.00 44.44 C ATOM 1700 C ASP A 109 -10.574 -13.233 7.959 1.00 75.12 C ATOM 1701 O ASP A 109 -9.620 -13.870 8.396 1.00 41.00 O ATOM 1702 CB ASP A 109 -12.884 -13.750 8.841 1.00 15.43 C ATOM 1703 CG ASP A 109 -13.819 -13.564 10.031 1.00 14.21 C ATOM 1704 OD1 ASP A 109 -13.486 -14.102 11.108 1.00 11.31 O ATOM 1705 OD2 ASP A 109 -14.827 -12.842 9.869 1.00 4.24 O ATOM 0 H ASP A 109 -13.062 -11.339 8.322 1.00 11.55 H new ATOM 0 HA ASP A 109 -11.285 -12.840 9.927 1.00 44.44 H new ATOM 0 HB2 ASP A 109 -13.433 -13.576 7.915 1.00 15.43 H new ATOM 0 HB3 ASP A 109 -12.530 -14.781 8.813 1.00 15.43 H new ATOM 1710 N ARG A 110 -10.684 -12.896 6.667 1.00 22.31 N ATOM 1711 CA ARG A 110 -9.751 -13.345 5.641 1.00 30.03 C ATOM 1712 C ARG A 110 -8.312 -12.887 5.904 1.00 21.33 C ATOM 1713 O ARG A 110 -7.376 -13.646 5.654 1.00 63.24 O ATOM 1714 CB ARG A 110 -10.262 -12.994 4.241 1.00 54.44 C ATOM 1715 CG ARG A 110 -9.556 -13.882 3.212 1.00 30.55 C ATOM 1716 CD ARG A 110 -10.265 -13.869 1.859 1.00 30.15 C ATOM 1717 NE ARG A 110 -9.413 -14.526 0.864 1.00 43.33 N ATOM 1718 CZ ARG A 110 -9.740 -14.837 -0.397 1.00 3.23 C ATOM 1719 NH1 ARG A 110 -10.988 -14.665 -0.852 1.00 14.31 N ATOM 1720 NH2 ARG A 110 -8.788 -15.324 -1.201 1.00 3.44 N ATOM 0 H ARG A 110 -11.430 -12.300 6.308 1.00 22.31 H new ATOM 0 HA ARG A 110 -9.705 -14.433 5.692 1.00 30.03 H new ATOM 0 HB2 ARG A 110 -11.341 -13.141 4.187 1.00 54.44 H new ATOM 0 HB3 ARG A 110 -10.072 -11.943 4.024 1.00 54.44 H new ATOM 0 HG2 ARG A 110 -8.528 -13.542 3.085 1.00 30.55 H new ATOM 0 HG3 ARG A 110 -9.510 -14.904 3.587 1.00 30.55 H new ATOM 0 HD2 ARG A 110 -11.223 -14.383 1.932 1.00 30.15 H new ATOM 0 HD3 ARG A 110 -10.476 -12.844 1.555 1.00 30.15 H new ATOM 0 HE ARG A 110 -8.470 -14.773 1.164 1.00 43.33 H new ATOM 0 HH11 ARG A 110 -11.709 -14.291 -0.235 1.00 14.31 H new ATOM 0 HH12 ARG A 110 -11.217 -14.908 -1.816 1.00 14.31 H new ATOM 0 HH21 ARG A 110 -7.839 -15.451 -0.849 1.00 3.44 H new ATOM 0 HH22 ARG A 110 -9.011 -15.569 -2.166 1.00 3.44 H new ATOM 1734 N LEU A 111 -8.144 -11.680 6.462 1.00 11.14 N ATOM 1735 CA LEU A 111 -6.858 -11.176 6.936 1.00 33.41 C ATOM 1736 C LEU A 111 -6.179 -12.158 7.899 1.00 40.23 C ATOM 1737 O LEU A 111 -4.971 -12.372 7.807 1.00 4.34 O ATOM 1738 CB LEU A 111 -7.055 -9.820 7.629 1.00 4.23 C ATOM 1739 CG LEU A 111 -7.264 -8.671 6.632 1.00 2.32 C ATOM 1740 CD1 LEU A 111 -7.899 -7.465 7.328 1.00 42.31 C ATOM 1741 CD2 LEU A 111 -5.925 -8.211 6.045 1.00 21.53 C ATOM 0 H LEU A 111 -8.911 -11.021 6.596 1.00 11.14 H new ATOM 0 HA LEU A 111 -6.208 -11.059 6.069 1.00 33.41 H new ATOM 0 HB2 LEU A 111 -7.916 -9.879 8.295 1.00 4.23 H new ATOM 0 HB3 LEU A 111 -6.185 -9.604 8.250 1.00 4.23 H new ATOM 0 HG LEU A 111 -7.916 -9.043 5.842 1.00 2.32 H new ATOM 0 HD11 LEU A 111 -8.040 -6.661 6.606 1.00 42.31 H new ATOM 0 HD12 LEU A 111 -8.865 -7.752 7.744 1.00 42.31 H new ATOM 0 HD13 LEU A 111 -7.246 -7.122 8.130 1.00 42.31 H new ATOM 0 HD21 LEU A 111 -6.097 -7.396 5.341 1.00 21.53 H new ATOM 0 HD22 LEU A 111 -5.275 -7.865 6.849 1.00 21.53 H new ATOM 0 HD23 LEU A 111 -5.450 -9.044 5.527 1.00 21.53 H new ATOM 1753 N LEU A 112 -6.946 -12.746 8.824 1.00 2.13 N ATOM 1754 CA LEU A 112 -6.435 -13.688 9.810 1.00 50.45 C ATOM 1755 C LEU A 112 -6.242 -15.068 9.184 1.00 2.51 C ATOM 1756 O LEU A 112 -5.197 -15.688 9.367 1.00 24.21 O ATOM 1757 CB LEU A 112 -7.390 -13.771 11.009 1.00 20.51 C ATOM 1758 CG LEU A 112 -7.658 -12.414 11.677 1.00 62.13 C ATOM 1759 CD1 LEU A 112 -8.509 -12.622 12.936 1.00 34.11 C ATOM 1760 CD2 LEU A 112 -6.345 -11.721 12.052 1.00 13.51 C ATOM 0 H LEU A 112 -7.948 -12.575 8.905 1.00 2.13 H new ATOM 0 HA LEU A 112 -5.466 -13.332 10.160 1.00 50.45 H new ATOM 0 HB2 LEU A 112 -8.337 -14.198 10.679 1.00 20.51 H new ATOM 0 HB3 LEU A 112 -6.973 -14.454 11.749 1.00 20.51 H new ATOM 0 HG LEU A 112 -8.193 -11.779 10.970 1.00 62.13 H new ATOM 0 HD11 LEU A 112 -8.699 -11.659 13.410 1.00 34.11 H new ATOM 0 HD12 LEU A 112 -9.457 -13.085 12.662 1.00 34.11 H new ATOM 0 HD13 LEU A 112 -7.977 -13.270 13.632 1.00 34.11 H new ATOM 0 HD21 LEU A 112 -6.561 -10.762 12.523 1.00 13.51 H new ATOM 0 HD22 LEU A 112 -5.787 -12.349 12.747 1.00 13.51 H new ATOM 0 HD23 LEU A 112 -5.750 -11.558 11.153 1.00 13.51 H new ATOM 1772 N ALA A 113 -7.261 -15.542 8.458 1.00 63.43 N ATOM 1773 CA ALA A 113 -7.330 -16.874 7.874 1.00 72.02 C ATOM 1774 C ALA A 113 -6.111 -17.173 7.003 1.00 43.02 C ATOM 1775 O ALA A 113 -5.452 -18.194 7.190 1.00 25.55 O ATOM 1776 CB ALA A 113 -8.619 -17.001 7.058 1.00 64.05 C ATOM 0 H ALA A 113 -8.089 -14.982 8.257 1.00 63.43 H new ATOM 0 HA ALA A 113 -7.334 -17.606 8.682 1.00 72.02 H new ATOM 0 HB1 ALA A 113 -8.675 -17.997 6.619 1.00 64.05 H new ATOM 0 HB2 ALA A 113 -9.479 -16.843 7.709 1.00 64.05 H new ATOM 0 HB3 ALA A 113 -8.622 -16.254 6.264 1.00 64.05 H new ATOM 1782 N GLU A 114 -5.809 -16.276 6.058 1.00 33.24 N ATOM 1783 CA GLU A 114 -4.672 -16.415 5.158 1.00 52.32 C ATOM 1784 C GLU A 114 -3.330 -16.137 5.850 1.00 62.13 C ATOM 1785 O GLU A 114 -2.283 -16.390 5.257 1.00 43.34 O ATOM 1786 CB GLU A 114 -4.855 -15.471 3.968 1.00 51.12 C ATOM 1787 CG GLU A 114 -6.060 -15.848 3.098 1.00 13.12 C ATOM 1788 CD GLU A 114 -6.091 -15.021 1.816 1.00 40.04 C ATOM 1789 OE1 GLU A 114 -5.453 -13.949 1.809 1.00 41.52 O ATOM 1790 OE2 GLU A 114 -6.771 -15.468 0.861 1.00 50.55 O ATOM 0 H GLU A 114 -6.354 -15.429 5.900 1.00 33.24 H new ATOM 0 HA GLU A 114 -4.642 -17.451 4.821 1.00 52.32 H new ATOM 0 HB2 GLU A 114 -4.980 -14.452 4.333 1.00 51.12 H new ATOM 0 HB3 GLU A 114 -3.952 -15.483 3.357 1.00 51.12 H new ATOM 0 HG2 GLU A 114 -6.016 -16.908 2.850 1.00 13.12 H new ATOM 0 HG3 GLU A 114 -6.981 -15.690 3.659 1.00 13.12 H new ATOM 1797 N GLY A 115 -3.343 -15.598 7.077 1.00 54.14 N ATOM 1798 CA GLY A 115 -2.136 -15.204 7.787 1.00 1.02 C ATOM 1799 C GLY A 115 -1.503 -13.978 7.131 1.00 3.00 C ATOM 1800 O GLY A 115 -0.300 -13.955 6.880 1.00 11.43 O ATOM 0 H GLY A 115 -4.201 -15.425 7.601 1.00 54.14 H new ATOM 0 HA2 GLY A 115 -2.375 -14.984 8.827 1.00 1.02 H new ATOM 0 HA3 GLY A 115 -1.424 -16.029 7.791 1.00 1.02 H new ATOM 1804 N VAL A 116 -2.333 -12.968 6.846 1.00 3.33 N ATOM 1805 CA VAL A 116 -1.966 -11.734 6.162 1.00 51.21 C ATOM 1806 C VAL A 116 -1.862 -10.578 7.162 1.00 61.05 C ATOM 1807 O VAL A 116 -1.092 -9.645 6.932 1.00 61.35 O ATOM 1808 CB VAL A 116 -2.983 -11.479 5.036 1.00 61.11 C ATOM 1809 CG1 VAL A 116 -2.826 -10.107 4.376 1.00 54.35 C ATOM 1810 CG2 VAL A 116 -2.796 -12.545 3.951 1.00 3.23 C ATOM 0 H VAL A 116 -3.321 -12.995 7.099 1.00 3.33 H new ATOM 0 HA VAL A 116 -0.979 -11.820 5.707 1.00 51.21 H new ATOM 0 HB VAL A 116 -3.973 -11.518 5.491 1.00 61.11 H new ATOM 0 HG11 VAL A 116 -3.574 -9.993 3.591 1.00 54.35 H new ATOM 0 HG12 VAL A 116 -2.963 -9.326 5.124 1.00 54.35 H new ATOM 0 HG13 VAL A 116 -1.829 -10.024 3.942 1.00 54.35 H new ATOM 0 HG21 VAL A 116 -3.512 -12.375 3.147 1.00 3.23 H new ATOM 0 HG22 VAL A 116 -1.783 -12.486 3.554 1.00 3.23 H new ATOM 0 HG23 VAL A 116 -2.960 -13.533 4.380 1.00 3.23 H new ATOM 1820 N CYS A 117 -2.605 -10.649 8.276 1.00 31.04 N ATOM 1821 CA CYS A 117 -2.455 -9.754 9.417 1.00 60.41 C ATOM 1822 C CYS A 117 -2.604 -10.559 10.713 1.00 31.32 C ATOM 1823 O CYS A 117 -3.302 -11.571 10.730 1.00 73.25 O ATOM 1824 CB CYS A 117 -3.487 -8.623 9.329 1.00 63.44 C ATOM 1825 SG CYS A 117 -2.926 -7.178 10.264 1.00 41.05 S ATOM 0 H CYS A 117 -3.339 -11.346 8.405 1.00 31.04 H new ATOM 0 HA CYS A 117 -1.465 -9.299 9.411 1.00 60.41 H new ATOM 0 HB2 CYS A 117 -3.647 -8.349 8.286 1.00 63.44 H new ATOM 0 HB3 CYS A 117 -4.445 -8.966 9.719 1.00 63.44 H new ATOM 0 HG CYS A 117 -3.700 -6.166 10.005 1.00 41.05 H new ATOM 1831 N ASP A 118 -1.932 -10.118 11.786 1.00 23.51 N ATOM 1832 CA ASP A 118 -1.950 -10.795 13.081 1.00 54.41 C ATOM 1833 C ASP A 118 -3.256 -10.511 13.834 1.00 62.51 C ATOM 1834 O ASP A 118 -3.913 -9.498 13.601 1.00 24.42 O ATOM 1835 CB ASP A 118 -0.709 -10.418 13.907 1.00 53.31 C ATOM 1836 CG ASP A 118 -0.812 -10.930 15.339 1.00 1.31 C ATOM 1837 OD1 ASP A 118 -0.707 -12.163 15.516 1.00 61.50 O ATOM 1838 OD2 ASP A 118 -1.078 -10.088 16.224 1.00 43.34 O ATOM 0 H ASP A 118 -1.358 -9.275 11.775 1.00 23.51 H new ATOM 0 HA ASP A 118 -1.912 -11.871 12.910 1.00 54.41 H new ATOM 0 HB2 ASP A 118 0.182 -10.832 13.435 1.00 53.31 H new ATOM 0 HB3 ASP A 118 -0.592 -9.334 13.915 1.00 53.31 H new ATOM 1843 N ASN A 119 -3.613 -11.431 14.740 1.00 22.32 N ATOM 1844 CA ASN A 119 -4.823 -11.413 15.552 1.00 0.15 C ATOM 1845 C ASN A 119 -5.032 -10.102 16.317 1.00 75.21 C ATOM 1846 O ASN A 119 -6.176 -9.695 16.507 1.00 23.45 O ATOM 1847 CB ASN A 119 -4.844 -12.626 16.497 1.00 64.11 C ATOM 1848 CG ASN A 119 -4.013 -12.438 17.769 1.00 41.10 C ATOM 1849 OD1 ASN A 119 -4.571 -12.365 18.862 1.00 31.45 O ATOM 1850 ND2 ASN A 119 -2.686 -12.367 17.651 1.00 65.41 N ATOM 0 H ASN A 119 -3.032 -12.247 14.931 1.00 22.32 H new ATOM 0 HA ASN A 119 -5.665 -11.480 14.863 1.00 0.15 H new ATOM 0 HB2 ASN A 119 -5.876 -12.838 16.777 1.00 64.11 H new ATOM 0 HB3 ASN A 119 -4.474 -13.499 15.959 1.00 64.11 H new ATOM 0 HD21 ASN A 119 -2.106 -12.249 18.482 1.00 65.41 H new ATOM 0 HD22 ASN A 119 -2.252 -12.431 16.730 1.00 65.41 H new ATOM 1857 N ASP A 120 -3.949 -9.449 16.759 1.00 12.11 N ATOM 1858 CA ASP A 120 -4.022 -8.180 17.466 1.00 32.21 C ATOM 1859 C ASP A 120 -4.076 -7.035 16.459 1.00 73.30 C ATOM 1860 O ASP A 120 -4.921 -6.147 16.561 1.00 13.50 O ATOM 1861 CB ASP A 120 -2.805 -8.039 18.384 1.00 25.32 C ATOM 1862 CG ASP A 120 -2.817 -6.709 19.132 1.00 32.22 C ATOM 1863 OD1 ASP A 120 -3.531 -6.639 20.156 1.00 25.23 O ATOM 1864 OD2 ASP A 120 -2.119 -5.785 18.660 1.00 54.40 O ATOM 0 H ASP A 120 -2.998 -9.794 16.632 1.00 12.11 H new ATOM 0 HA ASP A 120 -4.925 -8.147 18.075 1.00 32.21 H new ATOM 0 HB2 ASP A 120 -2.792 -8.860 19.101 1.00 25.32 H new ATOM 0 HB3 ASP A 120 -1.892 -8.117 17.794 1.00 25.32 H new ATOM 1869 N THR A 121 -3.144 -7.055 15.502 1.00 24.43 N ATOM 1870 CA THR A 121 -2.867 -5.934 14.618 1.00 64.23 C ATOM 1871 C THR A 121 -3.983 -5.693 13.594 1.00 22.41 C ATOM 1872 O THR A 121 -4.092 -4.586 13.067 1.00 10.32 O ATOM 1873 CB THR A 121 -1.506 -6.126 13.935 1.00 64.44 C ATOM 1874 OG1 THR A 121 -1.545 -7.238 13.069 1.00 62.42 O ATOM 1875 CG2 THR A 121 -0.377 -6.326 14.952 1.00 1.32 C ATOM 0 H THR A 121 -2.554 -7.867 15.322 1.00 24.43 H new ATOM 0 HA THR A 121 -2.829 -5.035 15.233 1.00 64.23 H new ATOM 0 HB THR A 121 -1.302 -5.217 13.369 1.00 64.44 H new ATOM 0 HG1 THR A 121 -1.970 -6.980 12.224 1.00 62.42 H new ATOM 0 HG21 THR A 121 0.568 -6.458 14.425 1.00 1.32 H new ATOM 0 HG22 THR A 121 -0.312 -5.452 15.600 1.00 1.32 H new ATOM 0 HG23 THR A 121 -0.583 -7.210 15.555 1.00 1.32 H new ATOM 1883 N VAL A 122 -4.798 -6.717 13.305 1.00 5.41 N ATOM 1884 CA VAL A 122 -5.914 -6.655 12.370 1.00 51.24 C ATOM 1885 C VAL A 122 -6.840 -5.461 12.666 1.00 41.24 C ATOM 1886 O VAL A 122 -7.225 -5.262 13.817 1.00 74.31 O ATOM 1887 CB VAL A 122 -6.667 -7.999 12.393 1.00 42.13 C ATOM 1888 CG1 VAL A 122 -7.399 -8.245 13.722 1.00 12.41 C ATOM 1889 CG2 VAL A 122 -7.653 -8.136 11.230 1.00 22.13 C ATOM 0 H VAL A 122 -4.690 -7.637 13.732 1.00 5.41 H new ATOM 0 HA VAL A 122 -5.529 -6.490 11.364 1.00 51.24 H new ATOM 0 HB VAL A 122 -5.895 -8.760 12.283 1.00 42.13 H new ATOM 0 HG11 VAL A 122 -7.912 -9.206 13.682 1.00 12.41 H new ATOM 0 HG12 VAL A 122 -6.677 -8.252 14.539 1.00 12.41 H new ATOM 0 HG13 VAL A 122 -8.127 -7.451 13.889 1.00 12.41 H new ATOM 0 HG21 VAL A 122 -8.157 -9.100 11.292 1.00 22.13 H new ATOM 0 HG22 VAL A 122 -8.391 -7.336 11.283 1.00 22.13 H new ATOM 0 HG23 VAL A 122 -7.113 -8.069 10.285 1.00 22.13 H new ATOM 1899 N PRO A 123 -7.207 -4.656 11.654 1.00 11.41 N ATOM 1900 CA PRO A 123 -8.143 -3.553 11.812 1.00 32.02 C ATOM 1901 C PRO A 123 -9.576 -4.070 11.967 1.00 51.11 C ATOM 1902 O PRO A 123 -9.893 -5.197 11.587 1.00 14.03 O ATOM 1903 CB PRO A 123 -7.997 -2.718 10.538 1.00 35.04 C ATOM 1904 CG PRO A 123 -7.631 -3.772 9.495 1.00 55.15 C ATOM 1905 CD PRO A 123 -6.731 -4.719 10.282 1.00 12.12 C ATOM 0 HA PRO A 123 -7.933 -2.967 12.707 1.00 32.02 H new ATOM 0 HB2 PRO A 123 -8.921 -2.199 10.284 1.00 35.04 H new ATOM 0 HB3 PRO A 123 -7.222 -1.958 10.637 1.00 35.04 H new ATOM 0 HG2 PRO A 123 -8.513 -4.281 9.106 1.00 55.15 H new ATOM 0 HG3 PRO A 123 -7.112 -3.335 8.642 1.00 55.15 H new ATOM 0 HD2 PRO A 123 -6.793 -5.735 9.891 1.00 12.12 H new ATOM 0 HD3 PRO A 123 -5.687 -4.415 10.215 1.00 12.12 H new ATOM 1913 N SER A 124 -10.447 -3.216 12.513 1.00 23.05 N ATOM 1914 CA SER A 124 -11.866 -3.496 12.689 1.00 62.10 C ATOM 1915 C SER A 124 -12.558 -3.735 11.346 1.00 40.13 C ATOM 1916 O SER A 124 -12.168 -3.150 10.336 1.00 75.54 O ATOM 1917 CB SER A 124 -12.523 -2.304 13.393 1.00 71.41 C ATOM 1918 OG SER A 124 -12.194 -2.301 14.766 1.00 14.44 O ATOM 0 H SER A 124 -10.175 -2.293 12.850 1.00 23.05 H new ATOM 0 HA SER A 124 -11.969 -4.400 13.288 1.00 62.10 H new ATOM 0 HB2 SER A 124 -12.193 -1.374 12.931 1.00 71.41 H new ATOM 0 HB3 SER A 124 -13.605 -2.353 13.272 1.00 71.41 H new ATOM 0 HG SER A 124 -12.619 -1.533 15.203 1.00 14.44 H new ATOM 1924 N VAL A 125 -13.629 -4.541 11.368 1.00 3.11 N ATOM 1925 CA VAL A 125 -14.545 -4.724 10.245 1.00 74.04 C ATOM 1926 C VAL A 125 -15.057 -3.362 9.760 1.00 54.03 C ATOM 1927 O VAL A 125 -15.107 -3.101 8.561 1.00 61.20 O ATOM 1928 CB VAL A 125 -15.677 -5.695 10.643 1.00 53.22 C ATOM 1929 CG1 VAL A 125 -16.625 -5.140 11.716 1.00 42.11 C ATOM 1930 CG2 VAL A 125 -16.494 -6.136 9.424 1.00 0.23 C ATOM 0 H VAL A 125 -13.884 -5.093 12.187 1.00 3.11 H new ATOM 0 HA VAL A 125 -14.023 -5.179 9.403 1.00 74.04 H new ATOM 0 HB VAL A 125 -15.167 -6.555 11.077 1.00 53.22 H new ATOM 0 HG11 VAL A 125 -17.393 -5.880 11.942 1.00 42.11 H new ATOM 0 HG12 VAL A 125 -16.060 -4.916 12.621 1.00 42.11 H new ATOM 0 HG13 VAL A 125 -17.097 -4.229 11.349 1.00 42.11 H new ATOM 0 HG21 VAL A 125 -17.282 -6.819 9.742 1.00 0.23 H new ATOM 0 HG22 VAL A 125 -16.941 -5.262 8.950 1.00 0.23 H new ATOM 0 HG23 VAL A 125 -15.841 -6.641 8.712 1.00 0.23 H new ATOM 1940 N SER A 126 -15.379 -2.472 10.706 1.00 31.10 N ATOM 1941 CA SER A 126 -15.788 -1.104 10.440 1.00 65.42 C ATOM 1942 C SER A 126 -14.655 -0.271 9.831 1.00 2.12 C ATOM 1943 O SER A 126 -14.926 0.620 9.028 1.00 14.41 O ATOM 1944 CB SER A 126 -16.272 -0.466 11.745 1.00 70.32 C ATOM 1945 OG SER A 126 -17.279 -1.266 12.328 1.00 70.24 O ATOM 0 H SER A 126 -15.359 -2.697 11.701 1.00 31.10 H new ATOM 0 HA SER A 126 -16.596 -1.125 9.709 1.00 65.42 H new ATOM 0 HB2 SER A 126 -15.437 -0.356 12.437 1.00 70.32 H new ATOM 0 HB3 SER A 126 -16.658 0.534 11.549 1.00 70.32 H new ATOM 0 HG SER A 126 -17.583 -0.853 13.163 1.00 70.24 H new ATOM 1951 N SER A 127 -13.398 -0.536 10.218 1.00 5.25 N ATOM 1952 CA SER A 127 -12.258 0.277 9.808 1.00 40.41 C ATOM 1953 C SER A 127 -11.788 -0.071 8.400 1.00 52.33 C ATOM 1954 O SER A 127 -11.233 0.801 7.740 1.00 1.24 O ATOM 1955 CB SER A 127 -11.113 0.193 10.820 1.00 2.44 C ATOM 1956 OG SER A 127 -11.457 0.916 11.983 1.00 70.34 O ATOM 0 H SER A 127 -13.150 -1.319 10.822 1.00 5.25 H new ATOM 0 HA SER A 127 -12.597 1.313 9.785 1.00 40.41 H new ATOM 0 HB2 SER A 127 -10.913 -0.848 11.072 1.00 2.44 H new ATOM 0 HB3 SER A 127 -10.199 0.597 10.385 1.00 2.44 H new ATOM 0 HG SER A 127 -10.724 0.860 12.631 1.00 70.34 H new ATOM 1962 N ILE A 128 -12.027 -1.302 7.930 1.00 40.32 N ATOM 1963 CA ILE A 128 -11.881 -1.644 6.518 1.00 31.24 C ATOM 1964 C ILE A 128 -13.105 -1.178 5.715 1.00 22.34 C ATOM 1965 O ILE A 128 -12.950 -0.681 4.601 1.00 13.04 O ATOM 1966 CB ILE A 128 -11.580 -3.140 6.307 1.00 13.42 C ATOM 1967 CG1 ILE A 128 -12.642 -4.049 6.937 1.00 44.25 C ATOM 1968 CG2 ILE A 128 -10.177 -3.487 6.827 1.00 2.40 C ATOM 1969 CD1 ILE A 128 -12.375 -5.532 6.703 1.00 23.12 C ATOM 0 H ILE A 128 -12.325 -2.081 8.517 1.00 40.32 H new ATOM 0 HA ILE A 128 -11.012 -1.107 6.137 1.00 31.24 H new ATOM 0 HB ILE A 128 -11.611 -3.325 5.233 1.00 13.42 H new ATOM 0 HG12 ILE A 128 -12.685 -3.858 8.009 1.00 44.25 H new ATOM 0 HG13 ILE A 128 -13.620 -3.793 6.528 1.00 44.25 H new ATOM 0 HG21 ILE A 128 -9.983 -4.548 6.669 1.00 2.40 H new ATOM 0 HG22 ILE A 128 -9.434 -2.898 6.290 1.00 2.40 H new ATOM 0 HG23 ILE A 128 -10.118 -3.262 7.892 1.00 2.40 H new ATOM 0 HD11 ILE A 128 -13.162 -6.122 7.173 1.00 23.12 H new ATOM 0 HD12 ILE A 128 -12.361 -5.735 5.632 1.00 23.12 H new ATOM 0 HD13 ILE A 128 -11.412 -5.801 7.136 1.00 23.12 H new ATOM 1981 N ASN A 129 -14.317 -1.328 6.270 1.00 32.13 N ATOM 1982 CA ASN A 129 -15.563 -0.973 5.597 1.00 53.11 C ATOM 1983 C ASN A 129 -15.604 0.513 5.239 1.00 51.24 C ATOM 1984 O ASN A 129 -15.936 0.861 4.108 1.00 1.21 O ATOM 1985 CB ASN A 129 -16.756 -1.344 6.486 1.00 54.43 C ATOM 1986 CG ASN A 129 -18.100 -0.995 5.846 1.00 70.13 C ATOM 1987 OD1 ASN A 129 -18.860 -0.192 6.383 1.00 23.44 O ATOM 1988 ND2 ASN A 129 -18.402 -1.604 4.697 1.00 2.12 N ATOM 0 H ASN A 129 -14.455 -1.703 7.208 1.00 32.13 H new ATOM 0 HA ASN A 129 -15.619 -1.535 4.665 1.00 53.11 H new ATOM 0 HB2 ASN A 129 -16.726 -2.413 6.699 1.00 54.43 H new ATOM 0 HB3 ASN A 129 -16.667 -0.826 7.441 1.00 54.43 H new ATOM 0 HD21 ASN A 129 -19.290 -1.409 4.234 1.00 2.12 H new ATOM 0 HD22 ASN A 129 -17.745 -2.265 4.282 1.00 2.12 H new ATOM 1995 N ARG A 130 -15.288 1.382 6.206 1.00 24.22 N ATOM 1996 CA ARG A 130 -15.419 2.829 6.071 1.00 45.45 C ATOM 1997 C ARG A 130 -14.661 3.421 4.875 1.00 24.41 C ATOM 1998 O ARG A 130 -15.068 4.469 4.376 1.00 75.32 O ATOM 1999 CB ARG A 130 -15.100 3.535 7.397 1.00 34.41 C ATOM 2000 CG ARG A 130 -13.682 3.280 7.921 1.00 63.52 C ATOM 2001 CD ARG A 130 -12.737 4.464 7.690 1.00 70.01 C ATOM 2002 NE ARG A 130 -11.349 4.105 8.016 1.00 33.54 N ATOM 2003 CZ ARG A 130 -10.866 3.829 9.240 1.00 74.23 C ATOM 2004 NH1 ARG A 130 -11.617 3.999 10.337 1.00 53.30 N ATOM 2005 NH2 ARG A 130 -9.613 3.372 9.363 1.00 44.33 N ATOM 0 H ARG A 130 -14.929 1.091 7.115 1.00 24.22 H new ATOM 0 HA ARG A 130 -16.466 3.022 5.837 1.00 45.45 H new ATOM 0 HB2 ARG A 130 -15.239 4.608 7.267 1.00 34.41 H new ATOM 0 HB3 ARG A 130 -15.817 3.210 8.150 1.00 34.41 H new ATOM 0 HG2 ARG A 130 -13.729 3.062 8.988 1.00 63.52 H new ATOM 0 HG3 ARG A 130 -13.274 2.395 7.432 1.00 63.52 H new ATOM 0 HD2 ARG A 130 -12.798 4.785 6.650 1.00 70.01 H new ATOM 0 HD3 ARG A 130 -13.051 5.309 8.303 1.00 70.01 H new ATOM 0 HE ARG A 130 -10.689 4.061 7.239 1.00 33.54 H new ATOM 0 HH11 ARG A 130 -12.573 4.343 10.252 1.00 53.30 H new ATOM 0 HH12 ARG A 130 -11.232 3.784 11.257 1.00 53.30 H new ATOM 0 HH21 ARG A 130 -9.036 3.237 8.533 1.00 44.33 H new ATOM 0 HH22 ARG A 130 -9.236 3.159 10.287 1.00 44.33 H new ATOM 2019 N ILE A 131 -13.608 2.756 4.376 1.00 1.44 N ATOM 2020 CA ILE A 131 -12.957 3.145 3.129 1.00 42.11 C ATOM 2021 C ILE A 131 -14.007 3.091 2.015 1.00 1.11 C ATOM 2022 O ILE A 131 -14.370 4.122 1.455 1.00 21.41 O ATOM 2023 CB ILE A 131 -11.742 2.235 2.835 1.00 74.00 C ATOM 2024 CG1 ILE A 131 -10.549 2.499 3.775 1.00 41.50 C ATOM 2025 CG2 ILE A 131 -11.224 2.441 1.402 1.00 2.22 C ATOM 2026 CD1 ILE A 131 -10.780 2.070 5.223 1.00 11.23 C ATOM 0 H ILE A 131 -13.191 1.941 4.826 1.00 1.44 H new ATOM 0 HA ILE A 131 -12.563 4.159 3.201 1.00 42.11 H new ATOM 0 HB ILE A 131 -12.111 1.220 2.985 1.00 74.00 H new ATOM 0 HG12 ILE A 131 -9.675 1.975 3.389 1.00 41.50 H new ATOM 0 HG13 ILE A 131 -10.316 3.564 3.757 1.00 41.50 H new ATOM 0 HG21 ILE A 131 -10.370 1.787 1.226 1.00 2.22 H new ATOM 0 HG22 ILE A 131 -12.015 2.203 0.691 1.00 2.22 H new ATOM 0 HG23 ILE A 131 -10.919 3.479 1.271 1.00 2.22 H new ATOM 0 HD11 ILE A 131 -9.892 2.292 5.814 1.00 11.23 H new ATOM 0 HD12 ILE A 131 -11.633 2.612 5.632 1.00 11.23 H new ATOM 0 HD13 ILE A 131 -10.981 0.999 5.258 1.00 11.23 H new ATOM 2038 N ILE A 132 -14.512 1.889 1.723 1.00 55.23 N ATOM 2039 CA ILE A 132 -15.519 1.632 0.701 1.00 52.51 C ATOM 2040 C ILE A 132 -16.713 2.575 0.882 1.00 24.13 C ATOM 2041 O ILE A 132 -17.205 3.114 -0.105 1.00 1.22 O ATOM 2042 CB ILE A 132 -15.945 0.146 0.707 1.00 23.21 C ATOM 2043 CG1 ILE A 132 -14.849 -0.798 0.172 1.00 65.13 C ATOM 2044 CG2 ILE A 132 -17.191 -0.070 -0.168 1.00 41.25 C ATOM 2045 CD1 ILE A 132 -13.612 -0.922 1.065 1.00 74.52 C ATOM 0 H ILE A 132 -14.218 1.043 2.211 1.00 55.23 H new ATOM 0 HA ILE A 132 -15.086 1.834 -0.279 1.00 52.51 H new ATOM 0 HB ILE A 132 -16.145 -0.091 1.752 1.00 23.21 H new ATOM 0 HG12 ILE A 132 -15.280 -1.790 0.034 1.00 65.13 H new ATOM 0 HG13 ILE A 132 -14.536 -0.447 -0.811 1.00 65.13 H new ATOM 0 HG21 ILE A 132 -17.472 -1.123 -0.148 1.00 41.25 H new ATOM 0 HG22 ILE A 132 -18.014 0.532 0.216 1.00 41.25 H new ATOM 0 HG23 ILE A 132 -16.972 0.228 -1.193 1.00 41.25 H new ATOM 0 HD11 ILE A 132 -12.899 -1.606 0.606 1.00 74.52 H new ATOM 0 HD12 ILE A 132 -13.150 0.058 1.184 1.00 74.52 H new ATOM 0 HD13 ILE A 132 -13.906 -1.306 2.042 1.00 74.52 H new ATOM 2057 N ARG A 133 -17.167 2.792 2.124 1.00 34.40 N ATOM 2058 CA ARG A 133 -18.299 3.667 2.404 1.00 14.31 C ATOM 2059 C ARG A 133 -18.022 5.099 1.937 1.00 75.34 C ATOM 2060 O ARG A 133 -18.801 5.649 1.160 1.00 33.40 O ATOM 2061 CB ARG A 133 -18.659 3.650 3.895 1.00 60.44 C ATOM 2062 CG ARG A 133 -19.034 2.259 4.427 1.00 75.23 C ATOM 2063 CD ARG A 133 -20.455 1.818 4.055 1.00 52.54 C ATOM 2064 NE ARG A 133 -21.476 2.629 4.732 1.00 45.31 N ATOM 2065 CZ ARG A 133 -21.824 2.516 6.026 1.00 72.45 C ATOM 2066 NH1 ARG A 133 -21.249 1.601 6.823 1.00 74.35 N ATOM 2067 NH2 ARG A 133 -22.761 3.331 6.528 1.00 4.02 N ATOM 0 H ARG A 133 -16.758 2.365 2.955 1.00 34.40 H new ATOM 0 HA ARG A 133 -19.152 3.285 1.843 1.00 14.31 H new ATOM 0 HB2 ARG A 133 -17.814 4.032 4.468 1.00 60.44 H new ATOM 0 HB3 ARG A 133 -19.493 4.331 4.065 1.00 60.44 H new ATOM 0 HG2 ARG A 133 -18.324 1.528 4.040 1.00 75.23 H new ATOM 0 HG3 ARG A 133 -18.935 2.256 5.512 1.00 75.23 H new ATOM 0 HD2 ARG A 133 -20.588 1.894 2.976 1.00 52.54 H new ATOM 0 HD3 ARG A 133 -20.590 0.769 4.319 1.00 52.54 H new ATOM 0 HE ARG A 133 -21.960 3.334 4.176 1.00 45.31 H new ATOM 0 HH11 ARG A 133 -20.535 0.976 6.449 1.00 74.35 H new ATOM 0 HH12 ARG A 133 -21.527 1.531 7.802 1.00 74.35 H new ATOM 0 HH21 ARG A 133 -23.203 4.029 5.930 1.00 4.02 H new ATOM 0 HH22 ARG A 133 -23.032 3.254 7.508 1.00 4.02 H new ATOM 2081 N THR A 134 -16.921 5.703 2.405 1.00 63.15 N ATOM 2082 CA THR A 134 -16.562 7.074 2.048 1.00 75.30 C ATOM 2083 C THR A 134 -16.414 7.249 0.533 1.00 12.34 C ATOM 2084 O THR A 134 -16.766 8.307 0.014 1.00 41.42 O ATOM 2085 CB THR A 134 -15.302 7.541 2.797 1.00 14.35 C ATOM 2086 OG1 THR A 134 -14.229 6.637 2.627 1.00 12.34 O ATOM 2087 CG2 THR A 134 -15.578 7.750 4.289 1.00 34.44 C ATOM 0 H THR A 134 -16.260 5.254 3.039 1.00 63.15 H new ATOM 0 HA THR A 134 -17.386 7.714 2.365 1.00 75.30 H new ATOM 0 HB THR A 134 -15.017 8.499 2.361 1.00 14.35 H new ATOM 0 HG1 THR A 134 -14.531 5.866 2.103 1.00 12.34 H new ATOM 0 HG21 THR A 134 -14.665 8.080 4.785 1.00 34.44 H new ATOM 0 HG22 THR A 134 -16.352 8.507 4.413 1.00 34.44 H new ATOM 0 HG23 THR A 134 -15.913 6.812 4.732 1.00 34.44 H new