USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=18 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 99 ASN : amide:sc= 0.517 K(o=0.98,f=-5!) USER MOD Set 1.2: A 101 THR OG1 : rot -5:sc= 0.464 USER MOD Set 2.1: A 91 LYS NZ :NH3+ 171:sc= 0.94 (180deg=-0.165) USER MOD Set 2.2: A 95 TYR OH : rot 30:sc= 0.865 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 4 ASN : amide:sc= -0.425 X(o=-0.42,f=-0.81) USER MOD Single : A 5 SER OG : rot 117:sc= 0.79 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 14 ASN : amide:sc= -0.131 X(o=-0.13,f=-0.13) USER MOD Single : A 15 GLN : amide:sc= -0.546 X(o=-0.55,f=-1) USER MOD Single : A 32 GLN : amide:sc= 0.475 K(o=0.48,f=-4.2!) USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 40 GLN : amide:sc= 0.661 K(o=0.66,f=0) USER MOD Single : A 45 CYS SG : rot 180:sc= -0.0423 USER MOD Single : A 48 SER OG : rot -132:sc= 0.736 USER MOD Single : A 50 GLN : amide:sc= 0.447 X(o=0.45,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.032) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 140:sc= 0.509 (180deg=0.189) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 102 MET CE :methyl -170:sc= -0.0299 (180deg=-0.356) USER MOD Single : A 117 CYS SG : rot 20:sc= -0.138 USER MOD Single : A 119 ASN : amide:sc= -0.0217 K(o=-0.022,f=-1.5) USER MOD Single : A 121 THR OG1 : rot -25:sc= 0.434 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 -38:sc= 1.11 USER MOD Single : A 129 ASN : amide:sc= 0.68 K(o=0.68,f=-4.8!) USER MOD Single : A 134 THR OG1 : rot -43:sc= 0.743 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 55.013 27.291 94.583 1.00 41.13 N ATOM 35 CA HIS A 3 54.620 25.923 94.890 1.00 34.14 C ATOM 36 C HIS A 3 55.034 24.979 93.761 1.00 52.00 C ATOM 37 O HIS A 3 55.801 24.046 93.994 1.00 24.00 O ATOM 38 CB HIS A 3 53.105 25.870 95.137 1.00 23.43 C ATOM 39 CG HIS A 3 52.557 24.470 95.266 1.00 60.03 C ATOM 40 ND1 HIS A 3 53.172 23.490 96.030 1.00 52.24 N ATOM 41 CD2 HIS A 3 51.465 23.855 94.702 1.00 44.40 C ATOM 42 CE1 HIS A 3 52.450 22.365 95.893 1.00 24.52 C ATOM 43 NE2 HIS A 3 51.389 22.524 95.099 1.00 64.51 N ATOM 0 HA HIS A 3 55.131 25.593 95.794 1.00 34.14 H new ATOM 0 HB2 HIS A 3 52.875 26.425 96.046 1.00 23.43 H new ATOM 0 HB3 HIS A 3 52.595 26.376 94.317 1.00 23.43 H new ATOM 0 HD2 HIS A 3 50.762 24.339 94.041 1.00 44.40 H new ATOM 0 HE1 HIS A 3 52.702 21.431 96.374 1.00 24.52 H new ATOM 0 HE2 HIS A 3 50.686 21.831 94.843 1.00 64.51 H new ATOM 51 N ASN A 4 54.498 25.217 92.556 1.00 10.03 N ATOM 52 CA ASN A 4 54.683 24.394 91.364 1.00 12.43 C ATOM 53 C ASN A 4 53.991 23.031 91.503 1.00 3.25 C ATOM 54 O ASN A 4 53.625 22.612 92.600 1.00 21.33 O ATOM 55 CB ASN A 4 56.175 24.266 91.010 1.00 10.33 C ATOM 56 CG ASN A 4 56.388 23.763 89.584 1.00 20.30 C ATOM 57 OD1 ASN A 4 56.650 22.583 89.370 1.00 1.42 O ATOM 58 ND2 ASN A 4 56.259 24.653 88.599 1.00 51.43 N ATOM 0 H ASN A 4 53.899 26.024 92.383 1.00 10.03 H new ATOM 0 HA ASN A 4 54.198 24.898 90.528 1.00 12.43 H new ATOM 0 HB2 ASN A 4 56.659 25.235 91.128 1.00 10.33 H new ATOM 0 HB3 ASN A 4 56.656 23.583 91.710 1.00 10.33 H new ATOM 0 HD21 ASN A 4 56.379 24.361 87.629 1.00 51.43 H new ATOM 0 HD22 ASN A 4 56.041 25.625 88.816 1.00 51.43 H new ATOM 65 N SER A 5 53.795 22.344 90.373 1.00 61.40 N ATOM 66 CA SER A 5 53.211 21.014 90.306 1.00 2.42 C ATOM 67 C SER A 5 53.879 20.275 89.147 1.00 2.42 C ATOM 68 O SER A 5 53.483 20.449 87.995 1.00 11.22 O ATOM 69 CB SER A 5 51.690 21.131 90.129 1.00 64.44 C ATOM 70 OG SER A 5 51.083 19.854 90.111 1.00 0.01 O ATOM 0 H SER A 5 54.048 22.715 89.457 1.00 61.40 H new ATOM 0 HA SER A 5 53.379 20.451 91.224 1.00 2.42 H new ATOM 0 HB2 SER A 5 51.270 21.726 90.940 1.00 64.44 H new ATOM 0 HB3 SER A 5 51.468 21.657 89.200 1.00 64.44 H new ATOM 0 HG SER A 5 50.475 19.770 90.875 1.00 0.01 H new ATOM 76 N ILE A 6 54.908 19.474 89.453 1.00 75.43 N ATOM 77 CA ILE A 6 55.635 18.690 88.461 1.00 23.33 C ATOM 78 C ILE A 6 54.767 17.513 88.009 1.00 12.35 C ATOM 79 O ILE A 6 54.132 16.858 88.837 1.00 14.03 O ATOM 80 CB ILE A 6 57.015 18.257 88.998 1.00 11.50 C ATOM 81 CG1 ILE A 6 56.953 17.285 90.192 1.00 53.11 C ATOM 82 CG2 ILE A 6 57.833 19.497 89.384 1.00 73.12 C ATOM 83 CD1 ILE A 6 57.129 15.826 89.760 1.00 51.34 C ATOM 0 H ILE A 6 55.257 19.355 90.404 1.00 75.43 H new ATOM 0 HA ILE A 6 55.840 19.303 87.583 1.00 23.33 H new ATOM 0 HB ILE A 6 57.495 17.710 88.187 1.00 11.50 H new ATOM 0 HG12 ILE A 6 57.730 17.545 90.911 1.00 53.11 H new ATOM 0 HG13 ILE A 6 55.996 17.398 90.701 1.00 53.11 H new ATOM 0 HG21 ILE A 6 58.807 19.187 89.763 1.00 73.12 H new ATOM 0 HG22 ILE A 6 57.969 20.130 88.507 1.00 73.12 H new ATOM 0 HG23 ILE A 6 57.304 20.056 90.156 1.00 73.12 H new ATOM 0 HD11 ILE A 6 57.078 15.179 90.635 1.00 51.34 H new ATOM 0 HD12 ILE A 6 56.337 15.555 89.062 1.00 51.34 H new ATOM 0 HD13 ILE A 6 58.097 15.704 89.275 1.00 51.34 H new ATOM 95 N ARG A 7 54.700 17.284 86.692 1.00 43.03 N ATOM 96 CA ARG A 7 53.851 16.275 86.065 1.00 4.13 C ATOM 97 C ARG A 7 54.560 15.732 84.822 1.00 40.31 C ATOM 98 O ARG A 7 55.531 16.324 84.351 1.00 43.41 O ATOM 99 CB ARG A 7 52.486 16.879 85.688 1.00 73.55 C ATOM 100 CG ARG A 7 51.764 17.478 86.900 1.00 52.22 C ATOM 101 CD ARG A 7 50.385 18.040 86.554 1.00 3.52 C ATOM 102 NE ARG A 7 49.869 18.814 87.689 1.00 20.32 N ATOM 103 CZ ARG A 7 48.657 19.384 87.768 1.00 12.05 C ATOM 104 NH1 ARG A 7 47.763 19.247 86.778 1.00 51.45 N ATOM 105 NH2 ARG A 7 48.349 20.100 88.858 1.00 43.32 N ATOM 0 H ARG A 7 55.253 17.813 86.017 1.00 43.03 H new ATOM 0 HA ARG A 7 53.674 15.460 86.767 1.00 4.13 H new ATOM 0 HB2 ARG A 7 52.629 17.652 84.933 1.00 73.55 H new ATOM 0 HB3 ARG A 7 51.860 16.107 85.239 1.00 73.55 H new ATOM 0 HG2 ARG A 7 51.656 16.712 87.667 1.00 52.22 H new ATOM 0 HG3 ARG A 7 52.378 18.272 87.326 1.00 52.22 H new ATOM 0 HD2 ARG A 7 50.451 18.673 85.669 1.00 3.52 H new ATOM 0 HD3 ARG A 7 49.700 17.227 86.314 1.00 3.52 H new ATOM 0 HE ARG A 7 50.488 18.929 88.491 1.00 20.32 H new ATOM 0 HH11 ARG A 7 48.000 18.703 85.949 1.00 51.45 H new ATOM 0 HH12 ARG A 7 46.846 19.687 86.854 1.00 51.45 H new ATOM 0 HH21 ARG A 7 49.031 20.204 89.609 1.00 43.32 H new ATOM 0 HH22 ARG A 7 47.433 20.541 88.936 1.00 43.32 H new ATOM 119 N SER A 8 54.068 14.606 84.290 1.00 14.43 N ATOM 120 CA SER A 8 54.607 13.974 83.096 1.00 51.33 C ATOM 121 C SER A 8 53.496 13.181 82.408 1.00 54.44 C ATOM 122 O SER A 8 52.819 12.381 83.054 1.00 2.14 O ATOM 123 CB SER A 8 55.785 13.068 83.477 1.00 71.22 C ATOM 124 OG SER A 8 56.358 12.493 82.321 1.00 1.35 O ATOM 0 H SER A 8 53.273 14.107 84.689 1.00 14.43 H new ATOM 0 HA SER A 8 54.976 14.730 82.403 1.00 51.33 H new ATOM 0 HB2 SER A 8 56.537 13.645 84.015 1.00 71.22 H new ATOM 0 HB3 SER A 8 55.444 12.282 84.151 1.00 71.22 H new ATOM 0 HG SER A 8 57.109 11.919 82.579 1.00 1.35 H new ATOM 130 N GLY A 9 53.308 13.414 81.105 1.00 60.42 N ATOM 131 CA GLY A 9 52.325 12.714 80.292 1.00 61.42 C ATOM 132 C GLY A 9 52.877 11.384 79.780 1.00 31.23 C ATOM 133 O GLY A 9 54.058 11.085 79.945 1.00 71.45 O ATOM 0 H GLY A 9 53.846 14.106 80.583 1.00 60.42 H new ATOM 0 HA2 GLY A 9 51.425 12.535 80.880 1.00 61.42 H new ATOM 0 HA3 GLY A 9 52.036 13.340 79.448 1.00 61.42 H new ATOM 137 N HIS A 10 52.006 10.588 79.151 1.00 44.24 N ATOM 138 CA HIS A 10 52.341 9.286 78.592 1.00 3.23 C ATOM 139 C HIS A 10 51.262 8.867 77.592 1.00 44.44 C ATOM 140 O HIS A 10 50.153 9.400 77.609 1.00 30.45 O ATOM 141 CB HIS A 10 52.490 8.251 79.717 1.00 73.25 C ATOM 142 CG HIS A 10 51.268 8.137 80.592 1.00 54.54 C ATOM 143 ND1 HIS A 10 50.186 7.336 80.263 1.00 75.25 N ATOM 144 CD2 HIS A 10 50.928 8.737 81.782 1.00 32.33 C ATOM 145 CE1 HIS A 10 49.272 7.482 81.237 1.00 44.12 C ATOM 146 NE2 HIS A 10 49.665 8.325 82.194 1.00 32.43 N ATOM 0 H HIS A 10 51.027 10.842 79.016 1.00 44.24 H new ATOM 0 HA HIS A 10 53.294 9.347 78.066 1.00 3.23 H new ATOM 0 HB2 HIS A 10 52.705 7.277 79.278 1.00 73.25 H new ATOM 0 HB3 HIS A 10 53.347 8.518 80.335 1.00 73.25 H new ATOM 0 HD2 HIS A 10 51.555 9.432 82.322 1.00 32.33 H new ATOM 0 HE1 HIS A 10 48.320 6.971 81.245 1.00 44.12 H new ATOM 0 HE2 HIS A 10 49.157 8.603 83.034 1.00 32.43 H new ATOM 154 N GLY A 11 51.594 7.909 76.721 1.00 20.44 N ATOM 155 CA GLY A 11 50.697 7.404 75.695 1.00 21.11 C ATOM 156 C GLY A 11 51.399 6.331 74.867 1.00 72.42 C ATOM 157 O GLY A 11 52.460 5.840 75.253 1.00 13.22 O ATOM 0 H GLY A 11 52.510 7.460 76.715 1.00 20.44 H new ATOM 0 HA2 GLY A 11 49.801 6.990 76.156 1.00 21.11 H new ATOM 0 HA3 GLY A 11 50.375 8.220 75.049 1.00 21.11 H new ATOM 161 N GLY A 12 50.806 5.973 73.722 1.00 32.43 N ATOM 162 CA GLY A 12 51.353 4.983 72.809 1.00 2.14 C ATOM 163 C GLY A 12 50.739 5.155 71.422 1.00 72.25 C ATOM 164 O GLY A 12 49.578 5.545 71.299 1.00 61.41 O ATOM 0 H GLY A 12 49.922 6.372 73.407 1.00 32.43 H new ATOM 0 HA2 GLY A 12 52.436 5.089 72.752 1.00 2.14 H new ATOM 0 HA3 GLY A 12 51.150 3.980 73.184 1.00 2.14 H new ATOM 168 N LEU A 13 51.529 4.870 70.379 1.00 64.25 N ATOM 169 CA LEU A 13 51.127 5.025 68.990 1.00 3.53 C ATOM 170 C LEU A 13 50.317 3.795 68.570 1.00 35.15 C ATOM 171 O LEU A 13 50.820 2.925 67.861 1.00 74.43 O ATOM 172 CB LEU A 13 52.365 5.223 68.095 1.00 52.23 C ATOM 173 CG LEU A 13 53.134 6.548 68.266 1.00 42.22 C ATOM 174 CD1 LEU A 13 52.259 7.776 67.987 1.00 54.31 C ATOM 175 CD2 LEU A 13 53.826 6.696 69.627 1.00 43.33 C ATOM 0 H LEU A 13 52.481 4.520 70.487 1.00 64.25 H new ATOM 0 HA LEU A 13 50.502 5.911 68.877 1.00 3.53 H new ATOM 0 HB2 LEU A 13 53.056 4.401 68.282 1.00 52.23 H new ATOM 0 HB3 LEU A 13 52.050 5.144 67.055 1.00 52.23 H new ATOM 0 HG LEU A 13 53.919 6.500 67.511 1.00 42.22 H new ATOM 0 HD11 LEU A 13 52.850 8.682 68.122 1.00 54.31 H new ATOM 0 HD12 LEU A 13 51.888 7.734 66.963 1.00 54.31 H new ATOM 0 HD13 LEU A 13 51.416 7.787 68.678 1.00 54.31 H new ATOM 0 HD21 LEU A 13 54.345 7.654 69.669 1.00 43.33 H new ATOM 0 HD22 LEU A 13 53.080 6.652 70.421 1.00 43.33 H new ATOM 0 HD23 LEU A 13 54.545 5.888 69.759 1.00 43.33 H new ATOM 187 N ASN A 14 49.059 3.733 69.022 1.00 24.34 N ATOM 188 CA ASN A 14 48.114 2.677 68.689 1.00 22.22 C ATOM 189 C ASN A 14 47.363 3.025 67.401 1.00 21.12 C ATOM 190 O ASN A 14 47.166 4.198 67.087 1.00 72.44 O ATOM 191 CB ASN A 14 47.139 2.491 69.860 1.00 14.04 C ATOM 192 CG ASN A 14 46.091 1.417 69.570 1.00 62.11 C ATOM 193 OD1 ASN A 14 44.912 1.723 69.406 1.00 31.42 O ATOM 194 ND2 ASN A 14 46.518 0.155 69.491 1.00 44.35 N ATOM 0 H ASN A 14 48.666 4.438 69.646 1.00 24.34 H new ATOM 0 HA ASN A 14 48.649 1.743 68.520 1.00 22.22 H new ATOM 0 HB2 ASN A 14 47.697 2.220 70.756 1.00 14.04 H new ATOM 0 HB3 ASN A 14 46.640 3.437 70.069 1.00 14.04 H new ATOM 0 HD21 ASN A 14 45.857 -0.595 69.288 1.00 44.35 H new ATOM 0 HD22 ASN A 14 47.505 -0.059 69.633 1.00 44.35 H new ATOM 201 N GLN A 15 46.937 1.992 66.665 1.00 1.22 N ATOM 202 CA GLN A 15 46.162 2.104 65.438 1.00 42.43 C ATOM 203 C GLN A 15 45.439 0.782 65.177 1.00 31.04 C ATOM 204 O GLN A 15 45.819 -0.252 65.727 1.00 14.34 O ATOM 205 CB GLN A 15 47.049 2.521 64.249 1.00 63.22 C ATOM 206 CG GLN A 15 48.169 1.529 63.895 1.00 43.42 C ATOM 207 CD GLN A 15 49.247 1.444 64.973 1.00 14.14 C ATOM 208 OE1 GLN A 15 49.393 0.418 65.633 1.00 31.41 O ATOM 209 NE2 GLN A 15 49.990 2.534 65.169 1.00 4.34 N ATOM 0 H GLN A 15 47.133 1.024 66.922 1.00 1.22 H new ATOM 0 HA GLN A 15 45.417 2.891 65.555 1.00 42.43 H new ATOM 0 HB2 GLN A 15 46.415 2.658 63.373 1.00 63.22 H new ATOM 0 HB3 GLN A 15 47.498 3.489 64.472 1.00 63.22 H new ATOM 0 HG2 GLN A 15 47.737 0.540 63.741 1.00 43.42 H new ATOM 0 HG3 GLN A 15 48.627 1.827 62.952 1.00 43.42 H new ATOM 0 HE21 GLN A 15 49.836 3.365 64.599 1.00 4.34 H new ATOM 0 HE22 GLN A 15 50.712 2.536 65.889 1.00 4.34 H new ATOM 218 N LEU A 16 44.392 0.825 64.346 1.00 71.11 N ATOM 219 CA LEU A 16 43.570 -0.328 64.002 1.00 22.11 C ATOM 220 C LEU A 16 42.928 -0.087 62.635 1.00 72.11 C ATOM 221 O LEU A 16 42.581 1.047 62.305 1.00 34.24 O ATOM 222 CB LEU A 16 42.531 -0.562 65.110 1.00 13.41 C ATOM 223 CG LEU A 16 41.642 -1.801 64.888 1.00 25.31 C ATOM 224 CD1 LEU A 16 41.320 -2.462 66.234 1.00 21.54 C ATOM 225 CD2 LEU A 16 40.316 -1.440 64.204 1.00 4.02 C ATOM 0 H LEU A 16 44.090 1.684 63.886 1.00 71.11 H new ATOM 0 HA LEU A 16 44.174 -1.233 63.930 1.00 22.11 H new ATOM 0 HB2 LEU A 16 43.049 -0.666 66.063 1.00 13.41 H new ATOM 0 HB3 LEU A 16 41.894 0.319 65.188 1.00 13.41 H new ATOM 0 HG LEU A 16 42.198 -2.482 64.243 1.00 25.31 H new ATOM 0 HD11 LEU A 16 40.691 -3.337 66.069 1.00 21.54 H new ATOM 0 HD12 LEU A 16 42.246 -2.768 66.720 1.00 21.54 H new ATOM 0 HD13 LEU A 16 40.793 -1.752 66.871 1.00 21.54 H new ATOM 0 HD21 LEU A 16 39.720 -2.342 64.067 1.00 4.02 H new ATOM 0 HD22 LEU A 16 39.766 -0.733 64.826 1.00 4.02 H new ATOM 0 HD23 LEU A 16 40.519 -0.988 63.233 1.00 4.02 H new ATOM 375 N PRO A 27 35.769 -8.201 47.464 1.00 72.33 N ATOM 376 CA PRO A 27 34.779 -7.803 46.468 1.00 12.55 C ATOM 377 C PRO A 27 35.460 -7.070 45.298 1.00 43.43 C ATOM 378 O PRO A 27 36.666 -7.210 45.101 1.00 4.03 O ATOM 379 CB PRO A 27 33.803 -6.913 47.249 1.00 53.40 C ATOM 380 CG PRO A 27 34.733 -6.192 48.219 1.00 12.12 C ATOM 381 CD PRO A 27 35.711 -7.299 48.606 1.00 41.33 C ATOM 0 HA PRO A 27 34.260 -8.643 46.006 1.00 12.55 H new ATOM 0 HB2 PRO A 27 33.275 -6.217 46.597 1.00 53.40 H new ATOM 0 HB3 PRO A 27 33.045 -7.498 47.770 1.00 53.40 H new ATOM 0 HG2 PRO A 27 35.238 -5.348 47.749 1.00 12.12 H new ATOM 0 HG3 PRO A 27 34.197 -5.801 49.084 1.00 12.12 H new ATOM 0 HD2 PRO A 27 36.696 -6.889 48.830 1.00 41.33 H new ATOM 0 HD3 PRO A 27 35.373 -7.823 49.500 1.00 41.33 H new ATOM 389 N GLU A 28 34.679 -6.285 44.537 1.00 33.14 N ATOM 390 CA GLU A 28 35.079 -5.492 43.373 1.00 53.53 C ATOM 391 C GLU A 28 36.441 -4.806 43.518 1.00 5.11 C ATOM 392 O GLU A 28 37.188 -4.737 42.546 1.00 53.23 O ATOM 393 CB GLU A 28 33.967 -4.489 43.050 1.00 55.13 C ATOM 394 CG GLU A 28 34.108 -3.919 41.631 1.00 51.53 C ATOM 395 CD GLU A 28 35.147 -2.805 41.491 1.00 40.35 C ATOM 396 OE1 GLU A 28 35.332 -2.055 42.475 1.00 33.31 O ATOM 397 OE2 GLU A 28 35.739 -2.719 40.393 1.00 43.55 O ATOM 0 H GLU A 28 33.684 -6.184 44.737 1.00 33.14 H new ATOM 0 HA GLU A 28 35.214 -6.181 42.539 1.00 53.53 H new ATOM 0 HB2 GLU A 28 32.997 -4.976 43.151 1.00 55.13 H new ATOM 0 HB3 GLU A 28 33.991 -3.674 43.773 1.00 55.13 H new ATOM 0 HG2 GLU A 28 34.371 -4.730 40.952 1.00 51.53 H new ATOM 0 HG3 GLU A 28 33.139 -3.536 41.310 1.00 51.53 H new ATOM 404 N VAL A 29 36.772 -4.325 44.726 1.00 1.01 N ATOM 405 CA VAL A 29 38.039 -3.675 45.055 1.00 3.12 C ATOM 406 C VAL A 29 39.267 -4.434 44.523 1.00 2.41 C ATOM 407 O VAL A 29 40.274 -3.806 44.205 1.00 34.41 O ATOM 408 CB VAL A 29 38.107 -3.439 46.576 1.00 45.41 C ATOM 409 CG1 VAL A 29 38.329 -4.740 47.355 1.00 31.32 C ATOM 410 CG2 VAL A 29 39.201 -2.430 46.946 1.00 12.42 C ATOM 0 H VAL A 29 36.140 -4.382 45.524 1.00 1.01 H new ATOM 0 HA VAL A 29 38.069 -2.712 44.544 1.00 3.12 H new ATOM 0 HB VAL A 29 37.137 -3.029 46.859 1.00 45.41 H new ATOM 0 HG11 VAL A 29 38.370 -4.523 48.422 1.00 31.32 H new ATOM 0 HG12 VAL A 29 37.507 -5.428 47.156 1.00 31.32 H new ATOM 0 HG13 VAL A 29 39.268 -5.196 47.041 1.00 31.32 H new ATOM 0 HG21 VAL A 29 39.217 -2.291 48.027 1.00 12.42 H new ATOM 0 HG22 VAL A 29 40.169 -2.805 46.614 1.00 12.42 H new ATOM 0 HG23 VAL A 29 38.995 -1.476 46.460 1.00 12.42 H new ATOM 420 N VAL A 30 39.186 -5.768 44.403 1.00 40.44 N ATOM 421 CA VAL A 30 40.228 -6.590 43.801 1.00 61.32 C ATOM 422 C VAL A 30 40.597 -6.081 42.401 1.00 74.34 C ATOM 423 O VAL A 30 41.777 -5.887 42.115 1.00 35.51 O ATOM 424 CB VAL A 30 39.808 -8.074 43.810 1.00 1.31 C ATOM 425 CG1 VAL A 30 38.666 -8.401 42.836 1.00 64.12 C ATOM 426 CG2 VAL A 30 41.007 -8.981 43.502 1.00 22.15 C ATOM 0 H VAL A 30 38.382 -6.306 44.728 1.00 40.44 H new ATOM 0 HA VAL A 30 41.135 -6.509 44.400 1.00 61.32 H new ATOM 0 HB VAL A 30 39.436 -8.264 44.817 1.00 1.31 H new ATOM 0 HG11 VAL A 30 38.427 -9.463 42.899 1.00 64.12 H new ATOM 0 HG12 VAL A 30 37.785 -7.814 43.098 1.00 64.12 H new ATOM 0 HG13 VAL A 30 38.974 -8.159 41.819 1.00 64.12 H new ATOM 0 HG21 VAL A 30 40.687 -10.023 43.514 1.00 22.15 H new ATOM 0 HG22 VAL A 30 41.406 -8.735 42.518 1.00 22.15 H new ATOM 0 HG23 VAL A 30 41.780 -8.830 44.255 1.00 22.15 H new ATOM 436 N ARG A 31 39.594 -5.817 41.554 1.00 51.45 N ATOM 437 CA ARG A 31 39.775 -5.304 40.204 1.00 54.01 C ATOM 438 C ARG A 31 40.561 -4.000 40.243 1.00 14.54 C ATOM 439 O ARG A 31 41.574 -3.873 39.562 1.00 74.13 O ATOM 440 CB ARG A 31 38.407 -5.141 39.528 1.00 55.43 C ATOM 441 CG ARG A 31 38.501 -4.735 38.049 1.00 34.34 C ATOM 442 CD ARG A 31 38.477 -3.217 37.834 1.00 74.14 C ATOM 443 NE ARG A 31 38.462 -2.896 36.402 1.00 35.34 N ATOM 444 CZ ARG A 31 38.459 -1.653 35.892 1.00 11.05 C ATOM 445 NH1 ARG A 31 38.429 -0.581 36.695 1.00 24.23 N ATOM 446 NH2 ARG A 31 38.488 -1.486 34.563 1.00 62.42 N ATOM 0 H ARG A 31 38.615 -5.960 41.801 1.00 51.45 H new ATOM 0 HA ARG A 31 40.354 -6.011 39.610 1.00 54.01 H new ATOM 0 HB2 ARG A 31 37.858 -6.079 39.605 1.00 55.43 H new ATOM 0 HB3 ARG A 31 37.831 -4.389 40.067 1.00 55.43 H new ATOM 0 HG2 ARG A 31 39.420 -5.140 37.626 1.00 34.34 H new ATOM 0 HG3 ARG A 31 37.673 -5.186 37.502 1.00 34.34 H new ATOM 0 HD2 ARG A 31 37.598 -2.790 38.317 1.00 74.14 H new ATOM 0 HD3 ARG A 31 39.350 -2.764 38.304 1.00 74.14 H new ATOM 0 HE ARG A 31 38.453 -3.675 35.744 1.00 35.34 H new ATOM 0 HH11 ARG A 31 38.408 -0.703 37.708 1.00 24.23 H new ATOM 0 HH12 ARG A 31 38.427 0.357 36.294 1.00 24.23 H new ATOM 0 HH21 ARG A 31 38.512 -2.299 33.947 1.00 62.42 H new ATOM 0 HH22 ARG A 31 38.486 -0.546 34.167 1.00 62.42 H new ATOM 460 N GLN A 32 40.100 -3.039 41.053 1.00 44.31 N ATOM 461 CA GLN A 32 40.735 -1.737 41.195 1.00 14.12 C ATOM 462 C GLN A 32 42.208 -1.894 41.574 1.00 65.02 C ATOM 463 O GLN A 32 43.072 -1.342 40.902 1.00 53.44 O ATOM 464 CB GLN A 32 39.987 -0.876 42.226 1.00 14.32 C ATOM 465 CG GLN A 32 38.545 -0.545 41.813 1.00 33.11 C ATOM 466 CD GLN A 32 38.465 0.132 40.455 1.00 21.55 C ATOM 467 OE1 GLN A 32 37.878 -0.402 39.519 1.00 32.21 O ATOM 468 NE2 GLN A 32 39.072 1.307 40.334 1.00 14.31 N ATOM 0 H GLN A 32 39.267 -3.151 41.631 1.00 44.31 H new ATOM 0 HA GLN A 32 40.688 -1.225 40.234 1.00 14.12 H new ATOM 0 HB2 GLN A 32 39.972 -1.399 43.182 1.00 14.32 H new ATOM 0 HB3 GLN A 32 40.536 0.053 42.379 1.00 14.32 H new ATOM 0 HG2 GLN A 32 37.958 -1.463 41.792 1.00 33.11 H new ATOM 0 HG3 GLN A 32 38.096 0.104 42.565 1.00 33.11 H new ATOM 0 HE21 GLN A 32 39.550 1.719 41.135 1.00 14.31 H new ATOM 0 HE22 GLN A 32 39.060 1.797 39.440 1.00 14.31 H new ATOM 477 N ARG A 33 42.494 -2.670 42.625 1.00 23.54 N ATOM 478 CA ARG A 33 43.847 -2.893 43.115 1.00 73.53 C ATOM 479 C ARG A 33 44.760 -3.477 42.033 1.00 24.42 C ATOM 480 O ARG A 33 45.854 -2.959 41.813 1.00 63.44 O ATOM 481 CB ARG A 33 43.805 -3.807 44.344 1.00 2.44 C ATOM 482 CG ARG A 33 43.269 -3.044 45.562 1.00 70.00 C ATOM 483 CD ARG A 33 43.028 -3.976 46.757 1.00 42.54 C ATOM 484 NE ARG A 33 44.179 -4.847 47.039 1.00 74.41 N ATOM 485 CZ ARG A 33 45.388 -4.447 47.471 1.00 20.14 C ATOM 486 NH1 ARG A 33 45.632 -3.161 47.762 1.00 22.35 N ATOM 487 NH2 ARG A 33 46.363 -5.352 47.622 1.00 4.20 N ATOM 0 H ARG A 33 41.780 -3.164 43.161 1.00 23.54 H new ATOM 0 HA ARG A 33 44.269 -1.928 43.397 1.00 73.53 H new ATOM 0 HB2 ARG A 33 43.172 -4.671 44.141 1.00 2.44 H new ATOM 0 HB3 ARG A 33 44.804 -4.187 44.556 1.00 2.44 H new ATOM 0 HG2 ARG A 33 43.978 -2.266 45.845 1.00 70.00 H new ATOM 0 HG3 ARG A 33 42.337 -2.544 45.297 1.00 70.00 H new ATOM 0 HD2 ARG A 33 42.806 -3.377 47.640 1.00 42.54 H new ATOM 0 HD3 ARG A 33 42.151 -4.592 46.561 1.00 42.54 H new ATOM 0 HE ARG A 33 44.048 -5.848 46.893 1.00 74.41 H new ATOM 0 HH11 ARG A 33 44.893 -2.465 47.657 1.00 22.35 H new ATOM 0 HH12 ARG A 33 46.556 -2.878 48.088 1.00 22.35 H new ATOM 0 HH21 ARG A 33 46.185 -6.334 47.410 1.00 4.20 H new ATOM 0 HH22 ARG A 33 47.284 -5.060 47.949 1.00 4.20 H new ATOM 501 N ILE A 34 44.325 -4.550 41.365 1.00 42.22 N ATOM 502 CA ILE A 34 45.111 -5.205 40.326 1.00 24.14 C ATOM 503 C ILE A 34 45.344 -4.262 39.139 1.00 31.35 C ATOM 504 O ILE A 34 46.453 -4.226 38.610 1.00 0.13 O ATOM 505 CB ILE A 34 44.455 -6.540 39.924 1.00 23.42 C ATOM 506 CG1 ILE A 34 44.423 -7.549 41.091 1.00 70.25 C ATOM 507 CG2 ILE A 34 45.150 -7.168 38.708 1.00 71.14 C ATOM 508 CD1 ILE A 34 45.794 -7.961 41.641 1.00 31.43 C ATOM 0 H ILE A 34 43.418 -4.985 41.533 1.00 42.22 H new ATOM 0 HA ILE A 34 46.099 -5.445 40.718 1.00 24.14 H new ATOM 0 HB ILE A 34 43.426 -6.304 39.654 1.00 23.42 H new ATOM 0 HG12 ILE A 34 43.838 -7.120 41.904 1.00 70.25 H new ATOM 0 HG13 ILE A 34 43.899 -8.445 40.760 1.00 70.25 H new ATOM 0 HG21 ILE A 34 44.660 -8.108 38.454 1.00 71.14 H new ATOM 0 HG22 ILE A 34 45.087 -6.485 37.860 1.00 71.14 H new ATOM 0 HG23 ILE A 34 46.197 -7.357 38.945 1.00 71.14 H new ATOM 0 HD11 ILE A 34 45.660 -8.671 42.457 1.00 31.43 H new ATOM 0 HD12 ILE A 34 46.380 -8.425 40.848 1.00 31.43 H new ATOM 0 HD13 ILE A 34 46.318 -7.079 42.010 1.00 31.43 H new ATOM 520 N VAL A 35 44.333 -3.480 38.742 1.00 13.40 N ATOM 521 CA VAL A 35 44.462 -2.467 37.698 1.00 51.23 C ATOM 522 C VAL A 35 45.527 -1.435 38.086 1.00 1.01 C ATOM 523 O VAL A 35 46.459 -1.203 37.319 1.00 32.22 O ATOM 524 CB VAL A 35 43.090 -1.825 37.411 1.00 61.52 C ATOM 525 CG1 VAL A 35 43.201 -0.526 36.602 1.00 3.54 C ATOM 526 CG2 VAL A 35 42.211 -2.806 36.623 1.00 50.23 C ATOM 0 H VAL A 35 43.396 -3.536 39.142 1.00 13.40 H new ATOM 0 HA VAL A 35 44.797 -2.936 36.773 1.00 51.23 H new ATOM 0 HB VAL A 35 42.649 -1.588 38.379 1.00 61.52 H new ATOM 0 HG11 VAL A 35 42.205 -0.118 36.430 1.00 3.54 H new ATOM 0 HG12 VAL A 35 43.798 0.198 37.156 1.00 3.54 H new ATOM 0 HG13 VAL A 35 43.679 -0.733 35.644 1.00 3.54 H new ATOM 0 HG21 VAL A 35 41.243 -2.347 36.423 1.00 50.23 H new ATOM 0 HG22 VAL A 35 42.697 -3.053 35.679 1.00 50.23 H new ATOM 0 HG23 VAL A 35 42.068 -3.716 37.206 1.00 50.23 H new ATOM 536 N ASP A 36 45.396 -0.826 39.271 1.00 14.31 N ATOM 537 CA ASP A 36 46.294 0.200 39.773 1.00 20.13 C ATOM 538 C ASP A 36 47.735 -0.312 39.845 1.00 20.13 C ATOM 539 O ASP A 36 48.662 0.409 39.479 1.00 73.32 O ATOM 540 CB ASP A 36 45.806 0.657 41.154 1.00 34.45 C ATOM 541 CG ASP A 36 44.438 1.339 41.136 1.00 33.32 C ATOM 542 OD1 ASP A 36 44.086 1.916 40.084 1.00 33.22 O ATOM 543 OD2 ASP A 36 43.766 1.280 42.189 1.00 25.44 O ATOM 0 H ASP A 36 44.639 -1.045 39.918 1.00 14.31 H new ATOM 0 HA ASP A 36 46.288 1.047 39.087 1.00 20.13 H new ATOM 0 HB2 ASP A 36 45.761 -0.207 41.816 1.00 34.45 H new ATOM 0 HB3 ASP A 36 46.538 1.345 41.577 1.00 34.45 H new ATOM 548 N LEU A 37 47.924 -1.556 40.301 1.00 43.43 N ATOM 549 CA LEU A 37 49.234 -2.183 40.364 1.00 51.24 C ATOM 550 C LEU A 37 49.796 -2.362 38.953 1.00 14.33 C ATOM 551 O LEU A 37 50.870 -1.844 38.660 1.00 5.21 O ATOM 552 CB LEU A 37 49.131 -3.518 41.121 1.00 52.20 C ATOM 553 CG LEU A 37 50.503 -4.137 41.444 1.00 22.11 C ATOM 554 CD1 LEU A 37 51.143 -3.462 42.664 1.00 25.44 C ATOM 555 CD2 LEU A 37 50.344 -5.634 41.732 1.00 62.14 C ATOM 0 H LEU A 37 47.166 -2.151 40.636 1.00 43.43 H new ATOM 0 HA LEU A 37 49.927 -1.544 40.911 1.00 51.24 H new ATOM 0 HB2 LEU A 37 48.582 -3.361 42.050 1.00 52.20 H new ATOM 0 HB3 LEU A 37 48.552 -4.223 40.524 1.00 52.20 H new ATOM 0 HG LEU A 37 51.149 -3.986 40.579 1.00 22.11 H new ATOM 0 HD11 LEU A 37 52.111 -3.920 42.868 1.00 25.44 H new ATOM 0 HD12 LEU A 37 51.280 -2.400 42.462 1.00 25.44 H new ATOM 0 HD13 LEU A 37 50.494 -3.586 43.531 1.00 25.44 H new ATOM 0 HD21 LEU A 37 51.318 -6.066 41.960 1.00 62.14 H new ATOM 0 HD22 LEU A 37 49.678 -5.772 42.584 1.00 62.14 H new ATOM 0 HD23 LEU A 37 49.923 -6.130 40.858 1.00 62.14 H new ATOM 567 N ALA A 38 49.063 -3.070 38.084 1.00 31.30 N ATOM 568 CA ALA A 38 49.450 -3.352 36.705 1.00 31.13 C ATOM 569 C ALA A 38 49.849 -2.084 35.945 1.00 14.43 C ATOM 570 O ALA A 38 50.798 -2.112 35.163 1.00 64.14 O ATOM 571 CB ALA A 38 48.303 -4.069 35.988 1.00 40.15 C ATOM 0 H ALA A 38 48.159 -3.472 38.333 1.00 31.30 H new ATOM 0 HA ALA A 38 50.329 -3.997 36.728 1.00 31.13 H new ATOM 0 HB1 ALA A 38 48.592 -4.279 34.958 1.00 40.15 H new ATOM 0 HB2 ALA A 38 48.082 -5.005 36.501 1.00 40.15 H new ATOM 0 HB3 ALA A 38 47.417 -3.434 35.993 1.00 40.15 H new ATOM 577 N HIS A 39 49.129 -0.982 36.189 1.00 34.11 N ATOM 578 CA HIS A 39 49.309 0.304 35.530 1.00 54.51 C ATOM 579 C HIS A 39 50.735 0.850 35.654 1.00 72.41 C ATOM 580 O HIS A 39 51.185 1.542 34.742 1.00 24.34 O ATOM 581 CB HIS A 39 48.284 1.306 36.076 1.00 74.22 C ATOM 582 CG HIS A 39 48.347 2.652 35.403 1.00 71.10 C ATOM 583 ND1 HIS A 39 48.989 3.740 35.971 1.00 60.14 N ATOM 584 CD2 HIS A 39 47.881 3.099 34.190 1.00 13.52 C ATOM 585 CE1 HIS A 39 48.882 4.763 35.106 1.00 51.43 C ATOM 586 NE2 HIS A 39 48.214 4.436 33.998 1.00 43.35 N ATOM 0 H HIS A 39 48.378 -0.968 36.879 1.00 34.11 H new ATOM 0 HA HIS A 39 49.142 0.152 34.464 1.00 54.51 H new ATOM 0 HB2 HIS A 39 47.283 0.893 35.954 1.00 74.22 H new ATOM 0 HB3 HIS A 39 48.447 1.435 37.146 1.00 74.22 H new ATOM 0 HD2 HIS A 39 47.332 2.495 33.483 1.00 13.52 H new ATOM 0 HE1 HIS A 39 49.293 5.745 35.288 1.00 51.43 H new ATOM 0 HE2 HIS A 39 47.998 5.029 33.197 1.00 43.35 H new ATOM 594 N GLN A 40 51.458 0.550 36.746 1.00 72.22 N ATOM 595 CA GLN A 40 52.842 1.004 36.886 1.00 64.13 C ATOM 596 C GLN A 40 53.757 0.424 35.795 1.00 64.35 C ATOM 597 O GLN A 40 54.808 0.999 35.515 1.00 55.21 O ATOM 598 CB GLN A 40 53.373 0.720 38.300 1.00 24.03 C ATOM 599 CG GLN A 40 53.915 -0.705 38.456 1.00 63.22 C ATOM 600 CD GLN A 40 54.126 -1.076 39.921 1.00 32.13 C ATOM 601 OE1 GLN A 40 55.219 -0.912 40.456 1.00 3.24 O ATOM 602 NE2 GLN A 40 53.080 -1.587 40.569 1.00 25.11 N ATOM 0 H GLN A 40 51.109 0.002 37.532 1.00 72.22 H new ATOM 0 HA GLN A 40 52.848 2.085 36.744 1.00 64.13 H new ATOM 0 HB2 GLN A 40 54.164 1.432 38.536 1.00 24.03 H new ATOM 0 HB3 GLN A 40 52.573 0.881 39.023 1.00 24.03 H new ATOM 0 HG2 GLN A 40 53.220 -1.410 37.999 1.00 63.22 H new ATOM 0 HG3 GLN A 40 54.859 -0.795 37.919 1.00 63.22 H new ATOM 0 HE21 GLN A 40 52.189 -1.706 40.086 1.00 25.11 H new ATOM 0 HE22 GLN A 40 53.170 -1.859 41.548 1.00 25.11 H new ATOM 611 N GLY A 41 53.362 -0.706 35.191 1.00 54.35 N ATOM 612 CA GLY A 41 54.095 -1.385 34.133 1.00 64.12 C ATOM 613 C GLY A 41 54.808 -2.606 34.703 1.00 73.54 C ATOM 614 O GLY A 41 56.036 -2.663 34.710 1.00 32.30 O ATOM 0 H GLY A 41 52.494 -1.181 35.439 1.00 54.35 H new ATOM 0 HA2 GLY A 41 53.411 -1.689 33.341 1.00 64.12 H new ATOM 0 HA3 GLY A 41 54.820 -0.705 33.685 1.00 64.12 H new ATOM 618 N VAL A 42 54.028 -3.576 35.196 1.00 34.45 N ATOM 619 CA VAL A 42 54.539 -4.743 35.900 1.00 21.40 C ATOM 620 C VAL A 42 54.848 -5.861 34.900 1.00 45.35 C ATOM 621 O VAL A 42 54.004 -6.203 34.073 1.00 71.13 O ATOM 622 CB VAL A 42 53.525 -5.213 36.960 1.00 3.20 C ATOM 623 CG1 VAL A 42 54.194 -6.191 37.925 1.00 43.02 C ATOM 624 CG2 VAL A 42 52.994 -4.062 37.815 1.00 5.43 C ATOM 0 H VAL A 42 53.011 -3.566 35.112 1.00 34.45 H new ATOM 0 HA VAL A 42 55.463 -4.476 36.413 1.00 21.40 H new ATOM 0 HB VAL A 42 52.704 -5.671 36.409 1.00 3.20 H new ATOM 0 HG11 VAL A 42 53.470 -6.518 38.671 1.00 43.02 H new ATOM 0 HG12 VAL A 42 54.560 -7.055 37.371 1.00 43.02 H new ATOM 0 HG13 VAL A 42 55.029 -5.698 38.422 1.00 43.02 H new ATOM 0 HG21 VAL A 42 52.283 -4.449 38.545 1.00 5.43 H new ATOM 0 HG22 VAL A 42 53.823 -3.582 38.335 1.00 5.43 H new ATOM 0 HG23 VAL A 42 52.496 -3.333 37.175 1.00 5.43 H new ATOM 634 N ARG A 43 56.049 -6.445 34.993 1.00 51.03 N ATOM 635 CA ARG A 43 56.448 -7.614 34.214 1.00 35.12 C ATOM 636 C ARG A 43 55.652 -8.832 34.701 1.00 1.23 C ATOM 637 O ARG A 43 55.300 -8.875 35.875 1.00 62.52 O ATOM 638 CB ARG A 43 57.953 -7.861 34.400 1.00 5.30 C ATOM 639 CG ARG A 43 58.791 -6.638 34.019 1.00 54.12 C ATOM 640 CD ARG A 43 60.285 -6.949 34.153 1.00 51.23 C ATOM 641 NE ARG A 43 61.108 -5.758 33.908 1.00 71.05 N ATOM 642 CZ ARG A 43 61.417 -5.253 32.701 1.00 70.00 C ATOM 643 NH1 ARG A 43 60.977 -5.835 31.576 1.00 41.02 N ATOM 644 NH2 ARG A 43 62.175 -4.151 32.623 1.00 42.32 N ATOM 0 H ARG A 43 56.779 -6.110 35.622 1.00 51.03 H new ATOM 0 HA ARG A 43 56.244 -7.446 33.156 1.00 35.12 H new ATOM 0 HB2 ARG A 43 58.150 -8.125 35.439 1.00 5.30 H new ATOM 0 HB3 ARG A 43 58.258 -8.712 33.791 1.00 5.30 H new ATOM 0 HG2 ARG A 43 58.566 -6.340 32.995 1.00 54.12 H new ATOM 0 HG3 ARG A 43 58.530 -5.796 34.661 1.00 54.12 H new ATOM 0 HD2 ARG A 43 60.489 -7.334 35.152 1.00 51.23 H new ATOM 0 HD3 ARG A 43 60.559 -7.733 33.447 1.00 51.23 H new ATOM 0 HE ARG A 43 61.477 -5.271 34.725 1.00 71.05 H new ATOM 0 HH11 ARG A 43 60.399 -6.674 31.628 1.00 41.02 H new ATOM 0 HH12 ARG A 43 61.221 -5.439 30.668 1.00 41.02 H new ATOM 0 HH21 ARG A 43 62.512 -3.703 33.475 1.00 42.32 H new ATOM 0 HH22 ARG A 43 62.415 -3.760 31.712 1.00 42.32 H new ATOM 658 N PRO A 44 55.373 -9.838 33.857 1.00 63.44 N ATOM 659 CA PRO A 44 54.612 -11.017 34.261 1.00 12.52 C ATOM 660 C PRO A 44 55.243 -11.710 35.474 1.00 21.23 C ATOM 661 O PRO A 44 54.544 -12.038 36.430 1.00 52.23 O ATOM 662 CB PRO A 44 54.550 -11.921 33.025 1.00 42.13 C ATOM 663 CG PRO A 44 55.718 -11.448 32.159 1.00 72.23 C ATOM 664 CD PRO A 44 55.797 -9.956 32.473 1.00 2.40 C ATOM 0 HA PRO A 44 53.607 -10.753 34.590 1.00 12.52 H new ATOM 0 HB2 PRO A 44 54.653 -12.972 33.294 1.00 42.13 H new ATOM 0 HB3 PRO A 44 53.599 -11.818 32.503 1.00 42.13 H new ATOM 0 HG2 PRO A 44 56.644 -11.964 32.414 1.00 72.23 H new ATOM 0 HG3 PRO A 44 55.534 -11.628 31.100 1.00 72.23 H new ATOM 0 HD2 PRO A 44 56.810 -9.578 32.337 1.00 2.40 H new ATOM 0 HD3 PRO A 44 55.150 -9.379 31.812 1.00 2.40 H new ATOM 672 N CYS A 45 56.571 -11.878 35.456 1.00 44.34 N ATOM 673 CA CYS A 45 57.326 -12.395 36.589 1.00 51.13 C ATOM 674 C CYS A 45 57.199 -11.496 37.824 1.00 32.45 C ATOM 675 O CYS A 45 57.120 -11.999 38.944 1.00 24.42 O ATOM 676 CB CYS A 45 58.791 -12.628 36.189 1.00 61.51 C ATOM 677 SG CYS A 45 59.600 -11.099 35.634 1.00 41.05 S ATOM 0 H CYS A 45 57.150 -11.656 34.646 1.00 44.34 H new ATOM 0 HA CYS A 45 56.897 -13.356 36.872 1.00 51.13 H new ATOM 0 HB2 CYS A 45 59.337 -13.039 37.038 1.00 61.51 H new ATOM 0 HB3 CYS A 45 58.835 -13.371 35.392 1.00 61.51 H new ATOM 0 HG CYS A 45 60.833 -11.353 35.311 1.00 41.05 H new ATOM 683 N ASP A 46 57.177 -10.171 37.625 1.00 53.25 N ATOM 684 CA ASP A 46 57.109 -9.207 38.712 1.00 62.45 C ATOM 685 C ASP A 46 55.730 -9.221 39.388 1.00 41.03 C ATOM 686 O ASP A 46 55.649 -9.061 40.606 1.00 21.34 O ATOM 687 CB ASP A 46 57.538 -7.818 38.226 1.00 33.25 C ATOM 688 CG ASP A 46 57.673 -6.803 39.361 1.00 2.30 C ATOM 689 OD1 ASP A 46 57.983 -7.232 40.494 1.00 33.20 O ATOM 690 OD2 ASP A 46 57.487 -5.603 39.066 1.00 54.43 O ATOM 0 H ASP A 46 57.206 -9.744 36.699 1.00 53.25 H new ATOM 0 HA ASP A 46 57.818 -9.498 39.487 1.00 62.45 H new ATOM 0 HB2 ASP A 46 58.492 -7.900 37.704 1.00 33.25 H new ATOM 0 HB3 ASP A 46 56.810 -7.451 37.503 1.00 33.25 H new ATOM 695 N ILE A 47 54.648 -9.462 38.630 1.00 30.33 N ATOM 696 CA ILE A 47 53.323 -9.688 39.206 1.00 1.22 C ATOM 697 C ILE A 47 53.412 -10.864 40.179 1.00 15.22 C ATOM 698 O ILE A 47 53.022 -10.734 41.338 1.00 54.50 O ATOM 699 CB ILE A 47 52.248 -9.950 38.125 1.00 31.35 C ATOM 700 CG1 ILE A 47 52.085 -8.744 37.184 1.00 74.54 C ATOM 701 CG2 ILE A 47 50.897 -10.264 38.791 1.00 34.55 C ATOM 702 CD1 ILE A 47 51.149 -9.004 36.001 1.00 63.23 C ATOM 0 H ILE A 47 54.671 -9.504 37.611 1.00 30.33 H new ATOM 0 HA ILE A 47 53.013 -8.785 39.732 1.00 1.22 H new ATOM 0 HB ILE A 47 52.577 -10.804 37.533 1.00 31.35 H new ATOM 0 HG12 ILE A 47 51.705 -7.898 37.756 1.00 74.54 H new ATOM 0 HG13 ILE A 47 53.065 -8.457 36.803 1.00 74.54 H new ATOM 0 HG21 ILE A 47 50.146 -10.447 38.022 1.00 34.55 H new ATOM 0 HG22 ILE A 47 50.998 -11.150 39.418 1.00 34.55 H new ATOM 0 HG23 ILE A 47 50.589 -9.418 39.405 1.00 34.55 H new ATOM 0 HD11 ILE A 47 51.085 -8.108 35.384 1.00 63.23 H new ATOM 0 HD12 ILE A 47 51.538 -9.829 35.404 1.00 63.23 H new ATOM 0 HD13 ILE A 47 50.157 -9.260 36.372 1.00 63.23 H new ATOM 714 N SER A 48 53.928 -12.004 39.701 1.00 52.32 N ATOM 715 CA SER A 48 53.977 -13.245 40.457 1.00 41.01 C ATOM 716 C SER A 48 54.607 -13.056 41.840 1.00 4.34 C ATOM 717 O SER A 48 54.008 -13.464 42.832 1.00 31.43 O ATOM 718 CB SER A 48 54.698 -14.328 39.651 1.00 74.31 C ATOM 719 OG SER A 48 54.121 -14.448 38.368 1.00 42.22 O ATOM 0 H SER A 48 54.326 -12.083 38.765 1.00 52.32 H new ATOM 0 HA SER A 48 52.951 -13.570 40.630 1.00 41.01 H new ATOM 0 HB2 SER A 48 55.756 -14.080 39.560 1.00 74.31 H new ATOM 0 HB3 SER A 48 54.638 -15.282 40.175 1.00 74.31 H new ATOM 0 HG SER A 48 53.949 -15.393 38.174 1.00 42.22 H new ATOM 725 N ARG A 49 55.788 -12.426 41.921 1.00 13.24 N ATOM 726 CA ARG A 49 56.462 -12.207 43.200 1.00 0.12 C ATOM 727 C ARG A 49 55.664 -11.286 44.131 1.00 53.32 C ATOM 728 O ARG A 49 55.494 -11.625 45.301 1.00 34.41 O ATOM 729 CB ARG A 49 57.919 -11.749 43.025 1.00 54.23 C ATOM 730 CG ARG A 49 58.084 -10.509 42.141 1.00 4.41 C ATOM 731 CD ARG A 49 59.529 -10.000 42.119 1.00 3.40 C ATOM 732 NE ARG A 49 59.923 -9.426 43.414 1.00 42.00 N ATOM 733 CZ ARG A 49 59.611 -8.195 43.857 1.00 51.21 C ATOM 734 NH1 ARG A 49 58.908 -7.335 43.105 1.00 73.43 N ATOM 735 NH2 ARG A 49 60.012 -7.818 45.078 1.00 1.12 N ATOM 0 H ARG A 49 56.293 -12.061 41.113 1.00 13.24 H new ATOM 0 HA ARG A 49 56.505 -13.177 43.694 1.00 0.12 H new ATOM 0 HB2 ARG A 49 58.343 -11.541 44.007 1.00 54.23 H new ATOM 0 HB3 ARG A 49 58.497 -12.568 42.595 1.00 54.23 H new ATOM 0 HG2 ARG A 49 57.769 -10.745 41.125 1.00 4.41 H new ATOM 0 HG3 ARG A 49 57.428 -9.718 42.503 1.00 4.41 H new ATOM 0 HD2 ARG A 49 60.200 -10.821 41.865 1.00 3.40 H new ATOM 0 HD3 ARG A 49 59.638 -9.247 41.339 1.00 3.40 H new ATOM 0 HE ARG A 49 60.483 -10.014 44.032 1.00 42.00 H new ATOM 0 HH11 ARG A 49 58.597 -7.609 42.173 1.00 73.43 H new ATOM 0 HH12 ARG A 49 58.685 -6.407 43.465 1.00 73.43 H new ATOM 0 HH21 ARG A 49 60.548 -8.462 45.660 1.00 1.12 H new ATOM 0 HH22 ARG A 49 59.782 -6.887 45.426 1.00 1.12 H new ATOM 749 N GLN A 50 55.158 -10.146 43.640 1.00 11.15 N ATOM 750 CA GLN A 50 54.382 -9.215 44.450 1.00 73.20 C ATOM 751 C GLN A 50 53.111 -9.858 45.012 1.00 2.43 C ATOM 752 O GLN A 50 52.759 -9.610 46.162 1.00 51.52 O ATOM 753 CB GLN A 50 54.044 -7.978 43.615 1.00 4.44 C ATOM 754 CG GLN A 50 55.321 -7.191 43.299 1.00 3.41 C ATOM 755 CD GLN A 50 55.012 -5.988 42.422 1.00 1.11 C ATOM 756 OE1 GLN A 50 54.922 -4.861 42.904 1.00 51.23 O ATOM 757 NE2 GLN A 50 54.843 -6.233 41.124 1.00 40.31 N ATOM 0 H GLN A 50 55.278 -9.850 42.671 1.00 11.15 H new ATOM 0 HA GLN A 50 54.988 -8.923 45.308 1.00 73.20 H new ATOM 0 HB2 GLN A 50 53.554 -8.278 42.689 1.00 4.44 H new ATOM 0 HB3 GLN A 50 53.342 -7.345 44.157 1.00 4.44 H new ATOM 0 HG2 GLN A 50 55.788 -6.860 44.226 1.00 3.41 H new ATOM 0 HG3 GLN A 50 56.038 -7.839 42.795 1.00 3.41 H new ATOM 0 HE21 GLN A 50 54.927 -7.186 40.770 1.00 40.31 H new ATOM 0 HE22 GLN A 50 54.629 -5.468 40.484 1.00 40.31 H new ATOM 766 N LEU A 51 52.439 -10.695 44.212 1.00 50.22 N ATOM 767 CA LEU A 51 51.243 -11.423 44.624 1.00 64.04 C ATOM 768 C LEU A 51 51.607 -12.742 45.325 1.00 34.14 C ATOM 769 O LEU A 51 50.706 -13.474 45.727 1.00 22.31 O ATOM 770 CB LEU A 51 50.342 -11.667 43.399 1.00 22.32 C ATOM 771 CG LEU A 51 49.447 -10.481 42.990 1.00 14.55 C ATOM 772 CD1 LEU A 51 48.306 -10.259 43.993 1.00 53.02 C ATOM 773 CD2 LEU A 51 50.204 -9.166 42.778 1.00 4.21 C ATOM 0 H LEU A 51 52.718 -10.885 43.249 1.00 50.22 H new ATOM 0 HA LEU A 51 50.694 -10.820 45.348 1.00 64.04 H new ATOM 0 HB2 LEU A 51 50.974 -11.932 42.552 1.00 22.32 H new ATOM 0 HB3 LEU A 51 49.705 -12.527 43.603 1.00 22.32 H new ATOM 0 HG LEU A 51 49.036 -10.770 42.023 1.00 14.55 H new ATOM 0 HD11 LEU A 51 47.697 -9.414 43.670 1.00 53.02 H new ATOM 0 HD12 LEU A 51 47.687 -11.155 44.044 1.00 53.02 H new ATOM 0 HD13 LEU A 51 48.723 -10.050 44.978 1.00 53.02 H new ATOM 0 HD21 LEU A 51 49.501 -8.383 42.493 1.00 4.21 H new ATOM 0 HD22 LEU A 51 50.707 -8.883 43.703 1.00 4.21 H new ATOM 0 HD23 LEU A 51 50.944 -9.295 41.988 1.00 4.21 H new ATOM 785 N ARG A 52 52.907 -13.034 45.489 1.00 64.04 N ATOM 786 CA ARG A 52 53.470 -14.249 46.063 1.00 42.12 C ATOM 787 C ARG A 52 52.803 -15.534 45.555 1.00 44.05 C ATOM 788 O ARG A 52 52.313 -16.347 46.337 1.00 41.53 O ATOM 789 CB ARG A 52 53.584 -14.153 47.595 1.00 30.00 C ATOM 790 CG ARG A 52 52.259 -13.867 48.320 1.00 21.24 C ATOM 791 CD ARG A 52 52.422 -13.981 49.838 1.00 61.23 C ATOM 792 NE ARG A 52 52.677 -15.369 50.244 1.00 34.43 N ATOM 793 CZ ARG A 52 52.903 -15.770 51.506 1.00 2.43 C ATOM 794 NH1 ARG A 52 52.904 -14.886 52.515 1.00 14.21 N ATOM 795 NH2 ARG A 52 53.128 -17.067 51.758 1.00 3.22 N ATOM 0 H ARG A 52 53.634 -12.379 45.202 1.00 64.04 H new ATOM 0 HA ARG A 52 54.492 -14.329 45.693 1.00 42.12 H new ATOM 0 HB2 ARG A 52 53.996 -15.088 47.975 1.00 30.00 H new ATOM 0 HB3 ARG A 52 54.296 -13.366 47.844 1.00 30.00 H new ATOM 0 HG2 ARG A 52 51.910 -12.867 48.063 1.00 21.24 H new ATOM 0 HG3 ARG A 52 51.497 -14.568 47.980 1.00 21.24 H new ATOM 0 HD2 ARG A 52 53.245 -13.347 50.166 1.00 61.23 H new ATOM 0 HD3 ARG A 52 51.521 -13.615 50.331 1.00 61.23 H new ATOM 0 HE ARG A 52 52.683 -16.081 49.514 1.00 34.43 H new ATOM 0 HH11 ARG A 52 52.732 -13.898 52.328 1.00 14.21 H new ATOM 0 HH12 ARG A 52 53.077 -15.202 53.469 1.00 14.21 H new ATOM 0 HH21 ARG A 52 53.127 -17.743 50.994 1.00 3.22 H new ATOM 0 HH22 ARG A 52 53.300 -17.378 52.714 1.00 3.22 H new ATOM 809 N VAL A 53 52.827 -15.714 44.229 1.00 31.24 N ATOM 810 CA VAL A 53 52.334 -16.881 43.506 1.00 22.53 C ATOM 811 C VAL A 53 53.306 -17.199 42.362 1.00 33.45 C ATOM 812 O VAL A 53 54.353 -16.564 42.252 1.00 74.31 O ATOM 813 CB VAL A 53 50.903 -16.621 42.996 1.00 2.30 C ATOM 814 CG1 VAL A 53 49.895 -16.563 44.150 1.00 1.51 C ATOM 815 CG2 VAL A 53 50.820 -15.340 42.155 1.00 63.13 C ATOM 0 H VAL A 53 53.213 -15.008 43.602 1.00 31.24 H new ATOM 0 HA VAL A 53 52.285 -17.747 44.166 1.00 22.53 H new ATOM 0 HB VAL A 53 50.643 -17.463 42.355 1.00 2.30 H new ATOM 0 HG11 VAL A 53 48.897 -16.378 43.752 1.00 1.51 H new ATOM 0 HG12 VAL A 53 49.902 -17.511 44.687 1.00 1.51 H new ATOM 0 HG13 VAL A 53 50.169 -15.758 44.832 1.00 1.51 H new ATOM 0 HG21 VAL A 53 49.795 -15.194 41.815 1.00 63.13 H new ATOM 0 HG22 VAL A 53 51.127 -14.487 42.760 1.00 63.13 H new ATOM 0 HG23 VAL A 53 51.479 -15.428 41.292 1.00 63.13 H new ATOM 825 N SER A 54 52.963 -18.185 41.520 1.00 0.00 N ATOM 826 CA SER A 54 53.788 -18.645 40.408 1.00 13.44 C ATOM 827 C SER A 54 53.240 -18.134 39.070 1.00 41.25 C ATOM 828 O SER A 54 53.880 -17.305 38.424 1.00 51.23 O ATOM 829 CB SER A 54 53.886 -20.176 40.443 1.00 31.12 C ATOM 830 OG SER A 54 54.414 -20.594 41.685 1.00 10.24 O ATOM 0 H SER A 54 52.082 -18.693 41.601 1.00 0.00 H new ATOM 0 HA SER A 54 54.793 -18.236 40.510 1.00 13.44 H new ATOM 0 HB2 SER A 54 52.901 -20.616 40.290 1.00 31.12 H new ATOM 0 HB3 SER A 54 54.522 -20.527 39.630 1.00 31.12 H new ATOM 0 HG SER A 54 54.473 -21.572 41.703 1.00 10.24 H new ATOM 836 N HIS A 55 52.077 -18.647 38.642 1.00 52.45 N ATOM 837 CA HIS A 55 51.490 -18.356 37.333 1.00 50.41 C ATOM 838 C HIS A 55 50.024 -18.800 37.265 1.00 23.13 C ATOM 839 O HIS A 55 49.184 -18.078 36.733 1.00 2.12 O ATOM 840 CB HIS A 55 52.313 -19.003 36.207 1.00 63.12 C ATOM 841 CG HIS A 55 52.531 -20.487 36.366 1.00 22.14 C ATOM 842 ND1 HIS A 55 53.662 -21.010 36.973 1.00 2.12 N ATOM 843 CD2 HIS A 55 51.779 -21.578 36.000 1.00 74.03 C ATOM 844 CE1 HIS A 55 53.533 -22.347 36.973 1.00 5.13 C ATOM 845 NE2 HIS A 55 52.401 -22.757 36.397 1.00 42.33 N ATOM 0 H HIS A 55 51.513 -19.284 39.205 1.00 52.45 H new ATOM 0 HA HIS A 55 51.514 -17.275 37.193 1.00 50.41 H new ATOM 0 HB2 HIS A 55 51.811 -18.822 35.257 1.00 63.12 H new ATOM 0 HB3 HIS A 55 53.283 -18.510 36.154 1.00 63.12 H new ATOM 0 HD2 HIS A 55 50.836 -21.527 35.477 1.00 74.03 H new ATOM 0 HE1 HIS A 55 54.267 -23.018 37.394 1.00 5.13 H new ATOM 0 HE2 HIS A 55 52.069 -23.714 36.276 1.00 42.33 H new ATOM 853 N GLY A 56 49.710 -19.990 37.796 1.00 60.25 N ATOM 854 CA GLY A 56 48.365 -20.547 37.774 1.00 52.33 C ATOM 855 C GLY A 56 47.355 -19.612 38.440 1.00 52.15 C ATOM 856 O GLY A 56 46.259 -19.404 37.922 1.00 70.14 O ATOM 0 H GLY A 56 50.394 -20.592 38.255 1.00 60.25 H new ATOM 0 HA2 GLY A 56 48.065 -20.732 36.743 1.00 52.33 H new ATOM 0 HA3 GLY A 56 48.361 -21.510 38.285 1.00 52.33 H new ATOM 860 N CYS A 57 47.741 -19.034 39.582 1.00 11.14 N ATOM 861 CA CYS A 57 46.914 -18.101 40.331 1.00 52.21 C ATOM 862 C CYS A 57 46.843 -16.748 39.623 1.00 4.13 C ATOM 863 O CYS A 57 45.795 -16.106 39.646 1.00 15.43 O ATOM 864 CB CYS A 57 47.471 -17.927 41.744 1.00 1.01 C ATOM 865 SG CYS A 57 47.557 -19.524 42.600 1.00 71.12 S ATOM 0 H CYS A 57 48.649 -19.208 40.012 1.00 11.14 H new ATOM 0 HA CYS A 57 45.905 -18.508 40.392 1.00 52.21 H new ATOM 0 HB2 CYS A 57 48.464 -17.480 41.696 1.00 1.01 H new ATOM 0 HB3 CYS A 57 46.839 -17.240 42.307 1.00 1.01 H new ATOM 0 HG CYS A 57 48.035 -19.350 43.796 1.00 71.12 H new ATOM 871 N VAL A 58 47.949 -16.313 39.001 1.00 3.14 N ATOM 872 CA VAL A 58 48.038 -15.039 38.297 1.00 11.22 C ATOM 873 C VAL A 58 46.898 -14.909 37.284 1.00 2.23 C ATOM 874 O VAL A 58 46.272 -13.857 37.208 1.00 45.21 O ATOM 875 CB VAL A 58 49.421 -14.872 37.638 1.00 3.31 C ATOM 876 CG1 VAL A 58 49.532 -13.521 36.919 1.00 73.21 C ATOM 877 CG2 VAL A 58 50.544 -14.954 38.679 1.00 64.45 C ATOM 0 H VAL A 58 48.816 -16.850 38.977 1.00 3.14 H new ATOM 0 HA VAL A 58 47.929 -14.230 39.019 1.00 11.22 H new ATOM 0 HB VAL A 58 49.526 -15.683 36.918 1.00 3.31 H new ATOM 0 HG11 VAL A 58 50.518 -13.431 36.464 1.00 73.21 H new ATOM 0 HG12 VAL A 58 48.768 -13.457 36.145 1.00 73.21 H new ATOM 0 HG13 VAL A 58 49.389 -12.714 37.637 1.00 73.21 H new ATOM 0 HG21 VAL A 58 51.508 -14.833 38.185 1.00 64.45 H new ATOM 0 HG22 VAL A 58 50.413 -14.164 39.418 1.00 64.45 H new ATOM 0 HG23 VAL A 58 50.510 -15.924 39.175 1.00 64.45 H new ATOM 887 N SER A 59 46.603 -15.986 36.541 1.00 11.22 N ATOM 888 CA SER A 59 45.501 -16.036 35.588 1.00 5.52 C ATOM 889 C SER A 59 44.190 -15.528 36.205 1.00 24.51 C ATOM 890 O SER A 59 43.612 -14.558 35.716 1.00 41.34 O ATOM 891 CB SER A 59 45.359 -17.467 35.053 1.00 65.14 C ATOM 892 OG SER A 59 44.333 -17.538 34.086 1.00 34.44 O ATOM 0 H SER A 59 47.135 -16.855 36.591 1.00 11.22 H new ATOM 0 HA SER A 59 45.725 -15.368 34.756 1.00 5.52 H new ATOM 0 HB2 SER A 59 46.302 -17.792 34.614 1.00 65.14 H new ATOM 0 HB3 SER A 59 45.139 -18.148 35.875 1.00 65.14 H new ATOM 0 HG SER A 59 44.258 -18.457 33.755 1.00 34.44 H new ATOM 898 N LYS A 60 43.724 -16.172 37.284 1.00 53.53 N ATOM 899 CA LYS A 60 42.474 -15.799 37.935 1.00 22.42 C ATOM 900 C LYS A 60 42.560 -14.429 38.619 1.00 73.34 C ATOM 901 O LYS A 60 41.571 -13.700 38.626 1.00 44.22 O ATOM 902 CB LYS A 60 41.965 -16.904 38.870 1.00 61.32 C ATOM 903 CG LYS A 60 42.911 -17.251 40.026 1.00 54.14 C ATOM 904 CD LYS A 60 42.220 -18.218 40.993 1.00 70.41 C ATOM 905 CE LYS A 60 43.126 -18.536 42.188 1.00 13.51 C ATOM 906 NZ LYS A 60 42.444 -19.407 43.162 1.00 11.41 N ATOM 0 H LYS A 60 44.203 -16.959 37.722 1.00 53.53 H new ATOM 0 HA LYS A 60 41.725 -15.692 37.151 1.00 22.42 H new ATOM 0 HB2 LYS A 60 41.005 -16.597 39.284 1.00 61.32 H new ATOM 0 HB3 LYS A 60 41.786 -17.804 38.282 1.00 61.32 H new ATOM 0 HG2 LYS A 60 43.824 -17.702 39.637 1.00 54.14 H new ATOM 0 HG3 LYS A 60 43.204 -16.343 40.553 1.00 54.14 H new ATOM 0 HD2 LYS A 60 41.286 -17.781 41.346 1.00 70.41 H new ATOM 0 HD3 LYS A 60 41.963 -19.140 40.471 1.00 70.41 H new ATOM 0 HE2 LYS A 60 44.036 -19.022 41.837 1.00 13.51 H new ATOM 0 HE3 LYS A 60 43.427 -17.609 42.675 1.00 13.51 H new ATOM 0 HZ1 LYS A 60 43.083 -19.604 43.959 1.00 11.41 H new ATOM 0 HZ2 LYS A 60 41.589 -18.931 43.514 1.00 11.41 H new ATOM 0 HZ3 LYS A 60 42.179 -20.301 42.702 1.00 11.41 H new ATOM 920 N ILE A 61 43.726 -14.070 39.173 1.00 13.44 N ATOM 921 CA ILE A 61 43.947 -12.783 39.828 1.00 2.33 C ATOM 922 C ILE A 61 43.795 -11.631 38.826 1.00 52.55 C ATOM 923 O ILE A 61 43.212 -10.606 39.168 1.00 74.04 O ATOM 924 CB ILE A 61 45.316 -12.776 40.541 1.00 13.23 C ATOM 925 CG1 ILE A 61 45.271 -13.713 41.764 1.00 74.40 C ATOM 926 CG2 ILE A 61 45.702 -11.360 40.991 1.00 41.43 C ATOM 927 CD1 ILE A 61 46.662 -14.059 42.308 1.00 44.11 C ATOM 0 H ILE A 61 44.548 -14.674 39.177 1.00 13.44 H new ATOM 0 HA ILE A 61 43.185 -12.633 40.593 1.00 2.33 H new ATOM 0 HB ILE A 61 46.068 -13.127 39.834 1.00 13.23 H new ATOM 0 HG12 ILE A 61 44.685 -13.242 42.554 1.00 74.40 H new ATOM 0 HG13 ILE A 61 44.755 -14.633 41.490 1.00 74.40 H new ATOM 0 HG21 ILE A 61 46.671 -11.388 41.490 1.00 41.43 H new ATOM 0 HG22 ILE A 61 45.760 -10.705 40.122 1.00 41.43 H new ATOM 0 HG23 ILE A 61 44.949 -10.980 41.682 1.00 41.43 H new ATOM 0 HD11 ILE A 61 46.562 -14.721 43.168 1.00 44.11 H new ATOM 0 HD12 ILE A 61 47.243 -14.557 41.532 1.00 44.11 H new ATOM 0 HD13 ILE A 61 47.172 -13.145 42.612 1.00 44.11 H new ATOM 939 N LEU A 62 44.301 -11.794 37.598 1.00 13.30 N ATOM 940 CA LEU A 62 44.113 -10.827 36.522 1.00 14.15 C ATOM 941 C LEU A 62 42.651 -10.805 36.070 1.00 64.33 C ATOM 942 O LEU A 62 42.107 -9.726 35.846 1.00 52.14 O ATOM 943 CB LEU A 62 45.067 -11.124 35.354 1.00 33.42 C ATOM 944 CG LEU A 62 46.415 -10.382 35.445 1.00 34.53 C ATOM 945 CD1 LEU A 62 46.267 -8.898 35.082 1.00 0.51 C ATOM 946 CD2 LEU A 62 47.093 -10.513 36.813 1.00 33.50 C ATOM 0 H LEU A 62 44.855 -12.606 37.326 1.00 13.30 H new ATOM 0 HA LEU A 62 44.356 -9.833 36.897 1.00 14.15 H new ATOM 0 HB2 LEU A 62 45.256 -12.197 35.316 1.00 33.42 H new ATOM 0 HB3 LEU A 62 44.577 -10.853 34.419 1.00 33.42 H new ATOM 0 HG LEU A 62 47.061 -10.871 34.715 1.00 34.53 H new ATOM 0 HD11 LEU A 62 47.237 -8.407 35.157 1.00 0.51 H new ATOM 0 HD12 LEU A 62 45.893 -8.808 34.062 1.00 0.51 H new ATOM 0 HD13 LEU A 62 45.566 -8.424 35.769 1.00 0.51 H new ATOM 0 HD21 LEU A 62 48.036 -9.967 36.805 1.00 33.50 H new ATOM 0 HD22 LEU A 62 46.441 -10.101 37.583 1.00 33.50 H new ATOM 0 HD23 LEU A 62 47.285 -11.565 37.025 1.00 33.50 H new ATOM 958 N GLY A 63 42.018 -11.980 35.957 1.00 22.04 N ATOM 959 CA GLY A 63 40.583 -12.095 35.734 1.00 43.01 C ATOM 960 C GLY A 63 40.272 -13.072 34.613 1.00 65.34 C ATOM 961 O GLY A 63 39.878 -12.661 33.523 1.00 63.22 O ATOM 0 H GLY A 63 42.496 -12.879 36.019 1.00 22.04 H new ATOM 0 HA2 GLY A 63 40.096 -12.425 36.652 1.00 43.01 H new ATOM 0 HA3 GLY A 63 40.172 -11.116 35.489 1.00 43.01 H new ATOM 1314 N LYS A 87 -0.793 -0.943 4.235 1.00 40.41 N ATOM 1315 CA LYS A 87 -1.085 -1.880 3.160 1.00 23.51 C ATOM 1316 C LYS A 87 -2.037 -2.994 3.619 1.00 43.41 C ATOM 1317 O LYS A 87 -2.817 -3.494 2.813 1.00 11.32 O ATOM 1318 CB LYS A 87 0.224 -2.434 2.584 1.00 54.02 C ATOM 1319 CG LYS A 87 -0.023 -3.190 1.271 1.00 35.41 C ATOM 1320 CD LYS A 87 1.302 -3.539 0.587 1.00 20.13 C ATOM 1321 CE LYS A 87 1.035 -4.242 -0.748 1.00 21.44 C ATOM 1322 NZ LYS A 87 2.289 -4.563 -1.451 1.00 23.50 N ATOM 0 HA LYS A 87 -1.607 -1.348 2.365 1.00 23.51 H new ATOM 0 HB2 LYS A 87 0.923 -1.616 2.410 1.00 54.02 H new ATOM 0 HB3 LYS A 87 0.690 -3.102 3.309 1.00 54.02 H new ATOM 0 HG2 LYS A 87 -0.585 -4.102 1.471 1.00 35.41 H new ATOM 0 HG3 LYS A 87 -0.632 -2.580 0.604 1.00 35.41 H new ATOM 0 HD2 LYS A 87 1.884 -2.633 0.420 1.00 20.13 H new ATOM 0 HD3 LYS A 87 1.896 -4.184 1.234 1.00 20.13 H new ATOM 0 HE2 LYS A 87 0.471 -5.158 -0.571 1.00 21.44 H new ATOM 0 HE3 LYS A 87 0.416 -3.604 -1.379 1.00 21.44 H new ATOM 0 HZ1 LYS A 87 2.071 -5.038 -2.350 1.00 23.50 H new ATOM 0 HZ2 LYS A 87 2.815 -3.686 -1.641 1.00 23.50 H new ATOM 0 HZ3 LYS A 87 2.868 -5.192 -0.859 1.00 23.50 H new ATOM 1336 N VAL A 88 -2.012 -3.354 4.912 1.00 45.02 N ATOM 1337 CA VAL A 88 -2.971 -4.286 5.500 1.00 23.45 C ATOM 1338 C VAL A 88 -4.409 -3.812 5.249 1.00 33.54 C ATOM 1339 O VAL A 88 -5.280 -4.639 5.000 1.00 14.31 O ATOM 1340 CB VAL A 88 -2.690 -4.476 7.003 1.00 20.52 C ATOM 1341 CG1 VAL A 88 -3.725 -5.403 7.655 1.00 34.22 C ATOM 1342 CG2 VAL A 88 -1.306 -5.095 7.236 1.00 23.00 C ATOM 0 H VAL A 88 -1.322 -3.003 5.576 1.00 45.02 H new ATOM 0 HA VAL A 88 -2.855 -5.257 5.017 1.00 23.45 H new ATOM 0 HB VAL A 88 -2.741 -3.483 7.451 1.00 20.52 H new ATOM 0 HG11 VAL A 88 -3.497 -5.515 8.715 1.00 34.22 H new ATOM 0 HG12 VAL A 88 -4.720 -4.974 7.542 1.00 34.22 H new ATOM 0 HG13 VAL A 88 -3.694 -6.380 7.172 1.00 34.22 H new ATOM 0 HG21 VAL A 88 -1.137 -5.216 8.306 1.00 23.00 H new ATOM 0 HG22 VAL A 88 -1.256 -6.068 6.748 1.00 23.00 H new ATOM 0 HG23 VAL A 88 -0.540 -4.441 6.820 1.00 23.00 H new ATOM 1352 N VAL A 89 -4.658 -2.496 5.297 1.00 53.21 N ATOM 1353 CA VAL A 89 -5.965 -1.919 5.002 1.00 52.42 C ATOM 1354 C VAL A 89 -6.275 -2.064 3.508 1.00 22.33 C ATOM 1355 O VAL A 89 -7.357 -2.523 3.146 1.00 60.53 O ATOM 1356 CB VAL A 89 -6.035 -0.449 5.460 1.00 22.30 C ATOM 1357 CG1 VAL A 89 -7.464 0.093 5.323 1.00 62.11 C ATOM 1358 CG2 VAL A 89 -5.595 -0.293 6.923 1.00 61.33 C ATOM 0 H VAL A 89 -3.951 -1.803 5.543 1.00 53.21 H new ATOM 0 HA VAL A 89 -6.726 -2.464 5.560 1.00 52.42 H new ATOM 0 HB VAL A 89 -5.357 0.115 4.820 1.00 22.30 H new ATOM 0 HG11 VAL A 89 -7.492 1.132 5.651 1.00 62.11 H new ATOM 0 HG12 VAL A 89 -7.777 0.033 4.281 1.00 62.11 H new ATOM 0 HG13 VAL A 89 -8.139 -0.501 5.939 1.00 62.11 H new ATOM 0 HG21 VAL A 89 -5.657 0.756 7.212 1.00 61.33 H new ATOM 0 HG22 VAL A 89 -6.248 -0.885 7.564 1.00 61.33 H new ATOM 0 HG23 VAL A 89 -4.567 -0.639 7.033 1.00 61.33 H new ATOM 1368 N GLU A 90 -5.323 -1.683 2.645 1.00 2.53 N ATOM 1369 CA GLU A 90 -5.468 -1.737 1.192 1.00 0.21 C ATOM 1370 C GLU A 90 -5.857 -3.137 0.705 1.00 63.41 C ATOM 1371 O GLU A 90 -6.654 -3.262 -0.223 1.00 43.51 O ATOM 1372 CB GLU A 90 -4.174 -1.280 0.508 1.00 34.42 C ATOM 1373 CG GLU A 90 -3.840 0.179 0.842 1.00 22.10 C ATOM 1374 CD GLU A 90 -2.562 0.656 0.151 1.00 63.54 C ATOM 1375 OE1 GLU A 90 -1.662 -0.188 -0.052 1.00 30.43 O ATOM 1376 OE2 GLU A 90 -2.506 1.866 -0.159 1.00 4.22 O ATOM 0 H GLU A 90 -4.417 -1.323 2.947 1.00 2.53 H new ATOM 0 HA GLU A 90 -6.277 -1.058 0.922 1.00 0.21 H new ATOM 0 HB2 GLU A 90 -3.351 -1.922 0.821 1.00 34.42 H new ATOM 0 HB3 GLU A 90 -4.274 -1.392 -0.572 1.00 34.42 H new ATOM 0 HG2 GLU A 90 -4.672 0.817 0.543 1.00 22.10 H new ATOM 0 HG3 GLU A 90 -3.728 0.286 1.921 1.00 22.10 H new ATOM 1383 N LYS A 91 -5.302 -4.181 1.335 1.00 12.01 N ATOM 1384 CA LYS A 91 -5.563 -5.576 1.002 1.00 50.50 C ATOM 1385 C LYS A 91 -7.049 -5.938 0.980 1.00 75.11 C ATOM 1386 O LYS A 91 -7.444 -6.767 0.161 1.00 4.05 O ATOM 1387 CB LYS A 91 -4.830 -6.491 1.985 1.00 31.32 C ATOM 1388 CG LYS A 91 -3.340 -6.651 1.679 1.00 4.42 C ATOM 1389 CD LYS A 91 -3.110 -7.440 0.381 1.00 24.33 C ATOM 1390 CE LYS A 91 -1.759 -8.162 0.376 1.00 72.14 C ATOM 1391 NZ LYS A 91 -1.741 -9.299 1.315 1.00 3.12 N ATOM 0 H LYS A 91 -4.645 -4.070 2.107 1.00 12.01 H new ATOM 0 HA LYS A 91 -5.192 -5.721 -0.013 1.00 50.50 H new ATOM 0 HB2 LYS A 91 -4.944 -6.093 2.993 1.00 31.32 H new ATOM 0 HB3 LYS A 91 -5.302 -7.473 1.975 1.00 31.32 H new ATOM 0 HG2 LYS A 91 -2.878 -5.667 1.594 1.00 4.42 H new ATOM 0 HG3 LYS A 91 -2.851 -7.163 2.508 1.00 4.42 H new ATOM 0 HD2 LYS A 91 -3.910 -8.169 0.254 1.00 24.33 H new ATOM 0 HD3 LYS A 91 -3.160 -6.760 -0.469 1.00 24.33 H new ATOM 0 HE2 LYS A 91 -1.542 -8.519 -0.631 1.00 72.14 H new ATOM 0 HE3 LYS A 91 -0.970 -7.458 0.642 1.00 72.14 H new ATOM 0 HZ1 LYS A 91 -0.871 -9.852 1.174 1.00 3.12 H new ATOM 0 HZ2 LYS A 91 -1.771 -8.943 2.292 1.00 3.12 H new ATOM 0 HZ3 LYS A 91 -2.568 -9.905 1.142 1.00 3.12 H new ATOM 1405 N ILE A 92 -7.876 -5.340 1.855 1.00 64.24 N ATOM 1406 CA ILE A 92 -9.314 -5.581 1.824 1.00 1.13 C ATOM 1407 C ILE A 92 -9.866 -5.238 0.439 1.00 10.42 C ATOM 1408 O ILE A 92 -10.685 -5.985 -0.096 1.00 53.21 O ATOM 1409 CB ILE A 92 -10.034 -4.814 2.953 1.00 4.32 C ATOM 1410 CG1 ILE A 92 -9.750 -5.453 4.328 1.00 14.34 C ATOM 1411 CG2 ILE A 92 -11.555 -4.805 2.738 1.00 51.52 C ATOM 1412 CD1 ILE A 92 -8.543 -4.837 5.033 1.00 62.32 C ATOM 0 H ILE A 92 -7.570 -4.694 2.582 1.00 64.24 H new ATOM 0 HA ILE A 92 -9.503 -6.639 2.006 1.00 1.13 H new ATOM 0 HB ILE A 92 -9.651 -3.794 2.931 1.00 4.32 H new ATOM 0 HG12 ILE A 92 -10.630 -5.343 4.962 1.00 14.34 H new ATOM 0 HG13 ILE A 92 -9.582 -6.522 4.198 1.00 14.34 H new ATOM 0 HG21 ILE A 92 -12.034 -4.257 3.550 1.00 51.52 H new ATOM 0 HG22 ILE A 92 -11.785 -4.322 1.789 1.00 51.52 H new ATOM 0 HG23 ILE A 92 -11.926 -5.830 2.723 1.00 51.52 H new ATOM 0 HD11 ILE A 92 -8.394 -5.328 5.995 1.00 62.32 H new ATOM 0 HD12 ILE A 92 -7.654 -4.970 4.416 1.00 62.32 H new ATOM 0 HD13 ILE A 92 -8.718 -3.773 5.192 1.00 62.32 H new ATOM 1424 N GLY A 93 -9.387 -4.134 -0.150 1.00 23.34 N ATOM 1425 CA GLY A 93 -9.701 -3.740 -1.511 1.00 5.22 C ATOM 1426 C GLY A 93 -9.457 -4.887 -2.489 1.00 44.44 C ATOM 1427 O GLY A 93 -10.373 -5.270 -3.211 1.00 33.45 O ATOM 0 H GLY A 93 -8.759 -3.484 0.324 1.00 23.34 H new ATOM 0 HA2 GLY A 93 -10.743 -3.424 -1.570 1.00 5.22 H new ATOM 0 HA3 GLY A 93 -9.091 -2.882 -1.794 1.00 5.22 H new ATOM 1431 N ASP A 94 -8.239 -5.446 -2.504 1.00 11.12 N ATOM 1432 CA ASP A 94 -7.877 -6.509 -3.432 1.00 3.20 C ATOM 1433 C ASP A 94 -8.764 -7.736 -3.254 1.00 71.25 C ATOM 1434 O ASP A 94 -9.286 -8.252 -4.238 1.00 21.32 O ATOM 1435 CB ASP A 94 -6.411 -6.915 -3.272 1.00 72.54 C ATOM 1436 CG ASP A 94 -5.449 -5.748 -3.475 1.00 63.21 C ATOM 1437 OD1 ASP A 94 -5.572 -5.084 -4.528 1.00 61.31 O ATOM 1438 OD2 ASP A 94 -4.605 -5.544 -2.576 1.00 71.24 O ATOM 0 H ASP A 94 -7.486 -5.171 -1.874 1.00 11.12 H new ATOM 0 HA ASP A 94 -8.027 -6.111 -4.436 1.00 3.20 H new ATOM 0 HB2 ASP A 94 -6.261 -7.334 -2.277 1.00 72.54 H new ATOM 0 HB3 ASP A 94 -6.176 -7.702 -3.988 1.00 72.54 H new ATOM 1443 N TYR A 95 -8.931 -8.221 -2.018 1.00 53.33 N ATOM 1444 CA TYR A 95 -9.719 -9.409 -1.763 1.00 11.35 C ATOM 1445 C TYR A 95 -11.199 -9.223 -2.128 1.00 72.12 C ATOM 1446 O TYR A 95 -11.800 -10.150 -2.671 1.00 71.25 O ATOM 1447 CB TYR A 95 -9.458 -9.870 -0.330 1.00 52.20 C ATOM 1448 CG TYR A 95 -7.997 -10.183 -0.034 1.00 14.24 C ATOM 1449 CD1 TYR A 95 -7.246 -10.981 -0.918 1.00 43.03 C ATOM 1450 CD2 TYR A 95 -7.400 -9.724 1.155 1.00 60.45 C ATOM 1451 CE1 TYR A 95 -5.893 -11.251 -0.664 1.00 33.01 C ATOM 1452 CE2 TYR A 95 -6.054 -10.025 1.425 1.00 44.23 C ATOM 1453 CZ TYR A 95 -5.293 -10.768 0.509 1.00 63.12 C ATOM 1454 OH TYR A 95 -3.980 -11.041 0.768 1.00 33.12 O ATOM 0 H TYR A 95 -8.525 -7.799 -1.183 1.00 53.33 H new ATOM 0 HA TYR A 95 -9.405 -10.216 -2.425 1.00 11.35 H new ATOM 0 HB2 TYR A 95 -9.799 -9.096 0.357 1.00 52.20 H new ATOM 0 HB3 TYR A 95 -10.056 -10.759 -0.131 1.00 52.20 H new ATOM 0 HD1 TYR A 95 -7.716 -11.389 -1.800 1.00 43.03 H new ATOM 0 HD2 TYR A 95 -7.975 -9.141 1.859 1.00 60.45 H new ATOM 0 HE1 TYR A 95 -5.315 -11.829 -1.369 1.00 33.01 H new ATOM 0 HE2 TYR A 95 -5.602 -9.682 2.344 1.00 44.23 H new ATOM 0 HH TYR A 95 -3.492 -11.132 -0.077 1.00 33.12 H new ATOM 1464 N LYS A 96 -11.783 -8.036 -1.906 1.00 44.40 N ATOM 1465 CA LYS A 96 -13.112 -7.718 -2.421 1.00 33.32 C ATOM 1466 C LYS A 96 -13.142 -7.720 -3.951 1.00 24.53 C ATOM 1467 O LYS A 96 -14.075 -8.265 -4.534 1.00 4.33 O ATOM 1468 CB LYS A 96 -13.600 -6.355 -1.908 1.00 24.43 C ATOM 1469 CG LYS A 96 -14.005 -6.346 -0.431 1.00 23.41 C ATOM 1470 CD LYS A 96 -15.178 -7.270 -0.067 1.00 23.52 C ATOM 1471 CE LYS A 96 -16.452 -7.056 -0.894 1.00 1.14 C ATOM 1472 NZ LYS A 96 -16.523 -7.985 -2.036 1.00 4.54 N ATOM 0 H LYS A 96 -11.350 -7.283 -1.371 1.00 44.40 H new ATOM 0 HA LYS A 96 -13.780 -8.498 -2.056 1.00 33.32 H new ATOM 0 HB2 LYS A 96 -12.811 -5.619 -2.061 1.00 24.43 H new ATOM 0 HB3 LYS A 96 -14.453 -6.038 -2.508 1.00 24.43 H new ATOM 0 HG2 LYS A 96 -13.140 -6.631 0.168 1.00 23.41 H new ATOM 0 HG3 LYS A 96 -14.266 -5.326 -0.149 1.00 23.41 H new ATOM 0 HD2 LYS A 96 -14.856 -8.305 -0.185 1.00 23.52 H new ATOM 0 HD3 LYS A 96 -15.419 -7.129 0.987 1.00 23.52 H new ATOM 0 HE2 LYS A 96 -17.326 -7.194 -0.258 1.00 1.14 H new ATOM 0 HE3 LYS A 96 -16.481 -6.029 -1.258 1.00 1.14 H new ATOM 0 HZ1 LYS A 96 -17.500 -8.321 -2.150 1.00 4.54 H new ATOM 0 HZ2 LYS A 96 -16.223 -7.494 -2.902 1.00 4.54 H new ATOM 0 HZ3 LYS A 96 -15.896 -8.796 -1.863 1.00 4.54 H new ATOM 1486 N ARG A 97 -12.157 -7.090 -4.601 1.00 55.53 N ATOM 1487 CA ARG A 97 -12.090 -6.998 -6.053 1.00 55.10 C ATOM 1488 C ARG A 97 -12.028 -8.386 -6.689 1.00 32.54 C ATOM 1489 O ARG A 97 -12.824 -8.687 -7.577 1.00 54.41 O ATOM 1490 CB ARG A 97 -10.881 -6.151 -6.469 1.00 43.23 C ATOM 1491 CG ARG A 97 -11.146 -4.658 -6.238 1.00 74.41 C ATOM 1492 CD ARG A 97 -9.849 -3.838 -6.267 1.00 13.22 C ATOM 1493 NE ARG A 97 -8.986 -4.173 -7.408 1.00 1.45 N ATOM 1494 CZ ARG A 97 -9.191 -3.806 -8.684 1.00 35.21 C ATOM 1495 NH1 ARG A 97 -10.262 -3.078 -9.029 1.00 24.33 N ATOM 1496 NH2 ARG A 97 -8.310 -4.175 -9.624 1.00 20.25 N ATOM 0 H ARG A 97 -11.382 -6.628 -4.126 1.00 55.53 H new ATOM 0 HA ARG A 97 -12.997 -6.512 -6.412 1.00 55.10 H new ATOM 0 HB2 ARG A 97 -10.004 -6.460 -5.900 1.00 43.23 H new ATOM 0 HB3 ARG A 97 -10.656 -6.325 -7.521 1.00 43.23 H new ATOM 0 HG2 ARG A 97 -11.828 -4.287 -7.003 1.00 74.41 H new ATOM 0 HG3 ARG A 97 -11.641 -4.521 -5.277 1.00 74.41 H new ATOM 0 HD2 ARG A 97 -10.097 -2.777 -6.304 1.00 13.22 H new ATOM 0 HD3 ARG A 97 -9.299 -4.005 -5.341 1.00 13.22 H new ATOM 0 HE ARG A 97 -8.157 -4.735 -7.214 1.00 1.45 H new ATOM 0 HH11 ARG A 97 -10.936 -2.794 -8.318 1.00 24.33 H new ATOM 0 HH12 ARG A 97 -10.403 -2.808 -10.002 1.00 24.33 H new ATOM 0 HH21 ARG A 97 -7.493 -4.729 -9.368 1.00 20.25 H new ATOM 0 HH22 ARG A 97 -8.456 -3.902 -10.596 1.00 20.25 H new ATOM 1510 N GLN A 98 -11.086 -9.226 -6.244 1.00 72.13 N ATOM 1511 CA GLN A 98 -10.882 -10.545 -6.819 1.00 74.14 C ATOM 1512 C GLN A 98 -12.074 -11.466 -6.520 1.00 60.23 C ATOM 1513 O GLN A 98 -12.483 -12.231 -7.390 1.00 65.02 O ATOM 1514 CB GLN A 98 -9.532 -11.139 -6.389 1.00 60.31 C ATOM 1515 CG GLN A 98 -9.554 -11.713 -4.971 1.00 73.33 C ATOM 1516 CD GLN A 98 -8.159 -12.037 -4.453 1.00 65.22 C ATOM 1517 OE1 GLN A 98 -7.269 -11.191 -4.477 1.00 22.40 O ATOM 1518 NE2 GLN A 98 -7.970 -13.258 -3.955 1.00 43.44 N ATOM 0 H GLN A 98 -10.450 -9.004 -5.478 1.00 72.13 H new ATOM 0 HA GLN A 98 -10.835 -10.447 -7.904 1.00 74.14 H new ATOM 0 HB2 GLN A 98 -9.248 -11.925 -7.089 1.00 60.31 H new ATOM 0 HB3 GLN A 98 -8.766 -10.366 -6.450 1.00 60.31 H new ATOM 0 HG2 GLN A 98 -10.031 -10.998 -4.300 1.00 73.33 H new ATOM 0 HG3 GLN A 98 -10.162 -12.617 -4.958 1.00 73.33 H new ATOM 0 HE21 GLN A 98 -8.735 -13.932 -3.953 1.00 43.44 H new ATOM 0 HE22 GLN A 98 -7.060 -13.519 -3.575 1.00 43.44 H new ATOM 1527 N ASN A 99 -12.624 -11.382 -5.297 1.00 25.30 N ATOM 1528 CA ASN A 99 -13.753 -12.180 -4.836 1.00 34.32 C ATOM 1529 C ASN A 99 -14.885 -11.239 -4.397 1.00 14.32 C ATOM 1530 O ASN A 99 -14.877 -10.768 -3.259 1.00 5.12 O ATOM 1531 CB ASN A 99 -13.290 -13.108 -3.705 1.00 71.41 C ATOM 1532 CG ASN A 99 -14.378 -14.084 -3.276 1.00 35.43 C ATOM 1533 OD1 ASN A 99 -15.532 -13.705 -3.092 1.00 63.43 O ATOM 1534 ND2 ASN A 99 -14.007 -15.348 -3.095 1.00 43.45 N ATOM 0 H ASN A 99 -12.279 -10.736 -4.587 1.00 25.30 H new ATOM 0 HA ASN A 99 -14.138 -12.810 -5.638 1.00 34.32 H new ATOM 0 HB2 ASN A 99 -12.413 -13.666 -4.032 1.00 71.41 H new ATOM 0 HB3 ASN A 99 -12.985 -12.508 -2.848 1.00 71.41 H new ATOM 0 HD21 ASN A 99 -14.691 -16.042 -2.793 1.00 43.45 H new ATOM 0 HD22 ASN A 99 -13.039 -15.624 -3.258 1.00 43.45 H new ATOM 1541 N PRO A 100 -15.864 -10.953 -5.272 1.00 34.30 N ATOM 1542 CA PRO A 100 -16.921 -9.989 -5.001 1.00 64.54 C ATOM 1543 C PRO A 100 -17.933 -10.500 -3.970 1.00 41.51 C ATOM 1544 O PRO A 100 -18.483 -9.697 -3.217 1.00 11.32 O ATOM 1545 CB PRO A 100 -17.574 -9.703 -6.356 1.00 50.22 C ATOM 1546 CG PRO A 100 -17.351 -10.996 -7.134 1.00 42.12 C ATOM 1547 CD PRO A 100 -15.992 -11.477 -6.625 1.00 24.34 C ATOM 0 HA PRO A 100 -16.516 -9.081 -4.554 1.00 64.54 H new ATOM 0 HB2 PRO A 100 -18.635 -9.475 -6.251 1.00 50.22 H new ATOM 0 HB3 PRO A 100 -17.112 -8.850 -6.853 1.00 50.22 H new ATOM 0 HG2 PRO A 100 -18.136 -11.726 -6.937 1.00 42.12 H new ATOM 0 HG3 PRO A 100 -17.340 -10.822 -8.210 1.00 42.12 H new ATOM 0 HD2 PRO A 100 -15.936 -12.566 -6.629 1.00 24.34 H new ATOM 0 HD3 PRO A 100 -15.186 -11.114 -7.262 1.00 24.34 H new ATOM 1555 N THR A 101 -18.186 -11.815 -3.932 1.00 4.23 N ATOM 1556 CA THR A 101 -19.185 -12.413 -3.055 1.00 4.44 C ATOM 1557 C THR A 101 -18.788 -12.307 -1.579 1.00 20.42 C ATOM 1558 O THR A 101 -19.652 -12.061 -0.739 1.00 12.43 O ATOM 1559 CB THR A 101 -19.453 -13.869 -3.464 1.00 73.13 C ATOM 1560 OG1 THR A 101 -18.256 -14.616 -3.447 1.00 2.20 O ATOM 1561 CG2 THR A 101 -20.072 -13.952 -4.863 1.00 2.24 C ATOM 0 H THR A 101 -17.696 -12.493 -4.516 1.00 4.23 H new ATOM 0 HA THR A 101 -20.111 -11.850 -3.170 1.00 4.44 H new ATOM 0 HB THR A 101 -20.157 -14.283 -2.742 1.00 73.13 H new ATOM 0 HG1 THR A 101 -17.501 -14.020 -3.260 1.00 2.20 H new ATOM 0 HG21 THR A 101 -20.249 -14.996 -5.121 1.00 2.24 H new ATOM 0 HG22 THR A 101 -21.018 -13.410 -4.875 1.00 2.24 H new ATOM 0 HG23 THR A 101 -19.391 -13.509 -5.589 1.00 2.24 H new ATOM 1569 N MET A 102 -17.499 -12.482 -1.256 1.00 72.32 N ATOM 1570 CA MET A 102 -17.007 -12.392 0.113 1.00 24.12 C ATOM 1571 C MET A 102 -17.279 -11.010 0.703 1.00 53.52 C ATOM 1572 O MET A 102 -17.031 -9.989 0.062 1.00 25.35 O ATOM 1573 CB MET A 102 -15.513 -12.725 0.176 1.00 2.35 C ATOM 1574 CG MET A 102 -15.304 -14.238 0.254 1.00 34.41 C ATOM 1575 SD MET A 102 -13.570 -14.763 0.173 1.00 13.33 S ATOM 1576 CE MET A 102 -13.034 -14.391 1.863 1.00 75.51 C ATOM 0 H MET A 102 -16.773 -12.690 -1.942 1.00 72.32 H new ATOM 0 HA MET A 102 -17.546 -13.126 0.713 1.00 24.12 H new ATOM 0 HB2 MET A 102 -15.008 -12.327 -0.704 1.00 2.35 H new ATOM 0 HB3 MET A 102 -15.064 -12.245 1.045 1.00 2.35 H new ATOM 0 HG2 MET A 102 -15.738 -14.605 1.184 1.00 34.41 H new ATOM 0 HG3 MET A 102 -15.852 -14.710 -0.561 1.00 34.41 H new ATOM 0 HE1 MET A 102 -11.950 -14.488 1.931 1.00 75.51 H new ATOM 0 HE2 MET A 102 -13.324 -13.372 2.121 1.00 75.51 H new ATOM 0 HE3 MET A 102 -13.505 -15.088 2.556 1.00 75.51 H new ATOM 1586 N PHE A 103 -17.802 -11.012 1.932 1.00 32.22 N ATOM 1587 CA PHE A 103 -18.236 -9.834 2.676 1.00 34.25 C ATOM 1588 C PHE A 103 -17.139 -9.378 3.637 1.00 32.34 C ATOM 1589 O PHE A 103 -16.161 -10.088 3.842 1.00 25.20 O ATOM 1590 CB PHE A 103 -19.508 -10.176 3.457 1.00 43.24 C ATOM 1591 CG PHE A 103 -20.579 -10.866 2.634 1.00 41.51 C ATOM 1592 CD1 PHE A 103 -21.311 -10.134 1.681 1.00 62.24 C ATOM 1593 CD2 PHE A 103 -20.786 -12.252 2.763 1.00 24.50 C ATOM 1594 CE1 PHE A 103 -22.263 -10.784 0.876 1.00 20.44 C ATOM 1595 CE2 PHE A 103 -21.731 -12.901 1.953 1.00 74.23 C ATOM 1596 CZ PHE A 103 -22.474 -12.166 1.012 1.00 11.15 C ATOM 0 H PHE A 103 -17.939 -11.876 2.456 1.00 32.22 H new ATOM 0 HA PHE A 103 -18.441 -9.022 1.978 1.00 34.25 H new ATOM 0 HB2 PHE A 103 -19.243 -10.817 4.298 1.00 43.24 H new ATOM 0 HB3 PHE A 103 -19.922 -9.258 3.874 1.00 43.24 H new ATOM 0 HD1 PHE A 103 -21.142 -9.073 1.568 1.00 62.24 H new ATOM 0 HD2 PHE A 103 -20.217 -12.817 3.486 1.00 24.50 H new ATOM 0 HE1 PHE A 103 -22.833 -10.220 0.152 1.00 20.44 H new ATOM 0 HE2 PHE A 103 -21.888 -13.965 2.052 1.00 74.23 H new ATOM 0 HZ PHE A 103 -23.207 -12.664 0.394 1.00 11.15 H new ATOM 1606 N ALA A 104 -17.317 -8.197 4.243 1.00 61.44 N ATOM 1607 CA ALA A 104 -16.344 -7.559 5.125 1.00 72.32 C ATOM 1608 C ALA A 104 -15.725 -8.518 6.148 1.00 54.23 C ATOM 1609 O ALA A 104 -14.510 -8.511 6.336 1.00 20.22 O ATOM 1610 CB ALA A 104 -17.006 -6.380 5.840 1.00 74.14 C ATOM 0 H ALA A 104 -18.168 -7.647 4.127 1.00 61.44 H new ATOM 0 HA ALA A 104 -15.522 -7.214 4.498 1.00 72.32 H new ATOM 0 HB1 ALA A 104 -16.282 -5.901 6.499 1.00 74.14 H new ATOM 0 HB2 ALA A 104 -17.358 -5.658 5.103 1.00 74.14 H new ATOM 0 HB3 ALA A 104 -17.851 -6.739 6.428 1.00 74.14 H new ATOM 1616 N TRP A 105 -16.553 -9.339 6.802 1.00 63.43 N ATOM 1617 CA TRP A 105 -16.128 -10.266 7.838 1.00 42.13 C ATOM 1618 C TRP A 105 -15.405 -11.482 7.244 1.00 21.31 C ATOM 1619 O TRP A 105 -14.484 -12.007 7.867 1.00 31.32 O ATOM 1620 CB TRP A 105 -17.351 -10.661 8.670 1.00 62.22 C ATOM 1621 CG TRP A 105 -18.520 -11.167 7.883 1.00 60.23 C ATOM 1622 CD1 TRP A 105 -18.643 -12.422 7.412 1.00 53.43 C ATOM 1623 CD2 TRP A 105 -19.685 -10.444 7.380 1.00 41.45 C ATOM 1624 NE1 TRP A 105 -19.806 -12.550 6.685 1.00 73.34 N ATOM 1625 CE2 TRP A 105 -20.492 -11.353 6.632 1.00 2.43 C ATOM 1626 CE3 TRP A 105 -20.128 -9.105 7.453 1.00 74.44 C ATOM 1627 CZ2 TRP A 105 -21.682 -10.959 6.005 1.00 70.24 C ATOM 1628 CZ3 TRP A 105 -21.314 -8.696 6.815 1.00 50.43 C ATOM 1629 CH2 TRP A 105 -22.094 -9.620 6.097 1.00 64.31 C ATOM 0 H TRP A 105 -17.556 -9.373 6.617 1.00 63.43 H new ATOM 0 HA TRP A 105 -15.401 -9.782 8.490 1.00 42.13 H new ATOM 0 HB2 TRP A 105 -17.053 -11.430 9.383 1.00 62.22 H new ATOM 0 HB3 TRP A 105 -17.671 -9.795 9.250 1.00 62.22 H new ATOM 0 HD1 TRP A 105 -17.931 -13.216 7.580 1.00 53.43 H new ATOM 0 HE1 TRP A 105 -20.119 -13.415 6.244 1.00 73.34 H new ATOM 0 HE3 TRP A 105 -19.547 -8.383 8.008 1.00 74.44 H new ATOM 0 HZ2 TRP A 105 -22.275 -11.677 5.458 1.00 70.24 H new ATOM 0 HZ3 TRP A 105 -21.628 -7.664 6.877 1.00 50.43 H new ATOM 0 HH2 TRP A 105 -23.008 -9.300 5.618 1.00 64.31 H new ATOM 1640 N GLU A 106 -15.789 -11.917 6.035 1.00 13.32 N ATOM 1641 CA GLU A 106 -15.101 -12.986 5.331 1.00 71.24 C ATOM 1642 C GLU A 106 -13.677 -12.526 5.009 1.00 55.41 C ATOM 1643 O GLU A 106 -12.716 -13.242 5.279 1.00 51.13 O ATOM 1644 CB GLU A 106 -15.846 -13.371 4.040 1.00 52.31 C ATOM 1645 CG GLU A 106 -17.356 -13.622 4.175 1.00 45.32 C ATOM 1646 CD GLU A 106 -17.730 -14.824 5.039 1.00 71.31 C ATOM 1647 OE1 GLU A 106 -16.827 -15.633 5.342 1.00 40.04 O ATOM 1648 OE2 GLU A 106 -18.934 -14.923 5.360 1.00 12.43 O ATOM 0 H GLU A 106 -16.585 -11.532 5.526 1.00 13.32 H new ATOM 0 HA GLU A 106 -15.070 -13.871 5.967 1.00 71.24 H new ATOM 0 HB2 GLU A 106 -15.695 -12.577 3.308 1.00 52.31 H new ATOM 0 HB3 GLU A 106 -15.384 -14.271 3.634 1.00 52.31 H new ATOM 0 HG2 GLU A 106 -17.822 -12.731 4.595 1.00 45.32 H new ATOM 0 HG3 GLU A 106 -17.777 -13.763 3.180 1.00 45.32 H new ATOM 1655 N ILE A 107 -13.549 -11.316 4.448 1.00 62.04 N ATOM 1656 CA ILE A 107 -12.280 -10.705 4.080 1.00 21.51 C ATOM 1657 C ILE A 107 -11.411 -10.443 5.315 1.00 35.43 C ATOM 1658 O ILE A 107 -10.202 -10.671 5.265 1.00 21.20 O ATOM 1659 CB ILE A 107 -12.518 -9.407 3.294 1.00 25.42 C ATOM 1660 CG1 ILE A 107 -13.422 -9.584 2.063 1.00 13.33 C ATOM 1661 CG2 ILE A 107 -11.172 -8.814 2.863 1.00 45.13 C ATOM 1662 CD1 ILE A 107 -12.792 -10.351 0.903 1.00 15.32 C ATOM 0 H ILE A 107 -14.352 -10.725 4.235 1.00 62.04 H new ATOM 0 HA ILE A 107 -11.742 -11.403 3.439 1.00 21.51 H new ATOM 0 HB ILE A 107 -13.044 -8.730 3.967 1.00 25.42 H new ATOM 0 HG12 ILE A 107 -14.331 -10.102 2.370 1.00 13.33 H new ATOM 0 HG13 ILE A 107 -13.722 -8.598 1.707 1.00 13.33 H new ATOM 0 HG21 ILE A 107 -11.342 -7.893 2.305 1.00 45.13 H new ATOM 0 HG22 ILE A 107 -10.570 -8.598 3.746 1.00 45.13 H new ATOM 0 HG23 ILE A 107 -10.645 -9.529 2.231 1.00 45.13 H new ATOM 0 HD11 ILE A 107 -13.507 -10.423 0.083 1.00 15.32 H new ATOM 0 HD12 ILE A 107 -11.900 -9.826 0.561 1.00 15.32 H new ATOM 0 HD13 ILE A 107 -12.518 -11.353 1.235 1.00 15.32 H new ATOM 1674 N ARG A 108 -12.016 -9.972 6.415 1.00 1.32 N ATOM 1675 CA ARG A 108 -11.332 -9.785 7.691 1.00 35.03 C ATOM 1676 C ARG A 108 -10.558 -11.054 8.044 1.00 44.12 C ATOM 1677 O ARG A 108 -9.357 -11.003 8.295 1.00 41.43 O ATOM 1678 CB ARG A 108 -12.348 -9.446 8.791 1.00 32.03 C ATOM 1679 CG ARG A 108 -11.674 -9.209 10.148 1.00 45.24 C ATOM 1680 CD ARG A 108 -12.714 -9.200 11.273 1.00 35.25 C ATOM 1681 NE ARG A 108 -12.076 -8.996 12.580 1.00 42.42 N ATOM 1682 CZ ARG A 108 -11.380 -9.919 13.267 1.00 52.41 C ATOM 1683 NH1 ARG A 108 -11.282 -11.187 12.839 1.00 31.43 N ATOM 1684 NH2 ARG A 108 -10.761 -9.555 14.399 1.00 23.21 N ATOM 0 H ARG A 108 -13.001 -9.710 6.438 1.00 1.32 H new ATOM 0 HA ARG A 108 -10.630 -8.955 7.608 1.00 35.03 H new ATOM 0 HB2 ARG A 108 -12.908 -8.556 8.505 1.00 32.03 H new ATOM 0 HB3 ARG A 108 -13.068 -10.259 8.882 1.00 32.03 H new ATOM 0 HG2 ARG A 108 -10.936 -9.989 10.334 1.00 45.24 H new ATOM 0 HG3 ARG A 108 -11.138 -8.260 10.133 1.00 45.24 H new ATOM 0 HD2 ARG A 108 -13.442 -8.409 11.093 1.00 35.25 H new ATOM 0 HD3 ARG A 108 -13.261 -10.143 11.275 1.00 35.25 H new ATOM 0 HE ARG A 108 -12.169 -8.073 13.004 1.00 42.42 H new ATOM 0 HH11 ARG A 108 -11.742 -11.470 11.974 1.00 31.43 H new ATOM 0 HH12 ARG A 108 -10.748 -11.868 13.379 1.00 31.43 H new ATOM 0 HH21 ARG A 108 -10.822 -8.591 14.727 1.00 23.21 H new ATOM 0 HH22 ARG A 108 -10.229 -10.242 14.933 1.00 23.21 H new ATOM 1698 N ASP A 109 -11.255 -12.193 8.045 1.00 33.04 N ATOM 1699 CA ASP A 109 -10.677 -13.475 8.409 1.00 11.33 C ATOM 1700 C ASP A 109 -9.812 -14.050 7.278 1.00 74.54 C ATOM 1701 O ASP A 109 -8.935 -14.868 7.547 1.00 2.33 O ATOM 1702 CB ASP A 109 -11.788 -14.423 8.863 1.00 32.42 C ATOM 1703 CG ASP A 109 -12.580 -13.889 10.064 1.00 32.14 C ATOM 1704 OD1 ASP A 109 -12.069 -12.980 10.760 1.00 43.32 O ATOM 1705 OD2 ASP A 109 -13.697 -14.409 10.272 1.00 63.52 O ATOM 0 H ASP A 109 -12.241 -12.245 7.791 1.00 33.04 H new ATOM 0 HA ASP A 109 -9.995 -13.339 9.248 1.00 11.33 H new ATOM 0 HB2 ASP A 109 -12.472 -14.596 8.032 1.00 32.42 H new ATOM 0 HB3 ASP A 109 -11.351 -15.387 9.123 1.00 32.42 H new ATOM 1710 N ARG A 110 -10.008 -13.599 6.029 1.00 50.12 N ATOM 1711 CA ARG A 110 -9.135 -13.936 4.910 1.00 70.13 C ATOM 1712 C ARG A 110 -7.698 -13.497 5.200 1.00 44.33 C ATOM 1713 O ARG A 110 -6.768 -14.276 5.004 1.00 1.20 O ATOM 1714 CB ARG A 110 -9.653 -13.346 3.597 1.00 63.42 C ATOM 1715 CG ARG A 110 -9.026 -14.113 2.427 1.00 52.10 C ATOM 1716 CD ARG A 110 -9.115 -13.333 1.117 1.00 44.14 C ATOM 1717 NE ARG A 110 -8.034 -13.751 0.218 1.00 70.41 N ATOM 1718 CZ ARG A 110 -8.081 -14.722 -0.708 1.00 35.42 C ATOM 1719 NH1 ARG A 110 -9.238 -15.307 -1.047 1.00 40.43 N ATOM 1720 NH2 ARG A 110 -6.940 -15.113 -1.288 1.00 51.22 N ATOM 0 H ARG A 110 -10.783 -12.987 5.773 1.00 50.12 H new ATOM 0 HA ARG A 110 -9.137 -15.020 4.792 1.00 70.13 H new ATOM 0 HB2 ARG A 110 -10.740 -13.417 3.555 1.00 63.42 H new ATOM 0 HB3 ARG A 110 -9.400 -12.288 3.533 1.00 63.42 H new ATOM 0 HG2 ARG A 110 -7.981 -14.326 2.652 1.00 52.10 H new ATOM 0 HG3 ARG A 110 -9.529 -15.073 2.312 1.00 52.10 H new ATOM 0 HD2 ARG A 110 -10.082 -13.507 0.644 1.00 44.14 H new ATOM 0 HD3 ARG A 110 -9.044 -12.263 1.314 1.00 44.14 H new ATOM 0 HE ARG A 110 -7.150 -13.249 0.306 1.00 70.41 H new ATOM 0 HH11 ARG A 110 -10.107 -15.016 -0.599 1.00 40.43 H new ATOM 0 HH12 ARG A 110 -9.250 -16.043 -1.753 1.00 40.43 H new ATOM 0 HH21 ARG A 110 -6.057 -14.675 -1.024 1.00 51.22 H new ATOM 0 HH22 ARG A 110 -6.953 -15.849 -1.994 1.00 51.22 H new ATOM 1734 N LEU A 111 -7.521 -12.264 5.693 1.00 10.32 N ATOM 1735 CA LEU A 111 -6.218 -11.739 6.090 1.00 65.01 C ATOM 1736 C LEU A 111 -5.544 -12.665 7.102 1.00 24.32 C ATOM 1737 O LEU A 111 -4.352 -12.942 6.985 1.00 74.21 O ATOM 1738 CB LEU A 111 -6.373 -10.339 6.694 1.00 62.13 C ATOM 1739 CG LEU A 111 -6.800 -9.299 5.651 1.00 61.13 C ATOM 1740 CD1 LEU A 111 -7.558 -8.150 6.315 1.00 2.12 C ATOM 1741 CD2 LEU A 111 -5.571 -8.722 4.945 1.00 3.35 C ATOM 0 H LEU A 111 -8.286 -11.603 5.826 1.00 10.32 H new ATOM 0 HA LEU A 111 -5.591 -11.680 5.200 1.00 65.01 H new ATOM 0 HB2 LEU A 111 -7.111 -10.371 7.495 1.00 62.13 H new ATOM 0 HB3 LEU A 111 -5.428 -10.033 7.143 1.00 62.13 H new ATOM 0 HG LEU A 111 -7.447 -9.797 4.929 1.00 61.13 H new ATOM 0 HD11 LEU A 111 -7.852 -7.423 5.558 1.00 2.12 H new ATOM 0 HD12 LEU A 111 -8.448 -8.539 6.810 1.00 2.12 H new ATOM 0 HD13 LEU A 111 -6.915 -7.667 7.051 1.00 2.12 H new ATOM 0 HD21 LEU A 111 -5.888 -7.985 4.207 1.00 3.35 H new ATOM 0 HD22 LEU A 111 -4.921 -8.245 5.678 1.00 3.35 H new ATOM 0 HD23 LEU A 111 -5.028 -9.525 4.446 1.00 3.35 H new ATOM 1753 N LEU A 112 -6.307 -13.144 8.091 1.00 70.40 N ATOM 1754 CA LEU A 112 -5.806 -14.034 9.129 1.00 72.31 C ATOM 1755 C LEU A 112 -5.368 -15.368 8.521 1.00 13.51 C ATOM 1756 O LEU A 112 -4.268 -15.839 8.804 1.00 3.15 O ATOM 1757 CB LEU A 112 -6.864 -14.242 10.225 1.00 51.21 C ATOM 1758 CG LEU A 112 -7.431 -12.935 10.805 1.00 70.24 C ATOM 1759 CD1 LEU A 112 -8.389 -13.263 11.955 1.00 61.43 C ATOM 1760 CD2 LEU A 112 -6.323 -12.003 11.301 1.00 50.34 C ATOM 0 H LEU A 112 -7.297 -12.919 8.189 1.00 70.40 H new ATOM 0 HA LEU A 112 -4.935 -13.572 9.593 1.00 72.31 H new ATOM 0 HB2 LEU A 112 -7.684 -14.832 9.816 1.00 51.21 H new ATOM 0 HB3 LEU A 112 -6.424 -14.825 11.034 1.00 51.21 H new ATOM 0 HG LEU A 112 -7.964 -12.416 10.009 1.00 70.24 H new ATOM 0 HD11 LEU A 112 -8.792 -12.338 12.368 1.00 61.43 H new ATOM 0 HD12 LEU A 112 -9.206 -13.881 11.583 1.00 61.43 H new ATOM 0 HD13 LEU A 112 -7.851 -13.804 12.734 1.00 61.43 H new ATOM 0 HD21 LEU A 112 -6.767 -11.092 11.703 1.00 50.34 H new ATOM 0 HD22 LEU A 112 -5.750 -12.503 12.082 1.00 50.34 H new ATOM 0 HD23 LEU A 112 -5.662 -11.750 10.472 1.00 50.34 H new ATOM 1772 N ALA A 113 -6.217 -15.963 7.673 1.00 23.30 N ATOM 1773 CA ALA A 113 -5.949 -17.230 7.004 1.00 25.30 C ATOM 1774 C ALA A 113 -4.673 -17.164 6.160 1.00 64.22 C ATOM 1775 O ALA A 113 -3.838 -18.063 6.235 1.00 52.51 O ATOM 1776 CB ALA A 113 -7.155 -17.619 6.144 1.00 64.04 C ATOM 0 H ALA A 113 -7.125 -15.565 7.432 1.00 23.30 H new ATOM 0 HA ALA A 113 -5.789 -17.995 7.764 1.00 25.30 H new ATOM 0 HB1 ALA A 113 -6.955 -18.566 5.644 1.00 64.04 H new ATOM 0 HB2 ALA A 113 -8.036 -17.722 6.778 1.00 64.04 H new ATOM 0 HB3 ALA A 113 -7.334 -16.845 5.397 1.00 64.04 H new ATOM 1782 N GLU A 114 -4.517 -16.093 5.373 1.00 52.21 N ATOM 1783 CA GLU A 114 -3.345 -15.856 4.539 1.00 63.45 C ATOM 1784 C GLU A 114 -2.114 -15.473 5.371 1.00 32.03 C ATOM 1785 O GLU A 114 -0.996 -15.542 4.865 1.00 61.52 O ATOM 1786 CB GLU A 114 -3.677 -14.765 3.513 1.00 62.40 C ATOM 1787 CG GLU A 114 -4.682 -15.264 2.468 1.00 63.32 C ATOM 1788 CD GLU A 114 -5.115 -14.135 1.538 1.00 60.22 C ATOM 1789 OE1 GLU A 114 -5.778 -13.207 2.047 1.00 62.04 O ATOM 1790 OE2 GLU A 114 -4.803 -14.219 0.329 1.00 1.45 O ATOM 0 H GLU A 114 -5.218 -15.356 5.300 1.00 52.21 H new ATOM 0 HA GLU A 114 -3.092 -16.782 4.022 1.00 63.45 H new ATOM 0 HB2 GLU A 114 -4.086 -13.894 4.026 1.00 62.40 H new ATOM 0 HB3 GLU A 114 -2.763 -14.442 3.015 1.00 62.40 H new ATOM 0 HG2 GLU A 114 -4.235 -16.069 1.884 1.00 63.32 H new ATOM 0 HG3 GLU A 114 -5.555 -15.681 2.969 1.00 63.32 H new ATOM 1797 N GLY A 115 -2.302 -15.072 6.636 1.00 72.45 N ATOM 1798 CA GLY A 115 -1.222 -14.704 7.539 1.00 10.14 C ATOM 1799 C GLY A 115 -0.634 -13.342 7.174 1.00 12.31 C ATOM 1800 O GLY A 115 0.581 -13.161 7.198 1.00 43.43 O ATOM 0 H GLY A 115 -3.227 -14.996 7.060 1.00 72.45 H new ATOM 0 HA2 GLY A 115 -1.594 -14.679 8.563 1.00 10.14 H new ATOM 0 HA3 GLY A 115 -0.440 -15.462 7.502 1.00 10.14 H new ATOM 1804 N VAL A 116 -1.510 -12.387 6.843 1.00 74.40 N ATOM 1805 CA VAL A 116 -1.157 -11.019 6.496 1.00 24.43 C ATOM 1806 C VAL A 116 -0.985 -10.196 7.774 1.00 14.41 C ATOM 1807 O VAL A 116 -0.061 -9.390 7.870 1.00 35.20 O ATOM 1808 CB VAL A 116 -2.239 -10.433 5.572 1.00 14.12 C ATOM 1809 CG1 VAL A 116 -1.952 -8.966 5.230 1.00 43.31 C ATOM 1810 CG2 VAL A 116 -2.319 -11.237 4.267 1.00 1.25 C ATOM 0 H VAL A 116 -2.515 -12.557 6.810 1.00 74.40 H new ATOM 0 HA VAL A 116 -0.210 -10.995 5.958 1.00 24.43 H new ATOM 0 HB VAL A 116 -3.187 -10.492 6.107 1.00 14.12 H new ATOM 0 HG11 VAL A 116 -2.736 -8.585 4.576 1.00 43.31 H new ATOM 0 HG12 VAL A 116 -1.926 -8.377 6.147 1.00 43.31 H new ATOM 0 HG13 VAL A 116 -0.990 -8.892 4.724 1.00 43.31 H new ATOM 0 HG21 VAL A 116 -3.089 -10.811 3.624 1.00 1.25 H new ATOM 0 HG22 VAL A 116 -1.357 -11.198 3.756 1.00 1.25 H new ATOM 0 HG23 VAL A 116 -2.568 -12.274 4.493 1.00 1.25 H new ATOM 1820 N CYS A 117 -1.880 -10.398 8.748 1.00 23.34 N ATOM 1821 CA CYS A 117 -1.880 -9.698 10.025 1.00 71.02 C ATOM 1822 C CYS A 117 -2.522 -10.575 11.102 1.00 21.41 C ATOM 1823 O CYS A 117 -3.109 -11.612 10.793 1.00 51.12 O ATOM 1824 CB CYS A 117 -2.598 -8.351 9.873 1.00 24.43 C ATOM 1825 SG CYS A 117 -4.318 -8.608 9.361 1.00 44.32 S ATOM 0 H CYS A 117 -2.641 -11.071 8.661 1.00 23.34 H new ATOM 0 HA CYS A 117 -0.856 -9.495 10.339 1.00 71.02 H new ATOM 0 HB2 CYS A 117 -2.570 -7.808 10.818 1.00 24.43 H new ATOM 0 HB3 CYS A 117 -2.080 -7.736 9.137 1.00 24.43 H new ATOM 0 HG CYS A 117 -4.677 -9.825 9.643 1.00 44.32 H new ATOM 1831 N ASP A 118 -2.392 -10.157 12.365 1.00 71.14 N ATOM 1832 CA ASP A 118 -2.835 -10.913 13.530 1.00 24.43 C ATOM 1833 C ASP A 118 -4.324 -10.686 13.798 1.00 3.25 C ATOM 1834 O ASP A 118 -4.913 -9.719 13.313 1.00 1.32 O ATOM 1835 CB ASP A 118 -2.014 -10.533 14.771 1.00 33.20 C ATOM 1836 CG ASP A 118 -0.516 -10.450 14.490 1.00 72.25 C ATOM 1837 OD1 ASP A 118 -0.100 -9.397 13.959 1.00 71.30 O ATOM 1838 OD2 ASP A 118 0.187 -11.431 14.810 1.00 3.52 O ATOM 0 H ASP A 118 -1.965 -9.262 12.606 1.00 71.14 H new ATOM 0 HA ASP A 118 -2.679 -11.971 13.317 1.00 24.43 H new ATOM 0 HB2 ASP A 118 -2.361 -9.572 15.150 1.00 33.20 H new ATOM 0 HB3 ASP A 118 -2.191 -11.268 15.556 1.00 33.20 H new ATOM 1843 N ASN A 119 -4.904 -11.582 14.604 1.00 52.10 N ATOM 1844 CA ASN A 119 -6.318 -11.639 14.967 1.00 2.40 C ATOM 1845 C ASN A 119 -6.856 -10.312 15.506 1.00 73.12 C ATOM 1846 O ASN A 119 -8.033 -10.011 15.309 1.00 64.43 O ATOM 1847 CB ASN A 119 -6.535 -12.737 16.018 1.00 31.52 C ATOM 1848 CG ASN A 119 -6.204 -14.144 15.519 1.00 25.35 C ATOM 1849 OD1 ASN A 119 -5.779 -14.339 14.382 1.00 45.11 O ATOM 1850 ND2 ASN A 119 -6.399 -15.140 16.385 1.00 33.43 N ATOM 0 H ASN A 119 -4.365 -12.328 15.044 1.00 52.10 H new ATOM 0 HA ASN A 119 -6.869 -11.861 14.053 1.00 2.40 H new ATOM 0 HB2 ASN A 119 -5.921 -12.518 16.891 1.00 31.52 H new ATOM 0 HB3 ASN A 119 -7.574 -12.713 16.345 1.00 31.52 H new ATOM 0 HD21 ASN A 119 -6.194 -16.101 16.112 1.00 33.43 H new ATOM 0 HD22 ASN A 119 -6.753 -14.940 17.321 1.00 33.43 H new ATOM 1857 N ASP A 120 -6.011 -9.547 16.205 1.00 21.11 N ATOM 1858 CA ASP A 120 -6.363 -8.285 16.839 1.00 15.13 C ATOM 1859 C ASP A 120 -5.970 -7.113 15.940 1.00 44.12 C ATOM 1860 O ASP A 120 -6.738 -6.166 15.787 1.00 75.32 O ATOM 1861 CB ASP A 120 -5.657 -8.191 18.194 1.00 30.13 C ATOM 1862 CG ASP A 120 -6.056 -9.336 19.121 1.00 63.05 C ATOM 1863 OD1 ASP A 120 -7.072 -9.168 19.829 1.00 43.32 O ATOM 1864 OD2 ASP A 120 -5.344 -10.364 19.093 1.00 75.54 O ATOM 0 H ASP A 120 -5.034 -9.803 16.346 1.00 21.11 H new ATOM 0 HA ASP A 120 -7.441 -8.241 16.995 1.00 15.13 H new ATOM 0 HB2 ASP A 120 -4.578 -8.205 18.043 1.00 30.13 H new ATOM 0 HB3 ASP A 120 -5.901 -7.239 18.666 1.00 30.13 H new ATOM 1869 N THR A 121 -4.764 -7.175 15.360 1.00 34.34 N ATOM 1870 CA THR A 121 -4.183 -6.095 14.569 1.00 1.23 C ATOM 1871 C THR A 121 -4.954 -5.836 13.271 1.00 10.13 C ATOM 1872 O THR A 121 -4.893 -4.727 12.742 1.00 43.24 O ATOM 1873 CB THR A 121 -2.700 -6.372 14.278 1.00 64.54 C ATOM 1874 OG1 THR A 121 -2.557 -7.487 13.425 1.00 52.03 O ATOM 1875 CG2 THR A 121 -1.894 -6.586 15.563 1.00 70.51 C ATOM 0 H THR A 121 -4.159 -7.993 15.432 1.00 34.34 H new ATOM 0 HA THR A 121 -4.260 -5.187 15.167 1.00 1.23 H new ATOM 0 HB THR A 121 -2.302 -5.489 13.779 1.00 64.54 H new ATOM 0 HG1 THR A 121 -3.338 -8.072 13.518 1.00 52.03 H new ATOM 0 HG21 THR A 121 -0.851 -6.779 15.311 1.00 70.51 H new ATOM 0 HG22 THR A 121 -1.958 -5.693 16.185 1.00 70.51 H new ATOM 0 HG23 THR A 121 -2.299 -7.438 16.109 1.00 70.51 H new ATOM 1883 N VAL A 122 -5.675 -6.846 12.763 1.00 72.10 N ATOM 1884 CA VAL A 122 -6.553 -6.731 11.604 1.00 4.13 C ATOM 1885 C VAL A 122 -7.491 -5.522 11.760 1.00 1.21 C ATOM 1886 O VAL A 122 -8.067 -5.340 12.833 1.00 75.24 O ATOM 1887 CB VAL A 122 -7.312 -8.059 11.422 1.00 51.10 C ATOM 1888 CG1 VAL A 122 -8.296 -8.345 12.562 1.00 5.11 C ATOM 1889 CG2 VAL A 122 -8.057 -8.132 10.088 1.00 30.22 C ATOM 0 H VAL A 122 -5.659 -7.785 13.161 1.00 72.10 H new ATOM 0 HA VAL A 122 -5.971 -6.551 10.700 1.00 4.13 H new ATOM 0 HB VAL A 122 -6.536 -8.825 11.434 1.00 51.10 H new ATOM 0 HG11 VAL A 122 -8.800 -9.294 12.378 1.00 5.11 H new ATOM 0 HG12 VAL A 122 -7.753 -8.400 13.506 1.00 5.11 H new ATOM 0 HG13 VAL A 122 -9.035 -7.545 12.614 1.00 5.11 H new ATOM 0 HG21 VAL A 122 -8.574 -9.088 10.012 1.00 30.22 H new ATOM 0 HG22 VAL A 122 -8.783 -7.321 10.032 1.00 30.22 H new ATOM 0 HG23 VAL A 122 -7.345 -8.039 9.268 1.00 30.22 H new ATOM 1899 N PRO A 123 -7.618 -4.658 10.738 1.00 42.22 N ATOM 1900 CA PRO A 123 -8.314 -3.388 10.859 1.00 53.32 C ATOM 1901 C PRO A 123 -9.822 -3.574 11.024 1.00 61.45 C ATOM 1902 O PRO A 123 -10.383 -4.617 10.689 1.00 41.41 O ATOM 1903 CB PRO A 123 -7.971 -2.602 9.590 1.00 10.41 C ATOM 1904 CG PRO A 123 -7.689 -3.701 8.571 1.00 42.44 C ATOM 1905 CD PRO A 123 -7.003 -4.763 9.427 1.00 60.22 C ATOM 0 HA PRO A 123 -7.998 -2.851 11.754 1.00 53.32 H new ATOM 0 HB2 PRO A 123 -8.796 -1.963 9.276 1.00 10.41 H new ATOM 0 HB3 PRO A 123 -7.105 -1.956 9.737 1.00 10.41 H new ATOM 0 HG2 PRO A 123 -8.604 -4.076 8.112 1.00 42.44 H new ATOM 0 HG3 PRO A 123 -7.047 -3.352 7.762 1.00 42.44 H new ATOM 0 HD2 PRO A 123 -7.144 -5.758 9.006 1.00 60.22 H new ATOM 0 HD3 PRO A 123 -5.928 -4.589 9.482 1.00 60.22 H new ATOM 1913 N SER A 124 -10.464 -2.534 11.562 1.00 24.34 N ATOM 1914 CA SER A 124 -11.884 -2.501 11.868 1.00 30.21 C ATOM 1915 C SER A 124 -12.733 -2.609 10.602 1.00 33.43 C ATOM 1916 O SER A 124 -12.388 -2.035 9.571 1.00 34.20 O ATOM 1917 CB SER A 124 -12.189 -1.184 12.590 1.00 1.33 C ATOM 1918 OG SER A 124 -11.674 -1.215 13.903 1.00 1.12 O ATOM 0 H SER A 124 -9.987 -1.665 11.802 1.00 24.34 H new ATOM 0 HA SER A 124 -12.132 -3.354 12.500 1.00 30.21 H new ATOM 0 HB2 SER A 124 -11.752 -0.350 12.040 1.00 1.33 H new ATOM 0 HB3 SER A 124 -13.266 -1.018 12.618 1.00 1.33 H new ATOM 0 HG SER A 124 -11.874 -0.368 14.353 1.00 1.12 H new ATOM 1924 N VAL A 125 -13.883 -3.285 10.712 1.00 52.12 N ATOM 1925 CA VAL A 125 -14.931 -3.267 9.697 1.00 64.43 C ATOM 1926 C VAL A 125 -15.375 -1.820 9.444 1.00 22.55 C ATOM 1927 O VAL A 125 -15.632 -1.430 8.306 1.00 0.21 O ATOM 1928 CB VAL A 125 -16.100 -4.164 10.144 1.00 21.25 C ATOM 1929 CG1 VAL A 125 -17.282 -4.071 9.169 1.00 44.32 C ATOM 1930 CG2 VAL A 125 -15.650 -5.630 10.235 1.00 0.31 C ATOM 0 H VAL A 125 -14.110 -3.865 11.520 1.00 52.12 H new ATOM 0 HA VAL A 125 -14.552 -3.666 8.756 1.00 64.43 H new ATOM 0 HB VAL A 125 -16.419 -3.812 11.125 1.00 21.25 H new ATOM 0 HG11 VAL A 125 -18.090 -4.716 9.514 1.00 44.32 H new ATOM 0 HG12 VAL A 125 -17.635 -3.041 9.122 1.00 44.32 H new ATOM 0 HG13 VAL A 125 -16.961 -4.390 8.177 1.00 44.32 H new ATOM 0 HG21 VAL A 125 -16.489 -6.249 10.552 1.00 0.31 H new ATOM 0 HG22 VAL A 125 -15.301 -5.965 9.258 1.00 0.31 H new ATOM 0 HG23 VAL A 125 -14.840 -5.718 10.959 1.00 0.31 H new ATOM 1940 N SER A 126 -15.433 -1.017 10.512 1.00 44.31 N ATOM 1941 CA SER A 126 -15.723 0.403 10.443 1.00 44.44 C ATOM 1942 C SER A 126 -14.678 1.163 9.620 1.00 72.13 C ATOM 1943 O SER A 126 -15.046 2.064 8.871 1.00 64.30 O ATOM 1944 CB SER A 126 -15.798 0.974 11.864 1.00 30.13 C ATOM 1945 OG SER A 126 -16.694 0.216 12.648 1.00 40.32 O ATOM 0 H SER A 126 -15.275 -1.351 11.463 1.00 44.31 H new ATOM 0 HA SER A 126 -16.682 0.530 9.940 1.00 44.44 H new ATOM 0 HB2 SER A 126 -14.808 0.965 12.320 1.00 30.13 H new ATOM 0 HB3 SER A 126 -16.124 2.014 11.829 1.00 30.13 H new ATOM 0 HG SER A 126 -16.732 0.589 13.554 1.00 40.32 H new ATOM 1951 N SER A 127 -13.385 0.834 9.768 1.00 42.43 N ATOM 1952 CA SER A 127 -12.319 1.631 9.171 1.00 1.50 C ATOM 1953 C SER A 127 -12.326 1.483 7.653 1.00 71.12 C ATOM 1954 O SER A 127 -12.417 2.489 6.957 1.00 30.50 O ATOM 1955 CB SER A 127 -10.948 1.331 9.789 1.00 2.44 C ATOM 1956 OG SER A 127 -10.511 0.018 9.515 1.00 3.53 O ATOM 0 H SER A 127 -13.060 0.023 10.295 1.00 42.43 H new ATOM 0 HA SER A 127 -12.517 2.678 9.399 1.00 1.50 H new ATOM 0 HB2 SER A 127 -10.216 2.042 9.406 1.00 2.44 H new ATOM 0 HB3 SER A 127 -10.999 1.476 10.868 1.00 2.44 H new ATOM 0 HG SER A 127 -11.274 -0.596 9.555 1.00 3.53 H new ATOM 1962 N ILE A 128 -12.278 0.242 7.147 1.00 71.43 N ATOM 1963 CA ILE A 128 -12.352 -0.059 5.718 1.00 22.51 C ATOM 1964 C ILE A 128 -13.529 0.663 5.051 1.00 3.31 C ATOM 1965 O ILE A 128 -13.372 1.216 3.963 1.00 3.24 O ATOM 1966 CB ILE A 128 -12.370 -1.580 5.464 1.00 42.51 C ATOM 1967 CG1 ILE A 128 -13.522 -2.278 6.208 1.00 51.10 C ATOM 1968 CG2 ILE A 128 -11.000 -2.167 5.835 1.00 24.52 C ATOM 1969 CD1 ILE A 128 -13.627 -3.783 5.962 1.00 63.24 C ATOM 0 H ILE A 128 -12.185 -0.589 7.731 1.00 71.43 H new ATOM 0 HA ILE A 128 -11.447 0.326 5.249 1.00 22.51 H new ATOM 0 HB ILE A 128 -12.555 -1.759 4.405 1.00 42.51 H new ATOM 0 HG12 ILE A 128 -13.401 -2.107 7.278 1.00 51.10 H new ATOM 0 HG13 ILE A 128 -14.462 -1.810 5.914 1.00 51.10 H new ATOM 0 HG21 ILE A 128 -11.005 -3.243 5.658 1.00 24.52 H new ATOM 0 HG22 ILE A 128 -10.227 -1.702 5.223 1.00 24.52 H new ATOM 0 HG23 ILE A 128 -10.794 -1.973 6.888 1.00 24.52 H new ATOM 0 HD11 ILE A 128 -14.467 -4.186 6.528 1.00 63.24 H new ATOM 0 HD12 ILE A 128 -13.783 -3.968 4.899 1.00 63.24 H new ATOM 0 HD13 ILE A 128 -12.706 -4.269 6.284 1.00 63.24 H new ATOM 1981 N ASN A 129 -14.688 0.707 5.721 1.00 35.52 N ATOM 1982 CA ASN A 129 -15.851 1.432 5.233 1.00 12.13 C ATOM 1983 C ASN A 129 -15.576 2.938 5.208 1.00 1.30 C ATOM 1984 O ASN A 129 -15.774 3.568 4.173 1.00 53.11 O ATOM 1985 CB ASN A 129 -17.085 1.097 6.079 1.00 1.15 C ATOM 1986 CG ASN A 129 -18.335 1.775 5.523 1.00 23.14 C ATOM 1987 OD1 ASN A 129 -18.900 2.664 6.155 1.00 71.05 O ATOM 1988 ND2 ASN A 129 -18.766 1.362 4.329 1.00 61.12 N ATOM 0 H ASN A 129 -14.838 0.239 6.615 1.00 35.52 H new ATOM 0 HA ASN A 129 -16.056 1.118 4.209 1.00 12.13 H new ATOM 0 HB2 ASN A 129 -17.233 0.017 6.100 1.00 1.15 H new ATOM 0 HB3 ASN A 129 -16.922 1.417 7.108 1.00 1.15 H new ATOM 0 HD21 ASN A 129 -19.593 1.788 3.910 1.00 61.12 H new ATOM 0 HD22 ASN A 129 -18.269 0.621 3.836 1.00 61.12 H new ATOM 1995 N ARG A 130 -15.109 3.505 6.329 1.00 74.12 N ATOM 1996 CA ARG A 130 -14.774 4.921 6.462 1.00 3.54 C ATOM 1997 C ARG A 130 -13.821 5.400 5.362 1.00 30.30 C ATOM 1998 O ARG A 130 -13.963 6.533 4.902 1.00 43.44 O ATOM 1999 CB ARG A 130 -14.174 5.213 7.846 1.00 45.34 C ATOM 2000 CG ARG A 130 -15.208 5.122 8.979 1.00 65.13 C ATOM 2001 CD ARG A 130 -15.632 6.505 9.488 1.00 4.05 C ATOM 2002 NE ARG A 130 -16.220 7.344 8.433 1.00 50.03 N ATOM 2003 CZ ARG A 130 -17.496 7.294 8.019 1.00 33.51 C ATOM 2004 NH1 ARG A 130 -18.337 6.359 8.483 1.00 75.41 N ATOM 2005 NH2 ARG A 130 -17.934 8.194 7.127 1.00 53.53 N ATOM 0 H ARG A 130 -14.952 2.975 7.186 1.00 74.12 H new ATOM 0 HA ARG A 130 -15.706 5.476 6.353 1.00 3.54 H new ATOM 0 HB2 ARG A 130 -13.366 4.508 8.042 1.00 45.34 H new ATOM 0 HB3 ARG A 130 -13.734 6.210 7.842 1.00 45.34 H new ATOM 0 HG2 ARG A 130 -16.086 4.582 8.625 1.00 65.13 H new ATOM 0 HG3 ARG A 130 -14.791 4.545 9.804 1.00 65.13 H new ATOM 0 HD2 ARG A 130 -16.355 6.384 10.295 1.00 4.05 H new ATOM 0 HD3 ARG A 130 -14.765 7.014 9.910 1.00 4.05 H new ATOM 0 HE ARG A 130 -15.607 8.020 7.978 1.00 50.03 H new ATOM 0 HH11 ARG A 130 -18.011 5.671 9.161 1.00 75.41 H new ATOM 0 HH12 ARG A 130 -19.303 6.336 8.158 1.00 75.41 H new ATOM 0 HH21 ARG A 130 -17.299 8.908 6.769 1.00 53.53 H new ATOM 0 HH22 ARG A 130 -18.902 8.165 6.806 1.00 53.53 H new ATOM 2019 N ILE A 131 -12.870 4.560 4.925 1.00 53.40 N ATOM 2020 CA ILE A 131 -11.975 4.922 3.831 1.00 55.31 C ATOM 2021 C ILE A 131 -12.813 5.226 2.584 1.00 42.33 C ATOM 2022 O ILE A 131 -12.682 6.299 2.003 1.00 51.02 O ATOM 2023 CB ILE A 131 -10.922 3.832 3.536 1.00 71.23 C ATOM 2024 CG1 ILE A 131 -10.201 3.242 4.762 1.00 11.15 C ATOM 2025 CG2 ILE A 131 -9.878 4.375 2.549 1.00 3.53 C ATOM 2026 CD1 ILE A 131 -9.817 4.229 5.871 1.00 63.51 C ATOM 0 H ILE A 131 -12.707 3.632 5.314 1.00 53.40 H new ATOM 0 HA ILE A 131 -11.415 5.808 4.130 1.00 55.31 H new ATOM 0 HB ILE A 131 -11.492 3.004 3.114 1.00 71.23 H new ATOM 0 HG12 ILE A 131 -10.840 2.473 5.196 1.00 11.15 H new ATOM 0 HG13 ILE A 131 -9.294 2.746 4.418 1.00 11.15 H new ATOM 0 HG21 ILE A 131 -9.136 3.603 2.343 1.00 3.53 H new ATOM 0 HG22 ILE A 131 -10.370 4.662 1.620 1.00 3.53 H new ATOM 0 HG23 ILE A 131 -9.385 5.245 2.983 1.00 3.53 H new ATOM 0 HD11 ILE A 131 -9.317 3.693 6.678 1.00 63.51 H new ATOM 0 HD12 ILE A 131 -9.145 4.987 5.467 1.00 63.51 H new ATOM 0 HD13 ILE A 131 -10.716 4.710 6.257 1.00 63.51 H new ATOM 2038 N ILE A 132 -13.681 4.287 2.193 1.00 42.53 N ATOM 2039 CA ILE A 132 -14.500 4.351 0.988 1.00 23.42 C ATOM 2040 C ILE A 132 -15.566 5.453 1.092 1.00 43.24 C ATOM 2041 O ILE A 132 -15.892 6.065 0.078 1.00 5.33 O ATOM 2042 CB ILE A 132 -15.113 2.965 0.681 1.00 62.51 C ATOM 2043 CG1 ILE A 132 -14.019 1.877 0.590 1.00 22.15 C ATOM 2044 CG2 ILE A 132 -15.881 3.003 -0.651 1.00 52.15 C ATOM 2045 CD1 ILE A 132 -14.592 0.456 0.574 1.00 13.24 C ATOM 0 H ILE A 132 -13.835 3.433 2.729 1.00 42.53 H new ATOM 0 HA ILE A 132 -13.861 4.621 0.147 1.00 23.42 H new ATOM 0 HB ILE A 132 -15.793 2.721 1.497 1.00 62.51 H new ATOM 0 HG12 ILE A 132 -13.430 2.036 -0.313 1.00 22.15 H new ATOM 0 HG13 ILE A 132 -13.340 1.980 1.436 1.00 22.15 H new ATOM 0 HG21 ILE A 132 -16.307 2.020 -0.854 1.00 52.15 H new ATOM 0 HG22 ILE A 132 -16.682 3.740 -0.588 1.00 52.15 H new ATOM 0 HG23 ILE A 132 -15.199 3.276 -1.456 1.00 52.15 H new ATOM 0 HD11 ILE A 132 -13.777 -0.264 0.509 1.00 13.24 H new ATOM 0 HD12 ILE A 132 -15.158 0.282 1.489 1.00 13.24 H new ATOM 0 HD13 ILE A 132 -15.249 0.338 -0.287 1.00 13.24 H new ATOM 2057 N ARG A 133 -16.095 5.725 2.297 1.00 61.24 N ATOM 2058 CA ARG A 133 -17.081 6.781 2.536 1.00 24.22 C ATOM 2059 C ARG A 133 -16.617 8.123 1.967 1.00 31.21 C ATOM 2060 O ARG A 133 -17.400 8.813 1.317 1.00 52.21 O ATOM 2061 CB ARG A 133 -17.376 6.929 4.038 1.00 72.35 C ATOM 2062 CG ARG A 133 -18.190 5.764 4.612 1.00 54.34 C ATOM 2063 CD ARG A 133 -19.700 5.966 4.441 1.00 12.42 C ATOM 2064 NE ARG A 133 -20.412 4.735 4.809 1.00 12.34 N ATOM 2065 CZ ARG A 133 -21.609 4.335 4.352 1.00 45.22 C ATOM 2066 NH1 ARG A 133 -22.351 5.122 3.559 1.00 12.23 N ATOM 2067 NH2 ARG A 133 -22.063 3.123 4.699 1.00 43.14 N ATOM 0 H ARG A 133 -15.844 5.209 3.140 1.00 61.24 H new ATOM 0 HA ARG A 133 -17.996 6.487 2.021 1.00 24.22 H new ATOM 0 HB2 ARG A 133 -16.434 7.007 4.581 1.00 72.35 H new ATOM 0 HB3 ARG A 133 -17.918 7.860 4.205 1.00 72.35 H new ATOM 0 HG2 ARG A 133 -17.892 4.839 4.119 1.00 54.34 H new ATOM 0 HG3 ARG A 133 -17.959 5.650 5.671 1.00 54.34 H new ATOM 0 HD2 ARG A 133 -20.038 6.793 5.065 1.00 12.42 H new ATOM 0 HD3 ARG A 133 -19.926 6.233 3.409 1.00 12.42 H new ATOM 0 HE ARG A 133 -19.950 4.122 5.480 1.00 12.34 H new ATOM 0 HH11 ARG A 133 -22.008 6.045 3.292 1.00 12.23 H new ATOM 0 HH12 ARG A 133 -23.258 4.798 3.223 1.00 12.23 H new ATOM 0 HH21 ARG A 133 -21.501 2.521 5.301 1.00 43.14 H new ATOM 0 HH22 ARG A 133 -22.970 2.802 4.361 1.00 43.14 H new ATOM 2081 N THR A 134 -15.349 8.488 2.202 1.00 44.42 N ATOM 2082 CA THR A 134 -14.791 9.746 1.716 1.00 23.04 C ATOM 2083 C THR A 134 -14.683 9.793 0.185 1.00 3.22 C ATOM 2084 O THR A 134 -14.575 10.883 -0.372 1.00 15.10 O ATOM 2085 CB THR A 134 -13.443 10.048 2.393 1.00 72.23 C ATOM 2086 OG1 THR A 134 -12.485 9.045 2.122 1.00 14.21 O ATOM 2087 CG2 THR A 134 -13.598 10.201 3.910 1.00 10.51 C ATOM 0 H THR A 134 -14.689 7.919 2.732 1.00 44.42 H new ATOM 0 HA THR A 134 -15.491 10.534 1.994 1.00 23.04 H new ATOM 0 HB THR A 134 -13.093 10.991 1.974 1.00 72.23 H new ATOM 0 HG1 THR A 134 -12.905 8.163 2.197 1.00 14.21 H new ATOM 0 HG21 THR A 134 -12.626 10.414 4.355 1.00 10.51 H new ATOM 0 HG22 THR A 134 -14.283 11.021 4.125 1.00 10.51 H new ATOM 0 HG23 THR A 134 -13.995 9.277 4.330 1.00 10.51 H new